#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fie s VAL 10 N 0.00 1.54 0.02 2.53 0.11 -1.26 -5.15 120.40 118.20 2fie s VAL 10 Ca 0.00 -0.89 0.01 0.00 -2.93 0.00 0.00 61.98 58.16 2fie s VAL 10 Cb 0.00 -1.29 -0.02 0.00 -1.53 0.00 0.00 36.38 33.54 2fie s VAL 10 CO 0.00 0.39 -0.03 0.21 -3.33 0.00 0.00 175.10 172.33 2fie s ASN 11 N -0.59 0.33 0.33 3.54 2.47 -1.26 -5.08 114.94 114.68 2fie s ASN 11 Ca 0.07 -0.39 0.08 0.00 0.42 0.00 0.00 52.86 53.04 2fie s ASN 11 Cb -0.08 0.06 -0.04 0.00 -1.45 0.00 0.00 41.25 39.74 2fie s ASN 11 CO -0.00 -0.21 0.17 0.42 -3.72 0.00 0.00 177.10 173.76 2fie s THR 12 N -1.10 3.21 0.19 -5.21 -4.23 -1.26 -0.71 115.64 106.53 2fie s THR 12 Ca -0.11 -1.63 -0.13 0.00 -1.18 0.00 0.00 61.69 58.65 2fie s THR 12 Cb -0.08 -3.03 0.10 0.00 1.34 0.00 0.00 72.50 70.83 2fie s THR 12 CO -0.01 -0.20 1.84 0.25 -0.54 0.00 0.00 174.62 175.97 2fie h LEU 13 N 1.51 0.72 -0.75 4.79 5.85 -1.65 0.20 115.31 125.97 2fie h LEU 13 Ca -0.44 -0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.15 2fie h LEU 13 Cb 1.25 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 42.08 2fie h LEU 13 CO 0.62 0.54 -0.10 0.74 -0.34 0.00 0.00 178.44 179.90 2fie h THR 14 N 0.84 1.26 -0.15 1.05 2.02 -1.96 -1.43 112.91 114.53 2fie h THR 14 Ca 0.22 -1.18 -0.03 0.00 0.77 0.00 0.00 66.41 66.20 2fie h THR 14 Cb -0.07 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.34 2fie h THR 14 CO -0.05 0.41 -0.00 -0.09 0.37 0.00 0.00 175.52 176.16 2fie h ARG 15 N 0.77 0.28 0.05 6.66 2.43 -1.83 -1.25 114.38 121.48 2fie h ARG 15 Ca 0.13 -0.09 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 2fie h ARG 15 Cb 0.60 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.10 2fie h ARG 15 CO 0.04 0.50 -0.29 0.35 -1.51 0.00 0.00 179.97 179.06 2fie h PHE 16 N 0.02 -0.85 -0.72 2.20 3.04 -0.45 -0.36 116.94 119.81 2fie h PHE 16 Ca 0.04 0.02 0.14 0.00 3.98 0.00 0.00 57.97 62.16 2fie h PHE 16 Cb 0.38 0.36 -0.10 0.00 2.56 0.00 0.00 35.95 39.16 2fie h PHE 16 CO 0.04 -0.32 0.24 0.28 -2.02 0.00 0.00 178.31 176.52 2fie h VAL 17 N -0.40 0.62 -0.36 1.41 2.07 -1.29 0.75 116.25 119.05 2fie h VAL 17 Ca -0.00 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.37 2fie h VAL 17 Cb 0.41 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 2fie h VAL 17 CO -0.17 0.07 0.11 0.24 0.02 0.00 0.00 177.57 177.84 2fie h MET 18 N 0.37 0.51 -0.02 1.57 2.86 -0.88 0.12 114.93 119.47 2fie h MET 18 Ca 0.39 -0.07 -0.17 0.00 -2.06 0.00 0.00 59.70 57.79 2fie h MET 18 Cb 0.61 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.16 2fie h MET 18 CO -0.43 0.46 -0.73 0.93 1.06 0.00 0.00 176.91 178.20 2fie h GLU 19 N 0.51 0.15 -0.17 1.72 5.08 0.83 -0.95 114.58 121.74 2fie h GLU 19 Ca 0.12 -0.13 -0.13 0.00 -1.00 0.00 0.00 59.36 58.22 2fie h GLU 19 Cb 0.16 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.44 2fie h GLU 19 CO -0.01 0.82 -0.40 0.93 -1.00 0.00 0.00 179.01 179.35 2fie h GLU 20 N 0.10 0.57 -0.53 2.33 4.39 -0.26 -2.33 114.58 118.85 2fie h GLU 20 Ca -0.02 -0.38 -0.06 0.00 0.34 0.00 0.00 59.36 59.24 2fie h GLU 20 Cb 1.30 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.98 2fie h GLU 20 CO 0.11 1.00 0.09 0.78 -1.16 0.00 0.00 179.01 179.82 2fie h GLY 21 N 0.22 0.90 0.82 -3.84 0.00 -0.72 -2.45 103.07 97.99 2fie h GLY 21 Ca -0.00 -0.55 -0.07 0.00 0.00 0.00 0.00 47.33 46.71 2fie h GLY 21 CO 0.09 0.51 -0.14 3.21 0.00 0.00 0.00 176.54 180.21 2fie h ARG 22 N 0.79 0.45 -0.01 4.80 3.08 -1.17 -1.77 114.38 120.56 2fie h ARG 22 Ca 0.17 -0.22 0.00 0.00 0.07 0.00 0.00 59.98 60.00 2fie h ARG 22 Cb 0.35 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 2fie h ARG 22 CO 0.01 0.77 -0.09 0.87 -1.07 0.00 0.00 179.97 180.45 2fie h LYS 23 N 0.14 -0.11 -0.54 0.04 1.57 -1.23 -2.60 116.57 113.83 2fie h LYS 23 Ca 0.04 0.01 0.15 0.00 -1.87 0.00 0.00 60.65 58.97 2fie h LYS 23 Cb 0.66 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.96 2fie h LYS 23 CO 0.04 -0.07 0.39 0.00 -0.57 0.00 0.00 179.45 179.23 2fie h ALA 24 N -1.28 2.42 -4.59 3.86 0.00 -1.52 -3.47 119.26 114.68 2fie h ALA 24 Ca 0.00 -0.02 -0.25 0.00 0.00 0.00 0.00 54.91 54.65 2fie h ALA 24 Cb 0.12 0.02 0.12 0.00 0.00 0.00 0.00 17.79 18.05 2fie h ALA 24 CO -0.07 -0.57 -0.54 0.54 0.00 0.00 0.00 179.25 178.62 2fie n ARG 25 N -4.40 -5.07 0.00 0.00 1.74 -0.67 -5.05 116.66 103.22 2fie n ARG 25 Ca 0.10 0.61 0.00 0.00 -0.77 0.00 0.00 57.85 57.79 2fie n ARG 25 Cb 0.57 -4.93 0.00 0.00 -1.02 0.00 0.00 32.46 27.08 2fie n ARG 25 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2fie n GLY 26 N -1.24 -0.43 0.02 -0.13 0.00 -1.24 -4.96 105.19 97.20 2fie n GLY 26 Ca -0.14 -1.67 0.13 0.00 0.00 0.00 0.00 46.02 44.34 2fie n GLY 26 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2fie n THR 27 N 0.00 0.00 0.00 2.61 -2.24 -1.26 -4.93 114.28 108.46 2fie n THR 27 Ca 0.00 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 2fie n THR 27 Cb 0.00 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.01 2fie n THR 27 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fie n GLY 28 N 1.46 3.25 0.25 3.38 0.00 -1.26 -4.93 105.19 107.32 2fie n GLY 28 Ca 0.08 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.04 2fie n GLY 28 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2fie h GLU 29 N 1.84 -0.13 -0.55 1.61 5.08 -1.94 -1.29 114.58 119.20 2fie h GLU 29 Ca 0.00 0.01 0.11 0.00 -1.00 0.00 0.00 59.36 58.48 2fie h GLU 29 Cb 0.00 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 2fie h GLU 29 CO 0.00 -0.08 0.38 1.25 -1.00 0.00 0.00 179.01 179.55 2fie h LEU 30 N -0.13 0.26 -0.53 1.33 5.85 -1.93 0.27 115.31 120.42 2fie h LEU 30 Ca 0.19 0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.78 2fie h LEU 30 Cb 0.42 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 2fie h LEU 30 CO -0.47 0.15 -0.30 0.74 -0.34 0.00 0.00 178.44 178.22 2fie h THR 31 N 0.28 1.27 0.03 1.05 2.02 -1.62 -0.50 112.91 115.44 2fie h THR 31 Ca 0.26 -1.46 -0.22 0.00 0.77 0.00 0.00 66.41 65.76 2fie h THR 31 Cb 0.64 1.29 -0.01 0.00 -1.74 0.00 0.00 68.15 68.33 2fie h THR 31 CO -0.06 0.49 -0.97 1.56 0.37 0.00 0.00 175.52 176.92 2fie h GLN 32 N 0.73 0.21 0.24 6.66 4.20 -0.79 -2.38 115.11 124.00 2fie h GLN 32 Ca 0.08 -0.27 -0.00 0.00 0.06 0.00 0.00 58.65 58.52 2fie h GLN 32 Cb 0.86 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.71 2fie h GLN 32 CO 0.08 1.03 -0.20 1.25 -0.67 0.00 0.00 178.83 180.31 2fie h LEU 33 N 0.10 -0.52 -0.34 1.46 7.12 -0.35 0.56 115.31 123.36 2fie h LEU 33 Ca -0.06 0.04 0.01 0.00 0.13 0.00 0.00 57.88 58.00 2fie h LEU 33 Cb 1.63 0.17 -0.02 0.00 -0.53 0.00 0.00 40.66 41.91 2fie h LEU 33 CO 0.15 -0.30 0.20 -0.07 -0.13 0.00 0.00 178.44 178.29 2fie h LEU 34 N -0.45 0.32 -1.14 2.25 3.38 -1.06 -1.55 115.31 117.06 2fie h LEU 34 Ca -0.01 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 2fie h LEU 34 Cb 0.41 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 2fie h LEU 34 CO -0.02 0.24 -0.41 -1.13 0.09 0.00 0.00 178.44 177.20 2fie h ASN 35 N 0.41 0.04 -0.45 -0.43 -0.73 -1.30 0.89 115.58 114.00 2fie h ASN 35 Ca 0.13 -0.01 -0.11 0.00 1.87 0.00 0.00 56.30 58.18 2fie h ASN 35 Cb -0.00 -0.01 -0.01 0.00 0.27 0.00 0.00 38.32 38.57 2fie h ASN 35 CO -0.06 0.45 -0.15 0.28 -0.37 0.00 0.00 177.43 177.57 2fie h SER 36 N 0.03 0.91 -0.42 1.15 0.02 -0.51 -1.09 113.55 113.64 2fie h SER 36 Ca -0.00 -0.38 -0.07 0.00 -0.84 0.00 0.00 61.79 60.50 2fie h SER 36 Cb 0.74 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.02 2fie h SER 36 CO 0.05 1.08 -0.02 0.25 -1.14 0.00 0.00 176.83 177.06 2fie h LEU 37 N 0.73 0.75 -0.27 5.07 5.85 -0.95 -2.13 115.31 124.35 2fie h LEU 37 Ca 0.11 -0.32 0.05 0.00 0.84 0.00 0.00 57.88 58.56 2fie h LEU 37 Cb 0.71 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 2fie h LEU 37 CO 0.05 0.89 -0.01 0.00 -0.34 0.00 0.00 178.44 179.03 2fie h THR 39 N 0.07 1.17 -0.14 0.00 2.02 -1.02 -1.77 112.91 113.25 2fie h THR 39 Ca 0.13 -0.41 -0.00 0.00 0.77 0.00 0.00 66.41 66.90 2fie h THR 39 Cb 0.18 -0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 66.44 2fie h THR 39 CO -0.23 0.22 0.09 0.00 0.37 0.00 0.00 175.52 175.97 2fie h ALA 40 N 1.38 0.18 -0.99 6.16 0.00 -0.64 -2.17 119.26 123.18 2fie h ALA 40 Ca 0.37 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.33 2fie h ALA 40 Cb -0.03 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 17.64 2fie h ALA 40 CO -0.11 -0.31 0.63 0.28 0.00 0.00 0.00 179.25 179.73 2fie h VAL 41 N 0.16 1.04 -0.58 0.00 2.07 -0.65 0.19 116.25 118.47 2fie h VAL 41 Ca 0.05 -0.38 -0.06 0.00 0.82 0.00 0.00 66.70 67.14 2fie h VAL 41 Cb 0.02 -0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 29.60 2fie h VAL 41 CO -0.01 0.20 0.13 0.11 0.02 0.00 0.00 177.57 178.03 2fie h LYS 42 N 1.10 0.90 -0.06 1.57 1.57 -1.02 0.11 116.57 120.75 2fie h LYS 42 Ca 0.44 -0.19 -0.02 0.00 -1.87 0.00 0.00 60.65 59.01 2fie h LYS 42 Cb 0.25 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 2fie h LYS 42 CO -0.20 0.81 -0.03 0.00 -0.57 0.00 0.00 179.45 179.46 2fie h ALA 43 N 1.28 0.08 0.02 3.86 0.00 -0.57 -2.08 119.26 121.85 2fie h ALA 43 Ca 0.19 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.87 2fie h ALA 43 Cb 0.32 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2fie h ALA 43 CO 0.00 -0.16 -0.15 0.82 0.00 0.00 0.00 179.25 179.76 2fie h ILE 44 N -0.28 0.63 -1.01 0.00 2.04 -0.54 -1.20 117.51 117.16 2fie h ILE 44 Ca 0.01 0.00 0.24 0.00 1.00 0.00 0.00 64.86 66.11 2fie h ILE 44 Cb 0.49 0.63 -0.11 0.00 -0.74 0.00 0.00 36.82 37.09 2fie h ILE 44 CO 0.01 0.00 0.62 -1.28 0.00 0.00 0.00 178.15 177.50 2fie h SER 45 N -0.26 0.63 -0.24 1.72 0.87 -0.74 0.34 113.55 115.86 2fie h SER 45 Ca 0.04 0.11 -0.03 0.00 -1.23 0.00 0.00 61.79 60.69 2fie h SER 45 Cb 0.32 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.28 2fie h SER 45 CO -0.13 0.13 0.03 -1.28 -0.53 0.00 0.00 176.83 175.05 2fie h SER 46 N 0.57 0.39 -0.34 6.23 0.87 -0.52 -1.55 113.55 119.19 2fie h SER 46 Ca 0.62 -0.27 -0.12 0.00 -1.23 0.00 0.00 61.79 60.79 2fie h SER 46 Cb 1.23 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 63.08 2fie h SER 46 CO -0.41 0.55 -0.24 0.00 -0.53 0.00 0.00 176.83 176.21 2fie h ALA 47 N 0.85 0.80 -0.54 6.23 0.00 0.01 -1.20 119.26 125.41 2fie h ALA 47 Ca 0.07 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.54 2fie h ALA 47 Cb 0.34 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2fie h ALA 47 CO 0.01 0.65 0.10 0.28 0.00 0.00 0.00 179.25 180.28 2fie h VAL 48 N 0.72 1.23 -0.04 0.00 2.07 -0.30 -0.62 116.25 119.32 2fie h VAL 48 Ca 0.09 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.73 2fie h VAL 48 Cb 0.78 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 2fie h VAL 48 CO 0.06 0.32 0.00 0.54 0.02 0.00 0.00 177.57 178.52 2fie n ARG 49 N -4.25 1.26 -3.32 1.57 3.00 -0.60 -4.85 116.66 109.47 2fie n ARG 49 Ca 0.04 -0.23 -0.16 0.00 -0.01 0.00 0.00 57.85 57.49 2fie n ARG 49 Cb 0.25 -1.48 0.08 0.00 0.00 0.00 0.00 32.46 31.31 2fie n ARG 49 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2fie n LYS 50 N -0.01 -4.20 0.00 5.56 4.01 -0.24 -4.97 118.16 118.31 2fie n LYS 50 Ca 0.02 0.86 0.00 0.00 -0.51 0.00 0.00 58.31 58.68 2fie n LYS 50 Cb 0.28 -5.84 0.00 0.00 -0.51 0.00 0.00 35.03 28.96 2fie n LYS 50 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2fie n ALA 51 N -3.62 0.00 -2.00 7.82 0.00 -0.46 -3.47 120.51 118.78 2fie n ALA 51 Ca -0.17 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 52.99 2fie n ALA 51 Cb 0.64 0.26 0.03 0.00 0.00 0.00 0.00 19.45 20.38 2fie n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fie n GLY 52 N -0.96 6.14 0.39 0.00 0.00 -1.26 -4.78 105.19 104.72 2fie n GLY 52 Ca 0.00 -2.61 0.19 0.00 0.00 0.00 0.00 46.02 43.60 2fie n GLY 52 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2fie h ILE 53 N 2.05 0.73 -0.86 -0.61 2.10 -1.96 -1.75 117.51 117.21 2fie h ILE 53 Ca 0.41 -0.06 0.16 0.00 1.08 0.00 0.00 64.86 66.46 2fie h ILE 53 Cb 1.13 0.55 -0.10 0.00 -1.09 0.00 0.00 36.82 37.31 2fie h ILE 53 CO 0.99 0.03 0.42 0.00 -1.08 0.00 0.00 178.15 178.52 2fie h ALA 54 N 1.68 1.31 -0.40 0.18 0.00 -1.87 -1.90 119.26 118.25 2fie h ALA 54 Ca 0.32 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.34 2fie h ALA 54 Cb 1.05 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 2fie h ALA 54 CO -0.05 -0.15 0.24 0.45 0.00 0.00 0.00 179.25 179.74 2fie h HIS 55 N 0.57 0.53 0.00 0.00 3.86 -1.72 -2.01 115.15 116.38 2fie h HIS 55 Ca 0.49 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.69 2fie h HIS 55 Cb 0.75 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 29.05 2fie h HIS 55 CO -0.10 0.38 0.00 1.47 0.86 0.00 0.00 177.93 180.53 2fie n LEU 56 N -4.77 0.00 -0.73 2.43 -0.00 -0.73 -1.41 117.00 111.80 2fie n LEU 56 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 56.01 56.10 2fie n LEU 56 Cb 0.06 0.00 0.22 0.00 -0.00 0.00 0.00 43.42 43.70 2fie n LEU 56 CO 0.35 0.00 0.67 -1.22 -0.00 0.00 0.00 177.39 177.20 2fie n TYR 57 N -0.85 0.73 -1.41 1.47 4.02 -0.78 -4.98 117.16 115.37 2fie n TYR 57 Ca 0.10 -0.84 -0.01 0.00 -0.01 0.00 0.00 57.90 57.14 2fie n TYR 57 Cb 0.05 -0.25 -0.00 0.00 -0.02 0.00 0.00 39.34 39.11 2fie n TYR 57 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2fie n GLY 58 N -0.53 0.41 0.15 2.72 0.00 -0.50 -4.92 105.19 102.52 2fie n GLY 58 Ca 0.19 -0.97 0.12 0.00 0.00 0.00 0.00 46.02 45.36 2fie n GLY 58 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2fie h ILE 59 N 0.00 0.00 0.00 -0.61 2.10 -1.61 -1.85 117.51 115.54 2fie h ILE 59 Ca -0.02 -0.20 -0.04 0.00 1.08 0.00 0.00 64.86 65.68 2fie h ILE 59 Cb 0.43 0.90 -0.01 0.00 -1.09 0.00 0.00 36.82 37.06 2fie h ILE 59 CO 0.03 0.00 -1.82 0.00 -1.08 0.00 0.00 178.15 175.28 2fie n ALA 60 N -1.80 2.51 0.00 0.18 0.00 -1.26 -5.01 120.51 115.12 2fie n ALA 60 Ca 0.01 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.97 2fie n ALA 60 Cb 0.19 -0.52 0.00 0.00 0.00 0.00 0.00 19.45 19.12 2fie n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fie n GLY 61 N 1.59 1.00 0.00 0.00 0.00 -0.70 -5.21 105.19 101.88 2fie n GLY 61 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2fie n GLY 61 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2fie n SER 62 N 0.00 0.00 0.00 1.61 3.41 -1.26 -4.98 113.62 112.40 2fie n SER 62 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2fie n SER 62 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2fie n SER 62 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2fie n LYS 72 N 0.00 0.00 0.21 4.33 4.81 -1.26 -4.01 118.16 122.24 2fie n LYS 72 Ca 0.00 0.00 0.07 0.00 -0.87 0.00 0.00 58.31 57.51 2fie n LYS 72 Cb 0.00 0.00 0.45 0.00 0.02 0.00 0.00 35.03 35.50 2fie n LYS 72 CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 2fie h LEU 73 N 0.00 0.00 0.67 3.14 5.85 -2.00 -1.75 115.31 121.22 2fie h LEU 73 Ca 0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2fie h LEU 73 Cb 0.00 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.04 2fie h LEU 73 CO 0.00 0.30 -0.32 -0.78 -0.34 0.00 0.00 178.44 177.30 2fie h ASP 74 N 0.00 -0.76 -0.54 1.25 1.82 -1.97 -2.70 116.42 113.53 2fie h ASP 74 Ca -0.00 0.03 0.11 0.00 -0.39 0.00 0.00 57.03 56.77 2fie h ASP 74 Cb 0.68 0.20 -0.11 0.00 0.68 0.00 0.00 39.33 40.78 2fie h ASP 74 CO 0.04 -0.42 -0.22 0.58 -1.61 0.00 0.00 179.24 177.60 2fie h VAL 75 N -1.14 0.32 0.02 2.25 2.07 -1.96 -1.98 116.25 115.83 2fie h VAL 75 Ca -0.09 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.45 2fie h VAL 75 Cb 0.69 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 2fie h VAL 75 CO 0.15 0.00 -0.18 0.25 0.02 0.00 0.00 177.57 177.81 2fie h LEU 76 N -0.09 -0.51 -1.44 2.57 5.85 -1.39 0.38 115.31 120.68 2fie h LEU 76 Ca 0.25 0.07 0.21 0.00 0.84 0.00 0.00 57.88 59.25 2fie h LEU 76 Cb 0.48 0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.65 2fie h LEU 76 CO -0.60 -0.24 0.62 0.28 -0.34 0.00 0.00 178.44 178.15 2fie h SER 77 N -0.30 0.45 0.43 1.25 0.02 -1.07 0.46 113.55 114.79 2fie h SER 77 Ca 0.05 0.05 -0.18 0.00 -0.84 0.00 0.00 61.79 60.87 2fie h SER 77 Cb 0.36 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 2fie h SER 77 CO -0.16 0.16 -0.78 -1.13 -1.14 0.00 0.00 176.83 173.79 2fie h ASN 78 N 0.44 0.34 0.59 3.07 -1.24 -0.49 -2.67 115.58 115.63 2fie h ASN 78 Ca 0.50 -0.24 -0.15 0.00 0.71 0.00 0.00 56.30 57.11 2fie h ASN 78 Cb 1.21 -0.10 -0.02 0.00 0.73 0.00 0.00 38.32 40.14 2fie h ASN 78 CO -0.21 0.99 -0.70 0.44 -1.29 0.00 0.00 177.43 176.66 2fie h ASP 79 N 0.18 0.11 0.07 1.15 3.32 0.19 -1.58 116.42 119.86 2fie h ASP 79 Ca -0.04 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 2fie h ASP 79 Cb 1.37 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.89 2fie h ASP 79 CO 0.12 0.78 -0.04 -0.07 -1.72 0.00 0.00 179.24 178.32 2fie h LEU 80 N 0.06 -0.08 0.22 1.55 3.38 -0.78 -1.47 115.31 118.18 2fie h LEU 80 Ca -0.01 -0.43 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 2fie h LEU 80 Cb 1.24 0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.02 2fie h LEU 80 CO 0.10 0.41 -0.10 0.58 0.09 0.00 0.00 178.44 179.52 2fie h VAL 81 N -0.61 0.79 -0.49 1.22 2.07 -1.52 0.32 116.25 118.02 2fie h VAL 81 Ca -0.01 -0.02 0.10 0.00 0.82 0.00 0.00 66.70 67.59 2fie h VAL 81 Cb 0.51 0.80 -0.08 0.00 -1.52 0.00 0.00 31.29 31.00 2fie h VAL 81 CO 0.02 0.00 -0.02 -0.03 0.02 0.00 0.00 177.57 177.56 2fie h MET 82 N -0.30 0.09 -0.08 1.57 -1.53 -1.36 0.21 114.93 113.53 2fie h MET 82 Ca -0.03 -0.01 -0.17 0.00 -3.44 0.00 0.00 59.70 56.06 2fie h MET 82 Cb 0.23 -0.02 0.01 0.00 -0.55 0.00 0.00 31.60 31.27 2fie h MET 82 CO 0.05 0.06 -0.60 -0.97 0.14 0.00 0.00 176.91 175.59 2fie h ASN 83 N 0.10 0.67 -0.47 1.39 -1.24 -1.15 -2.23 115.58 112.65 2fie h ASN 83 Ca 0.25 -0.67 -0.06 0.00 0.71 0.00 0.00 56.30 56.53 2fie h ASN 83 Cb 0.37 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 39.20 2fie h ASN 83 CO -0.43 1.24 0.09 0.24 -1.29 0.00 0.00 177.43 177.28 2fie h MET 84 N 0.16 0.84 -0.13 6.67 2.86 -0.66 0.35 114.93 125.02 2fie h MET 84 Ca -0.05 -0.19 -0.04 0.00 -2.06 0.00 0.00 59.70 57.36 2fie h MET 84 Cb 1.26 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 32.80 2fie h MET 84 CO 0.12 0.79 -0.05 -0.07 1.06 0.00 0.00 176.91 178.76 2fie h LEU 85 N 0.80 0.28 -0.21 1.22 3.38 -0.63 -2.41 115.31 117.74 2fie h LEU 85 Ca 0.17 -0.40 0.01 0.00 0.09 0.00 0.00 57.88 57.75 2fie h LEU 85 Cb 0.36 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2fie h LEU 85 CO 0.01 0.61 0.11 0.11 0.09 0.00 0.00 178.44 179.37 2fie h LYS 86 N -0.06 0.22 0.00 1.13 1.57 -1.12 -1.90 116.57 116.42 2fie h LYS 86 Ca 0.03 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2fie h LYS 86 Cb 0.50 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2fie h LYS 86 CO 0.02 0.15 0.00 0.43 -0.57 0.00 0.00 179.45 179.47 2fie n SER 87 N -4.99 0.00 0.08 0.86 7.64 0.12 -2.84 113.62 114.50 2fie n SER 87 Ca -0.03 0.30 -0.11 0.00 1.01 0.00 0.00 58.87 60.05 2fie n SER 87 Cb 0.05 -0.37 -0.06 0.00 -1.01 0.00 0.00 64.21 62.82 2fie n SER 87 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2fie h SER 88 N 0.00 0.28 -1.22 6.43 4.64 -0.82 -3.48 113.55 119.38 2fie h SER 88 Ca 0.00 -0.25 -0.10 0.00 -0.47 0.00 0.00 61.79 60.96 2fie h SER 88 Cb 0.10 -0.09 0.01 0.00 -0.31 0.00 0.00 62.40 62.11 2fie h SER 88 CO 0.00 1.11 -0.15 0.49 -0.87 0.00 0.00 176.83 177.41 2fie n PHE 89 N -3.59 -0.40 -0.54 4.77 3.01 -1.13 -4.88 117.46 114.70 2fie n PHE 89 Ca -0.04 0.08 0.00 0.00 1.01 0.00 0.00 57.45 58.50 2fie n PHE 89 Cb 0.88 -1.83 0.00 0.00 -0.01 0.00 0.00 39.48 38.52 2fie n PHE 89 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2fie n ALA 90 N -1.86 0.90 -2.57 4.37 0.00 -1.26 -4.16 120.51 115.93 2fie n ALA 90 Ca -0.04 -0.16 -0.24 0.00 0.00 0.00 0.00 53.44 53.00 2fie n ALA 90 Cb 0.54 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.91 2fie n ALA 90 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2fie s THR 91 N -0.05 3.00 0.00 0.00 -4.23 -1.26 -0.87 115.64 112.23 2fie s THR 91 Ca 0.00 -1.94 0.00 0.00 -1.18 0.00 0.00 61.69 58.57 2fie s THR 91 Cb 0.00 -2.80 0.00 0.00 1.34 0.00 0.00 72.50 71.04 2fie s THR 91 CO 0.00 -0.28 0.00 0.00 -0.54 0.00 0.00 174.62 173.80 2fie s VAL 93 N -0.91 -0.03 -0.13 0.00 1.01 -1.25 -2.44 120.40 116.65 2fie s VAL 93 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.17 2fie s VAL 93 Cb 0.00 -0.10 0.02 0.00 0.00 0.00 0.00 36.38 36.31 2fie s VAL 93 CO 0.00 0.09 -0.12 -0.76 0.00 0.00 0.00 175.10 174.31 2fie s LEU 94 N 1.01 1.49 -0.15 3.92 1.43 -0.42 -2.04 118.68 123.92 2fie s LEU 94 Ca -0.09 -0.40 -0.04 0.00 -1.03 0.00 0.00 54.13 52.57 2fie s LEU 94 Cb -0.12 -1.02 -0.03 0.00 0.03 0.00 0.00 46.19 45.04 2fie s LEU 94 CO -0.03 -0.07 -0.02 -0.69 0.23 0.00 0.00 176.35 175.77 2fie s VAL 95 N 1.49 4.06 0.04 -1.59 1.01 -0.64 -1.12 120.40 123.64 2fie s VAL 95 Ca 0.03 -0.30 0.03 0.00 0.00 0.00 0.00 61.98 61.74 2fie s VAL 95 Cb -0.13 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.45 2fie s VAL 95 CO -0.08 0.50 -0.09 -0.55 0.00 0.00 0.00 175.10 174.88 2fie s SER 96 N 0.19 1.00 0.42 3.32 0.15 -1.26 -1.69 113.70 115.82 2fie s SER 96 Ca -0.01 -0.49 0.12 0.00 0.70 0.00 0.00 55.95 56.27 2fie s SER 96 Cb -0.13 0.00 0.90 0.00 -1.71 0.00 0.00 66.02 65.08 2fie s SER 96 CO 0.02 -0.14 1.96 -0.08 1.20 0.00 0.00 173.24 176.21 2fie h GLU 97 N 4.69 0.11 0.00 5.44 4.81 -1.95 -2.52 114.58 125.17 2fie h GLU 97 Ca -0.36 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 2fie h GLU 97 Cb 1.20 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.56 2fie h GLU 97 CO 0.42 0.27 0.00 0.39 -0.73 0.00 0.00 179.01 179.36 2fie n GLU 98 N -4.30 0.12 -5.04 1.92 -0.58 -1.26 -4.76 120.64 106.73 2fie n GLU 98 Ca -0.02 0.20 -0.32 0.00 -0.42 0.00 0.00 57.16 56.60 2fie n GLU 98 Cb 0.25 -1.67 -0.15 0.00 -0.57 0.00 0.00 31.44 29.31 2fie n GLU 98 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2fie s ASP 99 N -3.71 3.63 0.08 1.62 1.01 -0.95 -5.03 116.67 113.31 2fie s ASP 99 Ca 0.10 -0.33 -0.16 0.00 0.71 0.00 0.00 52.55 52.86 2fie s ASP 99 Cb 0.13 -0.83 -0.11 0.00 1.01 0.00 0.00 42.92 43.12 2fie s ASP 99 CO 0.47 0.30 1.37 0.50 0.21 0.00 0.00 175.17 178.02 2fie h LYS 100 N 5.68 0.62 -6.18 8.23 3.64 -1.86 -3.42 116.57 123.29 2fie h LYS 100 Ca -0.40 -0.36 -0.49 0.00 -1.27 0.00 0.00 60.65 58.12 2fie h LYS 100 Cb 1.16 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.97 2fie h LYS 100 CO 0.50 0.97 -0.41 -1.01 -2.27 0.00 0.00 179.45 177.23 2fie s HIS 101 N -4.20 2.78 0.23 1.91 3.76 -1.26 -4.99 115.29 113.52 2fie s HIS 101 Ca -0.13 -0.42 -0.20 0.00 -0.15 0.00 0.00 55.06 54.16 2fie s HIS 101 Cb 0.08 -2.02 -0.08 0.00 1.11 0.00 0.00 32.58 31.66 2fie s HIS 101 CO 0.82 0.00 0.74 0.00 -0.85 0.00 0.00 174.74 175.46 2fie s ALA 102 N -2.41 3.39 -0.11 -1.40 0.00 -1.26 -4.75 121.76 115.22 2fie s ALA 102 Ca 0.45 0.20 -0.24 0.00 0.00 0.00 0.00 51.96 52.37 2fie s ALA 102 Cb -0.04 -2.85 -0.03 0.00 0.00 0.00 0.00 23.12 20.20 2fie s ALA 102 CO 0.27 0.31 0.73 0.42 0.00 0.00 0.00 175.76 177.49 2fie s ILE 103 N -1.54 5.00 -0.45 0.00 1.09 -0.28 -4.88 121.20 120.14 2fie s ILE 103 Ca 0.44 1.46 -0.14 0.00 -1.10 0.00 0.00 60.65 61.31 2fie s ILE 103 Cb -0.17 -4.06 0.07 0.00 -1.06 0.00 0.00 42.46 37.25 2fie s ILE 103 CO 0.21 0.17 0.36 -0.63 -0.10 0.00 0.00 174.94 174.95 2fie s ILE 104 N 1.30 5.02 0.33 2.92 -1.09 -1.26 -1.30 121.20 127.11 2fie s ILE 104 Ca 0.37 -1.09 -0.27 0.00 -2.23 0.00 0.00 60.65 57.43 2fie s ILE 104 Cb -0.17 -3.99 -0.13 0.00 -1.58 0.00 0.00 42.46 36.59 2fie s ILE 104 CO 0.16 -0.53 1.00 0.52 -1.23 0.00 0.00 174.94 174.86 2fie n VAL 105 N 5.14 2.07 -0.78 2.92 0.31 -1.02 -4.92 118.33 122.04 2fie n VAL 105 Ca -0.12 -0.50 -0.33 0.00 -0.01 0.00 0.00 64.34 63.38 2fie n VAL 105 Cb 0.44 -1.04 0.13 0.00 -0.91 0.00 0.00 33.84 32.45 2fie n VAL 105 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2fie n GLU 106 N 0.59 -0.74 0.07 5.55 1.02 -1.26 -4.78 120.64 121.09 2fie n GLU 106 Ca 0.09 -0.19 0.13 0.00 -0.02 0.00 0.00 57.16 57.17 2fie n GLU 106 Cb 0.34 -1.65 0.48 0.00 -0.02 0.00 0.00 31.44 30.58 2fie n GLU 106 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 2fie n PRO 107 N -1.13 0.17 0.04 3.49 -0.02 -1.26 -2.96 135.00 133.33 2fie n PRO 107 Ca 0.03 0.16 -0.05 0.00 -2.02 0.00 0.00 63.50 61.61 2fie n PRO 107 Cb 0.59 -1.70 -0.10 0.00 -0.02 0.00 0.00 33.50 32.26 2fie n PRO 107 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2fie h GLU 108 N 0.00 0.00 -0.32 -0.52 3.07 -2.01 -3.33 114.58 111.46 2fie h GLU 108 Ca 0.00 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.84 2fie h GLU 108 Cb 0.64 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.54 2fie h GLU 108 CO 0.00 0.66 0.01 1.63 -1.40 0.00 0.00 179.01 179.91 2fie n LYS 109 N -3.16 3.17 -2.42 2.33 5.02 -1.22 -5.02 118.16 116.85 2fie n LYS 109 Ca -0.07 -2.92 -0.41 0.00 -2.02 0.00 0.00 58.31 52.89 2fie n LYS 109 Cb 0.94 -1.92 -0.03 0.00 -0.02 0.00 0.00 35.03 34.00 2fie n LYS 109 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2fie s ARG 110 N -2.85 4.50 0.48 1.97 0.52 -1.15 -4.02 118.95 118.39 2fie s ARG 110 Ca 0.45 1.80 0.00 0.00 -0.52 0.00 0.00 55.73 57.46 2fie s ARG 110 Cb 0.36 -3.29 -0.00 0.00 0.52 0.00 0.00 34.95 32.54 2fie s ARG 110 CO 0.10 -0.11 0.02 0.41 0.02 0.00 0.00 175.30 175.73 2fie n GLY 111 N 2.51 3.55 1.78 -3.53 0.00 0.62 -4.61 105.19 105.52 2fie n GLY 111 Ca 0.06 -2.34 0.03 0.00 0.00 0.00 0.00 46.02 43.77 2fie n GLY 111 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2fie n LYS 112 N -1.18 4.19 -4.63 1.61 2.85 -1.05 -3.41 118.16 116.54 2fie n LYS 112 Ca -0.19 -2.78 -0.27 0.00 -1.05 0.00 0.00 58.31 54.02 2fie n LYS 112 Cb 0.62 -2.17 -0.14 0.00 -0.65 0.00 0.00 35.03 32.69 2fie n LYS 112 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 2fie s TYR 113 N -2.61 1.99 -0.17 5.58 2.02 -0.05 -2.37 117.35 121.76 2fie s TYR 113 Ca 0.49 -0.39 -0.03 0.00 -0.37 0.00 0.00 57.07 56.76 2fie s TYR 113 Cb 0.38 -1.16 -0.02 0.00 -0.40 0.00 0.00 41.96 40.75 2fie s TYR 113 CO 0.14 0.14 -0.06 0.08 -1.57 0.00 0.00 175.55 174.28 2fie s VAL 114 N -0.88 3.61 -0.15 0.71 1.01 0.11 -1.57 120.40 123.24 2fie s VAL 114 Ca 0.09 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 61.63 2fie s VAL 114 Cb -0.09 -2.58 0.02 0.00 0.00 0.00 0.00 36.38 33.72 2fie s VAL 114 CO 0.03 0.48 -0.17 -0.69 0.00 0.00 0.00 175.10 174.74 2fie s VAL 115 N 0.65 1.77 0.13 2.92 1.01 -0.87 -0.14 120.40 125.87 2fie s VAL 115 Ca -0.03 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.21 2fie s VAL 115 Cb -0.15 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.58 2fie s VAL 115 CO 0.02 0.49 0.16 0.00 0.00 0.00 0.00 175.10 175.77 2fie s PHE 117 N -1.62 -0.17 -0.36 0.00 -0.71 -0.68 -1.35 117.98 113.08 2fie s PHE 117 Ca 0.32 0.15 -0.01 0.00 -1.04 0.00 0.00 56.93 56.36 2fie s PHE 117 Cb -0.11 0.51 0.09 0.00 -1.21 0.00 0.00 43.02 42.30 2fie s PHE 117 CO 0.25 -0.24 0.11 0.34 -1.34 0.00 0.00 175.22 174.33 2fie s ASP 118 N -1.97 5.02 0.45 1.98 -1.08 -0.66 -3.04 116.67 117.37 2fie s ASP 118 Ca 0.08 -1.90 0.28 0.00 -0.52 0.00 0.00 52.55 50.49 2fie s ASP 118 Cb -0.01 -1.74 1.35 0.00 -1.46 0.00 0.00 42.92 41.06 2fie s ASP 118 CO -0.05 -0.43 1.70 1.55 0.52 0.00 0.00 175.17 178.46 2fie h PRO 119 N 7.91 0.17 -0.19 4.34 0.13 -1.88 -3.04 132.00 139.44 2fie h PRO 119 Ca -0.12 -0.01 -0.18 0.00 -0.87 0.00 0.00 66.00 64.82 2fie h PRO 119 Cb 1.04 -0.04 -0.14 0.00 0.13 0.00 0.00 31.00 31.99 2fie h PRO 119 CO 0.61 0.11 -0.42 -0.11 -0.23 0.00 0.00 178.00 177.97 2fie n LEU 120 N -4.54 -2.74 -4.72 1.56 7.94 -1.26 -4.55 117.00 108.70 2fie n LEU 120 Ca 0.32 -2.94 -0.42 0.00 -1.11 0.00 0.00 56.01 51.85 2fie n LEU 120 Cb 1.24 0.78 -0.03 0.00 0.53 0.00 0.00 43.42 45.94 2fie n LEU 120 CO 0.27 1.90 1.30 -0.67 -1.11 0.00 0.00 177.39 179.09 2fie n ASP 121 N 1.90 3.83 0.00 1.96 2.03 0.94 -2.53 116.55 124.69 2fie n ASP 121 Ca 0.10 1.09 0.00 0.00 0.52 0.00 0.00 54.79 56.50 2fie n ASP 121 Cb 0.63 -1.56 0.00 0.00 -0.72 0.00 0.00 41.12 39.47 2fie n ASP 121 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2fie n GLY 122 N 3.29 0.84 0.31 0.27 0.00 -1.26 -2.56 105.19 106.08 2fie n GLY 122 Ca 0.14 -0.03 0.01 0.00 0.00 0.00 0.00 46.02 46.13 2fie n GLY 122 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2fie h SER 123 N 0.00 0.64 -0.77 1.61 0.02 -1.86 -2.22 113.55 110.98 2fie h SER 123 Ca 0.00 -0.06 0.22 0.00 -0.84 0.00 0.00 61.79 61.11 2fie h SER 123 Cb 0.00 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.34 2fie h SER 123 CO 0.00 0.56 0.58 0.77 -1.14 0.00 0.00 176.83 177.60 2fie h SER 124 N 0.72 0.00 -0.55 3.07 4.64 -1.93 0.48 113.55 119.97 2fie h SER 124 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 2fie h SER 124 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 2fie h SER 124 CO -0.02 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.53 2fie n ASN 125 N -4.19 3.54 0.00 4.97 4.13 -0.84 -4.58 115.26 118.29 2fie n ASN 125 Ca 0.15 -2.04 0.03 0.00 1.68 0.00 0.00 54.58 54.40 2fie n ASN 125 Cb 0.86 -0.38 0.16 0.00 -1.54 0.00 0.00 39.78 38.89 2fie n ASN 125 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2fie n ILE 126 N 1.08 0.00 -0.07 2.41 3.06 0.16 -2.40 119.36 123.59 2fie n ILE 126 Ca 0.19 0.00 -0.15 0.00 -2.50 0.00 0.00 62.75 60.29 2fie n ILE 126 Cb 0.55 -0.87 -0.05 0.00 0.54 0.00 0.00 39.64 39.82 2fie n ILE 126 CO 0.00 0.00 0.00 0.44 -2.50 0.00 0.00 176.55 174.49 2fie h ASP 127 N 0.00 0.90 -0.06 9.51 3.45 -1.81 -2.89 116.42 125.52 2fie h ASP 127 Ca 0.00 -0.54 0.00 0.00 0.43 0.00 0.00 57.03 56.92 2fie h ASP 127 Cb 0.00 -0.26 0.00 0.00 -0.56 0.00 0.00 39.33 38.51 2fie h ASP 127 CO 0.00 1.27 0.00 0.00 -1.57 0.00 0.00 179.24 178.94 2fie n LEU 129 N -0.38 -0.98 -4.72 0.00 4.77 -1.09 -5.00 117.00 109.59 2fie n LEU 129 Ca 0.14 0.11 -0.33 0.00 -0.03 0.00 0.00 56.01 55.90 2fie n LEU 129 Cb 0.15 -1.48 0.11 0.00 -2.33 0.00 0.00 43.42 39.86 2fie n LEU 129 CO 0.11 -0.28 0.74 0.54 -1.33 0.00 0.00 177.39 177.17 2fie s VAL 130 N -2.37 2.57 0.53 4.08 0.11 -1.25 -4.94 120.40 119.13 2fie s VAL 130 Ca 0.00 0.23 -0.22 0.00 -2.93 0.00 0.00 61.98 59.06 2fie s VAL 130 Cb 0.00 -2.63 -0.05 0.00 -1.53 0.00 0.00 36.38 32.16 2fie s VAL 130 CO 0.00 -0.20 1.36 -0.44 -3.33 0.00 0.00 175.10 172.50 2fie s SER 131 N -2.54 5.36 0.19 3.54 0.01 -1.26 -4.80 113.70 114.20 2fie s SER 131 Ca 0.69 2.77 -0.01 0.00 1.31 0.00 0.00 55.95 60.71 2fie s SER 131 Cb -0.24 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.31 2fie s SER 131 CO 0.50 -1.51 0.12 0.68 0.41 0.00 0.00 173.24 173.44 2fie s VAL 132 N -1.30 0.04 0.06 3.43 -7.23 -1.25 -4.78 120.40 109.37 2fie s VAL 132 Ca 0.70 -1.99 -0.27 0.00 -1.81 0.00 0.00 61.98 58.61 2fie s VAL 132 Cb -0.41 -2.44 0.09 0.00 0.56 0.00 0.00 36.38 34.18 2fie s VAL 132 CO 0.48 -0.07 1.01 -0.83 -0.31 0.00 0.00 175.10 175.39 2fie s GLY 133 N -3.15 -0.32 -0.13 2.32 0.00 -1.06 -0.79 107.32 104.18 2fie s GLY 133 Ca 0.37 0.53 -0.03 0.00 0.00 0.00 0.00 44.72 45.59 2fie s GLY 133 CO 0.11 0.14 -0.01 -1.59 0.00 0.00 0.00 173.10 171.74 2fie s THR 134 N -3.05 4.15 0.08 0.90 2.01 -0.02 -0.04 115.64 119.67 2fie s THR 134 Ca 0.10 -0.28 0.09 0.00 0.31 0.00 0.00 61.69 61.91 2fie s THR 134 Cb -0.00 -2.79 -0.04 0.00 0.01 0.00 0.00 72.50 69.68 2fie s THR 134 CO -0.02 0.53 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.59 2fie s ILE 135 N -0.12 2.51 -0.04 1.82 1.01 -1.15 -0.00 121.20 125.23 2fie s ILE 135 Ca 0.04 -1.46 -0.18 0.00 0.00 0.00 0.00 60.65 59.05 2fie s ILE 135 Cb -0.13 -2.08 0.03 0.00 0.01 0.00 0.00 42.46 40.30 2fie s ILE 135 CO 0.02 0.23 0.40 0.72 0.00 0.00 0.00 174.94 176.30 2fie s PHE 136 N -0.98 -0.31 -0.01 3.97 -0.12 -0.84 -1.65 117.98 118.04 2fie s PHE 136 Ca 0.15 0.55 0.00 0.00 -0.05 0.00 0.00 56.93 57.57 2fie s PHE 136 Cb -0.10 0.16 0.01 0.00 -0.63 0.00 0.00 43.02 42.46 2fie s PHE 136 CO 0.06 -0.41 0.00 0.20 -0.05 0.00 0.00 175.22 175.02 2fie s GLY 137 N -1.09 0.07 -0.24 1.99 0.00 -0.45 -1.40 107.32 106.18 2fie s GLY 137 Ca -0.11 0.05 0.02 0.00 0.00 0.00 0.00 44.72 44.68 2fie s GLY 137 CO 0.05 0.17 -0.12 -0.42 0.00 0.00 0.00 173.10 172.78 2fie s ILE 138 N 0.28 2.27 0.01 0.90 1.01 0.11 -1.34 121.20 124.44 2fie s ILE 138 Ca -0.02 -1.42 0.01 0.00 0.00 0.00 0.00 60.65 59.22 2fie s ILE 138 Cb -0.04 -2.24 -0.04 0.00 0.01 0.00 0.00 42.46 40.15 2fie s ILE 138 CO -0.01 0.11 0.06 -0.31 0.00 0.00 0.00 174.94 174.79 2fie s TYR 139 N 1.17 3.22 0.17 3.97 2.02 0.81 -0.38 117.35 128.33 2fie s TYR 139 Ca -0.05 0.16 -0.17 0.00 -0.37 0.00 0.00 57.07 56.63 2fie s TYR 139 Cb -0.18 -1.70 -0.07 0.00 -0.40 0.00 0.00 41.96 39.60 2fie s TYR 139 CO -0.06 0.53 0.63 0.50 -1.57 0.00 0.00 175.55 175.57 2fie s ARG 140 N -1.79 4.14 -0.16 -0.62 3.52 -1.26 0.05 118.95 122.82 2fie s ARG 140 Ca 0.23 0.70 -0.29 0.00 -0.13 0.00 0.00 55.73 56.24 2fie s ARG 140 Cb -0.12 -2.95 -0.01 0.00 -1.56 0.00 0.00 34.95 30.31 2fie s ARG 140 CO 0.14 0.46 1.15 0.21 -0.81 0.00 0.00 175.30 176.46 2fie s LYS 141 N -1.84 4.28 -0.09 5.12 2.20 -1.00 -4.84 119.74 123.58 2fie s LYS 141 Ca 0.39 1.54 -0.15 0.00 -0.36 0.00 0.00 55.97 57.38 2fie s LYS 141 Cb -0.16 -3.67 -0.12 0.00 -1.51 0.00 0.00 37.83 32.37 2fie s LYS 141 CO 0.20 -0.59 0.53 0.87 -0.36 0.00 0.00 175.35 176.00 2fie h LYS 142 N 7.71 -0.12 -7.44 4.03 6.56 -1.91 -3.48 116.57 121.91 2fie h LYS 142 Ca -0.26 0.01 -0.43 0.00 -1.06 0.00 0.00 60.65 58.91 2fie h LYS 142 Cb 1.10 0.03 0.17 0.00 -0.57 0.00 0.00 32.23 32.96 2fie h LYS 142 CO 0.95 0.27 0.20 -1.54 -2.06 0.00 0.00 179.45 177.27 2fie s SER 143 N -5.62 1.96 -0.08 0.86 1.04 -1.26 -4.99 113.70 105.62 2fie s SER 143 Ca -0.09 0.79 0.13 0.00 0.48 0.00 0.00 55.95 57.25 2fie s SER 143 Cb -0.00 -1.17 0.40 0.00 0.10 0.00 0.00 66.02 65.34 2fie s SER 143 CO 0.34 -3.49 1.32 0.35 0.98 0.00 0.00 173.24 172.74 2fie n THR 144 N -4.36 1.55 -2.17 2.02 -2.24 -1.26 -5.02 114.28 102.80 2fie n THR 144 Ca 0.10 -1.37 -0.30 0.00 -2.27 0.00 0.00 64.05 60.21 2fie n THR 144 Cb 0.59 0.18 0.00 0.00 -2.10 0.00 0.00 70.33 69.00 2fie n THR 144 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2fie s ASP 145 N -1.40 6.27 0.22 3.42 1.01 -1.26 -4.98 116.67 119.95 2fie s ASP 145 Ca 0.31 1.26 -0.32 0.00 0.71 0.00 0.00 52.55 54.51 2fie s ASP 145 Cb 0.21 -2.40 -0.14 0.00 1.01 0.00 0.00 42.92 41.60 2fie s ASP 145 CO 0.13 -0.75 1.35 1.21 0.21 0.00 0.00 175.17 177.32 2fie n GLU 146 N -2.49 1.80 -1.76 8.23 4.07 -1.26 -4.83 120.64 124.39 2fie n GLU 146 Ca 0.04 0.64 -0.41 0.00 -0.06 0.00 0.00 57.16 57.37 2fie n GLU 146 Cb 0.54 -2.26 -0.01 0.00 -0.06 0.00 0.00 31.44 29.66 2fie n GLU 146 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 2fie n PRO 147 N 2.03 2.73 -4.02 5.31 -0.04 -1.26 -4.98 135.00 134.76 2fie n PRO 147 Ca 0.13 0.96 -0.13 0.00 -0.04 0.00 0.00 63.50 64.42 2fie n PRO 147 Cb 0.29 -2.73 -0.02 0.00 -0.04 0.00 0.00 33.50 31.00 2fie n PRO 147 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2fie s SER 148 N 0.24 0.73 0.41 3.54 1.04 -1.26 -4.99 113.70 113.41 2fie s SER 148 Ca 0.59 -1.42 0.13 0.00 0.48 0.00 0.00 55.95 55.73 2fie s SER 148 Cb -0.48 0.71 0.97 0.00 0.10 0.00 0.00 66.02 67.32 2fie s SER 148 CO 0.55 -1.40 1.93 -0.08 0.98 0.00 0.00 173.24 175.22 2fie h GLU 149 N 2.07 0.49 -0.95 4.02 4.81 -1.94 -2.41 114.58 120.68 2fie h GLU 149 Ca -0.29 -0.03 0.25 0.00 -0.13 0.00 0.00 59.36 59.16 2fie h GLU 149 Cb 1.24 -0.11 -0.13 0.00 0.63 0.00 0.00 28.75 30.38 2fie h GLU 149 CO 0.39 0.32 0.47 0.87 -0.73 0.00 0.00 179.01 180.34 2fie h LYS 150 N 0.50 0.41 0.00 1.92 6.56 -1.96 -1.14 116.57 122.85 2fie h LYS 150 Ca 0.35 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.91 2fie h LYS 150 Cb 0.66 -0.09 0.00 0.00 -0.57 0.00 0.00 32.23 32.23 2fie h LYS 150 CO -0.12 0.27 0.00 -0.25 -2.06 0.00 0.00 179.45 177.29 2fie n ASP 151 N -5.02 0.34 -0.29 0.86 8.00 -0.90 -1.40 116.55 118.14 2fie n ASP 151 Ca 0.25 0.62 0.12 0.00 0.71 0.00 0.00 54.79 56.49 2fie n ASP 151 Cb 0.75 -0.68 0.23 0.00 -0.02 0.00 0.00 41.12 41.40 2fie n ASP 151 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2fie n ALA 152 N -1.65 3.36 -2.62 2.24 0.00 -0.43 -4.59 120.51 116.81 2fie n ALA 152 Ca 0.01 -0.48 -0.43 0.00 0.00 0.00 0.00 53.44 52.53 2fie n ALA 152 Cb 0.11 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.55 2fie n ALA 152 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2fie n LEU 153 N -0.58 5.55 -4.28 0.00 4.77 -0.49 -4.92 117.00 117.04 2fie n LEU 153 Ca 0.10 -4.30 -0.19 0.00 -0.03 0.00 0.00 56.01 51.59 2fie n LEU 153 Cb 0.38 -1.64 -0.11 0.00 -2.33 0.00 0.00 43.42 39.72 2fie n LEU 153 CO 0.28 0.71 -0.46 -1.10 -1.33 0.00 0.00 177.39 175.49 2fie s GLN 154 N 2.30 1.13 0.28 3.23 -0.21 -1.26 -4.77 119.66 120.37 2fie s GLN 154 Ca 0.46 -1.34 -0.29 0.00 0.02 0.00 0.00 55.36 54.21 2fie s GLN 154 Cb 0.03 -1.04 -0.09 0.00 1.00 0.00 0.00 33.01 32.90 2fie s GLN 154 CO 0.02 0.20 1.06 -1.25 -2.12 0.00 0.00 175.29 173.19 2fie s PRO 155 N -2.87 4.65 0.46 2.91 0.04 -1.26 -4.54 135.00 134.39 2fie s PRO 155 Ca 0.13 1.70 0.31 0.00 0.04 0.00 0.00 61.00 63.18 2fie s PRO 155 Cb -0.04 -3.14 1.42 0.00 0.04 0.00 0.00 34.50 32.77 2fie s PRO 155 CO 0.04 0.25 1.67 0.78 0.04 0.00 0.00 177.00 179.79 2fie h GLY 156 N 3.76 0.92 1.26 0.56 0.00 -1.63 0.48 103.07 108.43 2fie h GLY 156 Ca -0.46 -0.10 0.02 0.00 0.00 0.00 0.00 47.33 46.78 2fie h GLY 156 CO 0.67 -0.23 0.36 -0.09 0.00 0.00 0.00 176.54 177.24 2fie h ARG 157 N 0.13 0.00 -0.54 4.80 9.65 -0.86 -1.58 114.38 125.99 2fie h ARG 157 Ca 0.75 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.63 2fie h ARG 157 Cb 2.46 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 31.04 2fie h ARG 157 CO -0.28 0.00 0.00 0.09 2.80 0.00 0.00 179.97 182.58 2fie n ASN 158 N -2.99 3.19 -4.68 -3.80 3.02 0.17 -4.99 115.26 105.18 2fie n ASN 158 Ca -0.01 -1.98 -0.35 0.00 -0.03 0.00 0.00 54.58 52.22 2fie n ASN 158 Cb 0.42 -0.35 0.10 0.00 -0.61 0.00 0.00 39.78 39.34 2fie n ASN 158 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2fie n LEU 159 N 1.26 4.61 -0.04 3.41 4.77 -0.60 -4.46 117.00 125.95 2fie n LEU 159 Ca 0.20 0.67 -0.05 0.00 -0.03 0.00 0.00 56.01 56.80 2fie n LEU 159 Cb 0.52 -1.49 -0.06 0.00 -2.33 0.00 0.00 43.42 40.06 2fie n LEU 159 CO 0.14 -1.60 -0.79 0.52 -1.33 0.00 0.00 177.39 174.33 2fie n VAL 160 N -2.72 0.57 -3.59 4.08 0.31 0.49 -4.98 118.33 112.49 2fie n VAL 160 Ca 0.14 -0.31 -0.14 0.00 -0.01 0.00 0.00 64.34 64.03 2fie n VAL 160 Cb 0.49 -0.81 -0.06 0.00 -0.91 0.00 0.00 33.84 32.55 2fie n VAL 160 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2fie s ALA 161 N -2.20 -1.84 0.13 3.52 0.00 -1.17 -4.40 121.76 115.80 2fie s ALA 161 Ca -0.07 1.71 -0.18 0.00 0.00 0.00 0.00 51.96 53.42 2fie s ALA 161 Cb 0.03 -0.79 0.04 0.00 0.00 0.00 0.00 23.12 22.40 2fie s ALA 161 CO 0.30 -0.32 0.46 0.00 0.00 0.00 0.00 175.76 176.20 2fie s ALA 162 N -0.38 -1.12 0.00 0.00 0.00 -0.58 0.08 121.76 119.75 2fie s ALA 162 Ca -0.03 0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.05 2fie s ALA 162 Cb -0.03 0.73 0.00 0.00 0.00 0.00 0.00 23.12 23.82 2fie s ALA 162 CO 0.02 -0.67 0.00 0.41 0.00 0.00 0.00 175.76 175.52 2fie n GLY 163 N -0.24 0.75 3.61 0.00 0.00 -0.49 -0.17 105.19 108.65 2fie n GLY 163 Ca -0.16 -0.59 -0.08 0.00 0.00 0.00 0.00 46.02 45.19 2fie n GLY 163 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2fie s TYR 164 N -2.01 -0.29 -0.11 1.61 -0.85 -0.20 -1.98 117.35 113.53 2fie s TYR 164 Ca 0.00 0.57 -0.04 0.00 -0.52 0.00 0.00 57.07 57.09 2fie s TYR 164 Cb 0.00 0.44 -0.03 0.00 0.38 0.00 0.00 41.96 42.75 2fie s TYR 164 CO 0.00 -0.21 0.03 0.00 -1.52 0.00 0.00 175.55 173.85 2fie s ALA 165 N -0.63 3.40 -0.22 9.51 0.00 1.00 -0.14 121.76 134.68 2fie s ALA 165 Ca 0.03 -0.77 0.01 0.00 0.00 0.00 0.00 51.96 51.23 2fie s ALA 165 Cb -0.02 -1.63 0.03 0.00 0.00 0.00 0.00 23.12 21.50 2fie s ALA 165 CO -0.04 0.53 -0.14 -1.17 0.00 0.00 0.00 175.76 174.94 2fie s LEU 166 N -0.72 2.76 -1.09 0.00 2.96 0.12 -0.84 118.68 121.87 2fie s LEU 166 Ca 0.12 -0.90 -0.02 0.00 -0.22 0.00 0.00 54.13 53.11 2fie s LEU 166 Cb -0.12 -1.55 0.28 0.00 0.50 0.00 0.00 46.19 45.31 2fie s LEU 166 CO 0.02 -0.08 1.85 -1.22 -1.32 0.00 0.00 176.35 175.60 2fie n TYR 167 N 4.59 2.65 0.00 5.38 4.01 0.03 -1.76 117.16 132.05 2fie n TYR 167 Ca -0.18 -2.60 0.00 0.00 -0.16 0.00 0.00 57.90 54.96 2fie n TYR 167 Cb 0.47 -1.32 0.00 0.00 -0.31 0.00 0.00 39.34 38.18 2fie n TYR 167 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2fie n GLY 168 N 0.54 0.76 0.16 2.72 0.00 -1.26 -3.93 105.19 104.19 2fie n GLY 168 Ca 0.45 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.60 2fie n GLY 168 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2fie h SER 169 N 0.00 0.00 -5.07 1.61 4.64 -2.00 -3.44 113.55 109.30 2fie h SER 169 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 2fie h SER 169 Cb 0.00 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 61.92 2fie h SER 169 CO 0.00 0.00 -0.28 0.00 -0.87 0.00 0.00 176.83 175.68 2fie s ALA 170 N -3.21 -0.59 -0.34 5.18 0.00 -1.26 -5.14 121.76 116.40 2fie s ALA 170 Ca 0.08 -0.10 -0.13 0.00 0.00 0.00 0.00 51.96 51.81 2fie s ALA 170 Cb 0.09 0.34 -0.02 0.00 0.00 0.00 0.00 23.12 23.53 2fie s ALA 170 CO 0.60 -0.42 0.26 0.99 0.00 0.00 0.00 175.76 177.19 2fie s THR 171 N -2.69 5.27 0.05 0.00 2.01 -1.26 -4.50 115.64 114.51 2fie s THR 171 Ca -0.04 -0.18 0.08 0.00 0.31 0.00 0.00 61.69 61.86 2fie s THR 171 Cb -0.00 -3.74 -0.03 0.00 0.01 0.00 0.00 72.50 68.74 2fie s THR 171 CO -0.04 -0.03 -0.22 -0.32 -0.69 0.00 0.00 174.62 173.32 2fie s MET 172 N 1.77 1.46 -0.13 4.92 -2.45 -0.72 -0.77 119.30 123.37 2fie s MET 172 Ca 0.07 -1.00 0.01 0.00 -1.25 0.00 0.00 55.69 53.52 2fie s MET 172 Cb -0.17 -1.61 -0.01 0.00 1.25 0.00 0.00 34.83 34.30 2fie s MET 172 CO 0.11 0.41 -0.16 -1.17 1.05 0.00 0.00 175.02 175.25 2fie s LEU 173 N -1.25 2.47 -0.21 4.11 0.20 0.64 0.11 118.68 124.75 2fie s LEU 173 Ca 0.08 -0.44 -0.05 0.00 0.69 0.00 0.00 54.13 54.41 2fie s LEU 173 Cb -0.09 -1.55 -0.02 0.00 -0.43 0.00 0.00 46.19 44.10 2fie s LEU 173 CO 0.02 0.13 0.00 -0.69 -0.29 0.00 0.00 176.35 175.52 2fie s VAL 174 N 0.56 3.95 -0.15 1.68 1.01 0.81 -0.13 120.40 128.14 2fie s VAL 174 Ca -0.10 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.57 2fie s VAL 174 Cb -0.16 -2.79 -0.00 0.00 0.00 0.00 0.00 36.38 33.42 2fie s VAL 174 CO 0.04 0.42 -0.16 -0.22 0.00 0.00 0.00 175.10 175.18 2fie s LEU 175 N 1.07 2.48 -0.13 3.92 2.96 -0.08 -1.03 118.68 127.87 2fie s LEU 175 Ca 0.02 -0.46 0.03 0.00 -0.22 0.00 0.00 54.13 53.50 2fie s LEU 175 Cb -0.14 -1.56 0.01 0.00 0.50 0.00 0.00 46.19 45.00 2fie s LEU 175 CO 0.02 0.10 -0.22 0.00 -1.32 0.00 0.00 176.35 174.93 2fie s ALA 176 N 0.70 2.15 0.00 5.97 0.00 0.76 -0.57 121.76 130.78 2fie s ALA 176 Ca -0.07 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 50.87 2fie s ALA 176 Cb -0.16 -0.92 0.00 0.00 0.00 0.00 0.00 23.12 22.04 2fie s ALA 176 CO 0.02 0.05 0.00 -1.33 0.00 0.00 0.00 175.76 174.49 2fie n MET 177 N 3.94 0.89 -0.03 0.00 2.81 0.36 -1.53 117.12 123.55 2fie n MET 177 Ca -0.20 0.00 -0.09 0.00 -1.81 0.00 0.00 57.70 55.60 2fie n MET 177 Cb 0.52 0.00 -0.03 0.00 -0.71 0.00 0.00 33.22 33.00 2fie n MET 177 CO 0.00 0.00 0.00 0.22 1.51 0.00 0.00 175.97 177.70 2fie h ASP 178 N 0.00 -0.04 0.32 7.83 -0.00 -1.96 -2.63 116.42 119.94 2fie h ASP 178 Ca 0.00 0.04 -0.03 0.00 -0.00 0.00 0.00 57.03 57.04 2fie h ASP 178 Cb 0.00 0.06 -0.00 0.00 -0.00 0.00 0.00 39.33 39.39 2fie h ASP 178 CO 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 179.24 179.10 2fie n GLY 180 N -0.76 -0.03 3.51 0.00 0.00 -0.99 -5.03 105.19 101.89 2fie n GLY 180 Ca -0.02 -1.43 -0.32 0.00 0.00 0.00 0.00 46.02 44.25 2fie n GLY 180 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fie s VAL 181 N -2.92 3.19 -0.04 1.61 1.01 -1.26 -0.49 120.40 121.51 2fie s VAL 181 Ca 0.00 -0.86 -0.03 0.00 0.00 0.00 0.00 61.98 61.09 2fie s VAL 181 Cb 0.00 -2.32 0.02 0.00 0.00 0.00 0.00 36.38 34.08 2fie s VAL 181 CO 0.00 0.46 0.10 0.20 0.00 0.00 0.00 175.10 175.86 2fie s ASN 182 N -1.14 -0.08 -0.18 3.32 0.01 0.27 -0.92 114.94 116.20 2fie s ASN 182 Ca 0.14 0.19 -0.08 0.00 -0.71 0.00 0.00 52.86 52.41 2fie s ASN 182 Cb -0.11 0.16 -0.04 0.00 0.41 0.00 0.00 41.25 41.67 2fie s ASN 182 CO 0.04 -0.07 0.07 0.00 -1.51 0.00 0.00 177.10 175.63 2fie s PHE 184 N 0.40 2.64 -0.19 0.00 0.40 0.82 -1.69 117.98 120.37 2fie s PHE 184 Ca 0.03 -0.85 -0.14 0.00 -0.60 0.00 0.00 56.93 55.37 2fie s PHE 184 Cb -0.12 -1.74 -0.04 0.00 0.51 0.00 0.00 43.02 41.62 2fie s PHE 184 CO 0.00 -0.31 0.29 1.41 0.70 0.00 0.00 175.22 177.32 2fie s MET 185 N 0.27 4.20 -0.37 0.44 1.75 -0.23 -0.26 119.30 125.09 2fie s MET 185 Ca -0.14 0.05 -0.26 0.00 -1.25 0.00 0.00 55.69 54.08 2fie s MET 185 Cb -0.17 -3.48 0.02 0.00 2.84 0.00 0.00 34.83 34.04 2fie s MET 185 CO 0.07 0.12 0.96 -1.17 -0.65 0.00 0.00 175.02 174.35 2fie s LEU 186 N 0.84 3.97 -0.87 4.11 2.96 0.05 -0.04 118.68 129.70 2fie s LEU 186 Ca 0.15 0.64 -0.20 0.00 -0.22 0.00 0.00 54.13 54.50 2fie s LEU 186 Cb -0.13 -3.32 0.11 0.00 0.50 0.00 0.00 46.19 43.35 2fie s LEU 186 CO 0.05 -0.88 1.10 -0.62 -1.32 0.00 0.00 176.35 174.67 2fie s ASP 187 N 1.88 6.51 0.44 3.68 -1.08 -0.50 -4.66 116.67 122.94 2fie s ASP 187 Ca 0.40 -1.77 0.18 0.00 -0.52 0.00 0.00 52.55 50.84 2fie s ASP 187 Cb -0.12 -2.41 0.96 0.00 -1.46 0.00 0.00 42.92 39.89 2fie s ASP 187 CO 0.19 -1.17 1.47 1.55 0.52 0.00 0.00 175.17 177.73 2fie h PRO 188 N 9.06 0.00 0.12 4.34 0.13 -1.93 -1.68 132.00 142.03 2fie h PRO 188 Ca 0.05 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.90 2fie h PRO 188 Cb 1.04 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.19 2fie h PRO 188 CO 1.14 0.00 -1.15 0.00 -0.23 0.00 0.00 178.00 177.76 2fie h ALA 189 N 1.18 -0.02 -0.06 -0.56 0.00 -1.95 -3.35 119.26 114.50 2fie h ALA 189 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.16 2fie h ALA 189 Cb 0.68 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2fie h ALA 189 CO 0.00 0.61 0.00 0.44 0.00 0.00 0.00 179.25 180.30 2fie n ILE 190 N -3.87 0.10 -3.45 0.00 -5.35 -0.92 -5.00 119.36 100.87 2fie n ILE 190 Ca -0.14 -0.55 -0.20 0.00 -0.27 0.00 0.00 62.75 61.59 2fie n ILE 190 Cb 0.94 1.23 0.07 0.00 -1.74 0.00 0.00 39.64 40.15 2fie n ILE 190 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2fie n GLY 191 N 0.84 -0.37 3.10 3.28 0.00 -0.68 -5.02 105.19 106.33 2fie n GLY 191 Ca 0.09 0.14 -0.12 0.00 0.00 0.00 0.00 46.02 46.13 2fie n GLY 191 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2fie s GLU 192 N -6.00 0.62 -0.28 1.61 2.56 -1.23 -5.01 118.70 110.97 2fie s GLU 192 Ca 0.43 -0.96 -0.16 0.00 0.00 0.00 0.00 54.97 54.28 2fie s GLU 192 Cb -0.19 -0.23 -0.03 0.00 2.00 0.00 0.00 34.13 35.68 2fie s GLU 192 CO 0.65 0.02 0.44 -0.06 -0.56 0.00 0.00 175.26 175.75 2fie s PHE 193 N -2.21 3.24 -0.26 5.30 0.08 -1.26 -1.41 117.98 121.46 2fie s PHE 193 Ca -0.02 0.44 -0.12 0.00 0.12 0.00 0.00 56.93 57.35 2fie s PHE 193 Cb -0.04 -2.67 -0.05 0.00 -0.57 0.00 0.00 43.02 39.69 2fie s PHE 193 CO -0.02 -0.29 0.21 0.42 -0.10 0.00 0.00 175.22 175.44 2fie s ILE 194 N 2.19 5.31 0.00 0.64 1.09 0.94 -1.54 121.20 129.83 2fie s ILE 194 Ca 0.17 0.25 -0.30 0.00 -1.10 0.00 0.00 60.65 59.67 2fie s ILE 194 Cb -0.16 -3.55 -0.08 0.00 -1.06 0.00 0.00 42.46 37.62 2fie s ILE 194 CO 0.10 0.27 1.90 -0.22 -0.10 0.00 0.00 174.94 176.90 2fie s LEU 195 N 1.52 4.36 0.00 2.97 2.96 0.11 -1.07 118.68 129.53 2fie s LEU 195 Ca 0.09 2.53 0.00 0.00 -0.22 0.00 0.00 54.13 56.53 2fie s LEU 195 Cb -0.15 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.01 2fie s LEU 195 CO 0.08 -1.07 0.61 1.33 -1.32 0.00 0.00 176.35 175.99 2fie n VAL 196 N 5.64 0.27 -3.17 1.68 0.24 -0.68 -4.73 118.33 117.58 2fie n VAL 196 Ca 0.20 -0.60 0.02 0.00 -2.04 0.00 0.00 64.34 61.92 2fie n VAL 196 Cb 0.42 0.92 -0.01 0.00 -1.47 0.00 0.00 33.84 33.70 2fie n VAL 196 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2fie s ASP 197 N -0.27 -1.40 0.32 -1.34 1.11 -1.18 -4.99 116.67 108.92 2fie s ASP 197 Ca 0.00 0.06 -0.25 0.00 0.18 0.00 0.00 52.55 52.54 2fie s ASP 197 Cb 0.00 1.93 -0.10 0.00 1.07 0.00 0.00 42.92 45.82 2fie s ASP 197 CO 0.00 -0.30 0.92 -0.54 1.18 0.00 0.00 175.17 176.43 2fie s LYS 198 N 2.73 4.52 -0.46 8.23 1.02 -1.26 -2.13 119.74 132.39 2fie s LYS 198 Ca 0.10 1.26 -0.00 0.00 0.02 0.00 0.00 55.97 57.35 2fie s LYS 198 Cb -0.10 -2.76 0.00 0.00 -0.52 0.00 0.00 37.83 34.45 2fie s LYS 198 CO -0.25 0.27 0.33 -0.25 -0.92 0.00 0.00 175.35 174.53 2fie n ASP 199 N 0.49 -2.64 -4.75 2.83 9.92 -1.08 -4.84 116.55 116.47 2fie n ASP 199 Ca 0.02 -0.55 -0.36 0.00 -0.53 0.00 0.00 54.79 53.37 2fie n ASP 199 Cb 0.50 -0.88 0.04 0.00 -0.64 0.00 0.00 41.12 40.15 2fie n ASP 199 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2fie s VAL 200 N -2.55 2.55 -0.09 2.53 1.01 -0.10 -4.88 120.40 118.88 2fie s VAL 200 Ca 0.00 0.34 -0.08 0.00 0.00 0.00 0.00 61.98 62.24 2fie s VAL 200 Cb -0.00 -3.10 0.02 0.00 0.00 0.00 0.00 36.38 33.30 2fie s VAL 200 CO 0.50 -0.08 0.23 -0.75 0.00 0.00 0.00 175.10 175.00 2fie s LYS 201 N -3.40 0.26 0.25 2.72 2.20 -1.26 -4.42 119.74 116.08 2fie s LYS 201 Ca 0.77 0.34 -0.04 0.00 -0.36 0.00 0.00 55.97 56.69 2fie s LYS 201 Cb -0.31 0.11 -0.05 0.00 -1.51 0.00 0.00 37.83 36.07 2fie s LYS 201 CO 0.35 -0.04 0.49 -1.50 -0.36 0.00 0.00 175.35 174.29 2fie s ILE 202 N 0.22 5.08 0.31 5.43 2.07 0.20 -5.01 121.20 129.51 2fie s ILE 202 Ca -0.01 -0.05 -0.28 0.00 -1.41 0.00 0.00 60.65 58.91 2fie s ILE 202 Cb -0.02 -3.72 -0.13 0.00 0.13 0.00 0.00 42.46 38.72 2fie s ILE 202 CO -0.00 -0.24 1.13 0.29 -1.91 0.00 0.00 174.94 174.21 2fie n LYS 203 N -0.73 1.68 0.25 3.50 5.02 -1.26 -4.82 118.16 121.81 2fie n LYS 203 Ca -0.02 0.59 0.09 0.00 -2.02 0.00 0.00 58.31 56.95 2fie n LYS 203 Cb 0.54 -2.05 0.68 0.00 -0.02 0.00 0.00 35.03 34.17 2fie n LYS 203 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 2fie h LYS 204 N 2.24 0.00 -2.22 1.97 3.64 -1.97 -3.39 116.57 116.84 2fie h LYS 204 Ca -0.42 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 58.89 2fie h LYS 204 Cb 1.32 0.00 -0.21 0.00 -0.41 0.00 0.00 32.23 32.92 2fie h LYS 204 CO 0.61 0.00 0.03 0.21 -2.27 0.00 0.00 179.45 178.04 2fie s LYS 205 N -5.01 0.78 0.00 1.90 2.20 -1.26 -1.91 119.74 116.44 2fie s LYS 205 Ca -0.05 0.73 0.00 0.00 -0.36 0.00 0.00 55.97 56.29 2fie s LYS 205 Cb 0.17 0.38 0.00 0.00 -1.51 0.00 0.00 37.83 36.87 2fie s LYS 205 CO 0.66 -0.13 0.00 0.41 -0.36 0.00 0.00 175.35 175.93 2fie n GLY 206 N 2.38 5.58 0.41 5.54 0.00 -1.26 -4.72 105.19 113.11 2fie n GLY 206 Ca -0.15 -2.11 0.03 0.00 0.00 0.00 0.00 46.02 43.79 2fie n GLY 206 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2fie n LYS 207 N -0.06 0.33 -4.45 1.61 5.02 -1.26 -4.69 118.16 114.65 2fie n LYS 207 Ca 0.00 -1.42 -0.23 0.00 -2.02 0.00 0.00 58.31 54.64 2fie n LYS 207 Cb 0.00 -0.75 -0.16 0.00 -0.02 0.00 0.00 35.03 34.10 2fie n LYS 207 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2fie s ILE 208 N -0.73 0.93 -0.09 -0.18 1.01 -1.26 0.91 121.20 121.79 2fie s ILE 208 Ca 0.09 -0.37 0.01 0.00 0.00 0.00 0.00 60.65 60.38 2fie s ILE 208 Cb 0.08 -0.87 -0.02 0.00 0.01 0.00 0.00 42.46 41.65 2fie s ILE 208 CO 0.00 0.31 -0.11 -0.72 0.00 0.00 0.00 174.94 174.43 2fie s TYR 209 N 0.67 2.84 -0.15 3.97 1.13 -0.53 -0.71 117.35 124.57 2fie s TYR 209 Ca -0.13 -0.24 0.00 0.00 -1.41 0.00 0.00 57.07 55.30 2fie s TYR 209 Cb -0.15 -1.75 0.02 0.00 -1.10 0.00 0.00 41.96 38.99 2fie s TYR 209 CO 0.02 0.10 -0.13 0.45 -2.51 0.00 0.00 175.55 173.49 2fie s SER 210 N -0.35 2.73 -0.14 -0.18 0.15 0.18 -3.00 113.70 113.08 2fie s SER 210 Ca 0.04 -0.52 -0.30 0.00 0.70 0.00 0.00 55.95 55.87 2fie s SER 210 Cb -0.12 -1.16 0.13 0.00 -1.71 0.00 0.00 66.02 63.16 2fie s SER 210 CO 0.02 -0.07 1.02 -1.48 1.20 0.00 0.00 173.24 173.93 2fie s LEU 211 N 1.50 -0.32 -0.55 3.45 2.34 -1.26 0.97 118.68 124.81 2fie s LEU 211 Ca 0.04 0.26 -0.28 0.00 0.06 0.00 0.00 54.13 54.20 2fie s LEU 211 Cb -0.13 1.79 0.03 0.00 -0.56 0.00 0.00 46.19 47.32 2fie s LEU 211 CO -0.10 -0.36 1.20 0.21 -1.06 0.00 0.00 176.35 176.23 2fie s ASN 212 N -1.48 6.48 -0.01 1.48 3.84 -1.26 -4.87 114.94 119.11 2fie s ASN 212 Ca 0.01 0.23 0.06 0.00 0.21 0.00 0.00 52.86 53.38 2fie s ASN 212 Cb -0.01 -2.55 0.20 0.00 -0.55 0.00 0.00 41.25 38.34 2fie s ASN 212 CO -0.02 -1.44 1.11 -0.62 -2.79 0.00 0.00 177.10 173.35 2fie n GLU 213 N 8.29 1.60 0.24 0.43 1.02 -1.26 -3.31 120.64 127.66 2fie n GLU 213 Ca 0.10 -0.79 0.14 0.00 -0.02 0.00 0.00 57.16 56.58 2fie n GLU 213 Cb 0.49 -1.26 0.38 0.00 -0.02 0.00 0.00 31.44 31.03 2fie n GLU 213 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2fie h GLY 214 N 5.40 0.00 -1.92 0.62 0.00 -2.06 -2.90 103.07 102.21 2fie h GLY 214 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2fie h GLY 214 CO 0.02 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.84 2fie n TYR 215 N -3.12 0.82 -0.23 5.60 0.53 -1.21 -4.47 117.16 115.09 2fie n TYR 215 Ca 0.02 -0.33 0.03 0.00 -1.02 0.00 0.00 57.90 56.60 2fie n TYR 215 Cb 0.45 -0.14 0.12 0.00 -1.03 0.00 0.00 39.34 38.74 2fie n TYR 215 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2fie h ALA 216 N 3.50 0.68 -1.05 -0.72 0.00 -1.75 0.13 119.26 120.04 2fie h ALA 216 Ca 0.00 0.21 0.28 0.00 0.00 0.00 0.00 54.91 55.40 2fie h ALA 216 Cb 0.89 0.36 -0.09 0.00 0.00 0.00 0.00 17.79 18.95 2fie h ALA 216 CO 0.12 -0.40 0.69 -0.22 0.00 0.00 0.00 179.25 179.44 2fie h LYS 217 N 0.12 0.32 -0.02 0.00 3.64 -1.87 -2.05 116.57 116.70 2fie h LYS 217 Ca 0.36 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.72 2fie h LYS 217 Cb 0.60 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 2fie h LYS 217 CO -0.58 0.21 -0.28 -0.25 -2.27 0.00 0.00 179.45 176.28 2fie n ASP 218 N -4.56 2.11 -4.66 4.20 8.00 0.38 -5.00 116.55 117.01 2fie n ASP 218 Ca 0.25 -1.55 -0.36 0.00 0.71 0.00 0.00 54.79 53.84 2fie n ASP 218 Cb 0.93 0.32 0.08 0.00 -0.02 0.00 0.00 41.12 42.44 2fie n ASP 218 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2fie n PHE 219 N 0.32 1.19 -2.09 1.24 3.72 -0.71 -4.47 117.46 116.66 2fie n PHE 219 Ca 0.09 0.41 -0.29 0.00 -0.05 0.00 0.00 57.45 57.61 2fie n PHE 219 Cb 0.44 -2.15 0.03 0.00 -0.94 0.00 0.00 39.48 36.85 2fie n PHE 219 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 2fie s ASP 220 N -1.59 5.79 0.27 4.37 1.47 -1.26 -4.89 116.67 120.83 2fie s ASP 220 Ca 0.77 1.09 -0.03 0.00 1.18 0.00 0.00 52.55 55.55 2fie s ASP 220 Cb -0.36 -2.06 0.37 0.00 -0.34 0.00 0.00 42.92 40.53 2fie s ASP 220 CO 0.47 -1.06 1.93 1.55 0.68 0.00 0.00 175.17 178.74 2fie h PRO 221 N -0.35 1.19 -0.78 2.11 0.13 -1.99 -2.37 132.00 129.94 2fie h PRO 221 Ca -0.45 -0.07 0.12 0.00 -0.87 0.00 0.00 66.00 64.73 2fie h PRO 221 Cb 1.23 -0.27 -0.08 0.00 0.13 0.00 0.00 31.00 32.01 2fie h PRO 221 CO 0.62 0.79 0.39 0.00 -0.23 0.00 0.00 178.00 179.57 2fie h ALA 222 N 1.43 1.12 -0.02 -0.56 0.00 -1.92 -1.10 119.26 118.21 2fie h ALA 222 Ca 0.36 0.07 -0.18 0.00 0.00 0.00 0.00 54.91 55.16 2fie h ALA 222 Cb -0.07 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2fie h ALA 222 CO -0.09 -0.07 -0.78 0.28 0.00 0.00 0.00 179.25 178.59 2fie h VAL 223 N 0.61 1.46 -0.51 0.00 2.07 -1.89 -2.98 116.25 115.01 2fie h VAL 223 Ca 0.40 -2.38 -0.09 0.00 0.82 0.00 0.00 66.70 65.45 2fie h VAL 223 Cb 0.51 2.29 -0.02 0.00 -1.52 0.00 0.00 31.29 32.55 2fie h VAL 223 CO -0.32 0.70 -0.04 0.74 0.02 0.00 0.00 177.57 178.67 2fie h THR 224 N 0.13 1.27 -0.36 2.57 2.02 -0.82 -2.37 112.91 115.35 2fie h THR 224 Ca -0.03 -1.15 -0.04 0.00 0.77 0.00 0.00 66.41 65.96 2fie h THR 224 Cb 1.36 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 68.74 2fie h THR 224 CO 0.12 0.40 0.07 -0.08 0.37 0.00 0.00 175.52 176.40 2fie h GLU 225 N 0.78 0.60 -0.06 6.66 4.81 -1.27 -2.04 114.58 124.06 2fie h GLU 225 Ca 0.14 -0.16 0.04 0.00 -0.13 0.00 0.00 59.36 59.25 2fie h GLU 225 Cb 0.58 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.84 2fie h GLU 225 CO 0.03 0.66 -0.19 -0.92 -0.73 0.00 0.00 179.01 177.86 2fie h TYR 226 N 0.44 -0.50 -0.44 0.92 3.20 -1.41 -0.04 116.97 119.15 2fie h TYR 226 Ca 0.11 0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.08 2fie h TYR 226 Cb 0.34 0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.82 2fie h TYR 226 CO 0.02 -0.27 0.30 0.82 -1.64 0.00 0.00 178.16 177.39 2fie h ILE 227 N -0.28 0.92 -0.37 1.81 1.08 -1.34 -0.96 117.51 118.38 2fie h ILE 227 Ca 0.08 -0.10 -0.04 0.00 -0.39 0.00 0.00 64.86 64.41 2fie h ILE 227 Cb 0.39 0.62 -0.01 0.00 -3.07 0.00 0.00 36.82 34.74 2fie h ILE 227 CO -0.22 0.05 0.09 1.56 -0.69 0.00 0.00 178.15 178.93 2fie h GLN 228 N 0.28 0.59 0.00 2.37 1.08 -0.31 -2.61 115.11 116.51 2fie h GLN 228 Ca 0.20 -0.14 0.00 0.00 -1.45 0.00 0.00 58.65 57.25 2fie h GLN 228 Cb 0.42 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.77 2fie h GLN 228 CO -0.04 0.63 0.00 0.54 -0.95 0.00 0.00 178.83 179.01 2fie n ARG 229 N -4.59 0.05 0.00 1.46 1.74 -0.38 -0.85 116.66 114.09 2fie n ARG 229 Ca -0.01 0.37 -0.18 0.00 -0.77 0.00 0.00 57.85 57.26 2fie n ARG 229 Cb 0.20 -1.61 -0.14 0.00 -1.02 0.00 0.00 32.46 29.89 2fie n ARG 229 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2fie h LYS 230 N 0.00 0.20 0.05 5.56 1.79 -1.25 -2.26 116.57 120.66 2fie h LYS 230 Ca 0.00 -0.34 -0.23 0.00 -2.18 0.00 0.00 60.65 57.89 2fie h LYS 230 Cb 0.20 0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 30.98 2fie h LYS 230 CO 0.00 1.02 -1.03 0.87 -1.08 0.00 0.00 179.45 179.23 2fie h LYS 231 N 0.05 0.29 -2.09 3.15 1.57 -1.28 -2.13 116.57 116.14 2fie h LYS 231 Ca -0.38 -0.38 -0.58 0.00 -1.87 0.00 0.00 60.65 57.45 2fie h LYS 231 Cb 2.03 0.12 -0.40 0.00 0.08 0.00 0.00 32.23 34.06 2fie h LYS 231 CO 0.09 1.10 -0.88 1.19 -0.57 0.00 0.00 179.45 180.38 2fie n PHE 232 N -3.64 1.46 -1.65 -1.35 3.72 -0.03 -4.73 117.46 111.24 2fie n PHE 232 Ca -0.06 -3.83 -0.56 0.00 -0.05 0.00 0.00 57.45 52.95 2fie n PHE 232 Cb 0.90 -0.44 -0.07 0.00 -0.94 0.00 0.00 39.48 38.92 2fie n PHE 232 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 2fie n PRO 233 N 1.09 1.01 -0.25 -1.08 -0.04 -0.85 -4.50 135.00 130.39 2fie n PRO 233 Ca 0.25 0.37 0.24 0.00 -0.04 0.00 0.00 63.50 64.32 2fie n PRO 233 Cb 0.48 -2.01 0.58 0.00 -0.04 0.00 0.00 33.50 32.51 2fie n PRO 233 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 2fie h PRO 234 N 5.65 0.27 -0.98 0.54 0.13 -1.94 0.13 132.00 135.81 2fie h PRO 234 Ca -0.47 -0.02 -0.67 0.00 -0.87 0.00 0.00 66.00 63.97 2fie h PRO 234 Cb 1.34 -0.06 -0.30 0.00 0.13 0.00 0.00 31.00 32.10 2fie h PRO 234 CO 0.86 0.18 0.72 -0.40 -0.23 0.00 0.00 178.00 179.13 2fie n ASP 235 N -4.46 7.46 -1.83 1.44 5.75 -1.26 -4.90 116.55 118.75 2fie n ASP 235 Ca 0.21 -3.79 -0.02 0.00 -0.01 0.00 0.00 54.79 51.18 2fie n ASP 235 Cb 0.85 -0.92 -0.00 0.00 -1.03 0.00 0.00 41.12 40.01 2fie n ASP 235 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2fie n ASN 236 N -0.90 -0.64 -2.36 -1.12 2.85 0.46 -4.86 115.26 108.69 2fie n ASN 236 Ca 0.61 0.19 -0.02 0.00 -0.11 0.00 0.00 54.58 55.26 2fie n ASN 236 Cb 0.69 -0.62 0.01 0.00 1.24 0.00 0.00 39.78 41.10 2fie n ASN 236 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 2fie n SER 237 N -0.90 -0.60 -4.73 1.20 3.41 -1.26 -4.98 113.62 105.76 2fie n SER 237 Ca 0.01 -0.75 -0.41 0.00 -0.26 0.00 0.00 58.87 57.46 2fie n SER 237 Cb 0.29 -0.05 -0.05 0.00 -0.26 0.00 0.00 64.21 64.14 2fie n SER 237 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2fie s ALA 238 N -3.43 3.26 0.61 7.33 0.00 -1.26 -4.65 121.76 123.61 2fie s ALA 238 Ca 0.04 0.57 -0.19 0.00 0.00 0.00 0.00 51.96 52.39 2fie s ALA 238 Cb -0.00 -3.26 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 2fie s ALA 238 CO 0.03 0.01 1.07 -2.30 0.00 0.00 0.00 175.76 174.57 2fie n PRO 239 N 2.60 1.00 -2.23 0.00 -0.02 -1.26 -4.90 135.00 130.18 2fie n PRO 239 Ca 0.02 0.39 -0.31 0.00 -2.02 0.00 0.00 63.50 61.57 2fie n PRO 239 Cb 0.49 -2.28 -0.01 0.00 -0.02 0.00 0.00 33.50 31.68 2fie n PRO 239 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2fie s TYR 240 N -1.47 3.54 0.36 6.00 1.51 -0.80 -5.05 117.35 121.45 2fie s TYR 240 Ca 0.77 1.31 -0.09 0.00 -1.01 0.00 0.00 57.07 58.06 2fie s TYR 240 Cb -0.41 -2.70 -0.06 0.00 -0.11 0.00 0.00 41.96 38.68 2fie s TYR 240 CO 0.46 -0.47 0.69 0.20 -1.11 0.00 0.00 175.55 175.32 2fie s GLY 241 N -3.61 1.91 -0.19 0.71 0.00 0.26 -4.84 107.32 101.56 2fie s GLY 241 Ca 0.56 -0.33 -0.03 0.00 0.00 0.00 0.00 44.72 44.92 2fie s GLY 241 CO 0.42 -0.17 -0.05 0.00 0.00 0.00 0.00 173.10 173.30 2fie s ALA 242 N -2.27 2.83 -0.05 3.20 0.00 -1.26 -1.45 121.76 122.76 2fie s ALA 242 Ca 0.49 -1.05 -0.01 0.00 0.00 0.00 0.00 51.96 51.38 2fie s ALA 242 Cb -0.10 -1.61 0.03 0.00 0.00 0.00 0.00 23.12 21.43 2fie s ALA 242 CO 0.31 -0.20 0.02 1.03 0.00 0.00 0.00 175.76 176.92 2fie s ARG 243 N 1.08 0.30 -0.16 0.00 1.81 -1.16 -5.00 118.95 115.82 2fie s ARG 243 Ca 0.01 0.20 -0.04 0.00 -1.72 0.00 0.00 55.73 54.18 2fie s ARG 243 Cb -0.15 -0.72 0.07 0.00 -0.45 0.00 0.00 34.95 33.70 2fie s ARG 243 CO -0.00 -0.29 0.15 -0.47 -0.68 0.00 0.00 175.30 174.01 2fie s TYR 244 N 1.89 -0.05 -0.02 -0.53 5.04 -1.26 -4.33 117.35 118.09 2fie s TYR 244 Ca 0.03 0.07 -0.05 0.00 -2.44 0.00 0.00 57.07 54.68 2fie s TYR 244 Cb -0.12 -0.49 -0.28 0.00 0.35 0.00 0.00 41.96 41.42 2fie s TYR 244 CO -0.04 -0.49 0.77 0.28 -1.34 0.00 0.00 175.55 174.73 2fie h VAL 245 N 6.37 1.05 0.00 3.14 2.07 -1.98 -3.48 116.25 123.42 2fie h VAL 245 Ca -0.15 -2.69 0.00 0.00 0.82 0.00 0.00 66.70 64.68 2fie h VAL 245 Cb 1.14 2.73 0.00 0.00 -1.52 0.00 0.00 31.29 33.64 2fie h VAL 245 CO 0.25 0.82 0.00 0.61 0.02 0.00 0.00 177.57 179.27 2fie n GLY 246 N 1.73 0.77 2.83 2.17 0.00 -1.26 -5.01 105.19 106.43 2fie n GLY 246 Ca -0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 2fie n GLY 246 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2fie s SER 247 N -2.42 3.51 0.11 1.61 0.15 -1.26 -4.96 113.70 110.45 2fie s SER 247 Ca 0.00 -1.12 -0.22 0.00 0.70 0.00 0.00 55.95 55.31 2fie s SER 247 Cb 0.00 -0.90 -0.05 0.00 -1.71 0.00 0.00 66.02 63.36 2fie s SER 247 CO 0.00 -0.29 1.21 0.80 1.20 0.00 0.00 173.24 176.16 2fie n MET 248 N 4.84 -0.31 -0.36 5.44 1.56 -1.26 -0.13 117.12 126.89 2fie n MET 248 Ca -0.09 1.19 0.32 0.00 -0.27 0.00 0.00 57.70 58.85 2fie n MET 248 Cb 0.45 -1.75 0.66 0.00 2.15 0.00 0.00 33.22 34.73 2fie n MET 248 CO 0.00 0.00 0.00 0.28 -0.73 0.00 0.00 175.97 175.52 2fie h VAL 249 N 0.00 0.38 0.07 1.12 2.07 -1.94 0.37 116.25 118.32 2fie h VAL 249 Ca 0.11 -0.05 -0.20 0.00 0.82 0.00 0.00 66.70 67.38 2fie h VAL 249 Cb 0.29 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 2fie h VAL 249 CO -0.67 0.03 -1.05 0.00 0.02 0.00 0.00 177.57 175.90 2fie h ALA 250 N 1.48 0.14 0.00 1.67 0.00 -0.89 -1.59 119.26 120.07 2fie h ALA 250 Ca 0.63 -0.97 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 2fie h ALA 250 Cb 2.14 0.42 -0.00 0.00 0.00 0.00 0.00 17.79 20.35 2fie h ALA 250 CO -0.16 0.60 -0.16 -0.44 0.00 0.00 0.00 179.25 179.09 2fie h ASP 251 N -0.61 0.00 0.20 0.00 3.32 -0.13 -0.88 116.42 118.32 2fie h ASP 251 Ca -0.24 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.48 2fie h ASP 251 Cb 1.49 0.00 0.02 0.00 0.22 0.00 0.00 39.33 41.06 2fie h ASP 251 CO -0.01 0.16 -1.54 0.58 -1.72 0.00 0.00 179.24 176.70 2fie h VAL 252 N 0.00 1.12 -0.42 -1.35 2.07 -0.41 -2.85 116.25 114.41 2fie h VAL 252 Ca -0.00 -2.57 -0.08 0.00 0.82 0.00 0.00 66.70 64.87 2fie h VAL 252 Cb 0.36 2.90 -0.02 0.00 -1.52 0.00 0.00 31.29 33.01 2fie h VAL 252 CO 0.02 0.81 -0.05 -0.74 0.02 0.00 0.00 177.57 177.63 2fie h HIS 253 N 0.04 0.76 0.15 1.57 -0.00 -1.01 0.27 115.15 116.92 2fie h HIS 253 Ca -0.29 -0.11 -0.01 0.00 -0.00 0.00 0.00 60.37 59.96 2fie h HIS 253 Cb 2.06 -0.20 0.00 0.00 -0.00 0.00 0.00 27.41 29.26 2fie h HIS 253 CO 0.12 0.74 -0.07 -0.09 -0.00 0.00 0.00 177.93 178.63 2fie h ARG 254 N 0.65 -0.19 -0.96 5.26 2.43 -1.25 0.38 114.38 120.69 2fie h ARG 254 Ca 0.12 0.01 0.14 0.00 -0.81 0.00 0.00 59.98 59.45 2fie h ARG 254 Cb 0.48 0.04 -0.09 0.00 -0.42 0.00 0.00 29.97 29.99 2fie h ARG 254 CO 0.02 -0.07 0.58 1.15 -1.51 0.00 0.00 179.97 180.15 2fie h THR 255 N -0.27 0.84 -0.14 0.20 2.02 -1.21 1.04 112.91 115.39 2fie h THR 255 Ca -0.02 -0.30 -0.13 0.00 0.77 0.00 0.00 66.41 66.74 2fie h THR 255 Cb 0.21 -0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.51 2fie h THR 255 CO 0.03 0.16 -0.46 0.25 0.37 0.00 0.00 175.52 175.87 2fie h LEU 256 N 0.86 0.37 0.10 2.58 5.85 -0.39 0.17 115.31 124.85 2fie h LEU 256 Ca 0.50 -0.17 -0.30 0.00 0.84 0.00 0.00 57.88 58.75 2fie h LEU 256 Cb 0.60 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 2fie h LEU 256 CO -0.31 0.78 -1.58 0.58 -0.34 0.00 0.00 178.44 177.57 2fie h VAL 257 N 0.28 0.88 -0.02 1.05 2.07 0.12 -3.40 116.25 117.24 2fie h VAL 257 Ca 0.02 -2.35 0.00 0.00 0.82 0.00 0.00 66.70 65.19 2fie h VAL 257 Cb 0.92 2.57 0.00 0.00 -1.52 0.00 0.00 31.29 33.26 2fie h VAL 257 CO 0.08 0.71 -0.41 -1.22 0.02 0.00 0.00 177.57 176.74 2fie n TYR 258 N -3.86 0.00 -0.12 1.57 4.01 0.34 -4.93 117.16 114.17 2fie n TYR 258 Ca -0.28 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.46 2fie n TYR 258 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.95 2fie n TYR 258 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2fie n GLY 259 N 1.37 -2.50 0.00 2.72 0.00 0.05 -4.64 105.19 102.19 2fie n GLY 259 Ca 0.09 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.51 2fie n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fie n GLY 260 N -0.86 -0.43 3.11 -0.02 0.00 -1.26 -4.42 105.19 101.32 2fie n GLY 260 Ca 0.00 -2.16 -0.12 0.00 0.00 0.00 0.00 46.02 43.74 2fie n GLY 260 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2fie s ILE 261 N 0.00 0.02 -0.14 -0.61 2.07 0.11 -1.05 121.20 121.60 2fie s ILE 261 Ca 0.00 -0.20 0.01 0.00 -1.41 0.00 0.00 60.65 59.05 2fie s ILE 261 Cb 0.00 -0.36 -0.00 0.00 0.13 0.00 0.00 42.46 42.22 2fie s ILE 261 CO 0.00 -0.11 -0.16 0.12 -1.91 0.00 0.00 174.94 172.88 2fie s PHE 262 N -0.35 2.76 -0.05 3.50 5.36 0.17 0.49 117.98 129.86 2fie s PHE 262 Ca -0.05 -0.95 0.05 0.00 -0.96 0.00 0.00 56.93 55.02 2fie s PHE 262 Cb -0.03 -1.86 -0.01 0.00 -0.34 0.00 0.00 43.02 40.79 2fie s PHE 262 CO 0.01 -0.41 -0.20 -0.51 -1.46 0.00 0.00 175.22 172.65 2fie s LEU 263 N 0.65 1.98 -0.46 6.12 1.02 0.27 -0.93 118.68 127.33 2fie s LEU 263 Ca -0.08 -0.40 0.07 0.00 0.02 0.00 0.00 54.13 53.73 2fie s LEU 263 Cb -0.16 -1.10 0.23 0.00 0.02 0.00 0.00 46.19 45.18 2fie s LEU 263 CO 0.02 0.19 0.70 0.00 0.02 0.00 0.00 176.35 177.29 2fie n TYR 264 N 3.03 -2.27 -1.81 0.29 4.19 -0.01 -4.28 117.16 116.30 2fie n TYR 264 Ca -0.18 -2.40 -0.29 0.00 3.31 0.00 0.00 57.90 58.34 2fie n TYR 264 Cb 0.53 0.84 0.10 0.00 0.49 0.00 0.00 39.34 41.29 2fie n TYR 264 CO 0.00 0.00 0.00 -1.25 0.91 0.00 0.00 176.86 176.52 2fie s PRO 265 N 0.08 1.85 0.43 2.98 0.04 -1.26 -1.67 135.00 137.46 2fie s PRO 265 Ca 0.33 0.19 -0.24 0.00 0.04 0.00 0.00 61.00 61.32 2fie s PRO 265 Cb 0.16 -1.93 -0.08 0.00 0.04 0.00 0.00 34.50 32.69 2fie s PRO 265 CO -0.17 -1.69 1.15 0.00 0.04 0.00 0.00 177.00 176.33 2fie s ALA 266 N -3.48 3.05 0.00 8.56 0.00 -1.26 -4.72 121.76 123.91 2fie s ALA 266 Ca 0.62 0.92 0.00 0.00 0.00 0.00 0.00 51.96 53.50 2fie s ALA 266 Cb -0.12 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.63 2fie s ALA 266 CO 0.50 -0.56 0.00 0.27 0.00 0.00 0.00 175.76 175.97 2fie n ASN 267 N -0.24 0.48 0.15 0.00 0.23 -1.24 -4.58 115.26 110.07 2fie n ASN 267 Ca 0.06 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.11 2fie n ASN 267 Cb 0.48 0.00 0.23 0.00 -2.08 0.00 0.00 39.78 38.41 2fie n ASN 267 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 2fie h LYS 268 N 0.00 0.00 -0.44 -3.83 3.64 -1.95 -3.13 116.57 110.85 2fie h LYS 268 Ca 0.00 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.42 2fie h LYS 268 Cb 0.00 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 2fie h LYS 268 CO 0.00 0.53 0.22 -0.22 -2.27 0.00 0.00 179.45 177.71 2fie h LYS 269 N 0.00 0.43 0.00 1.90 3.64 -1.95 -3.47 116.57 117.12 2fie h LYS 269 Ca -0.01 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2fie h LYS 269 Cb 0.95 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.67 2fie h LYS 269 CO 0.07 0.28 0.00 0.43 -2.27 0.00 0.00 179.45 177.96 2fie n SER 270 N -4.91 0.00 0.00 4.20 7.64 -1.18 -4.96 113.62 114.41 2fie n SER 270 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.91 2fie n SER 270 Cb 0.11 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 2fie n SER 270 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 2fie n PRO 271 N -0.66 0.00 -0.01 1.43 -0.02 -1.26 -0.55 135.00 133.93 2fie n PRO 271 Ca 0.00 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.58 2fie n PRO 271 Cb 0.00 -1.22 -0.14 0.00 -0.02 0.00 0.00 33.50 32.12 2fie n PRO 271 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2fie n ASN 272 N -0.69 0.58 0.00 2.55 5.03 -1.26 -4.74 115.26 116.74 2fie n ASN 272 Ca 0.00 -0.39 0.00 0.00 0.87 0.00 0.00 54.58 55.06 2fie n ASN 272 Cb 0.00 1.55 0.00 0.00 -1.02 0.00 0.00 39.78 40.31 2fie n ASN 272 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2fie n GLY 273 N 1.39 -1.75 0.24 7.41 0.00 0.28 -0.47 105.19 112.30 2fie n GLY 273 Ca -0.01 -1.95 -0.10 0.00 0.00 0.00 0.00 46.02 43.97 2fie n GLY 273 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2fie n LYS 274 N 0.00 0.27 -2.14 1.61 0.00 -1.26 -4.65 118.16 111.99 2fie n LYS 274 Ca 0.00 0.08 -0.38 0.00 0.00 0.00 0.00 58.31 58.02 2fie n LYS 274 Cb 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 35.03 33.90 2fie n LYS 274 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2fie s LEU 275 N -5.99 4.00 -0.00 3.14 1.43 -1.26 -4.83 118.68 115.17 2fie s LEU 275 Ca -0.16 2.43 -0.23 0.00 -1.03 0.00 0.00 54.13 55.14 2fie s LEU 275 Cb 0.05 -4.21 -0.05 0.00 0.03 0.00 0.00 46.19 42.01 2fie s LEU 275 CO 0.25 -1.04 0.70 -0.13 0.23 0.00 0.00 176.35 176.36 2fie s ARG 276 N -2.69 4.43 0.09 1.70 1.81 -1.26 -0.74 118.95 122.29 2fie s ARG 276 Ca 0.64 0.92 -0.17 0.00 -1.72 0.00 0.00 55.73 55.41 2fie s ARG 276 Cb -0.32 -3.39 -0.08 0.00 -0.45 0.00 0.00 34.95 30.72 2fie s ARG 276 CO 0.39 0.23 1.46 1.25 -0.68 0.00 0.00 175.30 177.95 2fie h LEU 277 N 6.02 0.60 -0.10 2.53 5.85 -1.10 -0.44 115.31 128.67 2fie h LEU 277 Ca -0.43 -0.40 -0.00 0.00 0.84 0.00 0.00 57.88 57.89 2fie h LEU 277 Cb 1.20 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 42.06 2fie h LEU 277 CO 0.72 0.86 0.05 -0.07 -0.34 0.00 0.00 178.44 179.66 2fie h LEU 278 N 0.33 0.13 -2.97 2.25 3.38 -1.81 -0.16 115.31 116.45 2fie h LEU 278 Ca 0.07 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2fie h LEU 278 Cb 0.63 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2fie h LEU 278 CO 0.04 0.19 0.00 0.00 0.09 0.00 0.00 178.44 178.75 2fie n TYR 279 N -4.96 0.24 0.09 1.13 0.18 -1.26 -4.58 117.16 108.00 2fie n TYR 279 Ca -0.05 -0.56 0.00 0.00 1.88 0.00 0.00 57.90 59.16 2fie n TYR 279 Cb 0.08 -0.07 0.00 0.00 -0.38 0.00 0.00 39.34 38.97 2fie n TYR 279 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 2fie n GLU 280 N -0.18 0.00 0.34 -3.48 1.02 -1.02 -4.32 120.64 112.99 2fie n GLU 280 Ca 0.07 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 57.07 2fie n GLU 280 Cb 0.39 -0.28 -0.07 0.00 -0.02 0.00 0.00 31.44 31.46 2fie n GLU 280 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2fie h ASN 282 N -1.18 -1.43 0.01 0.00 -0.26 -1.27 1.05 115.58 112.50 2fie h ASN 282 Ca -0.09 0.19 0.02 0.00 -0.56 0.00 0.00 56.30 55.86 2fie h ASN 282 Cb 0.70 0.59 -0.05 0.00 -1.06 0.00 0.00 38.32 38.50 2fie h ASN 282 CO 0.15 -0.42 -0.46 -0.65 -1.06 0.00 0.00 177.43 174.99 2fie h PRO 283 N -0.46 -0.56 -0.41 0.81 0.11 -1.81 0.54 132.00 130.22 2fie h PRO 283 Ca 0.09 0.04 0.08 0.00 0.11 0.00 0.00 66.00 66.32 2fie h PRO 283 Cb 0.62 0.13 -0.09 0.00 0.11 0.00 0.00 31.00 31.77 2fie h PRO 283 CO -0.46 -0.38 -0.27 0.52 -0.21 0.00 0.00 178.00 177.21 2fie h MET 284 N -0.58 -0.19 -0.70 1.05 2.86 -1.36 0.17 114.93 116.18 2fie h MET 284 Ca 0.01 0.01 0.13 0.00 -2.06 0.00 0.00 59.70 57.80 2fie h MET 284 Cb 0.62 0.04 -0.09 0.00 0.06 0.00 0.00 31.60 32.23 2fie h MET 284 CO -0.30 -0.12 0.23 0.00 1.06 0.00 0.00 176.91 177.78 2fie h ALA 285 N 0.95 0.94 -0.80 6.32 0.00 0.20 -1.31 119.26 125.56 2fie h ALA 285 Ca 0.19 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 2fie h ALA 285 Cb 0.50 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 2fie h ALA 285 CO -0.52 -0.25 0.33 -0.92 0.00 0.00 0.00 179.25 177.88 2fie h TYR 286 N 0.37 1.21 -0.22 0.00 5.03 0.20 -1.98 116.97 121.58 2fie h TYR 286 Ca 0.38 -0.09 -0.05 0.00 2.58 0.00 0.00 58.73 61.56 2fie h TYR 286 Cb 0.59 -0.36 -0.01 0.00 1.55 0.00 0.00 36.73 38.50 2fie h TYR 286 CO -0.20 0.91 -0.05 0.28 -1.32 0.00 0.00 178.16 177.78 2fie h VAL 287 N 1.16 1.28 -0.23 1.81 2.07 -0.25 -1.20 116.25 120.89 2fie h VAL 287 Ca 0.27 -1.03 0.05 0.00 0.82 0.00 0.00 66.70 66.81 2fie h VAL 287 Cb 0.21 1.50 -0.05 0.00 -1.52 0.00 0.00 31.29 31.43 2fie h VAL 287 CO -0.02 0.32 -0.07 0.24 0.02 0.00 0.00 177.57 178.06 2fie h MET 288 N 0.16 -0.01 -0.37 1.57 2.86 -1.14 -0.61 114.93 117.39 2fie h MET 288 Ca 0.06 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.59 2fie h MET 288 Cb 0.49 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 2fie h MET 288 CO 0.02 -0.01 -0.21 0.93 1.06 0.00 0.00 176.91 178.70 2fie h GLU 289 N -0.01 0.73 0.00 1.72 5.08 -1.33 1.37 114.58 122.14 2fie h GLU 289 Ca 0.11 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 2fie h GLU 289 Cb 0.18 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.40 2fie h GLU 289 CO -0.25 0.88 0.00 1.63 -1.00 0.00 0.00 179.01 180.27 2fie n LYS 290 N -4.12 0.62 -0.07 2.33 4.76 -0.46 -2.22 118.16 119.01 2fie n LYS 290 Ca 0.00 0.02 0.10 0.00 -2.87 0.00 0.00 58.31 55.56 2fie n LYS 290 Cb 0.42 -1.50 0.13 0.00 -1.84 0.00 0.00 35.03 32.24 2fie n LYS 290 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2fie n ALA 291 N -1.08 2.25 0.00 7.82 0.00 -0.28 -4.11 120.51 125.10 2fie n ALA 291 Ca 0.16 -2.56 0.00 0.00 0.00 0.00 0.00 53.44 51.04 2fie n ALA 291 Cb 0.11 -0.37 0.00 0.00 0.00 0.00 0.00 19.45 19.19 2fie n ALA 291 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fie n GLY 292 N -1.40 2.92 0.77 0.00 0.00 -0.94 0.63 105.19 107.17 2fie n GLY 292 Ca 0.15 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.11 2fie n GLY 292 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fie n GLY 293 N -2.00 -2.05 2.96 -0.02 0.00 0.46 -4.54 105.19 100.00 2fie n GLY 293 Ca 0.00 -1.54 -0.11 0.00 0.00 0.00 0.00 46.02 44.37 2fie n GLY 293 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2fie s MET 294 N -3.56 0.28 -0.12 1.61 1.00 -0.18 -3.75 119.30 114.57 2fie s MET 294 Ca 0.15 -0.42 -0.04 0.00 0.00 0.00 0.00 55.69 55.38 2fie s MET 294 Cb -0.01 -0.05 0.05 0.00 0.00 0.00 0.00 34.83 34.82 2fie s MET 294 CO 0.11 -0.00 0.09 0.00 0.00 0.00 0.00 175.02 175.22 2fie s ALA 295 N -0.90 0.30 0.24 3.03 0.00 -1.26 -1.10 121.76 122.07 2fie s ALA 295 Ca -0.09 -0.07 0.04 0.00 0.00 0.00 0.00 51.96 51.85 2fie s ALA 295 Cb -0.06 -0.89 -0.05 0.00 0.00 0.00 0.00 23.12 22.11 2fie s ALA 295 CO -0.00 -0.91 -0.01 -0.08 0.00 0.00 0.00 175.76 174.76 2fie s THR 296 N 2.17 1.13 -0.19 0.00 -1.32 -0.95 -0.29 115.64 116.19 2fie s THR 296 Ca 0.03 -2.05 0.17 0.00 -1.21 0.00 0.00 61.69 58.63 2fie s THR 296 Cb -0.14 -2.39 0.53 0.00 -1.51 0.00 0.00 72.50 68.99 2fie s THR 296 CO -0.07 -0.30 1.42 0.35 -2.21 0.00 0.00 174.62 173.81 2fie n THR 297 N -0.46 2.27 0.00 5.08 -2.24 -0.40 -1.55 114.28 116.98 2fie n THR 297 Ca -0.05 -1.87 0.00 0.00 -2.27 0.00 0.00 64.05 59.86 2fie n THR 297 Cb 0.64 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.63 2fie n THR 297 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fie n GLY 298 N -0.49 1.52 0.09 3.38 0.00 -1.26 -4.52 105.19 103.90 2fie n GLY 298 Ca 0.21 -0.16 0.11 0.00 0.00 0.00 0.00 46.02 46.18 2fie n GLY 298 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2fie n LYS 299 N 0.00 0.62 -3.59 1.61 5.02 -1.26 -5.01 118.16 115.55 2fie n LYS 299 Ca 0.00 0.04 -0.05 0.00 -2.02 0.00 0.00 58.31 56.28 2fie n LYS 299 Cb 0.00 -1.74 -0.02 0.00 -0.02 0.00 0.00 35.03 33.25 2fie n LYS 299 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2fie s GLU 300 N -3.39 0.35 0.07 1.97 -1.05 -1.26 -5.13 118.70 110.26 2fie s GLU 300 Ca -0.03 -0.13 -0.35 0.00 -0.15 0.00 0.00 54.97 54.31 2fie s GLU 300 Cb 0.11 0.16 -0.15 0.00 -0.44 0.00 0.00 34.13 33.81 2fie s GLU 300 CO 0.82 -0.15 1.55 0.00 0.95 0.00 0.00 175.26 178.43 2fie n ALA 301 N -0.10 0.39 -0.28 -0.84 0.00 -1.26 -1.27 120.51 117.15 2fie n ALA 301 Ca -0.00 0.45 0.08 0.00 0.00 0.00 0.00 53.44 53.96 2fie n ALA 301 Cb 0.58 -2.27 0.23 0.00 0.00 0.00 0.00 19.45 18.00 2fie n ALA 301 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2fie h VAL 302 N 3.87 0.61 0.00 0.00 2.07 -0.92 0.18 116.25 122.05 2fie h VAL 302 Ca -0.46 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 66.90 2fie h VAL 302 Cb 1.29 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 2fie h VAL 302 CO 0.86 0.09 0.00 0.18 0.02 0.00 0.00 177.57 178.72 2fie n LEU 303 N -4.99 0.00 -0.74 2.57 4.77 -1.26 -2.47 117.00 114.88 2fie n LEU 303 Ca 0.17 0.26 0.08 0.00 -0.03 0.00 0.00 56.01 56.49 2fie n LEU 303 Cb 0.49 -0.26 0.10 0.00 -2.33 0.00 0.00 43.42 41.43 2fie n LEU 303 CO 0.17 -0.20 0.55 0.47 -1.33 0.00 0.00 177.39 177.05 2fie n ASP 304 N -1.26 2.61 -4.71 -1.43 8.00 0.62 -0.10 116.55 120.28 2fie n ASP 304 Ca 0.03 -1.76 -0.42 0.00 0.71 0.00 0.00 54.79 53.35 2fie n ASP 304 Cb 0.05 -0.07 -0.03 0.00 -0.02 0.00 0.00 41.12 41.05 2fie n ASP 304 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2fie s VAL 305 N -1.33 4.56 -0.24 2.53 1.01 -1.03 -4.96 120.40 120.95 2fie s VAL 305 Ca 0.23 1.89 -0.18 0.00 0.00 0.00 0.00 61.98 63.92 2fie s VAL 305 Cb 0.15 -4.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.29 2fie s VAL 305 CO 0.22 0.17 0.51 -0.63 0.00 0.00 0.00 175.10 175.37 2fie s ILE 306 N 0.84 5.09 0.31 2.22 1.01 -1.26 -4.29 121.20 125.11 2fie s ILE 306 Ca 0.53 0.89 -0.28 0.00 0.00 0.00 0.00 60.65 61.79 2fie s ILE 306 Cb -0.24 -3.82 -0.09 0.00 0.01 0.00 0.00 42.46 38.31 2fie s ILE 306 CO 0.29 0.13 1.04 -2.84 0.00 0.00 0.00 174.94 173.55 2fie s PRO 307 N 2.02 4.56 -0.24 2.79 0.02 -1.26 -4.96 135.00 137.93 2fie s PRO 307 Ca 0.22 1.61 0.05 0.00 0.02 0.00 0.00 61.00 62.90 2fie s PRO 307 Cb -0.15 -3.00 -0.18 0.00 0.02 0.00 0.00 34.50 31.18 2fie s PRO 307 CO 0.09 0.20 -0.17 2.41 -0.33 0.00 0.00 177.00 179.19 2fie n THR 308 N 0.86 1.44 -4.34 0.99 -1.04 -1.26 -4.82 114.28 106.11 2fie n THR 308 Ca 0.01 -0.61 -0.18 0.00 -2.04 0.00 0.00 64.05 61.22 2fie n THR 308 Cb 0.47 -1.24 -0.14 0.00 -1.82 0.00 0.00 70.33 67.60 2fie n THR 308 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2fie s ASP 309 N -6.29 1.16 0.37 8.00 -1.08 -1.26 -5.04 116.67 112.53 2fie s ASP 309 Ca -0.30 -0.26 0.26 0.00 -0.52 0.00 0.00 52.55 51.73 2fie s ASP 309 Cb 0.08 -0.10 1.31 0.00 -1.46 0.00 0.00 42.92 42.75 2fie s ASP 309 CO 0.63 0.06 1.79 0.16 0.52 0.00 0.00 175.17 178.33 2fie h ILE 310 N 4.79 0.00 -0.24 4.11 3.07 -1.93 -1.33 117.51 125.98 2fie h ILE 310 Ca -0.33 -0.09 0.00 0.00 1.55 0.00 0.00 64.86 66.00 2fie h ILE 310 Cb 1.18 0.72 0.00 0.00 -0.27 0.00 0.00 36.82 38.45 2fie h ILE 310 CO 0.48 0.00 0.00 1.41 -1.05 0.00 0.00 178.15 178.99 2fie n HIS 311 N -2.41 0.80 -1.71 0.16 8.25 -1.26 -4.58 115.22 114.46 2fie n HIS 311 Ca -0.01 -0.84 -0.42 0.00 -0.26 0.00 0.00 57.72 56.19 2fie n HIS 311 Cb 0.10 -0.27 -0.01 0.00 1.12 0.00 0.00 29.99 30.94 2fie n HIS 311 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 2fie n GLN 312 N -0.49 2.23 -3.58 -0.41 7.27 -0.50 -4.85 117.38 117.06 2fie n GLN 312 Ca 0.20 0.78 -0.20 0.00 0.07 0.00 0.00 57.00 57.85 2fie n GLN 312 Cb 0.81 -2.40 -0.01 0.00 2.41 0.00 0.00 30.24 31.06 2fie n GLN 312 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 2fie s ARG 313 N -1.85 3.21 -0.22 3.69 0.52 -1.26 -0.57 118.95 122.46 2fie s ARG 313 Ca 0.55 -0.91 -0.24 0.00 -0.52 0.00 0.00 55.73 54.62 2fie s ARG 313 Cb -0.55 -2.82 0.06 0.00 0.52 0.00 0.00 34.95 32.16 2fie s ARG 313 CO 0.62 0.15 0.66 0.00 0.02 0.00 0.00 175.30 176.75 2fie s ALA 314 N -2.14 -1.64 0.28 2.13 0.00 0.38 -4.63 121.76 116.14 2fie s ALA 314 Ca 0.42 1.78 -0.29 0.00 0.00 0.00 0.00 51.96 53.87 2fie s ALA 314 Cb -0.09 -0.94 -0.10 0.00 0.00 0.00 0.00 23.12 21.99 2fie s ALA 314 CO 0.31 -0.32 1.11 -2.14 0.00 0.00 0.00 175.76 174.72 2fie s PRO 315 N 0.14 4.62 -0.01 0.00 0.02 -0.31 -4.22 135.00 135.25 2fie s PRO 315 Ca -0.02 1.83 0.01 0.00 0.02 0.00 0.00 61.00 62.84 2fie s PRO 315 Cb -0.04 -3.18 0.00 0.00 0.02 0.00 0.00 34.50 31.30 2fie s PRO 315 CO 0.02 0.19 -0.02 0.14 -0.33 0.00 0.00 177.00 176.99 2fie s VAL 316 N -1.15 0.20 -0.19 3.83 -7.23 -0.67 -4.02 120.40 111.17 2fie s VAL 316 Ca 0.45 -0.09 -0.05 0.00 -1.81 0.00 0.00 61.98 60.49 2fie s VAL 316 Cb -0.32 -0.19 0.07 0.00 0.56 0.00 0.00 36.38 36.49 2fie s VAL 316 CO 0.42 0.07 0.09 -0.63 -0.31 0.00 0.00 175.10 174.74 2fie s ILE 317 N 0.07 -0.02 0.20 -0.62 1.09 -0.59 -0.83 121.20 120.50 2fie s ILE 317 Ca -0.00 -0.29 0.04 0.00 -1.10 0.00 0.00 60.65 59.29 2fie s ILE 317 Cb -0.03 -0.68 -0.05 0.00 -1.06 0.00 0.00 42.46 40.65 2fie s ILE 317 CO -0.00 -0.34 -0.03 -1.48 -0.10 0.00 0.00 174.94 172.99 2fie s LEU 318 N 2.10 2.25 0.00 2.97 0.05 -0.10 -2.23 118.68 123.72 2fie s LEU 318 Ca 0.03 -1.17 0.00 0.00 0.05 0.00 0.00 54.13 53.04 2fie s LEU 318 Cb -0.16 -0.26 0.00 0.00 -2.05 0.00 0.00 46.19 43.72 2fie s LEU 318 CO -0.13 -0.48 0.00 0.61 -0.55 0.00 0.00 176.35 175.80 2fie n GLY 319 N -0.34 0.27 3.77 -3.48 0.00 -0.26 0.41 105.19 105.57 2fie n GLY 319 Ca -0.06 -1.28 -0.40 0.00 0.00 0.00 0.00 46.02 44.27 2fie n GLY 319 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fie s SER 320 N -4.00 6.27 0.09 1.61 0.01 -0.22 -1.01 113.70 116.44 2fie s SER 320 Ca 0.00 2.90 -0.28 0.00 1.31 0.00 0.00 55.95 59.88 2fie s SER 320 Cb 0.00 -2.66 -0.12 0.00 0.21 0.00 0.00 66.02 63.46 2fie s SER 320 CO 0.00 -0.91 1.44 -0.65 0.41 0.00 0.00 173.24 173.54 2fie h PRO 321 N 2.81 -0.56 -1.01 12.44 0.11 -1.75 -0.77 132.00 143.26 2fie h PRO 321 Ca -0.50 0.04 0.24 0.00 0.11 0.00 0.00 66.00 65.89 2fie h PRO 321 Cb 1.25 0.13 -0.11 0.00 0.11 0.00 0.00 31.00 32.37 2fie h PRO 321 CO 0.63 -0.37 0.63 -0.44 -0.21 0.00 0.00 178.00 178.23 2fie h ASP 322 N -0.58 0.61 -0.18 -2.05 5.19 -1.72 0.96 116.42 118.64 2fie h ASP 322 Ca -0.00 0.11 -0.08 0.00 -0.62 0.00 0.00 57.03 56.44 2fie h ASP 322 Cb 0.60 0.01 -0.00 0.00 0.18 0.00 0.00 39.33 40.12 2fie h ASP 322 CO -0.25 0.13 -0.19 0.44 -3.12 0.00 0.00 179.24 176.25 2fie h ASP 323 N 0.54 0.48 -0.57 6.45 3.32 -1.54 -2.55 116.42 122.55 2fie h ASP 323 Ca 0.61 -0.49 -0.08 0.00 0.02 0.00 0.00 57.03 57.09 2fie h ASP 323 Cb 1.27 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.66 2fie h ASP 323 CO -0.39 0.87 0.04 0.58 -1.72 0.00 0.00 179.24 178.62 2fie h VAL 324 N 0.10 1.26 -0.66 -1.35 2.07 0.11 -2.67 116.25 115.11 2fie h VAL 324 Ca 0.03 -1.06 -0.01 0.00 0.82 0.00 0.00 66.70 66.47 2fie h VAL 324 Cb 0.74 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 2fie h VAL 324 CO 0.05 0.38 0.36 -0.07 0.02 0.00 0.00 177.57 178.31 2fie h LEU 325 N 0.86 0.81 -0.51 2.57 3.38 -0.89 0.61 115.31 122.15 2fie h LEU 325 Ca 0.17 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2fie h LEU 325 Cb 0.49 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2fie h LEU 325 CO 0.02 0.66 0.24 -0.08 0.09 0.00 0.00 178.44 179.37 2fie h GLU 326 N 0.92 0.73 -0.38 1.13 4.81 -1.20 0.27 114.58 120.86 2fie h GLU 326 Ca 0.23 -0.11 0.01 0.00 -0.13 0.00 0.00 59.36 59.37 2fie h GLU 326 Cb 0.03 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 2fie h GLU 326 CO -0.04 0.61 0.23 0.35 -0.73 0.00 0.00 179.01 179.43 2fie h PHE 327 N 0.67 0.44 -0.05 0.92 3.57 -1.04 -1.58 116.94 119.87 2fie h PHE 327 Ca 0.17 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.66 2fie h PHE 327 Cb 0.12 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 2fie h PHE 327 CO -0.01 0.26 -0.10 -0.07 -2.23 0.00 0.00 178.31 176.16 2fie h LEU 328 N 0.48 0.07 -0.11 0.59 3.38 -0.11 0.23 115.31 119.84 2fie h LEU 328 Ca 0.15 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 2fie h LEU 328 Cb -0.02 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 2fie h LEU 328 CO -0.05 0.19 -0.10 0.50 0.09 0.00 0.00 178.44 179.06 2fie h LYS 329 N 0.08 0.27 -0.29 1.13 3.64 0.16 -2.73 116.57 118.82 2fie h LYS 329 Ca 0.02 -0.14 -0.02 0.00 -1.27 0.00 0.00 60.65 59.24 2fie h LYS 329 Cb 0.24 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 2fie h LYS 329 CO 0.01 0.67 0.10 0.28 -2.27 0.00 0.00 179.45 178.24 2fie h VAL 330 N -0.12 1.19 -0.82 2.00 2.07 -0.82 -2.63 116.25 117.12 2fie h VAL 330 Ca 0.02 -0.59 0.17 0.00 0.82 0.00 0.00 66.70 67.11 2fie h VAL 330 Cb 0.61 1.04 -0.10 0.00 -1.52 0.00 0.00 31.29 31.32 2fie h VAL 330 CO 0.03 0.20 0.35 0.22 0.02 0.00 0.00 177.57 178.39 2fie h TYR 331 N 0.31 0.60 -0.27 1.57 5.03 -0.55 0.08 116.97 123.74 2fie h TYR 331 Ca 0.09 0.04 -0.14 0.00 2.58 0.00 0.00 58.73 61.31 2fie h TYR 331 Cb 0.21 -0.14 -0.01 0.00 1.55 0.00 0.00 36.73 38.34 2fie h TYR 331 CO -0.00 0.05 -0.39 0.93 -1.32 0.00 0.00 178.16 177.43 2fie h GLU 332 N 0.47 0.62 0.00 1.82 5.08 -1.36 -2.04 114.58 119.17 2fie h GLU 332 Ca 0.47 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2fie h GLU 332 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 2fie h GLU 332 CO -0.43 0.91 0.02 1.17 -1.00 0.00 0.00 179.01 179.68 2fie n LYS 333 N -4.04 0.14 -0.14 2.33 4.81 -0.01 -0.64 118.16 120.61 2fie n LYS 333 Ca -0.02 0.64 0.05 0.00 -0.87 0.00 0.00 58.31 58.11 2fie n LYS 333 Cb 0.51 -1.98 0.12 0.00 0.02 0.00 0.00 35.03 33.70 2fie n LYS 333 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 2fie n HIS 334 N -2.25 0.30 -3.91 5.64 8.25 -0.79 -5.01 115.22 117.45 2fie n HIS 334 Ca -0.01 -0.66 -0.23 0.00 -0.26 0.00 0.00 57.72 56.56 2fie n HIS 334 Cb 0.06 -0.11 -0.05 0.00 1.12 0.00 0.00 29.99 31.01 2fie n HIS 334 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2fie s SER 335 N -1.51 4.80 0.00 0.41 0.01 0.19 -4.95 113.70 112.65 2fie s SER 335 Ca 0.20 -0.81 0.00 0.00 1.31 0.00 0.00 55.95 56.65 2fie s SER 335 Cb 0.15 -0.64 0.00 0.00 0.21 0.00 0.00 66.02 65.73 2fie s SER 335 CO 0.07 -0.48 0.00 0.00 0.41 0.00 0.00 173.24 173.24