#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1afv n ILE 2 N 0.00 0.00 -0.75 4.25 3.06 -0.50 -2.06 119.36 123.35 1afv n ILE 2 Ca 0.00 0.00 -0.08 0.00 -2.50 0.00 0.00 62.75 60.17 1afv n ILE 2 Cb 0.00 0.00 -0.04 0.00 0.54 0.00 0.00 39.64 40.14 1afv n ILE 2 CO 0.00 0.00 0.00 0.52 -2.50 0.00 0.00 176.55 174.57 1afv n VAL 3 N -1.80 2.46 0.00 9.51 0.31 0.25 -4.44 118.33 124.62 1afv n VAL 3 Ca 0.00 -1.10 0.00 0.00 -0.01 0.00 0.00 64.34 63.23 1afv n VAL 3 Cb 0.00 -1.59 0.00 0.00 -0.91 0.00 0.00 33.84 31.34 1afv n VAL 3 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1afv n GLN 4 N 1.47 0.00 -0.42 5.55 0.00 -1.25 -3.76 117.38 118.97 1afv n GLN 4 Ca 0.18 0.00 0.06 0.00 -0.00 0.00 0.00 57.00 57.24 1afv n GLN 4 Cb 0.61 -0.75 0.20 0.00 0.00 0.00 0.00 30.24 30.29 1afv n GLN 4 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1afv n ASN 5 N -0.42 2.67 0.00 1.69 3.02 -1.26 -4.70 115.26 116.25 1afv n ASN 5 Ca 0.00 -3.37 0.00 0.00 -0.03 0.00 0.00 54.58 51.18 1afv n ASN 5 Cb 0.00 -0.52 0.00 0.00 -0.61 0.00 0.00 39.78 38.65 1afv n ASN 5 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1afv n LEU 6 N -1.07 0.53 -1.79 3.41 4.77 -1.26 -4.76 117.00 116.82 1afv n LEU 6 Ca 0.22 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 56.12 1afv n LEU 6 Cb 0.80 -1.03 -0.09 0.00 -2.33 0.00 0.00 43.42 40.77 1afv n LEU 6 CO 0.08 -0.27 1.35 0.00 -1.33 0.00 0.00 177.39 177.22 1afv n GLN 7 N -2.00 1.58 -3.67 3.23 -0.00 -1.26 -4.57 117.38 110.68 1afv n GLN 7 Ca 0.00 -0.60 -0.09 0.00 -0.00 0.00 0.00 57.00 56.30 1afv n GLN 7 Cb 0.00 -1.58 -0.10 0.00 -0.00 0.00 0.00 30.24 28.56 1afv n GLN 7 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1afv s GLY 8 N 1.95 -0.34 0.00 2.61 0.00 -1.26 -5.10 107.32 105.18 1afv s GLY 8 Ca 0.38 1.51 0.00 0.00 0.00 0.00 0.00 44.72 46.62 1afv s GLY 8 CO -0.00 2.08 0.00 -1.06 0.00 0.00 0.00 173.10 174.12 1afv n GLN 9 N 4.88 0.63 0.00 2.90 3.00 -1.26 -4.72 117.38 122.80 1afv n GLN 9 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.84 1afv n GLN 9 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.76 1afv n GLN 9 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 1afv n MET 10 N 0.00 0.00 -1.72 -1.09 2.81 -1.26 -4.67 117.12 111.19 1afv n MET 10 Ca 0.00 0.08 -0.39 0.00 -1.81 0.00 0.00 57.70 55.58 1afv n MET 10 Cb 0.00 -1.52 0.03 0.00 -0.71 0.00 0.00 33.22 31.03 1afv n MET 10 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1afv n VAL 11 N -1.00 3.43 -3.53 2.03 0.31 -1.26 -5.03 118.33 113.28 1afv n VAL 11 Ca 0.00 -0.50 -0.13 0.00 -0.01 0.00 0.00 64.34 63.70 1afv n VAL 11 Cb 0.02 -1.58 -0.05 0.00 -0.91 0.00 0.00 33.84 31.33 1afv n VAL 11 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 1afv s HIS 12 N -1.29 -0.48 -0.01 3.52 -3.43 -1.26 -4.72 115.29 107.63 1afv s HIS 12 Ca 0.69 0.71 -0.06 0.00 -0.80 0.00 0.00 55.06 55.60 1afv s HIS 12 Cb -0.44 0.46 0.00 0.00 -1.43 0.00 0.00 32.58 31.17 1afv s HIS 12 CO 0.52 -0.50 0.11 -0.65 -2.00 0.00 0.00 174.74 172.22 1afv s GLN 13 N -1.65 0.39 0.39 -0.38 -0.21 -0.88 -4.92 119.66 112.40 1afv s GLN 13 Ca -0.04 -0.30 -0.24 0.00 0.02 0.00 0.00 55.36 54.81 1afv s GLN 13 Cb -0.00 0.16 -0.09 0.00 1.00 0.00 0.00 33.01 34.08 1afv s GLN 13 CO 0.02 -0.08 1.04 0.00 -2.12 0.00 0.00 175.29 174.14 1afv s ALA 14 N -1.07 3.10 -0.13 6.09 0.00 -1.26 0.33 121.76 128.81 1afv s ALA 14 Ca -0.12 0.68 -0.33 0.00 0.00 0.00 0.00 51.96 52.19 1afv s ALA 14 Cb -0.06 -3.26 -0.11 0.00 0.00 0.00 0.00 23.12 19.69 1afv s ALA 14 CO 0.01 -0.17 1.98 1.51 0.00 0.00 0.00 175.76 179.09 1afv n ILE 15 N -0.02 0.52 -1.64 0.00 3.06 -1.26 -4.59 119.36 115.42 1afv n ILE 15 Ca 0.05 -0.18 -0.49 0.00 -2.50 0.00 0.00 62.75 59.63 1afv n ILE 15 Cb 0.50 -1.98 -0.05 0.00 0.54 0.00 0.00 39.64 38.65 1afv n ILE 15 CO 0.00 0.00 0.00 -0.24 -2.50 0.00 0.00 176.55 173.81 1afv n SER 16 N 7.84 2.45 0.11 9.51 2.88 -1.26 -4.75 113.62 130.39 1afv n SER 16 Ca 0.26 1.09 0.20 0.00 -1.33 0.00 0.00 58.87 59.09 1afv n SER 16 Cb 0.32 -1.31 0.76 0.00 -0.75 0.00 0.00 64.21 63.23 1afv n SER 16 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1afv h PRO 17 N 5.61 0.00 0.21 -1.46 0.11 -1.98 0.10 132.00 134.58 1afv h PRO 17 Ca -0.46 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1afv h PRO 17 Cb 1.29 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.40 1afv h PRO 17 CO 0.85 0.00 -0.12 0.00 -0.21 0.00 0.00 178.00 178.52 1afv h ARG 18 N 0.00 -0.30 -0.40 1.05 2.47 -1.99 0.29 114.38 115.50 1afv h ARG 18 Ca 0.18 0.02 -0.03 0.00 -1.26 0.00 0.00 59.98 58.88 1afv h ARG 18 Cb 0.96 0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 29.33 1afv h ARG 18 CO -0.00 -0.20 0.11 1.15 0.56 0.00 0.00 179.97 181.59 1afv h THR 19 N -0.31 1.22 0.34 2.04 2.02 -1.21 -0.89 112.91 116.12 1afv h THR 19 Ca -0.02 -0.74 -0.02 0.00 0.77 0.00 0.00 66.41 66.40 1afv h THR 19 Cb 0.25 0.95 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 1afv h THR 19 CO 0.03 0.26 -0.16 0.25 0.37 0.00 0.00 175.52 176.26 1afv h LEU 20 N 0.50 -0.39 -1.46 2.58 6.46 -1.00 -1.76 115.31 120.25 1afv h LEU 20 Ca 0.13 -0.05 0.10 0.00 -0.12 0.00 0.00 57.88 57.94 1afv h LEU 20 Cb 0.28 0.10 -0.05 0.00 -0.73 0.00 0.00 40.66 40.26 1afv h LEU 20 CO -0.00 -0.20 0.48 0.78 -0.62 0.00 0.00 178.44 178.88 1afv h ASN 21 N -0.55 0.55 -0.89 1.25 2.35 -0.40 0.06 115.58 117.94 1afv h ASN 21 Ca -0.05 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.70 1afv h ASN 21 Cb 0.41 -0.10 -0.04 0.00 0.05 0.00 0.00 38.32 38.64 1afv h ASN 21 CO 0.08 0.33 0.47 0.00 -1.65 0.00 0.00 177.43 176.66 1afv h ALA 22 N 1.63 1.14 -0.44 -0.83 0.00 -0.63 -1.86 119.26 118.27 1afv h ALA 22 Ca 0.33 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1afv h ALA 22 Cb 0.49 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1afv h ALA 22 CO -0.12 0.66 0.28 2.35 0.00 0.00 0.00 179.25 182.42 1afv h TRP 23 N 1.25 0.57 0.24 0.00 -0.00 -0.12 -0.56 115.95 117.33 1afv h TRP 23 Ca 0.31 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 59.20 1afv h TRP 23 Cb 0.05 -0.19 -0.01 0.00 -0.00 0.00 0.00 29.16 29.01 1afv h TRP 23 CO 0.01 0.38 -0.22 0.28 -0.00 0.00 0.00 178.44 178.89 1afv h VAL 24 N 0.59 0.00 -0.91 2.65 2.07 -1.06 -2.14 116.25 117.45 1afv h VAL 24 Ca 0.16 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.91 1afv h VAL 24 Cb -0.03 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 29.61 1afv h VAL 24 CO -0.03 0.00 0.40 0.50 0.02 0.00 0.00 177.57 178.46 1afv h LYS 25 N -0.45 0.38 -0.01 1.57 3.11 -1.29 0.16 116.57 120.04 1afv h LYS 25 Ca -0.03 -0.02 0.03 0.00 -2.81 0.00 0.00 60.65 57.82 1afv h LYS 25 Cb 0.39 -0.09 -0.05 0.00 -1.00 0.00 0.00 32.23 31.49 1afv h LYS 25 CO -0.02 0.25 -0.25 0.28 -2.81 0.00 0.00 179.45 176.91 1afv h VAL 26 N 0.40 0.43 0.00 2.00 2.07 -0.63 0.70 116.25 121.22 1afv h VAL 26 Ca 0.57 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 68.02 1afv h VAL 26 Cb 1.10 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 1afv h VAL 26 CO -0.54 0.00 -0.35 0.58 0.02 0.00 0.00 177.57 177.29 1afv h VAL 27 N -0.38 0.78 -0.36 2.57 2.07 -0.71 0.79 116.25 121.02 1afv h VAL 27 Ca 0.07 -1.49 -0.12 0.00 0.82 0.00 0.00 66.70 65.98 1afv h VAL 27 Cb 0.47 1.94 -0.01 0.00 -1.52 0.00 0.00 31.29 32.17 1afv h VAL 27 CO -0.23 0.34 -0.23 -0.08 0.02 0.00 0.00 177.57 177.38 1afv h GLU 28 N 0.00 0.80 0.00 1.57 4.81 0.64 0.46 114.58 122.86 1afv h GLU 28 Ca -0.00 -0.37 -0.22 0.00 -0.13 0.00 0.00 59.36 58.63 1afv h GLU 28 Cb 0.91 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.25 1afv h GLU 28 CO 0.04 1.00 -1.53 0.39 -0.73 0.00 0.00 179.01 178.18 1afv n GLU 29 N -4.24 0.62 -0.00 1.92 -0.58 0.23 -4.48 120.64 114.12 1afv n GLU 29 Ca -0.02 0.26 0.02 0.00 -0.42 0.00 0.00 57.16 57.00 1afv n GLU 29 Cb 0.45 -1.80 -0.03 0.00 -0.57 0.00 0.00 31.44 29.48 1afv n GLU 29 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1afv n LYS 30 N -2.96 5.22 0.00 3.49 4.01 0.26 -5.09 118.16 123.10 1afv n LYS 30 Ca -0.13 -0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.67 1afv n LYS 30 Cb 0.93 -0.74 0.00 0.00 -0.51 0.00 0.00 35.03 34.71 1afv n LYS 30 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1afv n ALA 31 N -1.13 0.00 -0.58 7.82 0.00 0.16 -2.78 120.51 124.00 1afv n ALA 31 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.30 1afv n ALA 31 Cb 0.08 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.59 1afv n ALA 31 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1afv n PHE 32 N 0.00 1.59 -1.33 0.00 3.72 -1.26 -4.58 117.46 115.59 1afv n PHE 32 Ca 0.00 -1.67 -0.31 0.00 -0.05 0.00 0.00 57.45 55.42 1afv n PHE 32 Cb 0.00 -0.82 0.08 0.00 -0.94 0.00 0.00 39.48 37.80 1afv n PHE 32 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1afv s SER 33 N -0.01 4.62 0.66 4.37 1.04 -1.12 -4.68 113.70 118.57 1afv s SER 33 Ca 0.31 1.83 0.16 0.00 0.48 0.00 0.00 55.95 58.73 1afv s SER 33 Cb 0.25 -2.52 0.85 0.00 0.10 0.00 0.00 66.02 64.70 1afv s SER 33 CO 0.02 -1.96 1.48 1.55 0.98 0.00 0.00 173.24 175.31 1afv h PRO 34 N -0.97 0.00 -0.00 4.02 0.13 -1.92 0.13 132.00 133.39 1afv h PRO 34 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1afv h PRO 34 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1afv h PRO 34 CO 0.52 0.00 -0.02 -0.85 -0.23 0.00 0.00 178.00 177.42 1afv n GLU 35 N -2.74 0.87 0.14 0.86 0.28 -1.26 -3.53 120.64 115.26 1afv n GLU 35 Ca -0.00 -0.12 -0.01 0.00 -0.16 0.00 0.00 57.16 56.87 1afv n GLU 35 Cb 0.70 -1.50 0.19 0.00 1.43 0.00 0.00 31.44 32.26 1afv n GLU 35 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 177.13 176.73 1afv h VAL 36 N 0.29 1.42 0.30 3.84 3.04 -0.98 -3.16 116.25 120.99 1afv h VAL 36 Ca 0.00 -2.04 -0.01 0.00 -1.01 0.00 0.00 66.70 63.63 1afv h VAL 36 Cb 0.17 2.10 0.00 0.00 -2.01 0.00 0.00 31.29 31.55 1afv h VAL 36 CO 0.00 0.58 -0.14 0.40 -1.01 0.00 0.00 177.57 177.40 1afv h ILE 37 N 0.00 0.65 -0.24 3.17 2.04 -1.78 -2.25 117.51 119.11 1afv h ILE 37 Ca -0.01 -0.71 0.05 0.00 1.00 0.00 0.00 64.86 65.20 1afv h ILE 37 Cb 1.06 0.99 -0.05 0.00 -0.74 0.00 0.00 36.82 38.07 1afv h ILE 37 CO 0.08 0.13 -0.09 -0.65 0.00 0.00 0.00 178.15 177.62 1afv h PRO 38 N -0.83 -0.04 -0.36 2.37 0.11 -1.77 -1.50 132.00 129.98 1afv h PRO 38 Ca -0.04 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.06 1afv h PRO 38 Cb 0.52 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.62 1afv h PRO 38 CO 0.07 -0.03 0.16 0.52 -0.21 0.00 0.00 178.00 178.51 1afv h MET 39 N -0.04 0.51 0.59 1.05 2.86 -1.65 -1.79 114.93 116.46 1afv h MET 39 Ca 0.12 -0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.68 1afv h MET 39 Cb 0.23 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 31.79 1afv h MET 39 CO -0.27 0.41 -0.33 0.35 1.06 0.00 0.00 176.91 178.13 1afv h PHE 40 N 0.51 -0.87 -0.95 -0.22 3.57 -0.66 -1.51 116.94 116.80 1afv h PHE 40 Ca 0.13 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.70 1afv h PHE 40 Cb 0.09 0.30 -0.07 0.00 2.79 0.00 0.00 35.95 39.06 1afv h PHE 40 CO 0.00 -0.52 0.61 0.77 -2.23 0.00 0.00 178.31 176.95 1afv h SER 41 N -0.86 0.93 -0.48 0.41 0.02 -1.05 -1.87 113.55 110.64 1afv h SER 41 Ca -0.07 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 60.88 1afv h SER 41 Cb 0.69 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 63.03 1afv h SER 41 CO 0.10 0.56 0.26 0.00 -1.14 0.00 0.00 176.83 176.61 1afv h ALA 42 N 1.51 0.62 -0.17 3.77 0.00 -1.07 -0.97 119.26 122.95 1afv h ALA 42 Ca 0.43 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.24 1afv h ALA 42 Cb 0.30 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1afv h ALA 42 CO -0.18 0.14 0.01 1.28 0.00 0.00 0.00 179.25 180.49 1afv n LEU 43 N -4.67 2.39 -0.80 0.00 4.77 -0.59 -3.50 117.00 114.61 1afv n LEU 43 Ca 0.02 -1.21 0.05 0.00 -0.03 0.00 0.00 56.01 54.84 1afv n LEU 43 Cb 0.09 -0.55 0.10 0.00 -2.33 0.00 0.00 43.42 40.72 1afv n LEU 43 CO 0.36 0.37 0.28 -0.24 -1.33 0.00 0.00 177.39 176.82 1afv n SER 44 N 0.17 1.29 -4.44 -1.43 2.88 -0.37 -4.92 113.62 106.80 1afv n SER 44 Ca 0.08 -2.82 -0.18 0.00 -1.33 0.00 0.00 58.87 54.63 1afv n SER 44 Cb 0.53 -0.38 -0.17 0.00 -0.75 0.00 0.00 64.21 63.43 1afv n SER 44 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1afv n GLU 45 N -0.44 0.08 -4.23 -1.46 1.02 -1.21 -2.82 120.64 111.58 1afv n GLU 45 Ca 0.11 -0.16 -0.30 0.00 -0.02 0.00 0.00 57.16 56.78 1afv n GLU 45 Cb 0.84 -1.45 -0.08 0.00 -0.02 0.00 0.00 31.44 30.73 1afv n GLU 45 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1afv n GLY 46 N 5.56 -0.17 3.95 0.62 0.00 -1.25 -4.16 105.19 109.75 1afv n GLY 46 Ca 0.55 0.18 -0.26 0.00 0.00 0.00 0.00 46.02 46.49 1afv n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1afv s ALA 47 N -4.27 3.06 0.40 4.61 0.00 -1.13 0.87 121.76 125.30 1afv s ALA 47 Ca 0.02 -1.24 -0.14 0.00 0.00 0.00 0.00 51.96 50.60 1afv s ALA 47 Cb -0.01 -2.48 -0.08 0.00 0.00 0.00 0.00 23.12 20.56 1afv s ALA 47 CO 0.97 -1.67 0.82 0.95 0.00 0.00 0.00 175.76 176.83 1afv s THR 48 N -3.40 4.67 0.35 0.00 -4.23 -1.26 -4.45 115.64 107.31 1afv s THR 48 Ca 0.66 0.92 0.14 0.00 -1.18 0.00 0.00 61.69 62.23 1afv s THR 48 Cb -0.07 -3.68 0.34 0.00 1.34 0.00 0.00 72.50 70.43 1afv s THR 48 CO 0.47 -0.43 1.70 -0.65 -0.54 0.00 0.00 174.62 175.17 1afv h PRO 49 N 1.57 0.41 -0.11 3.99 0.11 -1.87 -0.34 132.00 135.76 1afv h PRO 49 Ca -0.47 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 1afv h PRO 49 Cb 1.18 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1afv h PRO 49 CO 0.64 0.27 0.03 0.37 -0.21 0.00 0.00 178.00 179.10 1afv h GLN 50 N 0.43 0.18 -0.97 1.05 4.15 -1.92 -0.24 115.11 117.78 1afv h GLN 50 Ca 0.68 -0.04 0.11 0.00 0.77 0.00 0.00 58.65 60.18 1afv h GLN 50 Cb 1.52 -0.02 -0.08 0.00 0.21 0.00 0.00 27.48 29.10 1afv h GLN 50 CO -0.50 0.34 0.60 -0.44 -1.93 0.00 0.00 178.83 176.91 1afv h ASP 51 N -0.01 0.89 -0.11 -0.69 3.32 -1.47 0.28 116.42 118.63 1afv h ASP 51 Ca 0.04 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 1afv h ASP 51 Cb 0.24 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 1afv h ASP 51 CO -0.00 0.48 0.02 -0.07 -1.72 0.00 0.00 179.24 177.95 1afv h LEU 52 N 0.97 0.16 -1.46 1.55 4.07 -1.07 -1.63 115.31 117.89 1afv h LEU 52 Ca 0.48 -0.24 0.06 0.00 0.08 0.00 0.00 57.88 58.26 1afv h LEU 52 Cb 0.46 -0.04 -0.04 0.00 1.08 0.00 0.00 40.66 42.11 1afv h LEU 52 CO -0.26 0.35 0.43 0.78 -1.08 0.00 0.00 178.44 178.66 1afv h ASN 53 N -0.04 0.58 0.32 -0.43 2.35 0.28 -1.10 115.58 117.55 1afv h ASN 53 Ca 0.03 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 1afv h ASN 53 Cb 0.26 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.51 1afv h ASN 53 CO 0.00 0.38 -0.16 0.74 -1.65 0.00 0.00 177.43 176.74 1afv h THR 54 N 0.66 0.69 0.14 2.81 2.02 -0.22 -0.16 112.91 118.85 1afv h THR 54 Ca 0.28 -0.14 0.02 0.00 0.77 0.00 0.00 66.41 67.33 1afv h THR 54 Cb 0.25 0.77 -0.05 0.00 -1.74 0.00 0.00 68.15 67.39 1afv h THR 54 CO -0.09 0.03 -0.46 0.24 0.37 0.00 0.00 175.52 175.62 1afv h MET 55 N -0.51 -0.68 -0.40 6.66 2.86 -0.28 0.42 114.93 123.00 1afv h MET 55 Ca -0.04 0.05 0.08 0.00 -2.06 0.00 0.00 59.70 57.72 1afv h MET 55 Cb 0.38 0.15 -0.07 0.00 0.06 0.00 0.00 31.60 32.12 1afv h MET 55 CO 0.07 -0.45 -0.09 -0.07 1.06 0.00 0.00 176.91 177.43 1afv h LEU 56 N -0.71 -0.34 -1.15 1.22 3.38 -1.23 -0.22 115.31 116.26 1afv h LEU 56 Ca 0.01 0.12 0.05 0.00 0.09 0.00 0.00 57.88 58.14 1afv h LEU 56 Cb 0.72 0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.65 1afv h LEU 56 CO -0.25 -0.12 0.58 -1.13 0.09 0.00 0.00 178.44 177.61 1afv h ASN 57 N 0.01 0.93 -0.48 -0.43 -0.00 -0.48 -1.04 115.58 114.09 1afv h ASN 57 Ca 0.19 -0.00 0.02 0.00 -0.00 0.00 0.00 56.30 56.51 1afv h ASN 57 Cb 0.29 -0.21 -0.03 0.00 -0.00 0.00 0.00 38.32 38.38 1afv h ASN 57 CO -0.40 0.62 0.29 0.74 -0.00 0.00 0.00 177.43 178.68 1afv h THR 58 N 1.07 1.07 -0.68 -3.57 2.02 0.16 -3.01 112.91 109.96 1afv h THR 58 Ca 0.36 -0.20 -0.46 0.00 0.77 0.00 0.00 66.41 66.88 1afv h THR 58 Cb 0.09 0.43 -0.29 0.00 -1.74 0.00 0.00 68.15 66.64 1afv h THR 58 CO -0.12 0.11 -0.15 0.55 0.37 0.00 0.00 175.52 176.27 1afv n VAL 59 N -4.80 2.82 -1.03 3.16 3.14 -0.90 -4.78 118.33 115.94 1afv n VAL 59 Ca 0.03 -3.42 -0.14 0.00 -2.96 0.00 0.00 64.34 57.85 1afv n VAL 59 Cb 0.06 -0.87 -0.16 0.00 -1.06 0.00 0.00 33.84 31.80 1afv n VAL 59 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1afv n GLY 60 N -0.90 3.09 0.32 7.55 0.00 -0.44 -4.76 105.19 110.05 1afv n GLY 60 Ca 0.45 -1.24 0.15 0.00 0.00 0.00 0.00 46.02 45.39 1afv n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1afv n GLY 61 N 2.51 -1.23 2.81 -0.02 0.00 -1.26 -4.56 105.19 103.44 1afv n GLY 61 Ca 0.45 0.91 -0.17 0.00 0.00 0.00 0.00 46.02 47.21 1afv n GLY 61 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1afv s HIS 62 N -5.88 -0.09 0.66 1.61 -3.43 -1.26 -5.02 115.29 101.88 1afv s HIS 62 Ca -0.12 0.42 0.14 0.00 -0.80 0.00 0.00 55.06 54.70 1afv s HIS 62 Cb 0.28 -0.27 0.70 0.00 -1.43 0.00 0.00 32.58 31.86 1afv s HIS 62 CO 0.73 -0.20 1.38 -0.56 -2.00 0.00 0.00 174.74 174.09 1afv h GLN 63 N 7.96 0.00 0.00 -0.38 -0.00 -1.97 -2.39 115.11 118.33 1afv h GLN 63 Ca -0.25 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.40 1afv h GLN 63 Cb 1.12 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.60 1afv h GLN 63 CO 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 178.83 179.09 1afv n ALA 64 N -1.73 -0.35 -0.21 0.06 0.00 -1.26 -1.92 120.51 115.10 1afv n ALA 64 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.37 1afv n ALA 64 Cb 0.81 0.07 0.03 0.00 0.00 0.00 0.00 19.45 20.36 1afv n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1afv h ALA 65 N -1.88 0.80 -0.13 0.00 0.00 -1.88 -2.25 119.26 113.93 1afv h ALA 65 Ca 0.00 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 54.71 1afv h ALA 65 Cb 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1afv h ALA 65 CO 0.00 0.53 0.31 0.52 0.00 0.00 0.00 179.25 180.60 1afv h MET 66 N 0.89 0.00 -0.01 0.00 2.07 -1.57 0.22 114.93 116.53 1afv h MET 66 Ca 0.19 0.00 -0.04 0.00 -2.07 0.00 0.00 59.70 57.78 1afv h MET 66 Cb 0.38 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.11 1afv h MET 66 CO 0.01 0.00 -0.16 0.37 1.07 0.00 0.00 176.91 178.20 1afv h GLN 67 N 0.00 0.13 -0.81 1.72 5.75 -0.75 -0.96 115.11 120.19 1afv h GLN 67 Ca 0.06 -0.12 0.04 0.00 -0.15 0.00 0.00 58.65 58.48 1afv h GLN 67 Cb 0.68 0.03 -0.05 0.00 1.07 0.00 0.00 27.48 29.21 1afv h GLN 67 CO -0.00 0.84 0.52 0.52 -2.65 0.00 0.00 178.83 178.06 1afv h MET 68 N -0.55 0.97 -0.39 1.69 2.86 -0.63 0.17 114.93 119.05 1afv h MET 68 Ca -0.02 -0.06 -0.10 0.00 -2.06 0.00 0.00 59.70 57.47 1afv h MET 68 Cb 0.89 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 1afv h MET 68 CO 0.03 0.64 -0.13 1.25 1.06 0.00 0.00 176.91 179.76 1afv h LEU 69 N 1.00 0.78 0.63 1.22 6.46 -1.27 -2.69 115.31 121.44 1afv h LEU 69 Ca 0.33 -0.38 -0.03 0.00 -0.12 0.00 0.00 57.88 57.68 1afv h LEU 69 Cb 0.03 -0.21 0.01 0.00 -0.73 0.00 0.00 40.66 39.75 1afv h LEU 69 CO -0.12 0.99 -0.30 0.50 -0.62 0.00 0.00 178.44 178.88 1afv h LYS 70 N 0.57 -0.82 -0.87 1.25 3.64 -0.37 -1.65 116.57 118.33 1afv h LYS 70 Ca 0.09 0.06 0.18 0.00 -1.27 0.00 0.00 60.65 59.71 1afv h LYS 70 Cb 0.66 0.19 -0.11 0.00 -0.41 0.00 0.00 32.23 32.56 1afv h LYS 70 CO 0.05 -0.53 0.41 1.05 -2.27 0.00 0.00 179.45 178.16 1afv h GLU 71 N -0.89 0.50 -0.51 1.90 4.11 -0.73 -0.92 114.58 118.04 1afv h GLU 71 Ca -0.09 -0.03 -0.10 0.00 0.07 0.00 0.00 59.36 59.22 1afv h GLU 71 Cb 0.67 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 1afv h GLU 71 CO 0.14 0.33 -0.06 1.15 0.07 0.00 0.00 179.01 180.64 1afv h THR 72 N 0.51 1.27 -0.18 -1.06 2.02 -1.28 -1.14 112.91 113.05 1afv h THR 72 Ca 0.51 -1.18 0.01 0.00 0.77 0.00 0.00 66.41 66.52 1afv h THR 72 Cb 0.86 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.25 1afv h THR 72 CO -0.44 0.41 0.09 0.40 0.37 0.00 0.00 175.52 176.35 1afv h ILE 73 N 0.79 1.00 -0.23 3.11 1.08 -0.22 -0.75 117.51 122.29 1afv h ILE 73 Ca 0.14 -0.07 0.02 0.00 -0.39 0.00 0.00 64.86 64.56 1afv h ILE 73 Cb 0.60 0.79 -0.02 0.00 -3.07 0.00 0.00 36.82 35.12 1afv h ILE 73 CO 0.04 0.04 0.08 0.78 -0.69 0.00 0.00 178.15 178.40 1afv h ASN 74 N 0.19 0.10 -0.86 1.72 4.21 -1.17 0.19 115.58 119.97 1afv h ASN 74 Ca 0.07 0.02 -0.01 0.00 1.21 0.00 0.00 56.30 57.60 1afv h ASN 74 Cb 0.01 0.01 -0.04 0.00 -1.12 0.00 0.00 38.32 37.18 1afv h ASN 74 CO -0.05 0.09 0.51 -0.33 -1.29 0.00 0.00 177.43 176.36 1afv h GLU 75 N 0.19 1.17 -0.26 0.81 5.08 -0.97 -0.04 114.58 120.55 1afv h GLU 75 Ca 0.10 -0.11 -0.16 0.00 -1.00 0.00 0.00 59.36 58.20 1afv h GLU 75 Cb 0.06 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 1afv h GLU 75 CO -0.10 0.82 -0.47 0.93 -1.00 0.00 0.00 179.01 179.20 1afv h GLU 76 N 1.18 0.70 -0.59 2.33 4.39 -0.71 -1.18 114.58 120.69 1afv h GLU 76 Ca 0.31 -0.39 -0.08 0.00 0.34 0.00 0.00 59.36 59.54 1afv h GLU 76 Cb -0.04 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 1afv h GLU 76 CO -0.06 1.01 0.06 0.00 -1.16 0.00 0.00 179.01 178.87 1afv h ALA 77 N 0.92 1.00 -0.21 3.43 0.00 -0.26 -1.86 119.26 122.27 1afv h ALA 77 Ca 0.03 -0.27 -0.19 0.00 0.00 0.00 0.00 54.91 54.49 1afv h ALA 77 Cb 1.02 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1afv h ALA 77 CO 0.10 0.63 -0.61 0.00 0.00 0.00 0.00 179.25 179.36 1afv h ALA 78 N 1.15 0.52 -0.37 0.00 0.00 -0.86 -2.90 119.26 116.79 1afv h ALA 78 Ca 0.18 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1afv h ALA 78 Cb 0.44 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1afv h ALA 78 CO 0.02 0.69 0.23 1.49 0.00 0.00 0.00 179.25 181.68 1afv h GLU 79 N 0.53 0.50 -0.57 0.00 4.57 -1.01 -1.09 114.58 117.50 1afv h GLU 79 Ca -0.01 -0.04 0.12 0.00 -1.18 0.00 0.00 59.36 58.25 1afv h GLU 79 Cb 1.21 -0.11 -0.10 0.00 -0.16 0.00 0.00 28.75 29.59 1afv h GLU 79 CO 0.13 0.35 0.00 2.35 -1.18 0.00 0.00 179.01 180.66 1afv h TRP 80 N 0.49 -0.04 -0.94 0.92 2.91 -1.30 0.07 115.95 118.07 1afv h TRP 80 Ca 0.13 0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.20 1afv h TRP 80 Cb -0.02 0.10 -0.05 0.00 -0.51 0.00 0.00 29.16 28.69 1afv h TRP 80 CO -0.04 -0.14 0.59 -0.44 -1.03 0.00 0.00 178.44 177.37 1afv h ASP 81 N 0.12 1.11 -0.09 2.65 3.32 -1.16 -2.39 116.42 119.99 1afv h ASP 81 Ca 0.29 -0.05 0.04 0.00 0.02 0.00 0.00 57.03 57.33 1afv h ASP 81 Cb 0.46 -0.28 -0.06 0.00 0.22 0.00 0.00 39.33 39.67 1afv h ASP 81 CO -0.48 0.83 -0.36 -0.09 -1.72 0.00 0.00 179.24 177.42 1afv h ARG 82 N 1.29 -0.45 -0.52 3.56 2.43 0.26 -0.19 114.38 120.76 1afv h ARG 82 Ca 0.34 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.54 1afv h ARG 82 Cb -0.09 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 1afv h ARG 82 CO -0.07 -0.30 0.00 1.47 -1.51 0.00 0.00 179.97 179.56 1afv n LEU 83 N -5.43 1.53 -3.26 3.80 -0.00 -1.04 -4.02 117.00 108.58 1afv n LEU 83 Ca -0.04 -0.77 -0.25 0.00 -0.00 0.00 0.00 56.01 54.95 1afv n LEU 83 Cb 0.34 -0.32 -0.07 0.00 -0.00 0.00 0.00 43.42 43.37 1afv n LEU 83 CO 0.15 0.29 -0.12 1.41 -0.00 0.00 0.00 177.39 179.12 1afv n HIS 84 N 0.09 1.49 0.00 1.47 8.25 -0.08 -4.97 115.22 121.47 1afv n HIS 84 Ca 0.06 -3.84 0.00 0.00 -0.26 0.00 0.00 57.72 53.69 1afv n HIS 84 Cb 0.31 -0.44 0.00 0.00 1.12 0.00 0.00 29.99 30.97 1afv n HIS 84 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1afv n PRO 85 N 1.00 0.00 -2.05 -0.41 -0.04 -1.24 -4.68 135.00 127.57 1afv n PRO 85 Ca 0.25 0.03 -0.15 0.00 -0.04 0.00 0.00 63.50 63.59 1afv n PRO 85 Cb 0.49 -1.51 -0.03 0.00 -0.04 0.00 0.00 33.50 32.41 1afv n PRO 85 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1afv n VAL 86 N -0.92 -0.45 -0.33 0.52 3.14 -1.26 -4.03 118.33 115.00 1afv n VAL 86 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1afv n VAL 86 Cb 0.01 -1.89 0.00 0.00 -1.06 0.00 0.00 33.84 30.90 1afv n VAL 86 CO 0.00 0.00 0.00 1.57 -6.46 0.00 0.00 176.83 171.94 1afv n HIS 87 N -2.99 0.00 -1.01 1.45 -0.00 -1.26 0.71 115.22 112.12 1afv n HIS 87 Ca -0.17 0.00 -0.00 0.00 0.46 0.00 0.00 57.72 58.01 1afv n HIS 87 Cb 0.58 0.00 -0.00 0.00 -0.12 0.00 0.00 29.99 30.45 1afv n HIS 87 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1afv n ALA 88 N 0.08 -0.00 0.00 1.57 0.00 -1.26 -4.88 120.51 116.02 1afv n ALA 88 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1afv n ALA 88 Cb 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 19.45 19.21 1afv n ALA 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1afv n GLY 89 N -2.86 -2.16 2.75 0.00 0.00 0.22 -4.71 105.19 98.43 1afv n GLY 89 Ca -0.00 -1.28 -0.42 0.00 0.00 0.00 0.00 46.02 44.32 1afv n GLY 89 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1afv n PRO 90 N -0.70 2.74 -1.69 1.61 -0.04 -1.26 -4.94 135.00 130.73 1afv n PRO 90 Ca 0.00 -2.52 -0.44 0.00 -0.04 0.00 0.00 63.50 60.50 1afv n PRO 90 Cb 0.00 -3.24 -0.04 0.00 -0.04 0.00 0.00 33.50 30.18 1afv n PRO 90 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1afv n ILE 91 N 5.15 0.01 -1.49 0.52 -5.35 -1.26 -4.58 119.36 112.35 1afv n ILE 91 Ca 0.52 -0.00 -0.00 0.00 -0.27 0.00 0.00 62.75 63.00 1afv n ILE 91 Cb 0.39 -1.71 -0.00 0.00 -1.74 0.00 0.00 39.64 36.58 1afv n ILE 91 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1afv n ALA 92 N 3.66 -2.68 -1.94 -1.28 0.00 -1.26 -4.94 120.51 112.06 1afv n ALA 92 Ca 0.17 0.20 -0.42 0.00 0.00 0.00 0.00 53.44 53.39 1afv n ALA 92 Cb 0.31 -0.57 -0.03 0.00 0.00 0.00 0.00 19.45 19.17 1afv n ALA 92 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1afv s PRO 93 N -1.49 4.17 0.00 0.00 0.04 -1.26 -3.99 135.00 132.47 1afv s PRO 93 Ca -0.00 2.28 0.00 0.00 0.04 0.00 0.00 61.00 63.32 1afv s PRO 93 Cb 0.00 -4.02 0.00 0.00 0.04 0.00 0.00 34.50 30.52 1afv s PRO 93 CO 0.01 -0.87 0.00 0.41 0.04 0.00 0.00 177.00 176.60 1afv n GLY 94 N 4.21 0.18 3.81 0.56 0.00 -1.26 -5.14 105.19 107.54 1afv n GLY 94 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 1afv n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1afv s GLN 95 N 0.00 4.36 0.45 1.61 -2.07 -1.26 -4.95 119.66 117.80 1afv s GLN 95 Ca 0.00 1.19 0.18 0.00 -1.82 0.00 0.00 55.36 54.90 1afv s GLN 95 Cb 0.00 -2.43 1.12 0.00 -1.09 0.00 0.00 33.01 30.61 1afv s GLN 95 CO 0.00 0.10 1.93 1.98 -1.32 0.00 0.00 175.29 177.97 1afv h MET 96 N 2.42 0.33 -1.79 9.60 1.85 -2.01 -3.48 114.93 121.86 1afv h MET 96 Ca -0.48 -0.02 0.07 0.00 -0.61 0.00 0.00 59.70 58.66 1afv h MET 96 Cb 1.18 -0.07 -0.04 0.00 0.43 0.00 0.00 31.60 33.10 1afv h MET 96 CO 0.63 0.22 -0.54 2.89 -0.40 0.00 0.00 176.91 179.71 1afv n ARG 97 N -4.46 -1.87 -2.52 0.39 1.85 -1.26 -4.88 116.66 103.91 1afv n ARG 97 Ca 0.14 1.48 -0.42 0.00 -1.00 0.00 0.00 57.85 58.05 1afv n ARG 97 Cb 0.57 -1.94 -0.03 0.00 -1.05 0.00 0.00 32.46 30.00 1afv n ARG 97 CO 0.00 0.00 0.00 -2.00 -0.01 0.00 0.00 177.63 175.62 1afv s GLU 98 N -4.28 4.50 0.20 2.89 2.56 -1.26 -4.97 118.70 118.34 1afv s GLU 98 Ca 0.00 1.66 -0.32 0.00 0.00 0.00 0.00 54.97 56.31 1afv s GLU 98 Cb 0.00 -3.37 -0.12 0.00 2.00 0.00 0.00 34.13 32.64 1afv s GLU 98 CO 0.00 -0.14 1.71 -0.35 -0.56 0.00 0.00 175.26 175.92 1afv n PRO 99 N 3.64 2.71 -3.73 4.30 -0.04 -1.26 -5.00 135.00 135.62 1afv n PRO 99 Ca 0.07 0.98 -0.22 0.00 -0.04 0.00 0.00 63.50 64.28 1afv n PRO 99 Cb 0.48 -2.82 -0.02 0.00 -0.04 0.00 0.00 33.50 31.10 1afv n PRO 99 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1afv s ARG 100 N 1.14 3.46 0.21 0.54 3.52 -1.26 -4.89 118.95 121.67 1afv s ARG 100 Ca 0.76 -0.58 -0.13 0.00 -0.13 0.00 0.00 55.73 55.65 1afv s ARG 100 Cb -0.53 -2.80 0.24 0.00 -1.56 0.00 0.00 34.95 30.31 1afv s ARG 100 CO 0.33 0.32 1.64 0.78 -0.81 0.00 0.00 175.30 177.56 1afv h GLY 101 N 1.05 0.50 2.00 8.12 0.00 -1.94 0.50 103.07 113.29 1afv h GLY 101 Ca -0.51 0.17 -0.02 0.00 0.00 0.00 0.00 47.33 46.97 1afv h GLY 101 CO 0.61 -0.23 -0.11 1.48 0.00 0.00 0.00 176.54 178.30 1afv h SER 102 N 0.03 0.00 0.06 0.19 4.64 -1.96 -0.27 113.55 116.25 1afv h SER 102 Ca 0.30 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.62 1afv h SER 102 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1afv h SER 102 CO -0.60 0.11 -0.03 0.44 -0.87 0.00 0.00 176.83 175.88 1afv h ASP 103 N 0.00 -0.07 -0.34 4.97 5.19 -0.45 -0.95 116.42 124.77 1afv h ASP 103 Ca -0.00 -0.57 0.04 0.00 -0.62 0.00 0.00 57.03 55.87 1afv h ASP 103 Cb 0.30 0.02 -0.02 0.00 0.18 0.00 0.00 39.33 39.81 1afv h ASP 103 CO 0.01 0.61 0.23 0.40 -3.12 0.00 0.00 179.24 177.37 1afv h ILE 104 N -0.82 1.00 0.00 0.35 2.04 -0.21 0.18 117.51 120.05 1afv h ILE 104 Ca -0.01 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1afv h ILE 104 Cb 0.64 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 37.37 1afv h ILE 104 CO 0.01 0.06 0.00 0.00 0.00 0.00 0.00 178.15 178.22 1afv h ALA 105 N 1.81 1.00 0.00 1.87 0.00 -1.06 -3.43 119.26 119.44 1afv h ALA 105 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1afv h ALA 105 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1afv h ALA 105 CO -0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.63 1afv n GLY 106 N 0.70 2.35 0.31 0.00 0.00 0.62 -4.86 105.19 104.31 1afv n GLY 106 Ca 0.03 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.97 1afv n GLY 106 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1afv h THR 107 N 0.00 1.26 -0.15 2.61 1.35 -1.41 -3.28 112.91 113.30 1afv h THR 107 Ca 0.00 -1.09 -0.06 0.00 -0.55 0.00 0.00 66.41 64.71 1afv h THR 107 Cb 0.00 0.69 -0.04 0.00 -1.73 0.00 0.00 68.15 67.08 1afv h THR 107 CO 0.00 0.40 -0.22 0.35 -0.25 0.00 0.00 175.52 175.81 1afv n THR 108 N -4.20 2.28 -4.53 6.82 -2.24 -0.79 -4.99 114.28 106.64 1afv n THR 108 Ca 0.04 -2.76 -0.22 0.00 -2.27 0.00 0.00 64.05 58.84 1afv n THR 108 Cb 0.32 -0.27 -0.16 0.00 -2.10 0.00 0.00 70.33 68.12 1afv n THR 108 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1afv s SER 109 N -2.80 1.49 0.41 3.42 1.04 -1.24 -4.68 113.70 111.34 1afv s SER 109 Ca 0.40 -0.24 -0.13 0.00 0.48 0.00 0.00 55.95 56.46 1afv s SER 109 Cb 0.36 -0.38 -0.08 0.00 0.10 0.00 0.00 66.02 66.03 1afv s SER 109 CO -0.01 0.10 0.81 0.42 0.98 0.00 0.00 173.24 175.53 1afv s THR 110 N 0.11 4.70 0.30 2.02 -4.23 -1.26 -4.86 115.64 112.41 1afv s THR 110 Ca -0.03 0.85 0.05 0.00 -1.18 0.00 0.00 61.69 61.38 1afv s THR 110 Cb -0.09 -3.69 0.29 0.00 1.34 0.00 0.00 72.50 70.34 1afv s THR 110 CO 0.01 -0.46 1.74 0.25 -0.54 0.00 0.00 174.62 175.62 1afv h LEU 111 N 1.47 0.60 -0.46 4.79 7.12 -2.00 0.20 115.31 127.03 1afv h LEU 111 Ca -0.47 0.12 -0.03 0.00 0.13 0.00 0.00 57.88 57.62 1afv h LEU 111 Cb 1.18 0.03 -0.02 0.00 -0.53 0.00 0.00 40.66 41.32 1afv h LEU 111 CO 0.64 0.16 0.16 1.56 -0.13 0.00 0.00 178.44 180.83 1afv h GLN 112 N 0.61 0.71 -0.11 1.25 1.08 -2.00 -2.50 115.11 114.16 1afv h GLN 112 Ca 0.57 -0.14 0.04 0.00 -1.45 0.00 0.00 58.65 57.66 1afv h GLN 112 Cb 0.97 -0.11 -0.04 0.00 -0.05 0.00 0.00 27.48 28.25 1afv h GLN 112 CO -0.43 0.66 -0.14 0.93 -0.95 0.00 0.00 178.83 178.89 1afv h GLU 113 N 0.61 -0.18 -0.83 1.46 5.08 -1.03 -0.35 114.58 119.34 1afv h GLU 113 Ca 0.15 0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.65 1afv h GLU 113 Cb 0.23 0.04 -0.09 0.00 0.50 0.00 0.00 28.75 29.44 1afv h GLU 113 CO -0.01 -0.12 0.44 1.96 -1.00 0.00 0.00 179.01 180.28 1afv h GLN 114 N -0.19 0.65 -0.29 2.33 4.20 -1.13 0.04 115.11 120.73 1afv h GLN 114 Ca 0.09 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1afv h GLN 114 Cb 0.31 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 1afv h GLN 114 CO -0.22 0.43 0.19 0.82 -0.67 0.00 0.00 178.83 179.38 1afv h ILE 115 N 0.67 1.08 -0.71 2.54 1.08 -0.83 -2.00 117.51 119.36 1afv h ILE 115 Ca 0.44 -0.17 0.10 0.00 -0.39 0.00 0.00 64.86 64.84 1afv h ILE 115 Cb 0.55 0.67 -0.07 0.00 -3.07 0.00 0.00 36.82 34.89 1afv h ILE 115 CO -0.32 0.08 0.34 1.23 -0.69 0.00 0.00 178.15 178.79 1afv h GLY 116 N 0.39 1.06 1.42 5.37 0.00 0.64 -1.00 103.07 110.94 1afv h GLY 116 Ca 0.11 -0.21 -0.10 0.00 0.00 0.00 0.00 47.33 47.12 1afv h GLY 116 CO -0.02 0.04 -0.21 1.49 0.00 0.00 0.00 176.54 177.83 1afv h TRP 117 N 0.57 0.76 0.00 5.60 6.55 -1.02 -2.46 115.95 125.95 1afv h TRP 117 Ca 0.35 -0.16 0.00 0.00 0.95 0.00 0.00 58.89 60.03 1afv h TRP 117 Cb 0.40 -0.19 0.00 0.00 -0.86 0.00 0.00 29.16 28.51 1afv h TRP 117 CO -0.12 0.83 0.00 -1.33 -1.05 0.00 0.00 178.44 176.78 1afv n MET 118 N -4.12 0.90 -3.11 0.49 2.81 -0.48 -1.37 117.12 112.24 1afv n MET 118 Ca 0.00 0.00 -0.20 0.00 -1.81 0.00 0.00 57.70 55.69 1afv n MET 118 Cb 0.41 -1.46 -0.04 0.00 -0.71 0.00 0.00 33.22 31.43 1afv n MET 118 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1afv n THR 119 N -0.96 -0.46 -3.70 2.03 -2.24 -0.61 -4.91 114.28 103.43 1afv n THR 119 Ca 0.20 -3.67 -0.10 0.00 -2.27 0.00 0.00 64.05 58.21 1afv n THR 119 Cb 0.09 -0.97 -0.04 0.00 -2.10 0.00 0.00 70.33 67.31 1afv n THR 119 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1afv s HIS 120 N -1.11 -0.13 0.19 4.78 5.04 -1.22 -4.84 115.29 118.00 1afv s HIS 120 Ca 0.35 -0.20 -0.33 0.00 -1.54 0.00 0.00 55.06 53.34 1afv s HIS 120 Cb 0.22 0.32 -0.15 0.00 0.04 0.00 0.00 32.58 33.01 1afv s HIS 120 CO -0.12 -0.82 1.30 0.09 -2.34 0.00 0.00 174.74 172.85 1afv n ASN 121 N -0.29 1.99 -3.15 9.88 4.13 -1.26 -1.50 115.26 125.05 1afv n ASN 121 Ca -0.12 1.13 -0.18 0.00 1.68 0.00 0.00 54.58 57.09 1afv n ASN 121 Cb 0.63 -1.30 0.02 0.00 -1.54 0.00 0.00 39.78 37.59 1afv n ASN 121 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 1afv n PRO 122 N 2.06 -2.00 -1.63 3.52 -0.02 -1.26 -4.83 135.00 130.83 1afv n PRO 122 Ca 0.14 1.71 -0.44 0.00 -2.02 0.00 0.00 63.50 62.90 1afv n PRO 122 Cb 0.27 -3.41 -0.03 0.00 -0.02 0.00 0.00 33.50 30.30 1afv n PRO 122 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1afv n PRO 123 N 0.14 2.34 -2.82 0.52 -0.04 -0.56 -4.94 135.00 129.64 1afv n PRO 123 Ca 0.00 0.78 -0.43 0.00 -0.04 0.00 0.00 63.50 63.82 1afv n PRO 123 Cb 0.50 -3.03 -0.04 0.00 -0.04 0.00 0.00 33.50 30.89 1afv n PRO 123 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1afv s ILE 124 N 6.06 4.41 -0.62 0.52 -1.09 -0.47 -4.93 121.20 125.07 1afv s ILE 124 Ca 0.95 0.46 -0.06 0.00 -2.23 0.00 0.00 60.65 59.77 1afv s ILE 124 Cb -0.45 -4.51 -0.12 0.00 -1.58 0.00 0.00 42.46 35.80 1afv s ILE 124 CO 0.41 -1.02 2.57 -0.81 -1.23 0.00 0.00 174.94 174.86 1afv n PRO 125 N 7.39 2.09 -0.33 2.79 -0.04 -1.26 -3.64 135.00 141.99 1afv n PRO 125 Ca 0.03 -1.25 0.16 0.00 -0.04 0.00 0.00 63.50 62.40 1afv n PRO 125 Cb 0.48 -2.24 0.31 0.00 -0.04 0.00 0.00 33.50 32.01 1afv n PRO 125 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 1afv h VAL 126 N 2.82 0.05 -0.39 0.52 -1.51 -1.91 0.38 116.25 116.21 1afv h VAL 126 Ca 0.40 -0.01 -0.09 0.00 -1.23 0.00 0.00 66.70 65.78 1afv h VAL 126 Cb 0.62 0.02 -0.01 0.00 -2.13 0.00 0.00 31.29 29.79 1afv h VAL 126 CO 0.98 0.00 -0.09 1.23 -1.23 0.00 0.00 177.57 178.47 1afv h GLY 127 N 0.03 0.82 0.94 5.19 0.00 -1.84 -0.37 103.07 107.83 1afv h GLY 127 Ca 0.61 -0.67 -0.03 0.00 0.00 0.00 0.00 47.33 47.24 1afv h GLY 127 CO -0.88 0.61 0.12 -2.09 0.00 0.00 0.00 176.54 174.30 1afv h GLU 128 N 0.57 0.64 -0.02 4.80 4.57 -0.62 0.26 114.58 124.77 1afv h GLU 128 Ca 0.10 -0.14 -0.00 0.00 -1.18 0.00 0.00 59.36 58.14 1afv h GLU 128 Cb 0.60 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.10 1afv h GLU 128 CO 0.04 0.64 0.01 0.82 -1.18 0.00 0.00 179.01 179.34 1afv h ILE 129 N 0.52 1.12 -0.88 2.32 2.04 -0.65 -1.97 117.51 120.01 1afv h ILE 129 Ca 0.13 -0.37 0.03 0.00 1.00 0.00 0.00 64.86 65.66 1afv h ILE 129 Cb 0.27 1.33 -0.05 0.00 -0.74 0.00 0.00 36.82 37.63 1afv h ILE 129 CO -0.00 0.10 0.58 0.22 0.00 0.00 0.00 178.15 179.05 1afv h TYR 130 N -0.11 1.07 0.00 1.37 3.20 -0.90 0.49 116.97 122.09 1afv h TYR 130 Ca 0.01 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 1afv h TYR 130 Cb 0.15 -0.36 -0.00 0.00 1.54 0.00 0.00 36.73 38.06 1afv h TYR 130 CO -0.02 0.63 -0.07 -0.22 -1.64 0.00 0.00 178.16 176.83 1afv h LYS 131 N 1.11 0.00 0.02 1.82 3.64 -0.06 -1.45 116.57 121.65 1afv h LYS 131 Ca 0.35 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.68 1afv h LYS 131 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1afv h LYS 131 CO -0.10 0.07 -0.20 0.00 -2.27 0.00 0.00 179.45 176.95 1afv h ARG 132 N 0.00 0.10 -0.52 1.90 3.08 -0.17 -3.12 114.38 115.64 1afv h ARG 132 Ca -0.00 -0.13 0.05 0.00 0.07 0.00 0.00 59.98 59.97 1afv h ARG 132 Cb 0.20 0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.25 1afv h ARG 132 CO 0.01 0.98 0.25 -1.49 -1.07 0.00 0.00 179.97 178.64 1afv h TRP 133 N -0.72 0.45 -0.41 3.04 6.55 -0.83 -1.85 115.95 122.18 1afv h TRP 133 Ca -0.03 0.02 0.04 0.00 0.95 0.00 0.00 58.89 59.87 1afv h TRP 133 Cb 1.06 -0.12 -0.04 0.00 -0.86 0.00 0.00 29.16 29.20 1afv h TRP 133 CO 0.23 0.20 0.19 0.82 -1.05 0.00 0.00 178.44 178.82 1afv h ILE 134 N 0.48 0.94 -0.86 1.49 2.04 -1.41 -1.77 117.51 118.41 1afv h ILE 134 Ca 0.24 -0.13 0.03 0.00 1.00 0.00 0.00 64.86 66.00 1afv h ILE 134 Cb 0.18 0.53 -0.05 0.00 -0.74 0.00 0.00 36.82 36.74 1afv h ILE 134 CO -0.19 0.07 0.57 0.40 0.00 0.00 0.00 178.15 179.00 1afv h ILE 135 N 0.38 1.16 -0.24 -0.67 2.04 -1.34 0.24 117.51 119.09 1afv h ILE 135 Ca 0.18 -0.38 -0.04 0.00 1.00 0.00 0.00 64.86 65.63 1afv h ILE 135 Cb 0.11 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.15 1afv h ILE 135 CO -0.14 0.20 -0.01 -0.07 0.00 0.00 0.00 178.15 178.13 1afv h LEU 136 N 1.10 0.33 -0.14 1.44 4.07 -0.69 0.93 115.31 122.34 1afv h LEU 136 Ca 0.33 -0.05 -0.09 0.00 0.08 0.00 0.00 57.88 58.15 1afv h LEU 136 Cb -0.02 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 41.64 1afv h LEU 136 CO -0.09 0.40 -0.28 1.23 -1.08 0.00 0.00 178.44 178.62 1afv h GLY 137 N 0.68 0.47 0.92 0.83 0.00 0.11 -2.74 103.07 103.34 1afv h GLY 137 Ca 0.08 -0.56 -0.02 0.00 0.00 0.00 0.00 47.33 46.83 1afv h GLY 137 CO 0.01 0.51 0.12 1.41 0.00 0.00 0.00 176.54 178.59 1afv h LEU 138 N 0.04 0.41 -1.18 3.11 3.38 -0.06 -2.60 115.31 118.40 1afv h LEU 138 Ca 0.00 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1afv h LEU 138 Cb 0.87 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1afv h LEU 138 CO 0.06 0.46 0.00 -0.55 0.09 0.00 0.00 178.44 178.50 1afv h ASN 139 N 0.34 0.00 0.54 -0.43 -0.00 -0.91 -1.09 115.58 114.03 1afv h ASN 139 Ca 0.10 0.00 -0.23 0.00 -0.00 0.00 0.00 56.30 56.17 1afv h ASN 139 Cb 0.17 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 38.49 1afv h ASN 139 CO -0.01 0.00 -1.00 0.11 -0.00 0.00 0.00 177.43 176.53 1afv h LYS 140 N 0.00 0.27 0.47 4.14 1.79 -1.29 -2.02 116.57 119.93 1afv h LYS 140 Ca 0.00 -0.34 -0.02 0.00 -2.18 0.00 0.00 60.65 58.11 1afv h LYS 140 Cb 0.54 0.11 0.00 0.00 -1.58 0.00 0.00 32.23 31.30 1afv h LYS 140 CO 0.00 1.07 -0.22 0.82 -1.08 0.00 0.00 179.45 180.04 1afv h ILE 141 N 0.13 0.00 -0.90 1.86 2.04 -1.07 -2.16 117.51 117.42 1afv h ILE 141 Ca -0.08 -0.18 0.21 0.00 1.00 0.00 0.00 64.86 65.82 1afv h ILE 141 Cb 1.66 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 37.57 1afv h ILE 141 CO 0.16 0.00 -0.06 0.58 0.00 0.00 0.00 178.15 178.83 1afv h VAL 142 N -0.80 0.14 0.86 1.67 2.07 -1.27 0.59 116.25 119.49 1afv h VAL 142 Ca -0.06 -0.01 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 1afv h VAL 142 Cb 0.48 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.35 1afv h VAL 142 CO 0.11 0.01 -0.48 -0.09 0.02 0.00 0.00 177.57 177.14 1afv h ARG 143 N 0.04 -1.19 -1.41 1.57 2.43 -1.36 -2.99 114.38 111.47 1afv h ARG 143 Ca 0.49 0.08 -0.27 0.00 -0.81 0.00 0.00 59.98 59.47 1afv h ARG 143 Cb 0.90 0.27 -0.13 0.00 -0.42 0.00 0.00 29.97 30.60 1afv h ARG 143 CO -0.85 -0.79 0.35 -1.33 -1.51 0.00 0.00 179.97 175.83 1afv n MET 144 N -5.63 1.67 0.00 0.20 2.81 0.01 -4.59 117.12 111.59 1afv n MET 144 Ca -0.15 -1.37 0.00 0.00 -1.81 0.00 0.00 57.70 54.36 1afv n MET 144 Cb 0.50 -1.54 0.00 0.00 -0.71 0.00 0.00 33.22 31.48 1afv n MET 144 CO 0.00 0.00 0.00 0.98 1.51 0.00 0.00 175.97 178.46 1afv n TYR 145 N 0.27 0.00 0.07 2.03 9.36 -0.12 -4.96 117.16 123.81 1afv n TYR 145 Ca 0.27 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.49 1afv n TYR 145 Cb 0.69 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.40 1afv n TYR 145 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1afv n SER 146 N 0.00 -1.22 -2.54 2.98 2.88 -1.21 -3.71 113.62 110.80 1afv n SER 146 Ca 0.00 0.32 -0.06 0.00 -1.33 0.00 0.00 58.87 57.81 1afv n SER 146 Cb 0.00 1.39 0.03 0.00 -0.75 0.00 0.00 64.21 64.89 1afv n SER 146 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1afv n PRO 147 N -2.64 0.20 0.00 -1.46 -0.04 -1.26 -4.86 135.00 124.93 1afv n PRO 147 Ca 0.00 -0.58 0.00 0.00 -0.04 0.00 0.00 63.50 62.88 1afv n PRO 147 Cb 0.00 -0.21 0.00 0.00 -0.04 0.00 0.00 33.50 33.25 1afv n PRO 147 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1afv n THR 148 N -1.95 0.00 -2.27 0.52 -2.24 -1.26 -5.14 114.28 101.93 1afv n THR 148 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1afv n THR 148 Cb 0.14 -0.76 0.00 0.00 -2.10 0.00 0.00 70.33 67.61 1afv n THR 148 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1afv n SER 149 N -1.12 0.00 -4.38 3.42 7.64 -1.26 -5.05 113.62 112.87 1afv n SER 149 Ca 0.00 -0.14 -0.40 0.00 1.01 0.00 0.00 58.87 59.34 1afv n SER 149 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 1afv n SER 149 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1afv n ILE 150 N 0.00 3.40 0.94 0.44 -5.35 -1.26 -5.28 119.36 112.25 1afv n ILE 150 Ca 0.00 -3.42 0.11 0.00 -0.27 0.00 0.00 62.75 59.17 1afv n ILE 150 Cb 0.00 -2.36 0.09 0.00 -1.74 0.00 0.00 39.64 35.63 1afv n ILE 150 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97