#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fva n VAL 29 N 0.00 0.57 -2.33 9.51 3.14 -1.26 -4.86 118.33 123.10 1fva n VAL 29 Ca 0.00 -0.14 -0.42 0.00 -2.96 0.00 0.00 64.34 60.82 1fva n VAL 29 Cb 0.00 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 32.75 1fva n VAL 29 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1fva s SER 30 N -0.28 6.97 0.27 6.55 1.04 -1.26 -4.85 113.70 122.14 1fva s SER 30 Ca 0.49 2.07 -0.08 0.00 0.48 0.00 0.00 55.95 58.92 1fva s SER 30 Cb -0.70 -2.57 0.45 0.00 0.10 0.00 0.00 66.02 63.30 1fva s SER 30 CO 0.35 -0.58 1.57 -0.65 0.98 0.00 0.00 173.24 174.91 1fva h PRO 31 N 7.11 0.00 -1.02 4.02 0.11 -1.98 1.51 132.00 141.75 1fva h PRO 31 Ca -0.40 -0.00 0.26 0.00 0.11 0.00 0.00 66.00 65.97 1fva h PRO 31 Cb 1.20 -0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.19 1fva h PRO 31 CO 0.85 0.00 0.63 -0.56 -0.21 0.00 0.00 178.00 178.71 1fva h GLN 32 N 0.00 0.48 -0.01 1.05 3.07 -2.01 -0.24 115.11 117.46 1fva h GLN 32 Ca 0.47 -0.03 0.00 0.00 0.09 0.00 0.00 58.65 59.18 1fva h GLN 32 Cb 0.72 -0.11 0.00 0.00 0.08 0.00 0.00 27.48 28.17 1fva h GLN 32 CO -0.99 0.32 -0.30 -1.91 0.09 0.00 0.00 178.83 176.04 1fva n GLU 33 N -4.80 0.77 -1.73 0.06 2.13 0.50 -4.99 120.64 112.59 1fva n GLU 33 Ca 0.27 -0.47 -0.38 0.00 0.66 0.00 0.00 57.16 57.24 1fva n GLU 33 Cb 0.82 -1.49 0.06 0.00 0.27 0.00 0.00 31.44 31.10 1fva n GLU 33 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1fva n ALA 34 N -0.70 1.30 -1.73 4.31 0.00 -0.10 -4.89 120.51 118.69 1fva n ALA 34 Ca 0.11 0.05 -0.40 0.00 0.00 0.00 0.00 53.44 53.20 1fva n ALA 34 Cb 0.35 -2.33 0.02 0.00 0.00 0.00 0.00 19.45 17.50 1fva n ALA 34 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1fva n LEU 35 N -1.54 4.89 -0.07 0.00 4.77 -0.38 -4.90 117.00 119.76 1fva n LEU 35 Ca 0.14 1.07 -0.07 0.00 -0.03 0.00 0.00 56.01 57.11 1fva n LEU 35 Cb 0.47 -1.56 -0.01 0.00 -2.33 0.00 0.00 43.42 39.99 1fva n LEU 35 CO 0.49 -0.47 0.73 -0.65 -1.33 0.00 0.00 177.39 176.16 1fva h PRO 36 N 1.93 -0.15 0.00 3.23 0.11 -1.93 -3.38 132.00 131.80 1fva h PRO 36 Ca -0.50 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1fva h PRO 36 Cb 1.29 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1fva h PRO 36 CO 0.59 -0.10 0.00 0.41 -0.21 0.00 0.00 178.00 178.69 1fva n GLY 37 N -1.35 0.92 3.58 -0.55 0.00 -1.26 -4.44 105.19 102.09 1fva n GLY 37 Ca 0.00 -1.44 -0.08 0.00 0.00 0.00 0.00 46.02 44.50 1fva n GLY 37 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1fva s ARG 38 N 0.00 0.50 0.08 1.61 1.70 -0.62 -4.99 118.95 117.23 1fva s ARG 38 Ca 0.00 0.04 0.16 0.00 -0.47 0.00 0.00 55.73 55.46 1fva s ARG 38 Cb 0.00 0.23 -0.12 0.00 -0.57 0.00 0.00 34.95 34.49 1fva s ARG 38 CO 0.00 -0.17 0.89 0.87 -1.08 0.00 0.00 175.30 175.81 1fva h LYS 39 N 2.35 0.00 -5.83 3.89 1.57 -1.92 -3.30 116.57 113.33 1fva h LYS 39 Ca -0.16 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.03 1fva h LYS 39 Cb 1.18 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 33.41 1fva h LYS 39 CO 0.29 0.34 0.37 -1.21 -0.57 0.00 0.00 179.45 178.67 1fva s GLU 40 N -2.90 4.24 0.75 3.15 2.02 -1.26 -4.97 118.70 119.72 1fva s GLU 40 Ca -0.02 0.92 -0.12 0.00 0.02 0.00 0.00 54.97 55.77 1fva s GLU 40 Cb 0.09 -3.60 0.04 0.00 0.10 0.00 0.00 34.13 30.75 1fva s GLU 40 CO 0.81 -0.39 1.11 -1.25 0.02 0.00 0.00 175.26 175.56 1fva s PRO 41 N 2.38 2.50 0.55 0.39 0.04 -1.26 -4.86 135.00 134.74 1fva s PRO 41 Ca 0.35 0.44 -0.11 0.00 0.04 0.00 0.00 61.00 61.72 1fva s PRO 41 Cb -0.16 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.35 1fva s PRO 41 CO 0.10 -1.29 0.95 -0.51 0.04 0.00 0.00 177.00 176.30 1fva s LEU 42 N -5.51 3.45 -0.15 -3.56 1.43 -1.26 -5.06 118.68 108.02 1fva s LEU 42 Ca 0.59 1.35 -0.04 0.00 -1.03 0.00 0.00 54.13 55.00 1fva s LEU 42 Cb -0.12 -4.34 -0.03 0.00 0.03 0.00 0.00 46.19 41.73 1fva s LEU 42 CO 0.52 -0.71 -0.02 -0.69 0.23 0.00 0.00 176.35 175.68 1fva s VAL 43 N -2.89 4.05 0.19 -1.59 1.01 -1.26 -4.97 120.40 114.94 1fva s VAL 43 Ca 0.54 -0.30 0.01 0.00 0.00 0.00 0.00 61.98 62.23 1fva s VAL 43 Cb -0.11 -2.78 -0.05 0.00 0.00 0.00 0.00 36.38 33.45 1fva s VAL 43 CO 0.45 0.50 0.04 0.68 0.00 0.00 0.00 175.10 176.77 1fva s VAL 44 N 0.27 0.53 0.40 2.92 -7.23 -1.26 -3.97 120.40 112.06 1fva s VAL 44 Ca -0.02 -1.98 -0.27 0.00 -1.81 0.00 0.00 61.98 57.91 1fva s VAL 44 Cb -0.14 -2.27 -0.10 0.00 0.56 0.00 0.00 36.38 34.43 1fva s VAL 44 CO 0.02 -0.32 1.41 0.00 -0.31 0.00 0.00 175.10 175.91 1fva n ALA 45 N -0.29 1.97 1.07 1.32 0.00 -1.26 -4.89 120.51 118.43 1fva n ALA 45 Ca -0.04 0.30 0.14 0.00 0.00 0.00 0.00 53.44 53.84 1fva n ALA 45 Cb 0.64 -2.37 0.63 0.00 0.00 0.00 0.00 19.45 18.36 1fva n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fva n ALA 46 N 0.12 2.39 -2.44 0.00 0.00 -1.26 -4.67 120.51 114.66 1fva n ALA 46 Ca 0.04 -0.11 -0.30 0.00 0.00 0.00 0.00 53.44 53.06 1fva n ALA 46 Cb 0.39 -1.46 -0.13 0.00 0.00 0.00 0.00 19.45 18.25 1fva n ALA 46 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1fva s LYS 47 N -2.92 1.89 0.08 0.00 -0.14 -1.26 -0.93 119.74 116.45 1fva s LYS 47 Ca 0.16 -1.08 -0.31 0.00 -1.36 0.00 0.00 55.97 53.38 1fva s LYS 47 Cb 0.19 -2.10 -0.07 0.00 -1.68 0.00 0.00 37.83 34.17 1fva s LYS 47 CO 0.52 0.51 1.35 -1.58 -0.76 0.00 0.00 175.35 175.40 1fva s HIS 48 N -0.96 3.21 0.38 3.18 2.46 0.72 -4.79 115.29 119.50 1fva s HIS 48 Ca 0.15 1.00 0.10 0.00 0.47 0.00 0.00 55.06 56.78 1fva s HIS 48 Cb -0.10 -3.62 0.86 0.00 -0.13 0.00 0.00 32.58 29.59 1fva s HIS 48 CO 0.06 -2.15 1.94 1.25 -2.47 0.00 0.00 174.74 173.36 1fva h HIS 49 N 7.00 0.67 0.08 3.88 2.76 -1.91 -0.56 115.15 127.07 1fva h HIS 49 Ca -0.41 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 57.77 1fva h HIS 49 Cb 1.20 -0.22 0.00 0.00 1.55 0.00 0.00 27.41 29.95 1fva h HIS 49 CO 0.68 0.31 -0.04 0.28 -1.30 0.00 0.00 177.93 177.86 1fva h VAL 50 N 0.62 0.00 -0.05 5.26 2.07 -1.94 -3.41 116.25 118.79 1fva h VAL 50 Ca 0.34 -0.79 0.00 0.00 0.82 0.00 0.00 66.70 67.07 1fva h VAL 50 Cb 0.51 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1fva h VAL 50 CO -0.12 0.00 0.00 -0.46 0.02 0.00 0.00 177.57 177.01 1fva n ASN 51 N -4.51 2.42 0.00 0.57 0.23 -1.24 -4.99 115.26 107.75 1fva n ASN 51 Ca -0.01 -1.70 0.00 0.00 -0.53 0.00 0.00 54.58 52.34 1fva n ASN 51 Cb 0.04 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 37.72 1fva n ASN 51 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1fva n GLY 52 N 0.92 1.83 3.51 4.83 0.00 -0.22 -4.95 105.19 111.10 1fva n GLY 52 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 1fva n GLY 52 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1fva s ASN 53 N -3.29 1.14 0.36 1.61 0.01 -1.26 -4.00 114.94 109.51 1fva s ASN 53 Ca 0.00 1.68 -0.27 0.00 -0.71 0.00 0.00 52.86 53.56 1fva s ASN 53 Cb 0.00 -2.39 -0.09 0.00 0.41 0.00 0.00 41.25 39.17 1fva s ASN 53 CO 0.00 -4.13 1.22 -0.13 -1.51 0.00 0.00 177.10 172.55 1fva s ARG 54 N -4.45 4.22 0.00 -0.60 0.52 -1.26 -0.20 118.95 117.18 1fva s ARG 54 Ca 0.68 2.00 0.12 0.00 -0.52 0.00 0.00 55.73 58.01 1fva s ARG 54 Cb -0.25 -2.88 0.09 0.00 0.52 0.00 0.00 34.95 32.42 1fva s ARG 54 CO 0.64 -0.23 0.86 0.25 0.02 0.00 0.00 175.30 176.85 1fva n THR 55 N 0.47 0.00 -4.00 0.02 -2.24 -0.11 -4.75 114.28 103.67 1fva n THR 55 Ca 0.02 -0.49 -0.08 0.00 -2.27 0.00 0.00 64.05 61.23 1fva n THR 55 Cb 0.44 1.24 -0.09 0.00 -2.10 0.00 0.00 70.33 69.82 1fva n THR 55 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1fva s VAL 56 N -1.03 0.18 0.55 2.28 -7.23 -1.26 -4.93 120.40 108.95 1fva s VAL 56 Ca 0.14 -1.44 -0.19 0.00 -1.81 0.00 0.00 61.98 58.67 1fva s VAL 56 Cb 0.10 -1.23 -0.08 0.00 0.56 0.00 0.00 36.38 35.73 1fva s VAL 56 CO 0.16 -0.80 0.75 -0.62 -0.31 0.00 0.00 175.10 174.29 1fva n GLU 57 N 0.37 0.78 -2.93 4.82 4.71 -1.26 -4.49 120.64 122.63 1fva n GLU 57 Ca -0.16 0.30 -0.30 0.00 -0.01 0.00 0.00 57.16 56.98 1fva n GLU 57 Cb 0.60 -1.90 -0.03 0.00 -1.01 0.00 0.00 31.44 29.10 1fva n GLU 57 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 1fva s PRO 58 N -2.27 3.76 0.32 3.49 0.04 -1.26 -5.17 135.00 133.91 1fva s PRO 58 Ca 0.70 0.40 0.06 0.00 0.04 0.00 0.00 61.00 62.21 1fva s PRO 58 Cb -0.46 -2.43 -0.01 0.00 0.04 0.00 0.00 34.50 31.63 1fva s PRO 58 CO 0.52 0.00 0.43 -0.06 0.04 0.00 0.00 177.00 177.94 1fva s PHE 59 N -2.33 3.15 0.78 0.56 0.40 -1.26 -4.96 117.98 114.33 1fva s PHE 59 Ca 0.50 -0.19 -0.13 0.00 -0.60 0.00 0.00 56.93 56.51 1fva s PHE 59 Cb -0.10 -1.90 0.07 0.00 0.51 0.00 0.00 43.02 41.60 1fva s PHE 59 CO 0.31 0.09 1.19 -2.14 0.70 0.00 0.00 175.22 175.37 1fva s PRO 60 N -4.12 1.82 0.22 0.24 0.02 -1.26 -4.91 135.00 127.01 1fva s PRO 60 Ca 0.43 1.69 -0.31 0.00 0.02 0.00 0.00 61.00 62.83 1fva s PRO 60 Cb -0.09 -1.80 -0.11 0.00 0.02 0.00 0.00 34.50 32.52 1fva s PRO 60 CO 0.30 -2.06 1.59 -2.00 -0.33 0.00 0.00 177.00 174.50 1fva s GLU 61 N -4.16 4.18 0.00 5.54 2.12 -1.26 -2.03 118.70 123.09 1fva s GLU 61 Ca 0.72 2.46 0.00 0.00 0.36 0.00 0.00 54.97 58.51 1fva s GLU 61 Cb -0.27 -3.09 0.00 0.00 0.26 0.00 0.00 34.13 31.02 1fva s GLU 61 CO 0.49 -0.61 0.00 0.41 -0.54 0.00 0.00 175.26 175.01 1fva n GLY 62 N 3.13 2.05 3.80 -1.50 0.00 -1.26 -5.05 105.19 106.35 1fva n GLY 62 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 1fva n GLY 62 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fva s THR 63 N -2.45 3.69 0.22 2.61 -4.23 -0.86 -4.33 115.64 110.28 1fva s THR 63 Ca 0.00 0.63 0.03 0.00 -1.18 0.00 0.00 61.69 61.17 1fva s THR 63 Cb 0.00 -3.23 -0.05 0.00 1.34 0.00 0.00 72.50 70.56 1fva s THR 63 CO 0.00 -0.63 -0.00 -1.10 -0.54 0.00 0.00 174.62 172.34 1fva s GLN 64 N -4.66 1.28 -0.03 3.99 -0.21 -0.03 -4.95 119.66 115.05 1fva s GLN 64 Ca 0.61 -1.64 0.05 0.00 0.02 0.00 0.00 55.36 54.40 1fva s GLN 64 Cb -0.16 -0.53 -0.01 0.00 1.00 0.00 0.00 33.01 33.31 1fva s GLN 64 CO 0.49 -0.10 -0.17 -1.64 -2.12 0.00 0.00 175.29 171.75 1fva s MET 65 N -3.88 1.65 0.01 2.91 -1.94 -1.26 -0.77 119.30 116.03 1fva s MET 65 Ca 0.27 -0.62 0.05 0.00 -1.71 0.00 0.00 55.69 53.68 1fva s MET 65 Cb 0.06 -1.49 -0.03 0.00 2.01 0.00 0.00 34.83 35.37 1fva s MET 65 CO 0.08 0.30 -0.14 0.00 -0.01 0.00 0.00 175.02 175.24 1fva s ALA 66 N -0.15 2.71 -0.16 3.03 0.00 0.10 -4.61 121.76 122.69 1fva s ALA 66 Ca 0.01 -1.10 -0.00 0.00 0.00 0.00 0.00 51.96 50.86 1fva s ALA 66 Cb -0.10 -0.89 0.04 0.00 0.00 0.00 0.00 23.12 22.18 1fva s ALA 66 CO 0.01 0.58 -0.06 0.08 0.00 0.00 0.00 175.76 176.37 1fva s VAL 67 N -0.89 1.16 0.01 0.00 1.01 -1.26 -0.11 120.40 120.31 1fva s VAL 67 Ca 0.14 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 61.53 1fva s VAL 67 Cb -0.11 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 34.95 1fva s VAL 67 CO 0.05 0.16 -0.13 -0.36 0.00 0.00 0.00 175.10 174.81 1fva s PHE 68 N 1.62 1.19 -0.22 5.22 0.40 -0.04 -1.30 117.98 124.85 1fva s PHE 68 Ca 0.01 -0.26 -0.07 0.00 -0.60 0.00 0.00 56.93 56.01 1fva s PHE 68 Cb -0.15 -0.74 -0.03 0.00 0.51 0.00 0.00 43.02 42.61 1fva s PHE 68 CO -0.08 -0.00 0.05 0.20 0.70 0.00 0.00 175.22 176.09 1fva s GLY 69 N -0.58 1.77 -0.02 4.36 0.00 0.83 -0.46 107.32 113.22 1fva s GLY 69 Ca 0.04 -1.02 0.03 0.00 0.00 0.00 0.00 44.72 43.77 1fva s GLY 69 CO 0.00 0.35 0.85 1.03 0.00 0.00 0.00 173.10 175.33 1fva n MET 70 N 4.46 0.65 0.00 2.90 2.81 -1.26 -1.10 117.12 125.58 1fva n MET 70 Ca -0.17 -1.14 0.00 0.00 -1.81 0.00 0.00 57.70 54.59 1fva n MET 70 Cb 0.52 -0.73 0.00 0.00 -0.71 0.00 0.00 33.22 32.30 1fva n MET 70 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1fva n GLY 71 N -0.29 0.58 3.70 3.03 0.00 -1.21 -4.83 105.19 106.17 1fva n GLY 71 Ca 0.02 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.88 1fva n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fva n PHE 73 N 5.26 0.30 0.42 0.00 1.16 -1.26 -3.24 117.46 120.09 1fva n PHE 73 Ca 0.17 0.12 -0.17 0.00 -1.87 0.00 0.00 57.45 55.70 1fva n PHE 73 Cb 0.38 -0.69 -0.08 0.00 -1.61 0.00 0.00 39.48 37.48 1fva n PHE 73 CO 0.00 0.00 0.00 -1.49 -1.87 0.00 0.00 176.76 173.40 1fva h TRP 74 N 0.00 -1.01 -0.50 2.97 6.55 -1.89 -0.76 115.95 121.31 1fva h TRP 74 Ca 0.00 -0.02 -0.01 0.00 0.95 0.00 0.00 58.89 59.80 1fva h TRP 74 Cb 0.31 0.34 -0.02 0.00 -0.86 0.00 0.00 29.16 28.92 1fva h TRP 74 CO 0.00 -0.63 0.25 0.78 -1.05 0.00 0.00 178.44 177.79 1fva h GLY 75 N -1.29 0.74 1.00 1.49 0.00 -1.72 -2.81 103.07 100.49 1fva h GLY 75 Ca -0.11 -0.32 -0.08 0.00 0.00 0.00 0.00 47.33 46.81 1fva h GLY 75 CO 0.18 0.31 -0.03 0.00 0.00 0.00 0.00 176.54 177.00 1fva h ALA 76 N 1.59 0.63 -0.62 3.60 0.00 -1.51 -3.14 119.26 119.80 1fva h ALA 76 Ca 0.18 -0.30 0.04 0.00 0.00 0.00 0.00 54.91 54.83 1fva h ALA 76 Cb 0.05 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 1fva h ALA 76 CO -0.03 0.47 0.36 1.49 0.00 0.00 0.00 179.25 181.54 1fva h GLU 77 N 0.70 0.67 -0.18 0.00 4.81 -0.86 -1.77 114.58 117.95 1fva h GLU 77 Ca 0.13 -0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.37 1fva h GLU 77 Cb 0.55 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1fva h GLU 77 CO 0.03 0.45 0.14 -0.09 -0.73 0.00 0.00 179.01 178.81 1fva h ARG 78 N 0.69 0.00 0.00 1.92 2.43 -1.50 -0.84 114.38 117.09 1fva h ARG 78 Ca 0.27 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.44 1fva h ARG 78 Cb 0.10 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1fva h ARG 78 CO -0.14 0.00 0.00 0.87 -1.51 0.00 0.00 179.97 179.19 1fva h LYS 79 N 0.00 0.00 0.00 0.20 1.79 -1.31 -3.33 116.57 113.91 1fva h LYS 79 Ca 0.09 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.39 1fva h LYS 79 Cb 0.36 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.98 1fva h LYS 79 CO -0.00 0.00 -1.63 1.19 -1.08 0.00 0.00 179.45 177.93 1fva n PHE 80 N -2.67 0.00 0.31 -1.35 3.01 -0.34 -4.66 117.46 111.77 1fva n PHE 80 Ca -0.00 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.58 1fva n PHE 80 Cb 0.18 -0.45 0.58 0.00 -0.01 0.00 0.00 39.48 39.78 1fva n PHE 80 CO 0.00 0.00 0.00 0.11 1.01 0.00 0.00 176.76 177.88 1fva h TRP 81 N 0.00 0.00 -0.01 1.38 0.09 -1.63 -1.69 115.95 114.10 1fva h TRP 81 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.73 1fva h TRP 81 Cb 1.54 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.78 1fva h TRP 81 CO 0.00 0.00 -0.39 0.25 0.09 0.00 0.00 178.44 178.39 1fva n THR 82 N -2.37 0.00 -2.88 0.12 -2.24 -1.26 -4.94 114.28 100.71 1fva n THR 82 Ca 0.01 -0.10 -0.33 0.00 -2.27 0.00 0.00 64.05 61.35 1fva n THR 82 Cb 0.17 0.50 -0.07 0.00 -2.10 0.00 0.00 70.33 68.83 1fva n THR 82 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1fva s LEU 83 N -2.66 3.96 0.25 3.22 1.43 -0.64 -5.02 118.68 119.23 1fva s LEU 83 Ca 0.19 1.61 -0.30 0.00 -1.03 0.00 0.00 54.13 54.60 1fva s LEU 83 Cb 0.18 -4.45 -0.09 0.00 0.03 0.00 0.00 46.19 41.87 1fva s LEU 83 CO 0.59 -0.33 1.12 -0.75 0.23 0.00 0.00 176.35 177.22 1fva s LYS 84 N -3.14 4.60 0.00 1.70 2.20 -1.26 -2.56 119.74 121.27 1fva s LYS 84 Ca 0.60 1.82 0.00 0.00 -0.36 0.00 0.00 55.97 58.03 1fva s LYS 84 Cb -0.09 -3.21 0.00 0.00 -1.51 0.00 0.00 37.83 33.02 1fva s LYS 84 CO 0.14 0.13 0.00 0.41 -0.36 0.00 0.00 175.35 175.67 1fva n GLY 85 N 1.49 3.44 3.55 5.54 0.00 -1.26 -4.52 105.19 113.43 1fva n GLY 85 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1fva n GLY 85 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fva s VAL 86 N -2.88 4.70 0.07 1.61 1.01 -1.06 -0.20 120.40 123.65 1fva s VAL 86 Ca 0.00 0.45 -0.16 0.00 0.00 0.00 0.00 61.98 62.27 1fva s VAL 86 Cb 0.00 -4.28 -0.15 0.00 0.00 0.00 0.00 36.38 31.95 1fva s VAL 86 CO 0.00 -0.64 1.29 0.22 0.00 0.00 0.00 175.10 175.98 1fva h TYR 87 N 8.87 0.82 -1.95 5.22 3.20 -1.25 -3.46 116.97 128.41 1fva h TYR 87 Ca -0.25 -0.33 0.25 0.00 3.14 0.00 0.00 58.73 61.54 1fva h TYR 87 Cb 1.09 -0.14 -0.10 0.00 1.54 0.00 0.00 36.73 39.13 1fva h TYR 87 CO 0.78 1.11 0.65 -1.54 -1.64 0.00 0.00 178.16 177.52 1fva s SER 88 N -6.73 -0.11 0.05 -2.11 1.04 -1.03 -4.73 113.70 100.08 1fva s SER 88 Ca -0.12 -0.30 -0.03 0.00 0.48 0.00 0.00 55.95 55.98 1fva s SER 88 Cb 0.07 0.34 -0.03 0.00 0.10 0.00 0.00 66.02 66.50 1fva s SER 88 CO 0.84 -0.63 0.02 0.42 0.98 0.00 0.00 173.24 174.88 1fva s THR 89 N -2.84 0.18 0.12 2.02 -4.23 -1.26 -1.16 115.64 108.47 1fva s THR 89 Ca 0.14 -1.47 -0.05 0.00 -1.18 0.00 0.00 61.69 59.12 1fva s THR 89 Cb 0.01 -1.21 -0.02 0.00 1.34 0.00 0.00 72.50 72.62 1fva s THR 89 CO -0.00 -0.81 0.15 -1.10 -0.54 0.00 0.00 174.62 172.31 1fva s GLN 90 N -3.35 0.93 0.06 3.99 1.11 -0.48 -4.91 119.66 117.01 1fva s GLN 90 Ca 0.01 -1.20 0.08 0.00 0.01 0.00 0.00 55.36 54.26 1fva s GLN 90 Cb 0.04 0.31 -0.03 0.00 -1.01 0.00 0.00 33.01 32.31 1fva s GLN 90 CO -0.08 -0.29 -0.21 0.14 0.01 0.00 0.00 175.29 174.86 1fva s VAL 91 N -3.96 1.74 0.00 1.09 -7.23 -1.26 -0.22 120.40 110.56 1fva s VAL 91 Ca 0.14 -1.29 0.00 0.00 -1.81 0.00 0.00 61.98 59.03 1fva s VAL 91 Cb 0.06 -1.52 0.00 0.00 0.56 0.00 0.00 36.38 35.48 1fva s VAL 91 CO -0.04 0.18 0.00 0.61 -0.31 0.00 0.00 175.10 175.54 1fva n GLY 92 N 1.69 2.22 3.01 2.32 0.00 -0.01 -1.19 105.19 113.23 1fva n GLY 92 Ca -0.18 -0.46 -0.20 0.00 0.00 0.00 0.00 46.02 45.19 1fva n GLY 92 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1fva s PHE 93 N -1.43 0.96 0.19 1.61 0.40 0.21 0.04 117.98 119.95 1fva s PHE 93 Ca 0.00 -0.23 -0.18 0.00 -0.60 0.00 0.00 56.93 55.92 1fva s PHE 93 Cb 0.00 -0.67 0.03 0.00 0.51 0.00 0.00 43.02 42.89 1fva s PHE 93 CO 0.00 -0.08 0.53 0.00 0.70 0.00 0.00 175.22 176.37 1fva s ALA 94 N 0.10 -1.03 0.00 5.36 0.00 -0.93 -0.49 121.76 124.77 1fva s ALA 94 Ca -0.02 -0.13 0.00 0.00 0.00 0.00 0.00 51.96 51.82 1fva s ALA 94 Cb -0.08 0.84 0.00 0.00 0.00 0.00 0.00 23.12 23.89 1fva s ALA 94 CO 0.00 -0.80 0.00 0.41 0.00 0.00 0.00 175.76 175.38 1fva n GLY 95 N -0.34 1.22 0.00 0.00 0.00 -1.26 -0.29 105.19 104.52 1fva n GLY 95 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1fva n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fva n GLY 96 N -2.00 3.08 0.00 -0.02 0.00 -1.22 -4.63 105.19 100.40 1fva n GLY 96 Ca 0.00 -1.87 -0.00 0.00 0.00 0.00 0.00 46.02 44.15 1fva n GLY 96 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1fva n TYR 97 N 0.00 0.00 -1.90 1.61 4.02 0.50 -4.83 117.16 116.56 1fva n TYR 97 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.46 1fva n TYR 97 Cb 0.00 -0.01 -0.03 0.00 -0.02 0.00 0.00 39.34 39.28 1fva n TYR 97 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 1fva s THR 98 N -2.01 3.38 0.47 -0.72 2.01 -1.21 -4.96 115.64 112.60 1fva s THR 98 Ca -0.00 0.41 -0.21 0.00 0.31 0.00 0.00 61.69 62.19 1fva s THR 98 Cb 0.00 -3.44 -0.08 0.00 0.01 0.00 0.00 72.50 68.99 1fva s THR 98 CO 0.01 -0.23 1.05 -2.16 -0.69 0.00 0.00 174.62 172.60 1fva s PRO 99 N 5.39 3.86 -1.59 4.92 0.04 -1.26 -3.61 135.00 142.75 1fva s PRO 99 Ca 0.83 1.43 -0.14 0.00 0.04 0.00 0.00 61.00 63.17 1fva s PRO 99 Cb -0.28 -2.21 0.11 0.00 0.04 0.00 0.00 34.50 32.15 1fva s PRO 99 CO 0.34 -0.39 0.82 0.09 0.04 0.00 0.00 177.00 177.90 1fva n ASN 100 N -0.74 -3.50 -4.73 6.66 3.02 -1.24 -1.59 115.26 113.14 1fva n ASN 100 Ca 0.08 -0.91 -0.32 0.00 -0.03 0.00 0.00 54.58 53.41 1fva n ASN 100 Cb 0.51 -3.29 0.12 0.00 -0.61 0.00 0.00 39.78 36.52 1fva n ASN 100 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1fva s PRO 101 N -6.73 1.80 0.16 3.52 0.04 -1.24 -4.49 135.00 128.06 1fva s PRO 101 Ca 0.60 1.40 0.02 0.00 0.04 0.00 0.00 61.00 63.07 1fva s PRO 101 Cb -0.32 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.36 1fva s PRO 101 CO 0.88 -2.03 0.30 0.95 0.04 0.00 0.00 177.00 177.14 1fva s THR 102 N -2.66 5.31 0.24 1.26 -4.23 -1.26 -4.92 115.64 109.38 1fva s THR 102 Ca 0.65 -0.69 -0.05 0.00 -1.18 0.00 0.00 61.69 60.42 1fva s THR 102 Cb -0.21 -3.75 0.21 0.00 1.34 0.00 0.00 72.50 70.09 1fva s THR 102 CO 0.54 -0.11 1.72 0.22 -0.54 0.00 0.00 174.62 176.45 1fva h TYR 103 N 2.07 0.44 -0.21 3.99 3.20 -1.97 0.18 116.97 124.67 1fva h TYR 103 Ca -0.49 0.04 0.06 0.00 3.14 0.00 0.00 58.73 61.48 1fva h TYR 103 Cb 1.20 -0.09 -0.07 0.00 1.54 0.00 0.00 36.73 39.31 1fva h TYR 103 CO 0.53 0.04 -0.24 -0.22 -1.64 0.00 0.00 178.16 176.62 1fva h LYS 104 N 0.40 -0.26 -0.95 1.82 3.64 -1.99 -0.18 116.57 119.05 1fva h LYS 104 Ca 0.40 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.79 1fva h LYS 104 Cb 0.60 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.43 1fva h LYS 104 CO -0.41 -0.17 0.59 0.93 -2.27 0.00 0.00 179.45 178.12 1fva h GLU 105 N -0.27 1.28 -0.60 1.90 5.08 -1.33 -2.54 114.58 118.10 1fva h GLU 105 Ca 0.13 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1fva h GLU 105 Cb 0.46 -0.27 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 1fva h GLU 105 CO -0.37 0.88 0.37 0.28 -1.00 0.00 0.00 179.01 179.17 1fva h VAL 106 N 1.31 1.18 0.00 3.13 2.07 0.09 -2.59 116.25 121.43 1fva h VAL 106 Ca 0.34 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.48 1fva h VAL 106 Cb -0.08 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.04 1fva h VAL 106 CO -0.07 0.18 0.00 0.00 0.02 0.00 0.00 177.57 177.70 1fva h SER 108 N 0.00 0.00 0.00 0.00 4.64 -1.33 -3.46 113.55 113.40 1fva h SER 108 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1fva h SER 108 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1fva h SER 108 CO 0.00 0.06 0.00 0.61 -0.87 0.00 0.00 176.83 176.63 1fva n GLY 109 N 0.73 1.85 0.14 -0.77 0.00 0.72 -4.89 105.19 102.98 1fva n GLY 109 Ca 0.03 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.05 1fva n GLY 109 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fva n LYS 110 N -2.00 1.11 -0.02 1.61 5.02 -1.25 -3.64 118.16 118.99 1fva n LYS 110 Ca 0.00 -0.16 0.05 0.00 -2.02 0.00 0.00 58.31 56.18 1fva n LYS 110 Cb 0.00 -1.10 -0.11 0.00 -0.02 0.00 0.00 35.03 33.80 1fva n LYS 110 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1fva n THR 111 N -0.32 0.17 -0.08 -0.18 -2.24 -1.26 -1.25 114.28 109.11 1fva n THR 111 Ca 0.01 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 1fva n THR 111 Cb 0.07 0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 1fva n THR 111 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fva n GLY 112 N 1.79 2.17 3.86 3.38 0.00 -1.24 -0.37 105.19 114.78 1fva n GLY 112 Ca -0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 1fva n GLY 112 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1fva s HIS 113 N -2.86 3.42 0.02 1.61 3.76 -1.26 -3.36 115.29 116.62 1fva s HIS 113 Ca 0.00 1.27 0.03 0.00 -0.15 0.00 0.00 55.06 56.21 1fva s HIS 113 Cb 0.00 -2.83 -0.04 0.00 1.11 0.00 0.00 32.58 30.82 1fva s HIS 113 CO 0.00 -0.95 -0.04 0.00 -0.85 0.00 0.00 174.74 172.90 1fva s ALA 114 N -3.18 3.13 0.02 -1.40 0.00 0.61 -3.86 121.76 117.08 1fva s ALA 114 Ca 0.56 -1.03 -0.30 0.00 0.00 0.00 0.00 51.96 51.19 1fva s ALA 114 Cb -0.12 -1.18 -0.05 0.00 0.00 0.00 0.00 23.12 21.76 1fva s ALA 114 CO 0.54 0.64 1.30 -1.21 0.00 0.00 0.00 175.76 177.03 1fva s GLU 115 N -1.63 4.34 0.21 0.00 2.02 0.74 -2.19 118.70 122.21 1fva s GLU 115 Ca 0.19 1.87 0.05 0.00 0.02 0.00 0.00 54.97 57.10 1fva s GLU 115 Cb -0.11 -3.46 -0.05 0.00 0.10 0.00 0.00 34.13 30.61 1fva s GLU 115 CO 0.10 -0.44 -0.06 0.14 0.02 0.00 0.00 175.26 175.02 1fva s VAL 116 N 1.79 1.26 -0.11 2.63 -7.23 0.11 -4.08 120.40 114.77 1fva s VAL 116 Ca 0.61 -2.08 0.00 0.00 -1.81 0.00 0.00 61.98 58.71 1fva s VAL 116 Cb -0.30 -2.19 -0.02 0.00 0.56 0.00 0.00 36.38 34.42 1fva s VAL 116 CO 0.27 -0.47 -0.11 -0.69 -0.31 0.00 0.00 175.10 173.79 1fva s VAL 117 N -3.27 3.27 -0.18 1.32 1.01 0.40 -0.83 120.40 122.10 1fva s VAL 117 Ca 0.25 -0.61 -0.06 0.00 0.00 0.00 0.00 61.98 61.56 1fva s VAL 117 Cb 0.04 -2.36 -0.03 0.00 0.00 0.00 0.00 36.38 34.03 1fva s VAL 117 CO 0.07 0.55 0.01 -0.60 0.00 0.00 0.00 175.10 175.13 1fva s ARG 118 N -0.06 3.76 -0.18 2.72 3.52 0.70 -0.86 118.95 128.55 1fva s ARG 118 Ca -0.02 -0.46 -0.02 0.00 -0.13 0.00 0.00 55.73 55.11 1fva s ARG 118 Cb -0.14 -3.09 -0.01 0.00 -1.56 0.00 0.00 34.95 30.15 1fva s ARG 118 CO 0.03 0.16 -0.09 0.08 -0.81 0.00 0.00 175.30 174.68 1fva s VAL 119 N 0.62 3.16 -0.37 7.11 1.01 0.84 -1.38 120.40 131.40 1fva s VAL 119 Ca 0.00 -0.59 -0.12 0.00 0.00 0.00 0.00 61.98 61.28 1fva s VAL 119 Cb -0.14 -2.39 0.01 0.00 0.00 0.00 0.00 36.38 33.87 1fva s VAL 119 CO 0.02 0.47 0.22 -0.69 0.00 0.00 0.00 175.10 175.13 1fva s VAL 120 N 1.03 4.83 0.25 2.92 1.01 -0.30 0.02 120.40 130.15 1fva s VAL 120 Ca -0.00 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.35 1fva s VAL 120 Cb -0.15 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.55 1fva s VAL 120 CO -0.01 -0.18 0.01 0.72 0.00 0.00 0.00 175.10 175.64 1fva s PHE 121 N 1.61 1.64 -0.49 5.22 -0.12 0.05 -0.73 117.98 125.16 1fva s PHE 121 Ca 0.04 -0.94 -0.12 0.00 -0.05 0.00 0.00 56.93 55.86 1fva s PHE 121 Cb -0.19 -0.97 0.11 0.00 -0.63 0.00 0.00 43.02 41.35 1fva s PHE 121 CO 0.08 -0.04 0.40 -1.14 -0.05 0.00 0.00 175.22 174.47 1fva s GLN 122 N -3.87 2.73 0.58 1.99 -0.44 0.72 -0.85 119.66 120.52 1fva s GLN 122 Ca 0.30 -1.66 0.29 0.00 -2.50 0.00 0.00 55.36 51.79 1fva s GLN 122 Cb 0.06 -4.06 1.46 0.00 -1.64 0.00 0.00 33.01 28.83 1fva s GLN 122 CO 0.10 -1.20 1.89 -1.35 0.50 0.00 0.00 175.29 175.23 1fva h PRO 123 N 8.64 0.00 0.00 1.67 0.11 -1.76 0.35 132.00 141.01 1fva h PRO 123 Ca -0.25 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.83 1fva h PRO 123 Cb 1.09 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1fva h PRO 123 CO 0.91 0.00 -0.11 1.05 -0.21 0.00 0.00 178.00 179.65 1fva h GLU 124 N 0.00 0.00 0.00 1.05 4.11 -1.93 -3.30 114.58 114.51 1fva h GLU 124 Ca 0.26 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.67 1fva h GLU 124 Cb 1.30 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.54 1fva h GLU 124 CO -0.00 0.11 -1.58 0.72 0.07 0.00 0.00 179.01 178.33 1fva n HIS 125 N -3.22 0.00 -3.69 2.06 8.25 0.10 -4.99 115.22 113.74 1fva n HIS 125 Ca 0.01 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.37 1fva n HIS 125 Cb 0.40 -0.30 -0.10 0.00 1.12 0.00 0.00 29.99 31.10 1fva n HIS 125 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 1fva s ILE 126 N -2.81 -0.08 0.43 1.59 2.07 -0.15 -4.56 121.20 117.68 1fva s ILE 126 Ca -0.05 0.09 -0.09 0.00 -1.41 0.00 0.00 60.65 59.20 1fva s ILE 126 Cb 0.08 -0.66 -0.06 0.00 0.13 0.00 0.00 42.46 41.95 1fva s ILE 126 CO 0.51 0.04 0.77 -0.94 -1.91 0.00 0.00 174.94 173.41 1fva s SER 127 N 1.55 6.44 0.42 4.50 1.04 -1.26 -3.98 113.70 122.41 1fva s SER 127 Ca -0.09 1.07 0.10 0.00 0.48 0.00 0.00 55.95 57.52 1fva s SER 127 Cb -0.08 -2.30 0.90 0.00 0.10 0.00 0.00 66.02 64.63 1fva s SER 127 CO -0.14 -0.45 2.00 0.15 0.98 0.00 0.00 173.24 175.78 1fva h PHE 128 N 0.96 0.28 -0.65 5.02 3.57 -1.97 0.46 116.94 124.61 1fva h PHE 128 Ca -0.47 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 60.97 1fva h PHE 128 Cb 1.19 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.82 1fva h PHE 128 CO 0.60 0.29 0.23 0.93 -2.23 0.00 0.00 178.31 178.13 1fva h GLU 129 N 0.28 0.97 -0.38 1.11 3.07 -1.96 0.46 114.58 118.12 1fva h GLU 129 Ca 0.07 -0.18 -0.10 0.00 -0.50 0.00 0.00 59.36 58.65 1fva h GLU 129 Cb 0.18 -0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 27.92 1fva h GLU 129 CO 0.00 0.82 -0.17 0.93 -1.40 0.00 0.00 179.01 179.18 1fva h GLU 130 N 0.95 0.72 -0.50 2.33 5.08 -1.31 -2.33 114.58 119.51 1fva h GLU 130 Ca 0.22 -0.26 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 1fva h GLU 130 Cb 0.23 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 1fva h GLU 130 CO -0.01 0.85 0.08 -0.07 -1.00 0.00 0.00 179.01 178.86 1fva h LEU 131 N 0.64 0.73 -0.68 1.33 3.38 -0.66 -2.39 115.31 117.67 1fva h LEU 131 Ca 0.10 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1fva h LEU 131 Cb 0.65 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 1fva h LEU 131 CO 0.05 0.75 0.36 -0.07 0.09 0.00 0.00 178.44 179.62 1fva h LEU 132 N 0.75 0.85 -0.51 1.67 3.38 -0.58 -1.28 115.31 119.58 1fva h LEU 132 Ca 0.16 -0.10 0.03 0.00 0.09 0.00 0.00 57.88 58.06 1fva h LEU 132 Cb 0.34 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 1fva h LEU 132 CO 0.00 0.70 0.30 0.50 0.09 0.00 0.00 178.44 180.04 1fva h LYS 133 N 0.93 0.57 -0.83 1.13 3.64 -0.95 0.22 116.57 121.28 1fva h LYS 133 Ca 0.24 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.55 1fva h LYS 133 Cb 0.05 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.70 1fva h LYS 133 CO -0.04 0.38 0.41 0.28 -2.27 0.00 0.00 179.45 178.21 1fva h VAL 134 N 0.59 1.26 0.49 2.00 2.07 -1.11 -1.04 116.25 120.51 1fva h VAL 134 Ca 0.21 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 1fva h VAL 134 Cb 0.04 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.00 1fva h VAL 134 CO -0.10 0.30 -0.26 0.15 0.02 0.00 0.00 177.57 177.68 1fva h PHE 135 N 1.18 -0.69 -0.74 1.57 3.57 -0.38 -2.51 116.94 118.95 1fva h PHE 135 Ca 0.29 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.75 1fva h PHE 135 Cb 0.11 0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 1fva h PHE 135 CO 0.01 -0.41 0.36 -1.49 -2.23 0.00 0.00 178.31 174.55 1fva h TRP 136 N -0.70 1.06 0.00 0.41 4.06 -0.34 -3.09 115.95 117.35 1fva h TRP 136 Ca -0.06 -0.05 -0.10 0.00 2.06 0.00 0.00 58.89 60.74 1fva h TRP 136 Cb 0.55 -0.33 -0.01 0.00 -1.00 0.00 0.00 29.16 28.37 1fva h TRP 136 CO -0.06 0.77 -0.48 0.93 -3.56 0.00 0.00 178.44 176.04 1fva h GLU 137 N 1.04 0.00 -0.54 0.49 5.08 -1.19 -3.32 114.58 116.13 1fva h GLU 137 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1fva h GLU 137 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1fva h GLU 137 CO -0.03 0.48 0.00 0.09 -1.00 0.00 0.00 179.01 178.55 1fva n ASN 138 N -3.70 2.90 -3.52 1.42 3.02 -0.95 -3.26 115.26 111.17 1fva n ASN 138 Ca -0.01 -2.00 -0.11 0.00 -0.03 0.00 0.00 54.58 52.43 1fva n ASN 138 Cb 0.55 -0.36 -0.02 0.00 -0.61 0.00 0.00 39.78 39.33 1fva n ASN 138 CO 0.00 0.00 0.00 -1.38 -2.62 0.00 0.00 177.26 173.26 1fva s HIS 139 N -1.28 -0.45 -0.47 3.10 -3.43 -1.24 -3.36 115.29 108.17 1fva s HIS 139 Ca 0.36 0.19 -0.19 0.00 -0.80 0.00 0.00 55.06 54.62 1fva s HIS 139 Cb 0.19 0.58 0.04 0.00 -1.43 0.00 0.00 32.58 31.96 1fva s HIS 139 CO 0.25 -0.92 0.60 0.34 -2.00 0.00 0.00 174.74 173.00 1fva s ASP 140 N -2.79 6.25 -0.12 7.38 -1.08 -1.26 -4.32 116.67 120.74 1fva s ASP 140 Ca 0.03 -0.68 0.03 0.00 -0.52 0.00 0.00 52.55 51.42 1fva s ASP 140 Cb -0.02 -2.29 0.28 0.00 -1.46 0.00 0.00 42.92 39.43 1fva s ASP 140 CO -0.09 -0.80 1.14 -0.81 0.52 0.00 0.00 175.17 175.13 1fva n PRO 141 N 6.11 1.98 -0.01 4.34 -0.04 -1.26 -3.83 135.00 142.29 1fva n PRO 141 Ca -0.05 -1.14 0.01 0.00 -0.04 0.00 0.00 63.50 62.28 1fva n PRO 141 Cb 0.47 -1.62 0.01 0.00 -0.04 0.00 0.00 33.50 32.31 1fva n PRO 141 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1fva n THR 142 N 0.07 0.88 0.91 0.52 -2.24 -1.26 0.77 114.28 113.93 1fva n THR 142 Ca 0.16 -0.90 0.11 0.00 -2.27 0.00 0.00 64.05 61.15 1fva n THR 142 Cb 0.76 0.54 0.30 0.00 -2.10 0.00 0.00 70.33 69.83 1fva n THR 142 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fva n GLN 143 N -0.47 2.06 0.00 -0.78 6.02 -1.25 -4.74 117.38 118.22 1fva n GLN 143 Ca 0.01 -1.58 0.00 0.00 -0.01 0.00 0.00 57.00 55.42 1fva n GLN 143 Cb 0.32 -1.45 0.00 0.00 1.02 0.00 0.00 30.24 30.13 1fva n GLN 143 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1fva n GLY 144 N 1.29 2.43 2.32 1.08 0.00 -1.26 -3.61 105.19 107.43 1fva n GLY 144 Ca 0.17 -0.33 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 1fva n GLY 144 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1fva n MET 145 N 13.30 3.45 -3.56 1.61 2.81 -1.26 -4.30 117.12 129.17 1fva n MET 145 Ca 0.00 -2.36 -0.07 0.00 -1.81 0.00 0.00 57.70 53.47 1fva n MET 145 Cb 0.00 -2.50 -0.03 0.00 -0.71 0.00 0.00 33.22 29.98 1fva n MET 145 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 1fva s ARG 146 N 0.41 0.52 -0.27 0.03 3.52 -1.24 -1.38 118.95 120.54 1fva s ARG 146 Ca 0.63 -0.14 -0.01 0.00 -0.13 0.00 0.00 55.73 56.09 1fva s ARG 146 Cb 0.24 0.24 0.13 0.00 -1.56 0.00 0.00 34.95 34.00 1fva s ARG 146 CO -0.08 -0.22 0.30 -1.14 -0.81 0.00 0.00 175.30 173.35 1fva s GLN 147 N -2.41 0.31 7.16 5.12 2.00 -0.56 -4.59 119.66 126.69 1fva s GLN 147 Ca 0.06 -0.01 0.00 0.00 -2.00 0.00 0.00 55.36 53.41 1fva s GLN 147 Cb -0.01 -0.71 0.00 0.00 0.80 0.00 0.00 33.01 33.09 1fva s GLN 147 CO -0.06 -0.94 0.00 0.41 -0.50 0.00 0.00 175.29 174.21 1fva n GLY 148 N 5.32 2.55 0.57 2.59 0.00 -1.26 -1.16 105.19 113.79 1fva n GLY 148 Ca -0.03 -0.31 0.11 0.00 0.00 0.00 0.00 46.02 45.79 1fva n GLY 148 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fva n ASN 149 N 5.19 1.71 -4.54 1.61 3.02 -1.26 -4.74 115.26 116.26 1fva n ASN 149 Ca 0.00 -1.69 -0.42 0.00 -0.03 0.00 0.00 54.58 52.44 1fva n ASN 149 Cb 0.00 -0.09 -0.08 0.00 -0.61 0.00 0.00 39.78 39.00 1fva n ASN 149 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1fva s ASP 150 N -1.64 6.30 -0.15 6.41 1.01 -0.31 -5.05 116.67 123.24 1fva s ASP 150 Ca 0.33 -0.19 -0.08 0.00 0.71 0.00 0.00 52.55 53.33 1fva s ASP 150 Cb 0.18 -2.27 -0.04 0.00 1.01 0.00 0.00 42.92 41.79 1fva s ASP 150 CO 0.28 -0.57 0.11 -1.00 0.21 0.00 0.00 175.17 174.20 1fva s HIS 151 N 2.46 3.45 0.00 4.23 3.76 -1.26 -1.50 115.29 126.43 1fva s HIS 151 Ca 0.19 0.37 0.00 0.00 -0.15 0.00 0.00 55.06 55.47 1fva s HIS 151 Cb -0.15 -2.02 0.00 0.00 1.11 0.00 0.00 32.58 31.52 1fva s HIS 151 CO 0.15 0.49 0.00 0.41 -0.85 0.00 0.00 174.74 174.93 1fva n GLY 152 N 2.71 3.97 0.14 -2.22 0.00 -0.48 -4.87 105.19 104.44 1fva n GLY 152 Ca -0.18 -1.68 0.10 0.00 0.00 0.00 0.00 46.02 44.26 1fva n GLY 152 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1fva n SER 153 N 0.00 0.54 0.00 1.61 3.41 -1.26 -1.20 113.62 116.72 1fva n SER 153 Ca 0.00 0.72 0.14 0.00 -0.26 0.00 0.00 58.87 59.46 1fva n SER 153 Cb 0.00 -0.80 0.66 0.00 -0.26 0.00 0.00 64.21 63.81 1fva n SER 153 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fva n GLN 154 N -2.18 0.22 -0.17 4.33 0.00 -1.25 -2.87 117.38 115.45 1fva n GLN 154 Ca -0.00 0.02 0.05 0.00 0.00 0.00 0.00 57.00 57.07 1fva n GLN 154 Cb 0.08 -1.50 0.14 0.00 0.00 0.00 0.00 30.24 28.96 1fva n GLN 154 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1fva n TYR 155 N -1.39 0.42 -1.68 2.61 4.02 -0.34 -0.18 117.16 120.61 1fva n TYR 155 Ca 0.10 -0.54 -0.33 0.00 -0.01 0.00 0.00 57.90 57.12 1fva n TYR 155 Cb 0.27 -0.06 0.06 0.00 -0.02 0.00 0.00 39.34 39.59 1fva n TYR 155 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 176.86 174.87 1fva s ARG 156 N -1.18 2.67 0.30 -0.72 1.70 -1.14 -3.28 118.95 117.30 1fva s ARG 156 Ca 0.21 1.44 -0.29 0.00 -0.47 0.00 0.00 55.73 56.62 1fva s ARG 156 Cb 0.12 -1.93 -0.09 0.00 -0.57 0.00 0.00 34.95 32.48 1fva s ARG 156 CO 0.12 -1.36 1.09 0.45 -1.08 0.00 0.00 175.30 174.52 1fva s SER 157 N -2.53 7.19 0.11 -2.89 0.15 -1.26 -4.26 113.70 110.21 1fva s SER 157 Ca 0.68 2.23 -0.25 0.00 0.70 0.00 0.00 55.95 59.31 1fva s SER 157 Cb -0.22 -2.62 0.07 0.00 -1.71 0.00 0.00 66.02 61.55 1fva s SER 157 CO 0.43 -0.20 0.62 0.00 1.20 0.00 0.00 173.24 175.29 1fva s ALA 158 N -1.24 -1.64 -0.05 5.45 0.00 -0.26 -0.33 121.76 123.69 1fva s ALA 158 Ca 0.47 0.67 -0.02 0.00 0.00 0.00 0.00 51.96 53.08 1fva s ALA 158 Cb -0.30 0.70 0.03 0.00 0.00 0.00 0.00 23.12 23.55 1fva s ALA 158 CO 0.39 -0.69 0.08 0.42 0.00 0.00 0.00 175.76 175.96 1fva s ILE 159 N -3.23 -0.12 -0.56 0.00 1.01 -0.45 -0.12 121.20 117.74 1fva s ILE 159 Ca -0.01 0.33 0.04 0.00 0.00 0.00 0.00 60.65 61.00 1fva s ILE 159 Cb -0.01 -0.17 0.14 0.00 0.01 0.00 0.00 42.46 42.43 1fva s ILE 159 CO -0.08 0.14 0.31 -0.31 0.00 0.00 0.00 174.94 174.99 1fva s TYR 160 N 1.77 3.26 0.46 3.97 4.12 -0.42 -2.92 117.35 127.59 1fva s TYR 160 Ca -0.01 -3.18 -0.25 0.00 0.02 0.00 0.00 57.07 53.66 1fva s TYR 160 Cb -0.12 -2.83 -0.08 0.00 -1.52 0.00 0.00 41.96 37.41 1fva s TYR 160 CO -0.04 -0.72 1.37 -2.14 0.02 0.00 0.00 175.55 174.04 1fva s PRO 161 N -0.47 3.67 -0.00 -1.71 0.02 -1.23 -4.18 135.00 131.10 1fva s PRO 161 Ca 0.18 2.29 0.17 0.00 0.02 0.00 0.00 61.00 63.66 1fva s PRO 161 Cb -0.22 -2.60 -0.20 0.00 0.02 0.00 0.00 34.50 31.49 1fva s PRO 161 CO -0.03 -0.79 0.66 0.25 -0.33 0.00 0.00 177.00 176.77 1fva n THR 162 N -0.27 0.00 -4.14 0.99 -2.24 -1.26 -4.35 114.28 103.01 1fva n THR 162 Ca 0.06 -0.16 -0.09 0.00 -2.27 0.00 0.00 64.05 61.59 1fva n THR 162 Cb 0.43 0.83 -0.10 0.00 -2.10 0.00 0.00 70.33 69.39 1fva n THR 162 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1fva s SER 163 N -2.88 0.94 0.25 3.42 1.04 -1.26 -5.03 113.70 110.18 1fva s SER 163 Ca 0.04 -1.00 -0.06 0.00 0.48 0.00 0.00 55.95 55.41 1fva s SER 163 Cb 0.13 0.13 0.27 0.00 0.10 0.00 0.00 66.02 66.65 1fva s SER 163 CO 0.71 -0.50 1.92 0.00 0.98 0.00 0.00 173.24 176.34 1fva h ALA 164 N 3.03 1.27 -0.33 5.32 0.00 -2.00 -1.43 119.26 125.12 1fva h ALA 164 Ca -0.35 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.38 1fva h ALA 164 Cb 1.16 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1fva h ALA 164 CO 0.65 0.65 -0.20 0.93 0.00 0.00 0.00 179.25 181.28 1fva h GLU 165 N 1.31 0.62 -0.54 0.00 5.08 -2.00 -2.05 114.58 117.00 1fva h GLU 165 Ca 0.35 -0.23 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 1fva h GLU 165 Cb -0.10 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 1fva h GLU 165 CO -0.07 0.78 0.03 0.45 -1.00 0.00 0.00 179.01 179.20 1fva h HIS 166 N 0.55 0.95 0.06 4.33 3.86 -1.81 -0.79 115.15 122.31 1fva h HIS 166 Ca 0.08 -0.13 -0.00 0.00 -1.16 0.00 0.00 60.37 59.16 1fva h HIS 166 Cb 0.65 -0.26 -0.00 0.00 1.06 0.00 0.00 27.41 28.86 1fva h HIS 166 CO 0.03 0.85 -0.04 0.28 0.86 0.00 0.00 177.93 179.91 1fva h VAL 167 N 0.83 0.92 -0.65 2.45 2.07 -0.84 0.32 116.25 121.36 1fva h VAL 167 Ca 0.16 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.75 1fva h VAL 167 Cb 0.45 0.92 -0.06 0.00 -1.52 0.00 0.00 31.29 31.09 1fva h VAL 167 CO 0.02 0.00 0.33 1.23 0.02 0.00 0.00 177.57 179.17 1fva h GLY 168 N -0.10 0.94 0.98 2.17 0.00 -1.12 -0.72 103.07 105.23 1fva h GLY 168 Ca -0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1fva h GLY 168 CO 0.01 0.11 0.28 0.00 0.00 0.00 0.00 176.54 176.93 1fva h ALA 169 N 1.36 0.61 0.06 3.60 0.00 -0.18 -1.64 119.26 123.06 1fva h ALA 169 Ca 0.30 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1fva h ALA 169 Cb 0.24 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1fva h ALA 169 CO -0.21 0.11 -0.03 0.00 0.00 0.00 0.00 179.25 179.12 1fva h ALA 170 N 1.12 -0.07 -0.80 0.00 0.00 0.05 -1.70 119.26 117.85 1fva h ALA 170 Ca 0.17 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1fva h ALA 170 Cb 0.02 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 1fva h ALA 170 CO -0.03 -0.49 0.51 -0.07 0.00 0.00 0.00 179.25 179.17 1fva h LEU 171 N -0.18 0.84 -0.38 0.00 3.38 -1.03 0.15 115.31 118.09 1fva h LEU 171 Ca -0.01 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1fva h LEU 171 Cb 0.15 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1fva h LEU 171 CO 0.01 0.58 0.06 0.50 0.09 0.00 0.00 178.44 179.68 1fva h LYS 172 N 0.99 0.64 -0.06 1.13 3.64 -1.14 -2.24 116.57 119.52 1fva h LYS 172 Ca 0.32 -0.17 -0.03 0.00 -1.27 0.00 0.00 60.65 59.50 1fva h LYS 172 Cb 0.03 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1fva h LYS 172 CO -0.12 0.69 -0.11 0.66 -2.27 0.00 0.00 179.45 178.31 1fva h SER 173 N 0.48 0.08 -0.05 4.20 4.64 -0.87 0.63 113.55 122.67 1fva h SER 173 Ca 0.12 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1fva h SER 173 Cb 0.37 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1fva h SER 173 CO 0.01 0.21 0.01 0.50 -0.87 0.00 0.00 176.83 176.69 1fva h LYS 174 N 0.09 0.08 -0.63 4.77 3.64 -0.29 0.42 116.57 124.65 1fva h LYS 174 Ca 0.02 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.41 1fva h LYS 174 Cb 0.25 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.02 1fva h LYS 174 CO 0.02 0.28 0.38 0.93 -2.27 0.00 0.00 179.45 178.79 1fva h GLU 175 N -0.14 0.72 -0.29 1.90 5.08 -0.77 0.15 114.58 121.23 1fva h GLU 175 Ca 0.01 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 1fva h GLU 175 Cb 0.24 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1fva h GLU 175 CO 0.00 0.48 -0.00 -0.44 -1.00 0.00 0.00 179.01 178.05 1fva h ASP 176 N 0.74 0.50 -0.21 1.42 3.32 -0.68 -2.81 116.42 118.71 1fva h ASP 176 Ca 0.26 -0.31 -0.08 0.00 0.02 0.00 0.00 57.03 56.91 1fva h ASP 176 Cb 0.04 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 1fva h ASP 176 CO -0.11 0.69 -0.13 0.22 -1.72 0.00 0.00 179.24 178.18 1fva h TYR 177 N 0.30 0.67 -0.65 4.55 3.20 0.19 -2.68 116.97 122.54 1fva h TYR 177 Ca 0.08 -0.12 0.07 0.00 3.14 0.00 0.00 58.73 61.91 1fva h TYR 177 Cb 0.43 -0.17 -0.04 0.00 1.54 0.00 0.00 36.73 38.49 1fva h TYR 177 CO 0.04 0.72 0.43 0.37 -1.64 0.00 0.00 178.16 178.07 1fva h GLN 178 N 0.56 0.59 0.33 1.82 5.75 -0.78 -0.89 115.11 122.49 1fva h GLN 178 Ca 0.10 -0.04 -0.02 0.00 -0.15 0.00 0.00 58.65 58.55 1fva h GLN 178 Cb 0.56 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 28.98 1fva h GLN 178 CO 0.04 0.39 -0.16 -0.22 -2.65 0.00 0.00 178.83 176.23 1fva h LYS 179 N 0.61 -0.43 0.00 1.69 3.64 -1.23 -0.08 116.57 120.77 1fva h LYS 179 Ca 0.28 0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.61 1fva h LYS 179 Cb 0.33 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1fva h LYS 179 CO -0.09 -0.21 -0.40 -0.39 -2.27 0.00 0.00 179.45 176.09 1fva h VAL 180 N -0.57 1.03 -0.34 2.00 -1.51 -1.42 0.13 116.25 115.56 1fva h VAL 180 Ca -0.05 -1.53 -0.10 0.00 -1.23 0.00 0.00 66.70 63.80 1fva h VAL 180 Cb 0.42 1.89 -0.01 0.00 -2.13 0.00 0.00 31.29 31.47 1fva h VAL 180 CO 0.08 0.40 -0.16 -0.07 -1.23 0.00 0.00 177.57 176.58 1fva h LEU 181 N 0.00 0.74 -0.74 4.19 3.38 -1.00 -0.06 115.31 121.82 1fva h LEU 181 Ca -0.00 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1fva h LEU 181 Cb 0.86 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 1fva h LEU 181 CO 0.05 0.98 0.47 0.28 0.09 0.00 0.00 178.44 180.32 1fva h SER 182 N 0.49 0.87 0.51 -0.43 0.02 -0.74 0.61 113.55 114.89 1fva h SER 182 Ca 0.08 -0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1fva h SER 182 Cb 0.70 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 63.02 1fva h SER 182 CO 0.05 0.65 -0.02 -0.33 -1.14 0.00 0.00 176.83 176.03 1fva h GLU 183 N 1.01 0.00 -0.40 3.45 5.08 -0.41 -1.23 114.58 122.08 1fva h GLU 183 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1fva h GLU 183 Cb -0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.16 1fva h GLU 183 CO -0.06 0.02 0.00 0.72 -1.00 0.00 0.00 179.01 178.70 1fva n HIS 184 N -3.18 0.51 -0.19 4.33 8.25 0.40 -4.91 115.22 120.43 1fva n HIS 184 Ca -0.01 -0.26 0.00 0.00 -0.26 0.00 0.00 57.72 57.19 1fva n HIS 184 Cb 0.20 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.31 1fva n HIS 184 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fva n GLY 185 N 1.48 0.68 3.94 -1.41 0.00 -0.46 -5.05 105.19 104.37 1fva n GLY 185 Ca 0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.96 1fva n GLY 185 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1fva s PHE 186 N -2.27 2.78 0.00 1.61 0.40 0.19 -4.97 117.98 115.71 1fva s PHE 186 Ca 0.00 0.34 0.00 0.00 -0.60 0.00 0.00 56.93 56.67 1fva s PHE 186 Cb 0.00 -3.18 0.00 0.00 0.51 0.00 0.00 43.02 40.35 1fva s PHE 186 CO 0.00 -1.42 0.00 0.41 0.70 0.00 0.00 175.22 174.91 1fva n GLY 187 N -2.89 1.48 3.74 4.36 0.00 -1.26 -4.06 105.19 106.55 1fva n GLY 187 Ca 0.09 -1.85 -0.41 0.00 0.00 0.00 0.00 46.02 43.84 1fva n GLY 187 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1fva s LEU 188 N 0.00 4.45 0.13 0.99 2.96 -1.26 -4.59 118.68 121.36 1fva s LEU 188 Ca 0.00 2.20 -0.31 0.00 -0.22 0.00 0.00 54.13 55.80 1fva s LEU 188 Cb 0.00 -3.60 -0.08 0.00 0.50 0.00 0.00 46.19 43.01 1fva s LEU 188 CO 0.00 -0.37 1.31 -0.63 -1.32 0.00 0.00 176.35 175.35 1fva s ILE 189 N 0.04 3.45 -2.18 6.68 1.01 -1.26 -4.43 121.20 124.51 1fva s ILE 189 Ca 0.53 1.09 0.23 0.00 0.00 0.00 0.00 60.65 62.50 1fva s ILE 189 Cb -0.32 -3.70 0.05 0.00 0.01 0.00 0.00 42.46 38.50 1fva s ILE 189 CO 0.36 0.11 1.16 0.35 0.00 0.00 0.00 174.94 176.92 1fva n THR 190 N 3.49 0.00 -1.54 2.92 -2.24 0.23 -4.96 114.28 112.19 1fva n THR 190 Ca 0.09 -0.29 -0.47 0.00 -2.27 0.00 0.00 64.05 61.11 1fva n THR 190 Cb 0.43 1.23 -0.03 0.00 -2.10 0.00 0.00 70.33 69.86 1fva n THR 190 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1fva n THR 191 N 0.16 1.58 -3.14 4.28 -1.04 -1.22 -4.78 114.28 110.13 1fva n THR 191 Ca 0.10 -0.40 -0.42 0.00 -2.04 0.00 0.00 64.05 61.29 1fva n THR 191 Cb 0.48 -0.67 -0.07 0.00 -1.82 0.00 0.00 70.33 68.26 1fva n THR 191 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1fva s ASP 192 N -0.48 6.34 -0.26 8.00 2.15 0.56 -4.93 116.67 128.05 1fva s ASP 192 Ca 0.66 -0.20 -0.00 0.00 0.43 0.00 0.00 52.55 53.44 1fva s ASP 192 Cb -0.83 -2.31 0.04 0.00 -0.30 0.00 0.00 42.92 39.53 1fva s ASP 192 CO 0.57 -0.68 -0.07 -0.63 -0.17 0.00 0.00 175.17 174.19 1fva s ILE 193 N 2.70 2.64 0.05 4.11 1.01 -1.26 -1.34 121.20 129.11 1fva s ILE 193 Ca 0.22 -1.31 -0.06 0.00 0.00 0.00 0.00 60.65 59.50 1fva s ILE 193 Cb -0.15 -2.44 -0.01 0.00 0.01 0.00 0.00 42.46 39.87 1fva s ILE 193 CO 0.17 0.06 0.11 -0.13 0.00 0.00 0.00 174.94 175.15 1fva s ARG 194 N 1.23 0.64 0.45 2.79 0.52 -1.15 -5.01 118.95 118.42 1fva s ARG 194 Ca -0.04 -0.80 0.07 0.00 -0.52 0.00 0.00 55.73 54.44 1fva s ARG 194 Cb -0.18 0.25 -0.01 0.00 0.52 0.00 0.00 34.95 35.53 1fva s ARG 194 CO -0.04 -0.17 0.40 -1.21 0.02 0.00 0.00 175.30 174.30 1fva s GLU 195 N -2.88 2.45 -0.83 3.54 8.01 -1.26 -3.52 118.70 124.21 1fva s GLU 195 Ca -0.03 -1.65 0.00 0.00 0.01 0.00 0.00 54.97 53.30 1fva s GLU 195 Cb 0.00 -2.32 0.00 0.00 -4.31 0.00 0.00 34.13 27.51 1fva s GLU 195 CO -0.06 -0.31 0.00 0.41 0.01 0.00 0.00 175.26 175.31 1fva n GLY 196 N -1.61 0.82 3.77 -1.39 0.00 -1.26 -5.00 105.19 100.52 1fva n GLY 196 Ca 0.03 -0.65 -0.38 0.00 0.00 0.00 0.00 46.02 45.02 1fva n GLY 196 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fva s GLN 197 N -3.01 4.18 0.01 1.61 -1.52 -1.26 -5.05 119.66 114.62 1fva s GLN 197 Ca 0.00 0.50 -0.19 0.00 -1.95 0.00 0.00 55.36 53.72 1fva s GLN 197 Cb 0.00 -3.33 -0.06 0.00 -0.22 0.00 0.00 33.01 29.40 1fva s GLN 197 CO 0.00 0.42 0.55 0.99 -0.25 0.00 0.00 175.29 176.99 1fva s THR 198 N -0.23 4.89 -0.27 -0.19 2.01 -1.26 -4.96 115.64 115.62 1fva s THR 198 Ca 0.26 1.15 -0.15 0.00 0.31 0.00 0.00 61.69 63.26 1fva s THR 198 Cb -0.16 -3.88 -0.03 0.00 0.01 0.00 0.00 72.50 68.43 1fva s THR 198 CO 0.13 0.48 0.40 0.12 -0.69 0.00 0.00 174.62 175.06 1fva s PHE 199 N -0.57 3.24 -0.15 4.92 5.36 -1.26 -4.39 117.98 125.13 1fva s PHE 199 Ca 0.29 0.41 -0.04 0.00 -0.96 0.00 0.00 56.93 56.63 1fva s PHE 199 Cb -0.18 -2.61 -0.03 0.00 -0.34 0.00 0.00 43.02 39.86 1fva s PHE 199 CO 0.17 -0.26 -0.02 0.71 -1.46 0.00 0.00 175.22 174.36 1fva s TYR 200 N 2.11 3.07 0.55 10.12 1.51 0.36 -4.95 117.35 130.12 1fva s TYR 200 Ca 0.16 -0.17 -0.20 0.00 -1.01 0.00 0.00 57.07 55.85 1fva s TYR 200 Cb -0.16 -1.94 -0.05 0.00 -0.11 0.00 0.00 41.96 39.70 1fva s TYR 200 CO 0.10 0.08 1.18 0.71 -1.11 0.00 0.00 175.55 176.50 1fva s TYR 201 N 0.14 2.57 0.55 2.71 1.51 -1.26 0.67 117.35 124.24 1fva s TYR 201 Ca -0.00 1.52 -0.02 0.00 -1.01 0.00 0.00 57.07 57.56 1fva s TYR 201 Cb -0.13 -3.41 0.02 0.00 -0.11 0.00 0.00 41.96 38.32 1fva s TYR 201 CO 0.02 -1.89 0.80 0.00 -1.11 0.00 0.00 175.55 173.38 1fva s ALA 202 N -1.64 3.59 0.80 3.71 0.00 -0.33 -4.71 121.76 123.18 1fva s ALA 202 Ca 0.73 -1.00 -0.16 0.00 0.00 0.00 0.00 51.96 51.53 1fva s ALA 202 Cb -0.28 -2.31 -0.05 0.00 0.00 0.00 0.00 23.12 20.47 1fva s ALA 202 CO 0.32 -0.70 0.18 0.39 0.00 0.00 0.00 175.76 175.95 1fva n GLU 203 N -2.39 0.07 -0.31 0.00 4.71 -1.26 -4.75 120.64 116.71 1fva n GLU 203 Ca 0.05 0.06 0.07 0.00 -0.01 0.00 0.00 57.16 57.32 1fva n GLU 203 Cb 0.58 -1.59 0.27 0.00 -1.01 0.00 0.00 31.44 29.69 1fva n GLU 203 CO 0.00 0.00 0.00 0.22 0.09 0.00 0.00 177.13 177.44 1fva h ASP 204 N -0.74 0.85 -0.88 1.62 1.82 -1.97 -1.13 116.42 116.00 1fva h ASP 204 Ca -0.44 0.03 0.24 0.00 -0.39 0.00 0.00 57.03 56.46 1fva h ASP 204 Cb 1.33 -0.15 -0.15 0.00 0.68 0.00 0.00 39.33 41.05 1fva h ASP 204 CO 0.37 0.50 0.20 0.22 -1.61 0.00 0.00 179.24 178.92 1fva h TYR 205 N 0.94 0.29 0.00 0.28 3.20 -1.92 0.14 116.97 119.90 1fva h TYR 205 Ca 0.43 0.05 -0.02 0.00 3.14 0.00 0.00 58.73 62.33 1fva h TYR 205 Cb 0.40 0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.68 1fva h TYR 205 CO -0.00 -0.24 -0.12 0.45 -1.64 0.00 0.00 178.16 176.61 1fva h HIS 206 N 0.17 0.00 -2.86 -3.82 3.86 -1.51 -3.42 115.15 107.57 1fva h HIS 206 Ca 0.55 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 59.24 1fva h HIS 206 Cb 1.13 0.00 0.03 0.00 1.06 0.00 0.00 27.41 29.63 1fva h HIS 206 CO -0.30 0.12 0.85 -0.65 0.86 0.00 0.00 177.93 178.81 1fva s GLN 207 N -3.40 4.24 -1.58 2.45 -1.52 0.47 -2.62 119.66 117.70 1fva s GLN 207 Ca 0.04 2.27 -0.14 0.00 -1.95 0.00 0.00 55.36 55.57 1fva s GLN 207 Cb 0.08 -3.23 0.11 0.00 -0.22 0.00 0.00 33.01 29.74 1fva s GLN 207 CO 0.64 -0.57 0.86 1.04 -0.25 0.00 0.00 175.29 177.01 1fva n GLN 208 N 4.15 -4.46 -0.25 2.91 3.00 -1.26 -4.84 117.38 116.63 1fva n GLN 208 Ca 0.13 0.50 -0.01 0.00 -0.01 0.00 0.00 57.00 57.61 1fva n GLN 208 Cb 0.40 -5.27 0.06 0.00 0.00 0.00 0.00 30.24 25.43 1fva n GLN 208 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.06 176.14 1fva h TYR 209 N -1.84 -0.61 0.00 1.08 3.20 -1.75 -0.68 116.97 116.38 1fva h TYR 209 Ca -0.59 0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.35 1fva h TYR 209 Cb 1.38 0.37 0.00 0.00 1.54 0.00 0.00 36.73 40.02 1fva h TYR 209 CO 0.59 -0.35 0.00 1.28 -1.64 0.00 0.00 178.16 178.04 1fva n LEU 210 N -5.47 0.00 0.05 2.82 4.77 -1.26 -0.90 117.00 117.00 1fva n LEU 210 Ca 0.08 0.34 -0.17 0.00 -0.03 0.00 0.00 56.01 56.24 1fva n LEU 210 Cb 0.37 -0.34 -0.14 0.00 -2.33 0.00 0.00 43.42 40.98 1fva n LEU 210 CO -0.01 -0.08 -0.41 -1.28 -1.33 0.00 0.00 177.39 174.28 1fva h SER 211 N 0.00 0.37 -0.26 -1.43 0.87 -1.50 -2.88 113.55 108.72 1fva h SER 211 Ca 0.00 -0.56 -0.09 0.00 -1.23 0.00 0.00 61.79 59.91 1fva h SER 211 Cb 0.26 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 1fva h SER 211 CO 0.00 1.48 -0.17 0.11 -0.53 0.00 0.00 176.83 177.72 1fva h LYS 212 N 0.06 0.58 -2.87 2.24 1.57 -0.80 -3.37 116.57 113.98 1fva h LYS 212 Ca -0.27 -0.27 -0.61 0.00 -1.87 0.00 0.00 60.65 57.63 1fva h LYS 212 Cb 2.02 -0.01 -0.40 0.00 0.08 0.00 0.00 32.23 33.92 1fva h LYS 212 CO 0.15 0.85 -0.75 0.34 -0.57 0.00 0.00 179.45 179.47 1fva s ASP 213 N -6.31 3.46 0.51 0.86 2.15 -0.08 -4.99 116.67 112.27 1fva s ASP 213 Ca -0.13 -3.10 0.30 0.00 0.43 0.00 0.00 52.55 50.05 1fva s ASP 213 Cb 0.08 -1.08 1.41 0.00 -0.30 0.00 0.00 42.92 43.04 1fva s ASP 213 CO 0.79 -0.19 1.85 -0.65 -0.17 0.00 0.00 175.17 176.80 1fva h PRO 214 N 6.07 0.09 -0.61 4.34 0.11 -1.68 0.38 132.00 140.69 1fva h PRO 214 Ca 0.10 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1fva h PRO 214 Cb 0.87 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1fva h PRO 214 CO 0.53 0.06 0.00 -0.25 -0.21 0.00 0.00 178.00 178.13 1fva n ASP 215 N -4.31 3.63 -4.09 -2.05 8.00 -1.26 -4.98 116.55 111.49 1fva n ASP 215 Ca 0.21 -2.23 -0.30 0.00 0.71 0.00 0.00 54.79 53.19 1fva n ASP 215 Cb 1.00 -0.47 0.21 0.00 -0.02 0.00 0.00 41.12 41.84 1fva n ASP 215 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1fva s GLY 216 N -0.88 1.60 0.04 0.44 0.00 0.13 -4.94 107.32 103.72 1fva s GLY 216 Ca 0.40 -0.83 -0.31 0.00 0.00 0.00 0.00 44.72 43.98 1fva s GLY 216 CO 0.22 -0.03 1.93 2.98 0.00 0.00 0.00 173.10 178.20 1fva n TYR 217 N -4.48 2.51 -1.03 1.90 9.36 -1.26 -4.89 117.16 119.28 1fva n TYR 217 Ca 0.11 -0.27 0.06 0.00 3.32 0.00 0.00 57.90 61.12 1fva n TYR 217 Cb 0.59 -2.77 0.08 0.00 -0.63 0.00 0.00 39.34 36.61 1fva n TYR 217 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1fva n GLY 219 N -0.90 -0.38 0.47 0.00 0.00 -1.26 -4.48 105.19 98.65 1fva n GLY 219 Ca 0.09 -1.04 0.07 0.00 0.00 0.00 0.00 46.02 45.14 1fva n GLY 219 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fva n LEU 220 N 0.00 1.93 0.00 0.99 4.77 -1.26 -5.11 117.00 118.32 1fva n LEU 220 Ca 0.00 -0.93 0.00 0.00 -0.03 0.00 0.00 56.01 55.05 1fva n LEU 220 Cb 0.00 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1fva n LEU 220 CO 0.00 0.36 -0.00 0.61 -1.33 0.00 0.00 177.39 177.03 1fva n GLY 221 N 0.84 -1.90 0.00 -0.72 0.00 -1.26 -4.98 105.19 97.17 1fva n GLY 221 Ca 0.07 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.74 1fva n GLY 221 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fva n GLY 222 N -0.08 -0.17 0.12 -0.02 0.00 -1.20 -4.05 105.19 99.79 1fva n GLY 222 Ca 0.00 -1.78 0.12 0.00 0.00 0.00 0.00 46.02 44.36 1fva n GLY 222 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1fva h THR 223 N -0.48 0.00 0.00 2.61 1.35 -1.75 -3.45 112.91 111.19 1fva h THR 223 Ca 0.00 -0.72 0.00 0.00 -0.55 0.00 0.00 66.41 65.14 1fva h THR 223 Cb 0.00 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 67.86 1fva h THR 223 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1fva n GLY 224 N 1.24 0.78 3.66 5.82 0.00 -1.26 -5.02 105.19 110.41 1fva n GLY 224 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1fva n GLY 224 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fva s VAL 225 N -2.24 4.83 0.36 1.61 1.01 -1.26 -5.02 120.40 119.68 1fva s VAL 225 Ca 0.00 1.68 -0.27 0.00 0.00 0.00 0.00 61.98 63.38 1fva s VAL 225 Cb 0.00 -4.16 -0.09 0.00 0.00 0.00 0.00 36.38 32.13 1fva s VAL 225 CO 0.00 -0.05 1.26 -0.44 0.00 0.00 0.00 175.10 175.88 1fva s SER 226 N 1.24 6.64 -0.21 3.32 0.01 -1.26 -4.72 113.70 118.71 1fva s SER 226 Ca 0.38 2.59 -0.08 0.00 1.31 0.00 0.00 55.95 60.14 1fva s SER 226 Cb -0.16 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.39 1fva s SER 226 CO 0.09 -0.62 0.09 0.00 0.41 0.00 0.00 173.24 173.22