#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fga s GLU 3 N 0.00 2.71 -0.54 0.11 4.04 -1.26 -5.03 118.70 118.73 3fga s GLU 3 Ca 0.00 -0.87 0.01 0.00 0.04 0.00 0.00 54.97 54.15 3fga s GLU 3 Cb 0.00 -2.18 0.47 0.00 0.02 0.00 0.00 34.13 32.44 3fga s GLU 3 CO 0.00 0.28 1.79 0.36 -1.84 0.00 0.00 175.26 175.85 3fga n LYS 4 N 3.22 2.86 -0.02 -4.83 2.85 -1.26 -4.54 118.16 116.44 3fga n LYS 4 Ca -0.18 -3.50 -0.01 0.00 -1.05 0.00 0.00 58.31 53.57 3fga n LYS 4 Cb 0.52 -2.26 0.25 0.00 -0.65 0.00 0.00 35.03 32.90 3fga n LYS 4 CO 0.00 0.00 0.00 -0.24 -0.05 0.00 0.00 177.40 177.11 3fga h VAL 5 N 1.30 1.22 -0.01 0.58 3.04 -2.01 -2.96 116.25 117.41 3fga h VAL 5 Ca 0.53 -0.90 -0.20 0.00 -1.01 0.00 0.00 66.70 65.12 3fga h VAL 5 Cb 1.16 0.98 -0.01 0.00 -2.01 0.00 0.00 31.29 31.42 3fga h VAL 5 CO 1.30 0.31 -0.87 0.15 -1.01 0.00 0.00 177.57 177.45 3fga h PHE 6 N 0.54 0.45 0.00 3.17 3.04 -2.00 -2.96 116.94 119.18 3fga h PHE 6 Ca 0.11 -0.23 0.00 0.00 3.98 0.00 0.00 57.97 61.83 3fga h PHE 6 Cb 0.40 -0.05 0.00 0.00 2.56 0.00 0.00 35.95 38.86 3fga h PHE 6 CO 0.02 1.03 0.00 1.79 -2.02 0.00 0.00 178.31 179.13 3fga h THR 7 N 0.18 0.00 -0.19 4.41 1.35 -1.88 0.10 112.91 116.88 3fga h THR 7 Ca -0.05 -0.59 -0.09 0.00 -0.55 0.00 0.00 66.41 65.12 3fga h THR 7 Cb 1.49 1.56 -0.00 0.00 -1.73 0.00 0.00 68.15 69.46 3fga h THR 7 CO 0.14 0.00 -0.25 0.11 -0.25 0.00 0.00 175.52 175.27 3fga h LYS 8 N 0.00 0.51 -0.79 4.72 6.56 -1.47 -1.63 116.57 124.47 3fga h LYS 8 Ca 0.00 -0.29 -0.03 0.00 -1.06 0.00 0.00 60.65 59.27 3fga h LYS 8 Cb 0.62 0.02 -0.04 0.00 -0.57 0.00 0.00 32.23 32.27 3fga h LYS 8 CO 0.00 0.88 0.38 1.49 -2.06 0.00 0.00 179.45 180.15 3fga h GLU 9 N 0.16 1.14 -0.19 3.15 4.81 -1.19 -1.99 114.58 120.47 3fga h GLU 9 Ca 0.02 -0.17 -0.03 0.00 -0.13 0.00 0.00 59.36 59.05 3fga h GLU 9 Cb 0.82 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.99 3fga h GLU 9 CO 0.06 0.88 -0.01 -0.07 -0.73 0.00 0.00 179.01 179.13 3fga h LEU 10 N 1.12 0.34 -0.98 1.64 3.38 -0.87 -1.87 115.31 118.07 3fga h LEU 10 Ca 0.27 -0.33 0.12 0.00 0.09 0.00 0.00 57.88 58.03 3fga h LEU 10 Cb 0.11 -0.09 -0.08 0.00 0.09 0.00 0.00 40.66 40.69 3fga h LEU 10 CO -0.03 0.59 0.61 0.44 0.09 0.00 0.00 178.44 180.13 3fga h ASP 11 N 0.09 0.90 0.13 -0.43 5.19 -1.10 0.21 116.42 121.41 3fga h ASP 11 Ca 0.05 0.05 -0.01 0.00 -0.62 0.00 0.00 57.03 56.50 3fga h ASP 11 Cb 0.42 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 39.80 3fga h ASP 11 CO 0.01 0.48 -0.06 -0.61 -3.12 0.00 0.00 179.24 175.94 3fga h GLN 12 N 0.97 -0.17 -0.68 3.56 -0.00 -1.28 -0.77 115.11 116.75 3fga h GLN 12 Ca 0.48 0.01 0.11 0.00 -0.00 0.00 0.00 58.65 59.25 3fga h GLN 12 Cb 0.46 0.04 -0.08 0.00 0.00 0.00 0.00 27.48 27.90 3fga h GLN 12 CO -0.26 -0.01 0.28 -1.49 0.00 0.00 0.00 178.83 177.35 3fga h TRP 13 N -0.30 0.48 -0.28 3.99 6.55 -0.56 -0.05 115.95 125.79 3fga h TRP 13 Ca -0.02 0.03 -0.04 0.00 0.95 0.00 0.00 58.89 59.82 3fga h TRP 13 Cb 0.24 -0.11 -0.01 0.00 -0.86 0.00 0.00 29.16 28.42 3fga h TRP 13 CO -0.03 0.12 0.03 0.82 -1.05 0.00 0.00 178.44 178.33 3fga h ILE 14 N 0.46 1.24 -0.57 1.49 2.04 -0.88 -1.24 117.51 120.06 3fga h ILE 14 Ca 0.35 -0.84 0.04 0.00 1.00 0.00 0.00 64.86 65.41 3fga h ILE 14 Cb 0.45 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 37.73 3fga h ILE 14 CO -0.33 0.27 0.32 -0.08 0.00 0.00 0.00 178.15 178.33 3fga h GLU 15 N 0.28 0.59 -0.47 2.37 4.81 -0.64 -0.70 114.58 120.82 3fga h GLU 15 Ca 0.08 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.31 3fga h GLU 15 Cb 0.37 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.57 3fga h GLU 15 CO 0.01 0.39 0.24 0.37 -0.73 0.00 0.00 179.01 179.29 3fga h GLN 16 N 0.61 0.47 -0.21 1.92 4.15 -0.82 -2.72 115.11 118.50 3fga h GLN 16 Ca 0.24 -0.03 -0.08 0.00 0.77 0.00 0.00 58.65 59.55 3fga h GLN 16 Cb 0.11 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 3fga h GLN 16 CO -0.14 0.31 -0.24 -0.07 -1.93 0.00 0.00 178.83 176.76 3fga h LEU 17 N 0.48 0.38 -1.95 -2.39 3.38 -0.40 -1.13 115.31 113.68 3fga h LEU 17 Ca 0.20 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3fga h LEU 17 Cb 0.10 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.74 3fga h LEU 17 CO -0.13 0.62 0.00 0.78 0.09 0.00 0.00 178.44 179.80 3fga h ASN 18 N 0.34 0.00 -0.89 -0.43 2.35 -0.83 0.85 115.58 116.96 3fga h ASN 18 Ca 0.05 0.00 -0.41 0.00 -0.55 0.00 0.00 56.30 55.39 3fga h ASN 18 Cb 0.61 0.00 -0.25 0.00 0.05 0.00 0.00 38.32 38.73 3fga h ASN 18 CO 0.04 0.00 0.51 -0.62 -1.65 0.00 0.00 177.43 175.71 3fga n GLU 19 N -2.65 2.68 -4.19 0.81 1.02 -0.43 -4.94 120.64 112.93 3fga n GLU 19 Ca -0.01 -3.05 -0.34 0.00 -0.02 0.00 0.00 57.16 53.74 3fga n GLU 19 Cb 0.10 -2.18 -0.03 0.00 -0.02 0.00 0.00 31.44 29.31 3fga n GLU 19 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3fga s LYS 21 N -6.90 3.20 0.71 0.00 1.02 -1.18 -5.03 119.74 111.56 3fga s LYS 21 Ca 0.56 -0.73 -0.16 0.00 0.02 0.00 0.00 55.97 55.67 3fga s LYS 21 Cb -0.31 -2.77 0.00 0.00 -0.52 0.00 0.00 37.83 34.24 3fga s LYS 21 CO 0.93 -0.16 1.01 0.00 -0.92 0.00 0.00 175.35 176.21 3fga n GLN 22 N 4.59 0.57 -1.97 1.68 10.64 -1.26 -4.07 117.38 127.56 3fga n GLN 22 Ca -0.19 0.25 -0.30 0.00 -1.83 0.00 0.00 57.00 54.93 3fga n GLN 22 Cb 0.51 -2.26 0.19 0.00 -0.86 0.00 0.00 30.24 27.82 3fga n GLN 22 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 3fga s LEU 23 N -3.28 2.75 0.41 2.61 1.43 -1.26 -5.00 118.68 116.35 3fga s LEU 23 Ca 0.74 0.17 0.01 0.00 -1.03 0.00 0.00 54.13 54.03 3fga s LEU 23 Cb -0.35 -2.17 -0.01 0.00 0.03 0.00 0.00 46.19 43.69 3fga s LEU 23 CO 0.49 -2.79 0.62 -0.94 0.23 0.00 0.00 176.35 173.95 3fga s SER 24 N -4.92 5.92 0.20 2.29 1.04 -1.26 -4.87 113.70 112.10 3fga s SER 24 Ca 0.75 0.22 -0.17 0.00 0.48 0.00 0.00 55.95 57.23 3fga s SER 24 Cb -0.03 -1.55 0.19 0.00 0.10 0.00 0.00 66.02 64.73 3fga s SER 24 CO 0.53 -0.60 1.60 -0.08 0.98 0.00 0.00 173.24 175.67 3fga h GLU 25 N 0.54 -0.09 0.00 4.02 4.81 -1.98 0.22 114.58 122.10 3fga h GLU 25 Ca -0.47 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 3fga h GLU 25 Cb 1.25 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.65 3fga h GLU 25 CO 0.57 -0.06 0.00 -1.13 -0.73 0.00 0.00 179.01 177.66 3fga n SER 26 N -5.45 0.66 0.01 1.04 3.41 -1.26 -1.36 113.62 110.68 3fga n SER 26 Ca 0.06 0.64 -0.22 0.00 -0.26 0.00 0.00 58.87 59.10 3fga n SER 26 Cb 0.35 -0.79 -0.14 0.00 -0.26 0.00 0.00 64.21 63.37 3fga n SER 26 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 3fga h GLN 27 N 0.00 0.27 -0.37 4.33 4.20 -1.06 -2.93 115.11 119.56 3fga h GLN 27 Ca 0.00 -0.47 0.00 0.00 0.06 0.00 0.00 58.65 58.24 3fga h GLN 27 Cb 0.42 0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.36 3fga h GLN 27 CO 0.00 1.22 0.23 0.28 -0.67 0.00 0.00 178.83 179.90 3fga h VAL 28 N -0.08 1.11 -0.68 -0.54 2.07 -0.72 0.20 116.25 117.60 3fga h VAL 28 Ca -0.37 -0.24 0.05 0.00 0.82 0.00 0.00 66.70 66.95 3fga h VAL 28 Cb 1.94 0.61 -0.05 0.00 -1.52 0.00 0.00 31.29 32.27 3fga h VAL 28 CO 0.08 0.11 0.40 0.50 0.02 0.00 0.00 177.57 178.68 3fga h LYS 29 N 0.49 0.74 -0.39 1.57 3.64 -1.34 0.39 116.57 121.67 3fga h LYS 29 Ca 0.13 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.38 3fga h LYS 29 Cb -0.02 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 3fga h LYS 29 CO -0.03 0.49 -0.09 1.03 -2.27 0.00 0.00 179.45 178.58 3fga h SER 30 N 0.76 0.75 0.25 4.20 0.87 -1.32 -1.80 113.55 117.26 3fga h SER 30 Ca 0.29 -0.36 -0.00 0.00 -1.23 0.00 0.00 61.79 60.49 3fga h SER 30 Cb 0.11 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 3fga h SER 30 CO -0.15 0.93 -0.22 0.25 -0.53 0.00 0.00 176.83 177.12 3fga h LEU 31 N 0.55 -0.57 -0.88 2.23 6.46 0.57 -0.85 115.31 122.81 3fga h LEU 31 Ca 0.10 0.05 0.03 0.00 -0.12 0.00 0.00 57.88 57.93 3fga h LEU 31 Cb 0.61 0.19 -0.05 0.00 -0.73 0.00 0.00 40.66 40.68 3fga h LEU 31 CO 0.04 -0.33 0.57 0.00 -0.62 0.00 0.00 178.44 178.10 3fga h GLU 33 N 1.14 0.55 -0.37 0.00 5.08 -0.96 0.66 114.58 120.67 3fga h GLU 33 Ca 0.34 -0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.55 3fga h GLU 33 Cb -0.04 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 3fga h GLU 33 CO -0.10 0.36 -0.24 0.87 -1.00 0.00 0.00 179.01 178.91 3fga h LYS 34 N 0.56 0.74 -0.30 2.33 1.57 -0.57 -3.22 116.57 117.69 3fga h LYS 34 Ca 0.25 -0.30 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3fga h LYS 34 Cb 0.15 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 3fga h LYS 34 CO -0.17 0.90 0.10 0.00 -0.57 0.00 0.00 179.45 179.72 3fga h ALA 35 N 1.10 0.39 -0.72 3.86 0.00 0.29 -3.17 119.26 121.01 3fga h ALA 35 Ca 0.09 -0.14 0.14 0.00 0.00 0.00 0.00 54.91 55.00 3fga h ALA 35 Cb 0.74 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 18.31 3fga h ALA 35 CO 0.06 0.01 0.23 0.87 0.00 0.00 0.00 179.25 180.42 3fga h LYS 36 N 0.33 0.35 -0.07 0.00 1.57 -0.90 -1.84 116.57 116.01 3fga h LYS 36 Ca 0.10 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.78 3fga h LYS 36 Cb 0.22 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 3fga h LYS 36 CO -0.00 0.23 -0.30 1.49 -0.57 0.00 0.00 179.45 180.30 3fga h GLU 37 N 0.36 0.12 0.12 3.15 4.57 -1.58 -1.16 114.58 120.16 3fga h GLU 37 Ca 0.39 -0.04 -0.29 0.00 -1.18 0.00 0.00 59.36 58.24 3fga h GLU 37 Cb 0.61 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.19 3fga h GLU 37 CO -0.43 0.42 -1.42 -0.84 -1.18 0.00 0.00 179.01 175.56 3fga h ILE 38 N 0.11 1.29 -0.28 2.32 -0.00 -1.46 -3.37 117.51 116.12 3fga h ILE 38 Ca 0.02 -2.91 -0.19 0.00 -0.00 0.00 0.00 64.86 61.78 3fga h ILE 38 Cb 0.59 2.82 0.00 0.00 -0.00 0.00 0.00 36.82 40.24 3fga h ILE 38 CO 0.04 0.84 -0.56 -0.07 -0.00 0.00 0.00 178.15 178.41 3fga h LEU 39 N 0.07 0.97 -1.77 0.16 4.07 -1.15 -3.18 115.31 114.47 3fga h LEU 39 Ca -0.20 -0.54 0.17 0.00 0.08 0.00 0.00 57.88 57.39 3fga h LEU 39 Cb 1.99 -0.28 -0.04 0.00 1.08 0.00 0.00 40.66 43.42 3fga h LEU 39 CO 0.17 1.33 0.49 0.00 -1.08 0.00 0.00 178.44 179.35 3fga h THR 40 N 0.64 0.73 -0.17 0.22 1.03 -1.37 0.17 112.91 114.17 3fga h THR 40 Ca 0.01 -0.07 0.00 0.00 -0.01 0.00 0.00 66.41 66.33 3fga h THR 40 Cb 1.17 0.50 0.00 0.00 -1.07 0.00 0.00 68.15 68.74 3fga h THR 40 CO 0.12 0.04 0.00 0.29 -0.01 0.00 0.00 175.52 175.96 3fga n LYS 41 N -4.42 1.54 -3.86 0.00 5.02 -1.20 -4.86 118.16 110.38 3fga n LYS 41 Ca 0.14 -0.82 -0.33 0.00 -2.02 0.00 0.00 58.31 55.28 3fga n LYS 41 Cb 0.63 -1.29 -0.05 0.00 -0.02 0.00 0.00 35.03 34.30 3fga n LYS 41 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3fga s GLU 42 N -1.77 3.48 0.64 1.97 2.02 0.60 -5.09 118.70 120.55 3fga s GLU 42 Ca 0.25 -0.29 -0.12 0.00 0.02 0.00 0.00 54.97 54.83 3fga s GLU 42 Cb 0.13 -3.04 -0.02 0.00 0.10 0.00 0.00 34.13 31.29 3fga s GLU 42 CO 0.19 0.62 1.04 0.45 0.02 0.00 0.00 175.26 177.59 3fga s SER 43 N -2.15 5.83 0.34 -0.19 0.15 -1.26 -4.91 113.70 111.51 3fga s SER 43 Ca 0.32 1.57 0.05 0.00 0.70 0.00 0.00 55.95 58.58 3fga s SER 43 Cb -0.13 -2.49 0.70 0.00 -1.71 0.00 0.00 66.02 62.40 3fga s SER 43 CO 0.22 -1.14 1.91 0.78 1.20 0.00 0.00 173.24 176.21 3fga h ASN 44 N -0.31 0.73 -4.11 5.45 4.21 -1.89 -3.24 115.58 116.43 3fga h ASN 44 Ca -0.44 0.02 -0.65 0.00 1.21 0.00 0.00 56.30 56.43 3fga h ASN 44 Cb 1.20 -0.14 -0.40 0.00 -1.12 0.00 0.00 38.32 37.86 3fga h ASN 44 CO 0.59 0.44 -0.65 0.54 -1.29 0.00 0.00 177.43 177.06 3fga s VAL 45 N -5.75 2.54 0.11 2.81 0.11 -1.26 -2.02 120.40 116.95 3fga s VAL 45 Ca -0.10 -2.94 -0.31 0.00 -2.93 0.00 0.00 61.98 55.69 3fga s VAL 45 Cb 0.20 -2.80 -0.08 0.00 -1.53 0.00 0.00 36.38 32.17 3fga s VAL 45 CO 0.79 -0.73 1.47 -1.10 -3.33 0.00 0.00 175.10 172.20 3fga s GLN 46 N 0.16 4.27 -0.16 1.54 -1.52 -0.37 -4.70 119.66 118.88 3fga s GLN 46 Ca 0.15 2.17 -0.29 0.00 -1.95 0.00 0.00 55.36 55.44 3fga s GLN 46 Cb -0.23 -3.31 -0.01 0.00 -0.22 0.00 0.00 33.01 29.24 3fga s GLN 46 CO -0.03 -0.54 1.17 -2.00 -0.25 0.00 0.00 175.29 173.64 3fga s GLU 47 N 1.47 4.27 -0.08 2.91 2.56 -1.26 0.39 118.70 128.96 3fga s GLU 47 Ca 0.67 1.56 0.04 0.00 0.00 0.00 0.00 54.97 57.24 3fga s GLU 47 Cb -0.38 -3.68 -0.00 0.00 2.00 0.00 0.00 34.13 32.07 3fga s GLU 47 CO 0.30 -0.61 -0.23 0.08 -0.56 0.00 0.00 175.26 174.25 3fga s VAL 48 N 3.08 1.92 0.64 3.70 1.01 -0.00 -4.93 120.40 125.82 3fga s VAL 48 Ca 0.51 -0.95 -0.15 0.00 0.00 0.00 0.00 61.98 61.39 3fga s VAL 48 Cb -0.20 -1.66 -0.01 0.00 0.00 0.00 0.00 36.38 34.51 3fga s VAL 48 CO 0.14 0.53 1.09 -0.13 0.00 0.00 0.00 175.10 176.73 3fga s ARG 49 N 0.24 2.94 0.10 2.72 3.00 -1.26 -2.62 118.95 124.07 3fga s ARG 49 Ca -0.14 1.32 -0.19 0.00 0.00 0.00 0.00 55.73 56.72 3fga s ARG 49 Cb -0.16 -1.97 -0.07 0.00 0.00 0.00 0.00 34.95 32.74 3fga s ARG 49 CO 0.07 -1.13 1.64 0.00 0.00 0.00 0.00 175.30 175.88 3fga s PRO 51 N -5.51 3.53 0.09 0.00 0.04 -1.26 -4.63 135.00 127.25 3fga s PRO 51 Ca -0.13 0.16 -0.04 0.00 0.04 0.00 0.00 61.00 61.02 3fga s PRO 51 Cb 0.08 -3.93 -0.03 0.00 0.04 0.00 0.00 34.50 30.66 3fga s PRO 51 CO 0.72 -1.25 0.08 0.08 0.04 0.00 0.00 177.00 176.67 3fga s VAL 52 N 3.81 0.16 -0.14 -0.36 1.01 -0.65 -4.63 120.40 119.60 3fga s VAL 52 Ca 0.37 -1.61 0.00 0.00 0.00 0.00 0.00 61.98 60.74 3fga s VAL 52 Cb -0.10 -1.62 -0.01 0.00 0.00 0.00 0.00 36.38 34.65 3fga s VAL 52 CO 0.26 -0.71 -0.14 -0.89 0.00 0.00 0.00 175.10 173.62 3fga s THR 53 N -3.94 2.90 -0.14 3.92 2.01 -0.09 -0.46 115.64 119.84 3fga s THR 53 Ca 0.11 -0.70 -0.04 0.00 0.31 0.00 0.00 61.69 61.37 3fga s THR 53 Cb 0.06 -2.22 -0.03 0.00 0.01 0.00 0.00 72.50 70.32 3fga s THR 53 CO -0.07 0.52 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.67 3fga s VAL 54 N 0.54 4.06 0.04 3.82 1.01 0.49 -0.68 120.40 129.69 3fga s VAL 54 Ca -0.09 -0.31 0.06 0.00 0.00 0.00 0.00 61.98 61.65 3fga s VAL 54 Cb -0.16 -2.77 -0.02 0.00 0.00 0.00 0.00 36.38 33.43 3fga s VAL 54 CO 0.04 0.51 -0.18 0.00 0.00 0.00 0.00 175.10 175.47 3fga n GLY 56 N 1.83 0.57 3.70 0.00 0.00 -1.26 -1.76 105.19 108.27 3fga n GLY 56 Ca -0.18 -1.68 -0.36 0.00 0.00 0.00 0.00 46.02 43.80 3fga n GLY 56 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3fga n ASP 57 N 0.00 1.56 0.00 1.61 10.43 -1.25 -4.40 116.55 124.51 3fga n ASP 57 Ca 0.00 0.76 0.00 0.00 2.57 0.00 0.00 54.79 58.12 3fga n ASP 57 Cb 0.00 -1.52 0.00 0.00 1.84 0.00 0.00 41.12 41.44 3fga n ASP 57 CO 0.00 0.00 0.00 0.52 -1.07 0.00 0.00 177.20 176.65 3fga n VAL 58 N -2.26 0.00 -4.07 2.53 0.31 -0.61 -2.20 118.33 112.03 3fga n VAL 58 Ca 0.15 0.00 -0.46 0.00 -0.01 0.00 0.00 64.34 64.02 3fga n VAL 58 Cb 0.49 -0.43 0.02 0.00 -0.91 0.00 0.00 33.84 33.00 3fga n VAL 58 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 3fga n HIS 59 N -1.86 -1.40 -1.02 3.52 8.25 -0.44 -2.40 115.22 119.87 3fga n HIS 59 Ca 0.00 0.09 -0.01 0.00 -0.26 0.00 0.00 57.72 57.54 3fga n HIS 59 Cb 0.31 -2.81 -0.00 0.00 1.12 0.00 0.00 29.99 28.61 3fga n HIS 59 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3fga n GLY 60 N -2.09 0.15 2.65 -1.41 0.00 -0.56 -0.28 105.19 103.64 3fga n GLY 60 Ca -0.11 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 3fga n GLY 60 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3fga n GLN 61 N 0.17 4.24 -0.33 1.61 6.02 -1.01 -0.92 117.38 127.15 3fga n GLN 61 Ca -0.01 -3.56 0.07 0.00 -0.01 0.00 0.00 57.00 53.50 3fga n GLN 61 Cb 0.42 -2.73 0.17 0.00 1.02 0.00 0.00 30.24 29.11 3fga n GLN 61 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 3fga h PHE 62 N 5.06 -0.36 0.00 1.08 3.04 -1.87 0.28 116.94 124.17 3fga h PHE 62 Ca 0.56 0.08 -0.02 0.00 3.98 0.00 0.00 57.97 62.57 3fga h PHE 62 Cb 0.44 0.31 -0.00 0.00 2.56 0.00 0.00 35.95 39.26 3fga h PHE 62 CO 1.44 -0.40 -0.08 0.45 -2.02 0.00 0.00 178.31 177.69 3fga h HIS 63 N 0.01 0.00 0.00 0.41 3.86 -1.96 0.19 115.15 117.66 3fga h HIS 63 Ca 0.49 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 59.43 3fga h HIS 63 Cb 0.83 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.25 3fga h HIS 63 CO -0.66 0.08 -1.44 -0.44 0.86 0.00 0.00 177.93 176.34 3fga h ASP 64 N 0.00 0.02 -0.33 2.45 3.45 -0.87 -2.24 116.42 118.89 3fga h ASP 64 Ca -0.00 -0.03 -0.01 0.00 0.43 0.00 0.00 57.03 57.42 3fga h ASP 64 Cb 0.26 -0.01 -0.02 0.00 -0.56 0.00 0.00 39.33 39.01 3fga h ASP 64 CO 0.01 1.02 0.15 0.25 -1.57 0.00 0.00 179.24 179.11 3fga h LEU 65 N 0.00 0.44 -0.69 1.55 5.85 -0.35 0.22 115.31 122.33 3fga h LEU 65 Ca -0.18 -0.14 0.11 0.00 0.84 0.00 0.00 57.88 58.51 3fga h LEU 65 Cb 1.92 -0.11 -0.08 0.00 0.37 0.00 0.00 40.66 42.76 3fga h LEU 65 CO 0.10 0.45 0.31 0.24 -0.34 0.00 0.00 178.44 179.20 3fga h MET 66 N 0.40 0.49 -0.94 1.25 2.86 -0.72 0.32 114.93 118.59 3fga h MET 66 Ca 0.11 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.72 3fga h MET 66 Cb 0.14 -0.11 -0.05 0.00 0.06 0.00 0.00 31.60 31.64 3fga h MET 66 CO -0.01 0.33 0.56 1.49 1.06 0.00 0.00 176.91 180.34 3fga h GLU 67 N 0.51 1.27 -0.11 1.72 4.57 -0.91 -1.16 114.58 120.47 3fga h GLU 67 Ca 0.36 -0.11 0.03 0.00 -1.18 0.00 0.00 59.36 58.45 3fga h GLU 67 Cb 0.44 -0.27 -0.03 0.00 -0.16 0.00 0.00 28.75 28.73 3fga h GLU 67 CO -0.31 0.89 -0.06 1.25 -1.18 0.00 0.00 179.01 179.59 3fga h LEU 68 N 1.29 -0.21 -1.73 1.64 6.46 0.13 -1.33 115.31 121.57 3fga h LEU 68 Ca 0.34 0.05 -0.01 0.00 -0.12 0.00 0.00 57.88 58.14 3fga h LEU 68 Cb -0.06 0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 39.98 3fga h LEU 68 CO -0.06 -0.09 0.07 -0.26 -0.62 0.00 0.00 178.44 177.48 3fga h PHE 69 N -0.06 0.23 -0.49 1.25 0.04 -0.48 0.20 116.94 117.63 3fga h PHE 69 Ca 0.07 -0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.81 3fga h PHE 69 Cb 0.16 -0.08 -0.02 0.00 2.20 0.00 0.00 35.95 38.21 3fga h PHE 69 CO -0.19 0.19 0.18 0.00 -0.60 0.00 0.00 178.31 177.90 3fga h ARG 70 N 0.24 0.70 0.15 1.51 3.08 -0.12 0.26 114.38 120.21 3fga h ARG 70 Ca 0.06 -0.10 -0.30 0.00 0.07 0.00 0.00 59.98 59.71 3fga h ARG 70 Cb 0.06 -0.13 0.03 0.00 0.08 0.00 0.00 29.97 30.00 3fga h ARG 70 CO -0.01 0.59 -1.29 0.82 -1.07 0.00 0.00 179.97 179.01 3fga h ILE 71 N 0.70 1.33 0.11 2.04 1.08 -0.58 -3.39 117.51 118.80 3fga h ILE 71 Ca 0.17 -2.64 -0.35 0.00 -0.39 0.00 0.00 64.86 61.64 3fga h ILE 71 Cb 0.16 2.82 -0.02 0.00 -3.07 0.00 0.00 36.82 36.71 3fga h ILE 71 CO -0.01 0.79 -1.93 1.23 -0.69 0.00 0.00 178.15 177.54 3fga h GLY 72 N 0.58 0.27 0.00 5.37 0.00 -0.36 -3.51 103.07 105.43 3fga h GLY 72 Ca -0.19 -0.70 0.00 0.00 0.00 0.00 0.00 47.33 46.44 3fga h GLY 72 CO 0.24 0.61 0.00 0.61 0.00 0.00 0.00 176.54 178.00 3fga n GLY 73 N 1.92 3.43 3.78 4.60 0.00 0.88 -4.89 105.19 114.90 3fga n GLY 73 Ca -0.29 -1.89 -0.36 0.00 0.00 0.00 0.00 46.02 43.48 3fga n GLY 73 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fga s LYS 74 N -2.87 3.78 0.22 1.61 1.02 -1.26 -4.69 119.74 117.56 3fga s LYS 74 Ca 0.00 1.66 0.19 0.00 0.02 0.00 0.00 55.97 57.84 3fga s LYS 74 Cb 0.00 -2.35 0.89 0.00 -0.52 0.00 0.00 37.83 35.85 3fga s LYS 74 CO 0.00 -0.50 1.57 -1.13 -0.92 0.00 0.00 175.35 174.37 3fga n SER 75 N -0.56 0.47 -0.09 2.83 3.41 -1.26 -1.21 113.62 117.20 3fga n SER 75 Ca 0.08 0.67 -0.17 0.00 -0.26 0.00 0.00 58.87 59.19 3fga n SER 75 Cb 0.49 -0.75 -0.10 0.00 -0.26 0.00 0.00 64.21 63.59 3fga n SER 75 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 3fga h PRO 76 N 0.00 0.00 -0.89 4.33 0.14 -1.96 -3.44 132.00 130.18 3fga h PRO 76 Ca 0.00 0.00 0.03 0.00 0.14 0.00 0.00 66.00 66.17 3fga h PRO 76 Cb 0.15 0.00 -0.05 0.00 0.14 0.00 0.00 31.00 31.24 3fga h PRO 76 CO 0.00 0.84 0.59 -0.44 0.14 0.00 0.00 178.00 179.12 3fga h ASP 77 N -1.00 0.97 -3.46 1.44 3.45 -1.54 -3.40 116.42 112.88 3fga h ASP 77 Ca -0.20 -0.01 -0.68 0.00 0.43 0.00 0.00 57.03 56.58 3fga h ASP 77 Cb 1.06 -0.23 -0.17 0.00 -0.56 0.00 0.00 39.33 39.43 3fga h ASP 77 CO -0.12 0.67 -0.66 0.28 -1.57 0.00 0.00 179.24 177.85 3fga s THR 78 N -5.95 4.01 0.19 0.35 -1.32 -0.92 -5.02 115.64 106.99 3fga s THR 78 Ca -0.12 -0.35 -0.30 0.00 -1.21 0.00 0.00 61.69 59.71 3fga s THR 78 Cb 0.19 -2.68 -0.08 0.00 -1.51 0.00 0.00 72.50 68.42 3fga s THR 78 CO 0.80 0.59 0.94 0.20 -2.21 0.00 0.00 174.62 174.94 3fga s ASN 79 N -0.68 7.58 0.10 8.08 0.02 -1.26 -4.68 114.94 124.10 3fga s ASN 79 Ca 0.11 1.88 0.08 0.00 -1.02 0.00 0.00 52.86 53.90 3fga s ASN 79 Cb -0.12 -2.60 -0.03 0.00 0.02 0.00 0.00 41.25 38.52 3fga s ASN 79 CO 0.02 0.08 -0.21 -0.31 0.02 0.00 0.00 177.10 176.70 3fga s TYR 80 N -0.75 1.82 -0.13 2.20 2.02 -0.56 -0.91 117.35 121.03 3fga s TYR 80 Ca 0.43 -0.41 -0.00 0.00 -0.37 0.00 0.00 57.07 56.71 3fga s TYR 80 Cb -0.25 -1.01 0.03 0.00 -0.40 0.00 0.00 41.96 40.34 3fga s TYR 80 CO 0.31 0.20 -0.07 -1.17 -1.57 0.00 0.00 175.55 173.25 3fga s LEU 81 N -1.84 1.30 -0.18 -1.29 2.96 0.15 -1.15 118.68 118.63 3fga s LEU 81 Ca 0.07 -0.41 -0.07 0.00 -0.22 0.00 0.00 54.13 53.49 3fga s LEU 81 Cb -0.10 -0.85 -0.04 0.00 0.50 0.00 0.00 46.19 45.70 3fga s LEU 81 CO 0.04 -0.14 0.07 -0.36 -1.32 0.00 0.00 176.35 174.63 3fga s PHE 82 N 1.69 3.27 -0.46 5.38 0.08 0.47 -0.66 117.98 127.75 3fga s PHE 82 Ca 0.04 0.11 -0.02 0.00 0.12 0.00 0.00 56.93 57.18 3fga s PHE 82 Cb -0.13 -2.07 0.29 0.00 -0.57 0.00 0.00 43.02 40.54 3fga s PHE 82 CO -0.08 0.19 2.07 -1.33 -0.10 0.00 0.00 175.22 175.97 3fga n MET 83 N 3.44 2.18 0.00 0.44 2.81 -0.72 -0.26 117.12 125.01 3fga n MET 83 Ca -0.17 -2.27 0.00 0.00 -1.81 0.00 0.00 57.70 53.45 3fga n MET 83 Cb 0.52 -1.90 0.00 0.00 -0.71 0.00 0.00 33.22 31.13 3fga n MET 83 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3fga n GLY 84 N -0.09 -1.78 3.49 3.03 0.00 -1.17 -4.32 105.19 104.34 3fga n GLY 84 Ca 0.43 -1.74 -0.23 0.00 0.00 0.00 0.00 46.02 44.49 3fga n GLY 84 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3fga n ASP 85 N 0.12 -6.01 0.01 1.61 10.43 -1.26 -4.39 116.55 117.06 3fga n ASP 85 Ca 0.00 -0.81 0.11 0.00 2.57 0.00 0.00 54.79 56.66 3fga n ASP 85 Cb 0.00 -4.06 -0.01 0.00 1.84 0.00 0.00 41.12 38.90 3fga n ASP 85 CO 0.00 0.00 0.00 -1.22 -1.07 0.00 0.00 177.20 174.91 3fga n TYR 86 N -3.52 0.07 -0.01 1.24 4.01 -1.26 -1.32 117.16 116.36 3fga n TYR 86 Ca -0.09 0.02 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 3fga n TYR 86 Cb 0.59 -0.20 0.00 0.00 -0.31 0.00 0.00 39.34 39.42 3fga n TYR 86 CO 0.00 0.00 0.00 1.33 -0.46 0.00 0.00 176.86 177.73 3fga n VAL 87 N -1.68 0.00 0.00 -0.72 0.24 -1.26 -1.50 118.33 113.41 3fga n VAL 87 Ca 0.03 -0.45 0.00 0.00 -2.04 0.00 0.00 64.34 61.88 3fga n VAL 87 Cb 0.38 1.01 0.00 0.00 -1.47 0.00 0.00 33.84 33.76 3fga n VAL 87 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3fga n ASN 88 N -0.79 0.00 0.19 -1.34 5.03 -1.26 -4.05 115.26 113.04 3fga n ASN 88 Ca 0.00 0.09 0.07 0.00 0.87 0.00 0.00 54.58 55.60 3fga n ASN 88 Cb 0.00 -0.28 0.27 0.00 -1.02 0.00 0.00 39.78 38.75 3fga n ASN 88 CO 0.00 0.00 0.00 0.03 -1.83 0.00 0.00 177.26 175.46 3fga h ARG 89 N 0.00 0.00 -7.02 3.52 2.47 -1.95 -3.32 114.38 108.08 3fga h ARG 89 Ca 0.00 0.00 -0.41 0.00 -1.26 0.00 0.00 59.98 58.31 3fga h ARG 89 Cb 0.00 0.00 0.22 0.00 -1.65 0.00 0.00 29.97 28.54 3fga h ARG 89 CO 0.00 0.34 -0.13 0.41 0.56 0.00 0.00 179.97 181.15 3fga n GLY 90 N 0.58 -2.75 0.39 0.04 0.00 0.61 -4.88 105.19 99.17 3fga n GLY 90 Ca 0.01 -1.35 0.12 0.00 0.00 0.00 0.00 46.02 44.80 3fga n GLY 90 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3fga n TYR 91 N -5.29 0.00 -2.84 1.61 9.36 -1.21 -4.49 117.16 114.30 3fga n TYR 91 Ca 0.06 0.00 -0.16 0.00 3.32 0.00 0.00 57.90 61.11 3fga n TYR 91 Cb 0.56 -0.05 -0.00 0.00 -0.63 0.00 0.00 39.34 39.22 3fga n TYR 91 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 3fga n TYR 92 N -0.28 1.47 -0.02 2.98 4.02 -0.10 -4.89 117.16 120.33 3fga n TYR 92 Ca 0.11 -3.30 -0.15 0.00 -0.01 0.00 0.00 57.90 54.55 3fga n TYR 92 Cb 0.42 -0.36 -0.04 0.00 -0.02 0.00 0.00 39.34 39.34 3fga n TYR 92 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 3fga h SER 93 N 2.94 0.86 0.48 7.72 0.02 -1.79 -2.28 113.55 121.50 3fga h SER 93 Ca 0.05 -0.53 -0.01 0.00 -0.84 0.00 0.00 61.79 60.45 3fga h SER 93 Cb 1.00 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.28 3fga h SER 93 CO 0.58 1.32 -0.37 0.58 -1.14 0.00 0.00 176.83 177.81 3fga h VAL 94 N 0.53 0.25 -0.53 2.27 2.07 -1.91 -1.27 116.25 117.67 3fga h VAL 94 Ca -0.03 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.53 3fga h VAL 94 Cb 1.31 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 3fga h VAL 94 CO 0.14 0.00 0.35 -0.33 0.02 0.00 0.00 177.57 177.75 3fga h GLU 95 N -0.83 0.56 -0.01 1.57 3.07 -1.95 -2.06 114.58 114.93 3fga h GLU 95 Ca -0.05 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.75 3fga h GLU 95 Cb 0.71 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 28.49 3fga h GLU 95 CO 0.01 0.37 -0.09 1.15 -1.40 0.00 0.00 179.01 179.04 3fga h THR 96 N 0.58 1.57 -0.26 1.13 2.02 -1.06 -1.68 112.91 115.20 3fga h THR 96 Ca 0.22 -1.79 -0.10 0.00 0.77 0.00 0.00 66.41 65.50 3fga h THR 96 Cb 0.14 2.74 -0.00 0.00 -1.74 0.00 0.00 68.15 69.29 3fga h THR 96 CO -0.06 0.48 -0.24 1.62 0.37 0.00 0.00 175.52 177.69 3fga h VAL 97 N -0.63 1.31 -0.36 3.16 3.04 -1.22 -1.45 116.25 120.10 3fga h VAL 97 Ca -0.01 -1.40 -0.06 0.00 -1.01 0.00 0.00 66.70 64.22 3fga h VAL 97 Cb 0.83 1.63 -0.02 0.00 -2.01 0.00 0.00 31.29 31.72 3fga h VAL 97 CO 0.02 0.44 -0.01 0.00 -1.01 0.00 0.00 177.57 177.01 3fga h THR 98 N 0.35 1.21 -0.13 3.17 1.03 -1.45 0.13 112.91 117.22 3fga h THR 98 Ca 0.04 -0.84 -0.01 0.00 -0.01 0.00 0.00 66.41 65.59 3fga h THR 98 Cb 0.80 0.95 -0.01 0.00 -1.07 0.00 0.00 68.15 68.82 3fga h THR 98 CO 0.06 0.29 0.05 0.25 -0.01 0.00 0.00 175.52 176.16 3fga h LEU 99 N 0.54 0.18 -0.71 0.00 5.85 -1.16 0.64 115.31 120.65 3fga h LEU 99 Ca 0.11 -0.17 -0.08 0.00 0.84 0.00 0.00 57.88 58.59 3fga h LEU 99 Cb 0.36 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.32 3fga h LEU 99 CO 0.01 0.30 0.13 -0.07 -0.34 0.00 0.00 178.44 178.47 3fga h LEU 100 N 0.05 1.07 0.15 2.25 3.38 -0.45 0.36 115.31 122.12 3fga h LEU 100 Ca 0.04 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 3fga h LEU 100 Cb 0.18 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.65 3fga h LEU 100 CO -0.00 1.05 -0.07 0.58 0.09 0.00 0.00 178.44 180.08 3fga h VAL 101 N 1.05 0.92 -0.80 1.22 2.07 -0.76 -2.54 116.25 117.41 3fga h VAL 101 Ca 0.21 -0.27 0.10 0.00 0.82 0.00 0.00 66.70 67.56 3fga h VAL 101 Cb 0.42 1.09 -0.12 0.00 -1.52 0.00 0.00 31.29 31.16 3fga h VAL 101 CO 0.01 0.06 -0.49 0.00 0.02 0.00 0.00 177.57 177.17 3fga h ALA 102 N 0.52 -0.34 -0.71 1.67 0.00 -0.20 0.28 119.26 120.48 3fga h ALA 102 Ca -0.02 0.14 0.15 0.00 0.00 0.00 0.00 54.91 55.18 3fga h ALA 102 Cb 0.25 1.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.14 3fga h ALA 102 CO 0.03 -0.85 0.48 -0.07 0.00 0.00 0.00 179.25 178.84 3fga h LEU 103 N -0.12 0.30 -0.14 0.00 3.38 -0.87 -1.85 115.31 116.00 3fga h LEU 103 Ca 0.20 0.02 -0.19 0.00 0.09 0.00 0.00 57.88 57.99 3fga h LEU 103 Cb 0.52 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.24 3fga h LEU 103 CO -0.84 0.15 -0.66 0.50 0.09 0.00 0.00 178.44 177.69 3fga h LYS 104 N 0.31 0.70 -0.00 1.13 1.63 -0.04 -0.84 116.57 119.46 3fga h LYS 104 Ca 0.34 -0.56 -0.13 0.00 -0.85 0.00 0.00 60.65 59.45 3fga h LYS 104 Cb 0.90 0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 32.63 3fga h LYS 104 CO -0.09 1.18 -0.64 -0.24 -3.45 0.00 0.00 179.45 176.21 3fga h VAL 105 N 0.39 1.46 -0.00 2.00 3.04 -0.87 -2.22 116.25 120.06 3fga h VAL 105 Ca -0.04 -2.19 -0.17 0.00 -1.01 0.00 0.00 66.70 63.29 3fga h VAL 105 Cb 1.29 2.18 -0.02 0.00 -2.01 0.00 0.00 31.29 32.73 3fga h VAL 105 CO 0.14 0.63 -0.78 -0.09 -1.01 0.00 0.00 177.57 176.45 3fga h ARG 106 N 0.00 0.02 -1.85 4.17 1.12 -1.31 -3.40 114.38 113.13 3fga h ARG 106 Ca -0.01 -0.02 -0.52 0.00 -1.11 0.00 0.00 59.98 58.32 3fga h ARG 106 Cb 1.13 0.01 -0.37 0.00 -0.01 0.00 0.00 29.97 30.73 3fga h ARG 106 CO 0.08 0.79 -1.08 0.66 -3.11 0.00 0.00 179.97 177.31 3fga n TYR 107 N -3.63 -0.47 0.30 2.20 4.02 -0.33 -4.97 117.16 114.29 3fga n TYR 107 Ca -0.01 -3.48 0.18 0.00 -0.01 0.00 0.00 57.90 54.58 3fga n TYR 107 Cb 0.75 -0.22 0.92 0.00 -0.02 0.00 0.00 39.34 40.77 3fga n TYR 107 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 176.86 175.92 3fga h ARG 108 N 3.79 0.00 0.00 -0.72 0.11 -1.62 -1.57 114.38 114.36 3fga h ARG 108 Ca 0.06 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.14 3fga h ARG 108 Cb 0.91 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.99 3fga h ARG 108 CO 0.46 0.03 -1.20 -1.91 0.10 0.00 0.00 179.97 177.45 3fga n GLU 109 N -3.26 0.51 -0.02 0.08 4.07 -1.26 -4.22 120.64 116.54 3fga n GLU 109 Ca -0.02 0.02 0.09 0.00 -0.06 0.00 0.00 57.16 57.19 3fga n GLU 109 Cb 0.19 -1.69 -0.16 0.00 -0.06 0.00 0.00 31.44 29.71 3fga n GLU 109 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 3fga n ARG 110 N -2.35 0.65 -4.27 5.31 5.12 -0.61 -4.93 116.66 115.57 3fga n ARG 110 Ca -0.00 -0.18 -0.17 0.00 -1.93 0.00 0.00 57.85 55.57 3fga n ARG 110 Cb 0.52 -1.51 -0.15 0.00 -1.16 0.00 0.00 32.46 30.16 3fga n ARG 110 CO 0.00 0.00 0.00 -1.50 -1.93 0.00 0.00 177.63 174.20 3fga s ILE 111 N -3.40 0.58 -0.03 0.55 2.07 -1.08 -1.50 121.20 118.40 3fga s ILE 111 Ca -0.08 -0.32 0.05 0.00 -1.41 0.00 0.00 60.65 58.89 3fga s ILE 111 Cb 0.13 -0.49 -0.01 0.00 0.13 0.00 0.00 42.46 42.22 3fga s ILE 111 CO 0.88 0.16 -0.17 0.28 -1.91 0.00 0.00 174.94 174.17 3fga s THR 112 N -0.19 1.39 -0.14 4.00 -1.32 -0.30 -4.76 115.64 114.32 3fga s THR 112 Ca 0.03 -0.73 0.01 0.00 -1.21 0.00 0.00 61.69 59.79 3fga s THR 112 Cb -0.03 -1.17 0.02 0.00 -1.51 0.00 0.00 72.50 69.80 3fga s THR 112 CO -0.00 0.40 -0.17 0.27 -2.21 0.00 0.00 174.62 172.91 3fga s ILE 113 N -0.22 1.74 0.53 5.08 -4.36 -1.26 -0.39 121.20 122.32 3fga s ILE 113 Ca 0.02 -0.76 0.03 0.00 -0.26 0.00 0.00 60.65 59.69 3fga s ILE 113 Cb -0.09 -1.59 0.04 0.00 1.25 0.00 0.00 42.46 42.07 3fga s ILE 113 CO 0.00 0.49 0.74 -0.76 0.24 0.00 0.00 174.94 175.65 3fga s LEU 114 N 1.22 3.33 0.08 0.37 1.43 0.65 -4.35 118.68 121.42 3fga s LEU 114 Ca 0.00 -0.22 -0.22 0.00 -1.03 0.00 0.00 54.13 52.67 3fga s LEU 114 Cb -0.14 -2.64 -0.07 0.00 0.03 0.00 0.00 46.19 43.38 3fga s LEU 114 CO -0.08 -1.13 0.67 -0.60 0.23 0.00 0.00 176.35 175.45 3fga s ARG 115 N -4.68 4.38 0.46 1.70 3.52 0.13 -3.06 118.95 121.40 3fga s ARG 115 Ca 0.58 0.92 0.07 0.00 -0.13 0.00 0.00 55.73 57.16 3fga s ARG 115 Cb -0.09 -3.29 -0.01 0.00 -1.56 0.00 0.00 34.95 30.00 3fga s ARG 115 CO 0.38 0.51 0.31 0.20 -0.81 0.00 0.00 175.30 175.89 3fga s GLY 116 N -0.77 2.30 0.23 8.12 0.00 -1.26 -4.42 107.32 111.51 3fga s GLY 116 Ca 0.33 -1.72 0.20 0.00 0.00 0.00 0.00 44.72 43.52 3fga s GLY 116 CO 0.22 -1.86 1.60 1.16 0.00 0.00 0.00 173.10 174.21 3fga n ASN 117 N -1.51 0.50 -0.05 1.64 2.04 -1.26 -2.15 115.26 114.46 3fga n ASN 117 Ca -0.00 0.67 0.12 0.00 -0.44 0.00 0.00 54.58 54.92 3fga n ASN 117 Cb 0.64 -0.75 0.22 0.00 -2.53 0.00 0.00 39.78 37.36 3fga n ASN 117 CO 0.00 0.00 0.00 1.41 -0.44 0.00 0.00 177.26 178.23 3fga n HIS 118 N -2.10 0.00 -1.81 -2.53 8.25 -1.26 -4.43 115.22 111.34 3fga n HIS 118 Ca 0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.05 3fga n HIS 118 Cb 0.13 -0.20 -0.00 0.00 1.12 0.00 0.00 29.99 31.05 3fga n HIS 118 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 3fga n GLU 119 N -1.33 3.00 -3.61 -0.41 4.71 -0.91 -4.32 120.64 117.76 3fga n GLU 119 Ca 0.07 -2.74 -0.14 0.00 -0.01 0.00 0.00 57.16 54.34 3fga n GLU 119 Cb 0.34 -3.22 -0.07 0.00 -1.01 0.00 0.00 31.44 27.48 3fga n GLU 119 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 3fga s SER 120 N 2.80 -0.69 0.25 1.62 1.04 -1.26 -4.80 113.70 112.65 3fga s SER 120 Ca 0.46 1.25 -0.03 0.00 0.48 0.00 0.00 55.95 58.11 3fga s SER 120 Cb 0.13 1.23 0.48 0.00 0.10 0.00 0.00 66.02 67.97 3fga s SER 120 CO -0.07 -0.29 1.73 0.03 0.98 0.00 0.00 173.24 175.61 3fga h ARG 121 N 4.55 0.44 -0.08 4.02 3.08 -1.91 -1.71 114.38 122.77 3fga h ARG 121 Ca -0.28 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.71 3fga h ARG 121 Cb 1.16 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 31.11 3fga h ARG 121 CO 0.11 0.29 -0.06 0.37 -1.07 0.00 0.00 179.97 179.62 3fga h GLN 122 N 0.45 0.18 -0.24 0.04 4.15 -1.97 -2.91 115.11 114.82 3fga h GLN 122 Ca 0.43 -0.09 -0.10 0.00 0.77 0.00 0.00 58.65 59.66 3fga h GLN 122 Cb 0.65 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.33 3fga h GLN 122 CO -0.41 0.58 -0.27 0.82 -1.93 0.00 0.00 178.83 177.62 3fga h ILE 123 N -0.22 1.27 0.00 2.39 1.08 -1.76 -1.94 117.51 118.33 3fga h ILE 123 Ca 0.02 -1.30 0.00 0.00 -0.39 0.00 0.00 64.86 63.19 3fga h ILE 123 Cb 0.54 1.38 0.00 0.00 -3.07 0.00 0.00 36.82 35.67 3fga h ILE 123 CO 0.02 0.41 0.00 0.00 -0.69 0.00 0.00 178.15 177.89 3fga h THR 124 N 0.41 0.00 0.13 -0.27 1.03 -1.33 -2.13 112.91 110.76 3fga h THR 124 Ca 0.06 -0.48 -0.36 0.00 -0.01 0.00 0.00 66.41 65.62 3fga h THR 124 Cb 0.69 1.43 -0.01 0.00 -1.07 0.00 0.00 68.15 69.19 3fga h THR 124 CO 0.05 0.00 -1.91 1.56 -0.01 0.00 0.00 175.52 175.21 3fga h GLN 125 N 0.00 0.29 0.00 0.00 4.20 -1.15 -1.30 115.11 117.14 3fga h GLN 125 Ca 0.00 -0.49 -0.12 0.00 0.06 0.00 0.00 58.65 58.11 3fga h GLN 125 Cb 0.51 0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 3fga h GLN 125 CO 0.00 1.20 -0.56 -0.39 -0.67 0.00 0.00 178.83 178.42 3fga h VAL 126 N 0.08 1.00 -0.64 -0.54 -1.51 -1.37 -3.45 116.25 109.82 3fga h VAL 126 Ca -0.39 -2.27 -0.53 0.00 -1.23 0.00 0.00 66.70 62.28 3fga h VAL 126 Cb 2.05 2.40 0.00 0.00 -2.13 0.00 0.00 31.29 33.61 3fga h VAL 126 CO 0.11 0.54 -0.15 -0.31 -1.23 0.00 0.00 177.57 176.54 3fga s TYR 127 N -3.05 1.35 0.21 5.19 2.02 -0.81 -5.04 117.35 117.23 3fga s TYR 127 Ca 0.03 -0.79 -0.12 0.00 -0.37 0.00 0.00 57.07 55.82 3fga s TYR 127 Cb 0.09 -2.10 0.28 0.00 -0.40 0.00 0.00 41.96 39.83 3fga s TYR 127 CO 0.75 -1.00 1.64 0.78 -1.57 0.00 0.00 175.55 176.14 3fga h GLY 128 N 0.31 0.57 -0.81 0.71 0.00 -1.80 -3.35 103.07 98.71 3fga h GLY 128 Ca -0.31 0.15 0.32 0.00 0.00 0.00 0.00 47.33 47.49 3fga h GLY 128 CO 0.46 -0.23 0.31 -2.75 0.00 0.00 0.00 176.54 174.32 3fga h PHE 129 N 0.05 0.45 -0.23 5.60 3.57 -1.70 0.74 116.94 125.43 3fga h PHE 129 Ca 0.32 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.87 3fga h PHE 129 Cb 0.52 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.21 3fga h PHE 129 CO -0.45 -0.37 0.12 -0.92 -2.23 0.00 0.00 178.31 174.47 3fga h TYR 130 N 0.09 0.33 -0.04 0.41 5.03 -1.36 -0.59 116.97 120.83 3fga h TYR 130 Ca 0.69 -0.01 -0.11 0.00 2.58 0.00 0.00 58.73 61.88 3fga h TYR 130 Cb 1.60 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 39.76 3fga h TYR 130 CO -0.23 0.31 -0.48 -0.44 -1.32 0.00 0.00 178.16 176.00 3fga h ASP 131 N 0.25 0.10 -0.28 -2.11 3.45 -1.13 -2.39 116.42 114.31 3fga h ASP 131 Ca 0.08 -0.05 -0.01 0.00 0.43 0.00 0.00 57.03 57.48 3fga h ASP 131 Cb 0.10 -0.03 -0.01 0.00 -0.56 0.00 0.00 39.33 38.82 3fga h ASP 131 CO -0.01 0.57 0.13 -0.08 -1.57 0.00 0.00 179.24 178.27 3fga h GLU 132 N 0.08 0.41 -0.61 3.56 4.81 -1.02 -1.19 114.58 120.62 3fga h GLU 132 Ca 0.00 -0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.19 3fga h GLU 132 Cb 0.87 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.15 3fga h GLU 132 CO 0.07 0.41 0.41 0.00 -0.73 0.00 0.00 179.01 179.16 3fga h LEU 134 N 0.78 0.57 -0.01 0.00 5.85 -1.04 -1.33 115.31 120.13 3fga h LEU 134 Ca 0.23 -0.57 0.00 0.00 0.84 0.00 0.00 57.88 58.38 3fga h LEU 134 Cb -0.01 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 40.85 3fga h LEU 134 CO -0.06 1.04 0.00 -2.11 -0.34 0.00 0.00 178.44 176.97 3fga n ARG 135 N -4.33 0.02 -0.00 1.25 1.85 -0.49 -0.89 116.66 114.07 3fga n ARG 135 Ca -0.07 0.08 0.08 0.00 -1.00 0.00 0.00 57.85 56.94 3fga n ARG 135 Cb 0.51 -1.53 -0.11 0.00 -1.05 0.00 0.00 32.46 30.28 3fga n ARG 135 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 3fga n LYS 136 N -1.56 1.15 0.00 2.89 5.02 -0.71 -4.70 118.16 120.25 3fga n LYS 136 Ca 0.06 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3fga n LYS 136 Cb 0.31 -1.33 0.00 0.00 -0.02 0.00 0.00 35.03 33.99 3fga n LYS 136 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3fga n TYR 137 N -1.64 0.00 -0.34 2.13 4.01 -0.51 -5.04 117.16 115.76 3fga n TYR 137 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 3fga n TYR 137 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.36 3fga n TYR 137 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fga n GLY 138 N 1.14 1.05 3.41 2.72 0.00 -0.07 -5.02 105.19 108.43 3fga n GLY 138 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 3fga n GLY 138 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3fga n ASN 139 N 0.00 -1.56 -1.06 1.61 2.04 -1.26 -5.04 115.26 109.99 3fga n ASN 139 Ca 0.00 -2.80 0.08 0.00 -0.44 0.00 0.00 54.58 51.42 3fga n ASN 139 Cb 0.00 2.80 0.24 0.00 -2.53 0.00 0.00 39.78 40.29 3fga n ASN 139 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3fga n ALA 140 N -0.70 2.59 0.06 -2.53 0.00 -1.26 -4.34 120.51 114.33 3fga n ALA 140 Ca -0.14 -1.00 -0.13 0.00 0.00 0.00 0.00 53.44 52.17 3fga n ALA 140 Cb 0.58 -0.98 -0.08 0.00 0.00 0.00 0.00 19.45 18.97 3fga n ALA 140 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 3fga h ASN 141 N 3.07 -0.11 -0.66 0.00 2.35 -1.97 -1.34 115.58 116.94 3fga h ASN 141 Ca 0.00 -0.23 0.03 0.00 -0.55 0.00 0.00 56.30 55.55 3fga h ASN 141 Cb 0.85 0.03 -0.04 0.00 0.05 0.00 0.00 38.32 39.21 3fga h ASN 141 CO 0.06 0.17 0.43 0.58 -1.65 0.00 0.00 177.43 177.02 3fga h VAL 142 N -0.39 1.11 0.10 2.81 2.07 -1.93 0.39 116.25 120.41 3fga h VAL 142 Ca -0.01 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 3fga h VAL 142 Cb 0.32 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 3fga h VAL 142 CO 0.02 0.15 -0.05 -0.25 0.02 0.00 0.00 177.57 177.46 3fga h TRP 143 N 0.81 -0.12 -0.71 1.57 7.01 -1.83 -1.12 115.95 121.55 3fga h TRP 143 Ca 0.26 -0.00 0.13 0.00 2.11 0.00 0.00 58.89 61.39 3fga h TRP 143 Cb 0.02 0.04 -0.09 0.00 -2.10 0.00 0.00 29.16 27.03 3fga h TRP 143 CO -0.00 -0.01 0.25 -0.22 -2.79 0.00 0.00 178.44 175.68 3fga h LYS 144 N -0.20 0.39 -0.50 2.65 3.11 -0.07 0.17 116.57 122.10 3fga h LYS 144 Ca -0.01 -0.02 -0.12 0.00 -2.81 0.00 0.00 60.65 57.68 3fga h LYS 144 Cb 0.17 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 31.29 3fga h LYS 144 CO 0.02 0.25 -0.16 1.88 -2.81 0.00 0.00 179.45 178.63 3fga h TYR 145 N 0.40 1.13 -0.09 1.91 0.05 -0.73 -0.61 116.97 119.03 3fga h TYR 145 Ca 0.39 -0.26 -0.15 0.00 0.05 0.00 0.00 58.73 58.76 3fga h TYR 145 Cb 0.58 -0.27 0.01 0.00 1.01 0.00 0.00 36.73 38.06 3fga h TYR 145 CO -0.19 1.08 -0.52 0.74 -1.05 0.00 0.00 178.16 178.22 3fga h PHE 146 N 0.86 0.69 -0.59 4.88 -1.00 -0.82 -1.97 116.94 118.99 3fga h PHE 146 Ca 0.12 -0.31 -0.08 0.00 2.81 0.00 0.00 57.97 60.51 3fga h PHE 146 Cb 0.74 -0.10 -0.02 0.00 3.61 0.00 0.00 35.95 40.17 3fga h PHE 146 CO 0.05 1.10 0.05 1.79 -1.61 0.00 0.00 178.31 179.68 3fga h THR 147 N 0.08 1.26 -0.94 -1.55 1.35 -0.71 0.18 112.91 112.59 3fga h THR 147 Ca -0.04 -1.07 0.08 0.00 -0.55 0.00 0.00 66.41 64.83 3fga h THR 147 Cb 1.17 0.80 -0.07 0.00 -1.73 0.00 0.00 68.15 68.33 3fga h THR 147 CO 0.11 0.39 0.61 0.44 -0.25 0.00 0.00 175.52 176.81 3fga h ASP 148 N 0.90 0.91 0.02 5.36 3.45 -1.14 -2.06 116.42 123.86 3fga h ASP 148 Ca 0.17 0.02 -0.12 0.00 0.43 0.00 0.00 57.03 57.53 3fga h ASP 148 Cb 0.49 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 39.07 3fga h ASP 148 CO 0.02 0.56 -0.37 0.25 -1.57 0.00 0.00 179.24 178.12 3fga h LEU 149 N 1.02 0.49 -1.79 1.55 7.12 -0.51 -3.09 115.31 120.10 3fga h LEU 149 Ca 0.42 -0.20 0.03 0.00 0.13 0.00 0.00 57.88 58.26 3fga h LEU 149 Cb 0.30 -0.14 -0.02 0.00 -0.53 0.00 0.00 40.66 40.27 3fga h LEU 149 CO -0.18 0.82 0.20 -0.26 -0.13 0.00 0.00 178.44 178.89 3fga h PHE 150 N 0.40 0.26 0.00 1.25 0.05 0.08 -1.85 116.94 117.12 3fga h PHE 150 Ca 0.04 0.01 0.00 0.00 3.82 0.00 0.00 57.97 61.84 3fga h PHE 150 Cb 0.84 -0.09 0.00 0.00 2.00 0.00 0.00 35.95 38.70 3fga h PHE 150 CO 0.03 0.15 0.01 -0.44 -0.18 0.00 0.00 178.31 177.88 3fga h ASP 151 N 0.27 0.00 0.07 2.17 3.45 -1.49 -2.53 116.42 118.36 3fga h ASP 151 Ca 0.12 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.58 3fga h ASP 151 Cb 0.15 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.92 3fga h ASP 151 CO -0.02 0.00 -0.35 -1.22 -1.57 0.00 0.00 179.24 176.08 3fga n TYR 152 N -2.81 0.00 -2.51 4.55 4.02 -0.69 -3.86 117.16 115.86 3fga n TYR 152 Ca -0.02 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.44 3fga n TYR 152 Cb 0.07 -0.04 -0.03 0.00 -0.02 0.00 0.00 39.34 39.32 3fga n TYR 152 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 3fga s LEU 153 N -2.43 4.31 0.62 7.72 1.43 -0.96 -4.51 118.68 124.87 3fga s LEU 153 Ca 0.22 1.81 -0.18 0.00 -1.03 0.00 0.00 54.13 54.96 3fga s LEU 153 Cb 0.19 -3.56 -0.06 0.00 0.03 0.00 0.00 46.19 42.78 3fga s LEU 153 CO 0.53 -0.50 0.67 -0.81 0.23 0.00 0.00 176.35 176.46 3fga n PRO 154 N 4.72 0.56 0.03 1.29 -0.04 -1.26 -4.38 135.00 135.92 3fga n PRO 154 Ca 0.10 0.23 -0.01 0.00 -0.04 0.00 0.00 63.50 63.77 3fga n PRO 154 Cb 0.47 -1.89 -0.08 0.00 -0.04 0.00 0.00 33.50 31.96 3fga n PRO 154 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3fga h LEU 155 N 0.14 0.00 -7.30 1.53 3.38 -1.79 0.39 115.31 111.66 3fga h LEU 155 Ca -0.46 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.43 3fga h LEU 155 Cb 1.38 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.96 3fga h LEU 155 CO 0.47 0.64 -0.05 0.42 0.09 0.00 0.00 178.44 180.01 3fga s THR 156 N -2.88 0.04 0.12 0.22 -4.23 -0.86 -4.41 115.64 103.65 3fga s THR 156 Ca -0.03 -0.37 0.07 0.00 -1.18 0.00 0.00 61.69 60.19 3fga s THR 156 Cb 0.09 -0.96 -0.04 0.00 1.34 0.00 0.00 72.50 72.93 3fga s THR 156 CO 0.81 -0.20 -0.18 0.00 -0.54 0.00 0.00 174.62 174.51 3fga s ALA 157 N -2.45 1.69 -0.23 3.99 0.00 0.15 -1.24 121.76 123.67 3fga s ALA 157 Ca -0.05 -1.28 0.01 0.00 0.00 0.00 0.00 51.96 50.64 3fga s ALA 157 Cb -0.01 -0.17 0.06 0.00 0.00 0.00 0.00 23.12 23.00 3fga s ALA 157 CO -0.02 0.25 -0.06 -1.17 0.00 0.00 0.00 175.76 174.76 3fga s LEU 158 N -2.17 2.62 -0.38 0.00 0.20 0.16 -0.38 118.68 118.73 3fga s LEU 158 Ca 0.08 -1.18 -0.22 0.00 0.69 0.00 0.00 54.13 53.50 3fga s LEU 158 Cb -0.08 -1.21 0.01 0.00 -0.43 0.00 0.00 46.19 44.48 3fga s LEU 158 CO 0.04 -0.23 0.71 -0.69 -0.29 0.00 0.00 176.35 175.89 3fga s VAL 159 N 1.37 4.79 -1.74 1.68 1.01 -0.37 -0.82 120.40 126.32 3fga s VAL 159 Ca -0.06 0.60 -0.01 0.00 0.00 0.00 0.00 61.98 62.51 3fga s VAL 159 Cb -0.19 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 32.02 3fga s VAL 159 CO -0.06 -0.46 0.12 0.47 0.00 0.00 0.00 175.10 175.17 3fga n ASP 160 N 6.31 -5.95 -1.03 3.32 10.43 -1.08 -1.66 116.55 126.89 3fga n ASP 160 Ca 0.01 -0.07 -0.13 0.00 2.57 0.00 0.00 54.79 57.16 3fga n ASP 160 Cb 0.48 -4.93 -0.06 0.00 1.84 0.00 0.00 41.12 38.46 3fga n ASP 160 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3fga n GLY 161 N -1.12 1.35 0.00 0.44 0.00 -1.26 -4.79 105.19 99.81 3fga n GLY 161 Ca -0.22 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.64 3fga n GLY 161 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3fga n GLN 162 N -1.91 0.14 -3.91 1.61 6.02 -0.72 -4.72 117.38 113.89 3fga n GLN 162 Ca -0.13 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.51 3fga n GLN 162 Cb 0.53 -0.53 -0.14 0.00 1.02 0.00 0.00 30.24 31.12 3fga n GLN 162 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3fga s ILE 163 N -1.07 3.07 -0.09 5.09 1.09 -0.67 -1.25 121.20 127.38 3fga s ILE 163 Ca 0.00 -1.17 -0.23 0.00 -1.10 0.00 0.00 60.65 58.16 3fga s ILE 163 Cb 0.00 -2.67 -0.03 0.00 -1.06 0.00 0.00 42.46 38.70 3fga s ILE 163 CO 0.00 0.03 0.68 0.12 -0.10 0.00 0.00 174.94 175.66 3fga s PHE 164 N 1.31 3.54 -0.08 3.97 5.36 -0.87 -1.24 117.98 129.97 3fga s PHE 164 Ca -0.02 1.18 0.03 0.00 -0.96 0.00 0.00 56.93 57.16 3fga s PHE 164 Cb -0.18 -2.79 0.01 0.00 -0.34 0.00 0.00 43.02 39.71 3fga s PHE 164 CO -0.02 0.06 -0.18 0.00 -1.46 0.00 0.00 175.22 173.62 3fga s LEU 166 N 0.51 -0.46 -0.03 0.00 2.34 -0.89 0.30 118.68 120.46 3fga s LEU 166 Ca -0.17 -0.01 -0.26 0.00 0.06 0.00 0.00 54.13 53.75 3fga s LEU 166 Cb -0.17 2.31 -0.21 0.00 -0.56 0.00 0.00 46.19 47.56 3fga s LEU 166 CO 0.06 -0.80 1.24 -0.74 -1.06 0.00 0.00 176.35 175.05 3fga h HIS 167 N 2.00 0.00 0.00 3.48 -0.00 -1.75 -3.30 115.15 115.58 3fga h HIS 167 Ca -0.28 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.09 3fga h HIS 167 Cb 1.27 -0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.68 3fga h HIS 167 CO 0.25 0.52 0.00 0.41 -0.00 0.00 0.00 177.93 179.10 3fga n GLY 168 N 0.30 -0.03 0.00 5.26 0.00 0.21 -1.63 105.19 109.30 3fga n GLY 168 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 3fga n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fga n GLY 169 N 2.06 -0.60 3.93 -0.02 0.00 -1.06 -4.40 105.19 105.11 3fga n GLY 169 Ca 0.00 -1.29 -0.25 0.00 0.00 0.00 0.00 46.02 44.48 3fga n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fga s LEU 170 N 0.00 3.08 -0.02 0.99 1.43 -1.26 -4.07 118.68 118.83 3fga s LEU 170 Ca 0.00 0.48 0.04 0.00 -1.03 0.00 0.00 54.13 53.62 3fga s LEU 170 Cb 0.00 -3.24 -0.01 0.00 0.03 0.00 0.00 46.19 42.97 3fga s LEU 170 CO 0.00 -1.29 -0.13 -0.55 0.23 0.00 0.00 176.35 174.61 3fga s SER 171 N -4.41 1.61 0.38 2.29 0.15 -1.26 -4.64 113.70 107.81 3fga s SER 171 Ca 0.57 -0.25 0.07 0.00 0.70 0.00 0.00 55.95 57.04 3fga s SER 171 Cb -0.11 -0.30 0.76 0.00 -1.71 0.00 0.00 66.02 64.66 3fga s SER 171 CO 0.44 0.14 1.95 1.55 1.20 0.00 0.00 173.24 178.52 3fga h PRO 172 N 6.05 0.43 0.00 5.44 0.13 -1.98 -1.13 132.00 140.93 3fga h PRO 172 Ca -0.34 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 3fga h PRO 172 Cb 1.17 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.22 3fga h PRO 172 CO 0.49 0.42 0.00 0.43 -0.23 0.00 0.00 178.00 179.11 3fga n SER 173 N -4.35 0.00 -4.29 1.44 7.64 -1.26 -4.75 113.62 108.05 3fga n SER 173 Ca 0.01 -0.16 -0.33 0.00 1.01 0.00 0.00 58.87 59.40 3fga n SER 173 Cb 0.19 -0.24 -0.15 0.00 -1.01 0.00 0.00 64.21 63.00 3fga n SER 173 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3fga s ILE 174 N -2.48 2.65 0.00 0.44 1.09 -0.43 -4.98 121.20 117.49 3fga s ILE 174 Ca 0.24 -0.79 0.00 0.00 -1.10 0.00 0.00 60.65 59.00 3fga s ILE 174 Cb 0.16 -2.09 0.00 0.00 -1.06 0.00 0.00 42.46 39.47 3fga s ILE 174 CO 0.34 0.53 0.00 0.47 -0.10 0.00 0.00 174.94 176.18 3fga n ASP 175 N 3.72 4.21 -4.17 3.58 10.43 -1.26 -4.59 116.55 128.47 3fga n ASP 175 Ca -0.19 0.00 -0.11 0.00 2.57 0.00 0.00 54.79 57.07 3fga n ASP 175 Cb 0.52 0.75 -0.10 0.00 1.84 0.00 0.00 41.12 44.13 3fga n ASP 175 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 3fga s THR 176 N -1.72 0.54 0.25 -3.53 -4.23 -1.26 -4.82 115.64 100.87 3fga s THR 176 Ca 0.00 -1.92 -0.04 0.00 -1.18 0.00 0.00 61.69 58.55 3fga s THR 176 Cb 0.00 -1.81 0.25 0.00 1.34 0.00 0.00 72.50 72.28 3fga s THR 176 CO 0.00 -0.75 1.88 -0.07 -0.54 0.00 0.00 174.62 175.14 3fga h LEU 177 N 2.92 0.98 -1.70 4.79 3.38 -1.97 -2.75 115.31 120.95 3fga h LEU 177 Ca -0.35 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.61 3fga h LEU 177 Cb 1.17 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 3fga h LEU 177 CO 0.64 0.63 0.04 0.44 0.09 0.00 0.00 178.44 180.28 3fga h ASP 178 N 1.12 0.20 -0.79 -0.43 3.32 -1.98 0.59 116.42 118.45 3fga h ASP 178 Ca 0.41 -0.02 0.05 0.00 0.02 0.00 0.00 57.03 57.49 3fga h ASP 178 Cb 0.14 -0.05 -0.05 0.00 0.22 0.00 0.00 39.33 39.58 3fga h ASP 178 CO -0.16 0.21 0.49 0.45 -1.72 0.00 0.00 179.24 178.51 3fga h HIS 179 N 0.23 0.91 -0.31 4.55 3.86 -1.90 -1.98 115.15 120.51 3fga h HIS 179 Ca 0.06 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.23 3fga h HIS 179 Cb 0.09 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 28.26 3fga h HIS 179 CO 0.00 0.48 -0.08 0.82 0.86 0.00 0.00 177.93 180.02 3fga h ILE 180 N 0.92 1.28 -0.04 2.45 2.04 0.05 -2.89 117.51 121.32 3fga h ILE 180 Ca 0.34 -1.12 0.01 0.00 1.00 0.00 0.00 64.86 65.09 3fga h ILE 180 Cb 0.11 1.37 -0.00 0.00 -0.74 0.00 0.00 36.82 37.55 3fga h ILE 180 CO -0.15 0.36 0.04 0.03 0.00 0.00 0.00 178.15 178.43 3fga h ARG 181 N 0.38 0.00 -0.00 2.37 3.08 -0.28 -2.18 114.38 117.74 3fga h ARG 181 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 3fga h ARG 181 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.61 3fga h ARG 181 CO 0.03 0.00 -0.07 0.00 -1.07 0.00 0.00 179.97 178.86 3fga n ALA 182 N -2.37 2.65 -1.68 0.04 0.00 -0.77 -4.86 120.51 113.53 3fga n ALA 182 Ca -0.02 -0.21 -0.31 0.00 0.00 0.00 0.00 53.44 52.90 3fga n ALA 182 Cb 0.13 -1.40 0.03 0.00 0.00 0.00 0.00 19.45 18.21 3fga n ALA 182 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3fga s LEU 183 N -2.53 3.21 -0.43 0.00 1.43 -0.82 -5.03 118.68 114.51 3fga s LEU 183 Ca 0.28 1.58 -0.11 0.00 -1.03 0.00 0.00 54.13 54.85 3fga s LEU 183 Cb 0.20 -4.49 0.08 0.00 0.03 0.00 0.00 46.19 42.01 3fga s LEU 183 CO 0.47 -1.22 0.30 -0.62 0.23 0.00 0.00 176.35 175.51 3fga s ASP 184 N -3.78 5.75 0.14 2.29 2.15 -1.26 -4.96 116.67 117.00 3fga s ASP 184 Ca 0.58 -1.49 0.25 0.00 0.43 0.00 0.00 52.55 52.31 3fga s ASP 184 Cb -0.13 -2.03 0.48 0.00 -0.30 0.00 0.00 42.92 40.94 3fga s ASP 184 CO 0.52 -0.57 1.45 -2.11 -0.17 0.00 0.00 175.17 174.29 3fga n ARG 185 N 4.98 0.28 -0.66 4.34 1.85 -1.26 -4.62 116.66 121.57 3fga n ARG 185 Ca -0.10 0.12 -0.19 0.00 -1.00 0.00 0.00 57.85 56.68 3fga n ARG 185 Cb 0.43 -1.71 -0.02 0.00 -1.05 0.00 0.00 32.46 30.11 3fga n ARG 185 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 3fga n LEU 186 N -2.13 4.34 -3.78 2.89 4.32 -1.25 -4.76 117.00 116.62 3fga n LEU 186 Ca 0.04 -2.65 -0.07 0.00 -0.02 0.00 0.00 56.01 53.31 3fga n LEU 186 Cb 0.43 -1.02 -0.02 0.00 -1.62 0.00 0.00 43.42 41.20 3fga n LEU 186 CO 0.35 0.46 0.52 0.00 -1.22 0.00 0.00 177.39 177.50 3fga s GLN 187 N 3.43 1.57 0.51 3.23 -2.07 -1.25 -5.00 119.66 120.08 3fga s GLN 187 Ca 0.36 -0.84 -0.23 0.00 -1.82 0.00 0.00 55.36 52.83 3fga s GLN 187 Cb 0.10 0.56 -0.06 0.00 -1.09 0.00 0.00 33.01 32.51 3fga s GLN 187 CO -0.03 -0.72 1.38 -2.00 -1.32 0.00 0.00 175.29 172.61 3fga s GLU 188 N -3.74 3.33 0.02 9.60 2.56 -1.26 -4.69 118.70 124.52 3fga s GLU 188 Ca 0.10 2.30 -0.30 0.00 0.00 0.00 0.00 54.97 57.07 3fga s GLU 188 Cb -0.04 -2.40 -0.08 0.00 2.00 0.00 0.00 34.13 33.61 3fga s GLU 188 CO 0.03 -1.06 1.88 0.08 -0.56 0.00 0.00 175.26 175.63 3fga s VAL 189 N -1.27 3.16 0.73 3.70 1.01 -1.26 -4.94 120.40 121.53 3fga s VAL 189 Ca 0.68 0.21 -0.11 0.00 0.00 0.00 0.00 61.98 62.76 3fga s VAL 189 Cb -0.42 -3.14 0.03 0.00 0.00 0.00 0.00 36.38 32.86 3fga s VAL 189 CO 0.51 -0.02 1.08 -2.84 0.00 0.00 0.00 175.10 173.83 3fga s PRO 190 N 4.27 2.61 0.49 2.72 0.02 -1.26 -4.95 135.00 138.89 3fga s PRO 190 Ca 0.84 1.09 0.28 0.00 0.02 0.00 0.00 61.00 63.23 3fga s PRO 190 Cb -0.40 -1.94 0.96 0.00 0.02 0.00 0.00 34.50 33.14 3fga s PRO 190 CO 0.38 -1.37 1.84 0.45 -0.33 0.00 0.00 177.00 177.97 3fga h HIS 191 N -0.84 0.00 -4.17 6.54 3.86 -2.00 -3.41 115.15 115.12 3fga h HIS 191 Ca -0.44 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 58.63 3fga h HIS 191 Cb 1.22 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 29.55 3fga h HIS 191 CO 0.59 0.08 -0.51 -1.21 0.86 0.00 0.00 177.93 177.74 3fga s GLU 192 N -3.52 0.99 0.00 2.45 8.01 -1.26 -4.83 118.70 120.54 3fga s GLU 192 Ca 0.02 -1.29 0.00 0.00 0.01 0.00 0.00 54.97 53.71 3fga s GLU 192 Cb 0.08 0.30 0.00 0.00 -4.31 0.00 0.00 34.13 30.20 3fga s GLU 192 CO 0.60 -0.31 0.00 0.41 0.01 0.00 0.00 175.26 175.97 3fga n GLY 193 N -0.12 1.36 0.14 -1.39 0.00 -1.26 -4.57 105.19 99.34 3fga n GLY 193 Ca -0.07 -2.15 -0.10 0.00 0.00 0.00 0.00 46.02 43.70 3fga n GLY 193 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fga h PRO 194 N 0.00 0.40 -0.77 1.61 0.13 -1.99 -1.76 132.00 129.61 3fga h PRO 194 Ca 0.00 -0.05 0.13 0.00 -0.87 0.00 0.00 66.00 65.21 3fga h PRO 194 Cb 0.00 -0.07 -0.09 0.00 0.13 0.00 0.00 31.00 30.97 3fga h PRO 194 CO 0.00 0.37 0.35 1.98 -0.23 0.00 0.00 178.00 180.47 3fga h MET 195 N 0.33 0.51 -0.48 0.86 4.05 -1.97 -0.91 114.93 117.33 3fga h MET 195 Ca 0.10 -0.03 -0.08 0.00 -0.28 0.00 0.00 59.70 59.41 3fga h MET 195 Cb 0.09 -0.12 -0.02 0.00 -0.80 0.00 0.00 31.60 30.76 3fga h MET 195 CO -0.01 0.34 0.01 0.00 0.23 0.00 0.00 176.91 177.47 3fga h ASP 197 N 0.71 0.98 0.15 0.00 3.32 -0.41 -0.51 116.42 120.66 3fga h ASP 197 Ca 0.14 -0.26 -0.03 0.00 0.02 0.00 0.00 57.03 56.89 3fga h ASP 197 Cb 0.50 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.78 3fga h ASP 197 CO 0.02 1.03 -0.15 -0.07 -1.72 0.00 0.00 179.24 178.35 3fga h LEU 198 N 0.93 0.01 -0.11 1.55 3.38 -1.18 0.11 115.31 120.00 3fga h LEU 198 Ca 0.17 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3fga h LEU 198 Cb 0.52 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3fga h LEU 198 CO 0.03 0.16 -0.69 0.18 0.09 0.00 0.00 178.44 178.20 3fga n LEU 199 N -4.36 0.87 -0.01 1.67 4.77 -0.83 -0.62 117.00 118.49 3fga n LEU 199 Ca -0.02 -0.29 -0.01 0.00 -0.03 0.00 0.00 56.01 55.65 3fga n LEU 199 Cb 0.22 -0.11 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 3fga n LEU 199 CO 0.36 0.20 -0.60 0.79 -1.33 0.00 0.00 177.39 176.81 3fga n TRP 200 N -1.32 0.00 -0.82 -1.77 7.02 -0.26 -4.01 117.44 116.28 3fga n TRP 200 Ca 0.06 0.00 -0.31 0.00 -1.02 0.00 0.00 57.50 56.23 3fga n TRP 200 Cb 0.34 -0.15 0.15 0.00 -2.42 0.00 0.00 31.31 29.24 3fga n TRP 200 CO 0.00 0.00 0.00 -1.12 -2.02 0.00 0.00 177.69 174.55 3fga s SER 201 N -3.32 3.20 0.01 -0.99 0.01 0.29 -4.74 113.70 108.17 3fga s SER 201 Ca -0.02 2.09 0.04 0.00 1.31 0.00 0.00 55.95 59.37 3fga s SER 201 Cb 0.01 -2.55 -0.01 0.00 0.21 0.00 0.00 66.02 63.68 3fga s SER 201 CO 0.13 -2.91 -0.11 -1.81 0.41 0.00 0.00 173.24 168.95 3fga s ASP 202 N -2.83 1.31 0.57 2.44 1.01 -0.94 -3.74 116.67 114.48 3fga s ASP 202 Ca 0.66 -0.27 -0.17 0.00 0.71 0.00 0.00 52.55 53.47 3fga s ASP 202 Cb -0.22 -0.12 -0.05 0.00 1.01 0.00 0.00 42.92 43.55 3fga s ASP 202 CO 0.58 0.09 1.05 -2.16 0.21 0.00 0.00 175.17 174.93 3fga s PRO 203 N -0.54 3.45 0.00 8.23 0.04 -1.26 -1.62 135.00 143.29 3fga s PRO 203 Ca 0.03 1.23 0.00 0.00 0.04 0.00 0.00 61.00 62.30 3fga s PRO 203 Cb -0.05 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.44 3fga s PRO 203 CO 0.00 -0.71 0.00 -0.40 0.04 0.00 0.00 177.00 175.93 3fga n ASP 204 N -1.78 0.00 -1.40 6.66 3.85 0.25 -4.75 116.55 119.38 3fga n ASP 204 Ca 0.09 -0.83 0.08 0.00 -0.71 0.00 0.00 54.79 53.42 3fga n ASP 204 Cb 0.53 0.00 0.33 0.00 -1.35 0.00 0.00 41.12 40.63 3fga n ASP 204 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 3fga n ASP 205 N -1.72 4.82 -1.58 -1.12 5.75 -1.26 -4.24 116.55 117.19 3fga n ASP 205 Ca 0.00 -2.94 -0.07 0.00 -0.01 0.00 0.00 54.79 51.77 3fga n ASP 205 Cb 0.00 -0.61 0.24 0.00 -1.03 0.00 0.00 41.12 39.72 3fga n ASP 205 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3fga n ARG 206 N 0.12 2.67 -3.69 0.11 1.74 -1.26 -5.00 116.66 111.35 3fga n ARG 206 Ca 0.25 -3.06 -0.23 0.00 -0.77 0.00 0.00 57.85 54.03 3fga n ARG 206 Cb 1.04 -2.02 -0.06 0.00 -1.02 0.00 0.00 32.46 30.40 3fga n ARG 206 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3fga n GLY 207 N -0.74 -0.13 0.00 -0.13 0.00 -1.26 -4.72 105.19 98.21 3fga n GLY 207 Ca 0.39 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.51 3fga n GLY 207 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fga n GLY 208 N -1.74 -1.77 3.77 -0.02 0.00 -1.26 -4.75 105.19 99.42 3fga n GLY 208 Ca -0.14 -1.12 -0.38 0.00 0.00 0.00 0.00 46.02 44.38 3fga n GLY 208 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3fga s TRP 209 N -2.10 2.92 0.19 1.61 0.52 -1.26 -2.05 118.94 118.77 3fga s TRP 209 Ca 0.00 1.51 -0.20 0.00 0.02 0.00 0.00 56.10 57.43 3fga s TRP 209 Cb 0.00 -3.47 0.04 0.00 -1.15 0.00 0.00 33.47 28.89 3fga s TRP 209 CO 0.00 -1.62 0.57 0.20 0.02 0.00 0.00 176.95 176.12 3fga s GLY 210 N -1.10 -0.31 0.07 0.98 0.00 -0.54 -4.97 107.32 101.45 3fga s GLY 210 Ca 0.60 0.05 -0.31 0.00 0.00 0.00 0.00 44.72 45.05 3fga s GLY 210 CO 0.40 -0.08 1.44 -0.42 0.00 0.00 0.00 173.10 174.44 3fga s ILE 211 N -3.83 3.38 0.11 0.90 1.09 -1.26 -1.17 121.20 120.42 3fga s ILE 211 Ca 0.06 0.91 -0.31 0.00 -1.10 0.00 0.00 60.65 60.21 3fga s ILE 211 Cb -0.01 -3.58 -0.07 0.00 -1.06 0.00 0.00 42.46 37.73 3fga s ILE 211 CO -0.06 0.03 1.26 -0.55 -0.10 0.00 0.00 174.94 175.53 3fga s SER 212 N 1.57 6.99 0.63 3.58 0.15 -1.26 -4.54 113.70 120.83 3fga s SER 212 Ca 0.66 2.17 0.39 0.00 0.70 0.00 0.00 55.95 59.87 3fga s SER 212 Cb -0.36 -2.59 2.16 0.00 -1.71 0.00 0.00 66.02 63.53 3fga s SER 212 CO 0.29 -0.51 2.31 -0.65 1.20 0.00 0.00 173.24 175.89 3fga h PRO 213 N 6.41 0.00 -7.08 5.44 0.11 -1.94 -3.40 132.00 131.53 3fga h PRO 213 Ca -0.42 0.00 -0.46 0.00 0.11 0.00 0.00 66.00 65.23 3fga h PRO 213 Cb 1.21 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.33 3fga h PRO 213 CO 0.81 0.01 0.37 1.03 -0.21 0.00 0.00 178.00 180.00 3fga s ARG 214 N -4.29 3.97 0.00 1.05 0.52 -1.26 -4.91 118.95 114.03 3fga s ARG 214 Ca -0.05 1.23 0.00 0.00 -0.52 0.00 0.00 55.73 56.40 3fga s ARG 214 Cb 0.14 -2.13 0.00 0.00 0.52 0.00 0.00 34.95 33.47 3fga s ARG 214 CO 0.47 -0.27 0.32 0.41 0.02 0.00 0.00 175.30 176.25 3fga n GLY 215 N -0.51 0.06 3.44 -3.53 0.00 -1.26 -4.78 105.19 98.61 3fga n GLY 215 Ca 0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.00 3fga n GLY 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fga s ALA 216 N -1.55 -1.21 0.02 4.61 0.00 -1.26 -5.07 121.76 117.30 3fga s ALA 216 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.06 3fga s ALA 216 Cb 0.00 0.82 0.00 0.00 0.00 0.00 0.00 23.12 23.94 3fga s ALA 216 CO 0.00 -0.76 0.00 0.41 0.00 0.00 0.00 175.76 175.41 3fga n GLY 217 N -0.33 -1.27 3.20 0.00 0.00 -1.26 -4.68 105.19 100.84 3fga n GLY 217 Ca -0.14 -1.11 -0.15 0.00 0.00 0.00 0.00 46.02 44.62 3fga n GLY 217 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3fga s TYR 218 N -0.12 1.15 0.44 1.61 2.02 -1.26 -4.12 117.35 117.07 3fga s TYR 218 Ca 0.00 -0.64 -0.14 0.00 -0.37 0.00 0.00 57.07 55.92 3fga s TYR 218 Cb 0.00 -0.62 -0.08 0.00 -0.40 0.00 0.00 41.96 40.87 3fga s TYR 218 CO 0.00 0.04 0.86 0.95 -1.57 0.00 0.00 175.55 175.83 3fga s THR 219 N -2.42 4.65 -0.11 -0.71 -4.23 -0.32 -2.22 115.64 110.29 3fga s THR 219 Ca 0.07 0.94 -0.09 0.00 -1.18 0.00 0.00 61.69 61.43 3fga s THR 219 Cb -0.03 -3.70 0.03 0.00 1.34 0.00 0.00 72.50 70.14 3fga s THR 219 CO 0.01 -0.53 0.28 0.72 -0.54 0.00 0.00 174.62 174.56 3fga s PHE 220 N -2.40 -0.32 0.49 3.99 -0.71 -0.64 -1.47 117.98 116.92 3fga s PHE 220 Ca 0.55 0.77 0.07 0.00 -1.04 0.00 0.00 56.93 57.28 3fga s PHE 220 Cb -0.10 0.11 0.08 0.00 -1.21 0.00 0.00 43.02 41.90 3fga s PHE 220 CO 0.28 -0.16 0.68 0.41 -1.34 0.00 0.00 175.22 175.09 3fga n GLY 221 N 3.05 1.74 0.34 1.99 0.00 -0.87 -0.58 105.19 110.86 3fga n GLY 221 Ca -0.14 -2.18 0.19 0.00 0.00 0.00 0.00 46.02 43.90 3fga n GLY 221 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3fga h GLN 222 N 0.00 0.49 -0.15 1.61 4.15 -1.89 -2.52 115.11 116.81 3fga h GLN 222 Ca -0.23 -0.03 -0.09 0.00 0.77 0.00 0.00 58.65 59.07 3fga h GLN 222 Cb 1.01 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.58 3fga h GLN 222 CO 0.31 0.33 -0.30 0.38 -1.93 0.00 0.00 178.83 177.62 3fga h ASP 223 N 0.51 0.28 0.10 -0.69 3.04 -1.95 0.69 116.42 118.40 3fga h ASP 223 Ca 0.67 -0.10 -0.00 0.00 -3.24 0.00 0.00 57.03 54.36 3fga h ASP 223 Cb 1.35 -0.08 0.00 0.00 -1.04 0.00 0.00 39.33 39.57 3fga h ASP 223 CO -0.51 0.58 -0.05 0.40 -2.04 0.00 0.00 179.24 177.62 3fga h ILE 224 N 0.25 1.05 -0.22 4.15 5.03 -1.81 -1.44 117.51 124.52 3fga h ILE 224 Ca 0.03 -0.56 0.05 0.00 -0.12 0.00 0.00 64.86 64.27 3fga h ILE 224 Cb 0.66 1.40 -0.05 0.00 -3.03 0.00 0.00 36.82 35.80 3fga h ILE 224 CO 0.05 0.14 -0.14 0.28 -0.68 0.00 0.00 178.15 177.80 3fga h SER 225 N -0.39 -0.44 -0.54 1.72 0.02 -1.42 0.36 113.55 112.86 3fga h SER 225 Ca -0.01 0.10 0.02 0.00 -0.84 0.00 0.00 61.79 61.05 3fga h SER 225 Cb 0.33 0.23 -0.03 0.00 0.14 0.00 0.00 62.40 63.07 3fga h SER 225 CO 0.02 -0.17 0.34 -0.33 -1.14 0.00 0.00 176.83 175.55 3fga h GLU 226 N -0.13 0.67 -0.01 3.45 5.08 -0.89 0.23 114.58 122.98 3fga h GLU 226 Ca 0.12 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3fga h GLU 226 Cb 0.31 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 3fga h GLU 226 CO -0.29 0.44 0.00 1.15 -1.00 0.00 0.00 179.01 179.31 3fga h THR 227 N 0.69 1.12 -0.56 1.13 2.02 -0.69 -1.38 112.91 115.24 3fga h THR 227 Ca 0.21 -0.36 0.02 0.00 0.77 0.00 0.00 66.41 67.04 3fga h THR 227 Cb -0.03 1.36 -0.03 0.00 -1.74 0.00 0.00 68.15 67.71 3fga h THR 227 CO -0.07 0.10 0.35 0.15 0.37 0.00 0.00 175.52 176.41 3fga h PHE 228 N -0.14 0.66 -0.33 3.16 3.57 0.03 0.18 116.94 124.07 3fga h PHE 228 Ca 0.00 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 3fga h PHE 228 Cb 0.15 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 3fga h PHE 228 CO -0.02 0.39 0.14 -0.91 -2.23 0.00 0.00 178.31 175.67 3fga h ASN 229 N 0.70 0.44 -0.62 0.41 2.35 -0.55 -2.68 115.58 115.63 3fga h ASN 229 Ca 0.22 -0.16 -0.09 0.00 -0.55 0.00 0.00 56.30 55.72 3fga h ASN 229 Cb -0.01 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 3fga h ASN 229 CO -0.08 0.48 0.03 -0.74 -1.65 0.00 0.00 177.43 175.46 3fga h HIS 230 N 0.38 1.17 0.00 1.19 2.76 -0.72 0.12 115.15 120.06 3fga h HIS 230 Ca 0.11 -0.19 -0.06 0.00 -2.20 0.00 0.00 60.37 58.03 3fga h HIS 230 Cb 0.17 -0.31 -0.01 0.00 1.55 0.00 0.00 27.41 28.81 3fga h HIS 230 CO -0.01 1.01 -0.30 0.00 -1.30 0.00 0.00 177.93 177.34 3fga h ALA 231 N 1.02 1.42 -0.01 5.26 0.00 -0.66 -3.17 119.26 123.13 3fga h ALA 231 Ca 0.18 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3fga h ALA 231 Cb 0.53 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3fga h ALA 231 CO 0.03 0.37 -0.33 0.09 0.00 0.00 0.00 179.25 179.41 3fga n ASN 232 N -4.06 1.24 -2.06 0.00 3.02 -1.01 -4.99 115.26 107.40 3fga n ASN 232 Ca -0.02 -1.12 -0.11 0.00 -0.03 0.00 0.00 54.58 53.30 3fga n ASN 232 Cb 0.35 0.57 0.04 0.00 -0.61 0.00 0.00 39.78 40.14 3fga n ASN 232 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3fga n GLY 233 N 1.06 0.17 3.74 7.41 0.00 0.31 -5.01 105.19 112.87 3fga n GLY 233 Ca 0.05 -0.22 -0.36 0.00 0.00 0.00 0.00 46.02 45.50 3fga n GLY 233 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fga s LEU 234 N -4.09 3.88 0.21 0.99 1.43 -0.53 -4.65 118.68 115.93 3fga s LEU 234 Ca 0.19 0.24 0.24 0.00 -1.03 0.00 0.00 54.13 53.77 3fga s LEU 234 Cb -0.08 -1.92 0.31 0.00 0.03 0.00 0.00 46.19 44.52 3fga s LEU 234 CO 0.35 0.36 1.35 0.71 0.23 0.00 0.00 176.35 179.35 3fga h THR 235 N 4.22 0.00 -1.83 5.49 1.35 -1.49 -3.42 112.91 117.23 3fga h THR 235 Ca -0.50 -0.72 0.02 0.00 -0.55 0.00 0.00 66.41 64.66 3fga h THR 235 Cb 1.20 1.40 -0.23 0.00 -1.73 0.00 0.00 68.15 68.79 3fga h THR 235 CO 0.58 0.00 0.24 -0.22 -0.25 0.00 0.00 175.52 175.87 3fga s LEU 236 N -4.91 -0.66 -0.22 3.87 2.96 -1.22 -4.82 118.68 113.67 3fga s LEU 236 Ca 0.05 1.21 -0.13 0.00 -0.22 0.00 0.00 54.13 55.04 3fga s LEU 236 Cb 0.11 2.20 -0.04 0.00 0.50 0.00 0.00 46.19 48.95 3fga s LEU 236 CO 0.72 -0.20 0.27 -0.69 -1.32 0.00 0.00 176.35 175.12 3fga s VAL 237 N 0.59 5.28 -0.17 1.68 1.01 0.25 -2.05 120.40 127.00 3fga s VAL 237 Ca -0.01 0.43 -0.03 0.00 0.00 0.00 0.00 61.98 62.37 3fga s VAL 237 Cb -0.05 -3.61 -0.02 0.00 0.00 0.00 0.00 36.38 32.71 3fga s VAL 237 CO -0.06 0.30 -0.07 -0.55 0.00 0.00 0.00 175.10 174.72 3fga s SER 238 N 1.07 4.38 0.24 3.32 0.15 0.17 -0.45 113.70 122.58 3fga s SER 238 Ca 0.13 -0.28 -0.06 0.00 0.70 0.00 0.00 55.95 56.45 3fga s SER 238 Cb -0.14 -1.71 -0.02 0.00 -1.71 0.00 0.00 66.02 62.44 3fga s SER 238 CO 0.06 0.11 0.32 0.00 1.20 0.00 0.00 173.24 174.93 3fga s ARG 239 N 0.69 1.45 0.00 5.44 1.70 0.24 -2.09 118.95 126.38 3fga s ARG 239 Ca -0.04 -1.51 0.00 0.00 -0.47 0.00 0.00 55.73 53.71 3fga s ARG 239 Cb -0.15 0.37 0.00 0.00 -0.57 0.00 0.00 34.95 34.61 3fga s ARG 239 CO 0.02 -0.55 0.51 0.00 -1.08 0.00 0.00 175.30 174.20 3fga n ALA 240 N -0.37 1.93 0.21 7.88 0.00 -1.09 -0.69 120.51 128.39 3fga n ALA 240 Ca 0.01 -0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.48 3fga n ALA 240 Cb 0.64 -0.04 0.26 0.00 0.00 0.00 0.00 19.45 20.31 3fga n ALA 240 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 3fga n HIS 241 N 0.00 0.63 -4.08 0.00 -0.00 -0.65 -3.76 115.22 107.37 3fga n HIS 241 Ca 0.00 -0.32 -0.27 0.00 -0.00 0.00 0.00 57.72 57.14 3fga n HIS 241 Cb 0.52 0.00 -0.17 0.00 -0.00 0.00 0.00 29.99 30.34 3fga n HIS 241 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.34 175.20 3fga s GLN 242 N -1.37 1.63 0.11 1.57 0.74 -1.26 -5.06 119.66 116.02 3fga s GLN 242 Ca 0.41 -0.32 -0.35 0.00 0.05 0.00 0.00 55.36 55.15 3fga s GLN 242 Cb 0.23 -1.59 -0.14 0.00 1.10 0.00 0.00 33.01 32.61 3fga s GLN 242 CO 0.31 -0.19 1.57 -0.11 -0.55 0.00 0.00 175.29 176.32 3fga n LEU 243 N 4.66 2.84 -4.11 3.68 0.00 -1.26 -4.83 117.00 117.97 3fga n LEU 243 Ca -0.15 1.08 -0.25 0.00 0.00 0.00 0.00 56.01 56.68 3fga n LEU 243 Cb 0.50 -1.37 -0.16 0.00 0.00 0.00 0.00 43.42 42.40 3fga n LEU 243 CO 0.19 -0.41 -0.49 0.68 0.00 0.00 0.00 177.39 177.36 3fga s VAL 244 N 1.25 1.35 0.18 1.96 -7.23 -1.26 -5.05 120.40 111.60 3fga s VAL 244 Ca 0.82 -0.67 0.28 0.00 -1.81 0.00 0.00 61.98 60.60 3fga s VAL 244 Cb -0.74 -1.17 0.30 0.00 0.56 0.00 0.00 36.38 35.32 3fga s VAL 244 CO 0.42 0.39 1.92 0.24 -0.31 0.00 0.00 175.10 177.77 3fga h MET 245 N 6.34 0.00 -0.53 4.82 0.00 -1.92 -1.37 114.93 122.28 3fga h MET 245 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.38 3fga h MET 245 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.78 3fga h MET 245 CO 0.48 0.13 0.00 0.39 0.00 0.00 0.00 176.91 177.91 3fga n GLU 246 N -3.33 2.28 0.00 1.72 -0.58 -1.26 -1.82 120.64 117.65 3fga n GLU 246 Ca -0.00 -1.88 0.00 0.00 -0.42 0.00 0.00 57.16 54.85 3fga n GLU 246 Cb 0.35 -1.43 0.00 0.00 -0.57 0.00 0.00 31.44 29.79 3fga n GLU 246 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3fga n GLY 247 N 1.28 2.20 3.36 0.62 0.00 -0.52 -4.73 105.19 107.41 3fga n GLY 247 Ca 0.17 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.04 3fga n GLY 247 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3fga s TYR 248 N -0.71 -0.38 -0.11 1.61 1.13 -1.26 -0.95 117.35 116.68 3fga s TYR 248 Ca 0.00 0.65 -0.05 0.00 -1.41 0.00 0.00 57.07 56.26 3fga s TYR 248 Cb 0.00 0.22 0.05 0.00 -1.10 0.00 0.00 41.96 41.14 3fga s TYR 248 CO 0.00 -0.47 0.25 1.21 -2.51 0.00 0.00 175.55 174.03 3fga s ASN 249 N -1.22 0.01 0.30 -0.18 2.47 -0.00 -4.93 114.94 111.39 3fga s ASN 249 Ca -0.12 0.55 -0.22 0.00 0.42 0.00 0.00 52.86 53.49 3fga s ASN 249 Cb -0.03 0.52 -0.09 0.00 -1.45 0.00 0.00 41.25 40.19 3fga s ASN 249 CO 0.06 -0.20 0.84 0.26 -3.72 0.00 0.00 177.10 174.35 3fga s TRP 250 N 1.75 3.60 0.33 0.43 0.52 -1.26 -1.19 118.94 123.12 3fga s TRP 250 Ca -0.05 1.56 -0.13 0.00 0.02 0.00 0.00 56.10 57.50 3fga s TRP 250 Cb -0.11 -2.76 0.02 0.00 -1.15 0.00 0.00 33.47 29.47 3fga s TRP 250 CO -0.08 0.21 0.64 0.00 0.02 0.00 0.00 176.95 177.73 3fga n HIS 252 N -0.50 -2.19 -4.01 0.00 8.25 -1.26 -2.20 115.22 113.31 3fga n HIS 252 Ca -0.04 0.89 -0.30 0.00 -0.26 0.00 0.00 57.72 58.01 3fga n HIS 252 Cb 0.61 -4.69 -0.01 0.00 1.12 0.00 0.00 29.99 27.02 3fga n HIS 252 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3fga n ASP 253 N -3.12 -2.57 -2.45 0.41 2.03 -1.26 -1.18 116.55 108.41 3fga n ASP 253 Ca -0.23 -0.93 -0.20 0.00 0.52 0.00 0.00 54.79 53.95 3fga n ASP 253 Cb 0.66 -3.27 -0.01 0.00 -0.72 0.00 0.00 41.12 37.78 3fga n ASP 253 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3fga n ARG 254 N -4.46 -1.98 0.14 -0.67 1.74 -0.94 -4.86 116.66 105.64 3fga n ARG 254 Ca -0.09 0.94 0.10 0.00 -0.77 0.00 0.00 57.85 58.03 3fga n ARG 254 Cb 0.58 -5.61 0.05 0.00 -1.02 0.00 0.00 32.46 26.46 3fga n ARG 254 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 3fga h ASN 255 N -0.09 0.00 -4.30 0.55 2.35 -0.99 -3.46 115.58 109.64 3fga h ASN 255 Ca -0.47 0.00 -0.28 0.00 -0.55 0.00 0.00 56.30 55.00 3fga h ASN 255 Cb 1.34 0.00 -0.25 0.00 0.05 0.00 0.00 38.32 39.46 3fga h ASN 255 CO 0.55 0.10 -0.74 0.68 -1.65 0.00 0.00 177.43 176.37 3fga s VAL 256 N -3.24 0.40 -0.02 2.81 -7.23 -1.14 0.85 120.40 112.83 3fga s VAL 256 Ca 0.02 -0.58 0.05 0.00 -1.81 0.00 0.00 61.98 59.66 3fga s VAL 256 Cb 0.08 -0.41 -0.01 0.00 0.56 0.00 0.00 36.38 36.60 3fga s VAL 256 CO 0.75 -0.13 -0.18 0.54 -0.31 0.00 0.00 175.10 175.76 3fga s VAL 257 N -0.70 1.44 -0.24 1.32 0.11 0.41 -2.17 120.40 120.57 3fga s VAL 257 Ca -0.04 -0.76 -0.12 0.00 -2.93 0.00 0.00 61.98 58.13 3fga s VAL 257 Cb -0.06 -1.21 -0.05 0.00 -1.53 0.00 0.00 36.38 33.54 3fga s VAL 257 CO -0.00 0.41 0.22 -0.89 -3.33 0.00 0.00 175.10 171.51 3fga s THR 258 N -0.29 5.31 -0.08 5.04 2.01 -0.33 -0.59 115.64 126.72 3fga s THR 258 Ca 0.04 0.30 0.03 0.00 0.31 0.00 0.00 61.69 62.37 3fga s THR 258 Cb -0.08 -3.56 -0.02 0.00 0.01 0.00 0.00 72.50 68.85 3fga s THR 258 CO 0.00 0.31 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.46 3fga s ILE 259 N 1.22 2.98 -0.04 1.82 1.01 0.13 -0.82 121.20 127.50 3fga s ILE 259 Ca 0.10 -0.73 -0.01 0.00 0.00 0.00 0.00 60.65 60.01 3fga s ILE 259 Cb -0.14 -2.19 0.03 0.00 0.01 0.00 0.00 42.46 40.17 3fga s ILE 259 CO 0.06 0.57 0.04 0.12 0.00 0.00 0.00 174.94 175.73 3fga s PHE 260 N -0.32 0.21 -0.46 3.97 2.19 -0.12 -4.00 117.98 119.44 3fga s PHE 260 Ca 0.03 0.14 0.13 0.00 0.33 0.00 0.00 56.93 57.55 3fga s PHE 260 Cb -0.13 -0.52 0.37 0.00 -1.31 0.00 0.00 43.02 41.44 3fga s PHE 260 CO 0.02 -0.20 1.29 0.43 1.83 0.00 0.00 175.22 178.59 3fga n SER 261 N 5.06 3.20 -4.13 6.13 7.64 -1.05 -0.63 113.62 129.83 3fga n SER 261 Ca -0.08 -2.51 -0.37 0.00 1.01 0.00 0.00 58.87 56.92 3fga n SER 261 Cb 0.50 -0.36 -0.11 0.00 -1.01 0.00 0.00 64.21 63.23 3fga n SER 261 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3fga s ALA 262 N -1.91 3.21 0.42 -0.43 0.00 -0.93 -4.74 121.76 117.37 3fga s ALA 262 Ca 0.30 -2.59 -0.24 0.00 0.00 0.00 0.00 51.96 49.43 3fga s ALA 262 Cb 0.21 -2.47 -0.08 0.00 0.00 0.00 0.00 23.12 20.78 3fga s ALA 262 CO 0.10 -1.83 1.09 -1.25 0.00 0.00 0.00 175.76 173.87 3fga s PRO 263 N 1.08 4.02 -0.98 0.00 0.04 -1.26 -3.53 135.00 134.38 3fga s PRO 263 Ca 0.09 1.61 -0.13 0.00 0.04 0.00 0.00 61.00 62.61 3fga s PRO 263 Cb -0.23 -2.50 0.02 0.00 0.04 0.00 0.00 34.50 31.83 3fga s PRO 263 CO -0.04 -0.29 0.65 -1.71 0.04 0.00 0.00 177.00 175.65 3fga n ASN 264 N -0.21 -4.79 -4.63 6.66 5.15 0.79 -4.75 115.26 113.48 3fga n ASN 264 Ca 0.06 -1.04 -0.47 0.00 -0.60 0.00 0.00 54.58 52.52 3fga n ASN 264 Cb 0.49 -1.97 -0.04 0.00 -0.53 0.00 0.00 39.78 37.74 3fga n ASN 264 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3fga n TYR 265 N -3.53 1.84 -1.19 1.20 -0.00 -1.23 -0.41 117.16 113.84 3fga n TYR 265 Ca -0.22 0.51 -0.09 0.00 -0.00 0.00 0.00 57.90 58.10 3fga n TYR 265 Cb 0.63 -2.40 -0.04 0.00 -0.00 0.00 0.00 39.34 37.53 3fga n TYR 265 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 3fga n TYR 267 N -1.95 0.00 -0.01 0.00 4.02 0.45 -4.82 117.16 114.84 3fga n TYR 267 Ca -0.09 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.77 3fga n TYR 267 Cb 0.51 -2.47 -0.01 0.00 -0.02 0.00 0.00 39.34 37.35 3fga n TYR 267 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 3fga n ARG 268 N -2.38 0.06 0.17 -0.72 5.12 -0.00 -4.88 116.66 114.03 3fga n ARG 268 Ca -0.13 0.02 0.13 0.00 -1.93 0.00 0.00 57.85 55.94 3fga n ARG 268 Cb 0.47 -0.65 0.62 0.00 -1.16 0.00 0.00 32.46 31.73 3fga n ARG 268 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3fga n GLY 270 N -0.74 0.29 3.77 0.00 0.00 -1.26 -4.83 105.19 102.42 3fga n GLY 270 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3fga n GLY 270 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fga s ASN 271 N -2.24 5.19 0.64 1.61 4.22 -1.26 -4.71 114.94 118.39 3fga s ASN 271 Ca 0.00 2.11 -0.11 0.00 -2.14 0.00 0.00 52.86 52.72 3fga s ASN 271 Cb 0.00 -2.57 -0.03 0.00 1.28 0.00 0.00 41.25 39.94 3fga s ASN 271 CO 0.00 -1.58 1.04 -1.10 -2.04 0.00 0.00 177.10 173.42 3fga s GLN 272 N -3.80 3.41 0.36 3.55 -0.21 -0.75 -0.15 119.66 122.07 3fga s GLN 272 Ca 0.70 0.81 0.08 0.00 0.02 0.00 0.00 55.36 56.97 3fga s GLN 272 Cb -0.23 -2.05 -0.04 0.00 1.00 0.00 0.00 33.01 31.69 3fga s GLN 272 CO 0.37 -0.72 0.18 0.00 -2.12 0.00 0.00 175.29 173.00 3fga s ALA 273 N -3.14 3.59 0.13 6.09 0.00 -0.53 -2.68 121.76 125.21 3fga s ALA 273 Ca 0.56 -1.89 -0.14 0.00 0.00 0.00 0.00 51.96 50.50 3fga s ALA 273 Cb -0.12 -0.70 0.02 0.00 0.00 0.00 0.00 23.12 22.32 3fga s ALA 273 CO 0.54 -0.04 0.35 0.00 0.00 0.00 0.00 175.76 176.62 3fga s ALA 274 N -2.46 -0.65 0.07 0.00 0.00 0.19 -1.08 121.76 117.83 3fga s ALA 274 Ca 0.40 -0.31 -0.02 0.00 0.00 0.00 0.00 51.96 52.03 3fga s ALA 274 Cb -0.01 0.69 -0.04 0.00 0.00 0.00 0.00 23.12 23.75 3fga s ALA 274 CO 0.23 -0.63 0.01 0.96 0.00 0.00 0.00 175.76 176.33 3fga s ILE 275 N -3.85 0.19 -0.11 0.00 -4.36 -0.76 -3.94 121.20 108.38 3fga s ILE 275 Ca 0.06 -1.79 0.03 0.00 -0.26 0.00 0.00 60.65 58.69 3fga s ILE 275 Cb 0.02 -1.64 0.01 0.00 1.25 0.00 0.00 42.46 42.11 3fga s ILE 275 CO -0.09 -0.84 -0.19 -0.32 0.24 0.00 0.00 174.94 173.74 3fga s MET 276 N -3.95 2.56 -0.26 0.37 -2.45 -0.66 -0.82 119.30 114.09 3fga s MET 276 Ca 0.11 -0.70 -0.11 0.00 -1.25 0.00 0.00 55.69 53.75 3fga s MET 276 Cb 0.08 -2.05 -0.05 0.00 1.25 0.00 0.00 34.83 34.06 3fga s MET 276 CO -0.07 0.04 0.18 -1.21 1.05 0.00 0.00 175.02 175.00 3fga s GLU 277 N 0.70 4.00 -0.35 4.11 2.02 0.12 -0.38 118.70 128.92 3fga s GLU 277 Ca -0.12 -0.30 -0.15 0.00 0.02 0.00 0.00 54.97 54.43 3fga s GLU 277 Cb -0.16 -3.61 -0.01 0.00 0.10 0.00 0.00 34.13 30.45 3fga s GLU 277 CO 0.02 -0.07 0.34 -0.51 0.02 0.00 0.00 175.26 175.06 3fga s LEU 278 N 1.45 4.51 0.00 1.80 1.43 0.40 -2.41 118.68 125.85 3fga s LEU 278 Ca 0.07 -0.33 -0.03 0.00 -1.03 0.00 0.00 54.13 52.82 3fga s LEU 278 Cb -0.15 -2.30 0.06 0.00 0.03 0.00 0.00 46.19 43.83 3fga s LEU 278 CO 0.08 -0.34 0.34 -0.90 0.23 0.00 0.00 176.35 175.76 3fga n ASP 279 N 5.34 0.13 -0.13 2.29 5.68 -0.84 -1.63 116.55 127.38 3fga n ASP 279 Ca -0.10 -1.19 0.19 0.00 -0.50 0.00 0.00 54.79 53.19 3fga n ASP 279 Cb 0.49 -0.25 0.58 0.00 -1.14 0.00 0.00 41.12 40.80 3fga n ASP 279 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3fga h ASP 280 N -0.38 0.24 -0.37 -1.12 5.19 -1.91 -0.43 116.42 117.64 3fga h ASP 280 Ca -0.11 0.02 -0.07 0.00 -0.62 0.00 0.00 57.03 56.25 3fga h ASP 280 Cb 0.33 -0.03 -0.04 0.00 0.18 0.00 0.00 39.33 39.77 3fga h ASP 280 CO 0.09 0.12 0.03 0.35 -3.12 0.00 0.00 179.24 176.71 3fga n THR 281 N -4.43 2.47 -1.61 0.35 -2.24 -1.26 -4.76 114.28 102.80 3fga n THR 281 Ca 0.14 -1.97 -0.17 0.00 -2.27 0.00 0.00 64.05 59.78 3fga n THR 281 Cb 0.63 -0.29 -0.06 0.00 -2.10 0.00 0.00 70.33 68.51 3fga n THR 281 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3fga n LEU 282 N -0.51 -1.30 -4.78 3.22 7.94 -0.17 -4.99 117.00 116.42 3fga n LEU 282 Ca 0.27 0.36 -0.37 0.00 -1.11 0.00 0.00 56.01 55.15 3fga n LEU 282 Cb 1.01 -2.41 -0.04 0.00 0.53 0.00 0.00 43.42 42.51 3fga n LEU 282 CO 0.21 -0.78 0.73 -0.54 -1.11 0.00 0.00 177.39 175.90 3fga s LYS 283 N -3.62 4.31 0.35 1.96 -0.14 -1.26 -4.72 119.74 116.61 3fga s LYS 283 Ca 0.00 1.53 0.07 0.00 -1.36 0.00 0.00 55.97 56.21 3fga s LYS 283 Cb 0.00 -2.68 -0.02 0.00 -1.68 0.00 0.00 37.83 33.45 3fga s LYS 283 CO 0.00 -0.02 0.38 1.52 -0.76 0.00 0.00 175.35 176.48 3fga s TYR 284 N -1.58 2.93 -0.27 3.18 1.13 -1.26 -1.99 117.35 119.50 3fga s TYR 284 Ca 0.54 -0.31 -0.26 0.00 -1.41 0.00 0.00 57.07 55.64 3fga s TYR 284 Cb -0.23 -1.96 0.12 0.00 -1.10 0.00 0.00 41.96 38.79 3fga s TYR 284 CO 0.29 0.03 1.00 -1.54 -2.51 0.00 0.00 175.55 172.81 3fga s SER 285 N -4.10 -0.47 0.06 -0.18 1.04 -1.01 -4.97 113.70 104.06 3fga s SER 285 Ca 0.44 0.88 0.04 0.00 0.48 0.00 0.00 55.95 57.79 3fga s SER 285 Cb -0.07 0.88 -0.04 0.00 0.10 0.00 0.00 66.02 66.89 3fga s SER 285 CO 0.29 -0.18 -0.02 -0.36 0.98 0.00 0.00 173.24 173.94 3fga s PHE 286 N 0.10 2.96 -0.16 5.02 0.40 -1.26 0.12 117.98 125.16 3fga s PHE 286 Ca 0.02 -0.02 0.00 0.00 -0.60 0.00 0.00 56.93 56.34 3fga s PHE 286 Cb -0.05 -1.57 0.03 0.00 0.51 0.00 0.00 43.02 41.95 3fga s PHE 286 CO -0.05 0.45 -0.11 -0.51 0.70 0.00 0.00 175.22 175.70 3fga s LEU 287 N -1.97 1.80 0.25 -0.37 1.43 -0.00 -4.98 118.68 114.85 3fga s LEU 287 Ca 0.22 -0.61 -0.04 0.00 -1.03 0.00 0.00 54.13 52.68 3fga s LEU 287 Cb -0.11 -1.13 -0.05 0.00 0.03 0.00 0.00 46.19 44.92 3fga s LEU 287 CO 0.14 -0.10 0.49 -1.10 0.23 0.00 0.00 176.35 176.01 3fga s GLN 288 N 1.50 3.60 -0.05 1.70 -0.21 -1.26 -1.82 119.66 123.12 3fga s GLN 288 Ca 0.03 -0.10 -0.29 0.00 0.02 0.00 0.00 55.36 55.03 3fga s GLN 288 Cb -0.14 -2.72 0.06 0.00 1.00 0.00 0.00 33.01 31.21 3fga s GLN 288 CO -0.09 0.29 0.63 -0.59 -2.12 0.00 0.00 175.29 173.40 3fga s PHE 289 N -1.98 -0.59 0.75 0.91 -0.12 -0.24 -4.96 117.98 111.75 3fga s PHE 289 Ca 0.42 1.02 -0.06 0.00 -0.05 0.00 0.00 56.93 58.26 3fga s PHE 289 Cb -0.11 0.36 0.11 0.00 -0.63 0.00 0.00 43.02 42.75 3fga s PHE 289 CO 0.29 -0.57 1.05 -0.51 -0.05 0.00 0.00 175.22 175.43 3fga s ASP 290 N -1.18 4.35 0.53 1.98 1.01 -1.26 -1.45 116.67 120.64 3fga s ASP 290 Ca -0.11 0.11 -0.21 0.00 0.71 0.00 0.00 52.55 53.04 3fga s ASP 290 Cb -0.01 -0.56 -0.05 0.00 1.01 0.00 0.00 42.92 43.30 3fga s ASP 290 CO 0.09 -1.88 1.25 -2.16 0.21 0.00 0.00 175.17 172.68 3fga s PRO 291 N -5.30 3.29 0.51 8.23 0.04 -1.26 -4.91 135.00 135.60 3fga s PRO 291 Ca 0.65 1.97 -0.21 0.00 0.04 0.00 0.00 61.00 63.45 3fga s PRO 291 Cb -0.07 -2.21 -0.06 0.00 0.04 0.00 0.00 34.50 32.19 3fga s PRO 291 CO 0.46 -0.99 1.18 0.00 0.04 0.00 0.00 177.00 177.68 3fga s ALA 292 N -1.46 2.81 -0.20 8.56 0.00 -1.26 -4.90 121.76 125.31 3fga s ALA 292 Ca 0.71 0.95 -0.37 0.00 0.00 0.00 0.00 51.96 53.25 3fga s ALA 292 Cb -0.34 -3.40 -0.13 0.00 0.00 0.00 0.00 23.12 19.25 3fga s ALA 292 CO 0.39 -0.83 1.87 -2.30 0.00 0.00 0.00 175.76 174.89 3fga n PRO 293 N -0.95 1.65 -3.36 0.00 -0.02 -1.26 -4.91 135.00 126.16 3fga n PRO 293 Ca 0.10 0.59 -0.41 0.00 -2.02 0.00 0.00 63.50 61.76 3fga n PRO 293 Cb 0.49 -2.42 -0.09 0.00 -0.02 0.00 0.00 33.50 31.46 3fga n PRO 293 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 3fga s ARG 294 N 4.15 3.51 0.00 -0.52 6.06 -1.26 -5.15 118.95 125.74 3fga s ARG 294 Ca 0.97 -0.41 0.00 0.00 -2.50 0.00 0.00 55.73 53.79 3fga s ARG 294 Cb -0.86 -3.83 0.00 0.00 0.06 0.00 0.00 34.95 30.32 3fga s ARG 294 CO 0.57 -0.60 0.53 2.89 -2.50 0.00 0.00 175.30 176.19 3fga n ARG 295 N 5.49 0.00 -0.11 5.12 1.85 -1.26 -5.31 116.66 122.44 3fga n ARG 295 Ca -0.08 0.21 -0.04 0.00 -1.00 0.00 0.00 57.85 56.94 3fga n ARG 295 Cb 0.49 -1.08 0.04 0.00 -1.05 0.00 0.00 32.46 30.86 3fga n ARG 295 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 3fga n THR 301 N -1.13 0.00 -2.99 8.89 -2.24 -1.26 -5.35 114.28 110.21 3fga n THR 301 Ca 0.00 -0.05 -0.40 0.00 -2.27 0.00 0.00 64.05 61.33 3fga n THR 301 Cb 0.00 -0.75 -0.04 0.00 -2.10 0.00 0.00 70.33 67.43 3fga n THR 301 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3fga s ARG 302 N -3.33 4.46 1.10 -0.78 3.52 -1.26 -5.05 118.95 117.60 3fga s ARG 302 Ca 0.10 0.97 -0.12 0.00 -0.13 0.00 0.00 55.73 56.55 3fga s ARG 302 Cb -0.01 -3.45 0.24 0.00 -1.56 0.00 0.00 34.95 30.17 3fga s ARG 302 CO 0.08 0.04 1.00 2.89 -0.81 0.00 0.00 175.30 178.50 3fga n ARG 303 N 3.83 -1.86 -2.16 5.12 -4.01 -1.26 -4.95 116.66 111.37 3fga n ARG 303 Ca 0.00 -0.50 -0.42 0.00 -1.04 0.00 0.00 57.85 55.89 3fga n ARG 303 Cb 0.51 -2.20 -0.03 0.00 -3.04 0.00 0.00 32.46 27.70 3fga n ARG 303 CO 0.00 0.00 0.00 0.95 -3.04 0.00 0.00 177.63 175.54 3fga s THR 304 N -2.46 3.22 0.36 8.89 -4.23 -1.26 -4.98 115.64 115.17 3fga s THR 304 Ca 0.67 0.90 -0.26 0.00 -1.18 0.00 0.00 61.69 61.83 3fga s THR 304 Cb -0.24 -3.58 -0.12 0.00 1.34 0.00 0.00 72.50 69.89 3fga s THR 304 CO 0.63 0.09 0.97 -2.65 -0.54 0.00 0.00 174.62 173.12 3fga n PRO 305 N 3.60 1.30 0.00 3.99 -0.02 -1.26 -4.86 135.00 137.74 3fga n PRO 305 Ca 0.10 0.46 0.10 0.00 -2.02 0.00 0.00 63.50 62.14 3fga n PRO 305 Cb 0.42 -1.90 0.45 0.00 -0.02 0.00 0.00 33.50 32.45 3fga n PRO 305 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3fga n ASP 306 N 0.93 0.00 -0.85 2.55 3.85 -1.26 -2.04 116.55 119.72 3fga n ASP 306 Ca 0.09 0.28 0.07 0.00 -0.71 0.00 0.00 54.79 54.53 3fga n ASP 306 Cb 0.36 -0.41 0.20 0.00 -1.35 0.00 0.00 41.12 39.92 3fga n ASP 306 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3fga n TYR 307 N -1.41 0.64 -3.50 2.11 0.18 -1.26 -4.90 117.16 109.03 3fga n TYR 307 Ca 0.07 -0.31 -0.35 0.00 1.88 0.00 0.00 57.90 59.19 3fga n TYR 307 Cb 0.20 -0.02 -0.06 0.00 -0.38 0.00 0.00 39.34 39.08 3fga n TYR 307 CO 0.00 0.00 0.00 -0.06 -2.08 0.00 0.00 176.86 174.72 3fga s PHE 308 N -1.45 3.59 0.00 -3.48 0.40 -0.87 -5.29 117.98 110.88 3fga s PHE 308 Ca 0.30 0.88 0.00 0.00 -0.60 0.00 0.00 56.93 57.51 3fga s PHE 308 Cb 0.16 -2.23 0.00 0.00 0.51 0.00 0.00 43.02 41.46 3fga s PHE 308 CO 0.19 0.48 0.00 -0.11 0.70 0.00 0.00 175.22 176.49