#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fiu s GLN 2 N 0.00 4.66 0.94 2.12 -0.21 -1.26 -5.02 119.66 120.89 1fiu s GLN 2 Ca 0.00 1.41 -0.10 0.00 0.02 0.00 0.00 55.36 56.69 1fiu s GLN 2 Cb 0.00 -3.39 0.16 0.00 1.00 0.00 0.00 33.01 30.78 1fiu s GLN 2 CO 0.00 0.19 1.13 -1.25 -2.12 0.00 0.00 175.29 173.23 1fiu s PRO 3 N 0.12 0.83 0.40 2.91 0.04 -1.26 -4.75 135.00 133.29 1fiu s PRO 3 Ca 0.47 1.42 0.09 0.00 0.04 0.00 0.00 61.00 63.01 1fiu s PRO 3 Cb -0.23 -1.72 0.82 0.00 0.04 0.00 0.00 34.50 33.42 1fiu s PRO 3 CO 0.29 -2.72 1.97 -0.07 0.04 0.00 0.00 177.00 176.52 1fiu h LEU 4 N -1.93 0.32 -1.18 -3.56 3.38 -1.99 -1.82 115.31 108.53 1fiu h LEU 4 Ca -0.46 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.40 1fiu h LEU 4 Cb 1.27 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 1fiu h LEU 4 CO 0.44 0.36 -0.35 -0.26 0.09 0.00 0.00 178.44 178.72 1fiu h PHE 5 N 0.34 0.00 -0.18 1.13 0.05 -1.99 0.72 116.94 117.01 1fiu h PHE 5 Ca 0.08 0.00 -0.19 0.00 3.82 0.00 0.00 57.97 61.68 1fiu h PHE 5 Cb 0.21 0.00 0.01 0.00 2.00 0.00 0.00 35.95 38.16 1fiu h PHE 5 CO 0.00 0.35 -0.62 1.15 -0.18 0.00 0.00 178.31 179.02 1fiu h THR 6 N 0.00 1.30 -0.66 -1.55 2.02 -1.70 -1.41 112.91 110.90 1fiu h THR 6 Ca -0.00 -1.84 -0.03 0.00 0.77 0.00 0.00 66.41 65.31 1fiu h THR 6 Cb 0.75 1.93 -0.03 0.00 -1.74 0.00 0.00 68.15 69.06 1fiu h THR 6 CO 0.05 0.58 0.31 1.56 0.37 0.00 0.00 175.52 178.39 1fiu h GLN 7 N 0.45 0.96 -0.57 6.66 4.20 -0.95 -1.39 115.11 124.47 1fiu h GLN 7 Ca -0.03 -0.15 -0.07 0.00 0.06 0.00 0.00 58.65 58.47 1fiu h GLN 7 Cb 1.25 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.83 1fiu h GLN 7 CO 0.13 0.77 0.07 0.93 -0.67 0.00 0.00 178.83 180.06 1fiu h GLU 8 N 0.92 0.94 -0.68 1.46 4.39 -0.79 -1.22 114.58 119.59 1fiu h GLU 8 Ca 0.23 -0.24 -0.06 0.00 0.34 0.00 0.00 59.36 59.62 1fiu h GLU 8 Cb 0.13 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.64 1fiu h GLU 8 CO -0.03 0.88 0.18 -0.09 -1.16 0.00 0.00 179.01 178.80 1fiu h ARG 9 N 0.88 1.07 -0.35 2.33 2.43 -0.83 -1.05 114.38 118.85 1fiu h ARG 9 Ca 0.18 -0.24 -0.13 0.00 -0.81 0.00 0.00 59.98 58.98 1fiu h ARG 9 Cb 0.42 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.81 1fiu h ARG 9 CO 0.01 0.93 -0.30 0.00 -1.51 0.00 0.00 179.97 179.10 1fiu h ARG 10 N 1.02 0.75 -0.77 0.20 3.08 -0.88 -1.96 114.38 115.82 1fiu h ARG 10 Ca 0.22 -0.34 -0.04 0.00 0.07 0.00 0.00 59.98 59.89 1fiu h ARG 10 Cb 0.33 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.33 1fiu h ARG 10 CO -0.00 0.95 0.31 0.82 -1.07 0.00 0.00 179.97 180.98 1fiu h ILE 11 N 0.63 1.26 -0.08 2.04 2.04 -0.89 0.07 117.51 122.58 1fiu h ILE 11 Ca 0.07 -0.81 0.01 0.00 1.00 0.00 0.00 64.86 65.13 1fiu h ILE 11 Cb 0.82 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 1fiu h ILE 11 CO 0.07 0.33 0.03 0.15 0.00 0.00 0.00 178.15 178.73 1fiu h PHE 12 N 1.12 0.05 -0.75 1.37 3.57 -0.89 -1.73 116.94 119.69 1fiu h PHE 12 Ca 0.26 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.72 1fiu h PHE 12 Cb 0.21 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.91 1fiu h PHE 12 CO 0.02 0.03 0.28 0.45 -2.23 0.00 0.00 178.31 176.86 1fiu h HIS 13 N 0.07 1.15 -0.66 0.41 3.86 -0.98 -2.76 115.15 116.24 1fiu h HIS 13 Ca 0.03 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.14 1fiu h HIS 13 Cb 0.01 -0.34 -0.03 0.00 1.06 0.00 0.00 27.41 28.11 1fiu h HIS 13 CO -0.09 0.89 0.39 -0.22 0.86 0.00 0.00 177.93 179.75 1fiu h LYS 14 N 1.09 0.89 -0.45 2.45 3.64 -0.69 -0.67 116.57 122.83 1fiu h LYS 14 Ca 0.25 -0.08 -0.08 0.00 -1.27 0.00 0.00 60.65 59.46 1fiu h LYS 14 Cb 0.24 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1fiu h LYS 14 CO -0.02 0.63 -0.06 0.87 -2.27 0.00 0.00 179.45 178.60 1fiu h LYS 15 N 0.91 0.77 -0.41 1.90 1.57 -1.04 0.30 116.57 120.56 1fiu h LYS 15 Ca 0.24 -0.23 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 1fiu h LYS 15 Cb -0.02 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.20 1fiu h LYS 15 CO -0.04 0.82 -0.15 -0.07 -0.57 0.00 0.00 179.45 179.44 1fiu h LEU 16 N 0.71 0.77 0.02 2.94 3.38 -1.10 -1.79 115.31 120.24 1fiu h LEU 16 Ca 0.13 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1fiu h LEU 16 Cb 0.53 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1fiu h LEU 16 CO 0.03 0.93 -0.01 -0.07 0.09 0.00 0.00 178.44 179.41 1fiu h LEU 17 N 0.69 -0.02 -1.79 1.67 3.38 -0.69 -0.68 115.31 117.86 1fiu h LEU 17 Ca 0.11 -0.60 0.03 0.00 0.09 0.00 0.00 57.88 57.50 1fiu h LEU 17 Cb 0.64 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 1fiu h LEU 17 CO 0.05 0.60 0.19 0.44 0.09 0.00 0.00 178.44 179.81 1fiu h ASP 18 N -0.67 0.23 -0.08 -0.43 3.32 -0.41 -0.01 116.42 118.38 1fiu h ASP 18 Ca -0.00 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1fiu h ASP 18 Cb 0.62 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.12 1fiu h ASP 18 CO 0.00 0.16 0.00 0.61 -1.72 0.00 0.00 179.24 178.30 1fiu n GLY 19 N -1.52 -0.14 2.46 2.75 0.00 -0.68 -4.90 105.19 103.17 1fiu n GLY 19 Ca 0.02 -0.35 -0.18 0.00 0.00 0.00 0.00 46.02 45.51 1fiu n GLY 19 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fiu n ASN 20 N -0.04 -5.17 -0.04 1.61 5.03 -0.02 -4.87 115.26 111.76 1fiu n ASN 20 Ca 0.17 0.30 -0.13 0.00 0.87 0.00 0.00 54.58 55.79 1fiu n ASN 20 Cb 0.27 -4.24 -0.08 0.00 -1.02 0.00 0.00 39.78 34.70 1fiu n ASN 20 CO 0.00 0.00 0.00 0.40 -1.83 0.00 0.00 177.26 175.83 1fiu h ILE 21 N 0.00 1.37 -3.63 2.41 1.08 -1.37 -3.39 117.51 113.99 1fiu h ILE 21 Ca -0.38 -1.37 -0.68 0.00 -0.39 0.00 0.00 64.86 62.04 1fiu h ILE 21 Cb 1.21 2.03 -0.24 0.00 -3.07 0.00 0.00 36.82 36.74 1fiu h ILE 21 CO 0.53 0.39 -0.58 -0.22 -0.69 0.00 0.00 178.15 177.58 1fiu s LEU 22 N -9.04 4.11 0.00 1.44 2.96 -0.81 -4.79 118.68 112.55 1fiu s LEU 22 Ca -0.14 -0.69 -0.08 0.00 -0.22 0.00 0.00 54.13 53.00 1fiu s LEU 22 Cb 0.04 -1.95 0.03 0.00 0.50 0.00 0.00 46.19 44.81 1fiu s LEU 22 CO 0.74 -0.23 0.41 0.00 -1.32 0.00 0.00 176.35 175.96 1fiu n ALA 23 N 4.93 -0.93 -2.71 5.97 0.00 -1.26 -4.44 120.51 122.07 1fiu n ALA 23 Ca -0.14 -0.64 -0.28 0.00 0.00 0.00 0.00 53.44 52.38 1fiu n ALA 23 Cb 0.48 0.51 -0.16 0.00 0.00 0.00 0.00 19.45 20.28 1fiu n ALA 23 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1fiu s THR 24 N -2.53 1.65 0.84 0.00 2.01 -0.98 -0.70 115.64 115.93 1fiu s THR 24 Ca 0.08 -0.86 -0.06 0.00 0.31 0.00 0.00 61.69 61.16 1fiu s THR 24 Cb -0.02 -1.40 0.18 0.00 0.01 0.00 0.00 72.50 71.26 1fiu s THR 24 CO 0.06 0.47 1.15 0.54 -0.69 0.00 0.00 174.62 176.15 1fiu s ASN 25 N -0.17 3.68 0.00 3.53 2.20 -0.61 -0.47 114.94 123.09 1fiu s ASN 25 Ca -0.00 -0.26 0.11 0.00 -0.94 0.00 0.00 52.86 51.77 1fiu s ASN 25 Cb -0.11 0.11 0.63 0.00 -2.00 0.00 0.00 41.25 39.88 1fiu s ASN 25 CO 0.02 -2.33 1.14 -0.46 -2.94 0.00 0.00 177.10 172.52 1fiu n ASN 26 N -3.25 0.00 -0.45 3.54 0.23 -1.26 -1.69 115.26 112.37 1fiu n ASN 26 Ca 0.17 -0.95 0.04 0.00 -0.53 0.00 0.00 54.58 53.31 1fiu n ASN 26 Cb 0.60 0.00 0.11 0.00 -2.08 0.00 0.00 39.78 38.41 1fiu n ASN 26 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1fiu n ARG 27 N -0.76 2.80 -0.86 -3.83 1.74 -1.26 -4.99 116.66 109.51 1fiu n ARG 27 Ca 0.08 -1.86 0.00 0.00 -0.77 0.00 0.00 57.85 55.30 1fiu n ARG 27 Cb 0.04 -1.19 0.00 0.00 -1.02 0.00 0.00 32.46 30.29 1fiu n ARG 27 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fiu n GLY 28 N 0.23 0.72 3.67 -0.13 0.00 -0.68 -5.03 105.19 103.96 1fiu n GLY 28 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 1fiu n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fiu s VAL 29 N -2.69 5.00 0.31 1.61 1.01 -1.26 -4.81 120.40 119.58 1fiu s VAL 29 Ca 0.00 1.29 -0.27 0.00 0.00 0.00 0.00 61.98 62.99 1fiu s VAL 29 Cb 0.00 -3.99 -0.09 0.00 0.00 0.00 0.00 36.38 32.30 1fiu s VAL 29 CO 0.00 0.11 1.03 -0.69 0.00 0.00 0.00 175.10 175.55 1fiu s VAL 30 N 1.81 3.80 -1.01 2.92 1.01 -1.26 -1.57 120.40 126.10 1fiu s VAL 30 Ca 0.31 1.62 0.03 0.00 0.00 0.00 0.00 61.98 63.94 1fiu s VAL 30 Cb -0.16 -3.96 0.02 0.00 0.00 0.00 0.00 36.38 32.29 1fiu s VAL 30 CO 0.11 0.24 1.08 -1.54 0.00 0.00 0.00 175.10 174.99 1fiu n SER 31 N 0.76 0.00 -0.67 3.32 3.41 0.12 -1.09 113.62 119.47 1fiu n SER 31 Ca 0.01 0.49 0.06 0.00 -0.26 0.00 0.00 58.87 59.18 1fiu n SER 31 Cb 0.48 -0.50 0.15 0.00 -0.26 0.00 0.00 64.21 64.08 1fiu n SER 31 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1fiu n ASN 32 N -1.50 2.83 -4.93 4.04 6.94 -1.26 -4.98 115.26 116.41 1fiu n ASN 32 Ca 0.01 -1.90 -0.25 0.00 -0.02 0.00 0.00 54.58 52.41 1fiu n ASN 32 Cb 0.03 -0.21 0.00 0.00 -2.36 0.00 0.00 39.78 37.24 1fiu n ASN 32 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1fiu s ALA 33 N -1.01 3.58 -0.43 -2.53 0.00 -0.25 -4.40 121.76 116.72 1fiu s ALA 33 Ca 0.24 -0.80 -0.08 0.00 0.00 0.00 0.00 51.96 51.32 1fiu s ALA 33 Cb 0.13 -2.32 0.09 0.00 0.00 0.00 0.00 23.12 21.02 1fiu s ALA 33 CO 0.17 -0.29 0.26 0.34 0.00 0.00 0.00 175.76 176.24 1fiu s ASP 34 N -4.13 5.54 0.29 0.00 -1.08 -1.26 -4.94 116.67 111.10 1fiu s ASP 34 Ca 0.46 -1.71 0.17 0.00 -0.52 0.00 0.00 52.55 50.95 1fiu s ASP 34 Cb -0.10 -1.95 0.94 0.00 -1.46 0.00 0.00 42.92 40.35 1fiu s ASP 34 CO 0.40 -0.57 1.49 0.61 0.52 0.00 0.00 175.17 177.62 1fiu n GLY 35 N 4.84 -0.75 0.18 2.66 0.00 -1.26 -1.59 105.19 109.26 1fiu n GLY 35 Ca -0.08 0.16 0.15 0.00 0.00 0.00 0.00 46.02 46.25 1fiu n GLY 35 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1fiu n SER 36 N -2.12 0.61 -4.00 1.61 3.41 -1.26 -4.73 113.62 107.14 1fiu n SER 36 Ca -0.01 -0.96 -0.30 0.00 -0.26 0.00 0.00 58.87 57.34 1fiu n SER 36 Cb 0.12 -0.03 -0.16 0.00 -0.26 0.00 0.00 64.21 63.88 1fiu n SER 36 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1fiu s ASN 37 N -2.20 2.90 0.18 4.04 3.84 -0.62 -5.02 114.94 118.06 1fiu s ASN 37 Ca 0.37 -0.62 -0.15 0.00 0.21 0.00 0.00 52.86 52.67 1fiu s ASN 37 Cb 0.21 -1.17 0.15 0.00 -0.55 0.00 0.00 41.25 39.89 1fiu s ASN 37 CO 0.40 -0.09 1.68 0.74 -2.79 0.00 0.00 177.10 177.04 1fiu h THR 38 N 6.19 0.61 -0.49 -5.21 2.02 -1.85 -0.03 112.91 114.14 1fiu h THR 38 Ca -0.34 -0.02 -0.12 0.00 0.77 0.00 0.00 66.41 66.70 1fiu h THR 38 Cb 1.12 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 1fiu h THR 38 CO 0.50 0.01 -0.17 0.03 0.37 0.00 0.00 175.52 176.26 1fiu h ARG 39 N 0.07 0.98 -0.14 6.66 3.08 -1.95 -0.97 114.38 122.10 1fiu h ARG 39 Ca 0.23 -0.40 -0.00 0.00 0.07 0.00 0.00 59.98 59.87 1fiu h ARG 39 Cb 0.34 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 1fiu h ARG 39 CO -0.41 1.07 0.09 1.03 -1.07 0.00 0.00 179.97 180.68 1fiu h SER 40 N 0.84 0.17 -0.19 7.04 0.87 -1.73 0.76 113.55 121.32 1fiu h SER 40 Ca 0.12 -0.04 0.05 0.00 -1.23 0.00 0.00 61.79 60.69 1fiu h SER 40 Cb 0.74 -0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 62.61 1fiu h SER 40 CO 0.06 0.16 -0.16 0.15 -0.53 0.00 0.00 176.83 176.51 1fiu h PHE 41 N 0.16 -0.41 -0.31 2.24 3.57 -0.91 -0.73 116.94 120.56 1fiu h PHE 41 Ca 0.05 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.43 1fiu h PHE 41 Cb 0.02 0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 1fiu h PHE 41 CO -0.06 -0.23 -0.39 -0.91 -2.23 0.00 0.00 178.31 174.49 1fiu h ASN 42 N -0.17 0.78 -0.11 0.41 2.35 -1.02 -2.24 115.58 115.57 1fiu h ASN 42 Ca 0.11 -0.35 -0.02 0.00 -0.55 0.00 0.00 56.30 55.50 1fiu h ASN 42 Cb 0.34 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.49 1fiu h ASN 42 CO -0.29 1.08 0.01 0.40 -1.65 0.00 0.00 177.43 176.98 1fiu h ILE 43 N 0.60 1.24 -0.93 2.81 2.04 -0.68 -1.41 117.51 121.17 1fiu h ILE 43 Ca 0.05 -0.75 0.01 0.00 1.00 0.00 0.00 64.86 65.17 1fiu h ILE 43 Cb 0.94 1.52 -0.05 0.00 -0.74 0.00 0.00 36.82 38.49 1fiu h ILE 43 CO 0.09 0.22 0.62 0.00 0.00 0.00 0.00 178.15 179.07 1fiu h ALA 44 N 0.77 1.34 -0.35 1.87 0.00 -1.14 -0.85 119.26 120.89 1fiu h ALA 44 Ca 0.03 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1fiu h ALA 44 Cb 0.33 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1fiu h ALA 44 CO 0.00 0.61 0.06 -0.22 0.00 0.00 0.00 179.25 179.70 1fiu h LYS 45 N 1.26 0.59 -0.63 0.00 1.63 -1.32 -1.07 116.57 117.03 1fiu h LYS 45 Ca 0.34 -0.16 -0.00 0.00 -0.85 0.00 0.00 60.65 59.98 1fiu h LYS 45 Cb -0.13 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 31.40 1fiu h LYS 45 CO -0.08 0.66 0.38 0.78 -3.45 0.00 0.00 179.45 177.75 1fiu h GLY 46 N 0.43 0.90 0.91 5.01 0.00 -0.76 -0.84 103.07 108.73 1fiu h GLY 46 Ca 0.11 -0.37 -0.02 0.00 0.00 0.00 0.00 47.33 47.05 1fiu h GLY 46 CO 0.01 0.36 0.11 -2.22 0.00 0.00 0.00 176.54 174.80 1fiu h ILE 47 N 0.85 1.19 -0.61 2.60 2.04 -1.01 -1.52 117.51 121.04 1fiu h ILE 47 Ca 0.22 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 1fiu h ILE 47 Cb -0.03 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 1fiu h ILE 47 CO -0.04 0.20 0.35 0.00 0.00 0.00 0.00 178.15 178.66 1fiu h ALA 48 N 0.95 1.48 -0.45 1.87 0.00 -0.99 -0.75 119.26 121.37 1fiu h ALA 48 Ca 0.10 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1fiu h ALA 48 Cb 0.21 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1fiu h ALA 48 CO -0.01 0.45 0.08 0.22 0.00 0.00 0.00 179.25 179.99 1fiu h ASP 49 N 0.84 0.71 0.54 0.00 3.58 -0.81 -0.80 116.42 120.48 1fiu h ASP 49 Ca 0.22 -0.26 0.00 0.00 0.42 0.00 0.00 57.03 57.41 1fiu h ASP 49 Cb -0.01 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 40.85 1fiu h ASP 49 CO -0.04 0.78 0.00 -0.07 -2.88 0.00 0.00 179.24 177.03 1fiu h LEU 50 N 0.60 0.00 -1.68 2.28 3.38 -0.34 -0.63 115.31 118.92 1fiu h LEU 50 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1fiu h LEU 50 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1fiu h LEU 50 CO 0.01 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.72 1fiu n LEU 51 N -2.84 2.58 -2.43 1.67 4.32 -0.38 -4.96 117.00 114.96 1fiu n LEU 51 Ca -0.00 -0.95 -0.18 0.00 -0.02 0.00 0.00 56.01 54.86 1fiu n LEU 51 Cb 0.19 -0.07 0.02 0.00 -1.62 0.00 0.00 43.42 41.95 1fiu n LEU 51 CO 0.22 0.47 -0.03 1.41 -1.22 0.00 0.00 177.39 178.24 1fiu n HIS 52 N 0.98 -1.50 -2.31 -1.77 8.25 -0.24 -4.97 115.22 113.64 1fiu n HIS 52 Ca 0.17 0.37 -0.41 0.00 -0.26 0.00 0.00 57.72 57.58 1fiu n HIS 52 Cb 0.51 -3.83 -0.03 0.00 1.12 0.00 0.00 29.99 27.76 1fiu n HIS 52 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1fiu s SER 53 N -2.68 7.00 0.00 0.41 0.15 -0.38 -4.88 113.70 113.32 1fiu s SER 53 Ca 0.21 2.28 0.00 0.00 0.70 0.00 0.00 55.95 59.14 1fiu s SER 53 Cb -0.09 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.61 1fiu s SER 53 CO 0.26 -0.45 0.00 -0.62 1.20 0.00 0.00 173.24 173.63 1fiu n GLU 54 N 2.78 3.17 -2.11 5.44 1.02 -1.26 -4.77 120.64 124.92 1fiu n GLU 54 Ca 0.06 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.79 1fiu n GLU 54 Cb 0.44 -0.70 -0.02 0.00 -0.02 0.00 0.00 31.44 31.13 1fiu n GLU 54 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1fiu s THR 55 N -0.92 2.80 -0.20 2.62 2.01 -1.26 -4.97 115.64 115.72 1fiu s THR 55 Ca 0.00 0.73 -0.04 0.00 0.31 0.00 0.00 61.69 62.69 1fiu s THR 55 Cb 0.00 -3.47 -0.01 0.00 0.01 0.00 0.00 72.50 69.03 1fiu s THR 55 CO 0.00 0.14 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.34 1fiu s VAL 56 N -0.55 3.46 0.16 3.82 1.01 -1.26 -2.32 120.40 124.73 1fiu s VAL 56 Ca 0.54 -0.47 -0.23 0.00 0.00 0.00 0.00 61.98 61.81 1fiu s VAL 56 Cb -0.40 -2.56 0.07 0.00 0.00 0.00 0.00 36.38 33.49 1fiu s VAL 56 CO 0.47 0.44 0.60 -0.94 0.00 0.00 0.00 175.10 175.67 1fiu s SER 57 N 1.23 -0.57 0.47 3.32 1.04 0.37 -4.95 113.70 114.61 1fiu s SER 57 Ca 0.03 -0.00 -0.23 0.00 0.48 0.00 0.00 55.95 56.23 1fiu s SER 57 Cb -0.14 0.60 -0.07 0.00 0.10 0.00 0.00 66.02 66.50 1fiu s SER 57 CO -0.01 -0.97 1.22 -1.61 0.98 0.00 0.00 173.24 172.85 1fiu s GLU 58 N -3.74 3.65 0.22 4.02 0.41 -1.26 -3.28 118.70 118.71 1fiu s GLU 58 Ca 0.01 1.91 -0.32 0.00 -0.41 0.00 0.00 54.97 56.16 1fiu s GLU 58 Cb -0.01 -2.41 -0.13 0.00 -1.78 0.00 0.00 34.13 29.80 1fiu s GLU 58 CO -0.13 -0.68 1.57 -2.13 -0.49 0.00 0.00 175.26 173.40 1fiu n ARG 59 N -0.53 2.38 -1.87 1.61 0.63 -1.26 -4.96 116.66 112.66 1fiu n ARG 59 Ca 0.08 0.85 -0.32 0.00 -0.92 0.00 0.00 57.85 57.54 1fiu n ARG 59 Cb 0.47 -2.62 0.03 0.00 0.45 0.00 0.00 32.46 30.79 1fiu n ARG 59 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1fiu s LEU 60 N 0.47 3.38 0.44 6.15 1.43 -1.26 -4.96 118.68 124.32 1fiu s LEU 60 Ca 0.72 1.78 -0.26 0.00 -1.03 0.00 0.00 54.13 55.35 1fiu s LEU 60 Cb -0.59 -4.52 -0.09 0.00 0.03 0.00 0.00 46.19 41.01 1fiu s LEU 60 CO 0.42 -1.31 1.37 -2.65 0.23 0.00 0.00 176.35 174.41 1fiu n PRO 61 N -2.39 2.15 -0.10 1.29 -0.02 -1.26 -4.76 135.00 129.90 1fiu n PRO 61 Ca 0.09 0.76 0.16 0.00 -2.02 0.00 0.00 63.50 62.49 1fiu n PRO 61 Cb 0.53 -2.53 0.55 0.00 -0.02 0.00 0.00 33.50 32.02 1fiu n PRO 61 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1fiu h GLY 62 N 2.25 0.50 1.56 -1.23 0.00 -1.99 -0.35 103.07 103.80 1fiu h GLY 62 Ca -0.50 -0.13 -0.07 0.00 0.00 0.00 0.00 47.33 46.63 1fiu h GLY 62 CO 0.61 0.06 -0.09 1.46 0.00 0.00 0.00 176.54 178.58 1fiu h GLN 63 N 0.31 0.54 -0.05 4.80 7.50 -1.99 -0.43 115.11 125.79 1fiu h GLN 63 Ca 0.32 -0.14 -0.03 0.00 0.50 0.00 0.00 58.65 59.29 1fiu h GLN 63 Cb 0.81 -0.06 -0.00 0.00 0.05 0.00 0.00 27.48 28.28 1fiu h GLN 63 CO -0.08 0.63 -0.09 1.15 -1.50 0.00 0.00 178.83 178.93 1fiu h THR 64 N 0.50 1.41 -0.35 -0.54 2.02 -1.43 -2.13 112.91 112.39 1fiu h THR 64 Ca 0.10 -1.37 -0.10 0.00 0.77 0.00 0.00 66.41 65.80 1fiu h THR 64 Cb 0.46 2.20 -0.02 0.00 -1.74 0.00 0.00 68.15 69.05 1fiu h THR 64 CO 0.02 0.38 -0.20 0.77 0.37 0.00 0.00 175.52 176.86 1fiu h SER 65 N -0.33 0.66 0.23 4.18 4.64 -1.34 -0.27 113.55 121.32 1fiu h SER 65 Ca 0.00 -0.22 -0.01 0.00 -0.47 0.00 0.00 61.79 61.10 1fiu h SER 65 Cb 0.66 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1fiu h SER 65 CO 0.02 0.86 -0.14 1.23 -0.87 0.00 0.00 176.83 177.93 1fiu h GLY 66 N 0.99 -0.36 0.95 -0.77 0.00 -1.10 0.40 103.07 103.18 1fiu h GLY 66 Ca 0.09 0.15 -0.05 0.00 0.00 0.00 0.00 47.33 47.52 1fiu h GLY 66 CO 0.05 -0.15 0.08 -0.57 0.00 0.00 0.00 176.54 175.95 1fiu h ASN 67 N -0.36 0.67 -0.40 0.19 -0.73 -1.28 -2.60 115.58 111.07 1fiu h ASN 67 Ca -0.02 -0.25 -0.07 0.00 1.87 0.00 0.00 56.30 57.83 1fiu h ASN 67 Cb 0.30 -0.18 -0.02 0.00 0.27 0.00 0.00 38.32 38.69 1fiu h ASN 67 CO 0.03 0.75 0.02 0.00 -0.37 0.00 0.00 177.43 177.86 1fiu h ALA 68 N 0.94 1.14 -0.66 1.57 0.00 -0.96 -1.52 119.26 119.77 1fiu h ALA 68 Ca 0.13 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 1fiu h ALA 68 Cb 0.36 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1fiu h ALA 68 CO 0.01 0.56 0.09 0.35 0.00 0.00 0.00 179.25 180.25 1fiu h PHE 69 N 0.73 1.19 -0.19 0.00 3.57 -0.82 -0.64 116.94 120.78 1fiu h PHE 69 Ca 0.15 -0.17 -0.00 0.00 3.53 0.00 0.00 57.97 61.47 1fiu h PHE 69 Cb 0.42 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 1fiu h PHE 69 CO 0.02 1.00 0.10 0.93 -2.23 0.00 0.00 178.31 178.14 1fiu h GLU 70 N 1.04 0.27 -0.37 1.11 5.08 -1.05 -0.58 114.58 120.06 1fiu h GLU 70 Ca 0.20 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1fiu h GLU 70 Cb 0.47 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 1fiu h GLU 70 CO 0.02 0.27 0.23 0.00 -1.00 0.00 0.00 179.01 178.52 1fiu h ALA 71 N 0.99 0.48 -0.48 3.43 0.00 -0.93 -0.62 119.26 122.12 1fiu h ALA 71 Ca 0.07 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1fiu h ALA 71 Cb 0.08 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1fiu h ALA 71 CO -0.01 -0.03 -0.10 0.82 0.00 0.00 0.00 179.25 179.92 1fiu h ILE 72 N 0.49 1.26 -0.68 0.00 2.04 -1.04 -1.69 117.51 117.89 1fiu h ILE 72 Ca 0.13 -1.20 -0.03 0.00 1.00 0.00 0.00 64.86 64.77 1fiu h ILE 72 Cb -0.01 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 1fiu h ILE 72 CO -0.03 0.42 0.30 0.00 0.00 0.00 0.00 178.15 178.84 1fiu h SER 74 N 0.95 0.56 -0.75 0.00 0.87 -0.71 -1.10 113.55 113.37 1fiu h SER 74 Ca 0.23 -0.01 -0.06 0.00 -1.23 0.00 0.00 61.79 60.72 1fiu h SER 74 Cb 0.16 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 61.96 1fiu h SER 74 CO -0.02 0.40 0.23 -0.33 -0.53 0.00 0.00 176.83 176.58 1fiu h GLU 75 N 0.67 1.16 -0.33 2.24 5.08 -1.15 0.01 114.58 122.25 1fiu h GLU 75 Ca 0.19 -0.25 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 1fiu h GLU 75 Cb -0.05 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.02 1fiu h GLU 75 CO -0.06 0.99 0.10 0.35 -1.00 0.00 0.00 179.01 179.39 1fiu h PHE 76 N 1.11 0.55 -0.30 4.33 3.57 -1.09 -1.41 116.94 123.69 1fiu h PHE 76 Ca 0.24 -0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.66 1fiu h PHE 76 Cb 0.31 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 1fiu h PHE 76 CO 0.03 0.55 0.11 0.28 -2.23 0.00 0.00 178.31 177.04 1fiu h VAL 77 N 0.38 1.19 -0.19 1.41 2.07 -0.95 -1.37 116.25 118.80 1fiu h VAL 77 Ca 0.11 -0.60 0.03 0.00 0.82 0.00 0.00 66.70 67.06 1fiu h VAL 77 Cb 0.27 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1fiu h VAL 77 CO -0.00 0.20 0.00 -0.61 0.02 0.00 0.00 177.57 177.18 1fiu h GLN 78 N 0.33 0.06 -0.36 1.57 4.15 -0.91 -0.40 115.11 119.54 1fiu h GLN 78 Ca 0.10 -0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.46 1fiu h GLN 78 Cb 0.21 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.88 1fiu h GLN 78 CO -0.01 0.04 0.02 1.03 -1.93 0.00 0.00 178.83 177.98 1fiu h SER 79 N 0.06 0.62 -0.14 -0.69 0.87 -1.15 -2.49 113.55 110.64 1fiu h SER 79 Ca 0.09 -0.29 -0.21 0.00 -1.23 0.00 0.00 61.79 60.15 1fiu h SER 79 Cb 0.11 -0.16 0.01 0.00 -0.44 0.00 0.00 62.40 61.91 1fiu h SER 79 CO -0.15 0.76 -0.72 0.00 -0.53 0.00 0.00 176.83 176.19 1fiu h ALA 80 N 0.88 0.27 -0.12 6.23 0.00 -1.17 -3.25 119.26 122.11 1fiu h ALA 80 Ca 0.11 -0.58 -0.06 0.00 0.00 0.00 0.00 54.91 54.38 1fiu h ALA 80 Cb 0.43 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1fiu h ALA 80 CO 0.02 0.61 -0.20 0.35 0.00 0.00 0.00 179.25 180.02 1fiu h PHE 81 N 0.43 0.21 -0.20 0.00 3.57 -1.10 -1.94 116.94 117.92 1fiu h PHE 81 Ca -0.05 -0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.48 1fiu h PHE 81 Cb 1.36 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 40.03 1fiu h PHE 81 CO 0.09 0.39 0.17 1.49 -2.23 0.00 0.00 178.31 178.23 1fiu h GLU 82 N 0.18 0.00 -0.01 1.11 4.81 -1.47 -0.67 114.58 118.54 1fiu h GLU 82 Ca 0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1fiu h GLU 82 Cb 0.46 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1fiu h GLU 82 CO 0.03 0.00 0.00 1.63 -0.73 0.00 0.00 179.01 179.94 1fiu n LYS 83 N -4.12 1.20 -0.59 1.92 5.02 -0.73 -3.70 118.16 117.15 1fiu n LYS 83 Ca 0.02 -0.29 0.08 0.00 -2.02 0.00 0.00 58.31 56.10 1fiu n LYS 83 Cb 0.30 -1.49 0.31 0.00 -0.02 0.00 0.00 35.03 34.13 1fiu n LYS 83 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1fiu n LEU 84 N -0.65 4.48 0.11 -0.35 4.77 -0.26 -4.66 117.00 120.44 1fiu n LEU 84 Ca 0.22 -2.99 0.18 0.00 -0.03 0.00 0.00 56.01 53.39 1fiu n LEU 84 Cb 0.18 -0.59 0.74 0.00 -2.33 0.00 0.00 43.42 41.42 1fiu n LEU 84 CO 0.17 0.66 1.16 -0.61 -1.33 0.00 0.00 177.39 177.44 1fiu h GLN 85 N 2.50 0.00 0.00 3.23 5.75 -1.71 -0.44 115.11 124.44 1fiu h GLN 85 Ca 0.00 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.48 1fiu h GLN 85 Cb 1.62 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 30.16 1fiu h GLN 85 CO 0.31 0.00 -0.07 1.12 -2.65 0.00 0.00 178.83 177.54 1fiu h HIS 86 N 0.00 0.00 0.00 3.99 2.07 -1.92 -1.79 115.15 117.49 1fiu h HIS 86 Ca 0.16 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.68 1fiu h HIS 86 Cb 0.72 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.70 1fiu h HIS 86 CO 0.00 0.07 -1.10 0.44 -3.07 0.00 0.00 177.93 174.28 1fiu n ILE 87 N -3.14 0.00 -2.92 6.12 -5.35 -0.42 -4.75 119.36 108.90 1fiu n ILE 87 Ca 0.02 -0.22 -0.13 0.00 -0.27 0.00 0.00 62.75 62.15 1fiu n ILE 87 Cb 0.48 0.68 -0.00 0.00 -1.74 0.00 0.00 39.64 39.06 1fiu n ILE 87 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 1fiu n ARG 88 N -1.62 0.67 -1.48 6.28 3.00 -0.31 -4.95 116.66 118.26 1fiu n ARG 88 Ca 0.01 -2.29 -0.34 0.00 -0.00 0.00 0.00 57.85 55.23 1fiu n ARG 88 Cb 0.30 -1.42 0.09 0.00 0.00 0.00 0.00 32.46 31.43 1fiu n ARG 88 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1fiu s PRO 89 N 0.19 2.24 0.00 -0.14 0.04 -0.68 -4.47 135.00 132.18 1fiu s PRO 89 Ca 0.33 1.67 0.00 0.00 0.04 0.00 0.00 61.00 63.04 1fiu s PRO 89 Cb 0.16 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.84 1fiu s PRO 89 CO -0.18 -1.74 0.00 0.41 0.04 0.00 0.00 177.00 175.54 1fiu n GLY 90 N 0.19 2.48 3.34 0.56 0.00 -1.26 -5.02 105.19 105.48 1fiu n GLY 90 Ca 0.13 -1.17 -0.47 0.00 0.00 0.00 0.00 46.02 44.51 1fiu n GLY 90 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1fiu s ASP 91 N 0.00 6.69 0.04 1.61 2.15 -1.26 -5.04 116.67 120.87 1fiu s ASP 91 Ca 0.00 -2.53 -0.06 0.00 0.43 0.00 0.00 52.55 50.39 1fiu s ASP 91 Cb 0.00 -2.23 -0.05 0.00 -0.30 0.00 0.00 42.92 40.34 1fiu s ASP 91 CO 0.00 -0.66 0.30 0.26 -0.17 0.00 0.00 175.17 174.90 1fiu s TRP 92 N 0.59 3.56 -0.01 -5.34 0.52 -1.26 -1.34 118.94 115.65 1fiu s TRP 92 Ca 0.18 0.57 0.05 0.00 0.02 0.00 0.00 56.10 56.92 1fiu s TRP 92 Cb -0.11 -1.99 -0.01 0.00 -1.15 0.00 0.00 33.47 30.20 1fiu s TRP 92 CO -0.08 0.57 -0.15 -0.80 0.02 0.00 0.00 176.95 176.51 1fiu s ASN 93 N -1.90 1.79 -0.09 2.95 0.01 -0.44 -4.98 114.94 112.28 1fiu s ASN 93 Ca 0.31 -0.28 0.02 0.00 -0.71 0.00 0.00 52.86 52.21 1fiu s ASN 93 Cb -0.13 -0.20 0.01 0.00 0.41 0.00 0.00 41.25 41.34 1fiu s ASN 93 CO 0.19 0.19 -0.15 -0.69 -1.51 0.00 0.00 177.10 175.13 1fiu s VAL 94 N -0.36 1.39 -0.06 1.60 1.01 -1.26 -0.93 120.40 121.79 1fiu s VAL 94 Ca 0.06 -0.61 -0.20 0.00 0.00 0.00 0.00 61.98 61.23 1fiu s VAL 94 Cb -0.06 -1.26 0.04 0.00 0.00 0.00 0.00 36.38 35.10 1fiu s VAL 94 CO -0.01 0.42 0.46 -1.59 0.00 0.00 0.00 175.10 174.38 1fiu s LYS 95 N 0.76 0.76 -0.08 2.72 -2.85 -0.23 -4.99 119.74 115.83 1fiu s LYS 95 Ca -0.12 0.13 -0.30 0.00 -1.00 0.00 0.00 55.97 54.68 1fiu s LYS 95 Cb -0.16 0.35 -0.02 0.00 -2.06 0.00 0.00 37.83 35.94 1fiu s LYS 95 CO 0.02 -0.20 1.06 -1.14 0.10 0.00 0.00 175.35 175.19 1fiu s GLN 96 N -0.94 4.42 -0.06 1.78 0.74 -1.26 -1.03 119.66 123.30 1fiu s GLN 96 Ca -0.10 1.48 -0.05 0.00 0.05 0.00 0.00 55.36 56.73 1fiu s GLN 96 Cb -0.03 -3.53 -0.03 0.00 1.10 0.00 0.00 33.01 30.51 1fiu s GLN 96 CO 0.05 -0.33 0.25 0.28 -0.55 0.00 0.00 175.29 175.00 1fiu h VAL 97 N 5.03 0.00 -0.42 1.34 2.07 -1.08 -3.48 116.25 119.71 1fiu h VAL 97 Ca -0.33 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 66.52 1fiu h VAL 97 Cb 1.16 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1fiu h VAL 97 CO 0.85 0.00 0.00 0.61 0.02 0.00 0.00 177.57 179.05 1fiu n GLY 98 N 1.24 -0.46 0.23 2.17 0.00 -1.26 -4.63 105.19 102.48 1fiu n GLY 98 Ca -0.02 -1.02 0.03 0.00 0.00 0.00 0.00 46.02 45.01 1fiu n GLY 98 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1fiu h SER 99 N 0.00 0.00 0.12 1.61 4.64 -1.92 0.23 113.55 118.23 1fiu h SER 99 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1fiu h SER 99 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1fiu h SER 99 CO 0.00 0.00 -0.03 0.03 -0.87 0.00 0.00 176.83 175.96 1fiu h ARG 100 N 0.00 0.00 -4.74 4.77 3.08 -2.02 -3.37 114.38 112.11 1fiu h ARG 100 Ca 0.00 0.00 -0.73 0.00 0.07 0.00 0.00 59.98 59.32 1fiu h ARG 100 Cb 1.34 0.00 -0.17 0.00 0.08 0.00 0.00 29.97 31.22 1fiu h ARG 100 CO 0.00 0.03 1.49 0.09 -1.07 0.00 0.00 179.97 180.51 1fiu n ASN 101 N -3.60 5.19 -4.73 7.04 3.02 0.80 -5.01 115.26 117.96 1fiu n ASN 101 Ca -0.03 -2.98 -0.41 0.00 -0.03 0.00 0.00 54.58 51.13 1fiu n ASN 101 Cb 0.12 -1.58 -0.04 0.00 -0.61 0.00 0.00 39.78 37.67 1fiu n ASN 101 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1fiu s ARG 102 N 1.68 4.66 -1.13 3.52 0.52 -1.26 -2.82 118.95 124.13 1fiu s ARG 102 Ca 0.44 1.58 0.00 0.00 -0.52 0.00 0.00 55.73 57.23 1fiu s ARG 102 Cb -0.01 -3.32 0.00 0.00 0.52 0.00 0.00 34.95 32.14 1fiu s ARG 102 CO 0.01 0.17 0.00 1.28 0.02 0.00 0.00 175.30 176.78 1fiu n LEU 103 N 2.49 -0.64 -0.37 2.53 4.77 -1.26 -4.87 117.00 119.63 1fiu n LEU 103 Ca 0.02 0.26 -0.02 0.00 -0.03 0.00 0.00 56.01 56.24 1fiu n LEU 103 Cb 0.48 -1.96 0.11 0.00 -2.33 0.00 0.00 43.42 39.71 1fiu n LEU 103 CO 0.52 -0.69 1.28 -0.08 -1.33 0.00 0.00 177.39 177.10 1fiu h GLU 104 N 0.07 1.32 0.00 3.23 4.57 -1.78 -1.25 114.58 120.73 1fiu h GLU 104 Ca -0.22 -0.09 -0.01 0.00 -1.18 0.00 0.00 59.36 57.87 1fiu h GLU 104 Cb 0.82 -0.29 -0.00 0.00 -0.16 0.00 0.00 28.75 29.12 1fiu h GLU 104 CO 0.32 0.88 -0.02 -0.84 -1.18 0.00 0.00 179.01 178.17 1fiu h ILE 105 N 1.35 0.13 0.00 2.32 3.07 -1.85 -1.33 117.51 121.20 1fiu h ILE 105 Ca 0.36 -0.28 0.00 0.00 1.55 0.00 0.00 64.86 66.50 1fiu h ILE 105 Cb -0.14 1.24 0.00 0.00 -0.27 0.00 0.00 36.82 37.65 1fiu h ILE 105 CO -0.08 0.02 0.00 0.00 -1.05 0.00 0.00 178.15 177.05 1fiu n ALA 106 N -2.13 2.22 1.47 0.16 0.00 -0.47 -1.96 120.51 119.80 1fiu n ALA 106 Ca -0.02 -0.12 0.15 0.00 0.00 0.00 0.00 53.44 53.45 1fiu n ALA 106 Cb 0.18 -1.36 0.71 0.00 0.00 0.00 0.00 19.45 18.98 1fiu n ALA 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1fiu n ARG 107 N -1.19 0.61 -4.30 0.00 1.74 -0.50 -3.99 116.66 109.03 1fiu n ARG 107 Ca 0.13 -0.11 -0.31 0.00 -0.77 0.00 0.00 57.85 56.79 1fiu n ARG 107 Cb 0.14 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 29.99 1fiu n ARG 107 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1fiu s TYR 108 N -2.47 2.86 0.21 -1.55 1.51 -0.83 -4.22 117.35 112.86 1fiu s TYR 108 Ca 0.31 -0.08 -0.15 0.00 -1.01 0.00 0.00 57.07 56.13 1fiu s TYR 108 Cb 0.20 -1.53 0.22 0.00 -0.11 0.00 0.00 41.96 40.75 1fiu s TYR 108 CO 0.46 0.42 1.61 0.37 -1.11 0.00 0.00 175.55 177.29 1fiu h GLN 109 N 3.93 -0.06 0.00 -0.62 4.15 -1.16 -0.96 115.11 120.40 1fiu h GLN 109 Ca -0.48 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.94 1fiu h GLN 109 Cb 1.17 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.87 1fiu h GLN 109 CO 0.55 -0.04 0.00 1.04 -1.93 0.00 0.00 178.83 178.45 1fiu n GLN 110 N -5.45 0.15 -0.11 1.69 3.00 -1.26 -3.05 117.38 112.35 1fiu n GLN 110 Ca 0.07 0.46 0.02 0.00 -0.01 0.00 0.00 57.00 57.54 1fiu n GLN 110 Cb 0.36 -1.82 0.03 0.00 0.00 0.00 0.00 30.24 28.80 1fiu n GLN 110 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1fiu n TYR 111 N -2.11 0.00 0.26 1.08 4.02 -0.68 -1.84 117.16 117.89 1fiu n TYR 111 Ca 0.01 -0.38 0.11 0.00 -0.01 0.00 0.00 57.90 57.63 1fiu n TYR 111 Cb 0.16 -0.06 0.74 0.00 -0.02 0.00 0.00 39.34 40.16 1fiu n TYR 111 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1fiu h ALA 112 N 0.00 1.86 0.00 -0.72 0.00 -1.13 -1.67 119.26 117.60 1fiu h ALA 112 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fiu h ALA 112 Cb 0.91 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1fiu h ALA 112 CO 0.00 -0.04 0.00 -2.39 0.00 0.00 0.00 179.25 176.82 1fiu n HIS 113 N -4.28 0.55 0.24 0.00 1.44 -1.26 -2.45 115.22 109.46 1fiu n HIS 113 Ca -0.02 0.23 0.10 0.00 -2.01 0.00 0.00 57.72 56.02 1fiu n HIS 113 Cb 0.12 -0.87 0.62 0.00 0.12 0.00 0.00 29.99 29.97 1fiu n HIS 113 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 1fiu h LEU 114 N 0.00 0.00 -0.41 2.39 3.38 -1.66 -2.16 115.31 116.85 1fiu h LEU 114 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1fiu h LEU 114 Cb 0.24 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1fiu h LEU 114 CO 0.00 0.18 0.12 0.74 0.09 0.00 0.00 178.44 179.56 1fiu h THR 115 N 0.00 1.22 -0.69 0.22 2.02 -1.69 -0.17 112.91 113.82 1fiu h THR 115 Ca -0.00 -0.75 -0.08 0.00 0.77 0.00 0.00 66.41 66.35 1fiu h THR 115 Cb 0.44 0.94 -0.03 0.00 -1.74 0.00 0.00 68.15 67.76 1fiu h THR 115 CO 0.02 0.26 0.13 0.00 0.37 0.00 0.00 175.52 176.30 1fiu h ALA 116 N 0.96 0.91 -0.06 6.16 0.00 -1.60 -0.19 119.26 125.46 1fiu h ALA 116 Ca 0.13 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1fiu h ALA 116 Cb 0.28 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1fiu h ALA 116 CO -0.00 0.67 0.03 -0.07 0.00 0.00 0.00 179.25 179.88 1fiu h LEU 117 N 1.06 0.07 -0.50 0.00 3.38 -1.18 0.16 115.31 118.30 1fiu h LEU 117 Ca 0.21 -0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.12 1fiu h LEU 117 Cb 0.43 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1fiu h LEU 117 CO 0.01 0.13 0.31 0.00 0.09 0.00 0.00 178.44 178.98 1fiu h ALA 118 N 0.94 0.64 -0.46 1.53 0.00 -0.87 -0.07 119.26 120.98 1fiu h ALA 118 Ca 0.02 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1fiu h ALA 118 Cb 0.08 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1fiu h ALA 118 CO -0.00 0.02 0.06 0.87 0.00 0.00 0.00 179.25 180.20 1fiu h LYS 119 N 0.61 0.71 -0.14 0.00 1.57 -0.76 -1.76 116.57 116.80 1fiu h LYS 119 Ca 0.20 -0.15 -0.20 0.00 -1.87 0.00 0.00 60.65 58.62 1fiu h LYS 119 Cb -0.01 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.21 1fiu h LYS 119 CO -0.08 0.68 -0.74 0.00 -0.57 0.00 0.00 179.45 178.75 1fiu h ALA 120 N 1.39 0.44 -0.37 3.86 0.00 -0.48 -3.20 119.26 120.90 1fiu h ALA 120 Ca 0.15 -0.59 -0.08 0.00 0.00 0.00 0.00 54.91 54.38 1fiu h ALA 120 Cb 0.33 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1fiu h ALA 120 CO 0.01 0.71 -0.11 0.00 0.00 0.00 0.00 179.25 179.86 1fiu h ALA 121 N 0.72 1.12 0.00 0.00 0.00 -0.77 -2.49 119.26 117.84 1fiu h ALA 121 Ca -0.04 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1fiu h ALA 121 Cb 1.34 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1fiu h ALA 121 CO 0.14 0.55 0.00 -0.85 0.00 0.00 0.00 179.25 179.09 1fiu n GLU 122 N -4.18 0.22 0.00 0.00 0.28 -0.68 -0.11 120.64 116.16 1fiu n GLU 122 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.01 1fiu n GLU 122 Cb 0.34 -1.07 0.00 0.00 1.43 0.00 0.00 31.44 32.14 1fiu n GLU 122 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1fiu n GLU 123 N 0.05 0.00 -3.50 3.44 1.02 -0.96 -5.08 120.64 115.62 1fiu n GLU 123 Ca 0.00 -0.02 -0.20 0.00 -0.02 0.00 0.00 57.16 56.92 1fiu n GLU 123 Cb 0.03 -0.29 -0.13 0.00 -0.02 0.00 0.00 31.44 31.03 1fiu n GLU 123 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1fiu s ASN 124 N 0.00 1.69 0.00 1.62 2.47 0.84 -5.11 114.94 116.45 1fiu s ASN 124 Ca 0.00 -0.42 0.00 0.00 0.42 0.00 0.00 52.86 52.86 1fiu s ASN 124 Cb 0.00 0.28 0.00 0.00 -1.45 0.00 0.00 41.25 40.08 1fiu s ASN 124 CO 0.00 -0.35 0.05 -0.81 -3.72 0.00 0.00 177.10 172.27 1fiu n PRO 125 N 5.31 0.00 0.00 0.43 -0.04 -1.26 -1.85 135.00 137.59 1fiu n PRO 125 Ca -0.05 0.05 0.02 0.00 -0.04 0.00 0.00 63.50 63.48 1fiu n PRO 125 Cb 0.48 -0.47 0.15 0.00 -0.04 0.00 0.00 33.50 33.62 1fiu n PRO 125 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1fiu n GLU 126 N -0.11 0.19 0.07 0.54 2.13 -1.26 0.14 120.64 122.34 1fiu n GLU 126 Ca 0.00 0.00 -0.21 0.00 0.66 0.00 0.00 57.16 57.61 1fiu n GLU 126 Cb 0.00 -1.41 -0.15 0.00 0.27 0.00 0.00 31.44 30.15 1fiu n GLU 126 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1fiu h LEU 127 N 0.00 0.54 -0.31 4.31 6.46 -1.83 -2.67 115.31 121.82 1fiu h LEU 127 Ca 0.00 -0.94 -0.08 0.00 -0.12 0.00 0.00 57.88 56.74 1fiu h LEU 127 Cb 0.00 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 39.75 1fiu h LEU 127 CO 0.00 1.44 -0.13 0.00 -0.62 0.00 0.00 178.44 179.13 1fiu h ALA 128 N 0.11 0.43 -0.74 1.25 0.00 0.21 -0.41 119.26 120.11 1fiu h ALA 128 Ca -0.16 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 1fiu h ALA 128 Cb 1.72 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 19.37 1fiu h ALA 128 CO 0.17 0.31 0.27 0.00 0.00 0.00 0.00 179.25 180.00 1fiu h ALA 129 N 0.77 0.97 0.01 0.00 0.00 -1.41 -0.21 119.26 119.39 1fiu h ALA 129 Ca 0.07 -0.21 -0.17 0.00 0.00 0.00 0.00 54.91 54.60 1fiu h ALA 129 Cb 0.65 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.16 1fiu h ALA 129 CO 0.04 0.62 -0.68 0.00 0.00 0.00 0.00 179.25 179.23 1fiu h ALA 130 N 1.13 0.06 -0.05 0.00 0.00 -1.45 -3.33 119.26 115.62 1fiu h ALA 130 Ca 0.24 -0.60 -0.21 0.00 0.00 0.00 0.00 54.91 54.35 1fiu h ALA 130 Cb 0.26 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1fiu h ALA 130 CO -0.01 0.39 -0.83 -0.07 0.00 0.00 0.00 179.25 178.73 1fiu h LEU 131 N -0.07 0.58 0.00 0.00 3.38 -1.10 -3.50 115.31 114.61 1fiu h LEU 131 Ca -0.09 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1fiu h LEU 131 Cb 1.40 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1fiu h LEU 131 CO 0.13 1.19 0.00 0.61 0.09 0.00 0.00 178.44 180.46 1fiu n GLY 132 N 0.75 -1.67 0.00 0.83 0.00 -0.09 -4.69 105.19 100.32 1fiu n GLY 132 Ca -0.06 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1fiu n GLY 132 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1fiu n SER 133 N 0.13 0.00 0.21 1.61 3.41 -1.26 -4.79 113.62 112.93 1fiu n SER 133 Ca 0.00 -0.45 0.06 0.00 -0.26 0.00 0.00 58.87 58.22 1fiu n SER 133 Cb 0.00 0.00 0.47 0.00 -0.26 0.00 0.00 64.21 64.42 1fiu n SER 133 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1fiu h ASP 134 N 0.00 0.00 0.00 4.04 5.19 -2.00 0.26 116.42 123.92 1fiu h ASP 134 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1fiu h ASP 134 Cb 0.23 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.74 1fiu h ASP 134 CO 0.00 0.29 0.13 0.00 -3.12 0.00 0.00 179.24 176.54 1fiu n TYR 135 N -3.85 0.00 -2.46 4.55 0.18 -1.26 -2.24 117.16 112.08 1fiu n TYR 135 Ca -0.02 0.00 -0.43 0.00 1.88 0.00 0.00 57.90 59.34 1fiu n TYR 135 Cb 0.37 -0.34 0.00 0.00 -0.38 0.00 0.00 39.34 38.99 1fiu n TYR 135 CO 0.00 0.00 0.00 2.41 -2.08 0.00 0.00 176.86 177.19 1fiu n THR 136 N -1.34 3.91 -2.97 -3.48 -1.04 0.08 -4.93 114.28 104.51 1fiu n THR 136 Ca 0.00 -3.99 -0.40 0.00 -2.04 0.00 0.00 64.05 57.62 1fiu n THR 136 Cb 0.13 -2.41 -0.05 0.00 -1.82 0.00 0.00 70.33 66.18 1fiu n THR 136 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1fiu s ILE 137 N 3.53 4.64 -0.41 12.58 1.01 -0.95 -4.92 121.20 136.69 1fiu s ILE 137 Ca 0.51 1.66 0.02 0.00 0.00 0.00 0.00 60.65 62.84 1fiu s ILE 137 Cb 0.05 -4.13 0.15 0.00 0.01 0.00 0.00 42.46 38.55 1fiu s ILE 137 CO 0.03 0.40 0.28 -0.89 0.00 0.00 0.00 174.94 174.76 1fiu s THR 138 N -0.29 0.59 0.86 2.92 2.01 -1.26 -4.34 115.64 116.13 1fiu s THR 138 Ca 0.38 -2.35 -0.12 0.00 0.31 0.00 0.00 61.69 59.92 1fiu s THR 138 Cb -0.21 -1.42 0.11 0.00 0.01 0.00 0.00 72.50 70.99 1fiu s THR 138 CO 0.24 -1.06 1.17 -2.84 -0.69 0.00 0.00 174.62 171.44 1fiu s PRO 139 N 0.43 1.35 0.04 4.92 0.02 -1.26 -4.94 135.00 135.56 1fiu s PRO 139 Ca 0.24 1.64 -0.20 0.00 0.02 0.00 0.00 61.00 62.70 1fiu s PRO 139 Cb -0.12 -1.76 -0.15 0.00 0.02 0.00 0.00 34.50 32.49 1fiu s PRO 139 CO -0.08 -2.40 1.30 -0.44 -0.33 0.00 0.00 177.00 175.05 1fiu h ASP 140 N -1.38 0.44 -3.99 2.53 3.32 -1.96 -3.41 116.42 111.97 1fiu h ASP 140 Ca -0.45 -0.53 -0.36 0.00 0.02 0.00 0.00 57.03 55.71 1fiu h ASP 140 Cb 1.28 -0.13 -0.28 0.00 0.22 0.00 0.00 39.33 40.42 1fiu h ASP 140 CO 0.44 0.89 -0.77 -0.63 -1.72 0.00 0.00 179.24 177.45 1fiu s ILE 141 N -4.10 0.59 0.08 0.35 1.01 -0.78 -0.60 121.20 117.75 1fiu s ILE 141 Ca -0.14 -0.33 0.06 0.00 0.00 0.00 0.00 60.65 60.24 1fiu s ILE 141 Cb 0.05 -0.50 -0.03 0.00 0.01 0.00 0.00 42.46 41.99 1fiu s ILE 141 CO 0.77 0.16 -0.16 0.27 0.00 0.00 0.00 174.94 175.97 1fiu s ILE 142 N -0.20 1.31 -0.10 2.92 -4.36 -0.20 -0.97 121.20 119.62 1fiu s ILE 142 Ca 0.03 -1.41 0.03 0.00 -0.26 0.00 0.00 60.65 59.03 1fiu s ILE 142 Cb -0.03 -1.25 -0.01 0.00 1.25 0.00 0.00 42.46 42.41 1fiu s ILE 142 CO -0.00 -0.19 -0.19 -0.69 0.24 0.00 0.00 174.94 174.11 1fiu s VAL 143 N -1.30 2.57 0.16 8.37 1.01 -0.63 -1.07 120.40 129.51 1fiu s VAL 143 Ca 0.01 -0.85 0.06 0.00 0.00 0.00 0.00 61.98 61.20 1fiu s VAL 143 Cb -0.10 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 1fiu s VAL 143 CO 0.03 0.55 -0.13 0.42 0.00 0.00 0.00 175.10 175.97 1fiu s THR 144 N 0.13 1.44 -0.14 3.92 -4.23 -0.11 -0.13 115.64 116.52 1fiu s THR 144 Ca -0.10 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.43 1fiu s THR 144 Cb -0.16 -1.82 0.01 0.00 1.34 0.00 0.00 72.50 71.88 1fiu s THR 144 CO 0.06 -0.58 -0.21 -0.60 -0.54 0.00 0.00 174.62 172.75 1fiu s ARG 145 N -3.35 2.95 0.58 3.99 3.52 0.19 -1.33 118.95 125.50 1fiu s ARG 145 Ca 0.16 -0.83 -0.15 0.00 -0.13 0.00 0.00 55.73 54.78 1fiu s ARG 145 Cb -0.01 -2.42 -0.04 0.00 -1.56 0.00 0.00 34.95 30.92 1fiu s ARG 145 CO 0.04 -0.05 1.04 -0.80 -0.81 0.00 0.00 175.30 174.71 1fiu s ASN 146 N 0.91 5.98 0.85 -2.12 0.02 -0.45 -1.06 114.94 119.07 1fiu s ASN 146 Ca -0.05 1.71 -0.12 0.00 -1.02 0.00 0.00 52.86 53.39 1fiu s ASN 146 Cb -0.15 -2.52 0.10 0.00 0.02 0.00 0.00 41.25 38.70 1fiu s ASN 146 CO -0.04 -1.03 1.11 -0.76 0.02 0.00 0.00 177.10 176.40 1fiu s LEU 147 N -4.53 2.35 0.17 0.60 1.43 -1.26 -4.60 118.68 112.84 1fiu s LEU 147 Ca 0.61 1.24 0.11 0.00 -1.03 0.00 0.00 54.13 55.06 1fiu s LEU 147 Cb -0.14 -3.73 -0.04 0.00 0.03 0.00 0.00 46.19 42.31 1fiu s LEU 147 CO 0.38 -2.26 -0.25 0.27 0.23 0.00 0.00 176.35 174.72 1fiu s ILE 148 N -3.15 2.27 0.60 -0.59 -4.36 -0.05 -4.84 121.20 111.10 1fiu s ILE 148 Ca 0.62 -1.91 -0.14 0.00 -0.26 0.00 0.00 60.65 58.96 1fiu s ILE 148 Cb -0.15 -2.05 -0.04 0.00 1.25 0.00 0.00 42.46 41.48 1fiu s ILE 148 CO 0.54 -0.05 1.04 0.00 0.24 0.00 0.00 174.94 176.72 1fiu s ALA 149 N -1.44 2.82 0.42 2.27 0.00 -1.26 -2.63 121.76 121.94 1fiu s ALA 149 Ca 0.18 0.25 0.08 0.00 0.00 0.00 0.00 51.96 52.47 1fiu s ALA 149 Cb -0.09 -3.19 0.91 0.00 0.00 0.00 0.00 23.12 20.76 1fiu s ALA 149 CO 0.08 -0.78 2.07 -0.44 0.00 0.00 0.00 175.76 176.69 1fiu h ASP 150 N 0.23 0.41 0.43 0.00 5.19 -1.97 -1.04 116.42 119.67 1fiu h ASP 150 Ca -0.46 -0.01 -0.04 0.00 -0.62 0.00 0.00 57.03 55.90 1fiu h ASP 150 Cb 1.21 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.61 1fiu h ASP 150 CO 0.58 0.30 -0.18 0.00 -3.12 0.00 0.00 179.24 176.82 1fiu h ALA 151 N 1.77 1.29 0.02 3.45 0.00 -1.93 0.20 119.26 124.06 1fiu h ALA 151 Ca 0.14 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1fiu h ALA 151 Cb -0.04 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.73 1fiu h ALA 151 CO -0.03 0.22 -0.54 1.49 0.00 0.00 0.00 179.25 180.40 1fiu h GLU 152 N 0.00 0.33 -0.93 0.00 4.57 -1.58 -0.98 114.58 116.00 1fiu h GLU 152 Ca -0.00 -0.38 0.02 0.00 -1.18 0.00 0.00 59.36 57.82 1fiu h GLU 152 Cb 0.44 0.11 -0.05 0.00 -0.16 0.00 0.00 28.75 29.10 1fiu h GLU 152 CO 0.02 1.08 0.61 0.82 -1.18 0.00 0.00 179.01 180.36 1fiu h ILE 153 N -0.25 1.20 -0.36 2.32 2.04 -1.04 -1.91 117.51 119.52 1fiu h ILE 153 Ca -0.07 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.37 1fiu h ILE 153 Cb 1.28 -0.12 0.00 0.00 -0.74 0.00 0.00 36.82 37.24 1fiu h ILE 153 CO 0.11 0.22 0.00 0.59 0.00 0.00 0.00 178.15 179.07 1fiu n ASN 154 N -4.47 3.12 -0.31 1.72 3.02 0.66 -4.60 115.26 114.40 1fiu n ASN 154 Ca 0.11 -2.33 0.12 0.00 -0.03 0.00 0.00 54.58 52.46 1fiu n ASN 154 Cb 0.05 -0.48 0.30 0.00 -0.61 0.00 0.00 39.78 39.03 1fiu n ASN 154 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 1fiu h ARG 155 N 2.30 0.47 0.00 3.52 2.43 -0.32 -2.99 114.38 119.79 1fiu h ARG 155 Ca 0.00 -0.03 -0.21 0.00 -0.81 0.00 0.00 59.98 58.94 1fiu h ARG 155 Cb 1.04 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 30.45 1fiu h ARG 155 CO 0.17 0.31 -2.06 0.09 -1.51 0.00 0.00 179.97 176.98 1fiu n ASN 156 N -4.98 0.79 -3.81 -3.80 3.02 -1.26 -5.03 115.26 100.20 1fiu n ASN 156 Ca 0.21 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.66 1fiu n ASN 156 Cb 0.61 1.23 -0.08 0.00 -0.61 0.00 0.00 39.78 40.93 1fiu n ASN 156 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1fiu s GLU 157 N -2.71 0.75 -1.00 3.52 2.02 -1.13 -5.09 118.70 115.07 1fiu s GLU 157 Ca -0.08 -0.59 -0.23 0.00 0.02 0.00 0.00 54.97 54.09 1fiu s GLU 157 Cb 0.07 0.32 0.03 0.00 0.10 0.00 0.00 34.13 34.66 1fiu s GLU 157 CO 0.72 -0.23 1.52 0.12 0.02 0.00 0.00 175.26 177.41 1fiu s PHE 158 N -2.62 2.41 -0.15 1.61 5.36 -1.26 -4.32 117.98 119.02 1fiu s PHE 158 Ca -0.05 -0.60 -0.07 0.00 -0.96 0.00 0.00 56.93 55.26 1fiu s PHE 158 Cb -0.01 -4.60 -0.24 0.00 -0.34 0.00 0.00 43.02 37.83 1fiu s PHE 158 CO -0.04 -1.91 0.27 1.28 -1.46 0.00 0.00 175.22 173.35 1fiu n LEU 159 N 9.67 2.63 -4.07 6.12 4.77 -1.26 -5.02 117.00 129.84 1fiu n LEU 159 Ca 0.34 0.18 -0.10 0.00 -0.03 0.00 0.00 56.01 56.40 1fiu n LEU 159 Cb 0.50 -1.08 -0.11 0.00 -2.33 0.00 0.00 43.42 40.41 1fiu n LEU 159 CO 0.65 0.82 -0.38 0.68 -1.33 0.00 0.00 177.39 177.84 1fiu s VAL 160 N -2.54 0.38 0.00 4.08 -7.23 -1.26 -5.07 120.40 108.76 1fiu s VAL 160 Ca -0.25 -1.43 0.00 0.00 -1.81 0.00 0.00 61.98 58.49 1fiu s VAL 160 Cb 0.07 -1.01 0.00 0.00 0.56 0.00 0.00 36.38 36.00 1fiu s VAL 160 CO 0.73 -0.69 0.00 -0.90 -0.31 0.00 0.00 175.10 173.93 1fiu n ASP 161 N 0.78 0.74 0.00 4.85 5.68 -1.26 -4.97 116.55 122.37 1fiu n ASP 161 Ca -0.18 -0.74 0.11 0.00 -0.50 0.00 0.00 54.79 53.48 1fiu n ASP 161 Cb 0.58 0.00 0.61 0.00 -1.14 0.00 0.00 41.12 41.17 1fiu n ASP 161 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 1fiu n GLU 162 N 0.00 0.46 -0.21 0.11 0.00 -1.26 -3.52 120.64 116.21 1fiu n GLU 162 Ca 0.00 0.05 0.06 0.00 0.00 0.00 0.00 57.16 57.27 1fiu n GLU 162 Cb 0.00 -1.50 0.16 0.00 0.00 0.00 0.00 31.44 30.10 1fiu n GLU 162 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1fiu n ASN 163 N -1.19 3.03 -3.98 -1.84 3.02 -1.26 -4.87 115.26 108.16 1fiu n ASN 163 Ca 0.13 -2.19 -0.10 0.00 -0.03 0.00 0.00 54.58 52.39 1fiu n ASN 163 Cb 0.15 -0.27 -0.11 0.00 -0.61 0.00 0.00 39.78 38.93 1fiu n ASN 163 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1fiu s ILE 164 N -1.33 0.18 -1.49 2.41 1.10 -1.23 -4.86 121.20 115.98 1fiu s ILE 164 Ca 0.25 -0.85 -0.08 0.00 -0.51 0.00 0.00 60.65 59.47 1fiu s ILE 164 Cb 0.15 -0.30 0.06 0.00 0.15 0.00 0.00 42.46 42.52 1fiu s ILE 164 CO 0.13 -0.42 0.67 0.00 -2.11 0.00 0.00 174.94 173.22 1fiu n ALA 165 N 1.73 -1.67 0.80 1.50 0.00 -1.26 -4.61 120.51 117.01 1fiu n ALA 165 Ca -0.22 -0.09 0.11 0.00 0.00 0.00 0.00 53.44 53.23 1fiu n ALA 165 Cb 0.55 -2.69 0.49 0.00 0.00 0.00 0.00 19.45 17.80 1fiu n ALA 165 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1fiu n THR 166 N -4.44 0.45 -0.02 0.00 -2.24 -1.26 -3.05 114.28 103.73 1fiu n THR 166 Ca -0.14 0.11 0.02 0.00 -2.27 0.00 0.00 64.05 61.77 1fiu n THR 166 Cb 0.60 -0.73 0.04 0.00 -2.10 0.00 0.00 70.33 68.14 1fiu n THR 166 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1fiu n TYR 167 N -1.47 0.12 -1.68 4.78 4.02 -1.26 -4.98 117.16 116.68 1fiu n TYR 167 Ca 0.06 -0.40 -0.45 0.00 -0.01 0.00 0.00 57.90 57.10 1fiu n TYR 167 Cb 0.25 -0.03 -0.04 0.00 -0.02 0.00 0.00 39.34 39.50 1fiu n TYR 167 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1fiu n ALA 168 N -0.11 1.62 -0.19 -0.72 0.00 -1.17 -4.87 120.51 115.07 1fiu n ALA 168 Ca 0.03 0.40 0.13 0.00 0.00 0.00 0.00 53.44 54.00 1fiu n ALA 168 Cb 0.26 -2.43 0.44 0.00 0.00 0.00 0.00 19.45 17.73 1fiu n ALA 168 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1fiu h SER 169 N 6.83 0.51 0.93 0.00 0.02 -1.96 -2.09 113.55 117.79 1fiu h SER 169 Ca -0.45 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 1fiu h SER 169 Cb 1.24 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.71 1fiu h SER 169 CO 0.91 0.27 0.00 0.18 -1.14 0.00 0.00 176.83 177.06 1fiu n LEU 170 N -4.50 0.43 -4.69 5.07 4.77 -1.26 -4.79 117.00 112.02 1fiu n LEU 170 Ca 0.14 0.57 -0.42 0.00 -0.03 0.00 0.00 56.01 56.28 1fiu n LEU 170 Cb 0.46 -0.48 -0.03 0.00 -2.33 0.00 0.00 43.42 41.04 1fiu n LEU 170 CO 0.32 -0.28 0.73 -0.13 -1.33 0.00 0.00 177.39 176.70 1fiu s ARG 171 N -3.13 4.44 0.40 3.23 0.52 -0.79 -0.87 118.95 122.76 1fiu s ARG 171 Ca 0.08 1.35 -0.25 0.00 -0.52 0.00 0.00 55.73 56.39 1fiu s ARG 171 Cb 0.12 -3.52 -0.08 0.00 0.52 0.00 0.00 34.95 31.98 1fiu s ARG 171 CO 0.45 -0.24 1.14 0.00 0.02 0.00 0.00 175.30 176.67 1fiu s ALA 172 N 1.75 3.13 0.00 2.13 0.00 -1.08 -4.16 121.76 123.53 1fiu s ALA 172 Ca 0.48 0.91 0.00 0.00 0.00 0.00 0.00 51.96 53.35 1fiu s ALA 172 Cb -0.19 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.57 1fiu s ALA 172 CO 0.20 -0.47 0.00 0.41 0.00 0.00 0.00 175.76 175.89 1fiu n GLY 173 N 0.57 3.39 0.22 0.00 0.00 -1.26 -4.91 105.19 103.21 1fiu n GLY 173 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1fiu n GLY 173 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1fiu n ASN 174 N 0.01 0.07 0.00 1.61 5.15 -1.26 -4.33 115.26 116.50 1fiu n ASN 174 Ca 0.00 -0.31 0.00 0.00 -0.60 0.00 0.00 54.58 53.67 1fiu n ASN 174 Cb 0.00 -0.03 0.00 0.00 -0.53 0.00 0.00 39.78 39.22 1fiu n ASN 174 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1fiu n GLY 175 N -0.00 0.65 3.79 8.20 0.00 -1.26 -5.02 105.19 111.55 1fiu n GLY 175 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1fiu n GLY 175 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1fiu s ASN 176 N -2.00 5.92 0.41 1.61 2.47 -1.26 -5.09 114.94 117.00 1fiu s ASN 176 Ca 0.00 1.95 0.08 0.00 0.42 0.00 0.00 52.86 55.31 1fiu s ASN 176 Cb 0.00 -2.55 -0.04 0.00 -1.45 0.00 0.00 41.25 37.21 1fiu s ASN 176 CO 0.00 -1.07 0.28 -0.04 -3.72 0.00 0.00 177.10 172.55 1fiu s MET 177 N -3.59 2.40 0.94 0.43 -1.94 -1.26 -4.61 119.30 111.66 1fiu s MET 177 Ca 0.67 -1.66 -0.11 0.00 -1.71 0.00 0.00 55.69 52.88 1fiu s MET 177 Cb -0.18 -2.21 0.15 0.00 2.01 0.00 0.00 34.83 34.61 1fiu s MET 177 CO 0.29 -0.14 1.10 -2.14 -0.01 0.00 0.00 175.02 174.12 1fiu s PRO 178 N -4.02 0.90 -0.11 2.03 0.02 -1.26 -4.37 135.00 128.20 1fiu s PRO 178 Ca 0.44 1.11 -0.07 0.00 0.02 0.00 0.00 61.00 62.50 1fiu s PRO 178 Cb -0.00 -1.75 -0.04 0.00 0.02 0.00 0.00 34.50 32.73 1fiu s PRO 178 CO 0.25 -2.57 0.16 -0.51 -0.33 0.00 0.00 177.00 174.01 1fiu s LEU 179 N -6.50 4.40 -0.30 -5.54 1.43 -0.22 -0.78 118.68 111.16 1fiu s LEU 179 Ca 0.65 0.51 -0.26 0.00 -1.03 0.00 0.00 54.13 54.00 1fiu s LEU 179 Cb -0.21 -2.13 0.01 0.00 0.03 0.00 0.00 46.19 43.88 1fiu s LEU 179 CO 0.59 0.40 0.90 -0.22 0.23 0.00 0.00 176.35 178.24 1fiu s LEU 180 N -1.07 4.04 -0.12 1.79 2.96 -1.26 -0.64 118.68 124.37 1fiu s LEU 180 Ca 0.16 0.85 -0.07 0.00 -0.22 0.00 0.00 54.13 54.85 1fiu s LEU 180 Cb -0.12 -3.26 -0.26 0.00 0.50 0.00 0.00 46.19 43.04 1fiu s LEU 180 CO 0.05 -0.70 0.37 1.57 -1.32 0.00 0.00 176.35 176.32 1fiu n HIS 181 N 6.42 1.27 -3.67 5.38 -0.00 0.81 -4.50 115.22 120.93 1fiu n HIS 181 Ca 0.07 0.27 -0.15 0.00 -0.00 0.00 0.00 57.72 57.91 1fiu n HIS 181 Cb 0.48 -1.16 -0.08 0.00 -0.00 0.00 0.00 29.99 29.22 1fiu n HIS 181 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1fiu s ALA 182 N -2.56 -1.21 -0.23 1.57 0.00 -0.79 -0.73 121.76 117.82 1fiu s ALA 182 Ca -0.22 0.88 -0.03 0.00 0.00 0.00 0.00 51.96 52.59 1fiu s ALA 182 Cb 0.07 -0.14 0.00 0.00 0.00 0.00 0.00 23.12 23.05 1fiu s ALA 182 CO 0.77 -0.29 -0.05 0.45 0.00 0.00 0.00 175.76 176.64 1fiu s SER 183 N -0.94 4.28 -0.29 0.00 0.15 0.50 -1.61 113.70 115.78 1fiu s SER 183 Ca -0.10 -0.53 0.02 0.00 0.70 0.00 0.00 55.95 56.04 1fiu s SER 183 Cb -0.03 -1.72 0.07 0.00 -1.71 0.00 0.00 66.02 62.63 1fiu s SER 183 CO 0.05 -0.05 -0.03 -0.63 1.20 0.00 0.00 173.24 173.78 1fiu s ILE 184 N 1.44 2.48 -0.01 6.45 1.01 -0.14 -1.60 121.20 130.82 1fiu s ILE 184 Ca 0.04 -1.72 -0.17 0.00 0.00 0.00 0.00 60.65 58.80 1fiu s ILE 184 Cb -0.15 -2.53 -0.05 0.00 0.01 0.00 0.00 42.46 39.74 1fiu s ILE 184 CO -0.04 -0.19 0.48 -0.55 0.00 0.00 0.00 174.94 174.64 1fiu s SER 185 N 1.15 6.85 0.00 3.58 0.15 -0.36 -1.86 113.70 123.22 1fiu s SER 185 Ca -0.03 1.01 0.06 0.00 0.70 0.00 0.00 55.95 57.69 1fiu s SER 185 Cb -0.20 -2.30 -0.03 0.00 -1.71 0.00 0.00 66.02 61.79 1fiu s SER 185 CO -0.04 0.21 -0.19 0.00 1.20 0.00 0.00 173.24 174.41 1fiu s LYS 187 N -1.07 0.07 0.14 0.00 1.02 -0.29 -4.94 119.74 114.66 1fiu s LYS 187 Ca 0.13 -0.02 -0.18 0.00 0.02 0.00 0.00 55.97 55.91 1fiu s LYS 187 Cb -0.10 -1.69 -0.03 0.00 -0.52 0.00 0.00 37.83 35.48 1fiu s LYS 187 CO 0.03 -0.65 1.79 2.35 -0.92 0.00 0.00 175.35 177.94 1fiu h TRP 188 N 8.41 0.37 -3.93 3.18 -0.00 -1.90 -2.56 115.95 119.51 1fiu h TRP 188 Ca -0.15 0.01 -0.32 0.00 -0.00 0.00 0.00 58.89 58.42 1fiu h TRP 188 Cb 1.15 -0.12 -0.15 0.00 -0.00 0.00 0.00 29.16 30.04 1fiu h TRP 188 CO 0.16 0.24 -0.62 0.95 -0.00 0.00 0.00 178.44 179.17 1fiu s THR 189 N -6.15 0.45 0.03 2.65 -4.23 -1.26 -2.61 115.64 104.53 1fiu s THR 189 Ca -0.13 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.43 1fiu s THR 189 Cb 0.09 -2.59 -0.02 0.00 1.34 0.00 0.00 72.50 71.33 1fiu s THR 189 CO 0.71 -0.02 -0.15 -0.63 -0.54 0.00 0.00 174.62 173.98 1fiu s ILE 190 N -3.83 1.21 -0.02 2.99 1.01 -1.26 -4.90 121.20 116.40 1fiu s ILE 190 Ca 0.37 -0.98 0.05 0.00 0.00 0.00 0.00 60.65 60.10 1fiu s ILE 190 Cb 0.08 -1.08 -0.01 0.00 0.01 0.00 0.00 42.46 41.46 1fiu s ILE 190 CO 0.13 0.09 -0.17 -0.13 0.00 0.00 0.00 174.94 174.85 1fiu s ARG 191 N -1.03 1.51 0.63 2.79 1.81 -1.26 -4.99 118.95 118.40 1fiu s ARG 191 Ca 0.03 -0.61 0.36 0.00 -1.72 0.00 0.00 55.73 53.78 1fiu s ARG 191 Cb -0.08 -1.41 2.05 0.00 -0.45 0.00 0.00 34.95 35.06 1fiu s ARG 191 CO 0.01 0.33 2.27 0.66 -0.68 0.00 0.00 175.30 177.90 1fiu h SER 192 N 5.87 0.00 0.06 0.23 4.64 -1.97 -1.98 113.55 120.40 1fiu h SER 192 Ca -0.36 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1fiu h SER 192 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1fiu h SER 192 CO 0.48 0.00 -0.03 -2.24 -0.87 0.00 0.00 176.83 174.17 1fiu h ASP 193 N 0.00 -0.07 0.78 4.97 -0.00 -1.98 -3.34 116.42 116.78 1fiu h ASP 193 Ca 0.01 -0.45 0.00 0.00 -0.00 0.00 0.00 57.03 56.59 1fiu h ASP 193 Cb 0.09 0.02 0.00 0.00 -0.00 0.00 0.00 39.33 39.43 1fiu h ASP 193 CO -0.00 0.61 0.00 0.08 -0.00 0.00 0.00 179.24 179.93 1fiu h ARG 194 N -0.96 0.00 0.00 4.15 0.11 -1.96 -2.88 114.38 112.84 1fiu h ARG 194 Ca -0.01 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.07 1fiu h ARG 194 Cb 0.51 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.59 1fiu h ARG 194 CO 0.01 0.00 0.00 0.00 0.10 0.00 0.00 179.97 180.08 1fiu h ALA 195 N 2.19 1.00 0.00 0.08 0.00 -1.48 -3.18 119.26 117.86 1fiu h ALA 195 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fiu h ALA 195 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1fiu h ALA 195 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.29 1fiu n GLN 196 N -2.52 0.12 0.25 0.00 1.13 -1.09 -2.27 117.38 113.01 1fiu n GLN 196 Ca 0.03 0.35 0.17 0.00 -1.94 0.00 0.00 57.00 55.61 1fiu n GLN 196 Cb 0.33 -1.73 0.79 0.00 0.11 0.00 0.00 30.24 29.74 1fiu n GLN 196 CO 0.00 0.00 0.00 -2.95 -1.44 0.00 0.00 177.06 172.67 1fiu h ASN 197 N 0.00 0.00 0.12 1.08 -1.07 -1.79 -1.08 115.58 112.84 1fiu h ASN 197 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 56.30 56.25 1fiu h ASN 197 Cb 0.33 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.57 1fiu h ASN 197 CO 0.00 0.00 -0.40 0.00 0.07 0.00 0.00 177.43 177.10 1fiu h ALA 198 N 2.05 1.01 -0.16 4.14 0.00 -1.73 -1.17 119.26 123.40 1fiu h ALA 198 Ca 0.00 -0.42 -0.17 0.00 0.00 0.00 0.00 54.91 54.32 1fiu h ALA 198 Cb 0.27 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.97 1fiu h ALA 198 CO 0.00 0.61 -0.57 0.00 0.00 0.00 0.00 179.25 179.29 1fiu h ARG 199 N 0.31 0.67 -0.27 0.00 3.08 -1.40 -1.61 114.38 115.16 1fiu h ARG 199 Ca 0.03 -0.51 -0.13 0.00 0.07 0.00 0.00 59.98 59.44 1fiu h ARG 199 Cb 0.85 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.98 1fiu h ARG 199 CO 0.07 1.13 -0.37 0.66 -1.07 0.00 0.00 179.97 180.39 1fiu h SER 200 N 0.35 0.66 -0.51 7.04 4.64 -1.34 -0.66 113.55 123.74 1fiu h SER 200 Ca -0.03 -0.28 -0.12 0.00 -0.47 0.00 0.00 61.79 60.89 1fiu h SER 200 Cb 1.20 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 63.09 1fiu h SER 200 CO 0.12 0.96 -0.15 -0.33 -0.87 0.00 0.00 176.83 176.57 1fiu h GLU 201 N 0.52 1.00 -0.81 4.77 5.08 -1.25 -1.58 114.58 122.31 1fiu h GLU 201 Ca 0.05 -0.39 -0.02 0.00 -1.00 0.00 0.00 59.36 57.99 1fiu h GLU 201 Cb 0.88 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.04 1fiu h GLU 201 CO 0.08 1.07 0.42 0.78 -1.00 0.00 0.00 179.01 180.36 1fiu h GLY 202 N 0.86 1.23 1.66 -3.84 0.00 -1.04 -2.04 103.07 99.91 1fiu h GLY 202 Ca 0.13 -0.58 -0.08 0.00 0.00 0.00 0.00 47.33 46.79 1fiu h GLY 202 CO 0.06 0.56 -0.23 1.41 0.00 0.00 0.00 176.54 178.33 1fiu h LEU 203 N 1.14 0.40 -0.72 3.11 3.38 -0.83 -1.20 115.31 120.58 1fiu h LEU 203 Ca 0.28 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 58.03 1fiu h LEU 203 Cb 0.07 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1fiu h LEU 203 CO -0.04 0.64 -0.05 0.78 0.09 0.00 0.00 178.44 179.86 1fiu h ASN 204 N 0.36 0.92 -0.38 -0.43 2.35 -0.86 0.75 115.58 118.29 1fiu h ASN 204 Ca 0.06 -0.27 -0.09 0.00 -0.55 0.00 0.00 56.30 55.45 1fiu h ASN 204 Cb 0.61 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.71 1fiu h ASN 204 CO 0.04 1.00 -0.08 -0.07 -1.65 0.00 0.00 177.43 176.67 1fiu h LEU 205 N 0.85 0.80 0.21 1.61 3.38 -0.91 -2.31 115.31 118.94 1fiu h LEU 205 Ca 0.15 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1fiu h LEU 205 Cb 0.57 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1fiu h LEU 205 CO 0.03 0.91 -0.10 0.58 0.09 0.00 0.00 178.44 179.96 1fiu h VAL 206 N 0.74 0.88 0.00 1.22 2.07 -0.89 -3.19 116.25 117.08 1fiu h VAL 206 Ca 0.13 -0.63 -0.04 0.00 0.82 0.00 0.00 66.70 66.98 1fiu h VAL 206 Cb 0.57 1.25 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 1fiu h VAL 206 CO 0.03 0.14 -0.18 0.03 0.02 0.00 0.00 177.57 177.61 1fiu h ARG 207 N -0.60 0.00 -0.23 1.57 3.08 -0.81 -3.25 114.38 114.14 1fiu h ARG 207 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1fiu h ARG 207 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.49 1fiu h ARG 207 CO 0.05 0.18 0.00 0.09 -1.07 0.00 0.00 179.97 179.22 1fiu n ASN 208 N -4.04 2.75 -4.79 7.04 3.02 -0.87 -5.03 115.26 113.33 1fiu n ASN 208 Ca -0.02 -1.81 -0.34 0.00 -0.03 0.00 0.00 54.58 52.38 1fiu n ASN 208 Cb 0.26 -0.15 -0.03 0.00 -0.61 0.00 0.00 39.78 39.26 1fiu n ASN 208 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fiu s ARG 209 N -1.17 3.78 -0.29 3.52 1.70 -1.20 -4.78 118.95 120.51 1fiu s ARG 209 Ca 0.25 1.39 0.01 0.00 -0.47 0.00 0.00 55.73 56.90 1fiu s ARG 209 Cb 0.15 -2.11 0.09 0.00 -0.57 0.00 0.00 34.95 32.51 1fiu s ARG 209 CO 0.21 -0.45 0.04 0.15 -1.08 0.00 0.00 175.30 174.17 1fiu s LYS 210 N -3.20 1.15 0.00 3.89 1.02 -0.77 -5.04 119.74 116.79 1fiu s LYS 210 Ca 0.67 -1.20 0.00 0.00 0.02 0.00 0.00 55.97 55.46 1fiu s LYS 210 Cb -0.17 -2.46 0.00 0.00 -0.52 0.00 0.00 37.83 34.68 1fiu s LYS 210 CO 0.21 -0.84 0.00 0.41 -0.92 0.00 0.00 175.35 174.20 1fiu n GLY 211 N 4.67 0.04 3.76 -3.33 0.00 -1.26 -4.07 105.19 105.00 1fiu n GLY 211 Ca -0.04 -2.29 -0.41 0.00 0.00 0.00 0.00 46.02 43.29 1fiu n GLY 211 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1fiu s ARG 212 N -0.18 4.45 0.30 1.61 3.52 -1.26 -4.97 118.95 122.42 1fiu s ARG 212 Ca 0.00 2.04 -0.29 0.00 -0.13 0.00 0.00 55.73 57.34 1fiu s ARG 212 Cb 0.00 -3.15 -0.10 0.00 -1.56 0.00 0.00 34.95 30.14 1fiu s ARG 212 CO 0.00 -0.09 1.44 -1.17 -0.81 0.00 0.00 175.30 174.67 1fiu s LEU 213 N -1.12 4.38 0.93 -0.88 2.96 -1.26 -4.99 118.68 118.70 1fiu s LEU 213 Ca 0.50 2.78 -0.12 0.00 -0.22 0.00 0.00 54.13 57.08 1fiu s LEU 213 Cb -0.36 -3.64 0.15 0.00 0.50 0.00 0.00 46.19 42.84 1fiu s LEU 213 CO 0.44 -0.72 1.09 -2.84 -1.32 0.00 0.00 176.35 173.00 1fiu s PRO 214 N -1.05 0.94 0.44 0.98 0.02 -1.26 -4.97 135.00 130.10 1fiu s PRO 214 Ca 0.56 0.84 -0.25 0.00 0.02 0.00 0.00 61.00 62.16 1fiu s PRO 214 Cb -0.43 -1.77 -0.08 0.00 0.02 0.00 0.00 34.50 32.24 1fiu s PRO 214 CO 0.50 -2.46 1.39 -1.01 -0.33 0.00 0.00 177.00 175.09 1fiu s HIS 215 N -2.87 2.55 -0.24 6.54 3.76 0.09 -4.85 115.29 120.26 1fiu s HIS 215 Ca 0.64 1.30 -0.01 0.00 -0.15 0.00 0.00 55.06 56.85 1fiu s HIS 215 Cb -0.19 -3.85 0.07 0.00 1.11 0.00 0.00 32.58 29.72 1fiu s HIS 215 CO 0.58 -2.72 0.03 0.42 -0.85 0.00 0.00 174.74 172.20 1fiu s ILE 216 N -1.22 0.94 0.19 0.60 1.01 -1.26 -0.37 121.20 121.08 1fiu s ILE 216 Ca 0.60 -1.02 0.02 0.00 0.00 0.00 0.00 60.65 60.25 1fiu s ILE 216 Cb -0.42 -1.46 -0.05 0.00 0.01 0.00 0.00 42.46 40.54 1fiu s ILE 216 CO 0.54 -0.33 0.02 0.68 0.00 0.00 0.00 174.94 175.85 1fiu s VAL 217 N 1.64 0.66 -0.03 2.92 -7.23 -0.63 -0.30 120.40 117.44 1fiu s VAL 217 Ca 0.01 -1.99 0.04 0.00 -1.81 0.00 0.00 61.98 58.23 1fiu s VAL 217 Cb -0.18 -2.22 -0.00 0.00 0.56 0.00 0.00 36.38 34.54 1fiu s VAL 217 CO -0.12 -0.38 -0.13 -0.69 -0.31 0.00 0.00 175.10 173.46 1fiu s VAL 218 N -3.67 1.11 -0.08 1.32 1.01 -1.09 -1.23 120.40 117.78 1fiu s VAL 218 Ca 0.27 -0.56 0.04 0.00 0.00 0.00 0.00 61.98 61.73 1fiu s VAL 218 Cb 0.06 -0.96 -0.01 0.00 0.00 0.00 0.00 36.38 35.47 1fiu s VAL 218 CO 0.06 0.33 -0.21 -0.69 0.00 0.00 0.00 175.10 174.59 1fiu s VAL 219 N 0.01 2.44 0.03 2.92 1.01 0.90 -0.22 120.40 127.50 1fiu s VAL 219 Ca -0.01 -0.92 -0.04 0.00 0.00 0.00 0.00 61.98 61.01 1fiu s VAL 219 Cb -0.09 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.34 1fiu s VAL 219 CO 0.01 0.56 0.05 0.28 0.00 0.00 0.00 175.10 176.00 1fiu s THR 220 N -0.11 0.14 -0.58 3.92 -1.32 -0.41 -1.14 115.64 116.14 1fiu s THR 220 Ca -0.04 -1.16 0.12 0.00 -1.21 0.00 0.00 61.69 59.40 1fiu s THR 220 Cb -0.14 -0.85 0.35 0.00 -1.51 0.00 0.00 72.50 70.36 1fiu s THR 220 CO 0.04 -0.64 1.28 0.00 -2.21 0.00 0.00 174.62 173.09 1fiu n ALA 221 N 0.86 2.43 -1.71 11.08 0.00 -0.97 -0.99 120.51 131.22 1fiu n ALA 221 Ca -0.19 -1.56 -0.43 0.00 0.00 0.00 0.00 53.44 51.25 1fiu n ALA 221 Cb 0.58 -0.49 -0.03 0.00 0.00 0.00 0.00 19.45 19.51 1fiu n ALA 221 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1fiu n GLU 222 N 0.03 2.69 0.14 0.00 4.07 -1.07 -4.83 120.64 121.67 1fiu n GLU 222 Ca 0.14 0.97 0.02 0.00 -0.06 0.00 0.00 57.16 58.23 1fiu n GLU 222 Cb 0.57 -2.82 0.05 0.00 -0.06 0.00 0.00 31.44 29.18 1fiu n GLU 222 CO 0.00 0.00 0.00 -1.00 -0.06 0.00 0.00 177.13 176.07 1fiu h PRO 223 N 7.07 0.00 -5.76 5.31 0.13 -1.90 -3.46 132.00 133.40 1fiu h PRO 223 Ca -0.44 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.11 1fiu h PRO 223 Cb 1.21 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.27 1fiu h PRO 223 CO 0.95 0.53 -0.17 0.95 -0.23 0.00 0.00 178.00 180.03 1fiu s THR 224 N -3.00 5.17 0.36 1.56 -4.23 -1.26 -4.90 115.64 109.33 1fiu s THR 224 Ca 0.03 0.90 0.07 0.00 -1.18 0.00 0.00 61.69 61.51 1fiu s THR 224 Cb 0.08 -3.78 0.30 0.00 1.34 0.00 0.00 72.50 70.44 1fiu s THR 224 CO 0.74 0.37 1.93 -0.65 -0.54 0.00 0.00 174.62 176.48 1fiu h PRO 225 N 6.39 0.73 -0.32 3.99 0.11 -1.89 -1.21 132.00 139.80 1fiu h PRO 225 Ca -0.43 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 1fiu h PRO 225 Cb 1.18 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 1fiu h PRO 225 CO 0.73 0.48 0.19 0.66 -0.21 0.00 0.00 178.00 179.85 1fiu h SER 226 N 0.75 0.39 -0.07 -2.05 4.64 -1.93 0.91 113.55 116.19 1fiu h SER 226 Ca 0.35 -0.06 -0.17 0.00 -0.47 0.00 0.00 61.79 61.44 1fiu h SER 226 Cb 0.38 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1fiu h SER 226 CO -0.13 0.34 -0.53 0.03 -0.87 0.00 0.00 176.83 175.67 1fiu h ARG 227 N 0.41 0.65 -0.90 4.77 3.08 -1.83 -2.78 114.38 117.78 1fiu h ARG 227 Ca 0.11 -0.40 0.01 0.00 0.07 0.00 0.00 59.98 59.77 1fiu h ARG 227 Cb 0.02 0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.07 1fiu h ARG 227 CO -0.02 1.02 0.59 0.82 -1.07 0.00 0.00 179.97 181.31 1fiu h ILE 228 N 0.50 1.22 0.00 2.04 2.04 -1.01 -2.41 117.51 119.88 1fiu h ILE 228 Ca 0.01 -0.41 -0.00 0.00 1.00 0.00 0.00 64.86 65.46 1fiu h ILE 228 Cb 1.09 -0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1fiu h ILE 228 CO 0.11 0.22 -0.01 0.77 0.00 0.00 0.00 178.15 179.23 1fiu h SER 229 N 1.20 0.00 0.48 1.72 4.64 -0.53 -1.08 113.55 119.98 1fiu h SER 229 Ca 0.33 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.65 1fiu h SER 229 Cb -0.12 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 61.97 1fiu h SER 229 CO -0.08 0.01 -0.00 0.77 -0.87 0.00 0.00 176.83 176.66 1fiu h SER 230 N 0.00 0.00 0.00 4.97 4.64 -1.37 -2.13 113.55 119.65 1fiu h SER 230 Ca -0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1fiu h SER 230 Cb 0.05 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.13 1fiu h SER 230 CO 0.00 0.00 -1.14 0.00 -0.87 0.00 0.00 176.83 174.83 1fiu n ILE 231 N -3.09 0.10 0.08 0.95 0.13 -0.76 -4.80 119.36 111.98 1fiu n ILE 231 Ca -0.01 -0.08 -0.16 0.00 -1.10 0.00 0.00 62.75 61.40 1fiu n ILE 231 Cb 0.18 -0.48 -0.08 0.00 -0.84 0.00 0.00 39.64 38.42 1fiu n ILE 231 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1fiu h ALA 232 N 0.14 0.23 -2.52 1.51 0.00 -1.17 -3.46 119.26 113.99 1fiu h ALA 232 Ca -0.04 -0.76 -0.49 0.00 0.00 0.00 0.00 54.91 53.62 1fiu h ALA 232 Cb 0.79 0.01 0.05 0.00 0.00 0.00 0.00 17.79 18.65 1fiu h ALA 232 CO 0.00 0.83 0.42 -0.51 0.00 0.00 0.00 179.25 180.00 1fiu s LEU 233 N -7.62 3.84 0.00 0.00 1.43 -0.81 -4.83 118.68 110.69 1fiu s LEU 233 Ca -0.06 2.11 0.00 0.00 -1.03 0.00 0.00 54.13 55.15 1fiu s LEU 233 Cb 0.08 -4.50 0.00 0.00 0.03 0.00 0.00 46.19 41.80 1fiu s LEU 233 CO 0.88 -1.00 0.00 0.61 0.23 0.00 0.00 176.35 177.08 1fiu n GLY 234 N 0.09 -0.03 3.19 -3.19 0.00 -1.26 -4.98 105.19 99.00 1fiu n GLY 234 Ca 0.10 -1.75 -0.11 0.00 0.00 0.00 0.00 46.02 44.25 1fiu n GLY 234 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fiu s THR 235 N -2.35 0.46 0.00 2.61 -4.23 -1.26 -4.92 115.64 105.94 1fiu s THR 235 Ca 0.00 -1.93 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 1fiu s THR 235 Cb 0.00 -1.96 0.00 0.00 1.34 0.00 0.00 72.50 71.88 1fiu s THR 235 CO 0.00 -0.59 0.00 0.61 -0.54 0.00 0.00 174.62 174.10 1fiu n GLY 236 N -0.13 0.67 0.56 3.99 0.00 -1.26 -4.91 105.19 104.11 1fiu n GLY 236 Ca -0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.83 1fiu n GLY 236 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1fiu n GLU 237 N -0.01 0.24 -4.09 1.61 4.71 -1.26 -4.89 120.64 116.96 1fiu n GLU 237 Ca 0.00 0.10 -0.35 0.00 -0.01 0.00 0.00 57.16 56.90 1fiu n GLU 237 Cb 0.00 -0.94 -0.12 0.00 -1.01 0.00 0.00 31.44 29.37 1fiu n GLU 237 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 1fiu s ILE 238 N -2.20 4.10 0.07 -3.67 -1.09 -1.26 -4.67 121.20 112.48 1fiu s ILE 238 Ca -0.15 -0.27 -0.21 0.00 -2.23 0.00 0.00 60.65 57.79 1fiu s ILE 238 Cb 0.06 -2.85 -0.12 0.00 -1.58 0.00 0.00 42.46 37.97 1fiu s ILE 238 CO 0.20 0.43 1.58 0.44 -1.23 0.00 0.00 174.94 176.37 1fiu h ASP 239 N 7.31 0.20 -4.36 3.58 3.32 -1.05 -3.47 116.42 121.96 1fiu h ASP 239 Ca -0.35 -0.20 0.13 0.00 0.02 0.00 0.00 57.03 56.63 1fiu h ASP 239 Cb 1.18 -0.05 -0.19 0.00 0.22 0.00 0.00 39.33 40.49 1fiu h ASP 239 CO 0.62 0.35 0.59 0.00 -1.72 0.00 0.00 179.24 179.08 1fiu s VAL 241 N -2.31 3.59 -0.09 0.00 1.01 -0.53 -2.69 120.40 119.37 1fiu s VAL 241 Ca 0.04 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.22 1fiu s VAL 241 Cb -0.01 -2.57 0.01 0.00 0.00 0.00 0.00 36.38 33.81 1fiu s VAL 241 CO -0.05 0.37 -0.18 -0.31 0.00 0.00 0.00 175.10 174.93 1fiu s TYR 242 N -1.01 2.08 -0.01 5.22 1.51 0.70 -1.20 117.35 124.63 1fiu s TYR 242 Ca 0.17 -0.88 -0.14 0.00 -1.01 0.00 0.00 57.07 55.21 1fiu s TYR 242 Cb -0.11 -1.45 -0.06 0.00 -0.11 0.00 0.00 41.96 40.24 1fiu s TYR 242 CO 0.08 -0.40 0.39 -1.58 -1.11 0.00 0.00 175.55 172.93 1fiu s HIS 243 N 0.63 3.71 0.12 2.71 2.46 0.18 -1.29 115.29 123.81 1fiu s HIS 243 Ca -0.14 0.96 0.33 0.00 0.47 0.00 0.00 55.06 56.68 1fiu s HIS 243 Cb -0.16 -2.28 1.62 0.00 -0.13 0.00 0.00 32.58 31.63 1fiu s HIS 243 CO 0.04 0.62 2.00 0.27 -2.47 0.00 0.00 174.74 175.20 1fiu h PHE 244 N 4.85 0.00 -0.44 3.88 -0.00 -1.39 0.19 116.94 124.02 1fiu h PHE 244 Ca -0.51 0.00 -0.29 0.00 -0.00 0.00 0.00 57.97 57.16 1fiu h PHE 244 Cb 1.22 0.00 -0.20 0.00 -0.00 0.00 0.00 35.95 36.97 1fiu h PHE 244 CO 0.71 0.00 -0.62 0.00 -0.00 0.00 0.00 178.31 178.40 1fiu n ALA 245 N -1.96 -0.33 -0.18 12.09 0.00 -1.26 -4.72 120.51 124.14 1fiu n ALA 245 Ca -0.01 -1.87 -0.08 0.00 0.00 0.00 0.00 53.44 51.49 1fiu n ALA 245 Cb 0.15 -1.15 0.02 0.00 0.00 0.00 0.00 19.45 18.47 1fiu n ALA 245 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1fiu h LEU 246 N 3.39 0.66 -0.73 0.00 5.85 -1.88 -1.45 115.31 121.15 1fiu h LEU 246 Ca -0.07 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.54 1fiu h LEU 246 Cb 1.04 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.87 1fiu h LEU 246 CO 0.27 0.58 0.46 1.88 -0.34 0.00 0.00 178.44 181.29 1fiu h TYR 247 N 0.69 0.95 -0.41 1.25 0.99 -1.95 -0.40 116.97 118.09 1fiu h TYR 247 Ca 0.18 0.01 -0.14 0.00 2.00 0.00 0.00 58.73 60.78 1fiu h TYR 247 Cb 0.08 -0.31 -0.01 0.00 1.00 0.00 0.00 36.73 37.49 1fiu h TYR 247 CO -0.01 0.62 -0.31 0.93 -0.00 0.00 0.00 178.16 179.39 1fiu h GLU 248 N 1.00 0.90 -0.37 4.88 3.07 -1.93 -0.94 114.58 121.19 1fiu h GLU 248 Ca 0.26 -0.43 -0.00 0.00 -0.50 0.00 0.00 59.36 58.70 1fiu h GLU 248 Cb -0.07 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 27.82 1fiu h GLU 248 CO -0.05 1.08 0.23 1.25 -1.40 0.00 0.00 179.01 180.11 1fiu h LEU 249 N 0.76 0.44 -0.64 1.33 5.85 -0.89 -0.69 115.31 121.48 1fiu h LEU 249 Ca 0.08 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1fiu h LEU 249 Cb 0.88 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.77 1fiu h LEU 249 CO 0.08 0.36 0.35 -0.08 -0.34 0.00 0.00 178.44 178.82 1fiu h GLU 250 N 0.49 0.89 -0.58 1.25 4.81 -0.90 -1.40 114.58 119.14 1fiu h GLU 250 Ca 0.13 -0.10 -0.04 0.00 -0.13 0.00 0.00 59.36 59.22 1fiu h GLU 250 Cb -0.00 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.18 1fiu h GLU 250 CO -0.03 0.67 0.20 0.37 -0.73 0.00 0.00 179.01 179.49 1fiu h GLN 251 N 0.87 0.88 -0.37 1.92 4.15 -0.86 -1.54 115.11 120.16 1fiu h GLN 251 Ca 0.22 -0.18 -0.09 0.00 0.77 0.00 0.00 58.65 59.38 1fiu h GLN 251 Cb 0.04 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.58 1fiu h GLN 251 CO -0.04 0.78 -0.13 0.82 -1.93 0.00 0.00 178.83 178.34 1fiu h ILE 252 N 0.81 1.28 -0.73 2.39 1.08 -0.90 0.62 117.51 122.05 1fiu h ILE 252 Ca 0.19 -1.22 0.02 0.00 -0.39 0.00 0.00 64.86 63.46 1fiu h ILE 252 Cb 0.25 1.31 -0.04 0.00 -3.07 0.00 0.00 36.82 35.26 1fiu h ILE 252 CO -0.01 0.40 0.47 -0.07 -0.69 0.00 0.00 178.15 178.25 1fiu h LEU 253 N 0.53 0.78 -0.30 1.44 3.38 -1.15 -0.84 115.31 119.16 1fiu h LEU 253 Ca 0.09 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1fiu h LEU 253 Cb 0.65 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1fiu h LEU 253 CO 0.04 0.55 0.04 1.56 0.09 0.00 0.00 178.44 180.72 1fiu h GLN 254 N 0.93 0.50 -0.24 1.13 1.08 -1.06 -1.90 115.11 115.54 1fiu h GLN 254 Ca 0.29 -0.14 0.02 0.00 -1.45 0.00 0.00 58.65 57.37 1fiu h GLN 254 Cb -0.02 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.33 1fiu h GLN 254 CO -0.10 0.61 0.11 0.77 -0.95 0.00 0.00 178.83 179.28 1fiu h SER 255 N 0.31 0.16 0.39 1.46 0.02 -0.47 -2.66 113.55 112.77 1fiu h SER 255 Ca 0.09 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1fiu h SER 255 Cb 0.36 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.88 1fiu h SER 255 CO 0.01 0.13 -0.01 0.18 -1.14 0.00 0.00 176.83 175.99 1fiu n LEU 256 N -4.99 0.07 -3.78 5.07 4.77 -0.35 -4.95 117.00 112.84 1fiu n LEU 256 Ca -0.02 0.17 -0.24 0.00 -0.03 0.00 0.00 56.01 55.89 1fiu n LEU 256 Cb 0.07 -0.19 0.03 0.00 -2.33 0.00 0.00 43.42 40.99 1fiu n LEU 256 CO 0.31 0.01 -0.05 0.59 -1.33 0.00 0.00 177.39 176.93 1fiu n ASN 257 N -1.15 -1.88 -4.48 -1.43 3.02 -0.74 -4.87 115.26 103.73 1fiu n ASN 257 Ca 0.17 -0.83 -0.44 0.00 -0.03 0.00 0.00 54.58 53.45 1fiu n ASN 257 Cb 0.21 -3.91 -0.01 0.00 -0.61 0.00 0.00 39.78 35.46 1fiu n ASN 257 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1fiu s TYR 258 N -3.62 3.27 0.20 3.10 4.12 -1.09 -4.87 117.35 118.46 1fiu s TYR 258 Ca 0.15 -1.82 -0.10 0.00 0.02 0.00 0.00 57.07 55.32 1fiu s TYR 258 Cb -0.08 -4.38 0.26 0.00 -1.52 0.00 0.00 41.96 36.25 1fiu s TYR 258 CO 0.82 -1.50 1.73 0.93 0.02 0.00 0.00 175.55 177.56 1fiu h GLU 259 N 7.78 0.34 -0.19 -0.62 4.39 -1.89 0.31 114.58 124.70 1fiu h GLU 259 Ca 0.29 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.93 1fiu h GLU 259 Cb 0.92 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.48 1fiu h GLU 259 CO 1.24 0.23 -0.00 -0.44 -1.16 0.00 0.00 179.01 178.88 1fiu h ASP 260 N 0.35 0.33 -0.66 1.42 3.32 -1.99 -0.20 116.42 118.99 1fiu h ASP 260 Ca 0.30 -0.31 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 1fiu h ASP 260 Cb 0.38 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.81 1fiu h ASP 260 CO -0.32 0.56 0.39 0.00 -1.72 0.00 0.00 179.24 178.15 1fiu h ALA 261 N 0.78 1.42 -0.26 3.45 0.00 -1.93 -0.48 119.26 122.25 1fiu h ALA 261 Ca 0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1fiu h ALA 261 Cb 0.39 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1fiu h ALA 261 CO 0.01 0.49 0.11 -0.07 0.00 0.00 0.00 179.25 179.79 1fiu h LEU 262 N 0.92 0.36 -0.70 0.00 3.38 -0.69 0.11 115.31 118.70 1fiu h LEU 262 Ca 0.24 -0.16 0.05 0.00 0.09 0.00 0.00 57.88 58.11 1fiu h LEU 262 Cb -0.01 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.59 1fiu h LEU 262 CO -0.04 0.42 0.41 0.44 0.09 0.00 0.00 178.44 179.76 1fiu h ASP 263 N 0.28 0.62 -0.35 -0.43 3.32 -0.28 -0.74 116.42 118.83 1fiu h ASP 263 Ca 0.09 0.02 -0.14 0.00 0.02 0.00 0.00 57.03 57.02 1fiu h ASP 263 Cb 0.17 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1fiu h ASP 263 CO -0.01 0.40 -0.31 0.25 -1.72 0.00 0.00 179.24 177.85 1fiu h LEU 264 N 0.75 0.88 -0.21 1.55 5.85 -0.83 -1.49 115.31 121.82 1fiu h LEU 264 Ca 0.31 -0.46 0.04 0.00 0.84 0.00 0.00 57.88 58.61 1fiu h LEU 264 Cb 0.16 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 1fiu h LEU 264 CO -0.17 1.16 -0.04 0.15 -0.34 0.00 0.00 178.44 179.20 1fiu h PHE 265 N 0.62 -0.09 0.00 1.25 3.57 -0.38 -1.54 116.94 120.37 1fiu h PHE 265 Ca 0.06 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.50 1fiu h PHE 265 Cb 0.89 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.70 1fiu h PHE 265 CO 0.07 -0.08 -0.36 1.88 -2.23 0.00 0.00 178.31 177.59 1fiu h TYR 266 N 0.01 0.00 -0.46 0.41 -1.99 -1.03 0.03 116.97 113.96 1fiu h TYR 266 Ca 0.10 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.81 1fiu h TYR 266 Cb 0.15 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.86 1fiu h TYR 266 CO -0.22 0.36 0.20 0.82 -0.00 0.00 0.00 178.16 179.32 1fiu h ILE 267 N 0.00 1.20 -0.25 -2.88 2.04 -0.67 0.26 117.51 117.21 1fiu h ILE 267 Ca -0.00 -0.59 -0.13 0.00 1.00 0.00 0.00 64.86 65.14 1fiu h ILE 267 Cb 0.76 0.74 -0.00 0.00 -0.74 0.00 0.00 36.82 37.58 1fiu h ILE 267 CO 0.05 0.22 -0.34 0.24 0.00 0.00 0.00 178.15 178.32 1fiu h MET 268 N 0.59 0.67 -0.03 2.37 2.86 -0.97 -0.48 114.93 119.94 1fiu h MET 268 Ca 0.15 -0.39 -0.04 0.00 -2.06 0.00 0.00 59.70 57.37 1fiu h MET 268 Cb 0.17 0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.86 1fiu h MET 268 CO -0.02 1.00 -0.14 0.28 1.06 0.00 0.00 176.91 179.10 1fiu h VAL 269 N 0.39 1.48 0.00 -2.22 2.07 -0.89 0.17 116.25 117.25 1fiu h VAL 269 Ca 0.03 -1.62 -0.06 0.00 0.82 0.00 0.00 66.70 65.88 1fiu h VAL 269 Cb 0.92 2.45 -0.01 0.00 -1.52 0.00 0.00 31.29 33.13 1fiu h VAL 269 CO 0.08 0.44 -0.28 0.78 0.02 0.00 0.00 177.57 178.62 1fiu h ASN 270 N -0.43 0.00 -0.20 0.57 2.35 -0.58 -2.44 115.58 114.85 1fiu h ASN 270 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1fiu h ASN 270 Cb 0.79 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.16 1fiu h ASN 270 CO 0.03 0.28 0.00 0.61 -1.65 0.00 0.00 177.43 176.69 1fiu n GLY 271 N -0.29 0.25 3.52 2.83 0.00 -0.19 -4.92 105.19 106.40 1fiu n GLY 271 Ca -0.01 -0.22 -0.26 0.00 0.00 0.00 0.00 46.02 45.53 1fiu n GLY 271 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fiu n LYS 272 N 0.11 -5.71 -0.00 1.61 4.76 -0.92 -4.86 118.16 113.15 1fiu n LYS 272 Ca 0.07 0.72 0.03 0.00 -2.87 0.00 0.00 58.31 56.26 1fiu n LYS 272 Cb 0.22 -5.62 -0.04 0.00 -1.84 0.00 0.00 35.03 27.75 1fiu n LYS 272 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1fiu n ARG 273 N -4.47 2.88 -3.78 1.97 5.12 0.56 -4.86 116.66 114.06 1fiu n ARG 273 Ca -0.01 -0.02 -0.15 0.00 -1.93 0.00 0.00 57.85 55.74 1fiu n ARG 273 Cb 0.56 -0.94 -0.16 0.00 -1.16 0.00 0.00 32.46 30.76 1fiu n ARG 273 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 1fiu s LEU 274 N -2.79 1.21 0.00 0.55 2.96 -0.90 -1.46 118.68 118.24 1fiu s LEU 274 Ca 0.00 0.03 0.03 0.00 -0.22 0.00 0.00 54.13 53.98 1fiu s LEU 274 Cb 0.04 -0.06 -0.01 0.00 0.50 0.00 0.00 46.19 46.66 1fiu s LEU 274 CO 0.25 -0.11 0.11 0.29 -1.32 0.00 0.00 176.35 175.57 1fiu n LYS 275 N 4.03 0.39 -3.51 1.98 5.02 -0.34 -4.30 118.16 121.43 1fiu n LYS 275 Ca -0.26 -1.65 -0.26 0.00 -2.02 0.00 0.00 58.31 54.13 1fiu n LYS 275 Cb 0.51 1.19 -0.02 0.00 -0.02 0.00 0.00 35.03 36.69 1fiu n LYS 275 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1fiu s ASP 276 N -2.17 6.36 0.44 4.39 2.15 -1.26 -0.64 116.67 125.93 1fiu s ASP 276 Ca 0.16 0.46 0.18 0.00 0.43 0.00 0.00 52.55 53.78 1fiu s ASP 276 Cb 0.01 -2.04 1.11 0.00 -0.30 0.00 0.00 42.92 41.70 1fiu s ASP 276 CO 0.11 -0.18 1.91 -0.29 -0.17 0.00 0.00 175.17 176.56 1fiu h ILE 277 N 1.16 0.75 0.00 4.11 6.09 -1.24 -0.03 117.51 128.35 1fiu h ILE 277 Ca -0.49 -0.12 0.00 0.00 -1.37 0.00 0.00 64.86 62.88 1fiu h ILE 277 Cb 1.20 0.36 0.00 0.00 0.47 0.00 0.00 36.82 38.86 1fiu h ILE 277 CO 0.64 0.07 0.00 0.77 -3.07 0.00 0.00 178.15 176.56 1fiu h SER 278 N 0.36 0.00 1.70 2.19 4.64 -1.94 -2.09 113.55 118.41 1fiu h SER 278 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 1fiu h SER 278 Cb 0.97 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 1fiu h SER 278 CO -0.12 0.00 -0.26 0.44 -0.87 0.00 0.00 176.83 176.02 1fiu h ASP 279 N 0.00 0.00 0.01 4.97 3.32 -1.38 -3.39 116.42 119.95 1fiu h ASP 279 Ca 0.00 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 1fiu h ASP 279 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1fiu h ASP 279 CO 0.00 0.00 -0.00 0.25 -1.72 0.00 0.00 179.24 177.77 1fiu h LEU 280 N 0.00 -0.01 -0.58 1.55 5.85 -1.44 -1.03 115.31 119.65 1fiu h LEU 280 Ca 0.00 -0.08 0.07 0.00 0.84 0.00 0.00 57.88 58.71 1fiu h LEU 280 Cb 0.98 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.95 1fiu h LEU 280 CO 0.00 0.08 0.25 -0.65 -0.34 0.00 0.00 178.44 177.78 1fiu h PRO 281 N -0.10 0.46 -0.31 5.25 0.11 -1.76 -0.43 132.00 135.22 1fiu h PRO 281 Ca -0.00 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.98 1fiu h PRO 281 Cb 0.09 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 1fiu h PRO 281 CO 0.00 0.30 -0.23 -0.07 -0.21 0.00 0.00 178.00 177.80 1fiu h LEU 282 N 0.47 0.61 -1.49 2.35 3.38 -1.78 -2.45 115.31 116.39 1fiu h LEU 282 Ca 0.28 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1fiu h LEU 282 Cb 0.27 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1fiu h LEU 282 CO -0.24 0.83 -0.23 0.44 0.09 0.00 0.00 178.44 179.33 1fiu h ASP 283 N 0.53 0.00 0.45 -0.43 3.32 -0.30 -1.13 116.42 118.86 1fiu h ASP 283 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1fiu h ASP 283 Cb 0.68 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.23 1fiu h ASP 283 CO 0.05 0.23 0.00 0.18 -1.72 0.00 0.00 179.24 177.98 1fiu n LEU 284 N -3.71 0.00 -1.11 1.55 4.77 -0.25 -3.29 117.00 114.95 1fiu n LEU 284 Ca -0.01 0.27 0.12 0.00 -0.03 0.00 0.00 56.01 56.35 1fiu n LEU 284 Cb 0.34 -0.27 0.22 0.00 -2.33 0.00 0.00 43.42 41.39 1fiu n LEU 284 CO 0.34 -0.04 0.70 0.00 -1.33 0.00 0.00 177.39 177.06 1fiu n ALA 285 N -1.27 2.43 0.40 -1.18 0.00 -0.43 -5.08 120.51 115.39 1fiu n ALA 285 Ca 0.13 -0.94 0.03 0.00 0.00 0.00 0.00 53.44 52.65 1fiu n ALA 285 Cb 0.19 -0.89 0.19 0.00 0.00 0.00 0.00 19.45 18.95 1fiu n ALA 285 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83