#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1noi h LYS 11 N 0.00 0.26 -1.13 -0.14 1.79 -2.12 -0.16 116.57 115.07 1noi h LYS 11 Ca 0.00 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 1noi h LYS 11 Cb 0.00 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.59 1noi h LYS 11 CO 0.00 0.17 0.00 0.94 -1.08 0.00 0.00 179.45 179.48 1noi n GLN 12 N -5.15 0.70 -3.52 3.15 7.27 -1.26 -4.04 117.38 114.53 1noi n GLN 12 Ca 0.12 0.00 -0.27 0.00 0.07 0.00 0.00 57.00 56.92 1noi n GLN 12 Cb 0.41 -1.21 -0.10 0.00 2.41 0.00 0.00 30.24 31.75 1noi n GLN 12 CO 0.00 0.00 0.00 -0.89 0.07 0.00 0.00 177.06 176.24 1noi n ILE 13 N 0.51 -0.30 -4.22 1.69 5.41 -0.07 -5.07 119.36 117.31 1noi n ILE 13 Ca 0.00 -3.91 -0.13 0.00 1.00 0.00 0.00 62.75 59.72 1noi n ILE 13 Cb 0.30 -1.83 -0.10 0.00 -0.71 0.00 0.00 39.64 37.30 1noi n ILE 13 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1noi s SER 14 N -0.51 0.33 0.00 4.38 0.15 -1.26 -5.01 113.70 111.80 1noi s SER 14 Ca 0.31 -1.39 0.06 0.00 0.70 0.00 0.00 55.95 55.63 1noi s SER 14 Cb 0.03 0.34 0.34 0.00 -1.71 0.00 0.00 66.02 65.02 1noi s SER 14 CO -0.18 -0.82 0.97 0.52 1.20 0.00 0.00 173.24 174.93 1noi n VAL 15 N -0.30 0.00 0.00 4.45 0.31 -1.26 -4.79 118.33 116.74 1noi n VAL 15 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 1noi n VAL 15 Cb 0.66 -0.27 0.00 0.00 -0.91 0.00 0.00 33.84 33.32 1noi n VAL 15 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1noi n ARG 16 N -0.63 0.00 0.00 5.55 3.00 -1.26 -3.12 116.66 120.20 1noi n ARG 16 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.89 1noi n ARG 16 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.48 1noi n ARG 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1noi n GLY 17 N 0.00 -0.63 2.73 5.14 0.00 -1.26 -5.10 105.19 106.07 1noi n GLY 17 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 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 0.00 6.54 0.00 0.99 4.32 -1.18 -4.93 117.00 122.74 1noi n LEU 18 Ca 0.00 -5.44 0.00 0.00 -0.02 0.00 0.00 56.01 50.55 1noi n LEU 18 Cb 0.00 -1.03 0.00 0.00 -1.62 0.00 0.00 43.42 40.77 1noi n LEU 18 CO 0.00 2.08 0.00 0.00 -1.22 0.00 0.00 177.39 178.25 1noi n ALA 19 N 0.06 0.00 1.17 -1.18 0.00 -1.26 -4.96 120.51 114.33 1noi n ALA 19 Ca 0.41 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.97 1noi n ALA 19 Cb 0.30 0.00 0.23 0.00 0.00 0.00 0.00 19.45 19.98 1noi n ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1noi n GLY 20 N -1.18 -0.05 7.00 0.00 0.00 -1.26 -5.06 105.19 104.63 1noi n GLY 20 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.49 1noi n GLY 20 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1noi n VAL 21 N -0.01 0.00 -0.58 1.61 0.31 -1.26 -4.53 118.33 113.87 1noi n VAL 21 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.46 1noi n VAL 21 Cb 0.43 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.36 1noi n VAL 21 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1noi n GLU 22 N 5.55 0.00 -3.24 5.55 1.02 -1.26 -4.54 120.64 123.71 1noi n GLU 22 Ca 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 57.16 57.17 1noi n GLU 22 Cb 0.00 -0.58 -0.02 0.00 -0.02 0.00 0.00 31.44 30.82 1noi n GLU 22 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1noi s ASN 23 N 1.63 -1.20 0.10 1.62 3.84 -1.26 -5.04 114.94 114.62 1noi s ASN 23 Ca 0.00 0.92 -0.22 0.00 0.21 0.00 0.00 52.86 53.76 1noi s ASN 23 Cb 0.00 2.07 -0.13 0.00 -0.55 0.00 0.00 41.25 42.65 1noi s ASN 23 CO 0.00 -0.23 1.75 0.58 -2.79 0.00 0.00 177.10 176.41 1noi h VAL 24 N 5.90 1.01 -0.77 -5.21 2.07 -1.85 -2.92 116.25 114.48 1noi h VAL 24 Ca -0.21 -0.02 0.15 0.00 0.82 0.00 0.00 66.70 67.44 1noi h VAL 24 Cb 1.15 0.94 -0.10 0.00 -1.52 0.00 0.00 31.29 31.76 1noi h VAL 24 CO 0.18 0.01 0.32 0.74 0.02 0.00 0.00 177.57 178.84 1noi h THR 25 N 0.07 0.65 0.04 2.57 2.02 -1.96 -0.58 112.91 115.72 1noi h THR 25 Ca 0.02 -0.16 -0.22 0.00 0.77 0.00 0.00 66.41 66.82 1noi h THR 25 Cb -0.01 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 66.55 1noi h THR 25 CO -0.01 0.08 -1.00 -0.33 0.37 0.00 0.00 175.52 174.64 1noi h GLU 26 N 0.45 0.23 -0.40 6.66 4.39 -1.90 -3.09 114.58 120.92 1noi h GLU 26 Ca 0.43 -0.30 -0.10 0.00 0.34 0.00 0.00 59.36 59.74 1noi h GLU 26 Cb 0.66 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.39 1noi h GLU 26 CO -0.41 1.06 -0.15 -0.07 -1.16 0.00 0.00 179.01 178.28 1noi h LEU 27 N 0.11 0.74 -0.48 1.33 3.38 -0.96 -1.26 115.31 118.17 1noi h LEU 27 Ca -0.07 -0.23 -0.13 0.00 0.09 0.00 0.00 57.88 57.54 1noi h LEU 27 Cb 1.67 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 42.21 1noi h LEU 27 CO 0.16 0.89 -0.21 0.11 0.09 0.00 0.00 178.44 179.48 1noi h LYS 28 N 0.66 0.98 -0.11 1.13 1.57 -1.20 -0.88 116.57 118.74 1noi h LYS 28 Ca 0.11 -0.42 0.04 0.00 -1.87 0.00 0.00 60.65 58.51 1noi h LYS 28 Cb 0.62 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.85 1noi h LYS 28 CO 0.04 1.10 -0.19 -0.22 -0.57 0.00 0.00 179.45 179.61 1noi h LYS 29 N 0.84 -0.24 0.00 3.15 3.64 -1.41 -2.06 116.57 120.50 1noi h LYS 29 Ca 0.11 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.46 1noi h LYS 29 Cb 0.79 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.66 1noi h LYS 29 CO 0.07 -0.16 -0.20 -0.91 -2.27 0.00 0.00 179.45 175.98 1noi h ASN 30 N -0.25 0.00 0.03 4.20 2.35 -1.08 -0.97 115.58 119.86 1noi h ASN 30 Ca 0.09 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1noi h ASN 30 Cb 0.38 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.75 1noi h ASN 30 CO -0.25 0.20 -0.01 0.15 -1.65 0.00 0.00 177.43 175.86 1noi h PHE 31 N 0.00 -0.04 -0.37 1.19 3.57 -0.79 -1.26 116.94 119.25 1noi h PHE 31 Ca -0.00 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.41 1noi h PHE 31 Cb 0.91 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.65 1noi h PHE 31 CO 0.00 0.12 -0.13 -0.91 -2.23 0.00 0.00 178.31 175.15 1noi h ASN 32 N -0.19 0.65 -0.22 0.41 2.35 -0.63 -1.20 115.58 116.76 1noi h ASN 32 Ca -0.00 -0.19 -0.02 0.00 -0.55 0.00 0.00 56.30 55.54 1noi h ASN 32 Cb 0.17 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 1noi h ASN 32 CO 0.01 0.81 0.07 0.03 -1.65 0.00 0.00 177.43 176.69 1noi h ARG 33 N 0.60 0.35 -0.32 0.81 3.08 -1.11 -2.38 114.38 115.40 1noi h ARG 33 Ca 0.10 -0.08 -0.13 0.00 0.07 0.00 0.00 59.98 59.94 1noi h ARG 33 Cb 0.58 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 1noi h ARG 33 CO 0.04 0.44 -0.34 0.45 -1.07 0.00 0.00 179.97 179.48 1noi h HIS 34 N 0.19 0.85 -0.86 3.04 3.86 -0.10 0.16 115.15 122.29 1noi h HIS 34 Ca 0.07 -0.23 0.00 0.00 -1.16 0.00 0.00 60.37 59.05 1noi h HIS 34 Cb 0.24 -0.19 -0.04 0.00 1.06 0.00 0.00 27.41 28.48 1noi h HIS 34 CO 0.00 0.96 0.55 1.25 0.86 0.00 0.00 177.93 181.55 1noi h LEU 35 N 0.60 1.01 0.00 2.43 5.85 -1.30 -1.47 115.31 122.43 1noi h LEU 35 Ca 0.06 -0.04 -0.18 0.00 0.84 0.00 0.00 57.88 58.56 1noi h LEU 35 Cb 0.87 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.62 1noi h LEU 35 CO 0.08 0.75 -1.00 0.45 -0.34 0.00 0.00 178.44 178.38 1noi h HIS 36 N 1.17 0.00 0.00 1.25 3.86 -0.87 -2.97 115.15 117.59 1noi h HIS 36 Ca 0.31 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 59.29 1noi h HIS 36 Cb -0.10 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.33 1noi h HIS 36 CO -0.01 1.30 -1.69 1.19 0.86 0.00 0.00 177.93 179.58 1noi n PHE 37 N -4.48 0.79 -0.04 2.45 3.72 0.53 -2.59 117.46 117.84 1noi n PHE 37 Ca -0.27 0.27 -0.21 0.00 -0.05 0.00 0.00 57.45 57.19 1noi n PHE 37 Cb 0.62 -1.08 -0.13 0.00 -0.94 0.00 0.00 39.48 37.95 1noi n PHE 37 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 1noi h THR 38 N 0.00 0.91 0.00 4.37 2.02 -1.40 -3.40 112.91 115.42 1noi h THR 38 Ca -0.26 -2.30 0.00 0.00 0.77 0.00 0.00 66.41 64.62 1noi h THR 38 Cb 1.80 2.51 0.00 0.00 -1.74 0.00 0.00 68.15 70.72 1noi h THR 38 CO 0.05 0.61 -0.91 0.18 0.37 0.00 0.00 175.52 175.82 1noi n LEU 39 N -4.02 0.74 -3.71 2.58 4.32 -0.62 -5.01 117.00 111.27 1noi n LEU 39 Ca -0.29 0.23 -0.29 0.00 -0.02 0.00 0.00 56.01 55.64 1noi n LEU 39 Cb 0.84 -0.10 0.03 0.00 -1.62 0.00 0.00 43.42 42.57 1noi n LEU 39 CO 0.33 -0.10 -0.10 0.52 -1.22 0.00 0.00 177.39 176.82 1noi n VAL 40 N -2.36 -5.35 -4.38 4.08 0.31 -1.07 -5.00 118.33 104.55 1noi n VAL 40 Ca 0.01 -0.85 -0.21 0.00 -0.01 0.00 0.00 64.34 63.28 1noi n VAL 40 Cb 0.50 -4.07 -0.08 0.00 -0.91 0.00 0.00 33.84 29.27 1noi n VAL 40 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1noi s LYS 41 N -6.02 1.77 0.14 5.55 -0.14 -1.13 -5.05 119.74 114.86 1noi s LYS 41 Ca 0.34 -2.04 -0.01 0.00 -1.36 0.00 0.00 55.97 52.90 1noi s LYS 41 Cb -0.12 -0.14 0.00 0.00 -1.68 0.00 0.00 37.83 35.89 1noi s LYS 41 CO 0.86 -0.53 0.20 -0.40 -0.76 0.00 0.00 175.35 174.72 1noi n ASP 42 N -1.27 -0.56 0.28 2.83 5.75 -1.26 -4.05 116.55 118.26 1noi n ASP 42 Ca 0.01 -1.76 0.15 0.00 -0.01 0.00 0.00 54.79 53.17 1noi n ASP 42 Cb 0.64 1.05 0.80 0.00 -1.03 0.00 0.00 41.12 42.58 1noi n ASP 42 CO 0.00 0.00 0.00 0.08 -0.11 0.00 0.00 177.20 177.17 1noi h ARG 43 N 0.00 0.00 -0.26 0.11 0.11 -1.98 0.18 114.38 112.54 1noi h ARG 43 Ca -0.11 0.00 -0.16 0.00 0.10 0.00 0.00 59.98 59.81 1noi h ARG 43 Cb 0.48 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.55 1noi h ARG 43 CO 0.15 0.08 -0.48 -0.91 0.10 0.00 0.00 179.97 178.91 1noi h ASN 44 N 0.00 0.77 0.00 0.08 4.21 -2.05 -3.34 115.58 115.26 1noi h ASN 44 Ca -0.00 -0.38 -0.02 0.00 1.21 0.00 0.00 56.30 57.11 1noi h ASN 44 Cb 0.29 -0.22 -0.00 0.00 -1.12 0.00 0.00 38.32 37.27 1noi h ASN 44 CO 0.01 1.13 -1.88 0.55 -1.29 0.00 0.00 177.43 175.95 1noi n VAL 45 N -4.01 0.07 -2.23 2.81 3.14 -0.93 -5.00 118.33 112.18 1noi n VAL 45 Ca -0.03 -0.45 -0.38 0.00 -2.96 0.00 0.00 64.34 60.52 1noi n VAL 45 Cb 0.58 0.04 -0.01 0.00 -1.06 0.00 0.00 33.84 33.38 1noi n VAL 45 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1noi s ALA 46 N -3.25 3.10 0.27 1.55 0.00 0.59 -4.89 121.76 119.13 1noi s ALA 46 Ca -0.07 1.01 0.07 0.00 0.00 0.00 0.00 51.96 52.97 1noi s ALA 46 Cb 0.12 -3.40 -0.03 0.00 0.00 0.00 0.00 23.12 19.80 1noi s ALA 46 CO 0.78 -0.63 0.23 -0.08 0.00 0.00 0.00 175.76 176.05 1noi s THR 47 N -1.43 4.28 0.26 0.00 -1.32 -1.26 -4.96 115.64 111.21 1noi s THR 47 Ca 0.59 -1.38 -0.12 0.00 -1.21 0.00 0.00 61.69 59.58 1noi s THR 47 Cb -0.31 -3.37 0.36 0.00 -1.51 0.00 0.00 72.50 67.66 1noi s THR 47 CO 0.39 -0.31 1.56 -0.65 -2.21 0.00 0.00 174.62 173.40 1noi h PRO 48 N 1.42 -0.00 -0.67 7.08 0.11 -2.00 0.13 132.00 138.07 1noi h PRO 48 Ca -0.48 0.00 0.10 0.00 0.11 0.00 0.00 66.00 65.73 1noi h PRO 48 Cb 1.24 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.31 1noi h PRO 48 CO 0.60 -0.00 0.45 -0.09 -0.21 0.00 0.00 178.00 178.74 1noi h ARG 49 N -0.00 0.49 -0.14 1.05 2.43 -1.96 -1.97 114.38 114.28 1noi h ARG 49 Ca 0.42 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.43 1noi h ARG 49 Cb 0.67 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.10 1noi h ARG 49 CO -0.99 0.32 -0.46 -0.44 -1.51 0.00 0.00 179.97 176.89 1noi h ASP 50 N 0.50 0.37 0.33 -3.80 3.32 -1.12 -0.27 116.42 115.74 1noi h ASP 50 Ca 0.31 -0.17 -0.20 0.00 0.02 0.00 0.00 57.03 56.99 1noi h ASP 50 Cb 0.54 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.99 1noi h ASP 50 CO -0.10 0.77 -0.81 1.88 -1.72 0.00 0.00 179.24 179.26 1noi h TYR 51 N 0.28 0.53 -0.21 4.55 0.05 -1.18 -0.58 116.97 120.41 1noi h TYR 51 Ca 0.02 -0.26 -0.02 0.00 0.05 0.00 0.00 58.73 58.52 1noi h TYR 51 Cb 0.91 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 38.57 1noi h TYR 51 CO 0.02 1.04 0.06 -0.92 -1.05 0.00 0.00 178.16 177.31 1noi h TYR 52 N 0.24 0.35 -0.34 4.88 3.20 -0.84 -1.76 116.97 122.70 1noi h TYR 52 Ca -0.05 -0.04 -0.07 0.00 3.14 0.00 0.00 58.73 61.72 1noi h TYR 52 Cb 1.41 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.57 1noi h TYR 52 CO 0.05 0.43 -0.07 0.74 -1.64 0.00 0.00 178.16 177.67 1noi h PHE 53 N 0.16 0.59 -0.67 -3.82 0.04 -0.97 0.82 116.94 113.09 1noi h PHE 53 Ca 0.07 -0.08 -0.08 0.00 2.80 0.00 0.00 57.97 60.68 1noi h PHE 53 Cb 0.26 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.22 1noi h PHE 53 CO 0.01 0.62 0.10 0.00 -0.60 0.00 0.00 178.31 178.44 1noi h ALA 54 N 1.41 0.91 -0.16 2.45 0.00 -0.98 -1.57 119.26 121.31 1noi h ALA 54 Ca 0.10 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1noi h ALA 54 Cb 0.44 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1noi h ALA 54 CO 0.02 0.67 -0.01 1.25 0.00 0.00 0.00 179.25 181.18 1noi h LEU 55 N 1.04 0.29 -0.47 0.00 5.85 -0.82 -1.06 115.31 120.14 1noi h LEU 55 Ca 0.20 -0.33 0.10 0.00 0.84 0.00 0.00 57.88 58.69 1noi h LEU 55 Cb 0.45 -0.08 -0.09 0.00 0.37 0.00 0.00 40.66 41.31 1noi h LEU 55 CO 0.01 0.55 -0.13 0.00 -0.34 0.00 0.00 178.44 178.53 1noi h ALA 56 N 0.75 0.29 -0.05 1.25 0.00 -0.81 -0.89 119.26 119.80 1noi h ALA 56 Ca 0.04 0.18 -0.12 0.00 0.00 0.00 0.00 54.91 55.02 1noi h ALA 56 Cb 0.41 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1noi h ALA 56 CO 0.01 -0.46 -0.52 0.45 0.00 0.00 0.00 179.25 178.73 1noi h HIS 57 N -0.02 0.18 -0.19 0.00 3.86 -1.17 0.32 115.15 118.14 1noi h HIS 57 Ca 0.23 -0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.37 1noi h HIS 57 Cb 0.37 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.79 1noi h HIS 57 CO -0.42 0.64 0.09 1.15 0.86 0.00 0.00 177.93 180.25 1noi h THR 58 N 0.12 1.13 -0.47 2.45 2.02 -0.16 -2.64 112.91 115.36 1noi h THR 58 Ca 0.00 -0.36 -0.06 0.00 0.77 0.00 0.00 66.41 66.76 1noi h THR 58 Cb 0.96 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 68.38 1noi h THR 58 CO 0.08 0.12 0.08 0.58 0.37 0.00 0.00 175.52 176.74 1noi h VAL 59 N 0.18 1.25 -0.77 3.16 2.07 -1.06 -3.17 116.25 117.91 1noi h VAL 59 Ca 0.07 -0.91 0.07 0.00 0.82 0.00 0.00 66.70 66.74 1noi h VAL 59 Cb 0.11 0.93 -0.06 0.00 -1.52 0.00 0.00 31.29 30.74 1noi h VAL 59 CO -0.01 0.32 0.44 -0.09 0.02 0.00 0.00 177.57 178.26 1noi h ARG 60 N 0.65 0.77 -0.81 1.57 2.43 -0.83 -2.05 114.38 116.12 1noi h ARG 60 Ca 0.14 -0.05 0.19 0.00 -0.81 0.00 0.00 59.98 59.46 1noi h ARG 60 Cb 0.39 -0.17 -0.13 0.00 -0.42 0.00 0.00 29.97 29.64 1noi h ARG 60 CO 0.01 0.51 0.17 -0.44 -1.51 0.00 0.00 179.97 178.71 1noi h ASP 61 N 0.79 -0.07 0.60 -3.80 3.32 -1.44 -0.90 116.42 114.92 1noi h ASP 61 Ca 0.35 0.18 -0.14 0.00 0.02 0.00 0.00 57.03 57.44 1noi h ASP 61 Cb 0.23 0.26 -0.02 0.00 0.22 0.00 0.00 39.33 40.03 1noi h ASP 61 CO -0.20 -0.12 -0.66 0.45 -1.72 0.00 0.00 179.24 177.00 1noi h HIS 62 N 0.21 0.07 0.07 4.55 3.86 -1.50 -2.59 115.15 119.82 1noi h HIS 62 Ca 0.47 -0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.65 1noi h HIS 62 Cb 0.88 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.34 1noi h HIS 62 CO -0.30 0.70 -0.03 1.25 0.86 0.00 0.00 177.93 180.40 1noi h LEU 63 N 0.04 -0.08 -0.82 2.43 6.46 -0.95 -3.25 115.31 119.14 1noi h LEU 63 Ca -0.01 -0.27 -0.11 0.00 -0.12 0.00 0.00 57.88 57.37 1noi h LEU 63 Cb 1.17 0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 41.10 1noi h LEU 63 CO 0.09 0.24 -0.30 -0.37 -0.62 0.00 0.00 178.44 177.48 1noi h VAL 64 N -0.40 1.28 -0.42 1.05 -1.51 -1.17 -1.33 116.25 113.76 1noi h VAL 64 Ca -0.01 -1.38 0.09 0.00 -1.23 0.00 0.00 66.70 64.16 1noi h VAL 64 Cb 0.35 1.40 -0.09 0.00 -2.13 0.00 0.00 31.29 30.82 1noi h VAL 64 CO 0.02 0.44 -0.15 1.23 -1.23 0.00 0.00 177.57 177.87 1noi h GLY 65 N 1.03 0.21 1.75 5.19 0.00 -1.58 0.16 103.07 109.83 1noi h GLY 65 Ca 0.06 0.20 -0.07 0.00 0.00 0.00 0.00 47.33 47.52 1noi h GLY 65 CO 0.06 -0.18 -0.19 3.21 0.00 0.00 0.00 176.54 179.44 1noi h ARG 66 N -0.06 0.30 -0.27 4.80 3.08 -1.52 -2.91 114.38 117.79 1noi h ARG 66 Ca 0.20 -0.09 -0.07 0.00 0.07 0.00 0.00 59.98 60.10 1noi h ARG 66 Cb 0.37 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1noi h ARG 66 CO -0.47 0.48 -0.11 2.35 -1.07 0.00 0.00 179.97 181.16 1noi h TRP 67 N 0.27 0.63 -0.14 3.04 7.01 -0.30 -0.04 115.95 126.43 1noi h TRP 67 Ca 0.05 -0.15 -0.01 0.00 2.11 0.00 0.00 58.89 60.89 1noi h TRP 67 Cb 0.50 -0.15 -0.01 0.00 -2.10 0.00 0.00 29.16 27.40 1noi h TRP 67 CO 0.01 0.79 0.03 0.82 -2.79 0.00 0.00 178.44 177.30 1noi h ILE 68 N 0.30 1.20 -0.40 2.65 2.04 -1.01 -0.02 117.51 122.27 1noi h ILE 68 Ca 0.06 -0.62 -0.02 0.00 1.00 0.00 0.00 64.86 65.28 1noi h ILE 68 Cb 0.61 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 38.02 1noi h ILE 68 CO 0.04 0.18 0.15 0.03 0.00 0.00 0.00 178.15 178.55 1noi h ARG 69 N 0.02 0.57 -0.30 2.37 3.08 -1.46 -0.54 114.38 118.12 1noi h ARG 69 Ca 0.04 -0.08 -0.10 0.00 0.07 0.00 0.00 59.98 59.92 1noi h ARG 69 Cb 0.26 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 1noi h ARG 69 CO 0.00 0.48 -0.20 1.15 -1.07 0.00 0.00 179.97 180.33 1noi h THR 70 N 0.57 1.30 -0.02 2.04 2.02 -0.31 -2.44 112.91 116.06 1noi h THR 70 Ca 0.14 -1.34 -0.13 0.00 0.77 0.00 0.00 66.41 65.86 1noi h THR 70 Cb 0.14 1.50 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 1noi h THR 70 CO -0.01 0.43 -0.58 1.56 0.37 0.00 0.00 175.52 177.29 1noi h GLN 71 N 0.43 0.06 -0.00 6.66 1.08 -0.55 -2.51 115.11 120.27 1noi h GLN 71 Ca 0.06 -0.04 -0.00 0.00 -1.45 0.00 0.00 58.65 57.22 1noi h GLN 71 Cb 0.75 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 28.18 1noi h GLN 71 CO 0.06 0.62 0.00 1.96 -0.95 0.00 0.00 178.83 180.52 1noi h GLN 72 N 0.04 0.01 -0.72 1.46 4.20 -1.04 -2.19 115.11 116.88 1noi h GLN 72 Ca -0.00 -0.00 0.14 0.00 0.06 0.00 0.00 58.65 58.84 1noi h GLN 72 Cb 1.03 -0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.76 1noi h GLN 72 CO 0.08 0.09 0.48 1.25 -0.67 0.00 0.00 178.83 180.06 1noi h HIS 73 N -0.08 0.46 0.00 2.96 2.76 -1.32 0.17 115.15 120.10 1noi h HIS 73 Ca 0.00 0.01 -0.09 0.00 -2.20 0.00 0.00 60.37 58.10 1noi h HIS 73 Cb 0.09 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 28.89 1noi h HIS 73 CO -0.05 0.18 -0.42 1.88 -1.30 0.00 0.00 177.93 178.23 1noi h TYR 74 N 0.40 0.00 0.05 5.26 0.05 -1.08 -2.95 116.97 118.70 1noi h TYR 74 Ca 0.35 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 59.13 1noi h TYR 74 Cb 0.79 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.53 1noi h TYR 74 CO -0.00 0.42 -0.02 -0.92 -1.05 0.00 0.00 178.16 176.58 1noi h TYR 75 N 0.00 -0.06 0.00 4.88 3.20 -0.10 -1.71 116.97 123.18 1noi h TYR 75 Ca -0.00 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1noi h TYR 75 Cb 1.17 0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.46 1noi h TYR 75 CO 0.00 0.43 0.00 0.39 -1.64 0.00 0.00 178.16 177.34 1noi n GLU 76 N -4.88 0.22 -0.04 1.82 -0.58 -0.41 -3.31 120.64 113.46 1noi n GLU 76 Ca -0.09 0.40 0.04 0.00 -0.42 0.00 0.00 57.16 57.09 1noi n GLU 76 Cb 0.26 -1.88 0.06 0.00 -0.57 0.00 0.00 31.44 29.31 1noi n GLU 76 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1noi n LYS 77 N -2.28 0.96 0.00 3.49 3.00 -1.11 -5.04 118.16 117.18 1noi n LYS 77 Ca 0.03 -1.27 0.00 0.00 -0.00 0.00 0.00 58.31 57.07 1noi n LYS 77 Cb 0.27 -1.17 0.00 0.00 0.00 0.00 0.00 35.03 34.12 1noi n LYS 77 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1noi n ASP 78 N 0.41 0.00 -4.86 3.14 9.92 -0.65 -4.94 116.55 119.58 1noi n ASP 78 Ca 0.06 0.00 -0.29 0.00 -0.53 0.00 0.00 54.79 54.03 1noi n ASP 78 Cb 0.26 0.00 0.09 0.00 -0.64 0.00 0.00 41.12 40.83 1noi n ASP 78 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 1noi s PRO 79 N 0.00 1.93 0.09 -0.24 0.04 -1.26 -5.00 135.00 130.56 1noi s PRO 79 Ca 0.00 0.26 -0.31 0.00 0.04 0.00 0.00 61.00 61.00 1noi s PRO 79 Cb 0.00 -1.93 -0.08 0.00 0.04 0.00 0.00 34.50 32.53 1noi s PRO 79 CO 0.00 -1.65 1.47 0.21 0.04 0.00 0.00 177.00 177.07 1noi s LYS 80 N -5.43 4.27 -0.05 4.56 2.20 -1.26 -4.92 119.74 119.12 1noi s LYS 80 Ca 0.62 2.14 -0.02 0.00 -0.36 0.00 0.00 55.97 58.34 1noi s LYS 80 Cb -0.12 -3.38 -0.04 0.00 -1.51 0.00 0.00 37.83 32.78 1noi s LYS 80 CO 0.51 -0.55 0.09 1.03 -0.36 0.00 0.00 175.35 176.07 1noi s ARG 81 N 1.70 3.18 -0.09 4.03 0.52 -0.68 -4.48 118.95 123.13 1noi s ARG 81 Ca 0.67 -0.37 0.04 0.00 -0.52 0.00 0.00 55.73 55.55 1noi s ARG 81 Cb -0.37 -2.95 0.00 0.00 0.52 0.00 0.00 34.95 32.15 1noi s ARG 81 CO 0.30 0.69 -0.21 -1.50 0.02 0.00 0.00 175.30 174.60 1noi s ILE 82 N -1.11 1.79 -0.24 1.52 -1.16 1.00 -1.43 121.20 121.56 1noi s ILE 82 Ca 0.20 -0.87 -0.05 0.00 -0.51 0.00 0.00 60.65 59.42 1noi s ILE 82 Cb -0.12 -1.56 -0.01 0.00 0.61 0.00 0.00 42.46 41.38 1noi s ILE 82 CO 0.10 0.50 0.01 -0.31 -2.81 0.00 0.00 174.94 172.43 1noi s TYR 83 N 0.39 3.03 -0.40 3.50 2.02 -0.44 -0.32 117.35 125.12 1noi s TYR 83 Ca -0.16 -0.81 -0.11 0.00 -0.37 0.00 0.00 57.07 55.61 1noi s TYR 83 Cb -0.17 -2.16 0.05 0.00 -0.40 0.00 0.00 41.96 39.28 1noi s TYR 83 CO 0.07 -0.50 0.25 -0.47 -1.57 0.00 0.00 175.55 173.33 1noi s TYR 84 N 1.52 3.27 -0.22 2.71 5.04 0.11 -0.68 117.35 129.10 1noi s TYR 84 Ca 0.05 -1.13 -0.12 0.00 -2.44 0.00 0.00 57.07 53.43 1noi s TYR 84 Cb -0.15 -2.70 -0.05 0.00 0.35 0.00 0.00 41.96 39.42 1noi s TYR 84 CO -0.01 -0.73 0.25 -0.51 -1.34 0.00 0.00 175.55 173.21 1noi s LEU 85 N 1.53 4.14 -0.05 6.97 1.43 -0.95 -1.45 118.68 130.30 1noi s LEU 85 Ca 0.03 0.27 -0.09 0.00 -1.03 0.00 0.00 54.13 53.31 1noi s LEU 85 Cb -0.21 -2.26 0.02 0.00 0.03 0.00 0.00 46.19 43.77 1noi s LEU 85 CO 0.05 0.02 0.21 -0.55 0.23 0.00 0.00 176.35 176.32 1noi s SER 86 N 1.01 -0.16 -0.01 2.29 0.15 -0.94 -3.61 113.70 112.43 1noi s SER 86 Ca 0.12 0.22 0.03 0.00 0.70 0.00 0.00 55.95 57.02 1noi s SER 86 Cb -0.14 0.37 0.11 0.00 -1.71 0.00 0.00 66.02 64.65 1noi s SER 86 CO 0.05 -0.21 0.98 0.18 1.20 0.00 0.00 173.24 175.44 1noi n LEU 87 N 2.30 0.91 -3.77 3.45 4.32 -1.26 -4.23 117.00 118.71 1noi n LEU 87 Ca -0.17 -0.45 -0.13 0.00 -0.02 0.00 0.00 56.01 55.24 1noi n LEU 87 Cb 0.57 -0.20 -0.12 0.00 -1.62 0.00 0.00 43.42 42.06 1noi n LEU 87 CO 0.20 0.19 -0.11 -1.61 -1.22 0.00 0.00 177.39 174.84 1noi s GLU 88 N -1.70 0.26 -0.25 3.23 2.02 -1.26 -4.88 118.70 116.12 1noi s GLU 88 Ca 0.08 0.38 -0.04 0.00 0.02 0.00 0.00 54.97 55.42 1noi s GLU 88 Cb 0.05 0.06 0.08 0.00 0.10 0.00 0.00 34.13 34.42 1noi s GLU 88 CO 0.04 -0.07 0.10 -0.06 0.02 0.00 0.00 175.26 175.29 1noi s PHE 89 N 0.44 0.62 -1.10 1.61 0.08 -0.27 -4.49 117.98 114.87 1noi s PHE 89 Ca -0.03 -0.86 -0.07 0.00 0.12 0.00 0.00 56.93 56.09 1noi s PHE 89 Cb -0.04 -0.99 0.29 0.00 -0.57 0.00 0.00 43.02 41.70 1noi s PHE 89 CO -0.02 -0.72 1.21 0.98 -0.10 0.00 0.00 175.22 176.57 1noi n TYR 90 N 5.16 4.44 0.09 0.36 9.36 -0.53 -3.63 117.16 132.42 1noi n TYR 90 Ca -0.06 -3.57 -0.04 0.00 3.32 0.00 0.00 57.90 57.55 1noi n TYR 90 Cb 0.45 -1.56 0.14 0.00 -0.63 0.00 0.00 39.34 37.73 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 6.28 0.21 -5.76 2.98 2.86 -1.84 -3.40 114.93 116.26 1noi h MET 91 Ca 0.18 -0.14 -0.31 0.00 -2.06 0.00 0.00 59.70 57.38 1noi h MET 91 Cb 0.80 0.02 0.01 0.00 0.06 0.00 0.00 31.60 32.48 1noi h MET 91 CO 1.10 0.73 -0.77 0.41 1.06 0.00 0.00 176.91 179.44 1noi n GLY 92 N 0.21 -0.50 0.71 8.32 0.00 -1.26 -4.74 105.19 107.94 1noi n GLY 92 Ca -0.02 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.55 1noi n GLY 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1noi n ARG 93 N -1.25 0.00 -0.02 1.61 1.74 -1.26 -4.60 116.66 112.89 1noi n ARG 93 Ca -0.16 0.43 0.04 0.00 -0.77 0.00 0.00 57.85 57.40 1noi n ARG 93 Cb 0.46 -0.28 -0.12 0.00 -1.02 0.00 0.00 32.46 31.51 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 0.40 0.22 0.31 0.55 -1.04 -1.26 -4.59 114.28 108.87 1noi n THR 94 Ca 0.00 -0.41 -0.15 0.00 -2.04 0.00 0.00 64.05 61.45 1noi n THR 94 Cb 0.00 -0.02 -0.08 0.00 -1.82 0.00 0.00 70.33 68.41 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 -0.69 -0.73 -4.42 6.46 -1.96 -2.11 115.31 111.88 1noi h LEU 95 Ca -0.09 -0.03 -0.10 0.00 -0.12 0.00 0.00 57.88 57.55 1noi h LEU 95 Cb 0.96 0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 41.05 1noi h LEU 95 CO 0.00 -0.34 -0.10 -0.61 -0.62 0.00 0.00 178.44 176.77 1noi h GLN 96 N -1.07 0.87 -0.37 1.25 4.15 -1.96 -2.00 115.11 115.98 1noi h GLN 96 Ca -0.08 -0.30 -0.01 0.00 0.77 0.00 0.00 58.65 59.03 1noi h GLN 96 Cb 0.67 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 28.28 1noi h GLN 96 CO 0.14 0.93 0.17 -0.97 -1.93 0.00 0.00 178.83 177.17 1noi h ASN 97 N 0.78 0.45 -0.02 -0.69 -0.73 -1.80 -2.02 115.58 111.55 1noi h ASN 97 Ca 0.13 -0.03 -0.11 0.00 1.87 0.00 0.00 56.30 58.16 1noi h ASN 97 Cb 0.62 -0.11 0.01 0.00 0.27 0.00 0.00 38.32 39.10 1noi h ASN 97 CO 0.04 0.39 -0.40 0.74 -0.37 0.00 0.00 177.43 177.83 1noi h THR 98 N 0.51 1.47 -0.26 -3.57 2.02 -0.83 -0.34 112.91 111.91 1noi h THR 98 Ca 0.13 -1.93 -0.04 0.00 0.77 0.00 0.00 66.41 65.33 1noi h THR 98 Cb 0.06 2.58 -0.01 0.00 -1.74 0.00 0.00 68.15 69.04 1noi h THR 98 CO -0.02 0.55 -0.02 0.24 0.37 0.00 0.00 175.52 176.64 1noi h MET 99 N -0.25 0.40 0.10 6.66 2.86 -1.28 -1.28 114.93 122.14 1noi h MET 99 Ca -0.04 -0.08 -0.31 0.00 -2.06 0.00 0.00 59.70 57.21 1noi h MET 99 Cb 1.11 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.69 1noi h MET 99 CO 0.08 0.44 -1.59 -0.39 1.06 0.00 0.00 176.91 176.51 1noi h VAL 100 N 0.39 1.07 0.00 -2.22 -1.51 -1.34 0.19 116.25 112.83 1noi h VAL 100 Ca 0.09 -2.75 -0.01 0.00 -1.23 0.00 0.00 66.70 62.80 1noi h VAL 100 Cb 0.29 2.68 -0.00 0.00 -2.13 0.00 0.00 31.29 32.13 1noi h VAL 100 CO 0.01 0.79 -0.03 0.78 -1.23 0.00 0.00 177.57 177.88 1noi h ASN 101 N 0.06 0.00 -0.32 4.19 4.21 -0.82 -1.02 115.58 121.88 1noi h ASN 101 Ca -0.26 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.25 1noi h ASN 101 Cb 2.01 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 39.21 1noi h ASN 101 CO 0.14 0.03 0.00 0.18 -1.29 0.00 0.00 177.43 176.49 1noi n LEU 102 N -3.44 3.17 -3.91 1.61 4.32 -0.50 -0.67 117.00 117.57 1noi n LEU 102 Ca -0.02 -1.48 -0.29 0.00 -0.02 0.00 0.00 56.01 54.20 1noi n LEU 102 Cb 0.15 -0.20 0.02 0.00 -1.62 0.00 0.00 43.42 41.76 1noi n LEU 102 CO 0.26 0.68 0.03 0.00 -1.22 0.00 0.00 177.39 177.13 1noi n ALA 103 N 1.24 -1.50 0.33 -1.18 0.00 -0.39 -4.91 120.51 114.10 1noi n ALA 103 Ca 0.16 0.05 0.03 0.00 0.00 0.00 0.00 53.44 53.69 1noi n ALA 103 Cb 0.54 -3.57 -0.02 0.00 0.00 0.00 0.00 19.45 16.39 1noi n ALA 103 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1noi n LEU 104 N -4.54 0.63 -0.31 0.00 4.32 0.65 -4.77 117.00 112.98 1noi n LEU 104 Ca -0.06 -0.62 -0.04 0.00 -0.02 0.00 0.00 56.01 55.27 1noi n LEU 104 Cb 0.57 0.00 0.07 0.00 -1.62 0.00 0.00 43.42 42.44 1noi n LEU 104 CO 0.75 0.14 1.16 -0.08 -1.22 0.00 0.00 177.39 178.15 1noi h GLU 105 N 0.36 1.14 -0.25 3.23 4.81 -1.83 -1.51 114.58 120.54 1noi h GLU 105 Ca 0.00 -0.12 0.04 0.00 -0.13 0.00 0.00 59.36 59.15 1noi h GLU 105 Cb 0.20 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 29.32 1noi h GLU 105 CO 0.00 0.82 0.04 -0.91 -0.73 0.00 0.00 179.01 178.23 1noi h ASN 106 N 1.15 -0.02 -0.15 1.04 2.35 -1.90 0.12 115.58 118.18 1noi h ASN 106 Ca 0.29 0.04 -0.11 0.00 -0.55 0.00 0.00 56.30 55.98 1noi h ASN 106 Cb -0.00 0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.43 1noi h ASN 106 CO -0.05 0.02 -0.34 0.00 -1.65 0.00 0.00 177.43 175.42 1noi h ALA 107 N 1.19 0.24 -0.45 -0.83 0.00 -1.87 -1.08 119.26 116.45 1noi h ALA 107 Ca 0.11 -0.43 -0.10 0.00 0.00 0.00 0.00 54.91 54.49 1noi h ALA 107 Cb 0.12 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1noi h ALA 107 CO -0.16 0.29 -0.12 0.00 0.00 0.00 0.00 179.25 179.26 1noi h ASP 109 N 0.75 0.17 -0.32 0.00 3.58 -0.54 -0.72 116.42 119.33 1noi h ASP 109 Ca 0.12 -0.14 -0.07 0.00 0.42 0.00 0.00 57.03 57.37 1noi h ASP 109 Cb 0.62 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.61 1noi h ASP 109 CO 0.04 0.26 -0.03 -0.08 -2.88 0.00 0.00 179.24 176.55 1noi h GLU 110 N 0.07 0.69 0.04 0.28 4.57 -0.94 -2.55 114.58 116.74 1noi h GLU 110 Ca 0.04 -0.18 -0.00 0.00 -1.18 0.00 0.00 59.36 58.04 1noi h GLU 110 Cb 0.14 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.64 1noi h GLU 110 CO -0.00 0.73 -0.02 0.00 -1.18 0.00 0.00 179.01 178.53 1noi h ALA 111 N 1.32 -0.05 -0.26 2.92 0.00 -0.58 -2.61 119.26 119.99 1noi h ALA 111 Ca 0.13 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1noi h ALA 111 Cb 0.44 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1noi h ALA 111 CO 0.02 -0.43 -0.14 1.79 0.00 0.00 0.00 179.25 180.49 1noi h THR 112 N -0.25 1.23 -0.31 0.00 1.35 -1.11 -2.49 112.91 111.33 1noi h THR 112 Ca -0.01 -1.02 -0.12 0.00 -0.55 0.00 0.00 66.41 64.72 1noi h THR 112 Cb 0.23 1.19 -0.01 0.00 -1.73 0.00 0.00 68.15 67.82 1noi h THR 112 CO 0.01 0.33 -0.29 0.22 -0.25 0.00 0.00 175.52 175.54 1noi h TYR 113 N 0.41 0.75 -0.00 4.73 3.20 -1.46 0.23 116.97 124.82 1noi h TYR 113 Ca 0.08 -0.18 -0.14 0.00 3.14 0.00 0.00 58.73 61.62 1noi h TYR 113 Cb 0.50 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 1noi h TYR 113 CO 0.01 0.87 -0.68 1.96 -1.64 0.00 0.00 178.16 178.68 1noi h GLN 114 N 0.56 0.01 0.00 1.82 4.20 -1.21 -2.80 115.11 117.70 1noi h GLN 114 Ca 0.07 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1noi h GLN 114 Cb 0.78 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.56 1noi h GLN 114 CO 0.06 0.69 0.00 -0.07 -0.67 0.00 0.00 178.83 178.84 1noi h LEU 115 N 0.01 0.00 0.00 1.46 3.38 -0.99 -3.47 115.31 115.70 1noi h LEU 115 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1noi h LEU 115 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1noi h LEU 115 CO 0.09 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.23 1noi n GLY 116 N 0.63 0.97 3.64 0.83 0.00 -0.17 -5.08 105.19 106.00 1noi n GLY 116 Ca 0.03 -0.04 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 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 3.24 -0.33 0.99 1.43 0.63 -4.99 118.68 119.64 1noi s LEU 117 Ca 0.00 -0.35 -0.06 0.00 -1.03 0.00 0.00 54.13 52.69 1noi s LEU 117 Cb 0.00 -1.96 0.04 0.00 0.03 0.00 0.00 46.19 44.30 1noi s LEU 117 CO 0.00 0.14 0.10 -0.62 0.23 0.00 0.00 176.35 176.20 1noi s ASP 118 N -2.55 5.28 0.44 2.29 2.15 -1.26 -3.39 116.67 119.63 1noi s ASP 118 Ca 0.25 -1.11 0.12 0.00 0.43 0.00 0.00 52.55 52.24 1noi s ASP 118 Cb -0.10 -1.86 0.97 0.00 -0.30 0.00 0.00 42.92 41.63 1noi s ASP 118 CO 0.17 -0.31 2.01 -0.03 -0.17 0.00 0.00 175.17 176.83 1noi h MET 119 N 8.21 0.13 -0.74 4.34 1.85 -1.91 -1.51 114.93 125.30 1noi h MET 119 Ca -0.24 -0.02 -0.03 0.00 -0.61 0.00 0.00 59.70 58.81 1noi h MET 119 Cb 1.08 -0.02 -0.03 0.00 0.43 0.00 0.00 31.60 33.06 1noi h MET 119 CO 0.60 0.23 0.36 0.93 -0.40 0.00 0.00 176.91 178.62 1noi h GLU 120 N 0.13 1.05 -0.06 0.39 5.08 -2.00 -1.33 114.58 117.84 1noi h GLU 120 Ca 0.03 -0.14 -0.16 0.00 -1.00 0.00 0.00 59.36 58.08 1noi h GLU 120 Cb 0.23 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1noi h GLU 120 CO 0.01 0.81 -0.68 1.49 -1.00 0.00 0.00 179.01 179.64 1noi h GLU 121 N 1.05 0.27 0.00 2.33 4.22 -1.72 -2.80 114.58 117.93 1noi h GLU 121 Ca 0.26 -0.21 -0.09 0.00 0.08 0.00 0.00 59.36 59.40 1noi h GLU 121 Cb 0.10 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1noi h GLU 121 CO -0.03 0.85 -0.41 -0.07 -2.18 0.00 0.00 179.01 177.16 1noi h LEU 122 N 0.19 0.00 -0.80 1.64 3.38 -0.97 -2.59 115.31 116.16 1noi h LEU 122 Ca -0.02 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 1noi h LEU 122 Cb 1.22 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.96 1noi h LEU 122 CO 0.11 0.41 -0.58 -0.33 0.09 0.00 0.00 178.44 178.14 1noi h GLU 123 N 0.00 0.05 0.00 1.13 5.08 -1.00 -2.80 114.58 117.04 1noi h GLU 123 Ca -0.00 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1noi h GLU 123 Cb 0.89 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.14 1noi h GLU 123 CO 0.05 0.62 -0.04 0.93 -1.00 0.00 0.00 179.01 179.57 1noi h GLU 124 N 0.04 0.00 0.00 2.33 4.39 -1.32 -2.47 114.58 117.54 1noi h GLU 124 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 1noi h GLU 124 Cb 1.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.69 1noi h GLU 124 CO 0.08 0.04 0.00 0.82 -1.16 0.00 0.00 179.01 178.79 1noi h ILE 125 N 0.00 0.00 -3.73 3.13 1.08 -1.47 -3.45 117.51 113.06 1noi h ILE 125 Ca -0.00 -0.54 -0.50 0.00 -0.39 0.00 0.00 64.86 63.43 1noi h ILE 125 Cb 0.50 1.47 -0.01 0.00 -3.07 0.00 0.00 36.82 35.71 1noi h ILE 125 CO 0.01 0.00 0.40 -0.70 -0.69 0.00 0.00 178.15 177.17 1noi s GLU 126 N -3.40 4.75 0.26 2.37 2.12 -0.93 -5.02 118.70 118.85 1noi s GLU 126 Ca 0.05 1.61 -0.29 0.00 0.36 0.00 0.00 54.97 56.70 1noi s GLU 126 Cb 0.09 -3.26 -0.09 0.00 0.26 0.00 0.00 34.13 31.13 1noi s GLU 126 CO 0.54 0.35 0.95 -1.21 -0.54 0.00 0.00 175.26 175.35 1noi s GLU 127 N -1.08 4.78 0.45 4.30 0.41 -1.26 -4.98 118.70 121.31 1noi s GLU 127 Ca 0.43 1.46 -0.25 0.00 -0.41 0.00 0.00 54.97 56.21 1noi s GLU 127 Cb -0.28 -3.15 -0.08 0.00 -1.78 0.00 0.00 34.13 28.84 1noi s GLU 127 CO 0.35 0.44 1.36 -0.51 -0.49 0.00 0.00 175.26 176.41 1noi s ASP 128 N -1.28 5.93 -0.13 -0.19 1.11 -1.26 -4.21 116.67 116.64 1noi s ASP 128 Ca 0.44 2.77 -0.29 0.00 0.18 0.00 0.00 52.55 55.64 1noi s ASP 128 Cb -0.24 -2.64 -0.02 0.00 1.07 0.00 0.00 42.92 41.08 1noi s ASP 128 CO 0.30 -1.12 1.30 0.00 1.18 0.00 0.00 175.17 176.83 1noi s ALA 129 N -1.26 3.63 -1.23 5.23 0.00 -1.26 -4.84 121.76 122.04 1noi s ALA 129 Ca 0.62 0.54 -0.11 0.00 0.00 0.00 0.00 51.96 53.01 1noi s ALA 129 Cb -0.40 -3.62 -0.07 0.00 0.00 0.00 0.00 23.12 19.03 1noi s ALA 129 CO 0.51 -1.13 2.40 0.41 0.00 0.00 0.00 175.76 177.94 1noi n GLY 130 N 3.64 3.63 0.00 0.00 0.00 -1.26 -4.32 105.19 106.87 1noi n GLY 130 Ca 0.14 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.91 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 4.73 1.38 0.00 0.99 4.32 -1.26 -3.19 117.00 123.96 1noi n LEU 131 Ca 0.58 -1.38 -0.03 0.00 -0.02 0.00 0.00 56.01 55.17 1noi n LEU 131 Cb 0.24 0.00 0.01 0.00 -1.62 0.00 0.00 43.42 42.06 1noi n LEU 131 CO 0.83 0.34 0.42 0.61 -1.22 0.00 0.00 177.39 178.38 1noi n GLY 132 N -0.23 1.05 2.00 -0.72 0.00 -1.24 -1.11 105.19 104.94 1noi n GLY 132 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.94 1noi n GLY 132 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1noi n ASN 133 N -1.09 -0.07 0.00 1.61 5.15 -1.26 -4.86 115.26 114.74 1noi n ASN 133 Ca -0.02 0.13 0.00 0.00 -0.60 0.00 0.00 54.58 54.09 1noi n ASN 133 Cb 0.34 0.14 0.00 0.00 -0.53 0.00 0.00 39.78 39.73 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 1.43 5.23 0.33 8.20 0.00 -1.26 -5.00 105.19 114.12 1noi n GLY 134 Ca 0.00 -0.90 -0.05 0.00 0.00 0.00 0.00 46.02 45.06 1noi n GLY 134 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1noi h GLY 135 N 0.00 1.18 1.19 -0.02 0.00 -2.01 -2.17 103.07 101.24 1noi h GLY 135 Ca 0.00 -0.68 0.07 0.00 0.00 0.00 0.00 47.33 46.72 1noi h GLY 135 CO 0.00 0.64 0.38 -2.00 0.00 0.00 0.00 176.54 175.56 1noi h LEU 136 N 1.06 0.46 0.15 3.11 6.46 -1.96 -1.66 115.31 122.92 1noi h LEU 136 Ca 0.24 0.00 -0.20 0.00 -0.12 0.00 0.00 57.88 57.80 1noi h LEU 136 Cb 0.28 -0.10 0.02 0.00 -0.73 0.00 0.00 40.66 40.13 1noi h LEU 136 CO -0.01 0.29 -0.89 1.23 -0.62 0.00 0.00 178.44 178.45 1noi h GLY 137 N 0.52 0.36 1.37 3.75 0.00 -1.63 -3.00 103.07 104.44 1noi h GLY 137 Ca 0.25 -0.92 -0.12 0.00 0.00 0.00 0.00 47.33 46.55 1noi h GLY 137 CO -0.07 0.80 -0.27 -0.09 0.00 0.00 0.00 176.54 176.91 1noi h ARG 138 N -0.34 0.72 0.31 4.80 1.12 -1.41 -0.80 114.38 118.79 1noi h ARG 138 Ca -0.16 -0.31 0.00 0.00 -1.11 0.00 0.00 59.98 58.41 1noi h ARG 138 Cb 1.68 -0.02 -0.03 0.00 -0.01 0.00 0.00 29.97 31.59 1noi h ARG 138 CO 0.16 0.91 -0.39 1.25 -3.11 0.00 0.00 179.97 178.79 1noi h LEU 139 N 0.62 -1.07 -1.06 3.80 5.85 -1.39 0.20 115.31 122.25 1noi h LEU 139 Ca 0.08 0.10 0.08 0.00 0.84 0.00 0.00 57.88 58.98 1noi h LEU 139 Cb 0.78 0.37 -0.07 0.00 0.37 0.00 0.00 40.66 42.11 1noi h LEU 139 CO 0.06 -0.51 0.62 0.00 -0.34 0.00 0.00 178.44 178.28 1noi h ALA 140 N -0.30 1.49 -0.28 1.25 0.00 -1.45 0.10 119.26 120.06 1noi h ALA 140 Ca -0.01 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.70 1noi h ALA 140 Cb 0.69 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1noi h ALA 140 CO -0.11 0.34 -0.54 0.00 0.00 0.00 0.00 179.25 178.93 1noi h ALA 141 N 1.50 0.45 -0.07 0.00 0.00 -0.21 -1.77 119.26 119.17 1noi h ALA 141 Ca 0.44 -0.51 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1noi h ALA 141 Cb 0.29 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1noi h ALA 141 CO -0.19 0.66 -0.04 0.00 0.00 0.00 0.00 179.25 179.68 1noi h PHE 143 N -0.05 0.94 -0.82 0.00 -1.00 -0.75 -1.38 116.94 113.89 1noi h PHE 143 Ca 0.04 0.02 -0.04 0.00 2.81 0.00 0.00 57.97 60.81 1noi h PHE 143 Cb 0.11 -0.31 -0.04 0.00 3.61 0.00 0.00 35.95 39.32 1noi h PHE 143 CO -0.15 0.52 0.36 -0.07 -1.61 0.00 0.00 178.31 177.36 1noi h LEU 144 N 0.95 1.10 -0.47 1.54 3.38 -0.92 0.17 115.31 121.06 1noi h LEU 144 Ca 0.34 -0.15 -0.10 0.00 0.09 0.00 0.00 57.88 58.05 1noi h LEU 144 Cb 0.14 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1noi h LEU 144 CO -0.11 0.95 -0.11 -0.78 0.09 0.00 0.00 178.44 178.48 1noi h ASP 145 N 1.18 0.92 -0.36 -0.43 1.82 -1.00 -2.53 116.42 116.01 1noi h ASP 145 Ca 0.28 -0.36 -0.08 0.00 -0.39 0.00 0.00 57.03 56.47 1noi h ASP 145 Cb 0.17 -0.25 -0.01 0.00 0.68 0.00 0.00 39.33 39.92 1noi h ASP 145 CO -0.03 1.07 -0.10 0.28 -1.61 0.00 0.00 179.24 178.85 1noi h SER 146 N 0.76 0.71 -0.19 2.28 0.02 -1.11 -2.16 113.55 113.85 1noi h SER 146 Ca 0.12 -0.37 0.03 0.00 -0.84 0.00 0.00 61.79 60.73 1noi h SER 146 Cb 0.67 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.98 1noi h SER 146 CO 0.05 0.92 -0.01 0.24 -1.14 0.00 0.00 176.83 176.89 1noi h MET 147 N 0.50 0.05 -0.78 3.45 2.86 -0.96 -1.11 114.93 118.94 1noi h MET 147 Ca 0.09 -0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.78 1noi h MET 147 Cb 0.61 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 32.21 1noi h MET 147 CO 0.04 0.03 0.48 0.00 1.06 0.00 0.00 176.91 178.52 1noi h ALA 148 N 1.16 1.04 -0.03 6.32 0.00 -1.53 -1.29 119.26 124.94 1noi h ALA 148 Ca 0.09 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 1noi h ALA 148 Cb 0.11 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1noi h ALA 148 CO -0.16 0.24 -0.50 1.15 0.00 0.00 0.00 179.25 179.98 1noi h THR 149 N 0.91 1.36 -0.50 0.00 2.02 -0.96 -2.76 112.91 112.96 1noi h THR 149 Ca 0.33 -1.74 0.00 0.00 0.77 0.00 0.00 66.41 65.77 1noi h THR 149 Cb 0.10 1.91 0.00 0.00 -1.74 0.00 0.00 68.15 68.42 1noi h THR 149 CO -0.15 0.50 0.00 0.18 0.37 0.00 0.00 175.52 176.43 1noi n LEU 150 N -3.94 4.44 -2.90 2.58 4.77 -0.46 -4.68 117.00 116.81 1noi n LEU 150 Ca -0.02 -2.25 -0.22 0.00 -0.03 0.00 0.00 56.01 53.50 1noi n LEU 150 Cb 0.53 -0.59 0.03 0.00 -2.33 0.00 0.00 43.42 41.06 1noi n LEU 150 CO 0.41 0.62 -0.04 0.61 -1.33 0.00 0.00 177.39 177.67 1noi n GLY 151 N 0.75 -0.50 3.87 -0.72 0.00 -0.73 -0.15 105.19 107.70 1noi n GLY 151 Ca 0.22 0.10 -0.32 0.00 0.00 0.00 0.00 46.02 46.02 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 -6.53 4.15 -1.09 0.99 1.43 -0.57 -4.65 118.68 112.41 1noi s LEU 152 Ca 0.26 1.02 -0.16 0.00 -1.03 0.00 0.00 54.13 54.22 1noi s LEU 152 Cb -0.11 -3.78 0.14 0.00 0.03 0.00 0.00 46.19 42.47 1noi s LEU 152 CO 0.32 -0.10 1.33 0.00 0.23 0.00 0.00 176.35 178.13 1noi s ALA 153 N -1.85 3.64 -0.01 4.21 0.00 -1.26 -4.60 121.76 121.90 1noi s ALA 153 Ca 0.49 -3.04 0.06 0.00 0.00 0.00 0.00 51.96 49.47 1noi s ALA 153 Cb -0.11 -4.15 -0.02 0.00 0.00 0.00 0.00 23.12 18.85 1noi s ALA 153 CO 0.20 -2.93 -0.20 0.00 0.00 0.00 0.00 175.76 172.83 1noi s ALA 154 N 2.35 1.66 -0.07 0.00 0.00 -1.26 -0.00 121.76 124.44 1noi s ALA 154 Ca 0.39 -0.88 0.01 0.00 0.00 0.00 0.00 51.96 51.48 1noi s ALA 154 Cb -0.03 -0.41 0.02 0.00 0.00 0.00 0.00 23.12 22.70 1noi s ALA 154 CO -0.04 0.40 -0.07 0.71 0.00 0.00 0.00 175.76 176.76 1noi s TYR 155 N -0.51 1.10 -0.01 0.00 1.51 0.57 -3.83 117.35 116.18 1noi s TYR 155 Ca 0.08 -0.40 -0.24 0.00 -1.01 0.00 0.00 57.07 55.50 1noi s TYR 155 Cb -0.08 -0.91 -0.05 0.00 -0.11 0.00 0.00 41.96 40.82 1noi s TYR 155 CO -0.00 -0.29 0.71 0.20 -1.11 0.00 0.00 175.55 175.06 1noi s GLY 156 N 1.07 2.69 -0.03 0.71 0.00 -0.79 0.04 107.32 111.01 1noi s GLY 156 Ca -0.08 0.18 0.05 0.00 0.00 0.00 0.00 44.72 44.87 1noi s GLY 156 CO -0.01 1.08 -0.18 -0.19 0.00 0.00 0.00 173.10 173.80 1noi s TYR 157 N 0.29 1.73 0.00 1.90 2.02 -0.53 -1.27 117.35 121.48 1noi s TYR 157 Ca 0.37 -0.42 0.00 0.00 -0.37 0.00 0.00 57.07 56.65 1noi s TYR 157 Cb -0.19 -1.14 0.00 0.00 -0.40 0.00 0.00 41.96 40.23 1noi s TYR 157 CO 0.20 -0.11 0.00 0.41 -1.57 0.00 0.00 175.55 174.48 1noi n GLY 158 N 2.90 2.67 3.43 0.71 0.00 -1.04 -2.20 105.19 111.65 1noi n GLY 158 Ca -0.17 -0.68 -0.32 0.00 0.00 0.00 0.00 46.02 44.86 1noi n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1noi s ILE 159 N -2.50 2.72 -0.43 -0.61 1.01 -1.26 -2.05 121.20 118.08 1noi s ILE 159 Ca 0.00 -1.00 -0.23 0.00 0.00 0.00 0.00 60.65 59.42 1noi s ILE 159 Cb 0.00 -2.07 0.02 0.00 0.01 0.00 0.00 42.46 40.42 1noi s ILE 159 CO 0.00 0.49 0.78 -0.60 0.00 0.00 0.00 174.94 175.61 1noi s ARG 160 N -0.99 3.50 -0.01 2.79 3.52 -0.58 -4.74 118.95 122.45 1noi s ARG 160 Ca 0.12 0.01 -0.18 0.00 -0.13 0.00 0.00 55.73 55.55 1noi s ARG 160 Cb -0.10 -3.90 -0.06 0.00 -1.56 0.00 0.00 34.95 29.33 1noi s ARG 160 CO 0.02 -1.05 0.51 0.71 -0.81 0.00 0.00 175.30 174.69 1noi s TYR 161 N 3.25 3.69 0.11 5.12 2.02 -1.26 -4.77 117.35 125.51 1noi s TYR 161 Ca 0.30 1.10 0.16 0.00 -0.37 0.00 0.00 57.07 58.27 1noi s TYR 161 Cb -0.12 -2.48 0.45 0.00 -0.40 0.00 0.00 41.96 39.41 1noi s TYR 161 CO 0.21 0.46 1.63 1.49 -1.57 0.00 0.00 175.55 177.77 1noi h GLU 162 N 5.32 0.00 0.00 -0.62 4.81 -0.63 -3.34 114.58 120.12 1noi h GLU 162 Ca -0.47 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 58.68 1noi h GLU 162 Cb 1.20 0.00 -0.17 0.00 0.63 0.00 0.00 28.75 30.41 1noi h GLU 162 CO 0.67 0.47 -0.68 1.19 -0.73 0.00 0.00 179.01 179.93 1noi n PHE 163 N -3.48 0.00 0.00 0.92 3.72 -0.60 -4.44 117.46 113.59 1noi n PHE 163 Ca 0.00 -0.54 0.00 0.00 -0.05 0.00 0.00 57.45 56.86 1noi n PHE 163 Cb 0.60 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 39.01 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 -0.09 1.46 3.15 1.37 0.00 -1.19 -3.58 105.19 106.31 1noi n GLY 164 Ca 0.07 0.50 0.05 0.00 0.00 0.00 0.00 46.02 46.64 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 -0.62 0.00 -0.61 -1.16 -1.26 -0.08 121.20 117.47 1noi s ILE 165 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.14 1noi s ILE 165 Cb 0.00 -0.88 0.00 0.00 0.61 0.00 0.00 42.46 42.19 1noi s ILE 165 CO 0.00 0.00 0.00 2.22 -2.81 0.00 0.00 174.94 174.35 1noi n PHE 166 N 5.39 0.00 -3.87 3.50 1.16 -1.25 -4.89 117.46 117.51 1noi n PHE 166 Ca -0.01 0.00 -0.36 0.00 -1.87 0.00 0.00 57.45 55.21 1noi n PHE 166 Cb 0.54 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.33 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 0.00 6.19 -0.05 5.98 0.02 0.43 -4.85 114.94 122.66 1noi s ASN 167 Ca 0.00 0.33 -0.22 0.00 -1.02 0.00 0.00 52.86 51.95 1noi s ASN 167 Cb 0.00 -2.03 -0.04 0.00 0.02 0.00 0.00 41.25 39.19 1noi s ASN 167 CO 0.00 0.30 0.66 -1.58 0.02 0.00 0.00 177.10 176.50 1noi s GLN 168 N -0.39 4.41 -0.01 -0.60 0.74 -1.26 -0.80 119.66 121.74 1noi s GLN 168 Ca 0.11 0.81 0.07 0.00 0.05 0.00 0.00 55.36 56.41 1noi s GLN 168 Cb -0.12 -3.41 -0.02 0.00 1.10 0.00 0.00 33.01 30.56 1noi s GLN 168 CO 0.01 0.17 -0.23 0.21 -0.55 0.00 0.00 175.29 174.90 1noi s LYS 169 N 0.47 1.83 -0.31 1.67 2.20 -0.21 -4.21 119.74 121.18 1noi s LYS 169 Ca 0.35 -0.82 -0.10 0.00 -0.36 0.00 0.00 55.97 55.03 1noi s LYS 169 Cb -0.18 -1.78 -0.01 0.00 -1.51 0.00 0.00 37.83 34.35 1noi s LYS 169 CO 0.17 0.49 0.17 0.42 -0.36 0.00 0.00 175.35 176.24 1noi s ILE 170 N -0.55 4.80 -0.13 5.43 -1.09 -1.26 0.16 121.20 128.56 1noi s ILE 170 Ca 0.09 -0.31 0.02 0.00 -2.23 0.00 0.00 60.65 58.22 1noi s ILE 170 Cb -0.09 -3.43 0.02 0.00 -1.58 0.00 0.00 42.46 37.38 1noi s ILE 170 CO -0.01 0.08 -0.17 0.00 -1.23 0.00 0.00 174.94 173.61 1noi n GLY 172 N 4.34 -0.05 2.11 0.00 0.00 -1.26 -1.58 105.19 108.75 1noi n GLY 172 Ca -0.19 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.82 1noi n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1noi n GLY 173 N -0.83 0.51 3.46 -0.02 0.00 -1.26 -5.06 105.19 101.99 1noi n GLY 173 Ca -0.21 -0.46 -0.31 0.00 0.00 0.00 0.00 46.02 45.04 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 -1.98 2.57 0.35 1.61 0.52 -0.61 -3.78 118.94 117.62 1noi s TRP 174 Ca 0.00 -0.25 -0.28 0.00 0.02 0.00 0.00 56.10 55.59 1noi s TRP 174 Cb 0.00 -1.47 -0.10 0.00 -1.15 0.00 0.00 33.47 30.75 1noi s TRP 174 CO 0.00 0.26 1.36 -1.14 0.02 0.00 0.00 176.95 177.44 1noi s GLN 175 N -1.44 4.25 -0.04 4.98 0.74 -1.26 -0.43 119.66 126.46 1noi s GLN 175 Ca 0.15 2.31 0.02 0.00 0.05 0.00 0.00 55.36 57.89 1noi s GLN 175 Cb -0.11 -3.02 0.01 0.00 1.10 0.00 0.00 33.01 31.00 1noi s GLN 175 CO 0.05 -0.31 -0.09 -1.64 -0.55 0.00 0.00 175.29 172.76 1noi s MET 176 N -1.92 1.12 -0.19 1.67 -1.94 0.12 -4.85 119.30 113.31 1noi s MET 176 Ca 0.51 -0.28 -0.07 0.00 -1.71 0.00 0.00 55.69 54.13 1noi s MET 176 Cb -0.42 -1.01 -0.04 0.00 2.01 0.00 0.00 34.83 35.37 1noi s MET 176 CO 0.56 0.04 0.05 -1.83 -0.01 0.00 0.00 175.02 173.83 1noi s GLU 177 N 0.49 3.89 0.05 2.03 1.03 -1.26 -1.04 118.70 123.89 1noi s GLU 177 Ca -0.08 -0.39 0.02 0.00 0.03 0.00 0.00 54.97 54.55 1noi s GLU 177 Cb -0.12 -3.20 -0.04 0.00 -0.80 0.00 0.00 34.13 29.97 1noi s GLU 177 CO 0.01 0.19 0.09 -1.21 -1.33 0.00 0.00 175.26 173.01 1noi s GLU 178 N 0.60 3.00 0.52 -4.83 2.02 0.02 -4.93 118.70 115.09 1noi s GLU 178 Ca 0.03 -0.60 -0.21 0.00 0.02 0.00 0.00 54.97 54.21 1noi s GLU 178 Cb -0.13 -2.80 -0.06 0.00 0.10 0.00 0.00 34.13 31.24 1noi s GLU 178 CO 0.01 0.59 1.16 0.00 0.02 0.00 0.00 175.26 177.05 1noi s ALA 179 N -1.34 2.78 -0.90 5.21 0.00 -1.26 -0.43 121.76 125.81 1noi s ALA 179 Ca 0.28 0.90 -0.12 0.00 0.00 0.00 0.00 51.96 53.02 1noi s ALA 179 Cb -0.12 -3.39 0.23 0.00 0.00 0.00 0.00 23.12 19.85 1noi s ALA 179 CO 0.20 -0.79 0.85 0.34 0.00 0.00 0.00 175.76 176.36 1noi s ASP 180 N -1.58 6.88 -0.97 0.00 2.15 -1.23 -4.58 116.67 117.34 1noi s ASP 180 Ca 0.70 -2.95 -0.13 0.00 0.43 0.00 0.00 52.55 50.60 1noi s ASP 180 Cb -0.27 -2.20 0.23 0.00 -0.30 0.00 0.00 42.92 40.38 1noi s ASP 180 CO 0.31 -0.49 0.98 1.51 -0.17 0.00 0.00 175.17 177.31 1noi s ASP 181 N 1.88 6.98 0.61 -0.34 -4.77 -1.26 -4.14 116.67 115.62 1noi s ASP 181 Ca 0.21 -2.98 0.36 0.00 -3.30 0.00 0.00 52.55 46.84 1noi s ASP 181 Cb -0.10 -2.24 1.98 0.00 -1.09 0.00 0.00 42.92 41.46 1noi s ASP 181 CO -0.09 -0.53 2.26 4.11 0.70 0.00 0.00 175.17 181.62 1noi h TRP 182 N 7.44 0.00 -0.21 2.11 5.08 -1.91 -1.84 115.95 126.61 1noi h TRP 182 Ca 0.16 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.13 1noi h TRP 182 Cb 0.97 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.13 1noi h TRP 182 CO 0.96 0.02 0.00 1.28 -1.28 0.00 0.00 178.44 179.42 1noi n LEU 183 N -3.46 1.90 -0.31 0.11 4.77 -1.26 -4.51 117.00 114.23 1noi n LEU 183 Ca -0.03 -0.81 0.00 0.00 -0.03 0.00 0.00 56.01 55.14 1noi n LEU 183 Cb 0.12 -0.14 0.07 0.00 -2.33 0.00 0.00 43.42 41.14 1noi n LEU 183 CO 0.25 0.41 0.64 -0.09 -1.33 0.00 0.00 177.39 177.27 1noi h ARG 184 N 2.46 -0.04 -0.45 3.23 2.43 -1.70 -1.25 114.38 119.06 1noi h ARG 184 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1noi h ARG 184 Cb 0.54 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 1noi h ARG 184 CO 0.00 -0.02 0.00 0.66 -1.51 0.00 0.00 179.97 179.10 1noi n TYR 185 N -5.51 0.60 -0.09 2.20 4.01 -1.26 -5.04 117.16 112.07 1noi n TYR 185 Ca 0.10 -0.30 0.00 0.00 -0.16 0.00 0.00 57.90 57.54 1noi n TYR 185 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.44 1noi n TYR 185 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1noi n GLY 186 N 1.46 -3.74 2.59 2.72 0.00 -0.47 -4.97 105.19 102.77 1noi n GLY 186 Ca 0.20 -1.99 -0.27 0.00 0.00 0.00 0.00 46.02 43.96 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 -0.79 2.82 0.00 1.61 2.47 -1.26 -4.71 114.94 115.07 1noi s ASN 187 Ca 0.00 -0.88 0.15 0.00 0.42 0.00 0.00 52.86 52.55 1noi s ASN 187 Cb 0.00 -0.30 0.76 0.00 -1.45 0.00 0.00 41.25 40.26 1noi s ASN 187 CO 0.00 -0.38 1.42 -0.81 -3.72 0.00 0.00 177.10 173.61 1noi n PRO 188 N 5.26 0.21 0.09 0.43 -0.04 -1.26 -3.38 135.00 136.30 1noi n PRO 188 Ca -0.07 0.15 0.12 0.00 -0.04 0.00 0.00 63.50 63.66 1noi n PRO 188 Cb 0.46 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.49 1noi n PRO 188 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1noi h TRP 189 N 0.00 0.00 -3.00 0.54 4.06 -1.95 -3.48 115.95 112.12 1noi h TRP 189 Ca 0.00 0.00 -0.64 0.00 2.06 0.00 0.00 58.89 60.31 1noi h TRP 189 Cb 0.15 0.00 -0.07 0.00 -1.00 0.00 0.00 29.16 28.24 1noi h TRP 189 CO 0.00 0.00 -0.54 -1.83 -3.56 0.00 0.00 178.44 172.51 1noi s GLU 190 N -3.28 3.20 -0.27 0.49 -1.05 -1.22 -4.20 118.70 112.37 1noi s GLU 190 Ca 0.02 -0.48 -0.00 0.00 -0.15 0.00 0.00 54.97 54.37 1noi s GLU 190 Cb 0.11 -2.93 0.05 0.00 -0.44 0.00 0.00 34.13 30.92 1noi s GLU 190 CO 0.76 0.63 -0.05 0.21 0.95 0.00 0.00 175.26 177.76 1noi s LYS 191 N -2.09 2.48 0.30 -4.83 2.36 0.17 -4.92 119.74 113.21 1noi s LYS 191 Ca 0.28 -1.21 -0.30 0.00 -2.55 0.00 0.00 55.97 52.19 1noi s LYS 191 Cb -0.12 -3.03 -0.11 0.00 -1.05 0.00 0.00 37.83 33.51 1noi s LYS 191 CO 0.20 -0.54 1.56 0.00 1.55 0.00 0.00 175.35 178.11 1noi s ALA 192 N 1.23 3.71 -0.66 3.13 0.00 -1.26 -1.62 121.76 126.29 1noi s ALA 192 Ca -0.05 1.54 0.06 0.00 0.00 0.00 0.00 51.96 53.51 1noi s ALA 192 Cb -0.19 -3.63 0.25 0.00 0.00 0.00 0.00 23.12 19.55 1noi s ALA 192 CO -0.03 -0.96 0.76 0.54 0.00 0.00 0.00 175.76 176.06 1noi n ARG 193 N 1.98 2.55 -0.29 0.00 5.12 0.31 -4.94 116.66 121.38 1noi n ARG 193 Ca 0.07 -4.66 0.10 0.00 -1.93 0.00 0.00 57.85 51.43 1noi n ARG 193 Cb 0.38 -2.27 0.26 0.00 -1.16 0.00 0.00 32.46 29.67 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 4.29 0.38 -0.43 5.56 0.11 -1.94 -0.44 132.00 139.52 1noi h PRO 194 Ca 0.20 -0.02 0.13 0.00 0.11 0.00 0.00 66.00 66.41 1noi h PRO 194 Cb 0.66 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.67 1noi h PRO 194 CO 0.85 0.25 0.55 0.93 -0.21 0.00 0.00 178.00 180.37 1noi h GLU 195 N 0.39 0.00 -0.38 1.05 3.07 -1.97 -2.55 114.58 114.19 1noi h GLU 195 Ca 0.51 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 59.34 1noi h GLU 195 Cb 0.92 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.81 1noi h GLU 195 CO -0.51 0.00 0.02 1.19 -1.40 0.00 0.00 179.01 178.32 1noi n PHE 196 N -3.50 1.34 -1.67 4.33 3.72 -0.17 -5.00 117.46 116.50 1noi n PHE 196 Ca 0.08 -0.93 -0.43 0.00 -0.05 0.00 0.00 57.45 56.12 1noi n PHE 196 Cb 0.73 -0.41 -0.01 0.00 -0.94 0.00 0.00 39.48 38.85 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 -0.29 1.79 -4.32 4.37 -1.04 -0.97 -4.69 114.28 109.14 1noi n THR 197 Ca 0.26 -0.45 -0.23 0.00 -2.04 0.00 0.00 64.05 61.59 1noi n THR 197 Cb 1.02 -1.45 -0.12 0.00 -1.82 0.00 0.00 70.33 67.96 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 -0.55 2.39 -0.13 -4.42 1.43 -0.12 -4.93 118.68 112.35 1noi s LEU 198 Ca 0.58 -0.80 -0.07 0.00 -1.03 0.00 0.00 54.13 52.82 1noi s LEU 198 Cb -0.61 -0.87 -0.04 0.00 0.03 0.00 0.00 46.19 44.70 1noi s LEU 198 CO 0.59 0.01 0.12 -2.16 0.23 0.00 0.00 176.35 175.14 1noi s PRO 199 N -2.46 3.56 -0.12 1.29 0.04 -1.26 -0.09 135.00 135.96 1noi s PRO 199 Ca 0.13 -0.18 -0.02 0.00 0.04 0.00 0.00 61.00 60.96 1noi s PRO 199 Cb -0.07 -3.20 -0.03 0.00 0.04 0.00 0.00 34.50 31.24 1noi s PRO 199 CO 0.06 0.66 -0.05 0.08 0.04 0.00 0.00 177.00 177.79 1noi s VAL 200 N -0.68 3.85 -0.02 -0.36 1.01 0.21 -4.92 120.40 119.48 1noi s VAL 200 Ca 0.13 -0.39 -0.03 0.00 0.00 0.00 0.00 61.98 61.69 1noi s VAL 200 Cb -0.12 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 1noi s VAL 200 CO 0.03 0.54 0.15 -1.00 0.00 0.00 0.00 175.10 174.82 1noi s HIS 201 N -0.18 3.49 0.13 5.22 3.76 -1.26 -1.46 115.29 124.99 1noi s HIS 201 Ca 0.03 0.35 0.04 0.00 -0.15 0.00 0.00 55.06 55.33 1noi s HIS 201 Cb -0.13 -1.82 -0.04 0.00 1.11 0.00 0.00 32.58 31.70 1noi s HIS 201 CO 0.02 0.64 -0.10 -0.06 -0.85 0.00 0.00 174.74 174.39 1noi s PHE 202 N -1.25 1.19 0.00 1.40 0.08 -0.27 -4.90 117.98 114.23 1noi s PHE 202 Ca 0.24 -0.75 0.00 0.00 0.12 0.00 0.00 56.93 56.54 1noi s PHE 202 Cb -0.12 -0.62 0.00 0.00 -0.57 0.00 0.00 43.02 41.70 1noi s PHE 202 CO 0.15 0.04 0.00 0.66 -0.10 0.00 0.00 175.22 175.98 1noi n TYR 203 N -0.03 0.00 -1.61 0.36 4.01 0.04 0.10 117.16 120.02 1noi n TYR 203 Ca -0.12 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.62 1noi n TYR 203 Cb 0.60 0.09 0.00 0.00 -0.31 0.00 0.00 39.34 39.72 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 -1.82 3.76 2.72 0.00 -1.23 -4.64 105.19 103.98 1noi n GLY 204 Ca 0.00 -1.79 -0.08 0.00 0.00 0.00 0.00 46.02 44.16 1noi n GLY 204 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1noi s ARG 205 N 0.00 1.71 -0.13 1.61 1.70 -0.92 -4.89 118.95 118.03 1noi s ARG 205 Ca 0.00 -1.09 -0.01 0.00 -0.47 0.00 0.00 55.73 54.16 1noi s ARG 205 Cb 0.00 0.56 -0.02 0.00 -0.57 0.00 0.00 34.95 34.92 1noi s ARG 205 CO 0.00 -0.76 -0.10 0.08 -1.08 0.00 0.00 175.30 173.44 1noi s VAL 206 N -3.93 3.32 -0.51 4.99 1.01 -1.26 -1.83 120.40 122.19 1noi s VAL 206 Ca 0.15 -0.57 -0.13 0.00 0.00 0.00 0.00 61.98 61.44 1noi s VAL 206 Cb -0.04 -2.41 0.13 0.00 0.00 0.00 0.00 36.38 34.06 1noi s VAL 206 CO 0.08 0.52 0.42 -0.70 0.00 0.00 0.00 175.10 175.43 1noi s GLU 207 N 0.24 2.74 -0.73 2.72 2.12 0.19 -4.88 118.70 121.09 1noi s GLU 207 Ca -0.07 -1.75 -0.23 0.00 0.36 0.00 0.00 54.97 53.28 1noi s GLU 207 Cb -0.15 -4.11 0.07 0.00 0.26 0.00 0.00 34.13 30.20 1noi s GLU 207 CO 0.04 -1.26 1.07 -1.01 -0.54 0.00 0.00 175.26 173.56 1noi s HIS 208 N 1.46 2.65 0.00 5.30 3.76 -1.26 -0.05 115.29 127.14 1noi s HIS 208 Ca 0.05 -0.58 0.00 0.00 -0.15 0.00 0.00 55.06 54.38 1noi s HIS 208 Cb -0.28 -4.38 0.00 0.00 1.11 0.00 0.00 32.58 29.03 1noi s HIS 208 CO 0.01 -1.73 0.00 0.25 -0.85 0.00 0.00 174.74 172.42 1noi n THR 209 N 6.01 0.00 0.05 1.30 -2.24 -0.07 -4.89 114.28 114.45 1noi n THR 209 Ca 0.03 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.79 1noi n THR 209 Cb 0.47 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.69 1noi n THR 209 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1noi h SER 210 N 0.00 -0.11 0.73 3.42 4.64 -1.98 -2.99 113.55 117.26 1noi h SER 210 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 1noi h SER 210 Cb 0.00 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 1noi h SER 210 CO 0.00 -0.07 -0.20 -0.61 -0.87 0.00 0.00 176.83 175.08 1noi h GLN 211 N -0.15 0.00 0.00 4.77 5.75 -1.99 -3.48 115.11 120.01 1noi h GLN 211 Ca -0.01 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 1noi h GLN 211 Cb 0.10 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.65 1noi h GLN 211 CO 0.02 0.20 0.00 0.41 -2.65 0.00 0.00 178.83 176.81 1noi n GLY 212 N -0.13 0.40 3.75 2.39 0.00 -1.13 -5.08 105.19 105.39 1noi n GLY 212 Ca -0.01 -1.39 -0.38 0.00 0.00 0.00 0.00 46.02 44.24 1noi n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1noi s ALA 213 N -1.00 2.74 -0.03 4.61 0.00 -1.25 -0.89 121.76 125.95 1noi s ALA 213 Ca 0.00 1.21 0.02 0.00 0.00 0.00 0.00 51.96 53.19 1noi s ALA 213 Cb 0.00 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.60 1noi s ALA 213 CO 0.00 -1.26 -0.09 0.15 0.00 0.00 0.00 175.76 174.56 1noi s LYS 214 N -3.00 0.95 -0.44 0.00 1.02 0.92 -4.86 119.74 114.33 1noi s LYS 214 Ca 0.73 -0.29 -0.15 0.00 0.02 0.00 0.00 55.97 56.28 1noi s LYS 214 Cb -0.37 -0.89 0.05 0.00 -0.52 0.00 0.00 37.83 36.11 1noi s LYS 214 CO 0.42 0.10 0.35 -0.46 -0.92 0.00 0.00 175.35 174.84 1noi s TRP 215 N 0.24 3.25 0.31 3.18 -0.00 -1.26 -0.64 118.94 124.01 1noi s TRP 215 Ca -0.04 -0.81 0.11 0.00 -0.00 0.00 0.00 56.10 55.36 1noi s TRP 215 Cb -0.09 -2.92 -0.06 0.00 -0.00 0.00 0.00 33.47 30.41 1noi s TRP 215 CO 0.00 -0.71 -0.15 0.14 -0.00 0.00 0.00 176.95 176.23 1noi s VAL 216 N 1.65 2.39 -1.43 5.86 -7.23 -0.76 -4.82 120.40 116.06 1noi s VAL 216 Ca 0.04 -2.32 -0.11 0.00 -1.81 0.00 0.00 61.98 57.79 1noi s VAL 216 Cb -0.22 -2.45 0.04 0.00 0.56 0.00 0.00 36.38 34.31 1noi s VAL 216 CO 0.08 -0.32 1.10 0.47 -0.31 0.00 0.00 175.10 176.12 1noi n ASP 217 N -0.70 -5.62 -4.87 4.85 8.00 -1.26 -2.17 116.55 114.79 1noi n ASP 217 Ca -0.05 -0.64 -0.31 0.00 0.71 0.00 0.00 54.79 54.50 1noi n ASP 217 Cb 0.61 -4.55 -0.01 0.00 -0.02 0.00 0.00 41.12 37.15 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 -3.32 4.69 0.36 -3.53 -4.23 -1.26 -3.50 115.64 104.85 1noi s THR 218 Ca 0.61 0.87 -0.16 0.00 -1.18 0.00 0.00 61.69 61.83 1noi s THR 218 Cb -0.28 -3.79 -0.09 0.00 1.34 0.00 0.00 72.50 69.67 1noi s THR 218 CO 0.77 -0.83 0.79 -1.58 -0.54 0.00 0.00 174.62 173.23 1noi s GLN 219 N -4.49 4.02 -0.06 3.99 0.74 0.11 -4.81 119.66 119.16 1noi s GLN 219 Ca 0.55 0.75 0.06 0.00 0.05 0.00 0.00 55.36 56.77 1noi s GLN 219 Cb -0.10 -2.36 -0.01 0.00 1.10 0.00 0.00 33.01 31.64 1noi s GLN 219 CO 0.41 0.08 -0.24 0.08 -0.55 0.00 0.00 175.29 175.07 1noi s VAL 220 N -2.09 1.99 0.04 1.34 1.01 -1.26 -1.11 120.40 120.31 1noi s VAL 220 Ca 0.56 -1.02 0.09 0.00 0.00 0.00 0.00 61.98 61.60 1noi s VAL 220 Cb -0.10 -1.69 -0.03 0.00 0.00 0.00 0.00 36.38 34.57 1noi s VAL 220 CO 0.18 0.55 -0.26 -0.69 0.00 0.00 0.00 175.10 174.89 1noi s VAL 221 N -0.09 2.09 0.09 2.92 1.01 -0.54 -4.55 120.40 121.33 1noi s VAL 221 Ca -0.05 -1.35 -0.07 0.00 0.00 0.00 0.00 61.98 60.51 1noi s VAL 221 Cb -0.14 -1.79 -0.05 0.00 0.00 0.00 0.00 36.38 34.40 1noi s VAL 221 CO 0.04 0.37 0.35 -0.76 0.00 0.00 0.00 175.10 175.10 1noi s LEU 222 N -1.19 4.32 -0.30 3.92 1.43 -0.86 -0.62 118.68 125.39 1noi s LEU 222 Ca 0.11 0.64 0.02 0.00 -1.03 0.00 0.00 54.13 53.87 1noi s LEU 222 Cb -0.10 -3.04 0.09 0.00 0.03 0.00 0.00 46.19 43.17 1noi s LEU 222 CO 0.02 0.14 0.02 0.00 0.23 0.00 0.00 176.35 176.77 1noi s ALA 223 N -1.48 2.28 -0.24 4.21 0.00 0.87 -0.71 121.76 126.68 1noi s ALA 223 Ca 0.35 -1.95 -0.14 0.00 0.00 0.00 0.00 51.96 50.22 1noi s ALA 223 Cb -0.13 -1.71 -0.04 0.00 0.00 0.00 0.00 23.12 21.24 1noi s ALA 223 CO 0.20 -1.52 0.32 1.41 0.00 0.00 0.00 175.76 176.18 1noi s MET 224 N 1.23 4.08 0.30 0.00 1.75 0.82 -0.94 119.30 126.54 1noi s MET 224 Ca 0.05 -0.00 -0.15 0.00 -1.25 0.00 0.00 55.69 54.33 1noi s MET 224 Cb -0.19 -3.59 -0.09 0.00 2.84 0.00 0.00 34.83 33.81 1noi s MET 224 CO -0.12 -0.11 0.72 -1.25 -0.65 0.00 0.00 175.02 173.61 1noi s PRO 225 N 1.56 4.02 -0.14 4.11 0.04 -1.26 -0.48 135.00 142.85 1noi s PRO 225 Ca 0.14 0.67 0.02 0.00 0.04 0.00 0.00 61.00 61.87 1noi s PRO 225 Cb -0.15 -2.52 0.01 0.00 0.04 0.00 0.00 34.50 31.88 1noi s PRO 225 CO 0.08 0.21 -0.22 0.71 0.04 0.00 0.00 177.00 177.82 1noi s TYR 226 N -1.90 2.68 -0.17 0.56 1.51 -0.19 -0.53 117.35 119.31 1noi s TYR 226 Ca 0.52 -1.36 -0.09 0.00 -1.01 0.00 0.00 57.07 55.13 1noi s TYR 226 Cb -0.11 -1.83 -0.05 0.00 -0.11 0.00 0.00 41.96 39.86 1noi s TYR 226 CO 0.18 -0.62 0.13 -0.51 -1.11 0.00 0.00 175.55 173.62 1noi s ASP 227 N 0.85 6.26 -0.09 2.29 1.01 -0.64 -1.13 116.67 125.23 1noi s ASP 227 Ca -0.06 0.31 0.04 0.00 0.71 0.00 0.00 52.55 53.55 1noi s ASP 227 Cb -0.15 -2.08 0.00 0.00 1.01 0.00 0.00 42.92 41.70 1noi s ASP 227 CO -0.03 0.26 -0.21 -0.89 0.21 0.00 0.00 175.17 174.50 1noi s THR 228 N -0.10 1.85 0.24 -1.27 2.01 -0.01 0.42 115.64 118.77 1noi s THR 228 Ca 0.10 -0.90 -0.30 0.00 0.31 0.00 0.00 61.69 60.90 1noi s THR 228 Cb -0.11 -1.60 -0.09 0.00 0.01 0.00 0.00 72.50 70.71 1noi s THR 228 CO 0.00 0.51 1.12 -2.84 -0.69 0.00 0.00 174.62 172.72 1noi s PRO 229 N 0.34 4.60 -0.23 4.92 0.02 -1.26 -0.64 135.00 142.75 1noi s PRO 229 Ca -0.16 1.80 0.00 0.00 0.02 0.00 0.00 61.00 62.66 1noi s PRO 229 Cb -0.17 -3.22 0.06 0.00 0.02 0.00 0.00 34.50 31.19 1noi s PRO 229 CO 0.07 0.12 -0.04 0.14 -0.33 0.00 0.00 177.00 176.97 1noi s VAL 230 N -0.75 1.35 0.19 3.83 -7.23 -0.45 -4.88 120.40 112.45 1noi s VAL 230 Ca 0.47 -1.10 -0.30 0.00 -1.81 0.00 0.00 61.98 59.24 1noi s VAL 230 Cb -0.32 -1.66 -0.08 0.00 0.56 0.00 0.00 36.38 34.89 1noi s VAL 230 CO 0.39 -0.12 0.96 -2.16 -0.31 0.00 0.00 175.10 173.86 1noi s PRO 231 N 1.48 4.77 0.51 4.82 0.04 -1.26 -0.58 135.00 144.77 1noi s PRO 231 Ca -0.05 1.50 -0.04 0.00 0.04 0.00 0.00 61.00 62.45 1noi s PRO 231 Cb -0.19 -3.32 -0.02 0.00 0.04 0.00 0.00 34.50 31.02 1noi s PRO 231 CO -0.06 0.36 0.79 0.20 0.04 0.00 0.00 177.00 178.33 1noi s GLY 232 N -0.63 1.54 -0.52 0.56 0.00 -0.08 -4.79 107.32 103.39 1noi s GLY 232 Ca 0.44 -0.68 -0.26 0.00 0.00 0.00 0.00 44.72 44.21 1noi s GLY 232 CO 0.32 -0.48 2.12 -0.47 0.00 0.00 0.00 173.10 174.58 1noi s TYR 233 N -2.77 1.38 -1.81 1.90 5.04 -1.26 -4.07 117.35 115.76 1noi s TYR 233 Ca 0.49 1.12 0.00 0.00 -2.44 0.00 0.00 57.07 56.24 1noi s TYR 233 Cb -0.10 -3.86 0.00 0.00 0.35 0.00 0.00 41.96 38.35 1noi s TYR 233 CO 0.43 -2.54 0.00 0.54 -1.34 0.00 0.00 175.55 172.65 1noi n ARG 234 N 9.04 -1.47 -0.09 4.97 3.00 0.15 -4.76 116.66 127.50 1noi n ARG 234 Ca 0.28 1.01 0.05 0.00 -0.01 0.00 0.00 57.85 59.18 1noi n ARG 234 Cb 0.53 -5.39 0.09 0.00 0.00 0.00 0.00 32.46 27.69 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 -1.16 2.37 -1.60 0.55 2.04 -1.26 -4.93 115.26 111.27 1noi n ASN 235 Ca -0.18 -1.76 -0.20 0.00 -0.44 0.00 0.00 54.58 51.99 1noi n ASN 235 Cb 0.59 -0.12 -0.08 0.00 -2.53 0.00 0.00 39.78 37.64 1noi n ASN 235 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1noi n ASN 236 N 0.39 -5.46 -4.84 0.53 3.02 -1.26 -0.66 115.26 106.99 1noi n ASN 236 Ca 0.08 0.47 -0.37 0.00 -0.03 0.00 0.00 54.58 54.72 1noi n ASN 236 Cb 0.33 -4.72 -0.06 0.00 -0.61 0.00 0.00 39.78 34.71 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 -2.77 5.28 -0.27 2.41 -7.23 -1.26 -4.80 120.40 111.75 1noi s VAL 237 Ca 0.00 0.51 -0.02 0.00 -1.81 0.00 0.00 61.98 60.66 1noi s VAL 237 Cb 0.00 -3.56 0.09 0.00 0.56 0.00 0.00 36.38 33.47 1noi s VAL 237 CO 0.00 0.57 0.08 -0.69 -0.31 0.00 0.00 175.10 174.76 1noi s VAL 238 N -0.86 0.63 0.00 1.32 1.01 -1.26 -0.91 120.40 120.33 1noi s VAL 238 Ca 0.19 -1.06 0.00 0.00 0.00 0.00 0.00 61.98 61.11 1noi s VAL 238 Cb -0.14 -1.38 0.00 0.00 0.00 0.00 0.00 36.38 34.86 1noi s VAL 238 CO 0.08 -0.55 0.00 0.59 0.00 0.00 0.00 175.10 175.22 1noi n ASN 239 N 4.97 0.00 -4.00 3.32 3.02 0.25 -4.64 115.26 118.18 1noi n ASN 239 Ca -0.05 -0.61 -0.16 0.00 -0.03 0.00 0.00 54.58 53.73 1noi n ASN 239 Cb 0.43 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.47 1noi n ASN 239 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1noi s THR 240 N -0.41 0.51 -0.29 3.41 2.01 -1.25 -1.35 115.64 118.27 1noi s THR 240 Ca 0.00 -0.48 -0.04 0.00 0.31 0.00 0.00 61.69 61.48 1noi s THR 240 Cb 0.00 -0.47 0.03 0.00 0.01 0.00 0.00 72.50 72.07 1noi s THR 240 CO 0.00 0.00 0.02 -0.32 -0.69 0.00 0.00 174.62 173.63 1noi s MET 241 N -0.53 2.68 -0.27 4.92 1.75 0.18 -1.88 119.30 126.15 1noi s MET 241 Ca -0.01 -1.11 -0.05 0.00 -1.25 0.00 0.00 55.69 53.27 1noi s MET 241 Cb -0.04 -3.22 0.01 0.00 2.84 0.00 0.00 34.83 34.41 1noi s MET 241 CO -0.00 -0.55 0.03 0.50 -0.65 0.00 0.00 175.02 174.35 1noi s ARG 242 N 1.34 3.04 -0.20 4.11 6.06 -0.40 -0.83 118.95 132.07 1noi s ARG 242 Ca -0.02 -0.87 -0.04 0.00 -2.50 0.00 0.00 55.73 52.30 1noi s ARG 242 Cb -0.18 -3.23 -0.02 0.00 0.06 0.00 0.00 34.95 31.58 1noi s ARG 242 CO -0.00 -0.41 -0.03 -0.51 -2.50 0.00 0.00 175.30 171.84 1noi s LEU 243 N 1.45 3.05 0.12 -0.88 1.02 -0.29 -2.51 118.68 120.64 1noi s LEU 243 Ca 0.02 -0.29 -0.26 0.00 0.02 0.00 0.00 54.13 53.62 1noi s LEU 243 Cb -0.17 -1.77 -0.07 0.00 0.02 0.00 0.00 46.19 44.21 1noi s LEU 243 CO -0.00 0.04 0.81 0.26 0.02 0.00 0.00 176.35 177.48 1noi s TRP 244 N 1.11 3.84 -0.11 0.29 0.52 -0.87 -1.02 118.94 122.70 1noi s TRP 244 Ca 0.02 1.62 0.02 0.00 0.02 0.00 0.00 56.10 57.78 1noi s TRP 244 Cb -0.15 -2.84 -0.00 0.00 -1.15 0.00 0.00 33.47 29.33 1noi s TRP 244 CO 0.00 0.39 -0.20 0.45 0.02 0.00 0.00 176.95 177.61 1noi s SER 245 N -0.63 3.43 -0.01 2.95 0.15 0.37 -1.52 113.70 118.43 1noi s SER 245 Ca 0.38 -0.48 -0.30 0.00 0.70 0.00 0.00 55.95 56.26 1noi s SER 245 Cb -0.22 -1.49 -0.03 0.00 -1.71 0.00 0.00 66.02 62.57 1noi s SER 245 CO 0.26 0.16 0.99 0.00 1.20 0.00 0.00 173.24 175.85 1noi s ALA 246 N 0.38 3.20 -0.02 5.45 0.00 -1.26 -0.12 121.76 129.38 1noi s ALA 246 Ca -0.15 0.54 0.08 0.00 0.00 0.00 0.00 51.96 52.42 1noi s ALA 246 Cb -0.17 -3.36 -0.02 0.00 0.00 0.00 0.00 23.12 19.57 1noi s ALA 246 CO 0.07 -0.28 -0.25 0.15 0.00 0.00 0.00 175.76 175.45 1noi s LYS 247 N 1.13 2.07 0.00 0.00 -0.14 0.11 -4.59 119.74 118.32 1noi s LYS 247 Ca 0.52 -0.90 -0.23 0.00 -1.36 0.00 0.00 55.97 54.00 1noi s LYS 247 Cb -0.21 -1.98 -0.05 0.00 -1.68 0.00 0.00 37.83 33.91 1noi s LYS 247 CO 0.27 0.53 0.69 0.00 -0.76 0.00 0.00 175.35 176.07 1noi s ALA 248 N -0.55 3.41 -0.26 5.17 0.00 -1.26 -2.02 121.76 126.23 1noi s ALA 248 Ca 0.09 0.16 -0.28 0.00 0.00 0.00 0.00 51.96 51.93 1noi s ALA 248 Cb -0.10 -2.89 -0.05 0.00 0.00 0.00 0.00 23.12 20.08 1noi s ALA 248 CO -0.01 0.07 2.24 -2.14 0.00 0.00 0.00 175.76 175.92 1noi s PRO 249 N 0.06 2.97 -0.12 0.00 0.02 -1.26 -4.91 135.00 131.76 1noi s PRO 249 Ca 0.35 1.92 -0.29 0.00 0.02 0.00 0.00 61.00 63.00 1noi s PRO 249 Cb -0.19 -4.40 -0.01 0.00 0.02 0.00 0.00 34.50 29.91 1noi s PRO 249 CO 0.20 -2.29 1.09 1.21 -0.33 0.00 0.00 177.00 176.88 1noi s ASN 250 N 8.87 7.13 -0.36 2.53 3.84 -1.26 -4.59 114.94 131.11 1noi s ASN 250 Ca 1.00 1.59 0.05 0.00 0.21 0.00 0.00 52.86 55.70 1noi s ASN 250 Cb -0.30 -2.55 0.30 0.00 -0.55 0.00 0.00 41.25 38.15 1noi s ASN 250 CO 0.34 -0.56 1.30 -0.67 -2.79 0.00 0.00 177.10 174.72 1noi n ASP 251 N 5.49 -1.49 -4.26 -4.21 -0.08 -1.26 -5.02 116.55 105.73 1noi n ASP 251 Ca 0.10 -2.27 -0.44 0.00 -1.51 0.00 0.00 54.79 50.68 1noi n ASP 251 Cb 0.47 1.31 -0.05 0.00 2.34 0.00 0.00 41.12 45.19 1noi n ASP 251 CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 1noi s PHE 252 N 0.10 3.61 0.00 -0.67 0.08 -1.26 -4.18 117.98 115.66 1noi s PHE 252 Ca 0.19 -2.15 0.00 0.00 0.12 0.00 0.00 56.93 55.09 1noi s PHE 252 Cb 0.28 -3.62 0.00 0.00 -0.57 0.00 0.00 43.02 39.10 1noi s PHE 252 CO -0.14 -0.95 0.00 0.27 -0.10 0.00 0.00 175.22 174.30 1noi n ASN 253 N 3.96 0.00 0.00 1.36 0.23 -1.26 -5.05 115.26 114.51 1noi n ASN 253 Ca 0.09 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.14 1noi n ASN 253 Cb 0.44 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.14 1noi n ASN 253 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1noi n LEU 254 N 0.00 0.00 -4.64 -4.53 4.77 -1.26 -4.27 117.00 107.07 1noi n LEU 254 Ca 0.00 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.55 1noi n LEU 254 Cb 0.00 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 1noi n LEU 254 CO 0.00 0.00 1.03 -0.54 -1.33 0.00 0.00 177.39 176.55 1noi s LYS 255 N -1.51 4.04 0.00 3.23 -0.14 -1.26 -0.44 119.74 123.67 1noi s LYS 255 Ca 0.00 1.21 0.00 0.00 -1.36 0.00 0.00 55.97 55.82 1noi s LYS 255 Cb 0.00 -3.78 0.00 0.00 -1.68 0.00 0.00 37.83 32.37 1noi s LYS 255 CO 0.00 -0.94 0.00 -3.47 -0.76 0.00 0.00 175.35 170.18 1noi n ASP 256 N 7.07 0.00 -3.67 2.83 2.03 -1.26 -4.66 116.55 118.89 1noi n ASP 256 Ca 0.13 0.00 -0.25 0.00 0.52 0.00 0.00 54.79 55.19 1noi n ASP 256 Cb 0.47 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.82 1noi n ASP 256 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1noi n PHE 257 N -1.75 -1.53 0.06 -0.67 3.72 0.42 -4.77 117.46 112.95 1noi n PHE 257 Ca 0.00 0.40 -0.13 0.00 -0.05 0.00 0.00 57.45 57.67 1noi n PHE 257 Cb 0.00 -1.56 -0.09 0.00 -0.94 0.00 0.00 39.48 36.90 1noi n PHE 257 CO 0.00 0.00 0.00 -2.95 -0.05 0.00 0.00 176.76 173.76 1noi h ASN 258 N -0.52 -0.15 -2.72 4.37 7.08 -1.83 -3.44 115.58 118.37 1noi h ASN 258 Ca -0.35 -0.29 0.00 0.00 -3.08 0.00 0.00 56.30 52.58 1noi h ASN 258 Cb 1.23 0.04 0.00 0.00 -2.08 0.00 0.00 38.32 37.51 1noi h ASN 258 CO 0.52 0.23 0.00 1.33 -2.08 0.00 0.00 177.43 177.43 1noi n VAL 259 N -5.00 0.00 -0.92 6.14 0.24 -1.26 -4.84 118.33 112.69 1noi n VAL 259 Ca -0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.21 1noi n VAL 259 Cb 0.23 -0.77 0.00 0.00 -1.47 0.00 0.00 33.84 31.83 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 5.00 1.08 0.00 7.63 0.00 -1.26 -4.78 105.19 112.86 1noi n GLY 260 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.38 0.37 3.07 -0.02 0.00 -1.26 -5.15 105.19 101.82 1noi n GLY 261 Ca 0.00 -0.03 -0.13 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.26 -0.08 1.61 5.04 -1.26 -5.16 117.35 117.25 1noi s TYR 262 Ca 0.00 0.63 0.02 0.00 -2.44 0.00 0.00 57.07 55.27 1noi s TYR 262 Cb 0.00 0.06 -0.02 0.00 0.35 0.00 0.00 41.96 42.34 1noi s TYR 262 CO 0.00 -0.15 -0.11 0.96 -1.34 0.00 0.00 175.55 174.91 1noi s ILE 263 N 0.53 3.30 0.00 3.14 -4.36 -1.26 -4.56 121.20 117.98 1noi s ILE 263 Ca -0.03 -0.62 0.00 0.00 -0.26 0.00 0.00 60.65 59.74 1noi s ILE 263 Cb -0.05 -2.34 0.00 0.00 1.25 0.00 0.00 42.46 41.33 1noi s ILE 263 CO -0.03 0.57 0.00 0.00 0.24 0.00 0.00 174.94 175.73 1noi n GLN 264 N 2.61 0.00 0.32 0.37 10.64 -1.26 -4.86 117.38 125.21 1noi n GLN 264 Ca -0.18 0.00 0.21 0.00 -1.83 0.00 0.00 57.00 55.20 1noi n GLN 264 Cb 0.53 0.00 1.10 0.00 -0.86 0.00 0.00 30.24 31.01 1noi n GLN 264 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1noi h ALA 265 N 0.00 1.06 -0.92 2.61 0.00 -2.01 -0.59 119.26 119.41 1noi h ALA 265 Ca 0.00 0.00 0.22 0.00 0.00 0.00 0.00 54.91 55.13 1noi h ALA 265 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 17.67 1noi h ALA 265 CO 0.00 -0.06 0.45 0.28 0.00 0.00 0.00 179.25 179.92 1noi h VAL 266 N 0.00 0.51 -0.16 0.00 2.07 -1.97 -1.45 116.25 115.24 1noi h VAL 266 Ca 0.00 -0.16 -0.16 0.00 0.82 0.00 0.00 66.70 67.20 1noi h VAL 266 Cb 0.12 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 29.89 1noi h VAL 266 CO 0.00 0.08 -0.56 -0.07 0.02 0.00 0.00 177.57 177.05 1noi h LEU 267 N 0.46 0.56 -0.65 2.57 3.38 -1.50 -2.26 115.31 117.87 1noi h LEU 267 Ca 0.58 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 58.21 1noi h LEU 267 Cb 1.08 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.64 1noi h LEU 267 CO -0.50 1.00 0.26 -0.78 0.09 0.00 0.00 178.44 178.51 1noi h ASP 268 N 0.38 0.89 0.50 -0.43 1.82 -1.42 -1.47 116.42 116.68 1noi h ASP 268 Ca 0.01 -0.17 -0.02 0.00 -0.39 0.00 0.00 57.03 56.45 1noi h ASP 268 Cb 1.09 -0.23 0.00 0.00 0.68 0.00 0.00 39.33 40.88 1noi h ASP 268 CO 0.10 0.81 -0.24 0.03 -1.61 0.00 0.00 179.24 178.33 1noi h ARG 269 N 0.91 -0.65 -0.77 0.28 3.08 -1.34 -0.01 114.38 115.88 1noi h ARG 269 Ca 0.22 0.04 0.11 0.00 0.07 0.00 0.00 59.98 60.42 1noi h ARG 269 Cb 0.20 0.15 -0.08 0.00 0.08 0.00 0.00 29.97 30.32 1noi h ARG 269 CO -0.02 -0.38 0.40 -0.97 -1.07 0.00 0.00 179.97 177.94 1noi h ASN 270 N -0.80 0.52 0.11 7.04 -0.73 -1.37 -2.19 115.58 118.17 1noi h ASN 270 Ca -0.07 0.07 -0.28 0.00 1.87 0.00 0.00 56.30 57.89 1noi h ASN 270 Cb 0.57 -0.02 0.02 0.00 0.27 0.00 0.00 38.32 39.16 1noi h ASN 270 CO 0.11 0.28 -1.14 -0.07 -0.37 0.00 0.00 177.43 176.24 1noi h LEU 271 N 0.65 0.85 0.17 0.34 3.38 -1.23 -1.53 115.31 117.95 1noi h LEU 271 Ca 0.39 -0.73 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 1noi h LEU 271 Cb 0.44 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1noi h LEU 271 CO -0.29 1.54 -0.26 0.00 0.09 0.00 0.00 178.44 179.52 1noi h ALA 272 N 0.39 -0.88 -0.74 1.53 0.00 -0.97 -3.13 119.26 115.46 1noi h ALA 272 Ca -0.15 -0.08 0.10 0.00 0.00 0.00 0.00 54.91 54.77 1noi h ALA 272 Cb 1.80 0.57 -0.05 0.00 0.00 0.00 0.00 17.79 20.11 1noi h ALA 272 CO 0.22 -0.92 0.48 0.93 0.00 0.00 0.00 179.25 179.96 1noi h GLU 273 N -0.45 0.61 -0.37 0.00 5.08 -1.44 -1.54 114.58 116.46 1noi h GLU 273 Ca -0.02 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1noi h GLU 273 Cb 0.41 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1noi h GLU 273 CO -0.08 0.41 0.00 0.27 -1.00 0.00 0.00 179.01 178.61 1noi n ASN 274 N -4.49 0.73 -0.15 1.42 2.04 -0.58 -2.60 115.26 111.63 1noi n ASN 274 Ca 0.12 -2.03 -0.02 0.00 -0.44 0.00 0.00 54.58 52.21 1noi n ASN 274 Cb 0.34 -0.21 0.20 0.00 -2.53 0.00 0.00 39.78 37.59 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 0.38 1.22 -0.04 1.53 2.04 -1.33 -2.80 117.51 118.51 1noi h ILE 275 Ca 0.00 -0.69 0.00 0.00 1.00 0.00 0.00 64.86 65.17 1noi h ILE 275 Cb 0.28 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 36.87 1noi h ILE 275 CO 0.02 0.27 0.00 -1.20 0.00 0.00 0.00 178.15 177.24 1noi n SER 276 N -4.31 1.21 -0.04 1.72 7.64 -1.07 -4.70 113.62 114.08 1noi n SER 276 Ca 0.05 -1.45 -0.22 0.00 1.01 0.00 0.00 58.87 58.27 1noi n SER 276 Cb 0.17 -0.02 -0.13 0.00 -1.01 0.00 0.00 64.21 63.23 1noi n SER 276 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 1noi h ARG 277 N 1.84 0.15 -4.07 1.43 3.08 -1.65 -1.26 114.38 113.90 1noi h ARG 277 Ca 0.00 -0.26 -0.11 0.00 0.07 0.00 0.00 59.98 59.68 1noi h ARG 277 Cb 0.39 0.10 -0.15 0.00 0.08 0.00 0.00 29.97 30.39 1noi h ARG 277 CO 0.00 1.12 -0.58 0.54 -1.07 0.00 0.00 179.97 179.99 1noi s VAL 278 N -2.46 0.19 0.81 2.04 0.11 -1.26 -1.55 120.40 118.27 1noi s VAL 278 Ca -0.24 -1.54 -0.11 0.00 -2.93 0.00 0.00 61.98 57.16 1noi s VAL 278 Cb 0.06 -1.38 0.07 0.00 -1.53 0.00 0.00 36.38 33.60 1noi s VAL 278 CO 0.70 -0.85 1.09 -0.22 -3.33 0.00 0.00 175.10 172.49 1noi s LEU 279 N -2.79 2.59 0.16 2.54 0.20 0.89 -5.00 118.68 117.27 1noi s LEU 279 Ca 0.05 1.36 -0.10 0.00 0.69 0.00 0.00 54.13 56.12 1noi s LEU 279 Cb 0.06 -3.96 -0.00 0.00 -0.43 0.00 0.00 46.19 41.86 1noi s LEU 279 CO -0.10 -2.04 0.30 -0.31 -0.29 0.00 0.00 176.35 173.92 1noi s TYR 280 N -3.12 0.31 -0.18 5.38 2.02 -1.26 -4.92 117.35 115.59 1noi s TYR 280 Ca 0.61 -0.68 0.19 0.00 -0.37 0.00 0.00 57.07 56.82 1noi s TYR 280 Cb -0.15 -0.00 0.46 0.00 -0.40 0.00 0.00 41.96 41.87 1noi s TYR 280 CO 0.55 -0.73 1.16 -0.35 -1.57 0.00 0.00 175.55 174.61 1noi n PRO 281 N -0.22 1.54 0.00 -1.71 -0.04 -1.26 -5.16 135.00 128.16 1noi n PRO 281 Ca -0.08 -3.14 0.00 0.00 -0.04 0.00 0.00 63.50 60.23 1noi n PRO 281 Cb 0.63 -1.25 0.00 0.00 -0.04 0.00 0.00 33.50 32.84 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 -0.38 0.00 -3.55 0.54 -0.00 -1.26 -5.15 120.64 110.84 1noi n GLU 287 Ca 0.16 0.00 -0.26 0.00 -0.00 0.00 0.00 57.16 57.06 1noi n GLU 287 Cb 0.92 0.00 -0.15 0.00 -0.00 0.00 0.00 31.44 32.21 1noi n GLU 287 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 1noi s GLY 288 N 0.00 0.36 0.20 -1.84 0.00 -1.26 -5.02 107.32 99.76 1noi s GLY 288 Ca 0.00 -0.64 -0.10 0.00 0.00 0.00 0.00 44.72 43.98 1noi s GLY 288 CO 0.00 1.99 0.36 -1.59 0.00 0.00 0.00 173.10 173.86 1noi s LYS 289 N 2.15 1.32 0.24 2.90 0.00 -1.26 -5.05 119.74 120.03 1noi s LYS 289 Ca 0.06 -1.22 -0.06 0.00 0.00 0.00 0.00 55.97 54.76 1noi s LYS 289 Cb -0.16 0.41 0.32 0.00 0.00 0.00 0.00 37.83 38.40 1noi s LYS 289 CO -0.25 -0.51 1.85 1.49 0.00 0.00 0.00 175.35 177.93 1noi h GLU 290 N 2.42 0.90 -0.24 1.78 4.81 -2.00 -1.74 114.58 120.51 1noi h GLU 290 Ca -0.30 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 58.85 1noi h GLU 290 Cb 1.24 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 1noi h GLU 290 CO 0.43 0.60 0.05 1.25 -0.73 0.00 0.00 179.01 180.61 1noi h LEU 291 N 0.93 0.31 -0.16 1.64 6.46 -1.99 -1.66 115.31 120.85 1noi h LEU 291 Ca 0.36 -0.03 -0.02 0.00 -0.12 0.00 0.00 57.88 58.07 1noi h LEU 291 Cb 0.17 -0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.01 1noi h LEU 291 CO -0.17 0.33 0.01 0.03 -0.62 0.00 0.00 178.44 178.03 1noi h ARG 292 N 0.35 0.27 -0.39 1.25 3.08 -1.72 -1.91 114.38 115.30 1noi h ARG 292 Ca 0.08 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 1noi h ARG 292 Cb 0.15 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 1noi h ARG 292 CO -0.00 0.47 0.07 1.25 -1.07 0.00 0.00 179.97 180.69 1noi h LEU 293 N 0.03 0.54 -0.82 3.04 5.85 -1.22 -0.54 115.31 122.20 1noi h LEU 293 Ca 0.05 -0.09 -0.10 0.00 0.84 0.00 0.00 57.88 58.58 1noi h LEU 293 Cb 0.34 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1noi h LEU 293 CO 0.01 0.56 -0.24 0.11 -0.34 0.00 0.00 178.44 178.54 1noi h LYS 294 N 0.57 0.61 -0.17 1.25 1.57 -1.05 0.93 116.57 120.28 1noi h LYS 294 Ca 0.13 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 1noi h LYS 294 Cb 0.26 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 1noi h LYS 294 CO 0.00 0.80 0.09 1.96 -0.57 0.00 0.00 179.45 181.73 1noi h GLN 295 N 0.54 0.25 0.78 3.15 4.20 -0.58 0.10 115.11 123.55 1noi h GLN 295 Ca 0.08 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.72 1noi h GLN 295 Cb 0.70 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.44 1noi h GLN 295 CO 0.05 0.28 -0.39 0.93 -0.67 0.00 0.00 178.83 179.02 1noi h GLU 296 N 0.16 -1.03 -0.66 1.46 5.08 -1.01 -1.42 114.58 117.15 1noi h GLU 296 Ca 0.06 0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.45 1noi h GLU 296 Cb 0.11 0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 1noi h GLU 296 CO -0.01 -0.69 0.25 -0.92 -1.00 0.00 0.00 179.01 176.64 1noi h TYR 297 N -1.07 0.99 -0.17 4.33 3.20 -0.82 -2.66 116.97 120.76 1noi h TYR 297 Ca -0.10 -0.07 0.05 0.00 3.14 0.00 0.00 58.73 61.74 1noi h TYR 297 Cb 0.83 -0.30 -0.05 0.00 1.54 0.00 0.00 36.73 38.76 1noi h TYR 297 CO -0.04 0.76 -0.13 0.35 -1.64 0.00 0.00 178.16 177.47 1noi h PHE 298 N 0.95 -0.32 -0.48 -3.82 3.57 -0.82 -0.62 116.94 115.40 1noi h PHE 298 Ca 0.22 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.65 1noi h PHE 298 Cb 0.21 0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.10 1noi h PHE 298 CO 0.02 -0.19 -0.10 -0.24 -2.23 0.00 0.00 178.31 175.57 1noi h VAL 299 N -0.13 1.26 -0.27 1.41 3.04 -1.18 -2.76 116.25 117.63 1noi h VAL 299 Ca 0.11 -1.19 -0.02 0.00 -1.01 0.00 0.00 66.70 64.58 1noi h VAL 299 Cb 0.29 0.99 -0.01 0.00 -2.01 0.00 0.00 31.29 30.55 1noi h VAL 299 CO -0.25 0.41 0.07 0.58 -1.01 0.00 0.00 177.57 177.37 1noi h VAL 300 N 0.79 1.21 -0.16 1.51 2.07 -1.07 -2.24 116.25 118.35 1noi h VAL 300 Ca 0.13 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 1noi h VAL 300 Cb 0.61 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 1noi h VAL 300 CO 0.04 0.22 0.03 0.00 0.02 0.00 0.00 177.57 177.88 1noi h ALA 301 N 0.90 0.21 -0.25 1.67 0.00 -1.12 -0.94 119.26 119.74 1noi h ALA 301 Ca 0.08 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1noi h ALA 301 Cb 0.26 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1noi h ALA 301 CO -0.00 -0.13 -0.08 0.00 0.00 0.00 0.00 179.25 179.04 1noi h ALA 302 N 0.82 0.35 -0.30 0.00 0.00 -1.56 -2.27 119.26 116.29 1noi h ALA 302 Ca 0.05 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1noi h ALA 302 Cb 0.29 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1noi h ALA 302 CO 0.00 0.17 0.17 1.15 0.00 0.00 0.00 179.25 180.74 1noi h THR 303 N 0.23 1.12 0.00 0.00 2.02 -1.41 -2.56 112.91 112.32 1noi h THR 303 Ca 0.06 -0.31 -0.05 0.00 0.77 0.00 0.00 66.41 66.88 1noi h THR 303 Cb 0.56 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 1noi h THR 303 CO 0.03 0.12 -0.24 -0.07 0.37 0.00 0.00 175.52 175.73 1noi h LEU 304 N 0.37 0.00 -0.37 2.58 4.07 -1.16 -0.88 115.31 119.92 1noi h LEU 304 Ca 0.11 0.00 -0.11 0.00 0.08 0.00 0.00 57.88 57.95 1noi h LEU 304 Cb 0.05 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.78 1noi h LEU 304 CO -0.02 0.24 -0.21 1.56 -1.08 0.00 0.00 178.44 178.93 1noi h GLN 305 N 0.00 0.79 -0.16 1.13 4.20 -1.01 -2.59 115.11 117.47 1noi h GLN 305 Ca -0.00 -0.36 -0.01 0.00 0.06 0.00 0.00 58.65 58.34 1noi h GLN 305 Cb 0.58 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 1noi h GLN 305 CO 0.03 0.98 0.05 0.22 -0.67 0.00 0.00 178.83 179.45 1noi h ASP 306 N 0.58 0.23 -0.26 1.46 3.58 -1.06 -0.62 116.42 120.34 1noi h ASP 306 Ca 0.08 -0.19 0.06 0.00 0.42 0.00 0.00 57.03 57.39 1noi h ASP 306 Cb 0.76 -0.06 -0.06 0.00 1.72 0.00 0.00 39.33 41.69 1noi h ASP 306 CO 0.06 0.36 -0.11 0.40 -2.88 0.00 0.00 179.24 177.08 1noi h ILE 307 N 0.09 0.65 -0.18 2.25 2.04 -1.18 0.13 117.51 121.31 1noi h ILE 307 Ca 0.05 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.90 1noi h ILE 307 Cb 0.21 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.93 1noi h ILE 307 CO -0.00 0.00 0.06 0.40 0.00 0.00 0.00 178.15 178.61 1noi h ILE 308 N -0.06 1.18 -0.18 -0.67 2.04 -1.33 -0.06 117.51 118.43 1noi h ILE 308 Ca 0.13 -0.56 0.04 0.00 1.00 0.00 0.00 64.86 65.47 1noi h ILE 308 Cb 0.26 1.21 -0.07 0.00 -0.74 0.00 0.00 36.82 37.49 1noi h ILE 308 CO -0.30 0.17 -0.51 -0.09 0.00 0.00 0.00 178.15 177.42 1noi h ARG 309 N 0.12 -0.51 0.00 2.37 2.43 -0.71 0.11 114.38 118.19 1noi h ARG 309 Ca 0.06 0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 1noi h ARG 309 Cb 0.22 0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.88 1noi h ARG 309 CO -0.00 -0.34 -0.17 -0.09 -1.51 0.00 0.00 179.97 177.86 1noi h ARG 310 N -0.53 0.00 -0.27 0.20 2.43 -0.63 0.24 114.38 115.81 1noi h ARG 310 Ca 0.05 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.08 1noi h ARG 310 Cb 0.66 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.20 1noi h ARG 310 CO -0.46 0.17 -0.41 0.35 -1.51 0.00 0.00 179.97 178.11 1noi h PHE 311 N 0.00 0.79 0.04 2.20 3.57 0.58 -1.31 116.94 122.81 1noi h PHE 311 Ca -0.00 -0.23 -0.00 0.00 3.53 0.00 0.00 57.97 61.26 1noi h PHE 311 Cb 0.31 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 38.89 1noi h PHE 311 CO 0.00 0.96 -0.02 0.87 -2.23 0.00 0.00 178.31 177.89 1noi h LYS 312 N 0.54 -0.05 0.86 1.11 1.57 0.41 -3.32 116.57 117.69 1noi h LYS 312 Ca 0.04 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 1noi h LYS 312 Cb 0.93 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.26 1noi h LYS 312 CO 0.08 -0.01 -0.47 0.77 -0.57 0.00 0.00 179.45 179.25 1noi h SER 313 N -1.01 -1.15 -2.09 0.86 0.02 -0.70 0.67 113.55 110.16 1noi h SER 313 Ca -0.01 0.05 -0.51 0.00 -0.84 0.00 0.00 61.79 60.49 1noi h SER 313 Cb 0.06 0.32 -0.03 0.00 0.14 0.00 0.00 62.40 62.89 1noi h SER 313 CO 0.01 -0.75 1.35 -0.44 -1.14 0.00 0.00 176.83 175.85 1noi s SER 314 N -3.96 5.34 0.00 3.07 0.01 -0.49 -4.30 113.70 113.37 1noi s SER 314 Ca -0.18 0.51 0.00 0.00 1.31 0.00 0.00 55.95 57.58 1noi s SER 314 Cb 0.02 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.73 1noi s SER 314 CO 0.57 -2.29 0.00 1.17 0.41 0.00 0.00 173.24 173.10 1noi n LYS 315 N 9.05 0.00 0.00 12.44 3.00 -1.26 -4.67 118.16 136.73 1noi n LYS 315 Ca 0.21 0.00 0.05 0.00 -0.00 0.00 0.00 58.31 58.57 1noi n LYS 315 Cb 0.51 0.00 0.28 0.00 0.00 0.00 0.00 35.03 35.83 1noi n LYS 315 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1noi n PHE 316 N 0.00 0.00 1.18 5.64 3.01 -0.55 -2.72 117.46 124.02 1noi n PHE 316 Ca 0.00 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.58 1noi n PHE 316 Cb 0.00 0.00 0.24 0.00 -0.01 0.00 0.00 39.48 39.71 1noi n PHE 316 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1noi n GLY 317 N -0.14 0.22 0.41 1.37 0.00 0.22 -4.45 105.19 102.83 1noi n GLY 317 Ca 0.07 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1noi n GLY 317 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1noi s ARG 319 N -0.34 4.43 0.00 0.00 3.00 -1.25 -4.93 118.95 119.85 1noi s ARG 319 Ca 0.00 1.90 0.02 0.00 -1.00 0.00 0.00 55.73 56.64 1noi s ARG 319 Cb 0.00 -3.27 0.03 0.00 0.00 0.00 0.00 34.95 31.70 1noi s ARG 319 CO 0.00 -0.23 0.73 -0.40 0.00 0.00 0.00 175.30 175.40 1noi n ASP 320 N 3.26 -0.15 0.00 -2.12 5.68 -1.26 -4.10 116.55 117.85 1noi n ASP 320 Ca 0.07 -1.43 0.00 0.00 -0.50 0.00 0.00 54.79 52.93 1noi n ASP 320 Cb 0.45 0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.44 1noi n ASP 320 CO 0.00 0.00 0.00 -2.65 -1.33 0.00 0.00 177.20 173.22 1noi n PRO 321 N 0.03 0.00 -3.66 0.11 -0.02 -1.26 -1.96 135.00 128.23 1noi n PRO 321 Ca -0.05 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.33 1noi n PRO 321 Cb 0.61 0.00 -0.11 0.00 -0.02 0.00 0.00 33.50 33.99 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 -0.53 0.00 -1.45 0.11 -1.26 -4.96 120.40 112.31 1noi s VAL 322 Ca 0.00 0.19 0.00 0.00 -2.93 0.00 0.00 61.98 59.24 1noi s VAL 322 Cb 0.00 -0.60 0.00 0.00 -1.53 0.00 0.00 36.38 34.25 1noi s VAL 322 CO 0.00 0.08 0.00 -2.11 -3.33 0.00 0.00 175.10 169.74 1noi n ARG 323 N 5.28 -0.51 -1.03 1.54 1.85 -1.26 -1.87 116.66 120.66 1noi n ARG 323 Ca -0.09 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.76 1noi n ARG 323 Cb 0.50 -0.16 0.00 0.00 -1.05 0.00 0.00 32.46 31.75 1noi n ARG 323 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1noi n THR 324 N -0.06 -1.82 -3.85 8.89 -1.04 -1.25 -5.02 114.28 110.13 1noi n THR 324 Ca 0.00 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.65 1noi n THR 324 Cb 0.01 -2.53 -0.12 0.00 -1.82 0.00 0.00 70.33 65.87 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 0.00 5.26 0.10 8.00 3.04 -0.78 -4.88 114.94 125.69 1noi s ASN 325 Ca 0.00 -0.13 0.10 0.00 0.04 0.00 0.00 52.86 52.87 1noi s ASN 325 Cb 0.00 -1.93 0.49 0.00 -1.54 0.00 0.00 41.25 38.26 1noi s ASN 325 CO 0.00 0.02 1.31 0.49 -3.04 0.00 0.00 177.10 175.88 1noi n PHE 326 N 4.55 0.26 -0.25 0.43 3.72 -1.26 -1.89 117.46 123.01 1noi n PHE 326 Ca -0.16 0.12 -0.01 0.00 -0.05 0.00 0.00 57.45 57.35 1noi n PHE 326 Cb 0.52 -0.70 0.11 0.00 -0.94 0.00 0.00 39.48 38.47 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 0.62 0.67 4.37 3.32 -1.95 -0.43 116.42 123.02 1noi h ASP 327 Ca 0.00 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1noi h ASP 327 Cb 0.08 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.53 1noi h ASP 327 CO 0.00 0.40 -0.09 0.00 -1.72 0.00 0.00 179.24 177.83 1noi n ALA 328 N -2.35 2.63 -0.13 3.45 0.00 -0.79 -4.34 120.51 118.98 1noi n ALA 328 Ca 0.09 -0.18 -0.06 0.00 0.00 0.00 0.00 53.44 53.29 1noi n ALA 328 Cb 0.17 -1.40 0.02 0.00 0.00 0.00 0.00 19.45 18.25 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 0.13 0.43 0.00 0.00 3.57 -1.17 -2.14 116.94 117.77 1noi h PHE 329 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1noi h PHE 329 Cb 0.41 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.02 1noi h PHE 329 CO 0.00 0.24 0.03 -1.35 -2.23 0.00 0.00 178.31 175.00 1noi h PRO 330 N 0.47 0.00 0.00 6.41 0.11 -1.76 -1.13 132.00 136.10 1noi h PRO 330 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1noi h PRO 330 Cb 0.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.16 1noi h PRO 330 CO -0.10 0.00 -1.02 -0.25 -0.21 0.00 0.00 178.00 176.42 1noi n ASP 331 N -2.70 0.75 -0.09 -2.05 8.00 -0.82 -4.35 116.55 115.28 1noi n ASP 331 Ca -0.02 -0.63 0.02 0.00 0.71 0.00 0.00 54.79 54.86 1noi n ASP 331 Cb 0.08 0.93 0.00 0.00 -0.02 0.00 0.00 41.12 42.12 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 -1.66 2.01 -3.84 -1.24 4.76 -0.52 -4.46 118.16 113.21 1noi n LYS 332 Ca 0.03 -0.44 -0.12 0.00 -2.87 0.00 0.00 58.31 54.90 1noi n LYS 332 Cb 0.37 -0.91 -0.14 0.00 -1.84 0.00 0.00 35.03 32.51 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 -0.71 -0.01 -0.06 -0.18 1.01 -0.65 -1.69 120.40 118.11 1noi s VAL 333 Ca 0.03 0.03 0.02 0.00 0.00 0.00 0.00 61.98 62.06 1noi s VAL 333 Cb 0.03 -0.08 0.02 0.00 0.00 0.00 0.00 36.38 36.35 1noi s VAL 333 CO 0.08 0.01 -0.10 0.00 0.00 0.00 0.00 175.10 175.09 1noi s ALA 334 N 0.15 1.13 -0.22 5.51 0.00 -0.52 -4.61 121.76 123.21 1noi s ALA 334 Ca -0.01 -0.34 -0.02 0.00 0.00 0.00 0.00 51.96 51.59 1noi s ALA 334 Cb -0.02 -0.56 0.01 0.00 0.00 0.00 0.00 23.12 22.56 1noi s ALA 334 CO -0.00 0.05 -0.09 0.42 0.00 0.00 0.00 175.76 176.14 1noi s ILE 335 N 0.79 2.87 -0.26 0.00 1.01 -0.74 -1.33 121.20 123.53 1noi s ILE 335 Ca -0.13 -0.79 -0.15 0.00 0.00 0.00 0.00 60.65 59.58 1noi s ILE 335 Cb -0.15 -2.34 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 1noi s ILE 335 CO 0.02 0.37 0.39 -1.58 0.00 0.00 0.00 174.94 174.15 1noi s GLN 336 N 1.38 4.04 -0.48 2.79 2.00 0.15 -2.31 119.66 127.22 1noi s GLN 336 Ca 0.04 0.09 -0.18 0.00 -2.00 0.00 0.00 55.36 53.31 1noi s GLN 336 Cb -0.15 -3.64 0.06 0.00 0.80 0.00 0.00 33.01 30.08 1noi s GLN 336 CO -0.06 -0.25 0.55 -0.51 -0.50 0.00 0.00 175.29 174.51 1noi s LEU 337 N 1.99 5.09 -0.71 3.68 1.02 0.28 -2.23 118.68 127.81 1noi s LEU 337 Ca 0.16 -0.96 -0.26 0.00 0.02 0.00 0.00 54.13 53.09 1noi s LEU 337 Cb -0.16 -2.39 0.04 0.00 0.02 0.00 0.00 46.19 43.71 1noi s LEU 337 CO 0.09 -0.79 1.17 0.20 0.02 0.00 0.00 176.35 177.05 1noi s ASN 338 N 2.53 6.17 0.51 2.29 -0.87 -1.24 -1.19 114.94 123.14 1noi s ASN 338 Ca 0.12 -0.62 0.00 0.00 -1.57 0.00 0.00 52.86 50.79 1noi s ASN 338 Cb -0.20 -2.51 0.00 0.00 -0.02 0.00 0.00 41.25 38.52 1noi s ASN 338 CO 0.11 -1.70 0.00 0.47 -2.57 0.00 0.00 177.10 173.41 1noi n ASP 339 N 8.81 -3.58 -0.02 -1.22 8.00 -0.01 -4.05 116.55 124.48 1noi n ASP 339 Ca 0.01 0.12 0.14 0.00 0.71 0.00 0.00 54.79 55.77 1noi n ASP 339 Cb 0.48 -0.35 0.66 0.00 -0.02 0.00 0.00 41.12 41.90 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 -1.36 0.00 -0.27 -3.53 -2.24 -1.26 -4.21 114.28 101.41 1noi n THR 340 Ca 0.00 -0.01 0.04 0.00 -2.27 0.00 0.00 64.05 61.81 1noi n THR 340 Cb 0.05 -0.40 0.18 0.00 -2.10 0.00 0.00 70.33 68.06 1noi n THR 340 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1noi h HIS 341 N 0.08 0.66 -0.26 4.78 3.86 -1.93 -1.20 115.15 121.13 1noi h HIS 341 Ca 0.00 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1noi h HIS 341 Cb 0.38 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 28.67 1noi h HIS 341 CO 0.00 0.18 0.00 -2.30 0.86 0.00 0.00 177.93 176.67 1noi n PRO 342 N -4.89 2.63 0.09 2.45 -0.02 -1.26 -4.71 135.00 129.29 1noi n PRO 342 Ca 0.14 -1.37 0.10 0.00 -2.02 0.00 0.00 63.50 60.35 1noi n PRO 342 Cb 0.36 -1.79 0.42 0.00 -0.02 0.00 0.00 33.50 32.47 1noi n PRO 342 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1noi n SER 343 N 0.29 0.42 0.05 2.55 3.41 -0.45 -1.11 113.62 118.78 1noi n SER 343 Ca 0.12 0.62 0.09 0.00 -0.26 0.00 0.00 58.87 59.44 1noi n SER 343 Cb 0.63 -0.70 0.39 0.00 -0.26 0.00 0.00 64.21 64.27 1noi n SER 343 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1noi n LEU 344 N -1.98 0.26 -0.15 1.04 4.77 -1.26 -2.07 117.00 117.60 1noi n LEU 344 Ca 0.02 0.56 0.08 0.00 -0.03 0.00 0.00 56.01 56.65 1noi n LEU 344 Cb 0.18 -0.53 0.40 0.00 -2.33 0.00 0.00 43.42 41.14 1noi n LEU 344 CO 0.16 -0.36 1.21 0.00 -1.33 0.00 0.00 177.39 177.06 1noi h ALA 345 N 2.43 1.80 0.44 -1.18 0.00 -1.47 0.17 119.26 121.45 1noi h ALA 345 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1noi h ALA 345 Cb 0.31 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1noi h ALA 345 CO 0.00 0.07 -0.21 0.82 0.00 0.00 0.00 179.25 179.93 1noi h ILE 346 N 0.64 0.43 0.00 0.00 2.04 -1.65 -0.74 117.51 118.23 1noi h ILE 346 Ca 0.31 -0.52 -0.04 0.00 1.00 0.00 0.00 64.86 65.61 1noi h ILE 346 Cb 0.37 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 1noi h ILE 346 CO -0.10 0.07 -0.21 1.55 0.00 0.00 0.00 178.15 179.46 1noi h PRO 347 N -0.95 0.00 -0.20 2.37 0.13 -1.72 -2.87 132.00 128.77 1noi h PRO 347 Ca -0.06 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.94 1noi h PRO 347 Cb 0.57 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.69 1noi h PRO 347 CO 0.10 0.21 -0.42 1.49 -0.23 0.00 0.00 178.00 179.15 1noi h GLU 348 N 0.00 0.47 -0.43 0.86 4.57 -0.52 -1.22 114.58 118.31 1noi h GLU 348 Ca -0.00 -0.24 -0.14 0.00 -1.18 0.00 0.00 59.36 57.81 1noi h GLU 348 Cb 0.47 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.05 1noi h GLU 348 CO 0.03 0.80 -0.27 1.25 -1.18 0.00 0.00 179.01 179.64 1noi h LEU 349 N 0.38 0.94 -0.04 1.64 5.85 -0.92 -2.52 115.31 120.65 1noi h LEU 349 Ca 0.03 -0.38 -0.01 0.00 0.84 0.00 0.00 57.88 58.37 1noi h LEU 349 Cb 0.89 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.66 1noi h LEU 349 CO 0.08 1.15 -0.01 0.24 -0.34 0.00 0.00 178.44 179.56 1noi h MET 350 N 0.78 0.08 -0.04 1.25 2.86 -1.48 -0.54 114.93 117.83 1noi h MET 350 Ca 0.09 -0.03 0.03 0.00 -2.06 0.00 0.00 59.70 57.73 1noi h MET 350 Cb 0.83 -0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.43 1noi h MET 350 CO 0.07 0.42 -0.44 -0.09 1.06 0.00 0.00 176.91 177.93 1noi h ARG 351 N -0.27 -0.55 -0.21 1.72 2.43 -1.13 0.39 114.38 116.76 1noi h ARG 351 Ca 0.01 0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.23 1noi h ARG 351 Cb 0.39 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.05 1noi h ARG 351 CO 0.00 -0.37 0.12 0.28 -1.51 0.00 0.00 179.97 178.50 1noi h VAL 352 N -0.57 1.02 -0.19 0.20 2.07 -1.45 0.86 116.25 118.18 1noi h VAL 352 Ca 0.05 -0.09 -0.05 0.00 0.82 0.00 0.00 66.70 67.43 1noi h VAL 352 Cb 0.66 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1noi h VAL 352 CO -0.35 0.05 -0.09 -0.07 0.02 0.00 0.00 177.57 177.12 1noi h LEU 353 N 0.25 0.41 0.04 2.57 3.38 -0.91 0.10 115.31 121.15 1noi h LEU 353 Ca 0.08 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 57.64 1noi h LEU 353 Cb 0.00 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1noi h LEU 353 CO -0.04 0.73 -0.02 0.58 0.09 0.00 0.00 178.44 179.78 1noi h VAL 354 N 0.09 0.00 -0.37 1.22 2.07 -0.84 -1.12 116.25 117.30 1noi h VAL 354 Ca 0.04 -0.26 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 1noi h VAL 354 Cb 0.58 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 1noi h VAL 354 CO 0.03 0.00 0.08 0.44 0.02 0.00 0.00 177.57 178.14 1noi h ASP 355 N -0.31 0.57 0.21 0.57 5.19 0.61 -1.84 116.42 121.41 1noi h ASP 355 Ca -0.01 -0.24 -0.35 0.00 -0.62 0.00 0.00 57.03 55.82 1noi h ASP 355 Cb 0.04 -0.15 -0.03 0.00 0.18 0.00 0.00 39.33 39.38 1noi h ASP 355 CO 0.01 0.66 -1.95 0.18 -3.12 0.00 0.00 179.24 175.02 1noi n LEU 356 N -4.58 2.19 -0.36 1.55 4.32 0.16 -4.20 117.00 116.08 1noi n LEU 356 Ca -0.01 0.24 0.12 0.00 -0.02 0.00 0.00 56.01 56.35 1noi n LEU 356 Cb 0.21 -0.78 0.20 0.00 -1.62 0.00 0.00 43.42 41.43 1noi n LEU 356 CO 0.38 0.74 0.49 -0.62 -1.22 0.00 0.00 177.39 177.16 1noi n GLU 357 N -3.36 1.01 -2.18 3.23 -0.58 -0.14 -4.98 120.64 113.65 1noi n GLU 357 Ca -0.29 -0.73 -0.16 0.00 -0.42 0.00 0.00 57.16 55.57 1noi n GLU 357 Cb 1.05 -1.48 -0.02 0.00 -0.57 0.00 0.00 31.44 30.42 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 -0.36 -1.26 -2.12 3.49 3.00 -0.69 -4.93 116.66 113.79 1noi n ARG 358 Ca 0.11 0.82 -0.27 0.00 -0.01 0.00 0.00 57.85 58.50 1noi n ARG 358 Cb 0.40 -5.18 0.07 0.00 0.00 0.00 0.00 32.46 27.75 1noi n ARG 358 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1noi s LEU 359 N -4.47 2.80 0.33 0.55 1.43 -0.49 -4.98 118.68 113.86 1noi s LEU 359 Ca 0.00 0.64 -0.17 0.00 -1.03 0.00 0.00 54.13 53.57 1noi s LEU 359 Cb 0.00 -3.29 -0.09 0.00 0.03 0.00 0.00 46.19 42.84 1noi s LEU 359 CO 0.00 -1.57 0.78 -1.81 0.23 0.00 0.00 176.35 173.98 1noi s ASP 360 N -4.49 6.88 0.28 2.29 1.11 -1.26 -4.35 116.67 117.13 1noi s ASP 360 Ca 0.59 1.41 0.01 0.00 0.18 0.00 0.00 52.55 54.74 1noi s ASP 360 Cb -0.11 -2.42 0.61 0.00 1.07 0.00 0.00 42.92 42.07 1noi s ASP 360 CO 0.47 -0.19 1.76 -0.25 1.18 0.00 0.00 175.17 178.14 1noi h TRP 361 N 2.43 0.83 -0.48 4.23 7.01 -1.96 0.47 115.95 128.47 1noi h TRP 361 Ca -0.48 0.04 -0.07 0.00 2.11 0.00 0.00 58.89 60.48 1noi h TRP 361 Cb 1.18 -0.23 -0.02 0.00 -2.10 0.00 0.00 29.16 27.99 1noi h TRP 361 CO 0.62 0.17 0.02 -0.44 -2.79 0.00 0.00 178.44 176.02 1noi h ASP 362 N 0.63 0.82 -0.08 2.65 3.32 -1.98 0.15 116.42 121.93 1noi h ASP 362 Ca 0.50 -0.29 -0.00 0.00 0.02 0.00 0.00 57.03 57.26 1noi h ASP 362 Cb 0.76 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 40.09 1noi h ASP 362 CO -0.39 0.91 0.04 0.50 -1.72 0.00 0.00 179.24 178.58 1noi h LYS 363 N 0.70 0.12 0.00 3.56 1.63 -1.56 -1.05 116.57 119.97 1noi h LYS 363 Ca 0.14 -0.02 -0.07 0.00 -0.85 0.00 0.00 60.65 59.85 1noi h LYS 363 Cb 0.48 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.07 1noi h LYS 363 CO 0.02 0.20 -0.35 0.00 -3.45 0.00 0.00 179.45 175.88 1noi h ALA 364 N 0.91 1.33 0.03 5.00 0.00 -0.72 -0.41 119.26 125.40 1noi h ALA 364 Ca 0.03 -0.31 -0.25 0.00 0.00 0.00 0.00 54.91 54.38 1noi h ALA 364 Cb 0.12 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.87 1noi h ALA 364 CO -0.00 0.43 -1.03 2.35 0.00 0.00 0.00 179.25 181.00 1noi h TRP 365 N 0.00 0.68 -0.01 0.00 2.91 -0.60 0.17 115.95 119.09 1noi h TRP 365 Ca -0.00 -0.39 -0.00 0.00 1.13 0.00 0.00 58.89 59.62 1noi h TRP 365 Cb 0.65 -0.07 -0.00 0.00 -0.51 0.00 0.00 29.16 29.23 1noi h TRP 365 CO 0.00 1.23 0.00 1.49 -1.03 0.00 0.00 178.44 180.13 1noi h GLU 366 N 0.23 0.02 -0.72 2.65 4.81 -0.27 -1.09 114.58 120.20 1noi h GLU 366 Ca -0.10 -0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.14 1noi h GLU 366 Cb 1.69 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 31.02 1noi h GLU 366 CO 0.18 0.21 0.46 0.28 -0.73 0.00 0.00 179.01 179.41 1noi h VAL 367 N -0.18 1.13 -0.10 0.32 2.07 -1.13 -2.99 116.25 115.38 1noi h VAL 367 Ca 0.00 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 1noi h VAL 367 Cb 0.20 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.10 1noi h VAL 367 CO -0.00 0.17 0.00 0.74 0.02 0.00 0.00 177.57 178.50 1noi h THR 368 N 0.92 1.25 0.00 2.57 2.02 0.18 -2.43 112.91 117.42 1noi h THR 368 Ca 0.28 -0.78 -0.05 0.00 0.77 0.00 0.00 66.41 66.63 1noi h THR 368 Cb -0.03 1.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.94 1noi h THR 368 CO -0.09 0.22 -0.26 -0.37 0.37 0.00 0.00 175.52 175.40 1noi h VAL 369 N -0.10 0.56 0.00 3.16 -1.51 -1.19 -2.09 116.25 115.09 1noi h VAL 369 Ca 0.03 -1.29 -0.02 0.00 -1.23 0.00 0.00 66.70 64.19 1noi h VAL 369 Cb 0.34 1.89 -0.00 0.00 -2.13 0.00 0.00 31.29 31.39 1noi h VAL 369 CO 0.00 0.25 -0.09 0.11 -1.23 0.00 0.00 177.57 176.62 1noi h LYS 370 N 0.00 0.00 0.17 5.19 1.57 -1.53 0.94 116.57 122.90 1noi h LYS 370 Ca -0.00 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.44 1noi h LYS 370 Cb 0.87 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.18 1noi h LYS 370 CO 0.03 0.09 -1.68 1.15 -0.57 0.00 0.00 179.45 178.47 1noi h THR 371 N 0.00 1.01 -2.94 -0.16 2.02 -0.87 -3.47 112.91 108.50 1noi h THR 371 Ca -0.00 -2.61 -0.62 0.00 0.77 0.00 0.00 66.41 63.96 1noi h THR 371 Cb 0.88 2.76 -0.05 0.00 -1.74 0.00 0.00 68.15 70.01 1noi h THR 371 CO 0.01 0.84 -0.42 0.00 0.37 0.00 0.00 175.52 176.32 1noi s ALA 373 N -1.44 0.22 -0.11 0.00 0.00 -0.98 -1.53 121.76 117.92 1noi s ALA 373 Ca 0.32 -0.69 0.02 0.00 0.00 0.00 0.00 51.96 51.62 1noi s ALA 373 Cb -0.13 0.16 -0.01 0.00 0.00 0.00 0.00 23.12 23.14 1noi s ALA 373 CO 0.22 -0.18 -0.20 -0.47 0.00 0.00 0.00 175.76 175.13 1noi s TYR 374 N -1.78 2.65 -0.10 0.00 5.04 -0.80 -0.55 117.35 121.80 1noi s TYR 374 Ca -0.12 -0.90 0.02 0.00 -2.44 0.00 0.00 57.07 53.62 1noi s TYR 374 Cb -0.08 -1.76 -0.01 0.00 0.35 0.00 0.00 41.96 40.46 1noi s TYR 374 CO -0.02 -0.34 -0.17 0.99 -1.34 0.00 0.00 175.55 174.67 1noi s THR 375 N 0.34 2.76 -0.16 4.34 2.01 -0.34 -1.65 115.64 122.94 1noi s THR 375 Ca -0.16 -0.79 -0.10 0.00 0.31 0.00 0.00 61.69 60.96 1noi s THR 375 Cb -0.17 -2.11 -0.05 0.00 0.01 0.00 0.00 72.50 70.18 1noi s THR 375 CO 0.08 0.55 0.16 0.21 -0.69 0.00 0.00 174.62 174.93 1noi s ASN 376 N 0.10 6.32 0.00 3.53 3.84 -0.61 -0.83 114.94 127.29 1noi s ASN 376 Ca -0.08 0.37 0.04 0.00 0.21 0.00 0.00 52.86 53.40 1noi s ASN 376 Cb -0.15 -2.10 -0.02 0.00 -0.55 0.00 0.00 41.25 38.43 1noi s ASN 376 CO 0.05 0.25 0.28 1.41 -2.79 0.00 0.00 177.10 176.31 1noi n HIS 377 N 2.94 0.00 -3.51 0.43 8.25 -1.26 -4.19 115.22 117.88 1noi n HIS 377 Ca -0.17 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.17 1noi n HIS 377 Cb 0.53 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.60 1noi n HIS 377 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1noi s THR 378 N -1.07 0.00 -0.20 1.59 -4.23 -1.26 -4.58 115.64 105.90 1noi s THR 378 Ca 0.02 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 60.40 1noi s THR 378 Cb 0.03 -1.00 -0.08 0.00 1.34 0.00 0.00 72.50 72.79 1noi s THR 378 CO 0.12 0.00 -0.30 0.55 -0.54 0.00 0.00 174.62 174.45 1noi n VAL 379 N 0.22 1.37 -1.68 2.29 3.14 -1.26 -4.88 118.33 117.54 1noi n VAL 379 Ca -0.13 -0.13 -0.42 0.00 -2.96 0.00 0.00 64.34 60.70 1noi n VAL 379 Cb 0.60 -1.99 -0.03 0.00 -1.06 0.00 0.00 33.84 31.36 1noi n VAL 379 CO 0.00 0.00 0.00 -0.38 -6.46 0.00 0.00 176.83 169.99 1noi n ILE 380 N -4.17 0.58 0.05 1.55 2.08 -1.26 -4.71 119.36 113.48 1noi n ILE 380 Ca -0.33 -0.10 0.00 0.00 0.56 0.00 0.00 62.75 62.88 1noi n ILE 380 Cb 0.68 -2.24 0.00 0.00 -0.75 0.00 0.00 39.64 37.33 1noi n ILE 380 CO 0.00 0.00 0.00 -2.65 0.56 0.00 0.00 176.55 174.46 1noi n PRO 381 N 6.64 0.00 -0.17 0.38 -0.02 -1.26 -1.16 135.00 139.41 1noi n PRO 381 Ca 0.19 0.16 -0.05 0.00 -2.02 0.00 0.00 63.50 61.77 1noi n PRO 381 Cb 0.39 -0.85 0.04 0.00 -0.02 0.00 0.00 33.50 33.07 1noi n PRO 381 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1noi h GLU 382 N 0.00 0.59 0.00 -0.52 3.07 -1.98 -3.13 114.58 112.61 1noi h GLU 382 Ca 0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.82 1noi h GLU 382 Cb 0.54 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 28.32 1noi h GLU 382 CO 0.00 0.39 0.00 0.00 -1.40 0.00 0.00 179.01 178.00 1noi n ALA 383 N -2.28 2.25 -3.92 3.43 0.00 -0.31 -4.27 120.51 115.40 1noi n ALA 383 Ca 0.04 -0.10 -0.30 0.00 0.00 0.00 0.00 53.44 53.08 1noi n ALA 383 Cb 0.08 -1.26 -0.14 0.00 0.00 0.00 0.00 19.45 18.14 1noi n ALA 383 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1noi s LEU 384 N -1.75 4.09 0.44 0.00 1.02 -1.18 -4.59 118.68 116.70 1noi s LEU 384 Ca 0.24 -2.64 -0.24 0.00 0.02 0.00 0.00 54.13 51.51 1noi s LEU 384 Cb 0.11 -1.51 -0.10 0.00 0.02 0.00 0.00 46.19 44.72 1noi s LEU 384 CO 0.18 -0.29 1.11 -0.62 0.02 0.00 0.00 176.35 176.76 1noi n GLU 385 N 3.59 1.52 -4.47 1.70 1.02 -1.26 -4.85 120.64 117.90 1noi n GLU 385 Ca 0.05 0.55 -0.22 0.00 -0.02 0.00 0.00 57.16 57.52 1noi n GLU 385 Cb 0.36 -2.19 -0.16 0.00 -0.02 0.00 0.00 31.44 29.43 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 -2.18 1.17 -0.09 3.49 0.52 -1.26 -0.55 118.95 120.05 1noi s ARG 386 Ca 0.64 -0.35 0.04 0.00 -0.52 0.00 0.00 55.73 55.54 1noi s ARG 386 Cb -0.52 -1.06 -0.01 0.00 0.52 0.00 0.00 34.95 33.89 1noi s ARG 386 CO 0.56 0.11 -0.23 -1.58 0.02 0.00 0.00 175.30 174.18 1noi s TRP 387 N 0.28 2.56 0.18 -0.53 0.52 -0.38 -4.89 118.94 116.67 1noi s TRP 387 Ca -0.05 -0.88 -0.33 0.00 0.02 0.00 0.00 56.10 54.85 1noi s TRP 387 Cb -0.10 -1.69 -0.14 0.00 -1.15 0.00 0.00 33.47 30.38 1noi s TRP 387 CO 0.01 -0.32 1.44 -2.30 0.02 0.00 0.00 176.95 175.80 1noi n PRO 388 N 3.32 1.84 0.13 4.98 -0.02 -1.26 -0.96 135.00 143.03 1noi n PRO 388 Ca -0.18 0.66 0.03 0.00 -2.02 0.00 0.00 63.50 61.99 1noi n PRO 388 Cb 0.53 -2.34 0.41 0.00 -0.02 0.00 0.00 33.50 32.07 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 3.28 1.17 -0.88 -1.45 -1.51 -1.70 -1.37 116.25 113.79 1noi h VAL 389 Ca -0.45 -0.75 0.09 0.00 -1.23 0.00 0.00 66.70 64.36 1noi h VAL 389 Cb 1.28 1.21 -0.06 0.00 -2.13 0.00 0.00 31.29 31.59 1noi h VAL 389 CO 0.81 0.23 0.57 1.12 -1.23 0.00 0.00 177.57 179.07 1noi h HIS 390 N 0.20 0.96 -0.43 5.19 2.07 -1.90 0.30 115.15 121.53 1noi h HIS 390 Ca 0.04 0.03 -0.12 0.00 -2.85 0.00 0.00 60.37 57.46 1noi h HIS 390 Cb 0.36 -0.31 -0.01 0.00 2.57 0.00 0.00 27.41 30.02 1noi h HIS 390 CO 0.00 0.45 -0.21 1.25 -3.07 0.00 0.00 177.93 176.36 1noi h LEU 391 N 0.90 0.93 -0.55 6.12 6.46 -1.63 -2.44 115.31 125.10 1noi h LEU 391 Ca 0.40 -0.40 -0.16 0.00 -0.12 0.00 0.00 57.88 57.60 1noi h LEU 391 Cb 0.36 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 40.03 1noi h LEU 391 CO -0.17 1.13 -0.67 0.25 -0.62 0.00 0.00 178.44 178.37 1noi h LEU 392 N 0.73 0.30 -0.87 2.25 5.85 -0.97 -1.96 115.31 120.64 1noi h LEU 392 Ca 0.10 -0.19 -0.12 0.00 0.84 0.00 0.00 57.88 58.51 1noi h LEU 392 Cb 0.78 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.70 1noi h LEU 392 CO 0.06 0.88 -0.56 -0.08 -0.34 0.00 0.00 178.44 178.41 1noi h GLU 393 N 0.18 0.00 0.11 1.25 4.81 -0.31 -0.08 114.58 120.55 1noi h GLU 393 Ca -0.02 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 58.95 1noi h GLU 393 Cb 1.20 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.58 1noi h GLU 393 CO 0.10 0.56 -1.35 1.15 -0.73 0.00 0.00 179.01 178.74 1noi h THR 394 N 0.00 1.06 0.00 0.32 2.02 -1.31 -3.35 112.91 111.65 1noi h THR 394 Ca -0.01 -2.40 -0.00 0.00 0.77 0.00 0.00 66.41 64.77 1noi h THR 394 Cb 1.00 2.73 -0.00 0.00 -1.74 0.00 0.00 68.15 70.14 1noi h THR 394 CO 0.07 0.69 -1.99 0.00 0.37 0.00 0.00 175.52 174.66 1noi n LEU 395 N -3.96 0.01 -3.08 2.58 -0.00 -0.75 -4.32 117.00 107.48 1noi n LEU 395 Ca -0.24 0.00 -0.23 0.00 -0.00 0.00 0.00 56.01 55.54 1noi n LEU 395 Cb 0.88 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 44.27 1noi n LEU 395 CO 0.40 0.00 -0.04 0.18 -0.00 0.00 0.00 177.39 177.94 1noi n LEU 396 N -2.27 2.67 -0.21 1.47 7.99 -0.05 -0.78 117.00 125.82 1noi n LEU 396 Ca -0.04 -5.34 -0.01 0.00 -0.01 0.00 0.00 56.01 50.61 1noi n LEU 396 Cb 0.57 0.06 0.10 0.00 -0.11 0.00 0.00 43.42 44.04 1noi n LEU 396 CO 0.46 2.31 1.04 1.55 -1.51 0.00 0.00 177.39 181.24 1noi h PRO 397 N 3.06 0.54 -0.50 3.23 0.13 -1.68 -0.30 132.00 136.48 1noi h PRO 397 Ca 0.12 -0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 65.13 1noi h PRO 397 Cb 0.73 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 31.72 1noi h PRO 397 CO 0.66 0.36 -0.04 -0.09 -0.23 0.00 0.00 178.00 178.66 1noi h ARG 398 N 0.56 0.86 -0.52 0.86 9.65 -1.92 -2.43 114.38 121.43 1noi h ARG 398 Ca 0.30 -0.26 -0.06 0.00 -1.10 0.00 0.00 59.98 58.86 1noi h ARG 398 Cb 0.27 -0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 28.74 1noi h ARG 398 CO -0.23 0.88 0.10 0.45 2.80 0.00 0.00 179.97 183.97 1noi h HIS 399 N 0.79 0.89 -0.41 2.20 3.86 -1.50 -1.74 115.15 119.24 1noi h HIS 399 Ca 0.14 -0.12 -0.04 0.00 -1.16 0.00 0.00 60.37 59.19 1noi h HIS 399 Cb 0.53 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.73 1noi h HIS 399 CO 0.03 0.80 0.08 1.25 0.86 0.00 0.00 177.93 180.96 1noi h LEU 400 N 0.73 0.56 -0.71 2.43 7.12 -0.86 -0.94 115.31 123.65 1noi h LEU 400 Ca 0.16 -0.09 -0.04 0.00 0.13 0.00 0.00 57.88 58.04 1noi h LEU 400 Cb 0.38 -0.15 -0.03 0.00 -0.53 0.00 0.00 40.66 40.33 1noi h LEU 400 CO 0.01 0.58 0.28 1.56 -0.13 0.00 0.00 178.44 180.74 1noi h GLN 401 N 0.60 1.05 -0.15 1.25 4.20 -0.87 -2.37 115.11 118.82 1noi h GLN 401 Ca 0.14 -0.19 -0.19 0.00 0.06 0.00 0.00 58.65 58.47 1noi h GLN 401 Cb 0.25 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 27.86 1noi h GLN 401 CO -0.00 0.87 -0.68 0.82 -0.67 0.00 0.00 178.83 179.17 1noi h ILE 402 N 1.01 1.32 -0.41 2.54 2.04 -0.98 -2.75 117.51 120.28 1noi h ILE 402 Ca 0.24 -1.96 -0.05 0.00 1.00 0.00 0.00 64.86 64.08 1noi h ILE 402 Cb 0.21 1.93 -0.02 0.00 -0.74 0.00 0.00 36.82 38.20 1noi h ILE 402 CO -0.02 0.61 0.03 0.40 0.00 0.00 0.00 178.15 179.17 1noi h ILE 403 N 0.43 1.21 -0.11 -0.67 2.04 -1.03 -0.52 117.51 118.86 1noi h ILE 403 Ca -0.02 -0.83 -0.11 0.00 1.00 0.00 0.00 64.86 64.90 1noi h ILE 403 Cb 1.26 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 38.20 1noi h ILE 403 CO 0.13 0.29 -0.42 1.88 0.00 0.00 0.00 178.15 180.03 1noi h TYR 404 N 0.61 0.31 0.11 1.37 0.05 -1.41 -1.12 116.97 116.89 1noi h TYR 404 Ca 0.13 -0.09 -0.20 0.00 0.05 0.00 0.00 58.73 58.62 1noi h TYR 404 Cb 0.34 -0.07 0.02 0.00 1.01 0.00 0.00 36.73 38.04 1noi h TYR 404 CO 0.01 0.65 -0.86 1.49 -1.05 0.00 0.00 178.16 178.40 1noi h GLU 405 N 0.22 0.39 -0.54 4.88 4.57 -1.04 -2.43 114.58 120.63 1noi h GLU 405 Ca 0.02 -0.57 0.10 0.00 -1.18 0.00 0.00 59.36 57.73 1noi h GLU 405 Cb 0.84 0.20 -0.08 0.00 -0.16 0.00 0.00 28.75 29.55 1noi h GLU 405 CO 0.07 1.24 0.06 0.82 -1.18 0.00 0.00 179.01 180.01 1noi h ILE 406 N -0.19 0.63 -0.65 2.32 2.04 -1.14 -2.48 117.51 118.05 1noi h ILE 406 Ca -0.14 -0.06 0.01 0.00 1.00 0.00 0.00 64.86 65.66 1noi h ILE 406 Cb 1.63 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 38.12 1noi h ILE 406 CO 0.16 0.03 0.42 -1.13 0.00 0.00 0.00 178.15 177.64 1noi h ASN 407 N 0.18 0.75 0.73 1.72 -1.24 -1.08 -0.79 115.58 115.85 1noi h ASN 407 Ca 0.27 -0.02 -0.03 0.00 0.71 0.00 0.00 56.30 57.23 1noi h ASN 407 Cb 0.41 -0.19 -0.00 0.00 0.73 0.00 0.00 38.32 39.27 1noi h ASN 407 CO -0.40 0.55 -0.43 -0.61 -1.29 0.00 0.00 177.43 175.24 1noi h GLN 408 N 0.88 -1.05 -0.71 6.67 4.15 -1.08 0.22 115.11 124.19 1noi h GLN 408 Ca 0.24 0.07 0.04 0.00 0.77 0.00 0.00 58.65 59.77 1noi h GLN 408 Cb -0.09 0.24 -0.05 0.00 0.21 0.00 0.00 27.48 27.79 1noi h GLN 408 CO -0.05 -0.70 0.43 0.00 -1.93 0.00 0.00 178.83 176.58 1noi h ARG 409 N -1.09 0.81 -0.30 1.69 3.08 -1.39 0.22 114.38 117.41 1noi h ARG 409 Ca -0.10 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 59.92 1noi h ARG 409 Cb 0.87 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.72 1noi h ARG 409 CO 0.11 0.54 0.17 0.35 -1.07 0.00 0.00 179.97 180.06 1noi h PHE 410 N 0.84 0.31 0.00 3.04 3.57 -0.98 -1.98 116.94 121.74 1noi h PHE 410 Ca 0.29 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.76 1noi h PHE 410 Cb 0.06 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 1noi h PHE 410 CO -0.05 0.18 -0.19 -0.07 -2.23 0.00 0.00 178.31 175.96 1noi h LEU 411 N 0.35 0.00 -0.16 0.59 3.38 0.80 -0.69 115.31 119.57 1noi h LEU 411 Ca 0.12 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.94 1noi h LEU 411 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1noi h LEU 411 CO -0.07 0.19 -0.47 0.78 0.09 0.00 0.00 178.44 178.96 1noi h ASN 412 N 0.00 0.69 -0.44 -0.43 -0.26 -0.10 -2.58 115.58 112.47 1noi h ASN 412 Ca -0.00 -0.59 0.08 0.00 -0.56 0.00 0.00 56.30 55.23 1noi h ASN 412 Cb 0.60 -0.20 -0.07 0.00 -1.06 0.00 0.00 38.32 37.59 1noi h ASN 412 CO 0.02 1.16 -0.01 0.03 -1.06 0.00 0.00 177.43 177.58 1noi h ARG 413 N 0.25 0.10 -0.64 0.81 3.08 -0.44 -0.69 114.38 116.86 1noi h ARG 413 Ca -0.01 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 1noi h ARG 413 Cb 1.09 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 31.09 1noi h ARG 413 CO 0.10 0.07 0.26 0.28 -1.07 0.00 0.00 179.97 179.60 1noi h VAL 414 N 0.10 1.22 -0.15 2.04 2.07 -1.31 -1.76 116.25 118.47 1noi h VAL 414 Ca 0.22 -0.69 -0.12 0.00 0.82 0.00 0.00 66.70 66.92 1noi h VAL 414 Cb 0.32 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1noi h VAL 414 CO -0.37 0.28 -0.43 0.00 0.02 0.00 0.00 177.57 177.07 1noi h ALA 415 N 1.36 0.98 -0.56 1.67 0.00 -0.94 0.36 119.26 122.14 1noi h ALA 415 Ca 0.22 -0.44 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 1noi h ALA 415 Cb 0.17 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1noi h ALA 415 CO -0.02 0.63 0.17 0.00 0.00 0.00 0.00 179.25 180.03 1noi h ALA 416 N 1.25 0.74 0.00 0.00 0.00 -0.71 -2.94 119.26 117.60 1noi h ALA 416 Ca 0.02 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 1noi h ALA 416 Cb 0.88 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1noi h ALA 416 CO 0.07 0.40 -0.50 0.00 0.00 0.00 0.00 179.25 179.22 1noi h ALA 417 N 1.04 0.76 -2.03 0.00 0.00 -1.01 -3.39 119.26 114.63 1noi h ALA 417 Ca 0.18 -0.46 -0.54 0.00 0.00 0.00 0.00 54.91 54.10 1noi h ALA 417 Cb 0.28 -0.08 -0.40 0.00 0.00 0.00 0.00 17.79 17.60 1noi h ALA 417 CO -0.01 0.63 -1.07 1.19 0.00 0.00 0.00 179.25 179.99 1noi n PHE 418 N -3.35 0.40 -2.05 0.00 3.72 0.09 -5.09 117.46 111.19 1noi n PHE 418 Ca 0.01 -3.73 -0.42 0.00 -0.05 0.00 0.00 57.45 53.26 1noi n PHE 418 Cb 0.67 -0.40 -0.03 0.00 -0.94 0.00 0.00 39.48 38.78 1noi n PHE 418 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 1noi s PRO 419 N -1.86 4.25 0.00 -1.08 0.02 -1.12 -1.16 135.00 134.06 1noi s PRO 419 Ca 0.38 2.21 0.00 0.00 0.02 0.00 0.00 61.00 63.61 1noi s PRO 419 Cb 0.24 -3.37 0.00 0.00 0.02 0.00 0.00 34.50 31.39 1noi s PRO 419 CO -0.09 -0.59 0.00 0.41 -0.33 0.00 0.00 177.00 176.40 1noi n GLY 420 N 3.73 3.13 3.53 0.52 0.00 -1.26 -4.98 105.19 109.86 1noi n GLY 420 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 1noi n GLY 420 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1noi s ASP 421 N -0.76 6.83 0.21 1.61 -1.08 -0.31 -4.72 116.67 118.45 1noi s ASP 421 Ca 0.00 -2.39 -0.03 0.00 -0.52 0.00 0.00 52.55 49.60 1noi s ASP 421 Cb 0.00 -2.50 0.18 0.00 -1.46 0.00 0.00 42.92 39.14 1noi s ASP 421 CO 0.00 -1.09 1.59 0.58 0.52 0.00 0.00 175.17 176.77 1noi h VAL 422 N 5.54 1.29 -0.65 1.11 2.07 -1.94 -2.61 116.25 121.07 1noi h VAL 422 Ca 0.33 -1.49 0.04 0.00 0.82 0.00 0.00 66.70 66.41 1noi h VAL 422 Cb 0.91 1.42 -0.04 0.00 -1.52 0.00 0.00 31.29 32.07 1noi h VAL 422 CO 1.35 0.48 0.43 -0.78 0.02 0.00 0.00 177.57 179.07 1noi h ASP 423 N 0.56 0.65 -0.57 0.57 3.58 -1.99 0.19 116.42 119.40 1noi h ASP 423 Ca 0.06 -0.01 -0.05 0.00 0.42 0.00 0.00 57.03 57.45 1noi h ASP 423 Cb 0.86 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.73 1noi h ASP 423 CO 0.07 0.44 0.16 -0.09 -2.88 0.00 0.00 179.24 176.95 1noi h ARG 424 N 0.75 0.90 -0.23 0.28 2.43 -1.87 0.85 114.38 117.50 1noi h ARG 424 Ca 0.26 -0.20 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1noi h ARG 424 Cb 0.11 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1noi h ARG 424 CO -0.08 0.82 0.09 -0.07 -1.51 0.00 0.00 179.97 179.23 1noi h LEU 425 N 0.81 0.31 -1.28 3.80 3.38 -0.40 0.34 115.31 122.27 1noi h LEU 425 Ca 0.18 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1noi h LEU 425 Cb 0.31 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1noi h LEU 425 CO -0.00 0.39 -0.17 0.08 0.09 0.00 0.00 178.44 178.83 1noi h ARG 426 N 0.22 0.00 0.03 1.13 -0.00 -1.08 -1.91 114.38 112.76 1noi h ARG 426 Ca 0.08 0.00 -0.23 0.00 -0.00 0.00 0.00 59.98 59.82 1noi h ARG 426 Cb 0.17 0.00 -0.02 0.00 -0.00 0.00 0.00 29.97 30.12 1noi h ARG 426 CO -0.01 0.17 -1.10 0.00 -0.00 0.00 0.00 179.97 179.03 1noi h ARG 427 N 0.00 0.07 0.00 0.08 3.08 0.83 -3.35 114.38 115.08 1noi h ARG 427 Ca -0.00 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.93 1noi h ARG 427 Cb 0.65 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.75 1noi h ARG 427 CO 0.02 1.03 -1.19 -1.33 -1.07 0.00 0.00 179.97 177.43 1noi n MET 428 N -3.38 0.37 -1.38 0.04 2.81 0.10 -4.98 117.12 110.70 1noi n MET 428 Ca -0.03 -0.02 -0.37 0.00 -1.81 0.00 0.00 57.70 55.46 1noi n MET 428 Cb 0.97 -1.60 0.05 0.00 -0.71 0.00 0.00 33.22 31.93 1noi n MET 428 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1noi n SER 429 N -2.06 -0.95 0.06 7.83 2.88 -0.75 -4.90 113.62 115.73 1noi n SER 429 Ca 0.01 0.67 0.13 0.00 -1.33 0.00 0.00 58.87 58.34 1noi n SER 429 Cb 0.46 -1.22 0.31 0.00 -0.75 0.00 0.00 64.21 63.02 1noi n SER 429 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1noi n LEU 430 N -0.02 0.62 -4.47 2.46 4.77 -1.26 -4.73 117.00 114.38 1noi n LEU 430 Ca 0.11 0.34 -0.38 0.00 -0.03 0.00 0.00 56.01 56.05 1noi n LEU 430 Cb 0.49 -0.27 -0.12 0.00 -2.33 0.00 0.00 43.42 41.19 1noi n LEU 430 CO 0.50 -0.06 -0.21 -0.69 -1.33 0.00 0.00 177.39 175.61 1noi s VAL 431 N -3.10 4.71 -0.18 4.08 1.01 -1.26 -0.69 120.40 124.96 1noi s VAL 431 Ca 0.09 -0.29 -0.13 0.00 0.00 0.00 0.00 61.98 61.65 1noi s VAL 431 Cb 0.14 -3.36 -0.05 0.00 0.00 0.00 0.00 36.38 33.12 1noi s VAL 431 CO 0.66 0.12 0.28 -1.61 0.00 0.00 0.00 175.10 174.55 1noi s GLU 432 N 1.64 4.21 0.75 2.72 2.02 0.56 -4.94 118.70 125.66 1noi s GLU 432 Ca 0.05 0.04 -0.03 0.00 0.02 0.00 0.00 54.97 55.05 1noi s GLU 432 Cb -0.17 -3.46 0.13 0.00 0.10 0.00 0.00 34.13 30.73 1noi s GLU 432 CO 0.07 0.17 1.03 -1.21 0.02 0.00 0.00 175.26 175.34 1noi s GLU 433 N 0.70 1.57 0.00 1.61 0.41 -1.26 -0.14 118.70 121.59 1noi s GLU 433 Ca 0.15 -0.99 0.00 0.00 -0.41 0.00 0.00 54.97 53.72 1noi s GLU 433 Cb -0.13 -2.27 0.00 0.00 -1.78 0.00 0.00 34.13 29.95 1noi s GLU 433 CO 0.04 -1.55 0.00 0.41 -0.49 0.00 0.00 175.26 173.67 1noi n GLY 434 N -2.95 0.73 3.46 -1.39 0.00 -1.26 -4.80 105.19 98.99 1noi n GLY 434 Ca 0.15 -1.63 -0.43 0.00 0.00 0.00 0.00 46.02 44.11 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 3.14 0.00 4.61 0.00 -1.26 -4.46 121.76 122.78 1noi s ALA 435 Ca 0.00 -2.08 0.00 0.00 0.00 0.00 0.00 51.96 49.88 1noi s ALA 435 Cb 0.00 -3.96 0.00 0.00 0.00 0.00 0.00 23.12 19.16 1noi s ALA 435 CO 0.00 -2.90 0.00 1.55 0.00 0.00 0.00 175.76 174.41 1noi n VAL 436 N 5.90 -0.55 -3.00 0.00 3.14 -1.26 -5.05 118.33 117.51 1noi n VAL 436 Ca 0.06 0.00 -0.38 0.00 -2.96 0.00 0.00 64.34 61.05 1noi n VAL 436 Cb 0.47 -0.55 -0.06 0.00 -1.06 0.00 0.00 33.84 32.64 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 -4.31 4.49 0.05 1.45 2.20 -1.26 -4.65 119.74 117.71 1noi s LYS 437 Ca 0.00 1.10 0.00 0.00 -0.36 0.00 0.00 55.97 56.71 1noi s LYS 437 Cb 0.00 -3.14 -0.03 0.00 -1.51 0.00 0.00 37.83 33.15 1noi s LYS 437 CO 0.00 0.51 -0.04 1.03 -0.36 0.00 0.00 175.35 176.48 1noi s ARG 438 N -1.41 0.56 -0.22 4.03 0.52 0.80 -1.85 118.95 121.38 1noi s ARG 438 Ca 0.38 -1.01 -0.05 0.00 -0.52 0.00 0.00 55.73 54.53 1noi s ARG 438 Cb -0.21 0.02 -0.02 0.00 0.52 0.00 0.00 34.95 35.26 1noi s ARG 438 CO 0.25 -0.05 0.01 0.42 0.02 0.00 0.00 175.30 175.95 1noi s ILE 439 N -2.81 3.90 -0.53 1.52 -1.09 -0.13 -0.33 121.20 121.73 1noi s ILE 439 Ca -0.01 -0.32 -0.23 0.00 -2.23 0.00 0.00 60.65 57.86 1noi s ILE 439 Cb -0.00 -2.79 0.04 0.00 -1.58 0.00 0.00 42.46 38.13 1noi s ILE 439 CO -0.05 0.40 0.88 0.21 -1.23 0.00 0.00 174.94 175.15 1noi s ASN 440 N 1.32 6.34 0.54 3.58 3.84 0.13 -1.25 114.94 129.44 1noi s ASN 440 Ca 0.04 -0.39 0.33 0.00 0.21 0.00 0.00 52.86 53.05 1noi s ASN 440 Cb -0.15 -2.41 1.32 0.00 -0.55 0.00 0.00 41.25 39.46 1noi s ASN 440 CO 0.01 -1.15 1.97 0.24 -2.79 0.00 0.00 177.10 175.38 1noi h MET 441 N 9.23 0.00 0.00 0.43 2.86 -1.13 -2.49 114.93 123.83 1noi h MET 441 Ca -0.26 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.30 1noi h MET 441 Cb 1.08 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.73 1noi h MET 441 CO 1.06 0.02 -0.38 0.00 1.06 0.00 0.00 176.91 178.67 1noi h ALA 442 N 1.98 1.05 0.02 6.32 0.00 -1.91 -2.41 119.26 124.33 1noi h ALA 442 Ca -0.00 -0.35 -0.21 0.00 0.00 0.00 0.00 54.91 54.36 1noi h ALA 442 Cb 0.53 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1noi h ALA 442 CO 0.00 0.47 -0.95 0.45 0.00 0.00 0.00 179.25 179.23 1noi h HIS 443 N 0.00 0.22 0.11 0.00 3.86 -1.82 -1.05 115.15 116.47 1noi h HIS 443 Ca -0.00 -0.14 -0.01 0.00 -1.16 0.00 0.00 60.37 59.07 1noi h HIS 443 Cb 0.85 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.30 1noi h HIS 443 CO 0.00 1.00 -0.05 1.25 0.86 0.00 0.00 177.93 180.99 1noi h LEU 444 N 0.06 -0.12 -0.96 2.43 6.46 -1.42 0.74 115.31 122.50 1noi h LEU 444 Ca -0.05 -0.29 -0.02 0.00 -0.12 0.00 0.00 57.88 57.41 1noi h LEU 444 Cb 1.63 0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 41.55 1noi h LEU 444 CO 0.14 0.23 0.47 0.00 -0.62 0.00 0.00 178.44 178.67 1noi h ILE 446 N 1.21 1.30 -0.66 0.00 2.04 -1.09 -2.11 117.51 118.20 1noi h ILE 446 Ca 0.31 -1.62 -0.04 0.00 1.00 0.00 0.00 64.86 64.50 1noi h ILE 446 Cb 0.03 1.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.75 1noi h ILE 446 CO -0.05 0.52 0.23 0.00 0.00 0.00 0.00 178.15 178.85 1noi h ALA 447 N 0.67 1.17 -0.56 1.87 0.00 -0.59 -3.10 119.26 118.72 1noi h ALA 447 Ca 0.02 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1noi h ALA 447 Cb 1.02 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1noi h ALA 447 CO 0.10 0.59 0.00 0.41 0.00 0.00 0.00 179.25 180.35 1noi n GLY 448 N -0.91 1.77 3.53 0.00 0.00 -0.08 -4.95 105.19 104.54 1noi n GLY 448 Ca 0.06 -0.66 -0.31 0.00 0.00 0.00 0.00 46.02 45.10 1noi n GLY 448 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1noi s SER 449 N -1.10 4.20 0.00 1.61 0.01 -0.80 -3.92 113.70 113.70 1noi s SER 449 Ca 0.40 -0.33 0.28 0.00 1.31 0.00 0.00 55.95 57.61 1noi s SER 449 Cb 0.21 -0.81 1.09 0.00 0.21 0.00 0.00 66.02 66.72 1noi s SER 449 CO 0.28 0.24 1.81 0.00 0.41 0.00 0.00 173.24 175.99 1noi n HIS 450 N 1.34 0.00 -3.75 2.43 -0.00 0.32 -4.87 115.22 110.69 1noi n HIS 450 Ca -0.15 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.44 1noi n HIS 450 Cb 0.52 -0.38 -0.11 0.00 -0.00 0.00 0.00 29.99 30.03 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 -2.89 -0.83 -0.07 1.59 0.00 -1.26 -4.64 121.76 113.66 1noi s ALA 451 Ca 0.17 0.97 0.02 0.00 0.00 0.00 0.00 51.96 53.12 1noi s ALA 451 Cb 0.19 -0.57 0.01 0.00 0.00 0.00 0.00 23.12 22.75 1noi s ALA 451 CO 0.56 -0.16 -0.14 0.08 0.00 0.00 0.00 175.76 176.09 1noi s VAL 452 N 0.26 1.28 0.05 0.00 1.01 -0.21 -1.91 120.40 120.88 1noi s VAL 452 Ca -0.01 -0.56 0.04 0.00 0.00 0.00 0.00 61.98 61.45 1noi s VAL 452 Cb -0.03 -1.16 -0.02 0.00 0.00 0.00 0.00 36.38 35.17 1noi s VAL 452 CO -0.00 0.39 -0.12 0.54 0.00 0.00 0.00 175.10 175.91 1noi s ASN 453 N 0.66 1.36 0.71 3.32 4.22 -0.66 -0.57 114.94 123.98 1noi s ASN 453 Ca -0.14 -0.51 0.01 0.00 -2.14 0.00 0.00 52.86 50.08 1noi s ASN 453 Cb -0.16 -0.04 0.13 0.00 1.28 0.00 0.00 41.25 42.45 1noi s ASN 453 CO 0.04 -0.07 0.97 -0.83 -2.04 0.00 0.00 177.10 175.17 1noi s GLY 454 N -1.39 1.75 0.00 0.45 0.00 -0.90 -1.57 107.32 105.66 1noi s GLY 454 Ca -0.03 -1.84 0.09 0.00 0.00 0.00 0.00 44.72 42.94 1noi s GLY 454 CO 0.01 -1.27 0.97 -0.62 0.00 0.00 0.00 173.10 172.20 1noi n VAL 455 N -2.76 0.45 -3.59 1.40 0.31 -1.26 -1.42 118.33 111.46 1noi n VAL 455 Ca 0.16 -0.72 -0.12 0.00 -0.01 0.00 0.00 64.34 63.64 1noi n VAL 455 Cb 0.61 0.88 -0.06 0.00 -0.91 0.00 0.00 33.84 34.36 1noi n VAL 455 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1noi s ALA 456 N -0.86 -1.90 0.26 3.52 0.00 -1.26 -2.17 121.76 119.35 1noi s ALA 456 Ca 0.14 1.66 -0.02 0.00 0.00 0.00 0.00 51.96 53.75 1noi s ALA 456 Cb 0.09 -0.84 0.48 0.00 0.00 0.00 0.00 23.12 22.85 1noi s ALA 456 CO 0.12 -0.30 1.80 -0.09 0.00 0.00 0.00 175.76 177.29 1noi h ARG 457 N 3.35 0.76 0.00 0.00 2.43 -1.90 0.15 114.38 119.16 1noi h ARG 457 Ca -0.24 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 58.80 1noi h ARG 457 Cb 1.16 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.53 1noi h ARG 457 CO 0.24 0.50 -0.41 -0.84 -1.51 0.00 0.00 179.97 177.95 1noi h ILE 458 N 0.78 0.94 -0.00 1.20 3.07 -1.90 -2.28 117.51 119.32 1noi h ILE 458 Ca 0.44 -1.63 -0.00 0.00 1.55 0.00 0.00 64.86 65.22 1noi h ILE 458 Cb 0.50 1.99 -0.00 0.00 -0.27 0.00 0.00 36.82 39.03 1noi h ILE 458 CO -0.29 0.40 -0.00 -0.74 -1.05 0.00 0.00 178.15 176.47 1noi h HIS 459 N 0.00 0.00 0.00 0.16 2.76 -1.54 -1.39 115.15 115.14 1noi h HIS 459 Ca -0.00 -0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.12 1noi h HIS 459 Cb 0.95 -0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.91 1noi h HIS 459 CO 0.00 0.44 -0.22 0.77 -1.30 0.00 0.00 177.93 177.62 1noi h SER 460 N -0.44 0.00 -0.21 3.26 0.02 -0.65 -2.18 113.55 113.35 1noi h SER 460 Ca 0.00 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.89 1noi h SER 460 Cb 0.44 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 1noi h SER 460 CO 0.00 0.22 -0.11 -0.33 -1.14 0.00 0.00 176.83 175.47 1noi h GLU 461 N 0.00 0.44 0.00 3.45 4.39 -1.14 -2.58 114.58 119.15 1noi h GLU 461 Ca -0.00 -0.20 -0.04 0.00 0.34 0.00 0.00 59.36 59.47 1noi h GLU 461 Cb 0.55 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.18 1noi h GLU 461 CO 0.03 0.73 -0.17 -0.84 -1.16 0.00 0.00 179.01 177.60 1noi h ILE 462 N 0.15 0.52 -0.03 3.13 3.07 -0.98 -0.52 117.51 122.85 1noi h ILE 462 Ca 0.05 -0.85 -0.01 0.00 1.55 0.00 0.00 64.86 65.60 1noi h ILE 462 Cb 0.60 1.58 -0.00 0.00 -0.27 0.00 0.00 36.82 38.73 1noi h ILE 462 CO 0.03 0.17 -0.03 -0.07 -1.05 0.00 0.00 178.15 177.20 1noi h LEU 463 N 0.00 0.08 -2.26 0.16 3.38 -1.17 0.35 115.31 115.84 1noi h LEU 463 Ca -0.00 -0.49 -0.01 0.00 0.09 0.00 0.00 57.88 57.47 1noi h LEU 463 Cb 0.56 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 1noi h LEU 463 CO 0.02 0.55 -0.03 0.11 0.09 0.00 0.00 178.44 179.18 1noi h LYS 464 N -0.40 0.00 0.01 1.13 1.57 -0.99 -0.27 116.57 117.62 1noi h LYS 464 Ca 0.00 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.43 1noi h LYS 464 Cb 0.53 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.78 1noi h LYS 464 CO 0.01 0.03 -2.26 1.63 -0.57 0.00 0.00 179.45 178.29 1noi n LYS 465 N -3.30 0.68 0.00 3.15 5.02 -0.27 -3.78 118.16 119.67 1noi n LYS 465 Ca -0.02 0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 1noi n LYS 465 Cb 0.18 -1.58 0.00 0.00 -0.02 0.00 0.00 35.03 33.61 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 -2.91 0.00 -0.32 -0.18 -2.24 0.12 -4.74 114.28 104.01 1noi n THR 466 Ca -0.32 0.00 0.18 0.00 -2.27 0.00 0.00 64.05 61.65 1noi n THR 466 Cb 1.11 -0.15 0.39 0.00 -2.10 0.00 0.00 70.33 69.58 1noi n THR 466 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1noi h ILE 467 N 0.00 0.38 0.00 2.28 5.03 -1.64 -2.81 117.51 120.75 1noi h ILE 467 Ca 0.00 -0.12 -0.02 0.00 -0.12 0.00 0.00 64.86 64.60 1noi h ILE 467 Cb 0.00 -0.01 -0.04 0.00 -3.03 0.00 0.00 36.82 33.73 1noi h ILE 467 CO 0.00 0.07 -0.35 0.49 -0.68 0.00 0.00 178.15 177.68 1noi n PHE 468 N -5.06 0.00 0.01 1.37 3.72 -0.12 -4.84 117.46 112.54 1noi n PHE 468 Ca 0.27 -0.96 0.02 0.00 -0.05 0.00 0.00 57.45 56.72 1noi n PHE 468 Cb 0.81 -0.17 0.36 0.00 -0.94 0.00 0.00 39.48 39.54 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 0.43 0.52 -0.89 -1.08 2.10 -1.53 -0.98 116.57 115.13 1noi h LYS 469 Ca -0.03 -0.07 0.00 0.00 -2.00 0.00 0.00 60.65 58.55 1noi h LYS 469 Cb 1.16 -0.09 -0.04 0.00 -0.90 0.00 0.00 32.23 32.35 1noi h LYS 469 CO 0.01 0.46 0.57 -0.44 -2.00 0.00 0.00 179.45 178.05 1noi h ASP 470 N 0.51 1.04 -0.26 7.07 3.32 -1.88 0.12 116.42 126.35 1noi h ASP 470 Ca 0.12 -0.04 -0.09 0.00 0.02 0.00 0.00 57.03 57.04 1noi h ASP 470 Cb 0.16 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1noi h ASP 470 CO -0.01 0.78 -0.18 -0.26 -1.72 0.00 0.00 179.24 177.85 1noi h PHE 471 N 1.22 0.67 -0.92 4.55 -1.00 -1.77 -2.39 116.94 117.30 1noi h PHE 471 Ca 0.32 -0.18 0.03 0.00 2.81 0.00 0.00 57.97 60.95 1noi h PHE 471 Cb -0.10 -0.15 -0.05 0.00 3.61 0.00 0.00 35.95 39.26 1noi h PHE 471 CO -0.00 0.86 0.60 -0.92 -1.61 0.00 0.00 178.31 177.24 1noi h TYR 472 N 0.29 1.12 -0.24 -0.55 3.20 -0.27 -0.05 116.97 120.47 1noi h TYR 472 Ca 0.05 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.90 1noi h TYR 472 Cb 0.71 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 1noi h TYR 472 CO 0.07 0.66 -0.06 0.93 -1.64 0.00 0.00 178.16 178.12 1noi h GLU 473 N 1.17 0.37 0.10 1.82 5.08 -0.51 -1.35 114.58 121.28 1noi h GLU 473 Ca 0.36 -0.08 -0.26 0.00 -1.00 0.00 0.00 59.36 58.38 1noi h GLU 473 Cb -0.02 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 1noi h GLU 473 CO -0.10 0.45 -1.19 1.25 -1.00 0.00 0.00 179.01 178.42 1noi h LEU 474 N 0.36 0.36 -5.61 1.33 7.12 -0.66 -3.42 115.31 114.79 1noi h LEU 474 Ca 0.08 -0.38 -0.36 0.00 0.13 0.00 0.00 57.88 57.35 1noi h LEU 474 Cb 0.34 -0.12 -0.26 0.00 -0.53 0.00 0.00 40.66 40.09 1noi h LEU 474 CO 0.01 1.29 -0.73 -0.62 -0.13 0.00 0.00 178.44 178.27 1noi n GLU 475 N -3.51 0.43 -0.26 1.25 1.02 -0.18 -5.01 120.64 114.38 1noi n GLU 475 Ca -0.07 -2.54 -0.02 0.00 -0.02 0.00 0.00 57.16 54.50 1noi n GLU 475 Cb 1.00 -1.53 0.15 0.00 -0.02 0.00 0.00 31.44 31.05 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 5.09 1.10 -0.09 3.49 0.11 -1.50 -0.24 132.00 139.95 1noi h PRO 476 Ca 0.13 -0.13 0.03 0.00 0.11 0.00 0.00 66.00 66.13 1noi h PRO 476 Cb 1.01 -0.21 -0.00 0.00 0.11 0.00 0.00 31.00 31.90 1noi h PRO 476 CO 0.21 0.81 0.07 1.12 -0.21 0.00 0.00 178.00 180.00 1noi h HIS 477 N 1.10 0.00 -0.05 0.65 2.07 -1.95 -2.62 115.15 114.35 1noi h HIS 477 Ca 0.28 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.77 1noi h HIS 477 Cb 0.04 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.02 1noi h HIS 477 CO 0.01 0.00 -0.12 0.87 -3.07 0.00 0.00 177.93 175.62 1noi h LYS 478 N 0.00 0.07 -6.13 5.12 1.57 -1.29 -3.46 116.57 112.45 1noi h LYS 478 Ca 0.04 -0.01 -0.56 0.00 -1.87 0.00 0.00 60.65 58.25 1noi h LYS 478 Cb 0.17 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.42 1noi h LYS 478 CO -0.00 0.19 0.04 -0.06 -0.57 0.00 0.00 179.45 179.06 1noi s PHE 479 N -4.78 3.69 0.35 -1.35 0.40 -0.99 -1.04 117.98 114.25 1noi s PHE 479 Ca -0.05 1.28 0.00 0.00 -0.60 0.00 0.00 56.93 57.56 1noi s PHE 479 Cb 0.16 -2.68 0.00 0.00 0.51 0.00 0.00 43.02 41.01 1noi s PHE 479 CO 0.70 0.31 0.45 1.04 0.70 0.00 0.00 175.22 178.42 1noi n GLN 480 N 2.84 0.65 -4.32 0.44 6.02 0.27 -4.93 117.38 118.36 1noi n GLN 480 Ca -0.05 -2.92 -0.22 0.00 -0.01 0.00 0.00 57.00 53.81 1noi n GLN 480 Cb 0.51 2.72 -0.11 0.00 1.02 0.00 0.00 30.24 34.37 1noi n GLN 480 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1noi s ASN 481 N -3.21 2.59 -0.41 1.08 3.04 -1.26 -2.11 114.94 114.65 1noi s ASN 481 Ca 0.31 -0.83 0.06 0.00 0.04 0.00 0.00 52.86 52.44 1noi s ASN 481 Cb -0.00 -0.14 0.17 0.00 -1.54 0.00 0.00 41.25 39.73 1noi s ASN 481 CO 0.22 -0.03 0.52 -0.54 -3.04 0.00 0.00 177.10 174.23 1noi s LYS 482 N -2.64 0.79 0.19 0.43 -0.14 -0.51 -4.90 119.74 112.95 1noi s LYS 482 Ca 0.13 -0.74 -0.32 0.00 -1.36 0.00 0.00 55.97 53.69 1noi s LYS 482 Cb -0.06 -0.35 -0.12 0.00 -1.68 0.00 0.00 37.83 35.62 1noi s LYS 482 CO 0.06 -1.23 1.74 2.41 -0.76 0.00 0.00 175.35 177.57 1noi n THR 483 N 4.04 0.08 -0.80 2.17 -1.04 -1.26 -4.28 114.28 113.19 1noi n THR 483 Ca 0.13 -0.01 -0.33 0.00 -2.04 0.00 0.00 64.05 61.80 1noi n THR 483 Cb 0.51 -1.99 0.12 0.00 -1.82 0.00 0.00 70.33 67.16 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 4.28 -2.51 -2.42 8.00 3.02 -0.92 -4.54 115.26 120.18 1noi n ASN 484 Ca 0.17 0.25 -0.11 0.00 -0.03 0.00 0.00 54.58 54.85 1noi n ASN 484 Cb 0.35 -1.12 -0.03 0.00 -0.61 0.00 0.00 39.78 38.36 1noi n ASN 484 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1noi n GLY 485 N 1.78 2.79 2.95 7.41 0.00 -1.26 -4.78 105.19 114.08 1noi n GLY 485 Ca 0.05 -1.66 -0.15 0.00 0.00 0.00 0.00 46.02 44.27 1noi n GLY 485 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1noi s ILE 486 N -2.78 0.33 -0.19 -0.61 1.10 0.10 -4.55 121.20 114.59 1noi s ILE 486 Ca 0.23 -0.27 -0.24 0.00 -0.51 0.00 0.00 60.65 59.85 1noi s ILE 486 Cb 0.00 -0.30 -0.01 0.00 0.15 0.00 0.00 42.46 42.30 1noi s ILE 486 CO 0.16 0.03 0.80 0.28 -2.11 0.00 0.00 174.94 174.10 1noi s THR 487 N -0.25 4.89 -1.23 4.00 -1.32 -1.26 0.46 115.64 120.93 1noi s THR 487 Ca -0.00 1.54 0.14 0.00 -1.21 0.00 0.00 61.69 62.16 1noi s THR 487 Cb -0.03 -4.10 0.19 0.00 -1.51 0.00 0.00 72.50 67.05 1noi s THR 487 CO -0.00 0.02 1.41 -0.81 -2.21 0.00 0.00 174.62 173.03 1noi n PRO 488 N 5.39 0.11 0.03 7.08 -0.04 -1.26 -1.95 135.00 144.36 1noi n PRO 488 Ca 0.04 0.20 -0.02 0.00 -0.04 0.00 0.00 63.50 63.68 1noi n PRO 488 Cb 0.49 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.44 1noi n PRO 488 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1noi h ARG 489 N 0.00 -0.13 -0.20 0.54 -0.00 -1.92 -2.79 114.38 109.87 1noi h ARG 489 Ca 0.00 0.01 -0.01 0.00 -0.50 0.00 0.00 59.98 59.48 1noi h ARG 489 Cb 0.18 0.03 -0.01 0.00 0.00 0.00 0.00 29.97 30.17 1noi h ARG 489 CO 0.00 -0.09 0.10 -0.09 0.00 0.00 0.00 179.97 179.89 1noi h ARG 490 N -0.62 0.29 -0.16 0.04 2.43 -1.97 -0.51 114.38 113.89 1noi h ARG 490 Ca -0.01 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1noi h ARG 490 Cb 0.11 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1noi h ARG 490 CO 0.02 0.32 0.00 0.91 -1.51 0.00 0.00 179.97 179.71 1noi n TRP 491 N -4.86 0.20 0.05 2.20 5.03 -0.82 -2.49 117.44 116.75 1noi n TRP 491 Ca -0.04 -0.10 0.00 0.00 3.03 0.00 0.00 57.50 60.39 1noi n TRP 491 Cb 0.10 0.00 0.00 0.00 -1.03 0.00 0.00 31.31 30.38 1noi n TRP 491 CO 0.00 0.00 0.00 -0.11 -0.03 0.00 0.00 177.69 177.55 1noi n LEU 492 N -0.02 -0.23 -0.25 -0.99 0.00 -1.13 -4.82 117.00 109.56 1noi n LEU 492 Ca 0.10 0.17 0.00 0.00 0.00 0.00 0.00 56.01 56.29 1noi n LEU 492 Cb 0.19 0.32 0.13 0.00 0.00 0.00 0.00 43.42 44.06 1noi n LEU 492 CO 0.08 -0.54 1.10 0.58 0.00 0.00 0.00 177.39 178.60 1noi h VAL 493 N 0.00 0.92 0.04 1.96 2.07 -1.20 0.26 116.25 120.30 1noi h VAL 493 Ca 0.00 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.28 1noi h VAL 493 Cb 0.00 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 29.94 1noi h VAL 493 CO 0.00 0.13 -0.02 0.25 0.02 0.00 0.00 177.57 177.95 1noi h LEU 494 N 0.69 -0.04 0.00 2.57 5.85 -1.21 -3.31 115.31 119.85 1noi h LEU 494 Ca 0.34 -0.62 0.00 0.00 0.84 0.00 0.00 57.88 58.44 1noi h LEU 494 Cb 0.28 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.33 1noi h LEU 494 CO -0.23 0.72 -0.39 0.00 -0.34 0.00 0.00 178.44 178.20 1noi n ASN 496 N -2.67 1.19 -0.02 0.00 2.85 0.91 -4.87 115.26 112.66 1noi n ASN 496 Ca 0.03 -2.89 -0.01 0.00 -0.11 0.00 0.00 54.58 51.59 1noi n ASN 496 Cb 0.50 -0.65 0.26 0.00 1.24 0.00 0.00 39.78 41.14 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 4.16 0.57 -0.02 1.20 0.13 -1.70 -1.72 132.00 134.62 1noi h PRO 497 Ca 0.12 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 1noi h PRO 497 Cb 0.82 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 31.87 1noi h PRO 497 CO 0.57 0.62 -0.01 0.78 -0.23 0.00 0.00 178.00 179.73 1noi h GLY 498 N 0.89 0.01 1.34 1.56 0.00 -1.91 -1.71 103.07 103.25 1noi h GLY 498 Ca 0.11 0.01 -0.14 0.00 0.00 0.00 0.00 47.33 47.31 1noi h GLY 498 CO 0.02 -0.01 -0.36 -2.00 0.00 0.00 0.00 176.54 174.18 1noi h LEU 499 N -0.00 0.78 -1.52 3.11 5.85 -1.85 -2.54 115.31 119.14 1noi h LEU 499 Ca 0.01 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.38 1noi h LEU 499 Cb 0.02 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 1noi h LEU 499 CO -0.02 1.06 0.14 0.00 -0.34 0.00 0.00 178.44 179.28 1noi h ALA 500 N 0.98 1.63 0.11 1.25 0.00 -1.20 -2.13 119.26 119.91 1noi h ALA 500 Ca 0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1noi h ALA 500 Cb 0.90 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1noi h ALA 500 CO 0.08 0.30 -0.05 1.49 0.00 0.00 0.00 179.25 181.06 1noi h GLU 501 N 0.46 -0.15 0.00 0.00 4.81 -0.90 -2.11 114.58 116.70 1noi h GLU 501 Ca 0.12 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.31 1noi h GLU 501 Cb 0.08 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 1noi h GLU 501 CO -0.01 0.31 -0.24 -0.84 -0.73 0.00 0.00 179.01 177.50 1noi h ILE 502 N -0.68 0.86 -0.52 2.32 3.07 -1.34 -0.72 117.51 120.50 1noi h ILE 502 Ca -0.02 -0.92 -0.12 0.00 1.55 0.00 0.00 64.86 65.35 1noi h ILE 502 Cb 0.52 1.55 -0.02 0.00 -0.27 0.00 0.00 36.82 38.60 1noi h ILE 502 CO 0.03 0.23 -0.16 0.40 -1.05 0.00 0.00 178.15 177.60 1noi h ILE 503 N 0.00 1.27 0.00 0.16 2.04 -1.40 -3.25 117.51 116.33 1noi h ILE 503 Ca -0.00 -1.33 -0.11 0.00 1.00 0.00 0.00 64.86 64.42 1noi h ILE 503 Cb 0.53 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 1noi h ILE 503 CO 0.03 0.46 -0.51 0.00 0.00 0.00 0.00 178.15 178.13 1noi h ALA 504 N 0.91 1.04 -0.40 1.87 0.00 -0.46 -0.97 119.26 121.24 1noi h ALA 504 Ca 0.13 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1noi h ALA 504 Cb 0.74 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1noi h ALA 504 CO 0.06 0.64 0.26 0.93 0.00 0.00 0.00 179.25 181.14 1noi h GLU 505 N 0.00 0.52 0.00 0.00 5.08 -1.29 -0.92 114.58 117.98 1noi h GLU 505 Ca -0.01 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1noi h GLU 505 Cb 0.98 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.11 1noi h GLU 505 CO 0.07 0.35 -0.00 0.00 -1.00 0.00 0.00 179.01 178.42 1noi h ARG 506 N 0.54 -0.00 -0.27 2.33 2.47 -1.50 -3.40 114.38 114.54 1noi h ARG 506 Ca 0.14 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.86 1noi h ARG 506 Cb -0.06 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.26 1noi h ARG 506 CO -0.03 0.76 0.00 0.44 0.56 0.00 0.00 179.97 181.70 1noi n ILE 507 N -4.65 0.96 -1.00 2.04 -5.35 -0.40 -5.11 119.36 105.84 1noi n ILE 507 Ca -0.08 -0.98 0.00 0.00 -0.27 0.00 0.00 62.75 61.42 1noi n ILE 507 Cb 0.37 0.53 0.00 0.00 -1.74 0.00 0.00 39.64 38.80 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 0.33 -2.63 0.23 3.28 0.00 -0.35 -4.67 105.19 101.39 1noi n GLY 508 Ca 0.09 -1.75 0.10 0.00 0.00 0.00 0.00 46.02 44.46 1noi n GLY 508 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1noi n GLU 509 N -0.33 1.59 0.23 1.61 1.02 -1.26 -4.23 120.64 119.27 1noi n GLU 509 Ca 0.00 -2.64 0.15 0.00 -0.02 0.00 0.00 57.16 54.65 1noi n GLU 509 Cb 0.00 -1.57 0.57 0.00 -0.02 0.00 0.00 31.44 30.42 1noi n GLU 509 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1noi h GLU 510 N 0.35 0.00 -0.16 3.49 4.81 -1.96 -3.14 114.58 117.97 1noi h GLU 510 Ca 0.00 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1noi h GLU 510 Cb 1.09 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.46 1noi h GLU 510 CO 0.04 0.00 0.11 0.10 -0.73 0.00 0.00 179.01 178.53 1noi h TYR 511 N 0.00 0.18 -0.90 0.92 -0.00 -1.81 -2.69 116.97 112.68 1noi h TYR 511 Ca 0.00 0.00 0.25 0.00 -0.00 0.00 0.00 58.73 58.99 1noi h TYR 511 Cb 0.53 -0.06 -0.04 0.00 -0.00 0.00 0.00 36.73 37.16 1noi h TYR 511 CO 0.00 0.11 0.64 0.82 -0.00 0.00 0.00 178.16 179.73 1noi h ILE 512 N 0.19 0.56 0.00 -0.90 2.04 -1.92 -2.49 117.51 115.00 1noi h ILE 512 Ca 0.06 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.91 1noi h ILE 512 Cb 0.00 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 36.61 1noi h ILE 512 CO -0.01 0.01 -0.10 -1.54 0.00 0.00 0.00 178.15 176.50 1noi n SER 513 N -4.29 1.61 -2.90 1.72 3.41 -1.04 -4.64 113.62 107.48 1noi n SER 513 Ca 0.19 -2.48 -0.13 0.00 -0.26 0.00 0.00 58.87 56.18 1noi n SER 513 Cb 0.94 -0.26 0.01 0.00 -0.26 0.00 0.00 64.21 64.63 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 -0.84 -1.97 0.19 4.04 2.03 -0.96 -5.02 116.55 114.01 1noi n ASP 514 Ca 0.08 -3.06 0.14 0.00 0.52 0.00 0.00 54.79 52.47 1noi n ASP 514 Cb 0.56 1.02 0.66 0.00 -0.72 0.00 0.00 41.12 42.64 1noi n ASP 514 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1noi h LEU 515 N 4.15 0.00 -2.16 -2.67 5.85 -1.78 -1.76 115.31 116.94 1noi h LEU 515 Ca -0.05 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 1noi h LEU 515 Cb 0.99 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.02 1noi h LEU 515 CO 0.34 0.00 -0.06 0.44 -0.34 0.00 0.00 178.44 178.83 1noi h ASP 516 N 0.00 0.00 -0.42 1.25 3.32 -1.87 -1.93 116.42 116.76 1noi h ASP 516 Ca 0.00 0.00 0.12 0.00 0.02 0.00 0.00 57.03 57.17 1noi h ASP 516 Cb 0.17 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 1noi h ASP 516 CO 0.00 0.06 0.48 1.56 -1.72 0.00 0.00 179.24 179.61 1noi h GLN 517 N 0.00 0.00 0.00 3.56 4.20 -1.67 -1.12 115.11 120.08 1noi h GLN 517 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1noi h GLN 517 Cb 0.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1noi h GLN 517 CO 0.01 0.00 0.05 -0.07 -0.67 0.00 0.00 178.83 178.15 1noi h LEU 518 N 0.00 0.00 -2.54 1.46 3.38 -1.57 -1.84 115.31 114.19 1noi h LEU 518 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1noi h LEU 518 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1noi h LEU 518 CO -0.00 0.00 0.14 0.03 0.09 0.00 0.00 178.44 178.70 1noi h ARG 519 N 0.00 0.00 0.00 1.13 3.08 -0.83 -1.30 114.38 116.46 1noi h ARG 519 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1noi h ARG 519 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1noi h ARG 519 CO 0.00 0.00 0.00 1.63 -1.07 0.00 0.00 179.97 180.53 1noi n LYS 520 N -2.97 0.01 0.00 0.04 5.02 -0.69 -2.42 118.16 117.15 1noi n LYS 520 Ca -0.03 0.33 0.12 0.00 -2.02 0.00 0.00 58.31 56.71 1noi n LYS 520 Cb 0.20 -1.50 0.15 0.00 -0.02 0.00 0.00 35.03 33.85 1noi n LYS 520 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1noi n LEU 521 N -1.48 1.18 -0.09 -0.35 7.94 -0.49 -3.84 117.00 119.87 1noi n LEU 521 Ca 0.02 -0.39 -0.09 0.00 -1.11 0.00 0.00 56.01 54.45 1noi n LEU 521 Cb 0.10 -0.09 0.06 0.00 0.53 0.00 0.00 43.42 44.02 1noi n LEU 521 CO 0.08 0.24 0.66 0.25 -1.11 0.00 0.00 177.39 177.51 1noi h LEU 522 N 1.04 0.82 0.00 -1.96 5.85 -1.68 -1.04 115.31 118.35 1noi h LEU 522 Ca 0.00 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.40 1noi h LEU 522 Cb 0.57 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.37 1noi h LEU 522 CO 0.00 1.05 0.11 -1.20 -0.34 0.00 0.00 178.44 178.06 1noi n SER 523 N -4.09 0.00 -0.30 1.25 7.64 -1.25 -1.53 113.62 115.34 1noi n SER 523 Ca -0.01 0.28 0.06 0.00 1.01 0.00 0.00 58.87 60.22 1noi n SER 523 Cb 0.47 -0.28 0.12 0.00 -1.01 0.00 0.00 64.21 63.51 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 -1.25 0.26 0.21 1.43 4.02 -0.39 -4.67 117.16 116.76 1noi n TYR 524 Ca 0.00 -0.75 0.07 0.00 -0.01 0.00 0.00 57.90 57.21 1noi n TYR 524 Cb 0.11 -0.13 0.59 0.00 -0.02 0.00 0.00 39.34 39.89 1noi n TYR 524 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 1noi h VAL 525 N 0.67 1.03 -0.41 -0.72 2.07 -1.35 -1.86 116.25 115.68 1noi h VAL 525 Ca 0.00 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1noi h VAL 525 Cb 0.89 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 1noi h VAL 525 CO 0.04 0.03 0.00 0.47 0.02 0.00 0.00 177.57 178.14 1noi n ASP 526 N -4.51 3.27 -4.59 0.57 8.00 -1.26 -4.84 116.55 113.18 1noi n ASP 526 Ca -0.02 -1.93 -0.43 0.00 0.71 0.00 0.00 54.79 53.12 1noi n ASP 526 Cb 0.10 -0.27 -0.04 0.00 -0.02 0.00 0.00 41.12 40.88 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 -1.19 6.62 0.57 -2.24 -1.08 -0.70 -4.92 116.67 113.74 1noi s ASP 527 Ca 0.34 0.46 0.27 0.00 -0.52 0.00 0.00 52.55 53.10 1noi s ASP 527 Cb 0.19 -2.45 1.57 0.00 -1.46 0.00 0.00 42.92 40.77 1noi s ASP 527 CO 0.26 -0.87 2.07 -0.33 0.52 0.00 0.00 175.17 176.81 1noi h GLU 528 N 8.59 0.00 -0.02 4.34 4.39 -1.92 -1.41 114.58 128.55 1noi h GLU 528 Ca -0.24 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.26 1noi h GLU 528 Cb 1.08 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.75 1noi h GLU 528 CO 0.98 0.00 -0.80 0.00 -1.16 0.00 0.00 179.01 178.03 1noi h ALA 529 N 1.75 0.13 0.11 3.43 0.00 -1.96 -2.15 119.26 120.57 1noi h ALA 529 Ca 0.12 -0.62 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1noi h ALA 529 Cb 0.60 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1noi h ALA 529 CO -0.00 0.53 -0.05 0.35 0.00 0.00 0.00 179.25 180.07 1noi h PHE 530 N 0.18 -0.14 -0.60 0.00 3.57 -1.61 -0.71 116.94 117.64 1noi h PHE 530 Ca -0.09 -0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.52 1noi h PHE 530 Cb 1.48 0.05 -0.09 0.00 2.79 0.00 0.00 35.95 40.17 1noi h PHE 530 CO 0.12 0.15 0.07 0.82 -2.23 0.00 0.00 178.31 177.23 1noi h ILE 531 N -0.42 0.58 0.00 1.41 2.04 -1.42 -0.01 117.51 119.69 1noi h ILE 531 Ca -0.02 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.78 1noi h ILE 531 Cb 0.35 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 1noi h ILE 531 CO 0.03 0.03 0.00 0.08 0.00 0.00 0.00 178.15 178.29 1noi h ARG 532 N 0.19 0.00 -0.05 2.37 0.11 -0.93 -2.81 114.38 113.27 1noi h ARG 532 Ca 0.31 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.36 1noi h ARG 532 Cb 0.49 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.57 1noi h ARG 532 CO -0.45 0.00 -0.09 -0.44 0.10 0.00 0.00 179.97 179.09 1noi h ASP 533 N 0.00 0.16 -0.76 0.08 5.19 0.41 -1.42 116.42 120.09 1noi h ASP 533 Ca 0.00 -0.57 0.10 0.00 -0.62 0.00 0.00 57.03 55.94 1noi h ASP 533 Cb 0.87 -0.05 -0.07 0.00 0.18 0.00 0.00 39.33 40.26 1noi h ASP 533 CO 0.00 0.70 0.41 0.58 -3.12 0.00 0.00 179.24 177.80 1noi h VAL 534 N -0.37 0.87 0.00 -1.35 2.07 -1.06 -1.33 116.25 115.08 1noi h VAL 534 Ca 0.00 -0.23 -0.05 0.00 0.82 0.00 0.00 66.70 67.24 1noi h VAL 534 Cb 0.67 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 1noi h VAL 534 CO 0.02 0.12 -0.22 0.00 0.02 0.00 0.00 177.57 177.52 1noi h ALA 535 N 1.45 0.96 -0.15 1.67 0.00 -1.46 -2.75 119.26 118.97 1noi h ALA 535 Ca 0.37 -0.20 -0.19 0.00 0.00 0.00 0.00 54.91 54.90 1noi h ALA 535 Cb 0.38 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.14 1noi h ALA 535 CO -0.26 0.27 -0.65 -0.22 0.00 0.00 0.00 179.25 178.39 1noi h LYS 536 N 0.00 0.71 0.31 0.00 1.63 -0.18 -2.26 116.57 116.78 1noi h LYS 536 Ca -0.00 -0.56 -0.02 0.00 -0.85 0.00 0.00 60.65 59.22 1noi h LYS 536 Cb 0.85 0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.59 1noi h LYS 536 CO 0.03 1.17 -0.15 0.28 -3.45 0.00 0.00 179.45 177.33 1noi h VAL 537 N 0.40 0.71 -0.75 2.00 2.07 -1.36 0.99 116.25 120.32 1noi h VAL 537 Ca -0.04 -0.20 0.06 0.00 0.82 0.00 0.00 66.70 67.34 1noi h VAL 537 Cb 1.28 0.83 -0.06 0.00 -1.52 0.00 0.00 31.29 31.82 1noi h VAL 537 CO 0.14 0.04 0.44 0.50 0.02 0.00 0.00 177.57 178.71 1noi h LYS 538 N -0.53 0.79 -0.00 1.57 1.63 -1.52 0.19 116.57 118.69 1noi h LYS 538 Ca -0.04 -0.05 -0.08 0.00 -0.85 0.00 0.00 60.65 59.63 1noi h LYS 538 Cb 0.39 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 31.83 1noi h LYS 538 CO 0.07 0.52 -0.37 0.37 -3.45 0.00 0.00 179.45 176.59 1noi h GLN 539 N 0.81 0.01 -0.06 1.90 4.15 -1.01 -2.14 115.11 118.77 1noi h GLN 539 Ca 0.33 -0.00 -0.17 0.00 0.77 0.00 0.00 58.65 59.57 1noi h GLN 539 Cb 0.17 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.85 1noi h GLN 539 CO -0.17 0.38 -0.71 0.93 -1.93 0.00 0.00 178.83 177.33 1noi h GLU 540 N 0.01 0.29 -0.32 1.69 5.08 0.19 -1.31 114.58 120.22 1noi h GLU 540 Ca -0.00 -0.24 -0.06 0.00 -1.00 0.00 0.00 59.36 58.06 1noi h GLU 540 Cb 0.66 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 1noi h GLU 540 CO 0.05 0.89 -0.02 -0.91 -1.00 0.00 0.00 179.01 178.01 1noi h ASN 541 N 0.20 0.57 -0.30 1.42 -0.26 -0.96 -1.32 115.58 114.93 1noi h ASN 541 Ca -0.02 -0.33 -0.01 0.00 -0.56 0.00 0.00 56.30 55.38 1noi h ASN 541 Cb 1.27 -0.15 -0.01 0.00 -1.06 0.00 0.00 38.32 38.36 1noi h ASN 541 CO 0.11 0.76 0.16 0.11 -1.06 0.00 0.00 177.43 177.51 1noi h LYS 542 N 0.36 0.42 -0.56 0.81 1.57 -1.32 0.19 116.57 118.04 1noi h LYS 542 Ca 0.09 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1noi h LYS 542 Cb 0.48 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.68 1noi h LYS 542 CO 0.02 0.38 0.30 1.25 -0.57 0.00 0.00 179.45 180.82 1noi h LEU 543 N 0.36 0.71 -0.27 2.94 7.12 -1.11 0.31 115.31 125.36 1noi h LEU 543 Ca 0.10 -0.10 -0.02 0.00 0.13 0.00 0.00 57.88 57.99 1noi h LEU 543 Cb 0.08 -0.18 -0.01 0.00 -0.53 0.00 0.00 40.66 40.02 1noi h LEU 543 CO -0.02 0.61 0.10 0.50 -0.13 0.00 0.00 178.44 179.51 1noi h LYS 544 N 0.76 0.41 -0.21 1.25 3.64 -1.00 -1.88 116.57 119.54 1noi h LYS 544 Ca 0.20 -0.08 -0.17 0.00 -1.27 0.00 0.00 60.65 59.33 1noi h LYS 544 Cb 0.07 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1noi h LYS 544 CO -0.03 0.46 -0.55 0.35 -2.27 0.00 0.00 179.45 177.41 1noi h PHE 545 N 0.28 0.80 -0.64 1.91 3.57 -0.09 -0.36 116.94 122.42 1noi h PHE 545 Ca 0.09 -0.29 0.10 0.00 3.53 0.00 0.00 57.97 61.40 1noi h PHE 545 Cb 0.21 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 38.76 1noi h PHE 545 CO -0.00 1.04 0.43 0.00 -2.23 0.00 0.00 178.31 177.55 1noi h ALA 546 N 0.90 1.97 0.06 2.41 0.00 -0.16 -1.00 119.26 123.45 1noi h ALA 546 Ca 0.01 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.61 1noi h ALA 546 Cb 1.11 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1noi h ALA 546 CO 0.11 -0.11 -1.56 0.00 0.00 0.00 0.00 179.25 177.68 1noi h ALA 547 N 1.68 0.46 -0.37 0.00 0.00 -0.62 -3.30 119.26 117.11 1noi h ALA 547 Ca 0.29 -1.23 0.03 0.00 0.00 0.00 0.00 54.91 54.01 1noi h ALA 547 Cb 0.53 0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 1noi h ALA 547 CO -0.09 1.32 0.17 -0.92 0.00 0.00 0.00 179.25 179.73 1noi h TYR 548 N 0.04 0.31 0.00 0.00 5.03 -0.64 -0.97 116.97 120.73 1noi h TYR 548 Ca -0.24 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.08 1noi h TYR 548 Cb 1.98 -0.08 0.00 0.00 1.55 0.00 0.00 36.73 40.18 1noi h TYR 548 CO 0.04 0.15 0.23 -0.11 -1.32 0.00 0.00 178.16 177.15 1noi n LEU 549 N -4.96 0.27 -0.15 2.82 7.94 -0.42 -0.66 117.00 121.84 1noi n LEU 549 Ca 0.01 0.52 0.01 0.00 -1.11 0.00 0.00 56.01 55.44 1noi n LEU 549 Cb 0.10 -0.50 0.02 0.00 0.53 0.00 0.00 43.42 43.58 1noi n LEU 549 CO 0.29 -0.61 0.34 -0.62 -1.11 0.00 0.00 177.39 175.68 1noi n GLU 550 N -1.88 0.70 -0.12 1.96 1.02 -0.90 -2.58 120.64 118.86 1noi n GLU 550 Ca -0.01 -1.09 -0.23 0.00 -0.02 0.00 0.00 57.16 55.81 1noi n GLU 550 Cb 0.24 -0.72 -0.09 0.00 -0.02 0.00 0.00 31.44 30.85 1noi n GLU 550 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1noi n ARG 551 N -0.27 0.56 -4.80 3.49 0.63 0.16 -4.81 116.66 111.62 1noi n ARG 551 Ca 0.02 0.39 -0.33 0.00 -0.92 0.00 0.00 57.85 57.01 1noi n ARG 551 Cb 0.53 -1.59 -0.15 0.00 0.45 0.00 0.00 32.46 31.70 1noi n ARG 551 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 1noi s GLU 552 N -2.48 3.31 1.01 -0.14 8.01 -0.32 -5.00 118.70 123.09 1noi s GLU 552 Ca -0.32 -0.72 0.00 0.00 0.01 0.00 0.00 54.97 53.94 1noi s GLU 552 Cb 0.10 -2.59 0.00 0.00 -4.31 0.00 0.00 34.13 27.33 1noi s GLU 552 CO 0.50 0.18 0.00 0.66 0.01 0.00 0.00 175.26 176.60 1noi n TYR 553 N 3.61 -1.19 0.00 1.61 4.01 -1.26 -4.17 117.16 119.78 1noi n TYR 553 Ca -0.18 0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.57 1noi n TYR 553 Cb 0.53 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.56 1noi n TYR 553 CO 0.00 0.00 0.00 0.36 -0.46 0.00 0.00 176.86 176.76 1noi n LYS 554 N -0.29 0.00 0.00 -0.72 -0.00 -1.06 -4.10 118.16 111.99 1noi n LYS 554 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1noi n LYS 554 Cb 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.04 1noi n LYS 554 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1noi n VAL 555 N -0.07 0.00 0.00 0.58 0.31 -1.26 -5.01 118.33 112.88 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 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 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 -4.63 3.52 -0.00 -1.26 -5.14 115.22 107.70 1noi n HIS 556 Ca 0.00 0.00 -0.33 0.00 0.46 0.00 0.00 57.72 57.85 1noi n HIS 556 Cb 0.00 0.00 -0.16 0.00 -0.12 0.00 0.00 29.99 29.71 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 2.43 -0.55 3.57 1.09 -1.26 -5.04 121.20 121.44 1noi s ILE 557 Ca 0.00 -0.85 -0.28 0.00 -1.10 0.00 0.00 60.65 58.41 1noi s ILE 557 Cb 0.00 -2.00 0.02 0.00 -1.06 0.00 0.00 42.46 39.42 1noi s ILE 557 CO 0.00 0.53 1.25 0.21 -0.10 0.00 0.00 174.94 176.83 1noi s ASN 558 N 0.77 6.39 0.00 3.58 2.47 -1.26 -4.92 114.94 121.97 1noi s ASN 558 Ca -0.07 0.25 0.13 0.00 0.42 0.00 0.00 52.86 53.59 1noi s ASN 558 Cb -0.16 -2.55 0.77 0.00 -1.45 0.00 0.00 41.25 37.86 1noi s ASN 558 CO 0.00 -1.50 1.21 -0.81 -3.72 0.00 0.00 177.10 172.28 1noi n PRO 559 N 8.39 0.56 0.03 0.43 -0.04 -1.26 -2.29 135.00 140.82 1noi n PRO 559 Ca 0.10 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.68 1noi n PRO 559 Cb 0.49 -1.36 -0.11 0.00 -0.04 0.00 0.00 33.50 32.48 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 -0.86 0.28 -4.62 3.54 4.13 -1.26 -4.79 115.26 111.68 1noi n ASN 560 Ca 0.10 0.09 -0.29 0.00 1.68 0.00 0.00 54.58 56.15 1noi n ASN 560 Cb 0.04 1.49 0.19 0.00 -1.54 0.00 0.00 39.78 39.96 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 -4.76 2.33 -0.17 6.41 1.04 -0.97 -4.96 113.70 112.62 1noi s SER 561 Ca -0.05 1.58 -0.29 0.00 0.48 0.00 0.00 55.95 57.66 1noi s SER 561 Cb 0.13 -2.24 -0.01 0.00 0.10 0.00 0.00 66.02 63.99 1noi s SER 561 CO 0.87 -3.37 1.28 -0.22 0.98 0.00 0.00 173.24 172.78 1noi s LEU 562 N -6.69 4.16 -0.54 2.42 0.20 -0.42 -4.80 118.68 113.02 1noi s LEU 562 Ca 0.66 1.67 -0.26 0.00 0.69 0.00 0.00 54.13 56.89 1noi s LEU 562 Cb -0.21 -3.54 0.03 0.00 -0.43 0.00 0.00 46.19 42.04 1noi s LEU 562 CO 0.60 -0.79 1.02 -0.36 -0.29 0.00 0.00 176.35 176.53 1noi s PHE 563 N 3.59 2.76 -0.40 5.38 0.40 -1.26 -1.11 117.98 127.34 1noi s PHE 563 Ca 0.55 0.21 -0.13 0.00 -0.60 0.00 0.00 56.93 56.97 1noi s PHE 563 Cb -0.22 -4.21 0.04 0.00 0.51 0.00 0.00 43.02 39.15 1noi s PHE 563 CO 0.16 -1.38 0.27 0.34 0.70 0.00 0.00 175.22 175.31 1noi s ASP 564 N 2.76 5.90 -0.02 1.36 -1.08 0.69 -0.21 116.67 126.07 1noi s ASP 564 Ca 0.36 -1.07 0.04 0.00 -0.52 0.00 0.00 52.55 51.36 1noi s ASP 564 Cb -0.10 -2.08 -0.01 0.00 -1.46 0.00 0.00 42.92 39.27 1noi s ASP 564 CO 0.23 -0.46 -0.13 0.54 0.52 0.00 0.00 175.17 175.87 1noi s VAL 565 N 1.59 1.04 -0.30 1.11 0.11 0.02 -1.24 120.40 122.73 1noi s VAL 565 Ca 0.03 -0.54 0.02 0.00 -2.93 0.00 0.00 61.98 58.57 1noi s VAL 565 Cb -0.20 -0.88 0.08 0.00 -1.53 0.00 0.00 36.38 33.85 1noi s VAL 565 CO 0.07 0.30 0.00 -1.58 -3.33 0.00 0.00 175.10 170.57 1noi s GLN 566 N -0.15 1.53 -0.18 1.54 0.74 -0.32 -1.02 119.66 121.80 1noi s GLN 566 Ca 0.02 -1.45 0.01 0.00 0.05 0.00 0.00 55.36 53.99 1noi s GLN 566 Cb -0.07 -2.82 0.03 0.00 1.10 0.00 0.00 33.01 31.26 1noi s GLN 566 CO 0.00 -0.80 -0.13 0.14 -0.55 0.00 0.00 175.29 173.95 1noi s VAL 567 N 1.16 1.69 0.00 1.34 -7.23 -1.26 -1.29 120.40 114.81 1noi s VAL 567 Ca 0.03 -0.91 0.00 0.00 -1.81 0.00 0.00 61.98 59.30 1noi s VAL 567 Cb -0.19 -1.68 0.00 0.00 0.56 0.00 0.00 36.38 35.07 1noi s VAL 567 CO -0.10 0.30 0.00 2.29 -0.31 0.00 0.00 175.10 177.28 1noi n LYS 568 N 4.69 0.00 -1.71 4.82 2.85 -0.76 -4.99 118.16 123.07 1noi n LYS 568 Ca -0.16 0.00 -0.39 0.00 -1.05 0.00 0.00 58.31 56.71 1noi n LYS 568 Cb 0.48 0.00 0.04 0.00 -0.65 0.00 0.00 35.03 34.90 1noi n LYS 568 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1noi n ARG 569 N -0.02 1.48 -2.46 -1.58 1.74 -1.26 -3.87 116.66 110.69 1noi n ARG 569 Ca 0.00 0.55 -0.43 0.00 -0.77 0.00 0.00 57.85 57.20 1noi n ARG 569 Cb 0.00 -2.45 -0.02 0.00 -1.02 0.00 0.00 32.46 28.97 1noi n ARG 569 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1noi s ILE 570 N -1.33 4.31 -0.24 0.55 -1.09 -0.99 -4.87 121.20 117.55 1noi s ILE 570 Ca 0.72 1.57 -0.20 0.00 -2.23 0.00 0.00 60.65 60.51 1noi s ILE 570 Cb -0.43 -4.07 0.06 0.00 -1.58 0.00 0.00 42.46 36.44 1noi s ILE 570 CO 0.49 -0.21 0.63 -2.28 -1.23 0.00 0.00 174.94 172.34 1noi s HIS 571 N 3.62 -0.73 0.24 3.97 2.46 -1.26 -4.69 115.29 118.89 1noi s HIS 571 Ca 0.53 1.72 -0.06 0.00 0.47 0.00 0.00 55.06 57.73 1noi s HIS 571 Cb -0.20 0.29 0.43 0.00 -0.13 0.00 0.00 32.58 32.97 1noi s HIS 571 CO 0.15 -0.36 1.70 0.93 -2.47 0.00 0.00 174.74 174.70 1noi h GLU 572 N 5.48 0.31 0.00 2.88 5.08 -1.96 -1.85 114.58 124.52 1noi h GLU 572 Ca -0.29 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.05 1noi h GLU 572 Cb 1.18 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.35 1noi h GLU 572 CO 0.12 0.21 -0.00 0.10 -1.00 0.00 0.00 179.01 178.44 1noi h TYR 573 N 0.32 0.00 0.00 4.33 -0.00 -1.97 -2.44 116.97 117.21 1noi h TYR 573 Ca 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 59.13 1noi h TYR 573 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.37 1noi h TYR 573 CO -0.23 0.00 -0.22 0.87 -0.00 0.00 0.00 178.16 178.59 1noi h LYS 574 N 0.00 0.00 -5.74 0.10 1.57 -1.67 -3.20 116.57 107.63 1noi h LYS 574 Ca -0.00 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.45 1noi h LYS 574 Cb 0.04 0.00 0.15 0.00 0.08 0.00 0.00 32.23 32.49 1noi h LYS 574 CO 0.00 0.00 -0.84 0.54 -0.57 0.00 0.00 179.45 178.58 1noi n ARG 575 N -2.36 -3.98 0.25 3.15 1.74 -0.92 -4.20 116.66 110.34 1noi n ARG 575 Ca 0.04 0.76 0.10 0.00 -0.77 0.00 0.00 57.85 57.99 1noi n ARG 575 Cb 0.45 -5.49 0.63 0.00 -1.02 0.00 0.00 32.46 27.04 1noi n ARG 575 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1noi h GLN 576 N -1.59 0.00 -0.70 5.56 7.50 -1.85 -0.88 115.11 123.15 1noi h GLN 576 Ca -0.61 0.00 -0.05 0.00 0.50 0.00 0.00 58.65 58.49 1noi h GLN 576 Cb 1.34 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 28.84 1noi h GLN 576 CO 0.49 0.17 0.24 -0.07 -1.50 0.00 0.00 178.83 178.15 1noi h LEU 577 N 0.00 1.00 -0.54 1.46 3.38 -1.92 -0.66 115.31 118.03 1noi h LEU 577 Ca -0.00 -0.20 0.05 0.00 0.09 0.00 0.00 57.88 57.83 1noi h LEU 577 Cb 0.42 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 1noi h LEU 577 CO 0.02 0.93 0.26 0.25 0.09 0.00 0.00 178.44 179.99 1noi h LEU 578 N 1.01 0.36 -0.72 1.67 5.85 -1.54 -0.88 115.31 121.06 1noi h LEU 578 Ca 0.23 0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.92 1noi h LEU 578 Cb 0.27 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 1noi h LEU 578 CO -0.01 0.24 0.18 -1.13 -0.34 0.00 0.00 178.44 177.38 1noi h ASN 579 N 0.50 1.09 -0.75 1.25 -0.00 -1.29 -1.72 115.58 114.66 1noi h ASN 579 Ca 0.25 -0.23 0.07 0.00 -0.00 0.00 0.00 56.30 56.39 1noi h ASN 579 Cb 0.18 -0.29 -0.05 0.00 -0.00 0.00 0.00 38.32 38.17 1noi h ASN 579 CO -0.19 1.03 0.49 0.00 -0.00 0.00 0.00 177.43 178.77 1noi h LEU 581 N 0.76 0.82 -0.07 0.00 3.38 -0.29 -2.27 115.31 117.63 1noi h LEU 581 Ca 0.33 -0.25 -0.18 0.00 0.09 0.00 0.00 57.88 57.86 1noi h LEU 581 Cb 0.30 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 40.84 1noi h LEU 581 CO -0.11 0.95 -0.66 -0.74 0.09 0.00 0.00 178.44 177.97 1noi h HIS 582 N 0.74 0.80 -0.84 1.13 2.76 -0.92 -1.97 115.15 116.86 1noi h HIS 582 Ca 0.12 -0.39 0.10 0.00 -2.20 0.00 0.00 60.37 58.00 1noi h HIS 582 Cb 0.62 -0.11 -0.07 0.00 1.55 0.00 0.00 27.41 29.39 1noi h HIS 582 CO 0.03 1.19 0.48 0.28 -1.30 0.00 0.00 177.93 178.62 1noi h VAL 583 N 0.19 0.91 -0.17 5.26 2.07 -0.87 -0.89 116.25 122.74 1noi h VAL 583 Ca -0.06 -0.27 -0.16 0.00 0.82 0.00 0.00 66.70 67.03 1noi h VAL 583 Cb 1.32 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1noi h VAL 583 CO 0.13 0.15 -0.50 0.40 0.02 0.00 0.00 177.57 177.77 1noi h ILE 584 N 0.80 1.33 -0.38 4.57 2.04 -1.46 -0.65 117.51 123.75 1noi h ILE 584 Ca 0.40 -1.74 0.08 0.00 1.00 0.00 0.00 64.86 64.60 1noi h ILE 584 Cb 0.38 1.95 -0.09 0.00 -0.74 0.00 0.00 36.82 38.32 1noi h ILE 584 CO -0.25 0.54 -0.29 0.74 0.00 0.00 0.00 178.15 178.89 1noi h THR 585 N 0.32 0.28 -0.71 -0.27 2.02 -0.56 0.27 112.91 114.26 1noi h THR 585 Ca -0.01 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.22 1noi h THR 585 Cb 1.12 0.28 -0.05 0.00 -1.74 0.00 0.00 68.15 67.76 1noi h THR 585 CO 0.11 0.00 0.41 -0.07 0.37 0.00 0.00 175.52 176.34 1noi h LEU 586 N -0.23 0.64 -0.60 2.58 4.07 -1.07 0.52 115.31 121.23 1noi h LEU 586 Ca 0.18 0.02 -0.03 0.00 0.08 0.00 0.00 57.88 58.13 1noi h LEU 586 Cb 0.51 -0.11 -0.03 0.00 1.08 0.00 0.00 40.66 42.11 1noi h LEU 586 CO -0.51 0.42 0.27 0.22 -1.08 0.00 0.00 178.44 177.76 1noi h TYR 587 N 0.77 0.88 -0.65 1.13 3.20 -0.19 -2.96 116.97 119.15 1noi h TYR 587 Ca 0.31 -0.05 -0.09 0.00 3.14 0.00 0.00 58.73 62.04 1noi h TYR 587 Cb 0.15 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.12 1noi h TYR 587 CO -0.06 0.69 0.07 -0.91 -1.64 0.00 0.00 178.16 176.30 1noi h ASN 588 N 0.82 1.06 -0.33 -2.11 2.35 0.82 -2.09 115.58 116.11 1noi h ASN 588 Ca 0.20 -0.28 0.04 0.00 -0.55 0.00 0.00 56.30 55.71 1noi h ASN 588 Cb 0.15 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 38.21 1noi h ASN 588 CO -0.02 1.07 0.11 -0.09 -1.65 0.00 0.00 177.43 176.85 1noi h ARG 589 N 1.01 0.25 -0.50 0.81 9.65 -0.83 -1.85 114.38 122.92 1noi h ARG 589 Ca 0.19 -0.01 -0.10 0.00 -1.10 0.00 0.00 59.98 58.96 1noi h ARG 589 Cb 0.49 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.99 1noi h ARG 589 CO 0.02 0.16 -0.08 0.82 2.80 0.00 0.00 179.97 183.69 1noi h ILE 590 N 0.25 1.27 -0.13 1.20 2.04 -1.41 -1.38 117.51 119.36 1noi h ILE 590 Ca 0.15 -1.21 -0.04 0.00 1.00 0.00 0.00 64.86 64.76 1noi h ILE 590 Cb 0.12 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 1noi h ILE 590 CO -0.15 0.42 -0.10 0.11 0.00 0.00 0.00 178.15 178.43 1noi h LYS 591 N 0.80 0.19 0.08 2.37 1.79 -0.98 0.24 116.57 121.06 1noi h LYS 591 Ca 0.13 -0.04 -0.26 0.00 -2.18 0.00 0.00 60.65 58.31 1noi h LYS 591 Cb 0.63 -0.03 0.01 0.00 -1.58 0.00 0.00 32.23 31.26 1noi h LYS 591 CO 0.04 0.31 -1.12 -0.22 -1.08 0.00 0.00 179.45 177.38 1noi h LYS 592 N 0.18 0.39 -2.37 3.15 3.64 -0.96 -3.41 116.57 117.19 1noi h LYS 592 Ca 0.04 -0.52 -0.59 0.00 -1.27 0.00 0.00 60.65 58.31 1noi h LYS 592 Cb 0.30 0.17 -0.40 0.00 -0.41 0.00 0.00 32.23 31.90 1noi h LYS 592 CO 0.02 1.20 -0.85 0.39 -2.27 0.00 0.00 179.45 177.93 1noi n GLU 593 N -3.67 1.17 0.00 1.90 1.02 -0.55 -4.97 120.64 115.53 1noi n GLU 593 Ca -0.09 -3.78 0.00 0.00 -0.02 0.00 0.00 57.16 53.28 1noi n GLU 593 Cb 0.94 -1.79 0.00 0.00 -0.02 0.00 0.00 31.44 30.57 1noi n GLU 593 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1noi n PRO 594 N 1.83 0.00 0.00 3.49 -0.02 0.03 -1.17 135.00 139.15 1noi n PRO 594 Ca 0.25 0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 1noi n PRO 594 Cb 0.45 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.43 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 -1.05 0.71 -4.83 2.55 3.02 -1.26 -5.04 115.26 109.37 1noi n ASN 595 Ca 0.00 -0.93 -0.32 0.00 -0.03 0.00 0.00 54.58 53.30 1noi n ASN 595 Cb 0.00 0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.27 1noi n ASN 595 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1noi s LYS 596 N -0.10 3.53 -0.04 3.52 2.36 -0.32 -4.99 119.74 123.71 1noi s LYS 596 Ca 0.00 0.98 -0.22 0.00 -2.55 0.00 0.00 55.97 54.17 1noi s LYS 596 Cb 0.00 -2.07 -0.04 0.00 -1.05 0.00 0.00 37.83 34.66 1noi s LYS 596 CO 0.00 -0.62 0.65 0.12 1.55 0.00 0.00 175.35 177.05 1noi s PHE 597 N -2.77 3.61 -0.02 4.03 5.36 -1.26 -5.03 117.98 121.91 1noi s PHE 597 Ca 0.59 1.22 0.01 0.00 -0.96 0.00 0.00 56.93 57.78 1noi s PHE 597 Cb -0.12 -2.72 0.01 0.00 -0.34 0.00 0.00 43.02 39.85 1noi s PHE 597 CO 0.42 0.19 -0.01 0.54 -1.46 0.00 0.00 175.22 174.89 1noi s VAL 598 N 0.42 0.19 -0.13 3.12 0.11 -1.26 -5.11 120.40 117.74 1noi s VAL 598 Ca 0.34 -0.01 -0.29 0.00 -2.93 0.00 0.00 61.98 59.09 1noi s VAL 598 Cb -0.18 -0.22 -0.04 0.00 -1.53 0.00 0.00 36.38 34.41 1noi s VAL 598 CO 0.17 0.10 1.62 -0.69 -3.33 0.00 0.00 175.10 172.98 1noi s VAL 599 N 0.50 3.67 0.37 2.04 1.01 -1.26 -5.00 120.40 121.73 1noi s VAL 599 Ca -0.05 0.79 -0.26 0.00 0.00 0.00 0.00 61.98 62.46 1noi s VAL 599 Cb -0.08 -3.58 -0.09 0.00 0.00 0.00 0.00 36.38 32.63 1noi s VAL 599 CO -0.01 -0.15 1.13 -2.16 0.00 0.00 0.00 175.10 173.91 1noi s PRO 600 N 4.27 4.22 0.02 2.72 0.04 -1.26 -4.96 135.00 140.06 1noi s PRO 600 Ca 0.72 1.77 0.04 0.00 0.04 0.00 0.00 61.00 63.56 1noi s PRO 600 Cb -0.29 -2.77 -0.02 0.00 0.04 0.00 0.00 34.50 31.46 1noi s PRO 600 CO 0.28 -0.16 -0.11 1.03 0.04 0.00 0.00 177.00 178.09 1noi s ARG 601 N -2.14 0.77 -0.28 4.56 0.52 -0.80 -1.30 118.95 120.28 1noi s ARG 601 Ca 0.54 -0.58 -0.04 0.00 -0.52 0.00 0.00 55.73 55.13 1noi s ARG 601 Cb -0.29 -0.72 0.03 0.00 0.52 0.00 0.00 34.95 34.48 1noi s ARG 601 CO 0.37 0.18 0.01 0.99 0.02 0.00 0.00 175.30 176.87 1noi s THR 602 N -0.69 3.31 -0.19 0.02 2.01 -0.27 -1.93 115.64 117.91 1noi s THR 602 Ca 0.00 -0.99 -0.09 0.00 0.31 0.00 0.00 61.69 60.93 1noi s THR 602 Cb -0.06 -2.75 -0.05 0.00 0.01 0.00 0.00 72.50 69.65 1noi s THR 602 CO 0.00 0.08 0.10 0.68 -0.69 0.00 0.00 174.62 174.80 1noi s VAL 603 N 1.37 5.14 -0.14 3.82 -7.23 0.22 -0.22 120.40 123.36 1noi s VAL 603 Ca -0.00 0.09 0.01 0.00 -1.81 0.00 0.00 61.98 60.27 1noi s VAL 603 Cb -0.18 -3.34 0.02 0.00 0.56 0.00 0.00 36.38 33.45 1noi s VAL 603 CO -0.01 0.45 -0.16 -0.04 -0.31 0.00 0.00 175.10 175.03 1noi s MET 604 N 0.39 2.41 0.01 4.82 -1.94 -0.37 -0.44 119.30 124.17 1noi s MET 604 Ca 0.06 -0.61 0.07 0.00 -1.71 0.00 0.00 55.69 53.50 1noi s MET 604 Cb -0.12 -2.14 -0.02 0.00 2.01 0.00 0.00 34.83 34.57 1noi s MET 604 CO -0.01 -0.18 -0.22 0.42 -0.01 0.00 0.00 175.02 175.02 1noi s ILE 605 N 1.32 1.76 -0.07 2.53 1.01 -0.59 -1.17 121.20 125.98 1noi s ILE 605 Ca 0.02 -1.05 -0.29 0.00 0.00 0.00 0.00 60.65 59.33 1noi s ILE 605 Cb -0.13 -1.48 0.06 0.00 0.01 0.00 0.00 42.46 40.92 1noi s ILE 605 CO -0.08 0.40 0.64 -0.83 0.00 0.00 0.00 174.94 175.07 1noi s GLY 606 N -0.77 -0.53 0.00 6.18 0.00 -0.41 0.39 107.32 112.18 1noi s GLY 606 Ca 0.09 1.28 0.00 0.00 0.00 0.00 0.00 44.72 46.09 1noi s GLY 606 CO 0.00 0.95 0.00 0.61 0.00 0.00 0.00 173.10 174.66 1noi n GLY 607 N 1.14 -0.63 3.50 0.20 0.00 -1.25 -1.83 105.19 106.33 1noi n GLY 607 Ca -0.19 -1.28 -0.31 0.00 0.00 0.00 0.00 46.02 44.24 1noi n GLY 607 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1noi s LYS 608 N -2.00 2.21 0.00 1.61 1.02 -1.26 -4.67 119.74 116.65 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 -2.28 0.00 0.00 -0.52 0.00 0.00 37.83 35.03 1noi s LYS 608 CO 0.00 0.55 0.23 -0.35 -0.92 0.00 0.00 175.35 174.86 1noi n PRO 609 N 1.50 0.00 0.00 -1.68 -0.05 -1.26 -2.34 135.00 131.17 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 -0.68 0.00 0.00 -0.05 0.00 0.00 33.50 33.29 1noi n PRO 609 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1noi n ALA 610 N -1.42 0.00 -1.72 0.55 0.00 -1.26 -4.41 120.51 112.24 1noi n ALA 610 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 1noi n ALA 610 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 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 2.67 -0.14 0.00 -0.02 -1.26 -0.18 135.00 136.07 1noi n PRO 611 Ca 0.00 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 1noi n PRO 611 Cb 0.00 -2.77 0.00 0.00 -0.02 0.00 0.00 33.50 30.71 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 3.30 0.87 3.28 -1.23 0.00 -1.26 -4.96 105.19 105.19 1noi n GLY 612 Ca 0.14 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.48 3.53 0.16 1.61 6.14 0.75 -4.96 117.35 122.10 1noi s TYR 613 Ca 0.00 -1.87 -0.11 0.00 0.64 0.00 0.00 57.07 55.73 1noi s TYR 613 Cb 0.00 -3.69 0.04 0.00 0.42 0.00 0.00 41.96 38.73 1noi s TYR 613 CO 0.00 -0.98 1.62 1.25 0.64 0.00 0.00 175.55 178.08 1noi h HIS 614 N 8.10 1.03 -0.70 4.97 -0.00 -1.93 -2.58 115.15 124.03 1noi h HIS 614 Ca -0.07 -0.17 0.03 0.00 -0.00 0.00 0.00 60.37 60.15 1noi h HIS 614 Cb 1.05 -0.27 -0.04 0.00 -0.00 0.00 0.00 27.41 28.15 1noi h HIS 614 CO 0.85 0.93 0.46 1.98 -0.00 0.00 0.00 177.93 182.16 1noi h MET 615 N 0.82 0.85 -0.09 5.26 -1.53 -1.97 -2.59 114.93 115.68 1noi h MET 615 Ca 0.15 -0.05 -0.11 0.00 -3.44 0.00 0.00 59.70 56.26 1noi h MET 615 Cb 0.52 -0.19 -0.01 0.00 -0.55 0.00 0.00 31.60 31.36 1noi h MET 615 CO 0.03 0.56 -0.42 0.00 0.14 0.00 0.00 176.91 177.22 1noi h ALA 616 N 1.58 1.13 0.00 0.39 0.00 -1.81 -1.72 119.26 118.82 1noi h ALA 616 Ca 0.27 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1noi h ALA 616 Cb 0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1noi h ALA 616 CO -0.07 0.59 -0.19 0.87 0.00 0.00 0.00 179.25 180.45 1noi h LYS 617 N 0.17 0.00 -0.12 0.00 1.57 -1.39 -2.72 116.57 114.08 1noi h LYS 617 Ca 0.01 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.71 1noi h LYS 617 Cb 0.82 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.13 1noi h LYS 617 CO 0.06 0.19 -0.27 0.52 -0.57 0.00 0.00 179.45 179.38 1noi h MET 618 N 0.00 0.38 -0.67 3.15 2.86 -1.01 -2.84 114.93 116.80 1noi h MET 618 Ca -0.00 -0.26 0.02 0.00 -2.06 0.00 0.00 59.70 57.40 1noi h MET 618 Cb 1.05 0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.71 1noi h MET 618 CO 0.02 0.87 0.43 0.82 1.06 0.00 0.00 176.91 180.11 1noi h ILE 619 N -0.04 1.13 -0.62 -1.22 2.04 -1.31 -0.14 117.51 117.35 1noi h ILE 619 Ca -0.00 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 1noi h ILE 619 Cb 0.87 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 1noi h ILE 619 CO 0.06 0.16 0.36 0.40 0.00 0.00 0.00 178.15 179.12 1noi h ILE 620 N 0.86 1.18 -0.24 -0.67 2.04 -1.49 -0.80 117.51 118.39 1noi h ILE 620 Ca 0.26 -0.42 -0.11 0.00 1.00 0.00 0.00 64.86 65.59 1noi h ILE 620 Cb -0.03 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 36.37 1noi h ILE 620 CO -0.08 0.19 -0.26 0.50 0.00 0.00 0.00 178.15 178.50 1noi h LYS 621 N 0.85 0.60 -0.17 2.37 1.63 -1.00 -1.97 116.57 118.88 1noi h LYS 621 Ca 0.22 -0.33 0.04 0.00 -0.85 0.00 0.00 60.65 59.74 1noi h LYS 621 Cb -0.01 0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 31.59 1noi h LYS 621 CO -0.04 0.93 -0.10 1.25 -3.45 0.00 0.00 179.45 178.04 1noi h LEU 622 N 0.31 -0.32 -0.49 5.20 6.46 -0.47 0.18 115.31 126.18 1noi h LEU 622 Ca 0.04 0.07 -0.02 0.00 -0.12 0.00 0.00 57.88 57.85 1noi h LEU 622 Cb 0.82 0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 40.91 1noi h LEU 622 CO 0.06 -0.13 0.22 0.40 -0.62 0.00 0.00 178.44 178.37 1noi h ILE 623 N -0.09 1.20 -0.76 4.05 2.04 -1.03 0.24 117.51 123.16 1noi h ILE 623 Ca 0.10 -0.59 -0.05 0.00 1.00 0.00 0.00 64.86 65.32 1noi h ILE 623 Cb 0.24 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 1noi h ILE 623 CO -0.23 0.23 0.30 0.74 0.00 0.00 0.00 178.15 179.19 1noi h THR 624 N 0.64 1.26 -0.02 -0.27 2.02 -0.92 -1.85 112.91 113.77 1noi h THR 624 Ca 0.16 -0.81 -0.01 0.00 0.77 0.00 0.00 66.41 66.53 1noi h THR 624 Cb 0.16 0.35 -0.00 0.00 -1.74 0.00 0.00 68.15 66.91 1noi h THR 624 CO -0.02 0.33 -0.02 0.00 0.37 0.00 0.00 175.52 176.18 1noi h ALA 625 N 1.21 0.03 -0.82 6.16 0.00 0.25 0.89 119.26 126.99 1noi h ALA 625 Ca 0.26 -0.25 0.13 0.00 0.00 0.00 0.00 54.91 55.05 1noi h ALA 625 Cb 0.22 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.91 1noi h ALA 625 CO -0.02 -0.21 0.43 0.82 0.00 0.00 0.00 179.25 180.26 1noi h ILE 626 N -0.40 0.79 -0.14 0.00 2.04 -0.54 -0.61 117.51 118.64 1noi h ILE 626 Ca 0.00 -0.22 -0.07 0.00 1.00 0.00 0.00 64.86 65.57 1noi h ILE 626 Cb 0.50 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1noi h ILE 626 CO 0.00 0.12 -0.22 1.23 0.00 0.00 0.00 178.15 179.28 1noi h GLY 627 N 0.65 0.26 0.91 5.37 0.00 -0.86 -1.06 103.07 108.35 1noi h GLY 627 Ca 0.43 -0.19 -0.05 0.00 0.00 0.00 0.00 47.33 47.52 1noi h GLY 627 CO -0.32 0.18 0.03 -0.55 0.00 0.00 0.00 176.54 175.88 1noi h ASP 628 N 0.23 0.57 0.43 0.19 3.32 0.65 -1.98 116.42 119.84 1noi h ASP 628 Ca 0.04 -0.28 -0.02 0.00 0.02 0.00 0.00 57.03 56.79 1noi h ASP 628 Cb 0.53 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1noi h ASP 628 CO 0.04 0.71 -0.21 0.58 -1.72 0.00 0.00 179.24 178.64 1noi h VAL 629 N 0.42 0.00 0.00 -1.35 2.07 -1.12 -3.32 116.25 112.95 1noi h VAL 629 Ca 0.10 -0.15 -0.13 0.00 0.82 0.00 0.00 66.70 67.35 1noi h VAL 629 Cb 0.40 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.15 1noi h VAL 629 CO 0.01 0.00 -0.61 -0.37 0.02 0.00 0.00 177.57 176.62 1noi h VAL 630 N -0.73 1.27 0.00 2.57 -1.51 -1.24 -2.39 116.25 114.21 1noi h VAL 630 Ca -0.06 -2.24 0.00 0.00 -1.23 0.00 0.00 66.70 63.17 1noi h VAL 630 Cb 0.45 2.27 0.00 0.00 -2.13 0.00 0.00 31.29 31.87 1noi h VAL 630 CO 0.10 0.60 0.00 0.59 -1.23 0.00 0.00 177.57 177.63 1noi n ASN 631 N -3.56 0.00 -0.04 4.19 3.02 -0.74 -2.09 115.26 116.03 1noi n ASN 631 Ca -0.00 -1.23 0.02 0.00 -0.03 0.00 0.00 54.58 53.33 1noi n ASN 631 Cb 0.67 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.86 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 -0.80 0.00 -3.11 3.10 8.25 -0.91 -5.00 115.22 116.75 1noi n HIS 632 Ca 0.13 -0.43 -0.41 0.00 -0.26 0.00 0.00 57.72 56.75 1noi n HIS 632 Cb 0.06 -0.05 -0.06 0.00 1.12 0.00 0.00 29.99 31.05 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 -1.06 6.54 0.32 0.41 -1.08 -0.89 -4.94 116.67 115.97 1noi s ASP 633 Ca 0.05 0.59 0.01 0.00 -0.52 0.00 0.00 52.55 52.67 1noi s ASP 633 Cb 0.04 -2.33 0.52 0.00 -1.46 0.00 0.00 42.92 39.69 1noi s ASP 633 CO 0.00 -0.42 1.91 -0.65 0.52 0.00 0.00 175.17 176.54 1noi h PRO 634 N 8.03 0.80 -0.89 4.34 0.11 -1.94 -2.21 132.00 140.23 1noi h PRO 634 Ca -0.27 -0.11 0.01 0.00 0.11 0.00 0.00 66.00 65.74 1noi h PRO 634 Cb 1.12 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 32.04 1noi h PRO 634 CO 0.79 0.64 0.59 0.28 -0.21 0.00 0.00 178.00 180.09 1noi h VAL 635 N 0.79 1.23 -0.20 3.15 2.07 -1.98 -3.02 116.25 118.30 1noi h VAL 635 Ca 0.19 -0.41 -0.20 0.00 0.82 0.00 0.00 66.70 67.09 1noi h VAL 635 Cb 0.13 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 29.82 1noi h VAL 635 CO -0.02 0.22 -0.68 0.58 0.02 0.00 0.00 177.57 177.69 1noi h VAL 636 N 1.21 1.29 0.00 2.57 2.07 -1.76 -3.48 116.25 118.14 1noi h VAL 636 Ca 0.33 -1.89 0.00 0.00 0.82 0.00 0.00 66.70 65.96 1noi h VAL 636 Cb -0.14 1.85 0.00 0.00 -1.52 0.00 0.00 31.29 31.48 1noi h VAL 636 CO -0.07 0.60 0.00 0.61 0.02 0.00 0.00 177.57 178.73 1noi n GLY 637 N 0.55 2.10 2.67 2.17 0.00 -1.09 -2.65 105.19 108.94 1noi n GLY 637 Ca -0.06 0.24 -0.07 0.00 0.00 0.00 0.00 46.02 46.13 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 10.95 2.14 -0.45 1.61 5.75 -1.26 -4.73 116.55 130.56 1noi n ASP 638 Ca 0.00 -2.53 0.11 0.00 -0.01 0.00 0.00 54.79 52.36 1noi n ASP 638 Cb 0.00 -0.48 0.04 0.00 -1.03 0.00 0.00 41.12 39.65 1noi n ASP 638 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1noi n ARG 639 N -0.45 1.12 -3.67 0.11 1.74 -1.08 -4.67 116.66 109.76 1noi n ARG 639 Ca 0.14 -0.90 -0.09 0.00 -0.77 0.00 0.00 57.85 56.22 1noi n ARG 639 Cb 0.82 -1.48 -0.09 0.00 -1.02 0.00 0.00 32.46 30.68 1noi n ARG 639 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1noi s LEU 640 N -2.50 -0.41 0.01 0.55 0.20 -1.24 -1.90 118.68 113.38 1noi s LEU 640 Ca 0.19 1.15 0.00 0.00 0.69 0.00 0.00 54.13 56.16 1noi s LEU 640 Cb 0.18 1.80 -0.01 0.00 -0.43 0.00 0.00 46.19 47.73 1noi s LEU 640 CO 0.58 -0.21 -0.01 -0.13 -0.29 0.00 0.00 176.35 176.28 1noi s ARG 641 N 1.36 0.13 -0.16 1.98 1.81 -0.81 -4.80 118.95 118.46 1noi s ARG 641 Ca -0.09 -0.21 0.01 0.00 -1.72 0.00 0.00 55.73 53.73 1noi s ARG 641 Cb -0.07 -0.00 0.02 0.00 -0.45 0.00 0.00 34.95 34.45 1noi s ARG 641 CO -0.14 -0.01 -0.19 0.08 -0.68 0.00 0.00 175.30 174.37 1noi s VAL 642 N -0.47 1.89 -0.04 3.52 1.01 -1.26 -0.61 120.40 124.45 1noi s VAL 642 Ca -0.05 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.12 1noi s VAL 642 Cb -0.03 -1.71 0.00 0.00 0.00 0.00 0.00 36.38 34.64 1noi s VAL 642 CO -0.00 0.51 -0.13 -0.63 0.00 0.00 0.00 175.10 174.85 1noi s ILE 643 N 1.18 1.13 -0.26 2.22 1.01 0.41 -4.60 121.20 122.30 1noi s ILE 643 Ca 0.01 -0.54 -0.14 0.00 0.00 0.00 0.00 60.65 59.98 1noi s ILE 643 Cb -0.14 -0.99 -0.04 0.00 0.01 0.00 0.00 42.46 41.30 1noi s ILE 643 CO -0.08 0.34 0.31 0.12 0.00 0.00 0.00 174.94 175.62 1noi s PHE 644 N 0.16 3.26 -0.38 3.97 5.36 -1.26 -1.55 117.98 127.54 1noi s PHE 644 Ca -0.04 0.34 -0.29 0.00 -0.96 0.00 0.00 56.93 55.98 1noi s PHE 644 Cb -0.11 -2.50 0.01 0.00 -0.34 0.00 0.00 43.02 40.09 1noi s PHE 644 CO 0.02 -0.17 1.25 -0.51 -1.46 0.00 0.00 175.22 174.34 1noi s LEU 645 N 1.85 3.74 0.01 6.12 1.43 0.16 -4.91 118.68 127.08 1noi s LEU 645 Ca 0.13 0.87 -0.30 0.00 -1.03 0.00 0.00 54.13 53.80 1noi s LEU 645 Cb -0.16 -3.54 -0.06 0.00 0.03 0.00 0.00 46.19 42.46 1noi s LEU 645 CO 0.10 -1.19 1.43 -0.70 0.23 0.00 0.00 176.35 176.21 1noi s GLU 646 N 4.37 4.27 -0.37 1.70 2.12 -1.26 -4.14 118.70 125.39 1noi s GLU 646 Ca 0.54 2.01 -0.02 0.00 0.36 0.00 0.00 54.97 57.85 1noi s GLU 646 Cb -0.12 -3.58 -0.02 0.00 0.26 0.00 0.00 34.13 30.67 1noi s GLU 646 CO 0.27 -0.60 0.33 -1.71 -0.54 0.00 0.00 175.26 173.01 1noi n ASN 647 N 5.41 -3.83 -4.70 -1.70 5.15 -1.26 -4.94 115.26 109.38 1noi n ASN 647 Ca 0.13 -0.22 -0.42 0.00 -0.60 0.00 0.00 54.58 53.47 1noi n ASN 647 Cb 0.43 -2.34 -0.03 0.00 -0.53 0.00 0.00 39.78 37.32 1noi n ASN 647 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1noi s TYR 648 N -3.12 3.18 0.36 1.20 5.04 -1.26 -4.86 117.35 117.89 1noi s TYR 648 Ca 0.14 1.03 -0.12 0.00 -2.44 0.00 0.00 57.07 55.68 1noi s TYR 648 Cb -0.02 -3.58 0.03 0.00 0.35 0.00 0.00 41.96 38.75 1noi s TYR 648 CO 0.28 -2.00 0.68 -0.98 -1.34 0.00 0.00 175.55 172.19 1noi s ARG 649 N 1.56 2.07 0.22 4.97 1.70 -1.26 -4.78 118.95 123.43 1noi s ARG 649 Ca 0.62 -1.47 -0.08 0.00 -0.47 0.00 0.00 55.73 54.33 1noi s ARG 649 Cb -0.32 0.57 0.28 0.00 -0.57 0.00 0.00 34.95 34.91 1noi s ARG 649 CO 0.28 -0.93 1.81 0.28 -1.08 0.00 0.00 175.30 175.66 1noi h VAL 650 N 2.04 0.96 0.00 4.99 2.07 -1.93 -0.80 116.25 123.58 1noi h VAL 650 Ca -0.30 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 66.96 1noi h VAL 650 Cb 1.25 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1noi h VAL 650 CO 0.38 0.13 -0.05 0.77 0.02 0.00 0.00 177.57 178.82 1noi h SER 651 N 0.73 0.00 0.60 0.57 4.64 -1.98 -1.96 113.55 116.15 1noi h SER 651 Ca 0.33 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.44 1noi h SER 651 Cb 0.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 1noi h SER 651 CO -0.20 0.05 -0.91 0.25 -0.87 0.00 0.00 176.83 175.16 1noi h LEU 652 N 0.00 0.26 -1.25 5.97 6.46 -1.51 -2.74 115.31 122.51 1noi h LEU 652 Ca -0.00 -0.22 -0.08 0.00 -0.12 0.00 0.00 57.88 57.46 1noi h LEU 652 Cb 0.70 -0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.54 1noi h LEU 652 CO 0.01 1.04 -0.37 0.00 -0.62 0.00 0.00 178.44 178.49 1noi h ALA 653 N 0.94 1.38 -0.14 1.25 0.00 -0.86 0.32 119.26 122.15 1noi h ALA 653 Ca -0.05 -0.34 -0.12 0.00 0.00 0.00 0.00 54.91 54.40 1noi h ALA 653 Cb 1.55 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 1noi h ALA 653 CO 0.14 0.47 -0.42 0.93 0.00 0.00 0.00 179.25 180.36 1noi h GLU 654 N 0.01 0.32 -0.05 0.00 5.08 -1.14 -2.78 114.58 116.03 1noi h GLU 654 Ca -0.00 -0.16 -0.10 0.00 -1.00 0.00 0.00 59.36 58.09 1noi h GLU 654 Cb 0.66 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.92 1noi h GLU 654 CO 0.05 0.70 -0.38 0.87 -1.00 0.00 0.00 179.01 179.25 1noi h LYS 655 N 0.27 0.34 0.15 2.33 1.79 -0.69 -3.41 116.57 117.36 1noi h LYS 655 Ca 0.02 -0.30 -0.33 0.00 -2.18 0.00 0.00 60.65 57.86 1noi h LYS 655 Cb 0.86 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.58 1noi h LYS 655 CO 0.07 0.96 -1.62 -0.24 -1.08 0.00 0.00 179.45 177.54 1noi h VAL 656 N -0.17 1.06 -0.81 0.50 3.04 -1.35 -3.37 116.25 115.15 1noi h VAL 656 Ca -0.03 -2.68 -0.00 0.00 -1.01 0.00 0.00 66.70 62.98 1noi h VAL 656 Cb 1.05 2.76 -0.04 0.00 -2.01 0.00 0.00 31.29 33.05 1noi h VAL 656 CO 0.08 0.83 0.50 0.40 -1.01 0.00 0.00 177.57 178.37 1noi h ILE 657 N 0.09 1.22 0.00 3.17 2.04 -1.72 0.98 117.51 123.28 1noi h ILE 657 Ca -0.29 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 65.11 1noi h ILE 657 Cb 2.06 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 38.20 1noi h ILE 657 CO 0.17 0.23 0.00 1.55 0.00 0.00 0.00 178.15 180.10 1noi h PRO 658 N 1.11 0.00 -0.00 2.37 0.13 -1.78 -3.21 132.00 130.62 1noi h PRO 658 Ca 0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.42 1noi h PRO 658 Cb -0.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.06 1noi h PRO 658 CO -0.06 0.00 -0.67 0.00 -0.23 0.00 0.00 178.00 177.04 1noi n ALA 659 N -1.84 3.98 -1.78 -0.56 0.00 0.31 -4.73 120.51 115.88 1noi n ALA 659 Ca 0.01 -0.46 -0.37 0.00 0.00 0.00 0.00 53.44 52.62 1noi n ALA 659 Cb 0.19 -0.97 -0.05 0.00 0.00 0.00 0.00 19.45 18.62 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 -2.94 3.14 -0.24 0.00 0.00 -1.05 -4.66 121.76 116.01 1noi s ALA 660 Ca 0.11 0.66 0.01 0.00 0.00 0.00 0.00 51.96 52.75 1noi s ALA 660 Cb 0.17 -3.25 -0.15 0.00 0.00 0.00 0.00 23.12 19.89 1noi s ALA 660 CO 0.74 -0.11 -0.21 -0.25 0.00 0.00 0.00 175.76 175.94 1noi n ASP 661 N 0.15 2.16 -4.19 0.00 8.00 0.71 -4.35 116.55 119.03 1noi n ASP 661 Ca 0.04 -0.11 -0.29 0.00 0.71 0.00 0.00 54.79 55.14 1noi n ASP 661 Cb 0.49 -0.39 -0.16 0.00 -0.02 0.00 0.00 41.12 41.04 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 -6.42 1.98 -0.26 0.64 0.20 -0.37 -0.22 118.68 114.24 1noi s LEU 662 Ca -0.32 -0.45 -0.07 0.00 0.69 0.00 0.00 54.13 53.98 1noi s LEU 662 Cb 0.08 -1.19 -0.02 0.00 -0.43 0.00 0.00 46.19 44.63 1noi s LEU 662 CO 0.54 0.18 0.07 -0.55 -0.29 0.00 0.00 176.35 176.29 1noi s SER 663 N 0.07 5.09 -0.41 3.68 0.15 -0.50 -0.80 113.70 120.98 1noi s SER 663 Ca -0.08 -0.31 -0.22 0.00 0.70 0.00 0.00 55.95 56.05 1noi s SER 663 Cb -0.14 -1.91 0.02 0.00 -1.71 0.00 0.00 66.02 62.28 1noi s SER 663 CO 0.04 -0.06 0.71 -1.61 1.20 0.00 0.00 173.24 173.52 1noi s GLU 664 N 1.59 3.51 -0.59 5.44 0.41 -0.18 -1.38 118.70 127.50 1noi s GLU 664 Ca 0.06 -0.05 0.05 0.00 -0.41 0.00 0.00 54.97 54.62 1noi s GLU 664 Cb -0.15 -3.88 0.20 0.00 -1.78 0.00 0.00 34.13 28.51 1noi s GLU 664 CO 0.03 -0.94 0.52 1.04 -0.49 0.00 0.00 175.26 175.42 1noi n GLN 665 N 6.38 1.49 -2.04 1.61 1.13 -0.88 -4.75 117.38 120.32 1noi n GLN 665 Ca 0.01 -4.08 -0.27 0.00 -1.94 0.00 0.00 57.00 50.71 1noi n GLN 665 Cb 0.48 -2.01 0.02 0.00 0.11 0.00 0.00 30.24 28.85 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 1.82 2.71 -2.45 5.09 -5.35 -1.26 -2.88 119.36 117.04 1noi n ILE 666 Ca 0.25 -4.24 -0.33 0.00 -0.27 0.00 0.00 62.75 58.15 1noi n ILE 666 Cb 0.42 -1.18 -0.03 0.00 -1.74 0.00 0.00 39.64 37.10 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 -3.17 6.30 0.26 7.28 1.04 -1.26 -4.53 113.70 119.62 1noi s SER 667 Ca 0.52 1.85 -0.31 0.00 0.48 0.00 0.00 55.95 58.50 1noi s SER 667 Cb 0.42 -2.55 -0.12 0.00 0.10 0.00 0.00 66.02 63.87 1noi s SER 667 CO -0.06 -0.81 1.56 0.41 0.98 0.00 0.00 173.24 175.32 1noi n THR 668 N -1.21 0.83 -1.66 2.02 -1.04 -1.21 -4.69 114.28 107.33 1noi n THR 668 Ca 0.09 -0.21 -0.48 0.00 -2.04 0.00 0.00 64.05 61.41 1noi n THR 668 Cb 0.53 -1.81 -0.05 0.00 -1.82 0.00 0.00 70.33 67.18 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 2.36 0.69 0.00 2.41 0.00 -1.26 -2.08 120.51 122.63 1noi n ALA 669 Ca 0.11 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.98 1noi n ALA 669 Cb 0.35 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.49 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 3.41 0.11 0.02 0.00 0.00 -1.26 -4.66 105.19 102.81 1noi n GLY 670 Ca 0.19 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.32 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 -1.91 0.09 -3.68 2.61 -2.24 -0.88 -4.90 114.28 103.37 1noi n THR 671 Ca 0.00 -0.39 -0.39 0.00 -2.27 0.00 0.00 64.05 61.01 1noi n THR 671 Cb 0.00 0.16 -0.12 0.00 -2.10 0.00 0.00 70.33 68.27 1noi n THR 671 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1noi s GLU 672 N -3.37 3.06 0.34 -0.78 2.56 -1.26 -4.89 118.70 114.36 1noi s GLU 672 Ca -0.03 -0.90 0.03 0.00 0.00 0.00 0.00 54.97 54.07 1noi s GLU 672 Cb 0.14 -3.53 0.63 0.00 2.00 0.00 0.00 34.13 33.37 1noi s GLU 672 CO 0.88 -0.52 1.97 0.00 -0.56 0.00 0.00 175.26 177.03 1noi h ALA 673 N 8.32 1.58 0.00 6.30 0.00 -1.91 -3.08 119.26 130.48 1noi h ALA 673 Ca -0.29 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1noi h ALA 673 Cb 1.12 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1noi h ALA 673 CO 0.62 0.34 0.00 0.45 0.00 0.00 0.00 179.25 180.66 1noi n SER 674 N -4.46 -0.45 -0.16 0.00 2.88 -1.26 -4.18 113.62 105.99 1noi n SER 674 Ca 0.10 0.10 0.02 0.00 -1.33 0.00 0.00 58.87 57.75 1noi n SER 674 Cb 0.13 0.83 -0.01 0.00 -0.75 0.00 0.00 64.21 64.42 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 -1.30 -2.38 0.00 0.46 0.00 -1.26 -0.94 105.19 99.78 1noi n GLY 675 Ca 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.59 1noi n GLY 675 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1noi n THR 676 N -2.46 0.00 0.02 2.61 -1.04 -1.26 -4.77 114.28 107.38 1noi n THR 676 Ca -0.01 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 61.97 1noi n THR 676 Cb 0.07 0.00 0.22 0.00 -1.82 0.00 0.00 70.33 68.80 1noi n THR 676 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1noi h GLY 677 N 0.00 0.52 0.39 3.41 0.00 -1.94 -2.70 103.07 102.74 1noi h GLY 677 Ca 0.00 -0.40 0.08 0.00 0.00 0.00 0.00 47.33 47.01 1noi h GLY 677 CO 0.00 0.37 0.09 3.45 0.00 0.00 0.00 176.54 180.45 1noi h ASN 678 N 0.43 -0.00 -0.13 0.19 7.08 -1.93 -0.09 115.58 121.14 1noi h ASN 678 Ca 0.07 0.08 -0.07 0.00 -3.08 0.00 0.00 56.30 53.30 1noi h ASN 678 Cb 0.62 0.12 -0.02 0.00 -2.08 0.00 0.00 38.32 36.96 1noi h ASN 678 CO 0.04 0.03 -0.12 0.24 -2.08 0.00 0.00 177.43 175.54 1noi h MET 679 N 0.23 0.47 -0.34 4.14 2.86 -1.83 -2.40 114.93 118.06 1noi h MET 679 Ca 0.24 -0.13 -0.17 0.00 -2.06 0.00 0.00 59.70 57.57 1noi h MET 679 Cb 0.31 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.91 1noi h MET 679 CO -0.31 0.59 -0.46 0.87 1.06 0.00 0.00 176.91 178.67 1noi h LYS 680 N 0.44 0.90 -0.78 1.72 1.57 -0.81 -2.21 116.57 117.40 1noi h LYS 680 Ca 0.08 -0.52 -0.03 0.00 -1.87 0.00 0.00 60.65 58.32 1noi h LYS 680 Cb 0.48 0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.79 1noi h LYS 680 CO 0.03 1.16 0.37 0.74 -0.57 0.00 0.00 179.45 181.18 1noi h PHE 681 N 0.72 1.14 -0.62 -1.35 0.04 -1.27 -2.78 116.94 112.82 1noi h PHE 681 Ca 0.04 -0.06 -0.08 0.00 2.80 0.00 0.00 57.97 60.67 1noi h PHE 681 Cb 1.06 -0.35 -0.02 0.00 2.20 0.00 0.00 35.95 38.83 1noi h PHE 681 CO 0.07 0.84 0.09 1.98 -0.60 0.00 0.00 178.31 180.68 1noi h MET 682 N 1.11 1.04 0.00 1.51 4.05 -0.99 -2.07 114.93 119.58 1noi h MET 682 Ca 0.27 -0.29 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 1noi h MET 682 Cb 0.13 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 30.82 1noi h MET 682 CO -0.03 0.97 0.00 1.25 0.23 0.00 0.00 176.91 179.33 1noi h LEU 683 N 0.95 0.00 -3.07 3.39 6.46 -1.25 -3.10 115.31 118.69 1noi h LEU 683 Ca 0.19 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.95 1noi h LEU 683 Cb 0.45 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.38 1noi h LEU 683 CO 0.01 0.00 0.00 0.59 -0.62 0.00 0.00 178.44 178.42 1noi n ASN 684 N -2.84 3.52 -1.02 1.25 3.02 -0.79 -4.90 115.26 113.50 1noi n ASN 684 Ca 0.01 -2.47 0.00 0.00 -0.03 0.00 0.00 54.58 52.09 1noi n ASN 684 Cb 0.31 -0.40 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 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 0.15 0.65 2.98 7.41 0.00 -1.15 -4.79 105.19 110.44 1noi n GLY 685 Ca 0.17 -0.39 -0.15 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.75 0.47 0.42 4.61 0.00 -1.20 -4.79 121.76 118.52 1noi s ALA 686 Ca 0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 51.96 51.59 1noi s ALA 686 Cb 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 23.12 23.01 1noi s ALA 686 CO 0.00 0.08 0.67 -0.51 0.00 0.00 0.00 175.76 176.00 1noi s LEU 687 N -0.46 3.81 -0.08 0.00 1.43 0.70 -4.49 118.68 119.59 1noi s LEU 687 Ca -0.01 0.68 0.03 0.00 -1.03 0.00 0.00 54.13 53.80 1noi s LEU 687 Cb -0.04 -3.58 -0.02 0.00 0.03 0.00 0.00 46.19 42.58 1noi s LEU 687 CO -0.00 -0.45 -0.16 -0.89 0.23 0.00 0.00 176.35 175.09 1noi s THR 688 N -2.53 2.86 -0.23 5.49 2.01 -1.26 -1.42 115.64 120.57 1noi s THR 688 Ca 0.44 -0.76 -0.06 0.00 0.31 0.00 0.00 61.69 61.62 1noi s THR 688 Cb -0.10 -2.14 -0.02 0.00 0.01 0.00 0.00 72.50 70.25 1noi s THR 688 CO 0.40 0.56 0.01 -0.51 -0.69 0.00 0.00 174.62 174.40 1noi s ILE 689 N -0.18 3.89 0.15 1.82 2.07 -0.48 -1.52 121.20 126.95 1noi s ILE 689 Ca -0.01 -0.32 -0.25 0.00 -1.41 0.00 0.00 60.65 58.66 1noi s ILE 689 Cb -0.13 -2.79 0.06 0.00 0.13 0.00 0.00 42.46 39.73 1noi s ILE 689 CO 0.03 0.39 0.90 -0.83 -1.91 0.00 0.00 174.94 173.52 1noi s GLY 690 N 1.42 -0.26 0.69 1.50 0.00 -0.48 -2.07 107.32 108.12 1noi s GLY 690 Ca 0.05 0.19 -0.03 0.00 0.00 0.00 0.00 44.72 44.93 1noi s GLY 690 CO 0.01 0.04 0.97 -0.51 0.00 0.00 0.00 173.10 173.61 1noi s THR 691 N -3.38 2.29 -1.21 0.90 -4.23 -1.14 -2.01 115.64 106.87 1noi s THR 691 Ca 0.11 -0.48 -0.11 0.00 -1.18 0.00 0.00 61.69 60.03 1noi s THR 691 Cb -0.02 -2.81 0.20 0.00 1.34 0.00 0.00 72.50 71.21 1noi s THR 691 CO 0.01 0.00 1.52 0.23 -0.54 0.00 0.00 174.62 175.84 1noi n MET 692 N -2.81 3.58 -4.33 3.99 2.81 -1.26 -4.68 117.12 114.42 1noi n MET 692 Ca 0.11 -3.92 -0.18 0.00 -1.81 0.00 0.00 57.70 51.90 1noi n MET 692 Cb 0.60 -2.88 -0.15 0.00 -0.71 0.00 0.00 33.22 30.08 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 1.56 0.98 1.67 7.83 2.15 -1.26 -4.61 116.67 125.00 1noi s ASP 693 Ca 0.39 -0.15 0.00 0.00 0.43 0.00 0.00 52.55 53.22 1noi s ASP 693 Cb 0.00 -0.12 0.00 0.00 -0.30 0.00 0.00 42.92 42.51 1noi s ASP 693 CO 0.00 0.10 0.00 0.61 -0.17 0.00 0.00 175.17 175.71 1noi n GLY 694 N 2.90 3.64 0.23 2.66 0.00 -1.17 -0.73 105.19 112.72 1noi n GLY 694 Ca -0.14 0.01 0.14 0.00 0.00 0.00 0.00 46.02 46.03 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 11.62 2.62 0.20 4.61 0.00 -0.11 -3.35 120.51 136.10 1noi n ALA 695 Ca 0.00 -0.31 0.04 0.00 0.00 0.00 0.00 53.44 53.18 1noi n ALA 695 Cb 0.00 -1.31 0.40 0.00 0.00 0.00 0.00 19.45 18.54 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 1.06 0.00 0.26 0.00 2.35 -1.14 -2.53 115.58 115.57 1noi h ASN 696 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1noi h ASN 696 Cb 0.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.60 1noi h ASN 696 CO 0.00 0.35 -0.12 0.58 -1.65 0.00 0.00 177.43 176.58 1noi h VAL 697 N 0.00 0.80 0.00 2.81 2.07 -1.68 -1.18 116.25 119.07 1noi h VAL 697 Ca -0.00 -0.48 -0.07 0.00 0.82 0.00 0.00 66.70 66.97 1noi h VAL 697 Cb 0.67 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 1noi h VAL 697 CO 0.04 0.10 -0.35 -0.33 0.02 0.00 0.00 177.57 177.06 1noi h GLU 698 N -0.60 0.00 -0.25 1.57 5.08 -1.73 -2.42 114.58 116.23 1noi h GLU 698 Ca -0.04 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.21 1noi h GLU 698 Cb 0.43 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 1noi h GLU 698 CO 0.06 0.35 -0.29 0.52 -1.00 0.00 0.00 179.01 178.65 1noi h MET 699 N 0.00 0.63 -0.64 2.33 2.86 -1.29 -0.54 114.93 118.29 1noi h MET 699 Ca -0.00 -0.35 -0.02 0.00 -2.06 0.00 0.00 59.70 57.27 1noi h MET 699 Cb 0.65 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.31 1noi h MET 699 CO 0.05 0.95 0.31 0.00 1.06 0.00 0.00 176.91 179.28 1noi h ALA 700 N 0.67 0.82 -0.73 6.32 0.00 -1.15 0.78 119.26 125.97 1noi h ALA 700 Ca 0.03 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1noi h ALA 700 Cb 0.86 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 1noi h ALA 700 CO 0.07 0.38 0.32 1.49 0.00 0.00 0.00 179.25 181.51 1noi h GLU 701 N 0.88 1.06 -0.27 0.00 4.81 -1.27 0.29 114.58 120.09 1noi h GLU 701 Ca 0.22 -0.16 -0.18 0.00 -0.13 0.00 0.00 59.36 59.10 1noi h GLU 701 Cb 0.11 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.30 1noi h GLU 701 CO -0.03 0.84 -0.55 0.93 -0.73 0.00 0.00 179.01 179.47 1noi h GLU 702 N 1.05 0.81 0.00 1.92 4.39 -0.26 -3.31 114.58 119.17 1noi h GLU 702 Ca 0.25 -0.52 0.00 0.00 0.34 0.00 0.00 59.36 59.43 1noi h GLU 702 Cb 0.15 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.86 1noi h GLU 702 CO -0.03 1.15 -0.49 0.00 -1.16 0.00 0.00 179.01 178.48 1noi h ALA 703 N 0.74 0.69 -0.03 3.43 0.00 -0.48 -3.48 119.26 120.13 1noi h ALA 703 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1noi h ALA 703 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1noi h ALA 703 CO 0.12 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.78 1noi n GLY 704 N 1.30 -0.02 0.44 0.00 0.00 1.00 -4.47 105.19 103.45 1noi n GLY 704 Ca 0.03 -1.23 0.25 0.00 0.00 0.00 0.00 46.02 45.08 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 0.21 0.00 1.61 5.08 -1.86 0.34 114.58 119.96 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 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.20 1noi h GLU 705 CO 0.00 0.14 -0.00 0.93 -1.00 0.00 0.00 179.01 179.08 1noi h GLU 706 N 0.22 0.00 -0.48 2.33 3.07 -1.90 -2.90 114.58 114.93 1noi h GLU 706 Ca 0.51 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.37 1noi h GLU 706 Cb 1.59 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.50 1noi h GLU 706 CO -0.13 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.57 1noi n ASN 707 N -3.31 3.59 -4.19 1.42 3.02 0.12 -4.92 115.26 110.99 1noi n ASN 707 Ca -0.03 -1.99 -0.25 0.00 -0.03 0.00 0.00 54.58 52.27 1noi n ASN 707 Cb 0.08 -0.31 -0.15 0.00 -0.61 0.00 0.00 39.78 38.78 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 -1.36 1.66 -1.21 3.10 5.36 -1.10 -4.77 117.98 119.67 1noi s PHE 708 Ca 0.41 -0.32 -0.09 0.00 -0.96 0.00 0.00 56.93 55.97 1noi s PHE 708 Cb 0.23 -1.06 0.21 0.00 -0.34 0.00 0.00 43.02 42.07 1noi s PHE 708 CO 0.32 -0.01 1.62 1.19 -1.46 0.00 0.00 175.22 176.88 1noi n PHE 709 N 2.50 3.45 -2.29 10.12 3.72 -0.58 -4.97 117.46 129.41 1noi n PHE 709 Ca -0.15 -2.97 -0.42 0.00 -0.05 0.00 0.00 57.45 53.85 1noi n PHE 709 Cb 0.54 -1.82 -0.03 0.00 -0.94 0.00 0.00 39.48 37.23 1noi n PHE 709 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1noi s ILE 710 N -0.24 3.71 0.34 4.37 -1.09 -1.25 -1.39 121.20 125.64 1noi s ILE 710 Ca 0.37 1.20 0.05 0.00 -2.23 0.00 0.00 60.65 60.04 1noi s ILE 710 Cb 0.04 -3.77 -0.02 0.00 -1.58 0.00 0.00 42.46 37.13 1noi s ILE 710 CO 0.02 0.07 0.18 2.22 -1.23 0.00 0.00 174.94 176.20 1noi n PHE 711 N 4.25 -0.19 -4.77 3.97 -1.74 -0.85 -4.94 117.46 113.19 1noi n PHE 711 Ca 0.11 -2.40 0.00 0.00 -0.56 0.00 0.00 57.45 54.60 1noi n PHE 711 Cb 0.44 0.09 0.00 0.00 1.52 0.00 0.00 39.48 41.54 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 -0.51 -0.47 3.77 4.97 0.00 -1.26 -4.42 105.19 107.27 1noi n GLY 712 Ca -0.01 -0.92 -0.40 0.00 0.00 0.00 0.00 46.02 44.70 1noi n GLY 712 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1noi s MET 713 N 0.00 4.08 0.30 1.61 -1.94 -1.26 -4.91 119.30 117.17 1noi s MET 713 Ca 0.00 2.14 0.07 0.00 -1.71 0.00 0.00 55.69 56.19 1noi s MET 713 Cb 0.00 -2.83 -0.03 0.00 2.01 0.00 0.00 34.83 33.98 1noi s MET 713 CO 0.00 -0.40 0.29 1.03 -0.01 0.00 0.00 175.02 175.93 1noi s ARG 714 N -2.13 2.91 0.14 2.03 3.00 -1.26 -4.28 118.95 119.36 1noi s ARG 714 Ca 0.55 -1.13 -0.18 0.00 0.00 0.00 0.00 55.73 54.97 1noi s ARG 714 Cb -0.38 -2.59 -0.02 0.00 0.00 0.00 0.00 34.95 31.97 1noi s ARG 714 CO 0.49 0.23 1.77 0.28 0.00 0.00 0.00 175.30 178.07 1noi h VAL 715 N 1.28 1.01 -1.04 3.52 2.07 -1.83 0.36 116.25 121.61 1noi h VAL 715 Ca -0.47 -0.11 0.27 0.00 0.82 0.00 0.00 66.70 67.22 1noi h VAL 715 Cb 1.25 0.67 -0.09 0.00 -1.52 0.00 0.00 31.29 31.60 1noi h VAL 715 CO 0.59 0.06 0.68 -0.08 0.02 0.00 0.00 177.57 178.84 1noi h GLU 716 N 0.31 0.34 -0.02 1.57 4.22 -1.96 0.14 114.58 119.17 1noi h GLU 716 Ca 0.11 -0.02 -0.21 0.00 0.08 0.00 0.00 59.36 59.32 1noi h GLU 716 Cb 0.02 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.19 1noi h GLU 716 CO -0.07 0.22 -0.86 -0.44 -2.18 0.00 0.00 179.01 175.68 1noi h ASP 717 N 0.35 0.46 -0.45 1.04 3.32 -1.35 -2.85 116.42 116.94 1noi h ASP 717 Ca 0.58 -0.35 -0.13 0.00 0.02 0.00 0.00 57.03 57.15 1noi h ASP 717 Cb 1.57 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.97 1noi h ASP 717 CO -0.26 1.13 -0.24 0.58 -1.72 0.00 0.00 179.24 178.74 1noi h VAL 718 N 0.22 1.27 -0.69 -1.35 2.07 -0.21 -2.08 116.25 115.48 1noi h VAL 718 Ca -0.06 -1.40 -0.04 0.00 0.82 0.00 0.00 66.70 66.03 1noi h VAL 718 Cb 1.48 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 32.41 1noi h VAL 718 CO 0.15 0.48 0.28 0.44 0.02 0.00 0.00 177.57 178.93 1noi h ASP 719 N 0.80 0.93 0.42 0.57 3.32 -1.15 -1.42 116.42 119.89 1noi h ASP 719 Ca 0.10 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 1noi h ASP 719 Cb 0.82 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.12 1noi h ASP 719 CO 0.07 0.83 -0.25 0.03 -1.72 0.00 0.00 179.24 178.20 1noi h ARG 720 N 1.00 -0.62 -0.89 3.56 2.47 -1.37 0.15 114.38 118.68 1noi h ARG 720 Ca 0.23 0.04 0.09 0.00 -1.26 0.00 0.00 59.98 59.08 1noi h ARG 720 Cb 0.18 0.14 -0.07 0.00 -1.65 0.00 0.00 29.97 28.57 1noi h ARG 720 CO -0.02 -0.41 0.54 1.25 0.56 0.00 0.00 179.97 181.88 1noi h LEU 721 N -0.64 0.80 0.08 3.04 5.85 -1.27 0.92 115.31 124.10 1noi h LEU 721 Ca -0.05 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.73 1noi h LEU 721 Cb 0.52 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.39 1noi h LEU 721 CO 0.05 0.47 -0.25 0.44 -0.34 0.00 0.00 178.44 178.81 1noi h ASP 722 N 0.92 -0.73 0.30 1.25 3.32 -0.81 0.23 116.42 120.89 1noi h ASP 722 Ca 0.41 0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.55 1noi h ASP 722 Cb 0.32 0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.15 1noi h ASP 722 CO -0.22 -0.34 0.00 1.56 -1.72 0.00 0.00 179.24 178.52 1noi h GLN 723 N -0.44 0.00 -0.00 3.56 4.20 0.12 0.26 115.11 122.80 1noi h GLN 723 Ca 0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.75 1noi h GLN 723 Cb 0.48 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.26 1noi h GLN 723 CO -0.17 0.00 -0.46 2.89 -0.67 0.00 0.00 178.83 180.42 1noi n ARG 724 N -2.41 3.35 0.00 1.46 1.85 -0.06 -5.07 116.66 115.78 1noi n ARG 724 Ca -0.00 -0.09 0.00 0.00 -1.00 0.00 0.00 57.85 56.76 1noi n ARG 724 Cb 0.12 -1.01 0.00 0.00 -1.05 0.00 0.00 32.46 30.52 1noi n ARG 724 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1noi n GLY 725 N 1.20 -1.77 3.55 2.89 0.00 0.76 -4.98 105.19 106.85 1noi n GLY 725 Ca 0.02 -1.18 -0.40 0.00 0.00 0.00 0.00 46.02 44.46 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 -1.21 3.21 -0.18 1.61 5.04 -1.25 -4.87 117.35 119.71 1noi s TYR 726 Ca 0.00 0.04 -0.00 0.00 -2.44 0.00 0.00 57.07 54.66 1noi s TYR 726 Cb 0.00 -2.66 0.01 0.00 0.35 0.00 0.00 41.96 39.65 1noi s TYR 726 CO 0.00 -0.41 -0.15 1.21 -1.34 0.00 0.00 175.55 174.86 1noi s ASN 727 N 1.73 3.57 0.40 4.32 3.04 -1.26 -4.98 114.94 121.76 1noi s ASN 727 Ca 0.12 -0.53 0.21 0.00 0.04 0.00 0.00 52.86 52.71 1noi s ASN 727 Cb -0.16 -1.57 0.35 0.00 -1.54 0.00 0.00 41.25 38.33 1noi s ASN 727 CO 0.12 0.03 1.60 0.00 -3.04 0.00 0.00 177.10 175.80 1noi h ALA 728 N 7.75 0.91 -0.24 1.71 0.00 -1.88 -3.24 119.26 124.27 1noi h ALA 728 Ca -0.40 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.28 1noi h ALA 728 Cb 1.16 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1noi h ALA 728 CO 0.60 0.18 -0.26 0.37 0.00 0.00 0.00 179.25 180.14 1noi h GLN 729 N 0.00 0.47 0.00 0.00 5.75 -1.93 -1.39 115.11 118.01 1noi h GLN 729 Ca -0.00 -0.18 0.00 0.00 -0.15 0.00 0.00 58.65 58.32 1noi h GLN 729 Cb 1.07 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.59 1noi h GLN 729 CO 0.02 0.69 0.00 -0.85 -2.65 0.00 0.00 178.83 176.04 1noi n GLU 730 N -4.12 0.18 -0.03 1.69 0.28 -1.22 -0.36 120.64 117.06 1noi n GLU 730 Ca -0.00 0.52 -0.22 0.00 -0.16 0.00 0.00 57.16 57.30 1noi n GLU 730 Cb 0.41 -1.93 -0.13 0.00 1.43 0.00 0.00 31.44 31.22 1noi n GLU 730 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 177.13 178.85 1noi h TYR 731 N 0.00 0.32 -0.87 -1.84 0.05 -1.60 -2.69 116.97 110.34 1noi h TYR 731 Ca 0.00 -0.23 0.12 0.00 0.05 0.00 0.00 58.73 58.67 1noi h TYR 731 Cb 0.21 -0.01 -0.08 0.00 1.01 0.00 0.00 36.73 37.85 1noi h TYR 731 CO 0.00 1.62 0.49 -0.92 -1.05 0.00 0.00 178.16 178.30 1noi h TYR 732 N -0.38 0.87 0.02 4.88 3.20 -0.16 -2.42 116.97 122.99 1noi h TYR 732 Ca -0.36 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.54 1noi h TYR 732 Cb 1.72 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 39.73 1noi h TYR 732 CO 0.10 0.29 -0.01 -0.44 -1.64 0.00 0.00 178.16 176.46 1noi h ASP 733 N 0.75 -0.02 -0.23 -2.11 3.32 -0.78 -3.30 116.42 114.04 1noi h ASP 733 Ca 0.44 -0.59 0.00 0.00 0.02 0.00 0.00 57.03 56.90 1noi h ASP 733 Cb 0.52 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.07 1noi h ASP 733 CO -0.30 0.60 0.00 -2.11 -1.72 0.00 0.00 179.24 175.71 1noi n ARG 734 N -4.81 1.96 -3.57 3.56 1.85 -1.02 -4.73 116.66 109.90 1noi n ARG 734 Ca -0.09 -1.01 -0.24 0.00 -1.00 0.00 0.00 57.85 55.52 1noi n ARG 734 Cb 0.31 -1.46 -0.16 0.00 -1.05 0.00 0.00 32.46 30.10 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 -1.64 -0.17 0.24 8.89 1.01 -0.93 -5.05 121.20 123.56 1noi s ILE 735 Ca 0.18 -0.16 0.01 0.00 0.00 0.00 0.00 60.65 60.68 1noi s ILE 735 Cb 0.12 -0.61 0.01 0.00 0.01 0.00 0.00 42.46 41.98 1noi s ILE 735 CO 0.09 -0.27 1.63 -0.65 0.00 0.00 0.00 174.94 175.74 1noi h PRO 736 N 8.38 0.49 -0.29 2.79 0.11 -1.85 -2.71 132.00 138.94 1noi h PRO 736 Ca -0.16 -0.24 -0.10 0.00 0.11 0.00 0.00 66.00 65.61 1noi h PRO 736 Cb 1.15 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1noi h PRO 736 CO 0.29 0.80 -0.24 0.93 -0.21 0.00 0.00 178.00 179.58 1noi h GLU 737 N 0.41 0.55 0.60 1.05 3.07 -1.97 -2.12 114.58 116.17 1noi h GLU 737 Ca 0.04 -0.21 -0.03 0.00 -0.50 0.00 0.00 59.36 58.66 1noi h GLU 737 Cb 0.86 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.75 1noi h GLU 737 CO 0.07 0.75 -0.31 1.25 -1.40 0.00 0.00 179.01 179.37 1noi h LEU 738 N 0.48 -0.74 -0.86 1.33 5.85 -1.89 -1.94 115.31 117.54 1noi h LEU 738 Ca 0.07 0.03 0.29 0.00 0.84 0.00 0.00 57.88 59.11 1noi h LEU 738 Cb 0.68 0.20 -0.16 0.00 0.37 0.00 0.00 40.66 41.75 1noi h LEU 738 CO 0.05 -0.50 0.20 -1.14 -0.34 0.00 0.00 178.44 176.71 1noi n ARG 739 N -4.29 -0.06 -0.03 1.25 0.63 -1.03 -0.02 116.66 113.11 1noi n ARG 739 Ca -0.10 1.25 -0.08 0.00 -0.92 0.00 0.00 57.85 57.99 1noi n ARG 739 Cb 0.33 -2.09 0.08 0.00 0.45 0.00 0.00 32.46 31.23 1noi n ARG 739 CO 0.00 0.00 0.00 0.37 -2.51 0.00 0.00 177.63 175.49 1noi h GLN 740 N 0.00 0.64 0.93 -0.14 4.15 -0.70 -2.74 115.11 117.25 1noi h GLN 740 Ca 0.61 -0.33 -0.05 0.00 0.77 0.00 0.00 58.65 59.66 1noi h GLN 740 Cb 1.44 0.01 0.01 0.00 0.21 0.00 0.00 27.48 29.14 1noi h GLN 740 CO -0.75 0.93 -0.45 0.82 -1.93 0.00 0.00 178.83 177.45 1noi h ILE 741 N 0.52 0.07 -0.41 2.39 1.08 0.28 -2.45 117.51 119.01 1noi h ILE 741 Ca 0.04 -0.01 0.08 0.00 -0.39 0.00 0.00 64.86 64.58 1noi h ILE 741 Cb 0.92 0.08 -0.07 0.00 -3.07 0.00 0.00 36.82 34.68 1noi h ILE 741 CO 0.08 0.00 -0.01 0.40 -0.69 0.00 0.00 178.15 177.93 1noi h ILE 742 N -1.26 0.68 0.00 -0.67 1.08 -1.39 0.11 117.51 116.06 1noi h ILE 742 Ca -0.13 -0.03 -0.00 0.00 -0.39 0.00 0.00 64.86 64.31 1noi h ILE 742 Cb 0.96 0.58 -0.00 0.00 -3.07 0.00 0.00 36.82 35.29 1noi h ILE 742 CO 0.21 0.02 -0.02 -0.33 -0.69 0.00 0.00 178.15 177.34 1noi h GLU 743 N 0.09 0.00 0.04 2.37 4.39 -1.52 0.77 114.58 120.72 1noi h GLU 743 Ca 0.20 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.68 1noi h GLU 743 Cb 0.29 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 1noi h GLU 743 CO -0.34 0.02 -1.01 1.96 -1.16 0.00 0.00 179.01 178.47 1noi h GLN 744 N 0.00 0.16 0.12 2.33 4.20 -0.30 0.20 115.11 121.82 1noi h GLN 744 Ca -0.00 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.48 1noi h GLN 744 Cb 0.40 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.26 1noi h GLN 744 CO 0.00 1.04 -0.06 -0.07 -0.67 0.00 0.00 178.83 179.08 1noi h LEU 745 N 0.07 -0.14 0.17 1.46 3.38 -0.37 -1.88 115.31 118.01 1noi h LEU 745 Ca -0.06 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1noi h LEU 745 Cb 1.71 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 42.48 1noi h LEU 745 CO 0.15 0.19 -0.17 0.28 0.09 0.00 0.00 178.44 178.99 1noi h SER 746 N -0.48 -0.45 0.16 -0.43 0.02 -0.94 -3.18 113.55 108.25 1noi h SER 746 Ca -0.02 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1noi h SER 746 Cb 0.38 0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.08 1noi h SER 746 CO 0.03 -0.26 0.00 -1.54 -1.14 0.00 0.00 176.83 173.92 1noi n SER 747 N -5.29 0.00 0.00 3.07 3.41 0.06 -4.58 113.62 110.28 1noi n SER 747 Ca -0.08 -0.16 0.00 0.00 -0.26 0.00 0.00 58.87 58.38 1noi n SER 747 Cb 0.21 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 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 -0.04 0.49 0.24 5.00 0.00 -1.20 -4.87 105.19 104.80 1noi n GLY 748 Ca 0.09 -0.92 -0.01 0.00 0.00 0.00 0.00 46.02 45.18 1noi n GLY 748 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1noi h PHE 749 N 0.00 0.44 -0.00 1.61 3.57 -1.58 -1.93 116.94 119.04 1noi h PHE 749 Ca 0.00 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.42 1noi h PHE 749 Cb 0.14 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 38.76 1noi h PHE 749 CO 0.00 0.58 -0.55 1.19 -2.23 0.00 0.00 178.31 177.30 1noi n PHE 750 N -4.17 0.00 -3.18 0.41 3.72 -1.25 -4.43 117.46 108.56 1noi n PHE 750 Ca -0.00 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.19 1noi n PHE 750 Cb 0.36 -0.15 -0.04 0.00 -0.94 0.00 0.00 39.48 38.70 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 -1.21 0.95 -0.27 4.37 3.41 -0.99 -4.70 113.62 115.17 1noi n SER 751 Ca 0.07 -2.97 -0.01 0.00 -0.26 0.00 0.00 58.87 55.70 1noi n SER 751 Cb 0.35 -0.62 0.18 0.00 -0.26 0.00 0.00 64.21 63.85 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 3.32 1.12 0.00 4.33 0.13 -1.57 0.23 132.00 139.56 1noi h PRO 752 Ca 0.10 -0.09 -0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1noi h PRO 752 Cb 0.91 -0.24 -0.00 0.00 0.13 0.00 0.00 31.00 31.79 1noi h PRO 752 CO 0.52 0.77 -0.01 0.87 -0.23 0.00 0.00 178.00 179.91 1noi h LYS 753 N 1.14 0.00 -1.97 0.86 6.56 -1.95 -3.30 116.57 117.92 1noi h LYS 753 Ca 0.30 0.00 -0.53 0.00 -1.06 0.00 0.00 60.65 59.36 1noi h LYS 753 Cb -0.08 0.00 -0.36 0.00 -0.57 0.00 0.00 32.23 31.22 1noi h LYS 753 CO -0.06 0.01 -1.00 1.04 -2.06 0.00 0.00 179.45 177.38 1noi n GLN 754 N -3.16 0.51 -0.34 3.15 6.02 0.05 -5.05 117.38 118.56 1noi n GLN 754 Ca -0.02 -3.06 0.08 0.00 -0.01 0.00 0.00 57.00 54.00 1noi n GLN 754 Cb 0.16 -1.41 0.18 0.00 1.02 0.00 0.00 30.24 30.19 1noi n GLN 754 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1noi n PRO 755 N 2.02 -0.08 -1.18 -1.09 -0.02 -1.08 -1.76 135.00 131.81 1noi n PRO 755 Ca 0.23 1.48 -0.25 0.00 -2.02 0.00 0.00 63.50 62.95 1noi n PRO 755 Cb 0.52 -2.25 0.15 0.00 -0.02 0.00 0.00 33.50 31.89 1noi n PRO 755 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1noi n ASP 756 N -5.52 4.58 -0.16 2.55 5.68 -1.26 -3.39 116.55 119.03 1noi n ASP 756 Ca 0.18 -3.56 0.05 0.00 -0.50 0.00 0.00 54.79 50.96 1noi n ASP 756 Cb 0.56 -0.86 0.34 0.00 -1.14 0.00 0.00 41.12 40.03 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 1.24 0.67 -3.77 -2.12 5.85 -1.67 -1.91 115.31 113.60 1noi h LEU 757 Ca 0.60 -0.00 -0.28 0.00 0.84 0.00 0.00 57.88 59.03 1noi h LEU 757 Cb 2.33 -0.15 -0.16 0.00 0.37 0.00 0.00 40.66 43.04 1noi h LEU 757 CO 1.15 0.45 0.33 0.49 -0.34 0.00 0.00 178.44 180.53 1noi n PHE 758 N -4.46 2.50 -0.27 1.25 3.72 -1.26 -4.54 117.46 114.40 1noi n PHE 758 Ca 0.09 -1.35 0.04 0.00 -0.05 0.00 0.00 57.45 56.17 1noi n PHE 758 Cb 0.16 -0.73 0.13 0.00 -0.94 0.00 0.00 39.48 38.09 1noi n PHE 758 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 1noi h LYS 759 N 2.23 0.03 -0.40 -1.08 1.57 -1.66 -2.27 116.57 114.99 1noi h LYS 759 Ca 0.34 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.11 1noi h LYS 759 Cb 2.41 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 34.69 1noi h LYS 759 CO 0.80 0.02 0.22 -0.44 -0.57 0.00 0.00 179.45 179.48 1noi h ASP 760 N 0.03 0.50 0.42 0.86 5.19 -1.84 -1.10 116.42 120.49 1noi h ASP 760 Ca 0.40 -0.09 -0.02 0.00 -0.62 0.00 0.00 57.03 56.70 1noi h ASP 760 Cb 0.66 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 40.05 1noi h ASP 760 CO -0.77 0.44 -0.20 0.40 -3.12 0.00 0.00 179.24 175.99 1noi h ILE 761 N 0.52 0.58 -0.92 0.35 2.04 -1.78 -0.08 117.51 118.22 1noi h ILE 761 Ca 0.14 -0.22 0.11 0.00 1.00 0.00 0.00 64.86 65.89 1noi h ILE 761 Cb 0.05 0.68 -0.08 0.00 -0.74 0.00 0.00 36.82 36.73 1noi h ILE 761 CO -0.02 0.04 0.55 0.58 0.00 0.00 0.00 178.15 179.30 1noi h VAL 762 N -0.70 0.90 0.00 1.67 2.07 -1.22 0.95 116.25 119.93 1noi h VAL 762 Ca -0.06 -0.30 -0.15 0.00 0.82 0.00 0.00 66.70 67.01 1noi h VAL 762 Cb 0.50 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 1noi h VAL 762 CO 0.10 0.16 -0.73 0.78 0.02 0.00 0.00 177.57 177.89 1noi h ASN 763 N 0.88 0.00 0.18 0.57 2.35 -0.98 0.71 115.58 119.30 1noi h ASN 763 Ca 0.45 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.19 1noi h ASN 763 Cb 0.45 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.82 1noi h ASN 763 CO -0.27 0.73 -0.09 -0.03 -1.65 0.00 0.00 177.43 176.13 1noi h MET 764 N 0.00 -0.24 -0.48 0.81 4.05 0.64 0.36 114.93 120.07 1noi h MET 764 Ca -0.01 0.02 0.06 0.00 -0.28 0.00 0.00 59.70 59.49 1noi h MET 764 Cb 1.39 0.05 -0.06 0.00 -0.80 0.00 0.00 31.60 32.19 1noi h MET 764 CO 0.10 0.04 0.17 -0.07 0.23 0.00 0.00 176.91 177.38 1noi h LEU 765 N -0.52 0.17 -0.10 3.39 4.07 -0.82 0.53 115.31 122.03 1noi h LEU 765 Ca -0.03 0.06 -0.23 0.00 0.08 0.00 0.00 57.88 57.76 1noi h LEU 765 Cb 0.39 0.04 0.00 0.00 1.08 0.00 0.00 40.66 42.18 1noi h LEU 765 CO 0.04 0.13 -1.02 0.24 -1.08 0.00 0.00 178.44 176.75 1noi h MET 766 N 0.34 0.32 0.00 1.13 2.86 -0.84 -3.42 114.93 115.33 1noi h MET 766 Ca 0.23 -0.40 -0.05 0.00 -2.06 0.00 0.00 59.70 57.42 1noi h MET 766 Cb 0.24 0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 1noi h MET 766 CO -0.24 1.11 -1.19 0.72 1.06 0.00 0.00 176.91 178.37 1noi n HIS 767 N -3.66 0.00 -3.04 -0.22 8.25 0.13 -4.38 115.22 112.29 1noi n HIS 767 Ca -0.07 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.22 1noi n HIS 767 Cb 0.89 -0.14 -0.03 0.00 1.12 0.00 0.00 29.99 31.83 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 -2.14 -1.79 -3.45 4.41 -0.00 0.18 -5.01 115.22 107.43 1noi n HIS 768 Ca -0.05 -2.71 -0.41 0.00 -0.00 0.00 0.00 57.72 54.56 1noi n HIS 768 Cb 0.59 0.55 -0.10 0.00 -0.00 0.00 0.00 29.99 31.03 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 -0.84 6.12 0.35 4.39 -1.08 -0.93 -4.75 116.67 119.93 1noi s ASP 769 Ca 0.33 -0.43 0.26 0.00 -0.52 0.00 0.00 52.55 52.19 1noi s ASP 769 Cb 0.14 -2.17 0.82 0.00 -1.46 0.00 0.00 42.92 40.25 1noi s ASP 769 CO -0.16 -0.33 1.76 0.03 0.52 0.00 0.00 175.17 176.99 1noi h ARG 770 N 8.52 0.00 -0.33 4.34 3.08 -1.97 -3.34 114.38 124.68 1noi h ARG 770 Ca -0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.75 1noi h ARG 770 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.19 1noi h ARG 770 CO 0.68 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.77 1noi n PHE 771 N -2.66 0.58 -3.80 3.04 3.72 -1.26 -5.03 117.46 112.05 1noi n PHE 771 Ca 0.03 -0.59 -0.25 0.00 -0.05 0.00 0.00 57.45 56.59 1noi n PHE 771 Cb 0.39 -0.10 0.01 0.00 -0.94 0.00 0.00 39.48 38.85 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 0.27 -3.33 0.27 -1.08 5.02 -1.26 -4.69 118.16 113.37 1noi n LYS 772 Ca 0.14 0.49 -0.16 0.00 -2.02 0.00 0.00 58.31 56.76 1noi n LYS 772 Cb 0.54 -4.66 -0.08 0.00 -0.02 0.00 0.00 35.03 30.80 1noi n LYS 772 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1noi h VAL 773 N -1.85 0.50 -0.41 -0.18 2.07 -1.94 -2.96 116.25 111.48 1noi h VAL 773 Ca -0.63 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 1noi h VAL 773 Cb 1.37 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.62 1noi h VAL 773 CO 0.57 0.00 0.22 -0.26 0.02 0.00 0.00 177.57 178.12 1noi h PHE 774 N -0.65 0.54 0.00 1.57 0.04 -1.91 -2.30 116.94 114.23 1noi h PHE 774 Ca -0.06 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.71 1noi h PHE 774 Cb 0.51 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.49 1noi h PHE 774 CO -0.06 0.38 0.00 0.00 -0.60 0.00 0.00 178.31 178.03 1noi h ALA 775 N 1.68 1.00 -0.01 2.45 0.00 -1.91 -1.88 119.26 120.59 1noi h ALA 775 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1noi h ALA 775 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1noi h ALA 775 CO -0.02 0.00 -0.09 -0.25 0.00 0.00 0.00 179.25 178.89 1noi n ASP 776 N -3.05 1.28 -0.35 0.00 8.00 -0.89 -4.77 116.55 116.77 1noi n ASP 776 Ca -0.02 -1.14 0.03 0.00 0.71 0.00 0.00 54.79 54.37 1noi n ASP 776 Cb 0.13 0.27 0.17 0.00 -0.02 0.00 0.00 41.12 41.68 1noi n ASP 776 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1noi h TYR 777 N 1.10 1.14 0.25 1.24 5.03 -1.05 -0.42 116.97 124.27 1noi h TYR 777 Ca 0.00 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.33 1noi h TYR 777 Cb 0.28 -0.37 0.00 0.00 1.55 0.00 0.00 36.73 38.19 1noi h TYR 777 CO 0.00 0.57 -0.12 0.93 -1.32 0.00 0.00 178.16 178.22 1noi h GLU 778 N 1.10 -0.33 -0.22 1.82 5.08 -1.86 -0.36 114.58 119.81 1noi h GLU 778 Ca 0.43 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.87 1noi h GLU 778 Cb 0.21 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 1noi h GLU 778 CO -0.19 0.01 0.16 0.93 -1.00 0.00 0.00 179.01 178.92 1noi h GLU 779 N -0.72 0.01 -0.11 2.33 5.08 -1.88 0.15 114.58 119.43 1noi h GLU 779 Ca -0.03 -0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.23 1noi h GLU 779 Cb 0.49 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1noi h GLU 779 CO 0.06 0.01 -0.32 -0.92 -1.00 0.00 0.00 179.01 176.84 1noi h TYR 780 N 0.01 0.54 0.00 4.33 3.20 -0.92 -2.33 116.97 121.80 1noi h TYR 780 Ca 0.10 -0.21 -0.09 0.00 3.14 0.00 0.00 58.73 61.68 1noi h TYR 780 Cb 0.40 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 1noi h TYR 780 CO -0.00 0.93 -0.41 -0.39 -1.64 0.00 0.00 178.16 176.65 1noi h VAL 781 N -0.01 0.85 -0.28 1.81 -1.51 0.76 -2.17 116.25 115.70 1noi h VAL 781 Ca -0.01 -1.72 -0.08 0.00 -1.23 0.00 0.00 66.70 63.67 1noi h VAL 781 Cb 0.93 2.07 -0.01 0.00 -2.13 0.00 0.00 31.29 32.16 1noi h VAL 781 CO 0.07 0.40 -0.13 0.11 -1.23 0.00 0.00 177.57 176.78 1noi h LYS 782 N 0.00 0.59 -0.98 5.19 1.79 -1.25 -2.30 116.57 119.61 1noi h LYS 782 Ca -0.00 -0.26 0.00 0.00 -2.18 0.00 0.00 60.65 58.21 1noi h LYS 782 Cb 1.04 -0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 31.63 1noi h LYS 782 CO 0.05 0.83 0.62 0.00 -1.08 0.00 0.00 179.45 179.87 1noi h GLN 784 N 1.34 1.12 -0.84 0.00 1.08 -1.31 -1.28 115.11 115.21 1noi h GLN 784 Ca 0.35 -0.09 0.04 0.00 -1.45 0.00 0.00 58.65 57.51 1noi h GLN 784 Cb -0.11 -0.24 -0.05 0.00 -0.05 0.00 0.00 27.48 27.03 1noi h GLN 784 CO -0.07 0.77 0.54 0.93 -0.95 0.00 0.00 178.83 180.04 1noi h GLU 785 N 1.14 0.99 -0.70 1.46 5.08 -0.69 -0.84 114.58 121.02 1noi h GLU 785 Ca 0.30 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.60 1noi h GLU 785 Cb -0.08 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 28.91 1noi h GLU 785 CO -0.06 0.66 0.41 0.00 -1.00 0.00 0.00 179.01 179.02 1noi h ARG 786 N 1.02 0.95 -0.17 2.33 3.08 -0.93 0.10 114.38 120.76 1noi h ARG 786 Ca 0.35 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.31 1noi h ARG 786 Cb 0.06 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.90 1noi h ARG 786 CO -0.13 0.67 0.09 0.28 -1.07 0.00 0.00 179.97 179.81 1noi h VAL 787 N 0.97 1.12 -0.64 2.04 2.07 -0.08 -0.59 116.25 121.14 1noi h VAL 787 Ca 0.25 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1noi h VAL 787 Cb -0.02 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 1noi h VAL 787 CO -0.05 0.11 0.41 0.28 0.02 0.00 0.00 177.57 178.34 1noi h SER 788 N 0.16 0.74 -0.13 0.57 0.02 -0.69 -0.71 113.55 113.52 1noi h SER 788 Ca 0.06 -0.03 -0.05 0.00 -0.84 0.00 0.00 61.79 60.94 1noi h SER 788 Cb 0.10 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.45 1noi h SER 788 CO -0.01 0.55 -0.10 0.00 -1.14 0.00 0.00 176.83 176.13 1noi h ALA 789 N 1.58 0.18 -0.02 3.77 0.00 -0.19 -2.80 119.26 121.78 1noi h ALA 789 Ca 0.23 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1noi h ALA 789 Cb -0.08 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1noi h ALA 789 CO -0.05 0.02 -0.26 1.25 0.00 0.00 0.00 179.25 180.22 1noi h LEU 790 N -0.09 0.03 -1.05 0.00 5.85 -0.92 -2.93 115.31 116.20 1noi h LEU 790 Ca 0.02 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.64 1noi h LEU 790 Cb 0.61 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1noi h LEU 790 CO 0.03 0.29 -0.43 0.22 -0.34 0.00 0.00 178.44 178.20 1noi h TYR 791 N 0.03 0.00 0.00 1.25 3.20 -0.86 -0.81 116.97 119.78 1noi h TYR 791 Ca 0.00 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 1noi h TYR 791 Cb 0.47 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.74 1noi h TYR 791 CO 0.00 0.43 -0.04 -0.22 -1.64 0.00 0.00 178.16 176.69 1noi h LYS 792 N 0.00 0.00 -3.58 1.82 3.64 -1.42 -3.34 116.57 113.70 1noi h LYS 792 Ca -0.00 0.00 -0.74 0.00 -1.27 0.00 0.00 60.65 58.64 1noi h LYS 792 Cb 0.85 0.00 -0.32 0.00 -0.41 0.00 0.00 32.23 32.35 1noi h LYS 792 CO 0.06 0.04 -0.04 1.21 -2.27 0.00 0.00 179.45 178.45 1noi s ASN 793 N -5.72 6.17 0.66 4.20 3.84 -0.31 -5.00 114.94 118.78 1noi s ASN 793 Ca -0.03 -3.15 0.43 0.00 0.21 0.00 0.00 52.86 50.33 1noi s ASN 793 Cb 0.12 -2.02 2.33 0.00 -0.55 0.00 0.00 41.25 41.13 1noi s ASN 793 CO 0.52 -0.37 2.35 -0.65 -2.79 0.00 0.00 177.10 176.16 1noi h PRO 794 N 6.92 0.00 0.10 0.43 0.11 -1.78 -1.90 132.00 135.88 1noi h PRO 794 Ca 0.09 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 65.85 1noi h PRO 794 Cb 0.93 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.02 1noi h PRO 794 CO 0.80 0.00 -1.93 -2.13 -0.21 0.00 0.00 178.00 174.54 1noi n ARG 795 N -3.16 0.74 -0.02 1.05 0.63 -1.26 -2.81 116.66 111.83 1noi n ARG 795 Ca -0.03 0.27 -0.04 0.00 -0.92 0.00 0.00 57.85 57.13 1noi n ARG 795 Cb 0.08 -1.73 0.18 0.00 0.45 0.00 0.00 32.46 31.44 1noi n ARG 795 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1noi h GLU 796 N 0.06 0.59 0.18 -0.14 4.39 -1.83 -0.39 114.58 117.44 1noi h GLU 796 Ca -0.39 -0.20 -0.01 0.00 0.34 0.00 0.00 59.36 59.10 1noi h GLU 796 Cb 2.03 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 30.64 1noi h GLU 796 CO 0.09 0.74 -0.09 2.35 -1.16 0.00 0.00 179.01 180.95 1noi h TRP 797 N 0.53 -0.23 -0.08 4.33 7.01 -1.49 -1.77 115.95 124.24 1noi h TRP 797 Ca 0.08 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.06 1noi h TRP 797 Cb 0.62 0.08 -0.01 0.00 -2.10 0.00 0.00 29.16 27.75 1noi h TRP 797 CO 0.02 0.03 -0.02 1.15 -2.79 0.00 0.00 178.44 176.83 1noi h THR 798 N -0.47 1.07 0.00 2.65 2.02 -1.42 -1.43 112.91 115.33 1noi h THR 798 Ca -0.03 -0.30 -0.14 0.00 0.77 0.00 0.00 66.41 66.72 1noi h THR 798 Cb 0.36 1.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 1noi h THR 798 CO 0.04 0.09 -0.68 0.03 0.37 0.00 0.00 175.52 175.38 1noi h ARG 799 N 0.12 0.00 0.03 6.66 3.08 -0.84 -1.71 114.38 121.72 1noi h ARG 799 Ca 0.03 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.81 1noi h ARG 799 Cb 0.13 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.20 1noi h ARG 799 CO 0.00 0.68 -1.07 1.98 -1.07 0.00 0.00 179.97 180.49 1noi h MET 800 N 0.00 0.68 -0.28 0.04 4.05 -0.51 -2.31 114.93 116.60 1noi h MET 800 Ca -0.01 -0.77 0.05 0.00 -0.28 0.00 0.00 59.70 58.70 1noi h MET 800 Cb 1.35 0.23 -0.08 0.00 -0.80 0.00 0.00 31.60 32.30 1noi h MET 800 CO 0.09 1.33 -0.45 0.28 0.23 0.00 0.00 176.91 178.40 1noi h VAL 801 N 0.35 0.10 -0.86 -5.77 2.07 -1.20 -1.91 116.25 109.04 1noi h VAL 801 Ca -0.14 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.50 1noi h VAL 801 Cb 1.73 0.10 -0.08 0.00 -1.52 0.00 0.00 31.29 31.52 1noi h VAL 801 CO 0.21 0.00 0.48 0.40 0.02 0.00 0.00 177.57 178.68 1noi h ILE 802 N -0.42 0.84 -0.27 4.57 2.04 -1.25 0.42 117.51 123.44 1noi h ILE 802 Ca 0.10 -0.26 0.03 0.00 1.00 0.00 0.00 64.86 65.73 1noi h ILE 802 Cb 0.61 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1noi h ILE 802 CO -0.50 0.14 0.18 -0.09 0.00 0.00 0.00 178.15 177.88 1noi h ARG 803 N 0.75 0.23 0.00 2.37 9.65 -0.87 -0.40 114.38 126.10 1noi h ARG 803 Ca 0.44 -0.01 -0.05 0.00 -1.10 0.00 0.00 59.98 59.25 1noi h ARG 803 Cb 0.50 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.02 1noi h ARG 803 CO -0.29 0.15 -0.52 -0.91 2.80 0.00 0.00 179.97 181.20 1noi h ASN 804 N 0.23 0.00 -0.79 -3.80 -0.26 0.43 -3.24 115.58 108.15 1noi h ASN 804 Ca 0.11 -0.20 0.16 0.00 -0.56 0.00 0.00 56.30 55.82 1noi h ASN 804 Cb 0.17 0.00 -0.11 0.00 -1.06 0.00 0.00 38.32 37.32 1noi h ASN 804 CO -0.02 0.88 0.30 0.40 -1.06 0.00 0.00 177.43 177.93 1noi h ILE 805 N -1.00 0.58 0.00 2.81 2.04 -0.68 -1.31 117.51 119.95 1noi h ILE 805 Ca -0.08 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.65 1noi h ILE 805 Cb 0.62 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 1noi h ILE 805 CO -0.05 0.07 0.00 0.00 0.00 0.00 0.00 178.15 178.18 1noi n ALA 806 N -2.55 1.91 -0.59 1.87 0.00 -0.16 -3.00 120.51 118.00 1noi n ALA 806 Ca 0.16 -0.07 0.06 0.00 0.00 0.00 0.00 53.44 53.58 1noi n ALA 806 Cb 0.48 -1.31 0.09 0.00 0.00 0.00 0.00 19.45 18.71 1noi n ALA 806 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1noi n THR 807 N -1.43 1.50 1.62 0.00 5.66 -0.51 -2.40 114.28 118.72 1noi n THR 807 Ca 0.06 -1.68 0.15 0.00 -3.05 0.00 0.00 64.05 59.53 1noi n THR 807 Cb 0.20 0.09 0.65 0.00 -1.55 0.00 0.00 70.33 69.72 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 -0.94 0.91 0.01 1.09 3.41 -1.10 -4.47 113.62 112.54 1noi n SER 808 Ca 0.09 -1.20 0.11 0.00 -0.26 0.00 0.00 58.87 57.61 1noi n SER 808 Cb 0.48 -0.00 0.53 0.00 -0.26 0.00 0.00 64.21 64.96 1noi n SER 808 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1noi h GLY 809 N 4.91 0.40 2.00 5.00 0.00 -1.83 -2.16 103.07 111.39 1noi h GLY 809 Ca 0.00 -0.13 -0.00 0.00 0.00 0.00 0.00 47.33 47.20 1noi h GLY 809 CO 0.00 0.09 -0.01 1.70 0.00 0.00 0.00 176.54 178.33 1noi h LYS 810 N 0.31 0.00 -0.69 4.80 3.64 -1.90 -2.75 116.57 119.99 1noi h LYS 810 Ca 0.20 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1noi h LYS 810 Cb 0.37 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 1noi h LYS 810 CO -0.04 0.01 0.00 1.19 -2.27 0.00 0.00 179.45 178.33 1noi n PHE 811 N -3.50 0.85 -2.69 1.91 3.72 -0.81 -4.69 117.46 112.25 1noi n PHE 811 Ca -0.03 -0.31 -0.40 0.00 -0.05 0.00 0.00 57.45 56.66 1noi n PHE 811 Cb 0.09 -0.22 -0.06 0.00 -0.94 0.00 0.00 39.48 38.35 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 -0.52 7.51 0.17 4.37 0.15 -1.04 -0.72 113.70 123.63 1noi s SER 812 Ca 0.25 2.01 0.23 0.00 0.70 0.00 0.00 55.95 59.14 1noi s SER 812 Cb 0.18 -2.61 0.90 0.00 -1.71 0.00 0.00 66.02 62.78 1noi s SER 812 CO 0.09 0.06 1.71 -1.54 1.20 0.00 0.00 173.24 174.76 1noi n SER 813 N 1.29 0.51 0.09 5.45 3.41 0.17 -1.28 113.62 123.26 1noi n SER 813 Ca -0.01 0.59 0.01 0.00 -0.26 0.00 0.00 58.87 59.20 1noi n SER 813 Cb 0.47 -0.71 0.33 0.00 -0.26 0.00 0.00 64.21 64.03 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 0.28 0.25 4.04 3.32 -1.91 -0.89 116.42 121.50 1noi h ASP 814 Ca 0.00 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 1noi h ASP 814 Cb 0.45 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1noi h ASP 814 CO 0.00 0.49 -0.12 -0.09 -1.72 0.00 0.00 179.24 177.80 1noi h ARG 815 N 0.26 -0.32 -0.97 3.56 1.12 -1.50 -1.84 114.38 114.69 1noi h ARG 815 Ca 0.05 0.02 0.15 0.00 -1.11 0.00 0.00 59.98 59.09 1noi h ARG 815 Cb 0.50 0.07 -0.16 0.00 -0.01 0.00 0.00 29.97 30.37 1noi h ARG 815 CO 0.03 -0.08 -0.38 1.15 -3.11 0.00 0.00 179.97 177.58 1noi h THR 816 N -1.03 0.01 -0.41 0.20 2.02 -1.57 -2.18 112.91 109.95 1noi h THR 816 Ca -0.03 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.03 1noi h THR 816 Cb 0.39 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 66.80 1noi h THR 816 CO 0.06 0.00 -0.21 0.40 0.37 0.00 0.00 175.52 176.14 1noi h ILE 817 N -0.01 1.27 0.00 3.11 1.08 -1.16 -1.40 117.51 120.40 1noi h ILE 817 Ca 0.35 -1.32 -0.03 0.00 -0.39 0.00 0.00 64.86 63.46 1noi h ILE 817 Cb 0.60 1.17 -0.00 0.00 -3.07 0.00 0.00 36.82 35.52 1noi h ILE 817 CO -0.97 0.45 -0.15 0.00 -0.69 0.00 0.00 178.15 176.78 1noi h ALA 818 N 1.05 1.60 0.14 1.87 0.00 -0.72 -0.66 119.26 122.54 1noi h ALA 818 Ca 0.10 -0.14 -0.30 0.00 0.00 0.00 0.00 54.91 54.57 1noi h ALA 818 Cb 0.73 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.52 1noi h ALA 818 CO 0.06 0.19 -1.28 1.96 0.00 0.00 0.00 179.25 180.17 1noi h GLN 819 N 0.00 0.60 -0.29 0.00 4.20 -0.90 -2.28 115.11 116.44 1noi h GLN 819 Ca -0.00 -0.84 0.03 0.00 0.06 0.00 0.00 58.65 57.90 1noi h GLN 819 Cb 0.29 0.28 -0.03 0.00 0.30 0.00 0.00 27.48 28.32 1noi h GLN 819 CO 0.02 1.38 0.10 1.88 -0.67 0.00 0.00 178.83 181.54 1noi h TYR 820 N 0.25 0.18 -0.08 2.96 0.05 -1.01 -1.84 116.97 117.49 1noi h TYR 820 Ca -0.20 0.02 0.04 0.00 0.05 0.00 0.00 58.73 58.64 1noi h TYR 820 Cb 1.96 -0.04 -0.06 0.00 1.01 0.00 0.00 36.73 39.60 1noi h TYR 820 CO 0.11 0.08 -0.41 0.00 -1.05 0.00 0.00 178.16 176.89 1noi h ALA 821 N 1.19 -0.61 -0.03 3.88 0.00 -1.12 0.14 119.26 122.71 1noi h ALA 821 Ca 0.13 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 1noi h ALA 821 Cb 0.10 0.76 0.01 0.00 0.00 0.00 0.00 17.79 18.65 1noi h ALA 821 CO -0.14 -0.93 -0.35 0.00 0.00 0.00 0.00 179.25 177.83 1noi h ARG 822 N -0.52 0.29 0.00 0.00 3.08 -1.38 0.30 114.38 116.15 1noi h ARG 822 Ca 0.07 -0.27 -0.07 0.00 0.07 0.00 0.00 59.98 59.77 1noi h ARG 822 Cb 0.63 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.74 1noi h ARG 822 CO -0.36 0.95 -0.96 0.93 -1.07 0.00 0.00 179.97 179.46 1noi h GLU 823 N -0.27 0.00 0.00 0.04 5.08 -1.41 -3.36 114.58 114.67 1noi h GLU 823 Ca -0.04 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1noi h GLU 823 Cb 1.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.30 1noi h GLU 823 CO 0.07 0.16 -1.06 -0.89 -1.00 0.00 0.00 179.01 176.29 1noi n ILE 824 N -2.87 0.06 0.83 3.13 5.41 0.33 -4.86 119.36 121.39 1noi n ILE 824 Ca -0.03 -0.03 0.10 0.00 1.00 0.00 0.00 62.75 63.80 1noi n ILE 824 Cb 0.67 -0.62 -0.13 0.00 -0.71 0.00 0.00 39.64 38.86 1noi n ILE 824 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.55 177.34 1noi n TRP 825 N -2.44 0.00 -2.79 1.39 8.01 -0.29 -4.99 117.44 116.32 1noi n TRP 825 Ca -0.02 0.00 -0.17 0.00 -1.31 0.00 0.00 57.50 56.00 1noi n TRP 825 Cb 0.52 -0.08 0.02 0.00 -2.01 0.00 0.00 31.31 29.77 1noi n TRP 825 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1noi n GLY 826 N 1.46 -0.23 3.43 6.99 0.00 0.99 -4.97 105.19 112.86 1noi n GLY 826 Ca 0.03 -0.11 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 1noi n GLY 826 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1noi s VAL 827 N -3.00 1.78 -0.11 1.61 -7.23 -0.87 -5.01 120.40 107.57 1noi s VAL 827 Ca 0.21 -2.17 0.01 0.00 -1.81 0.00 0.00 61.98 58.22 1noi s VAL 827 Cb -0.09 -2.40 -0.02 0.00 0.56 0.00 0.00 36.38 34.43 1noi s VAL 827 CO 0.26 -0.34 -0.13 -1.61 -0.31 0.00 0.00 175.10 172.97 1noi s GLU 828 N -3.69 3.20 0.79 4.82 0.41 -1.26 -3.24 118.70 119.73 1noi s GLU 828 Ca 0.29 -0.69 -0.15 0.00 -0.41 0.00 0.00 54.97 54.01 1noi s GLU 828 Cb 0.02 -2.58 0.02 0.00 -1.78 0.00 0.00 34.13 29.82 1noi s GLU 828 CO 0.12 0.30 0.83 -2.30 -0.49 0.00 0.00 175.26 173.72 1noi n PRO 829 N 3.27 0.22 -4.07 0.39 -0.02 -1.26 -4.93 135.00 128.59 1noi n PRO 829 Ca -0.18 0.13 -0.14 0.00 -2.02 0.00 0.00 63.50 61.29 1noi n PRO 829 Cb 0.53 -2.12 -0.14 0.00 -0.02 0.00 0.00 33.50 31.75 1noi n PRO 829 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1noi s SER 830 N -1.80 0.44 -0.23 2.55 0.15 0.79 -5.00 113.70 110.59 1noi s SER 830 Ca 0.68 -0.10 0.11 0.00 0.70 0.00 0.00 55.95 57.35 1noi s SER 830 Cb -0.31 -0.04 0.44 0.00 -1.71 0.00 0.00 66.02 64.40 1noi s SER 830 CO 0.55 0.03 1.20 -1.14 1.20 0.00 0.00 173.24 175.08 1noi n ARG 831 N 2.89 2.28 -3.02 5.44 0.63 -1.26 -3.21 116.66 120.41 1noi n ARG 831 Ca -0.13 -3.57 -0.40 0.00 -0.92 0.00 0.00 57.85 52.82 1noi n ARG 831 Cb 0.58 -1.78 -0.05 0.00 0.45 0.00 0.00 32.46 31.67 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 -3.21 4.32 -0.44 -0.14 0.74 -1.26 -4.98 119.66 114.69 1noi s GLN 832 Ca 0.42 0.84 -0.28 0.00 0.05 0.00 0.00 55.36 56.40 1noi s GLN 832 Cb 0.38 -3.53 -0.02 0.00 1.10 0.00 0.00 33.01 30.94 1noi s GLN 832 CO -0.03 -0.15 1.86 1.03 -0.55 0.00 0.00 175.29 177.44 1noi s ARG 833 N 1.57 3.00 0.26 1.67 3.00 -1.26 -4.96 118.95 122.23 1noi s ARG 833 Ca 0.35 1.13 -0.29 0.00 0.00 0.00 0.00 55.73 56.92 1noi s ARG 833 Cb -0.17 -4.29 -0.09 0.00 0.00 0.00 0.00 34.95 30.40 1noi s ARG 833 CO 0.14 -2.27 1.20 -1.17 0.00 0.00 0.00 175.30 173.20 1noi s LEU 834 N 8.04 4.48 0.00 2.53 0.20 0.16 -4.97 118.68 129.12 1noi s LEU 834 Ca 0.76 2.37 0.00 0.00 0.69 0.00 0.00 54.13 57.96 1noi s LEU 834 Cb -0.18 -3.62 0.00 0.00 -0.43 0.00 0.00 46.19 41.95 1noi s LEU 834 CO 0.28 -0.34 0.00 -0.81 -0.29 0.00 0.00 176.35 175.19 1noi n PRO 835 N 1.62 3.66 -0.03 0.98 -0.04 -1.26 -3.98 135.00 135.94 1noi n PRO 835 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1noi n PRO 835 Cb 0.44 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 33.90 1noi n PRO 835 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1noi n ALA 836 N -3.00 -0.08 0.00 0.55 0.00 -1.26 -4.82 120.51 111.90 1noi n ALA 836 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1noi n ALA 836 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.42 1noi n ALA 836 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1noi n PRO 837 N -0.53 0.00 0.00 0.00 -0.02 -1.26 -5.09 135.00 128.10 1noi n PRO 837 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1noi n PRO 837 Cb 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.49 1noi n PRO 837 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01