#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r0b s ASN 2 N 0.00 4.44 0.63 0.00 2.20 -1.08 -4.87 114.94 116.26 1r0b s ASN 2 Ca 0.00 2.07 0.19 0.00 -0.94 0.00 0.00 52.86 54.18 1r0b s ASN 2 Cb 0.00 -2.56 0.85 0.00 -2.00 0.00 0.00 41.25 37.55 1r0b s ASN 2 CO 0.00 -2.09 1.43 -0.65 -2.94 0.00 0.00 177.10 172.85 1r0b h PRO 3 N -0.59 0.00 -0.13 3.55 0.11 -1.95 0.51 132.00 133.51 1r0b h PRO 3 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1r0b h PRO 3 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1r0b h PRO 3 CO 0.51 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.58 1r0b n LEU 4 N -3.00 2.17 -4.72 2.35 4.77 -1.26 -4.93 117.00 112.38 1r0b n LEU 4 Ca 0.08 -1.69 -0.42 0.00 -0.03 0.00 0.00 56.01 53.95 1r0b n LEU 4 Cb 0.97 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.95 1r0b n LEU 4 CO 0.14 0.52 1.27 0.00 -1.33 0.00 0.00 177.39 178.00 1r0b n TYR 5 N 0.13 2.72 -0.88 -1.77 9.36 0.17 -2.31 117.16 124.57 1r0b n TYR 5 Ca 0.05 0.18 -0.03 0.00 3.32 0.00 0.00 57.90 61.43 1r0b n TYR 5 Cb 0.28 -2.61 -0.01 0.00 -0.63 0.00 0.00 39.34 36.36 1r0b n TYR 5 CO 0.00 0.00 0.00 1.04 0.22 0.00 0.00 176.86 178.12 1r0b n GLN 6 N 2.96 -1.87 -2.84 2.98 1.13 0.27 -4.95 117.38 115.06 1r0b n GLN 6 Ca 0.12 0.48 -0.32 0.00 -1.94 0.00 0.00 57.00 55.34 1r0b n GLN 6 Cb 0.35 -4.53 -0.05 0.00 0.11 0.00 0.00 30.24 26.13 1r0b n GLN 6 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1r0b s LYS 7 N -1.84 3.95 0.26 -1.09 -0.14 -0.98 -4.49 119.74 115.41 1r0b s LYS 7 Ca 0.00 0.72 -0.24 0.00 -1.36 0.00 0.00 55.97 55.09 1r0b s LYS 7 Cb 0.00 -2.32 -0.09 0.00 -1.68 0.00 0.00 37.83 33.74 1r0b s LYS 7 CO 0.00 -0.03 0.85 -1.01 -0.76 0.00 0.00 175.35 174.40 1r0b s HIS 8 N -2.28 3.72 -0.65 3.18 3.76 -1.26 -4.56 115.29 117.20 1r0b s HIS 8 Ca 0.55 1.64 0.03 0.00 -0.15 0.00 0.00 55.06 57.13 1r0b s HIS 8 Cb -0.10 -2.80 0.16 0.00 1.11 0.00 0.00 32.58 30.95 1r0b s HIS 8 CO 0.24 0.31 0.43 0.42 -0.85 0.00 0.00 174.74 175.29 1r0b s ILE 9 N -1.50 2.97 -0.18 0.60 -1.09 -1.12 -4.89 121.20 115.99 1r0b s ILE 9 Ca 0.45 -3.80 0.02 0.00 -2.23 0.00 0.00 60.65 55.09 1r0b s ILE 9 Cb -0.19 -2.97 -0.12 0.00 -1.58 0.00 0.00 42.46 37.59 1r0b s ILE 9 CO 0.24 -0.93 -0.16 -0.38 -1.23 0.00 0.00 174.94 172.48 1r0b n ILE 10 N 2.53 1.06 -3.83 2.92 2.08 -1.26 -1.05 119.36 121.82 1r0b n ILE 10 Ca 0.14 -0.41 -0.13 0.00 0.56 0.00 0.00 62.75 62.91 1r0b n ILE 10 Cb 0.34 -1.14 -0.14 0.00 -0.75 0.00 0.00 39.64 37.95 1r0b n ILE 10 CO 0.00 0.00 0.00 -0.55 0.56 0.00 0.00 176.55 176.56 1r0b s SER 11 N -5.78 -0.06 0.56 4.38 0.15 -1.26 -4.67 113.70 107.02 1r0b s SER 11 Ca -0.25 0.15 0.29 0.00 0.70 0.00 0.00 55.95 56.85 1r0b s SER 11 Cb 0.06 0.13 1.65 0.00 -1.71 0.00 0.00 66.02 66.15 1r0b s SER 11 CO 0.43 -0.05 2.16 0.40 1.20 0.00 0.00 173.24 177.38 1r0b h ILE 12 N 5.28 0.50 0.00 6.45 1.08 -1.95 0.50 117.51 129.38 1r0b h ILE 12 Ca -0.29 -0.30 0.00 0.00 -0.39 0.00 0.00 64.86 63.88 1r0b h ILE 12 Cb 1.19 1.20 0.00 0.00 -3.07 0.00 0.00 36.82 36.14 1r0b h ILE 12 CO 0.46 0.06 0.00 -3.20 -0.69 0.00 0.00 178.15 174.79 1r0b n ASN 13 N -3.67 0.49 -1.03 1.72 4.05 -1.26 -1.95 115.26 113.61 1r0b n ASN 13 Ca -0.02 0.62 0.08 0.00 0.45 0.00 0.00 54.58 55.71 1r0b n ASN 13 Cb 0.17 -0.73 0.25 0.00 1.23 0.00 0.00 39.78 40.70 1r0b n ASN 13 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 1r0b n ASP 14 N -2.04 3.72 -4.43 1.20 8.00 0.17 -4.97 116.55 118.19 1r0b n ASP 14 Ca 0.02 -2.29 -0.28 0.00 0.71 0.00 0.00 54.79 52.95 1r0b n ASP 14 Cb 0.21 -0.41 -0.12 0.00 -0.02 0.00 0.00 41.12 40.78 1r0b n ASP 14 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1r0b s LEU 15 N -1.54 2.48 0.25 0.64 1.43 -0.82 -5.01 118.68 116.11 1r0b s LEU 15 Ca 0.37 -0.78 0.06 0.00 -1.03 0.00 0.00 54.13 52.75 1r0b s LEU 15 Cb 0.23 -1.26 -0.03 0.00 0.03 0.00 0.00 46.19 45.16 1r0b s LEU 15 CO 0.19 0.14 0.31 -0.94 0.23 0.00 0.00 176.35 176.28 1r0b s SER 16 N -2.48 6.00 0.31 2.29 1.04 -1.26 -4.99 113.70 114.62 1r0b s SER 16 Ca 0.19 -0.07 0.08 0.00 0.48 0.00 0.00 55.95 56.64 1r0b s SER 16 Cb -0.09 -1.65 0.83 0.00 0.10 0.00 0.00 66.02 65.22 1r0b s SER 16 CO 0.09 -0.09 1.75 -0.09 0.98 0.00 0.00 173.24 175.88 1r0b h ARG 17 N 1.26 0.63 -0.24 4.02 9.65 -1.98 0.40 114.38 128.13 1r0b h ARG 17 Ca -0.50 -0.04 0.01 0.00 -1.10 0.00 0.00 59.98 58.35 1r0b h ARG 17 Cb 1.24 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 29.66 1r0b h ARG 17 CO 0.60 0.42 0.13 -0.44 2.80 0.00 0.00 179.97 183.49 1r0b h ASP 18 N 0.65 0.21 0.11 -3.80 5.19 -1.96 -1.51 116.42 115.32 1r0b h ASP 18 Ca 0.62 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 57.04 1r0b h ASP 18 Cb 1.10 -0.04 -0.03 0.00 0.18 0.00 0.00 39.33 40.54 1r0b h ASP 18 CO -0.43 0.16 -0.33 0.44 -3.12 0.00 0.00 179.24 175.95 1r0b h ASP 19 N 0.28 -0.98 -0.28 6.45 3.32 -1.31 0.33 116.42 124.24 1r0b h ASP 19 Ca 0.10 0.10 0.05 0.00 0.02 0.00 0.00 57.03 57.29 1r0b h ASP 19 Cb 0.01 0.35 -0.08 0.00 0.22 0.00 0.00 39.33 39.83 1r0b h ASP 19 CO -0.05 -0.36 -0.50 -0.07 -1.72 0.00 0.00 179.24 176.53 1r0b h LEU 20 N -0.50 -1.63 -0.91 1.55 3.38 -1.41 0.36 115.31 116.15 1r0b h LEU 20 Ca -0.01 0.22 0.22 0.00 0.09 0.00 0.00 57.88 58.40 1r0b h LEU 20 Cb 0.49 0.67 -0.13 0.00 0.09 0.00 0.00 40.66 41.78 1r0b h LEU 20 CO -0.16 -0.43 0.42 0.78 0.09 0.00 0.00 178.44 179.14 1r0b h ASN 21 N -0.46 0.37 -0.12 -0.43 -0.26 -1.11 0.98 115.58 114.55 1r0b h ASN 21 Ca 0.08 0.15 0.01 0.00 -0.56 0.00 0.00 56.30 55.98 1r0b h ASN 21 Cb 0.63 0.12 -0.01 0.00 -1.06 0.00 0.00 38.32 38.00 1r0b h ASN 21 CO -0.51 0.01 0.03 0.25 -1.06 0.00 0.00 177.43 176.14 1r0b h LEU 22 N 0.42 0.02 0.60 1.61 5.85 0.12 0.96 115.31 124.88 1r0b h LEU 22 Ca 0.57 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 59.29 1r0b h LEU 22 Cb 1.09 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 1r0b h LEU 22 CO -0.53 0.03 -0.47 0.58 -0.34 0.00 0.00 178.44 177.72 1r0b h VAL 23 N 0.08 0.07 -0.73 1.05 2.07 0.17 0.21 116.25 119.18 1r0b h VAL 23 Ca 0.05 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.74 1r0b h VAL 23 Cb 0.04 0.07 -0.12 0.00 -1.52 0.00 0.00 31.29 29.77 1r0b h VAL 23 CO -0.07 0.00 0.06 -0.07 0.02 0.00 0.00 177.57 177.51 1r0b h LEU 24 N -1.03 -0.22 -0.01 2.57 3.38 -0.75 0.41 115.31 119.66 1r0b h LEU 24 Ca -0.07 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1r0b h LEU 24 Cb 0.87 0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 1r0b h LEU 24 CO 0.01 -0.13 -0.07 0.00 0.09 0.00 0.00 178.44 178.34 1r0b h ALA 25 N 1.66 -0.54 -0.85 1.53 0.00 0.19 -0.01 119.26 121.23 1r0b h ALA 25 Ca 0.40 -0.01 0.19 0.00 0.00 0.00 0.00 54.91 55.50 1r0b h ALA 25 Cb 0.70 0.59 -0.16 0.00 0.00 0.00 0.00 17.79 18.92 1r0b h ALA 25 CO -0.60 -0.56 -0.08 1.15 0.00 0.00 0.00 179.25 179.16 1r0b h THR 26 N -0.09 0.19 -0.81 0.00 2.02 0.11 0.74 112.91 115.06 1r0b h THR 26 Ca 0.00 -0.01 0.14 0.00 0.77 0.00 0.00 66.41 67.31 1r0b h THR 26 Cb 0.10 0.14 -0.06 0.00 -1.74 0.00 0.00 68.15 66.59 1r0b h THR 26 CO -0.05 0.01 0.53 0.00 0.37 0.00 0.00 175.52 176.38 1r0b h ALA 27 N 1.83 1.99 0.11 6.16 0.00 0.56 -0.37 119.26 129.54 1r0b h ALA 27 Ca 0.46 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.37 1r0b h ALA 27 Cb 0.80 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1r0b h ALA 27 CO -0.81 -0.21 -0.18 0.00 0.00 0.00 0.00 179.25 178.04 1r0b h ALA 28 N 1.62 -0.80 0.00 0.00 0.00 0.24 -1.99 119.26 118.34 1r0b h ALA 28 Ca 0.40 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 55.14 1r0b h ALA 28 Cb 0.78 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 1r0b h ALA 28 CO -0.15 -0.83 -0.58 0.87 0.00 0.00 0.00 179.25 178.56 1r0b h LYS 29 N -0.31 0.00 0.00 0.00 1.79 -1.53 -2.79 116.57 113.73 1r0b h LYS 29 Ca -0.01 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.43 1r0b h LYS 29 Cb 0.29 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.93 1r0b h LYS 29 CO -0.06 0.58 -0.12 -0.07 -1.08 0.00 0.00 179.45 178.70 1r0b h LEU 30 N 0.00 0.00 0.00 2.94 3.38 -1.02 1.93 115.31 122.54 1r0b h LEU 30 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1r0b h LEU 30 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1r0b h LEU 30 CO 0.08 0.12 -0.12 0.50 0.09 0.00 0.00 178.44 179.11 1r0b h LYS 31 N 0.00 0.00 0.00 1.13 3.64 -1.15 -3.28 116.57 116.92 1r0b h LYS 31 Ca -0.00 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.11 1r0b h LYS 31 Cb 0.25 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.03 1r0b h LYS 31 CO 0.02 0.00 -1.78 0.00 -2.27 0.00 0.00 179.45 175.41 1r0b n ALA 32 N -2.08 0.99 -3.86 5.00 0.00 0.12 -4.79 120.51 115.89 1r0b n ALA 32 Ca 0.04 -0.88 -0.31 0.00 0.00 0.00 0.00 53.44 52.29 1r0b n ALA 32 Cb 0.52 -0.01 -0.12 0.00 0.00 0.00 0.00 19.45 19.84 1r0b n ALA 32 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1r0b s ASN 33 N -6.85 4.81 0.96 0.00 -0.87 0.61 -5.08 114.94 108.53 1r0b s ASN 33 Ca -0.33 -3.31 -0.13 0.00 -1.57 0.00 0.00 52.86 47.53 1r0b s ASN 33 Cb 0.10 -1.71 0.06 0.00 -0.02 0.00 0.00 41.25 39.68 1r0b s ASN 33 CO 0.47 -0.21 0.47 -2.65 -2.57 0.00 0.00 177.10 172.61 1r0b n PRO 34 N 2.76 -0.43 -3.11 -0.60 -0.02 -1.24 -4.53 135.00 127.83 1r0b n PRO 34 Ca 0.11 -0.08 -0.21 0.00 -2.02 0.00 0.00 63.50 61.30 1r0b n PRO 34 Cb 0.34 -1.91 -0.05 0.00 -0.02 0.00 0.00 33.50 31.87 1r0b n PRO 34 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1r0b n GLN 35 N -2.06 0.71 0.00 -0.52 6.02 -1.26 -5.01 117.38 115.26 1r0b n GLN 35 Ca 0.07 -2.94 0.00 0.00 -0.01 0.00 0.00 57.00 54.12 1r0b n GLN 35 Cb 0.54 -1.27 0.00 0.00 1.02 0.00 0.00 30.24 30.53 1r0b n GLN 35 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1r0b n PRO 36 N 1.50 0.00 0.00 -1.09 -0.02 -1.24 0.02 135.00 134.16 1r0b n PRO 36 Ca 0.19 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 1r0b n PRO 36 Cb 0.55 -1.51 0.00 0.00 -0.02 0.00 0.00 33.50 32.52 1r0b n PRO 36 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1r0b n GLU 37 N -0.70 0.20 -0.35 -0.52 -0.58 -1.26 -3.14 120.64 114.28 1r0b n GLU 37 Ca 0.00 -0.52 0.15 0.00 -0.42 0.00 0.00 57.16 56.37 1r0b n GLU 37 Cb 0.01 -0.54 0.36 0.00 -0.57 0.00 0.00 31.44 30.70 1r0b n GLU 37 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1r0b h LEU 38 N 0.00 0.73 -5.18 -4.62 5.85 -0.48 -2.20 115.31 109.41 1r0b h LEU 38 Ca 0.00 0.11 -0.57 0.00 0.84 0.00 0.00 57.88 58.26 1r0b h LEU 38 Cb 0.92 -0.01 -0.42 0.00 0.37 0.00 0.00 40.66 41.51 1r0b h LEU 38 CO 0.00 0.21 -0.74 0.18 -0.34 0.00 0.00 178.44 177.75 1r0b n LEU 39 N -4.80 4.05 -0.12 2.25 4.77 -0.30 -4.94 117.00 117.92 1r0b n LEU 39 Ca 0.25 -5.44 -0.09 0.00 -0.03 0.00 0.00 56.01 50.70 1r0b n LEU 39 Cb 0.65 -0.37 -0.01 0.00 -2.33 0.00 0.00 43.42 41.36 1r0b n LEU 39 CO 0.20 2.30 0.96 0.50 -1.33 0.00 0.00 177.39 180.01 1r0b h LYS 40 N 2.89 0.53 -0.69 3.23 3.64 -1.50 -3.09 116.57 121.58 1r0b h LYS 40 Ca 0.16 -0.07 -0.26 0.00 -1.27 0.00 0.00 60.65 59.20 1r0b h LYS 40 Cb 0.67 -0.10 -0.16 0.00 -0.41 0.00 0.00 32.23 32.23 1r0b h LYS 40 CO 0.78 0.45 0.28 0.72 -2.27 0.00 0.00 179.45 179.41 1r0b n HIS 41 N -4.74 2.22 -3.98 1.91 8.25 -1.26 -4.70 115.22 112.93 1r0b n HIS 41 Ca -0.00 -1.40 -0.30 0.00 -0.26 0.00 0.00 57.72 55.75 1r0b n HIS 41 Cb 0.09 -0.68 -0.05 0.00 1.12 0.00 0.00 29.99 30.47 1r0b n HIS 41 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1r0b s LYS 42 N -3.10 3.20 -0.21 -0.41 -0.14 -1.23 -5.05 119.74 112.79 1r0b s LYS 42 Ca 0.53 -0.57 -0.02 0.00 -1.36 0.00 0.00 55.97 54.54 1r0b s LYS 42 Cb 0.44 -2.89 0.06 0.00 -1.68 0.00 0.00 37.83 33.75 1r0b s LYS 42 CO 0.10 0.58 0.03 0.08 -0.76 0.00 0.00 175.35 175.38 1r0b s VAL 43 N -1.50 0.67 -0.02 3.17 1.01 -1.26 -1.82 120.40 120.65 1r0b s VAL 43 Ca 0.33 -0.70 -0.09 0.00 0.00 0.00 0.00 61.98 61.52 1r0b s VAL 43 Cb -0.12 -1.17 -0.05 0.00 0.00 0.00 0.00 36.38 35.04 1r0b s VAL 43 CO 0.26 -0.24 0.27 -0.63 0.00 0.00 0.00 175.10 174.76 1r0b s ILE 44 N 1.79 5.29 -0.15 2.22 1.01 -0.69 -2.17 121.20 128.51 1r0b s ILE 44 Ca -0.01 0.34 -0.20 0.00 0.00 0.00 0.00 60.65 60.78 1r0b s ILE 44 Cb -0.17 -3.56 -0.03 0.00 0.01 0.00 0.00 42.46 38.71 1r0b s ILE 44 CO -0.09 0.48 0.56 0.00 0.00 0.00 0.00 174.94 175.89 1r0b s ALA 45 N -1.18 3.48 -0.64 9.38 0.00 -0.36 -2.07 121.76 130.36 1r0b s ALA 45 Ca 0.24 -0.20 -0.04 0.00 0.00 0.00 0.00 51.96 51.96 1r0b s ALA 45 Cb -0.14 -2.82 0.16 0.00 0.00 0.00 0.00 23.12 20.33 1r0b s ALA 45 CO 0.12 -0.25 0.46 0.45 0.00 0.00 0.00 175.76 176.55 1r0b s SER 46 N 0.91 5.37 -0.46 0.00 0.15 -0.01 -0.02 113.70 119.64 1r0b s SER 46 Ca 0.28 -2.82 -0.13 0.00 0.70 0.00 0.00 55.95 53.98 1r0b s SER 46 Cb -0.16 -1.89 0.08 0.00 -1.71 0.00 0.00 66.02 62.35 1r0b s SER 46 CO 0.12 -0.39 0.37 0.00 1.20 0.00 0.00 173.24 174.53 1r0b s PHE 48 N 1.56 3.59 -2.12 0.00 0.40 -0.63 -1.06 117.98 119.72 1r0b s PHE 48 Ca 0.04 -2.43 0.16 0.00 -0.60 0.00 0.00 56.93 54.10 1r0b s PHE 48 Cb -0.25 -3.16 0.72 0.00 0.51 0.00 0.00 43.02 40.84 1r0b s PHE 48 CO 0.05 -0.96 1.50 1.19 0.70 0.00 0.00 175.22 177.69 1r0b n PHE 49 N 4.57 0.16 -4.21 0.36 3.01 0.62 -3.40 117.46 118.58 1r0b n PHE 49 Ca -0.02 -0.08 -0.12 0.00 1.01 0.00 0.00 57.45 58.24 1r0b n PHE 49 Cb 0.41 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.78 1r0b n PHE 49 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 1r0b s GLU 50 N -1.84 1.02 0.62 -1.08 2.12 -1.25 -4.56 118.70 113.74 1r0b s GLU 50 Ca 0.26 -1.48 -0.17 0.00 0.36 0.00 0.00 54.97 53.94 1r0b s GLU 50 Cb 0.13 -0.11 -0.02 0.00 0.26 0.00 0.00 34.13 34.39 1r0b s GLU 50 CO 0.20 -0.16 1.12 0.00 -0.54 0.00 0.00 175.26 175.89 1r0b s ALA 51 N -3.77 2.53 0.00 6.30 0.00 -1.26 -4.90 121.76 120.67 1r0b s ALA 51 Ca 0.22 0.66 0.00 0.00 0.00 0.00 0.00 51.96 52.85 1r0b s ALA 51 Cb 0.06 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.84 1r0b s ALA 51 CO 0.02 -1.13 0.00 0.45 0.00 0.00 0.00 175.76 175.10 1r0b n SER 52 N -2.04 0.00 -0.04 0.00 2.88 -1.26 -5.07 113.62 108.08 1r0b n SER 52 Ca 0.11 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.57 1r0b n SER 52 Cb 0.51 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.95 1r0b n SER 52 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1r0b n THR 53 N -0.17 1.32 0.13 2.46 -1.04 -1.26 -4.59 114.28 111.12 1r0b n THR 53 Ca 0.00 0.16 -0.05 0.00 -2.04 0.00 0.00 64.05 62.12 1r0b n THR 53 Cb 0.00 -2.00 -0.02 0.00 -1.82 0.00 0.00 70.33 66.49 1r0b n THR 53 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 1r0b h ARG 54 N -0.61 -0.33 -1.03 -2.82 3.08 -1.98 -2.41 114.38 108.29 1r0b h ARG 54 Ca -0.07 0.02 0.29 0.00 0.07 0.00 0.00 59.98 60.28 1r0b h ARG 54 Cb 0.74 0.07 -0.05 0.00 0.08 0.00 0.00 29.97 30.81 1r0b h ARG 54 CO -0.05 -0.22 0.72 1.15 -1.07 0.00 0.00 179.97 180.51 1r0b h THR 55 N -0.42 0.50 0.13 2.04 2.02 -1.97 0.22 112.91 115.44 1r0b h THR 55 Ca -0.03 -0.04 -0.35 0.00 0.77 0.00 0.00 66.41 66.76 1r0b h THR 55 Cb 0.26 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 1r0b h THR 55 CO 0.06 0.02 -1.85 -0.09 0.37 0.00 0.00 175.52 174.02 1r0b h ARG 56 N 0.11 0.28 -0.09 6.66 2.43 -1.81 -3.13 114.38 118.83 1r0b h ARG 56 Ca 0.51 -0.48 -0.08 0.00 -0.81 0.00 0.00 59.98 59.12 1r0b h ARG 56 Cb 1.82 0.18 0.00 0.00 -0.42 0.00 0.00 29.97 31.56 1r0b h ARG 56 CO -0.08 1.23 -0.26 -0.07 -1.51 0.00 0.00 179.97 179.28 1r0b h LEU 57 N -0.01 0.39 -0.71 3.80 3.38 -0.86 0.46 115.31 121.76 1r0b h LEU 57 Ca -0.39 -0.60 -0.07 0.00 0.09 0.00 0.00 57.88 56.91 1r0b h LEU 57 Cb 1.99 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 42.60 1r0b h LEU 57 CO 0.09 0.92 0.17 0.77 0.09 0.00 0.00 178.44 180.48 1r0b h SER 58 N -0.12 1.09 0.76 -0.43 4.64 -0.80 0.21 113.55 118.90 1r0b h SER 58 Ca -0.01 -0.24 -0.04 0.00 -0.47 0.00 0.00 61.79 61.04 1r0b h SER 58 Cb 0.88 -0.29 0.01 0.00 -0.31 0.00 0.00 62.40 62.69 1r0b h SER 58 CO 0.06 1.04 -0.36 0.15 -0.87 0.00 0.00 176.83 176.85 1r0b h PHE 59 N 1.08 -0.94 -0.67 4.77 3.57 -1.50 0.10 116.94 123.35 1r0b h PHE 59 Ca 0.22 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 1r0b h PHE 59 Cb 0.39 0.31 -0.03 0.00 2.79 0.00 0.00 35.95 39.41 1r0b h PHE 59 CO 0.03 -0.58 0.35 0.93 -2.23 0.00 0.00 178.31 176.81 1r0b h GLU 60 N -1.02 0.94 0.16 1.11 5.08 -0.84 -2.57 114.58 117.43 1r0b h GLU 60 Ca -0.10 -0.12 0.02 0.00 -1.00 0.00 0.00 59.36 58.15 1r0b h GLU 60 Cb 0.78 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.82 1r0b h GLU 60 CO 0.17 0.72 -0.31 1.15 -1.00 0.00 0.00 179.01 179.74 1r0b h THR 61 N 0.92 0.34 -0.91 1.13 2.02 -0.49 -1.66 112.91 114.26 1r0b h THR 61 Ca 0.23 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.53 1r0b h THR 61 Cb 0.06 0.34 -0.13 0.00 -1.74 0.00 0.00 68.15 66.68 1r0b h THR 61 CO -0.04 0.00 -0.42 -1.20 0.37 0.00 0.00 175.52 174.23 1r0b n SER 62 N -5.41 -0.73 -0.26 4.18 7.64 0.34 0.78 113.62 120.15 1r0b n SER 62 Ca -0.07 1.61 0.25 0.00 1.01 0.00 0.00 58.87 61.67 1r0b n SER 62 Cb 0.32 -0.31 0.61 0.00 -1.01 0.00 0.00 64.21 63.82 1r0b n SER 62 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 1r0b h MET 63 N 0.00 0.22 0.14 1.43 2.07 -0.93 -1.09 114.93 116.78 1r0b h MET 63 Ca 0.26 -0.01 -0.29 0.00 -2.07 0.00 0.00 59.70 57.58 1r0b h MET 63 Cb 0.48 -0.05 0.01 0.00 -1.87 0.00 0.00 31.60 30.17 1r0b h MET 63 CO -0.89 0.15 -1.34 0.45 1.07 0.00 0.00 176.91 176.35 1r0b h HIS 64 N 0.23 0.55 0.00 -0.22 3.86 0.77 0.22 115.15 120.56 1r0b h HIS 64 Ca 0.51 -0.40 0.00 0.00 -1.16 0.00 0.00 60.37 59.32 1r0b h HIS 64 Cb 1.59 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 30.04 1r0b h HIS 64 CO -0.00 1.34 0.00 0.00 0.86 0.00 0.00 177.93 180.13 1r0b h ARG 65 N 0.08 0.00 -0.44 2.45 2.47 -0.38 0.95 114.38 119.51 1r0b h ARG 65 Ca -0.17 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.55 1r0b h ARG 65 Cb 2.01 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.33 1r0b h ARG 65 CO 0.20 0.00 0.00 1.28 0.56 0.00 0.00 179.97 182.01 1r0b n LEU 66 N -2.64 4.49 -1.82 3.04 4.77 -1.03 -3.68 117.00 120.13 1r0b n LEU 66 Ca -0.02 -2.77 -0.20 0.00 -0.03 0.00 0.00 56.01 52.99 1r0b n LEU 66 Cb 0.08 -0.56 -0.06 0.00 -2.33 0.00 0.00 43.42 40.56 1r0b n LEU 66 CO 0.16 0.70 -0.22 0.61 -1.33 0.00 0.00 177.39 177.31 1r0b n GLY 67 N 0.25 1.07 3.93 -0.72 0.00 0.33 -1.15 105.19 108.89 1r0b n GLY 67 Ca 0.23 -0.04 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 1r0b n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r0b s ALA 68 N -2.84 3.86 0.56 4.61 0.00 0.77 -4.17 121.76 124.55 1r0b s ALA 68 Ca 0.00 -0.86 -0.04 0.00 0.00 0.00 0.00 51.96 51.06 1r0b s ALA 68 Cb 0.00 -1.95 0.01 0.00 0.00 0.00 0.00 23.12 21.18 1r0b s ALA 68 CO 0.00 0.48 0.85 -1.12 0.00 0.00 0.00 175.76 175.97 1r0b s SER 69 N -3.13 5.59 0.00 0.00 0.01 -0.75 -4.01 113.70 111.41 1r0b s SER 69 Ca 0.38 0.58 0.02 0.00 1.31 0.00 0.00 55.95 58.23 1r0b s SER 69 Cb -0.11 -1.60 -0.01 0.00 0.21 0.00 0.00 66.02 64.51 1r0b s SER 69 CO 0.29 -1.01 -0.06 -0.69 0.41 0.00 0.00 173.24 172.17 1r0b s VAL 70 N -2.90 0.46 -0.06 3.43 1.01 -1.26 -1.70 120.40 119.38 1r0b s VAL 70 Ca 0.53 -0.38 -0.07 0.00 0.00 0.00 0.00 61.98 62.06 1r0b s VAL 70 Cb -0.10 -0.42 0.02 0.00 0.00 0.00 0.00 36.38 35.87 1r0b s VAL 70 CO 0.43 0.04 0.19 0.68 0.00 0.00 0.00 175.10 176.44 1r0b s VAL 71 N -0.34 0.01 -2.02 2.92 -7.23 -0.88 -4.96 120.40 107.90 1r0b s VAL 71 Ca 0.00 -0.08 0.00 0.00 -1.81 0.00 0.00 61.98 60.10 1r0b s VAL 71 Cb -0.03 -0.30 0.00 0.00 0.56 0.00 0.00 36.38 36.61 1r0b s VAL 71 CO -0.00 -0.04 0.00 0.61 -0.31 0.00 0.00 175.10 175.36 1r0b n GLY 72 N 2.80 -0.68 3.61 2.32 0.00 -1.26 -0.83 105.19 111.13 1r0b n GLY 72 Ca -0.14 -0.47 -0.14 0.00 0.00 0.00 0.00 46.02 45.27 1r0b n GLY 72 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1r0b s PHE 73 N -3.99 -0.76 -1.70 1.61 -0.12 -0.81 -4.98 117.98 107.23 1r0b s PHE 73 Ca 0.00 1.81 0.16 0.00 -0.05 0.00 0.00 56.93 58.85 1r0b s PHE 73 Cb 0.00 0.28 0.30 0.00 -0.63 0.00 0.00 43.02 42.97 1r0b s PHE 73 CO 0.00 -0.40 1.21 -1.13 -0.05 0.00 0.00 175.22 174.85 1r0b n SER 74 N 2.50 2.89 -3.23 1.98 3.41 -1.26 -1.60 113.62 118.31 1r0b n SER 74 Ca -0.15 -1.85 -0.02 0.00 -0.26 0.00 0.00 58.87 56.59 1r0b n SER 74 Cb 0.55 -0.18 -0.03 0.00 -0.26 0.00 0.00 64.21 64.29 1r0b n SER 74 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1r0b s ASP 75 N -1.18 -0.66 0.00 4.04 2.15 -1.22 -4.74 116.67 115.06 1r0b s ASP 75 Ca 0.27 0.04 0.00 0.00 0.43 0.00 0.00 52.55 53.29 1r0b s ASP 75 Cb 0.16 1.61 0.00 0.00 -0.30 0.00 0.00 42.92 44.39 1r0b s ASP 75 CO 0.22 -0.32 0.62 -1.54 -0.17 0.00 0.00 175.17 173.98 1r0b n SER 76 N 5.39 0.00 -0.17 -0.34 3.41 -1.26 -2.59 113.62 118.06 1r0b n SER 76 Ca 0.02 0.19 -0.04 0.00 -0.26 0.00 0.00 58.87 58.78 1r0b n SER 76 Cb 0.52 -0.19 0.16 0.00 -0.26 0.00 0.00 64.21 64.44 1r0b n SER 76 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1r0b h ALA 77 N 1.36 1.17 -0.66 7.33 0.00 -1.95 -2.97 119.26 123.54 1r0b h ALA 77 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1r0b h ALA 77 Cb 0.18 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1r0b h ALA 77 CO 0.00 0.58 0.00 0.27 0.00 0.00 0.00 179.25 180.10 1r0b n ASN 78 N -4.28 3.64 -4.90 0.00 0.23 -1.07 -4.07 115.26 104.82 1r0b n ASN 78 Ca 0.05 -2.04 -0.23 0.00 -0.53 0.00 0.00 54.58 51.83 1r0b n ASN 78 Cb 0.21 -0.46 0.06 0.00 -2.08 0.00 0.00 39.78 37.52 1r0b n ASN 78 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 1r0b s THR 79 N -1.18 2.46 0.28 5.53 -4.23 -1.12 -4.88 115.64 112.50 1r0b s THR 79 Ca 0.45 -0.53 0.04 0.00 -1.18 0.00 0.00 61.69 60.48 1r0b s THR 79 Cb 0.24 -2.93 0.04 0.00 1.34 0.00 0.00 72.50 71.19 1r0b s THR 79 CO 0.30 0.00 1.70 -1.28 -0.54 0.00 0.00 174.62 174.79 1r0b h SER 80 N -0.25 0.36 0.01 3.99 0.87 -1.92 -0.81 113.55 115.80 1r0b h SER 80 Ca -0.42 -0.14 -0.00 0.00 -1.23 0.00 0.00 61.79 60.00 1r0b h SER 80 Cb 1.30 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 63.16 1r0b h SER 80 CO 0.52 0.70 -0.00 0.25 -0.53 0.00 0.00 176.83 177.77 1r0b h LEU 81 N 0.30 0.00 0.00 2.23 5.85 -1.86 -2.38 115.31 119.45 1r0b h LEU 81 Ca 0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1r0b h LEU 81 Cb 0.77 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.80 1r0b h LEU 81 CO 0.06 0.00 -0.02 1.23 -0.34 0.00 0.00 178.44 179.37 1r0b h GLY 82 N 0.02 0.00 2.00 3.75 0.00 -1.23 -3.22 103.07 104.39 1r0b h GLY 82 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 1r0b h GLY 82 CO 0.00 0.00 -0.42 0.50 0.00 0.00 0.00 176.54 176.62 1r0b h LYS 83 N -0.11 0.00 -0.34 4.80 1.79 -1.45 -3.30 116.57 117.96 1r0b h LYS 83 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1r0b h LYS 83 Cb 0.02 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.67 1r0b h LYS 83 CO 0.00 0.42 0.00 1.63 -1.08 0.00 0.00 179.45 180.42 1r0b n LYS 84 N -3.29 2.91 -3.57 3.15 5.02 -0.92 -5.01 118.16 116.45 1r0b n LYS 84 Ca 0.01 -2.26 -0.26 0.00 -2.02 0.00 0.00 58.31 53.79 1r0b n LYS 84 Cb 0.64 -1.42 0.04 0.00 -0.02 0.00 0.00 35.03 34.28 1r0b n LYS 84 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1r0b n GLY 85 N 0.33 -1.07 3.91 0.72 0.00 -1.14 -4.96 105.19 102.98 1r0b n GLY 85 Ca 0.14 0.49 -0.33 0.00 0.00 0.00 0.00 46.02 46.33 1r0b n GLY 85 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1r0b s GLU 86 N -5.38 3.43 0.51 1.61 2.12 -1.06 -4.98 118.70 114.95 1r0b s GLU 86 Ca 0.39 -0.36 -0.18 0.00 0.36 0.00 0.00 54.97 55.17 1r0b s GLU 86 Cb -0.13 -3.07 -0.07 0.00 0.26 0.00 0.00 34.13 31.12 1r0b s GLU 86 CO 0.84 0.65 1.02 0.95 -0.54 0.00 0.00 175.26 178.18 1r0b s THR 87 N -1.38 4.02 0.20 -1.70 -4.23 -1.26 -4.40 115.64 106.89 1r0b s THR 87 Ca 0.30 1.12 -0.08 0.00 -1.18 0.00 0.00 61.69 61.85 1r0b s THR 87 Cb -0.13 -3.50 0.09 0.00 1.34 0.00 0.00 72.50 70.30 1r0b s THR 87 CO 0.22 -0.41 1.69 0.25 -0.54 0.00 0.00 174.62 175.82 1r0b h LEU 88 N 1.17 1.03 -0.60 4.79 5.85 -1.98 -0.57 115.31 125.01 1r0b h LEU 88 Ca -0.48 -0.26 0.09 0.00 0.84 0.00 0.00 57.88 58.07 1r0b h LEU 88 Cb 1.21 -0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.89 1r0b h LEU 88 CO 0.59 1.04 0.22 0.00 -0.34 0.00 0.00 178.44 179.96 1r0b h ALA 89 N 1.07 0.77 -0.18 1.25 0.00 -1.97 0.23 119.26 120.44 1r0b h ALA 89 Ca 0.19 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 1r0b h ALA 89 Cb 0.48 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1r0b h ALA 89 CO 0.02 -0.19 -0.04 -0.44 0.00 0.00 0.00 179.25 178.60 1r0b h ASP 90 N 0.41 0.34 -0.07 0.00 5.19 -1.87 -0.14 116.42 120.28 1r0b h ASP 90 Ca 0.30 -0.36 0.03 0.00 -0.62 0.00 0.00 57.03 56.38 1r0b h ASP 90 Cb 0.36 -0.09 -0.06 0.00 0.18 0.00 0.00 39.33 39.72 1r0b h ASP 90 CO -0.30 0.63 -0.50 0.74 -3.12 0.00 0.00 179.24 176.69 1r0b h THR 91 N 0.06 0.05 -0.30 0.35 2.02 0.08 0.11 112.91 115.28 1r0b h THR 91 Ca 0.05 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.23 1r0b h THR 91 Cb 0.47 0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 1r0b h THR 91 CO 0.02 0.00 0.20 0.40 0.37 0.00 0.00 175.52 176.50 1r0b h ILE 92 N -0.60 1.08 -0.46 3.11 1.08 -0.59 -0.92 117.51 120.21 1r0b h ILE 92 Ca 0.04 -0.15 -0.04 0.00 -0.39 0.00 0.00 64.86 64.31 1r0b h ILE 92 Cb 0.69 0.64 -0.02 0.00 -3.07 0.00 0.00 36.82 35.05 1r0b h ILE 92 CO -0.39 0.08 0.12 0.28 -0.69 0.00 0.00 178.15 177.56 1r0b h SER 93 N 0.41 0.63 0.04 1.72 0.02 0.11 0.19 113.55 116.67 1r0b h SER 93 Ca 0.11 -0.10 -0.08 0.00 -0.84 0.00 0.00 61.79 60.88 1r0b h SER 93 Cb -0.04 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.34 1r0b h SER 93 CO -0.02 0.62 -0.40 -0.37 -1.14 0.00 0.00 176.83 175.52 1r0b h VAL 94 N 0.67 1.60 -0.13 2.27 -1.51 -0.33 -3.34 116.25 115.48 1r0b h VAL 94 Ca 0.15 -2.38 0.02 0.00 -1.23 0.00 0.00 66.70 63.26 1r0b h VAL 94 Cb 0.23 3.19 -0.01 0.00 -2.13 0.00 0.00 31.29 32.58 1r0b h VAL 94 CO -0.00 0.61 0.09 0.40 -1.23 0.00 0.00 177.57 177.43 1r0b h ILE 95 N -0.82 0.99 0.00 7.19 2.04 -1.13 -1.11 117.51 124.68 1r0b h ILE 95 Ca -0.09 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1r0b h ILE 95 Cb 1.22 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 38.19 1r0b h ILE 95 CO 0.02 0.02 0.00 -1.54 0.00 0.00 0.00 178.15 176.64 1r0b n SER 96 N -4.51 0.16 -0.88 1.72 3.41 0.05 -1.62 113.62 111.95 1r0b n SER 96 Ca -0.01 0.55 0.12 0.00 -0.26 0.00 0.00 58.87 59.27 1r0b n SER 96 Cb 0.14 -0.58 0.14 0.00 -0.26 0.00 0.00 64.21 63.66 1r0b n SER 96 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1r0b n THR 97 N -1.68 0.00 -0.09 6.66 -2.24 -0.42 -4.49 114.28 112.02 1r0b n THR 97 Ca 0.02 -0.46 -0.16 0.00 -2.27 0.00 0.00 64.05 61.18 1r0b n THR 97 Cb 0.14 1.37 -0.07 0.00 -2.10 0.00 0.00 70.33 69.67 1r0b n THR 97 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1r0b n TYR 98 N 1.13 0.00 -2.84 4.78 4.01 -0.64 -5.05 117.16 118.56 1r0b n TYR 98 Ca 0.14 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.66 1r0b n TYR 98 Cb 0.56 -0.63 0.09 0.00 -0.31 0.00 0.00 39.34 39.06 1r0b n TYR 98 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 1r0b s VAL 99 N -2.33 2.01 -0.45 -0.72 -7.23 -1.11 -4.97 120.40 105.61 1r0b s VAL 99 Ca -0.24 -0.82 0.14 0.00 -1.81 0.00 0.00 61.98 59.26 1r0b s VAL 99 Cb 0.08 -2.20 -0.17 0.00 0.56 0.00 0.00 36.38 34.65 1r0b s VAL 99 CO 0.34 0.00 0.50 0.47 -0.31 0.00 0.00 175.10 176.10 1r0b n ASP 100 N -2.59 1.01 -3.59 4.85 8.00 -0.92 -4.89 116.55 118.41 1r0b n ASP 100 Ca 0.17 -0.55 -0.14 0.00 0.71 0.00 0.00 54.79 54.97 1r0b n ASP 100 Cb 0.61 1.22 -0.06 0.00 -0.02 0.00 0.00 41.12 42.87 1r0b n ASP 100 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1r0b s ALA 101 N -2.53 -1.31 -0.13 2.24 0.00 -1.26 -4.18 121.76 114.58 1r0b s ALA 101 Ca 0.02 0.63 0.00 0.00 0.00 0.00 0.00 51.96 52.61 1r0b s ALA 101 Cb 0.10 0.32 0.02 0.00 0.00 0.00 0.00 23.12 23.56 1r0b s ALA 101 CO 0.58 -0.47 -0.12 0.42 0.00 0.00 0.00 175.76 176.17 1r0b s ILE 102 N -2.24 1.36 -0.37 0.00 1.01 -0.12 -1.23 121.20 119.62 1r0b s ILE 102 Ca -0.06 -0.51 -0.05 0.00 0.00 0.00 0.00 60.65 60.03 1r0b s ILE 102 Cb -0.01 -1.31 0.07 0.00 0.01 0.00 0.00 42.46 41.23 1r0b s ILE 102 CO -0.00 0.42 0.15 -0.69 0.00 0.00 0.00 174.94 174.82 1r0b s VAL 103 N 1.52 3.61 -0.01 2.92 1.01 0.97 -0.49 120.40 129.94 1r0b s VAL 103 Ca 0.04 -1.49 0.08 0.00 0.00 0.00 0.00 61.98 60.60 1r0b s VAL 103 Cb -0.13 -3.21 -0.02 0.00 0.00 0.00 0.00 36.38 33.02 1r0b s VAL 103 CO -0.09 -0.39 -0.24 -0.32 0.00 0.00 0.00 175.10 174.07 1r0b s MET 104 N 1.31 1.88 -0.06 2.72 0.00 -0.95 0.78 119.30 124.97 1r0b s MET 104 Ca 0.01 -0.89 0.04 0.00 0.00 0.00 0.00 55.69 54.86 1r0b s MET 104 Cb -0.21 -1.86 -0.00 0.00 0.00 0.00 0.00 34.83 32.76 1r0b s MET 104 CO -0.00 0.50 -0.19 0.50 0.00 0.00 0.00 175.02 175.83 1r0b s ARG 105 N -0.69 2.16 0.05 4.11 3.52 -0.23 -0.54 118.95 127.33 1r0b s ARG 105 Ca 0.09 -0.69 0.01 0.00 -0.13 0.00 0.00 55.73 55.01 1r0b s ARG 105 Cb -0.09 -1.79 -0.03 0.00 -1.56 0.00 0.00 34.95 31.48 1r0b s ARG 105 CO -0.00 0.23 -0.05 -1.58 -0.81 0.00 0.00 175.30 173.08 1r0b s HIS 106 N 0.15 0.56 -0.69 5.12 2.46 0.89 -0.27 115.29 123.51 1r0b s HIS 106 Ca -0.08 -0.74 0.26 0.00 0.47 0.00 0.00 55.06 54.97 1r0b s HIS 106 Cb -0.14 -0.36 0.83 0.00 -0.13 0.00 0.00 32.58 32.78 1r0b s HIS 106 CO 0.04 -0.20 1.77 -2.30 -2.47 0.00 0.00 174.74 171.58 1r0b n PRO 107 N 0.85 0.26 -3.99 2.88 -0.02 -1.26 0.14 135.00 133.86 1r0b n PRO 107 Ca -0.19 0.25 -0.32 0.00 -2.02 0.00 0.00 63.50 61.23 1r0b n PRO 107 Cb 0.58 -1.82 -0.05 0.00 -0.02 0.00 0.00 33.50 32.18 1r0b n PRO 107 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1r0b s GLN 108 N -3.14 3.21 0.30 -0.52 -0.21 -1.26 -4.25 119.66 113.79 1r0b s GLN 108 Ca 0.10 -0.50 -0.29 0.00 0.02 0.00 0.00 55.36 54.68 1r0b s GLN 108 Cb 0.12 -2.92 -0.10 0.00 1.00 0.00 0.00 33.01 31.10 1r0b s GLN 108 CO 0.57 0.62 1.25 -1.21 -2.12 0.00 0.00 175.29 174.40 1r0b s GLU 109 N -2.23 4.43 0.00 2.91 8.01 -1.24 -3.18 118.70 127.40 1r0b s GLU 109 Ca 0.30 2.09 0.00 0.00 0.01 0.00 0.00 54.97 57.37 1r0b s GLU 109 Cb -0.13 -3.12 0.00 0.00 -4.31 0.00 0.00 34.13 26.58 1r0b s GLU 109 CO 0.22 -0.09 0.00 0.41 0.01 0.00 0.00 175.26 175.81 1r0b n GLY 110 N 1.09 0.93 0.19 -1.39 0.00 -1.26 -4.92 105.19 99.83 1r0b n GLY 110 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1r0b n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r0b h ALA 111 N 0.00 0.57 -0.49 4.61 0.00 -1.90 -1.22 119.26 120.82 1r0b h ALA 111 Ca 0.00 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1r0b h ALA 111 Cb 0.00 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1r0b h ALA 111 CO 0.00 -0.25 0.31 0.00 0.00 0.00 0.00 179.25 179.30 1r0b h ALA 112 N 1.34 0.63 0.29 0.00 0.00 -1.91 -1.81 119.26 117.79 1r0b h ALA 112 Ca 0.23 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1r0b h ALA 112 Cb 0.27 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1r0b h ALA 112 CO -0.26 0.10 -0.23 -0.09 0.00 0.00 0.00 179.25 178.77 1r0b h ARG 113 N 0.66 -0.51 -0.53 0.00 9.65 -1.80 -2.57 114.38 119.28 1r0b h ARG 113 Ca 0.18 0.03 0.10 0.00 -1.10 0.00 0.00 59.98 59.19 1r0b h ARG 113 Cb -0.03 0.12 -0.11 0.00 -1.39 0.00 0.00 29.97 28.56 1r0b h ARG 113 CO -0.03 -0.34 -0.34 1.25 2.80 0.00 0.00 179.97 183.30 1r0b h LEU 114 N -0.53 -1.17 -1.84 3.80 5.85 -1.04 0.13 115.31 120.51 1r0b h LEU 114 Ca -0.02 0.22 0.24 0.00 0.84 0.00 0.00 57.88 59.16 1r0b h LEU 114 Cb 0.47 0.57 -0.05 0.00 0.37 0.00 0.00 40.66 42.02 1r0b h LEU 114 CO -0.02 -0.31 0.63 0.00 -0.34 0.00 0.00 178.44 178.40 1r0b h ALA 115 N 0.89 2.65 0.00 1.25 0.00 -0.96 0.24 119.26 123.33 1r0b h ALA 115 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1r0b h ALA 115 Cb 0.55 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1r0b h ALA 115 CO -0.64 -0.92 0.00 1.79 0.00 0.00 0.00 179.25 179.48 1r0b h THR 116 N 0.12 0.00 -0.18 0.00 1.35 -0.36 -0.46 112.91 113.39 1r0b h THR 116 Ca 0.44 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.98 1r0b h THR 116 Cb 1.55 1.14 0.00 0.00 -1.73 0.00 0.00 68.15 69.12 1r0b h THR 116 CO -0.06 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 174.59 1r0b n GLU 117 N -2.53 1.86 0.00 4.72 1.02 0.83 -4.28 120.64 122.26 1r0b n GLU 117 Ca 0.02 -1.29 0.00 0.00 -0.02 0.00 0.00 57.16 55.87 1r0b n GLU 117 Cb 0.25 -1.42 0.00 0.00 -0.02 0.00 0.00 31.44 30.25 1r0b n GLU 117 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1r0b n PHE 118 N 0.52 0.00 -2.70 -0.32 3.72 -0.81 -4.96 117.46 112.91 1r0b n PHE 118 Ca 0.17 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.14 1r0b n PHE 118 Cb 0.38 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.90 1r0b n PHE 118 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1r0b s SER 119 N -2.53 6.78 -0.20 4.37 1.04 -0.25 -4.56 113.70 118.36 1r0b s SER 119 Ca 0.00 0.76 -0.12 0.00 0.48 0.00 0.00 55.95 57.07 1r0b s SER 119 Cb 0.00 -2.51 -0.05 0.00 0.10 0.00 0.00 66.02 63.56 1r0b s SER 119 CO 0.00 -0.93 0.23 -0.83 0.98 0.00 0.00 173.24 172.68 1r0b s GLY 120 N 1.88 2.09 -1.28 7.32 0.00 -1.26 -4.13 107.32 111.93 1r0b s GLY 120 Ca 0.43 -0.64 0.00 0.00 0.00 0.00 0.00 44.72 44.51 1r0b s GLY 120 CO 0.19 0.39 0.00 0.70 0.00 0.00 0.00 173.10 174.38 1r0b n ASN 121 N 3.85 -4.95 -3.95 1.64 3.02 -1.26 -4.96 115.26 108.64 1r0b n ASN 121 Ca -0.13 0.30 -0.30 0.00 -0.03 0.00 0.00 54.58 54.41 1r0b n ASN 121 Cb 0.52 -3.52 -0.15 0.00 -0.61 0.00 0.00 39.78 36.02 1r0b n ASN 121 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1r0b s VAL 122 N -2.28 1.60 0.06 2.41 1.01 -1.26 -5.04 120.40 116.90 1r0b s VAL 122 Ca 0.00 -1.29 -0.36 0.00 0.00 0.00 0.00 61.98 60.33 1r0b s VAL 122 Cb 0.00 -1.86 -0.15 0.00 0.00 0.00 0.00 36.38 34.36 1r0b s VAL 122 CO 0.00 -0.11 1.49 -2.65 0.00 0.00 0.00 175.10 173.82 1r0b n PRO 123 N 4.64 1.50 -3.87 2.72 -0.02 -1.26 -4.75 135.00 133.96 1r0b n PRO 123 Ca -0.12 0.54 -0.34 0.00 -2.02 0.00 0.00 63.50 61.56 1r0b n PRO 123 Cb 0.44 -2.24 -0.13 0.00 -0.02 0.00 0.00 33.50 31.55 1r0b n PRO 123 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1r0b s VAL 124 N 1.17 2.89 -0.35 -1.45 1.01 -1.26 -0.94 120.40 121.47 1r0b s VAL 124 Ca 0.85 -2.15 -0.26 0.00 0.00 0.00 0.00 61.98 60.42 1r0b s VAL 124 Cb -0.87 -3.03 0.01 0.00 0.00 0.00 0.00 36.38 32.50 1r0b s VAL 124 CO 0.47 -0.64 0.93 -0.76 0.00 0.00 0.00 175.10 175.10 1r0b s LEU 125 N 1.05 4.00 -0.36 3.92 1.43 0.36 -2.79 118.68 126.28 1r0b s LEU 125 Ca 0.09 0.69 -0.29 0.00 -1.03 0.00 0.00 54.13 53.59 1r0b s LEU 125 Cb -0.21 -3.29 0.01 0.00 0.03 0.00 0.00 46.19 42.73 1r0b s LEU 125 CO -0.06 -0.82 1.22 0.21 0.23 0.00 0.00 176.35 177.13 1r0b s ASN 126 N 1.79 6.69 0.06 2.29 2.47 -0.21 -2.24 114.94 125.79 1r0b s ASN 126 Ca 0.39 0.94 0.23 0.00 0.42 0.00 0.00 52.86 54.83 1r0b s ASN 126 Cb -0.12 -2.54 -0.02 0.00 -1.45 0.00 0.00 41.25 37.12 1r0b s ASN 126 CO 0.17 -1.12 0.95 0.00 -3.72 0.00 0.00 177.10 173.39 1r0b n ALA 127 N 7.63 3.22 -2.74 1.71 0.00 0.30 -4.22 120.51 126.41 1r0b n ALA 127 Ca 0.14 -0.40 0.02 0.00 0.00 0.00 0.00 53.44 53.19 1r0b n ALA 127 Cb 0.47 -0.96 0.01 0.00 0.00 0.00 0.00 19.45 18.97 1r0b n ALA 127 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1r0b s GLY 128 N -3.86 -1.58 -1.39 0.00 0.00 -1.20 -4.87 107.32 94.42 1r0b s GLY 128 Ca 0.02 1.32 -0.14 0.00 0.00 0.00 0.00 44.72 45.92 1r0b s GLY 128 CO 0.82 4.35 2.05 1.34 0.00 0.00 0.00 173.10 181.66 1r0b n ASP 129 N 3.60 4.31 -0.01 1.64 -0.08 -1.01 -0.07 116.55 124.93 1r0b n ASP 129 Ca 0.05 -2.91 0.00 0.00 -1.51 0.00 0.00 54.79 50.43 1r0b n ASP 129 Cb 0.64 -1.64 0.00 0.00 2.34 0.00 0.00 41.12 42.46 1r0b n ASP 129 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1r0b n GLY 130 N 4.09 0.00 3.74 0.27 0.00 0.12 0.39 105.19 113.80 1r0b n GLY 130 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.51 1r0b n GLY 130 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1r0b n SER 131 N 0.44 -0.63 0.00 1.61 2.88 -1.26 -3.60 113.62 113.06 1r0b n SER 131 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1r0b n SER 131 Cb 0.00 -2.23 0.00 0.00 -0.75 0.00 0.00 64.21 61.23 1r0b n SER 131 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1r0b n ASN 132 N -0.10 0.00 -4.91 -3.46 5.15 0.16 -4.31 115.26 107.80 1r0b n ASN 132 Ca 0.00 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 53.70 1r0b n ASN 132 Cb 0.05 0.00 0.05 0.00 -0.53 0.00 0.00 39.78 39.34 1r0b n ASN 132 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1r0b s GLN 133 N 2.75 2.72 -0.44 1.20 -1.52 -1.26 -4.31 119.66 118.80 1r0b s GLN 133 Ca 0.00 0.13 0.05 0.00 -1.95 0.00 0.00 55.36 53.60 1r0b s GLN 133 Cb 0.00 -2.14 0.29 0.00 -0.22 0.00 0.00 33.01 30.94 1r0b s GLN 133 CO 0.00 -0.97 1.09 1.58 -0.25 0.00 0.00 175.29 176.74 1r0b n HIS 134 N -2.84 -2.59 -0.35 0.91 -0.00 -1.26 -2.40 115.22 106.68 1r0b n HIS 134 Ca 0.06 -1.75 -0.04 0.00 -0.00 0.00 0.00 57.72 55.99 1r0b n HIS 134 Cb 0.58 1.53 0.00 0.00 -0.00 0.00 0.00 29.99 32.10 1r0b n HIS 134 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1r0b h PRO 135 N 3.24 -0.04 -0.84 1.57 0.11 -1.83 -2.27 132.00 131.93 1r0b h PRO 135 Ca -0.15 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.03 1r0b h PRO 135 Cb 1.10 0.01 -0.05 0.00 0.11 0.00 0.00 31.00 32.16 1r0b h PRO 135 CO 0.16 -0.03 0.55 1.79 -0.21 0.00 0.00 178.00 180.26 1r0b h THR 136 N -0.04 1.05 -0.05 -1.15 1.35 -1.93 -1.98 112.91 110.15 1r0b h THR 136 Ca 0.28 -0.32 -0.11 0.00 -0.55 0.00 0.00 66.41 65.72 1r0b h THR 136 Cb 0.56 0.04 -0.01 0.00 -1.73 0.00 0.00 68.15 67.00 1r0b h THR 136 CO -0.92 0.17 -0.46 -0.61 -0.25 0.00 0.00 175.52 173.45 1r0b h GLN 137 N 0.93 0.12 -0.09 4.72 5.75 -1.78 -2.83 115.11 121.93 1r0b h GLN 137 Ca 0.36 -0.06 -0.13 0.00 -0.15 0.00 0.00 58.65 58.67 1r0b h GLN 137 Cb 0.22 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.76 1r0b h GLN 137 CO -0.13 0.56 -0.51 1.15 -2.65 0.00 0.00 178.83 177.25 1r0b h THR 138 N 0.10 1.35 -0.58 2.39 2.02 -1.22 -2.52 112.91 114.45 1r0b h THR 138 Ca 0.00 -1.77 -0.10 0.00 0.77 0.00 0.00 66.41 65.32 1r0b h THR 138 Cb 0.86 1.85 -0.02 0.00 -1.74 0.00 0.00 68.15 69.10 1r0b h THR 138 CO 0.07 0.53 -0.02 -0.07 0.37 0.00 0.00 175.52 176.39 1r0b h LEU 139 N 0.20 1.01 -0.72 2.58 3.38 -1.22 -1.60 115.31 118.93 1r0b h LEU 139 Ca 0.01 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.63 1r0b h LEU 139 Cb 0.97 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.42 1r0b h LEU 139 CO 0.08 1.07 0.22 -0.07 0.09 0.00 0.00 178.44 179.83 1r0b h LEU 140 N 0.93 1.06 -0.21 1.67 3.38 -1.34 -0.54 115.31 120.26 1r0b h LEU 140 Ca 0.16 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1r0b h LEU 140 Cb 0.57 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1r0b h LEU 140 CO 0.03 0.99 0.13 0.44 0.09 0.00 0.00 178.44 180.12 1r0b h ASP 141 N 1.07 0.26 0.34 -0.43 3.32 -1.11 -1.19 116.42 118.68 1r0b h ASP 141 Ca 0.23 -0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 1r0b h ASP 141 Cb 0.31 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1r0b h ASP 141 CO -0.01 0.23 -0.16 -0.07 -1.72 0.00 0.00 179.24 177.51 1r0b h LEU 142 N 0.26 -0.39 -2.01 1.55 3.38 -1.11 0.86 115.31 117.85 1r0b h LEU 142 Ca 0.08 -0.14 0.14 0.00 0.09 0.00 0.00 57.88 58.05 1r0b h LEU 142 Cb 0.02 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1r0b h LEU 142 CO -0.01 -0.06 0.43 0.15 0.09 0.00 0.00 178.44 179.03 1r0b h PHE 143 N -0.74 0.00 0.13 1.13 3.57 -1.11 0.11 116.94 120.03 1r0b h PHE 143 Ca -0.05 0.00 -0.32 0.00 3.53 0.00 0.00 57.97 61.13 1r0b h PHE 143 Cb 0.50 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.24 1r0b h PHE 143 CO 0.01 0.00 -1.66 1.15 -2.23 0.00 0.00 178.31 175.58 1r0b h THR 144 N 0.00 0.89 -0.46 4.41 2.02 -0.77 -2.78 112.91 116.22 1r0b h THR 144 Ca 0.23 -2.40 -0.03 0.00 0.77 0.00 0.00 66.41 64.98 1r0b h THR 144 Cb 1.08 2.65 -0.02 0.00 -1.74 0.00 0.00 68.15 70.12 1r0b h THR 144 CO -0.00 0.78 0.18 0.40 0.37 0.00 0.00 175.52 177.24 1r0b h ILE 145 N -0.12 1.21 -0.43 3.11 2.04 0.15 -1.64 117.51 121.83 1r0b h ILE 145 Ca -0.35 -0.66 -0.09 0.00 1.00 0.00 0.00 64.86 64.76 1r0b h ILE 145 Cb 1.91 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 38.75 1r0b h ILE 145 CO 0.09 0.24 -0.10 -0.61 0.00 0.00 0.00 178.15 177.77 1r0b h GLN 146 N 0.60 0.76 -0.26 2.37 4.15 -0.97 0.60 115.11 122.37 1r0b h GLN 146 Ca 0.15 -0.24 -0.07 0.00 0.77 0.00 0.00 58.65 59.26 1r0b h GLN 146 Cb 0.21 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.82 1r0b h GLN 146 CO -0.01 0.84 -0.14 1.49 -1.93 0.00 0.00 178.83 179.07 1r0b h GLU 147 N 0.69 0.44 0.00 1.69 4.81 -1.19 0.48 114.58 121.50 1r0b h GLU 147 Ca 0.12 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1r0b h GLU 147 Cb 0.57 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1r0b h GLU 147 CO 0.04 0.58 -1.72 0.25 -0.73 0.00 0.00 179.01 177.43 1r0b n THR 148 N -4.20 0.00 0.31 0.32 -2.24 -0.65 -4.53 114.28 103.29 1r0b n THR 148 Ca 0.00 -0.36 0.03 0.00 -2.27 0.00 0.00 64.05 61.45 1r0b n THR 148 Cb 0.32 0.27 -0.04 0.00 -2.10 0.00 0.00 70.33 68.78 1r0b n THR 148 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1r0b n GLN 149 N -2.05 4.10 0.00 -0.78 1.13 0.21 -4.92 117.38 115.07 1r0b n GLN 149 Ca -0.02 -0.01 0.00 0.00 -1.94 0.00 0.00 57.00 55.03 1r0b n GLN 149 Cb 0.50 -0.88 0.00 0.00 0.11 0.00 0.00 30.24 29.97 1r0b n GLN 149 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1r0b n GLY 150 N 1.27 2.80 3.32 1.08 0.00 0.15 -4.93 105.19 108.90 1r0b n GLY 150 Ca 0.01 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.86 1r0b n GLY 150 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1r0b s ARG 151 N -0.04 1.70 0.00 1.61 1.70 -1.26 -4.96 118.95 117.69 1r0b s ARG 151 Ca 0.00 -1.88 0.00 0.00 -0.47 0.00 0.00 55.73 53.38 1r0b s ARG 151 Cb 0.00 0.35 0.00 0.00 -0.57 0.00 0.00 34.95 34.73 1r0b s ARG 151 CO 0.00 -0.64 0.70 1.28 -1.08 0.00 0.00 175.30 175.56 1r0b n LEU 152 N -0.55 1.07 -4.26 -1.89 4.77 -1.26 -4.11 117.00 110.78 1r0b n LEU 152 Ca 0.05 -1.07 -0.23 0.00 -0.03 0.00 0.00 56.01 54.73 1r0b n LEU 152 Cb 0.63 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.59 1r0b n LEU 152 CO 0.32 0.27 -0.50 1.51 -1.33 0.00 0.00 177.39 177.65 1r0b s ASP 153 N -0.48 2.34 -0.60 -1.43 -4.77 -1.26 -4.76 116.67 105.70 1r0b s ASP 153 Ca 0.00 -0.66 -0.01 0.00 -3.30 0.00 0.00 52.55 48.58 1r0b s ASP 153 Cb 0.00 -0.12 -0.01 0.00 -1.09 0.00 0.00 42.92 41.70 1r0b s ASP 153 CO 0.00 0.03 0.56 0.59 0.70 0.00 0.00 175.17 177.05 1r0b n ASN 154 N 1.17 -6.27 -3.97 2.11 3.02 -0.45 -4.98 115.26 105.88 1r0b n ASN 154 Ca -0.20 -0.13 -0.12 0.00 -0.03 0.00 0.00 54.58 54.10 1r0b n ASN 154 Cb 0.54 -4.25 -0.12 0.00 -0.61 0.00 0.00 39.78 35.33 1r0b n ASN 154 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1r0b s LEU 155 N -3.73 2.15 -0.55 3.41 1.43 -1.19 -4.99 118.68 115.21 1r0b s LEU 155 Ca 0.06 -0.33 -0.13 0.00 -1.03 0.00 0.00 54.13 52.70 1r0b s LEU 155 Cb -0.01 -0.04 0.14 0.00 0.03 0.00 0.00 46.19 46.31 1r0b s LEU 155 CO 0.57 -0.15 0.48 -1.00 0.23 0.00 0.00 176.35 176.47 1r0b s HIS 156 N -0.88 3.36 -0.26 0.29 3.76 -1.26 -0.55 115.29 119.75 1r0b s HIS 156 Ca -0.08 -1.58 -0.07 0.00 -0.15 0.00 0.00 55.06 53.18 1r0b s HIS 156 Cb -0.06 -3.69 -0.01 0.00 1.11 0.00 0.00 32.58 29.92 1r0b s HIS 156 CO -0.00 -1.01 0.06 0.08 -0.85 0.00 0.00 174.74 173.02 1r0b s VAL 157 N 1.34 4.08 -0.15 -0.90 1.01 0.26 -0.06 120.40 125.98 1r0b s VAL 157 Ca 0.06 -0.38 -0.07 0.00 0.00 0.00 0.00 61.98 61.59 1r0b s VAL 157 Cb -0.27 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.11 1r0b s VAL 157 CO 0.01 0.27 0.10 0.00 0.00 0.00 0.00 175.10 175.47 1r0b s ALA 158 N 1.56 3.62 -0.24 5.51 0.00 -0.32 -2.38 121.76 129.51 1r0b s ALA 158 Ca 0.05 -0.70 0.02 0.00 0.00 0.00 0.00 51.96 51.32 1r0b s ALA 158 Cb -0.16 -1.94 0.06 0.00 0.00 0.00 0.00 23.12 21.09 1r0b s ALA 158 CO 0.02 0.38 -0.08 -1.64 0.00 0.00 0.00 175.76 174.45 1r0b s MET 159 N -0.27 1.86 0.24 0.00 -1.94 -0.93 0.32 119.30 118.58 1r0b s MET 159 Ca 0.10 -1.11 0.08 0.00 -1.71 0.00 0.00 55.69 53.05 1r0b s MET 159 Cb -0.12 -2.69 -0.04 0.00 2.01 0.00 0.00 34.83 33.99 1r0b s MET 159 CO 0.01 -0.58 0.08 0.08 -0.01 0.00 0.00 175.02 174.60 1r0b s VAL 160 N 1.29 3.91 0.00 -6.03 1.01 -0.91 -2.39 120.40 117.28 1r0b s VAL 160 Ca -0.07 -1.61 0.00 0.00 0.00 0.00 0.00 61.98 60.30 1r0b s VAL 160 Cb -0.19 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.11 1r0b s VAL 160 CO -0.06 -0.31 0.00 0.61 0.00 0.00 0.00 175.10 175.34 1r0b n GLY 161 N -0.86 -1.81 3.62 4.51 0.00 -0.85 -2.58 105.19 107.21 1r0b n GLY 161 Ca -0.08 -1.93 -0.43 0.00 0.00 0.00 0.00 46.02 43.59 1r0b n GLY 161 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1r0b s ASP 162 N -4.00 5.74 -0.00 1.61 -1.08 -1.26 -4.54 116.67 113.14 1r0b s ASP 162 Ca 0.00 2.09 0.13 0.00 -0.52 0.00 0.00 52.55 54.25 1r0b s ASP 162 Cb 0.00 -2.52 -0.15 0.00 -1.46 0.00 0.00 42.92 38.79 1r0b s ASP 162 CO 0.00 -1.70 0.48 0.18 0.52 0.00 0.00 175.17 174.65 1r0b n LEU 163 N 10.49 0.46 -0.03 -1.34 4.77 -0.97 -3.60 117.00 126.77 1r0b n LEU 163 Ca 0.27 -0.39 -0.14 0.00 -0.03 0.00 0.00 56.01 55.72 1r0b n LEU 163 Cb 0.44 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.42 1r0b n LEU 163 CO 0.67 0.11 0.49 0.50 -1.33 0.00 0.00 177.39 177.83 1r0b h LYS 164 N 0.00 0.09 -0.00 3.23 3.64 -1.49 -3.35 116.57 118.68 1r0b h LYS 164 Ca 0.00 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1r0b h LYS 164 Cb 0.36 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1r0b h LYS 164 CO 0.00 0.78 -0.82 0.66 -2.27 0.00 0.00 179.45 177.80 1r0b n TYR 165 N -4.65 0.00 -1.87 1.91 4.01 -1.26 -4.81 117.16 110.49 1r0b n TYR 165 Ca -0.09 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.41 1r0b n TYR 165 Cb 0.40 -0.02 -0.05 0.00 -0.31 0.00 0.00 39.34 39.36 1r0b n TYR 165 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1r0b s GLY 166 N -2.85 -0.17 0.39 2.72 0.00 -1.24 -4.56 107.32 101.61 1r0b s GLY 166 Ca 0.11 -1.16 0.12 0.00 0.00 0.00 0.00 44.72 43.80 1r0b s GLY 166 CO 0.77 3.75 1.90 0.07 0.00 0.00 0.00 173.10 179.60 1r0b h ARG 167 N 12.32 0.53 -0.66 2.90 0.11 -1.75 -1.72 114.38 126.12 1r0b h ARG 167 Ca 0.03 -0.03 0.01 0.00 0.10 0.00 0.00 59.98 60.09 1r0b h ARG 167 Cb 1.02 -0.12 -0.03 0.00 1.11 0.00 0.00 29.97 31.95 1r0b h ARG 167 CO 1.14 0.35 0.44 1.79 0.10 0.00 0.00 179.97 183.79 1r0b h THR 168 N 0.55 1.16 0.02 0.08 1.35 -1.86 -2.46 112.91 111.75 1r0b h THR 168 Ca 0.40 -0.30 -0.20 0.00 -0.55 0.00 0.00 66.41 65.76 1r0b h THR 168 Cb 0.78 0.20 -0.02 0.00 -1.73 0.00 0.00 68.15 67.39 1r0b h THR 168 CO -0.16 0.16 -0.94 -0.37 -0.25 0.00 0.00 175.52 173.96 1r0b h VAL 169 N 0.88 1.58 -0.52 6.82 -1.51 -1.68 -2.73 116.25 119.09 1r0b h VAL 169 Ca 0.24 -2.94 0.04 0.00 -1.23 0.00 0.00 66.70 62.82 1r0b h VAL 169 Cb -0.09 2.64 -0.04 0.00 -2.13 0.00 0.00 31.29 31.67 1r0b h VAL 169 CO -0.05 0.85 0.27 0.45 -1.23 0.00 0.00 177.57 177.85 1r0b h HIS 170 N 0.05 0.49 0.02 5.19 3.86 -1.30 -0.77 115.15 122.69 1r0b h HIS 170 Ca -0.04 0.02 -0.21 0.00 -1.16 0.00 0.00 60.37 58.99 1r0b h HIS 170 Cb 1.62 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 29.93 1r0b h HIS 170 CO 0.02 0.24 -0.94 0.77 0.86 0.00 0.00 177.93 178.88 1r0b h SER 171 N 0.52 0.22 0.84 2.45 0.02 -1.55 -2.97 113.55 113.08 1r0b h SER 171 Ca 0.23 -0.19 -0.19 0.00 -0.84 0.00 0.00 61.79 60.79 1r0b h SER 171 Cb 0.13 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 1r0b h SER 171 CO -0.15 1.04 -0.89 0.25 -1.14 0.00 0.00 176.83 175.94 1r0b h LEU 172 N 0.08 0.04 0.04 5.07 5.85 -1.30 -0.48 115.31 124.61 1r0b h LEU 172 Ca -0.05 -0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.63 1r0b h LEU 172 Cb 1.61 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.62 1r0b h LEU 172 CO 0.14 0.91 -0.02 0.74 -0.34 0.00 0.00 178.44 179.87 1r0b h THR 173 N 0.01 1.34 -0.13 1.05 2.02 -1.23 0.64 112.91 116.61 1r0b h THR 173 Ca -0.02 -1.31 0.01 0.00 0.77 0.00 0.00 66.41 65.86 1r0b h THR 173 Cb 1.56 2.20 -0.01 0.00 -1.74 0.00 0.00 68.15 70.16 1r0b h THR 173 CO 0.12 0.33 0.09 1.56 0.37 0.00 0.00 175.52 177.98 1r0b h GLN 174 N -0.64 0.13 0.03 6.66 4.20 -1.56 0.12 115.11 124.05 1r0b h GLN 174 Ca -0.01 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 1r0b h GLN 174 Cb 0.58 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.33 1r0b h GLN 174 CO 0.01 0.09 -0.01 0.00 -0.67 0.00 0.00 178.83 178.24 1r0b h ALA 175 N 1.92 -0.33 0.00 3.87 0.00 -0.97 -3.26 119.26 120.50 1r0b h ALA 175 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1r0b h ALA 175 Cb 0.05 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1r0b h ALA 175 CO -0.01 -0.32 0.38 -0.07 0.00 0.00 0.00 179.25 179.23 1r0b h LEU 176 N -0.10 0.00 -0.08 0.00 3.38 -0.78 0.75 115.31 118.48 1r0b h LEU 176 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1r0b h LEU 176 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1r0b h LEU 176 CO 0.01 0.00 -0.02 0.00 0.09 0.00 0.00 178.44 178.52 1r0b n ALA 177 N -1.73 2.61 0.45 1.53 0.00 0.40 -2.77 120.51 121.01 1r0b n ALA 177 Ca -0.01 -0.20 0.11 0.00 0.00 0.00 0.00 53.44 53.34 1r0b n ALA 177 Cb 0.41 -1.46 0.25 0.00 0.00 0.00 0.00 19.45 18.66 1r0b n ALA 177 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1r0b n LYS 178 N -1.07 2.35 -4.33 0.00 5.02 0.26 -4.91 118.16 115.49 1r0b n LYS 178 Ca 0.18 -2.05 -0.24 0.00 -2.02 0.00 0.00 58.31 54.17 1r0b n LYS 178 Cb 0.21 -1.49 -0.08 0.00 -0.02 0.00 0.00 35.03 33.65 1r0b n LYS 178 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1r0b s PHE 179 N -1.51 2.56 0.26 2.13 0.08 -1.11 -4.78 117.98 115.61 1r0b s PHE 179 Ca 0.38 -0.37 -0.21 0.00 0.12 0.00 0.00 56.93 56.85 1r0b s PHE 179 Cb 0.22 -1.36 -0.09 0.00 -0.57 0.00 0.00 43.02 41.22 1r0b s PHE 179 CO 0.30 0.54 0.80 -0.51 -0.10 0.00 0.00 175.22 176.24 1r0b s ASP 180 N -3.69 7.13 -1.30 1.36 1.01 -1.26 -4.48 116.67 115.44 1r0b s ASP 180 Ca 0.33 1.54 -0.01 0.00 0.71 0.00 0.00 52.55 55.13 1r0b s ASP 180 Cb -0.02 -2.47 -0.00 0.00 1.01 0.00 0.00 42.92 41.44 1r0b s ASP 180 CO 0.19 -0.02 0.70 0.61 0.21 0.00 0.00 175.17 176.86 1r0b n GLY 181 N 0.59 -0.34 3.79 0.21 0.00 -1.26 -1.34 105.19 106.84 1r0b n GLY 181 Ca -0.01 0.15 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 1r0b n GLY 181 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1r0b s ASN 182 N -4.31 5.71 -0.09 1.61 0.01 -1.26 -1.79 114.94 114.82 1r0b s ASN 182 Ca 0.03 0.16 0.04 0.00 -0.71 0.00 0.00 52.86 52.38 1r0b s ASN 182 Cb -0.01 -1.65 0.00 0.00 0.41 0.00 0.00 41.25 40.00 1r0b s ASN 182 CO 0.81 0.27 -0.22 -0.60 -1.51 0.00 0.00 177.10 175.86 1r0b s ARG 183 N -1.73 2.71 0.02 -0.60 3.00 0.28 -3.89 118.95 118.74 1r0b s ARG 183 Ca 0.23 -0.79 0.05 0.00 -1.00 0.00 0.00 55.73 54.22 1r0b s ARG 183 Cb -0.12 -2.10 -0.03 0.00 0.00 0.00 0.00 34.95 32.70 1r0b s ARG 183 CO 0.14 0.18 -0.12 -0.06 0.00 0.00 0.00 175.30 175.44 1r0b s PHE 184 N 0.33 2.74 -0.39 5.12 0.08 -0.54 -0.58 117.98 124.75 1r0b s PHE 184 Ca -0.16 -0.14 0.01 0.00 0.12 0.00 0.00 56.93 56.77 1r0b s PHE 184 Cb -0.17 -1.55 0.12 0.00 -0.57 0.00 0.00 43.02 40.85 1r0b s PHE 184 CO 0.07 0.31 0.17 0.71 -0.10 0.00 0.00 175.22 176.38 1r0b s TYR 185 N -0.95 2.18 -0.75 0.36 2.02 -1.00 -1.73 117.35 117.47 1r0b s TYR 185 Ca 0.16 -2.30 -0.22 0.00 -0.37 0.00 0.00 57.07 54.33 1r0b s TYR 185 Cb -0.11 -2.01 0.07 0.00 -0.40 0.00 0.00 41.96 39.51 1r0b s TYR 185 CO 0.06 -0.84 1.08 -0.06 -1.57 0.00 0.00 175.55 174.22 1r0b s PHE 186 N 0.83 2.69 -0.44 2.71 0.08 -0.95 -2.19 117.98 120.71 1r0b s PHE 186 Ca 0.14 -0.66 -0.16 0.00 0.12 0.00 0.00 56.93 56.37 1r0b s PHE 186 Cb -0.21 -4.37 0.04 0.00 -0.57 0.00 0.00 43.02 37.91 1r0b s PHE 186 CO -0.10 -1.70 0.38 0.42 -0.10 0.00 0.00 175.22 174.13 1r0b s ILE 187 N 4.12 5.19 0.14 0.64 1.01 -1.01 -3.70 121.20 127.59 1r0b s ILE 187 Ca 0.28 -0.72 -0.25 0.00 0.00 0.00 0.00 60.65 59.96 1r0b s ILE 187 Cb -0.12 -4.05 0.07 0.00 0.01 0.00 0.00 42.46 38.37 1r0b s ILE 187 CO 0.06 -0.46 0.86 0.00 0.00 0.00 0.00 174.94 175.40 1r0b s ALA 188 N 1.83 -1.61 0.36 9.38 0.00 -1.26 -2.01 121.76 128.45 1r0b s ALA 188 Ca 0.07 0.29 -0.28 0.00 0.00 0.00 0.00 51.96 52.04 1r0b s ALA 188 Cb -0.20 0.65 -0.10 0.00 0.00 0.00 0.00 23.12 23.47 1r0b s ALA 188 CO 0.10 -0.93 1.35 -2.14 0.00 0.00 0.00 175.76 174.14 1r0b s PRO 189 N -3.41 4.20 0.20 0.00 0.02 -1.26 -4.85 135.00 129.91 1r0b s PRO 189 Ca 0.09 2.30 -0.14 0.00 0.02 0.00 0.00 61.00 63.27 1r0b s PRO 189 Cb -0.02 -2.97 0.22 0.00 0.02 0.00 0.00 34.50 31.74 1r0b s PRO 189 CO -0.01 -0.35 1.64 -0.44 -0.33 0.00 0.00 177.00 177.51 1r0b h ASP 190 N 3.12 -0.52 0.00 2.53 3.45 -2.01 0.32 116.42 123.31 1r0b h ASP 190 Ca -0.50 0.17 0.00 0.00 0.43 0.00 0.00 57.03 57.14 1r0b h ASP 190 Cb 1.23 0.36 0.00 0.00 -0.56 0.00 0.00 39.33 40.36 1r0b h ASP 190 CO 0.64 -0.19 0.02 0.00 -1.57 0.00 0.00 179.24 178.15 1r0b n ALA 191 N -2.98 1.14 -2.76 3.45 0.00 -1.26 -2.12 120.51 115.98 1r0b n ALA 191 Ca 0.07 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.50 1r0b n ALA 191 Cb 0.31 -0.92 0.06 0.00 0.00 0.00 0.00 19.45 18.90 1r0b n ALA 191 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1r0b n LEU 192 N -1.23 0.80 -4.79 0.00 4.77 0.07 -5.01 117.00 111.61 1r0b n LEU 192 Ca 0.00 -2.97 -0.31 0.00 -0.03 0.00 0.00 56.01 52.69 1r0b n LEU 192 Cb 0.02 0.35 0.06 0.00 -2.33 0.00 0.00 43.42 41.52 1r0b n LEU 192 CO 0.00 1.16 0.71 0.00 -1.33 0.00 0.00 177.39 177.93 1r0b s ALA 193 N -2.59 2.50 -0.11 -1.18 0.00 -0.90 -1.99 121.76 117.49 1r0b s ALA 193 Ca 0.23 0.25 -0.36 0.00 0.00 0.00 0.00 51.96 52.08 1r0b s ALA 193 Cb 0.35 -3.24 -0.14 0.00 0.00 0.00 0.00 23.12 20.09 1r0b s ALA 193 CO -0.07 -1.39 1.77 -0.12 0.00 0.00 0.00 175.76 175.95 1r0b n MET 194 N -3.06 1.78 -1.20 0.00 1.56 -1.26 -3.76 117.12 111.17 1r0b n MET 194 Ca 0.09 0.65 -0.38 0.00 -0.27 0.00 0.00 57.70 57.79 1r0b n MET 194 Cb 0.53 -2.42 0.03 0.00 2.15 0.00 0.00 33.22 33.51 1r0b n MET 194 CO 0.00 0.00 0.00 -2.30 -0.73 0.00 0.00 175.97 172.94 1r0b n PRO 195 N 5.60 0.08 0.07 2.12 -0.02 -1.26 -4.81 135.00 136.78 1r0b n PRO 195 Ca 0.23 0.03 -0.13 0.00 -2.02 0.00 0.00 63.50 61.61 1r0b n PRO 195 Cb 0.23 -1.18 -0.08 0.00 -0.02 0.00 0.00 33.50 32.45 1r0b n PRO 195 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1r0b h GLN 196 N -0.30 -0.15 -0.84 -0.52 5.75 -2.00 -3.08 115.11 113.98 1r0b h GLN 196 Ca -0.43 0.01 0.24 0.00 -0.15 0.00 0.00 58.65 58.33 1r0b h GLN 196 Cb 1.39 0.04 -0.03 0.00 1.07 0.00 0.00 27.48 29.95 1r0b h GLN 196 CO 0.38 0.11 0.75 0.10 -2.65 0.00 0.00 178.83 177.52 1r0b h TYR 197 N -0.41 0.00 0.09 3.99 -0.00 -1.98 0.64 116.97 119.30 1r0b h TYR 197 Ca -0.02 0.00 -0.26 0.00 -0.00 0.00 0.00 58.73 58.45 1r0b h TYR 197 Cb 0.33 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.05 1r0b h TYR 197 CO 0.01 0.00 -1.24 0.82 -0.00 0.00 0.00 178.16 177.75 1r0b h ILE 198 N 0.00 1.48 -0.25 -0.90 1.08 -1.89 -1.99 117.51 115.04 1r0b h ILE 198 Ca 0.40 -3.11 -0.16 0.00 -0.39 0.00 0.00 64.86 61.59 1r0b h ILE 198 Cb 1.90 2.87 0.00 0.00 -3.07 0.00 0.00 36.82 38.52 1r0b h ILE 198 CO -0.00 0.89 -0.48 -0.07 -0.69 0.00 0.00 178.15 177.80 1r0b h LEU 199 N 0.05 0.86 -0.68 1.44 3.38 0.19 -2.44 115.31 118.11 1r0b h LEU 199 Ca -0.12 -0.54 -0.13 0.00 0.09 0.00 0.00 57.88 57.18 1r0b h LEU 199 Cb 1.92 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 42.42 1r0b h LEU 199 CO 0.17 1.23 -0.42 0.44 0.09 0.00 0.00 178.44 179.96 1r0b h ASP 200 N 0.52 0.56 0.09 -0.43 3.32 -0.68 -1.96 116.42 117.84 1r0b h ASP 200 Ca 0.01 -0.25 -0.06 0.00 0.02 0.00 0.00 57.03 56.75 1r0b h ASP 200 Cb 1.08 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.46 1r0b h ASP 200 CO 0.11 0.92 -0.20 -0.03 -1.72 0.00 0.00 179.24 178.32 1r0b h MET 201 N 0.44 0.21 -0.20 3.56 4.05 -1.29 -0.19 114.93 121.50 1r0b h MET 201 Ca 0.04 -0.06 -0.18 0.00 -0.28 0.00 0.00 59.70 59.22 1r0b h MET 201 Cb 0.91 -0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.69 1r0b h MET 201 CO 0.08 0.40 -0.61 -0.07 0.23 0.00 0.00 176.91 176.94 1r0b h LEU 202 N 0.19 0.78 -0.25 3.39 3.38 -0.97 -2.76 115.31 119.07 1r0b h LEU 202 Ca 0.04 -0.44 -0.18 0.00 0.09 0.00 0.00 57.88 57.39 1r0b h LEU 202 Cb 0.46 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1r0b h LEU 202 CO 0.03 1.20 -0.53 0.44 0.09 0.00 0.00 178.44 179.68 1r0b h ASP 203 N 0.51 0.90 -0.84 -0.43 3.32 -1.05 0.38 116.42 119.21 1r0b h ASP 203 Ca -0.01 -0.55 0.17 0.00 0.02 0.00 0.00 57.03 56.67 1r0b h ASP 203 Cb 1.20 -0.26 -0.06 0.00 0.22 0.00 0.00 39.33 40.43 1r0b h ASP 203 CO 0.12 1.28 0.56 -0.08 -1.72 0.00 0.00 179.24 179.40 1r0b h GLU 204 N 0.56 0.46 -0.00 3.56 4.57 -1.00 0.14 114.58 122.87 1r0b h GLU 204 Ca 0.01 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1r0b h GLU 204 Cb 1.14 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.62 1r0b h GLU 204 CO 0.12 0.31 -0.75 1.63 -1.18 0.00 0.00 179.01 179.13 1r0b n LYS 205 N -4.51 0.10 -1.68 1.92 5.02 -1.05 -4.98 118.16 112.98 1r0b n LYS 205 Ca 0.17 -0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 1r0b n LYS 205 Cb 0.58 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.09 1r0b n LYS 205 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1r0b n GLY 206 N 1.49 0.39 3.74 0.72 0.00 0.50 -5.04 105.19 106.99 1r0b n GLY 206 Ca 0.05 -0.94 -0.40 0.00 0.00 0.00 0.00 46.02 44.73 1r0b n GLY 206 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1r0b s ILE 207 N -2.00 4.24 0.01 -0.61 -1.09 0.12 -4.98 121.20 116.88 1r0b s ILE 207 Ca 0.00 2.06 -0.30 0.00 -2.23 0.00 0.00 60.65 60.18 1r0b s ILE 207 Cb 0.00 -4.31 -0.04 0.00 -1.58 0.00 0.00 42.46 36.53 1r0b s ILE 207 CO 0.00 0.41 1.09 0.00 -1.23 0.00 0.00 174.94 175.21 1r0b s ALA 208 N -0.65 3.31 -0.18 9.38 0.00 -1.25 -4.60 121.76 127.76 1r0b s ALA 208 Ca 0.44 0.65 -0.17 0.00 0.00 0.00 0.00 51.96 52.88 1r0b s ALA 208 Cb -0.25 -3.41 0.05 0.00 0.00 0.00 0.00 23.12 19.51 1r0b s ALA 208 CO 0.31 -0.40 0.49 1.67 0.00 0.00 0.00 175.76 177.83 1r0b s TRP 209 N 1.26 -0.55 0.26 0.00 1.48 -1.26 -1.46 118.94 118.66 1r0b s TRP 209 Ca 0.55 1.33 0.01 0.00 -1.06 0.00 0.00 56.10 56.93 1r0b s TRP 209 Cb -0.24 0.20 -0.04 0.00 -1.16 0.00 0.00 33.47 32.22 1r0b s TRP 209 CO 0.27 -0.27 0.13 -1.54 -4.06 0.00 0.00 176.95 171.48 1r0b s SER 210 N 0.34 1.07 0.28 -2.66 1.04 -0.71 -4.99 113.70 108.07 1r0b s SER 210 Ca -0.01 -1.45 0.09 0.00 0.48 0.00 0.00 55.95 55.06 1r0b s SER 210 Cb -0.04 0.29 -0.04 0.00 0.10 0.00 0.00 66.02 66.33 1r0b s SER 210 CO -0.00 -0.81 0.06 -0.76 0.98 0.00 0.00 173.24 172.71 1r0b s LEU 211 N -3.30 3.32 -0.07 2.42 1.43 -1.26 -2.24 118.68 118.97 1r0b s LEU 211 Ca 0.37 -0.60 -0.23 0.00 -1.03 0.00 0.00 54.13 52.64 1r0b s LEU 211 Cb 0.07 -1.83 0.05 0.00 0.03 0.00 0.00 46.19 44.51 1r0b s LEU 211 CO 0.15 -0.06 0.54 -1.00 0.23 0.00 0.00 176.35 176.20 1r0b s HIS 212 N -2.31 -0.50 -1.51 0.29 3.76 -1.24 -4.93 115.29 108.84 1r0b s HIS 212 Ca 0.33 0.94 0.20 0.00 -0.15 0.00 0.00 55.06 56.38 1r0b s HIS 212 Cb -0.06 0.27 0.65 0.00 1.11 0.00 0.00 32.58 34.55 1r0b s HIS 212 CO 0.21 -0.47 1.56 0.43 -0.85 0.00 0.00 174.74 175.62 1r0b n SER 213 N 1.43 4.22 -3.68 1.40 7.64 -1.26 -4.15 113.62 119.21 1r0b n SER 213 Ca -0.19 -2.20 -0.06 0.00 1.01 0.00 0.00 58.87 57.43 1r0b n SER 213 Cb 0.56 -0.51 -0.02 0.00 -1.01 0.00 0.00 64.21 63.24 1r0b n SER 213 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1r0b s SER 214 N -0.98 -0.28 -0.15 6.43 1.04 -1.26 -5.04 113.70 113.45 1r0b s SER 214 Ca 0.48 -0.31 -0.23 0.00 0.48 0.00 0.00 55.95 56.36 1r0b s SER 214 Cb 0.28 0.53 -0.24 0.00 0.10 0.00 0.00 66.02 66.69 1r0b s SER 214 CO 0.28 -0.95 0.52 0.40 0.98 0.00 0.00 173.24 174.48 1r0b h ILE 215 N 2.00 1.29 0.00 -1.02 2.04 -1.96 -3.32 117.51 116.53 1r0b h ILE 215 Ca -0.24 -2.31 0.00 0.00 1.00 0.00 0.00 64.86 63.32 1r0b h ILE 215 Cb 1.25 2.80 0.00 0.00 -0.74 0.00 0.00 36.82 40.13 1r0b h ILE 215 CO 0.28 0.52 0.02 -0.62 0.00 0.00 0.00 178.15 178.34 1r0b n GLU 216 N -4.37 0.00 -0.05 2.37 1.02 -1.26 -0.74 120.64 117.61 1r0b n GLU 216 Ca -0.22 0.04 -0.15 0.00 -0.02 0.00 0.00 57.16 56.81 1r0b n GLU 216 Cb 0.66 -1.52 -0.13 0.00 -0.02 0.00 0.00 31.44 30.44 1r0b n GLU 216 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1r0b h GLU 217 N 0.00 0.03 -0.02 3.49 5.08 -2.00 -3.38 114.58 117.78 1r0b h GLU 217 Ca 0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1r0b h GLU 217 Cb 0.03 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1r0b h GLU 217 CO 0.00 1.00 -0.10 1.33 -1.00 0.00 0.00 179.01 180.24 1r0b n VAL 218 N -4.57 0.00 -0.21 3.13 0.24 0.09 -4.65 118.33 112.35 1r0b n VAL 218 Ca -0.10 -0.45 0.20 0.00 -2.04 0.00 0.00 64.34 61.94 1r0b n VAL 218 Cb 0.50 1.33 0.54 0.00 -1.47 0.00 0.00 33.84 34.74 1r0b n VAL 218 CO 0.00 0.00 0.00 -0.03 -2.14 0.00 0.00 176.83 174.66 1r0b h MET 219 N 3.07 0.33 0.00 7.34 -1.53 -1.36 -1.74 114.93 121.04 1r0b h MET 219 Ca 0.00 -0.02 0.00 0.00 -3.44 0.00 0.00 59.70 56.24 1r0b h MET 219 Cb 0.70 -0.08 0.00 0.00 -0.55 0.00 0.00 31.60 31.68 1r0b h MET 219 CO 0.00 0.22 0.00 0.00 0.14 0.00 0.00 176.91 177.27 1r0b h ALA 220 N 1.62 1.00 0.00 0.39 0.00 -1.83 -3.35 119.26 117.09 1r0b h ALA 220 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.35 1r0b h ALA 220 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1r0b h ALA 220 CO -0.14 0.00 0.00 -0.85 0.00 0.00 0.00 179.25 178.26 1r0b n GLU 221 N -2.52 1.42 -3.19 0.00 0.28 -0.72 -4.32 120.64 111.58 1r0b n GLU 221 Ca 0.05 -0.34 -0.38 0.00 -0.16 0.00 0.00 57.16 56.32 1r0b n GLU 221 Cb 0.43 -0.84 -0.06 0.00 1.43 0.00 0.00 31.44 32.40 1r0b n GLU 221 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 1r0b s VAL 222 N -0.30 4.64 -0.13 3.84 -7.23 -0.81 -4.67 120.40 115.74 1r0b s VAL 222 Ca 0.00 1.32 0.01 0.00 -1.81 0.00 0.00 61.98 61.51 1r0b s VAL 222 Cb 0.00 -3.95 -0.24 0.00 0.56 0.00 0.00 36.38 32.75 1r0b s VAL 222 CO 0.00 0.50 0.32 0.47 -0.31 0.00 0.00 175.10 176.08 1r0b n ASP 223 N 1.55 1.63 -3.90 4.85 8.00 0.91 -4.58 116.55 125.01 1r0b n ASP 223 Ca -0.08 0.18 -0.29 0.00 0.71 0.00 0.00 54.79 55.31 1r0b n ASP 223 Cb 0.50 -0.45 -0.16 0.00 -0.02 0.00 0.00 41.12 41.00 1r0b n ASP 223 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1r0b s ILE 224 N -2.56 1.24 -0.66 0.53 -1.09 -1.07 -2.40 121.20 115.19 1r0b s ILE 224 Ca -0.19 -0.85 -0.19 0.00 -2.23 0.00 0.00 60.65 57.19 1r0b s ILE 224 Cb 0.07 -1.47 0.12 0.00 -1.58 0.00 0.00 42.46 39.60 1r0b s ILE 224 CO 0.76 0.03 0.78 -0.22 -1.23 0.00 0.00 174.94 175.06 1r0b s LEU 225 N 1.55 5.42 -0.93 2.97 2.96 -0.92 -1.17 118.68 128.57 1r0b s LEU 225 Ca -0.02 -1.61 -0.20 0.00 -0.22 0.00 0.00 54.13 52.08 1r0b s LEU 225 Cb -0.17 -2.31 0.11 0.00 0.50 0.00 0.00 46.19 44.32 1r0b s LEU 225 CO -0.07 -1.08 1.18 -0.47 -1.32 0.00 0.00 176.35 174.59 1r0b s TYR 226 N 2.52 2.96 0.56 5.38 5.04 0.15 -0.39 117.35 133.57 1r0b s TYR 226 Ca 0.15 -1.20 -0.16 0.00 -2.44 0.00 0.00 57.07 53.42 1r0b s TYR 226 Cb -0.20 -4.37 -0.05 0.00 0.35 0.00 0.00 41.96 37.69 1r0b s TYR 226 CO 0.03 -1.60 1.03 -1.64 -1.34 0.00 0.00 175.55 172.03 1r0b s MET 227 N 3.29 3.56 0.07 4.97 -1.94 0.11 -2.14 119.30 127.22 1r0b s MET 227 Ca 0.35 1.15 -0.07 0.00 -1.71 0.00 0.00 55.69 55.40 1r0b s MET 227 Cb -0.05 -2.07 -0.01 0.00 2.01 0.00 0.00 34.83 34.71 1r0b s MET 227 CO -0.08 -0.61 0.13 0.95 -0.01 0.00 0.00 175.02 175.40 1r0b s THR 228 N -2.46 0.16 0.10 2.05 -4.23 -1.07 -4.20 115.64 106.00 1r0b s THR 228 Ca 0.63 -1.30 -0.06 0.00 -1.18 0.00 0.00 61.69 59.78 1r0b s THR 228 Cb -0.14 -1.33 -0.05 0.00 1.34 0.00 0.00 72.50 72.32 1r0b s THR 228 CO 0.33 -0.72 0.34 -0.60 -0.54 0.00 0.00 174.62 173.44 1r0b s ARG 229 N -3.72 3.62 -0.28 3.99 3.52 -1.26 -4.53 118.95 120.28 1r0b s ARG 229 Ca 0.04 -0.07 -0.29 0.00 -0.13 0.00 0.00 55.73 55.28 1r0b s ARG 229 Cb 0.05 -2.94 0.00 0.00 -1.56 0.00 0.00 34.95 30.50 1r0b s ARG 229 CO -0.10 0.53 1.23 0.08 -0.81 0.00 0.00 175.30 176.23 1r0b s VAL 230 N -1.53 4.27 -0.12 7.11 1.01 -1.26 -4.40 120.40 125.48 1r0b s VAL 230 Ca 0.36 1.46 -0.01 0.00 0.00 0.00 0.00 61.98 63.79 1r0b s VAL 230 Cb -0.13 -4.20 -0.01 0.00 0.00 0.00 0.00 36.38 32.03 1r0b s VAL 230 CO 0.22 -0.42 1.15 0.00 0.00 0.00 0.00 175.10 176.05 1r0b n GLN 231 N 7.08 0.27 -0.19 2.72 1.13 -1.26 -4.74 117.38 122.39 1r0b n GLN 231 Ca 0.14 -0.63 -0.07 0.00 -1.94 0.00 0.00 57.00 54.49 1r0b n GLN 231 Cb 0.46 -2.07 -0.06 0.00 0.11 0.00 0.00 30.24 28.69 1r0b n GLN 231 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 1r0b h LYS 232 N 7.82 -0.08 -1.32 -1.09 3.64 -1.91 -0.17 116.57 123.45 1r0b h LYS 232 Ca 0.07 0.01 0.42 0.00 -1.27 0.00 0.00 60.65 59.87 1r0b h LYS 232 Cb 0.03 0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 31.78 1r0b h LYS 232 CO 1.08 -0.05 0.90 -0.85 -2.27 0.00 0.00 179.45 178.25 1r0b n GLU 233 N -4.33 -0.02 -0.00 1.90 0.28 -1.26 -0.54 120.64 116.67 1r0b n GLU 233 Ca 0.00 0.96 0.08 0.00 -0.16 0.00 0.00 57.16 58.04 1r0b n GLU 233 Cb 0.17 -2.02 -0.12 0.00 1.43 0.00 0.00 31.44 30.91 1r0b n GLU 233 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1r0b n ARG 234 N -4.01 0.97 -1.04 3.44 1.74 -0.16 -5.02 116.66 112.58 1r0b n ARG 234 Ca 0.34 -0.09 -0.34 0.00 -0.77 0.00 0.00 57.85 57.00 1r0b n ARG 234 Cb 1.43 -1.35 0.11 0.00 -1.02 0.00 0.00 32.46 31.63 1r0b n ARG 234 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1r0b n LEU 235 N -1.78 1.96 -4.86 0.55 4.77 0.30 -5.00 117.00 112.95 1r0b n LEU 235 Ca -0.00 0.51 -0.35 0.00 -0.03 0.00 0.00 56.01 56.13 1r0b n LEU 235 Cb 0.36 -1.33 -0.06 0.00 -2.33 0.00 0.00 43.42 40.06 1r0b n LEU 235 CO 0.35 -2.70 -0.19 -0.62 -1.33 0.00 0.00 177.39 172.90 1r0b s ASP 236 N -1.92 6.17 0.21 -1.43 -1.08 -1.26 -4.99 116.67 112.36 1r0b s ASP 236 Ca 0.66 0.34 -0.06 0.00 -0.52 0.00 0.00 52.55 52.97 1r0b s ASP 236 Cb -0.28 -1.92 0.34 0.00 -1.46 0.00 0.00 42.92 39.60 1r0b s ASP 236 CO 0.58 0.33 1.18 -2.65 0.52 0.00 0.00 175.17 175.14 1r0b n PRO 237 N 1.49 -0.07 0.00 4.34 -0.02 -1.26 0.19 135.00 139.67 1r0b n PRO 237 Ca -0.15 1.18 0.01 0.00 -2.02 0.00 0.00 63.50 62.52 1r0b n PRO 237 Cb 0.54 -1.76 0.05 0.00 -0.02 0.00 0.00 33.50 32.30 1r0b n PRO 237 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1r0b n SER 238 N -5.23 0.00 0.00 2.55 3.41 -1.26 -1.95 113.62 111.14 1r0b n SER 238 Ca 0.12 -0.70 0.00 0.00 -0.26 0.00 0.00 58.87 58.03 1r0b n SER 238 Cb 0.38 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 1r0b n SER 238 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1r0b n GLU 239 N -0.57 -0.50 0.00 4.33 1.02 0.52 -4.74 120.64 120.70 1r0b n GLU 239 Ca 0.01 -0.43 0.00 0.00 -0.02 0.00 0.00 57.16 56.72 1r0b n GLU 239 Cb 0.01 -0.86 0.00 0.00 -0.02 0.00 0.00 31.44 30.56 1r0b n GLU 239 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1r0b n TYR 240 N -0.03 0.00 0.12 -0.32 4.01 -0.82 -0.47 117.16 119.65 1r0b n TYR 240 Ca 0.00 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.72 1r0b n TYR 240 Cb 0.09 -0.35 0.19 0.00 -0.31 0.00 0.00 39.34 38.95 1r0b n TYR 240 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1r0b h ALA 241 N 1.68 1.01 -0.36 -0.72 0.00 -1.85 -2.87 119.26 116.15 1r0b h ALA 241 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1r0b h ALA 241 Cb 0.13 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1r0b h ALA 241 CO 0.00 0.69 0.00 0.09 0.00 0.00 0.00 179.25 180.03 1r0b n ASN 242 N -3.89 2.04 -0.28 0.00 3.02 0.38 -4.47 115.26 112.07 1r0b n ASN 242 Ca -0.02 -2.04 0.04 0.00 -0.03 0.00 0.00 54.58 52.54 1r0b n ASN 242 Cb 0.57 -0.27 0.18 0.00 -0.61 0.00 0.00 39.78 39.65 1r0b n ASN 242 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 1r0b h VAL 243 N 2.10 0.83 -3.70 2.41 3.04 -1.63 -3.42 116.25 115.88 1r0b h VAL 243 Ca 0.00 -0.23 -0.50 0.00 -1.01 0.00 0.00 66.70 64.96 1r0b h VAL 243 Cb 0.54 0.10 -0.03 0.00 -2.01 0.00 0.00 31.29 29.89 1r0b h VAL 243 CO 0.02 0.12 0.19 -0.54 -1.01 0.00 0.00 177.57 176.35 1r0b s LYS 244 N -6.02 4.33 0.05 4.17 1.02 -1.26 -4.88 119.74 117.14 1r0b s LYS 244 Ca -0.12 1.00 -0.32 0.00 0.02 0.00 0.00 55.97 56.55 1r0b s LYS 244 Cb 0.20 -2.78 -0.10 0.00 -0.52 0.00 0.00 37.83 34.62 1r0b s LYS 244 CO 0.77 0.32 1.89 0.00 -0.92 0.00 0.00 175.35 177.41 1r0b n ALA 245 N 0.51 1.65 0.11 5.17 0.00 -1.26 -4.86 120.51 121.82 1r0b n ALA 245 Ca -0.00 0.28 0.02 0.00 0.00 0.00 0.00 53.44 53.74 1r0b n ALA 245 Cb 0.51 -2.60 0.00 0.00 0.00 0.00 0.00 19.45 17.37 1r0b n ALA 245 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1r0b h GLN 246 N 9.33 0.00 -5.82 0.00 4.15 -1.93 -3.45 115.11 117.38 1r0b h GLN 246 Ca -0.48 0.00 -0.67 0.00 0.77 0.00 0.00 58.65 58.26 1r0b h GLN 246 Cb 1.24 0.00 -0.25 0.00 0.21 0.00 0.00 27.48 28.68 1r0b h GLN 246 CO 0.94 0.42 -0.77 -0.06 -1.93 0.00 0.00 178.83 177.43 1r0b s PHE 247 N -2.97 2.74 -0.05 3.99 0.08 -1.26 -5.12 117.98 115.39 1r0b s PHE 247 Ca 0.02 -0.42 0.03 0.00 0.12 0.00 0.00 56.93 56.68 1r0b s PHE 247 Cb 0.08 -1.73 0.00 0.00 -0.57 0.00 0.00 43.02 40.80 1r0b s PHE 247 CO 0.76 -0.02 -0.13 0.08 -0.10 0.00 0.00 175.22 175.80 1r0b s VAL 248 N -0.18 1.16 -0.21 -0.44 1.01 -1.26 -4.54 120.40 115.94 1r0b s VAL 248 Ca -0.00 -0.54 -0.06 0.00 0.00 0.00 0.00 61.98 61.38 1r0b s VAL 248 Cb -0.13 -1.03 -0.02 0.00 0.00 0.00 0.00 36.38 35.20 1r0b s VAL 248 CO 0.03 0.35 0.01 -0.22 0.00 0.00 0.00 175.10 175.28 1r0b s LEU 249 N 0.31 3.30 0.15 3.92 2.96 0.86 -5.00 118.68 125.18 1r0b s LEU 249 Ca -0.08 -0.20 0.11 0.00 -0.22 0.00 0.00 54.13 53.74 1r0b s LEU 249 Cb -0.12 -1.85 -0.04 0.00 0.50 0.00 0.00 46.19 44.68 1r0b s LEU 249 CO 0.02 0.05 -0.26 -0.13 -1.32 0.00 0.00 176.35 174.71 1r0b s ARG 250 N 1.12 1.44 0.59 1.98 0.52 -1.26 -1.80 118.95 121.53 1r0b s ARG 250 Ca 0.03 -1.40 0.30 0.00 -0.52 0.00 0.00 55.73 54.14 1r0b s ARG 250 Cb -0.14 -1.89 1.35 0.00 0.52 0.00 0.00 34.95 34.79 1r0b s ARG 250 CO 0.02 0.44 1.71 0.00 0.02 0.00 0.00 175.30 177.48 1r0b h ALA 251 N 3.68 2.57 0.00 2.13 0.00 -1.89 0.99 119.26 126.74 1r0b h ALA 251 Ca -0.50 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.24 1r0b h ALA 251 Cb 1.18 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 1r0b h ALA 251 CO 0.42 -1.15 -0.70 0.66 0.00 0.00 0.00 179.25 178.47 1r0b h SER 252 N 0.00 0.00 0.35 0.00 4.64 -1.96 -3.20 113.55 113.38 1r0b h SER 252 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 1r0b h SER 252 Cb 1.89 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.98 1r0b h SER 252 CO -0.00 0.70 0.00 0.47 -0.87 0.00 0.00 176.83 177.13 1r0b n ASP 253 N -3.68 0.00 -1.36 4.97 9.92 0.34 -2.59 116.55 124.15 1r0b n ASP 253 Ca -0.01 0.39 0.09 0.00 -0.53 0.00 0.00 54.79 54.73 1r0b n ASP 253 Cb 0.69 -0.44 0.32 0.00 -0.64 0.00 0.00 41.12 41.05 1r0b n ASP 253 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1r0b n LEU 254 N -1.44 4.32 -0.31 0.64 4.77 -1.21 -4.62 117.00 119.16 1r0b n LEU 254 Ca 0.04 -2.37 0.11 0.00 -0.03 0.00 0.00 56.01 53.75 1r0b n LEU 254 Cb 0.12 -0.51 0.34 0.00 -2.33 0.00 0.00 43.42 41.04 1r0b n LEU 254 CO 0.10 0.82 1.22 1.12 -1.33 0.00 0.00 177.39 179.32 1r0b h HIS 255 N 3.62 0.93 -1.40 -1.77 2.07 -1.70 -2.91 115.15 114.00 1r0b h HIS 255 Ca 0.00 0.03 -0.59 0.00 -2.85 0.00 0.00 60.37 56.96 1r0b h HIS 255 Cb 1.29 -0.29 -0.42 0.00 2.57 0.00 0.00 27.41 30.56 1r0b h HIS 255 CO 0.63 0.33 -0.70 0.27 -3.07 0.00 0.00 177.93 175.39 1r0b n ASN 256 N -4.60 4.82 -4.78 3.10 6.94 -1.26 -5.05 115.26 114.43 1r0b n ASN 256 Ca 0.19 -3.73 -0.31 0.00 -0.02 0.00 0.00 54.58 50.71 1r0b n ASN 256 Cb 0.46 -0.46 -0.06 0.00 -2.36 0.00 0.00 39.78 37.36 1r0b n ASN 256 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1r0b s ALA 257 N -3.56 3.59 0.88 -2.53 0.00 -1.10 -3.71 121.76 115.33 1r0b s ALA 257 Ca 0.49 -1.00 -0.14 0.00 0.00 0.00 0.00 51.96 51.31 1r0b s ALA 257 Cb 0.40 -1.46 0.02 0.00 0.00 0.00 0.00 23.12 22.08 1r0b s ALA 257 CO -0.16 0.75 0.50 1.63 0.00 0.00 0.00 175.76 178.49 1r0b n LYS 258 N 0.47 -0.11 0.01 0.00 5.02 -1.26 -4.93 118.16 117.35 1r0b n LYS 258 Ca -0.08 0.02 -0.17 0.00 -2.02 0.00 0.00 58.31 56.05 1r0b n LYS 258 Cb 0.52 -1.90 -0.12 0.00 -0.02 0.00 0.00 35.03 33.51 1r0b n LYS 258 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1r0b h ALA 259 N -1.22 0.04 0.00 7.82 0.00 -1.97 -3.21 119.26 120.71 1r0b h ALA 259 Ca -0.44 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 53.89 1r0b h ALA 259 Cb 1.30 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1r0b h ALA 259 CO 0.37 0.31 0.00 0.27 0.00 0.00 0.00 179.25 180.20 1r0b n ASN 260 N -4.25 0.18 -4.86 0.00 6.94 -1.26 -4.81 115.26 107.20 1r0b n ASN 260 Ca -0.11 -0.90 -0.32 0.00 -0.02 0.00 0.00 54.58 53.23 1r0b n ASN 260 Cb 0.67 -0.09 -0.05 0.00 -2.36 0.00 0.00 39.78 37.95 1r0b n ASN 260 CO 0.00 0.00 0.00 -0.32 -1.03 0.00 0.00 177.26 175.91 1r0b s MET 261 N -1.60 3.90 0.02 -3.83 1.75 -1.21 -4.80 119.30 113.53 1r0b s MET 261 Ca 0.00 0.57 0.00 0.00 -1.25 0.00 0.00 55.69 55.02 1r0b s MET 261 Cb 0.00 -2.42 -0.02 0.00 2.84 0.00 0.00 34.83 35.23 1r0b s MET 261 CO 0.00 0.08 -0.04 0.15 -0.65 0.00 0.00 175.02 174.56 1r0b s LYS 262 N -3.33 0.34 -0.25 4.11 -0.14 -1.01 -4.56 119.74 114.91 1r0b s LYS 262 Ca 0.53 -0.62 -0.07 0.00 -1.36 0.00 0.00 55.97 54.45 1r0b s LYS 262 Cb -0.10 0.03 -0.02 0.00 -1.68 0.00 0.00 37.83 36.05 1r0b s LYS 262 CO 0.23 -0.03 0.05 0.08 -0.76 0.00 0.00 175.35 174.92 1r0b s VAL 263 N -1.40 4.11 0.24 3.17 1.01 0.24 -2.15 120.40 125.61 1r0b s VAL 263 Ca -0.14 -0.26 0.06 0.00 0.00 0.00 0.00 61.98 61.64 1r0b s VAL 263 Cb -0.10 -2.92 -0.04 0.00 0.00 0.00 0.00 36.38 33.33 1r0b s VAL 263 CO -0.01 0.35 0.21 -0.76 0.00 0.00 0.00 175.10 174.89 1r0b s LEU 264 N 1.58 3.90 -0.30 3.92 1.43 0.48 -2.45 118.68 127.24 1r0b s LEU 264 Ca 0.06 -0.18 -0.18 0.00 -1.03 0.00 0.00 54.13 52.80 1r0b s LEU 264 Cb -0.15 -2.44 0.19 0.00 0.03 0.00 0.00 46.19 43.82 1r0b s LEU 264 CO 0.02 -0.03 1.20 -2.28 0.23 0.00 0.00 176.35 175.50 1r0b s HIS 265 N -2.05 -0.25 0.69 0.29 2.46 -1.26 0.07 115.29 115.24 1r0b s HIS 265 Ca 0.33 0.43 -0.16 0.00 0.47 0.00 0.00 55.06 56.13 1r0b s HIS 265 Cb -0.08 0.15 0.01 0.00 -0.13 0.00 0.00 32.58 32.53 1r0b s HIS 265 CO 0.25 -0.12 1.21 -2.14 -2.47 0.00 0.00 174.74 171.48 1r0b s PRO 266 N 2.07 2.40 0.46 2.88 0.02 -1.26 -4.79 135.00 136.79 1r0b s PRO 266 Ca -0.01 1.80 0.26 0.00 0.02 0.00 0.00 61.00 63.06 1r0b s PRO 266 Cb -0.02 -1.86 0.99 0.00 0.02 0.00 0.00 34.50 33.62 1r0b s PRO 266 CO -0.16 -1.64 1.85 -0.07 -0.33 0.00 0.00 177.00 176.64 1r0b h LEU 267 N 0.08 0.00 -8.74 -5.54 3.38 -1.97 -3.43 115.31 99.09 1r0b h LEU 267 Ca -0.49 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 56.95 1r0b h LEU 267 Cb 1.30 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.03 1r0b h LEU 267 CO 0.51 0.17 1.42 -2.84 0.09 0.00 0.00 178.44 177.80 1r0b s PRO 268 N -3.64 2.84 0.16 1.13 0.02 -1.26 -4.88 135.00 129.37 1r0b s PRO 268 Ca 0.01 1.35 0.08 0.00 0.02 0.00 0.00 61.00 62.46 1r0b s PRO 268 Cb 0.10 -4.37 -0.04 0.00 0.02 0.00 0.00 34.50 30.21 1r0b s PRO 268 CO 0.62 -2.44 -0.05 -0.98 -0.33 0.00 0.00 177.00 173.82 1r0b s ARG 269 N 6.72 2.25 -0.45 5.54 1.70 -1.26 -4.49 118.95 128.96 1r0b s ARG 269 Ca 0.85 -1.12 0.06 0.00 -0.47 0.00 0.00 55.73 55.05 1r0b s ARG 269 Cb -0.21 -2.30 0.19 0.00 -0.57 0.00 0.00 34.95 32.06 1r0b s ARG 269 CO 0.29 0.47 0.56 0.28 -1.08 0.00 0.00 175.30 175.81 1r0b n VAL 270 N 0.15 -0.60 -1.20 4.99 0.31 -1.26 -4.92 118.33 115.78 1r0b n VAL 270 Ca -0.11 -2.45 -0.07 0.00 -0.01 0.00 0.00 64.34 61.70 1r0b n VAL 270 Cb 0.54 -0.43 -0.03 0.00 -0.91 0.00 0.00 33.84 33.01 1r0b n VAL 270 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1r0b n ASP 271 N 2.56 -4.26 0.07 4.52 -0.08 -1.26 -4.72 116.55 113.39 1r0b n ASP 271 Ca 0.22 0.17 -0.00 0.00 -1.51 0.00 0.00 54.79 53.68 1r0b n ASP 271 Cb 0.53 -2.38 -0.05 0.00 2.34 0.00 0.00 41.12 41.56 1r0b n ASP 271 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1r0b h GLU 272 N 0.15 0.00 -3.35 -0.67 3.07 -1.92 -3.42 114.58 108.44 1r0b h GLU 272 Ca -0.14 0.00 -0.55 0.00 -0.50 0.00 0.00 59.36 58.17 1r0b h GLU 272 Cb 0.60 0.00 -0.40 0.00 -0.84 0.00 0.00 28.75 28.11 1r0b h GLU 272 CO 0.21 0.46 -0.76 0.42 -1.40 0.00 0.00 179.01 177.94 1r0b s ILE 273 N -2.90 0.52 0.42 3.13 1.01 -1.26 -0.10 121.20 122.03 1r0b s ILE 273 Ca 0.00 -0.96 -0.24 0.00 0.00 0.00 0.00 60.65 59.44 1r0b s ILE 273 Cb 0.08 -1.29 -0.10 0.00 0.01 0.00 0.00 42.46 41.16 1r0b s ILE 273 CO 0.79 -0.54 1.01 0.00 0.00 0.00 0.00 174.94 176.20 1r0b n ALA 274 N 5.02 0.21 0.33 9.38 0.00 -0.74 -4.84 120.51 129.85 1r0b n ALA 274 Ca -0.05 0.23 0.20 0.00 0.00 0.00 0.00 53.44 53.81 1r0b n ALA 274 Cb 0.44 -2.09 1.06 0.00 0.00 0.00 0.00 19.45 18.87 1r0b n ALA 274 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1r0b h THR 275 N 1.53 0.07 0.00 0.00 1.35 -1.99 -2.16 112.91 111.71 1r0b h THR 275 Ca -0.45 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 1r0b h THR 275 Cb 1.34 0.89 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 1r0b h THR 275 CO 0.57 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 174.94 1r0b n ASP 276 N -3.13 0.48 0.19 5.36 5.68 -1.26 -2.70 116.55 121.17 1r0b n ASP 276 Ca -0.02 0.64 0.13 0.00 -0.50 0.00 0.00 54.79 55.03 1r0b n ASP 276 Cb 0.18 -0.73 0.26 0.00 -1.14 0.00 0.00 41.12 39.69 1r0b n ASP 276 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 1r0b h VAL 277 N 0.00 0.00 -0.16 2.12 2.07 -1.73 -3.21 116.25 115.34 1r0b h VAL 277 Ca 0.00 -0.82 -0.03 0.00 0.82 0.00 0.00 66.70 66.67 1r0b h VAL 277 Cb 0.26 1.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.84 1r0b h VAL 277 CO 0.00 0.00 -0.05 0.44 0.02 0.00 0.00 177.57 177.98 1r0b h ASP 278 N 0.00 0.22 0.71 0.57 5.19 -1.73 -1.55 116.42 119.82 1r0b h ASP 278 Ca 0.00 -0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 1r0b h ASP 278 Cb 0.90 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 40.35 1r0b h ASP 278 CO 0.00 0.31 0.00 1.17 -3.12 0.00 0.00 179.24 177.60 1r0b n LYS 279 N -4.35 0.12 -3.20 3.56 4.81 -1.21 -4.79 118.16 113.11 1r0b n LYS 279 Ca -0.01 0.33 -0.33 0.00 -0.87 0.00 0.00 58.31 57.44 1r0b n LYS 279 Cb 0.21 -1.72 -0.06 0.00 0.02 0.00 0.00 35.03 33.48 1r0b n LYS 279 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 1r0b s THR 280 N -3.18 4.73 0.49 3.15 -4.23 -0.58 -4.96 115.64 111.05 1r0b s THR 280 Ca 0.06 0.89 0.41 0.00 -1.18 0.00 0.00 61.69 61.87 1r0b s THR 280 Cb 0.10 -3.65 0.43 0.00 1.34 0.00 0.00 72.50 70.72 1r0b s THR 280 CO 0.37 -0.09 2.26 -0.65 -0.54 0.00 0.00 174.62 175.96 1r0b h PRO 281 N 2.53 0.00 0.00 3.99 0.11 -1.87 -2.12 132.00 134.64 1r0b h PRO 281 Ca -0.48 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 1r0b h PRO 281 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1r0b h PRO 281 CO 0.66 0.00 -0.10 0.45 -0.21 0.00 0.00 178.00 178.80 1r0b h HIS 282 N 0.00 0.00 -2.81 0.65 3.86 -1.89 -3.45 115.15 111.51 1r0b h HIS 282 Ca -0.00 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.68 1r0b h HIS 282 Cb 0.16 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.65 1r0b h HIS 282 CO 0.00 0.10 0.90 0.00 0.86 0.00 0.00 177.93 179.78 1r0b s ALA 283 N -3.17 3.65 0.00 2.45 0.00 -0.80 0.82 121.76 124.70 1r0b s ALA 283 Ca 0.06 1.12 0.00 0.00 0.00 0.00 0.00 51.96 53.14 1r0b s ALA 283 Cb 0.06 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.54 1r0b s ALA 283 CO 0.68 -0.94 0.60 1.87 0.00 0.00 0.00 175.76 177.98 1r0b n TRP 284 N 5.10 0.00 0.17 0.00 -0.00 -1.03 -4.82 117.44 116.87 1r0b n TRP 284 Ca 0.14 0.00 0.04 0.00 -0.00 0.00 0.00 57.50 57.68 1r0b n TRP 284 Cb 0.41 0.05 0.27 0.00 -0.00 0.00 0.00 31.31 32.05 1r0b n TRP 284 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 177.69 177.79 1r0b h TYR 285 N 0.00 0.00 0.14 5.87 -0.00 -1.82 -1.88 116.97 119.28 1r0b h TYR 285 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 58.73 58.40 1r0b h TYR 285 Cb 1.14 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.87 1r0b h TYR 285 CO -0.02 0.45 -1.70 0.74 -0.00 0.00 0.00 178.16 177.63 1r0b h PHE 286 N 0.00 0.54 0.00 0.10 0.04 -1.91 -2.90 116.94 112.81 1r0b h PHE 286 Ca -0.00 -0.40 -0.04 0.00 2.80 0.00 0.00 57.97 60.33 1r0b h PHE 286 Cb 0.99 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 39.12 1r0b h PHE 286 CO 0.00 1.54 -0.20 1.96 -0.60 0.00 0.00 178.31 181.01 1r0b h GLN 287 N 0.08 0.00 0.12 1.51 7.50 -1.92 -2.25 115.11 120.16 1r0b h GLN 287 Ca -0.31 0.00 -0.27 0.00 0.50 0.00 0.00 58.65 58.56 1r0b h GLN 287 Cb 2.06 0.00 0.00 0.00 0.05 0.00 0.00 27.48 29.59 1r0b h GLN 287 CO 0.15 0.20 -1.24 -0.56 -1.50 0.00 0.00 178.83 175.88 1r0b h GLN 288 N 0.00 0.26 -0.37 1.46 3.07 -1.41 -3.19 115.11 114.94 1r0b h GLN 288 Ca -0.00 -0.45 -0.04 0.00 0.09 0.00 0.00 58.65 58.25 1r0b h GLN 288 Cb 0.57 0.17 -0.02 0.00 0.08 0.00 0.00 27.48 28.28 1r0b h GLN 288 CO 0.03 1.21 0.06 0.00 0.09 0.00 0.00 178.83 180.22 1r0b h ALA 289 N 0.59 1.43 -0.14 0.06 0.00 -1.23 -2.19 119.26 117.78 1r0b h ALA 289 Ca -0.13 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 1r0b h ALA 289 Cb 1.97 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 1r0b h ALA 289 CO 0.20 0.41 -0.28 0.78 0.00 0.00 0.00 179.25 180.36 1r0b h GLY 290 N 0.79 0.28 1.36 0.00 0.00 -1.41 -1.61 103.07 102.49 1r0b h GLY 290 Ca 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1r0b h GLY 290 CO 0.00 0.20 0.00 0.70 0.00 0.00 0.00 176.54 177.44 1r0b n ASN 291 N -4.13 0.00 0.02 0.19 5.03 -0.83 -2.02 115.26 113.52 1r0b n ASN 291 Ca -0.01 -0.05 -0.01 0.00 0.87 0.00 0.00 54.58 55.38 1r0b n ASN 291 Cb 0.39 -0.18 0.27 0.00 -1.02 0.00 0.00 39.78 39.24 1r0b n ASN 291 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 1r0b h GLY 292 N 1.77 0.49 0.97 7.41 0.00 -1.34 -0.20 103.07 112.17 1r0b h GLY 292 Ca 0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 1r0b h GLY 292 CO 0.00 0.31 0.21 -2.22 0.00 0.00 0.00 176.54 174.85 1r0b h ILE 293 N 0.43 1.14 -0.08 2.60 1.08 -1.61 -0.50 117.51 120.56 1r0b h ILE 293 Ca 0.08 -0.35 -0.06 0.00 -0.39 0.00 0.00 64.86 64.13 1r0b h ILE 293 Cb 0.48 0.69 0.00 0.00 -3.07 0.00 0.00 36.82 34.92 1r0b h ILE 293 CO 0.03 0.14 -0.20 -0.26 -0.69 0.00 0.00 178.15 177.17 1r0b h PHE 294 N 0.49 0.36 -0.38 1.37 0.04 -1.64 -0.20 116.94 116.98 1r0b h PHE 294 Ca 0.13 -0.14 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 1r0b h PHE 294 Cb 0.04 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.11 1r0b h PHE 294 CO -0.03 0.81 0.15 0.00 -0.60 0.00 0.00 178.31 178.64 1r0b h ALA 295 N 0.49 0.49 -0.04 2.45 0.00 -1.04 -1.32 119.26 120.28 1r0b h ALA 295 Ca -0.00 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.62 1r0b h ALA 295 Cb 0.80 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1r0b h ALA 295 CO 0.04 0.09 -0.68 0.00 0.00 0.00 0.00 179.25 178.70 1r0b h ARG 296 N 0.46 0.21 -0.42 0.00 3.08 -1.16 -1.93 114.38 114.62 1r0b h ARG 296 Ca 0.13 -0.16 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 1r0b h ARG 296 Cb 0.19 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 1r0b h ARG 296 CO -0.01 0.81 0.16 0.37 -1.07 0.00 0.00 179.97 180.23 1r0b h GLN 297 N 0.14 0.64 -0.50 0.04 4.15 -0.88 -1.53 115.11 117.17 1r0b h GLN 297 Ca -0.02 -0.12 -0.02 0.00 0.77 0.00 0.00 58.65 59.26 1r0b h GLN 297 Cb 1.22 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.79 1r0b h GLN 297 CO 0.10 0.60 0.23 0.00 -1.93 0.00 0.00 178.83 177.83 1r0b h ALA 298 N 1.00 0.65 -0.34 3.38 0.00 -1.09 -0.34 119.26 122.52 1r0b h ALA 298 Ca 0.14 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1r0b h ALA 298 Cb 0.21 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1r0b h ALA 298 CO -0.01 0.23 0.15 1.25 0.00 0.00 0.00 179.25 180.87 1r0b h LEU 299 N 0.66 0.46 0.49 0.00 5.85 -1.22 0.90 115.31 122.45 1r0b h LEU 299 Ca 0.17 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 1r0b h LEU 299 Cb 0.15 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 1r0b h LEU 299 CO -0.02 0.48 -0.46 -0.07 -0.34 0.00 0.00 178.44 178.04 1r0b h LEU 300 N 0.41 -1.25 -0.86 2.25 3.38 -1.01 -1.23 115.31 117.01 1r0b h LEU 300 Ca 0.12 0.10 0.22 0.00 0.09 0.00 0.00 57.88 58.40 1r0b h LEU 300 Cb 0.15 0.41 -0.14 0.00 0.09 0.00 0.00 40.66 41.17 1r0b h LEU 300 CO -0.01 -0.62 0.22 0.00 0.09 0.00 0.00 178.44 178.11 1r0b h ALA 301 N -1.02 1.21 -0.65 1.53 0.00 -0.89 -0.30 119.26 119.14 1r0b h ALA 301 Ca -0.06 0.22 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1r0b h ALA 301 Cb 0.81 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 1r0b h ALA 301 CO -0.04 -0.44 0.16 -0.07 0.00 0.00 0.00 179.25 178.86 1r0b h LEU 302 N 0.21 0.95 0.00 0.00 3.38 -0.26 -2.74 115.31 116.86 1r0b h LEU 302 Ca 0.53 -0.19 -0.12 0.00 0.09 0.00 0.00 57.88 58.19 1r0b h LEU 302 Cb 1.04 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 1r0b h LEU 302 CO -0.64 0.91 -0.67 0.58 0.09 0.00 0.00 178.44 178.72 1r0b h VAL 303 N 0.97 0.89 -0.24 1.22 2.07 0.13 -3.28 116.25 118.00 1r0b h VAL 303 Ca 0.21 -2.29 0.00 0.00 0.82 0.00 0.00 66.70 65.43 1r0b h VAL 303 Cb 0.33 2.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.51 1r0b h VAL 303 CO -0.00 0.51 0.00 0.18 0.02 0.00 0.00 177.57 178.28 1r0b n LEU 304 N -3.19 2.71 -4.06 2.57 4.77 -0.96 -0.56 117.00 118.27 1r0b n LEU 304 Ca 0.00 -1.52 -0.32 0.00 -0.03 0.00 0.00 56.01 54.15 1r0b n LEU 304 Cb 0.77 -0.15 -0.15 0.00 -2.33 0.00 0.00 43.42 41.55 1r0b n LEU 304 CO 0.41 0.61 -0.41 0.21 -1.33 0.00 0.00 177.39 176.88 1r0b s ASN 305 N -1.09 4.59 0.14 -1.43 3.84 -1.03 -4.96 114.94 114.99 1r0b s ASN 305 Ca 0.23 -1.64 -0.18 0.00 0.21 0.00 0.00 52.86 51.48 1r0b s ASN 305 Cb 0.14 -1.59 0.00 0.00 -0.55 0.00 0.00 41.25 39.25 1r0b s ASN 305 CO 0.19 -0.26 1.74 -0.09 -2.79 0.00 0.00 177.10 175.89 1r0b h ARG 306 N 7.74 0.19 -7.20 0.43 2.43 -1.88 -3.42 114.38 112.66 1r0b h ARG 306 Ca -0.14 -0.01 -0.53 0.00 -0.81 0.00 0.00 59.98 58.48 1r0b h ARG 306 Cb 1.04 -0.04 0.17 0.00 -0.42 0.00 0.00 29.97 30.72 1r0b h ARG 306 CO 0.49 0.12 0.35 -0.51 -1.51 0.00 0.00 179.97 178.91 1r0b s ASP 307 N -5.32 3.72 -0.72 -3.80 1.01 -1.26 -2.64 116.67 107.66 1r0b s ASP 307 Ca -0.13 2.34 -0.13 0.00 0.71 0.00 0.00 52.55 55.34 1r0b s ASP 307 Cb 0.10 -2.59 0.19 0.00 1.01 0.00 0.00 42.92 41.64 1r0b s ASP 307 CO 0.70 -2.58 0.65 -0.22 0.21 0.00 0.00 175.17 173.93 1r0b s LEU 308 N -5.62 6.41 0.20 1.23 2.96 -1.26 -4.75 118.68 117.83 1r0b s LEU 308 Ca 0.73 -2.48 -0.11 0.00 -0.22 0.00 0.00 54.13 52.05 1r0b s LEU 308 Cb -0.28 -2.16 -0.08 0.00 0.50 0.00 0.00 46.19 44.17 1r0b s LEU 308 CO 0.50 -0.61 0.05 0.55 -1.32 0.00 0.00 176.35 175.52 1r0b n VAL 309 N 4.23 0.35 -0.89 1.68 3.14 -1.26 -5.14 118.33 120.44 1r0b n VAL 309 Ca 0.06 -0.25 0.00 0.00 -2.96 0.00 0.00 64.34 61.19 1r0b n VAL 309 Cb 0.44 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.22 1r0b n VAL 309 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55