#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fer n TRP 24 N 0.00 0.11 -0.01 0.54 2.14 -1.26 -2.51 117.44 116.45 3fer n TRP 24 Ca 0.00 0.35 -0.02 0.00 2.07 0.00 0.00 57.50 59.90 3fer n TRP 24 Cb 0.00 -0.67 -0.01 0.00 -0.81 0.00 0.00 31.31 29.81 3fer n TRP 24 CO 0.00 0.00 0.00 1.17 2.07 0.00 0.00 177.69 180.93 3fer n LYS 25 N -4.44 1.24 0.00 -2.67 4.81 -1.26 -4.56 118.16 111.28 3fer n LYS 25 Ca 0.05 0.01 0.00 0.00 -0.87 0.00 0.00 58.31 57.50 3fer n LYS 25 Cb 0.15 -1.06 0.00 0.00 0.02 0.00 0.00 35.03 34.15 3fer n LYS 25 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 3fer n LYS 26 N -2.42 0.28 0.10 1.64 2.85 -1.11 -1.32 118.16 118.19 3fer n LYS 26 Ca -0.05 0.00 -0.05 0.00 -1.05 0.00 0.00 58.31 57.17 3fer n LYS 26 Cb 0.56 -1.07 0.05 0.00 -0.65 0.00 0.00 35.03 33.92 3fer n LYS 26 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 177.40 178.17 3fer h ILE 27 N 0.00 1.53 -0.20 0.58 2.04 -1.75 -2.27 117.51 117.44 3fer h ILE 27 Ca 0.00 -2.59 -0.18 0.00 1.00 0.00 0.00 64.86 63.09 3fer h ILE 27 Cb 0.07 2.40 0.00 0.00 -0.74 0.00 0.00 36.82 38.56 3fer h ILE 27 CO 0.00 0.74 -0.57 -0.61 0.00 0.00 0.00 178.15 177.72 3fer h GLN 28 N 0.03 0.74 -0.48 2.37 4.15 -1.51 -2.02 115.11 118.39 3fer h GLN 28 Ca -0.01 -0.53 -0.10 0.00 0.77 0.00 0.00 58.65 58.77 3fer h GLN 28 Cb 1.37 0.08 -0.02 0.00 0.21 0.00 0.00 27.48 29.13 3fer h GLN 28 CO 0.11 1.15 -0.12 0.37 -1.93 0.00 0.00 178.83 178.41 3fer h GLN 29 N 0.46 0.89 -0.36 1.69 4.15 -1.71 -0.01 115.11 120.22 3fer h GLN 29 Ca -0.01 -0.31 -0.03 0.00 0.77 0.00 0.00 58.65 59.06 3fer h GLN 29 Cb 1.18 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.80 3fer h GLN 29 CO 0.12 0.96 0.10 -0.91 -1.93 0.00 0.00 178.83 177.17 3fer h ASN 30 N 0.80 0.55 -0.09 -0.69 -0.26 -1.38 -2.07 115.58 112.43 3fer h ASN 30 Ca 0.13 -0.22 -0.01 0.00 -0.56 0.00 0.00 56.30 55.63 3fer h ASN 30 Cb 0.64 -0.14 -0.00 0.00 -1.06 0.00 0.00 38.32 37.75 3fer h ASN 30 CO 0.04 0.63 0.01 0.74 -1.06 0.00 0.00 177.43 177.79 3fer h THR 31 N 0.44 1.22 -0.50 2.81 2.02 -1.14 -1.44 112.91 116.33 3fer h THR 31 Ca 0.12 -0.70 0.04 0.00 0.77 0.00 0.00 66.41 66.64 3fer h THR 31 Cb 0.29 1.52 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 3fer h THR 31 CO -0.00 0.20 0.33 -0.26 0.37 0.00 0.00 175.52 176.16 3fer h PHE 32 N -0.10 0.52 -0.07 3.16 -1.00 -1.00 0.39 116.94 118.85 3fer h PHE 32 Ca 0.03 0.01 -0.03 0.00 2.81 0.00 0.00 57.97 60.78 3fer h PHE 32 Cb 0.30 -0.17 -0.00 0.00 3.61 0.00 0.00 35.95 39.69 3fer h PHE 32 CO 0.02 0.30 -0.09 1.15 -1.61 0.00 0.00 178.31 178.08 3fer h THR 33 N 0.53 1.39 -0.90 -1.55 2.02 -1.17 -1.92 112.91 111.31 3fer h THR 33 Ca 0.20 -1.32 0.02 0.00 0.77 0.00 0.00 66.41 66.09 3fer h THR 33 Cb 0.14 2.12 -0.05 0.00 -1.74 0.00 0.00 68.15 68.62 3fer h THR 33 CO -0.05 0.37 0.59 0.03 0.37 0.00 0.00 175.52 176.83 3fer h ARG 34 N -0.28 1.14 -0.19 6.66 3.08 -0.69 0.18 114.38 124.28 3fer h ARG 34 Ca 0.01 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.99 3fer h ARG 34 Cb 0.63 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 3fer h ARG 34 CO 0.02 0.75 0.12 2.35 -1.07 0.00 0.00 179.97 182.14 3fer h TRP 35 N 1.17 0.24 0.22 3.04 7.01 -0.89 0.10 115.95 126.84 3fer h TRP 35 Ca 0.35 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.34 3fer h TRP 35 Cb -0.05 -0.08 0.00 0.00 -2.10 0.00 0.00 29.16 26.93 3fer h TRP 35 CO -0.00 0.17 -0.11 0.00 -2.79 0.00 0.00 178.44 175.71 3fer h ASN 37 N -0.31 0.00 -0.60 0.00 -0.26 -0.84 0.22 115.58 113.80 3fer h ASN 37 Ca -0.03 0.00 -0.07 0.00 -0.56 0.00 0.00 56.30 55.64 3fer h ASN 37 Cb 0.24 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 37.47 3fer h ASN 37 CO 0.05 0.00 0.11 -0.08 -1.06 0.00 0.00 177.43 176.45 3fer h GLU 38 N 0.00 1.01 0.00 0.81 4.57 -0.60 -2.10 114.58 118.27 3fer h GLU 38 Ca -0.00 -0.25 -0.12 0.00 -1.18 0.00 0.00 59.36 57.81 3fer h GLU 38 Cb 0.01 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.45 3fer h GLU 38 CO 0.00 0.93 -0.61 0.45 -1.18 0.00 0.00 179.01 178.60 3fer h HIS 39 N 0.95 0.00 0.00 0.92 3.86 -0.77 -3.31 115.15 116.81 3fer h HIS 39 Ca 0.19 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.40 3fer h HIS 39 Cb 0.40 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.87 3fer h HIS 39 CO 0.03 0.55 -0.26 1.28 0.86 0.00 0.00 177.93 180.39 3fer n LEU 40 N -3.21 0.27 0.26 2.43 4.77 0.60 -3.84 117.00 118.28 3fer n LEU 40 Ca 0.01 0.25 0.16 0.00 -0.03 0.00 0.00 56.01 56.40 3fer n LEU 40 Cb 0.76 -0.37 0.59 0.00 -2.33 0.00 0.00 43.42 42.07 3fer n LEU 40 CO 0.41 0.06 0.95 0.07 -1.33 0.00 0.00 177.39 177.55 3fer h LYS 41 N 0.00 0.00 -0.09 3.23 2.10 -1.48 -1.26 116.57 119.07 3fer h LYS 41 Ca 0.00 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.62 3fer h LYS 41 Cb 0.51 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.83 3fer h LYS 41 CO 0.00 0.03 -0.10 0.00 -2.00 0.00 0.00 179.45 177.37 3fer n VAL 43 N -4.34 2.38 -3.53 0.00 0.24 -1.06 -4.99 118.33 107.03 3fer n VAL 43 Ca -0.01 -2.53 -0.24 0.00 -2.04 0.00 0.00 64.34 59.51 3fer n VAL 43 Cb 0.22 -0.29 0.06 0.00 -1.47 0.00 0.00 33.84 32.37 3fer n VAL 43 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 3fer n ASN 44 N -1.01 -6.13 -4.28 -1.34 5.15 -1.02 -5.01 115.26 101.62 3fer n ASN 44 Ca 0.27 -0.52 -0.16 0.00 -0.60 0.00 0.00 54.58 53.57 3fer n ASN 44 Cb 0.92 -4.85 -0.10 0.00 -0.53 0.00 0.00 39.78 35.22 3fer n ASN 44 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3fer s LYS 45 N -6.24 1.15 -0.17 1.20 1.02 -0.50 -5.02 119.74 111.17 3fer s LYS 45 Ca 0.54 -1.47 -0.25 0.00 0.02 0.00 0.00 55.97 54.81 3fer s LYS 45 Cb -0.25 -0.83 0.06 0.00 -0.52 0.00 0.00 37.83 36.30 3fer s LYS 45 CO 0.67 0.12 0.64 0.50 -0.92 0.00 0.00 175.35 176.37 3fer s ARG 46 N -3.59 0.85 -0.23 1.68 3.52 -1.26 -3.74 118.95 116.19 3fer s ARG 46 Ca 0.18 0.65 -0.11 0.00 -0.13 0.00 0.00 55.73 56.32 3fer s ARG 46 Cb 0.01 0.41 -0.05 0.00 -1.56 0.00 0.00 34.95 33.75 3fer s ARG 46 CO 0.03 -0.17 0.16 0.42 -0.81 0.00 0.00 175.30 174.93 3fer s ILE 47 N -0.22 5.37 -0.18 4.11 1.01 -1.26 -4.99 121.20 125.04 3fer s ILE 47 Ca -0.04 0.20 -0.14 0.00 0.00 0.00 0.00 60.65 60.67 3fer s ILE 47 Cb -0.03 -3.50 -0.08 0.00 0.01 0.00 0.00 42.46 38.85 3fer s ILE 47 CO 0.04 0.37 -0.13 0.61 0.00 0.00 0.00 174.94 175.83 3fer n GLY 48 N 4.08 -0.81 3.15 6.18 0.00 -1.26 -4.89 105.19 111.65 3fer n GLY 48 Ca -0.15 -0.12 -0.33 0.00 0.00 0.00 0.00 46.02 45.42 3fer n GLY 48 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3fer s ASN 49 N -6.22 3.15 0.44 1.61 3.84 -1.26 -5.00 114.94 111.50 3fer s ASN 49 Ca -0.23 -0.62 0.24 0.00 0.21 0.00 0.00 52.86 52.46 3fer s ASN 49 Cb 0.05 -1.47 0.93 0.00 -0.55 0.00 0.00 41.25 40.21 3fer s ASN 49 CO 0.37 0.05 1.83 0.25 -2.79 0.00 0.00 177.10 176.81 3fer h LEU 50 N 7.59 0.00 -0.47 3.21 5.85 -1.94 0.14 115.31 129.69 3fer h LEU 50 Ca -0.38 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.34 3fer h LEU 50 Cb 1.17 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.20 3fer h LEU 50 CO 0.59 0.22 0.00 -0.61 -0.34 0.00 0.00 178.44 178.30 3fer h GLN 51 N 0.00 0.00 0.00 1.25 4.15 -1.94 -3.39 115.11 115.18 3fer h GLN 51 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3fer h GLN 51 Cb 0.74 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.43 3fer h GLN 51 CO 0.03 0.00 -0.89 2.41 -1.93 0.00 0.00 178.83 178.44 3fer n THR 52 N -2.64 0.00 0.72 2.39 -1.04 -1.07 -4.42 114.28 108.23 3fer n THR 52 Ca 0.03 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 62.11 3fer n THR 52 Cb 0.38 -0.50 0.36 0.00 -1.82 0.00 0.00 70.33 68.75 3fer n THR 52 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3fer n ASP 53 N -2.33 0.00 -0.01 8.00 8.00 0.47 -1.97 116.55 128.71 3fer n ASP 53 Ca 0.00 -0.16 0.07 0.00 0.71 0.00 0.00 54.79 55.41 3fer n ASP 53 Cb 0.45 -0.14 -0.11 0.00 -0.02 0.00 0.00 41.12 41.30 3fer n ASP 53 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3fer n LEU 54 N -1.14 0.03 -0.32 0.64 4.77 -1.26 -4.45 117.00 115.26 3fer n LEU 54 Ca 0.08 -0.02 0.18 0.00 -0.03 0.00 0.00 56.01 56.22 3fer n LEU 54 Cb 0.07 0.00 0.43 0.00 -2.33 0.00 0.00 43.42 41.59 3fer n LEU 54 CO 0.09 0.01 1.20 0.28 -1.33 0.00 0.00 177.39 177.64 3fer h SER 55 N 0.00 0.59 0.83 -1.43 0.02 -1.55 0.54 113.55 112.56 3fer h SER 55 Ca 0.00 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3fer h SER 55 Cb 0.66 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.19 3fer h SER 55 CO 0.00 0.17 0.00 -0.90 -1.14 0.00 0.00 176.83 174.96 3fer n ASP 56 N -4.68 0.00 0.00 3.07 5.75 -1.26 -4.35 116.55 115.08 3fer n ASP 56 Ca 0.24 0.39 0.00 0.00 -0.01 0.00 0.00 54.79 55.41 3fer n ASP 56 Cb 0.71 -0.46 0.00 0.00 -1.03 0.00 0.00 41.12 40.34 3fer n ASP 56 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3fer n GLY 57 N 1.18 2.89 0.05 6.12 0.00 0.18 -4.58 105.19 111.02 3fer n GLY 57 Ca 0.08 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.98 3fer n GLY 57 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3fer h LEU 58 N 0.00 -0.03 -1.00 0.99 3.38 -1.90 0.74 115.31 117.49 3fer h LEU 58 Ca 0.00 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 3fer h LEU 58 Cb 0.00 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 3fer h LEU 58 CO 0.00 -0.01 -0.41 0.03 0.09 0.00 0.00 178.44 178.13 3fer h ARG 59 N -0.01 0.00 -0.15 1.13 3.08 -1.87 -1.26 114.38 115.31 3fer h ARG 59 Ca 0.01 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.95 3fer h ARG 59 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.07 3fer h ARG 59 CO -0.02 0.41 -0.32 1.25 -1.07 0.00 0.00 179.97 180.22 3fer h LEU 60 N 0.00 0.54 -0.15 3.04 5.85 -1.76 -1.27 115.31 121.56 3fer h LEU 60 Ca -0.00 -0.57 0.02 0.00 0.84 0.00 0.00 57.88 58.17 3fer h LEU 60 Cb 0.87 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 3fer h LEU 60 CO 0.05 1.00 0.02 0.40 -0.34 0.00 0.00 178.44 179.58 3fer h ILE 61 N 0.09 0.92 -0.90 4.05 2.04 -0.65 -1.24 117.51 121.82 3fer h ILE 61 Ca 0.00 -0.03 0.03 0.00 1.00 0.00 0.00 64.86 65.87 3fer h ILE 61 Cb 0.93 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 37.79 3fer h ILE 61 CO 0.07 0.01 0.59 0.00 0.00 0.00 0.00 178.15 178.82 3fer h ALA 62 N 1.11 1.19 -0.68 1.87 0.00 -1.20 -1.05 119.26 120.51 3fer h ALA 62 Ca 0.07 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3fer h ALA 62 Cb 0.07 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 3fer h ALA 62 CO -0.10 0.45 0.33 1.25 0.00 0.00 0.00 179.25 181.18 3fer h LEU 63 N 1.14 0.89 -1.07 0.00 5.85 -0.80 -0.65 115.31 120.66 3fer h LEU 63 Ca 0.36 -0.13 -0.10 0.00 0.84 0.00 0.00 57.88 58.85 3fer h LEU 63 Cb 0.00 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 3fer h LEU 63 CO -0.12 0.77 -0.42 -0.07 -0.34 0.00 0.00 178.44 178.26 3fer h LEU 64 N 0.94 0.09 -0.54 2.25 3.38 -0.67 -0.99 115.31 119.78 3fer h LEU 64 Ca 0.23 -0.04 -0.16 0.00 0.09 0.00 0.00 57.88 58.01 3fer h LEU 64 Cb 0.12 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 3fer h LEU 64 CO -0.03 0.51 -0.73 -0.33 0.09 0.00 0.00 178.44 177.95 3fer h GLU 65 N 0.07 0.02 0.04 1.13 5.08 -0.75 -1.70 114.58 118.48 3fer h GLU 65 Ca 0.00 -0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 58.23 3fer h GLU 65 Cb 0.78 0.01 0.01 0.00 0.50 0.00 0.00 28.75 30.05 3fer h GLU 65 CO 0.06 0.74 -0.45 0.28 -1.00 0.00 0.00 179.01 178.64 3fer h VAL 66 N 0.02 1.54 0.00 3.13 2.07 -0.80 -0.93 116.25 121.27 3fer h VAL 66 Ca -0.01 -2.18 -0.04 0.00 0.82 0.00 0.00 66.70 65.29 3fer h VAL 66 Cb 1.29 2.92 -0.01 0.00 -1.52 0.00 0.00 31.29 33.97 3fer h VAL 66 CO 0.10 0.61 -0.20 -0.07 0.02 0.00 0.00 177.57 178.03 3fer h LEU 67 N -0.43 0.00 0.00 2.57 3.38 -1.21 -3.00 115.31 116.61 3fer h LEU 67 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3fer h LEU 67 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 3fer h LEU 67 CO 0.09 0.20 -1.43 -1.54 0.09 0.00 0.00 178.44 175.84 3fer n SER 68 N -4.22 0.72 -3.34 -0.43 3.41 -0.64 -4.97 113.62 104.15 3fer n SER 68 Ca -0.02 -0.43 -0.24 0.00 -0.26 0.00 0.00 58.87 57.92 3fer n SER 68 Cb 0.26 1.48 0.02 0.00 -0.26 0.00 0.00 64.21 65.71 3fer n SER 68 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3fer n GLN 69 N -1.84 -4.60 -4.41 4.33 1.13 -0.36 -4.96 117.38 106.68 3fer n GLN 69 Ca -0.00 0.68 -0.21 0.00 -1.94 0.00 0.00 57.00 55.52 3fer n GLN 69 Cb 0.41 -5.50 -0.09 0.00 0.11 0.00 0.00 30.24 25.17 3fer n GLN 69 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 3fer s LYS 70 N -6.01 1.73 0.00 -1.09 1.02 -1.21 -5.07 119.74 109.10 3fer s LYS 70 Ca 0.42 -2.01 0.00 0.00 0.02 0.00 0.00 55.97 54.40 3fer s LYS 70 Cb -0.20 -0.34 0.00 0.00 -0.52 0.00 0.00 37.83 36.77 3fer s LYS 70 CO 0.52 -0.44 0.00 0.54 -0.92 0.00 0.00 175.35 175.04 3fer n ARG 71 N -0.71 0.00 -0.00 1.68 1.74 -1.26 -4.49 116.66 113.62 3fer n ARG 71 Ca -0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 3fer n ARG 71 Cb 0.65 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 32.08 3fer n ARG 71 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3fer n TYR 73 N 0.00 0.00 -4.02 -1.55 4.01 -1.26 -5.04 117.16 109.30 3fer n TYR 73 Ca 0.00 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.64 3fer n TYR 73 Cb 0.00 -0.01 -0.07 0.00 -0.31 0.00 0.00 39.34 38.95 3fer n TYR 73 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 3fer s ARG 74 N -1.66 1.34 0.80 -0.72 1.70 -1.26 -5.16 118.95 113.98 3fer s ARG 74 Ca -0.00 -1.28 -0.12 0.00 -0.47 0.00 0.00 55.73 53.86 3fer s ARG 74 Cb 0.01 0.40 0.08 0.00 -0.57 0.00 0.00 34.95 34.86 3fer s ARG 74 CO 0.03 -0.52 1.14 0.15 -1.08 0.00 0.00 175.30 175.03 3fer s LYS 75 N -4.02 1.87 0.16 3.89 1.02 -1.26 -5.07 119.74 116.32 3fer s LYS 75 Ca 0.23 1.48 -0.08 0.00 0.02 0.00 0.00 55.97 57.63 3fer s LYS 75 Cb 0.02 -1.83 -0.01 0.00 -0.52 0.00 0.00 37.83 35.49 3fer s LYS 75 CO 0.06 -1.98 0.24 1.52 -0.92 0.00 0.00 175.35 174.27 3fer s TYR 76 N -2.51 0.48 0.00 3.18 1.13 -1.26 -5.00 117.35 113.37 3fer s TYR 76 Ca 0.67 -0.84 -0.30 0.00 -1.41 0.00 0.00 57.07 55.19 3fer s TYR 76 Cb -0.23 -0.13 -0.03 0.00 -1.10 0.00 0.00 41.96 40.47 3fer s TYR 76 CO 0.52 -0.68 1.02 -1.01 -2.51 0.00 0.00 175.55 172.89 3fer s HIS 77 N -3.98 3.61 -0.10 -3.49 3.76 -1.26 -4.92 115.29 108.90 3fer s HIS 77 Ca 0.18 1.63 0.20 0.00 -0.15 0.00 0.00 55.06 56.93 3fer s HIS 77 Cb 0.04 -3.17 0.47 0.00 1.11 0.00 0.00 32.58 31.03 3fer s HIS 77 CO 0.00 -0.23 1.63 1.96 -0.85 0.00 0.00 174.74 177.25 3fer h GLN 78 N 6.82 0.00 -2.13 1.40 1.08 -2.00 -3.34 115.11 116.94 3fer h GLN 78 Ca -0.41 0.00 -0.58 0.00 -1.45 0.00 0.00 58.65 56.22 3fer h GLN 78 Cb 1.21 0.00 -0.41 0.00 -0.05 0.00 0.00 27.48 28.24 3fer h GLN 78 CO 0.77 0.28 -0.80 0.54 -0.95 0.00 0.00 178.83 178.67 3fer n ARG 79 N -3.25 1.97 -1.36 1.46 1.74 -1.26 -5.00 116.66 110.95 3fer n ARG 79 Ca 0.02 -4.17 -0.41 0.00 -0.77 0.00 0.00 57.85 52.52 3fer n ARG 79 Cb 0.57 -1.90 -0.05 0.00 -1.02 0.00 0.00 32.46 30.06 3fer n ARG 79 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 3fer n PRO 80 N 0.81 1.69 -0.05 5.56 -0.04 -1.26 -4.65 135.00 137.07 3fer n PRO 80 Ca 0.27 -2.03 -0.13 0.00 -0.04 0.00 0.00 63.50 61.56 3fer n PRO 80 Cb 0.46 -3.07 -0.08 0.00 -0.04 0.00 0.00 33.50 30.78 3fer n PRO 80 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 3fer h THR 81 N 4.67 1.37 -3.20 0.52 1.35 -1.96 -3.41 112.91 112.25 3fer h THR 81 Ca 0.41 -1.40 -0.50 0.00 -0.55 0.00 0.00 66.41 64.38 3fer h THR 81 Cb 0.70 2.01 0.00 0.00 -1.73 0.00 0.00 68.15 69.14 3fer h THR 81 CO 1.85 0.40 -0.09 -0.36 -0.25 0.00 0.00 175.52 177.08 3fer s PHE 82 N -4.13 3.50 0.16 4.73 0.40 -1.26 -4.97 117.98 116.40 3fer s PHE 82 Ca -0.14 0.62 -0.18 0.00 -0.60 0.00 0.00 56.93 56.63 3fer s PHE 82 Cb 0.04 -2.11 0.06 0.00 0.51 0.00 0.00 43.02 41.53 3fer s PHE 82 CO 0.75 0.06 1.68 -0.09 0.70 0.00 0.00 175.22 178.32 3fer h ARG 83 N 1.15 0.01 -1.93 0.44 2.43 -2.01 -1.73 114.38 112.73 3fer h ARG 83 Ca -0.48 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 3fer h ARG 83 Cb 1.20 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 3fer h ARG 83 CO 0.64 0.01 0.00 0.94 -1.51 0.00 0.00 179.97 180.04 3fer n GLN 84 N -5.26 0.08 0.00 0.20 -0.06 -1.26 -0.75 117.38 110.32 3fer n GLN 84 Ca 0.01 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.01 3fer n GLN 84 Cb 0.19 -1.46 0.00 0.00 -4.06 0.00 0.00 30.24 24.91 3fer n GLN 84 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 3fer n GLN 86 N 1.12 0.00 -0.30 3.69 6.02 -0.65 -1.99 117.38 125.27 3fer n GLN 86 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 56.98 3fer n GLN 86 Cb 0.04 0.00 0.18 0.00 1.02 0.00 0.00 30.24 31.48 3fer n GLN 86 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 3fer h LEU 87 N 0.00 1.01 -0.28 1.08 3.38 -1.23 -1.26 115.31 118.02 3fer h LEU 87 Ca 0.00 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 3fer h LEU 87 Cb 0.00 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 3fer h LEU 87 CO 0.00 0.73 0.03 -0.33 0.09 0.00 0.00 178.44 178.96 3fer h GLU 88 N 1.19 0.47 0.31 1.13 5.08 -1.65 -0.33 114.58 120.79 3fer h GLU 88 Ca 0.33 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 3fer h GLU 88 Cb -0.13 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.07 3fer h GLU 88 CO -0.07 0.60 -0.16 -0.91 -1.00 0.00 0.00 179.01 177.47 3fer h ASN 89 N 0.28 -0.39 -0.72 1.42 4.21 -1.74 -2.73 115.58 115.91 3fer h ASN 89 Ca 0.08 0.02 0.11 0.00 1.21 0.00 0.00 56.30 57.72 3fer h ASN 89 Cb 0.37 0.11 -0.08 0.00 -1.12 0.00 0.00 38.32 37.59 3fer h ASN 89 CO 0.01 -0.27 0.31 0.58 -1.29 0.00 0.00 177.43 176.77 3fer h VAL 90 N -0.44 0.75 -0.80 2.81 2.07 -1.19 -1.67 116.25 117.79 3fer h VAL 90 Ca -0.04 -0.17 0.11 0.00 0.82 0.00 0.00 66.70 67.42 3fer h VAL 90 Cb 0.35 0.20 -0.08 0.00 -1.52 0.00 0.00 31.29 30.24 3fer h VAL 90 CO 0.06 0.09 0.42 0.28 0.02 0.00 0.00 177.57 178.44 3fer h SER 91 N 0.50 0.56 -0.52 0.57 0.02 -0.76 0.12 113.55 114.05 3fer h SER 91 Ca 0.37 0.07 -0.08 0.00 -0.84 0.00 0.00 61.79 61.31 3fer h SER 91 Cb 0.48 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.97 3fer h SER 91 CO -0.33 0.30 0.03 -0.37 -1.14 0.00 0.00 176.83 175.31 3fer h VAL 92 N 0.68 1.25 -0.01 2.27 -1.51 -1.04 0.30 116.25 118.20 3fer h VAL 92 Ca 0.40 -1.05 0.01 0.00 -1.23 0.00 0.00 66.70 64.84 3fer h VAL 92 Cb 0.45 0.79 -0.01 0.00 -2.13 0.00 0.00 31.29 30.39 3fer h VAL 92 CO -0.29 0.38 -0.05 0.00 -1.23 0.00 0.00 177.57 176.38 3fer h ALA 93 N 1.15 -0.05 -0.22 5.19 0.00 -0.60 0.14 119.26 124.88 3fer h ALA 93 Ca 0.17 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.10 3fer h ALA 93 Cb 0.47 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 3fer h ALA 93 CO 0.02 -0.54 0.12 -0.07 0.00 0.00 0.00 179.25 178.78 3fer h LEU 94 N -0.09 0.19 -0.68 0.00 3.38 -0.51 -1.54 115.31 116.05 3fer h LEU 94 Ca 0.03 0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.09 3fer h LEU 94 Cb 0.12 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 40.77 3fer h LEU 94 CO -0.06 0.14 0.32 -0.33 0.09 0.00 0.00 178.44 178.60 3fer h GLU 95 N 0.25 0.54 -0.89 1.13 5.08 -0.09 -0.35 114.58 120.25 3fer h GLU 95 Ca 0.09 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.45 3fer h GLU 95 Cb 0.01 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.09 3fer h GLU 95 CO -0.05 0.36 0.58 0.35 -1.00 0.00 0.00 179.01 179.25 3fer h PHE 96 N 0.56 1.09 0.00 4.33 3.04 -0.14 0.62 116.94 126.44 3fer h PHE 96 Ca 0.34 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 62.30 3fer h PHE 96 Cb 0.37 -0.37 -0.00 0.00 2.56 0.00 0.00 35.95 38.51 3fer h PHE 96 CO -0.12 0.64 -0.09 -0.07 -2.02 0.00 0.00 178.31 176.65 3fer h LEU 97 N 1.14 0.00 0.32 0.59 3.38 -0.10 -2.59 115.31 118.06 3fer h LEU 97 Ca 0.35 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.31 3fer h LEU 97 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3fer h LEU 97 CO -0.11 0.09 -0.15 -0.78 0.09 0.00 0.00 178.44 177.58 3fer h ASP 98 N 0.00 -0.36 0.00 -0.43 1.82 -0.06 -1.80 116.42 115.58 3fer h ASP 98 Ca -0.00 -0.17 0.00 0.00 -0.39 0.00 0.00 57.03 56.46 3fer h ASP 98 Cb 0.22 0.09 0.00 0.00 0.68 0.00 0.00 39.33 40.33 3fer h ASP 98 CO 0.01 0.09 0.23 0.03 -1.61 0.00 0.00 179.24 177.99 3fer h ARG 99 N -0.93 0.00 -0.57 0.28 3.08 -1.21 0.73 114.38 115.75 3fer h ARG 99 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.01 3fer h ARG 99 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 3fer h ARG 99 CO 0.07 0.00 0.00 0.39 -1.07 0.00 0.00 179.97 179.36 3fer n GLU 100 N -2.73 2.33 -1.79 0.04 -0.58 -1.00 -4.93 120.64 111.99 3fer n GLU 100 Ca -0.02 -2.05 -0.16 0.00 -0.42 0.00 0.00 57.16 54.50 3fer n GLU 100 Cb 0.28 -1.45 -0.05 0.00 -0.57 0.00 0.00 31.44 29.65 3fer n GLU 100 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 3fer n SER 101 N 1.16 -4.52 -4.53 1.62 7.64 0.25 -4.93 113.62 110.31 3fer n SER 101 Ca 0.19 0.30 -0.43 0.00 1.01 0.00 0.00 58.87 59.95 3fer n SER 101 Cb 0.49 -3.99 -0.05 0.00 -1.01 0.00 0.00 64.21 59.65 3fer n SER 101 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3fer s ILE 102 N -2.54 4.49 -0.10 0.44 1.01 -0.70 -5.01 121.20 118.80 3fer s ILE 102 Ca 0.00 0.40 -0.30 0.00 0.00 0.00 0.00 60.65 60.76 3fer s ILE 102 Cb 0.00 -4.45 -0.03 0.00 0.01 0.00 0.00 42.46 37.99 3fer s ILE 102 CO 0.00 -0.93 1.35 -0.54 0.00 0.00 0.00 174.94 174.82 3fer s LYS 103 N 3.69 4.25 0.33 2.79 1.02 -1.26 -4.58 119.74 125.97 3fer s LYS 103 Ca 0.31 1.82 -0.02 0.00 0.02 0.00 0.00 55.97 58.11 3fer s LYS 103 Cb -0.12 -3.74 -0.04 0.00 -0.52 0.00 0.00 37.83 33.41 3fer s LYS 103 CO 0.22 -0.67 0.55 -0.51 -0.92 0.00 0.00 175.35 174.01 3fer s LEU 104 N 3.22 4.02 -0.59 3.17 1.43 -1.26 -5.05 118.68 123.62 3fer s LEU 104 Ca 0.60 0.55 -0.09 0.00 -1.03 0.00 0.00 54.13 54.16 3fer s LEU 104 Cb -0.26 -3.40 0.15 0.00 0.03 0.00 0.00 46.19 42.71 3fer s LEU 104 CO 0.21 -0.26 0.47 0.68 0.23 0.00 0.00 176.35 177.68 3fer s VAL 105 N -2.24 4.49 -1.17 -1.59 -7.23 -1.26 -4.73 120.40 106.67 3fer s VAL 105 Ca 0.41 -2.18 -0.15 0.00 -1.81 0.00 0.00 61.98 58.25 3fer s VAL 105 Cb -0.10 -3.90 -0.01 0.00 0.56 0.00 0.00 36.38 32.93 3fer s VAL 105 CO 0.34 -0.86 0.76 -1.20 -0.31 0.00 0.00 175.10 173.83 3fer n SER 106 N 4.41 -4.54 -4.00 4.85 7.64 -1.26 -4.93 113.62 115.79 3fer n SER 106 Ca -0.00 -0.96 -0.28 0.00 1.01 0.00 0.00 58.87 58.64 3fer n SER 106 Cb 0.41 -3.61 -0.17 0.00 -1.01 0.00 0.00 64.21 59.84 3fer n SER 106 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3fer s ILE 107 N -3.53 1.30 0.02 0.44 1.01 -1.26 -5.05 121.20 114.13 3fer s ILE 107 Ca 0.38 -0.50 0.05 0.00 0.00 0.00 0.00 60.65 60.58 3fer s ILE 107 Cb -0.12 -1.23 -0.02 0.00 0.01 0.00 0.00 42.46 41.10 3fer s ILE 107 CO 0.85 0.41 -0.15 1.51 0.00 0.00 0.00 174.94 177.55 3fer s ASP 108 N 1.24 1.82 0.28 3.58 -4.77 -1.26 -5.04 116.67 112.52 3fer s ASP 108 Ca -0.02 -0.38 0.03 0.00 -3.30 0.00 0.00 52.55 48.88 3fer s ASP 108 Cb -0.14 -0.16 0.73 0.00 -1.09 0.00 0.00 42.92 42.26 3fer s ASP 108 CO -0.04 0.12 1.39 -1.54 0.70 0.00 0.00 175.17 175.80 3fer n SER 109 N 2.28 -0.06 -0.34 2.11 3.41 -1.26 -0.06 113.62 119.70 3fer n SER 109 Ca -0.16 1.51 0.23 0.00 -0.26 0.00 0.00 58.87 60.18 3fer n SER 109 Cb 0.55 -0.57 0.49 0.00 -0.26 0.00 0.00 64.21 64.42 3fer n SER 109 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 3fer h LYS 110 N 0.00 0.39 -0.19 4.33 3.64 -1.96 0.71 116.57 123.49 3fer h LYS 110 Ca 0.56 -0.02 -0.18 0.00 -1.27 0.00 0.00 60.65 59.73 3fer h LYS 110 Cb 1.19 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.92 3fer h LYS 110 CO -0.82 0.26 -0.62 0.00 -2.27 0.00 0.00 179.45 176.00 3fer h ALA 111 N 1.67 0.56 -0.23 5.00 0.00 -0.89 -1.21 119.26 124.16 3fer h ALA 111 Ca 0.65 -0.54 -0.17 0.00 0.00 0.00 0.00 54.91 54.85 3fer h ALA 111 Cb 1.57 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.29 3fer h ALA 111 CO -0.39 0.70 -0.50 0.82 0.00 0.00 0.00 179.25 179.88 3fer h ILE 112 N 0.48 1.30 0.00 0.00 2.04 -1.13 -1.81 117.51 118.39 3fer h ILE 112 Ca -0.01 -1.71 -0.02 0.00 1.00 0.00 0.00 64.86 64.12 3fer h ILE 112 Cb 1.20 1.79 -0.00 0.00 -0.74 0.00 0.00 36.82 39.07 3fer h ILE 112 CO 0.12 0.54 -0.10 0.58 0.00 0.00 0.00 178.15 179.29 3fer h VAL 113 N 0.47 0.25 -0.13 1.67 2.07 -0.92 -2.95 116.25 116.71 3fer h VAL 113 Ca 0.00 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.67 3fer h VAL 113 Cb 1.11 1.69 0.00 0.00 -1.52 0.00 0.00 31.29 32.57 3fer h VAL 113 CO 0.11 0.10 0.00 0.47 0.02 0.00 0.00 177.57 178.27 3fer n ASP 114 N -3.22 2.98 -1.03 0.57 8.00 -0.46 -4.93 116.55 118.45 3fer n ASP 114 Ca 0.01 -1.95 -0.05 0.00 0.71 0.00 0.00 54.79 53.50 3fer n ASP 114 Cb 0.39 -0.07 0.01 0.00 -0.02 0.00 0.00 41.12 41.43 3fer n ASP 114 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3fer n GLY 115 N 1.38 0.53 3.55 0.44 0.00 -1.05 -4.97 105.19 105.06 3fer n GLY 115 Ca 0.16 -0.52 -0.40 0.00 0.00 0.00 0.00 46.02 45.25 3fer n GLY 115 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3fer s ASN 116 N -3.01 6.09 0.16 1.61 3.84 -0.71 -4.85 114.94 118.08 3fer s ASN 116 Ca 0.10 -0.59 -0.16 0.00 0.21 0.00 0.00 52.86 52.42 3fer s ASN 116 Cb -0.04 -2.56 0.06 0.00 -0.55 0.00 0.00 41.25 38.15 3fer s ASN 116 CO 0.12 -1.87 1.78 0.25 -2.79 0.00 0.00 177.10 174.60 3fer h LEU 117 N 13.58 0.30 -0.77 3.21 5.85 -1.90 -0.57 115.31 135.01 3fer h LEU 117 Ca -0.15 0.02 0.17 0.00 0.84 0.00 0.00 57.88 58.76 3fer h LEU 117 Cb 1.05 -0.04 -0.11 0.00 0.37 0.00 0.00 40.66 41.93 3fer h LEU 117 CO 1.30 0.22 0.22 0.50 -0.34 0.00 0.00 178.44 180.34 3fer h LYS 118 N 0.41 0.29 0.22 1.25 3.64 -2.00 -1.65 116.57 118.73 3fer h LYS 118 Ca 0.17 -0.02 -0.28 0.00 -1.27 0.00 0.00 60.65 59.25 3fer h LYS 118 Cb 0.07 -0.07 0.03 0.00 -0.41 0.00 0.00 32.23 31.85 3fer h LYS 118 CO -0.11 0.19 -1.24 -0.07 -2.27 0.00 0.00 179.45 175.95 3fer h LEU 119 N 0.30 0.72 -1.80 5.20 3.38 -1.83 -3.01 115.31 118.27 3fer h LEU 119 Ca 0.45 -0.93 -0.03 0.00 0.09 0.00 0.00 57.88 57.46 3fer h LEU 119 Cb 0.78 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 3fer h LEU 119 CO -0.52 1.60 -0.12 0.16 0.09 0.00 0.00 178.44 179.65 3fer h ILE 120 N -0.04 1.03 -0.22 1.22 -0.00 -0.80 0.18 117.51 118.88 3fer h ILE 120 Ca -0.22 -0.42 -0.12 0.00 -0.00 0.00 0.00 64.86 64.10 3fer h ILE 120 Cb 1.98 1.23 -0.01 0.00 -0.00 0.00 0.00 36.82 40.02 3fer h ILE 120 CO 0.23 0.12 -0.39 -0.07 -0.00 0.00 0.00 178.15 178.04 3fer h LEU 121 N 0.00 0.51 -1.30 0.16 3.38 -1.38 -0.62 115.31 116.06 3fer h LEU 121 Ca -0.00 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.70 3fer h LEU 121 Cb 0.22 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3fer h LEU 121 CO 0.02 0.85 -0.06 1.23 0.09 0.00 0.00 178.44 180.56 3fer h GLY 122 N 1.09 0.42 0.89 0.83 0.00 -0.59 -0.32 103.07 105.39 3fer h GLY 122 Ca 0.04 -0.25 -0.11 0.00 0.00 0.00 0.00 47.33 47.01 3fer h GLY 122 CO 0.07 0.24 -0.30 -2.00 0.00 0.00 0.00 176.54 174.55 3fer h LEU 123 N 0.37 0.62 -0.56 3.11 5.85 -0.27 -2.38 115.31 122.05 3fer h LEU 123 Ca 0.08 -0.52 -0.08 0.00 0.84 0.00 0.00 57.88 58.20 3fer h LEU 123 Cb 0.35 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 3fer h LEU 123 CO 0.02 1.02 0.03 0.58 -0.34 0.00 0.00 178.44 179.75 3fer h VAL 124 N 0.24 1.26 -0.40 1.05 2.07 -0.78 -1.80 116.25 117.89 3fer h VAL 124 Ca 0.02 -1.07 -0.01 0.00 0.82 0.00 0.00 66.70 66.47 3fer h VAL 124 Cb 0.88 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.48 3fer h VAL 124 CO 0.07 0.38 0.22 -0.25 0.02 0.00 0.00 177.57 178.01 3fer h TRP 125 N 0.85 0.52 -0.48 1.57 -0.00 -1.06 0.51 115.95 117.86 3fer h TRP 125 Ca 0.16 -0.00 -0.12 0.00 -0.00 0.00 0.00 58.89 58.94 3fer h TRP 125 Cb 0.49 -0.17 -0.01 0.00 -0.00 0.00 0.00 29.16 29.47 3fer h TRP 125 CO 0.04 0.37 -0.15 1.15 -0.00 0.00 0.00 178.44 179.84 3fer h THR 126 N 0.55 1.27 -0.40 2.65 2.02 -0.93 0.55 112.91 118.62 3fer h THR 126 Ca 0.14 -1.30 -0.14 0.00 0.77 0.00 0.00 66.41 65.88 3fer h THR 126 Cb 0.02 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 3fer h THR 126 CO -0.02 0.45 -0.31 -0.07 0.37 0.00 0.00 175.52 175.94 3fer h LEU 127 N 0.81 0.92 -0.38 2.58 3.38 -0.62 -1.69 115.31 120.31 3fer h LEU 127 Ca 0.12 -0.38 -0.05 0.00 0.09 0.00 0.00 57.88 57.66 3fer h LEU 127 Cb 0.72 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 3fer h LEU 127 CO 0.06 1.15 0.06 0.40 0.09 0.00 0.00 178.44 180.19 3fer h ILE 128 N 0.74 1.24 -0.77 1.22 2.04 -0.74 -0.74 117.51 120.50 3fer h ILE 128 Ca 0.08 -0.86 -0.05 0.00 1.00 0.00 0.00 64.86 65.03 3fer h ILE 128 Cb 0.87 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.98 3fer h ILE 128 CO 0.08 0.29 0.30 0.25 0.00 0.00 0.00 178.15 179.08 3fer h LEU 129 N 0.48 1.07 0.35 1.44 5.85 -0.81 -0.74 115.31 122.95 3fer h LEU 129 Ca 0.12 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 3fer h LEU 129 Cb 0.37 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.13 3fer h LEU 129 CO 0.01 0.95 -0.17 -0.74 -0.34 0.00 0.00 178.44 178.15 3fer h HIS 130 N 1.12 -0.43 0.00 1.25 2.76 -1.18 -1.78 115.15 116.88 3fer h HIS 130 Ca 0.26 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.42 3fer h HIS 130 Cb 0.22 0.14 0.00 0.00 1.55 0.00 0.00 27.41 29.32 3fer h HIS 130 CO 0.02 -0.21 0.00 1.88 -1.30 0.00 0.00 177.93 178.32 3fer h TYR 131 N -1.09 0.00 0.00 5.26 0.05 -1.21 -3.19 116.97 116.79 3fer h TYR 131 Ca -0.05 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.71 3fer h TYR 131 Cb 0.42 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.16 3fer h TYR 131 CO 0.01 0.00 -1.33 0.43 -1.05 0.00 0.00 178.16 176.22 3fer n SER 132 N -2.92 3.45 -0.02 3.88 7.64 -0.29 -4.25 113.62 121.12 3fer n SER 132 Ca 0.03 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.89 3fer n SER 132 Cb 0.43 1.18 -0.02 0.00 -1.01 0.00 0.00 64.21 64.78 3fer n SER 132 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 3fer n ILE 133 N -1.84 0.24 -0.84 0.44 5.41 -1.15 -4.72 119.36 116.90 3fer n ILE 133 Ca -0.03 -0.13 0.08 0.00 1.00 0.00 0.00 62.75 63.67 3fer n ILE 133 Cb 0.28 -0.82 0.39 0.00 -0.71 0.00 0.00 39.64 38.78 3fer n ILE 133 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 3fer n SER 134 N -2.30 5.47 -0.51 4.38 7.64 -0.68 -4.91 113.62 122.71 3fer n SER 134 Ca -0.06 -2.82 0.00 0.00 1.01 0.00 0.00 58.87 57.00 3fer n SER 134 Cb 0.60 -0.66 0.00 0.00 -1.01 0.00 0.00 64.21 63.14 3fer n SER 134 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 3fer n PRO 136 N 0.72 0.00 -3.03 1.43 -0.02 -1.26 -5.04 135.00 127.81 3fer n PRO 136 Ca 0.27 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.32 3fer n PRO 136 Cb 1.12 -0.23 -0.05 0.00 -0.02 0.00 0.00 33.50 34.32 3fer n PRO 136 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3fer s VAL 137 N -1.14 4.68 0.11 -1.45 0.11 -1.26 -5.03 120.40 116.42 3fer s VAL 137 Ca 0.00 -0.15 -0.29 0.00 -2.93 0.00 0.00 61.98 58.62 3fer s VAL 137 Cb 0.00 -4.39 -0.06 0.00 -1.53 0.00 0.00 36.38 30.40 3fer s VAL 137 CO 0.00 -0.92 0.90 0.26 -3.33 0.00 0.00 175.10 172.01 3fer s TRP 138 N 3.17 3.81 0.00 1.54 0.51 -1.26 -4.98 118.94 121.74 3fer s TRP 138 Ca 0.22 1.72 0.00 0.00 -2.12 0.00 0.00 56.10 55.92 3fer s TRP 138 Cb -0.16 -2.98 0.00 0.00 -0.81 0.00 0.00 33.47 29.52 3fer s TRP 138 CO 0.15 0.26 0.00 0.39 -0.51 0.00 0.00 176.95 177.24 3fer n GLU 139 N 2.64 0.00 0.00 4.98 -0.58 -1.26 -4.83 120.64 121.59 3fer n GLU 139 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 3fer n GLU 139 Cb 0.49 -0.04 0.00 0.00 -0.57 0.00 0.00 31.44 31.33 3fer n GLU 139 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 3fer n ASP 140 N 0.00 0.00 0.00 1.62 3.85 -1.26 -4.55 116.55 116.20 3fer n ASP 140 Ca 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.08 3fer n ASP 140 Cb 0.00 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.77 3fer n ASP 140 CO 0.00 0.00 0.00 -1.84 -1.01 0.00 0.00 177.20 174.35 3fer n GLU 141 N 0.00 0.00 -2.03 0.11 0.28 -1.26 -5.17 120.64 112.57 3fer n GLU 141 Ca 0.00 0.00 -0.00 0.00 -0.16 0.00 0.00 57.16 57.00 3fer n GLU 141 Cb 0.00 -0.21 -0.00 0.00 1.43 0.00 0.00 31.44 32.66 3fer n GLU 141 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3fer n GLY 142 N 0.00 -0.34 0.00 -1.84 0.00 -1.26 -5.15 105.19 96.59 3fer n GLY 142 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3fer n GLY 142 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3fer n LYS 148 N -2.03 0.00 0.00 1.61 4.01 -1.25 -5.29 118.16 115.21 3fer n LYS 148 Ca -0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 3fer n LYS 148 Cb 0.34 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.86 3fer n LYS 148 CO 0.00 0.00 0.00 0.94 -1.11 0.00 0.00 177.40 177.23 3fer n GLN 149 N 0.00 0.00 -1.09 1.97 -0.06 -1.26 -4.79 117.38 112.15 3fer n GLN 149 Ca 0.00 0.00 -0.34 0.00 -2.00 0.00 0.00 57.00 54.66 3fer n GLN 149 Cb 0.00 0.00 0.12 0.00 -4.06 0.00 0.00 30.24 26.30 3fer n GLN 149 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 3fer n THR 150 N -0.43 1.78 -0.31 1.69 -2.24 -1.26 -4.67 114.28 108.84 3fer n THR 150 Ca 0.00 -0.23 -0.01 0.00 -2.27 0.00 0.00 64.05 61.54 3fer n THR 150 Cb 0.00 -1.08 0.11 0.00 -2.10 0.00 0.00 70.33 67.26 3fer n THR 150 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3fer h PRO 151 N -0.91 1.02 -0.39 -0.78 0.13 -1.95 0.47 132.00 129.59 3fer h PRO 151 Ca -0.46 -0.06 0.03 0.00 -0.87 0.00 0.00 66.00 64.64 3fer h PRO 151 Cb 1.30 -0.23 -0.03 0.00 0.13 0.00 0.00 31.00 32.17 3fer h PRO 151 CO 0.44 0.68 0.18 -0.22 -0.23 0.00 0.00 178.00 178.85 3fer h LYS 152 N 1.05 0.37 -0.47 0.86 3.11 -1.95 -1.36 116.57 118.17 3fer h LYS 152 Ca 0.35 -0.02 -0.02 0.00 -2.81 0.00 0.00 60.65 58.14 3fer h LYS 152 Cb 0.04 -0.08 -0.02 0.00 -1.00 0.00 0.00 32.23 31.16 3fer h LYS 152 CO -0.13 0.24 0.21 1.96 -2.81 0.00 0.00 179.45 178.93 3fer h GLN 153 N 0.38 0.69 -0.94 1.90 4.20 -1.71 -1.26 115.11 118.37 3fer h GLN 153 Ca 0.17 -0.11 0.09 0.00 0.06 0.00 0.00 58.65 58.86 3fer h GLN 153 Cb 0.08 -0.12 -0.07 0.00 0.30 0.00 0.00 27.48 27.68 3fer h GLN 153 CO -0.12 0.60 0.60 -0.09 -0.67 0.00 0.00 178.83 179.15 3fer h ARG 154 N 0.62 0.95 -0.07 1.46 2.43 -0.38 0.16 114.38 119.56 3fer h ARG 154 Ca 0.16 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.17 3fer h ARG 154 Cb 0.15 -0.21 0.01 0.00 -0.42 0.00 0.00 29.97 29.49 3fer h ARG 154 CO -0.02 0.63 -0.36 1.25 -1.51 0.00 0.00 179.97 179.96 3fer h LEU 155 N 0.98 0.44 -0.64 3.80 5.85 -0.92 -2.53 115.31 122.29 3fer h LEU 155 Ca 0.43 -0.66 0.11 0.00 0.84 0.00 0.00 57.88 58.60 3fer h LEU 155 Cb 0.36 -0.13 -0.08 0.00 0.37 0.00 0.00 40.66 41.18 3fer h LEU 155 CO -0.19 1.02 0.22 0.25 -0.34 0.00 0.00 178.44 179.40 3fer h LEU 156 N -0.12 0.18 -0.73 2.25 5.85 -0.75 0.03 115.31 122.02 3fer h LEU 156 Ca -0.03 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 3fer h LEU 156 Cb 1.02 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 3fer h LEU 156 CO 0.07 0.09 0.38 1.23 -0.34 0.00 0.00 178.44 179.88 3fer h GLY 157 N 0.38 1.11 1.57 3.75 0.00 -0.66 -1.02 103.07 108.19 3fer h GLY 157 Ca 0.33 -0.53 -0.11 0.00 0.00 0.00 0.00 47.33 47.02 3fer h GLY 157 CO -0.35 0.50 -0.33 -0.25 0.00 0.00 0.00 176.54 176.11 3fer h TRP 158 N 1.01 0.56 -0.20 5.60 7.01 -0.86 -2.52 115.95 126.56 3fer h TRP 158 Ca 0.25 -0.14 -0.04 0.00 2.11 0.00 0.00 58.89 61.07 3fer h TRP 158 Cb 0.08 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 27.00 3fer h TRP 158 CO 0.00 0.77 -0.02 0.82 -2.79 0.00 0.00 178.44 177.22 3fer h ILE 159 N 0.42 1.27 -0.59 2.65 1.08 -0.65 -3.07 117.51 118.62 3fer h ILE 159 Ca 0.05 -0.94 0.02 0.00 -0.39 0.00 0.00 64.86 63.60 3fer h ILE 159 Cb 0.79 1.49 -0.04 0.00 -3.07 0.00 0.00 36.82 35.99 3fer h ILE 159 CO 0.06 0.28 0.36 1.56 -0.69 0.00 0.00 178.15 179.73 3fer h GLN 160 N 0.11 0.70 0.00 2.37 1.08 -1.08 -2.10 115.11 116.20 3fer h GLN 160 Ca 0.05 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.20 3fer h GLN 160 Cb 0.43 -0.16 -0.00 0.00 -0.05 0.00 0.00 27.48 27.71 3fer h GLN 160 CO 0.01 0.47 -0.04 -0.97 -0.95 0.00 0.00 178.83 177.35 3fer h ASN 161 N 0.72 0.00 0.19 1.46 -1.24 -1.45 -2.35 115.58 112.91 3fer h ASN 161 Ca 0.23 0.00 -0.31 0.00 0.71 0.00 0.00 56.30 56.93 3fer h ASN 161 Cb -0.00 0.00 0.02 0.00 0.73 0.00 0.00 38.32 39.07 3fer h ASN 161 CO -0.09 0.04 -1.46 0.11 -1.29 0.00 0.00 177.43 174.74 3fer h LYS 162 N 0.00 0.40 -2.41 6.67 1.79 -1.30 -3.39 116.57 118.33 3fer h LYS 162 Ca -0.00 -0.68 -0.60 0.00 -2.18 0.00 0.00 60.65 57.19 3fer h LYS 162 Cb 0.12 0.25 -0.41 0.00 -1.58 0.00 0.00 32.23 30.61 3fer h LYS 162 CO 0.01 1.33 -0.67 0.44 -1.08 0.00 0.00 179.45 179.48 3fer n ILE 163 N -3.78 1.64 0.88 1.86 -5.35 -0.92 -4.86 119.36 108.83 3fer n ILE 163 Ca -0.21 -4.90 0.04 0.00 -0.27 0.00 0.00 62.75 57.41 3fer n ILE 163 Cb 1.01 -2.08 0.25 0.00 -1.74 0.00 0.00 39.64 37.08 3fer n ILE 163 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 3fer n PRO 164 N 1.30 0.44 -0.34 6.28 -0.04 -0.91 -2.87 135.00 138.87 3fer n PRO 164 Ca 0.26 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.81 3fer n PRO 164 Cb 0.41 -1.30 0.25 0.00 -0.04 0.00 0.00 33.50 32.82 3fer n PRO 164 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3fer n TYR 165 N -0.80 0.86 -4.02 0.54 4.01 -1.26 -4.89 117.16 111.59 3fer n TYR 165 Ca 0.06 -0.55 -0.22 0.00 -0.16 0.00 0.00 57.90 57.03 3fer n TYR 165 Cb 0.03 -0.08 -0.17 0.00 -0.31 0.00 0.00 39.34 38.81 3fer n TYR 165 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3fer s LEU 166 N -1.32 1.08 -0.57 7.72 1.02 -1.14 -5.09 118.68 120.39 3fer s LEU 166 Ca 0.38 -0.13 -0.27 0.00 0.02 0.00 0.00 54.13 54.13 3fer s LEU 166 Cb 0.22 -0.49 -0.01 0.00 0.02 0.00 0.00 46.19 45.92 3fer s LEU 166 CO 0.22 -0.10 1.78 -2.16 0.02 0.00 0.00 176.35 176.11 3fer s PRO 167 N 1.33 2.83 -0.45 1.29 0.04 -1.26 -4.93 135.00 133.86 3fer s PRO 167 Ca -0.04 0.69 -0.14 0.00 0.04 0.00 0.00 61.00 61.54 3fer s PRO 167 Cb -0.13 -4.32 0.07 0.00 0.04 0.00 0.00 34.50 30.15 3fer s PRO 167 CO -0.02 -2.49 0.35 0.42 0.04 0.00 0.00 177.00 175.30 3fer s ILE 168 N 8.28 5.05 0.00 0.56 -1.09 -1.26 -4.86 121.20 127.88 3fer s ILE 168 Ca 0.66 -1.06 0.00 0.00 -2.23 0.00 0.00 60.65 58.02 3fer s ILE 168 Cb -0.14 -3.99 0.00 0.00 -1.58 0.00 0.00 42.46 36.75 3fer s ILE 168 CO 0.23 -0.52 0.10 0.35 -1.23 0.00 0.00 174.94 173.87 3fer n THR 169 N 5.14 0.00 -4.03 2.92 -2.24 -1.26 -4.83 114.28 109.99 3fer n THR 169 Ca -0.12 -0.32 -0.09 0.00 -2.27 0.00 0.00 64.05 61.24 3fer n THR 169 Cb 0.44 1.11 -0.08 0.00 -2.10 0.00 0.00 70.33 69.70 3fer n THR 169 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3fer s ASN 170 N -0.45 0.16 -0.46 3.42 2.20 -1.26 -5.06 114.94 113.50 3fer s ASN 170 Ca 0.00 -0.98 0.03 0.00 -0.94 0.00 0.00 52.86 50.97 3fer s ASN 170 Cb 0.00 0.37 0.49 0.00 -2.00 0.00 0.00 41.25 40.10 3fer s ASN 170 CO 0.00 -0.81 1.65 0.49 -2.94 0.00 0.00 177.10 175.49 3fer n PHE 171 N -0.14 2.64 0.00 1.54 3.72 -1.26 -4.51 117.46 119.44 3fer n PHE 171 Ca -0.08 -2.39 0.00 0.00 -0.05 0.00 0.00 57.45 54.94 3fer n PHE 171 Cb 0.63 -0.87 0.00 0.00 -0.94 0.00 0.00 39.48 38.30 3fer n PHE 171 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 3fer n ASN 172 N -0.92 0.00 -0.27 4.37 0.23 -1.26 -4.38 115.26 113.03 3fer n ASN 172 Ca 0.51 0.00 0.09 0.00 -0.53 0.00 0.00 54.58 54.65 3fer n ASN 172 Cb 0.93 0.00 0.22 0.00 -2.08 0.00 0.00 39.78 38.85 3fer n ASN 172 CO 0.00 0.00 0.00 -0.61 -0.93 0.00 0.00 177.26 175.72 3fer h GLN 173 N 0.00 0.20 0.00 -3.83 5.75 -1.94 0.77 115.11 116.06 3fer h GLN 173 Ca 0.00 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 3fer h GLN 173 Cb 0.00 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.51 3fer h GLN 173 CO 0.00 0.13 0.00 0.09 -2.65 0.00 0.00 178.83 176.40 3fer n ASN 174 N -5.23 0.00 -0.11 -0.69 3.02 -1.26 -1.87 115.26 109.12 3fer n ASN 174 Ca 0.17 0.43 0.03 0.00 -0.03 0.00 0.00 54.58 55.18 3fer n ASN 174 Cb 0.56 -0.44 -0.01 0.00 -0.61 0.00 0.00 39.78 39.28 3fer n ASN 174 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 3fer n TRP 175 N -1.44 0.00 -0.17 3.10 7.02 0.25 -4.60 117.44 121.59 3fer n TRP 175 Ca 0.01 0.00 0.25 0.00 -1.02 0.00 0.00 57.50 56.74 3fer n TRP 175 Cb 0.02 0.00 0.67 0.00 -2.42 0.00 0.00 31.31 29.58 3fer n TRP 175 CO 0.00 0.00 0.00 0.37 -2.02 0.00 0.00 177.69 176.04 3fer h GLN 176 N 0.52 0.09 -0.02 -0.99 4.15 -1.20 -1.51 115.11 116.16 3fer h GLN 176 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.41 3fer h GLN 176 Cb 0.19 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.86 3fer h GLN 176 CO 0.00 0.06 -0.05 -0.40 -1.93 0.00 0.00 178.83 176.52 3fer n ASP 177 N -4.34 2.36 0.00 -0.69 5.75 -1.26 -4.75 116.55 113.61 3fer n ASP 177 Ca 0.18 -1.75 0.00 0.00 -0.01 0.00 0.00 54.79 53.20 3fer n ASP 177 Cb 0.86 0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.99 3fer n ASP 177 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3fer n GLY 178 N 1.30 1.25 0.16 6.12 0.00 -0.57 -4.32 105.19 109.13 3fer n GLY 178 Ca 0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 3fer n GLY 178 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fer h LYS 179 N 1.49 0.35 -0.72 1.61 1.57 -1.91 -2.91 116.57 116.06 3fer h LYS 179 Ca 0.00 -0.35 0.07 0.00 -1.87 0.00 0.00 60.65 58.50 3fer h LYS 179 Cb 0.00 0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.34 3fer h LYS 179 CO 0.00 1.02 0.41 0.00 -0.57 0.00 0.00 179.45 180.31 3fer h ALA 180 N 0.86 0.99 -0.38 3.86 0.00 -1.88 0.11 119.26 122.82 3fer h ALA 180 Ca -0.06 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.88 3fer h ALA 180 Cb 1.47 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 3fer h ALA 180 CO 0.14 0.09 0.24 -0.07 0.00 0.00 0.00 179.25 179.66 3fer h LEU 181 N 0.74 0.41 -0.50 0.00 3.38 -1.89 0.16 115.31 117.62 3fer h LEU 181 Ca 0.33 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.34 3fer h LEU 181 Cb 0.22 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.82 3fer h LEU 181 CO -0.19 0.30 0.23 1.23 0.09 0.00 0.00 178.44 180.10 3fer h GLY 182 N 0.50 0.68 0.94 0.83 0.00 -1.00 -1.94 103.07 103.07 3fer h GLY 182 Ca 0.14 -0.15 -0.05 0.00 0.00 0.00 0.00 47.33 47.27 3fer h GLY 182 CO -0.04 0.08 0.05 0.00 0.00 0.00 0.00 176.54 176.63 3fer h ALA 183 N 1.28 0.52 0.35 3.60 0.00 -0.27 -2.81 119.26 121.93 3fer h ALA 183 Ca 0.22 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3fer h ALA 183 Cb 0.16 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3fer h ALA 183 CO -0.18 0.25 -0.39 1.25 0.00 0.00 0.00 179.25 180.18 3fer h LEU 184 N 0.50 -1.07 -1.09 0.00 5.85 -0.26 -1.20 115.31 118.04 3fer h LEU 184 Ca 0.12 0.10 0.03 0.00 0.84 0.00 0.00 57.88 58.96 3fer h LEU 184 Cb 0.39 0.37 -0.05 0.00 0.37 0.00 0.00 40.66 41.74 3fer h LEU 184 CO 0.01 -0.53 0.61 -0.37 -0.34 0.00 0.00 178.44 177.83 3fer h VAL 185 N -0.77 1.17 0.00 1.05 -1.51 -1.42 -0.25 116.25 114.52 3fer h VAL 185 Ca -0.02 -0.41 0.00 0.00 -1.23 0.00 0.00 66.70 65.04 3fer h VAL 185 Cb 0.70 -0.12 0.00 0.00 -2.13 0.00 0.00 31.29 29.75 3fer h VAL 185 CO -0.09 0.22 0.00 -0.67 -1.23 0.00 0.00 177.57 175.80 3fer n ASP 186 N -4.43 0.74 0.12 4.19 2.03 -1.06 -1.79 116.55 116.35 3fer n ASP 186 Ca 0.12 0.65 -0.20 0.00 0.52 0.00 0.00 54.79 55.87 3fer n ASP 186 Cb 0.09 -0.82 -0.15 0.00 -0.72 0.00 0.00 41.12 39.52 3fer n ASP 186 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 3fer h SER 187 N 0.00 0.65 0.87 1.67 0.87 0.20 0.19 113.55 117.99 3fer h SER 187 Ca 0.00 -0.68 -0.10 0.00 -1.23 0.00 0.00 61.79 59.77 3fer h SER 187 Cb 0.48 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.22 3fer h SER 187 CO 0.00 1.53 -0.49 0.00 -0.53 0.00 0.00 176.83 177.35 3fer s ALA 189 N -3.48 -1.58 -0.25 0.00 0.00 -0.74 -4.96 121.76 110.75 3fer s ALA 189 Ca 0.00 -0.70 -0.42 0.00 0.00 0.00 0.00 51.96 50.85 3fer s ALA 189 Cb 0.11 -2.54 -0.18 0.00 0.00 0.00 0.00 23.12 20.51 3fer s ALA 189 CO 0.72 -2.20 1.55 -2.30 0.00 0.00 0.00 175.76 173.53 3fer n PRO 190 N 3.01 0.68 0.00 0.00 -0.02 0.05 -2.58 135.00 136.14 3fer n PRO 190 Ca 0.19 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 3fer n PRO 190 Cb 0.55 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.18 3fer n PRO 190 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fer n GLY 191 N 3.53 1.32 0.10 -1.23 0.00 -1.26 -4.86 105.19 102.79 3fer n GLY 191 Ca 0.26 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.24 3fer n GLY 191 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3fer h LEU 192 N 0.00 0.00 -5.30 0.99 4.07 -1.76 -2.49 115.31 110.83 3fer h LEU 192 Ca 0.00 0.00 -0.31 0.00 0.08 0.00 0.00 57.88 57.65 3fer h LEU 192 Cb 0.00 0.00 -0.22 0.00 1.08 0.00 0.00 40.66 41.52 3fer h LEU 192 CO 0.00 0.80 -0.67 0.00 -1.08 0.00 0.00 178.44 177.49 3fer h PRO 194 N 3.40 0.00 -1.92 0.00 0.13 -1.79 -3.23 132.00 128.59 3fer h PRO 194 Ca -0.06 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.46 3fer h PRO 194 Cb 1.03 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.76 3fer h PRO 194 CO 0.29 0.06 -0.46 -0.40 -0.23 0.00 0.00 178.00 177.26 3fer n ASP 195 N -3.39 4.98 0.08 1.44 5.68 -1.26 -4.79 116.55 119.29 3fer n ASP 195 Ca -0.02 -3.71 -0.19 0.00 -0.50 0.00 0.00 54.79 50.37 3fer n ASP 195 Cb 0.21 -0.59 -0.11 0.00 -1.14 0.00 0.00 41.12 39.49 3fer n ASP 195 CO 0.00 0.00 0.00 4.11 -1.33 0.00 0.00 177.20 179.98 3fer h TRP 196 N 2.88 0.89 -1.00 2.11 5.08 -1.89 -3.29 115.95 120.73 3fer h TRP 196 Ca 0.26 -0.54 0.25 0.00 1.08 0.00 0.00 58.89 59.95 3fer h TRP 196 Cb 0.65 -0.08 -0.07 0.00 -3.00 0.00 0.00 29.16 26.65 3fer h TRP 196 CO 0.89 1.38 0.66 0.93 -1.28 0.00 0.00 178.44 181.02 3fer h GLU 197 N 0.27 0.31 -0.25 0.12 5.08 -1.90 -1.76 114.58 116.45 3fer h GLU 197 Ca -0.15 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 3fer h GLU 197 Cb 1.82 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 31.00 3fer h GLU 197 CO 0.21 0.20 0.00 -1.13 -1.00 0.00 0.00 179.01 177.30 3fer n SER 198 N -4.50 2.10 -4.71 1.42 3.41 -1.24 -4.95 113.62 105.14 3fer n SER 198 Ca 0.23 -1.81 -0.30 0.00 -0.26 0.00 0.00 58.87 56.72 3fer n SER 198 Cb 0.87 -0.16 0.13 0.00 -0.26 0.00 0.00 64.21 64.79 3fer n SER 198 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 3fer s TRP 199 N -1.68 2.22 -0.32 7.33 0.51 -0.66 -4.97 118.94 121.38 3fer s TRP 199 Ca 0.33 1.48 -0.22 0.00 -2.12 0.00 0.00 56.10 55.56 3fer s TRP 199 Cb 0.18 -3.15 -0.00 0.00 -0.81 0.00 0.00 33.47 29.69 3fer s TRP 199 CO 0.26 -2.34 0.71 0.34 -0.51 0.00 0.00 176.95 175.41 3fer s ASP 200 N -3.21 6.56 0.53 2.95 2.15 -1.26 -4.92 116.67 119.47 3fer s ASP 200 Ca 0.63 0.48 0.35 0.00 0.43 0.00 0.00 52.55 54.44 3fer s ASP 200 Cb -0.19 -2.37 1.87 0.00 -0.30 0.00 0.00 42.92 41.94 3fer s ASP 200 CO 0.57 -0.57 2.08 1.55 -0.17 0.00 0.00 175.17 178.63 3fer h PRO 201 N 8.22 0.00 -0.00 4.34 0.13 -1.93 0.45 132.00 143.21 3fer h PRO 201 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3fer h PRO 201 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3fer h PRO 201 CO 0.85 0.00 -0.01 1.04 -0.23 0.00 0.00 178.00 179.65 3fer n GLN 202 N -2.77 0.22 -3.62 0.86 6.02 -1.26 -3.96 117.38 112.87 3fer n GLN 202 Ca -0.02 -0.01 -0.28 0.00 -0.01 0.00 0.00 57.00 56.69 3fer n GLN 202 Cb 0.09 -1.50 -0.09 0.00 1.02 0.00 0.00 30.24 29.75 3fer n GLN 202 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3fer n LYS 203 N -1.39 2.29 -0.04 -1.09 5.02 0.15 -4.93 118.16 118.18 3fer n LYS 203 Ca 0.11 -4.60 -0.16 0.00 -2.02 0.00 0.00 58.31 51.63 3fer n LYS 203 Cb 0.29 -2.28 -0.07 0.00 -0.02 0.00 0.00 35.03 32.95 3fer n LYS 203 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 3fer h PRO 204 N 4.73 0.66 -0.06 1.97 0.13 -1.74 -2.57 132.00 135.11 3fer h PRO 204 Ca 0.18 -0.51 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 3fer h PRO 204 Cb 0.70 0.10 -0.00 0.00 0.13 0.00 0.00 31.00 31.92 3fer h PRO 204 CO 0.80 1.13 0.04 0.28 -0.23 0.00 0.00 178.00 180.01 3fer h VAL 205 N 0.33 1.03 -0.61 1.56 2.07 -1.88 0.89 116.25 119.64 3fer h VAL 205 Ca -0.03 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.41 3fer h VAL 205 Cb 1.21 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 31.93 3fer h VAL 205 CO 0.12 0.03 0.39 0.44 0.02 0.00 0.00 177.57 178.58 3fer h ASP 206 N 0.06 0.71 0.40 0.57 3.32 -1.98 0.71 116.42 120.20 3fer h ASP 206 Ca 0.02 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3fer h ASP 206 Cb 0.02 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.39 3fer h ASP 206 CO -0.00 0.52 -0.19 0.78 -1.72 0.00 0.00 179.24 178.63 3fer h ASN 207 N 0.83 -0.45 -0.24 6.45 4.21 -0.91 -2.15 115.58 123.32 3fer h ASN 207 Ca 0.22 -0.12 0.04 0.00 1.21 0.00 0.00 56.30 57.66 3fer h ASN 207 Cb -0.08 0.12 -0.04 0.00 -1.12 0.00 0.00 38.32 37.20 3fer h ASN 207 CO -0.05 -0.10 -0.02 0.00 -1.29 0.00 0.00 177.43 175.97 3fer h ALA 208 N -0.40 0.20 -0.26 -0.83 0.00 0.13 -2.28 119.26 115.81 3fer h ALA 208 Ca -0.05 0.08 0.06 0.00 0.00 0.00 0.00 54.91 54.99 3fer h ALA 208 Cb 0.54 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.41 3fer h ALA 208 CO 0.09 -0.44 -0.16 -0.09 0.00 0.00 0.00 179.25 178.65 3fer h ARG 209 N 0.05 -0.13 0.05 0.00 2.43 0.40 -2.80 114.38 114.37 3fer h ARG 209 Ca 0.12 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.29 3fer h ARG 209 Cb 0.16 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 3fer h ARG 209 CO -0.22 -0.09 -0.03 1.49 -1.51 0.00 0.00 179.97 179.62 3fer h GLU 210 N -0.13 -0.07 -0.02 0.20 4.57 -1.14 -0.17 114.58 117.82 3fer h GLU 210 Ca 0.14 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.33 3fer h GLU 210 Cb 0.35 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.95 3fer h GLU 210 CO -0.34 -0.05 0.00 0.00 -1.18 0.00 0.00 179.01 177.44 3fer n ALA 211 N -2.12 1.18 0.00 2.92 0.00 -0.88 -1.72 120.51 119.88 3fer n ALA 211 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 3fer n ALA 211 Cb 0.06 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.51 3fer n ALA 211 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 3fer n GLN 213 N 0.21 0.00 -0.09 0.00 -0.06 -0.07 -1.31 117.38 116.05 3fer n GLN 213 Ca 0.00 0.00 -0.05 0.00 -2.00 0.00 0.00 57.00 54.95 3fer n GLN 213 Cb 0.01 0.00 0.15 0.00 -4.06 0.00 0.00 30.24 26.34 3fer n GLN 213 CO 0.00 0.00 0.00 1.96 -0.20 0.00 0.00 177.06 178.82 3fer h GLN 214 N 0.00 0.75 -0.60 3.69 1.08 -1.56 -1.44 115.11 117.04 3fer h GLN 214 Ca 0.00 -0.23 -0.10 0.00 -1.45 0.00 0.00 58.65 56.87 3fer h GLN 214 Cb 0.00 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.33 3fer h GLN 214 CO 0.00 0.81 -0.03 0.00 -0.95 0.00 0.00 178.83 178.66 3fer h ALA 215 N 1.24 0.81 0.47 3.87 0.00 -1.45 -1.80 119.26 122.39 3fer h ALA 215 Ca 0.13 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 3fer h ALA 215 Cb 0.52 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3fer h ALA 215 CO 0.03 0.67 -0.23 0.22 0.00 0.00 0.00 179.25 179.94 3fer h ASP 216 N 0.97 -0.54 -0.52 0.00 1.82 -1.42 0.20 116.42 116.93 3fer h ASP 216 Ca 0.17 0.02 -0.02 0.00 -0.39 0.00 0.00 57.03 56.80 3fer h ASP 216 Cb 0.59 0.14 -0.03 0.00 0.68 0.00 0.00 39.33 40.71 3fer h ASP 216 CO 0.04 -0.36 0.26 0.44 -1.61 0.00 0.00 179.24 178.00 3fer h ASP 217 N -0.67 0.70 0.00 2.28 3.32 -1.35 -2.27 116.42 118.43 3fer h ASP 217 Ca -0.06 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.92 3fer h ASP 217 Cb 0.48 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.86 3fer h ASP 217 CO 0.11 0.60 -0.39 0.79 -1.72 0.00 0.00 179.24 178.63 3fer n TRP 218 N -4.36 0.00 0.09 4.55 7.02 -0.68 -4.61 117.44 119.44 3fer n TRP 218 Ca 0.05 0.00 0.02 0.00 -1.02 0.00 0.00 57.50 56.55 3fer n TRP 218 Cb 0.13 -0.00 -0.03 0.00 -2.42 0.00 0.00 31.31 28.99 3fer n TRP 218 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 3fer n LEU 219 N -1.19 0.09 -0.20 -0.99 4.77 0.52 -2.01 117.00 117.99 3fer n LEU 219 Ca 0.01 -0.20 -0.03 0.00 -0.03 0.00 0.00 56.01 55.77 3fer n LEU 219 Cb 0.12 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.20 3fer n LEU 219 CO 0.16 0.02 -0.02 0.61 -1.33 0.00 0.00 177.39 176.83 3fer n GLY 220 N 1.77 0.58 3.53 -0.72 0.00 -0.12 -3.63 105.19 106.61 3fer n GLY 220 Ca -0.00 -0.96 -0.42 0.00 0.00 0.00 0.00 46.02 44.64 3fer n GLY 220 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3fer s VAL 221 N -2.10 5.02 0.79 1.61 -7.23 -1.01 -4.96 120.40 112.53 3fer s VAL 221 Ca 0.00 0.12 -0.10 0.00 -1.81 0.00 0.00 61.98 60.19 3fer s VAL 221 Cb 0.00 -4.00 0.07 0.00 0.56 0.00 0.00 36.38 33.01 3fer s VAL 221 CO 0.00 -0.30 1.10 -2.16 -0.31 0.00 0.00 175.10 173.43 3fer s PRO 222 N 2.36 2.08 -1.02 4.82 0.04 -1.26 -3.28 135.00 138.73 3fer s PRO 222 Ca 0.17 1.23 -0.13 0.00 0.04 0.00 0.00 61.00 62.30 3fer s PRO 222 Cb -0.16 -1.87 0.21 0.00 0.04 0.00 0.00 34.50 32.72 3fer s PRO 222 CO 0.14 -1.79 1.09 -0.65 0.04 0.00 0.00 177.00 175.84 3fer s GLN 223 N -4.86 3.89 0.00 4.56 -0.21 -1.26 -4.77 119.66 117.01 3fer s GLN 223 Ca 0.62 -2.57 0.28 0.00 0.02 0.00 0.00 55.36 53.71 3fer s GLN 223 Cb -0.18 -4.71 1.41 0.00 1.00 0.00 0.00 33.01 30.53 3fer s GLN 223 CO 0.56 -1.48 1.97 1.33 -2.12 0.00 0.00 175.29 175.55 3fer n VAL 224 N 4.06 0.08 -4.11 1.09 0.24 -1.26 -4.64 118.33 113.79 3fer n VAL 224 Ca 0.24 0.02 -0.15 0.00 -2.04 0.00 0.00 64.34 62.41 3fer n VAL 224 Cb 0.44 -0.55 -0.14 0.00 -1.47 0.00 0.00 33.84 32.12 3fer n VAL 224 CO 0.00 0.00 0.00 -0.51 -2.14 0.00 0.00 176.83 174.18 3fer s ILE 225 N -2.59 0.34 0.49 1.34 2.07 -1.26 -4.10 121.20 117.49 3fer s ILE 225 Ca 0.26 -0.19 -0.08 0.00 -1.41 0.00 0.00 60.65 59.23 3fer s ILE 225 Cb 0.19 -0.29 -0.04 0.00 0.13 0.00 0.00 42.46 42.44 3fer s ILE 225 CO 0.43 0.09 0.83 0.42 -1.91 0.00 0.00 174.94 174.81 3fer s THR 226 N -0.11 4.84 0.32 4.00 -4.23 -1.26 -4.93 115.64 114.26 3fer s THR 226 Ca 0.02 0.44 -0.00 0.00 -1.18 0.00 0.00 61.69 60.97 3fer s THR 226 Cb -0.02 -3.83 0.25 0.00 1.34 0.00 0.00 72.50 70.24 3fer s THR 226 CO -0.00 -0.82 1.97 1.55 -0.54 0.00 0.00 174.62 176.77 3fer h PRO 227 N 0.39 0.95 -0.71 3.99 0.13 -1.93 -1.69 132.00 133.13 3fer h PRO 227 Ca -0.46 -0.07 -0.03 0.00 -0.87 0.00 0.00 66.00 64.56 3fer h PRO 227 Cb 1.20 -0.21 -0.03 0.00 0.13 0.00 0.00 31.00 32.09 3fer h PRO 227 CO 0.62 0.66 0.33 0.93 -0.23 0.00 0.00 178.00 180.31 3fer h GLU 228 N 0.97 1.03 -0.50 0.86 3.07 -1.94 -2.85 114.58 115.24 3fer h GLU 228 Ca 0.26 -0.16 -0.09 0.00 -0.50 0.00 0.00 59.36 58.87 3fer h GLU 228 Cb -0.06 -0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 27.65 3fer h GLU 228 CO -0.05 0.82 -0.05 0.93 -1.40 0.00 0.00 179.01 179.26 3fer h GLU 229 N 1.00 0.91 0.00 2.33 5.08 -1.76 -3.27 114.58 118.87 3fer h GLU 229 Ca 0.24 -0.32 -0.10 0.00 -1.00 0.00 0.00 59.36 58.19 3fer h GLU 229 Cb 0.14 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 3fer h GLU 229 CO -0.03 0.97 -0.45 0.97 -1.00 0.00 0.00 179.01 179.46 3fer h ILE 230 N 0.77 1.14 -0.94 3.13 2.10 -1.23 -3.10 117.51 119.38 3fer h ILE 230 Ca 0.13 -1.66 -0.45 0.00 1.08 0.00 0.00 64.86 63.97 3fer h ILE 230 Cb 0.59 1.94 -0.27 0.00 -1.09 0.00 0.00 36.82 37.99 3fer h ILE 230 CO 0.04 0.44 0.56 2.30 -1.08 0.00 0.00 178.15 180.41 3fer n ILE 231 N -3.73 3.15 1.25 2.19 -6.64 -1.08 -4.53 119.36 109.97 3fer n ILE 231 Ca -0.01 -1.86 0.13 0.00 -1.77 0.00 0.00 62.75 59.24 3fer n ILE 231 Cb 0.52 -0.44 0.31 0.00 -1.44 0.00 0.00 39.64 38.59 3fer n ILE 231 CO 0.00 0.00 0.00 1.57 -1.77 0.00 0.00 176.55 176.35 3fer n HIS 232 N -0.91 0.00 -2.97 4.28 -0.00 -1.17 -4.83 115.22 109.61 3fer n HIS 232 Ca 0.55 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.73 3fer n HIS 232 Cb 1.61 -0.01 0.00 0.00 -0.12 0.00 0.00 29.99 31.47 3fer n HIS 232 CO 0.00 0.00 0.00 -2.30 0.46 0.00 0.00 176.34 174.50 3fer n PRO 233 N 0.57 -0.64 0.00 1.57 -0.02 -1.26 -3.95 135.00 131.28 3fer n PRO 233 Ca 0.16 -0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 3fer n PRO 233 Cb 0.46 0.57 0.00 0.00 -0.02 0.00 0.00 33.50 34.51 3fer n PRO 233 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3fer n ASP 234 N 0.70 0.00 -4.77 2.55 2.03 -1.26 -5.07 116.55 110.74 3fer n ASP 234 Ca 0.00 0.00 -0.40 0.00 0.52 0.00 0.00 54.79 54.91 3fer n ASP 234 Cb 0.00 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.41 3fer n ASP 234 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3fer s VAL 235 N 0.00 2.16 0.24 5.18 0.11 -1.25 -4.83 120.40 121.99 3fer s VAL 235 Ca 0.00 0.14 -0.22 0.00 -2.93 0.00 0.00 61.98 58.97 3fer s VAL 235 Cb 0.00 -3.09 -0.09 0.00 -1.53 0.00 0.00 36.38 31.68 3fer s VAL 235 CO 0.00 0.02 0.79 1.51 -3.33 0.00 0.00 175.10 174.09 3fer s ASP 236 N -0.45 7.19 0.34 3.54 -4.77 -1.26 -4.91 116.67 116.34 3fer s ASP 236 Ca 0.58 1.56 0.06 0.00 -3.30 0.00 0.00 52.55 51.45 3fer s ASP 236 Cb -0.44 -2.47 0.71 0.00 -1.09 0.00 0.00 42.92 39.63 3fer s ASP 236 CO 0.57 0.04 1.89 -0.08 0.70 0.00 0.00 175.17 178.29 3fer h GLU 237 N 3.53 0.79 -0.23 2.11 4.81 -1.94 -2.23 114.58 121.42 3fer h GLU 237 Ca -0.47 -0.05 0.05 0.00 -0.13 0.00 0.00 59.36 58.75 3fer h GLU 237 Cb 1.20 -0.18 -0.04 0.00 0.63 0.00 0.00 28.75 30.35 3fer h GLU 237 CO 0.65 0.52 -0.06 0.45 -0.73 0.00 0.00 179.01 179.85 3fer h HIS 238 N 0.81 -0.12 -0.05 0.92 3.86 -1.93 -2.81 115.15 115.83 3fer h HIS 238 Ca 0.42 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.67 3fer h HIS 238 Cb 0.51 0.09 -0.02 0.00 1.06 0.00 0.00 27.41 29.05 3fer h HIS 238 CO -0.00 -0.10 -0.08 0.77 0.86 0.00 0.00 177.93 179.38 3fer h SER 239 N 0.00 -0.25 0.00 2.45 0.02 -1.78 -1.42 113.55 112.57 3fer h SER 239 Ca 0.11 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 3fer h SER 239 Cb 0.17 0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.83 3fer h SER 239 CO -0.24 -0.12 0.00 0.52 -1.14 0.00 0.00 176.83 175.86 3fer n VAL 240 N -5.21 0.02 0.00 2.27 0.31 -1.06 -2.20 118.33 112.46 3fer n VAL 240 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 3fer n VAL 240 Cb 0.14 -0.44 0.00 0.00 -0.91 0.00 0.00 33.84 32.63 3fer n VAL 240 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3fer n THR 242 N 0.92 0.00 0.07 2.52 -1.04 -0.54 -0.91 114.28 115.31 3fer n THR 242 Ca 0.00 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.91 3fer n THR 242 Cb 0.01 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.45 3fer n THR 242 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 3fer h TYR 243 N 0.00 -0.25 -0.46 -1.42 3.20 -1.72 -3.33 116.97 113.00 3fer h TYR 243 Ca 0.00 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.89 3fer h TYR 243 Cb 0.00 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.33 3fer h TYR 243 CO 0.00 0.11 0.30 -0.07 -1.64 0.00 0.00 178.16 176.87 3fer h LEU 244 N -0.94 0.43 0.00 2.82 4.07 -1.31 -2.47 115.31 117.91 3fer h LEU 244 Ca -0.03 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.93 3fer h LEU 244 Cb 0.48 -0.10 0.00 0.00 1.08 0.00 0.00 40.66 42.12 3fer h LEU 244 CO 0.05 0.30 0.02 -1.54 -1.08 0.00 0.00 178.44 176.19 3fer n SER 245 N -4.48 0.00 0.02 -0.43 3.41 -1.25 -1.18 113.62 109.71 3fer n SER 245 Ca 0.05 0.20 -0.03 0.00 -0.26 0.00 0.00 58.87 58.83 3fer n SER 245 Cb 0.15 -0.20 -0.10 0.00 -0.26 0.00 0.00 64.21 63.80 3fer n SER 245 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 3fer h GLN 246 N 0.00 0.00 -0.78 4.33 4.20 -1.62 -3.40 115.11 117.84 3fer h GLN 246 Ca 0.00 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.75 3fer h GLN 246 Cb 0.04 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.77 3fer h GLN 246 CO 0.00 0.36 0.48 0.74 -0.67 0.00 0.00 178.83 179.74 3fer h PHE 247 N 0.00 0.90 -0.99 2.96 -1.00 -1.35 -3.09 116.94 114.37 3fer h PHE 247 Ca -0.20 0.03 0.22 0.00 2.81 0.00 0.00 57.97 60.83 3fer h PHE 247 Cb 1.72 -0.29 -0.09 0.00 3.61 0.00 0.00 35.95 40.89 3fer h PHE 247 CO 0.00 0.49 0.63 -1.35 -1.61 0.00 0.00 178.31 176.47 3fer h PRO 248 N 0.92 0.51 -0.37 1.51 0.11 -1.77 0.03 132.00 132.95 3fer h PRO 248 Ca 0.32 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.40 3fer h PRO 248 Cb 0.07 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.07 3fer h PRO 248 CO -0.13 0.34 0.00 1.63 -0.21 0.00 0.00 178.00 179.62 3fer n LYS 249 N -4.65 2.25 -2.21 1.05 4.76 -1.17 -4.28 118.16 113.92 3fer n LYS 249 Ca 0.23 -1.91 -0.38 0.00 -2.87 0.00 0.00 58.31 53.38 3fer n LYS 249 Cb 0.72 -1.47 -0.01 0.00 -1.84 0.00 0.00 35.03 32.44 3fer n LYS 249 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3fer s ALA 250 N -1.52 3.11 0.03 7.82 0.00 -0.01 -5.06 121.76 126.13 3fer s ALA 250 Ca 0.37 1.03 0.03 0.00 0.00 0.00 0.00 51.96 53.39 3fer s ALA 250 Cb 0.21 -3.41 -0.02 0.00 0.00 0.00 0.00 23.12 19.90 3fer s ALA 250 CO 0.29 -0.67 -0.09 0.15 0.00 0.00 0.00 175.76 175.43 3fer s LYS 251 N -2.43 0.65 0.05 0.00 1.02 -1.24 -5.08 119.74 112.72 3fer s LYS 251 Ca 0.60 -0.62 -0.31 0.00 0.02 0.00 0.00 55.97 55.67 3fer s LYS 251 Cb -0.32 -0.56 -0.06 0.00 -0.52 0.00 0.00 37.83 36.37 3fer s LYS 251 CO 0.40 0.13 1.22 -1.17 -0.92 0.00 0.00 175.35 175.01 3fer s LEU 252 N -1.05 4.36 0.14 3.17 0.20 -1.26 -4.44 118.68 119.79 3fer s LEU 252 Ca -0.03 2.03 -0.30 0.00 0.69 0.00 0.00 54.13 56.52 3fer s LEU 252 Cb -0.07 -3.58 -0.07 0.00 -0.43 0.00 0.00 46.19 42.04 3fer s LEU 252 CO 0.01 -0.50 1.01 -0.54 -0.29 0.00 0.00 176.35 176.04 3fer s LYS 253 N 1.19 4.67 0.32 1.98 -0.14 -0.85 -4.97 119.74 121.93 3fer s LYS 253 Ca 0.59 1.55 -0.29 0.00 -1.36 0.00 0.00 55.97 56.46 3fer s LYS 253 Cb -0.30 -3.33 -0.11 0.00 -1.68 0.00 0.00 37.83 32.41 3fer s LYS 253 CO 0.29 0.18 1.56 -1.25 -0.76 0.00 0.00 175.35 175.36 3fer s PRO 254 N -0.19 4.12 0.00 -1.68 0.04 -1.26 -3.53 135.00 132.50 3fer s PRO 254 Ca 0.48 2.57 0.00 0.00 0.04 0.00 0.00 61.00 64.08 3fer s PRO 254 Cb -0.26 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.27 3fer s PRO 254 CO 0.32 -0.59 0.00 0.41 0.04 0.00 0.00 177.00 177.17 3fer n GLY 255 N 1.63 0.96 3.70 0.56 0.00 -1.26 -5.07 105.19 105.71 3fer n GLY 255 Ca 0.06 -0.06 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 3fer n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fer n ALA 256 N -1.79 1.23 -1.48 4.61 0.00 -1.23 -4.86 120.51 116.98 3fer n ALA 256 Ca 0.00 0.19 -0.33 0.00 0.00 0.00 0.00 53.44 53.30 3fer n ALA 256 Cb 0.00 -2.27 -0.05 0.00 0.00 0.00 0.00 19.45 17.13 3fer n ALA 256 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3fer n PRO 257 N -0.41 3.48 -1.62 0.00 -0.04 -1.26 -4.95 135.00 130.20 3fer n PRO 257 Ca 0.09 -2.38 -0.47 0.00 -0.04 0.00 0.00 63.50 60.70 3fer n PRO 257 Cb 0.42 -2.51 -0.05 0.00 -0.04 0.00 0.00 33.50 31.33 3fer n PRO 257 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3fer n LEU 258 N 2.43 3.28 -4.29 1.53 4.77 -1.26 -4.87 117.00 118.59 3fer n LEU 258 Ca 0.63 0.69 -0.31 0.00 -0.03 0.00 0.00 56.01 56.98 3fer n LEU 258 Cb 0.41 -1.42 -0.16 0.00 -2.33 0.00 0.00 43.42 39.92 3fer n LEU 258 CO 0.60 -0.28 -0.56 -0.75 -1.33 0.00 0.00 177.39 175.07 3fer s LYS 259 N 5.04 2.44 0.00 3.23 2.20 -0.94 -5.02 119.74 126.69 3fer s LYS 259 Ca 0.97 -0.90 0.00 0.00 -0.36 0.00 0.00 55.97 55.68 3fer s LYS 259 Cb -0.60 -2.15 0.00 0.00 -1.51 0.00 0.00 37.83 33.57 3fer s LYS 259 CO 0.46 0.44 0.00 -0.35 -0.36 0.00 0.00 175.35 175.54 3fer n PRO 260 N 2.79 3.68 -0.65 4.03 -0.04 -1.26 -4.32 135.00 139.22 3fer n PRO 260 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 3fer n PRO 260 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 3fer n PRO 260 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09