#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1paf s ASN 2 N 0.00 6.48 -0.02 4.52 0.01 -1.26 -4.93 114.94 119.74 1paf s ASN 2 Ca 0.00 1.05 0.07 0.00 -0.71 0.00 0.00 52.86 53.27 1paf s ASN 2 Cb 0.00 -2.29 -0.02 0.00 0.41 0.00 0.00 41.25 39.35 1paf s ASN 2 CO 0.00 -0.40 -0.21 0.28 -1.51 0.00 0.00 177.10 175.26 1paf s THR 3 N -2.39 1.66 -0.18 1.60 -1.32 -1.26 -1.45 115.64 112.31 1paf s THR 3 Ca 0.50 -0.91 -0.05 0.00 -1.21 0.00 0.00 61.69 60.02 1paf s THR 3 Cb -0.10 -1.38 -0.03 0.00 -1.51 0.00 0.00 72.50 69.48 1paf s THR 3 CO 0.33 0.47 -0.01 -0.63 -2.21 0.00 0.00 174.62 172.57 1paf s ILE 4 N -0.50 4.02 -0.16 5.08 -1.09 -0.17 -4.94 121.20 123.44 1paf s ILE 4 Ca 0.08 -0.30 -0.11 0.00 -2.23 0.00 0.00 60.65 58.08 1paf s ILE 4 Cb -0.08 -2.79 -0.05 0.00 -1.58 0.00 0.00 42.46 37.96 1paf s ILE 4 CO -0.01 0.46 0.22 -0.63 -1.23 0.00 0.00 174.94 173.76 1paf s ILE 5 N 0.63 5.35 -0.11 2.92 1.09 -1.26 -1.44 121.20 128.37 1paf s ILE 5 Ca -0.01 0.39 -0.01 0.00 -1.10 0.00 0.00 60.65 59.92 1paf s ILE 5 Cb -0.14 -3.54 0.03 0.00 -1.06 0.00 0.00 42.46 37.75 1paf s ILE 5 CO 0.02 0.46 -0.03 -0.47 -0.10 0.00 0.00 174.94 174.82 1paf s TYR 6 N 0.07 1.20 -0.50 3.97 5.04 0.51 -4.96 117.35 122.68 1paf s TYR 6 Ca 0.14 -0.61 -0.18 0.00 -2.44 0.00 0.00 57.07 53.97 1paf s TYR 6 Cb -0.12 -1.08 0.06 0.00 0.35 0.00 0.00 41.96 41.17 1paf s TYR 6 CO 0.03 -0.48 0.59 1.21 -1.34 0.00 0.00 175.55 175.56 1paf s ASN 7 N 1.80 6.21 0.21 4.32 2.47 -1.26 -0.50 114.94 128.19 1paf s ASN 7 Ca 0.04 -1.00 0.14 0.00 0.42 0.00 0.00 52.86 52.46 1paf s ASN 7 Cb -0.13 -2.27 -0.02 0.00 -1.45 0.00 0.00 41.25 37.38 1paf s ASN 7 CO -0.07 -0.86 1.29 0.58 -3.72 0.00 0.00 177.10 174.32 1paf h VAL 8 N 5.85 0.91 0.00 -5.21 2.07 -0.70 -3.25 116.25 115.92 1paf h VAL 8 Ca -0.28 -2.35 0.00 0.00 0.82 0.00 0.00 66.70 64.90 1paf h VAL 8 Cb 1.10 2.40 0.00 0.00 -1.52 0.00 0.00 31.29 33.27 1paf h VAL 8 CO 0.95 0.52 0.00 0.61 0.02 0.00 0.00 177.57 179.67 1paf n GLY 9 N 1.28 -1.14 2.94 2.17 0.00 -0.68 -4.52 105.19 105.24 1paf n GLY 9 Ca -0.01 -0.08 -0.08 0.00 0.00 0.00 0.00 46.02 45.86 1paf n GLY 9 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1paf s SER 10 N -2.89 0.16 0.29 1.61 0.15 -1.23 -4.81 113.70 106.99 1paf s SER 10 Ca 0.13 -0.44 0.06 0.00 0.70 0.00 0.00 55.95 56.40 1paf s SER 10 Cb 0.14 1.20 -0.02 0.00 -1.71 0.00 0.00 66.02 65.62 1paf s SER 10 CO 0.36 -0.33 0.26 0.35 1.20 0.00 0.00 173.24 175.08 1paf n THR 11 N 5.24 0.00 -3.82 6.45 -2.24 -1.26 -4.92 114.28 113.73 1paf n THR 11 Ca 0.02 -2.08 -0.10 0.00 -2.27 0.00 0.00 64.05 59.63 1paf n THR 11 Cb 0.50 1.05 -0.06 0.00 -2.10 0.00 0.00 70.33 69.72 1paf n THR 11 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1paf s THR 12 N -3.15 0.08 0.40 4.28 -4.23 -1.26 -5.08 115.64 106.68 1paf s THR 12 Ca 0.34 -1.03 0.07 0.00 -1.18 0.00 0.00 61.69 59.89 1paf s THR 12 Cb 0.01 -1.52 0.28 0.00 1.34 0.00 0.00 72.50 72.61 1paf s THR 12 CO 0.24 -0.34 2.04 0.16 -0.54 0.00 0.00 174.62 176.17 1paf h ILE 13 N 2.48 1.08 -0.38 2.99 3.07 -1.97 -2.89 117.51 121.89 1paf h ILE 13 Ca -0.32 -0.20 0.04 0.00 1.55 0.00 0.00 64.86 65.93 1paf h ILE 13 Cb 1.23 0.44 -0.07 0.00 -0.27 0.00 0.00 36.82 38.16 1paf h ILE 13 CO 0.47 0.11 -0.44 0.28 -1.05 0.00 0.00 178.15 177.52 1paf h SER 14 N 0.59 -1.49 -0.42 2.16 0.02 -1.98 -2.10 113.55 110.34 1paf h SER 14 Ca 0.19 0.20 -0.01 0.00 -0.84 0.00 0.00 61.79 61.33 1paf h SER 14 Cb 0.03 0.61 -0.02 0.00 0.14 0.00 0.00 62.40 63.17 1paf h SER 14 CO -0.05 -0.30 0.22 0.11 -1.14 0.00 0.00 176.83 175.68 1paf h LYS 15 N -0.27 0.58 -0.34 3.45 1.79 -1.94 0.51 116.57 120.35 1paf h LYS 15 Ca 0.06 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1paf h LYS 15 Cb 0.45 -0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 30.97 1paf h LYS 15 CO -0.50 0.48 0.22 -0.92 -1.08 0.00 0.00 179.45 177.65 1paf h TYR 16 N 0.54 0.43 0.00 -1.35 3.20 -1.41 0.14 116.97 118.52 1paf h TYR 16 Ca 0.15 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 1paf h TYR 16 Cb 0.07 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.19 1paf h TYR 16 CO -0.02 0.27 -0.10 0.00 -1.64 0.00 0.00 178.16 176.67 1paf h ALA 17 N 1.12 1.23 -0.15 1.82 0.00 -1.02 -1.02 119.26 121.24 1paf h ALA 17 Ca 0.12 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1paf h ALA 17 Cb -0.05 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1paf h ALA 17 CO -0.03 0.13 -0.22 1.15 0.00 0.00 0.00 179.25 180.28 1paf h THR 18 N 0.00 1.36 -0.49 0.00 2.02 0.69 -2.85 112.91 113.64 1paf h THR 18 Ca -0.00 -1.44 0.09 0.00 0.77 0.00 0.00 66.41 65.82 1paf h THR 18 Cb 0.34 1.94 -0.07 0.00 -1.74 0.00 0.00 68.15 68.62 1paf h THR 18 CO 0.01 0.43 0.07 0.15 0.37 0.00 0.00 175.52 176.55 1paf h PHE 19 N 0.03 0.09 -0.42 3.16 3.57 -0.29 -0.35 116.94 122.74 1paf h PHE 19 Ca 0.01 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.47 1paf h PHE 19 Cb 0.79 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.54 1paf h PHE 19 CO 0.09 -0.04 -0.06 -0.07 -2.23 0.00 0.00 178.31 176.00 1paf h LEU 20 N 0.19 0.69 -1.00 0.59 3.38 -1.27 -0.94 115.31 116.96 1paf h LEU 20 Ca 0.25 -0.18 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 1paf h LEU 20 Cb 0.35 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1paf h LEU 20 CO -0.35 0.80 -0.47 -1.13 0.09 0.00 0.00 178.44 177.38 1paf h ASN 21 N 0.66 0.00 -0.00 -0.43 -1.24 -1.11 0.33 115.58 113.79 1paf h ASN 21 Ca 0.12 0.00 -0.26 0.00 0.71 0.00 0.00 56.30 56.87 1paf h ASN 21 Cb 0.50 0.00 0.02 0.00 0.73 0.00 0.00 38.32 39.57 1paf h ASN 21 CO 0.03 0.47 -1.01 0.44 -1.29 0.00 0.00 177.43 176.07 1paf h ASP 22 N 0.00 0.90 -0.34 1.15 3.32 -0.91 -1.49 116.42 119.06 1paf h ASP 22 Ca -0.00 -0.71 -0.03 0.00 0.02 0.00 0.00 57.03 56.31 1paf h ASP 22 Cb 0.89 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 1paf h ASP 22 CO 0.06 1.51 0.09 0.25 -1.72 0.00 0.00 179.24 179.44 1paf h LEU 23 N 0.41 0.50 0.26 1.55 5.85 -1.01 -2.58 115.31 120.29 1paf h LEU 23 Ca -0.12 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.37 1paf h LEU 23 Cb 1.66 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.56 1paf h LEU 23 CO 0.20 0.58 -0.13 0.03 -0.34 0.00 0.00 178.44 178.79 1paf h ARG 24 N 0.39 -0.34 -0.29 1.25 3.08 -0.97 0.15 114.38 117.65 1paf h ARG 24 Ca 0.11 0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.26 1paf h ARG 24 Cb 0.27 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1paf h ARG 24 CO -0.00 -0.06 0.24 -0.91 -1.07 0.00 0.00 179.97 178.17 1paf h ASN 25 N -0.61 0.00 0.03 7.04 2.35 -1.35 -1.68 115.58 121.36 1paf h ASN 25 Ca -0.04 0.00 -0.27 0.00 -0.55 0.00 0.00 56.30 55.45 1paf h ASN 25 Cb 0.44 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.83 1paf h ASN 25 CO 0.06 0.00 -1.05 -0.08 -1.65 0.00 0.00 177.43 174.71 1paf h GLU 26 N 0.00 0.68 0.14 0.81 4.57 -0.94 -3.34 114.58 116.50 1paf h GLU 26 Ca 0.14 -0.75 -0.28 0.00 -1.18 0.00 0.00 59.36 57.29 1paf h GLU 26 Cb 0.62 0.21 0.03 0.00 -0.16 0.00 0.00 28.75 29.45 1paf h GLU 26 CO -0.00 1.32 -1.19 0.00 -1.18 0.00 0.00 179.01 177.96 1paf h ALA 27 N 0.42 -0.04 -2.27 2.92 0.00 0.16 -3.47 119.26 116.98 1paf h ALA 27 Ca -0.13 -0.76 -0.52 0.00 0.00 0.00 0.00 54.91 53.50 1paf h ALA 27 Cb 1.70 0.12 0.19 0.00 0.00 0.00 0.00 17.79 19.80 1paf h ALA 27 CO 0.21 0.62 0.22 -1.59 0.00 0.00 0.00 179.25 178.71 1paf s LYS 28 N -2.87 1.03 0.30 0.00 -2.85 -0.82 -4.24 119.74 110.29 1paf s LYS 28 Ca -0.10 1.50 -0.28 0.00 -1.00 0.00 0.00 55.97 56.09 1paf s LYS 28 Cb 0.05 -1.73 -0.09 0.00 -2.06 0.00 0.00 37.83 33.99 1paf s LYS 28 CO 0.92 -2.60 1.03 0.34 0.10 0.00 0.00 175.35 175.13 1paf s ASP 29 N -2.72 7.25 0.57 0.03 2.15 -0.81 -4.79 116.67 118.35 1paf s ASP 29 Ca 0.66 2.08 0.31 0.00 0.43 0.00 0.00 52.55 56.03 1paf s ASP 29 Cb -0.22 -2.61 1.70 0.00 -0.30 0.00 0.00 42.92 41.49 1paf s ASP 29 CO 0.58 -0.14 2.16 -0.65 -0.17 0.00 0.00 175.17 176.95 1paf h PRO 30 N 3.49 0.00 0.00 4.34 0.11 -1.93 -3.36 132.00 134.66 1paf h PRO 30 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1paf h PRO 30 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1paf h PRO 30 CO 0.66 0.06 -0.05 -1.13 -0.21 0.00 0.00 178.00 177.32 1paf n SER 31 N -3.57 0.27 -4.64 -2.05 3.41 -1.26 -5.05 113.62 100.73 1paf n SER 31 Ca -0.02 -0.04 -0.43 0.00 -0.26 0.00 0.00 58.87 58.12 1paf n SER 31 Cb 0.17 0.14 -0.02 0.00 -0.26 0.00 0.00 64.21 64.24 1paf n SER 31 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1paf s LEU 32 N -0.34 4.04 0.09 1.04 2.96 -1.26 -4.98 118.68 120.23 1paf s LEU 32 Ca 0.00 1.64 -0.01 0.00 -0.22 0.00 0.00 54.13 55.54 1paf s LEU 32 Cb 0.00 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.12 1paf s LEU 32 CO 0.00 -1.02 0.02 -1.59 -1.32 0.00 0.00 176.35 172.44 1paf s LYS 33 N 4.12 0.78 -0.03 1.98 -2.85 -1.26 -0.87 119.74 121.60 1paf s LYS 33 Ca 0.63 -1.32 -0.00 0.00 -1.00 0.00 0.00 55.97 54.28 1paf s LYS 33 Cb -0.23 0.23 0.03 0.00 -2.06 0.00 0.00 37.83 35.80 1paf s LYS 33 CO 0.24 -0.19 0.02 0.00 0.10 0.00 0.00 175.35 175.52 1paf n TYR 35 N 4.45 -1.52 0.00 0.00 4.01 0.13 -0.90 117.16 123.33 1paf n TYR 35 Ca -0.21 0.68 0.00 0.00 -0.16 0.00 0.00 57.90 58.21 1paf n TYR 35 Cb 0.50 -2.38 0.00 0.00 -0.31 0.00 0.00 39.34 37.15 1paf n TYR 35 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1paf n GLY 36 N -1.18 2.39 3.66 2.72 0.00 0.90 -4.82 105.19 108.87 1paf n GLY 36 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1paf n GLY 36 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1paf s ILE 37 N -2.65 4.97 0.60 -0.61 1.01 -0.07 -5.06 121.20 119.38 1paf s ILE 37 Ca 0.00 1.34 -0.19 0.00 0.00 0.00 0.00 60.65 61.80 1paf s ILE 37 Cb 0.00 -4.01 -0.03 0.00 0.01 0.00 0.00 42.46 38.43 1paf s ILE 37 CO 0.00 0.08 1.24 -2.16 0.00 0.00 0.00 174.94 174.10 1paf s PRO 38 N 2.00 2.92 0.11 2.79 0.04 -1.26 -1.70 135.00 139.90 1paf s PRO 38 Ca 0.32 1.93 0.06 0.00 0.04 0.00 0.00 61.00 63.34 1paf s PRO 38 Cb -0.16 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 1paf s PRO 38 CO 0.11 -1.28 -0.03 1.41 0.04 0.00 0.00 177.00 177.25 1paf s MET 39 N -3.27 2.39 0.61 4.56 1.75 -0.05 -1.07 119.30 124.22 1paf s MET 39 Ca 0.78 -0.94 -0.15 0.00 -1.25 0.00 0.00 55.69 54.13 1paf s MET 39 Cb -0.33 -2.44 -0.03 0.00 2.84 0.00 0.00 34.83 34.87 1paf s MET 39 CO 0.36 0.52 1.07 -0.51 -0.65 0.00 0.00 175.02 175.81 1paf s LEU 40 N -2.37 3.47 0.84 4.11 1.43 -0.58 -1.92 118.68 123.66 1paf s LEU 40 Ca 0.25 1.86 -0.11 0.00 -1.03 0.00 0.00 54.13 55.09 1paf s LEU 40 Cb -0.11 -4.54 0.10 0.00 0.03 0.00 0.00 46.19 41.67 1paf s LEU 40 CO 0.17 -1.28 1.09 -2.16 0.23 0.00 0.00 176.35 174.40 1paf s PRO 41 N -4.09 1.72 0.59 1.29 0.04 -1.26 -4.24 135.00 129.05 1paf s PRO 41 Ca 0.64 0.79 -0.09 0.00 0.04 0.00 0.00 61.00 62.39 1paf s PRO 41 Cb -0.17 -1.86 -0.02 0.00 0.04 0.00 0.00 34.50 32.48 1paf s PRO 41 CO 0.38 -1.91 0.95 0.54 0.04 0.00 0.00 177.00 177.00 1paf s ASN 42 N -3.61 6.03 0.65 6.66 4.22 -1.26 -4.11 114.94 123.51 1paf s ASN 42 Ca 0.62 1.13 0.37 0.00 -2.14 0.00 0.00 52.86 52.84 1paf s ASN 42 Cb -0.16 -2.21 2.05 0.00 1.28 0.00 0.00 41.25 42.20 1paf s ASN 42 CO 0.56 -0.89 2.21 0.71 -2.04 0.00 0.00 177.10 177.65 1paf h THR 43 N -0.20 0.14 0.00 0.54 1.35 -1.97 -1.65 112.91 111.13 1paf h THR 43 Ca -0.45 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.40 1paf h THR 43 Cb 1.21 0.89 -0.00 0.00 -1.73 0.00 0.00 68.15 68.52 1paf h THR 43 CO 0.62 0.00 -0.04 0.78 -0.25 0.00 0.00 175.52 176.63 1paf h ASN 44 N 0.00 0.00 -3.76 5.36 -0.26 -1.99 -3.43 115.58 111.50 1paf h ASN 44 Ca 0.02 0.00 -0.52 0.00 -0.56 0.00 0.00 56.30 55.24 1paf h ASN 44 Cb 0.25 0.00 0.05 0.00 -1.06 0.00 0.00 38.32 37.55 1paf h ASN 44 CO -0.00 0.04 0.60 -0.89 -1.06 0.00 0.00 177.43 176.11 1paf s THR 45 N -3.58 3.02 -0.02 2.81 2.01 -0.62 -5.01 115.64 114.25 1paf s THR 45 Ca 0.02 0.99 -0.00 0.00 0.31 0.00 0.00 61.69 63.00 1paf s THR 45 Cb 0.08 -3.63 -0.04 0.00 0.01 0.00 0.00 72.50 68.93 1paf s THR 45 CO 0.58 0.22 0.05 0.20 -0.69 0.00 0.00 174.62 174.98 1paf s ASN 46 N -0.42 5.46 0.64 3.53 0.01 -1.26 -3.47 114.94 119.42 1paf s ASN 46 Ca 0.49 0.10 -0.17 0.00 -0.71 0.00 0.00 52.86 52.58 1paf s ASN 46 Cb -0.37 -1.53 -0.01 0.00 0.41 0.00 0.00 41.25 39.75 1paf s ASN 46 CO 0.47 0.29 1.18 -2.16 -1.51 0.00 0.00 177.10 175.37 1paf s PRO 47 N -1.55 2.75 0.07 -0.60 0.04 -1.26 -5.10 135.00 129.36 1paf s PRO 47 Ca 0.20 1.70 0.24 0.00 0.04 0.00 0.00 61.00 63.19 1paf s PRO 47 Cb -0.12 -1.91 0.28 0.00 0.04 0.00 0.00 34.50 32.79 1paf s PRO 47 CO 0.11 -1.35 1.25 1.63 0.04 0.00 0.00 177.00 178.68 1paf n LYS 48 N -2.02 0.22 -4.21 4.56 5.02 -1.23 -4.88 118.16 115.63 1paf n LYS 48 Ca 0.13 0.04 -0.16 0.00 -2.02 0.00 0.00 58.31 56.29 1paf n LYS 48 Cb 0.50 -1.61 -0.11 0.00 -0.02 0.00 0.00 35.03 33.79 1paf n LYS 48 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1paf s TYR 49 N -3.14 1.23 -0.00 2.13 2.02 -1.26 -0.54 117.35 117.79 1paf s TYR 49 Ca 0.06 -0.60 0.02 0.00 -0.37 0.00 0.00 57.07 56.19 1paf s TYR 49 Cb 0.15 -0.66 -0.01 0.00 -0.40 0.00 0.00 41.96 41.04 1paf s TYR 49 CO 0.74 0.08 -0.08 0.14 -1.57 0.00 0.00 175.55 174.86 1paf s VAL 50 N -2.28 0.62 -0.02 0.71 -7.23 0.12 -4.43 120.40 107.90 1paf s VAL 50 Ca 0.07 -0.40 0.02 0.00 -1.81 0.00 0.00 61.98 59.87 1paf s VAL 50 Cb -0.04 -0.54 -0.03 0.00 0.56 0.00 0.00 36.38 36.33 1paf s VAL 50 CO 0.02 0.14 -0.05 -0.76 -0.31 0.00 0.00 175.10 174.13 1paf s LEU 51 N -0.29 3.25 -0.19 1.32 1.02 -0.53 -0.37 118.68 122.89 1paf s LEU 51 Ca 0.02 -0.08 0.00 0.00 0.02 0.00 0.00 54.13 54.09 1paf s LEU 51 Cb -0.04 -1.82 0.04 0.00 0.02 0.00 0.00 46.19 44.39 1paf s LEU 51 CO -0.00 0.30 -0.07 -0.69 0.02 0.00 0.00 176.35 175.91 1paf s VAL 52 N -0.97 1.38 -0.46 -1.59 1.01 -0.22 -1.00 120.40 118.54 1paf s VAL 52 Ca 0.16 -0.84 -0.22 0.00 0.00 0.00 0.00 61.98 61.08 1paf s VAL 52 Cb -0.11 -1.52 0.03 0.00 0.00 0.00 0.00 36.38 34.78 1paf s VAL 52 CO 0.06 0.13 0.72 -0.70 0.00 0.00 0.00 175.10 175.32 1paf s GLU 53 N 1.51 3.32 -0.21 2.72 2.12 -0.52 0.00 118.70 127.64 1paf s GLU 53 Ca -0.01 -0.31 -0.16 0.00 0.36 0.00 0.00 54.97 54.86 1paf s GLU 53 Cb -0.16 -3.97 -0.04 0.00 0.26 0.00 0.00 34.13 30.22 1paf s GLU 53 CO -0.08 -1.12 0.41 -0.51 -0.54 0.00 0.00 175.26 173.42 1paf s LEU 54 N 3.09 4.14 -0.33 2.70 1.43 0.10 -0.36 118.68 129.46 1paf s LEU 54 Ca 0.25 0.51 -0.03 0.00 -1.03 0.00 0.00 54.13 53.84 1paf s LEU 54 Cb -0.14 -2.53 0.06 0.00 0.03 0.00 0.00 46.19 43.61 1paf s LEU 54 CO 0.20 -0.10 0.06 -1.10 0.23 0.00 0.00 176.35 175.64 1paf s GLN 55 N 1.42 2.42 0.58 1.70 -0.21 0.35 -2.12 119.66 123.79 1paf s GLN 55 Ca 0.19 -1.33 0.07 0.00 0.02 0.00 0.00 55.36 54.31 1paf s GLN 55 Cb -0.15 -3.32 0.10 0.00 1.00 0.00 0.00 33.01 30.65 1paf s GLN 55 CO 0.08 -0.70 0.80 0.41 -2.12 0.00 0.00 175.29 173.76 1paf n GLY 56 N 4.67 1.65 3.66 3.09 0.00 -0.71 0.10 105.19 117.65 1paf n GLY 56 Ca -0.11 -2.18 -0.34 0.00 0.00 0.00 0.00 46.02 43.40 1paf n GLY 56 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1paf n SER 57 N -2.50 0.67 -3.43 1.61 7.64 -1.26 -3.39 113.62 112.95 1paf n SER 57 Ca 0.16 0.57 -0.25 0.00 1.01 0.00 0.00 58.87 60.35 1paf n SER 57 Cb 0.56 -1.47 0.03 0.00 -1.01 0.00 0.00 64.21 62.32 1paf n SER 57 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1paf n ASN 58 N -3.00 -5.09 -3.80 6.43 4.05 -1.26 -2.95 115.26 109.65 1paf n ASN 58 Ca 0.13 -0.48 -0.25 0.00 0.45 0.00 0.00 54.58 54.42 1paf n ASN 58 Cb 0.51 -4.10 0.03 0.00 1.23 0.00 0.00 39.78 37.44 1paf n ASN 58 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 177.26 175.38 1paf n LYS 59 N -4.23 -5.31 -4.25 1.20 0.00 -1.22 -5.01 118.16 99.35 1paf n LYS 59 Ca -0.03 0.62 -0.35 0.00 0.00 0.00 0.00 58.31 58.55 1paf n LYS 59 Cb 0.56 -5.34 -0.09 0.00 0.00 0.00 0.00 35.03 30.16 1paf n LYS 59 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1paf s LYS 60 N -6.29 3.28 0.01 1.64 -0.14 -1.15 -5.04 119.74 112.05 1paf s LYS 60 Ca 0.32 -0.37 -0.04 0.00 -1.36 0.00 0.00 55.97 54.52 1paf s LYS 60 Cb -0.16 -2.93 -0.01 0.00 -1.68 0.00 0.00 37.83 33.06 1paf s LYS 60 CO 0.82 0.59 0.07 0.99 -0.76 0.00 0.00 175.35 177.06 1paf s THR 61 N -0.56 0.09 -0.00 2.17 2.01 -1.26 -1.73 115.64 116.35 1paf s THR 61 Ca 0.10 -0.76 0.01 0.00 0.31 0.00 0.00 61.69 61.35 1paf s THR 61 Cb -0.12 -0.35 -0.00 0.00 0.01 0.00 0.00 72.50 72.03 1paf s THR 61 CO 0.02 -0.42 -0.03 -0.63 -0.69 0.00 0.00 174.62 172.88 1paf s ILE 62 N -1.37 0.23 -0.08 1.82 1.01 -0.90 -4.39 121.20 117.52 1paf s ILE 62 Ca -0.15 -0.15 0.01 0.00 0.00 0.00 0.00 60.65 60.36 1paf s ILE 62 Cb -0.08 -0.20 -0.03 0.00 0.01 0.00 0.00 42.46 42.16 1paf s ILE 62 CO 0.01 0.05 -0.09 -0.89 0.00 0.00 0.00 174.94 174.02 1paf s THR 63 N -0.10 3.50 -0.20 2.92 2.01 -0.21 -0.72 115.64 122.83 1paf s THR 63 Ca 0.01 -0.54 -0.05 0.00 0.31 0.00 0.00 61.69 61.42 1paf s THR 63 Cb -0.01 -2.43 -0.02 0.00 0.01 0.00 0.00 72.50 70.04 1paf s THR 63 CO -0.00 0.58 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.28 1paf s LEU 64 N -0.51 3.21 -0.12 4.42 2.96 0.10 -0.62 118.68 128.12 1paf s LEU 64 Ca 0.07 -0.22 -0.18 0.00 -0.22 0.00 0.00 54.13 53.58 1paf s LEU 64 Cb -0.12 -1.81 -0.04 0.00 0.50 0.00 0.00 46.19 44.72 1paf s LEU 64 CO 0.02 0.06 0.47 -0.32 -1.32 0.00 0.00 176.35 175.26 1paf s MET 65 N 1.04 4.34 -0.05 1.98 1.75 -0.51 -1.06 119.30 126.78 1paf s MET 65 Ca 0.02 0.44 0.04 0.00 -1.25 0.00 0.00 55.69 54.94 1paf s MET 65 Cb -0.14 -3.44 -0.00 0.00 2.84 0.00 0.00 34.83 34.09 1paf s MET 65 CO 0.01 0.15 -0.17 -0.51 -0.65 0.00 0.00 175.02 173.85 1paf s LEU 66 N 0.64 1.90 0.09 4.11 1.02 0.50 -0.63 118.68 126.32 1paf s LEU 66 Ca 0.26 -0.37 -0.31 0.00 0.02 0.00 0.00 54.13 53.73 1paf s LEU 66 Cb -0.15 -1.01 -0.06 0.00 0.02 0.00 0.00 46.19 44.99 1paf s LEU 66 CO 0.10 0.14 1.23 -0.60 0.02 0.00 0.00 176.35 177.24 1paf s ARG 67 N 0.16 4.43 0.16 1.70 3.52 0.04 -0.70 118.95 128.25 1paf s ARG 67 Ca -0.07 1.84 -0.01 0.00 -0.13 0.00 0.00 55.73 57.36 1paf s ARG 67 Cb -0.13 -3.31 -0.01 0.00 -1.56 0.00 0.00 34.95 29.94 1paf s ARG 67 CO 0.03 -0.25 1.38 0.00 -0.81 0.00 0.00 175.30 175.65 1paf h ARG 68 N 6.49 0.32 -0.96 5.12 3.08 -1.14 0.44 114.38 127.72 1paf h ARG 68 Ca -0.42 -0.32 0.22 0.00 0.07 0.00 0.00 59.98 59.53 1paf h ARG 68 Cb 1.21 0.08 -0.08 0.00 0.08 0.00 0.00 29.97 31.27 1paf h ARG 68 CO 0.81 1.00 0.63 -0.97 -1.07 0.00 0.00 179.97 180.36 1paf h ASN 69 N 0.19 0.44 0.00 7.04 -0.73 -1.78 -3.32 115.58 117.42 1paf h ASN 69 Ca -0.05 0.06 0.00 0.00 1.87 0.00 0.00 56.30 58.18 1paf h ASN 69 Cb 1.46 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 40.03 1paf h ASN 69 CO 0.14 0.15 0.00 -0.46 -0.37 0.00 0.00 177.43 176.89 1paf n ASN 70 N -4.55 0.00 -1.32 1.15 6.94 -1.22 -3.74 115.26 112.51 1paf n ASN 70 Ca 0.22 -1.00 -0.14 0.00 -0.02 0.00 0.00 54.58 53.64 1paf n ASN 70 Cb 0.76 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 38.12 1paf n ASN 70 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1paf n LEU 71 N 0.00 -0.95 -4.80 -4.53 4.77 0.15 -4.96 117.00 106.68 1paf n LEU 71 Ca 0.00 0.34 -0.33 0.00 -0.03 0.00 0.00 56.01 56.00 1paf n LEU 71 Cb 0.49 -2.19 0.01 0.00 -2.33 0.00 0.00 43.42 39.41 1paf n LEU 71 CO 0.00 -0.78 0.72 -0.31 -1.33 0.00 0.00 177.39 175.68 1paf s TYR 72 N -2.15 2.98 -0.07 -1.77 1.51 -1.23 -4.72 117.35 111.90 1paf s TYR 72 Ca 0.00 1.51 -0.20 0.00 -1.01 0.00 0.00 57.07 57.37 1paf s TYR 72 Cb 0.00 -3.01 -0.04 0.00 -0.11 0.00 0.00 41.96 38.80 1paf s TYR 72 CO 0.00 -1.14 0.58 0.08 -1.11 0.00 0.00 175.55 173.96 1paf s VAL 73 N -2.46 5.07 -0.14 0.71 1.01 -1.26 -0.78 120.40 122.54 1paf s VAL 73 Ca 0.64 1.19 0.17 0.00 0.00 0.00 0.00 61.98 63.98 1paf s VAL 73 Cb -0.16 -3.92 -0.24 0.00 0.00 0.00 0.00 36.38 32.06 1paf s VAL 73 CO 0.38 0.33 0.32 0.23 0.00 0.00 0.00 175.10 176.36 1paf n MET 74 N 3.42 0.67 -1.67 2.72 0.00 0.20 -4.94 117.12 117.51 1paf n MET 74 Ca -0.05 0.05 0.00 0.00 0.00 0.00 0.00 57.70 57.70 1paf n MET 74 Cb 0.51 -1.60 0.00 0.00 0.00 0.00 0.00 33.22 32.13 1paf n MET 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1paf n GLY 75 N 1.60 0.65 3.28 3.03 0.00 -1.25 -1.76 105.19 110.74 1paf n GLY 75 Ca -0.23 -0.81 -0.14 0.00 0.00 0.00 0.00 46.02 44.84 1paf n GLY 75 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1paf s TYR 76 N -2.88 -0.26 0.22 1.61 1.13 -0.65 -1.43 117.35 115.08 1paf s TYR 76 Ca 0.00 0.46 0.10 0.00 -1.41 0.00 0.00 57.07 56.22 1paf s TYR 76 Cb 0.00 0.14 -0.04 0.00 -1.10 0.00 0.00 41.96 40.95 1paf s TYR 76 CO 0.00 -0.39 -0.11 -1.54 -2.51 0.00 0.00 175.55 170.99 1paf s SER 77 N -1.13 4.09 -0.01 -0.18 1.04 0.21 0.11 113.70 117.83 1paf s SER 77 Ca -0.12 -0.70 -0.03 0.00 0.48 0.00 0.00 55.95 55.57 1paf s SER 77 Cb -0.04 -0.61 0.00 0.00 0.10 0.00 0.00 66.02 65.46 1paf s SER 77 CO 0.04 0.07 0.07 1.51 0.98 0.00 0.00 173.24 175.92 1paf s ASP 78 N -3.09 0.01 0.41 7.02 -4.77 -0.65 -1.04 116.67 114.56 1paf s ASP 78 Ca 0.26 -0.07 -0.26 0.00 -3.30 0.00 0.00 52.55 49.18 1paf s ASP 78 Cb -0.08 0.17 -0.09 0.00 -1.09 0.00 0.00 42.92 41.83 1paf s ASP 78 CO 0.15 -0.18 1.41 -2.84 0.70 0.00 0.00 175.17 174.42 1paf s PRO 79 N -0.66 3.90 0.01 2.11 0.02 -1.26 -1.24 135.00 137.89 1paf s PRO 79 Ca -0.07 2.40 -0.15 0.00 0.02 0.00 0.00 61.00 63.19 1paf s PRO 79 Cb -0.04 -2.79 0.02 0.00 0.02 0.00 0.00 34.50 31.71 1paf s PRO 79 CO 0.00 -0.63 0.32 0.12 -0.33 0.00 0.00 177.00 176.48 1paf s PHE 80 N -1.19 -0.16 0.00 6.54 5.36 0.11 -3.42 117.98 125.22 1paf s PHE 80 Ca 0.57 0.16 0.00 0.00 -0.96 0.00 0.00 56.93 56.70 1paf s PHE 80 Cb -0.43 0.11 0.00 0.00 -0.34 0.00 0.00 43.02 42.36 1paf s PHE 80 CO 0.56 -0.45 0.00 -1.91 -1.46 0.00 0.00 175.22 171.97 1paf n GLU 81 N 0.96 0.00 -0.04 10.12 4.07 -1.26 -1.38 120.64 133.10 1paf n GLU 81 Ca -0.20 0.00 -0.00 0.00 -0.06 0.00 0.00 57.16 56.89 1paf n GLU 81 Cb 0.57 0.00 -0.00 0.00 -0.06 0.00 0.00 31.44 31.95 1paf n GLU 81 CO 0.00 0.00 0.00 1.15 -0.06 0.00 0.00 177.13 178.22 1paf h THR 82 N 0.00 0.00 -1.87 6.31 2.02 -2.02 -3.42 112.91 113.93 1paf h THR 82 Ca 0.00 -0.83 -0.49 0.00 0.77 0.00 0.00 66.41 65.87 1paf h THR 82 Cb 0.00 0.00 -0.40 0.00 -1.74 0.00 0.00 68.15 66.01 1paf h THR 82 CO 0.00 0.00 -1.07 -0.46 0.37 0.00 0.00 175.52 174.36 1paf n ASN 83 N -4.29 1.83 -4.12 4.18 6.94 -1.24 -5.05 115.26 113.51 1paf n ASN 83 Ca -0.01 -3.13 -0.22 0.00 -0.02 0.00 0.00 54.58 51.20 1paf n ASN 83 Cb 0.02 -0.59 -0.15 0.00 -2.36 0.00 0.00 39.78 36.71 1paf n ASN 83 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1paf s LYS 84 N -2.80 1.13 -0.24 -3.83 1.02 -0.48 -4.86 119.74 109.67 1paf s LYS 84 Ca 0.40 -0.57 -0.07 0.00 0.02 0.00 0.00 55.97 55.75 1paf s LYS 84 Cb 0.36 -1.10 -0.03 0.00 -0.52 0.00 0.00 37.83 36.54 1paf s LYS 84 CO -0.08 0.30 0.07 0.00 -0.92 0.00 0.00 175.35 174.72 1paf s ARG 86 N 1.52 3.77 0.11 0.00 3.52 -0.37 -1.32 118.95 126.18 1paf s ARG 86 Ca 0.06 -0.44 0.02 0.00 -0.13 0.00 0.00 55.73 55.24 1paf s ARG 86 Cb -0.15 -3.22 -0.04 0.00 -1.56 0.00 0.00 34.95 29.99 1paf s ARG 86 CO 0.04 0.04 0.19 1.52 -0.81 0.00 0.00 175.30 176.28 1paf s TYR 87 N 0.98 3.37 -0.11 5.12 1.13 -0.76 -1.64 117.35 125.45 1paf s TYR 87 Ca 0.03 0.12 -0.02 0.00 -1.41 0.00 0.00 57.07 55.80 1paf s TYR 87 Cb -0.14 -1.66 0.04 0.00 -1.10 0.00 0.00 41.96 39.10 1paf s TYR 87 CO 0.03 0.54 0.01 -1.01 -2.51 0.00 0.00 175.55 172.60 1paf s HIS 88 N -1.60 0.80 -0.05 -3.49 3.76 0.12 -2.60 115.29 112.22 1paf s HIS 88 Ca 0.33 -0.37 0.01 0.00 -0.15 0.00 0.00 55.06 54.88 1paf s HIS 88 Cb -0.12 -0.88 -0.03 0.00 1.11 0.00 0.00 32.58 32.66 1paf s HIS 88 CO 0.26 -0.41 -0.04 0.42 -0.85 0.00 0.00 174.74 174.12 1paf s ILE 89 N 1.93 3.90 0.48 0.60 1.01 -1.26 -1.64 121.20 126.22 1paf s ILE 89 Ca 0.04 -0.51 -0.22 0.00 0.00 0.00 0.00 60.65 59.95 1paf s ILE 89 Cb -0.13 -2.65 -0.07 0.00 0.01 0.00 0.00 42.46 39.62 1paf s ILE 89 CO -0.06 0.52 1.16 -0.36 0.00 0.00 0.00 174.94 176.20 1paf s PHE 90 N -0.91 2.82 0.59 3.97 0.08 -0.72 -1.88 117.98 121.93 1paf s PHE 90 Ca 0.15 1.54 0.29 0.00 0.12 0.00 0.00 56.93 59.03 1paf s PHE 90 Cb -0.11 -3.36 1.73 0.00 -0.57 0.00 0.00 43.02 40.71 1paf s PHE 90 CO 0.04 -1.53 2.16 -0.97 -0.10 0.00 0.00 175.22 174.82 1paf h ASN 91 N 1.83 0.00 -0.44 1.36 -1.24 -1.27 -2.29 115.58 113.53 1paf h ASN 91 Ca -0.50 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.51 1paf h ASN 91 Cb 1.25 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.30 1paf h ASN 91 CO 0.59 0.00 0.00 -0.90 -1.29 0.00 0.00 177.43 175.83 1paf n ASP 92 N -3.80 2.77 -4.84 1.15 5.68 -1.26 -4.82 116.55 111.43 1paf n ASP 92 Ca -0.00 -2.11 -0.37 0.00 -0.50 0.00 0.00 54.79 51.80 1paf n ASP 92 Cb 0.23 -0.37 -0.06 0.00 -1.14 0.00 0.00 41.12 39.78 1paf n ASP 92 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1paf s ILE 93 N -1.52 5.35 0.19 2.12 -1.09 -0.86 -5.07 121.20 120.31 1paf s ILE 93 Ca 0.32 0.41 -0.06 0.00 -2.23 0.00 0.00 60.65 59.09 1paf s ILE 93 Cb 0.18 -3.52 -0.02 0.00 -1.58 0.00 0.00 42.46 37.52 1paf s ILE 93 CO 0.19 0.57 0.23 -0.94 -1.23 0.00 0.00 174.94 173.76 1paf s SER 94 N -0.74 0.10 0.94 3.58 1.04 -1.26 -4.72 113.70 112.64 1paf s SER 94 Ca 0.17 -1.10 0.00 0.00 0.48 0.00 0.00 55.95 55.50 1paf s SER 94 Cb -0.13 0.42 0.00 0.00 0.10 0.00 0.00 66.02 66.41 1paf s SER 94 CO 0.06 -0.90 0.00 0.61 0.98 0.00 0.00 173.24 173.99 1paf n GLY 95 N -0.24 2.01 0.38 7.32 0.00 -1.26 -2.57 105.19 110.83 1paf n GLY 95 Ca -0.03 -0.47 0.23 0.00 0.00 0.00 0.00 46.02 45.74 1paf n GLY 95 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1paf h THR 96 N 0.00 0.44 -0.58 2.61 2.02 -2.00 -0.76 112.91 114.64 1paf h THR 96 Ca 0.00 -0.14 0.09 0.00 0.77 0.00 0.00 66.41 67.13 1paf h THR 96 Cb 0.00 -0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 66.37 1paf h THR 96 CO 0.00 0.08 0.39 -0.33 0.37 0.00 0.00 175.52 176.02 1paf h GLU 97 N 0.41 0.41 -0.22 6.66 5.08 -1.90 0.34 114.58 125.37 1paf h GLU 97 Ca 0.66 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.94 1paf h GLU 97 Cb 1.55 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.70 1paf h GLU 97 CO -0.43 0.27 -0.14 0.00 -1.00 0.00 0.00 179.01 177.71 1paf h ARG 98 N 0.43 0.37 0.00 2.33 3.08 -1.17 -0.11 114.38 119.30 1paf h ARG 98 Ca 0.26 -0.10 -0.17 0.00 0.07 0.00 0.00 59.98 60.04 1paf h ARG 98 Cb 0.48 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 1paf h ARG 98 CO -0.07 0.51 -0.86 0.37 -1.07 0.00 0.00 179.97 178.85 1paf h GLN 99 N 0.34 0.00 -0.32 0.04 4.15 -0.63 -3.00 115.11 115.70 1paf h GLN 99 Ca 0.07 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.44 1paf h GLN 99 Cb 0.45 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.13 1paf h GLN 99 CO 0.03 0.75 0.01 -0.44 -1.93 0.00 0.00 178.83 177.25 1paf h ASP 100 N 0.00 0.45 0.17 -0.69 5.19 0.13 -1.29 116.42 120.39 1paf h ASP 100 Ca -0.03 -0.08 -0.01 0.00 -0.62 0.00 0.00 57.03 56.30 1paf h ASP 100 Cb 1.62 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 41.02 1paf h ASP 100 CO 0.10 0.51 -0.08 0.58 -3.12 0.00 0.00 179.24 177.23 1paf h VAL 101 N 0.47 0.95 -0.18 -1.35 2.07 -1.29 0.36 116.25 117.29 1paf h VAL 101 Ca 0.10 -0.71 0.05 0.00 0.82 0.00 0.00 66.70 66.97 1paf h VAL 101 Cb 0.29 1.37 -0.07 0.00 -1.52 0.00 0.00 31.29 31.36 1paf h VAL 101 CO 0.01 0.16 -0.28 -0.08 0.02 0.00 0.00 177.57 177.39 1paf h GLU 102 N -0.58 -0.32 0.00 1.57 4.81 -1.33 0.13 114.58 118.86 1paf h GLU 102 Ca -0.02 0.02 -0.15 0.00 -0.13 0.00 0.00 59.36 59.08 1paf h GLU 102 Cb 0.44 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 1paf h GLU 102 CO 0.04 -0.21 -0.71 1.15 -0.73 0.00 0.00 179.01 178.55 1paf h THR 103 N -0.33 1.39 0.07 0.32 2.02 -1.11 -1.74 112.91 113.53 1paf h THR 103 Ca 0.11 -2.51 -0.32 0.00 0.77 0.00 0.00 66.41 64.46 1paf h THR 103 Cb 0.51 2.40 -0.03 0.00 -1.74 0.00 0.00 68.15 69.28 1paf h THR 103 CO -0.36 0.69 -1.78 0.74 0.37 0.00 0.00 175.52 175.18 1paf h THR 104 N 0.00 0.82 0.06 3.16 2.02 0.20 -3.15 112.91 116.02 1paf h THR 104 Ca -0.01 -2.59 -0.24 0.00 0.77 0.00 0.00 66.41 64.35 1paf h THR 104 Cb 1.34 2.52 -0.01 0.00 -1.74 0.00 0.00 68.15 70.26 1paf h THR 104 CO 0.09 0.71 -1.08 -0.07 0.37 0.00 0.00 175.52 175.54 1paf h LEU 105 N 0.04 0.28 -6.27 2.58 3.38 -0.84 -3.37 115.31 111.12 1paf h LEU 105 Ca -0.33 -0.28 -0.59 0.00 0.09 0.00 0.00 57.88 56.77 1paf h LEU 105 Cb 2.02 -0.09 -0.41 0.00 0.09 0.00 0.00 40.66 42.27 1paf h LEU 105 CO 0.10 1.18 -0.76 0.00 0.09 0.00 0.00 178.44 179.05 1paf n PRO 107 N 1.28 0.49 -3.47 0.00 -0.04 -1.19 -4.19 135.00 127.88 1paf n PRO 107 Ca 0.26 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.29 1paf n PRO 107 Cb 0.44 -1.36 -0.05 0.00 -0.04 0.00 0.00 33.50 32.49 1paf n PRO 107 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1paf s ASN 108 N -1.86 6.21 1.23 3.54 2.47 -1.26 -5.05 114.94 120.21 1paf s ASN 108 Ca 0.17 -2.76 -0.18 0.00 0.42 0.00 0.00 52.86 50.51 1paf s ASN 108 Cb 0.08 -2.08 0.29 0.00 -1.45 0.00 0.00 41.25 38.09 1paf s ASN 108 CO 0.13 -0.50 1.05 0.00 -3.72 0.00 0.00 177.10 174.07 1paf s ALA 109 N 0.07 0.20 0.00 1.71 0.00 -1.26 -2.87 121.76 119.61 1paf s ALA 109 Ca 0.18 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.38 1paf s ALA 109 Cb -0.14 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 20.01 1paf s ALA 109 CO -0.07 -3.77 0.00 0.09 0.00 0.00 0.00 175.76 172.01 1paf n ASN 110 N -4.92 0.00 -2.11 0.00 3.02 -1.26 -4.69 115.26 105.30 1paf n ASN 110 Ca 0.11 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.52 1paf n ASN 110 Cb 0.59 0.00 0.25 0.00 -0.61 0.00 0.00 39.78 40.01 1paf n ASN 110 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1paf n SER 111 N 0.81 4.36 -4.28 6.41 3.41 -1.14 -5.00 113.62 118.19 1paf n SER 111 Ca 0.00 -3.37 -0.31 0.00 -0.26 0.00 0.00 58.87 54.93 1paf n SER 111 Cb 0.00 -0.79 -0.16 0.00 -0.26 0.00 0.00 64.21 63.00 1paf n SER 111 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1paf s ARG 112 N -3.09 2.22 0.12 4.33 1.70 -1.26 -1.84 118.95 121.13 1paf s ARG 112 Ca 0.55 -0.89 0.05 0.00 -0.47 0.00 0.00 55.73 54.97 1paf s ARG 112 Cb 0.45 -2.03 -0.04 0.00 -0.57 0.00 0.00 34.95 32.76 1paf s ARG 112 CO 0.12 0.48 -0.13 0.14 -1.08 0.00 0.00 175.30 174.83 1paf s VAL 113 N -0.42 1.25 0.26 4.99 -7.23 -0.43 -4.96 120.40 113.86 1paf s VAL 113 Ca 0.05 -1.71 -0.06 0.00 -1.81 0.00 0.00 61.98 58.45 1paf s VAL 113 Cb -0.11 -1.50 -0.06 0.00 0.56 0.00 0.00 36.38 35.27 1paf s VAL 113 CO 0.01 -0.45 0.54 -0.44 -0.31 0.00 0.00 175.10 174.45 1paf s SER 114 N -2.46 6.50 -0.29 4.85 0.01 -1.26 -1.82 113.70 119.22 1paf s SER 114 Ca 0.08 0.77 0.03 0.00 1.31 0.00 0.00 55.95 58.14 1paf s SER 114 Cb -0.04 -2.17 0.17 0.00 0.21 0.00 0.00 66.02 64.19 1paf s SER 114 CO 0.02 -0.15 0.45 -0.75 0.41 0.00 0.00 173.24 173.23 1paf s LYS 115 N -3.28 0.45 0.65 12.44 2.20 -1.07 -4.92 119.74 126.22 1paf s LYS 115 Ca 0.45 0.24 -0.11 0.00 -0.36 0.00 0.00 55.97 56.19 1paf s LYS 115 Cb -0.11 -0.17 -0.02 0.00 -1.51 0.00 0.00 37.83 36.03 1paf s LYS 115 CO 0.27 -1.03 1.04 -0.80 -0.36 0.00 0.00 175.35 174.47 1paf s ASN 116 N 2.61 5.87 -0.57 1.43 0.02 -1.26 -4.02 114.94 119.03 1paf s ASN 116 Ca 0.10 1.47 -0.18 0.00 -1.02 0.00 0.00 52.86 53.23 1paf s ASN 116 Cb -0.12 -2.45 0.11 0.00 0.02 0.00 0.00 41.25 38.81 1paf s ASN 116 CO -0.29 -1.11 0.63 -0.63 0.02 0.00 0.00 177.10 175.72 1paf s ILE 117 N -3.14 4.95 0.00 0.60 1.01 -0.79 -4.88 121.20 118.95 1paf s ILE 117 Ca 0.56 -1.10 0.00 0.00 0.00 0.00 0.00 60.65 60.11 1paf s ILE 117 Cb -0.12 -4.42 0.00 0.00 0.01 0.00 0.00 42.46 37.93 1paf s ILE 117 CO 0.54 -1.01 0.64 0.59 0.00 0.00 0.00 174.94 175.70 1paf n ASN 118 N 5.97 1.84 -3.39 3.58 3.02 -1.26 -2.70 115.26 122.32 1paf n ASN 118 Ca -0.11 -1.20 -0.10 0.00 -0.03 0.00 0.00 54.58 53.14 1paf n ASN 118 Cb 0.42 -0.33 -0.02 0.00 -0.61 0.00 0.00 39.78 39.24 1paf n ASN 118 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1paf s PHE 119 N 0.57 0.43 0.47 3.10 -0.12 -1.26 -4.97 117.98 116.21 1paf s PHE 119 Ca 0.00 -0.87 0.06 0.00 -0.05 0.00 0.00 56.93 56.07 1paf s PHE 119 Cb 0.00 0.38 0.06 0.00 -0.63 0.00 0.00 43.02 42.83 1paf s PHE 119 CO 0.00 -1.26 0.49 -0.40 -0.05 0.00 0.00 175.22 174.00 1paf n ASP 120 N -1.05 2.18 -0.37 1.98 5.68 -1.26 -2.47 116.55 121.25 1paf n ASP 120 Ca -0.03 -2.47 0.09 0.00 -0.50 0.00 0.00 54.79 51.88 1paf n ASP 120 Cb 0.61 -0.17 0.39 0.00 -1.14 0.00 0.00 41.12 40.81 1paf n ASP 120 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1paf n SER 121 N -2.11 1.10 -4.77 -1.12 3.41 -1.26 -4.57 113.62 104.30 1paf n SER 121 Ca 0.05 -1.66 -0.38 0.00 -0.26 0.00 0.00 58.87 56.62 1paf n SER 121 Cb 0.52 -0.08 -0.02 0.00 -0.26 0.00 0.00 64.21 64.37 1paf n SER 121 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1paf s ARG 122 N -1.84 4.06 0.23 4.33 0.52 -1.26 -4.85 118.95 120.13 1paf s ARG 122 Ca 0.29 1.85 -0.08 0.00 -0.52 0.00 0.00 55.73 57.27 1paf s ARG 122 Cb 0.15 -2.68 0.37 0.00 0.52 0.00 0.00 34.95 33.31 1paf s ARG 122 CO 0.23 -0.32 1.68 1.88 0.02 0.00 0.00 175.30 178.79 1paf h TYR 123 N 2.65 0.14 -0.86 -0.53 0.05 -1.99 -0.00 116.97 116.43 1paf h TYR 123 Ca -0.49 0.04 0.21 0.00 0.05 0.00 0.00 58.73 58.55 1paf h TYR 123 Cb 1.23 0.04 -0.13 0.00 1.01 0.00 0.00 36.73 38.89 1paf h TYR 123 CO 0.55 -0.11 0.31 -1.35 -1.05 0.00 0.00 178.16 176.51 1paf h PRO 124 N 0.21 0.31 -0.16 4.88 0.11 -1.98 -0.60 132.00 134.77 1paf h PRO 124 Ca 0.37 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 66.31 1paf h PRO 124 Cb 0.60 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.65 1paf h PRO 124 CO -0.50 0.21 -0.48 1.15 -0.21 0.00 0.00 178.00 178.16 1paf h THR 125 N 0.32 1.34 -0.27 -1.15 2.02 -1.36 -2.34 112.91 111.47 1paf h THR 125 Ca 0.53 -1.75 -0.05 0.00 0.77 0.00 0.00 66.41 65.92 1paf h THR 125 Cb 1.01 2.01 -0.01 0.00 -1.74 0.00 0.00 68.15 69.42 1paf h THR 125 CO -0.56 0.54 -0.01 -0.07 0.37 0.00 0.00 175.52 175.78 1paf h LEU 126 N 0.26 0.48 -0.50 2.58 3.38 -0.78 -0.43 115.31 120.29 1paf h LEU 126 Ca -0.02 -0.32 0.10 0.00 0.09 0.00 0.00 57.88 57.73 1paf h LEU 126 Cb 1.11 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 41.64 1paf h LEU 126 CO 0.10 0.69 -0.06 -0.33 0.09 0.00 0.00 178.44 178.93 1paf h GLU 127 N 0.27 0.06 0.67 1.13 4.39 -1.15 -0.24 114.58 119.70 1paf h GLU 127 Ca 0.08 -0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.74 1paf h GLU 127 Cb 0.45 -0.01 0.01 0.00 -0.10 0.00 0.00 28.75 29.09 1paf h GLU 127 CO 0.02 0.04 -0.32 1.03 -1.16 0.00 0.00 179.01 178.62 1paf h SER 128 N 0.06 -0.76 -0.03 1.42 0.87 -0.97 -0.02 113.55 114.12 1paf h SER 128 Ca 0.25 0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.77 1paf h SER 128 Cb 0.38 0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.53 1paf h SER 128 CO -0.47 -0.53 -0.13 0.11 -0.53 0.00 0.00 176.83 175.29 1paf h LYS 129 N -0.91 0.32 0.00 2.24 1.79 -0.98 -1.53 116.57 117.50 1paf h LYS 129 Ca -0.09 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.30 1paf h LYS 129 Cb 0.69 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.30 1paf h LYS 129 CO 0.15 0.46 0.00 0.00 -1.08 0.00 0.00 179.45 178.98 1paf n ALA 130 N -2.49 1.33 -2.07 3.86 0.00 -0.11 -3.98 120.51 117.06 1paf n ALA 130 Ca -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 1paf n ALA 130 Cb 0.29 -1.16 -0.00 0.00 0.00 0.00 0.00 19.45 18.58 1paf n ALA 130 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1paf n GLY 131 N -0.74 0.16 3.37 0.00 0.00 -0.57 -4.98 105.19 102.43 1paf n GLY 131 Ca 0.01 -0.65 -0.25 0.00 0.00 0.00 0.00 46.02 45.13 1paf n GLY 131 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1paf s VAL 132 N -2.28 2.08 -0.09 1.61 1.01 -0.11 -5.02 120.40 117.60 1paf s VAL 132 Ca 0.00 -1.92 -0.25 0.00 0.00 0.00 0.00 61.98 59.81 1paf s VAL 132 Cb 0.00 -1.95 -0.21 0.00 0.00 0.00 0.00 36.38 34.22 1paf s VAL 132 CO 0.00 -0.17 0.87 0.11 0.00 0.00 0.00 175.10 175.90 1paf h LYS 133 N 3.35 -0.04 -3.36 2.72 1.57 -1.96 -3.35 116.57 115.51 1paf h LYS 133 Ca -0.45 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.15 1paf h LYS 133 Cb 1.20 0.01 -0.26 0.00 0.08 0.00 0.00 32.23 33.26 1paf h LYS 133 CO 0.48 0.66 -0.53 0.45 -0.57 0.00 0.00 179.45 179.94 1paf s SER 134 N -5.90 -0.15 0.38 0.86 0.15 -1.26 -4.96 113.70 102.82 1paf s SER 134 Ca -0.16 0.27 -0.26 0.00 0.70 0.00 0.00 55.95 56.50 1paf s SER 134 Cb -0.01 0.32 -0.09 0.00 -1.71 0.00 0.00 66.02 64.53 1paf s SER 134 CO 0.60 -0.09 1.18 0.00 1.20 0.00 0.00 173.24 176.13 1paf s ARG 135 N -0.07 4.17 0.00 5.44 1.70 -1.26 -1.62 118.95 127.31 1paf s ARG 135 Ca -0.02 1.88 0.00 0.00 -0.47 0.00 0.00 55.73 57.13 1paf s ARG 135 Cb -0.02 -2.79 0.00 0.00 -0.57 0.00 0.00 34.95 31.57 1paf s ARG 135 CO 0.00 -0.24 0.00 -1.13 -1.08 0.00 0.00 175.30 172.86 1paf n SER 136 N 0.30 0.00 0.13 -2.89 3.41 -1.26 -4.82 113.62 108.49 1paf n SER 136 Ca 0.03 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.77 1paf n SER 136 Cb 0.46 0.00 0.43 0.00 -0.26 0.00 0.00 64.21 64.84 1paf n SER 136 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1paf h GLN 137 N 0.00 0.00 -5.24 4.33 4.20 -1.68 -3.40 115.11 113.32 1paf h GLN 137 Ca 0.00 0.00 -0.64 0.00 0.06 0.00 0.00 58.65 58.07 1paf h GLN 137 Cb 0.00 0.00 -0.21 0.00 0.30 0.00 0.00 27.48 27.57 1paf h GLN 137 CO 0.00 0.00 -0.65 0.54 -0.67 0.00 0.00 178.83 178.05 1paf s VAL 138 N -3.19 4.02 0.66 -0.54 0.11 -1.26 -5.06 120.40 115.13 1paf s VAL 138 Ca 0.08 -0.31 -0.14 0.00 -2.93 0.00 0.00 61.98 58.69 1paf s VAL 138 Cb 0.11 -2.78 -0.00 0.00 -1.53 0.00 0.00 36.38 32.17 1paf s VAL 138 CO 0.53 0.47 1.08 -1.10 -3.33 0.00 0.00 175.10 172.75 1paf s GLN 139 N 0.57 2.93 0.13 1.54 -0.21 -1.26 -4.78 119.66 118.57 1paf s GLN 139 Ca -0.02 1.19 0.11 0.00 0.02 0.00 0.00 55.36 56.66 1paf s GLN 139 Cb -0.14 -1.98 -0.04 0.00 1.00 0.00 0.00 33.01 31.85 1paf s GLN 139 CO 0.02 -1.12 -0.25 -0.51 -2.12 0.00 0.00 175.29 171.31 1paf s LEU 140 N -5.06 2.41 0.00 2.90 1.02 -0.25 -4.91 118.68 114.79 1paf s LEU 140 Ca 0.63 -0.72 0.00 0.00 0.02 0.00 0.00 54.13 54.06 1paf s LEU 140 Cb -0.17 -1.29 0.00 0.00 0.02 0.00 0.00 46.19 44.76 1paf s LEU 140 CO 0.45 0.17 0.00 0.61 0.02 0.00 0.00 176.35 177.61 1paf n GLY 141 N 0.82 2.85 0.13 -3.19 0.00 -1.26 -0.66 105.19 103.88 1paf n GLY 141 Ca -0.17 -0.80 -0.08 0.00 0.00 0.00 0.00 46.02 44.97 1paf n GLY 141 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1paf h ILE 142 N 1.30 0.92 0.00 -0.61 1.08 -1.85 -1.67 117.51 116.68 1paf h ILE 142 Ca 0.00 -0.07 -0.10 0.00 -0.39 0.00 0.00 64.86 64.30 1paf h ILE 142 Cb 0.00 0.68 -0.01 0.00 -3.07 0.00 0.00 36.82 34.41 1paf h ILE 142 CO 0.00 0.04 -0.46 1.56 -0.69 0.00 0.00 178.15 178.60 1paf h GLN 143 N 0.22 0.00 -0.78 2.37 7.50 -1.92 -2.53 115.11 119.96 1paf h GLN 143 Ca 0.13 0.00 -0.04 0.00 0.50 0.00 0.00 58.65 59.23 1paf h GLN 143 Cb 0.10 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 27.60 1paf h GLN 143 CO -0.14 0.46 0.32 0.82 -1.50 0.00 0.00 178.83 178.79 1paf h ILE 144 N 0.00 1.26 0.05 2.54 2.04 -1.74 0.56 117.51 122.22 1paf h ILE 144 Ca -0.00 -0.81 -0.00 0.00 1.00 0.00 0.00 64.86 65.04 1paf h ILE 144 Cb 1.11 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 1paf h ILE 144 CO 0.06 0.33 -0.02 0.25 0.00 0.00 0.00 178.15 178.77 1paf h LEU 145 N 1.13 -0.05 -0.16 1.44 5.85 -1.05 0.25 115.31 122.72 1paf h LEU 145 Ca 0.26 -0.29 0.05 0.00 0.84 0.00 0.00 57.88 58.74 1paf h LEU 145 Cb 0.21 0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.20 1paf h LEU 145 CO -0.02 0.27 -0.21 -0.78 -0.34 0.00 0.00 178.44 177.36 1paf h ASP 146 N -0.38 -0.65 0.01 1.25 3.58 -1.31 0.10 116.42 119.02 1paf h ASP 146 Ca -0.01 0.11 -0.08 0.00 0.42 0.00 0.00 57.03 57.47 1paf h ASP 146 Cb 0.34 0.30 -0.01 0.00 1.72 0.00 0.00 39.33 41.68 1paf h ASP 146 CO 0.01 -0.26 -0.23 0.77 -2.88 0.00 0.00 179.24 176.65 1paf h SER 147 N -0.25 0.37 -0.10 2.28 4.64 -0.59 -0.55 113.55 119.34 1paf h SER 147 Ca 0.11 -0.11 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 1paf h SER 147 Cb 0.41 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.39 1paf h SER 147 CO -0.31 0.61 -0.35 0.78 -0.87 0.00 0.00 176.83 176.70 1paf h ASN 148 N 0.34 0.63 -0.46 4.97 4.21 -0.58 -2.62 115.58 122.05 1paf h ASN 148 Ca 0.05 -0.26 -0.01 0.00 1.21 0.00 0.00 56.30 57.29 1paf h ASN 148 Cb 0.60 -0.17 -0.02 0.00 -1.12 0.00 0.00 38.32 37.60 1paf h ASN 148 CO 0.04 0.93 0.24 0.40 -1.29 0.00 0.00 177.43 177.74 1paf h ILE 149 N 0.51 1.18 0.00 2.81 2.04 0.78 -2.86 117.51 121.97 1paf h ILE 149 Ca 0.05 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1paf h ILE 149 Cb 0.85 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 37.57 1paf h ILE 149 CO 0.07 0.19 0.00 0.61 0.00 0.00 0.00 178.15 179.02 1paf n GLY 150 N -0.94 -1.15 0.22 5.37 0.00 -0.79 -0.88 105.19 107.02 1paf n GLY 150 Ca 0.01 0.14 0.13 0.00 0.00 0.00 0.00 46.02 46.30 1paf n GLY 150 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1paf n LYS 151 N -2.29 0.87 0.01 1.61 5.02 -1.01 -4.47 118.16 117.90 1paf n LYS 151 Ca 0.01 -0.44 0.00 0.00 -2.02 0.00 0.00 58.31 55.85 1paf n LYS 151 Cb 0.16 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 1paf n LYS 151 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1paf n ILE 152 N -0.68 0.04 -1.53 -0.18 2.08 -0.80 -4.85 119.36 113.45 1paf n ILE 152 Ca 0.14 0.01 -0.39 0.00 0.56 0.00 0.00 62.75 63.07 1paf n ILE 152 Cb 0.32 -0.92 -0.06 0.00 -0.75 0.00 0.00 39.64 38.24 1paf n ILE 152 CO 0.00 0.00 0.00 -0.24 0.56 0.00 0.00 176.55 176.87 1paf n SER 153 N -2.77 1.98 0.00 4.38 2.88 -0.06 -1.61 113.62 118.42 1paf n SER 153 Ca 0.00 -0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.33 1paf n SER 153 Cb 0.19 -1.42 0.00 0.00 -0.75 0.00 0.00 64.21 62.23 1paf n SER 153 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1paf n GLY 154 N 6.15 1.13 3.76 0.46 0.00 -1.22 -4.90 105.19 110.57 1paf n GLY 154 Ca 0.43 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.05 1paf n GLY 154 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1paf s VAL 155 N -2.90 4.56 0.10 1.61 -7.23 -0.63 -4.73 120.40 111.17 1paf s VAL 155 Ca 0.00 1.67 -0.30 0.00 -1.81 0.00 0.00 61.98 61.54 1paf s VAL 155 Cb 0.00 -4.13 -0.12 0.00 0.56 0.00 0.00 36.38 32.69 1paf s VAL 155 CO 0.00 0.44 1.49 -0.03 -0.31 0.00 0.00 175.10 176.69 1paf h MET 156 N 5.04 -0.54 -5.76 4.82 1.85 -1.96 -3.45 114.93 114.93 1paf h MET 156 Ca -0.45 0.04 -0.49 0.00 -0.61 0.00 0.00 59.70 58.19 1paf h MET 156 Cb 1.21 0.12 -0.17 0.00 0.43 0.00 0.00 31.60 33.19 1paf h MET 156 CO 0.69 -0.36 -0.77 -1.12 -0.40 0.00 0.00 176.91 174.95 1paf s SER 157 N -4.52 2.54 0.00 1.39 0.01 -1.26 -5.07 113.70 106.78 1paf s SER 157 Ca -0.14 -0.89 0.00 0.00 1.31 0.00 0.00 55.95 56.23 1paf s SER 157 Cb 0.06 -0.14 0.00 0.00 0.21 0.00 0.00 66.02 66.15 1paf s SER 157 CO 0.54 -0.09 0.00 2.22 0.41 0.00 0.00 173.24 176.32 1paf n PHE 158 N 0.18 0.00 -0.50 2.43 1.16 -1.26 -5.03 117.46 114.43 1paf n PHE 158 Ca -0.12 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.46 1paf n PHE 158 Cb 0.58 0.03 0.00 0.00 -1.61 0.00 0.00 39.48 38.48 1paf n PHE 158 CO 0.00 0.00 0.00 2.41 -1.87 0.00 0.00 176.76 177.30 1paf n THR 159 N 0.00 -1.71 -0.12 1.97 -1.04 -1.26 -4.51 114.28 107.61 1paf n THR 159 Ca 0.00 0.63 -0.07 0.00 -2.04 0.00 0.00 64.05 62.57 1paf n THR 159 Cb 0.17 -0.93 0.02 0.00 -1.82 0.00 0.00 70.33 67.77 1paf n THR 159 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1paf h GLU 160 N 0.31 0.41 0.12 -2.82 5.08 -1.98 -1.74 114.58 113.97 1paf h GLU 160 Ca 0.00 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1paf h GLU 160 Cb 0.14 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 1paf h GLU 160 CO 0.00 0.27 -0.46 -0.22 -1.00 0.00 0.00 179.01 177.60 1paf h LYS 161 N 0.42 -0.65 -0.52 2.33 3.64 -1.90 0.81 116.57 120.71 1paf h LYS 161 Ca 0.16 0.04 0.10 0.00 -1.27 0.00 0.00 60.65 59.69 1paf h LYS 161 Cb 0.05 0.15 -0.10 0.00 -0.41 0.00 0.00 32.23 31.92 1paf h LYS 161 CO -0.10 -0.43 -0.21 1.15 -2.27 0.00 0.00 179.45 177.59 1paf h THR 162 N -0.67 0.36 -0.54 1.00 2.02 -1.78 -1.51 112.91 111.78 1paf h THR 162 Ca -0.01 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.11 1paf h THR 162 Cb 0.67 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.41 1paf h THR 162 CO -0.24 0.00 0.08 -0.08 0.37 0.00 0.00 175.52 175.65 1paf h GLU 163 N -0.09 0.86 -0.67 6.66 4.81 -0.27 -2.27 114.58 123.61 1paf h GLU 163 Ca 0.24 -0.20 -0.03 0.00 -0.13 0.00 0.00 59.36 59.24 1paf h GLU 163 Cb 0.46 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 1paf h GLU 163 CO -0.58 0.80 0.28 0.00 -0.73 0.00 0.00 179.01 178.78 1paf h ALA 164 N 1.27 1.23 -0.51 2.92 0.00 0.12 -1.09 119.26 123.20 1paf h ALA 164 Ca 0.17 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1paf h ALA 164 Cb 0.37 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1paf h ALA 164 CO 0.01 0.57 0.01 0.93 0.00 0.00 0.00 179.25 180.77 1paf h GLU 165 N 0.96 0.86 0.02 0.00 5.08 -1.20 0.65 114.58 120.95 1paf h GLU 165 Ca 0.23 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1paf h GLU 165 Cb 0.17 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1paf h GLU 165 CO -0.02 0.85 -0.01 0.35 -1.00 0.00 0.00 179.01 179.18 1paf h PHE 166 N 0.80 -0.03 -0.07 4.33 3.57 -0.97 -2.89 116.94 121.68 1paf h PHE 166 Ca 0.15 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.57 1paf h PHE 166 Cb 0.46 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.20 1paf h PHE 166 CO 0.03 0.22 -0.35 -0.07 -2.23 0.00 0.00 178.31 175.91 1paf h LEU 167 N -0.27 0.14 -0.42 0.59 -0.00 -0.88 -1.77 115.31 112.70 1paf h LEU 167 Ca -0.00 -0.05 -0.01 0.00 -0.00 0.00 0.00 57.88 57.82 1paf h LEU 167 Cb 0.26 -0.04 -0.02 0.00 -0.00 0.00 0.00 40.66 40.86 1paf h LEU 167 CO 0.00 0.48 0.24 -0.07 -0.00 0.00 0.00 178.44 179.09 1paf h LEU 168 N 0.12 0.52 -0.33 1.67 3.38 -0.85 -1.74 115.31 118.08 1paf h LEU 168 Ca 0.01 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 1paf h LEU 168 Cb 0.67 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1paf h LEU 168 CO 0.05 0.45 -0.21 0.58 0.09 0.00 0.00 178.44 179.40 1paf h VAL 169 N 0.55 1.29 -0.46 1.22 2.07 -1.34 -3.18 116.25 116.40 1paf h VAL 169 Ca 0.15 -1.35 -0.12 0.00 0.82 0.00 0.00 66.70 66.21 1paf h VAL 169 Cb 0.03 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1paf h VAL 169 CO -0.03 0.44 -0.16 0.00 0.02 0.00 0.00 177.57 177.84 1paf h ALA 170 N 0.76 0.64 -0.34 1.67 0.00 -1.26 -2.19 119.26 118.54 1paf h ALA 170 Ca 0.07 -0.36 -0.13 0.00 0.00 0.00 0.00 54.91 54.48 1paf h ALA 170 Cb 0.76 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1paf h ALA 170 CO 0.06 0.59 -0.31 0.82 0.00 0.00 0.00 179.25 180.41 1paf h ILE 171 N 0.77 1.28 -0.39 0.00 2.04 -1.39 -2.86 117.51 116.96 1paf h ILE 171 Ca 0.11 -1.45 -0.12 0.00 1.00 0.00 0.00 64.86 64.40 1paf h ILE 171 Cb 0.73 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 1paf h ILE 171 CO 0.06 0.47 -0.24 1.56 0.00 0.00 0.00 178.15 180.00 1paf h GLN 172 N 0.63 0.86 -0.01 2.37 4.20 -1.51 -0.24 115.11 121.41 1paf h GLN 172 Ca 0.07 -0.40 0.00 0.00 0.06 0.00 0.00 58.65 58.39 1paf h GLN 172 Cb 0.83 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.60 1paf h GLN 172 CO 0.07 1.04 -0.21 -1.33 -0.67 0.00 0.00 178.83 177.73 1paf n MET 173 N -4.20 0.78 0.00 1.46 2.81 -0.83 -1.95 117.12 115.19 1paf n MET 173 Ca -0.02 -0.40 0.00 0.00 -1.81 0.00 0.00 57.70 55.47 1paf n MET 173 Cb 0.46 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.47 1paf n MET 173 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1paf n VAL 174 N -0.76 0.00 -0.03 2.03 0.31 -1.08 -4.62 118.33 114.18 1paf n VAL 174 Ca 0.13 0.05 -0.15 0.00 -0.01 0.00 0.00 64.34 64.36 1paf n VAL 174 Cb 0.32 -1.00 -0.10 0.00 -0.91 0.00 0.00 33.84 32.16 1paf n VAL 174 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1paf h SER 175 N 0.00 0.42 -0.68 4.52 0.02 -1.27 -2.34 113.55 114.21 1paf h SER 175 Ca 0.00 -0.67 -0.02 0.00 -0.84 0.00 0.00 61.79 60.26 1paf h SER 175 Cb 0.00 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.38 1paf h SER 175 CO 0.00 1.02 0.34 -0.33 -1.14 0.00 0.00 176.83 176.72 1paf h GLU 176 N -0.16 0.97 -0.24 3.45 4.39 -1.33 -2.41 114.58 119.26 1paf h GLU 176 Ca -0.03 -0.13 -0.04 0.00 0.34 0.00 0.00 59.36 59.50 1paf h GLU 176 Cb 1.02 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.48 1paf h GLU 176 CO 0.07 0.76 -0.01 0.00 -1.16 0.00 0.00 179.01 178.67 1paf h ALA 177 N 1.16 1.55 -0.21 3.43 0.00 -1.43 -0.76 119.26 123.00 1paf h ALA 177 Ca 0.24 -0.16 -0.19 0.00 0.00 0.00 0.00 54.91 54.80 1paf h ALA 177 Cb 0.09 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1paf h ALA 177 CO -0.03 0.33 -0.62 0.00 0.00 0.00 0.00 179.25 178.93 1paf h ALA 178 N 1.65 0.51 -0.69 0.00 0.00 -0.99 -3.15 119.26 116.60 1paf h ALA 178 Ca 0.08 -0.54 -0.06 0.00 0.00 0.00 0.00 54.91 54.39 1paf h ALA 178 Cb 0.25 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1paf h ALA 178 CO 0.01 0.69 0.19 0.00 0.00 0.00 0.00 179.25 180.14 1paf h ARG 179 N 0.54 1.08 -4.47 0.00 3.08 -1.10 -3.37 114.38 110.14 1paf h ARG 179 Ca -0.01 -0.24 -0.60 0.00 0.07 0.00 0.00 59.98 59.21 1paf h ARG 179 Cb 1.21 -0.15 -0.37 0.00 0.08 0.00 0.00 29.97 30.73 1paf h ARG 179 CO 0.13 0.93 -0.80 -0.06 -1.07 0.00 0.00 179.97 179.10 1paf s PHE 180 N -5.33 2.26 0.30 3.04 0.08 -0.32 0.08 117.98 118.09 1paf s PHE 180 Ca -0.12 -1.49 0.06 0.00 0.12 0.00 0.00 56.93 55.50 1paf s PHE 180 Cb 0.15 -1.56 0.81 0.00 -0.57 0.00 0.00 43.02 41.85 1paf s PHE 180 CO 0.84 -0.72 1.67 -0.22 -0.10 0.00 0.00 175.22 176.68 1paf h LYS 181 N 8.00 0.29 -0.11 0.44 1.63 -1.56 0.99 116.57 126.25 1paf h LYS 181 Ca -0.26 -0.02 0.04 0.00 -0.85 0.00 0.00 60.65 59.56 1paf h LYS 181 Cb 1.10 -0.07 -0.05 0.00 -0.60 0.00 0.00 32.23 32.61 1paf h LYS 181 CO 0.45 0.19 -0.24 -0.92 -3.45 0.00 0.00 179.45 175.49 1paf h TYR 182 N 0.30 -0.64 0.00 1.91 3.20 -1.80 0.87 116.97 120.81 1paf h TYR 182 Ca 0.60 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 62.39 1paf h TYR 182 Cb 1.24 0.30 -0.02 0.00 1.54 0.00 0.00 36.73 39.79 1paf h TYR 182 CO -0.16 -0.32 -0.53 0.82 -1.64 0.00 0.00 178.16 176.33 1paf h ILE 183 N -0.32 1.32 0.48 1.81 2.04 -1.16 -0.45 117.51 121.23 1paf h ILE 183 Ca 0.09 -1.84 -0.02 0.00 1.00 0.00 0.00 64.86 64.09 1paf h ILE 183 Cb 0.45 2.01 0.00 0.00 -0.74 0.00 0.00 36.82 38.55 1paf h ILE 183 CO -0.29 0.52 -0.23 -0.08 0.00 0.00 0.00 178.15 178.07 1paf h GLU 184 N 0.00 -0.62 0.00 2.37 4.81 -0.88 -2.36 114.58 117.91 1paf h GLU 184 Ca -0.01 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1paf h GLU 184 Cb 0.97 0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.49 1paf h GLU 184 CO 0.07 -0.40 0.00 -0.91 -0.73 0.00 0.00 179.01 177.04 1paf h ASN 185 N -0.66 0.00 0.20 1.04 -0.26 -0.05 -1.90 115.58 113.95 1paf h ASN 185 Ca -0.07 0.00 -0.18 0.00 -0.56 0.00 0.00 56.30 55.50 1paf h ASN 185 Cb 0.50 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.76 1paf h ASN 185 CO 0.11 0.00 -0.68 1.56 -1.06 0.00 0.00 177.43 177.36 1paf h GLN 186 N 0.00 0.44 -0.21 0.81 1.08 -0.57 -1.98 115.11 114.67 1paf h GLN 186 Ca 0.00 -0.34 -0.14 0.00 -1.45 0.00 0.00 58.65 56.72 1paf h GLN 186 Cb 0.30 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 27.79 1paf h GLN 186 CO 0.00 0.96 -0.43 0.28 -0.95 0.00 0.00 178.83 178.70 1paf h VAL 187 N 0.31 1.32 0.04 -0.54 2.07 -1.27 -2.96 116.25 115.22 1paf h VAL 187 Ca -0.02 -1.65 0.03 0.00 0.82 0.00 0.00 66.70 65.88 1paf h VAL 187 Cb 1.24 1.83 -0.04 0.00 -1.52 0.00 0.00 31.29 32.80 1paf h VAL 187 CO 0.12 0.52 -0.29 0.11 0.02 0.00 0.00 177.57 178.04 1paf h LYS 188 N 0.37 -0.44 0.00 1.57 1.57 -1.38 0.29 116.57 118.53 1paf h LYS 188 Ca 0.01 0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1paf h LYS 188 Cb 1.03 0.10 -0.00 0.00 0.08 0.00 0.00 32.23 33.44 1paf h LYS 188 CO 0.09 -0.30 -0.00 1.15 -0.57 0.00 0.00 179.45 179.83 1paf h THR 189 N -0.46 0.49 -0.09 -0.16 2.02 -1.40 -2.03 112.91 111.27 1paf h THR 189 Ca 0.05 -0.01 -0.00 0.00 0.77 0.00 0.00 66.41 67.22 1paf h THR 189 Cb 0.53 1.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.94 1paf h THR 189 CO -0.22 0.00 -0.02 0.59 0.37 0.00 0.00 175.52 176.24 1paf n ASN 190 N -3.79 2.82 -0.15 4.18 3.02 -0.45 -4.87 115.26 116.01 1paf n ASN 190 Ca -0.03 -3.11 0.28 0.00 -0.03 0.00 0.00 54.58 51.69 1paf n ASN 190 Cb 0.08 -0.47 0.67 0.00 -0.61 0.00 0.00 39.78 39.44 1paf n ASN 190 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1paf h PHE 191 N 0.62 0.00 -0.44 3.10 3.57 0.28 -0.80 116.94 123.27 1paf h PHE 191 Ca 0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1paf h PHE 191 Cb 1.16 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.90 1paf h PHE 191 CO 0.20 0.00 0.00 0.09 -2.23 0.00 0.00 178.31 176.37 1paf n ASN 192 N -3.72 4.64 -3.63 0.41 3.02 -1.26 -4.69 115.26 110.03 1paf n ASN 192 Ca 0.19 -2.83 -0.13 0.00 -0.03 0.00 0.00 54.58 51.78 1paf n ASN 192 Cb 1.11 -0.58 -0.06 0.00 -0.61 0.00 0.00 39.78 39.65 1paf n ASN 192 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1paf s ARG 193 N -2.52 0.98 0.20 3.52 1.70 -0.31 -5.11 118.95 117.42 1paf s ARG 193 Ca 0.47 -0.37 -0.30 0.00 -0.47 0.00 0.00 55.73 55.05 1paf s ARG 193 Cb 0.35 0.44 -0.09 0.00 -0.57 0.00 0.00 34.95 35.09 1paf s ARG 193 CO 0.14 -0.35 1.24 0.00 -1.08 0.00 0.00 175.30 175.25 1paf s ALA 194 N -2.68 3.47 0.37 7.88 0.00 -1.26 -4.69 121.76 124.85 1paf s ALA 194 Ca -0.04 1.03 0.04 0.00 0.00 0.00 0.00 51.96 52.99 1paf s ALA 194 Cb -0.00 -3.44 -0.05 0.00 0.00 0.00 0.00 23.12 19.63 1paf s ALA 194 CO -0.04 -0.44 0.07 -0.59 0.00 0.00 0.00 175.76 174.76 1paf s PHE 195 N -0.10 1.96 -0.15 0.00 -0.71 0.16 -4.88 117.98 114.26 1paf s PHE 195 Ca 0.54 -1.02 -0.04 0.00 -1.04 0.00 0.00 56.93 55.37 1paf s PHE 195 Cb -0.35 -1.32 -0.03 0.00 -1.21 0.00 0.00 43.02 40.11 1paf s PHE 195 CO 0.38 -0.01 -0.03 -0.80 -1.34 0.00 0.00 175.22 173.42 1paf s ASN 196 N -3.57 4.85 0.27 1.98 0.01 -1.26 -1.09 114.94 116.13 1paf s ASN 196 Ca 0.30 -0.10 -0.30 0.00 -0.71 0.00 0.00 52.86 52.06 1paf s ASN 196 Cb 0.07 -1.74 -0.10 0.00 0.41 0.00 0.00 41.25 39.88 1paf s ASN 196 CO 0.14 0.19 1.43 -2.16 -1.51 0.00 0.00 177.10 175.19 1paf s PRO 197 N 0.22 4.27 0.77 -0.60 0.04 -1.26 -5.02 135.00 133.42 1paf s PRO 197 Ca -0.02 2.31 -0.06 0.00 0.04 0.00 0.00 61.00 63.27 1paf s PRO 197 Cb -0.14 -3.10 0.13 0.00 0.04 0.00 0.00 34.50 31.43 1paf s PRO 197 CO 0.03 -0.40 1.07 0.54 0.04 0.00 0.00 177.00 178.28 1paf s ASN 198 N 0.23 4.18 0.29 6.66 2.20 -1.26 -4.79 114.94 122.44 1paf s ASN 198 Ca 0.58 0.00 0.03 0.00 -0.94 0.00 0.00 52.86 52.53 1paf s ASN 198 Cb -0.42 -0.38 0.62 0.00 -2.00 0.00 0.00 41.25 39.07 1paf s ASN 198 CO 0.45 -1.99 1.80 -0.65 -2.94 0.00 0.00 177.10 173.77 1paf h PRO 199 N -0.80 0.81 -0.35 3.55 0.11 -1.82 -2.36 132.00 131.15 1paf h PRO 199 Ca -0.41 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.55 1paf h PRO 199 Cb 1.27 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1paf h PRO 199 CO 0.45 0.54 -0.22 -0.22 -0.21 0.00 0.00 178.00 178.34 1paf h LYS 200 N 0.84 0.67 -0.15 1.05 3.64 -1.79 -0.18 116.57 120.64 1paf h LYS 200 Ca 0.52 -0.26 -0.21 0.00 -1.27 0.00 0.00 60.65 59.44 1paf h LYS 200 Cb 0.68 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 32.47 1paf h LYS 200 CO -0.33 0.84 -0.74 -0.39 -2.27 0.00 0.00 179.45 176.56 1paf h VAL 201 N 0.59 1.30 -0.33 2.00 -1.51 -1.79 -1.76 116.25 114.75 1paf h VAL 201 Ca 0.09 -1.98 -0.08 0.00 -1.23 0.00 0.00 66.70 63.50 1paf h VAL 201 Cb 0.69 1.96 -0.02 0.00 -2.13 0.00 0.00 31.29 31.80 1paf h VAL 201 CO 0.05 0.62 -0.13 -0.07 -1.23 0.00 0.00 177.57 176.81 1paf h LEU 202 N 0.50 0.57 -0.58 4.19 3.38 -1.47 0.44 115.31 122.33 1paf h LEU 202 Ca -0.04 -0.16 -0.15 0.00 0.09 0.00 0.00 57.88 57.62 1paf h LEU 202 Cb 1.35 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 1paf h LEU 202 CO 0.15 0.73 -0.51 -1.13 0.09 0.00 0.00 178.44 177.76 1paf h ASN 203 N 0.53 0.57 -0.21 -0.43 -1.24 -0.81 -1.98 115.58 112.01 1paf h ASN 203 Ca 0.09 -0.29 -0.12 0.00 0.71 0.00 0.00 56.30 56.69 1paf h ASN 203 Cb 0.54 -0.16 -0.00 0.00 0.73 0.00 0.00 38.32 39.42 1paf h ASN 203 CO 0.03 0.98 -0.35 0.25 -1.29 0.00 0.00 177.43 177.06 1paf h LEU 204 N 0.41 0.67 -0.61 0.34 5.85 -1.11 0.11 115.31 120.97 1paf h LEU 204 Ca 0.02 -0.53 0.13 0.00 0.84 0.00 0.00 57.88 58.33 1paf h LEU 204 Cb 1.04 -0.19 -0.11 0.00 0.37 0.00 0.00 40.66 41.77 1paf h LEU 204 CO 0.10 1.07 -0.02 1.56 -0.34 0.00 0.00 178.44 180.80 1paf h GLN 205 N 0.29 0.09 0.00 1.25 4.20 -0.69 -2.43 115.11 117.82 1paf h GLN 205 Ca 0.02 -0.01 -0.12 0.00 0.06 0.00 0.00 58.65 58.60 1paf h GLN 205 Cb 0.94 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.68 1paf h GLN 205 CO 0.08 0.06 -0.58 0.93 -0.67 0.00 0.00 178.83 178.65 1paf h GLU 206 N 0.10 0.00 -0.66 1.46 5.08 -0.67 -3.29 114.58 116.59 1paf h GLU 206 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1paf h GLU 206 Cb 0.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1paf h GLU 206 CO -0.54 0.58 0.00 0.25 -1.00 0.00 0.00 179.01 178.30 1paf n THR 207 N -3.30 1.27 -0.01 1.13 -2.24 0.32 -4.65 114.28 106.80 1paf n THR 207 Ca 0.01 -1.08 0.14 0.00 -2.27 0.00 0.00 64.05 60.85 1paf n THR 207 Cb 0.74 0.38 0.57 0.00 -2.10 0.00 0.00 70.33 69.92 1paf n THR 207 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 175.07 174.25 1paf h TRP 208 N 3.92 0.25 0.02 4.78 7.01 -1.52 -0.26 115.95 130.15 1paf h TRP 208 Ca 0.00 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.01 1paf h TRP 208 Cb 1.10 -0.08 0.00 0.00 -2.10 0.00 0.00 29.16 28.08 1paf h TRP 208 CO 0.54 0.12 -0.01 0.78 -2.79 0.00 0.00 178.44 177.08 1paf h GLY 209 N 0.24 -0.03 1.01 2.65 0.00 -1.88 -2.79 103.07 102.26 1paf h GLY 209 Ca 0.23 0.01 -0.04 0.00 0.00 0.00 0.00 47.33 47.53 1paf h GLY 209 CO -0.04 -0.01 0.21 1.70 0.00 0.00 0.00 176.54 178.40 1paf h LYS 210 N -0.31 0.94 -0.17 4.80 3.64 -1.65 -2.07 116.57 121.75 1paf h LYS 210 Ca -0.00 -0.19 -0.00 0.00 -1.27 0.00 0.00 60.65 59.18 1paf h LYS 210 Cb 0.30 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 1paf h LYS 210 CO 0.00 0.83 0.10 0.82 -2.27 0.00 0.00 179.45 178.93 1paf h ILE 211 N 0.87 1.08 -0.79 2.00 2.04 -1.11 -2.11 117.51 119.50 1paf h ILE 211 Ca 0.20 -0.20 0.05 0.00 1.00 0.00 0.00 64.86 65.91 1paf h ILE 211 Cb 0.26 0.90 -0.05 0.00 -0.74 0.00 0.00 36.82 37.19 1paf h ILE 211 CO -0.01 0.07 0.49 0.28 0.00 0.00 0.00 178.15 178.98 1paf h SER 212 N 0.19 0.78 -0.24 1.72 0.02 -1.18 -0.80 113.55 114.05 1paf h SER 212 Ca 0.06 0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 60.90 1paf h SER 212 Cb 0.03 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 62.41 1paf h SER 212 CO -0.01 0.52 -0.33 0.74 -1.14 0.00 0.00 176.83 176.61 1paf h THR 213 N 0.92 1.32 -0.59 -2.27 2.02 -1.22 -1.65 112.91 111.44 1paf h THR 213 Ca 0.33 -1.53 0.02 0.00 0.77 0.00 0.00 66.41 66.01 1paf h THR 213 Cb 0.10 1.73 -0.04 0.00 -1.74 0.00 0.00 68.15 68.21 1paf h THR 213 CO -0.15 0.48 0.37 0.00 0.37 0.00 0.00 175.52 176.59 1paf h ALA 214 N 0.65 0.76 0.08 6.16 0.00 -0.78 0.81 119.26 126.94 1paf h ALA 214 Ca 0.03 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1paf h ALA 214 Cb 0.91 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1paf h ALA 214 CO 0.08 0.12 -0.04 0.82 0.00 0.00 0.00 179.25 180.24 1paf h ILE 215 N 0.74 1.16 -0.68 0.00 1.08 -1.22 -2.02 117.51 116.58 1paf h ILE 215 Ca 0.23 -0.90 0.07 0.00 -0.39 0.00 0.00 64.86 63.87 1paf h ILE 215 Cb -0.02 1.74 -0.06 0.00 -3.07 0.00 0.00 36.82 35.41 1paf h ILE 215 CO -0.08 0.22 0.36 -0.74 -0.69 0.00 0.00 178.15 177.22 1paf h HIS 216 N -0.51 0.66 -0.03 1.37 2.76 -0.95 -2.77 115.15 115.69 1paf h HIS 216 Ca -0.01 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.19 1paf h HIS 216 Cb 0.44 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 29.20 1paf h HIS 216 CO 0.06 0.30 0.00 -0.25 -1.30 0.00 0.00 177.93 176.74 1paf n ASP 217 N -4.81 1.11 -4.77 3.26 8.00 0.25 -4.55 116.55 115.05 1paf n ASP 217 Ca 0.09 -1.40 -0.40 0.00 0.71 0.00 0.00 54.79 53.79 1paf n ASP 217 Cb 0.20 -0.01 0.01 0.00 -0.02 0.00 0.00 41.12 41.30 1paf n ASP 217 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1paf s ALA 218 N -1.98 3.22 -0.14 2.24 0.00 -0.76 -4.63 121.76 119.71 1paf s ALA 218 Ca 0.40 1.41 -0.03 0.00 0.00 0.00 0.00 51.96 53.74 1paf s ALA 218 Cb 0.21 -3.57 -0.03 0.00 0.00 0.00 0.00 23.12 19.73 1paf s ALA 218 CO 0.33 -1.13 -0.04 0.15 0.00 0.00 0.00 175.76 175.07 1paf s LYS 219 N -2.44 3.55 -0.58 0.00 3.01 -0.91 -4.52 119.74 117.85 1paf s LYS 219 Ca 0.61 -0.53 -0.01 0.00 -1.01 0.00 0.00 55.97 55.03 1paf s LYS 219 Cb -0.42 -2.86 0.01 0.00 -1.01 0.00 0.00 37.83 33.54 1paf s LYS 219 CO 0.54 0.30 0.03 0.09 0.51 0.00 0.00 175.35 176.82 1paf n ASN 220 N 3.35 -2.49 0.00 2.83 4.13 -1.26 -0.80 115.26 121.02 1paf n ASN 220 Ca -0.18 0.29 0.00 0.00 1.68 0.00 0.00 54.58 56.37 1paf n ASN 220 Cb 0.53 -2.19 0.00 0.00 -1.54 0.00 0.00 39.78 36.58 1paf n ASN 220 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1paf n GLY 221 N -0.68 0.77 3.69 7.41 0.00 -1.26 -5.01 105.19 110.11 1paf n GLY 221 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 1paf n GLY 221 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1paf s VAL 222 N -2.93 5.33 0.53 1.61 1.01 0.02 -1.00 120.40 124.97 1paf s VAL 222 Ca 0.00 0.34 -0.20 0.00 0.00 0.00 0.00 61.98 62.12 1paf s VAL 222 Cb 0.00 -3.56 -0.06 0.00 0.00 0.00 0.00 36.38 32.77 1paf s VAL 222 CO 0.00 0.36 1.17 -0.76 0.00 0.00 0.00 175.10 175.87 1paf s LEU 223 N 0.84 3.80 0.27 3.92 1.02 -0.32 -2.14 118.68 126.07 1paf s LEU 223 Ca 0.11 2.29 0.00 0.00 0.02 0.00 0.00 54.13 56.56 1paf s LEU 223 Cb -0.13 -4.48 0.56 0.00 0.02 0.00 0.00 46.19 42.15 1paf s LEU 223 CO 0.03 -1.25 1.78 -0.65 0.02 0.00 0.00 176.35 176.28 1paf h PRO 224 N 1.36 0.70 -3.75 1.29 0.11 -1.82 -3.40 132.00 126.48 1paf h PRO 224 Ca -0.50 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 65.43 1paf h PRO 224 Cb 1.27 -0.16 -0.19 0.00 0.11 0.00 0.00 31.00 32.03 1paf h PRO 224 CO 0.57 0.46 -0.55 -1.59 -0.21 0.00 0.00 178.00 176.68 1paf s LYS 225 N -5.96 0.49 0.53 1.05 -2.85 -1.26 -5.12 119.74 106.63 1paf s LYS 225 Ca -0.12 -0.61 -0.19 0.00 -1.00 0.00 0.00 55.97 54.05 1paf s LYS 225 Cb 0.22 0.19 -0.10 0.00 -2.06 0.00 0.00 37.83 36.09 1paf s LYS 225 CO 0.79 -0.11 0.53 -0.35 0.10 0.00 0.00 175.35 176.30 1paf n PRO 226 N 1.17 0.55 -4.70 1.78 -0.04 -1.26 -4.97 135.00 127.52 1paf n PRO 226 Ca -0.21 0.21 -0.33 0.00 -0.04 0.00 0.00 63.50 63.13 1paf n PRO 226 Cb 0.57 -1.66 -0.15 0.00 -0.04 0.00 0.00 33.50 32.22 1paf n PRO 226 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1paf s LEU 227 N 1.00 2.53 -0.27 1.53 2.96 0.22 -4.95 118.68 121.70 1paf s LEU 227 Ca 0.67 -0.42 -0.02 0.00 -0.22 0.00 0.00 54.13 54.13 1paf s LEU 227 Cb -0.48 -1.57 0.03 0.00 0.50 0.00 0.00 46.19 44.68 1paf s LEU 227 CO 0.55 0.12 -0.02 -1.61 -1.32 0.00 0.00 176.35 174.08 1paf s GLU 228 N 0.58 2.72 0.40 1.98 2.02 -1.26 -0.30 118.70 124.84 1paf s GLU 228 Ca -0.09 -1.07 0.00 0.00 0.02 0.00 0.00 54.97 53.83 1paf s GLU 228 Cb -0.16 -3.11 -0.00 0.00 0.10 0.00 0.00 34.13 30.96 1paf s GLU 228 CO 0.03 -0.49 0.01 1.28 0.02 0.00 0.00 175.26 176.11 1paf n LEU 229 N 4.68 0.00 -4.29 1.80 4.32 0.93 -4.93 117.00 119.51 1paf n LEU 229 Ca -0.15 -2.52 -0.30 0.00 -0.02 0.00 0.00 56.01 53.02 1paf n LEU 229 Cb 0.46 0.32 -0.16 0.00 -1.62 0.00 0.00 43.42 42.41 1paf n LEU 229 CO 0.27 -0.36 -0.56 -0.69 -1.22 0.00 0.00 177.39 174.83 1paf s VAL 230 N -2.47 1.96 0.11 4.08 1.01 -1.26 -0.03 120.40 123.80 1paf s VAL 230 Ca 0.01 -1.06 0.01 0.00 0.00 0.00 0.00 61.98 60.94 1paf s VAL 230 Cb 0.00 -1.63 0.02 0.00 0.00 0.00 0.00 36.38 34.78 1paf s VAL 230 CO 0.01 0.55 0.16 -0.90 0.00 0.00 0.00 175.10 174.92 1paf n ASP 231 N 2.47 0.28 0.18 3.32 5.68 0.19 -4.51 116.55 124.16 1paf n ASP 231 Ca -0.16 -1.22 0.14 0.00 -0.50 0.00 0.00 54.79 53.05 1paf n ASP 231 Cb 0.51 -0.09 0.56 0.00 -1.14 0.00 0.00 41.12 40.95 1paf n ASP 231 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1paf h ALA 232 N -0.09 1.00 0.00 2.12 0.00 -1.94 -2.14 119.26 118.21 1paf h ALA 232 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1paf h ALA 232 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1paf h ALA 232 CO 0.06 0.00 -0.52 0.66 0.00 0.00 0.00 179.25 179.45 1paf h SER 233 N 0.00 0.00 0.00 0.00 4.64 -1.99 -3.38 113.55 112.82 1paf h SER 233 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1paf h SER 233 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1paf h SER 233 CO 0.00 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.58 1paf n GLY 234 N 1.16 0.80 3.86 -0.77 0.00 -0.81 -4.98 105.19 104.44 1paf n GLY 234 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1paf n GLY 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1paf s ALA 235 N -2.00 3.52 0.43 4.61 0.00 -1.26 -4.80 121.76 122.26 1paf s ALA 235 Ca 0.00 -0.15 -0.23 0.00 0.00 0.00 0.00 51.96 51.57 1paf s ALA 235 Cb 0.00 -2.54 -0.11 0.00 0.00 0.00 0.00 23.12 20.48 1paf s ALA 235 CO 0.00 0.45 0.91 1.63 0.00 0.00 0.00 175.76 178.75 1paf n LYS 236 N 0.17 1.15 -3.81 0.00 4.01 -1.26 -0.64 118.16 117.78 1paf n LYS 236 Ca -0.01 0.41 -0.20 0.00 -0.51 0.00 0.00 58.31 58.00 1paf n LYS 236 Cb 0.52 -1.93 -0.17 0.00 -0.51 0.00 0.00 35.03 32.94 1paf n LYS 236 CO 0.00 0.00 0.00 -0.46 -1.11 0.00 0.00 177.40 175.83 1paf s TRP 237 N -1.33 0.38 -0.15 2.13 -0.00 0.96 -4.71 118.94 116.22 1paf s TRP 237 Ca 0.64 0.01 -0.01 0.00 -0.00 0.00 0.00 56.10 56.74 1paf s TRP 237 Cb -0.56 -0.57 -0.02 0.00 -0.00 0.00 0.00 33.47 32.32 1paf s TRP 237 CO 0.56 -0.22 -0.10 0.42 -0.00 0.00 0.00 176.95 177.61 1paf s ILE 238 N 1.68 3.22 -0.03 5.86 1.01 -1.26 -0.05 121.20 131.63 1paf s ILE 238 Ca -0.00 -0.59 0.07 0.00 0.00 0.00 0.00 60.65 60.12 1paf s ILE 238 Cb -0.13 -2.38 -0.02 0.00 0.01 0.00 0.00 42.46 39.95 1paf s ILE 238 CO -0.03 0.51 -0.24 0.68 0.00 0.00 0.00 174.94 175.85 1paf s VAL 239 N 0.52 1.90 -0.16 2.92 -7.23 0.59 -4.93 120.40 114.01 1paf s VAL 239 Ca -0.07 -1.02 0.10 0.00 -1.81 0.00 0.00 61.98 59.19 1paf s VAL 239 Cb -0.15 -1.58 -0.17 0.00 0.56 0.00 0.00 36.38 35.04 1paf s VAL 239 CO 0.04 0.54 0.00 0.18 -0.31 0.00 0.00 175.10 175.54 1paf n LEU 240 N 2.60 0.69 -4.62 1.32 4.77 -1.26 -0.61 117.00 119.89 1paf n LEU 240 Ca -0.16 -0.02 -0.23 0.00 -0.03 0.00 0.00 56.01 55.56 1paf n LEU 240 Cb 0.52 0.13 -0.08 0.00 -2.33 0.00 0.00 43.42 41.66 1paf n LEU 240 CO 0.24 0.47 -0.34 -0.13 -1.33 0.00 0.00 177.39 176.29 1paf s ARG 241 N -2.36 2.20 0.20 3.23 3.00 -1.26 -1.18 118.95 122.78 1paf s ARG 241 Ca -0.11 -1.48 -0.02 0.00 0.00 0.00 0.00 55.73 54.11 1paf s ARG 241 Cb 0.05 -2.10 0.13 0.00 0.00 0.00 0.00 34.95 33.03 1paf s ARG 241 CO 0.56 0.35 1.51 -0.39 0.00 0.00 0.00 175.30 177.33 1paf h VAL 242 N 1.93 1.33 -1.00 3.52 -1.51 -1.44 -2.80 116.25 116.29 1paf h VAL 242 Ca -0.44 -1.83 0.20 0.00 -1.23 0.00 0.00 66.70 63.40 1paf h VAL 242 Cb 1.25 1.82 -0.10 0.00 -2.13 0.00 0.00 31.29 32.13 1paf h VAL 242 CO 0.61 0.57 0.61 0.44 -1.23 0.00 0.00 177.57 178.57 1paf h ASP 243 N 0.39 0.73 -1.00 4.19 3.32 -1.97 -1.41 116.42 120.66 1paf h ASP 243 Ca 0.00 0.09 0.08 0.00 0.02 0.00 0.00 57.03 57.23 1paf h ASP 243 Cb 1.10 -0.04 -0.07 0.00 0.22 0.00 0.00 39.33 40.54 1paf h ASP 243 CO 0.10 0.25 0.64 -0.33 -1.72 0.00 0.00 179.24 178.19 1paf h GLU 244 N 0.70 1.08 0.00 3.56 5.08 -1.89 -3.32 114.58 119.79 1paf h GLU 244 Ca 0.57 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.81 1paf h GLU 244 Cb 0.96 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 1paf h GLU 244 CO -0.35 0.71 -1.71 1.51 -1.00 0.00 0.00 179.01 178.17 1paf n ILE 245 N -4.55 0.22 -0.35 3.13 0.13 -0.71 -4.65 119.36 112.57 1paf n ILE 245 Ca 0.17 -0.38 0.07 0.00 -1.10 0.00 0.00 62.75 61.50 1paf n ILE 245 Cb 0.24 -0.02 0.24 0.00 -0.84 0.00 0.00 39.64 39.26 1paf n ILE 245 CO 0.00 0.00 0.00 0.50 2.80 0.00 0.00 176.55 179.85 1paf h LYS 246 N 0.00 0.98 0.00 9.51 3.64 -1.39 -0.56 116.57 128.75 1paf h LYS 246 Ca -0.09 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1paf h LYS 246 Cb 0.93 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1paf h LYS 246 CO 0.00 0.65 0.21 -1.00 -2.27 0.00 0.00 179.45 177.04 1paf h PRO 247 N 1.01 0.00 -0.02 1.90 0.13 -1.83 -2.10 132.00 131.09 1paf h PRO 247 Ca 0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.61 1paf h PRO 247 Cb 0.44 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.57 1paf h PRO 247 CO -0.24 0.00 -0.21 -0.25 -0.23 0.00 0.00 178.00 177.07 1paf n ASP 248 N -2.88 1.92 -4.32 1.44 8.00 -0.22 -4.63 116.55 115.86 1paf n ASP 248 Ca -0.02 -1.48 -0.35 0.00 0.71 0.00 0.00 54.79 53.65 1paf n ASP 248 Cb 0.26 0.18 -0.14 0.00 -0.02 0.00 0.00 41.12 41.41 1paf n ASP 248 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1paf s VAL 249 N -2.27 3.51 -0.14 2.53 1.01 -0.79 -1.91 120.40 122.34 1paf s VAL 249 Ca 0.26 -0.57 0.06 0.00 0.00 0.00 0.00 61.98 61.73 1paf s VAL 249 Cb 0.19 -2.66 -0.23 0.00 0.00 0.00 0.00 36.38 33.68 1paf s VAL 249 CO 0.45 0.32 0.29 0.00 0.00 0.00 0.00 175.10 176.16 1paf n ALA 250 N 4.81 1.30 -2.86 5.51 0.00 0.11 -4.78 120.51 124.60 1paf n ALA 250 Ca -0.17 -0.89 -0.13 0.00 0.00 0.00 0.00 53.44 52.26 1paf n ALA 250 Cb 0.50 -0.53 -0.13 0.00 0.00 0.00 0.00 19.45 19.29 1paf n ALA 250 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1paf s LEU 251 N -6.35 2.09 0.03 0.00 1.43 -0.19 -4.52 118.68 111.18 1paf s LEU 251 Ca -0.17 -0.22 -0.06 0.00 -1.03 0.00 0.00 54.13 52.66 1paf s LEU 251 Cb 0.07 -0.08 -0.05 0.00 0.03 0.00 0.00 46.19 46.16 1paf s LEU 251 CO 0.77 -0.08 0.28 -0.76 0.23 0.00 0.00 176.35 176.79 1paf s LEU 252 N -0.59 4.36 0.66 1.79 1.43 -0.23 -4.88 118.68 121.22 1paf s LEU 252 Ca -0.04 0.55 -0.14 0.00 -1.03 0.00 0.00 54.13 53.46 1paf s LEU 252 Cb -0.04 -2.76 -0.00 0.00 0.03 0.00 0.00 46.19 43.42 1paf s LEU 252 CO -0.00 0.23 1.09 0.21 0.23 0.00 0.00 176.35 178.11 1paf s ASN 253 N -1.82 5.22 0.03 2.29 3.04 -1.26 -1.53 114.94 120.91 1paf s ASN 253 Ca 0.29 1.91 -0.30 0.00 0.04 0.00 0.00 52.86 54.79 1paf s ASN 253 Cb -0.13 -2.54 -0.06 0.00 -1.54 0.00 0.00 41.25 36.98 1paf s ASN 253 CO 0.18 -1.55 1.42 -0.47 -3.04 0.00 0.00 177.10 173.63 1paf s TYR 254 N -2.48 2.91 -0.08 0.43 5.04 -1.25 -4.52 117.35 117.41 1paf s TYR 254 Ca 0.65 0.81 0.02 0.00 -2.44 0.00 0.00 57.07 56.11 1paf s TYR 254 Cb -0.18 -3.69 0.02 0.00 0.35 0.00 0.00 41.96 38.45 1paf s TYR 254 CO 0.43 -2.53 -0.11 0.08 -1.34 0.00 0.00 175.55 172.08 1paf s VAL 255 N 2.12 1.11 0.28 3.14 1.01 -1.26 -5.04 120.40 121.75 1paf s VAL 255 Ca 0.65 -0.43 -0.29 0.00 0.00 0.00 0.00 61.98 61.90 1paf s VAL 255 Cb -0.33 -1.04 -0.10 0.00 0.00 0.00 0.00 36.38 34.91 1paf s VAL 255 CO 0.28 0.36 1.35 -0.83 0.00 0.00 0.00 175.10 176.25 1paf s GLY 256 N 0.93 2.68 0.00 4.51 0.00 -1.26 -4.89 107.32 109.29 1paf s GLY 256 Ca -0.10 1.25 0.00 0.00 0.00 0.00 0.00 44.72 45.87 1paf s GLY 256 CO 0.01 2.05 0.00 0.61 0.00 0.00 0.00 173.10 175.77 1paf n GLY 257 N 1.55 0.51 3.48 0.20 0.00 -1.26 -5.07 105.19 104.60 1paf n GLY 257 Ca 0.03 -2.27 -0.29 0.00 0.00 0.00 0.00 46.02 43.50 1paf n GLY 257 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1paf s SER 258 N -4.00 3.81 0.20 1.61 1.04 -1.26 -5.15 113.70 109.96 1paf s SER 258 Ca 0.00 -0.63 -0.09 0.00 0.48 0.00 0.00 55.95 55.71 1paf s SER 258 Cb 0.00 -0.49 -0.01 0.00 0.10 0.00 0.00 66.02 65.62 1paf s SER 258 CO 0.00 0.16 0.33 0.00 0.98 0.00 0.00 173.24 174.71 1paf s GLN 260 N -4.01 3.83 0.07 0.00 -0.44 -1.26 -4.86 119.66 112.99 1paf s GLN 260 Ca 0.22 1.32 -0.19 0.00 -2.50 0.00 0.00 55.36 54.21 1paf s GLN 260 Cb 0.02 -3.94 -0.10 0.00 -1.64 0.00 0.00 33.01 27.35 1paf s GLN 260 CO 0.05 -1.23 1.46 1.15 0.50 0.00 0.00 175.29 177.22 1paf h THR 261 N 6.08 1.28 0.00 -0.34 2.02 -1.93 0.36 112.91 120.39 1paf h THR 261 Ca -0.28 -1.03 0.00 0.00 0.77 0.00 0.00 66.41 65.87 1paf h THR 261 Cb 1.11 1.53 0.00 0.00 -1.74 0.00 0.00 68.15 69.05 1paf h THR 261 CO 1.03 0.31 0.00 0.35 0.37 0.00 0.00 175.52 177.59