#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 0.16 -0.09 -0.14 0.00 -1.26 -0.99 118.16 115.84 1noi n LYS 11 Ca 0.00 0.39 0.10 0.00 0.00 0.00 0.00 58.31 58.80 1noi n LYS 11 Cb 0.00 -1.80 0.35 0.00 0.00 0.00 0.00 35.03 33.58 1noi n LYS 11 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1noi n GLN 12 N -2.10 1.68 -2.80 1.64 3.00 -1.26 -4.46 117.38 113.08 1noi n GLN 12 Ca 0.02 -1.03 -0.43 0.00 -0.01 0.00 0.00 57.00 55.56 1noi n GLN 12 Cb 0.22 -1.37 -0.03 0.00 0.00 0.00 0.00 30.24 29.06 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 -1.77 4.29 -0.02 5.09 1.01 -0.16 -4.93 121.20 124.71 1noi s ILE 13 Ca 0.30 -0.62 -0.09 0.00 0.00 0.00 0.00 60.65 60.25 1noi s ILE 13 Cb 0.16 -4.79 0.01 0.00 0.01 0.00 0.00 42.46 37.85 1noi s ILE 13 CO 0.24 -1.59 0.20 -0.55 0.00 0.00 0.00 174.94 173.24 1noi s SER 14 N 3.84 -0.09 -0.04 3.58 0.15 -1.26 -5.06 113.70 114.83 1noi s SER 14 Ca 0.30 0.02 -0.23 0.00 0.70 0.00 0.00 55.95 56.73 1noi s SER 14 Cb -0.10 0.29 -0.23 0.00 -1.71 0.00 0.00 66.02 64.26 1noi s SER 14 CO 0.03 -0.31 1.06 0.58 1.20 0.00 0.00 173.24 175.79 1noi h VAL 15 N 4.31 1.51 0.00 4.45 2.07 -1.95 -3.42 116.25 123.22 1noi h VAL 15 Ca -0.29 -1.95 0.00 0.00 0.82 0.00 0.00 66.70 65.28 1noi h VAL 15 Cb 1.19 2.70 0.00 0.00 -1.52 0.00 0.00 31.29 33.66 1noi h VAL 15 CO 0.40 0.54 0.00 -2.11 0.02 0.00 0.00 177.57 176.42 1noi n ARG 16 N -4.44 0.00 -1.42 1.57 -4.01 -1.26 -1.79 116.66 105.30 1noi n ARG 16 Ca -0.10 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.72 1noi n ARG 16 Cb 0.54 0.00 0.09 0.00 -3.04 0.00 0.00 32.46 30.05 1noi n ARG 16 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1noi n GLY 17 N -0.56 3.33 0.28 2.89 0.00 -1.26 -4.53 105.19 105.34 1noi n GLY 17 Ca 0.00 -1.29 0.07 0.00 0.00 0.00 0.00 46.02 44.80 1noi n GLY 17 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1noi n LEU 18 N -0.40 0.83 -3.14 0.99 7.99 -0.74 -4.69 117.00 117.85 1noi n LEU 18 Ca 0.16 -0.38 0.02 0.00 -0.01 0.00 0.00 56.01 55.81 1noi n LEU 18 Cb 0.91 -0.07 -0.00 0.00 -0.11 0.00 0.00 43.42 44.14 1noi n LEU 18 CO 0.03 0.19 0.17 0.00 -1.51 0.00 0.00 177.39 176.27 1noi s ALA 19 N -1.85 -2.73 -0.59 -1.18 0.00 -1.26 -5.11 121.76 109.04 1noi s ALA 19 Ca 0.23 0.66 -0.27 0.00 0.00 0.00 0.00 51.96 52.58 1noi s ALA 19 Cb 0.11 -2.72 -0.01 0.00 0.00 0.00 0.00 23.12 20.50 1noi s ALA 19 CO 0.17 -2.13 1.77 0.20 0.00 0.00 0.00 175.76 175.78 1noi s GLY 20 N 2.23 0.38 0.60 0.00 0.00 -1.26 -4.96 107.32 104.30 1noi s GLY 20 Ca 0.15 -0.61 -0.15 0.00 0.00 0.00 0.00 44.72 44.11 1noi s GLY 20 CO -0.15 3.29 1.05 0.14 0.00 0.00 0.00 173.10 177.44 1noi s VAL 21 N 8.32 3.90 0.00 1.40 1.01 -1.26 -3.76 120.40 130.01 1noi s VAL 21 Ca 0.65 0.87 0.00 0.00 0.00 0.00 0.00 61.98 63.50 1noi s VAL 21 Cb -0.13 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.83 1noi s VAL 21 CO 0.22 -0.56 0.00 1.21 0.00 0.00 0.00 175.10 175.97 1noi n GLU 22 N -2.11 0.00 -3.76 2.72 4.07 -1.26 -5.06 120.64 115.24 1noi n GLU 22 Ca 0.08 0.17 -0.26 0.00 -0.06 0.00 0.00 57.16 57.09 1noi n GLU 22 Cb 0.53 -1.41 -0.17 0.00 -0.06 0.00 0.00 31.44 30.34 1noi n GLU 22 CO 0.00 0.00 0.00 1.21 -0.06 0.00 0.00 177.13 178.28 1noi s ASN 23 N -2.35 2.40 0.27 4.31 3.84 -1.25 -4.96 114.94 117.20 1noi s ASN 23 Ca 0.00 -0.53 -0.03 0.00 0.21 0.00 0.00 52.86 52.51 1noi s ASN 23 Cb 0.00 -0.57 0.37 0.00 -0.55 0.00 0.00 41.25 40.50 1noi s ASN 23 CO 0.00 -0.25 1.92 0.58 -2.79 0.00 0.00 177.10 176.56 1noi h VAL 24 N 6.42 1.17 -0.39 -5.21 2.07 -1.92 -0.62 116.25 117.77 1noi h VAL 24 Ca -0.18 -0.42 -0.14 0.00 0.82 0.00 0.00 66.70 66.78 1noi h VAL 24 Cb 1.12 -0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 1noi h VAL 24 CO 0.32 0.22 -0.28 0.74 0.02 0.00 0.00 177.57 178.59 1noi h THR 25 N 1.23 1.28 -0.17 2.57 2.02 -1.97 -0.34 112.91 117.53 1noi h THR 25 Ca 0.38 -1.45 -0.05 0.00 0.77 0.00 0.00 66.41 66.07 1noi h THR 25 Cb 0.00 1.34 -0.00 0.00 -1.74 0.00 0.00 68.15 67.75 1noi h THR 25 CO -0.12 0.48 -0.08 -0.33 0.37 0.00 0.00 175.52 175.85 1noi h GLU 26 N 0.70 0.35 -0.63 6.66 4.39 -1.81 -2.21 114.58 122.03 1noi h GLU 26 Ca 0.08 -0.15 0.03 0.00 0.34 0.00 0.00 59.36 59.65 1noi h GLU 26 Cb 0.86 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.47 1noi h GLU 26 CO 0.08 0.66 0.42 -0.07 -1.16 0.00 0.00 179.01 178.93 1noi h LEU 27 N 0.03 0.65 -0.71 1.33 3.38 -0.84 0.16 115.31 119.31 1noi h LEU 27 Ca 0.04 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.86 1noi h LEU 27 Cb 0.55 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1noi h LEU 27 CO 0.02 0.45 -0.63 0.11 0.09 0.00 0.00 178.44 178.49 1noi h LYS 28 N 0.76 0.07 -0.26 1.13 1.57 -0.72 -0.63 116.57 118.48 1noi h LYS 28 Ca 0.25 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.91 1noi h LYS 28 Cb 0.06 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1noi h LYS 28 CO -0.07 0.67 -0.10 -0.22 -0.57 0.00 0.00 179.45 179.16 1noi h LYS 29 N 0.05 0.54 -0.05 3.15 3.64 -0.66 -2.01 116.57 121.22 1noi h LYS 29 Ca -0.01 -0.22 -0.12 0.00 -1.27 0.00 0.00 60.65 59.03 1noi h LYS 29 Cb 1.12 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.90 1noi h LYS 29 CO 0.09 0.78 -0.52 -0.91 -2.27 0.00 0.00 179.45 176.61 1noi h ASN 30 N 0.28 0.14 0.36 4.20 2.35 -0.63 0.59 115.58 122.87 1noi h ASN 30 Ca 0.06 -0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 1noi h ASN 30 Cb 0.60 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.94 1noi h ASN 30 CO 0.03 0.63 -0.18 0.15 -1.65 0.00 0.00 177.43 176.42 1noi h PHE 31 N 0.10 -0.45 -0.49 1.19 3.57 -1.00 -1.28 116.94 118.58 1noi h PHE 31 Ca 0.00 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.45 1noi h PHE 31 Cb 0.95 0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.82 1noi h PHE 31 CO 0.01 -0.27 0.16 -0.91 -2.23 0.00 0.00 178.31 175.07 1noi h ASN 32 N -0.52 0.71 -0.98 0.41 2.35 -0.97 -0.32 115.58 116.27 1noi h ASN 32 Ca -0.05 -0.20 0.06 0.00 -0.55 0.00 0.00 56.30 55.56 1noi h ASN 32 Cb 0.39 -0.19 -0.07 0.00 0.05 0.00 0.00 38.32 38.51 1noi h ASN 32 CO 0.08 0.72 0.63 0.03 -1.65 0.00 0.00 177.43 177.24 1noi h ARG 33 N 0.66 1.11 -0.23 0.81 3.08 -0.85 -1.72 114.38 117.25 1noi h ARG 33 Ca 0.16 -0.07 -0.19 0.00 0.07 0.00 0.00 59.98 59.95 1noi h ARG 33 Cb 0.26 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1noi h ARG 33 CO -0.01 0.74 -0.61 0.45 -1.07 0.00 0.00 179.97 179.47 1noi h HIS 34 N 1.15 1.01 0.05 3.04 3.86 -0.29 0.26 115.15 124.22 1noi h HIS 34 Ca 0.42 -0.38 -0.00 0.00 -1.16 0.00 0.00 60.37 59.25 1noi h HIS 34 Cb 0.16 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 28.45 1noi h HIS 34 CO -0.01 1.20 -0.02 1.25 0.86 0.00 0.00 177.93 181.21 1noi h LEU 35 N 0.59 -0.05 0.09 2.43 5.85 -0.85 0.52 115.31 123.89 1noi h LEU 35 Ca -0.00 -0.01 -0.29 0.00 0.84 0.00 0.00 57.88 58.41 1noi h LEU 35 Cb 1.21 0.01 0.02 0.00 0.37 0.00 0.00 40.66 42.28 1noi h LEU 35 CO 0.13 -0.02 -1.22 0.45 -0.34 0.00 0.00 178.44 177.43 1noi h HIS 36 N -0.08 0.89 0.01 1.25 3.86 -1.33 -2.45 115.15 117.31 1noi h HIS 36 Ca -0.01 -0.57 -0.41 0.00 -1.16 0.00 0.00 60.37 58.22 1noi h HIS 36 Cb 0.06 -0.07 -0.07 0.00 1.06 0.00 0.00 27.41 28.40 1noi h HIS 36 CO -0.07 1.41 -2.43 1.19 0.86 0.00 0.00 177.93 178.89 1noi n PHE 37 N -3.75 0.12 -0.00 2.45 3.72 0.08 -2.31 117.46 117.77 1noi n PHE 37 Ca -0.12 0.03 -0.13 0.00 -0.05 0.00 0.00 57.45 57.18 1noi n PHE 37 Cb 0.98 -1.01 -0.10 0.00 -0.94 0.00 0.00 39.48 38.41 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 -0.44 1.32 0.00 4.37 2.02 -1.27 -3.36 112.91 115.55 1noi h THR 38 Ca -0.61 -1.31 -0.10 0.00 0.77 0.00 0.00 66.41 65.16 1noi h THR 38 Cb 1.77 2.17 -0.01 0.00 -1.74 0.00 0.00 68.15 70.34 1noi h THR 38 CO -0.22 0.32 -0.73 -0.07 0.37 0.00 0.00 175.52 175.19 1noi h LEU 39 N -0.65 0.00 -2.41 2.58 4.07 -0.95 -3.49 115.31 114.46 1noi h LEU 39 Ca -0.01 0.00 -0.25 0.00 0.08 0.00 0.00 57.88 57.70 1noi h LEU 39 Cb 0.58 0.00 0.19 0.00 1.08 0.00 0.00 40.66 42.51 1noi h LEU 39 CO 0.01 0.40 -0.84 0.52 -1.08 0.00 0.00 178.44 177.45 1noi n VAL 40 N -3.06 -8.85 -3.98 1.22 0.31 -0.94 -4.99 118.33 98.04 1noi n VAL 40 Ca -0.01 -1.28 -0.06 0.00 -0.01 0.00 0.00 64.34 62.98 1noi n VAL 40 Cb 0.71 -6.38 -0.02 0.00 -0.91 0.00 0.00 33.84 27.25 1noi n VAL 40 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1noi n LYS 41 N -3.25 0.17 -3.55 5.55 4.76 -1.10 -5.03 118.16 115.71 1noi n LYS 41 Ca -0.08 -1.06 -0.07 0.00 -2.87 0.00 0.00 58.31 54.22 1noi n LYS 41 Cb 0.62 0.91 -0.02 0.00 -1.84 0.00 0.00 35.03 34.70 1noi n LYS 41 CO 0.00 0.00 0.00 0.16 -1.37 0.00 0.00 177.40 176.19 1noi s ASP 42 N -1.76 -0.33 0.56 4.39 1.47 -1.26 -4.14 116.67 115.59 1noi s ASP 42 Ca 0.12 -0.07 0.33 0.00 1.18 0.00 0.00 52.55 54.11 1noi s ASP 42 Cb 0.00 0.40 1.47 0.00 -0.34 0.00 0.00 42.92 44.45 1noi s ASP 42 CO 0.09 -0.66 1.81 0.08 0.68 0.00 0.00 175.17 177.16 1noi h ARG 43 N 2.00 0.00 0.00 2.11 0.11 -1.98 0.15 114.38 116.77 1noi h ARG 43 Ca -0.22 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 59.76 1noi h ARG 43 Cb 1.24 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.30 1noi h ARG 43 CO 0.30 0.00 -0.48 -0.91 0.10 0.00 0.00 179.97 178.98 1noi h ASN 44 N 0.00 0.00 0.00 0.08 4.21 -2.05 -3.27 115.58 114.56 1noi h ASN 44 Ca 0.44 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.92 1noi h ASN 44 Cb 1.92 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 39.11 1noi h ASN 44 CO -0.00 0.48 -1.48 0.52 -1.29 0.00 0.00 177.43 175.65 1noi n VAL 45 N -3.78 0.12 -2.18 2.81 0.31 0.34 -5.03 118.33 110.91 1noi n VAL 45 Ca -0.01 -0.25 -0.38 0.00 -0.01 0.00 0.00 64.34 63.68 1noi n VAL 45 Cb 0.53 0.08 -0.01 0.00 -0.91 0.00 0.00 33.84 33.53 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 -2.60 3.10 0.25 3.52 0.00 -0.12 -4.90 121.76 121.01 1noi s ALA 46 Ca -0.04 1.06 0.10 0.00 0.00 0.00 0.00 51.96 53.08 1noi s ALA 46 Cb 0.06 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 1noi s ALA 46 CO 0.40 -0.71 -0.07 -0.08 0.00 0.00 0.00 175.76 175.31 1noi s THR 47 N -1.40 3.17 0.51 0.00 -1.32 -1.26 -4.96 115.64 110.38 1noi s THR 47 Ca 0.60 -1.97 0.23 0.00 -1.21 0.00 0.00 61.69 59.33 1noi s THR 47 Cb -0.33 -2.66 0.38 0.00 -1.51 0.00 0.00 72.50 68.38 1noi s THR 47 CO 0.41 -0.33 1.98 -0.65 -2.21 0.00 0.00 174.62 173.83 1noi h PRO 48 N 2.19 0.10 -0.72 7.08 0.11 -1.99 0.15 132.00 138.91 1noi h PRO 48 Ca -0.44 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.64 1noi h PRO 48 Cb 1.24 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.30 1noi h PRO 48 CO 0.59 0.06 0.36 -0.09 -0.21 0.00 0.00 178.00 178.71 1noi h ARG 49 N 0.10 1.03 -0.56 1.05 2.43 -1.97 -0.21 114.38 116.24 1noi h ARG 49 Ca 0.27 -0.14 -0.05 0.00 -0.81 0.00 0.00 59.98 59.25 1noi h ARG 49 Cb 0.94 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 30.28 1noi h ARG 49 CO -0.03 0.79 0.16 -0.44 -1.51 0.00 0.00 179.97 178.95 1noi h ASP 50 N 1.00 0.79 -0.68 -3.80 3.32 -1.13 -0.91 116.42 115.02 1noi h ASP 50 Ca 0.25 -0.13 -0.06 0.00 0.02 0.00 0.00 57.03 57.11 1noi h ASP 50 Cb 0.09 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.41 1noi h ASP 50 CO -0.03 0.75 0.21 1.88 -1.72 0.00 0.00 179.24 180.33 1noi h TYR 51 N 0.82 1.12 -0.20 4.55 0.05 -0.53 -0.45 116.97 122.33 1noi h TYR 51 Ca 0.18 -0.11 -0.04 0.00 0.05 0.00 0.00 58.73 58.82 1noi h TYR 51 Cb 0.26 -0.32 -0.01 0.00 1.01 0.00 0.00 36.73 37.67 1noi h TYR 51 CO 0.02 0.89 -0.03 -0.92 -1.05 0.00 0.00 178.16 177.06 1noi h TYR 52 N 1.04 0.41 -0.60 4.88 3.20 -0.55 -1.82 116.97 123.53 1noi h TYR 52 Ca 0.23 -0.08 -0.01 0.00 3.14 0.00 0.00 58.73 62.01 1noi h TYR 52 Cb 0.30 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.44 1noi h TYR 52 CO 0.02 0.60 0.35 0.74 -1.64 0.00 0.00 178.16 178.23 1noi h PHE 53 N 0.11 0.78 -0.46 -3.82 -1.00 -0.84 0.10 116.94 111.82 1noi h PHE 53 Ca 0.05 -0.00 -0.12 0.00 2.81 0.00 0.00 57.97 60.71 1noi h PHE 53 Cb 0.46 -0.26 -0.01 0.00 3.61 0.00 0.00 35.95 39.74 1noi h PHE 53 CO 0.05 0.53 -0.21 0.00 -1.61 0.00 0.00 178.31 177.07 1noi h ALA 54 N 1.56 0.77 -0.24 2.45 0.00 -0.90 -0.21 119.26 122.69 1noi h ALA 54 Ca 0.21 -0.38 -0.14 0.00 0.00 0.00 0.00 54.91 54.60 1noi h ALA 54 Cb -0.02 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1noi h ALA 54 CO -0.04 0.66 -0.40 1.25 0.00 0.00 0.00 179.25 180.72 1noi h LEU 55 N 0.80 0.77 -0.39 0.00 5.85 -0.98 -2.24 115.31 119.13 1noi h LEU 55 Ca 0.11 -0.52 0.04 0.00 0.84 0.00 0.00 57.88 58.35 1noi h LEU 55 Cb 0.76 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 1noi h LEU 55 CO 0.06 1.15 0.15 0.00 -0.34 0.00 0.00 178.44 179.46 1noi h ALA 56 N 0.65 0.46 0.00 1.25 0.00 -0.62 -0.51 119.26 120.49 1noi h ALA 56 Ca 0.02 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1noi h ALA 56 Cb 0.99 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1noi h ALA 56 CO 0.09 -0.23 -0.29 0.45 0.00 0.00 0.00 179.25 179.27 1noi h HIS 57 N 0.32 0.00 -0.19 0.00 3.86 -1.04 0.25 115.15 118.35 1noi h HIS 57 Ca 0.17 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 59.19 1noi h HIS 57 Cb 0.14 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.61 1noi h HIS 57 CO -0.13 0.29 -0.63 1.15 0.86 0.00 0.00 177.93 179.46 1noi h THR 58 N 0.00 1.29 -0.24 2.45 2.02 -0.63 -2.65 112.91 115.16 1noi h THR 58 Ca -0.00 -1.84 -0.18 0.00 0.77 0.00 0.00 66.41 65.16 1noi h THR 58 Cb 0.52 1.89 0.00 0.00 -1.74 0.00 0.00 68.15 68.83 1noi h THR 58 CO 0.04 0.58 -0.55 0.58 0.37 0.00 0.00 175.52 176.54 1noi h VAL 59 N 0.50 1.29 -0.84 3.16 2.07 -0.93 -3.17 116.25 118.33 1noi h VAL 59 Ca -0.02 -1.74 0.19 0.00 0.82 0.00 0.00 66.70 65.95 1noi h VAL 59 Cb 1.25 1.75 -0.12 0.00 -1.52 0.00 0.00 31.29 32.66 1noi h VAL 59 CO 0.13 0.56 0.31 -0.09 0.02 0.00 0.00 177.57 178.51 1noi h ARG 60 N 0.55 0.35 -0.44 1.57 2.43 -0.98 0.51 114.38 118.37 1noi h ARG 60 Ca 0.00 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1noi h ARG 60 Cb 1.16 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.61 1noi h ARG 60 CO 0.12 0.23 0.27 -0.44 -1.51 0.00 0.00 179.97 178.65 1noi h ASP 61 N 0.36 0.52 0.35 -3.80 3.32 -1.44 -1.14 116.42 114.59 1noi h ASP 61 Ca 0.50 -0.02 -0.12 0.00 0.02 0.00 0.00 57.03 57.41 1noi h ASP 61 Cb 0.91 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.32 1noi h ASP 61 CO -0.52 0.39 -0.50 0.45 -1.72 0.00 0.00 179.24 177.35 1noi h HIS 62 N 0.60 0.21 0.35 4.55 3.86 -1.03 -3.06 115.15 120.64 1noi h HIS 62 Ca 0.16 -0.07 -0.02 0.00 -1.16 0.00 0.00 60.37 59.29 1noi h HIS 62 Cb -0.04 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 28.39 1noi h HIS 62 CO 0.00 0.64 -0.17 -0.07 0.86 0.00 0.00 177.93 179.19 1noi h LEU 63 N 0.14 -0.40 -1.32 2.43 3.38 -1.07 -3.32 115.31 115.15 1noi h LEU 63 Ca 0.00 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1noi h LEU 63 Cb 0.93 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1noi h LEU 63 CO 0.07 -0.05 0.00 -0.37 0.09 0.00 0.00 178.44 178.18 1noi h VAL 64 N -0.79 0.00 -0.31 1.22 -1.51 -1.28 -1.96 116.25 111.62 1noi h VAL 64 Ca -0.05 -0.49 0.03 0.00 -1.23 0.00 0.00 66.70 64.96 1noi h VAL 64 Cb 0.52 1.46 -0.03 0.00 -2.13 0.00 0.00 31.29 31.11 1noi h VAL 64 CO 0.08 0.00 0.13 1.23 -1.23 0.00 0.00 177.57 177.77 1noi h GLY 65 N 2.15 0.40 2.00 5.19 0.00 -1.64 -0.68 103.07 110.49 1noi h GLY 65 Ca 0.00 -0.08 -0.19 0.00 0.00 0.00 0.00 47.33 47.06 1noi h GLY 65 CO 0.00 0.05 -0.89 3.21 0.00 0.00 0.00 176.54 178.91 1noi h ARG 66 N 0.27 0.00 0.34 4.80 3.08 -1.56 -2.92 114.38 118.39 1noi h ARG 66 Ca 0.13 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 1noi h ARG 66 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.14 1noi h ARG 66 CO -0.12 0.89 -0.16 2.35 -1.07 0.00 0.00 179.97 181.86 1noi h TRP 67 N 0.00 -0.42 -0.21 3.04 7.01 -0.91 0.29 115.95 124.75 1noi h TRP 67 Ca -0.01 -0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.04 1noi h TRP 67 Cb 1.59 0.14 -0.07 0.00 -2.10 0.00 0.00 29.16 28.73 1noi h TRP 67 CO 0.00 -0.22 -0.27 0.82 -2.79 0.00 0.00 178.44 175.98 1noi h ILE 68 N -0.51 0.35 0.00 2.65 2.04 -1.14 -0.78 117.51 120.11 1noi h ILE 68 Ca -0.05 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.76 1noi h ILE 68 Cb 0.38 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 1noi h ILE 68 CO 0.08 0.00 -0.23 0.03 0.00 0.00 0.00 178.15 178.02 1noi h ARG 69 N -0.30 0.00 -0.09 2.37 3.08 -1.31 -0.31 114.38 117.83 1noi h ARG 69 Ca 0.12 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.07 1noi h ARG 69 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1noi h ARG 69 CO -0.38 0.23 -0.34 1.15 -1.07 0.00 0.00 179.97 179.56 1noi h THR 70 N 0.00 1.40 -0.11 2.04 2.02 0.96 -2.04 112.91 117.18 1noi h THR 70 Ca -0.00 -1.71 -0.09 0.00 0.77 0.00 0.00 66.41 65.38 1noi h THR 70 Cb 0.49 2.24 -0.01 0.00 -1.74 0.00 0.00 68.15 69.13 1noi h THR 70 CO 0.03 0.50 -0.34 1.56 0.37 0.00 0.00 175.52 177.64 1noi h GLN 71 N -0.07 0.23 0.05 6.66 1.08 -1.16 0.75 115.11 122.64 1noi h GLN 71 Ca -0.02 -0.09 -0.00 0.00 -1.45 0.00 0.00 58.65 57.09 1noi h GLN 71 Cb 0.98 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.40 1noi h GLN 71 CO 0.07 0.55 -0.02 1.96 -0.95 0.00 0.00 178.83 180.43 1noi h GLN 72 N 0.20 -0.07 -0.23 1.46 4.20 -0.99 -0.89 115.11 118.78 1noi h GLN 72 Ca 0.02 0.00 0.06 0.00 0.06 0.00 0.00 58.65 58.80 1noi h GLN 72 Cb 0.70 0.02 -0.06 0.00 0.30 0.00 0.00 27.48 28.44 1noi h GLN 72 CO 0.05 -0.01 -0.15 1.25 -0.67 0.00 0.00 178.83 179.30 1noi h HIS 73 N -0.11 -0.39 -0.64 2.96 2.76 -0.79 -1.37 115.15 117.58 1noi h HIS 73 Ca -0.01 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.15 1noi h HIS 73 Cb 0.09 0.21 -0.03 0.00 1.55 0.00 0.00 27.41 29.22 1noi h HIS 73 CO -0.06 -0.22 0.23 1.88 -1.30 0.00 0.00 177.93 178.45 1noi h TYR 74 N -0.14 0.96 0.07 5.26 0.05 -0.61 -0.24 116.97 122.32 1noi h TYR 74 Ca 0.13 -0.07 0.02 0.00 0.05 0.00 0.00 58.73 58.86 1noi h TYR 74 Cb 0.34 -0.29 -0.03 0.00 1.01 0.00 0.00 36.73 37.76 1noi h TYR 74 CO -0.32 0.75 -0.19 -0.92 -1.05 0.00 0.00 178.16 176.43 1noi h TYR 75 N 0.92 -0.50 -0.86 4.88 3.20 -0.55 0.28 116.97 124.35 1noi h TYR 75 Ca 0.21 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.06 1noi h TYR 75 Cb 0.22 0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.66 1noi h TYR 75 CO 0.02 -0.28 0.41 0.93 -1.64 0.00 0.00 178.16 177.60 1noi h GLU 76 N -0.34 1.23 0.00 1.82 5.08 -0.99 -3.21 114.58 118.17 1noi h GLU 76 Ca 0.04 -0.18 -0.09 0.00 -1.00 0.00 0.00 59.36 58.12 1noi h GLU 76 Cb 0.38 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1noi h GLU 76 CO -0.13 0.94 -0.45 0.87 -1.00 0.00 0.00 179.01 179.25 1noi h LYS 77 N 1.22 0.00 -6.81 2.33 6.56 -1.01 -3.49 116.57 115.37 1noi h LYS 77 Ca 0.29 0.00 -0.56 0.00 -1.06 0.00 0.00 60.65 59.32 1noi h LYS 77 Cb 0.12 0.00 -0.12 0.00 -0.57 0.00 0.00 32.23 31.66 1noi h LYS 77 CO -0.04 0.45 -0.94 -3.47 -2.06 0.00 0.00 179.45 173.39 1noi n ASP 78 N -3.27 -0.13 -3.80 0.86 2.03 0.97 -4.99 116.55 108.23 1noi n ASP 78 Ca 0.02 -1.16 -0.28 0.00 0.52 0.00 0.00 54.79 53.88 1noi n ASP 78 Cb 0.68 -2.25 0.20 0.00 -0.72 0.00 0.00 41.12 39.03 1noi n ASP 78 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1noi n PRO 79 N -4.53 -1.34 -2.56 -0.67 -0.04 -1.26 -4.99 135.00 119.61 1noi n PRO 79 Ca -0.30 -1.95 -0.42 0.00 -0.04 0.00 0.00 63.50 60.79 1noi n PRO 79 Cb 0.68 -1.32 -0.03 0.00 -0.04 0.00 0.00 33.50 32.79 1noi n PRO 79 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1noi s LYS 80 N -5.76 4.43 -0.05 0.54 2.20 -1.26 -4.89 119.74 114.96 1noi s LYS 80 Ca 0.72 1.57 -0.06 0.00 -0.36 0.00 0.00 55.97 57.84 1noi s LYS 80 Cb -0.02 -3.49 -0.04 0.00 -1.51 0.00 0.00 37.83 32.77 1noi s LYS 80 CO 0.51 -0.29 0.20 1.03 -0.36 0.00 0.00 175.35 176.43 1noi s ARG 81 N 1.67 3.49 -0.10 4.03 0.52 -0.39 -4.54 118.95 123.64 1noi s ARG 81 Ca 0.54 -0.16 0.03 0.00 -0.52 0.00 0.00 55.73 55.62 1noi s ARG 81 Cb -0.23 -3.13 -0.01 0.00 0.52 0.00 0.00 34.95 32.10 1noi s ARG 81 CO 0.24 0.71 -0.21 -1.50 0.02 0.00 0.00 175.30 174.55 1noi s ILE 82 N -1.20 2.33 -0.24 1.52 -1.16 -0.11 -1.53 121.20 120.81 1noi s ILE 82 Ca 0.23 -0.93 -0.06 0.00 -0.51 0.00 0.00 60.65 59.37 1noi s ILE 82 Cb -0.13 -1.91 -0.02 0.00 0.61 0.00 0.00 42.46 41.02 1noi s ILE 82 CO 0.13 0.55 0.03 -0.31 -2.81 0.00 0.00 174.94 172.53 1noi s TYR 83 N 0.22 3.04 -0.42 3.50 2.02 0.40 -0.50 117.35 125.62 1noi s TYR 83 Ca -0.13 -0.64 -0.06 0.00 -0.37 0.00 0.00 57.07 55.86 1noi s TYR 83 Cb -0.17 -2.19 0.10 0.00 -0.40 0.00 0.00 41.96 39.30 1noi s TYR 83 CO 0.07 -0.44 0.23 -0.47 -1.57 0.00 0.00 175.55 173.37 1noi s TYR 84 N 1.56 3.46 -0.22 2.71 5.04 -0.64 -0.56 117.35 128.70 1noi s TYR 84 Ca 0.06 -2.01 -0.21 0.00 -2.44 0.00 0.00 57.07 52.47 1noi s TYR 84 Cb -0.15 -3.12 -0.02 0.00 0.35 0.00 0.00 41.96 39.02 1noi s TYR 84 CO 0.01 -0.93 0.66 -0.51 -1.34 0.00 0.00 175.55 173.44 1noi s LEU 85 N 1.28 4.11 -0.06 6.97 1.43 -0.67 -2.37 118.68 129.37 1noi s LEU 85 Ca 0.05 0.82 -0.05 0.00 -1.03 0.00 0.00 54.13 53.93 1noi s LEU 85 Cb -0.23 -2.92 0.02 0.00 0.03 0.00 0.00 46.19 43.08 1noi s LEU 85 CO -0.01 -0.33 0.15 -0.55 0.23 0.00 0.00 176.35 175.83 1noi s SER 86 N 1.30 -0.15 0.00 2.29 0.15 -1.13 -3.50 113.70 112.67 1noi s SER 86 Ca 0.29 0.30 0.11 0.00 0.70 0.00 0.00 55.95 57.35 1noi s SER 86 Cb -0.16 0.29 0.46 0.00 -1.71 0.00 0.00 66.02 64.91 1noi s SER 86 CO 0.10 -0.06 1.33 -0.11 1.20 0.00 0.00 173.24 175.70 1noi n LEU 87 N 3.08 0.97 -3.77 3.45 7.94 -1.26 -4.30 117.00 123.11 1noi n LEU 87 Ca -0.13 -0.46 -0.14 0.00 -1.11 0.00 0.00 56.01 54.17 1noi n LEU 87 Cb 0.59 -0.10 -0.15 0.00 0.53 0.00 0.00 43.42 44.29 1noi n LEU 87 CO 0.21 0.23 -0.28 -1.61 -1.11 0.00 0.00 177.39 174.83 1noi s GLU 88 N -1.80 0.04 -0.35 1.96 2.02 -1.26 -4.83 118.70 114.47 1noi s GLU 88 Ca 0.20 0.27 0.01 0.00 0.02 0.00 0.00 54.97 55.47 1noi s GLU 88 Cb 0.10 -0.18 0.11 0.00 0.10 0.00 0.00 34.13 34.26 1noi s GLU 88 CO 0.15 -0.15 0.13 -0.06 0.02 0.00 0.00 175.26 175.34 1noi s PHE 89 N 1.01 2.25 -1.30 1.61 0.08 0.12 -4.22 117.98 117.52 1noi s PHE 89 Ca -0.08 -2.21 -0.13 0.00 0.12 0.00 0.00 56.93 54.63 1noi s PHE 89 Cb -0.11 -2.05 0.13 0.00 -0.57 0.00 0.00 43.02 40.42 1noi s PHE 89 CO -0.04 -0.87 1.81 0.98 -0.10 0.00 0.00 175.22 177.01 1noi n TYR 90 N 4.36 3.85 0.10 0.36 9.36 -0.10 -3.87 117.16 131.21 1noi n TYR 90 Ca 0.02 -2.98 -0.05 0.00 3.32 0.00 0.00 57.90 58.20 1noi n TYR 90 Cb 0.40 -2.24 0.05 0.00 -0.63 0.00 0.00 39.34 36.93 1noi n TYR 90 CO 0.00 0.00 0.00 0.52 0.22 0.00 0.00 176.86 177.60 1noi h MET 91 N 6.42 0.11 -3.26 2.98 2.86 -1.84 -3.41 114.93 118.80 1noi h MET 91 Ca 0.42 -0.11 -0.08 0.00 -2.06 0.00 0.00 59.70 57.87 1noi h MET 91 Cb 0.73 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.42 1noi h MET 91 CO 1.56 0.82 -0.39 0.41 1.06 0.00 0.00 176.91 180.37 1noi n GLY 92 N 0.65 0.04 1.13 8.32 0.00 -1.26 -4.73 105.19 109.34 1noi n GLY 92 Ca -0.02 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 0.29 -0.52 -0.00 1.61 1.74 -1.25 -4.72 116.66 113.81 1noi n ARG 93 Ca -0.02 0.83 0.10 0.00 -0.77 0.00 0.00 57.85 57.99 1noi n ARG 93 Cb 0.21 -0.92 -0.14 0.00 -1.02 0.00 0.00 32.46 30.59 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 0.18 0.00 0.33 0.55 -1.04 -1.26 -4.60 114.28 108.45 1noi n THR 94 Ca 0.00 -0.23 -0.13 0.00 -2.04 0.00 0.00 64.05 61.65 1noi n THR 94 Cb 0.00 0.56 -0.06 0.00 -1.82 0.00 0.00 70.33 69.01 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 -0.74 -0.52 -4.42 6.46 -1.96 -2.12 115.31 112.00 1noi h LEU 95 Ca 0.00 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.79 1noi h LEU 95 Cb 0.69 0.19 -0.03 0.00 -0.73 0.00 0.00 40.66 40.78 1noi h LEU 95 CO 0.00 -0.41 0.34 -0.61 -0.62 0.00 0.00 178.44 177.14 1noi h GLN 96 N -1.11 0.70 -0.24 1.25 4.15 -1.98 -1.59 115.11 116.29 1noi h GLN 96 Ca -0.09 -0.05 0.06 0.00 0.77 0.00 0.00 58.65 59.34 1noi h GLN 96 Cb 0.67 -0.15 -0.06 0.00 0.21 0.00 0.00 27.48 28.15 1noi h GLN 96 CO 0.15 0.47 -0.16 -0.97 -1.93 0.00 0.00 178.83 176.39 1noi h ASN 97 N 0.71 -0.51 -0.01 -0.69 -0.73 -1.80 -0.63 115.58 111.91 1noi h ASN 97 Ca 0.19 0.11 0.03 0.00 1.87 0.00 0.00 56.30 58.50 1noi h ASN 97 Cb -0.06 0.26 -0.03 0.00 0.27 0.00 0.00 38.32 38.76 1noi h ASN 97 CO -0.04 -0.20 -0.17 0.74 -0.37 0.00 0.00 177.43 177.39 1noi h THR 98 N -0.14 0.58 -0.68 -3.57 2.02 -1.00 0.87 112.91 110.99 1noi h THR 98 Ca 0.13 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.30 1noi h THR 98 Cb 0.35 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 67.30 1noi h THR 98 CO -0.33 0.00 0.37 0.24 0.37 0.00 0.00 175.52 176.17 1noi h MET 99 N -0.28 0.94 0.09 6.66 2.86 -0.96 -1.57 114.93 122.69 1noi h MET 99 Ca 0.06 -0.10 -0.28 0.00 -2.06 0.00 0.00 59.70 57.32 1noi h MET 99 Cb 0.35 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 1noi h MET 99 CO -0.17 0.70 -1.36 -0.39 1.06 0.00 0.00 176.91 176.74 1noi h VAL 100 N 0.95 1.34 0.00 -2.22 -1.51 -0.62 0.28 116.25 114.47 1noi h VAL 100 Ca 0.24 -2.98 0.00 0.00 -1.23 0.00 0.00 66.70 62.73 1noi h VAL 100 Cb 0.03 2.81 0.00 0.00 -2.13 0.00 0.00 31.29 32.00 1noi h VAL 100 CO -0.04 0.84 0.00 0.78 -1.23 0.00 0.00 177.57 177.93 1noi h ASN 101 N 0.05 0.00 -0.01 4.19 4.21 -0.34 -1.98 115.58 121.70 1noi h ASN 101 Ca -0.17 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.34 1noi h ASN 101 Cb 1.96 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 39.16 1noi h ASN 101 CO 0.16 0.00 -0.12 0.18 -1.29 0.00 0.00 177.43 176.36 1noi n LEU 102 N -2.44 1.89 -1.59 1.61 4.32 -0.64 -1.27 117.00 118.89 1noi n LEU 102 Ca 0.00 -0.90 -0.15 0.00 -0.02 0.00 0.00 56.01 54.94 1noi n LEU 102 Cb 0.17 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 41.95 1noi n LEU 102 CO 0.18 0.35 -0.18 0.00 -1.22 0.00 0.00 177.39 176.52 1noi n ALA 103 N 0.39 -0.39 1.16 -1.18 0.00 -0.04 -4.90 120.51 115.55 1noi n ALA 103 Ca 0.07 0.16 0.13 0.00 0.00 0.00 0.00 53.44 53.80 1noi n ALA 103 Cb 0.33 -1.72 0.44 0.00 0.00 0.00 0.00 19.45 18.50 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 -2.07 0.50 0.11 0.00 4.32 0.79 -4.65 117.00 116.00 1noi n LEU 104 Ca -0.17 0.05 -0.12 0.00 -0.02 0.00 0.00 56.01 55.74 1noi n LEU 104 Cb 0.60 -0.25 -0.06 0.00 -1.62 0.00 0.00 43.42 42.09 1noi n LEU 104 CO 0.22 0.10 0.74 -0.08 -1.22 0.00 0.00 177.39 177.15 1noi h GLU 105 N 0.37 -0.36 0.18 3.23 4.81 -1.90 0.91 114.58 121.83 1noi h GLU 105 Ca 0.00 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 1noi h GLU 105 Cb 0.46 0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.92 1noi h GLU 105 CO 0.00 -0.24 -0.09 -0.91 -0.73 0.00 0.00 179.01 177.04 1noi h ASN 106 N -0.37 -0.21 -0.90 1.04 2.35 -1.93 -0.77 115.58 114.80 1noi h ASN 106 Ca 0.02 -0.08 0.10 0.00 -0.55 0.00 0.00 56.30 55.80 1noi h ASN 106 Cb 0.39 0.05 -0.08 0.00 0.05 0.00 0.00 38.32 38.74 1noi h ASN 106 CO -0.10 -0.05 0.53 0.00 -1.65 0.00 0.00 177.43 176.16 1noi h ALA 107 N 0.45 1.31 -0.18 -0.83 0.00 -1.78 0.24 119.26 118.47 1noi h ALA 107 Ca -0.02 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 1noi h ALA 107 Cb 0.27 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1noi h ALA 107 CO 0.04 0.15 -0.42 0.00 0.00 0.00 0.00 179.25 179.01 1noi h ASP 109 N 0.35 -0.70 -0.14 0.00 1.82 0.23 0.51 116.42 118.48 1noi h ASP 109 Ca 0.03 -0.02 0.04 0.00 -0.39 0.00 0.00 57.03 56.68 1noi h ASP 109 Cb 0.89 0.18 -0.04 0.00 0.68 0.00 0.00 39.33 41.05 1noi h ASP 109 CO 0.08 -0.39 -0.09 -0.08 -1.61 0.00 0.00 179.24 177.15 1noi h GLU 110 N -1.02 -0.08 -0.27 0.28 4.57 -0.44 -1.98 114.58 115.65 1noi h GLU 110 Ca -0.08 0.01 0.06 0.00 -1.18 0.00 0.00 59.36 58.16 1noi h GLU 110 Cb 0.68 0.02 -0.06 0.00 -0.16 0.00 0.00 28.75 29.23 1noi h GLU 110 CO 0.14 -0.05 -0.15 0.00 -1.18 0.00 0.00 179.01 177.77 1noi h ALA 111 N 1.04 0.05 -0.18 2.92 0.00 -1.24 -0.73 119.26 121.12 1noi h ALA 111 Ca 0.09 0.10 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 1noi h ALA 111 Cb 0.21 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1noi h ALA 111 CO -0.20 -0.56 -0.28 1.79 0.00 0.00 0.00 179.25 180.01 1noi h THR 112 N -0.12 1.26 0.80 0.00 1.35 -0.63 -1.27 112.91 114.29 1noi h THR 112 Ca 0.14 -1.25 -0.03 0.00 -0.55 0.00 0.00 66.41 64.72 1noi h THR 112 Cb 0.34 1.44 -0.00 0.00 -1.73 0.00 0.00 68.15 68.20 1noi h THR 112 CO -0.35 0.38 -0.49 0.22 -0.25 0.00 0.00 175.52 175.04 1noi h TYR 113 N 0.30 -1.30 -0.00 4.73 3.20 -0.53 -0.50 116.97 122.86 1noi h TYR 113 Ca 0.04 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1noi h TYR 113 Cb 0.65 0.46 -0.00 0.00 1.54 0.00 0.00 36.73 39.38 1noi h TYR 113 CO 0.01 -0.73 0.01 1.96 -1.64 0.00 0.00 178.16 177.77 1noi h GLN 114 N -1.20 0.00 0.00 1.82 4.20 -1.11 -0.34 115.11 118.47 1noi h GLN 114 Ca -0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.60 1noi h GLN 114 Cb 0.96 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.74 1noi h GLN 114 CO 0.11 0.00 -0.25 1.28 -0.67 0.00 0.00 178.83 179.30 1noi n LEU 115 N -3.38 0.39 0.00 1.46 4.77 -0.33 -4.96 117.00 114.95 1noi n LEU 115 Ca -0.03 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 1noi n LEU 115 Cb 0.08 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 40.83 1noi n LEU 115 CO 0.23 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 1noi n GLY 116 N 1.44 0.99 3.25 -0.72 0.00 -0.14 -5.07 105.19 104.94 1noi n GLY 116 Ca 0.06 -0.01 -0.26 0.00 0.00 0.00 0.00 46.02 45.80 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 2.13 -0.22 0.99 1.43 -0.57 -5.02 118.68 117.42 1noi s LEU 117 Ca 0.00 -0.49 -0.17 0.00 -1.03 0.00 0.00 54.13 52.45 1noi s LEU 117 Cb 0.00 -1.02 -0.03 0.00 0.03 0.00 0.00 46.19 45.17 1noi s LEU 117 CO 0.00 0.19 0.45 -0.62 0.23 0.00 0.00 176.35 176.60 1noi s ASP 118 N -1.00 6.46 0.27 2.29 2.15 -1.26 -3.45 116.67 122.13 1noi s ASP 118 Ca 0.08 0.54 -0.04 0.00 0.43 0.00 0.00 52.55 53.56 1noi s ASP 118 Cb -0.09 -2.26 0.35 0.00 -0.30 0.00 0.00 42.92 40.63 1noi s ASP 118 CO 0.01 -0.15 1.90 -0.03 -0.17 0.00 0.00 175.17 176.73 1noi h MET 119 N 7.57 1.10 -0.85 4.34 1.85 -1.91 -2.18 114.93 124.85 1noi h MET 119 Ca -0.34 -0.12 0.02 0.00 -0.61 0.00 0.00 59.70 58.66 1noi h MET 119 Cb 1.16 -0.22 -0.05 0.00 0.43 0.00 0.00 31.60 32.92 1noi h MET 119 CO 0.72 0.80 0.56 0.93 -0.40 0.00 0.00 176.91 179.51 1noi h GLU 120 N 1.11 1.08 0.00 0.39 5.08 -1.99 -1.48 114.58 118.76 1noi h GLU 120 Ca 0.28 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.49 1noi h GLU 120 Cb 0.01 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.00 1noi h GLU 120 CO -0.05 0.72 -0.42 1.49 -1.00 0.00 0.00 179.01 179.75 1noi h GLU 121 N 1.11 0.00 -0.03 2.33 4.22 -1.81 -2.20 114.58 118.19 1noi h GLU 121 Ca 0.33 0.00 -0.23 0.00 0.08 0.00 0.00 59.36 59.54 1noi h GLU 121 Cb -0.06 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.19 1noi h GLU 121 CO -0.09 0.42 -0.91 -0.07 -2.18 0.00 0.00 179.01 176.18 1noi h LEU 122 N 0.00 0.68 -0.69 1.64 3.38 -1.24 -3.00 115.31 116.08 1noi h LEU 122 Ca -0.00 -0.51 0.11 0.00 0.09 0.00 0.00 57.88 57.56 1noi h LEU 122 Cb 0.78 -0.21 -0.08 0.00 0.09 0.00 0.00 40.66 41.24 1noi h LEU 122 CO 0.05 1.30 0.29 -0.33 0.09 0.00 0.00 178.44 179.85 1noi h GLU 123 N 0.32 0.46 0.00 1.13 5.08 -0.72 0.12 114.58 120.98 1noi h GLU 123 Ca -0.08 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1noi h GLU 123 Cb 1.54 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.68 1noi h GLU 123 CO 0.17 0.31 0.00 0.39 -1.00 0.00 0.00 179.01 178.87 1noi n GLU 124 N -4.96 0.13 0.10 2.33 -0.58 -0.88 -2.64 120.64 114.13 1noi n GLU 124 Ca 0.11 0.53 -0.04 0.00 -0.42 0.00 0.00 57.16 57.34 1noi n GLU 124 Cb 0.32 -1.84 0.11 0.00 -0.57 0.00 0.00 31.44 29.46 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 1.43 -3.25 -3.67 1.08 -0.79 -3.45 117.51 108.86 1noi h ILE 125 Ca 0.00 -2.18 -0.53 0.00 -0.39 0.00 0.00 64.86 61.76 1noi h ILE 125 Cb 0.12 2.15 0.05 0.00 -3.07 0.00 0.00 36.82 36.08 1noi h ILE 125 CO 0.00 0.63 0.77 -0.70 -0.69 0.00 0.00 178.15 178.16 1noi s GLU 126 N -3.58 4.27 0.47 2.37 2.12 -1.08 -5.00 118.70 118.26 1noi s GLU 126 Ca -0.03 2.27 -0.23 0.00 0.36 0.00 0.00 54.97 57.35 1noi s GLU 126 Cb 0.12 -3.14 -0.07 0.00 0.26 0.00 0.00 34.13 31.30 1noi s GLU 126 CO 0.79 -0.44 1.16 -1.21 -0.54 0.00 0.00 175.26 175.02 1noi s GLU 127 N 0.03 3.72 0.09 4.30 0.41 -1.26 -4.93 118.70 121.06 1noi s GLU 127 Ca 0.61 1.75 -0.30 0.00 -0.41 0.00 0.00 54.97 56.62 1noi s GLU 127 Cb -0.41 -2.36 -0.06 0.00 -1.78 0.00 0.00 34.13 29.52 1noi s GLU 127 CO 0.40 -0.57 1.09 -0.51 -0.49 0.00 0.00 175.26 175.17 1noi s ASP 128 N -1.41 7.25 -0.01 -0.19 1.11 -1.26 -3.80 116.67 118.36 1noi s ASP 128 Ca 0.64 1.93 -0.31 0.00 0.18 0.00 0.00 52.55 55.00 1noi s ASP 128 Cb -0.28 -2.59 -0.09 0.00 1.07 0.00 0.00 42.92 41.03 1noi s ASP 128 CO 0.34 -0.30 1.99 0.00 1.18 0.00 0.00 175.17 178.38 1noi n ALA 129 N 3.29 1.49 -1.65 5.23 0.00 -1.26 -4.83 120.51 122.79 1noi n ALA 129 Ca 0.06 0.18 -0.39 0.00 0.00 0.00 0.00 53.44 53.28 1noi n ALA 129 Cb 0.48 -2.68 -0.04 0.00 0.00 0.00 0.00 19.45 17.21 1noi n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1noi n GLY 130 N 4.66 2.40 0.19 0.00 0.00 -1.26 -4.26 105.19 106.92 1noi n GLY 130 Ca 0.22 -1.18 0.02 0.00 0.00 0.00 0.00 46.02 45.08 1noi n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1noi n LEU 131 N 9.32 0.81 0.00 0.99 4.32 -1.26 -3.45 117.00 127.73 1noi n LEU 131 Ca 0.49 -1.32 0.02 0.00 -0.02 0.00 0.00 56.01 55.18 1noi n LEU 131 Cb 0.43 -0.09 0.01 0.00 -1.62 0.00 0.00 43.42 42.14 1noi n LEU 131 CO 0.89 0.32 0.69 0.61 -1.22 0.00 0.00 177.39 178.67 1noi n GLY 132 N -0.38 0.27 1.85 -0.72 0.00 -1.25 0.10 105.19 105.05 1noi n GLY 132 Ca 0.03 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.12 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 -0.63 0.00 0.00 1.61 5.15 -1.26 -4.74 115.26 115.39 1noi n ASN 133 Ca 0.04 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.02 1noi n ASN 133 Cb 0.34 0.15 0.00 0.00 -0.53 0.00 0.00 39.78 39.74 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 0.55 5.21 0.26 8.20 0.00 -1.26 -5.01 105.19 113.14 1noi n GLY 134 Ca 0.00 -1.57 0.14 0.00 0.00 0.00 0.00 46.02 44.59 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 0.00 1.03 -0.02 0.00 -2.01 -2.50 103.07 99.57 1noi h GLY 135 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 1noi h GLY 135 CO 0.00 0.00 0.14 -2.00 0.00 0.00 0.00 176.54 174.68 1noi h LEU 136 N 0.00 0.96 -0.23 3.11 6.46 -1.95 -2.16 115.31 121.50 1noi h LEU 136 Ca -0.00 -0.24 -0.20 0.00 -0.12 0.00 0.00 57.88 57.32 1noi h LEU 136 Cb 0.52 -0.25 0.00 0.00 -0.73 0.00 0.00 40.66 40.20 1noi h LEU 136 CO 0.01 0.95 -0.64 1.23 -0.62 0.00 0.00 178.44 179.38 1noi h GLY 137 N 0.93 0.92 1.83 3.75 0.00 -1.63 -2.80 103.07 106.06 1noi h GLY 137 Ca 0.20 -1.17 -0.15 0.00 0.00 0.00 0.00 47.33 46.21 1noi h GLY 137 CO 0.00 1.04 -0.65 -0.09 0.00 0.00 0.00 176.54 176.85 1noi h ARG 138 N 0.61 0.17 -0.03 4.80 1.12 -1.43 0.02 114.38 119.64 1noi h ARG 138 Ca -0.01 -0.13 -0.00 0.00 -1.11 0.00 0.00 59.98 58.73 1noi h ARG 138 Cb 1.26 0.02 -0.00 0.00 -0.01 0.00 0.00 29.97 31.24 1noi h ARG 138 CO 0.14 0.75 0.01 1.25 -3.11 0.00 0.00 179.97 179.01 1noi h LEU 139 N 0.12 0.04 -0.41 3.80 5.85 -1.28 0.14 115.31 123.57 1noi h LEU 139 Ca -0.01 -0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.55 1noi h LEU 139 Cb 1.16 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.14 1noi h LEU 139 CO 0.10 0.23 0.16 0.00 -0.34 0.00 0.00 178.44 178.59 1noi h ALA 140 N 0.81 0.49 -0.66 1.25 0.00 -1.34 0.13 119.26 119.93 1noi h ALA 140 Ca 0.01 0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.02 1noi h ALA 140 Cb 0.21 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.94 1noi h ALA 140 CO -0.00 -0.22 0.36 0.00 0.00 0.00 0.00 179.25 179.40 1noi h ALA 141 N 1.25 0.89 -0.39 0.00 0.00 -0.94 -0.45 119.26 119.62 1noi h ALA 141 Ca 0.18 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 1noi h ALA 141 Cb 0.15 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1noi h ALA 141 CO -0.17 0.03 0.10 0.00 0.00 0.00 0.00 179.25 179.22 1noi h PHE 143 N 0.49 0.67 0.00 0.00 -1.00 -0.60 -1.85 116.94 114.65 1noi h PHE 143 Ca 0.12 -0.02 -0.04 0.00 2.81 0.00 0.00 57.97 60.84 1noi h PHE 143 Cb 0.29 -0.21 -0.01 0.00 3.61 0.00 0.00 35.95 39.63 1noi h PHE 143 CO 0.01 0.51 -0.20 -0.07 -1.61 0.00 0.00 178.31 176.95 1noi h LEU 144 N 0.68 0.00 0.08 1.54 3.38 -0.71 0.19 115.31 120.46 1noi h LEU 144 Ca 0.17 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.93 1noi h LEU 144 Cb 0.10 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.87 1noi h LEU 144 CO -0.02 0.20 -0.86 -0.78 0.09 0.00 0.00 178.44 177.08 1noi h ASP 145 N 0.00 0.62 0.21 -0.43 1.82 -1.35 -2.93 116.42 114.36 1noi h ASP 145 Ca -0.00 -0.84 -0.13 0.00 -0.39 0.00 0.00 57.03 55.68 1noi h ASP 145 Cb 0.76 -0.20 -0.01 0.00 0.68 0.00 0.00 39.33 40.57 1noi h ASP 145 CO 0.03 1.39 -0.48 0.28 -1.61 0.00 0.00 179.24 178.85 1noi h SER 146 N -0.06 0.35 -0.67 2.28 0.02 -0.88 -2.17 113.55 112.42 1noi h SER 146 Ca -0.13 -0.16 -0.05 0.00 -0.84 0.00 0.00 61.79 60.60 1noi h SER 146 Cb 1.59 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 64.01 1noi h SER 146 CO 0.17 0.77 0.20 0.24 -1.14 0.00 0.00 176.83 177.07 1noi h MET 147 N 0.26 1.04 0.59 3.45 2.86 -0.98 -2.35 114.93 119.80 1noi h MET 147 Ca 0.01 -0.23 -0.03 0.00 -2.06 0.00 0.00 59.70 57.40 1noi h MET 147 Cb 0.94 -0.15 0.01 0.00 0.06 0.00 0.00 31.60 32.46 1noi h MET 147 CO 0.08 0.91 -0.28 0.00 1.06 0.00 0.00 176.91 178.67 1noi h ALA 148 N 1.08 -0.79 -0.99 6.32 0.00 -1.44 0.70 119.26 124.15 1noi h ALA 148 Ca 0.21 -0.20 0.17 0.00 0.00 0.00 0.00 54.91 55.10 1noi h ALA 148 Cb 0.30 0.31 -0.09 0.00 0.00 0.00 0.00 17.79 18.31 1noi h ALA 148 CO -0.01 -0.87 0.61 1.15 0.00 0.00 0.00 179.25 180.14 1noi h THR 149 N -0.95 0.76 -0.34 0.00 2.02 -1.42 -0.91 112.91 112.08 1noi h THR 149 Ca -0.08 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.83 1noi h THR 149 Cb 0.66 -0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 1noi h THR 149 CO 0.13 0.14 0.00 0.18 0.37 0.00 0.00 175.52 176.34 1noi n LEU 150 N -4.68 2.52 -1.98 2.58 4.77 -0.89 -4.67 117.00 114.65 1noi n LEU 150 Ca 0.21 -1.27 -0.19 0.00 -0.03 0.00 0.00 56.01 54.74 1noi n LEU 150 Cb 0.53 -0.38 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 1noi n LEU 150 CO 0.25 0.47 -0.23 0.61 -1.33 0.00 0.00 177.39 177.16 1noi n GLY 151 N 0.79 0.21 3.81 -0.72 0.00 -0.34 0.08 105.19 109.03 1noi n GLY 151 Ca 0.13 -0.09 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 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 -5.17 3.57 -1.29 0.99 1.43 0.20 -4.81 118.68 113.60 1noi s LEU 152 Ca 0.00 1.76 -0.12 0.00 -1.03 0.00 0.00 54.13 54.75 1noi s LEU 152 Cb 0.00 -4.53 0.15 0.00 0.03 0.00 0.00 46.19 41.84 1noi s LEU 152 CO 0.00 -0.98 1.80 0.00 0.23 0.00 0.00 176.35 177.41 1noi n ALA 153 N -1.80 4.90 -2.66 4.21 0.00 -1.26 -4.63 120.51 119.27 1noi n ALA 153 Ca 0.08 -4.21 -0.28 0.00 0.00 0.00 0.00 53.44 49.03 1noi n ALA 153 Cb 0.53 -3.11 -0.08 0.00 0.00 0.00 0.00 19.45 16.79 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 1.29 3.21 -0.01 0.00 0.00 -1.26 -0.93 121.76 124.06 1noi s ALA 154 Ca 0.42 -1.28 0.03 0.00 0.00 0.00 0.00 51.96 51.13 1noi s ALA 154 Cb 0.07 -1.05 -0.00 0.00 0.00 0.00 0.00 23.12 22.13 1noi s ALA 154 CO -0.00 0.56 -0.08 0.71 0.00 0.00 0.00 175.76 176.95 1noi s TYR 155 N -1.55 0.77 -0.08 0.00 1.51 0.34 -4.07 117.35 114.27 1noi s TYR 155 Ca 0.26 -0.15 -0.11 0.00 -1.01 0.00 0.00 57.07 56.07 1noi s TYR 155 Cb -0.10 -0.51 -0.05 0.00 -0.11 0.00 0.00 41.96 41.19 1noi s TYR 155 CO 0.18 -0.03 0.26 0.20 -1.11 0.00 0.00 175.55 175.05 1noi s GLY 156 N -0.12 2.28 -0.02 0.71 0.00 -0.99 -1.63 107.32 107.55 1noi s GLY 156 Ca 0.02 -0.46 0.01 0.00 0.00 0.00 0.00 44.72 44.29 1noi s GLY 156 CO -0.00 -0.10 -0.04 -0.19 0.00 0.00 0.00 173.10 172.78 1noi s TYR 157 N -0.88 0.53 0.00 1.90 1.51 -1.00 -0.91 117.35 118.50 1noi s TYR 157 Ca 0.18 -0.11 0.00 0.00 -1.01 0.00 0.00 57.07 56.14 1noi s TYR 157 Cb -0.14 -0.46 0.00 0.00 -0.11 0.00 0.00 41.96 41.25 1noi s TYR 157 CO 0.07 -0.10 0.00 0.41 -1.11 0.00 0.00 175.55 174.82 1noi n GLY 158 N 3.63 2.08 3.76 0.71 0.00 -1.08 -2.82 105.19 111.47 1noi n GLY 158 Ca -0.21 -0.55 -0.25 0.00 0.00 0.00 0.00 46.02 45.01 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 -1.91 4.22 -0.56 -0.61 1.01 -1.26 -1.14 121.20 120.95 1noi s ILE 159 Ca 0.00 -1.32 -0.11 0.00 0.00 0.00 0.00 60.65 59.22 1noi s ILE 159 Cb 0.00 -3.19 0.14 0.00 0.01 0.00 0.00 42.46 39.42 1noi s ILE 159 CO 0.00 -0.20 0.46 -0.60 0.00 0.00 0.00 174.94 174.60 1noi s ARG 160 N -3.32 2.79 0.02 2.79 3.52 0.44 -4.65 118.95 120.54 1noi s ARG 160 Ca 0.31 -1.94 -0.30 0.00 -0.13 0.00 0.00 55.73 53.67 1noi s ARG 160 Cb -0.09 -4.08 -0.04 0.00 -1.56 0.00 0.00 34.95 29.18 1noi s ARG 160 CO 0.22 -1.24 1.01 0.71 -0.81 0.00 0.00 175.30 175.19 1noi s TYR 161 N 1.10 3.64 0.09 5.12 2.02 -1.25 -4.74 117.35 123.33 1noi s TYR 161 Ca 0.08 1.65 0.11 0.00 -0.37 0.00 0.00 57.07 58.53 1noi s TYR 161 Cb -0.24 -3.16 0.04 0.00 -0.40 0.00 0.00 41.96 38.20 1noi s TYR 161 CO -0.01 -0.18 1.42 0.93 -1.57 0.00 0.00 175.55 176.13 1noi h GLU 162 N 6.72 0.00 -0.28 -0.62 5.08 -0.93 -3.30 114.58 121.24 1noi h GLU 162 Ca -0.41 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 1noi h GLU 162 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1noi h GLU 162 CO 0.76 0.76 0.00 1.19 -1.00 0.00 0.00 179.01 180.72 1noi n PHE 163 N -3.42 0.37 0.00 4.33 3.72 0.93 -4.42 117.46 118.97 1noi n PHE 163 Ca 0.00 -0.49 0.00 0.00 -0.05 0.00 0.00 57.45 56.91 1noi n PHE 163 Cb 0.79 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 39.30 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 0.33 0.74 3.64 1.37 0.00 -1.22 -3.85 105.19 106.20 1noi n GLY 164 Ca 0.09 0.51 -0.08 0.00 0.00 0.00 0.00 46.02 46.54 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 0.00 0.69 -0.61 -1.16 -1.26 -1.09 121.20 117.78 1noi s ILE 165 Ca 0.00 0.00 -0.17 0.00 -0.51 0.00 0.00 60.65 59.97 1noi s ILE 165 Cb 0.00 -1.00 -0.13 0.00 0.61 0.00 0.00 42.46 41.94 1noi s ILE 165 CO 0.00 0.00 -0.93 2.22 -2.81 0.00 0.00 174.94 173.42 1noi n PHE 166 N 3.40 -1.71 -4.43 3.50 1.16 -1.25 -4.77 117.46 113.36 1noi n PHE 166 Ca -0.17 0.32 -0.34 0.00 -1.87 0.00 0.00 57.45 55.39 1noi n PHE 166 Cb 0.57 -0.97 -0.10 0.00 -1.61 0.00 0.00 39.48 37.37 1noi n PHE 166 CO 0.00 0.00 0.00 -0.80 -1.87 0.00 0.00 176.76 174.09 1noi s ASN 167 N -0.69 5.05 -0.21 5.98 0.02 -0.02 -4.85 114.94 120.22 1noi s ASN 167 Ca 0.26 0.07 -0.22 0.00 -1.02 0.00 0.00 52.86 51.96 1noi s ASN 167 Cb 0.02 -1.36 -0.02 0.00 0.02 0.00 0.00 41.25 39.90 1noi s ASN 167 CO 0.49 0.36 0.67 -1.58 0.02 0.00 0.00 177.10 177.06 1noi s GLN 168 N -0.98 4.20 -0.07 -0.60 0.74 -1.26 -0.87 119.66 120.83 1noi s GLN 168 Ca 0.14 0.68 0.04 0.00 0.05 0.00 0.00 55.36 56.27 1noi s GLN 168 Cb -0.11 -3.59 -0.02 0.00 1.10 0.00 0.00 33.01 30.39 1noi s GLN 168 CO 0.03 -0.30 -0.20 0.21 -0.55 0.00 0.00 175.29 174.49 1noi s LYS 169 N 2.11 2.68 -0.46 1.67 2.20 -0.11 -4.02 119.74 123.80 1noi s LYS 169 Ca 0.30 -0.81 -0.14 0.00 -0.36 0.00 0.00 55.97 54.96 1noi s LYS 169 Cb -0.16 -2.31 0.08 0.00 -1.51 0.00 0.00 37.83 33.93 1noi s LYS 169 CO 0.10 0.42 0.37 0.42 -0.36 0.00 0.00 175.35 176.31 1noi s ILE 170 N -0.24 5.05 -0.40 5.43 -1.09 -1.26 0.21 121.20 128.90 1noi s ILE 170 Ca -0.00 -1.14 -0.08 0.00 -2.23 0.00 0.00 60.65 57.20 1noi s ILE 170 Cb -0.13 -4.03 0.07 0.00 -1.58 0.00 0.00 42.46 36.79 1noi s ILE 170 CO 0.03 -0.57 0.22 0.00 -1.23 0.00 0.00 174.94 173.38 1noi n GLY 172 N 4.86 0.12 0.53 0.00 0.00 -1.26 -2.57 105.19 106.87 1noi n GLY 172 Ca -0.10 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.11 0.55 3.86 -0.02 0.00 -1.26 -5.05 105.19 102.16 1noi n GLY 173 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.24 3.43 0.08 1.61 0.52 -1.06 -3.41 118.94 117.88 1noi s TRP 174 Ca 0.00 0.26 -0.30 0.00 0.02 0.00 0.00 56.10 56.08 1noi s TRP 174 Cb 0.00 -1.77 -0.05 0.00 -1.15 0.00 0.00 33.47 30.50 1noi s TRP 174 CO 0.00 0.60 1.01 -1.14 0.02 0.00 0.00 176.95 177.44 1noi s GLN 175 N -2.07 4.61 -0.10 4.98 0.74 -1.26 0.17 119.66 126.72 1noi s GLN 175 Ca 0.28 1.51 0.02 0.00 0.05 0.00 0.00 55.36 57.22 1noi s GLN 175 Cb -0.12 -3.39 -0.01 0.00 1.10 0.00 0.00 33.01 30.59 1noi s GLN 175 CO 0.20 0.06 -0.17 -1.64 -0.55 0.00 0.00 175.29 173.19 1noi s MET 176 N 0.37 3.10 -0.39 1.67 -1.94 0.13 -4.89 119.30 117.36 1noi s MET 176 Ca 0.50 -0.75 -0.10 0.00 -1.71 0.00 0.00 55.69 53.63 1noi s MET 176 Cb -0.24 -2.47 0.05 0.00 2.01 0.00 0.00 34.83 34.18 1noi s MET 176 CO 0.30 0.28 0.22 -1.83 -0.01 0.00 0.00 175.02 173.98 1noi s GLU 177 N 0.14 2.70 0.47 2.03 1.03 -1.26 -0.93 118.70 122.87 1noi s GLU 177 Ca -0.09 -1.27 -0.03 0.00 0.03 0.00 0.00 54.97 53.61 1noi s GLU 177 Cb -0.15 -3.72 -0.03 0.00 -0.80 0.00 0.00 34.13 29.43 1noi s GLU 177 CO 0.06 -0.81 0.74 -1.21 -1.33 0.00 0.00 175.26 172.70 1noi s GLU 178 N 1.47 3.39 0.22 -4.83 2.02 -0.04 -4.92 118.70 116.00 1noi s GLU 178 Ca 0.02 -0.02 -0.30 0.00 0.02 0.00 0.00 54.97 54.69 1noi s GLU 178 Cb -0.21 -2.44 -0.08 0.00 0.10 0.00 0.00 34.13 31.50 1noi s GLU 178 CO 0.04 -0.21 1.09 0.00 0.02 0.00 0.00 175.26 176.20 1noi s ALA 179 N -2.67 3.38 -1.06 5.21 0.00 -1.26 -0.84 121.76 124.52 1noi s ALA 179 Ca 0.47 0.83 -0.06 0.00 0.00 0.00 0.00 51.96 53.19 1noi s ALA 179 Cb -0.10 -3.33 0.28 0.00 0.00 0.00 0.00 23.12 19.96 1noi s ALA 179 CO 0.42 -0.16 1.14 -3.47 0.00 0.00 0.00 175.76 173.70 1noi n ASP 180 N 1.90 5.47 -4.37 0.00 2.03 -1.26 -4.65 116.55 115.66 1noi n ASP 180 Ca 0.01 -3.16 -0.45 0.00 0.52 0.00 0.00 54.79 51.71 1noi n ASP 180 Cb 0.46 -1.27 0.00 0.00 -0.72 0.00 0.00 41.12 39.58 1noi n ASP 180 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1noi n ASP 181 N 2.21 5.45 0.27 1.67 5.75 -1.26 -4.44 116.55 126.20 1noi n ASP 181 Ca 0.24 -3.02 0.17 0.00 -0.01 0.00 0.00 54.79 52.17 1noi n ASP 181 Cb 0.37 -1.43 0.92 0.00 -1.03 0.00 0.00 41.12 39.95 1noi n ASP 181 CO 0.00 0.00 0.00 4.11 -0.11 0.00 0.00 177.20 181.20 1noi h TRP 182 N 6.76 0.00 -0.45 2.11 5.08 -1.92 0.13 115.95 127.65 1noi h TRP 182 Ca 0.22 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.19 1noi h TRP 182 Cb 0.87 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.03 1noi h TRP 182 CO 0.84 0.00 0.00 1.28 -1.28 0.00 0.00 178.44 179.28 1noi n LEU 183 N -3.71 4.48 -0.29 0.11 4.77 -1.26 -4.69 117.00 116.40 1noi n LEU 183 Ca -0.01 -2.27 0.01 0.00 -0.03 0.00 0.00 56.01 53.71 1noi n LEU 183 Cb 0.18 -0.62 0.14 0.00 -2.33 0.00 0.00 43.42 40.79 1noi n LEU 183 CO 0.26 0.56 1.16 -0.09 -1.33 0.00 0.00 177.39 177.95 1noi h ARG 184 N 3.09 0.84 -0.09 3.23 2.43 -1.13 -2.58 114.38 120.16 1noi h ARG 184 Ca 0.00 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1noi h ARG 184 Cb 1.55 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.91 1noi h ARG 184 CO 0.34 0.55 0.00 0.66 -1.51 0.00 0.00 179.97 180.01 1noi n TYR 185 N -4.69 0.10 0.00 2.20 4.01 -1.26 -5.10 117.16 112.42 1noi n TYR 185 Ca 0.12 -0.07 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 1noi n TYR 185 Cb 0.20 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.23 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 0.94 0.85 2.78 2.72 0.00 -0.97 -4.96 105.19 106.54 1noi n GLY 186 Ca 0.11 -1.90 -0.28 0.00 0.00 0.00 0.00 46.02 43.95 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 -0.86 3.03 0.47 1.61 2.47 -1.26 -4.77 114.94 115.63 1noi s ASN 187 Ca 0.00 -0.86 0.32 0.00 0.42 0.00 0.00 52.86 52.74 1noi s ASN 187 Cb 0.00 -0.70 1.64 0.00 -1.45 0.00 0.00 41.25 40.74 1noi s ASN 187 CO 0.00 -0.29 1.97 1.55 -3.72 0.00 0.00 177.10 176.62 1noi h PRO 188 N 8.19 0.00 0.00 0.43 0.13 -1.96 -3.23 132.00 135.56 1noi h PRO 188 Ca -0.17 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.73 1noi h PRO 188 Cb 1.11 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.21 1noi h PRO 188 CO 0.35 0.00 -1.22 -1.49 -0.23 0.00 0.00 178.00 175.40 1noi h TRP 189 N 0.00 0.00 -4.01 1.56 4.06 -1.95 -3.47 115.95 112.14 1noi h TRP 189 Ca 0.00 0.00 -0.49 0.00 2.06 0.00 0.00 58.89 60.46 1noi h TRP 189 Cb 0.11 0.00 0.03 0.00 -1.00 0.00 0.00 29.16 28.30 1noi h TRP 189 CO 0.00 0.96 0.28 -1.83 -3.56 0.00 0.00 178.44 174.28 1noi s GLU 190 N -2.69 3.71 -0.16 0.49 -1.05 -1.22 -4.42 118.70 113.36 1noi s GLU 190 Ca -0.01 0.62 -0.01 0.00 -0.15 0.00 0.00 54.97 55.43 1noi s GLU 190 Cb 0.09 -2.22 0.04 0.00 -0.44 0.00 0.00 34.13 31.60 1noi s GLU 190 CO 0.82 -0.30 -0.04 0.21 0.95 0.00 0.00 175.26 176.89 1noi s LYS 191 N -4.52 1.30 0.36 -4.83 2.36 0.14 -4.90 119.74 109.65 1noi s LYS 191 Ca 0.54 -0.46 -0.27 0.00 -2.55 0.00 0.00 55.97 53.22 1noi s LYS 191 Cb -0.10 -1.94 -0.10 0.00 -1.05 0.00 0.00 37.83 34.64 1noi s LYS 191 CO 0.42 -0.44 1.30 0.00 1.55 0.00 0.00 175.35 178.17 1noi s ALA 192 N 1.68 3.39 -0.64 3.13 0.00 -1.26 -0.57 121.76 127.48 1noi s ALA 192 Ca 0.01 1.24 0.05 0.00 0.00 0.00 0.00 51.96 53.27 1noi s ALA 192 Cb -0.15 -3.48 0.27 0.00 0.00 0.00 0.00 23.12 19.76 1noi s ALA 192 CO -0.07 -0.71 0.82 0.54 0.00 0.00 0.00 175.76 176.33 1noi n ARG 193 N 0.50 2.77 -0.29 0.00 5.12 0.10 -4.89 116.66 119.97 1noi n ARG 193 Ca 0.02 -4.71 0.02 0.00 -1.93 0.00 0.00 57.85 51.24 1noi n ARG 193 Cb 0.43 -2.27 0.10 0.00 -1.16 0.00 0.00 32.46 29.56 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 3.97 -0.01 -1.21 5.56 0.11 -1.94 -2.06 132.00 136.42 1noi h PRO 194 Ca 0.19 0.00 0.45 0.00 0.11 0.00 0.00 66.00 66.75 1noi h PRO 194 Cb 0.62 0.00 -0.16 0.00 0.11 0.00 0.00 31.00 31.58 1noi h PRO 194 CO 0.85 -0.01 0.73 0.39 -0.21 0.00 0.00 178.00 179.76 1noi n GLU 195 N -5.53 -0.05 -0.05 1.05 4.71 -1.26 -1.94 120.64 117.57 1noi n GLU 195 Ca 0.12 1.31 0.12 0.00 -0.01 0.00 0.00 57.16 58.69 1noi n GLU 195 Cb 0.42 -2.47 0.35 0.00 -1.01 0.00 0.00 31.44 28.73 1noi n GLU 195 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 1noi n PHE 196 N -4.95 0.13 -1.58 -0.32 3.72 -0.77 -5.01 117.46 108.68 1noi n PHE 196 Ca 0.39 -0.07 -0.55 0.00 -0.05 0.00 0.00 57.45 57.18 1noi n PHE 196 Cb 1.44 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 39.91 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 0.64 0.02 -4.38 4.37 -1.04 -0.82 -4.75 114.28 108.33 1noi n THR 197 Ca 0.17 -0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.90 1noi n THR 197 Cb 0.43 -0.60 -0.13 0.00 -1.82 0.00 0.00 70.33 68.22 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 0.61 2.34 0.15 -4.42 1.43 -0.06 -4.95 118.68 113.78 1noi s LEU 198 Ca 0.88 -0.76 -0.10 0.00 -1.03 0.00 0.00 54.13 53.11 1noi s LEU 198 Cb -1.07 -1.14 -0.06 0.00 0.03 0.00 0.00 46.19 43.94 1noi s LEU 198 CO 0.52 0.14 0.48 -2.16 0.23 0.00 0.00 176.35 175.56 1noi s PRO 199 N -2.16 3.82 -0.03 1.29 0.04 -1.26 -0.12 135.00 136.58 1noi s PRO 199 Ca 0.14 0.26 0.06 0.00 0.04 0.00 0.00 61.00 61.50 1noi s PRO 199 Cb -0.10 -2.86 -0.02 0.00 0.04 0.00 0.00 34.50 31.56 1noi s PRO 199 CO 0.06 0.46 -0.20 0.08 0.04 0.00 0.00 177.00 177.44 1noi s VAL 200 N -1.57 2.56 0.04 -0.36 1.01 0.28 -4.88 120.40 117.48 1noi s VAL 200 Ca 0.39 -0.95 0.05 0.00 0.00 0.00 0.00 61.98 61.47 1noi s VAL 200 Cb -0.13 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 1noi s VAL 200 CO 0.20 0.56 -0.09 -1.00 0.00 0.00 0.00 175.10 174.77 1noi s HIS 201 N -0.69 2.79 0.03 5.22 3.76 -1.26 -1.16 115.29 123.97 1noi s HIS 201 Ca 0.11 -0.11 -0.04 0.00 -0.15 0.00 0.00 55.06 54.87 1noi s HIS 201 Cb -0.10 -1.53 -0.01 0.00 1.11 0.00 0.00 32.58 32.04 1noi s HIS 201 CO 0.00 0.37 0.06 -0.06 -0.85 0.00 0.00 174.74 174.26 1noi s PHE 202 N -1.05 0.22 0.00 1.40 0.08 -0.10 -4.98 117.98 113.55 1noi s PHE 202 Ca 0.18 -0.52 0.00 0.00 0.12 0.00 0.00 56.93 56.71 1noi s PHE 202 Cb -0.11 -0.17 0.00 0.00 -0.57 0.00 0.00 43.02 42.17 1noi s PHE 202 CO 0.09 -0.32 0.00 0.66 -0.10 0.00 0.00 175.22 175.55 1noi n TYR 203 N 0.94 0.00 -3.72 0.36 4.01 -0.12 0.28 117.16 118.91 1noi n TYR 203 Ca -0.20 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.54 1noi n TYR 203 Cb 0.58 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.61 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 -1.35 3.51 2.72 0.00 -1.19 -4.59 105.19 104.30 1noi n GLY 204 Ca 0.00 -1.33 -0.09 0.00 0.00 0.00 0.00 46.02 44.61 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 0.95 -0.22 1.61 1.70 -0.28 -4.93 118.95 117.77 1noi s ARG 205 Ca 0.00 -0.37 -0.07 0.00 -0.47 0.00 0.00 55.73 54.82 1noi s ARG 205 Cb 0.00 0.42 -0.03 0.00 -0.57 0.00 0.00 34.95 34.77 1noi s ARG 205 CO 0.00 -0.42 0.06 0.08 -1.08 0.00 0.00 175.30 173.95 1noi s VAL 206 N -3.26 4.47 -0.37 4.99 1.01 -1.26 -1.06 120.40 124.93 1noi s VAL 206 Ca 0.05 -0.13 -0.11 0.00 0.00 0.00 0.00 61.98 61.78 1noi s VAL 206 Cb -0.01 -3.05 0.02 0.00 0.00 0.00 0.00 36.38 33.34 1noi s VAL 206 CO -0.09 0.39 0.22 -0.70 0.00 0.00 0.00 175.10 174.92 1noi s GLU 207 N 1.06 2.94 -1.08 2.72 2.12 -0.30 -4.94 118.70 121.22 1noi s GLU 207 Ca 0.04 -1.01 -0.21 0.00 0.36 0.00 0.00 54.97 54.16 1noi s GLU 207 Cb -0.14 -3.75 0.08 0.00 0.26 0.00 0.00 34.13 30.57 1noi s GLU 207 CO 0.03 -0.66 1.46 -1.01 -0.54 0.00 0.00 175.26 174.54 1noi s HIS 208 N 1.59 2.75 0.00 5.30 3.76 -1.26 -1.10 115.29 126.32 1noi s HIS 208 Ca 0.03 -1.19 0.00 0.00 -0.15 0.00 0.00 55.06 53.75 1noi s HIS 208 Cb -0.19 -4.62 0.00 0.00 1.11 0.00 0.00 32.58 28.88 1noi s HIS 208 CO 0.07 -1.80 0.00 0.25 -0.85 0.00 0.00 174.74 172.41 1noi n THR 209 N 6.41 0.00 0.00 1.30 -2.24 -0.79 -4.86 114.28 114.10 1noi n THR 209 Ca 0.35 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.13 1noi n THR 209 Cb 0.49 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 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 0.16 3.42 3.41 -1.26 -4.05 113.62 115.30 1noi n SER 210 Ca 0.00 0.25 -0.14 0.00 -0.26 0.00 0.00 58.87 58.71 1noi n SER 210 Cb 0.00 -0.05 -0.08 0.00 -0.26 0.00 0.00 64.21 63.83 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 -0.33 0.00 4.33 5.75 -2.01 -3.48 115.11 119.36 1noi h GLN 211 Ca 0.00 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 1noi h GLN 211 Cb 0.00 0.08 0.00 0.00 1.07 0.00 0.00 27.48 28.63 1noi h GLN 211 CO 0.00 -0.19 0.00 0.41 -2.65 0.00 0.00 178.83 176.40 1noi n GLY 212 N -1.10 -0.59 3.67 2.39 0.00 -1.26 -5.16 105.19 103.15 1noi n GLY 212 Ca -0.10 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 1noi n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1noi n ALA 213 N 0.00 0.97 -3.84 4.61 0.00 -1.26 -1.88 120.51 119.12 1noi n ALA 213 Ca 0.00 0.29 -0.25 0.00 0.00 0.00 0.00 53.44 53.48 1noi n ALA 213 Cb 0.00 -2.21 -0.17 0.00 0.00 0.00 0.00 19.45 17.07 1noi n ALA 213 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1noi s LYS 214 N -2.05 1.06 -0.50 0.00 -0.14 -0.26 -4.86 119.74 113.00 1noi s LYS 214 Ca 0.60 -0.09 -0.24 0.00 -1.36 0.00 0.00 55.97 54.88 1noi s LYS 214 Cb -0.54 -1.31 0.03 0.00 -1.68 0.00 0.00 37.83 34.33 1noi s LYS 214 CO 0.59 -0.30 0.87 -0.46 -0.76 0.00 0.00 175.35 175.30 1noi s TRP 215 N 1.84 2.90 0.34 3.18 -0.00 -1.26 -1.15 118.94 124.78 1noi s TRP 215 Ca 0.05 0.11 0.09 0.00 -0.00 0.00 0.00 56.10 56.34 1noi s TRP 215 Cb -0.13 -3.90 -0.05 0.00 -0.00 0.00 0.00 33.47 29.39 1noi s TRP 215 CO -0.07 -1.17 0.05 0.14 -0.00 0.00 0.00 176.95 175.91 1noi s VAL 216 N 3.64 2.75 -1.24 5.86 -7.23 -0.22 -4.83 120.40 119.14 1noi s VAL 216 Ca 0.31 -1.89 -0.06 0.00 -1.81 0.00 0.00 61.98 58.53 1noi s VAL 216 Cb -0.12 -2.85 -0.01 0.00 0.56 0.00 0.00 36.38 33.96 1noi s VAL 216 CO 0.22 -0.20 0.73 0.47 -0.31 0.00 0.00 175.10 176.01 1noi n ASP 217 N -1.01 -2.86 -4.81 4.85 8.00 -1.26 -1.13 116.55 118.33 1noi n ASP 217 Ca -0.04 -0.87 -0.27 0.00 0.71 0.00 0.00 54.79 54.32 1noi n ASP 217 Cb 0.62 -3.98 -0.05 0.00 -0.02 0.00 0.00 41.12 37.69 1noi n ASP 217 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1noi s THR 218 N -3.60 4.62 0.39 -3.53 -4.23 -1.26 -3.16 115.64 104.87 1noi s THR 218 Ca 0.18 -0.95 -0.18 0.00 -1.18 0.00 0.00 61.69 59.56 1noi s THR 218 Cb -0.05 -3.33 -0.10 0.00 1.34 0.00 0.00 72.50 70.36 1noi s THR 218 CO 0.82 -0.05 0.86 -1.58 -0.54 0.00 0.00 174.62 174.13 1noi s GLN 219 N -2.95 4.11 0.09 3.99 0.74 0.14 -4.89 119.66 120.90 1noi s GLN 219 Ca 0.31 0.92 0.09 0.00 0.05 0.00 0.00 55.36 56.72 1noi s GLN 219 Cb -0.11 -2.28 -0.04 0.00 1.10 0.00 0.00 33.01 31.68 1noi s GLN 219 CO 0.24 0.03 -0.20 0.08 -0.55 0.00 0.00 175.29 174.89 1noi s VAL 220 N -2.13 2.69 0.01 1.34 1.01 -1.26 -0.93 120.40 121.14 1noi s VAL 220 Ca 0.58 -1.43 0.02 0.00 0.00 0.00 0.00 61.98 61.16 1noi s VAL 220 Cb -0.10 -2.18 -0.01 0.00 0.00 0.00 0.00 36.38 34.09 1noi s VAL 220 CO 0.16 0.20 -0.07 -0.69 0.00 0.00 0.00 175.10 174.70 1noi s VAL 221 N -1.03 0.52 0.01 2.92 1.01 -0.31 -4.76 120.40 118.76 1noi s VAL 221 Ca 0.16 -0.51 -0.02 0.00 0.00 0.00 0.00 61.98 61.61 1noi s VAL 221 Cb -0.10 -0.48 -0.04 0.00 0.00 0.00 0.00 36.38 35.75 1noi s VAL 221 CO 0.07 -0.01 0.19 -0.76 0.00 0.00 0.00 175.10 174.59 1noi s LEU 222 N -0.57 4.36 -0.31 3.92 1.43 0.32 -0.56 118.68 127.27 1noi s LEU 222 Ca -0.01 0.32 -0.02 0.00 -1.03 0.00 0.00 54.13 53.39 1noi s LEU 222 Cb -0.05 -2.70 0.05 0.00 0.03 0.00 0.00 46.19 43.53 1noi s LEU 222 CO 0.00 0.24 0.02 0.00 0.23 0.00 0.00 176.35 176.84 1noi s ALA 223 N -1.37 2.85 -0.22 4.21 0.00 0.83 -0.76 121.76 127.29 1noi s ALA 223 Ca 0.29 -1.80 -0.12 0.00 0.00 0.00 0.00 51.96 50.33 1noi s ALA 223 Cb -0.13 -1.99 -0.05 0.00 0.00 0.00 0.00 23.12 20.96 1noi s ALA 223 CO 0.21 -1.31 0.21 1.41 0.00 0.00 0.00 175.76 176.29 1noi s MET 224 N 1.26 4.12 0.19 0.00 1.75 -0.57 -0.89 119.30 125.16 1noi s MET 224 Ca -0.04 -0.14 -0.24 0.00 -1.25 0.00 0.00 55.69 54.01 1noi s MET 224 Cb -0.20 -3.52 -0.08 0.00 2.84 0.00 0.00 34.83 33.87 1noi s MET 224 CO -0.01 0.08 0.78 -1.25 -0.65 0.00 0.00 175.02 173.97 1noi s PRO 225 N 0.99 4.51 0.04 4.11 0.04 -1.26 -1.31 135.00 142.12 1noi s PRO 225 Ca 0.10 1.12 0.07 0.00 0.04 0.00 0.00 61.00 62.33 1noi s PRO 225 Cb -0.13 -3.13 -0.03 0.00 0.04 0.00 0.00 34.50 31.24 1noi s PRO 225 CO 0.04 0.51 -0.17 0.71 0.04 0.00 0.00 177.00 178.13 1noi s TYR 226 N -1.28 2.58 0.03 0.56 1.51 0.52 0.01 117.35 121.28 1noi s TYR 226 Ca 0.39 -0.24 0.07 0.00 -1.01 0.00 0.00 57.07 56.27 1noi s TYR 226 Cb -0.21 -1.46 -0.03 0.00 -0.11 0.00 0.00 41.96 40.14 1noi s TYR 226 CO 0.25 0.27 -0.18 -0.51 -1.11 0.00 0.00 175.55 174.27 1noi s ASP 227 N -1.49 3.82 -0.04 2.29 1.01 0.26 -1.67 116.67 120.85 1noi s ASP 227 Ca 0.15 -0.39 0.05 0.00 0.71 0.00 0.00 52.55 53.07 1noi s ASP 227 Cb -0.11 -0.64 -0.01 0.00 1.01 0.00 0.00 42.92 43.18 1noi s ASP 227 CO 0.06 0.27 -0.19 -0.89 0.21 0.00 0.00 175.17 174.62 1noi s THR 228 N -0.90 1.57 0.25 -1.27 2.01 -0.14 0.25 115.64 117.42 1noi s THR 228 Ca 0.14 -0.81 -0.26 0.00 0.31 0.00 0.00 61.69 61.08 1noi s THR 228 Cb -0.10 -1.34 -0.09 0.00 0.01 0.00 0.00 72.50 70.98 1noi s THR 228 CO 0.05 0.45 0.87 -2.16 -0.69 0.00 0.00 174.62 173.13 1noi s PRO 229 N -0.10 4.58 -0.22 4.92 0.05 -1.26 -0.49 135.00 142.48 1noi s PRO 229 Ca -0.01 1.24 0.01 0.00 0.05 0.00 0.00 61.00 62.29 1noi s PRO 229 Cb -0.11 -3.03 0.05 0.00 0.05 0.00 0.00 34.50 31.46 1noi s PRO 229 CO 0.02 0.42 -0.10 0.14 0.05 0.00 0.00 177.00 177.53 1noi s VAL 230 N -1.40 1.73 0.09 -0.36 -7.23 0.83 -4.85 120.40 109.22 1noi s VAL 230 Ca 0.44 -1.17 -0.30 0.00 -1.81 0.00 0.00 61.98 59.14 1noi s VAL 230 Cb -0.21 -1.84 -0.06 0.00 0.56 0.00 0.00 36.38 34.83 1noi s VAL 230 CO 0.26 0.09 1.07 -2.16 -0.31 0.00 0.00 175.10 174.04 1noi s PRO 231 N 1.34 4.57 0.69 4.82 0.04 -1.26 -0.06 135.00 145.13 1noi s PRO 231 Ca -0.03 1.60 -0.11 0.00 0.04 0.00 0.00 61.00 62.49 1noi s PRO 231 Cb -0.17 -3.36 0.00 0.00 0.04 0.00 0.00 34.50 31.01 1noi s PRO 231 CO -0.07 -0.01 1.07 0.20 0.04 0.00 0.00 177.00 178.22 1noi s GLY 232 N 0.49 1.65 -0.52 0.56 0.00 0.16 -4.73 107.32 104.93 1noi s GLY 232 Ca 0.52 -0.14 -0.27 0.00 0.00 0.00 0.00 44.72 44.83 1noi s GLY 232 CO 0.31 0.19 1.74 -0.47 0.00 0.00 0.00 173.10 174.87 1noi s TYR 233 N -3.20 1.85 -1.01 1.90 5.04 -1.26 -4.02 117.35 116.65 1noi s TYR 233 Ca 0.57 0.68 0.00 0.00 -2.44 0.00 0.00 57.07 55.88 1noi s TYR 233 Cb -0.12 -4.17 0.00 0.00 0.35 0.00 0.00 41.96 38.02 1noi s TYR 233 CO 0.54 -2.41 0.00 0.54 -1.34 0.00 0.00 175.55 172.88 1noi n ARG 234 N 8.83 -1.25 -0.01 4.97 3.00 -0.40 -4.77 116.66 127.03 1noi n ARG 234 Ca 0.19 0.57 0.09 0.00 -0.01 0.00 0.00 57.85 58.70 1noi n ARG 234 Cb 0.50 -4.72 0.08 0.00 0.00 0.00 0.00 32.46 28.31 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 -0.08 2.51 -0.67 0.55 2.04 -1.26 -4.94 115.26 113.41 1noi n ASN 235 Ca -0.10 -1.75 -0.09 0.00 -0.44 0.00 0.00 54.58 52.21 1noi n ASN 235 Cb 0.32 -0.01 -0.04 0.00 -2.53 0.00 0.00 39.78 37.53 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 1.01 -4.82 -4.74 0.53 3.02 -1.26 -0.42 115.26 108.56 1noi n ASN 236 Ca 0.11 0.22 -0.36 0.00 -0.03 0.00 0.00 54.58 54.51 1noi n ASN 236 Cb 0.45 -3.09 -0.07 0.00 -0.61 0.00 0.00 39.78 36.45 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 -2.07 5.33 -0.21 2.41 -7.23 -1.26 -4.79 120.40 112.57 1noi s VAL 237 Ca 0.00 0.47 -0.01 0.00 -1.81 0.00 0.00 61.98 60.63 1noi s VAL 237 Cb 0.00 -3.59 0.02 0.00 0.56 0.00 0.00 36.38 33.37 1noi s VAL 237 CO 0.00 0.42 -0.12 -0.69 -0.31 0.00 0.00 175.10 174.40 1noi s VAL 238 N 0.29 2.62 0.65 1.32 1.01 -1.26 -0.67 120.40 124.37 1noi s VAL 238 Ca 0.15 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.30 1noi s VAL 238 Cb -0.13 -2.21 0.11 0.00 0.00 0.00 0.00 36.38 34.15 1noi s VAL 238 CO 0.03 0.40 0.89 0.20 0.00 0.00 0.00 175.10 176.63 1noi s ASN 239 N 1.34 4.71 -0.12 3.32 0.01 0.91 -4.66 114.94 120.45 1noi s ASN 239 Ca 0.04 -0.55 -0.01 0.00 -0.71 0.00 0.00 52.86 51.63 1noi s ASN 239 Cb -0.14 0.07 -0.02 0.00 0.41 0.00 0.00 41.25 41.56 1noi s ASN 239 CO -0.08 -1.60 -0.09 -0.89 -1.51 0.00 0.00 177.10 172.92 1noi s THR 240 N -2.92 3.41 -0.29 1.60 2.01 -1.26 -0.12 115.64 118.08 1noi s THR 240 Ca 0.64 -0.55 -0.09 0.00 0.31 0.00 0.00 61.69 62.00 1noi s THR 240 Cb -0.06 -2.44 -0.02 0.00 0.01 0.00 0.00 72.50 69.99 1noi s THR 240 CO 0.42 0.53 0.14 -0.32 -0.69 0.00 0.00 174.62 174.70 1noi s MET 241 N 0.07 3.58 -0.27 4.92 1.75 0.35 -2.35 119.30 127.35 1noi s MET 241 Ca -0.03 -0.55 -0.06 0.00 -1.25 0.00 0.00 55.69 53.79 1noi s MET 241 Cb -0.14 -3.52 -0.00 0.00 2.84 0.00 0.00 34.83 34.01 1noi s MET 241 CO 0.04 -0.29 0.06 0.50 -0.65 0.00 0.00 175.02 174.67 1noi s ARG 242 N 1.65 3.23 -0.10 4.11 6.06 -0.09 -0.97 118.95 132.85 1noi s ARG 242 Ca 0.06 -0.75 0.03 0.00 -2.50 0.00 0.00 55.73 52.56 1noi s ARG 242 Cb -0.16 -3.30 -0.01 0.00 0.06 0.00 0.00 34.95 31.54 1noi s ARG 242 CO 0.07 -0.36 -0.20 -0.51 -2.50 0.00 0.00 175.30 171.79 1noi s LEU 243 N 1.51 2.31 0.12 -0.88 1.02 -0.67 -2.63 118.68 119.46 1noi s LEU 243 Ca 0.04 -0.47 -0.22 0.00 0.02 0.00 0.00 54.13 53.50 1noi s LEU 243 Cb -0.16 -1.48 -0.07 0.00 0.02 0.00 0.00 46.19 44.50 1noi s LEU 243 CO 0.02 0.17 0.66 0.26 0.02 0.00 0.00 176.35 177.48 1noi s TRP 244 N 0.27 3.83 0.02 0.29 0.52 -0.29 -0.36 118.94 123.23 1noi s TRP 244 Ca -0.14 1.42 0.09 0.00 0.02 0.00 0.00 56.10 57.48 1noi s TRP 244 Cb -0.17 -2.61 -0.03 0.00 -1.15 0.00 0.00 33.47 29.52 1noi s TRP 244 CO 0.07 0.54 -0.26 0.45 0.02 0.00 0.00 176.95 177.77 1noi s SER 245 N -1.18 3.17 -0.14 2.95 0.15 -0.43 -0.42 113.70 117.81 1noi s SER 245 Ca 0.33 -0.54 -0.14 0.00 0.70 0.00 0.00 55.95 56.30 1noi s SER 245 Cb -0.21 -0.33 -0.05 0.00 -1.71 0.00 0.00 66.02 63.73 1noi s SER 245 CO 0.22 0.28 0.32 0.00 1.20 0.00 0.00 173.24 175.25 1noi s ALA 246 N -0.75 3.60 -0.06 5.45 0.00 -1.26 -1.51 121.76 127.24 1noi s ALA 246 Ca 0.11 -0.41 0.01 0.00 0.00 0.00 0.00 51.96 51.67 1noi s ALA 246 Cb -0.10 -2.40 0.02 0.00 0.00 0.00 0.00 23.12 20.64 1noi s ALA 246 CO 0.01 0.14 -0.07 0.21 0.00 0.00 0.00 175.76 176.06 1noi s LYS 247 N 0.26 1.10 0.21 0.00 2.20 0.06 -4.61 119.74 118.97 1noi s LYS 247 Ca 0.18 -0.19 -0.30 0.00 -0.36 0.00 0.00 55.97 55.30 1noi s LYS 247 Cb -0.13 -1.05 -0.08 0.00 -1.51 0.00 0.00 37.83 35.05 1noi s LYS 247 CO 0.05 -0.07 1.17 0.00 -0.36 0.00 0.00 175.35 176.14 1noi s ALA 248 N 0.95 3.42 0.16 3.13 0.00 -1.26 -0.52 121.76 127.64 1noi s ALA 248 Ca -0.10 0.94 -0.31 0.00 0.00 0.00 0.00 51.96 52.48 1noi s ALA 248 Cb -0.15 -3.39 -0.11 0.00 0.00 0.00 0.00 23.12 19.48 1noi s ALA 248 CO 0.00 -0.31 1.71 -2.14 0.00 0.00 0.00 175.76 175.03 1noi s PRO 249 N -0.63 4.16 -0.43 0.00 0.02 -1.26 -4.89 135.00 131.96 1noi s PRO 249 Ca 0.50 2.52 0.10 0.00 0.02 0.00 0.00 61.00 64.14 1noi s PRO 249 Cb -0.32 -3.32 0.38 0.00 0.02 0.00 0.00 34.50 31.26 1noi s PRO 249 CO 0.38 -0.75 0.88 0.09 -0.33 0.00 0.00 177.00 177.28 1noi n ASN 250 N 4.71 2.47 0.11 2.53 3.02 -1.26 -4.46 115.26 122.37 1noi n ASN 250 Ca 0.16 -3.24 0.00 0.00 -0.03 0.00 0.00 54.58 51.48 1noi n ASN 250 Cb 0.37 -0.57 -0.02 0.00 -0.61 0.00 0.00 39.78 38.96 1noi n ASN 250 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 1noi h ASP 251 N 2.94 0.00 -2.97 6.41 3.04 -1.97 -3.44 116.42 120.43 1noi h ASP 251 Ca 0.10 0.00 -0.56 0.00 -3.24 0.00 0.00 57.03 53.33 1noi h ASP 251 Cb 0.87 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 39.13 1noi h ASP 251 CO 0.63 0.60 0.82 0.72 -2.04 0.00 0.00 179.24 179.97 1noi s PHE 252 N -2.91 2.96 0.00 4.15 -0.12 -1.26 -3.79 117.98 117.01 1noi s PHE 252 Ca 0.02 1.05 0.00 0.00 -0.05 0.00 0.00 56.93 57.95 1noi s PHE 252 Cb 0.08 -3.50 0.00 0.00 -0.63 0.00 0.00 43.02 38.97 1noi s PHE 252 CO 0.77 -1.67 0.00 -1.71 -0.05 0.00 0.00 175.22 172.55 1noi n ASN 253 N 5.92 0.00 -2.70 1.98 5.15 -1.26 -4.91 115.26 119.44 1noi n ASN 253 Ca 0.13 0.00 -0.07 0.00 -0.60 0.00 0.00 54.58 54.04 1noi n ASN 253 Cb 0.45 0.13 0.10 0.00 -0.53 0.00 0.00 39.78 39.93 1noi n ASN 253 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1noi n LEU 254 N -1.65 -1.88 -4.19 1.20 -0.00 -1.25 -5.07 117.00 104.17 1noi n LEU 254 Ca 0.00 -3.28 -0.24 0.00 -0.00 0.00 0.00 56.01 52.49 1noi n LEU 254 Cb 0.00 0.27 -0.15 0.00 -0.00 0.00 0.00 43.42 43.55 1noi n LEU 254 CO 0.00 1.84 -0.50 -0.75 -0.00 0.00 0.00 177.39 177.98 1noi s LYS 255 N 0.19 1.33 0.00 1.47 2.36 -1.25 -4.61 119.74 119.23 1noi s LYS 255 Ca 0.20 -0.73 0.00 0.00 -2.55 0.00 0.00 55.97 52.89 1noi s LYS 255 Cb 0.34 -1.34 0.00 0.00 -1.05 0.00 0.00 37.83 35.78 1noi s LYS 255 CO -0.08 0.36 0.00 -3.47 1.55 0.00 0.00 175.35 173.71 1noi n ASP 256 N 2.31 0.00 0.00 1.43 2.03 -1.26 -4.71 116.55 116.35 1noi n ASP 256 Ca -0.16 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.15 1noi n ASP 256 Cb 0.54 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.94 1noi n ASP 256 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 1noi n PHE 257 N 0.00 0.00 0.00 -0.67 -0.00 -1.26 -5.02 117.46 110.51 1noi n PHE 257 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1noi n PHE 257 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.48 1noi n PHE 257 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.76 177.03 1noi n ASN 258 N 0.00 0.00 -4.61 -2.13 6.94 -1.26 -5.14 115.26 109.06 1noi n ASN 258 Ca 0.00 0.00 -0.49 0.00 -0.02 0.00 0.00 54.58 54.07 1noi n ASN 258 Cb 0.00 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.37 1noi n ASN 258 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 177.26 177.56 1noi n VAL 259 N 0.00 0.47 0.00 3.53 0.24 -1.26 -4.54 118.33 116.76 1noi n VAL 259 Ca 0.00 -0.12 0.00 0.00 -2.04 0.00 0.00 64.34 62.18 1noi n VAL 259 Cb 0.00 -1.03 0.00 0.00 -1.47 0.00 0.00 33.84 31.34 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 2.41 -0.71 0.00 7.63 0.00 -1.26 -5.09 105.19 108.17 1noi n GLY 260 Ca 0.16 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.45 1noi n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1noi n GLY 261 N 0.00 0.00 3.56 -0.02 0.00 -1.26 -4.61 105.19 102.86 1noi n GLY 261 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 1noi n GLY 261 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1noi s TYR 262 N 0.00 -0.21 -1.18 1.61 5.04 -1.26 -5.06 117.35 116.29 1noi s TYR 262 Ca 0.00 0.12 -0.16 0.00 -2.44 0.00 0.00 57.07 54.60 1noi s TYR 262 Cb 0.00 0.52 0.14 0.00 0.35 0.00 0.00 41.96 42.97 1noi s TYR 262 CO 0.00 -0.33 1.46 0.42 -1.34 0.00 0.00 175.55 175.76 1noi s ILE 263 N -2.67 4.76 -0.84 3.14 1.01 -1.26 -4.73 121.20 120.60 1noi s ILE 263 Ca 0.08 -2.27 -0.03 0.00 0.00 0.00 0.00 60.65 58.44 1noi s ILE 263 Cb -0.01 -4.96 0.25 0.00 0.01 0.00 0.00 42.46 37.75 1noi s ILE 263 CO -0.06 -1.70 2.21 0.00 0.00 0.00 0.00 174.94 175.38 1noi n GLN 264 N 6.47 3.40 0.00 2.79 0.00 -1.26 -2.65 117.38 126.13 1noi n GLN 264 Ca 0.37 -3.46 0.00 0.00 0.00 0.00 0.00 57.00 53.91 1noi n GLN 264 Cb 0.45 -2.32 0.00 0.00 0.00 0.00 0.00 30.24 28.37 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 0.13 0.99 0.01 2.61 0.00 -1.26 -4.53 120.51 118.46 1noi n ALA 265 Ca 0.52 -0.18 -0.18 0.00 0.00 0.00 0.00 53.44 53.61 1noi n ALA 265 Cb 0.32 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.64 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 2.98 1.54 -0.36 0.00 2.07 -1.90 -3.21 116.25 117.36 1noi h VAL 266 Ca 0.00 -2.31 0.00 0.00 0.82 0.00 0.00 66.70 65.21 1noi h VAL 266 Cb 0.99 3.02 -0.02 0.00 -1.52 0.00 0.00 31.29 33.77 1noi h VAL 266 CO 0.00 0.65 0.23 -0.07 0.02 0.00 0.00 177.57 178.40 1noi h LEU 267 N -0.42 0.43 -0.34 2.57 3.38 -1.83 -1.60 115.31 117.50 1noi h LEU 267 Ca -0.09 -0.03 0.07 0.00 0.09 0.00 0.00 57.88 57.92 1noi h LEU 267 Cb 1.37 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.95 1noi h LEU 267 CO 0.11 0.33 -0.06 -0.78 0.09 0.00 0.00 178.44 178.13 1noi h ASP 268 N 0.48 -0.27 0.55 -0.43 1.82 -1.80 0.12 116.42 116.90 1noi h ASP 268 Ca 0.13 0.10 -0.02 0.00 -0.39 0.00 0.00 57.03 56.85 1noi h ASP 268 Cb -0.03 0.19 -0.01 0.00 0.68 0.00 0.00 39.33 40.16 1noi h ASP 268 CO -0.03 -0.09 -0.42 0.03 -1.61 0.00 0.00 179.24 177.12 1noi h ARG 269 N 0.03 -0.91 -0.35 0.28 3.08 -1.51 -0.56 114.38 114.43 1noi h ARG 269 Ca 0.17 0.06 0.07 0.00 0.07 0.00 0.00 59.98 60.35 1noi h ARG 269 Cb 0.25 0.21 -0.06 0.00 0.08 0.00 0.00 29.97 30.44 1noi h ARG 269 CO -0.33 -0.61 -0.07 -0.97 -1.07 0.00 0.00 179.97 176.92 1noi h ASN 270 N -0.95 -0.30 0.31 7.04 -0.73 -1.01 0.61 115.58 120.57 1noi h ASN 270 Ca -0.06 0.10 -0.15 0.00 1.87 0.00 0.00 56.30 58.06 1noi h ASN 270 Cb 0.80 0.21 -0.01 0.00 0.27 0.00 0.00 38.32 39.58 1noi h ASN 270 CO 0.02 -0.10 -0.60 -0.07 -0.37 0.00 0.00 177.43 176.30 1noi h LEU 271 N 0.01 0.33 0.15 0.34 3.38 -0.73 -0.88 115.31 117.90 1noi h LEU 271 Ca 0.17 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1noi h LEU 271 Cb 0.25 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1noi h LEU 271 CO -0.35 0.85 -0.07 0.00 0.09 0.00 0.00 178.44 178.96 1noi h ALA 272 N 1.15 -0.20 -0.48 1.53 0.00 -0.35 -3.24 119.26 117.67 1noi h ALA 272 Ca -0.01 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.90 1noi h ALA 272 Cb 1.11 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 1noi h ALA 272 CO 0.10 -0.60 0.20 0.93 0.00 0.00 0.00 179.25 179.88 1noi h GLU 273 N -0.24 0.39 -0.28 0.00 5.08 -0.68 -2.33 114.58 116.52 1noi h GLU 273 Ca -0.02 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1noi h GLU 273 Cb 0.18 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1noi h GLU 273 CO 0.03 0.26 0.00 0.27 -1.00 0.00 0.00 179.01 178.57 1noi n ASN 274 N -4.96 0.28 -0.12 1.42 2.04 -0.36 -2.94 115.26 110.63 1noi n ASN 274 Ca 0.04 -1.89 0.01 0.00 -0.44 0.00 0.00 54.58 52.30 1noi n ASN 274 Cb 0.16 -0.14 0.30 0.00 -2.53 0.00 0.00 39.78 37.58 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 0.00 1.17 -0.02 1.53 2.04 -1.44 -3.04 117.51 117.75 1noi h ILE 275 Ca 0.00 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.48 1noi h ILE 275 Cb 0.14 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.57 1noi h ILE 275 CO 0.00 0.18 -0.29 -1.20 0.00 0.00 0.00 178.15 176.84 1noi n SER 276 N -4.41 1.92 0.08 1.72 7.64 -1.15 -4.68 113.62 114.74 1noi n SER 276 Ca 0.05 -1.46 -0.14 0.00 1.01 0.00 0.00 58.87 58.34 1noi n SER 276 Cb 0.08 0.26 -0.14 0.00 -1.01 0.00 0.00 64.21 63.40 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 2.57 0.20 -3.59 1.43 3.08 -1.64 -0.47 114.38 115.96 1noi h ARG 277 Ca 0.00 -0.34 -0.12 0.00 0.07 0.00 0.00 59.98 59.59 1noi h ARG 277 Cb 0.72 0.13 -0.18 0.00 0.08 0.00 0.00 29.97 30.71 1noi h ARG 277 CO 0.00 1.11 -0.45 0.08 -1.07 0.00 0.00 179.97 179.64 1noi s VAL 278 N -2.65 0.11 1.07 2.04 1.01 -1.26 -0.05 120.40 120.66 1noi s VAL 278 Ca -0.04 -0.88 -0.15 0.00 0.00 0.00 0.00 61.98 60.91 1noi s VAL 278 Cb 0.08 -0.78 0.22 0.00 0.00 0.00 0.00 36.38 35.90 1noi s VAL 278 CO 0.86 -0.48 1.10 -0.76 0.00 0.00 0.00 175.10 175.82 1noi s LEU 279 N -1.89 1.30 0.19 3.92 1.43 -0.25 -5.00 118.68 118.38 1noi s LEU 279 Ca -0.08 0.98 -0.18 0.00 -1.03 0.00 0.00 54.13 53.83 1noi s LEU 279 Cb -0.03 -3.02 0.03 0.00 0.03 0.00 0.00 46.19 43.21 1noi s LEU 279 CO -0.02 -3.45 0.52 -0.31 0.23 0.00 0.00 176.35 173.32 1noi s TYR 280 N -3.00 -0.16 -0.21 0.29 2.02 -1.26 -5.00 117.35 110.03 1noi s TYR 280 Ca 0.67 -0.17 0.19 0.00 -0.37 0.00 0.00 57.07 57.39 1noi s TYR 280 Cb -0.16 0.40 0.47 0.00 -0.40 0.00 0.00 41.96 42.28 1noi s TYR 280 CO 0.57 -0.90 1.15 -0.35 -1.57 0.00 0.00 175.55 174.45 1noi n PRO 281 N -0.34 1.80 -0.28 -1.71 -0.04 -1.26 -5.16 135.00 128.02 1noi n PRO 281 Ca -0.11 -3.34 0.00 0.00 -0.04 0.00 0.00 63.50 60.01 1noi n PRO 281 Cb 0.63 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.64 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 -0.46 0.00 -3.63 0.54 -0.00 -1.26 -5.13 120.64 110.71 1noi n GLU 287 Ca 0.16 0.00 -0.39 0.00 -0.00 0.00 0.00 57.16 56.94 1noi n GLU 287 Cb 0.90 0.00 -0.08 0.00 -0.00 0.00 0.00 31.44 32.26 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 -0.55 2.60 0.11 -1.84 0.00 -1.26 -4.86 107.32 101.52 1noi s GLY 288 Ca 0.00 -3.34 0.04 0.00 0.00 0.00 0.00 44.72 41.42 1noi s GLY 288 CO 0.00 1.14 -0.11 1.25 0.00 0.00 0.00 173.10 175.39 1noi s LYS 289 N -0.15 0.93 0.32 2.90 2.20 -1.26 -5.05 119.74 119.63 1noi s LYS 289 Ca 0.18 -1.25 0.05 0.00 -0.36 0.00 0.00 55.97 54.60 1noi s LYS 289 Cb -0.17 -0.61 0.70 0.00 -1.51 0.00 0.00 37.83 36.24 1noi s LYS 289 CO -0.05 0.09 1.84 1.49 -0.36 0.00 0.00 175.35 178.36 1noi h GLU 290 N 3.35 0.80 -0.91 4.03 4.81 -1.99 0.30 114.58 124.97 1noi h GLU 290 Ca -0.38 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 58.84 1noi h GLU 290 Cb 1.19 -0.18 -0.05 0.00 0.63 0.00 0.00 28.75 30.33 1noi h GLU 290 CO 0.55 0.53 0.59 1.25 -0.73 0.00 0.00 179.01 181.20 1noi h LEU 291 N 0.83 0.98 -0.52 1.64 6.46 -1.99 0.09 115.31 122.80 1noi h LEU 291 Ca 0.49 -0.01 -0.04 0.00 -0.12 0.00 0.00 57.88 58.21 1noi h LEU 291 Cb 0.67 -0.22 -0.02 0.00 -0.73 0.00 0.00 40.66 40.35 1noi h LEU 291 CO -0.26 0.67 0.18 0.03 -0.62 0.00 0.00 178.44 178.44 1noi h ARG 292 N 1.14 0.79 -0.37 1.25 3.08 -1.29 -0.57 114.38 118.41 1noi h ARG 292 Ca 0.37 -0.16 -0.10 0.00 0.07 0.00 0.00 59.98 60.16 1noi h ARG 292 Cb 0.01 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 1noi h ARG 292 CO -0.12 0.72 -0.16 1.25 -1.07 0.00 0.00 179.97 180.59 1noi h LEU 293 N 0.70 0.68 -0.26 3.04 5.85 -0.77 -1.41 115.31 123.14 1noi h LEU 293 Ca 0.17 -0.21 -0.04 0.00 0.84 0.00 0.00 57.88 58.63 1noi h LEU 293 Cb 0.25 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 1noi h LEU 293 CO -0.01 0.85 -0.01 0.11 -0.34 0.00 0.00 178.44 179.05 1noi h LYS 294 N 0.61 0.46 -0.54 1.25 1.57 -0.52 -0.88 116.57 118.52 1noi h LYS 294 Ca 0.10 -0.15 0.11 0.00 -1.87 0.00 0.00 60.65 58.84 1noi h LYS 294 Cb 0.62 -0.04 -0.09 0.00 0.08 0.00 0.00 32.23 32.80 1noi h LYS 294 CO 0.04 0.63 -0.03 1.96 -0.57 0.00 0.00 179.45 181.49 1noi h GLN 295 N 0.24 0.09 -0.44 3.15 4.20 -0.95 0.23 115.11 121.62 1noi h GLN 295 Ca 0.07 -0.01 -0.09 0.00 0.06 0.00 0.00 58.65 58.68 1noi h GLN 295 Cb 0.43 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 1noi h GLN 295 CO 0.01 0.06 -0.09 0.93 -0.67 0.00 0.00 178.83 179.07 1noi h GLU 296 N 0.09 0.83 -0.14 1.46 5.08 -0.55 -2.26 114.58 119.08 1noi h GLU 296 Ca 0.27 -0.31 -0.20 0.00 -1.00 0.00 0.00 59.36 58.13 1noi h GLU 296 Cb 0.43 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1noi h GLU 296 CO -0.48 0.94 -0.71 -0.92 -1.00 0.00 0.00 179.01 176.83 1noi h TYR 297 N 0.66 0.84 -0.45 4.33 3.20 -0.91 -2.71 116.97 121.93 1noi h TYR 297 Ca 0.11 -0.36 0.08 0.00 3.14 0.00 0.00 58.73 61.70 1noi h TYR 297 Cb 0.62 -0.14 -0.06 0.00 1.54 0.00 0.00 36.73 38.69 1noi h TYR 297 CO 0.05 1.15 0.07 0.35 -1.64 0.00 0.00 178.16 178.14 1noi h PHE 298 N 0.44 0.11 -0.08 -3.82 3.57 -0.01 -1.49 116.94 115.66 1noi h PHE 298 Ca -0.03 0.03 -0.18 0.00 3.53 0.00 0.00 57.97 61.32 1noi h PHE 298 Cb 1.31 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 40.06 1noi h PHE 298 CO 0.06 -0.02 -0.71 -0.24 -2.23 0.00 0.00 178.31 175.18 1noi h VAL 299 N 0.20 1.38 -0.18 1.41 3.04 -1.43 -2.85 116.25 117.81 1noi h VAL 299 Ca 0.22 -2.11 -0.01 0.00 -1.01 0.00 0.00 66.70 63.79 1noi h VAL 299 Cb 0.30 2.09 -0.01 0.00 -2.01 0.00 0.00 31.29 31.66 1noi h VAL 299 CO -0.31 0.64 0.08 0.58 -1.01 0.00 0.00 177.57 177.54 1noi h VAL 300 N 0.27 1.15 -0.20 1.51 2.07 -1.17 -2.31 116.25 117.57 1noi h VAL 300 Ca -0.03 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.04 1noi h VAL 300 Cb 1.28 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 32.14 1noi h VAL 300 CO 0.12 0.14 0.04 0.00 0.02 0.00 0.00 177.57 177.89 1noi h ALA 301 N 0.93 0.26 -0.09 1.67 0.00 -1.17 -1.26 119.26 119.61 1noi h ALA 301 Ca 0.06 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1noi h ALA 301 Cb 0.15 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1noi h ALA 301 CO -0.01 -0.08 0.02 0.00 0.00 0.00 0.00 179.25 179.18 1noi h ALA 302 N 0.85 0.12 -0.26 0.00 0.00 -1.61 -2.68 119.26 115.67 1noi h ALA 302 Ca 0.06 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1noi h ALA 302 Cb 0.29 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1noi h ALA 302 CO 0.00 -0.25 0.15 1.15 0.00 0.00 0.00 179.25 180.31 1noi h THR 303 N -0.08 1.11 0.00 0.00 2.02 -1.31 -1.72 112.91 112.94 1noi h THR 303 Ca 0.03 -0.27 -0.06 0.00 0.77 0.00 0.00 66.41 66.88 1noi h THR 303 Cb 0.26 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 1noi h THR 303 CO 0.00 0.11 -0.28 -0.07 0.37 0.00 0.00 175.52 175.64 1noi h LEU 304 N 0.32 0.00 -0.17 2.58 4.07 -1.26 0.55 115.31 121.39 1noi h LEU 304 Ca 0.09 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.02 1noi h LEU 304 Cb 0.04 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.77 1noi h LEU 304 CO -0.02 0.28 -0.03 1.56 -1.08 0.00 0.00 178.44 179.16 1noi h GLN 305 N 0.00 0.32 -0.62 1.13 4.20 -1.27 -1.50 115.11 117.36 1noi h GLN 305 Ca -0.00 -0.12 -0.02 0.00 0.06 0.00 0.00 58.65 58.57 1noi h GLN 305 Cb 0.53 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.25 1noi h GLN 305 CO 0.04 0.57 0.31 0.22 -0.67 0.00 0.00 178.83 179.30 1noi h ASP 306 N 0.04 0.79 -0.16 1.46 3.58 -0.59 -0.86 116.42 120.68 1noi h ASP 306 Ca 0.04 -0.12 0.03 0.00 0.42 0.00 0.00 57.03 57.41 1noi h ASP 306 Cb 0.45 -0.20 -0.03 0.00 1.72 0.00 0.00 39.33 41.26 1noi h ASP 306 CO 0.01 0.69 -0.02 0.40 -2.88 0.00 0.00 179.24 177.44 1noi h ILE 307 N 0.84 0.86 -0.51 2.25 2.04 -0.88 -0.56 117.51 121.56 1noi h ILE 307 Ca 0.21 -0.01 -0.06 0.00 1.00 0.00 0.00 64.86 66.00 1noi h ILE 307 Cb 0.09 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 1noi h ILE 307 CO -0.03 0.01 0.07 0.40 0.00 0.00 0.00 178.15 178.60 1noi h ILE 308 N 0.03 1.25 -0.23 -0.67 2.04 -1.17 0.52 117.51 119.28 1noi h ILE 308 Ca 0.08 -0.96 0.06 0.00 1.00 0.00 0.00 64.86 65.03 1noi h ILE 308 Cb 0.11 0.88 -0.07 0.00 -0.74 0.00 0.00 36.82 37.00 1noi h ILE 308 CO -0.15 0.34 -0.22 -0.09 0.00 0.00 0.00 178.15 178.04 1noi h ARG 309 N 0.74 -0.22 -0.05 2.37 2.43 -0.95 0.24 114.38 118.94 1noi h ARG 309 Ca 0.15 0.02 -0.16 0.00 -0.81 0.00 0.00 59.98 59.18 1noi h ARG 309 Cb 0.42 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 1noi h ARG 309 CO 0.01 -0.15 -0.68 -0.09 -1.51 0.00 0.00 179.97 177.56 1noi h ARG 310 N -0.23 0.23 -0.75 0.20 2.43 -0.93 0.03 114.38 115.35 1noi h ARG 310 Ca 0.13 -0.18 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 1noi h ARG 310 Cb 0.43 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.98 1noi h ARG 310 CO -0.36 0.82 0.34 0.35 -1.51 0.00 0.00 179.97 179.61 1noi h PHE 311 N 0.16 1.11 -0.14 2.20 3.57 0.16 -3.12 116.94 120.87 1noi h PHE 311 Ca -0.02 -0.06 -0.07 0.00 3.53 0.00 0.00 57.97 61.35 1noi h PHE 311 Cb 1.21 -0.34 -0.00 0.00 2.79 0.00 0.00 35.95 39.61 1noi h PHE 311 CO 0.02 0.82 -0.18 0.87 -2.23 0.00 0.00 178.31 177.62 1noi h LYS 312 N 1.07 0.38 0.32 1.11 1.57 0.08 -3.29 116.57 117.81 1noi h LYS 312 Ca 0.26 -0.21 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 1noi h LYS 312 Cb 0.15 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1noi h LYS 312 CO -0.03 0.78 -0.15 0.66 -0.57 0.00 0.00 179.45 180.14 1noi h SER 313 N -0.01 -0.36 -0.37 0.86 4.64 -0.99 1.10 113.55 118.41 1noi h SER 313 Ca 0.02 0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.32 1noi h SER 313 Cb 0.73 0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.91 1noi h SER 313 CO 0.04 -0.09 0.08 -0.44 -0.87 0.00 0.00 176.83 175.55 1noi s SER 314 N -4.02 3.98 0.00 4.97 0.01 -1.18 -3.97 113.70 113.48 1noi s SER 314 Ca -0.06 -0.04 0.00 0.00 1.31 0.00 0.00 55.95 57.16 1noi s SER 314 Cb 0.01 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 1noi s SER 314 CO 0.19 -3.81 0.00 0.29 0.41 0.00 0.00 173.24 170.31 1noi n LYS 315 N 8.81 0.00 0.00 12.44 4.01 -1.26 -4.78 118.16 137.38 1noi n LYS 315 Ca 0.46 0.00 0.12 0.00 -0.51 0.00 0.00 58.31 58.39 1noi n LYS 315 Cb 0.43 -2.90 0.19 0.00 -0.51 0.00 0.00 35.03 32.25 1noi n LYS 315 CO 0.00 0.00 0.00 1.19 -1.11 0.00 0.00 177.40 177.48 1noi n PHE 316 N -1.46 0.00 0.07 2.13 3.72 -1.22 -0.52 117.46 120.17 1noi n PHE 316 Ca 0.00 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.20 1noi n PHE 316 Cb 0.00 -0.01 -0.15 0.00 -0.94 0.00 0.00 39.48 38.39 1noi n PHE 316 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1noi h GLY 317 N 4.77 0.38 0.59 1.37 0.00 0.11 -3.33 103.07 106.95 1noi h GLY 317 Ca 0.00 -0.96 -0.03 0.00 0.00 0.00 0.00 47.33 46.34 1noi h GLY 317 CO 0.00 0.84 -0.28 0.00 0.00 0.00 0.00 176.54 177.10 1noi s ARG 319 N -4.50 3.62 -0.08 0.00 3.00 0.32 -4.64 118.95 116.67 1noi s ARG 319 Ca -0.12 -1.65 -0.02 0.00 -1.00 0.00 0.00 55.73 52.94 1noi s ARG 319 Cb 0.01 -5.44 -0.26 0.00 0.00 0.00 0.00 34.95 29.26 1noi s ARG 319 CO 0.35 -2.58 0.53 0.22 0.00 0.00 0.00 175.30 173.82 1noi h ASP 320 N 8.43 0.32 0.00 -2.12 1.82 -1.67 -3.41 116.42 119.79 1noi h ASP 320 Ca 0.36 -0.66 0.00 0.00 -0.39 0.00 0.00 57.03 56.34 1noi h ASP 320 Cb 0.91 -0.11 0.00 0.00 0.68 0.00 0.00 39.33 40.81 1noi h ASP 320 CO 1.41 1.59 0.00 -2.65 -1.61 0.00 0.00 179.24 177.97 1noi n PRO 321 N -3.38 0.00 -3.71 0.28 -0.02 -1.26 -0.84 135.00 126.07 1noi n PRO 321 Ca -0.25 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 60.84 1noi n PRO 321 Cb 1.05 0.00 -0.12 0.00 -0.02 0.00 0.00 33.50 34.41 1noi n PRO 321 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1noi s VAL 322 N 0.00 3.98 -0.51 -1.45 0.11 -1.26 -4.73 120.40 116.54 1noi s VAL 322 Ca 0.00 -1.12 -0.02 0.00 -2.93 0.00 0.00 61.98 57.91 1noi s VAL 322 Cb 0.00 -3.28 0.00 0.00 -1.53 0.00 0.00 36.38 31.58 1noi s VAL 322 CO 0.00 -0.23 0.36 0.54 -3.33 0.00 0.00 175.10 172.44 1noi n ARG 323 N 4.86 -0.89 -3.52 1.54 3.00 -1.26 -2.30 116.66 118.09 1noi n ARG 323 Ca -0.12 0.38 -0.28 0.00 -0.01 0.00 0.00 57.85 57.83 1noi n ARG 323 Cb 0.45 -1.29 0.01 0.00 0.00 0.00 0.00 32.46 31.63 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 -1.92 -3.11 -3.37 0.55 -1.04 -1.17 -4.66 114.28 99.57 1noi n THR 324 Ca -0.18 0.02 -0.38 0.00 -2.04 0.00 0.00 64.05 61.47 1noi n THR 324 Cb 0.41 -2.80 -0.06 0.00 -1.82 0.00 0.00 70.33 66.06 1noi n THR 324 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1noi s ASN 325 N -2.29 6.59 0.00 8.00 3.84 -0.02 -4.90 114.94 126.16 1noi s ASN 325 Ca 0.13 0.69 0.00 0.00 0.21 0.00 0.00 52.86 53.90 1noi s ASN 325 Cb -0.01 -2.26 0.00 0.00 -0.55 0.00 0.00 41.25 38.43 1noi s ASN 325 CO 0.80 -0.01 0.79 0.49 -2.79 0.00 0.00 177.10 176.39 1noi n PHE 326 N 3.86 0.00 -0.38 0.43 3.72 -1.26 -3.06 117.46 120.77 1noi n PHE 326 Ca -0.08 0.00 0.33 0.00 -0.05 0.00 0.00 57.45 57.65 1noi n PHE 326 Cb 0.51 -0.29 0.65 0.00 -0.94 0.00 0.00 39.48 39.41 1noi n PHE 326 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1noi h ASP 327 N 0.00 0.21 0.25 4.37 3.32 -1.96 0.50 116.42 123.11 1noi h ASP 327 Ca 0.00 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1noi h ASP 327 Cb 0.42 0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1noi h ASP 327 CO 0.00 -0.01 -0.47 0.00 -1.72 0.00 0.00 179.24 177.04 1noi n ALA 328 N -2.63 3.52 -0.24 3.45 0.00 -1.17 -4.62 120.51 118.83 1noi n ALA 328 Ca 0.30 -0.45 0.01 0.00 0.00 0.00 0.00 53.44 53.30 1noi n ALA 328 Cb 1.23 -1.03 0.13 0.00 0.00 0.00 0.00 19.45 19.77 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 0.83 0.65 0.00 0.00 3.57 -1.12 0.33 116.94 121.19 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 0.54 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.09 1noi h PHE 329 CO 0.00 0.25 0.00 -1.35 -2.23 0.00 0.00 178.31 174.98 1noi h PRO 330 N 0.62 0.00 0.00 6.41 0.11 -1.79 0.41 132.00 137.77 1noi h PRO 330 Ca 0.34 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.44 1noi h PRO 330 Cb 0.33 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.44 1noi h PRO 330 CO -0.25 0.00 -1.17 -0.25 -0.21 0.00 0.00 178.00 176.13 1noi n ASP 331 N -2.40 0.73 -0.16 -2.05 8.00 0.03 -4.29 116.55 116.41 1noi n ASP 331 Ca 0.01 0.29 0.03 0.00 0.71 0.00 0.00 54.79 55.83 1noi n ASP 331 Cb 0.23 0.65 0.01 0.00 -0.02 0.00 0.00 41.12 41.98 1noi n ASP 331 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1noi n LYS 332 N -2.63 1.80 -4.04 -1.24 4.76 -0.50 -4.48 118.16 111.83 1noi n LYS 332 Ca -0.01 -0.55 -0.16 0.00 -2.87 0.00 0.00 58.31 54.72 1noi n LYS 332 Cb 0.57 -0.99 -0.15 0.00 -1.84 0.00 0.00 35.03 32.62 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 -0.88 0.29 -0.06 -0.18 1.01 0.13 -1.26 120.40 119.45 1noi s VAL 333 Ca 0.05 -0.08 0.03 0.00 0.00 0.00 0.00 61.98 61.98 1noi s VAL 333 Cb 0.05 -0.29 0.01 0.00 0.00 0.00 0.00 36.38 36.14 1noi s VAL 333 CO 0.13 0.12 -0.13 0.00 0.00 0.00 0.00 175.10 175.22 1noi s ALA 334 N 0.38 1.32 -0.12 5.51 0.00 -0.58 -4.48 121.76 123.79 1noi s ALA 334 Ca -0.04 -0.48 0.03 0.00 0.00 0.00 0.00 51.96 51.48 1noi s ALA 334 Cb -0.07 -0.56 0.01 0.00 0.00 0.00 0.00 23.12 22.50 1noi s ALA 334 CO -0.01 0.15 -0.22 0.42 0.00 0.00 0.00 175.76 176.10 1noi s ILE 335 N 0.52 2.01 -0.19 0.00 1.01 -0.72 -0.45 121.20 123.39 1noi s ILE 335 Ca -0.13 -0.97 -0.02 0.00 0.00 0.00 0.00 60.65 59.53 1noi s ILE 335 Cb -0.15 -1.76 -0.01 0.00 0.01 0.00 0.00 42.46 40.55 1noi s ILE 335 CO 0.04 0.55 -0.09 -1.58 0.00 0.00 0.00 174.94 173.85 1noi s GLN 336 N 0.58 3.33 -0.32 2.79 2.00 0.28 -1.62 119.66 126.69 1noi s GLN 336 Ca -0.13 -0.67 -0.12 0.00 -2.00 0.00 0.00 55.36 52.44 1noi s GLN 336 Cb -0.17 -2.83 -0.02 0.00 0.80 0.00 0.00 33.01 30.80 1noi s GLN 336 CO 0.04 -0.07 0.21 -0.51 -0.50 0.00 0.00 175.29 174.46 1noi s LEU 337 N 1.09 4.34 -0.47 3.68 1.02 -0.16 -1.68 118.68 126.49 1noi s LEU 337 Ca 0.00 -0.42 -0.15 0.00 0.02 0.00 0.00 54.13 53.58 1noi s LEU 337 Cb -0.15 -2.09 0.08 0.00 0.02 0.00 0.00 46.19 44.06 1noi s LEU 337 CO -0.02 -0.21 0.39 0.20 0.02 0.00 0.00 176.35 176.73 1noi s ASN 338 N 1.69 6.08 0.48 2.29 -0.87 -1.23 -1.27 114.94 122.11 1noi s ASN 338 Ca 0.06 -1.41 0.00 0.00 -1.57 0.00 0.00 52.86 49.93 1noi s ASN 338 Cb -0.17 -2.16 0.00 0.00 -0.02 0.00 0.00 41.25 38.90 1noi s ASN 338 CO 0.09 -0.66 0.00 0.47 -2.57 0.00 0.00 177.10 174.43 1noi n ASP 339 N 5.17 -6.52 -0.27 -1.22 8.00 0.81 -4.14 116.55 118.37 1noi n ASP 339 Ca -0.12 0.87 0.15 0.00 0.71 0.00 0.00 54.79 56.39 1noi n ASP 339 Cb 0.43 -2.44 0.71 0.00 -0.02 0.00 0.00 41.12 39.80 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 -3.05 0.00 -0.13 -3.53 -2.24 -1.26 -4.10 114.28 99.97 1noi n THR 340 Ca 0.01 -0.14 0.01 0.00 -2.27 0.00 0.00 64.05 61.65 1noi n THR 340 Cb 0.37 0.07 0.29 0.00 -2.10 0.00 0.00 70.33 68.96 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 1.33 0.79 -0.93 4.78 3.86 -1.99 -0.36 115.15 122.63 1noi h HIS 341 Ca 0.00 0.00 -0.46 0.00 -1.16 0.00 0.00 60.37 58.76 1noi h HIS 341 Cb 0.28 -0.26 -0.27 0.00 1.06 0.00 0.00 27.41 28.22 1noi h HIS 341 CO 0.00 0.53 0.58 -0.35 0.86 0.00 0.00 177.93 179.55 1noi n PRO 342 N -4.41 2.49 0.24 2.45 -0.04 -1.26 -4.61 135.00 129.86 1noi n PRO 342 Ca 0.06 -2.95 0.08 0.00 -0.04 0.00 0.00 63.50 60.65 1noi n PRO 342 Cb 0.08 -2.16 0.59 0.00 -0.04 0.00 0.00 33.50 31.97 1noi n PRO 342 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1noi h SER 343 N 1.28 0.00 0.00 3.54 4.64 -1.29 -1.88 113.55 119.83 1noi h SER 343 Ca 0.56 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.88 1noi h SER 343 Cb 2.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.83 1noi h SER 343 CO 1.02 0.16 0.00 0.18 -0.87 0.00 0.00 176.83 177.33 1noi n LEU 344 N -4.04 0.00 -0.19 5.97 4.77 -1.26 -1.63 117.00 120.62 1noi n LEU 344 Ca -0.02 0.45 -0.02 0.00 -0.03 0.00 0.00 56.01 56.39 1noi n LEU 344 Cb 0.25 -0.45 0.19 0.00 -2.33 0.00 0.00 43.42 41.07 1noi n LEU 344 CO 0.34 -0.45 1.09 0.00 -1.33 0.00 0.00 177.39 177.03 1noi h ALA 345 N 2.00 1.28 0.57 -1.18 0.00 -1.70 0.03 119.26 120.25 1noi h ALA 345 Ca 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1noi h ALA 345 Cb 0.00 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 17.53 1noi h ALA 345 CO 0.00 0.55 -0.27 0.82 0.00 0.00 0.00 179.25 180.35 1noi h ILE 346 N 0.94 0.28 -0.02 0.00 2.04 -1.54 0.11 117.51 119.32 1noi h ILE 346 Ca 0.23 -0.36 0.01 0.00 1.00 0.00 0.00 64.86 65.74 1noi h ILE 346 Cb 0.13 0.39 -0.00 0.00 -0.74 0.00 0.00 36.82 36.60 1noi h ILE 346 CO -0.03 0.04 0.02 1.55 0.00 0.00 0.00 178.15 179.73 1noi h PRO 347 N -1.04 0.00 -0.06 2.37 0.13 -1.75 -2.62 132.00 129.04 1noi h PRO 347 Ca -0.08 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.00 1noi h PRO 347 Cb 0.65 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.78 1noi h PRO 347 CO 0.13 0.00 -0.18 1.49 -0.23 0.00 0.00 178.00 179.20 1noi h GLU 348 N 0.00 0.23 -0.57 0.86 4.57 -0.82 -1.40 114.58 117.45 1noi h GLU 348 Ca 0.01 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 58.02 1noi h GLU 348 Cb 0.05 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.64 1noi h GLU 348 CO -0.00 0.79 0.36 1.25 -1.18 0.00 0.00 179.01 180.23 1noi h LEU 349 N -0.29 0.67 -1.31 1.64 5.85 -0.80 -0.60 115.31 120.46 1noi h LEU 349 Ca -0.01 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 1noi h LEU 349 Cb 0.81 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 1noi h LEU 349 CO 0.04 0.51 0.32 0.24 -0.34 0.00 0.00 178.44 179.21 1noi h MET 350 N 0.77 0.79 0.22 1.25 2.86 -1.48 -1.30 114.93 118.04 1noi h MET 350 Ca 0.21 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 1noi h MET 350 Cb -0.05 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.45 1noi h MET 350 CO -0.04 0.58 -0.11 -0.09 1.06 0.00 0.00 176.91 178.31 1noi h ARG 351 N 0.80 -0.29 -0.36 1.72 2.43 -0.20 -0.54 114.38 117.94 1noi h ARG 351 Ca 0.21 0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.44 1noi h ARG 351 Cb 0.01 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.59 1noi h ARG 351 CO -0.03 0.01 0.11 0.28 -1.51 0.00 0.00 179.97 178.83 1noi h VAL 352 N -0.59 0.88 -0.50 0.20 2.07 -0.90 0.20 116.25 117.61 1noi h VAL 352 Ca -0.03 -0.09 -0.06 0.00 0.82 0.00 0.00 66.70 67.34 1noi h VAL 352 Cb 0.43 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 1noi h VAL 352 CO 0.05 0.05 0.06 -0.07 0.02 0.00 0.00 177.57 177.67 1noi h LEU 353 N 0.26 0.81 0.00 2.57 3.38 -1.20 0.67 115.31 121.80 1noi h LEU 353 Ca 0.16 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1noi h LEU 353 Cb 0.15 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1noi h LEU 353 CO -0.18 0.88 -0.05 0.58 0.09 0.00 0.00 178.44 179.77 1noi h VAL 354 N 0.71 0.77 -0.11 1.22 2.07 -0.85 -1.35 116.25 118.71 1noi h VAL 354 Ca 0.15 -1.59 -0.17 0.00 0.82 0.00 0.00 66.70 65.91 1noi h VAL 354 Cb 0.43 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 1noi h VAL 354 CO 0.01 0.26 -0.64 0.44 0.02 0.00 0.00 177.57 177.67 1noi h ASP 355 N -1.00 0.47 0.00 0.57 3.32 -1.07 -1.96 116.42 116.76 1noi h ASP 355 Ca -0.01 -0.28 -0.28 0.00 0.02 0.00 0.00 57.03 56.48 1noi h ASP 355 Cb 0.46 -0.14 -0.05 0.00 0.22 0.00 0.00 39.33 39.83 1noi h ASP 355 CO -0.01 0.99 -2.06 0.18 -1.72 0.00 0.00 179.24 176.63 1noi n LEU 356 N -3.89 2.41 -0.49 1.55 4.32 0.04 -4.51 117.00 116.45 1noi n LEU 356 Ca -0.03 -0.08 0.14 0.00 -0.02 0.00 0.00 56.01 56.01 1noi n LEU 356 Cb 0.65 -0.46 0.51 0.00 -1.62 0.00 0.00 43.42 42.50 1noi n LEU 356 CO 0.47 0.73 0.86 -0.62 -1.22 0.00 0.00 177.39 177.61 1noi n GLU 357 N -2.95 1.67 -3.19 3.23 -0.58 -0.14 -4.97 120.64 113.71 1noi n GLU 357 Ca -0.31 -0.98 -0.23 0.00 -0.42 0.00 0.00 57.16 55.22 1noi n GLU 357 Cb 0.88 -1.47 0.01 0.00 -0.57 0.00 0.00 31.44 30.29 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 0.19 -4.11 -2.20 3.49 3.00 -0.74 -4.93 116.66 111.37 1noi n ARG 358 Ca 0.19 0.68 -0.30 0.00 -0.01 0.00 0.00 57.85 58.40 1noi n ARG 358 Cb 0.35 -5.46 -0.00 0.00 0.00 0.00 0.00 32.46 27.35 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 -6.57 3.43 0.57 0.55 1.43 -0.54 -4.99 118.68 112.56 1noi s LEU 359 Ca 0.35 1.33 -0.19 0.00 -1.03 0.00 0.00 54.13 54.59 1noi s LEU 359 Cb -0.17 -4.33 -0.05 0.00 0.03 0.00 0.00 46.19 41.68 1noi s LEU 359 CO 0.43 -0.72 1.14 -1.81 0.23 0.00 0.00 176.35 175.62 1noi s ASP 360 N -3.88 5.54 0.27 2.29 1.01 -1.26 -4.49 116.67 116.16 1noi s ASP 360 Ca 0.54 2.18 -0.01 0.00 0.71 0.00 0.00 52.55 55.97 1noi s ASP 360 Cb -0.11 -2.58 0.47 0.00 1.01 0.00 0.00 42.92 41.72 1noi s ASP 360 CO 0.46 -1.34 1.86 -0.25 0.21 0.00 0.00 175.17 176.11 1noi h TRP 361 N 0.97 1.17 -0.15 4.23 7.01 -1.98 -2.06 115.95 125.14 1noi h TRP 361 Ca -0.50 0.03 -0.09 0.00 2.11 0.00 0.00 58.89 60.44 1noi h TRP 361 Cb 1.26 -0.38 -0.01 0.00 -2.10 0.00 0.00 29.16 27.93 1noi h TRP 361 CO 0.51 0.54 -0.31 -0.44 -2.79 0.00 0.00 178.44 175.95 1noi h ASP 362 N 1.09 0.30 0.16 2.65 3.32 -2.00 -1.04 116.42 120.91 1noi h ASP 362 Ca 0.46 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.40 1noi h ASP 362 Cb 0.31 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.78 1noi h ASP 362 CO -0.22 0.61 -0.08 0.50 -1.72 0.00 0.00 179.24 178.33 1noi h LYS 363 N 0.26 -0.21 -0.96 3.56 1.63 -1.76 -3.06 116.57 116.03 1noi h LYS 363 Ca 0.04 0.01 0.12 0.00 -0.85 0.00 0.00 60.65 59.97 1noi h LYS 363 Cb 0.68 0.05 -0.09 0.00 -0.60 0.00 0.00 32.23 32.27 1noi h LYS 363 CO 0.05 0.22 0.59 0.00 -3.45 0.00 0.00 179.45 176.86 1noi h ALA 364 N -0.28 1.45 -0.60 5.00 0.00 -1.13 0.22 119.26 123.92 1noi h ALA 364 Ca -0.02 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1noi h ALA 364 Cb 0.53 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1noi h ALA 364 CO 0.04 0.16 0.06 2.35 0.00 0.00 0.00 179.25 181.86 1noi h TRP 365 N 0.92 1.08 -0.19 0.00 2.91 -1.27 0.71 115.95 120.11 1noi h TRP 365 Ca 0.48 -0.16 0.00 0.00 1.13 0.00 0.00 58.89 60.35 1noi h TRP 365 Cb 0.51 -0.29 -0.01 0.00 -0.51 0.00 0.00 29.16 28.86 1noi h TRP 365 CO -0.02 0.93 0.12 1.49 -1.03 0.00 0.00 178.44 179.94 1noi h GLU 366 N 0.94 0.26 -0.42 2.65 4.81 -0.88 -1.52 114.58 120.42 1noi h GLU 366 Ca 0.18 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1noi h GLU 366 Cb 0.47 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 1noi h GLU 366 CO 0.02 0.19 0.27 0.28 -0.73 0.00 0.00 179.01 179.04 1noi h VAL 367 N 0.25 1.12 0.04 0.32 2.07 -0.98 -2.66 116.25 116.41 1noi h VAL 367 Ca 0.07 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 1noi h VAL 367 Cb -0.01 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1noi h VAL 367 CO -0.01 0.12 -0.02 0.74 0.02 0.00 0.00 177.57 178.41 1noi h THR 368 N 0.57 1.02 0.00 2.57 2.02 -0.15 -2.02 112.91 116.92 1noi h THR 368 Ca 0.15 -0.18 -0.12 0.00 0.77 0.00 0.00 66.41 67.03 1noi h THR 368 Cb -0.04 1.14 -0.02 0.00 -1.74 0.00 0.00 68.15 67.49 1noi h THR 368 CO -0.03 0.05 -0.59 -0.37 0.37 0.00 0.00 175.52 174.95 1noi h VAL 369 N -0.13 1.24 0.00 3.16 -1.51 -1.27 -0.50 116.25 117.24 1noi h VAL 369 Ca -0.01 -2.14 -0.03 0.00 -1.23 0.00 0.00 66.70 63.30 1noi h VAL 369 Cb 0.12 2.22 -0.00 0.00 -2.13 0.00 0.00 31.29 31.49 1noi h VAL 369 CO 0.01 0.57 -0.13 0.11 -1.23 0.00 0.00 177.57 176.90 1noi h LYS 370 N 0.00 0.00 0.11 5.19 1.57 -1.38 -2.31 116.57 119.75 1noi h LYS 370 Ca -0.01 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.53 1noi h LYS 370 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 1noi h LYS 370 CO 0.08 0.13 -1.22 1.15 -0.57 0.00 0.00 179.45 179.02 1noi h THR 371 N 0.00 1.17 -3.05 -0.16 2.02 -0.50 -3.47 112.91 108.92 1noi h THR 371 Ca -0.00 -2.43 -0.60 0.00 0.77 0.00 0.00 66.41 64.15 1noi h THR 371 Cb 0.56 2.83 -0.05 0.00 -1.74 0.00 0.00 68.15 69.75 1noi h THR 371 CO 0.02 0.69 -0.28 0.00 0.37 0.00 0.00 175.52 176.32 1noi s ALA 373 N -1.35 0.50 -0.06 0.00 0.00 -0.64 -1.67 121.76 118.55 1noi s ALA 373 Ca 0.31 -0.72 0.06 0.00 0.00 0.00 0.00 51.96 51.60 1noi s ALA 373 Cb -0.14 0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.03 1noi s ALA 373 CO 0.17 -0.04 -0.25 -0.47 0.00 0.00 0.00 175.76 175.18 1noi s TYR 374 N -1.35 2.41 -0.18 0.00 5.04 -0.76 -0.99 117.35 121.51 1noi s TYR 374 Ca -0.10 -0.74 -0.02 0.00 -2.44 0.00 0.00 57.07 53.77 1noi s TYR 374 Cb -0.10 -1.58 -0.00 0.00 0.35 0.00 0.00 41.96 40.63 1noi s TYR 374 CO 0.00 -0.23 -0.11 0.99 -1.34 0.00 0.00 175.55 174.86 1noi s THR 375 N -0.12 2.94 -0.07 4.34 2.01 -0.39 -0.68 115.64 123.66 1noi s THR 375 Ca -0.05 -0.66 -0.15 0.00 0.31 0.00 0.00 61.69 61.15 1noi s THR 375 Cb -0.14 -2.29 -0.05 0.00 0.01 0.00 0.00 72.50 70.04 1noi s THR 375 CO 0.04 0.48 0.39 0.21 -0.69 0.00 0.00 174.62 175.05 1noi s ASN 376 N 1.12 6.68 0.00 3.53 3.84 -0.47 -0.14 114.94 129.50 1noi s ASN 376 Ca 0.01 0.80 0.01 0.00 0.21 0.00 0.00 52.86 53.89 1noi s ASN 376 Cb -0.14 -2.23 0.00 0.00 -0.55 0.00 0.00 41.25 38.32 1noi s ASN 376 CO -0.03 0.20 0.43 1.41 -2.79 0.00 0.00 177.10 176.32 1noi n HIS 377 N 2.66 0.00 -3.58 0.43 8.25 -1.26 -4.43 115.22 117.29 1noi n HIS 377 Ca -0.12 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.20 1noi n HIS 377 Cb 0.52 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.57 1noi n HIS 377 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1noi s THR 378 N -0.25 0.00 0.75 1.59 2.01 -1.26 -4.65 115.64 113.84 1noi s THR 378 Ca 0.01 0.00 -0.13 0.00 0.31 0.00 0.00 61.69 61.88 1noi s THR 378 Cb 0.01 -1.00 0.19 0.00 0.01 0.00 0.00 72.50 71.70 1noi s THR 378 CO 0.01 0.00 0.67 1.33 -0.69 0.00 0.00 174.62 175.94 1noi n VAL 379 N 1.53 0.00 -2.06 3.82 0.24 -1.26 -4.95 118.33 115.65 1noi n VAL 379 Ca -0.15 -0.29 0.00 0.00 -2.04 0.00 0.00 64.34 61.86 1noi n VAL 379 Cb 0.56 -1.14 0.00 0.00 -1.47 0.00 0.00 33.84 31.80 1noi n VAL 379 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1noi n ILE 380 N -3.95 -5.20 0.10 1.34 5.41 -1.26 -4.56 119.36 111.23 1noi n ILE 380 Ca 0.09 1.25 0.00 0.00 1.00 0.00 0.00 62.75 65.09 1noi n ILE 380 Cb 0.36 -3.11 0.00 0.00 -0.71 0.00 0.00 39.64 36.18 1noi n ILE 380 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1noi n PRO 381 N 1.90 0.06 -0.00 0.38 -0.02 -1.26 -2.42 135.00 133.63 1noi n PRO 381 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1noi n PRO 381 Cb 0.00 -1.01 -0.01 0.00 -0.02 0.00 0.00 33.50 32.47 1noi n PRO 381 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1noi n GLU 382 N -0.25 1.71 0.00 -0.52 4.71 -1.26 -4.68 120.64 120.35 1noi n GLU 382 Ca 0.00 -0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1noi n GLU 382 Cb 0.00 -1.02 0.01 0.00 -1.01 0.00 0.00 31.44 29.43 1noi n GLU 382 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1noi n ALA 383 N -1.74 1.23 -2.30 0.62 0.00 -1.01 -4.71 120.51 112.60 1noi n ALA 383 Ca -0.01 -0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.06 1noi n ALA 383 Cb 0.24 -1.01 -0.06 0.00 0.00 0.00 0.00 19.45 18.62 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 -2.59 4.46 0.22 0.00 1.02 -1.26 -4.98 118.68 115.54 1noi s LEU 384 Ca 0.01 1.20 -0.32 0.00 0.02 0.00 0.00 54.13 55.04 1noi s LEU 384 Cb 0.00 -3.04 -0.12 0.00 0.02 0.00 0.00 46.19 43.05 1noi s LEU 384 CO 0.01 0.21 1.67 -0.62 0.02 0.00 0.00 176.35 177.63 1noi n GLU 385 N 1.38 2.64 -4.60 1.70 1.02 -1.26 -4.91 120.64 116.61 1noi n GLU 385 Ca -0.08 0.95 -0.28 0.00 -0.02 0.00 0.00 57.16 57.72 1noi n GLU 385 Cb 0.51 -2.77 -0.17 0.00 -0.02 0.00 0.00 31.44 29.00 1noi n GLU 385 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1noi s ARG 386 N 0.76 2.26 -0.17 3.49 0.52 -1.26 -0.85 118.95 123.71 1noi s ARG 386 Ca 0.73 -0.59 -0.02 0.00 -0.52 0.00 0.00 55.73 55.34 1noi s ARG 386 Cb -0.54 -1.87 -0.01 0.00 0.52 0.00 0.00 34.95 33.05 1noi s ARG 386 CO 0.37 -0.01 -0.09 -1.58 0.02 0.00 0.00 175.30 174.01 1noi s TRP 387 N 0.83 2.89 0.08 -0.53 0.52 -0.28 -4.85 118.94 117.61 1noi s TRP 387 Ca -0.10 -0.73 -0.36 0.00 0.02 0.00 0.00 56.10 54.94 1noi s TRP 387 Cb -0.16 -1.95 -0.18 0.00 -1.15 0.00 0.00 33.47 30.03 1noi s TRP 387 CO 0.01 -0.32 1.02 -2.30 0.02 0.00 0.00 176.95 175.38 1noi n PRO 388 N 3.99 0.38 0.31 4.98 -0.02 -1.26 -0.92 135.00 142.45 1noi n PRO 388 Ca -0.18 0.13 0.18 0.00 -2.02 0.00 0.00 63.50 61.62 1noi n PRO 388 Cb 0.52 -1.56 0.98 0.00 -0.02 0.00 0.00 33.50 33.42 1noi n PRO 388 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 1noi h VAL 389 N 2.60 0.23 0.00 -1.45 -1.51 -1.39 -2.50 116.25 112.23 1noi h VAL 389 Ca -0.45 -0.19 -0.14 0.00 -1.23 0.00 0.00 66.70 64.70 1noi h VAL 389 Cb 1.40 1.14 -0.02 0.00 -2.13 0.00 0.00 31.29 31.69 1noi h VAL 389 CO 0.66 0.03 -0.66 1.12 -1.23 0.00 0.00 177.57 177.49 1noi h HIS 390 N 0.00 0.00 0.15 5.19 2.07 -1.89 -0.92 115.15 119.74 1noi h HIS 390 Ca -0.00 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.51 1noi h HIS 390 Cb 0.14 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.12 1noi h HIS 390 CO 0.00 0.66 -0.07 -0.07 -3.07 0.00 0.00 177.93 175.38 1noi h LEU 391 N 0.00 -0.16 -0.90 6.12 3.38 -1.82 -2.39 115.31 119.53 1noi h LEU 391 Ca -0.01 -0.29 0.08 0.00 0.09 0.00 0.00 57.88 57.75 1noi h LEU 391 Cb 1.32 0.04 -0.07 0.00 0.09 0.00 0.00 40.66 42.05 1noi h LEU 391 CO 0.09 0.23 0.56 0.25 0.09 0.00 0.00 178.44 179.65 1noi h LEU 392 N -0.58 0.86 -0.85 1.67 5.85 -1.49 -1.73 115.31 119.04 1noi h LEU 392 Ca -0.02 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.75 1noi h LEU 392 Cb 0.45 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 1noi h LEU 392 CO 0.03 0.53 0.55 -0.08 -0.34 0.00 0.00 178.44 179.13 1noi h GLU 393 N 0.99 1.04 0.08 1.25 4.81 -1.08 0.11 114.58 121.78 1noi h GLU 393 Ca 0.41 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.57 1noi h GLU 393 Cb 0.25 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.39 1noi h GLU 393 CO -0.20 0.69 -0.04 1.15 -0.73 0.00 0.00 179.01 179.88 1noi h THR 394 N 1.07 1.16 0.00 0.32 2.02 -0.81 -3.29 112.91 113.39 1noi h THR 394 Ca 0.33 -1.36 0.00 0.00 0.77 0.00 0.00 66.41 66.15 1noi h THR 394 Cb -0.01 1.97 0.00 0.00 -1.74 0.00 0.00 68.15 68.37 1noi h THR 394 CO -0.11 0.31 -1.45 0.00 0.37 0.00 0.00 175.52 174.64 1noi n LEU 395 N -4.84 0.48 -2.82 2.58 -0.00 -0.84 -4.34 117.00 107.22 1noi n LEU 395 Ca -0.08 -0.16 -0.21 0.00 -0.00 0.00 0.00 56.01 55.56 1noi n LEU 395 Cb 0.29 -0.02 -0.01 0.00 -0.00 0.00 0.00 43.42 43.68 1noi n LEU 395 CO 0.29 0.09 0.01 0.18 -0.00 0.00 0.00 177.39 177.95 1noi n LEU 396 N -1.96 2.99 -0.12 1.47 4.32 0.02 -0.94 117.00 122.78 1noi n LEU 396 Ca -0.00 -4.97 0.14 0.00 -0.02 0.00 0.00 56.01 51.16 1noi n LEU 396 Cb 0.46 -0.01 0.52 0.00 -1.62 0.00 0.00 43.42 42.78 1noi n LEU 396 CO 0.44 2.14 1.20 1.55 -1.22 0.00 0.00 177.39 181.49 1noi h PRO 397 N 2.89 0.37 -0.00 3.23 0.13 -1.61 -0.84 132.00 136.16 1noi h PRO 397 Ca 0.12 -0.02 -0.18 0.00 -0.87 0.00 0.00 66.00 65.04 1noi h PRO 397 Cb 0.87 -0.08 -0.02 0.00 0.13 0.00 0.00 31.00 31.90 1noi h PRO 397 CO 0.68 0.24 -0.82 -0.09 -0.23 0.00 0.00 178.00 177.79 1noi h ARG 398 N 0.38 0.11 0.03 0.86 9.65 -1.91 -3.01 114.38 120.49 1noi h ARG 398 Ca 0.32 -0.12 -0.23 0.00 -1.10 0.00 0.00 59.98 58.85 1noi h ARG 398 Cb 0.74 0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 29.35 1noi h ARG 398 CO -0.09 0.86 -1.00 0.45 2.80 0.00 0.00 179.97 182.99 1noi h HIS 399 N 0.07 0.48 -0.45 2.20 3.86 -1.54 -0.95 115.15 118.82 1noi h HIS 399 Ca -0.03 -0.29 -0.01 0.00 -1.16 0.00 0.00 60.37 58.89 1noi h HIS 399 Cb 1.42 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 29.83 1noi h HIS 399 CO 0.02 1.13 0.24 -0.07 0.86 0.00 0.00 177.93 180.11 1noi h LEU 400 N 0.15 0.55 0.58 2.43 3.38 -1.32 -1.58 115.31 119.50 1noi h LEU 400 Ca -0.08 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 1noi h LEU 400 Cb 1.66 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.27 1noi h LEU 400 CO 0.17 0.45 -0.39 1.56 0.09 0.00 0.00 178.44 180.32 1noi h GLN 401 N 0.63 -0.90 -0.84 1.13 4.20 -1.37 -1.03 115.11 116.93 1noi h GLN 401 Ca 0.16 0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.94 1noi h GLN 401 Cb 0.03 0.20 -0.04 0.00 0.30 0.00 0.00 27.48 27.97 1noi h GLN 401 CO -0.03 -0.60 0.53 0.82 -0.67 0.00 0.00 178.83 178.89 1noi h ILE 402 N -0.93 1.23 -0.23 2.54 2.04 -0.98 -2.12 117.51 119.06 1noi h ILE 402 Ca -0.07 -0.45 0.03 0.00 1.00 0.00 0.00 64.86 65.37 1noi h ILE 402 Cb 0.77 0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 1noi h ILE 402 CO 0.05 0.23 0.04 0.40 0.00 0.00 0.00 178.15 178.87 1noi h ILE 403 N 1.15 0.90 -0.80 -0.67 2.04 -1.23 -0.60 117.51 118.31 1noi h ILE 403 Ca 0.31 -0.05 0.06 0.00 1.00 0.00 0.00 64.86 66.18 1noi h ILE 403 Cb -0.09 0.75 -0.05 0.00 -0.74 0.00 0.00 36.82 36.69 1noi h ILE 403 CO -0.06 0.02 0.52 1.88 0.00 0.00 0.00 178.15 180.51 1noi h TYR 404 N 0.13 0.89 -0.13 1.37 0.05 -0.87 0.60 116.97 119.01 1noi h TYR 404 Ca 0.10 0.02 -0.12 0.00 0.05 0.00 0.00 58.73 58.78 1noi h TYR 404 Cb 0.10 -0.29 0.00 0.00 1.01 0.00 0.00 36.73 37.55 1noi h TYR 404 CO -0.15 0.48 -0.40 1.49 -1.05 0.00 0.00 178.16 178.53 1noi h GLU 405 N 0.88 0.51 -0.90 4.88 4.57 -0.65 0.11 114.58 123.98 1noi h GLU 405 Ca 0.34 -0.37 0.13 0.00 -1.18 0.00 0.00 59.36 58.28 1noi h GLU 405 Cb 0.20 0.06 -0.09 0.00 -0.16 0.00 0.00 28.75 28.77 1noi h GLU 405 CO -0.12 0.99 0.51 0.82 -1.18 0.00 0.00 179.01 180.03 1noi h ILE 406 N 0.12 0.82 -0.02 2.32 2.04 -0.42 -0.12 117.51 122.26 1noi h ILE 406 Ca -0.01 -0.27 -0.01 0.00 1.00 0.00 0.00 64.86 65.58 1noi h ILE 406 Cb 1.02 -0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1noi h ILE 406 CO 0.09 0.14 -0.01 -1.13 0.00 0.00 0.00 178.15 177.24 1noi h ASN 407 N 0.77 0.04 -0.33 1.72 -1.24 -0.69 0.14 115.58 115.99 1noi h ASN 407 Ca 0.47 -0.42 0.07 0.00 0.71 0.00 0.00 56.30 57.13 1noi h ASN 407 Cb 0.56 -0.01 -0.08 0.00 0.73 0.00 0.00 38.32 39.53 1noi h ASN 407 CO -0.31 0.45 -0.18 -0.61 -1.29 0.00 0.00 177.43 175.49 1noi h GLN 408 N -0.37 -0.12 -0.06 6.67 4.15 0.09 -1.40 115.11 124.06 1noi h GLN 408 Ca 0.00 0.01 -0.12 0.00 0.77 0.00 0.00 58.65 59.31 1noi h GLN 408 Cb 0.44 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.14 1noi h GLN 408 CO 0.00 -0.08 -0.51 0.00 -1.93 0.00 0.00 178.83 176.31 1noi h ARG 409 N -0.13 0.17 -0.08 1.69 3.08 -0.86 -2.49 114.38 115.76 1noi h ARG 409 Ca 0.17 -0.10 -0.06 0.00 0.07 0.00 0.00 59.98 60.06 1noi h ARG 409 Cb 0.39 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1noi h ARG 409 CO -0.41 0.64 -0.19 0.35 -1.07 0.00 0.00 179.97 179.28 1noi h PHE 410 N 0.14 0.35 0.00 3.04 3.57 -0.02 -3.02 116.94 121.00 1noi h PHE 410 Ca 0.00 -0.13 -0.02 0.00 3.53 0.00 0.00 57.97 61.35 1noi h PHE 410 Cb 0.94 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.62 1noi h PHE 410 CO 0.01 0.80 -0.10 -0.07 -2.23 0.00 0.00 178.31 176.73 1noi h LEU 411 N -0.20 0.00 -0.74 0.59 3.38 -1.25 0.33 115.31 117.41 1noi h LEU 411 Ca -0.00 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 1noi h LEU 411 Cb 0.80 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.53 1noi h LEU 411 CO 0.04 0.10 -0.62 0.78 0.09 0.00 0.00 178.44 178.84 1noi h ASN 412 N 0.00 0.00 -0.45 -0.43 -0.26 -1.36 -1.91 115.58 111.17 1noi h ASN 412 Ca -0.00 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 55.71 1noi h ASN 412 Cb 0.25 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.49 1noi h ASN 412 CO 0.01 0.62 0.18 0.03 -1.06 0.00 0.00 177.43 177.22 1noi h ARG 413 N 0.00 0.67 -0.79 0.81 3.08 -0.25 -1.63 114.38 116.26 1noi h ARG 413 Ca -0.01 -0.12 -0.05 0.00 0.07 0.00 0.00 59.98 59.88 1noi h ARG 413 Cb 1.11 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 31.01 1noi h ARG 413 CO 0.08 0.61 0.31 0.28 -1.07 0.00 0.00 179.97 180.18 1noi h VAL 414 N 0.58 1.26 -0.92 2.04 2.07 -1.25 -1.16 116.25 118.88 1noi h VAL 414 Ca 0.15 -0.83 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 1noi h VAL 414 Cb 0.19 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 1noi h VAL 414 CO -0.01 0.34 0.52 0.00 0.02 0.00 0.00 177.57 178.43 1noi h ALA 415 N 1.18 1.18 -0.24 1.67 0.00 -1.17 0.68 119.26 122.55 1noi h ALA 415 Ca 0.26 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1noi h ALA 415 Cb 0.22 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1noi h ALA 415 CO -0.02 0.67 0.13 0.00 0.00 0.00 0.00 179.25 180.03 1noi h ALA 416 N 1.28 0.31 -0.13 0.00 0.00 -0.56 -2.92 119.26 117.24 1noi h ALA 416 Ca 0.32 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 55.07 1noi h ALA 416 Cb 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1noi h ALA 416 CO -0.05 -0.15 -0.29 0.00 0.00 0.00 0.00 179.25 178.75 1noi h ALA 417 N 1.00 0.22 -2.45 0.00 0.00 -1.09 -3.39 119.26 113.55 1noi h ALA 417 Ca 0.08 -0.41 -0.60 0.00 0.00 0.00 0.00 54.91 53.98 1noi h ALA 417 Cb 0.08 -0.03 -0.42 0.00 0.00 0.00 0.00 17.79 17.43 1noi h ALA 417 CO -0.01 0.24 -0.65 1.19 0.00 0.00 0.00 179.25 180.01 1noi n PHE 418 N -4.40 2.98 -1.73 0.00 3.72 0.22 -5.10 117.46 113.15 1noi n PHE 418 Ca -0.07 -4.12 -0.42 0.00 -0.05 0.00 0.00 57.45 52.79 1noi n PHE 418 Cb 0.47 -0.52 -0.02 0.00 -0.94 0.00 0.00 39.48 38.47 1noi n PHE 418 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1noi n PRO 419 N 1.32 2.64 -0.54 -1.08 -0.02 -1.10 -3.20 135.00 133.01 1noi n PRO 419 Ca 0.26 0.94 0.00 0.00 -2.02 0.00 0.00 63.50 62.69 1noi n PRO 419 Cb 0.41 -2.74 0.00 0.00 -0.02 0.00 0.00 33.50 31.15 1noi n PRO 419 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1noi n GLY 420 N 2.85 0.97 3.36 -1.23 0.00 -1.26 -4.89 105.19 104.99 1noi n GLY 420 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1noi n GLY 420 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1noi s ASP 421 N -2.78 5.80 0.20 1.61 -4.77 -1.20 -4.92 116.67 110.60 1noi s ASP 421 Ca 0.00 -1.13 0.02 0.00 -3.30 0.00 0.00 52.55 48.14 1noi s ASP 421 Cb 0.00 -2.05 0.11 0.00 -1.09 0.00 0.00 42.92 39.90 1noi s ASP 421 CO 0.00 -0.45 1.46 0.58 0.70 0.00 0.00 175.17 177.46 1noi h VAL 422 N 5.88 1.42 0.00 2.11 2.07 -1.90 -3.24 116.25 122.60 1noi h VAL 422 Ca -0.25 -2.25 -0.02 0.00 0.82 0.00 0.00 66.70 65.01 1noi h VAL 422 Cb 1.10 2.19 -0.00 0.00 -1.52 0.00 0.00 31.29 33.06 1noi h VAL 422 CO 0.72 0.66 -0.08 -0.78 0.02 0.00 0.00 177.57 178.11 1noi h ASP 423 N 0.17 0.00 0.81 0.57 1.82 -2.00 -2.41 116.42 115.39 1noi h ASP 423 Ca -0.03 0.00 -0.22 0.00 -0.39 0.00 0.00 57.03 56.40 1noi h ASP 423 Cb 1.30 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.29 1noi h ASP 423 CO 0.12 0.08 -1.00 0.08 -1.61 0.00 0.00 179.24 176.90 1noi h ARG 424 N 0.00 0.10 -0.73 0.28 0.11 -1.98 -1.86 114.38 110.30 1noi h ARG 424 Ca -0.00 -0.14 0.09 0.00 0.10 0.00 0.00 59.98 60.02 1noi h ARG 424 Cb 0.21 0.05 -0.07 0.00 1.11 0.00 0.00 29.97 31.27 1noi h ARG 424 CO 0.01 1.01 0.38 -0.07 0.10 0.00 0.00 179.97 181.41 1noi h LEU 425 N 0.04 0.53 0.00 0.08 3.38 -1.53 -0.32 115.31 117.49 1noi h LEU 425 Ca -0.04 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1noi h LEU 425 Cb 1.71 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.42 1noi h LEU 425 CO 0.14 0.31 -0.15 0.08 0.09 0.00 0.00 178.44 178.91 1noi h ARG 426 N 0.66 0.00 0.02 1.13 -0.00 -1.48 -2.05 114.38 112.66 1noi h ARG 426 Ca 0.35 0.00 -0.21 0.00 -0.00 0.00 0.00 59.98 60.13 1noi h ARG 426 Cb 0.34 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.29 1noi h ARG 426 CO -0.25 0.00 -0.94 0.00 -0.00 0.00 0.00 179.97 178.78 1noi h ARG 427 N 0.00 0.15 0.06 0.08 3.08 -0.84 -3.35 114.38 113.56 1noi h ARG 427 Ca 0.00 -0.19 -0.25 0.00 0.07 0.00 0.00 59.98 59.61 1noi h ARG 427 Cb 0.97 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 31.06 1noi h ARG 427 CO 0.00 0.98 -1.20 0.52 -1.07 0.00 0.00 179.97 179.20 1noi h MET 428 N 0.07 0.13 -3.25 0.04 2.86 -0.98 -3.48 114.93 110.32 1noi h MET 428 Ca -0.05 -0.23 -0.41 0.00 -2.06 0.00 0.00 59.70 56.96 1noi h MET 428 Cb 1.60 0.09 0.04 0.00 0.06 0.00 0.00 31.60 33.38 1noi h MET 428 CO 0.14 1.07 -0.06 0.45 1.06 0.00 0.00 176.91 179.57 1noi n SER 429 N -3.41 -0.20 0.21 1.22 2.88 -0.78 -4.89 113.62 108.65 1noi n SER 429 Ca -0.06 0.62 0.07 0.00 -1.33 0.00 0.00 58.87 58.17 1noi n SER 429 Cb 0.99 -0.50 0.47 0.00 -0.75 0.00 0.00 64.21 64.42 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 1.31 0.00 -8.58 2.46 3.38 -1.92 -3.43 115.31 108.54 1noi h LEU 430 Ca -0.24 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 57.09 1noi h LEU 430 Cb 0.78 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.38 1noi h LEU 430 CO 0.34 0.28 0.26 -0.69 0.09 0.00 0.00 178.44 178.72 1noi s VAL 431 N -3.96 4.71 0.02 1.22 1.01 -1.26 0.01 120.40 122.15 1noi s VAL 431 Ca -0.02 0.20 -0.16 0.00 0.00 0.00 0.00 61.98 62.01 1noi s VAL 431 Cb 0.13 -4.30 -0.06 0.00 0.00 0.00 0.00 36.38 32.15 1noi s VAL 431 CO 0.66 -0.72 0.44 -1.61 0.00 0.00 0.00 175.10 173.87 1noi s GLU 432 N 3.12 3.98 0.26 2.72 2.02 0.71 -4.92 118.70 126.59 1noi s GLU 432 Ca 0.26 0.48 0.07 0.00 0.02 0.00 0.00 54.97 55.80 1noi s GLU 432 Cb -0.14 -3.22 -0.03 0.00 0.10 0.00 0.00 34.13 30.84 1noi s GLU 432 CO 0.20 0.68 0.23 -1.21 0.02 0.00 0.00 175.26 175.18 1noi s GLU 433 N -1.09 3.00 0.00 1.61 0.41 -1.26 -1.48 118.70 119.89 1noi s GLU 433 Ca 0.25 -1.02 0.00 0.00 -0.41 0.00 0.00 54.97 53.79 1noi s GLU 433 Cb -0.17 -2.62 0.00 0.00 -1.78 0.00 0.00 34.13 29.56 1noi s GLU 433 CO 0.15 0.39 0.00 0.41 -0.49 0.00 0.00 175.26 175.71 1noi n GLY 434 N -1.23 -0.09 3.49 -1.39 0.00 -1.26 -4.94 105.19 99.76 1noi n GLY 434 Ca -0.08 -0.95 -0.43 0.00 0.00 0.00 0.00 46.02 44.57 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 3.05 0.00 4.61 0.00 -1.26 -4.25 121.76 122.92 1noi s ALA 435 Ca 0.00 -2.13 0.00 0.00 0.00 0.00 0.00 51.96 49.83 1noi s ALA 435 Cb 0.00 -4.11 0.00 0.00 0.00 0.00 0.00 23.12 19.01 1noi s ALA 435 CO 0.00 -3.08 0.00 1.55 0.00 0.00 0.00 175.76 174.23 1noi n VAL 436 N 6.06 -0.91 -2.63 0.00 3.14 -1.26 -5.03 118.33 117.71 1noi n VAL 436 Ca 0.13 0.00 -0.36 0.00 -2.96 0.00 0.00 64.34 61.15 1noi n VAL 436 Cb 0.48 -0.95 -0.05 0.00 -1.06 0.00 0.00 33.84 32.26 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 -2.85 4.26 0.08 1.45 2.20 -1.26 -4.77 119.74 118.85 1noi s LYS 437 Ca 0.00 1.42 0.00 0.00 -0.36 0.00 0.00 55.97 57.04 1noi s LYS 437 Cb 0.00 -2.56 -0.04 0.00 -1.51 0.00 0.00 37.83 33.72 1noi s LYS 437 CO 0.00 -0.03 -0.04 1.03 -0.36 0.00 0.00 175.35 175.94 1noi s ARG 438 N -2.48 0.76 -0.22 4.03 0.52 -0.55 -0.99 118.95 120.03 1noi s ARG 438 Ca 0.57 -1.30 -0.08 0.00 -0.52 0.00 0.00 55.73 54.40 1noi s ARG 438 Cb -0.20 -0.01 -0.04 0.00 0.52 0.00 0.00 34.95 35.22 1noi s ARG 438 CO 0.25 -0.07 0.08 0.42 0.02 0.00 0.00 175.30 176.00 1noi s ILE 439 N -3.77 4.71 -0.48 1.52 -1.09 -0.10 -0.20 121.20 121.79 1noi s ILE 439 Ca 0.11 -0.05 -0.26 0.00 -2.23 0.00 0.00 60.65 58.22 1noi s ILE 439 Cb 0.07 -3.16 0.03 0.00 -1.58 0.00 0.00 42.46 37.81 1noi s ILE 439 CO -0.06 0.39 0.97 0.21 -1.23 0.00 0.00 174.94 175.22 1noi s ASN 440 N 0.95 6.49 0.38 3.58 3.84 0.10 -1.13 114.94 129.15 1noi s ASN 440 Ca 0.04 0.10 0.18 0.00 0.21 0.00 0.00 52.86 53.40 1noi s ASN 440 Cb -0.14 -2.47 0.72 0.00 -0.55 0.00 0.00 41.25 38.82 1noi s ASN 440 CO 0.03 -1.13 1.76 0.24 -2.79 0.00 0.00 177.10 175.21 1noi h MET 441 N 9.16 0.00 -0.38 0.43 2.86 -1.30 -2.60 114.93 123.10 1noi h MET 441 Ca -0.24 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.31 1noi h MET 441 Cb 1.07 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.71 1noi h MET 441 CO 1.06 0.37 -0.13 0.00 1.06 0.00 0.00 176.91 179.27 1noi h ALA 442 N 1.63 1.06 -0.26 6.32 0.00 -1.92 -0.74 119.26 125.35 1noi h ALA 442 Ca -0.00 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 1noi h ALA 442 Cb 0.84 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1noi h ALA 442 CO 0.05 0.57 -0.03 0.45 0.00 0.00 0.00 179.25 180.29 1noi h HIS 443 N 0.61 0.52 -0.54 0.00 3.86 -1.86 -1.61 115.15 116.14 1noi h HIS 443 Ca 0.10 -0.10 0.11 0.00 -1.16 0.00 0.00 60.37 59.32 1noi h HIS 443 Cb 0.58 -0.13 -0.10 0.00 1.06 0.00 0.00 27.41 28.82 1noi h HIS 443 CO 0.03 0.66 -0.07 1.25 0.86 0.00 0.00 177.93 180.66 1noi h LEU 444 N 0.23 -0.38 -0.97 2.43 6.46 -1.20 -1.86 115.31 120.02 1noi h LEU 444 Ca 0.07 0.15 -0.00 0.00 -0.12 0.00 0.00 57.88 57.97 1noi h LEU 444 Cb 0.48 0.29 -0.05 0.00 -0.73 0.00 0.00 40.66 40.65 1noi h LEU 444 CO 0.02 -0.14 0.58 0.00 -0.62 0.00 0.00 178.44 178.28 1noi h ILE 446 N 1.31 1.46 -0.77 0.00 2.04 -0.75 -2.70 117.51 118.11 1noi h ILE 446 Ca 0.34 -1.80 0.03 0.00 1.00 0.00 0.00 64.86 64.42 1noi h ILE 446 Cb -0.07 2.48 -0.04 0.00 -0.74 0.00 0.00 36.82 38.45 1noi h ILE 446 CO -0.07 0.51 0.51 0.00 0.00 0.00 0.00 178.15 179.10 1noi h ALA 447 N 0.37 1.51 -0.64 1.87 0.00 -1.24 -2.79 119.26 118.33 1noi h ALA 447 Ca -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1noi h ALA 447 Cb 0.99 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1noi h ALA 447 CO 0.06 0.42 0.00 0.41 0.00 0.00 0.00 179.25 180.15 1noi n GLY 448 N -1.42 2.40 3.44 0.00 0.00 -0.77 -4.96 105.19 103.88 1noi n GLY 448 Ca 0.09 -0.77 -0.29 0.00 0.00 0.00 0.00 46.02 45.04 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 -0.92 3.65 0.00 1.61 0.01 -1.02 -4.14 113.70 112.89 1noi s SER 449 Ca 0.47 -0.62 0.25 0.00 1.31 0.00 0.00 55.95 57.36 1noi s SER 449 Cb 0.28 -0.42 0.45 0.00 0.21 0.00 0.00 66.02 66.54 1noi s SER 449 CO 0.26 0.19 1.38 0.00 0.41 0.00 0.00 173.24 175.48 1noi n HIS 450 N 0.94 0.00 -3.78 2.43 -0.00 -0.67 -4.82 115.22 109.33 1noi n HIS 450 Ca -0.17 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.43 1noi n HIS 450 Cb 0.53 -0.22 -0.11 0.00 -0.00 0.00 0.00 29.99 30.19 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 -2.97 -0.71 0.02 1.59 0.00 -1.26 -4.70 121.76 113.74 1noi s ALA 451 Ca 0.12 0.71 0.08 0.00 0.00 0.00 0.00 51.96 52.87 1noi s ALA 451 Cb 0.17 -0.38 -0.02 0.00 0.00 0.00 0.00 23.12 22.89 1noi s ALA 451 CO 0.70 -0.16 -0.25 0.08 0.00 0.00 0.00 175.76 176.14 1noi s VAL 452 N -0.10 2.01 0.03 0.00 1.01 -0.22 -1.83 120.40 121.29 1noi s VAL 452 Ca -0.02 -1.24 -0.05 0.00 0.00 0.00 0.00 61.98 60.67 1noi s VAL 452 Cb -0.03 -1.70 -0.01 0.00 0.00 0.00 0.00 36.38 34.64 1noi s VAL 452 CO 0.01 0.42 0.09 0.54 0.00 0.00 0.00 175.10 176.16 1noi s ASN 453 N -0.97 0.18 0.57 3.32 4.22 0.14 -0.98 114.94 121.41 1noi s ASN 453 Ca 0.10 -0.52 0.08 0.00 -2.14 0.00 0.00 52.86 50.38 1noi s ASN 453 Cb -0.10 0.22 0.07 0.00 1.28 0.00 0.00 41.25 42.72 1noi s ASN 453 CO 0.01 -0.49 0.64 -0.83 -2.04 0.00 0.00 177.10 174.39 1noi s GLY 454 N -2.06 1.99 -0.02 0.45 0.00 -0.98 -1.37 107.32 105.34 1noi s GLY 454 Ca -0.06 -1.78 0.03 0.00 0.00 0.00 0.00 44.72 42.92 1noi s GLY 454 CO -0.04 -1.80 0.96 1.55 0.00 0.00 0.00 173.10 173.77 1noi n VAL 455 N -2.07 1.00 -3.64 1.40 3.14 -1.26 -1.86 118.33 115.04 1noi n VAL 455 Ca 0.09 -1.07 -0.06 0.00 -2.96 0.00 0.00 64.34 60.34 1noi n VAL 455 Cb 0.63 0.43 -0.07 0.00 -1.06 0.00 0.00 33.84 33.77 1noi n VAL 455 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1noi s ALA 456 N -1.18 -2.11 0.27 1.55 0.00 -1.26 -2.03 121.76 117.00 1noi s ALA 456 Ca 0.06 1.77 -0.01 0.00 0.00 0.00 0.00 51.96 53.77 1noi s ALA 456 Cb 0.05 -1.61 0.61 0.00 0.00 0.00 0.00 23.12 22.17 1noi s ALA 456 CO 0.01 -0.16 1.65 -0.09 0.00 0.00 0.00 175.76 177.16 1noi h ARG 457 N 3.56 0.19 -0.03 0.00 2.43 -1.89 -0.36 114.38 118.28 1noi h ARG 457 Ca -0.27 -0.01 -0.20 0.00 -0.81 0.00 0.00 59.98 58.69 1noi h ARG 457 Cb 1.19 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.69 1noi h ARG 457 CO 0.15 0.12 -0.82 -0.84 -1.51 0.00 0.00 179.97 177.08 1noi h ILE 458 N 0.19 1.42 -0.17 1.20 3.07 -1.89 -2.13 117.51 119.19 1noi h ILE 458 Ca 0.50 -2.34 0.04 0.00 1.55 0.00 0.00 64.86 64.62 1noi h ILE 458 Cb 0.97 2.28 -0.05 0.00 -0.27 0.00 0.00 36.82 39.75 1noi h ILE 458 CO -0.64 0.70 -0.12 -0.74 -1.05 0.00 0.00 178.15 176.29 1noi h HIS 459 N 0.21 -0.30 -0.79 0.16 2.76 -1.40 -0.49 115.15 115.30 1noi h HIS 459 Ca -0.05 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.10 1noi h HIS 459 Cb 1.42 0.16 -0.04 0.00 1.55 0.00 0.00 27.41 30.50 1noi h HIS 459 CO 0.04 -0.18 0.33 0.77 -1.30 0.00 0.00 177.93 177.59 1noi h SER 460 N -0.12 1.07 -0.65 3.26 0.02 -0.95 -1.96 113.55 114.22 1noi h SER 460 Ca 0.10 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1noi h SER 460 Cb 0.28 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.51 1noi h SER 460 CO -0.25 0.94 0.40 -0.33 -1.14 0.00 0.00 176.83 176.45 1noi h GLU 461 N 1.14 0.87 0.00 3.45 4.39 -1.00 -1.18 114.58 122.25 1noi h GLU 461 Ca 0.27 -0.07 -0.07 0.00 0.34 0.00 0.00 59.36 59.82 1noi h GLU 461 Cb 0.19 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 1noi h GLU 461 CO -0.03 0.62 -0.35 -0.84 -1.16 0.00 0.00 179.01 177.25 1noi h ILE 462 N 0.88 0.86 0.00 3.13 3.07 -0.55 -1.63 117.51 123.26 1noi h ILE 462 Ca 0.23 -1.44 -0.00 0.00 1.55 0.00 0.00 64.86 65.20 1noi h ILE 462 Cb -0.04 1.88 0.00 0.00 -0.27 0.00 0.00 36.82 38.39 1noi h ILE 462 CO -0.04 0.35 -0.00 -0.07 -1.05 0.00 0.00 178.15 177.33 1noi h LEU 463 N 0.00 -0.00 -1.22 0.16 3.38 -0.51 0.48 115.31 117.60 1noi h LEU 463 Ca -0.00 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1noi h LEU 463 Cb 0.85 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.58 1noi h LEU 463 CO 0.05 0.04 0.21 0.11 0.09 0.00 0.00 178.44 178.94 1noi h LYS 464 N -0.04 0.75 0.00 1.13 1.57 -0.94 -1.72 116.57 117.32 1noi h LYS 464 Ca -0.00 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1noi h LYS 464 Cb 0.04 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.22 1noi h LYS 464 CO 0.00 0.62 -1.07 1.63 -0.57 0.00 0.00 179.45 180.06 1noi n LYS 465 N -4.34 0.31 0.00 3.15 5.02 -0.65 -3.72 118.16 117.92 1noi n LYS 465 Ca 0.04 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 1noi n LYS 465 Cb 0.16 -1.60 0.00 0.00 -0.02 0.00 0.00 35.03 33.57 1noi n LYS 465 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1noi n THR 466 N -1.99 0.00 -0.31 -0.18 -2.24 0.16 -4.82 114.28 104.91 1noi n THR 466 Ca 0.02 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.87 1noi n THR 466 Cb 0.44 0.00 0.16 0.00 -2.10 0.00 0.00 70.33 68.83 1noi n THR 466 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1noi n ILE 467 N 0.00 -0.36 -1.24 2.28 5.41 -1.25 -0.66 119.36 123.55 1noi n ILE 467 Ca 0.00 1.94 0.06 0.00 1.00 0.00 0.00 62.75 65.76 1noi n ILE 467 Cb 0.00 -2.73 0.19 0.00 -0.71 0.00 0.00 39.64 36.39 1noi n ILE 467 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 1noi n PHE 468 N -5.35 0.37 0.20 1.39 3.72 -0.65 -4.79 117.46 112.34 1noi n PHE 468 Ca 0.16 -1.19 0.04 0.00 -0.05 0.00 0.00 57.45 56.41 1noi n PHE 468 Cb 0.50 -0.26 0.41 0.00 -0.94 0.00 0.00 39.48 39.19 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 0.75 0.00 -0.59 -1.08 2.10 -0.93 0.33 116.57 117.15 1noi h LYS 469 Ca 0.04 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.63 1noi h LYS 469 Cb 1.20 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.51 1noi h LYS 469 CO 0.11 0.32 0.15 -0.44 -2.00 0.00 0.00 179.45 177.59 1noi h ASP 470 N 0.00 0.89 -0.57 7.07 3.32 -1.87 -0.19 116.42 125.07 1noi h ASP 470 Ca -0.00 -0.23 -0.09 0.00 0.02 0.00 0.00 57.03 56.73 1noi h ASP 470 Cb 0.58 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.88 1noi h ASP 470 CO 0.04 0.89 0.02 -0.26 -1.72 0.00 0.00 179.24 178.21 1noi h PHE 471 N 0.85 1.08 -0.48 4.55 0.04 -1.75 -0.09 116.94 121.14 1noi h PHE 471 Ca 0.19 -0.18 -0.04 0.00 2.80 0.00 0.00 57.97 60.74 1noi h PHE 471 Cb 0.34 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.18 1noi h PHE 471 CO 0.02 0.96 0.15 -0.92 -0.60 0.00 0.00 178.31 177.92 1noi h TYR 472 N 0.89 0.78 0.00 -0.55 3.20 -0.70 -1.01 116.97 119.57 1noi h TYR 472 Ca 0.16 -0.08 -0.06 0.00 3.14 0.00 0.00 58.73 61.89 1noi h TYR 472 Cb 0.52 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 1noi h TYR 472 CO 0.04 0.69 -0.29 0.93 -1.64 0.00 0.00 178.16 177.88 1noi h GLU 473 N 0.64 0.00 -0.28 1.82 5.08 -0.43 -2.29 114.58 119.11 1noi h GLU 473 Ca 0.15 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.39 1noi h GLU 473 Cb 0.28 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 1noi h GLU 473 CO -0.00 0.29 -0.29 1.25 -1.00 0.00 0.00 179.01 179.26 1noi h LEU 474 N 0.00 0.75 -6.16 1.33 6.46 -0.37 -3.42 115.31 113.90 1noi h LEU 474 Ca -0.00 -0.47 -0.55 0.00 -0.12 0.00 0.00 57.88 56.73 1noi h LEU 474 Cb 0.55 -0.21 -0.37 0.00 -0.73 0.00 0.00 40.66 39.90 1noi h LEU 474 CO 0.04 1.07 -0.99 -0.62 -0.62 0.00 0.00 178.44 177.32 1noi n GLU 475 N -4.27 0.37 -0.12 1.25 1.02 -0.44 -5.02 120.64 113.44 1noi n GLU 475 Ca -0.04 -3.10 -0.09 0.00 -0.02 0.00 0.00 57.16 53.92 1noi n GLU 475 Cb 0.47 -1.52 -0.01 0.00 -0.02 0.00 0.00 31.44 30.37 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 5.07 0.50 -1.54 3.49 0.11 -1.67 -1.20 132.00 136.76 1noi h PRO 476 Ca 0.19 -0.05 0.45 0.00 0.11 0.00 0.00 66.00 66.70 1noi h PRO 476 Cb 0.91 -0.10 -0.08 0.00 0.11 0.00 0.00 31.00 31.84 1noi h PRO 476 CO 0.38 0.39 1.09 1.12 -0.21 0.00 0.00 178.00 180.77 1noi h HIS 477 N 0.47 0.11 -0.19 0.65 2.07 -1.95 -1.42 115.15 114.89 1noi h HIS 477 Ca 0.13 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.56 1noi h HIS 477 Cb 0.02 -0.03 -0.01 0.00 2.57 0.00 0.00 27.41 29.96 1noi h HIS 477 CO -0.03 -0.03 -0.31 0.87 -3.07 0.00 0.00 177.93 175.36 1noi h LYS 478 N 0.03 0.37 -5.83 5.12 1.57 -1.49 -3.44 116.57 112.91 1noi h LYS 478 Ca 0.77 -0.15 -0.59 0.00 -1.87 0.00 0.00 60.65 58.81 1noi h LYS 478 Cb 2.92 -0.02 -0.08 0.00 0.08 0.00 0.00 32.23 35.13 1noi h LYS 478 CO -0.09 0.64 0.41 -0.06 -0.57 0.00 0.00 179.45 179.79 1noi s PHE 479 N -4.38 3.35 0.48 -1.35 0.40 -0.54 -1.06 117.98 114.89 1noi s PHE 479 Ca -0.06 1.16 0.02 0.00 -0.60 0.00 0.00 56.93 57.45 1noi s PHE 479 Cb 0.14 -3.02 -0.01 0.00 0.51 0.00 0.00 43.02 40.64 1noi s PHE 479 CO 0.78 -0.33 0.08 -0.65 0.70 0.00 0.00 175.22 175.80 1noi s GLN 480 N 2.53 2.11 -0.02 0.44 -0.21 -0.15 -4.98 119.66 119.39 1noi s GLN 480 Ca 0.35 -2.34 0.01 0.00 0.02 0.00 0.00 55.36 53.40 1noi s GLN 480 Cb -0.16 -1.02 0.01 0.00 1.00 0.00 0.00 33.01 32.85 1noi s GLN 480 CO 0.09 -0.48 -0.02 1.21 -2.12 0.00 0.00 175.29 173.97 1noi s ASN 481 N -3.76 0.49 -0.36 5.90 3.84 -1.26 -2.31 114.94 117.48 1noi s ASN 481 Ca 0.12 -0.06 0.01 0.00 0.21 0.00 0.00 52.86 53.14 1noi s ASN 481 Cb 0.01 -0.16 0.15 0.00 -0.55 0.00 0.00 41.25 40.69 1noi s ASN 481 CO 0.08 -0.02 0.29 -0.54 -2.79 0.00 0.00 177.10 174.12 1noi s LYS 482 N 0.44 0.60 0.23 0.43 -0.14 -0.78 -4.94 119.74 115.59 1noi s LYS 482 Ca -0.05 -1.19 -0.32 0.00 -1.36 0.00 0.00 55.97 53.06 1noi s LYS 482 Cb -0.08 -1.07 -0.13 0.00 -1.68 0.00 0.00 37.83 34.88 1noi s LYS 482 CO -0.01 -1.22 1.56 2.41 -0.76 0.00 0.00 175.35 177.34 1noi n THR 483 N 4.05 0.58 -0.99 2.17 -1.04 -1.26 -4.43 114.28 113.35 1noi n THR 483 Ca 0.13 -0.14 -0.34 0.00 -2.04 0.00 0.00 64.05 61.66 1noi n THR 483 Cb 0.41 -1.73 0.12 0.00 -1.82 0.00 0.00 70.33 67.30 1noi n THR 483 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1noi n ASN 484 N 2.79 -0.54 -3.68 8.00 3.02 -0.86 -4.62 115.26 119.37 1noi n ASN 484 Ca 0.13 0.49 -0.24 0.00 -0.03 0.00 0.00 54.58 54.93 1noi n ASN 484 Cb 0.33 -1.34 -0.08 0.00 -0.61 0.00 0.00 39.78 38.08 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 -2.00 2.59 0.00 7.41 0.00 -1.26 -4.82 107.32 109.24 1noi s GLY 485 Ca 0.66 -1.57 0.00 0.00 0.00 0.00 0.00 44.72 43.81 1noi s GLY 485 CO 0.59 -1.67 -0.00 -1.50 0.00 0.00 0.00 173.10 170.51 1noi s ILE 486 N -3.27 0.02 -0.10 0.90 1.10 -0.50 -4.54 121.20 114.81 1noi s ILE 486 Ca 0.30 -0.04 -0.24 0.00 -0.51 0.00 0.00 60.65 60.17 1noi s ILE 486 Cb 0.01 -0.03 -0.03 0.00 0.15 0.00 0.00 42.46 42.56 1noi s ILE 486 CO 0.22 -0.02 0.73 0.28 -2.11 0.00 0.00 174.94 174.04 1noi s THR 487 N -0.06 5.00 -2.00 4.00 -1.32 -1.26 0.14 115.64 120.15 1noi s THR 487 Ca -0.01 1.47 0.17 0.00 -1.21 0.00 0.00 61.69 62.12 1noi s THR 487 Cb -0.00 -4.06 0.49 0.00 -1.51 0.00 0.00 72.50 67.42 1noi s THR 487 CO -0.00 0.19 1.45 -0.81 -2.21 0.00 0.00 174.62 173.23 1noi n PRO 488 N 4.22 0.61 0.00 7.08 -0.04 -1.26 -2.40 135.00 143.21 1noi n PRO 488 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1noi n PRO 488 Cb 0.51 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 1noi n PRO 488 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1noi n ARG 489 N -0.94 0.00 -0.32 0.54 3.00 -1.26 -2.66 116.66 115.01 1noi n ARG 489 Ca 0.13 0.13 0.15 0.00 -0.01 0.00 0.00 57.85 58.25 1noi n ARG 489 Cb 0.06 -0.58 0.34 0.00 0.00 0.00 0.00 32.46 32.28 1noi n ARG 489 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 1noi h ARG 490 N 0.00 0.50 -0.39 5.56 2.43 -1.96 -0.64 114.38 119.88 1noi h ARG 490 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1noi h ARG 490 Cb 0.00 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.44 1noi h ARG 490 CO 0.00 0.33 0.00 0.91 -1.51 0.00 0.00 179.97 179.70 1noi n TRP 491 N -4.95 0.51 0.01 2.20 7.02 -1.01 -2.60 117.44 118.62 1noi n TRP 491 Ca 0.24 -0.25 0.00 0.00 -1.02 0.00 0.00 57.50 56.47 1noi n TRP 491 Cb 0.68 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.57 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 1.00 -0.01 -0.09 -0.99 0.00 -1.14 -4.77 117.00 111.01 1noi n LEU 492 Ca 0.18 0.05 -0.07 0.00 0.00 0.00 0.00 56.01 56.16 1noi n LEU 492 Cb 0.47 0.04 0.00 0.00 0.00 0.00 0.00 43.42 43.92 1noi n LEU 492 CO 0.14 -0.53 0.93 0.58 0.00 0.00 0.00 177.39 178.51 1noi h VAL 493 N 0.00 0.91 0.11 1.96 2.07 -1.11 0.44 116.25 120.64 1noi h VAL 493 Ca 0.00 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 1noi h VAL 493 Cb 0.00 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1noi h VAL 493 CO 0.00 0.04 -0.05 0.25 0.02 0.00 0.00 177.57 177.83 1noi h LEU 494 N 0.24 -0.12 -0.01 2.57 6.46 -1.29 -3.28 115.31 119.87 1noi h LEU 494 Ca 0.14 -0.45 -0.19 0.00 -0.12 0.00 0.00 57.88 57.27 1noi h LEU 494 Cb 0.11 0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 40.04 1noi h LEU 494 CO -0.14 0.49 -0.90 0.00 -0.62 0.00 0.00 178.44 177.27 1noi n ASN 496 N -3.33 2.74 -0.33 0.00 2.85 0.15 -4.89 115.26 112.46 1noi n ASN 496 Ca 0.00 -3.32 0.04 0.00 -0.11 0.00 0.00 54.58 51.19 1noi n ASN 496 Cb 0.89 -0.61 0.19 0.00 1.24 0.00 0.00 39.78 41.49 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 3.34 0.90 -0.32 1.20 0.13 -1.62 -1.19 132.00 134.44 1noi h PRO 497 Ca 0.13 -0.05 0.06 0.00 -0.87 0.00 0.00 66.00 65.27 1noi h PRO 497 Cb 0.71 -0.20 -0.06 0.00 0.13 0.00 0.00 31.00 31.58 1noi h PRO 497 CO 0.68 0.59 -0.06 0.78 -0.23 0.00 0.00 178.00 179.77 1noi h GLY 498 N 0.92 0.25 1.19 1.56 0.00 -1.91 -0.34 103.07 104.75 1noi h GLY 498 Ca 0.43 0.09 -0.14 0.00 0.00 0.00 0.00 47.33 47.70 1noi h GLY 498 CO -0.23 -0.11 -0.32 -2.00 0.00 0.00 0.00 176.54 173.88 1noi h LEU 499 N 0.02 0.94 -1.24 3.11 5.85 -1.80 -2.57 115.31 119.61 1noi h LEU 499 Ca 0.15 -0.40 -0.05 0.00 0.84 0.00 0.00 57.88 58.43 1noi h LEU 499 Cb 0.23 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 1noi h LEU 499 CO -0.31 1.17 0.00 0.00 -0.34 0.00 0.00 178.44 178.96 1noi h ALA 500 N 0.88 1.38 0.30 1.25 0.00 -0.55 -2.66 119.26 119.86 1noi h ALA 500 Ca 0.08 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1noi h ALA 500 Cb 0.89 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1noi h ALA 500 CO 0.08 0.43 -0.14 1.49 0.00 0.00 0.00 179.25 181.11 1noi h GLU 501 N 0.49 -0.39 0.00 0.00 4.81 -0.81 -2.08 114.58 116.61 1noi h GLU 501 Ca 0.11 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1noi h GLU 501 Cb 0.32 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.79 1noi h GLU 501 CO 0.01 -0.09 0.00 0.44 -0.73 0.00 0.00 179.01 178.64 1noi n ILE 502 N -5.15 1.06 0.00 2.32 -5.35 -0.99 -1.65 119.36 109.61 1noi n ILE 502 Ca -0.10 0.40 -0.20 0.00 -0.27 0.00 0.00 62.75 62.59 1noi n ILE 502 Cb 0.25 -1.33 -0.14 0.00 -1.74 0.00 0.00 39.64 36.69 1noi n ILE 502 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 1noi h ILE 503 N 0.00 1.35 -0.00 7.28 2.04 -1.50 -3.30 117.51 123.37 1noi h ILE 503 Ca 0.00 -2.43 -0.06 0.00 1.00 0.00 0.00 64.86 63.37 1noi h ILE 503 Cb 0.20 2.99 -0.01 0.00 -0.74 0.00 0.00 36.82 39.26 1noi h ILE 503 CO 0.00 0.66 -0.28 0.00 0.00 0.00 0.00 178.15 178.53 1noi h ALA 504 N -0.02 1.53 -0.82 1.87 0.00 -0.57 -1.45 119.26 119.80 1noi h ALA 504 Ca -0.19 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.47 1noi h ALA 504 Cb 1.55 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.25 1noi h ALA 504 CO 0.06 0.35 0.54 0.93 0.00 0.00 0.00 179.25 181.14 1noi h GLU 505 N 0.01 1.08 0.01 0.00 5.08 -1.56 0.19 114.58 119.39 1noi h GLU 505 Ca -0.00 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1noi h GLU 505 Cb 0.50 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1noi h GLU 505 CO 0.04 0.72 -0.01 0.00 -1.00 0.00 0.00 179.01 178.76 1noi h ARG 506 N 1.11 -0.02 -0.00 2.33 2.47 -1.42 -3.43 114.38 115.42 1noi h ARG 506 Ca 0.30 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.02 1noi h ARG 506 Cb -0.12 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.20 1noi h ARG 506 CO -0.06 0.75 -0.00 0.44 0.56 0.00 0.00 179.97 181.66 1noi n ILE 507 N -4.68 0.00 0.00 2.04 -5.35 -0.63 -5.13 119.36 105.61 1noi n ILE 507 Ca -0.08 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 61.90 1noi n ILE 507 Cb 0.38 1.06 0.00 0.00 -1.74 0.00 0.00 39.64 39.34 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 0.19 1.11 1.04 3.28 0.00 0.68 -4.81 105.19 106.68 1noi n GLY 508 Ca 0.02 -2.04 0.12 0.00 0.00 0.00 0.00 46.02 44.12 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 1.37 2.37 0.03 1.61 1.02 -1.26 -4.28 120.64 121.50 1noi n GLU 509 Ca 0.00 -2.06 0.10 0.00 -0.02 0.00 0.00 57.16 55.19 1noi n GLU 509 Cb 0.00 -1.49 0.44 0.00 -0.02 0.00 0.00 31.44 30.37 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 1.31 0.05 0.20 3.49 2.13 -1.26 -2.92 120.64 123.64 1noi n GLU 510 Ca 0.18 0.20 0.06 0.00 0.66 0.00 0.00 57.16 58.25 1noi n GLU 510 Cb 0.57 -1.58 0.44 0.00 0.27 0.00 0.00 31.44 31.14 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 0.00 0.00 4.31 -0.00 -1.77 -2.44 116.97 117.07 1noi h TYR 511 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1noi h TYR 511 Cb 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.12 1noi h TYR 511 CO 0.00 0.31 0.12 0.82 -0.00 0.00 0.00 178.16 179.41 1noi h ILE 512 N 0.00 0.00 0.00 -0.90 2.04 -1.88 -1.14 117.51 115.63 1noi h ILE 512 Ca -0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 1noi h ILE 512 Cb 0.64 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 1noi h ILE 512 CO 0.04 0.00 -0.49 -1.54 0.00 0.00 0.00 178.15 176.16 1noi n SER 513 N -2.91 0.24 -3.06 1.72 3.41 -1.13 -4.64 113.62 107.25 1noi n SER 513 Ca -0.02 -2.09 -0.15 0.00 -0.26 0.00 0.00 58.87 56.34 1noi n SER 513 Cb 0.17 -0.22 -0.04 0.00 -0.26 0.00 0.00 64.21 63.86 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 -0.08 -1.99 0.25 4.04 2.03 -0.55 -5.04 116.55 115.20 1noi n ASP 514 Ca 0.02 -2.67 0.13 0.00 0.52 0.00 0.00 54.79 52.79 1noi n ASP 514 Cb 0.72 0.63 0.58 0.00 -0.72 0.00 0.00 41.12 42.33 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 5.24 0.00 -2.15 -2.67 5.85 -1.54 -2.64 115.31 117.40 1noi h LEU 515 Ca 0.15 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.91 1noi h LEU 515 Cb 1.01 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.03 1noi h LEU 515 CO 0.20 0.13 0.29 0.44 -0.34 0.00 0.00 178.44 179.16 1noi h ASP 516 N 0.00 0.00 0.32 1.25 3.32 -1.85 -0.19 116.42 119.27 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 0.61 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.16 1noi h ASP 516 CO 0.02 0.00 -0.00 1.56 -1.72 0.00 0.00 179.24 179.09 1noi h GLN 517 N 0.00 0.00 0.00 3.56 4.20 -1.78 -1.04 115.11 120.05 1noi h GLN 517 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1noi h GLN 517 Cb 0.65 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.43 1noi h GLN 517 CO -0.00 0.00 0.16 -0.07 -0.67 0.00 0.00 178.83 178.25 1noi h LEU 518 N 0.00 0.00 -2.11 1.46 3.38 -1.25 -1.49 115.31 115.30 1noi h LEU 518 Ca -0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 1noi h LEU 518 Cb 0.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1noi h LEU 518 CO 0.00 0.00 0.15 -0.09 0.09 0.00 0.00 178.44 178.59 1noi h ARG 519 N 0.00 0.00 0.00 1.13 2.43 -0.59 -1.95 114.38 115.40 1noi h ARG 519 Ca 0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1noi h ARG 519 Cb 0.31 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.86 1noi h ARG 519 CO 0.00 0.00 -0.05 0.87 -1.51 0.00 0.00 179.97 179.28 1noi h LYS 520 N 0.00 0.00 -0.09 0.20 1.57 -1.50 -1.41 116.57 115.33 1noi h LYS 520 Ca 0.09 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.90 1noi h LYS 520 Cb 0.40 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.70 1noi h LYS 520 CO -0.00 0.05 0.12 -0.07 -0.57 0.00 0.00 179.45 178.98 1noi h LEU 521 N 0.00 0.00 -1.97 2.94 4.07 -1.55 -2.77 115.31 116.03 1noi h LEU 521 Ca -0.00 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.94 1noi h LEU 521 Cb 0.11 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.85 1noi h LEU 521 CO 0.01 0.00 -0.10 -0.07 -1.08 0.00 0.00 178.44 177.20 1noi h LEU 522 N 0.00 0.00 0.00 1.67 4.07 -1.46 0.20 115.31 119.79 1noi h LEU 522 Ca 0.04 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.00 1noi h LEU 522 Cb 0.29 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.03 1noi h LEU 522 CO -0.00 0.10 0.00 -1.20 -1.08 0.00 0.00 178.44 176.25 1noi n SER 523 N -4.04 0.00 -0.47 -0.43 7.64 -1.04 -2.32 113.62 112.95 1noi n SER 523 Ca -0.02 0.47 0.04 0.00 1.01 0.00 0.00 58.87 60.37 1noi n SER 523 Cb 0.18 -0.48 0.11 0.00 -1.01 0.00 0.00 64.21 63.01 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 -1.48 0.32 0.22 1.43 4.02 0.71 -4.60 117.16 117.79 1noi n TYR 524 Ca 0.01 -0.46 0.11 0.00 -0.01 0.00 0.00 57.90 57.55 1noi n TYR 524 Cb 0.04 -0.03 0.69 0.00 -0.02 0.00 0.00 39.34 40.03 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 1.55 0.87 -0.35 -0.72 2.07 -1.56 -0.67 116.25 117.44 1noi h VAL 525 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1noi h VAL 525 Cb 0.65 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 31.37 1noi h VAL 525 CO 0.00 0.00 0.00 0.47 0.02 0.00 0.00 177.57 178.06 1noi n ASP 526 N -4.39 3.16 -4.53 0.57 8.00 -1.26 -4.80 116.55 113.29 1noi n ASP 526 Ca -0.01 -2.19 -0.43 0.00 0.71 0.00 0.00 54.79 52.88 1noi n ASP 526 Cb 0.18 -0.30 -0.06 0.00 -0.02 0.00 0.00 41.12 40.92 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 -1.16 6.38 0.53 -2.24 -1.08 -0.26 -4.92 116.67 113.91 1noi s ASP 527 Ca 0.28 -0.21 0.30 0.00 -0.52 0.00 0.00 52.55 52.39 1noi s ASP 527 Cb 0.17 -2.36 1.45 0.00 -1.46 0.00 0.00 42.92 40.71 1noi s ASP 527 CO 0.15 -0.87 1.91 -0.33 0.52 0.00 0.00 175.17 176.55 1noi h GLU 528 N 8.95 0.02 -0.01 4.34 4.39 -1.92 -2.64 114.58 127.71 1noi h GLU 528 Ca -0.25 -0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.45 1noi h GLU 528 Cb 1.09 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.73 1noi h GLU 528 CO 0.94 0.01 -0.01 0.00 -1.16 0.00 0.00 179.01 178.79 1noi h ALA 529 N 1.59 0.01 -0.03 3.43 0.00 -1.94 -1.82 119.26 120.52 1noi h ALA 529 Ca 0.39 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 55.08 1noi h ALA 529 Cb 1.53 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.30 1noi h ALA 529 CO -0.01 -0.25 -0.08 0.35 0.00 0.00 0.00 179.25 179.26 1noi h PHE 530 N -0.44 -0.19 -0.47 0.00 3.57 -1.77 -2.39 116.94 115.26 1noi h PHE 530 Ca 0.00 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.57 1noi h PHE 530 Cb 0.47 0.09 -0.09 0.00 2.79 0.00 0.00 35.95 39.21 1noi h PHE 530 CO 0.09 -0.12 -0.52 0.82 -2.23 0.00 0.00 178.31 176.34 1noi h ILE 531 N -0.12 0.03 0.00 1.41 2.04 -1.56 0.32 117.51 119.63 1noi h ILE 531 Ca 0.04 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.90 1noi h ILE 531 Cb 0.18 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.28 1noi h ILE 531 CO -0.10 0.00 0.00 -2.11 0.00 0.00 0.00 178.15 175.94 1noi n ARG 532 N -5.38 0.11 0.01 2.37 1.85 -0.68 -2.19 116.66 112.74 1noi n ARG 532 Ca -0.02 0.34 -0.19 0.00 -1.00 0.00 0.00 57.85 56.98 1noi n ARG 532 Cb 0.34 -1.70 -0.14 0.00 -1.05 0.00 0.00 32.46 29.91 1noi n ARG 532 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 1noi h ASP 533 N 0.00 0.32 -0.65 2.89 3.32 0.06 -1.61 116.42 120.75 1noi h ASP 533 Ca 0.00 -0.93 0.12 0.00 0.02 0.00 0.00 57.03 56.25 1noi h ASP 533 Cb 0.32 -0.10 -0.09 0.00 0.22 0.00 0.00 39.33 39.67 1noi h ASP 533 CO 0.00 1.34 0.17 0.58 -1.72 0.00 0.00 179.24 179.61 1noi h VAL 534 N -0.54 0.63 -0.31 -1.35 2.07 -0.83 0.20 116.25 116.13 1noi h VAL 534 Ca -0.14 -0.10 -0.12 0.00 0.82 0.00 0.00 66.70 67.15 1noi h VAL 534 Cb 1.49 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1noi h VAL 534 CO 0.08 0.05 -0.31 0.00 0.02 0.00 0.00 177.57 177.41 1noi h ALA 535 N 1.51 0.88 -0.05 1.67 0.00 -1.49 -2.68 119.26 119.09 1noi h ALA 535 Ca 0.35 -0.40 -0.20 0.00 0.00 0.00 0.00 54.91 54.66 1noi h ALA 535 Cb 0.52 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.20 1noi h ALA 535 CO -0.42 0.63 -0.74 -0.22 0.00 0.00 0.00 179.25 178.51 1noi h LYS 536 N 0.56 0.59 -0.11 0.00 1.63 0.34 -2.39 116.57 117.17 1noi h LYS 536 Ca 0.06 -0.57 0.05 0.00 -0.85 0.00 0.00 60.65 59.34 1noi h LYS 536 Cb 0.81 0.14 -0.06 0.00 -0.60 0.00 0.00 32.23 32.53 1noi h LYS 536 CO 0.07 1.19 -0.29 0.28 -3.45 0.00 0.00 179.45 177.25 1noi h VAL 537 N 0.21 0.34 -0.62 2.00 2.07 -1.00 0.44 116.25 119.68 1noi h VAL 537 Ca -0.08 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.51 1noi h VAL 537 Cb 1.40 0.34 -0.06 0.00 -1.52 0.00 0.00 31.29 31.46 1noi h VAL 537 CO 0.15 0.00 0.32 0.50 0.02 0.00 0.00 177.57 178.56 1noi h LYS 538 N -0.37 0.57 -0.20 1.57 1.63 -1.40 0.26 116.57 118.63 1noi h LYS 538 Ca 0.09 -0.03 0.04 0.00 -0.85 0.00 0.00 60.65 59.90 1noi h LYS 538 Cb 0.51 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 31.98 1noi h LYS 538 CO -0.32 0.38 -0.03 0.37 -3.45 0.00 0.00 179.45 176.40 1noi h GLN 539 N 0.59 0.03 -0.79 1.90 4.15 -0.88 0.22 115.11 120.33 1noi h GLN 539 Ca 0.28 -0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.69 1noi h GLN 539 Cb 0.21 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 27.86 1noi h GLN 539 CO -0.20 0.02 0.43 0.93 -1.93 0.00 0.00 178.83 178.08 1noi h GLU 540 N 0.03 1.11 -0.48 1.69 5.08 0.11 -0.40 114.58 121.71 1noi h GLU 540 Ca 0.10 -0.13 -0.11 0.00 -1.00 0.00 0.00 59.36 58.22 1noi h GLU 540 Cb 0.13 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 1noi h GLU 540 CO -0.18 0.82 -0.13 -0.91 -1.00 0.00 0.00 179.01 177.60 1noi h ASN 541 N 1.10 0.91 -0.22 1.42 -0.26 0.15 -1.92 115.58 116.76 1noi h ASN 541 Ca 0.28 -0.30 -0.16 0.00 -0.56 0.00 0.00 56.30 55.55 1noi h ASN 541 Cb 0.04 -0.25 -0.00 0.00 -1.06 0.00 0.00 38.32 37.04 1noi h ASN 541 CO -0.04 1.04 -0.47 0.11 -1.06 0.00 0.00 177.43 177.01 1noi h LYS 542 N 0.81 0.79 -0.56 0.81 1.57 0.19 -1.46 116.57 118.71 1noi h LYS 542 Ca 0.13 -0.46 -0.04 0.00 -1.87 0.00 0.00 60.65 58.41 1noi h LYS 542 Cb 0.67 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 1noi h LYS 542 CO 0.05 1.09 0.19 -0.07 -0.57 0.00 0.00 179.45 180.14 1noi h LEU 543 N 0.63 0.80 0.02 2.94 -0.00 -0.93 0.39 115.31 119.16 1noi h LEU 543 Ca 0.03 -0.19 0.01 0.00 -0.00 0.00 0.00 57.88 57.73 1noi h LEU 543 Cb 1.05 -0.21 -0.02 0.00 -0.00 0.00 0.00 40.66 41.48 1noi h LEU 543 CO 0.10 0.78 -0.09 0.50 -0.00 0.00 0.00 178.44 179.74 1noi h LYS 544 N 0.78 -0.16 -0.67 1.13 3.64 -1.20 -2.42 116.57 117.66 1noi h LYS 544 Ca 0.18 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.52 1noi h LYS 544 Cb 0.25 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.08 1noi h LYS 544 CO -0.01 -0.11 0.21 0.35 -2.27 0.00 0.00 179.45 177.62 1noi h PHE 545 N -0.17 1.09 -0.86 1.91 3.57 -0.92 -1.33 116.94 120.22 1noi h PHE 545 Ca 0.03 -0.11 0.09 0.00 3.53 0.00 0.00 57.97 61.51 1noi h PHE 545 Cb 0.20 -0.31 -0.06 0.00 2.79 0.00 0.00 35.95 38.56 1noi h PHE 545 CO -0.14 0.87 0.56 0.00 -2.23 0.00 0.00 178.31 177.37 1noi h ALA 546 N 1.09 1.66 0.17 2.41 0.00 -0.08 -2.34 119.26 122.17 1noi h ALA 546 Ca 0.22 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.83 1noi h ALA 546 Cb 0.30 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.90 1noi h ALA 546 CO -0.01 0.17 -1.39 0.00 0.00 0.00 0.00 179.25 178.03 1noi h ALA 547 N 1.56 0.04 -1.00 0.00 0.00 -0.89 -3.31 119.26 115.66 1noi h ALA 547 Ca 0.40 -0.97 0.22 0.00 0.00 0.00 0.00 54.91 54.56 1noi h ALA 547 Cb 0.39 0.33 -0.10 0.00 0.00 0.00 0.00 17.79 18.41 1noi h ALA 547 CO -0.16 0.75 0.62 -0.92 0.00 0.00 0.00 179.25 179.54 1noi h TYR 548 N -0.12 0.89 0.00 0.00 3.20 -0.95 0.94 116.97 120.95 1noi h TYR 548 Ca -0.27 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.63 1noi h TYR 548 Cb 1.91 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 39.92 1noi h TYR 548 CO 0.14 0.15 0.00 -0.11 -1.64 0.00 0.00 178.16 176.70 1noi n LEU 549 N -4.72 0.00 0.00 2.82 7.94 -0.91 -0.98 117.00 121.15 1noi n LEU 549 Ca 0.24 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.14 1noi n LEU 549 Cb 0.69 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.64 1noi n LEU 549 CO 0.23 0.00 0.00 -0.62 -1.11 0.00 0.00 177.39 175.89 1noi n GLU 550 N -0.75 0.47 -0.06 1.96 1.02 0.01 -2.86 120.64 120.43 1noi n GLU 550 Ca 0.04 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.05 1noi n GLU 550 Cb 0.02 -0.04 -0.12 0.00 -0.02 0.00 0.00 31.44 31.28 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 -0.00 -5.20 3.49 2.43 0.54 -3.42 114.38 112.22 1noi h ARG 551 Ca 0.00 0.00 -0.65 0.00 -0.81 0.00 0.00 59.98 58.52 1noi h ARG 551 Cb 0.00 0.00 -0.26 0.00 -0.42 0.00 0.00 29.97 29.29 1noi h ARG 551 CO 0.00 0.89 -0.73 -1.21 -1.51 0.00 0.00 179.97 177.42 1noi s GLU 552 N -2.50 3.46 1.72 0.20 8.01 -0.16 -5.01 118.70 124.42 1noi s GLU 552 Ca -0.18 -0.62 0.00 0.00 0.01 0.00 0.00 54.97 54.18 1noi s GLU 552 Cb -0.02 -2.83 0.00 0.00 -4.31 0.00 0.00 34.13 26.96 1noi s GLU 552 CO 0.67 0.08 0.00 0.66 0.01 0.00 0.00 175.26 176.68 1noi n TYR 553 N 3.96 -0.96 -3.91 1.61 4.01 -1.26 -4.29 117.16 116.32 1noi n TYR 553 Ca -0.18 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.57 1noi n TYR 553 Cb 0.52 0.09 0.01 0.00 -0.31 0.00 0.00 39.34 39.65 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 0.00 0.69 0.00 -0.72 0.00 -1.14 -3.82 119.74 114.76 1noi s LYS 554 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 55.97 55.53 1noi s LYS 554 Cb 0.00 0.20 0.00 0.00 0.00 0.00 0.00 37.83 38.03 1noi s LYS 554 CO 0.00 -0.33 0.00 0.28 0.00 0.00 0.00 175.35 175.30 1noi n VAL 555 N -0.78 0.00 0.00 1.79 0.31 -1.26 -4.87 118.33 113.52 1noi n VAL 555 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 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 -4.17 3.52 -0.00 -1.26 -5.16 115.22 108.15 1noi n HIS 556 Ca 0.00 0.00 -0.35 0.00 0.46 0.00 0.00 57.72 57.83 1noi n HIS 556 Cb 0.00 0.00 -0.09 0.00 -0.12 0.00 0.00 29.99 29.78 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 4.65 -0.48 3.57 1.09 -1.26 -5.03 121.20 123.74 1noi s ILE 557 Ca 0.00 -0.10 -0.26 0.00 -1.10 0.00 0.00 60.65 59.19 1noi s ILE 557 Cb 0.00 -3.02 0.03 0.00 -1.06 0.00 0.00 42.46 38.41 1noi s ILE 557 CO 0.00 0.55 0.98 0.21 -0.10 0.00 0.00 174.94 176.58 1noi s ASN 558 N -0.40 6.50 -0.00 3.58 3.84 -1.26 -4.91 114.94 122.29 1noi s ASN 558 Ca 0.09 0.12 0.00 0.00 0.21 0.00 0.00 52.86 53.28 1noi s ASN 558 Cb -0.12 -2.47 0.01 0.00 -0.55 0.00 0.00 41.25 38.12 1noi s ASN 558 CO 0.02 -1.14 0.86 -0.81 -2.79 0.00 0.00 177.10 173.25 1noi n PRO 559 N 7.40 1.04 -0.14 0.43 -0.04 -1.26 -2.87 135.00 139.56 1noi n PRO 559 Ca 0.07 -0.05 0.08 0.00 -0.04 0.00 0.00 63.50 63.56 1noi n PRO 559 Cb 0.48 -1.16 0.16 0.00 -0.04 0.00 0.00 33.50 32.94 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 -0.32 2.93 -4.91 3.54 4.13 -1.26 -4.77 115.26 114.59 1noi n ASN 560 Ca 0.00 -1.86 -0.27 0.00 1.68 0.00 0.00 54.58 54.13 1noi n ASN 560 Cb 0.09 -0.19 0.03 0.00 -1.54 0.00 0.00 39.78 38.17 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 -1.19 5.65 -0.31 6.41 1.04 -1.14 -4.98 113.70 119.18 1noi s SER 561 Ca 0.28 0.81 -0.29 0.00 0.48 0.00 0.00 55.95 57.22 1noi s SER 561 Cb 0.16 -1.80 0.00 0.00 0.10 0.00 0.00 66.02 64.48 1noi s SER 561 CO 0.22 -1.06 1.31 -0.22 0.98 0.00 0.00 173.24 174.48 1noi s LEU 562 N -5.02 3.85 -0.34 2.42 0.20 -1.03 -4.85 118.68 113.91 1noi s LEU 562 Ca 0.54 1.17 -0.29 0.00 0.69 0.00 0.00 54.13 56.24 1noi s LEU 562 Cb -0.11 -3.54 0.01 0.00 -0.43 0.00 0.00 46.19 42.13 1noi s LEU 562 CO 0.46 -1.11 1.15 -0.36 -0.29 0.00 0.00 176.35 176.20 1noi s PHE 563 N 4.45 2.97 -0.34 5.38 0.40 -1.26 -2.35 117.98 127.22 1noi s PHE 563 Ca 0.56 1.03 -0.11 0.00 -0.60 0.00 0.00 56.93 57.81 1noi s PHE 563 Cb -0.16 -3.87 -0.00 0.00 0.51 0.00 0.00 43.02 39.50 1noi s PHE 563 CO 0.24 -1.11 0.21 0.34 0.70 0.00 0.00 175.22 175.59 1noi s ASP 564 N 2.10 5.81 -0.03 1.36 -1.08 -0.23 -1.71 116.67 122.88 1noi s ASP 564 Ca 0.49 -0.62 0.02 0.00 -0.52 0.00 0.00 52.55 51.91 1noi s ASP 564 Cb -0.13 -2.07 0.01 0.00 -1.46 0.00 0.00 42.92 39.28 1noi s ASP 564 CO 0.20 -0.27 -0.07 0.68 0.52 0.00 0.00 175.17 176.23 1noi s VAL 565 N 1.64 0.67 -0.31 1.11 -7.23 -0.73 -1.00 120.40 114.55 1noi s VAL 565 Ca 0.05 -0.26 0.02 0.00 -1.81 0.00 0.00 61.98 59.98 1noi s VAL 565 Cb -0.18 -0.63 0.08 0.00 0.56 0.00 0.00 36.38 36.21 1noi s VAL 565 CO 0.08 0.23 -0.00 -1.58 -0.31 0.00 0.00 175.10 173.52 1noi s GLN 566 N 0.49 1.99 -0.11 4.82 0.74 -0.39 -2.18 119.66 125.02 1noi s GLN 566 Ca -0.07 -1.56 -0.01 0.00 0.05 0.00 0.00 55.36 53.76 1noi s GLN 566 Cb -0.11 -3.13 0.03 0.00 1.10 0.00 0.00 33.01 30.90 1noi s GLN 566 CO 0.01 -0.76 -0.03 0.14 -0.55 0.00 0.00 175.29 174.10 1noi s VAL 567 N 1.07 0.71 -0.09 1.34 -7.23 -1.26 -1.33 120.40 113.61 1noi s VAL 567 Ca 0.00 -0.19 -0.32 0.00 -1.81 0.00 0.00 61.98 59.66 1noi s VAL 567 Cb -0.20 -0.87 0.12 0.00 0.56 0.00 0.00 36.38 36.00 1noi s VAL 567 CO -0.05 0.23 1.40 -1.59 -0.31 0.00 0.00 175.10 174.77 1noi s LYS 568 N 1.82 0.04 0.68 4.82 -2.85 -1.11 -4.98 119.74 118.16 1noi s LYS 568 Ca 0.04 -0.03 -0.15 0.00 -1.00 0.00 0.00 55.97 54.83 1noi s LYS 568 Cb -0.13 0.01 0.01 0.00 -2.06 0.00 0.00 37.83 35.66 1noi s LYS 568 CO -0.07 -0.02 1.16 1.03 0.10 0.00 0.00 175.35 177.55 1noi s ARG 569 N -2.02 2.57 -0.33 1.78 0.52 -1.26 -4.01 118.95 116.20 1noi s ARG 569 Ca 0.25 1.58 -0.29 0.00 -0.52 0.00 0.00 55.73 56.75 1noi s ARG 569 Cb 0.03 -1.90 0.01 0.00 0.52 0.00 0.00 34.95 33.61 1noi s ARG 569 CO -0.04 -1.47 1.16 0.42 0.02 0.00 0.00 175.30 175.39 1noi s ILE 570 N -2.12 4.35 -0.15 1.52 -1.09 -0.99 -4.87 121.20 117.85 1noi s ILE 570 Ca 0.71 1.52 -0.19 0.00 -2.23 0.00 0.00 60.65 60.46 1noi s ILE 570 Cb -0.25 -4.35 0.05 0.00 -1.58 0.00 0.00 42.46 36.33 1noi s ILE 570 CO 0.42 -0.54 0.51 -2.28 -1.23 0.00 0.00 174.94 171.81 1noi s HIS 571 N 3.99 -0.52 0.26 3.97 2.46 -1.26 -4.76 115.29 119.43 1noi s HIS 571 Ca 0.49 1.20 -0.02 0.00 0.47 0.00 0.00 55.06 57.20 1noi s HIS 571 Cb -0.13 0.21 0.42 0.00 -0.13 0.00 0.00 32.58 32.95 1noi s HIS 571 CO 0.20 -0.33 1.87 0.93 -2.47 0.00 0.00 174.74 174.94 1noi h GLU 572 N 4.85 1.06 0.00 2.88 5.08 -1.98 -0.04 114.58 126.44 1noi h GLU 572 Ca -0.28 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 1noi h GLU 572 Cb 1.17 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1noi h GLU 572 CO 0.24 0.70 0.10 0.10 -1.00 0.00 0.00 179.01 179.15 1noi h TYR 573 N 1.10 0.00 0.00 4.33 -0.00 -1.96 -2.42 116.97 118.02 1noi h TYR 573 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.17 1noi h TYR 573 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.97 1noi h TYR 573 CO -0.01 0.00 -1.25 1.63 -0.00 0.00 0.00 178.16 178.53 1noi n LYS 574 N -2.52 0.39 -3.51 0.10 5.02 -0.04 -3.58 118.16 114.01 1noi n LYS 574 Ca -0.02 -0.03 -0.19 0.00 -2.02 0.00 0.00 58.31 56.05 1noi n LYS 574 Cb 0.14 -1.60 0.08 0.00 -0.02 0.00 0.00 35.03 33.63 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 -2.08 -6.51 0.02 1.97 1.74 -0.91 -4.12 116.66 106.78 1noi n ARG 575 Ca 0.00 0.80 0.10 0.00 -0.77 0.00 0.00 57.85 57.99 1noi n ARG 575 Cb 0.47 -5.75 0.53 0.00 -1.02 0.00 0.00 32.46 26.69 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 -2.01 0.30 -0.47 5.56 7.50 -1.86 0.96 115.11 125.10 1noi h GLN 576 Ca -0.59 -0.02 -0.04 0.00 0.50 0.00 0.00 58.65 58.51 1noi h GLN 576 Cb 1.35 -0.07 -0.02 0.00 0.05 0.00 0.00 27.48 28.79 1noi h GLN 576 CO 0.52 0.20 0.14 -0.07 -1.50 0.00 0.00 178.83 178.12 1noi h LEU 577 N 0.31 0.63 -0.87 1.46 3.38 -1.91 -0.46 115.31 117.85 1noi h LEU 577 Ca 0.18 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 1noi h LEU 577 Cb 0.33 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1noi h LEU 577 CO -0.04 0.61 0.30 0.25 0.09 0.00 0.00 178.44 179.65 1noi h LEU 578 N 0.68 1.04 -0.23 1.67 5.85 -1.19 -1.20 115.31 121.93 1noi h LEU 578 Ca 0.16 -0.16 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 1noi h LEU 578 Cb 0.21 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 1noi h LEU 578 CO -0.01 0.92 -0.12 -1.13 -0.34 0.00 0.00 178.44 177.76 1noi h ASN 579 N 1.10 0.50 -0.91 1.25 -0.00 -1.31 -1.84 115.58 114.37 1noi h ASN 579 Ca 0.25 -0.42 0.07 0.00 -0.00 0.00 0.00 56.30 56.20 1noi h ASN 579 Cb 0.22 -0.14 -0.06 0.00 -0.00 0.00 0.00 38.32 38.33 1noi h ASN 579 CO -0.02 0.81 0.57 0.00 -0.00 0.00 0.00 177.43 178.80 1noi h LEU 581 N 1.04 0.44 -1.00 0.00 3.38 -0.86 -0.88 115.31 117.42 1noi h LEU 581 Ca 0.40 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 58.27 1noi h LEU 581 Cb 0.19 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1noi h LEU 581 CO -0.18 0.35 0.05 -0.74 0.09 0.00 0.00 178.44 178.01 1noi h HIS 582 N 0.48 0.81 -0.23 1.13 2.76 -0.62 -2.16 115.15 117.32 1noi h HIS 582 Ca 0.13 -0.09 -0.00 0.00 -2.20 0.00 0.00 60.37 58.21 1noi h HIS 582 Cb -0.01 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 28.71 1noi h HIS 582 CO -0.04 0.72 0.13 0.28 -1.30 0.00 0.00 177.93 177.72 1noi h VAL 583 N 0.73 1.11 -0.02 5.26 2.07 0.27 -2.43 116.25 123.25 1noi h VAL 583 Ca 0.15 -0.29 -0.12 0.00 0.82 0.00 0.00 66.70 67.26 1noi h VAL 583 Cb 0.37 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1noi h VAL 583 CO 0.01 0.11 -0.57 0.40 0.02 0.00 0.00 177.57 177.54 1noi h ILE 584 N 0.26 1.40 0.46 4.57 2.04 -0.88 -1.99 117.51 123.37 1noi h ILE 584 Ca 0.08 -1.93 -0.01 0.00 1.00 0.00 0.00 64.86 64.00 1noi h ILE 584 Cb 0.06 2.02 -0.02 0.00 -0.74 0.00 0.00 36.82 38.14 1noi h ILE 584 CO -0.01 0.56 -0.43 0.74 0.00 0.00 0.00 178.15 179.00 1noi h THR 585 N 0.05 0.14 -1.00 -0.27 2.02 -1.33 0.13 112.91 112.64 1noi h THR 585 Ca -0.00 0.00 0.20 0.00 0.77 0.00 0.00 66.41 67.38 1noi h THR 585 Cb 1.01 0.14 -0.10 0.00 -1.74 0.00 0.00 68.15 67.46 1noi h THR 585 CO 0.08 0.00 0.62 -0.07 0.37 0.00 0.00 175.52 176.51 1noi h LEU 586 N -0.90 0.70 -0.12 2.58 4.07 -1.03 -0.71 115.31 119.89 1noi h LEU 586 Ca -0.05 0.09 -0.03 0.00 0.08 0.00 0.00 57.88 57.97 1noi h LEU 586 Cb 0.78 -0.03 -0.00 0.00 1.08 0.00 0.00 40.66 42.49 1noi h LEU 586 CO -0.05 0.23 -0.04 0.22 -1.08 0.00 0.00 178.44 177.72 1noi h TYR 587 N 0.67 0.28 -0.80 1.13 3.20 -0.56 -2.47 116.97 118.42 1noi h TYR 587 Ca 0.57 -0.07 0.04 0.00 3.14 0.00 0.00 58.73 62.42 1noi h TYR 587 Cb 1.02 -0.07 -0.05 0.00 1.54 0.00 0.00 36.73 39.18 1noi h TYR 587 CO -0.00 0.57 0.53 -0.91 -1.64 0.00 0.00 178.16 176.70 1noi h ASN 588 N -0.09 0.84 -0.28 -2.11 2.35 0.60 -1.78 115.58 115.11 1noi h ASN 588 Ca 0.03 -0.01 0.04 0.00 -0.55 0.00 0.00 56.30 55.81 1noi h ASN 588 Cb 0.49 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.62 1noi h ASN 588 CO 0.02 0.57 0.04 -0.09 -1.65 0.00 0.00 177.43 176.32 1noi h ARG 589 N 0.97 0.13 -0.07 0.81 9.65 -1.08 -2.13 114.38 122.66 1noi h ARG 589 Ca 0.32 -0.01 -0.20 0.00 -1.10 0.00 0.00 59.98 59.00 1noi h ARG 589 Cb 0.06 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 28.61 1noi h ARG 589 CO -0.10 0.09 -0.78 0.82 2.80 0.00 0.00 179.97 182.80 1noi h ILE 590 N 0.13 1.37 -0.08 1.20 2.04 -0.86 -2.79 117.51 118.52 1noi h ILE 590 Ca 0.13 -2.18 -0.14 0.00 1.00 0.00 0.00 64.86 63.67 1noi h ILE 590 Cb 0.15 2.15 -0.01 0.00 -0.74 0.00 0.00 36.82 38.37 1noi h ILE 590 CO -0.19 0.66 -0.56 0.11 0.00 0.00 0.00 178.15 178.17 1noi h LYS 591 N 0.30 0.25 -0.05 2.37 1.79 -1.29 -0.26 116.57 119.68 1noi h LYS 591 Ca -0.04 -0.16 -0.11 0.00 -2.18 0.00 0.00 60.65 58.15 1noi h LYS 591 Cb 1.37 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 32.03 1noi h LYS 591 CO 0.14 0.75 -0.50 -0.22 -1.08 0.00 0.00 179.45 178.54 1noi h LYS 592 N 0.19 0.13 -1.87 3.15 3.64 -1.38 -3.37 116.57 117.06 1noi h LYS 592 Ca -0.00 -0.07 -0.50 0.00 -1.27 0.00 0.00 60.65 58.81 1noi h LYS 592 Cb 1.05 0.00 -0.34 0.00 -0.41 0.00 0.00 32.23 32.53 1noi h LYS 592 CO 0.09 0.60 -0.94 0.39 -2.27 0.00 0.00 179.45 177.31 1noi n GLU 593 N -3.95 0.49 0.00 1.90 1.02 -1.06 -4.99 120.64 114.05 1noi n GLU 593 Ca -0.02 -2.95 0.00 0.00 -0.02 0.00 0.00 57.16 54.17 1noi n GLU 593 Cb 0.53 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.50 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 2.15 0.00 -0.09 3.49 -0.02 -0.13 -2.38 135.00 138.02 1noi n PRO 594 Ca 0.23 0.36 0.03 0.00 -2.02 0.00 0.00 63.50 62.11 1noi n PRO 594 Cb 0.52 -1.53 0.08 0.00 -0.02 0.00 0.00 33.50 32.56 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 -1.35 2.45 -4.81 2.55 3.02 -1.26 -5.01 115.26 110.84 1noi n ASN 595 Ca 0.00 -2.20 -0.37 0.00 -0.03 0.00 0.00 54.58 51.98 1noi n ASN 595 Cb 0.03 -0.16 -0.06 0.00 -0.61 0.00 0.00 39.78 38.98 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 -1.36 4.22 -0.02 3.52 2.36 -1.00 -5.03 119.74 122.44 1noi s LYS 596 Ca 0.14 0.80 -0.27 0.00 -2.55 0.00 0.00 55.97 54.09 1noi s LYS 596 Cb 0.09 -3.03 -0.04 0.00 -1.05 0.00 0.00 37.83 33.81 1noi s LYS 596 CO 0.06 0.49 0.84 0.12 1.55 0.00 0.00 175.35 178.41 1noi s PHE 597 N -1.36 3.63 -0.04 4.03 5.36 -1.26 -5.02 117.98 123.32 1noi s PHE 597 Ca 0.38 1.49 0.02 0.00 -0.96 0.00 0.00 56.93 57.85 1noi s PHE 597 Cb -0.18 -2.96 0.01 0.00 -0.34 0.00 0.00 43.02 39.56 1noi s PHE 597 CO 0.21 0.06 -0.08 0.54 -1.46 0.00 0.00 175.22 174.49 1noi s VAL 598 N 0.81 0.77 0.02 3.12 0.11 -1.26 -5.10 120.40 118.87 1noi s VAL 598 Ca 0.44 -0.29 -0.30 0.00 -2.93 0.00 0.00 61.98 58.90 1noi s VAL 598 Cb -0.20 -0.73 -0.07 0.00 -1.53 0.00 0.00 36.38 33.86 1noi s VAL 598 CO 0.23 0.27 1.55 -0.69 -3.33 0.00 0.00 175.10 173.12 1noi s VAL 599 N 0.61 3.40 0.53 2.04 1.01 -1.26 -4.97 120.40 121.75 1noi s VAL 599 Ca -0.10 0.77 -0.20 0.00 0.00 0.00 0.00 61.98 62.46 1noi s VAL 599 Cb -0.13 -3.50 -0.06 0.00 0.00 0.00 0.00 36.38 32.69 1noi s VAL 599 CO 0.01 -0.01 1.13 -2.16 0.00 0.00 0.00 175.10 174.07 1noi s PRO 600 N 2.74 3.40 -0.00 2.72 0.04 -1.26 -4.96 135.00 137.68 1noi s PRO 600 Ca 0.69 1.62 -0.02 0.00 0.04 0.00 0.00 61.00 63.34 1noi s PRO 600 Cb -0.35 -2.04 -0.00 0.00 0.04 0.00 0.00 34.50 32.14 1noi s PRO 600 CO 0.29 -0.81 0.03 1.03 0.04 0.00 0.00 177.00 177.59 1noi s ARG 601 N -3.23 0.20 -0.39 4.56 0.52 -0.37 -2.48 118.95 117.76 1noi s ARG 601 Ca 0.72 -0.23 -0.09 0.00 -0.52 0.00 0.00 55.73 55.61 1noi s ARG 601 Cb -0.24 0.08 0.06 0.00 0.52 0.00 0.00 34.95 35.37 1noi s ARG 601 CO 0.27 -0.04 0.22 0.99 0.02 0.00 0.00 175.30 176.77 1noi s THR 602 N -0.67 4.24 -0.22 0.02 2.01 -0.99 -2.03 115.64 118.00 1noi s THR 602 Ca -0.07 -1.21 -0.12 0.00 0.31 0.00 0.00 61.69 60.60 1noi s THR 602 Cb -0.05 -3.50 -0.05 0.00 0.01 0.00 0.00 72.50 68.91 1noi s THR 602 CO -0.00 -0.38 0.22 0.68 -0.69 0.00 0.00 174.62 174.45 1noi s VAL 603 N 1.45 5.33 -0.12 3.82 -7.23 0.19 -1.07 120.40 122.78 1noi s VAL 603 Ca 0.02 0.33 0.02 0.00 -1.81 0.00 0.00 61.98 60.54 1noi s VAL 603 Cb -0.21 -3.56 -0.01 0.00 0.56 0.00 0.00 36.38 33.16 1noi s VAL 603 CO 0.03 0.35 -0.18 -0.04 -0.31 0.00 0.00 175.10 174.95 1noi s MET 604 N 0.91 3.23 -0.04 4.82 -1.94 -0.17 -0.35 119.30 125.77 1noi s MET 604 Ca 0.11 -0.77 0.03 0.00 -1.71 0.00 0.00 55.69 53.35 1noi s MET 604 Cb -0.13 -2.48 0.00 0.00 2.01 0.00 0.00 34.83 34.22 1noi s MET 604 CO 0.04 0.19 -0.13 0.42 -0.01 0.00 0.00 175.02 175.53 1noi s ILE 605 N 0.36 1.10 -0.07 2.53 1.01 -0.00 -1.26 121.20 124.86 1noi s ILE 605 Ca -0.14 -0.53 -0.21 0.00 0.00 0.00 0.00 60.65 59.77 1noi s ILE 605 Cb -0.17 -0.96 0.04 0.00 0.01 0.00 0.00 42.46 41.38 1noi s ILE 605 CO 0.07 0.33 0.48 -0.83 0.00 0.00 0.00 174.94 174.99 1noi s GLY 606 N 0.14 -0.35 0.00 6.18 0.00 -0.44 -1.08 107.32 111.76 1noi s GLY 606 Ca -0.04 0.92 0.00 0.00 0.00 0.00 0.00 44.72 45.60 1noi s GLY 606 CO 0.01 0.66 0.00 0.61 0.00 0.00 0.00 173.10 174.38 1noi n GLY 607 N 1.52 -2.03 3.39 0.20 0.00 -1.26 -2.75 105.19 104.26 1noi n GLY 607 Ca -0.19 -1.44 -0.31 0.00 0.00 0.00 0.00 46.02 44.08 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 -1.84 2.15 0.00 1.61 1.02 -1.26 -4.70 119.74 116.72 1noi s LYS 608 Ca 0.00 -0.91 0.00 0.00 0.02 0.00 0.00 55.97 55.08 1noi s LYS 608 Cb 0.00 -2.15 0.00 0.00 -0.52 0.00 0.00 37.83 35.16 1noi s LYS 608 CO 0.00 0.56 0.03 -0.35 -0.92 0.00 0.00 175.35 174.67 1noi n PRO 609 N 2.12 0.00 0.00 -1.68 -0.05 -1.26 -2.34 135.00 131.78 1noi n PRO 609 Ca -0.16 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.29 1noi n PRO 609 Cb 0.52 -0.26 0.00 0.00 -0.05 0.00 0.00 33.50 33.71 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 -2.12 0.00 -1.69 0.55 0.00 -1.26 -4.53 120.51 111.46 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 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 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 2.51 -0.14 0.00 -0.02 -1.26 -0.67 135.00 135.43 1noi n PRO 611 Ca 0.00 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 1noi n PRO 611 Cb 0.00 -2.73 0.00 0.00 -0.02 0.00 0.00 33.50 30.75 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 3.81 1.61 3.35 -1.23 0.00 -1.26 -4.94 105.19 106.54 1noi n GLY 612 Ca 0.17 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.75 3.09 0.08 1.61 6.14 0.16 -4.91 117.35 120.76 1noi s TYR 613 Ca 0.00 -1.08 -0.24 0.00 0.64 0.00 0.00 57.07 56.39 1noi s TYR 613 Cb 0.00 -3.94 -0.16 0.00 0.42 0.00 0.00 41.96 38.28 1noi s TYR 613 CO 0.00 -1.20 1.68 1.25 0.64 0.00 0.00 175.55 177.92 1noi h HIS 614 N 9.08 -0.07 -0.20 4.97 -0.00 -1.92 -0.79 115.15 126.22 1noi h HIS 614 Ca -0.29 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.08 1noi h HIS 614 Cb 1.09 0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 28.51 1noi h HIS 614 CO 0.80 -0.00 0.13 1.98 -0.00 0.00 0.00 177.93 180.84 1noi h MET 615 N -0.12 0.27 -0.50 5.26 -1.53 -1.98 -0.52 114.93 115.81 1noi h MET 615 Ca -0.01 -0.02 -0.01 0.00 -3.44 0.00 0.00 59.70 56.22 1noi h MET 615 Cb 0.10 -0.06 -0.02 0.00 -0.55 0.00 0.00 31.60 31.07 1noi h MET 615 CO 0.01 0.18 0.26 0.00 0.14 0.00 0.00 176.91 177.50 1noi h ALA 616 N 1.07 1.52 -0.51 0.39 0.00 -1.86 0.52 119.26 120.40 1noi h ALA 616 Ca 0.07 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1noi h ALA 616 Cb -0.03 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1noi h ALA 616 CO -0.02 0.40 -0.05 0.87 0.00 0.00 0.00 179.25 180.45 1noi h LYS 617 N 0.70 0.91 -0.55 0.00 1.57 -0.37 -2.53 116.57 116.29 1noi h LYS 617 Ca 0.18 -0.29 -0.06 0.00 -1.87 0.00 0.00 60.65 58.61 1noi h LYS 617 Cb 0.04 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 1noi h LYS 617 CO -0.03 0.93 0.10 0.52 -0.57 0.00 0.00 179.45 180.41 1noi h MET 618 N 0.83 0.87 -0.12 3.15 2.86 0.15 -2.37 114.93 120.30 1noi h MET 618 Ca 0.14 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1noi h MET 618 Cb 0.57 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.10 1noi h MET 618 CO 0.03 0.81 0.03 0.82 1.06 0.00 0.00 176.91 179.66 1noi h ILE 619 N 0.83 1.20 -0.89 -1.22 2.04 -0.58 -0.17 117.51 118.72 1noi h ILE 619 Ca 0.18 -0.61 0.09 0.00 1.00 0.00 0.00 64.86 65.52 1noi h ILE 619 Cb 0.35 1.37 -0.07 0.00 -0.74 0.00 0.00 36.82 37.73 1noi h ILE 619 CO 0.00 0.18 0.54 0.40 0.00 0.00 0.00 178.15 179.28 1noi h ILE 620 N -0.00 0.97 -0.39 -0.67 2.04 -1.00 0.03 117.51 118.49 1noi h ILE 620 Ca 0.04 -0.32 -0.08 0.00 1.00 0.00 0.00 64.86 65.50 1noi h ILE 620 Cb 0.25 -0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.27 1noi h ILE 620 CO 0.00 0.17 -0.09 0.50 0.00 0.00 0.00 178.15 178.73 1noi h LYS 621 N 0.93 0.67 0.25 2.37 1.63 -1.23 -2.41 116.57 118.78 1noi h LYS 621 Ca 0.42 -0.20 -0.00 0.00 -0.85 0.00 0.00 60.65 60.02 1noi h LYS 621 Cb 0.31 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 31.86 1noi h LYS 621 CO -0.22 0.75 -0.21 1.25 -3.45 0.00 0.00 179.45 177.57 1noi h LEU 622 N 0.62 -0.55 -1.11 5.20 6.46 0.90 -0.14 115.31 126.69 1noi h LEU 622 Ca 0.11 0.05 0.04 0.00 -0.12 0.00 0.00 57.88 57.96 1noi h LEU 622 Cb 0.51 0.18 -0.05 0.00 -0.73 0.00 0.00 40.66 40.57 1noi h LEU 622 CO 0.03 -0.32 0.60 0.40 -0.62 0.00 0.00 178.44 178.53 1noi h ILE 623 N -0.48 1.15 0.58 4.05 2.04 -1.33 -0.10 117.51 123.42 1noi h ILE 623 Ca -0.01 -0.39 -0.02 0.00 1.00 0.00 0.00 64.86 65.43 1noi h ILE 623 Cb 0.43 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 1noi h ILE 623 CO -0.02 0.21 -0.40 0.74 0.00 0.00 0.00 178.15 178.68 1noi h THR 624 N 1.14 0.00 -0.50 -0.27 2.02 -1.39 -0.87 112.91 113.04 1noi h THR 624 Ca 0.37 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.63 1noi h THR 624 Cb 0.03 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.35 1noi h THR 624 CO -0.12 0.00 -0.44 0.00 0.37 0.00 0.00 175.52 175.33 1noi h ALA 625 N -1.27 -0.40 -0.45 6.16 0.00 0.26 -0.37 119.26 123.19 1noi h ALA 625 Ca -0.08 0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.01 1noi h ALA 625 Cb 0.75 0.95 -0.09 0.00 0.00 0.00 0.00 17.79 19.40 1noi h ALA 625 CO 0.05 -0.86 -0.22 0.82 0.00 0.00 0.00 179.25 179.04 1noi h ILE 626 N -0.28 0.36 -0.71 0.00 2.04 -1.11 -0.71 117.51 117.10 1noi h ILE 626 Ca 0.16 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.12 1noi h ILE 626 Cb 0.57 0.36 -0.07 0.00 -0.74 0.00 0.00 36.82 36.93 1noi h ILE 626 CO -0.64 0.00 0.34 1.23 0.00 0.00 0.00 178.15 179.08 1noi h GLY 627 N -0.13 1.07 1.37 5.37 0.00 0.37 0.59 103.07 111.71 1noi h GLY 627 Ca 0.21 -0.21 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 1noi h GLY 627 CO -0.53 0.03 0.17 -0.55 0.00 0.00 0.00 176.54 175.66 1noi h ASP 628 N 0.57 0.74 0.14 0.19 3.32 0.33 0.15 116.42 121.85 1noi h ASP 628 Ca 0.36 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 1noi h ASP 628 Cb 0.41 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1noi h ASP 628 CO -0.29 0.70 -0.07 0.58 -1.72 0.00 0.00 179.24 178.45 1noi h VAL 629 N 0.78 0.00 0.00 -1.35 2.07 -1.02 -3.32 116.25 113.40 1noi h VAL 629 Ca 0.18 -0.25 -0.09 0.00 0.82 0.00 0.00 66.70 67.36 1noi h VAL 629 Cb 0.23 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.99 1noi h VAL 629 CO -0.01 0.00 -0.44 -0.37 0.02 0.00 0.00 177.57 176.77 1noi h VAL 630 N -0.43 1.25 0.00 2.57 -1.51 -0.79 -2.46 116.25 114.88 1noi h VAL 630 Ca -0.02 -1.54 0.00 0.00 -1.23 0.00 0.00 66.70 63.91 1noi h VAL 630 Cb 0.14 1.84 0.00 0.00 -2.13 0.00 0.00 31.29 31.14 1noi h VAL 630 CO 0.03 0.43 0.00 0.59 -1.23 0.00 0.00 177.57 177.39 1noi n ASN 631 N -3.92 0.00 -0.76 4.19 3.02 0.52 -2.82 115.26 115.49 1noi n ASN 631 Ca -0.01 0.10 0.06 0.00 -0.03 0.00 0.00 54.58 54.69 1noi n ASN 631 Cb 0.48 -0.33 0.13 0.00 -0.61 0.00 0.00 39.78 39.45 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 -3.59 3.10 8.25 -0.93 -4.99 115.22 115.74 1noi n HIS 632 Ca 0.09 -1.03 -0.39 0.00 -0.26 0.00 0.00 57.72 56.13 1noi n HIS 632 Cb 0.18 -0.19 -0.11 0.00 1.12 0.00 0.00 29.99 30.99 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 -2.66 5.91 0.41 0.41 -1.08 -1.13 -4.97 116.67 113.57 1noi s ASP 633 Ca 0.33 -0.27 0.11 0.00 -0.52 0.00 0.00 52.55 52.20 1noi s ASP 633 Cb 0.33 -2.10 0.87 0.00 -1.46 0.00 0.00 42.92 40.57 1noi s ASP 633 CO -0.08 -0.15 1.97 -0.65 0.52 0.00 0.00 175.17 176.78 1noi h PRO 634 N 8.41 0.22 -0.37 4.34 0.11 -1.94 -2.24 132.00 140.53 1noi h PRO 634 Ca -0.33 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.65 1noi h PRO 634 Cb 1.17 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1noi h PRO 634 CO 0.60 0.31 -0.12 0.28 -0.21 0.00 0.00 178.00 178.86 1noi h VAL 635 N 0.21 1.28 -0.38 3.15 2.07 -1.98 -3.28 116.25 117.33 1noi h VAL 635 Ca 0.05 -1.21 -0.12 0.00 0.82 0.00 0.00 66.70 66.23 1noi h VAL 635 Cb 0.28 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 1noi h VAL 635 CO 0.01 0.40 -0.26 0.58 0.02 0.00 0.00 177.57 178.32 1noi h VAL 636 N 0.53 1.27 0.00 2.57 2.07 -1.77 -3.47 116.25 117.46 1noi h VAL 636 Ca 0.09 -1.40 0.00 0.00 0.82 0.00 0.00 66.70 66.21 1noi h VAL 636 Cb 0.64 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 1noi h VAL 636 CO 0.04 0.46 0.00 0.61 0.02 0.00 0.00 177.57 178.71 1noi n GLY 637 N -0.15 1.80 2.73 2.17 0.00 -0.90 -1.67 105.19 109.17 1noi n GLY 637 Ca -0.00 0.19 -0.05 0.00 0.00 0.00 0.00 46.02 46.16 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 11.07 1.26 0.05 1.61 5.68 -1.26 -4.62 116.55 130.34 1noi n ASP 638 Ca 0.00 -2.41 0.08 0.00 -0.50 0.00 0.00 54.79 51.95 1noi n ASP 638 Cb 0.00 -0.41 -0.06 0.00 -1.14 0.00 0.00 41.12 39.51 1noi n ASP 638 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1noi n ARG 639 N -0.34 0.62 -3.80 0.11 1.74 -0.67 -4.76 116.66 109.55 1noi n ARG 639 Ca 0.07 0.07 -0.13 0.00 -0.77 0.00 0.00 57.85 57.09 1noi n ARG 639 Cb 0.82 -1.74 -0.14 0.00 -1.02 0.00 0.00 32.46 30.37 1noi n ARG 639 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1noi s LEU 640 N -5.29 1.31 -0.01 0.55 1.43 -1.25 -1.23 118.68 114.20 1noi s LEU 640 Ca -0.03 0.20 0.01 0.00 -1.03 0.00 0.00 54.13 53.28 1noi s LEU 640 Cb 0.10 0.28 -0.00 0.00 0.03 0.00 0.00 46.19 46.60 1noi s LEU 640 CO 0.82 -0.08 -0.05 -0.13 0.23 0.00 0.00 176.35 177.15 1noi s ARG 641 N 0.50 0.41 -0.18 1.70 1.81 -0.86 -4.79 118.95 117.54 1noi s ARG 641 Ca -0.04 -0.16 0.01 0.00 -1.72 0.00 0.00 55.73 53.82 1noi s ARG 641 Cb -0.05 -0.41 0.03 0.00 -0.45 0.00 0.00 34.95 34.07 1noi s ARG 641 CO -0.02 0.09 -0.13 0.08 -0.68 0.00 0.00 175.30 174.64 1noi s VAL 642 N -0.03 1.70 -0.11 3.52 1.01 -1.26 -0.64 120.40 124.59 1noi s VAL 642 Ca 0.01 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.12 1noi s VAL 642 Cb -0.03 -1.68 0.01 0.00 0.00 0.00 0.00 36.38 34.69 1noi s VAL 642 CO -0.00 0.32 -0.19 -0.63 0.00 0.00 0.00 175.10 174.60 1noi s ILE 643 N 1.40 1.72 -0.44 2.22 1.01 0.53 -4.59 121.20 123.06 1noi s ILE 643 Ca 0.02 -0.80 -0.18 0.00 0.00 0.00 0.00 60.65 59.69 1noi s ILE 643 Cb -0.15 -1.54 0.03 0.00 0.01 0.00 0.00 42.46 40.82 1noi s ILE 643 CO -0.10 0.49 0.49 0.12 0.00 0.00 0.00 174.94 175.94 1noi s PHE 644 N 0.74 3.14 -0.47 3.97 5.36 -1.26 -0.82 117.98 128.64 1noi s PHE 644 Ca -0.11 -0.37 -0.29 0.00 -0.96 0.00 0.00 56.93 55.21 1noi s PHE 644 Cb -0.16 -3.06 0.03 0.00 -0.34 0.00 0.00 43.02 39.49 1noi s PHE 644 CO 0.02 -0.78 1.12 -0.51 -1.46 0.00 0.00 175.22 173.61 1noi s LEU 645 N 2.29 3.68 0.16 6.12 1.43 -0.24 -4.96 118.68 127.16 1noi s LEU 645 Ca 0.14 0.46 -0.31 0.00 -1.03 0.00 0.00 54.13 53.39 1noi s LEU 645 Cb -0.17 -3.52 -0.08 0.00 0.03 0.00 0.00 46.19 42.45 1noi s LEU 645 CO 0.14 -1.22 1.34 -0.70 0.23 0.00 0.00 176.35 176.14 1noi s GLU 646 N 4.37 4.36 -1.15 1.70 2.12 -1.26 -4.09 118.70 124.74 1noi s GLU 646 Ca 0.47 2.06 -0.01 0.00 0.36 0.00 0.00 54.97 57.85 1noi s GLU 646 Cb -0.08 -3.22 -0.01 0.00 0.26 0.00 0.00 34.13 31.09 1noi s GLU 646 CO 0.31 -0.33 0.97 -1.71 -0.54 0.00 0.00 175.26 173.95 1noi n ASN 647 N 3.18 -2.88 -4.72 -1.70 5.15 -1.26 -4.92 115.26 108.12 1noi n ASN 647 Ca 0.08 -0.63 -0.42 0.00 -0.60 0.00 0.00 54.58 53.02 1noi n ASN 647 Cb 0.43 -5.07 -0.00 0.00 -0.53 0.00 0.00 39.78 34.60 1noi n ASN 647 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1noi n TYR 648 N -3.92 2.43 -3.79 1.20 9.36 -1.26 -4.89 117.16 116.29 1noi n TYR 648 Ca -0.25 0.52 -0.04 0.00 3.32 0.00 0.00 57.90 61.46 1noi n TYR 648 Cb 0.66 -2.44 -0.00 0.00 -0.63 0.00 0.00 39.34 36.93 1noi n TYR 648 CO 0.00 0.00 0.00 -0.98 0.22 0.00 0.00 176.86 176.10 1noi s ARG 649 N -1.96 1.31 0.26 2.98 1.70 -1.26 -4.82 118.95 117.17 1noi s ARG 649 Ca 0.55 -0.77 -0.04 0.00 -0.47 0.00 0.00 55.73 55.00 1noi s ARG 649 Cb -0.54 0.42 0.52 0.00 -0.57 0.00 0.00 34.95 34.78 1noi s ARG 649 CO 0.62 -0.61 1.64 0.28 -1.08 0.00 0.00 175.30 176.15 1noi h VAL 650 N 2.00 0.32 0.00 4.99 2.07 -1.93 0.90 116.25 124.60 1noi h VAL 650 Ca -0.25 -0.04 -0.10 0.00 0.82 0.00 0.00 66.70 67.13 1noi h VAL 650 Cb 1.23 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 1noi h VAL 650 CO 0.29 0.02 -0.46 0.77 0.02 0.00 0.00 177.57 178.21 1noi h SER 651 N 0.13 0.00 0.35 0.57 4.64 -1.97 0.07 113.55 117.34 1noi h SER 651 Ca 0.46 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.54 1noi h SER 651 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1noi h SER 651 CO -0.68 0.46 -1.00 0.25 -0.87 0.00 0.00 176.83 174.99 1noi h LEU 652 N 0.00 0.55 -1.69 5.97 6.46 -1.25 -2.52 115.31 122.83 1noi h LEU 652 Ca -0.00 -0.46 0.02 0.00 -0.12 0.00 0.00 57.88 57.31 1noi h LEU 652 Cb 0.84 -0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 40.59 1noi h LEU 652 CO 0.06 1.27 0.23 0.00 -0.62 0.00 0.00 178.44 179.38 1noi h ALA 653 N 0.69 1.81 0.00 1.25 0.00 -0.25 0.23 119.26 123.00 1noi h ALA 653 Ca -0.09 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1noi h ALA 653 Cb 1.65 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.31 1noi h ALA 653 CO 0.17 0.16 -0.20 0.93 0.00 0.00 0.00 179.25 180.31 1noi h GLU 654 N 0.42 0.00 0.10 0.00 5.08 -0.57 -2.70 114.58 116.91 1noi h GLU 654 Ca 0.13 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 58.13 1noi h GLU 654 Cb 0.03 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 1noi h GLU 654 CO -0.03 0.20 -2.05 1.63 -1.00 0.00 0.00 179.01 177.77 1noi n LYS 655 N -3.71 0.74 0.02 2.33 4.76 0.01 -4.54 118.16 117.77 1noi n LYS 655 Ca -0.01 0.26 -0.09 0.00 -2.87 0.00 0.00 58.31 55.59 1noi n LYS 655 Cb 0.32 -1.68 -0.13 0.00 -1.84 0.00 0.00 35.03 31.70 1noi n LYS 655 CO 0.00 0.00 0.00 -0.24 -1.37 0.00 0.00 177.40 175.79 1noi h VAL 656 N 0.01 1.25 -0.16 -0.18 3.04 -1.48 -3.37 116.25 115.37 1noi h VAL 656 Ca -0.45 -3.02 -0.09 0.00 -1.01 0.00 0.00 66.70 62.13 1noi h VAL 656 Cb 1.98 2.64 -0.00 0.00 -2.01 0.00 0.00 31.29 33.90 1noi h VAL 656 CO 0.05 0.74 -0.27 0.40 -1.01 0.00 0.00 177.57 177.47 1noi h ILE 657 N 0.01 1.36 0.00 3.17 2.04 -1.72 -1.67 117.51 120.69 1noi h ILE 657 Ca -0.16 -1.51 0.00 0.00 1.00 0.00 0.00 64.86 64.19 1noi h ILE 657 Cb 1.91 1.95 0.00 0.00 -0.74 0.00 0.00 36.82 39.94 1noi h ILE 657 CO 0.11 0.45 0.10 -0.81 0.00 0.00 0.00 178.15 178.00 1noi n PRO 658 N -4.41 0.12 0.00 2.37 -0.04 -1.26 -2.54 135.00 129.23 1noi n PRO 658 Ca -0.06 0.60 0.12 0.00 -0.04 0.00 0.00 63.50 64.13 1noi n PRO 658 Cb 0.45 -1.98 0.23 0.00 -0.04 0.00 0.00 33.50 32.16 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 -1.69 2.88 -2.39 0.55 0.00 -0.64 -4.71 120.51 114.50 1noi n ALA 659 Ca -0.01 -0.57 -0.34 0.00 0.00 0.00 0.00 53.44 52.52 1noi n ALA 659 Cb 0.13 -0.95 -0.06 0.00 0.00 0.00 0.00 19.45 18.57 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 -2.21 3.58 -0.22 0.00 0.00 -1.05 -4.70 121.76 117.16 1noi s ALA 660 Ca 0.27 -0.19 -0.10 0.00 0.00 0.00 0.00 51.96 51.94 1noi s ALA 660 Cb 0.20 -2.48 -0.10 0.00 0.00 0.00 0.00 23.12 20.74 1noi s ALA 660 CO 0.42 0.48 -0.28 -0.25 0.00 0.00 0.00 175.76 176.13 1noi n ASP 661 N 0.49 1.59 -4.37 0.00 8.00 -0.70 -4.10 116.55 117.47 1noi n ASP 661 Ca -0.03 0.24 -0.33 0.00 0.71 0.00 0.00 54.79 55.38 1noi n ASP 661 Cb 0.52 -0.62 -0.15 0.00 -0.02 0.00 0.00 41.12 40.85 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 -7.13 2.58 -0.41 0.64 0.20 -0.75 -0.47 118.68 113.35 1noi s LEU 662 Ca -0.30 -0.34 -0.14 0.00 0.69 0.00 0.00 54.13 54.04 1noi s LEU 662 Cb 0.11 -1.55 0.03 0.00 -0.43 0.00 0.00 46.19 44.36 1noi s LEU 662 CO 0.39 0.21 0.29 -0.55 -0.29 0.00 0.00 176.35 176.40 1noi s SER 663 N 0.07 5.99 -0.50 3.68 0.15 0.22 -1.78 113.70 121.54 1noi s SER 663 Ca -0.07 -1.03 -0.28 0.00 0.70 0.00 0.00 55.95 55.27 1noi s SER 663 Cb -0.15 -2.12 0.01 0.00 -1.71 0.00 0.00 66.02 62.05 1noi s SER 663 CO 0.05 -0.47 1.47 -1.61 1.20 0.00 0.00 173.24 173.87 1noi s GLU 664 N 1.63 3.35 -0.62 5.44 0.41 -0.93 -1.49 118.70 126.48 1noi s GLU 664 Ca 0.04 0.68 0.05 0.00 -0.41 0.00 0.00 54.97 55.33 1noi s GLU 664 Cb -0.20 -4.11 0.19 0.00 -1.78 0.00 0.00 34.13 28.23 1noi s GLU 664 CO 0.08 -1.87 0.53 1.04 -0.49 0.00 0.00 175.26 174.56 1noi n GLN 665 N 8.49 1.65 -1.19 1.61 1.13 -0.38 -4.78 117.38 123.92 1noi n GLN 665 Ca 0.15 -4.23 -0.14 0.00 -1.94 0.00 0.00 57.00 50.83 1noi n GLN 665 Cb 0.49 -2.10 0.14 0.00 0.11 0.00 0.00 30.24 28.87 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 1.79 2.74 -1.11 5.09 -5.35 -1.26 -3.25 119.36 118.02 1noi n ILE 666 Ca 0.24 -3.10 -0.32 0.00 -0.27 0.00 0.00 62.75 59.30 1noi n ILE 666 Cb 0.40 -0.64 0.12 0.00 -1.74 0.00 0.00 39.64 37.78 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 -2.64 3.88 0.19 7.28 1.04 -1.26 -4.71 113.70 117.48 1noi s SER 667 Ca 0.50 2.08 -0.33 0.00 0.48 0.00 0.00 55.95 58.68 1noi s SER 667 Cb 0.43 -2.55 -0.13 0.00 0.10 0.00 0.00 66.02 63.87 1noi s SER 667 CO 0.01 -2.46 1.67 0.41 0.98 0.00 0.00 173.24 173.85 1noi n THR 668 N -3.56 0.01 -1.61 2.02 -1.04 -1.23 -4.67 114.28 104.20 1noi n THR 668 Ca 0.11 -0.00 -0.53 0.00 -2.04 0.00 0.00 64.05 61.59 1noi n THR 668 Cb 0.52 -1.83 -0.06 0.00 -1.82 0.00 0.00 70.33 67.14 1noi n THR 668 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1noi n ALA 669 N 3.80 -0.72 -0.00 2.41 0.00 -1.26 -2.04 120.51 122.71 1noi n ALA 669 Ca 0.16 0.49 0.00 0.00 0.00 0.00 0.00 53.44 54.10 1noi n ALA 669 Cb 0.33 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.66 1noi n ALA 669 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1noi n GLY 670 N 2.84 0.02 0.09 0.00 0.00 -1.26 -4.69 105.19 102.19 1noi n GLY 670 Ca 0.20 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.15 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 1.30 -3.30 2.61 -2.24 -0.86 -4.83 114.28 104.95 1noi n THR 671 Ca 0.00 -0.78 -0.43 0.00 -2.27 0.00 0.00 64.05 60.56 1noi n THR 671 Cb 0.00 -0.62 -0.08 0.00 -2.10 0.00 0.00 70.33 67.52 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 -2.68 3.09 0.22 -0.78 2.56 -1.26 -4.73 118.70 115.12 1noi s GLU 672 Ca -0.07 -0.83 -0.08 0.00 0.00 0.00 0.00 54.97 53.99 1noi s GLU 672 Cb 0.08 -4.00 0.19 0.00 2.00 0.00 0.00 34.13 32.39 1noi s GLU 672 CO 0.83 -0.92 1.85 0.00 -0.56 0.00 0.00 175.26 176.46 1noi h ALA 673 N 8.77 1.09 0.00 6.30 0.00 -1.88 -2.94 119.26 130.60 1noi h ALA 673 Ca -0.27 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1noi h ALA 673 Cb 1.11 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1noi h ALA 673 CO 0.83 0.59 0.00 0.45 0.00 0.00 0.00 179.25 181.12 1noi n SER 674 N -4.39 -0.50 0.00 0.00 2.88 -1.26 -4.27 113.62 106.08 1noi n SER 674 Ca 0.09 0.27 0.00 0.00 -1.33 0.00 0.00 58.87 57.90 1noi n SER 674 Cb 0.08 0.61 0.00 0.00 -0.75 0.00 0.00 64.21 64.16 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 0.85 0.14 0.00 0.46 0.00 -1.26 -1.30 105.19 104.07 1noi n GLY 675 Ca 0.00 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.35 1noi n GLY 675 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1noi n THR 676 N 0.35 0.00 0.03 2.61 5.66 -1.26 -4.77 114.28 116.90 1noi n THR 676 Ca 0.00 0.00 0.01 0.00 -3.05 0.00 0.00 64.05 61.01 1noi n THR 676 Cb 0.00 0.00 0.33 0.00 -1.55 0.00 0.00 70.33 69.11 1noi n THR 676 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 1noi h GLY 677 N 0.00 0.49 0.95 1.09 0.00 -1.95 -2.42 103.07 101.24 1noi h GLY 677 Ca 0.00 -0.29 0.02 0.00 0.00 0.00 0.00 47.33 47.06 1noi h GLY 677 CO 0.00 0.27 0.61 3.45 0.00 0.00 0.00 176.54 180.87 1noi h ASN 678 N 0.44 1.05 1.56 0.19 -1.07 -1.94 -1.53 115.58 114.27 1noi h ASN 678 Ca 0.10 -0.02 0.00 0.00 0.07 0.00 0.00 56.30 56.45 1noi h ASN 678 Cb 0.32 -0.25 0.00 0.00 -2.07 0.00 0.00 38.32 36.32 1noi h ASN 678 CO 0.01 0.74 0.00 0.24 0.07 0.00 0.00 177.43 178.49 1noi h MET 679 N 1.23 0.00 0.04 4.14 2.86 -1.75 -2.77 114.93 118.68 1noi h MET 679 Ca 0.35 0.00 -0.23 0.00 -2.06 0.00 0.00 59.70 57.77 1noi h MET 679 Cb -0.09 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 1noi h MET 679 CO -0.09 0.00 -1.02 0.87 1.06 0.00 0.00 176.91 177.73 1noi h LYS 680 N 0.00 0.23 -0.10 1.72 1.57 -1.19 -2.84 116.57 115.97 1noi h LYS 680 Ca 0.00 -0.30 -0.20 0.00 -1.87 0.00 0.00 60.65 58.27 1noi h LYS 680 Cb 0.78 0.10 0.01 0.00 0.08 0.00 0.00 32.23 33.20 1noi h LYS 680 CO 0.00 1.07 -0.74 0.74 -0.57 0.00 0.00 179.45 179.95 1noi h PHE 681 N 0.10 0.93 -0.77 -1.35 0.04 -1.50 -2.67 116.94 111.73 1noi h PHE 681 Ca -0.07 -0.44 -0.02 0.00 2.80 0.00 0.00 57.97 60.24 1noi h PHE 681 Cb 1.69 -0.13 -0.04 0.00 2.20 0.00 0.00 35.95 39.68 1noi h PHE 681 CO 0.04 1.25 0.38 1.98 -0.60 0.00 0.00 178.31 181.37 1noi h MET 682 N 0.33 1.09 0.00 1.51 4.05 -1.46 -1.87 114.93 118.59 1noi h MET 682 Ca -0.07 -0.15 -0.06 0.00 -0.28 0.00 0.00 59.70 59.14 1noi h MET 682 Cb 1.38 -0.20 -0.01 0.00 -0.80 0.00 0.00 31.60 31.97 1noi h MET 682 CO 0.15 0.83 -0.30 1.25 0.23 0.00 0.00 176.91 179.07 1noi h LEU 683 N 1.09 0.00 -3.46 3.39 6.46 -1.47 -3.05 115.31 118.28 1noi h LEU 683 Ca 0.27 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 58.03 1noi h LEU 683 Cb 0.09 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.02 1noi h LEU 683 CO -0.04 0.30 0.00 0.59 -0.62 0.00 0.00 178.44 178.68 1noi n ASN 684 N -3.64 5.18 -0.14 1.25 3.02 -0.95 -4.90 115.26 115.09 1noi n ASN 684 Ca -0.01 -2.92 0.00 0.00 -0.03 0.00 0.00 54.58 51.62 1noi n ASN 684 Cb 0.42 -0.64 0.00 0.00 -0.61 0.00 0.00 39.78 38.95 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 0.35 0.65 3.63 7.41 0.00 -1.15 -4.72 105.19 111.36 1noi n GLY 685 Ca 0.26 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.27 3.12 0.23 4.61 0.00 -0.75 -4.78 121.76 121.92 1noi s ALA 686 Ca 0.00 -1.25 -0.03 0.00 0.00 0.00 0.00 51.96 50.68 1noi s ALA 686 Cb 0.00 -1.00 -0.05 0.00 0.00 0.00 0.00 23.12 22.07 1noi s ALA 686 CO 0.00 0.61 0.45 -0.51 0.00 0.00 0.00 175.76 176.31 1noi s LEU 687 N -2.47 4.17 -0.09 0.00 1.43 0.38 -4.33 118.68 117.77 1noi s LEU 687 Ca 0.24 0.54 0.02 0.00 -1.03 0.00 0.00 54.13 53.90 1noi s LEU 687 Cb -0.11 -3.32 -0.02 0.00 0.03 0.00 0.00 46.19 42.77 1noi s LEU 687 CO 0.16 -0.09 -0.14 -0.89 0.23 0.00 0.00 176.35 175.62 1noi s THR 688 N -1.93 2.98 -0.28 5.49 2.01 -1.26 0.73 115.64 123.38 1noi s THR 688 Ca 0.41 -0.72 -0.04 0.00 0.31 0.00 0.00 61.69 61.64 1noi s THR 688 Cb -0.11 -2.20 0.02 0.00 0.01 0.00 0.00 72.50 70.22 1noi s THR 688 CO 0.29 0.56 0.02 -0.51 -0.69 0.00 0.00 174.62 174.28 1noi s ILE 689 N -0.18 3.46 0.06 1.82 2.07 -0.56 -1.13 121.20 126.75 1noi s ILE 689 Ca -0.00 -0.88 -0.27 0.00 -1.41 0.00 0.00 60.65 58.08 1noi s ILE 689 Cb -0.13 -2.79 0.09 0.00 0.13 0.00 0.00 42.46 39.76 1noi s ILE 689 CO 0.03 0.11 0.99 -0.83 -1.91 0.00 0.00 174.94 173.33 1noi s GLY 690 N 1.41 -0.33 0.96 1.50 0.00 -0.88 -1.24 107.32 108.74 1noi s GLY 690 Ca 0.01 0.56 -0.14 0.00 0.00 0.00 0.00 44.72 45.15 1noi s GLY 690 CO -0.01 0.15 1.15 -0.51 0.00 0.00 0.00 173.10 173.89 1noi s THR 691 N -3.08 1.95 -1.25 0.90 -4.23 -1.20 -2.60 115.64 106.13 1noi s THR 691 Ca 0.10 0.00 -0.09 0.00 -1.18 0.00 0.00 61.69 60.52 1noi s THR 691 Cb -0.00 -2.72 0.19 0.00 1.34 0.00 0.00 72.50 71.30 1noi s THR 691 CO -0.02 0.00 1.80 0.23 -0.54 0.00 0.00 174.62 176.09 1noi n MET 692 N -3.93 3.73 -4.41 3.99 2.81 -1.26 -4.64 117.12 113.41 1noi n MET 692 Ca 0.08 -3.68 -0.22 0.00 -1.81 0.00 0.00 57.70 52.07 1noi n MET 692 Cb 0.59 -2.87 -0.13 0.00 -0.71 0.00 0.00 33.22 30.10 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 0.59 2.06 0.98 7.83 2.15 -1.26 -4.64 116.67 124.38 1noi s ASP 693 Ca 0.38 -0.53 0.00 0.00 0.43 0.00 0.00 52.55 52.83 1noi s ASP 693 Cb 0.08 -0.14 0.00 0.00 -0.30 0.00 0.00 42.92 42.57 1noi s ASP 693 CO 0.02 0.06 0.00 0.61 -0.17 0.00 0.00 175.17 175.69 1noi n GLY 694 N 1.68 2.66 0.04 2.66 0.00 -1.11 -1.61 105.19 109.51 1noi n GLY 694 Ca -0.18 -0.41 0.14 0.00 0.00 0.00 0.00 46.02 45.57 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 8.35 2.77 -0.32 4.61 0.00 -0.42 -3.52 120.51 131.97 1noi n ALA 695 Ca 0.00 -0.22 0.15 0.00 0.00 0.00 0.00 53.44 53.36 1noi n ALA 695 Cb 0.00 -1.34 0.37 0.00 0.00 0.00 0.00 19.45 18.48 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 0.22 0.68 0.19 0.00 2.35 -1.50 -1.49 115.58 116.03 1noi h ASN 696 Ca 0.00 0.08 0.01 0.00 -0.55 0.00 0.00 56.30 55.84 1noi h ASN 696 Cb 0.43 -0.05 -0.04 0.00 0.05 0.00 0.00 38.32 38.71 1noi h ASN 696 CO 0.00 0.26 -0.45 0.58 -1.65 0.00 0.00 177.43 176.17 1noi h VAL 697 N 0.67 0.11 0.00 2.81 2.07 -1.64 -1.67 116.25 118.60 1noi h VAL 697 Ca 0.54 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.98 1noi h VAL 697 Cb 0.96 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 1noi h VAL 697 CO -0.31 0.00 -0.41 -0.33 0.02 0.00 0.00 177.57 176.54 1noi h GLU 698 N -0.73 0.00 -0.31 1.57 5.08 -1.61 -2.18 114.58 116.40 1noi h GLU 698 Ca 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1noi h GLU 698 Cb 0.73 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 1noi h GLU 698 CO -0.22 0.41 0.04 0.52 -1.00 0.00 0.00 179.01 178.76 1noi h MET 699 N 0.00 0.52 -0.16 2.33 2.86 -1.10 -2.79 114.93 116.60 1noi h MET 699 Ca -0.00 -0.14 -0.03 0.00 -2.06 0.00 0.00 59.70 57.46 1noi h MET 699 Cb 0.74 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.33 1noi h MET 699 CO 0.05 0.62 -0.05 0.00 1.06 0.00 0.00 176.91 178.60 1noi h ALA 700 N 0.88 1.64 0.00 6.32 0.00 -0.93 -0.62 119.26 126.55 1noi h ALA 700 Ca 0.09 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1noi h ALA 700 Cb 0.36 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1noi h ALA 700 CO 0.01 0.27 -0.26 1.49 0.00 0.00 0.00 179.25 180.76 1noi h GLU 701 N 0.22 0.00 0.06 0.00 4.81 -1.40 0.35 114.58 118.62 1noi h GLU 701 Ca 0.05 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 58.96 1noi h GLU 701 Cb 0.23 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 1noi h GLU 701 CO 0.01 0.26 -1.76 0.39 -0.73 0.00 0.00 179.01 177.18 1noi n GLU 702 N -3.20 0.66 0.16 1.92 -0.58 -0.83 -4.09 120.64 114.68 1noi n GLU 702 Ca 0.02 0.39 0.02 0.00 -0.42 0.00 0.00 57.16 57.18 1noi n GLU 702 Cb 0.60 -1.70 0.20 0.00 -0.57 0.00 0.00 31.44 29.97 1noi n GLU 702 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1noi h ALA 703 N -0.26 0.86 0.00 0.62 0.00 -1.25 -3.47 119.26 115.76 1noi h ALA 703 Ca -0.42 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.02 1noi h ALA 703 Cb 1.68 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.39 1noi h ALA 703 CO -0.09 0.64 0.00 0.41 0.00 0.00 0.00 179.25 180.21 1noi n GLY 704 N 0.55 1.27 0.29 0.00 0.00 0.04 -4.57 105.19 102.76 1noi n GLY 704 Ca 0.00 -1.40 0.08 0.00 0.00 0.00 0.00 46.02 44.70 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 0.19 0.00 1.61 5.08 -1.70 0.27 114.58 120.03 1noi h GLU 705 Ca 0.00 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1noi h GLU 705 Cb 0.00 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 1noi h GLU 705 CO 0.00 0.12 -0.01 0.93 -1.00 0.00 0.00 179.01 179.06 1noi h GLU 706 N 0.19 0.00 -0.58 2.33 3.07 -1.88 -2.74 114.58 114.97 1noi h GLU 706 Ca 0.08 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.94 1noi h GLU 706 Cb 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.00 1noi h GLU 706 CO -0.01 0.01 0.00 0.09 -1.40 0.00 0.00 179.01 177.69 1noi n ASN 707 N -3.87 4.44 -3.97 1.42 3.02 0.95 -4.93 115.26 112.32 1noi n ASN 707 Ca -0.03 -2.43 -0.17 0.00 -0.03 0.00 0.00 54.58 51.93 1noi n ASN 707 Cb 0.09 -0.53 -0.15 0.00 -0.61 0.00 0.00 39.78 38.58 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 -1.80 0.57 -1.17 3.10 5.36 -1.03 -4.85 117.98 118.15 1noi s PHE 708 Ca 0.47 -0.11 -0.09 0.00 -0.96 0.00 0.00 56.93 56.24 1noi s PHE 708 Cb 0.30 -0.38 0.23 0.00 -0.34 0.00 0.00 43.02 42.84 1noi s PHE 708 CO 0.23 -0.02 1.49 1.19 -1.46 0.00 0.00 175.22 176.64 1noi n PHE 709 N 3.02 3.77 -2.24 10.12 3.01 -0.28 -4.93 117.46 129.94 1noi n PHE 709 Ca -0.14 -3.13 -0.38 0.00 1.01 0.00 0.00 57.45 54.81 1noi n PHE 709 Cb 0.57 -1.76 -0.01 0.00 -0.01 0.00 0.00 39.48 38.27 1noi n PHE 709 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1noi s ILE 710 N -0.62 3.04 0.23 4.37 -1.09 -1.26 -2.06 121.20 123.81 1noi s ILE 710 Ca 0.36 0.86 -0.04 0.00 -2.23 0.00 0.00 60.65 59.59 1noi s ILE 710 Cb 0.01 -3.47 0.02 0.00 -1.58 0.00 0.00 42.46 37.43 1noi s ILE 710 CO 0.01 0.06 0.37 2.22 -1.23 0.00 0.00 174.94 176.38 1noi n PHE 711 N -0.08 -1.37 -3.10 3.97 -1.74 -1.07 -4.91 117.46 109.17 1noi n PHE 711 Ca 0.05 -1.32 0.03 0.00 -0.56 0.00 0.00 57.45 55.66 1noi n PHE 711 Cb 0.46 0.43 -0.01 0.00 1.52 0.00 0.00 39.48 41.88 1noi n PHE 711 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1noi n GLY 712 N -0.34 -1.75 3.76 4.97 0.00 -1.26 -4.24 105.19 106.33 1noi n GLY 712 Ca -0.02 -1.27 -0.41 0.00 0.00 0.00 0.00 46.02 44.32 1noi n GLY 712 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1noi s MET 713 N -0.58 4.40 0.40 1.61 1.75 -1.26 -4.89 119.30 120.73 1noi s MET 713 Ca 0.00 2.13 0.06 0.00 -1.25 0.00 0.00 55.69 56.63 1noi s MET 713 Cb 0.00 -3.11 0.00 0.00 2.84 0.00 0.00 34.83 34.56 1noi s MET 713 CO 0.00 -0.15 0.56 1.03 -0.65 0.00 0.00 175.02 175.81 1noi s ARG 714 N -1.37 2.97 0.56 4.11 3.00 -1.26 -4.34 118.95 122.62 1noi s ARG 714 Ca 0.50 -0.98 0.25 0.00 0.00 0.00 0.00 55.73 55.50 1noi s ARG 714 Cb -0.38 -2.73 1.60 0.00 0.00 0.00 0.00 34.95 33.43 1noi s ARG 714 CO 0.48 -0.16 2.20 0.28 0.00 0.00 0.00 175.30 178.10 1noi h VAL 715 N 0.66 0.70 0.06 3.52 2.07 -1.83 -1.15 116.25 120.28 1noi h VAL 715 Ca -0.44 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 1noi h VAL 715 Cb 1.27 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 32.01 1noi h VAL 715 CO 0.51 0.00 -0.03 -0.08 0.02 0.00 0.00 177.57 177.99 1noi h GLU 716 N 0.00 -0.08 -0.15 1.57 4.22 -1.96 -3.09 114.58 115.08 1noi h GLU 716 Ca 0.02 0.01 -0.07 0.00 0.08 0.00 0.00 59.36 59.39 1noi h GLU 716 Cb 0.08 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1noi h GLU 716 CO -0.00 0.09 -0.22 -0.44 -2.18 0.00 0.00 179.01 176.26 1noi h ASP 717 N -0.24 0.26 -0.08 1.04 3.32 -1.60 -2.67 116.42 116.45 1noi h ASP 717 Ca -0.01 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.97 1noi h ASP 717 Cb 0.21 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 1noi h ASP 717 CO 0.01 0.50 0.05 0.58 -1.72 0.00 0.00 179.24 178.67 1noi h VAL 718 N 0.25 1.03 -0.44 -1.35 2.07 -1.44 -1.50 116.25 114.86 1noi h VAL 718 Ca 0.04 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 1noi h VAL 718 Cb 0.53 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1noi h VAL 718 CO 0.04 0.03 0.25 0.44 0.02 0.00 0.00 177.57 178.34 1noi h ASP 719 N 0.10 0.55 -0.88 0.57 3.32 -1.52 0.12 116.42 118.68 1noi h ASP 719 Ca 0.03 -0.09 0.03 0.00 0.02 0.00 0.00 57.03 57.02 1noi h ASP 719 Cb -0.00 -0.14 -0.05 0.00 0.22 0.00 0.00 39.33 39.36 1noi h ASP 719 CO -0.01 0.48 0.57 0.03 -1.72 0.00 0.00 179.24 178.60 1noi h ARG 720 N 0.58 1.10 -0.44 3.56 2.47 -1.40 -0.65 114.38 119.59 1noi h ARG 720 Ca 0.16 -0.07 -0.08 0.00 -1.26 0.00 0.00 59.98 58.73 1noi h ARG 720 Cb 0.05 -0.25 -0.02 0.00 -1.65 0.00 0.00 29.97 28.10 1noi h ARG 720 CO -0.03 0.73 -0.04 1.25 0.56 0.00 0.00 179.97 182.44 1noi h LEU 721 N 1.13 0.71 -0.77 3.04 5.85 -0.07 -1.98 115.31 123.22 1noi h LEU 721 Ca 0.35 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.84 1noi h LEU 721 Cb -0.03 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.77 1noi h LEU 721 CO -0.11 0.81 0.33 0.44 -0.34 0.00 0.00 178.44 179.57 1noi h ASP 722 N 0.69 1.05 1.67 1.25 3.32 0.60 0.65 116.42 125.65 1noi h ASP 722 Ca 0.13 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 1noi h ASP 722 Cb 0.48 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.76 1noi h ASP 722 CO 0.02 0.92 -0.11 1.56 -1.72 0.00 0.00 179.24 179.91 1noi h GLN 723 N 1.11 0.00 0.00 3.56 4.20 -0.85 -3.12 115.11 120.01 1noi h GLN 723 Ca 0.26 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.74 1noi h GLN 723 Cb 0.19 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.93 1noi h GLN 723 CO -0.02 0.11 -1.57 2.89 -0.67 0.00 0.00 178.83 179.57 1noi n ARG 724 N -3.15 0.63 0.00 1.46 1.85 -0.78 -5.04 116.66 111.63 1noi n ARG 724 Ca 0.03 0.25 0.00 0.00 -1.00 0.00 0.00 57.85 57.13 1noi n ARG 724 Cb 0.53 -1.80 0.00 0.00 -1.05 0.00 0.00 32.46 30.14 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 1.47 2.14 3.62 2.89 0.00 0.19 -5.02 105.19 110.48 1noi n GLY 725 Ca -0.13 -1.33 -0.43 0.00 0.00 0.00 0.00 46.02 44.13 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 3.12 -0.26 1.61 5.04 -1.21 -4.88 117.35 120.78 1noi s TYR 726 Ca 0.00 0.96 0.02 0.00 -2.44 0.00 0.00 57.07 55.62 1noi s TYR 726 Cb 0.00 -3.61 0.06 0.00 0.35 0.00 0.00 41.96 38.76 1noi s TYR 726 CO 0.00 -0.77 -0.09 1.21 -1.34 0.00 0.00 175.55 174.57 1noi s ASN 727 N 1.75 4.28 0.41 4.32 3.04 -1.26 -4.98 114.94 122.50 1noi s ASN 727 Ca 0.41 -1.36 0.17 0.00 0.04 0.00 0.00 52.86 52.11 1noi s ASN 727 Cb -0.12 -1.44 0.89 0.00 -1.54 0.00 0.00 41.25 39.04 1noi s ASN 727 CO 0.16 -0.21 1.88 0.00 -3.04 0.00 0.00 177.10 175.90 1noi h ALA 728 N 7.82 1.35 -0.11 1.71 0.00 -1.88 -2.52 119.26 125.63 1noi h ALA 728 Ca -0.18 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 1noi h ALA 728 Cb 1.05 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1noi h ALA 728 CO 0.45 0.37 -0.08 0.37 0.00 0.00 0.00 179.25 180.36 1noi h GLN 729 N 0.00 0.16 0.00 0.00 5.75 -1.93 -0.73 115.11 118.35 1noi h GLN 729 Ca -0.00 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 1noi h GLN 729 Cb 0.59 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.11 1noi h GLN 729 CO 0.04 0.26 0.00 1.05 -2.65 0.00 0.00 178.83 177.52 1noi h GLU 730 N 0.16 0.00 0.12 1.69 4.11 -1.88 -0.61 114.58 118.17 1noi h GLU 730 Ca 0.04 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 59.28 1noi h GLU 730 Cb 0.25 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.52 1noi h GLU 730 CO 0.01 0.00 -0.83 1.88 0.07 0.00 0.00 179.01 180.14 1noi h TYR 731 N 0.00 0.48 -0.71 2.06 0.05 -1.29 -2.89 116.97 114.67 1noi h TYR 731 Ca 0.00 -0.35 0.16 0.00 0.05 0.00 0.00 58.73 58.59 1noi h TYR 731 Cb 0.75 -0.02 -0.12 0.00 1.01 0.00 0.00 36.73 38.36 1noi h TYR 731 CO 0.00 1.32 0.06 -0.92 -1.05 0.00 0.00 178.16 177.57 1noi h TYR 732 N -0.42 0.05 -0.33 4.88 3.20 -0.82 -2.44 116.97 121.08 1noi h TYR 732 Ca -0.16 0.05 -0.16 0.00 3.14 0.00 0.00 58.73 61.60 1noi h TYR 732 Cb 1.60 0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.96 1noi h TYR 732 CO 0.19 -0.17 -0.44 -0.44 -1.64 0.00 0.00 178.16 175.66 1noi h ASP 733 N 0.15 0.93 -0.05 -2.11 3.32 -1.23 -3.22 116.42 114.21 1noi h ASP 733 Ca 0.39 -0.44 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1noi h ASP 733 Cb 0.67 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.95 1noi h ASP 733 CO -0.58 1.23 0.00 -2.11 -1.72 0.00 0.00 179.24 176.06 1noi n ARG 734 N -4.03 1.73 -3.81 3.56 1.85 -0.96 -4.78 116.66 110.22 1noi n ARG 734 Ca -0.03 -1.07 -0.30 0.00 -1.00 0.00 0.00 57.85 55.45 1noi n ARG 734 Cb 0.57 -1.46 -0.15 0.00 -1.05 0.00 0.00 32.46 30.37 1noi n ARG 734 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 1noi s ILE 735 N -1.96 1.39 0.37 8.89 1.01 -0.96 -5.04 121.20 124.90 1noi s ILE 735 Ca 0.36 -1.90 0.04 0.00 0.00 0.00 0.00 60.65 59.15 1noi s ILE 735 Cb 0.20 -2.03 0.27 0.00 0.01 0.00 0.00 42.46 40.91 1noi s ILE 735 CO 0.32 -0.70 2.03 -0.65 0.00 0.00 0.00 174.94 175.94 1noi h PRO 736 N 7.69 0.73 -0.11 2.79 0.11 -1.86 -1.93 132.00 139.42 1noi h PRO 736 Ca -0.09 -0.04 -0.15 0.00 0.11 0.00 0.00 66.00 65.83 1noi h PRO 736 Cb 1.00 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.93 1noi h PRO 736 CO 0.49 0.49 -0.59 0.93 -0.21 0.00 0.00 178.00 179.11 1noi h GLU 737 N 0.76 0.35 -0.50 1.05 3.07 -1.96 -0.60 114.58 116.75 1noi h GLU 737 Ca 0.21 -0.23 -0.09 0.00 -0.50 0.00 0.00 59.36 58.74 1noi h GLU 737 Cb -0.08 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 27.84 1noi h GLU 737 CO -0.05 0.84 -0.04 1.25 -1.40 0.00 0.00 179.01 179.61 1noi h LEU 738 N 0.27 0.85 -1.00 1.33 5.85 -1.73 -2.29 115.31 118.58 1noi h LEU 738 Ca -0.00 -0.23 0.11 0.00 0.84 0.00 0.00 57.88 58.60 1noi h LEU 738 Cb 1.10 -0.23 -0.08 0.00 0.37 0.00 0.00 40.66 41.82 1noi h LEU 738 CO 0.10 0.93 0.63 -0.09 -0.34 0.00 0.00 178.44 179.67 1noi h ARG 739 N 0.80 0.98 -0.31 1.25 2.43 -0.76 -2.10 114.38 116.67 1noi h ARG 739 Ca 0.14 -0.06 -0.14 0.00 -0.81 0.00 0.00 59.98 59.12 1noi h ARG 739 Cb 0.53 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 1noi h ARG 739 CO 0.03 0.65 -0.37 0.37 -1.51 0.00 0.00 179.97 179.13 1noi h GLN 740 N 1.01 0.71 -0.07 0.20 4.15 -0.60 -2.45 115.11 118.05 1noi h GLN 740 Ca 0.49 -0.35 -0.08 0.00 0.77 0.00 0.00 58.65 59.48 1noi h GLN 740 Cb 0.46 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.15 1noi h GLN 740 CO -0.26 0.97 -0.26 0.82 -1.93 0.00 0.00 178.83 178.17 1noi h ILE 741 N 0.59 1.43 -0.94 2.39 2.04 -0.87 -2.50 117.51 119.64 1noi h ILE 741 Ca 0.05 -1.65 0.01 0.00 1.00 0.00 0.00 64.86 64.27 1noi h ILE 741 Cb 0.90 2.30 -0.05 0.00 -0.74 0.00 0.00 36.82 39.24 1noi h ILE 741 CO 0.08 0.47 0.62 0.40 0.00 0.00 0.00 178.15 179.72 1noi h ILE 742 N -0.20 1.24 -0.11 -0.67 1.08 -1.48 0.13 117.51 117.51 1noi h ILE 742 Ca -0.01 -0.45 -0.16 0.00 -0.39 0.00 0.00 64.86 63.84 1noi h ILE 742 Cb 0.90 -0.14 -0.01 0.00 -3.07 0.00 0.00 36.82 34.50 1noi h ILE 742 CO 0.05 0.24 -0.63 -0.33 -0.69 0.00 0.00 178.15 176.79 1noi h GLU 743 N 1.28 0.40 -0.59 2.37 4.39 -1.40 0.67 114.58 121.70 1noi h GLU 743 Ca 0.34 -0.28 -0.00 0.00 0.34 0.00 0.00 59.36 59.76 1noi h GLU 743 Cb -0.14 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.53 1noi h GLU 743 CO -0.07 0.90 0.36 1.96 -1.16 0.00 0.00 179.01 181.00 1noi h GLN 744 N 0.29 0.79 -0.06 2.33 4.20 -0.72 0.42 115.11 122.36 1noi h GLN 744 Ca -0.01 -0.06 -0.18 0.00 0.06 0.00 0.00 58.65 58.46 1noi h GLN 744 Cb 1.17 -0.17 0.01 0.00 0.30 0.00 0.00 27.48 28.80 1noi h GLN 744 CO 0.11 0.55 -0.66 -0.07 -0.67 0.00 0.00 178.83 178.09 1noi h LEU 745 N 0.80 0.68 -0.30 1.46 3.38 -0.27 0.96 115.31 122.03 1noi h LEU 745 Ca 0.21 -0.69 -0.01 0.00 0.09 0.00 0.00 57.88 57.48 1noi h LEU 745 Cb -0.04 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1noi h LEU 745 CO -0.04 1.27 0.14 0.28 0.09 0.00 0.00 178.44 180.18 1noi h SER 746 N 0.15 0.40 0.43 -0.43 0.02 0.82 -3.25 113.55 111.69 1noi h SER 746 Ca -0.06 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.75 1noi h SER 746 Cb 1.32 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.76 1noi h SER 746 CO 0.13 0.42 0.00 -1.54 -1.14 0.00 0.00 176.83 174.71 1noi n SER 747 N -4.77 0.00 0.00 3.07 3.41 0.13 -4.47 113.62 110.99 1noi n SER 747 Ca -0.02 -0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.54 1noi n SER 747 Cb 0.11 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 63.78 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 0.67 0.63 0.37 5.00 0.00 -1.08 -4.87 105.19 105.91 1noi n GLY 748 Ca 0.11 -0.68 0.06 0.00 0.00 0.00 0.00 46.02 45.51 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 1.09 0.00 1.61 3.57 -1.05 -1.98 116.94 120.19 1noi h PHE 749 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1noi h PHE 749 Cb 0.04 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 38.43 1noi h PHE 749 CO 0.00 0.49 -1.04 1.19 -2.23 0.00 0.00 178.31 176.72 1noi n PHE 750 N -4.56 0.07 -2.43 0.41 3.72 -1.25 -4.29 117.46 109.13 1noi n PHE 750 Ca 0.17 0.02 -0.22 0.00 -0.05 0.00 0.00 57.45 57.37 1noi n PHE 750 Cb 0.30 -0.21 0.01 0.00 -0.94 0.00 0.00 39.48 38.64 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 -1.71 4.01 -0.37 4.37 3.41 -0.96 -4.74 113.62 117.64 1noi n SER 751 Ca 0.03 -3.45 0.32 0.00 -0.26 0.00 0.00 58.87 55.51 1noi n SER 751 Cb 0.39 -0.45 0.64 0.00 -0.26 0.00 0.00 64.21 64.53 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 2.56 0.16 -0.16 4.33 0.13 -1.56 0.27 132.00 137.74 1noi h PRO 752 Ca 0.22 -0.01 -0.13 0.00 -0.87 0.00 0.00 66.00 65.21 1noi h PRO 752 Cb 1.12 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 1noi h PRO 752 CO 0.73 0.11 -0.46 -0.22 -0.23 0.00 0.00 178.00 177.93 1noi h LYS 753 N 0.17 0.39 -2.64 0.86 1.63 -1.94 -3.36 116.57 111.68 1noi h LYS 753 Ca 0.64 -0.21 -0.60 0.00 -0.85 0.00 0.00 60.65 59.64 1noi h LYS 753 Cb 2.12 0.01 -0.39 0.00 -0.60 0.00 0.00 32.23 33.36 1noi h LYS 753 CO -0.19 0.77 -0.83 -0.65 -3.45 0.00 0.00 179.45 175.09 1noi s GLN 754 N -4.10 1.36 0.26 1.90 -0.21 0.95 -5.07 119.66 114.75 1noi s GLN 754 Ca -0.06 -2.40 -0.02 0.00 0.02 0.00 0.00 55.36 52.91 1noi s GLN 754 Cb 0.13 -2.06 0.50 0.00 1.00 0.00 0.00 33.01 32.57 1noi s GLN 754 CO 0.80 -1.33 1.77 -1.35 -2.12 0.00 0.00 175.29 173.06 1noi h PRO 755 N 5.77 0.62 -0.93 2.91 0.11 -1.70 -2.57 132.00 136.20 1noi h PRO 755 Ca 0.19 -0.04 -0.59 0.00 0.11 0.00 0.00 66.00 65.68 1noi h PRO 755 Cb 0.87 -0.14 -0.30 0.00 0.11 0.00 0.00 31.00 31.55 1noi h PRO 755 CO 0.47 0.41 0.60 -0.40 -0.21 0.00 0.00 178.00 178.87 1noi n ASP 756 N -4.86 6.02 -0.09 -2.05 5.68 -1.26 -2.63 116.55 117.37 1noi n ASP 756 Ca 0.16 -3.74 0.00 0.00 -0.50 0.00 0.00 54.79 50.71 1noi n ASP 756 Cb 0.40 -0.86 0.29 0.00 -1.14 0.00 0.00 41.12 39.81 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 1.68 0.66 -2.32 -2.12 5.85 -1.80 -2.15 115.31 115.10 1noi h LEU 757 Ca 0.57 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 59.22 1noi h LEU 757 Cb 1.49 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.35 1noi h LEU 757 CO 1.30 0.58 0.00 0.49 -0.34 0.00 0.00 178.44 180.47 1noi n PHE 758 N -4.36 1.10 -0.25 1.25 3.72 -1.26 -4.43 117.46 113.23 1noi n PHE 758 Ca 0.04 -0.39 -0.06 0.00 -0.05 0.00 0.00 57.45 56.99 1noi n PHE 758 Cb 0.14 -0.28 -0.04 0.00 -0.94 0.00 0.00 39.48 38.35 1noi n PHE 758 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1noi n LYS 759 N 0.43 -0.24 -0.08 -1.08 0.00 -0.81 -1.54 118.16 114.83 1noi n LYS 759 Ca 0.16 0.92 -0.10 0.00 0.00 0.00 0.00 58.31 59.29 1noi n LYS 759 Cb 0.72 -1.36 -0.03 0.00 0.00 0.00 0.00 35.03 34.37 1noi n LYS 759 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 1noi h ASP 760 N 0.00 0.37 -0.12 3.14 3.32 -1.84 -2.04 116.42 119.25 1noi h ASP 760 Ca 0.12 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 1noi h ASP 760 Cb 0.27 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.72 1noi h ASP 760 CO -0.58 0.43 -0.01 0.40 -1.72 0.00 0.00 179.24 177.77 1noi h ILE 761 N 0.29 1.26 -0.31 0.35 2.04 -1.68 0.44 117.51 119.90 1noi h ILE 761 Ca 0.09 -0.85 0.04 0.00 1.00 0.00 0.00 64.86 65.14 1noi h ILE 761 Cb 0.18 1.60 -0.04 0.00 -0.74 0.00 0.00 36.82 37.82 1noi h ILE 761 CO -0.01 0.25 0.07 0.58 0.00 0.00 0.00 178.15 179.04 1noi h VAL 762 N -0.07 0.86 -0.05 1.67 2.07 -1.25 0.31 116.25 119.78 1noi h VAL 762 Ca 0.03 -0.06 -0.10 0.00 0.82 0.00 0.00 66.70 67.39 1noi h VAL 762 Cb 0.38 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 1noi h VAL 762 CO 0.01 0.03 -0.44 0.78 0.02 0.00 0.00 177.57 177.97 1noi h ASN 763 N 0.18 0.13 -0.12 0.57 2.35 -1.19 -0.60 115.58 116.90 1noi h ASN 763 Ca 0.15 -0.05 -0.13 0.00 -0.55 0.00 0.00 56.30 55.71 1noi h ASN 763 Cb 0.15 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 1noi h ASN 763 CO -0.19 0.55 -0.37 -0.03 -1.65 0.00 0.00 177.43 175.75 1noi h MET 764 N 0.10 0.64 -0.12 0.81 4.05 -0.20 -0.05 114.93 120.16 1noi h MET 764 Ca 0.01 -0.31 -0.04 0.00 -0.28 0.00 0.00 59.70 59.08 1noi h MET 764 Cb 0.82 -0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.62 1noi h MET 764 CO 0.06 0.91 -0.07 -0.07 0.23 0.00 0.00 176.91 177.97 1noi h LEU 765 N 0.53 0.26 -0.65 3.39 4.07 -0.42 0.82 115.31 123.31 1noi h LEU 765 Ca 0.05 -0.43 -0.06 0.00 0.08 0.00 0.00 57.88 57.52 1noi h LEU 765 Cb 0.88 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 42.54 1noi h LEU 765 CO 0.08 0.63 -0.29 0.24 -1.08 0.00 0.00 178.44 178.02 1noi h MET 766 N -0.11 0.00 0.00 1.13 2.86 -1.20 -3.40 114.93 114.21 1noi h MET 766 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1noi h MET 766 Cb 0.54 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.20 1noi h MET 766 CO 0.02 0.29 -0.68 0.72 1.06 0.00 0.00 176.91 178.32 1noi n HIS 767 N -3.31 0.00 -2.71 -0.22 8.25 -0.03 -4.51 115.22 112.70 1noi n HIS 767 Ca 0.01 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.40 1noi n HIS 767 Cb 0.54 0.00 0.11 0.00 1.12 0.00 0.00 29.99 31.76 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 -1.56 -2.54 -2.98 4.41 -0.00 0.06 -5.02 115.22 107.59 1noi n HIS 768 Ca 0.00 -1.98 -0.42 0.00 -0.00 0.00 0.00 57.72 55.32 1noi n HIS 768 Cb 0.34 1.60 -0.05 0.00 -0.00 0.00 0.00 29.99 31.88 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 -1.23 6.53 0.29 4.39 2.15 0.05 -4.88 116.67 123.97 1noi s ASP 769 Ca 0.22 0.32 0.24 0.00 0.43 0.00 0.00 52.55 53.76 1noi s ASP 769 Cb 0.38 -2.38 0.49 0.00 -0.30 0.00 0.00 42.92 41.10 1noi s ASP 769 CO -0.08 -0.71 1.58 0.03 -0.17 0.00 0.00 175.17 175.82 1noi h ARG 770 N 8.47 0.00 -0.37 4.34 3.08 -1.96 -3.28 114.38 124.67 1noi h ARG 770 Ca -0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.80 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 0.90 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.99 1noi n PHE 771 N -2.61 0.80 -3.86 3.04 3.72 -1.26 -5.03 117.46 112.25 1noi n PHE 771 Ca 0.04 -0.65 -0.38 0.00 -0.05 0.00 0.00 57.45 56.41 1noi n PHE 771 Cb 0.48 -0.16 0.03 0.00 -0.94 0.00 0.00 39.48 38.89 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 0.26 -0.77 0.37 -1.08 5.02 -1.24 -4.69 118.16 116.03 1noi n LYS 772 Ca 0.17 0.32 -0.16 0.00 -2.02 0.00 0.00 58.31 56.62 1noi n LYS 772 Cb 0.66 -3.26 -0.08 0.00 -0.02 0.00 0.00 35.03 32.33 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 -2.08 0.18 -0.46 -0.18 2.07 -1.93 -2.91 116.25 110.93 1noi h VAL 773 Ca -0.67 -0.22 0.09 0.00 0.82 0.00 0.00 66.70 66.71 1noi h VAL 773 Cb 1.38 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 1noi h VAL 773 CO 0.49 0.02 0.31 -0.26 0.02 0.00 0.00 177.57 178.15 1noi h PHE 774 N -1.13 0.25 -0.20 1.57 0.04 -1.92 -1.91 116.94 113.64 1noi h PHE 774 Ca -0.10 0.01 0.01 0.00 2.80 0.00 0.00 57.97 60.69 1noi h PHE 774 Cb 0.75 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.81 1noi h PHE 774 CO -0.00 0.12 0.13 0.00 -0.60 0.00 0.00 178.31 177.96 1noi h ALA 775 N 1.77 1.92 -0.00 2.45 0.00 -1.90 -2.54 119.26 120.95 1noi h ALA 775 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1noi h ALA 775 Cb 0.53 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1noi h ALA 775 CO -0.04 0.06 -0.67 -0.25 0.00 0.00 0.00 179.25 178.34 1noi n ASP 776 N -4.51 0.88 0.03 0.00 8.00 -0.77 -4.73 116.55 115.45 1noi n ASP 776 Ca 0.00 -0.94 -0.11 0.00 0.71 0.00 0.00 54.79 54.45 1noi n ASP 776 Cb 0.12 0.92 -0.05 0.00 -0.02 0.00 0.00 41.12 42.09 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 0.29 -0.92 -0.63 1.24 5.03 -0.97 -1.81 116.97 119.20 1noi h TYR 777 Ca 0.00 0.04 -0.02 0.00 2.58 0.00 0.00 58.73 61.33 1noi h TYR 777 Cb 0.40 0.42 -0.03 0.00 1.55 0.00 0.00 36.73 39.07 1noi h TYR 777 CO 0.00 -0.41 0.33 1.49 -1.32 0.00 0.00 178.16 178.25 1noi h GLU 778 N -0.44 0.89 -0.03 1.82 4.81 -1.85 -1.56 114.58 118.22 1noi h GLU 778 Ca 0.08 -0.11 -0.06 0.00 -0.13 0.00 0.00 59.36 59.14 1noi h GLU 778 Cb 0.56 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 1noi h GLU 778 CO -0.32 0.68 -0.25 0.93 -0.73 0.00 0.00 179.01 179.32 1noi h GLU 779 N 0.86 0.04 0.74 1.92 5.08 -1.86 -2.40 114.58 118.96 1noi h GLU 779 Ca 0.22 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.53 1noi h GLU 779 Cb 0.06 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.31 1noi h GLU 779 CO -0.03 0.29 -0.35 -0.92 -1.00 0.00 0.00 179.01 177.00 1noi h TYR 780 N 0.04 -0.92 0.00 4.33 3.20 -0.58 0.11 116.97 123.16 1noi h TYR 780 Ca 0.01 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.83 1noi h TYR 780 Cb 0.47 0.30 -0.00 0.00 1.54 0.00 0.00 36.73 39.04 1noi h TYR 780 CO 0.00 -0.56 -0.10 -0.39 -1.64 0.00 0.00 178.16 175.48 1noi h VAL 781 N -1.23 0.32 -0.08 1.81 -1.51 -1.22 0.14 116.25 114.48 1noi h VAL 781 Ca -0.10 -0.63 -0.20 0.00 -1.23 0.00 0.00 66.70 64.54 1noi h VAL 781 Cb 0.77 1.48 0.01 0.00 -2.13 0.00 0.00 31.29 31.42 1noi h VAL 781 CO 0.17 0.09 -0.74 0.11 -1.23 0.00 0.00 177.57 175.98 1noi h LYS 782 N 0.00 0.63 -0.48 5.19 1.79 -1.40 -2.49 116.57 119.82 1noi h LYS 782 Ca -0.00 -0.58 -0.02 0.00 -2.18 0.00 0.00 60.65 57.87 1noi h LYS 782 Cb 0.47 0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 31.23 1noi h LYS 782 CO 0.01 1.19 0.21 0.00 -1.08 0.00 0.00 179.45 179.79 1noi h GLN 784 N 0.68 0.78 -0.80 0.00 1.08 -1.00 -2.50 115.11 113.35 1noi h GLN 784 Ca 0.17 -0.26 -0.00 0.00 -1.45 0.00 0.00 58.65 57.10 1noi h GLN 784 Cb 0.10 -0.06 -0.04 0.00 -0.05 0.00 0.00 27.48 27.43 1noi h GLN 784 CO -0.02 0.86 0.49 0.93 -0.95 0.00 0.00 178.83 180.15 1noi h GLU 785 N 0.70 1.07 -0.06 1.46 5.08 -0.72 -0.33 114.58 121.78 1noi h GLU 785 Ca 0.12 -0.09 -0.06 0.00 -1.00 0.00 0.00 59.36 58.33 1noi h GLU 785 Cb 0.60 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1noi h GLU 785 CO 0.04 0.74 -0.24 0.00 -1.00 0.00 0.00 179.01 178.54 1noi h ARG 786 N 1.09 0.10 0.11 2.33 3.08 -1.04 -2.74 114.38 117.32 1noi h ARG 786 Ca 0.29 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.30 1noi h ARG 786 Cb -0.07 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 29.97 1noi h ARG 786 CO -0.06 0.35 -0.05 0.28 -1.07 0.00 0.00 179.97 179.42 1noi h VAL 787 N 0.10 1.05 -0.96 2.04 2.07 -0.81 -2.22 116.25 117.51 1noi h VAL 787 Ca 0.02 -0.70 0.13 0.00 0.82 0.00 0.00 66.70 66.96 1noi h VAL 787 Cb 0.49 1.49 -0.09 0.00 -1.52 0.00 0.00 31.29 31.67 1noi h VAL 787 CO 0.03 0.17 0.59 0.28 0.02 0.00 0.00 177.57 178.66 1noi h SER 788 N -0.48 0.84 -0.53 0.57 0.02 -1.28 0.20 113.55 112.89 1noi h SER 788 Ca -0.02 0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 60.97 1noi h SER 788 Cb 0.39 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.80 1noi h SER 788 CO 0.03 0.43 0.26 0.00 -1.14 0.00 0.00 176.83 176.40 1noi h ALA 789 N 1.54 0.68 -0.19 3.77 0.00 -1.28 -1.70 119.26 122.07 1noi h ALA 789 Ca 0.49 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 55.17 1noi h ALA 789 Cb 0.53 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1noi h ALA 789 CO -0.28 0.24 -0.35 1.25 0.00 0.00 0.00 179.25 180.10 1noi h LEU 790 N 0.70 0.41 -1.52 0.00 5.85 -0.68 -2.89 115.31 117.18 1noi h LEU 790 Ca 0.18 -0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 1noi h LEU 790 Cb 0.11 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1noi h LEU 790 CO -0.02 0.74 -0.25 0.22 -0.34 0.00 0.00 178.44 178.79 1noi h TYR 791 N 0.34 0.00 0.00 1.25 3.20 -0.10 0.12 116.97 121.78 1noi h TYR 791 Ca 0.04 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1noi h TYR 791 Cb 0.78 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.05 1noi h TYR 791 CO 0.02 0.25 0.00 0.87 -1.64 0.00 0.00 178.16 177.66 1noi h LYS 792 N 0.00 0.00 -3.15 1.82 1.57 -1.19 -3.32 116.57 112.31 1noi h LYS 792 Ca -0.00 0.00 -0.63 0.00 -1.87 0.00 0.00 60.65 58.15 1noi h LYS 792 Cb 0.46 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.36 1noi h LYS 792 CO 0.03 0.00 -0.53 1.21 -0.57 0.00 0.00 179.45 179.59 1noi s ASN 793 N -4.77 4.89 0.32 0.86 3.84 0.41 -5.00 114.94 115.50 1noi s ASN 793 Ca 0.00 -3.74 0.07 0.00 0.21 0.00 0.00 52.86 49.39 1noi s ASN 793 Cb 0.09 -1.67 0.90 0.00 -0.55 0.00 0.00 41.25 40.03 1noi s ASN 793 CO 0.39 -0.11 1.58 -0.65 -2.79 0.00 0.00 177.10 175.52 1noi h PRO 794 N 5.59 0.02 -0.47 0.43 0.11 -1.75 -0.79 132.00 135.14 1noi h PRO 794 Ca 0.12 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.12 1noi h PRO 794 Cb 0.78 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.87 1noi h PRO 794 CO 0.73 0.01 -0.15 -0.09 -0.21 0.00 0.00 178.00 178.29 1noi h ARG 795 N 0.02 0.90 0.15 1.05 2.43 -1.94 -1.45 114.38 115.55 1noi h ARG 795 Ca 0.66 -0.34 -0.29 0.00 -0.81 0.00 0.00 59.98 59.20 1noi h ARG 795 Cb 1.48 -0.06 0.01 0.00 -0.42 0.00 0.00 29.97 30.98 1noi h ARG 795 CO -0.87 0.99 -1.35 0.93 -1.51 0.00 0.00 179.97 178.16 1noi h GLU 796 N 0.80 0.33 0.12 0.20 4.39 -1.68 0.72 114.58 119.45 1noi h GLU 796 Ca 0.12 -0.56 0.01 0.00 0.34 0.00 0.00 59.36 59.27 1noi h GLU 796 Cb 0.68 0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 29.52 1noi h GLU 796 CO 0.05 1.25 -0.14 2.35 -1.16 0.00 0.00 179.01 181.36 1noi h TRP 797 N 0.09 -0.37 0.00 4.33 7.01 -1.12 -1.29 115.95 124.60 1noi h TRP 797 Ca -0.18 0.00 -0.03 0.00 2.11 0.00 0.00 58.89 60.79 1noi h TRP 797 Cb 2.02 0.15 -0.00 0.00 -2.10 0.00 0.00 29.16 29.23 1noi h TRP 797 CO 0.08 -0.21 -0.15 1.15 -2.79 0.00 0.00 178.44 176.51 1noi h THR 798 N -0.30 0.42 -0.00 2.65 2.02 -1.27 -1.66 112.91 114.77 1noi h THR 798 Ca 0.01 -0.86 -0.15 0.00 0.77 0.00 0.00 66.41 66.18 1noi h THR 798 Cb 0.30 1.62 -0.02 0.00 -1.74 0.00 0.00 68.15 68.31 1noi h THR 798 CO -0.06 0.15 -0.72 0.03 0.37 0.00 0.00 175.52 175.29 1noi h ARG 799 N 0.00 0.00 0.00 6.66 3.08 0.05 -2.30 114.38 121.88 1noi h ARG 799 Ca -0.00 -0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.90 1noi h ARG 799 Cb 0.61 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.64 1noi h ARG 799 CO 0.02 0.72 -0.71 1.98 -1.07 0.00 0.00 179.97 180.91 1noi h MET 800 N 0.00 0.00 -0.24 0.04 4.05 -0.68 -1.16 114.93 116.94 1noi h MET 800 Ca -0.01 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.39 1noi h MET 800 Cb 1.27 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.06 1noi h MET 800 CO 0.09 0.71 0.06 0.28 0.23 0.00 0.00 176.91 178.28 1noi h VAL 801 N 0.00 1.21 -0.49 -5.77 2.07 -1.26 -0.66 116.25 111.35 1noi h VAL 801 Ca -0.01 -0.68 -0.05 0.00 0.82 0.00 0.00 66.70 66.78 1noi h VAL 801 Cb 1.34 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 32.29 1noi h VAL 801 CO 0.09 0.22 0.10 0.40 0.02 0.00 0.00 177.57 178.40 1noi h ILE 802 N 0.21 1.22 -0.04 4.57 2.04 -1.16 0.99 117.51 125.34 1noi h ILE 802 Ca 0.08 -0.80 -0.04 0.00 1.00 0.00 0.00 64.86 65.10 1noi h ILE 802 Cb 0.28 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1noi h ILE 802 CO 0.00 0.29 -0.15 -0.09 0.00 0.00 0.00 178.15 178.20 1noi h ARG 803 N 0.72 0.05 0.00 2.37 9.65 -0.94 -1.91 114.38 124.32 1noi h ARG 803 Ca 0.16 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 59.02 1noi h ARG 803 Cb 0.30 -0.01 -0.00 0.00 -1.39 0.00 0.00 29.97 28.87 1noi h ARG 803 CO 0.00 0.21 -0.04 -0.91 2.80 0.00 0.00 179.97 182.04 1noi h ASN 804 N 0.05 0.00 -1.00 -3.80 2.35 0.74 -3.33 115.58 110.60 1noi h ASN 804 Ca 0.01 -0.38 0.20 0.00 -0.55 0.00 0.00 56.30 55.58 1noi h ASN 804 Cb 0.31 0.00 -0.10 0.00 0.05 0.00 0.00 38.32 38.58 1noi h ASN 804 CO 0.02 0.71 0.61 0.40 -1.65 0.00 0.00 177.43 177.53 1noi h ILE 805 N -1.00 0.68 0.00 2.81 2.04 -1.22 -1.01 117.51 119.81 1noi h ILE 805 Ca -0.01 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1noi h ILE 805 Cb 0.41 -0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.42 1noi h ILE 805 CO -0.00 0.13 0.00 0.00 0.00 0.00 0.00 178.15 178.27 1noi h ALA 806 N 1.64 1.00 -0.17 1.87 0.00 -1.52 -3.19 119.26 118.90 1noi h ALA 806 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.48 1noi h ALA 806 Cb 0.99 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1noi h ALA 806 CO -0.35 0.00 0.00 -2.37 0.00 0.00 0.00 179.25 176.53 1noi n THR 807 N -2.37 0.71 1.59 0.00 5.66 -0.41 -2.06 114.28 117.40 1noi n THR 807 Ca 0.03 -0.86 0.10 0.00 -3.05 0.00 0.00 64.05 60.27 1noi n THR 807 Cb 0.30 0.69 0.46 0.00 -1.55 0.00 0.00 70.33 70.23 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 0.24 0.90 0.26 1.09 3.41 -1.04 -4.39 113.62 114.08 1noi n SER 808 Ca 0.07 -1.57 0.12 0.00 -0.26 0.00 0.00 58.87 57.22 1noi n SER 808 Cb 0.31 -0.06 0.70 0.00 -0.26 0.00 0.00 64.21 64.90 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 5.20 0.00 2.00 5.00 0.00 -1.82 -1.82 103.07 111.63 1noi h GLY 809 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1noi h GLY 809 CO 0.00 0.00 -0.15 1.70 0.00 0.00 0.00 176.54 178.09 1noi h LYS 810 N 0.00 0.00 -0.82 4.80 3.64 -1.89 -2.72 116.57 119.58 1noi h LYS 810 Ca -0.00 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 1noi h LYS 810 Cb 0.36 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.13 1noi h LYS 810 CO 0.02 0.15 0.09 1.19 -2.27 0.00 0.00 179.45 178.63 1noi n PHE 811 N -4.20 1.34 -2.76 1.91 3.72 -0.68 -4.71 117.46 112.08 1noi n PHE 811 Ca -0.02 -0.62 -0.41 0.00 -0.05 0.00 0.00 57.45 56.35 1noi n PHE 811 Cb 0.22 -0.41 -0.05 0.00 -0.94 0.00 0.00 39.48 38.30 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 -0.42 7.54 0.28 4.37 0.15 -1.03 -1.41 113.70 123.18 1noi s SER 812 Ca 0.32 1.83 0.22 0.00 0.70 0.00 0.00 55.95 59.02 1noi s SER 812 Cb 0.25 -2.59 1.05 0.00 -1.71 0.00 0.00 66.02 63.02 1noi s SER 812 CO 0.08 0.03 1.66 -1.54 1.20 0.00 0.00 173.24 174.68 1noi n SER 813 N 2.25 0.59 0.03 5.45 3.41 0.12 -1.36 113.62 124.11 1noi n SER 813 Ca 0.00 0.71 -0.04 0.00 -0.26 0.00 0.00 58.87 59.28 1noi n SER 813 Cb 0.48 -0.81 0.19 0.00 -0.26 0.00 0.00 64.21 63.82 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 0.46 -0.03 4.04 3.32 -1.91 0.67 116.42 122.97 1noi h ASP 814 Ca 0.00 -0.17 -0.02 0.00 0.02 0.00 0.00 57.03 56.86 1noi h ASP 814 Cb 0.17 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1noi h ASP 814 CO 0.00 0.74 -0.06 -0.09 -1.72 0.00 0.00 179.24 178.11 1noi h ARG 815 N 0.39 0.10 -0.35 3.56 1.12 -1.52 -1.88 114.38 115.80 1noi h ARG 815 Ca 0.05 -0.06 0.08 0.00 -1.11 0.00 0.00 59.98 58.94 1noi h ARG 815 Cb 0.73 0.01 -0.08 0.00 -0.01 0.00 0.00 29.97 30.61 1noi h ARG 815 CO 0.06 0.63 -0.27 1.15 -3.11 0.00 0.00 179.97 178.43 1noi h THR 816 N -0.43 0.31 -0.09 0.20 2.02 -1.43 -1.61 112.91 111.88 1noi h THR 816 Ca 0.00 0.00 -0.16 0.00 0.77 0.00 0.00 66.41 67.02 1noi h THR 816 Cb 0.63 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.34 1noi h THR 816 CO 0.01 0.00 -0.62 0.40 0.37 0.00 0.00 175.52 175.68 1noi h ILE 817 N -0.23 1.37 -0.06 3.11 1.08 -0.85 -1.90 117.51 120.04 1noi h ILE 817 Ca 0.17 -1.98 -0.04 0.00 -0.39 0.00 0.00 64.86 62.62 1noi h ILE 817 Cb 0.50 1.98 -0.01 0.00 -3.07 0.00 0.00 36.82 36.22 1noi h ILE 817 CO -0.48 0.59 -0.14 0.00 -0.69 0.00 0.00 178.15 177.43 1noi h ALA 818 N 1.10 1.66 -0.13 1.87 0.00 -1.08 0.14 119.26 122.82 1noi h ALA 818 Ca -0.01 -0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.57 1noi h ALA 818 Cb 1.15 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.90 1noi h ALA 818 CO 0.10 0.25 -0.58 1.96 0.00 0.00 0.00 179.25 180.99 1noi h GLN 819 N 0.08 0.63 -0.31 0.00 4.20 -0.60 -1.59 115.11 117.52 1noi h GLN 819 Ca 0.02 -0.50 0.00 0.00 0.06 0.00 0.00 58.65 58.23 1noi h GLN 819 Cb 0.31 0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1noi h GLN 819 CO 0.02 1.12 0.21 1.88 -0.67 0.00 0.00 178.83 181.39 1noi h TYR 820 N 0.29 0.39 -0.00 2.96 -1.99 -0.93 0.72 116.97 118.41 1noi h TYR 820 Ca -0.03 0.01 0.03 0.00 2.00 0.00 0.00 58.73 60.73 1noi h TYR 820 Cb 1.22 -0.13 -0.04 0.00 2.00 0.00 0.00 36.73 39.77 1noi h TYR 820 CO 0.10 0.25 -0.22 0.00 -0.00 0.00 0.00 178.16 178.28 1noi h ALA 821 N 1.11 -0.29 0.13 3.88 0.00 -0.66 0.01 119.26 123.44 1noi h ALA 821 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.74 1noi h ALA 821 Cb -0.05 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1noi h ALA 821 CO -0.02 -0.72 -1.36 0.00 0.00 0.00 0.00 179.25 177.14 1noi h ARG 822 N -0.35 0.28 0.00 0.00 3.08 -1.26 0.82 114.38 116.96 1noi h ARG 822 Ca 0.06 -0.48 0.00 0.00 0.07 0.00 0.00 59.98 59.63 1noi h ARG 822 Cb 0.43 0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1noi h ARG 822 CO -0.21 1.19 -0.99 0.39 -1.07 0.00 0.00 179.97 179.29 1noi n GLU 823 N -3.51 0.44 0.00 0.04 1.02 0.24 -4.10 120.64 114.77 1noi n GLU 823 Ca -0.12 0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.08 1noi n GLU 823 Cb 1.04 -1.71 0.00 0.00 -0.02 0.00 0.00 31.44 30.75 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 -2.31 0.00 0.09 -3.67 5.41 -0.16 -4.84 119.36 113.88 1noi n ILE 824 Ca 0.01 0.00 -0.02 0.00 1.00 0.00 0.00 62.75 63.74 1noi n ILE 824 Cb 0.49 -1.16 -0.05 0.00 -0.71 0.00 0.00 39.64 38.22 1noi n ILE 824 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 1noi h TRP 825 N 0.00 0.00 -0.55 1.39 6.55 -1.03 -3.48 115.95 118.83 1noi h TRP 825 Ca 0.00 0.00 -0.09 0.00 0.95 0.00 0.00 58.89 59.75 1noi h TRP 825 Cb 0.69 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.98 1noi h TRP 825 CO 0.00 0.72 -0.11 0.41 -1.05 0.00 0.00 178.44 178.41 1noi n GLY 826 N 1.30 0.29 3.60 1.49 0.00 0.27 -4.97 105.19 107.18 1noi n GLY 826 Ca -0.01 -0.74 -0.25 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.21 3.32 -0.16 1.61 -7.23 -0.45 -4.97 120.40 110.32 1noi s VAL 827 Ca 0.00 -1.74 -0.13 0.00 -1.81 0.00 0.00 61.98 58.30 1noi s VAL 827 Cb 0.00 -2.70 -0.05 0.00 0.56 0.00 0.00 36.38 34.20 1noi s VAL 827 CO 0.00 -0.21 0.27 -1.61 -0.31 0.00 0.00 175.10 173.24 1noi s GLU 828 N -3.16 4.18 0.96 4.82 0.41 -1.26 -3.54 118.70 121.11 1noi s GLU 828 Ca 0.28 0.05 -0.11 0.00 -0.41 0.00 0.00 54.97 54.77 1noi s GLU 828 Cb -0.08 -3.40 0.13 0.00 -1.78 0.00 0.00 34.13 29.00 1noi s GLU 828 CO 0.17 0.30 0.89 -2.30 -0.49 0.00 0.00 175.26 173.84 1noi n PRO 829 N 3.38 -0.64 -3.67 0.39 -0.02 -1.26 -4.91 135.00 128.28 1noi n PRO 829 Ca -0.13 -0.13 -0.14 0.00 -2.02 0.00 0.00 63.50 61.07 1noi n PRO 829 Cb 0.52 -2.19 -0.14 0.00 -0.02 0.00 0.00 33.50 31.67 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 -2.42 0.45 -0.83 2.55 0.15 0.11 -5.03 113.70 108.69 1noi s SER 830 Ca 0.64 0.52 0.00 0.00 0.70 0.00 0.00 55.95 57.81 1noi s SER 830 Cb -0.22 0.57 0.35 0.00 -1.71 0.00 0.00 66.02 65.01 1noi s SER 830 CO 0.62 -0.24 1.72 -1.14 1.20 0.00 0.00 173.24 175.40 1noi n ARG 831 N 5.32 3.82 -5.10 5.44 0.63 -1.26 -3.14 116.66 122.37 1noi n ARG 831 Ca -0.06 -4.19 -0.30 0.00 -0.92 0.00 0.00 57.85 52.38 1noi n ARG 831 Cb 0.50 -2.33 -0.15 0.00 0.45 0.00 0.00 32.46 30.92 1noi n ARG 831 CO 0.00 0.00 0.00 -1.14 -2.51 0.00 0.00 177.63 173.98 1noi s GLN 832 N -4.03 1.92 0.46 -0.14 2.00 -1.26 -5.10 119.66 113.50 1noi s GLN 832 Ca 0.47 -0.98 -0.23 0.00 -2.00 0.00 0.00 55.36 52.61 1noi s GLN 832 Cb 0.33 -1.95 -0.07 0.00 0.80 0.00 0.00 33.01 32.11 1noi s GLN 832 CO -0.26 0.52 1.21 1.03 -0.50 0.00 0.00 175.29 177.29 1noi s ARG 833 N -0.87 3.73 -0.16 1.67 3.00 -1.26 -4.88 118.95 120.18 1noi s ARG 833 Ca 0.10 1.88 -0.08 0.00 0.00 0.00 0.00 55.73 57.64 1noi s ARG 833 Cb -0.10 -2.45 -0.04 0.00 0.00 0.00 0.00 34.95 32.36 1noi s ARG 833 CO 0.00 -0.61 0.11 -0.51 0.00 0.00 0.00 175.30 174.30 1noi s LEU 834 N -2.97 4.17 0.53 2.53 1.02 0.43 -5.04 118.68 119.36 1noi s LEU 834 Ca 0.63 0.30 -0.21 0.00 0.02 0.00 0.00 54.13 54.87 1noi s LEU 834 Cb -0.31 -2.04 -0.05 0.00 0.02 0.00 0.00 46.19 43.80 1noi s LEU 834 CO 0.38 0.29 1.23 -2.16 0.02 0.00 0.00 176.35 176.11 1noi s PRO 835 N -0.30 3.31 0.00 1.29 0.04 -1.26 -4.55 135.00 133.53 1noi s PRO 835 Ca 0.10 1.92 0.00 0.00 0.04 0.00 0.00 61.00 63.06 1noi s PRO 835 Cb -0.12 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.23 1noi s PRO 835 CO 0.01 -0.96 0.00 0.00 0.04 0.00 0.00 177.00 176.10 1noi n ALA 836 N -1.03 0.00 -1.22 8.56 0.00 -1.26 -4.97 120.51 120.60 1noi n ALA 836 Ca 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.36 1noi n ALA 836 Cb 0.48 0.00 0.23 0.00 0.00 0.00 0.00 19.45 20.16 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 -0.23 -2.66 0.00 0.00 -0.04 -1.26 -5.09 135.00 125.71 1noi n PRO 837 Ca 0.00 -1.71 0.00 0.00 -0.04 0.00 0.00 63.50 61.75 1noi n PRO 837 Cb 0.00 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 31.97 1noi n PRO 837 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06