#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rlo s ALA 2 N 0.00 2.83 -0.02 5.13 0.00 -1.26 -4.93 121.76 123.51 2rlo s ALA 2 Ca 0.00 -2.01 0.02 0.00 0.00 0.00 0.00 51.96 49.97 2rlo s ALA 2 Cb 0.00 -0.09 0.01 0.00 0.00 0.00 0.00 23.12 23.04 2rlo s ALA 2 CO 0.00 0.13 -0.06 0.42 0.00 0.00 0.00 175.76 176.25 2rlo s ILE 3 N -2.62 0.53 0.11 0.00 1.01 -1.26 -4.89 121.20 114.08 2rlo s ILE 3 Ca 0.31 -0.20 -0.31 0.00 0.00 0.00 0.00 60.65 60.45 2rlo s ILE 3 Cb 0.00 -0.50 -0.10 0.00 0.01 0.00 0.00 42.46 41.87 2rlo s ILE 3 CO 0.16 0.19 1.83 -2.84 0.00 0.00 0.00 174.94 174.28 2rlo s PRO 4 N 0.37 4.14 0.11 2.79 0.02 -1.26 0.53 135.00 141.70 2rlo s PRO 4 Ca -0.05 2.59 0.22 0.00 0.02 0.00 0.00 61.00 63.78 2rlo s PRO 4 Cb -0.09 -3.64 -0.12 0.00 0.02 0.00 0.00 34.50 30.67 2rlo s PRO 4 CO -0.00 -0.85 0.84 -0.89 -0.33 0.00 0.00 177.00 175.77 2rlo n ILE 5 N 4.81 0.38 0.00 2.83 2.08 0.83 -4.85 119.36 125.43 2rlo n ILE 5 Ca 0.18 -0.52 0.00 0.00 0.56 0.00 0.00 62.75 62.97 2rlo n ILE 5 Cb 0.38 -0.20 0.00 0.00 -0.75 0.00 0.00 39.64 39.08 2rlo n ILE 5 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28 2rlo n LYS 6 N -2.50 0.00 -3.91 0.38 3.00 -0.74 -4.87 118.16 109.52 2rlo n LYS 6 Ca -0.01 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 58.01 2rlo n LYS 6 Cb 0.55 0.00 -0.16 0.00 0.00 0.00 0.00 35.03 35.42 2rlo n LYS 6 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.40 176.26 2rlo s GLN 7 N 0.00 1.52 0.14 1.64 0.74 -1.26 0.79 119.66 123.23 2rlo s GLN 7 Ca 0.00 -0.68 -0.15 0.00 0.05 0.00 0.00 55.36 54.58 2rlo s GLN 7 Cb 0.00 -2.22 0.05 0.00 1.10 0.00 0.00 33.01 31.94 2rlo s GLN 7 CO 0.00 -0.49 0.74 -1.13 -0.55 0.00 0.00 175.29 173.87 2rlo n SER 8 N 4.81 -1.27 -4.80 6.67 3.41 -0.12 -4.99 113.62 117.32 2rlo n SER 8 Ca -0.12 -1.68 -0.37 0.00 -0.26 0.00 0.00 58.87 56.44 2rlo n SER 8 Cb 0.47 2.07 -0.06 0.00 -0.26 0.00 0.00 64.21 66.43 2rlo n SER 8 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2rlo s PHE 9 N -3.21 3.74 0.08 7.33 0.08 -1.26 -0.58 117.98 124.16 2rlo s PHE 9 Ca 0.16 1.53 0.03 0.00 0.12 0.00 0.00 56.93 58.77 2rlo s PHE 9 Cb -0.02 -2.71 -0.03 0.00 -0.57 0.00 0.00 43.02 39.68 2rlo s PHE 9 CO 0.04 0.38 -0.08 -0.51 -0.10 0.00 0.00 175.22 174.94 2rlo s LEU 10 N -1.72 2.39 -0.02 -0.37 1.02 -0.74 -4.28 118.68 114.97 2rlo s LEU 10 Ca 0.42 -0.79 -0.18 0.00 0.02 0.00 0.00 54.13 53.59 2rlo s LEU 10 Cb -0.19 -0.19 -0.05 0.00 0.02 0.00 0.00 46.19 45.78 2rlo s LEU 10 CO 0.23 -0.31 0.51 -0.22 0.02 0.00 0.00 176.35 176.58 2rlo s LEU 11 N -2.37 4.41 -0.21 1.79 2.96 -0.97 0.11 118.68 124.40 2rlo s LEU 11 Ca 0.03 1.03 0.00 0.00 -0.22 0.00 0.00 54.13 54.97 2rlo s LEU 11 Cb -0.02 -2.76 0.05 0.00 0.50 0.00 0.00 46.19 43.95 2rlo s LEU 11 CO -0.01 0.16 -0.07 -0.75 -1.32 0.00 0.00 176.35 174.36 2rlo s LYS 12 N -0.35 1.73 0.58 1.98 2.47 -0.55 -0.74 119.74 124.85 2rlo s LYS 12 Ca 0.27 -0.82 -0.20 0.00 -1.56 0.00 0.00 55.97 53.66 2rlo s LYS 12 Cb -0.17 -2.39 -0.04 0.00 -1.46 0.00 0.00 37.83 33.76 2rlo s LYS 12 CO 0.15 -0.50 1.19 2.89 0.16 0.00 0.00 175.35 179.24 2rlo n ARG 13 N 4.72 1.28 -3.15 4.03 1.85 -1.25 -1.49 116.66 122.65 2rlo n ARG 13 Ca -0.13 0.48 0.06 0.00 -1.00 0.00 0.00 57.85 57.26 2rlo n ARG 13 Cb 0.46 -2.40 -0.00 0.00 -1.05 0.00 0.00 32.46 29.47 2rlo n ARG 13 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 2rlo s SER 14 N -1.11 -0.23 0.00 2.89 0.15 0.30 -4.87 113.70 110.83 2rlo s SER 14 Ca 0.75 0.04 0.00 0.00 0.70 0.00 0.00 55.95 57.44 2rlo s SER 14 Cb -0.42 1.15 0.00 0.00 -1.71 0.00 0.00 66.02 65.04 2rlo s SER 14 CO 0.47 -0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.48 2rlo n GLY 15 N 5.11 3.17 1.44 9.45 0.00 -1.26 -4.60 105.19 118.50 2rlo n GLY 15 Ca 0.08 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2rlo n GLY 15 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2rlo n ASN 16 N 0.00 -7.79 -0.07 1.61 2.85 -1.26 -4.15 115.26 106.45 2rlo n ASN 16 Ca 0.00 1.71 -0.09 0.00 -0.11 0.00 0.00 54.58 56.10 2rlo n ASN 16 Cb 0.00 -4.58 -0.05 0.00 1.24 0.00 0.00 39.78 36.39 2rlo n ASN 16 CO 0.00 0.00 0.00 -1.28 -2.11 0.00 0.00 177.26 173.87 2rlo h SER 17 N 0.19 0.00 -0.36 1.20 0.87 -2.01 -3.40 113.55 110.05 2rlo h SER 17 Ca 0.00 -0.23 -0.14 0.00 -1.23 0.00 0.00 61.79 60.19 2rlo h SER 17 Cb 0.87 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.82 2rlo h SER 17 CO 0.00 0.89 -0.32 -0.07 -0.53 0.00 0.00 176.83 176.80 2rlo h LEU 18 N -1.00 0.91 -7.76 2.23 4.07 -2.06 -3.36 115.31 108.34 2rlo h LEU 18 Ca -0.08 -0.46 -0.75 0.00 0.08 0.00 0.00 57.88 56.67 2rlo h LEU 18 Cb 0.63 -0.26 -0.22 0.00 1.08 0.00 0.00 40.66 41.90 2rlo h LEU 18 CO -0.05 1.18 0.79 0.20 -1.08 0.00 0.00 178.44 179.48 2rlo s ASN 19 N -6.70 6.99 1.06 -0.43 0.01 -1.26 -5.03 114.94 109.57 2rlo s ASN 19 Ca -0.12 -2.89 -0.13 0.00 -0.71 0.00 0.00 52.86 49.01 2rlo s ASN 19 Cb 0.10 -2.32 0.17 0.00 0.41 0.00 0.00 41.25 39.61 2rlo s ASN 19 CO 0.86 -0.67 0.73 0.29 -1.51 0.00 0.00 177.10 176.80 2rlo n LYS 20 N 4.80 -1.37 -3.13 -0.60 4.76 -1.26 -4.29 118.16 117.07 2rlo n LYS 20 Ca 0.27 -0.36 0.04 0.00 -2.87 0.00 0.00 58.31 55.38 2rlo n LYS 20 Cb 0.44 -2.07 -0.00 0.00 -1.84 0.00 0.00 35.03 31.56 2rlo n LYS 20 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 2rlo s GLU 21 N -4.13 0.46 -0.11 1.97 2.12 -1.26 -4.97 118.70 112.79 2rlo s GLU 21 Ca 0.63 0.29 -0.11 0.00 0.36 0.00 0.00 54.97 56.14 2rlo s GLU 21 Cb -0.21 0.16 -0.05 0.00 0.26 0.00 0.00 34.13 34.30 2rlo s GLU 21 CO 0.64 -0.81 0.25 -1.58 -0.54 0.00 0.00 175.26 173.22 2rlo s TRP 22 N 2.67 3.57 0.21 5.30 0.52 -1.26 0.11 118.94 130.06 2rlo s TRP 22 Ca 0.16 0.64 0.09 0.00 0.02 0.00 0.00 56.10 57.01 2rlo s TRP 22 Cb -0.06 -2.17 -0.04 0.00 -1.15 0.00 0.00 33.47 30.05 2rlo s TRP 22 CO -0.22 0.52 -0.04 0.15 0.02 0.00 0.00 176.95 177.38 2rlo s LYS 23 N -0.45 2.23 -0.04 4.98 1.02 -0.56 -4.70 119.74 122.21 2rlo s LYS 23 Ca 0.17 -1.29 -0.30 0.00 0.02 0.00 0.00 55.97 54.58 2rlo s LYS 23 Cb -0.13 -2.21 -0.07 0.00 -0.52 0.00 0.00 37.83 34.90 2rlo s LYS 23 CO 0.06 0.41 1.80 0.15 -0.92 0.00 0.00 175.35 176.85 2rlo s LYS 24 N -3.17 4.08 0.44 1.68 -0.14 -1.26 -1.49 119.74 119.88 2rlo s LYS 24 Ca 0.28 2.30 0.00 0.00 -1.36 0.00 0.00 55.97 57.19 2rlo s LYS 24 Cb -0.08 -4.08 0.00 0.00 -1.68 0.00 0.00 37.83 32.00 2rlo s LYS 24 CO 0.18 -0.99 0.02 1.63 -0.76 0.00 0.00 175.35 175.43 2rlo n LYS 25 N 7.41 0.93 -3.74 1.68 4.76 0.29 -4.47 118.16 125.02 2rlo n LYS 25 Ca 0.19 -3.20 -0.25 0.00 -2.87 0.00 0.00 58.31 52.17 2rlo n LYS 25 Cb 0.42 0.83 -0.17 0.00 -1.84 0.00 0.00 35.03 34.27 2rlo n LYS 25 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 2rlo s TYR 26 N -2.58 0.81 0.07 2.13 6.14 -0.74 -1.78 117.35 121.39 2rlo s TYR 26 Ca 0.01 -0.50 0.10 0.00 0.64 0.00 0.00 57.07 57.32 2rlo s TYR 26 Cb -0.00 -0.90 -0.03 0.00 0.42 0.00 0.00 41.96 41.45 2rlo s TYR 26 CO 0.01 -0.47 -0.27 0.08 0.64 0.00 0.00 175.55 175.54 2rlo s VAL 27 N 1.93 2.17 -0.17 3.14 1.01 0.25 0.20 120.40 128.94 2rlo s VAL 27 Ca 0.02 -1.49 -0.04 0.00 0.00 0.00 0.00 61.98 60.47 2rlo s VAL 27 Cb -0.15 -1.87 0.06 0.00 0.00 0.00 0.00 36.38 34.42 2rlo s VAL 27 CO -0.07 0.29 0.08 -0.89 0.00 0.00 0.00 175.10 174.51 2rlo s THR 28 N -0.88 0.05 -0.33 3.92 2.01 0.95 -0.94 115.64 120.43 2rlo s THR 28 Ca 0.12 -0.22 -0.21 0.00 0.31 0.00 0.00 61.69 61.69 2rlo s THR 28 Cb -0.10 -0.66 -0.00 0.00 0.01 0.00 0.00 72.50 71.75 2rlo s THR 28 CO 0.03 -0.24 0.68 -0.22 -0.69 0.00 0.00 174.62 174.18 2rlo s LEU 29 N 2.08 4.17 0.22 4.42 1.98 0.24 -2.32 118.68 129.46 2rlo s LEU 29 Ca 0.01 0.37 0.07 0.00 -2.89 0.00 0.00 54.13 51.70 2rlo s LEU 29 Cb -0.16 -2.88 -0.04 0.00 0.66 0.00 0.00 46.19 43.77 2rlo s LEU 29 CO -0.08 -0.57 0.14 -0.55 -1.89 0.00 0.00 176.35 173.39 2rlo s SER 30 N 1.71 5.34 0.00 3.68 0.15 -1.10 0.29 113.70 123.77 2rlo s SER 30 Ca 0.27 -0.28 0.18 0.00 0.70 0.00 0.00 55.95 56.82 2rlo s SER 30 Cb -0.14 -1.31 1.08 0.00 -1.71 0.00 0.00 66.02 63.94 2rlo s SER 30 CO 0.14 0.00 1.54 -0.24 1.20 0.00 0.00 173.24 175.88 2rlo n SER 31 N -0.85 0.00 -1.47 5.45 2.88 0.19 -3.28 113.62 116.54 2rlo n SER 31 Ca -0.08 -0.91 -0.06 0.00 -1.33 0.00 0.00 58.87 56.49 2rlo n SER 31 Cb 0.57 0.00 0.14 0.00 -0.75 0.00 0.00 64.21 64.17 2rlo n SER 31 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2rlo n ASN 32 N -0.88 3.41 -3.89 -3.46 2.85 -1.26 -4.78 115.26 107.24 2rlo n ASN 32 Ca 0.14 -2.69 -0.30 0.00 -0.11 0.00 0.00 54.58 51.62 2rlo n ASN 32 Cb 0.06 -0.64 0.03 0.00 1.24 0.00 0.00 39.78 40.47 2rlo n ASN 32 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2rlo n GLY 33 N -0.08 -0.48 2.72 8.20 0.00 -1.21 -4.96 105.19 109.38 2rlo n GLY 33 Ca 0.24 0.19 -0.19 0.00 0.00 0.00 0.00 46.02 46.27 2rlo n GLY 33 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2rlo s PHE 34 N -3.33 0.14 -0.30 1.61 5.36 -1.25 -1.75 117.98 118.45 2rlo s PHE 34 Ca 0.62 0.16 -0.10 0.00 -0.96 0.00 0.00 56.93 56.65 2rlo s PHE 34 Cb -0.31 -0.44 -0.02 0.00 -0.34 0.00 0.00 43.02 41.91 2rlo s PHE 34 CO 0.83 -0.17 0.16 -1.17 -1.46 0.00 0.00 175.22 173.41 2rlo s LEU 35 N 1.75 4.06 0.02 6.12 2.96 -0.93 -2.69 118.68 129.98 2rlo s LEU 35 Ca -0.00 -0.36 0.05 0.00 -0.22 0.00 0.00 54.13 53.60 2rlo s LEU 35 Cb -0.12 -2.04 -0.03 0.00 0.50 0.00 0.00 46.19 44.50 2rlo s LEU 35 CO -0.03 -0.15 -0.13 -0.76 -1.32 0.00 0.00 176.35 173.96 2rlo s LEU 36 N 1.66 2.87 -0.17 -0.68 1.02 -0.98 -0.07 118.68 122.33 2rlo s LEU 36 Ca 0.06 -0.29 -0.08 0.00 0.02 0.00 0.00 54.13 53.84 2rlo s LEU 36 Cb -0.17 -1.66 0.07 0.00 0.02 0.00 0.00 46.19 44.45 2rlo s LEU 36 CO 0.07 0.27 0.38 -0.72 0.02 0.00 0.00 176.35 176.38 2rlo s TYR 37 N -0.96 -0.63 0.26 0.29 1.13 0.41 -0.03 117.35 117.81 2rlo s TYR 37 Ca 0.16 1.30 0.10 0.00 -1.41 0.00 0.00 57.07 57.22 2rlo s TYR 37 Cb -0.11 0.23 -0.04 0.00 -1.10 0.00 0.00 41.96 40.94 2rlo s TYR 37 CO 0.06 -0.39 -0.03 -1.01 -2.51 0.00 0.00 175.55 171.68 2rlo s HIS 38 N 1.97 2.66 0.55 -3.49 3.76 0.13 -1.55 115.29 119.32 2rlo s HIS 38 Ca -0.05 -0.23 0.35 0.00 -0.15 0.00 0.00 55.06 54.97 2rlo s HIS 38 Cb -0.10 -1.19 1.52 0.00 1.11 0.00 0.00 32.58 33.92 2rlo s HIS 38 CO -0.12 0.62 1.83 -1.35 -0.85 0.00 0.00 174.74 174.87 2rlo h PRO 39 N 2.02 0.00 0.00 8.40 0.11 -1.92 -1.96 132.00 138.65 2rlo h PRO 39 Ca -0.44 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.70 2rlo h PRO 39 Cb 1.25 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 2rlo h PRO 39 CO 0.60 0.00 0.07 0.45 -0.21 0.00 0.00 178.00 178.91 2rlo n SER 40 N -4.16 -0.09 -0.15 -2.05 2.88 -1.26 -4.32 113.62 104.47 2rlo n SER 40 Ca 0.22 -1.02 -0.09 0.00 -1.33 0.00 0.00 58.87 56.65 2rlo n SER 40 Cb 1.13 0.14 -0.00 0.00 -0.75 0.00 0.00 64.21 64.73 2rlo n SER 40 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 2rlo h ILE 41 N 1.07 1.24 -0.65 2.46 5.03 -1.88 -2.19 117.51 122.60 2rlo h ILE 41 Ca -0.02 -0.84 0.19 0.00 -0.12 0.00 0.00 64.86 64.08 2rlo h ILE 41 Cb 0.09 0.93 -0.03 0.00 -3.03 0.00 0.00 36.82 34.78 2rlo h ILE 41 CO 0.02 0.29 0.56 0.78 -0.68 0.00 0.00 178.15 179.12 2rlo h ASN 42 N 0.59 0.00 0.09 1.72 2.35 -1.98 0.44 115.58 118.79 2rlo h ASN 42 Ca 0.14 0.00 -0.28 0.00 -0.55 0.00 0.00 56.30 55.61 2rlo h ASN 42 Cb 0.34 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.73 2rlo h ASN 42 CO 0.00 0.00 -1.14 0.44 -1.65 0.00 0.00 177.43 175.08 2rlo h ASP 43 N 0.00 0.87 0.05 5.81 5.19 -1.79 -1.88 116.42 124.67 2rlo h ASP 43 Ca 0.31 -0.75 -0.00 0.00 -0.62 0.00 0.00 57.03 55.96 2rlo h ASP 43 Cb 1.41 -0.27 0.00 0.00 0.18 0.00 0.00 39.33 40.65 2rlo h ASP 43 CO -0.00 1.55 -0.03 0.22 -3.12 0.00 0.00 179.24 177.87 2rlo h TYR 44 N 0.32 -0.07 0.63 4.55 3.20 -0.13 0.96 116.97 126.43 2rlo h TYR 44 Ca -0.16 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.69 2rlo h TYR 44 Cb 1.81 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 40.09 2rlo h TYR 44 CO 0.11 0.46 -0.42 0.82 -1.64 0.00 0.00 178.16 177.49 2rlo h ILE 45 N -0.65 0.00 0.00 1.81 2.04 -0.53 -3.01 117.51 117.16 2rlo h ILE 45 Ca -0.01 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.78 2rlo h ILE 45 Cb 0.56 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 2rlo h ILE 45 CO 0.01 0.00 -0.33 0.45 0.00 0.00 0.00 178.15 178.28 2rlo h HIS 46 N -0.99 0.00 -3.62 1.37 3.86 -1.47 -3.49 115.15 110.81 2rlo h HIS 46 Ca -0.08 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.13 2rlo h HIS 46 Cb 0.81 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.28 2rlo h HIS 46 CO -0.10 0.33 -0.03 0.45 0.86 0.00 0.00 177.93 179.44 2rlo n SER 47 N -3.42 -3.55 -1.92 2.45 2.88 0.30 -5.02 113.62 105.35 2rlo n SER 47 Ca 0.00 0.01 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 2rlo n SER 47 Cb 0.52 -2.15 0.00 0.00 -0.75 0.00 0.00 64.21 61.83 2rlo n SER 47 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2rlo n THR 48 N -1.05 0.00 -0.37 2.46 -2.24 0.46 -4.92 114.28 108.62 2rlo n THR 48 Ca 0.01 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.74 2rlo n THR 48 Cb 0.42 -0.73 -0.00 0.00 -2.10 0.00 0.00 70.33 67.92 2rlo n THR 48 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 2rlo h HIS 49 N 0.00 -1.31 -5.04 4.78 -0.00 -1.99 -3.47 115.15 108.12 2rlo h HIS 49 Ca 0.00 0.11 0.01 0.00 -0.00 0.00 0.00 60.37 60.49 2rlo h HIS 49 Cb 0.00 0.70 -0.13 0.00 -0.00 0.00 0.00 27.41 27.98 2rlo h HIS 49 CO 0.00 -0.40 -1.58 0.41 -0.00 0.00 0.00 177.93 176.37 2rlo n GLY 50 N -1.41 -5.18 3.77 5.26 0.00 -1.26 -4.94 105.19 101.43 2rlo n GLY 50 Ca 0.07 1.79 -0.38 0.00 0.00 0.00 0.00 46.02 47.50 2rlo n GLY 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rlo s LYS 51 N -0.68 4.38 -0.02 1.61 -0.14 -0.59 -4.87 119.74 119.43 2rlo s LYS 51 Ca -0.28 1.61 0.00 0.00 -1.36 0.00 0.00 55.97 55.94 2rlo s LYS 51 Cb 0.02 -2.82 0.02 0.00 -1.68 0.00 0.00 37.83 33.37 2rlo s LYS 51 CO 0.79 0.03 0.00 -1.21 -0.76 0.00 0.00 175.35 174.20 2rlo s GLU 52 N -2.04 0.14 -0.17 1.68 2.02 -1.26 -0.44 118.70 118.63 2rlo s GLU 52 Ca 0.52 0.07 0.01 0.00 0.02 0.00 0.00 54.97 55.58 2rlo s GLU 52 Cb -0.26 -0.29 0.01 0.00 0.10 0.00 0.00 34.13 33.69 2rlo s GLU 52 CO 0.32 -0.09 -0.18 1.41 0.02 0.00 0.00 175.26 176.74 2rlo s MET 53 N 0.69 3.07 0.19 1.61 -2.45 0.90 -4.97 119.30 118.34 2rlo s MET 53 Ca -0.06 -0.80 -0.33 0.00 -1.25 0.00 0.00 55.69 53.24 2rlo s MET 53 Cb -0.09 -2.59 -0.13 0.00 1.25 0.00 0.00 34.83 33.27 2rlo s MET 53 CO -0.02 -0.13 1.63 -3.47 1.05 0.00 0.00 175.02 174.08 2rlo n ASP 54 N 4.43 3.48 -1.86 1.11 2.03 -1.26 -2.18 116.55 122.30 2rlo n ASP 54 Ca -0.20 1.08 -0.14 0.00 0.52 0.00 0.00 54.79 56.05 2rlo n ASP 54 Cb 0.51 -1.49 0.17 0.00 -0.72 0.00 0.00 41.12 39.58 2rlo n ASP 54 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2rlo n LEU 55 N 3.52 5.61 -0.05 -2.67 4.77 -0.72 -4.39 117.00 123.07 2rlo n LEU 55 Ca 0.16 -2.96 -0.01 0.00 -0.03 0.00 0.00 56.01 53.17 2rlo n LEU 55 Cb 0.32 -0.74 -0.00 0.00 -2.33 0.00 0.00 43.42 40.67 2rlo n LEU 55 CO 0.64 0.85 -0.09 0.25 -1.33 0.00 0.00 177.39 177.70 2rlo h LEU 56 N 1.36 0.00 -4.67 2.23 5.85 -1.88 -3.21 115.31 114.99 2rlo h LEU 56 Ca 0.40 0.00 -0.62 0.00 0.84 0.00 0.00 57.88 58.50 2rlo h LEU 56 Cb 2.28 0.00 -0.39 0.00 0.37 0.00 0.00 40.66 42.91 2rlo h LEU 56 CO 0.75 0.49 -0.42 0.54 -0.34 0.00 0.00 178.44 179.46 2rlo n ARG 57 N -4.31 3.34 -3.79 1.25 1.74 -1.26 -4.49 116.66 109.14 2rlo n ARG 57 Ca -0.02 -4.38 -0.20 0.00 -0.77 0.00 0.00 57.85 52.47 2rlo n ARG 57 Cb 0.07 -2.26 -0.02 0.00 -1.02 0.00 0.00 32.46 29.24 2rlo n ARG 57 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2rlo s THR 58 N -5.38 4.78 0.26 0.55 -4.23 -1.26 -3.85 115.64 106.51 2rlo s THR 58 Ca 0.49 -1.01 0.01 0.00 -1.18 0.00 0.00 61.69 60.00 2rlo s THR 58 Cb 0.39 -3.67 -0.05 0.00 1.34 0.00 0.00 72.50 70.51 2rlo s THR 58 CO -0.22 -0.27 0.09 -0.89 -0.54 0.00 0.00 174.62 172.80 2rlo s THR 59 N -2.06 0.59 -0.10 3.99 2.01 0.04 -4.95 115.64 115.15 2rlo s THR 59 Ca 0.38 -2.00 -0.01 0.00 0.31 0.00 0.00 61.69 60.37 2rlo s THR 59 Cb -0.09 -2.65 0.03 0.00 0.01 0.00 0.00 72.50 69.80 2rlo s THR 59 CO 0.30 0.00 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.48 2rlo s VAL 60 N -3.73 0.84 0.17 3.82 1.01 -1.26 -1.25 120.40 120.00 2rlo s VAL 60 Ca 0.38 -0.17 0.05 0.00 0.00 0.00 0.00 61.98 62.24 2rlo s VAL 60 Cb 0.08 -0.89 -0.05 0.00 0.00 0.00 0.00 36.38 35.52 2rlo s VAL 60 CO 0.14 0.34 -0.10 -1.59 0.00 0.00 0.00 175.10 173.88 2rlo s LYS 61 N 1.76 1.17 -0.10 2.72 -2.85 -0.91 -4.95 119.74 116.58 2rlo s LYS 61 Ca 0.05 -1.52 -0.07 0.00 -1.00 0.00 0.00 55.97 53.43 2rlo s LYS 61 Cb -0.13 -0.76 0.04 0.00 -2.06 0.00 0.00 37.83 34.92 2rlo s LYS 61 CO -0.07 0.09 0.25 0.08 0.10 0.00 0.00 175.35 175.80 2rlo s VAL 62 N -3.24 -0.02 -0.89 1.79 1.01 -1.26 -0.25 120.40 117.53 2rlo s VAL 62 Ca 0.20 0.09 -0.24 0.00 0.00 0.00 0.00 61.98 62.02 2rlo s VAL 62 Cb 0.02 -0.38 -0.19 0.00 0.00 0.00 0.00 36.38 35.83 2rlo s VAL 62 CO 0.03 0.04 2.19 -0.81 0.00 0.00 0.00 175.10 176.55 2rlo n PRO 63 N 3.72 0.29 -2.41 2.72 -0.04 -1.26 -4.01 135.00 134.00 2rlo n PRO 63 Ca -0.20 -1.14 -0.04 0.00 -0.04 0.00 0.00 63.50 62.07 2rlo n PRO 63 Cb 0.55 -3.51 -0.04 0.00 -0.04 0.00 0.00 33.50 30.46 2rlo n PRO 63 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2rlo n GLY 64 N 6.31 -4.83 3.54 0.55 0.00 -1.26 -4.73 105.19 104.76 2rlo n GLY 64 Ca 0.43 1.35 -0.38 0.00 0.00 0.00 0.00 46.02 47.43 2rlo n GLY 64 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2rlo n LYS 65 N 1.33 0.97 0.00 1.61 4.01 -1.26 -4.76 118.16 120.07 2rlo n LYS 65 Ca -0.32 0.04 0.00 0.00 -0.51 0.00 0.00 58.31 57.51 2rlo n LYS 65 Cb 0.50 -3.16 0.00 0.00 -0.51 0.00 0.00 35.03 31.86 2rlo n LYS 65 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 2rlo n ARG 66 N 8.90 -2.34 -1.64 1.97 3.00 -1.26 -5.14 116.66 120.16 2rlo n ARG 66 Ca 0.40 0.00 -0.47 0.00 -0.01 0.00 0.00 57.85 57.77 2rlo n ARG 66 Cb 0.47 0.00 -0.04 0.00 0.00 0.00 0.00 32.46 32.89 2rlo n ARG 66 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 2rlo n PRO 67 N -0.50 1.71 -2.34 5.56 -0.02 -1.26 -4.93 135.00 133.22 2rlo n PRO 67 Ca 0.00 0.61 -0.40 0.00 -2.02 0.00 0.00 63.50 61.69 2rlo n PRO 67 Cb 0.00 -2.25 -0.03 0.00 -0.02 0.00 0.00 33.50 31.20 2rlo n PRO 67 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2rlo s PRO 68 N -0.05 4.43 -1.53 0.52 0.04 -1.26 -3.22 135.00 133.93 2rlo s PRO 68 Ca 0.73 1.91 -0.05 0.00 0.04 0.00 0.00 61.00 63.63 2rlo s PRO 68 Cb -0.75 -3.03 0.01 0.00 0.04 0.00 0.00 34.50 30.78 2rlo s PRO 68 CO 0.48 -0.02 0.64 0.54 0.04 0.00 0.00 177.00 178.68 2rlo n ARG 69 N 0.81 -5.01 0.12 4.56 1.74 -1.26 -4.83 116.66 112.79 2rlo n ARG 69 Ca 0.00 0.87 -0.13 0.00 -0.77 0.00 0.00 57.85 57.83 2rlo n ARG 69 Cb 0.44 -5.74 -0.06 0.00 -1.02 0.00 0.00 32.46 26.08 2rlo n ARG 69 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2rlo h ALA 70 N 1.01 -0.28 -0.15 7.54 0.00 -1.94 -3.38 119.26 122.04 2rlo h ALA 70 Ca -0.53 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2rlo h ALA 70 Cb 1.36 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.36 2rlo h ALA 70 CO 0.57 -0.68 0.00 -0.89 0.00 0.00 0.00 179.25 178.25 2rlo n ILE 71 N -5.27 0.00 -3.48 0.00 -0.00 -1.26 -5.02 119.36 104.33 2rlo n ILE 71 Ca -0.08 0.47 -0.22 0.00 -0.00 0.00 0.00 62.75 62.93 2rlo n ILE 71 Cb 0.19 -1.45 0.06 0.00 -0.00 0.00 0.00 39.64 38.43 2rlo n ILE 71 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.55 176.31 2rlo n SER 72 N -2.20 -5.16 -1.27 4.38 2.88 -1.26 -4.69 113.62 106.29 2rlo n SER 72 Ca 0.00 -0.84 0.05 0.00 -1.33 0.00 0.00 58.87 56.76 2rlo n SER 72 Cb 0.00 -4.37 0.25 0.00 -0.75 0.00 0.00 64.21 59.34 2rlo n SER 72 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2rlo n ALA 73 N -3.77 3.16 -3.60 -1.46 0.00 -1.26 -4.13 120.51 109.44 2rlo n ALA 73 Ca -0.12 -1.13 -0.40 0.00 0.00 0.00 0.00 53.44 51.79 2rlo n ALA 73 Cb 0.62 -1.05 -0.08 0.00 0.00 0.00 0.00 19.45 18.94 2rlo n ALA 73 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2rlo s PHE 74 N -1.95 3.50 0.00 0.00 0.40 -1.26 -5.00 117.98 113.67 2rlo s PHE 74 Ca 0.34 -2.34 0.00 0.00 -0.60 0.00 0.00 56.93 54.33 2rlo s PHE 74 Cb 0.24 -3.41 0.00 0.00 0.51 0.00 0.00 43.02 40.37 2rlo s PHE 74 CO 0.13 -0.92 0.00 0.41 0.70 0.00 0.00 175.22 175.54 2rlo n GLY 75 N 4.01 0.44 3.57 4.36 0.00 -1.26 -4.76 105.19 111.54 2rlo n GLY 75 Ca 0.05 -1.01 -0.40 0.00 0.00 0.00 0.00 46.02 44.66 2rlo n GLY 75 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2rlo s PRO 76 N 0.00 2.83 0.85 1.61 0.04 -1.26 -4.98 135.00 134.10 2rlo s PRO 76 Ca 0.00 1.07 -0.14 0.00 0.04 0.00 0.00 61.00 61.97 2rlo s PRO 76 Cb 0.00 -4.34 0.22 0.00 0.04 0.00 0.00 34.50 30.41 2rlo s PRO 76 CO 0.00 -2.46 0.59 0.43 0.04 0.00 0.00 177.00 175.60 2rlo n SER 77 N 12.24 -2.70 0.19 6.66 7.64 -1.26 -4.93 113.62 131.47 2rlo n SER 77 Ca 0.24 -0.69 0.09 0.00 1.01 0.00 0.00 58.87 59.52 2rlo n SER 77 Cb 0.50 -0.62 0.14 0.00 -1.01 0.00 0.00 64.21 63.23 2rlo n SER 77 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2rlo h ALA 78 N -2.80 0.89 -4.43 -0.43 0.00 -1.84 -3.49 119.26 107.16 2rlo h ALA 78 Ca -0.25 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.51 2rlo h ALA 78 Cb 0.80 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 18.49 2rlo h ALA 78 CO 0.15 0.21 -1.13 0.43 0.00 0.00 0.00 179.25 178.92 2rlo n SER 79 N -3.15 -2.76 0.00 0.00 7.64 -1.26 -5.02 113.62 109.08 2rlo n SER 79 Ca 0.03 1.18 0.00 0.00 1.01 0.00 0.00 58.87 61.09 2rlo n SER 79 Cb 0.59 -4.35 0.00 0.00 -1.01 0.00 0.00 64.21 59.44 2rlo n SER 79 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2rlo n GLY 80 N 1.37 1.42 2.87 0.23 0.00 -1.26 -5.02 105.19 104.80 2rlo n GLY 80 Ca -0.24 -1.41 -0.30 0.00 0.00 0.00 0.00 46.02 44.07 2rlo n GLY 80 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2rlo s SER 81 N -0.11 4.09 0.61 1.61 1.04 -1.26 -5.06 113.70 114.62 2rlo s SER 81 Ca 0.00 -2.90 0.00 0.00 0.48 0.00 0.00 55.95 53.53 2rlo s SER 81 Cb 0.00 -1.43 0.00 0.00 0.10 0.00 0.00 66.02 64.69 2rlo s SER 81 CO 0.00 -0.24 0.00 0.00 0.98 0.00 0.00 173.24 173.98 2rlo n ALA 82 N 3.23 -3.07 0.00 5.32 0.00 -1.26 -4.99 120.51 119.74 2rlo n ALA 82 Ca 0.07 0.77 0.00 0.00 0.00 0.00 0.00 53.44 54.27 2rlo n ALA 82 Cb 0.33 -1.53 0.00 0.00 0.00 0.00 0.00 19.45 18.25 2rlo n ALA 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rlo n GLY 83 N -3.67 1.71 0.00 0.00 0.00 -1.26 -4.89 105.19 97.08 2rlo n GLY 83 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2rlo n GLY 83 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2rlo n GLN 84 N -0.84 0.00 -3.60 1.61 7.27 -1.26 -5.16 117.38 115.40 2rlo n GLN 84 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 57.00 57.04 2rlo n GLN 84 Cb 0.00 0.00 -0.02 0.00 2.41 0.00 0.00 30.24 32.63 2rlo n GLN 84 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2rlo s ALA 85 N -0.97 -2.09 -0.19 1.69 0.00 -1.26 -5.17 121.76 113.79 2rlo s ALA 85 Ca 0.00 1.35 -0.07 0.00 0.00 0.00 0.00 51.96 53.24 2rlo s ALA 85 Cb 0.00 0.03 0.08 0.00 0.00 0.00 0.00 23.12 23.23 2rlo s ALA 85 CO 0.00 -0.71 0.40 -2.00 0.00 0.00 0.00 175.76 173.45 2rlo s GLU 86 N -2.47 0.31 0.12 0.00 2.56 -1.26 -4.47 118.70 113.50 2rlo s GLU 86 Ca 0.10 0.96 -0.21 0.00 0.00 0.00 0.00 54.97 55.83 2rlo s GLU 86 Cb 0.00 0.24 -0.04 0.00 2.00 0.00 0.00 34.13 36.33 2rlo s GLU 86 CO -0.05 -0.24 1.70 1.05 -0.56 0.00 0.00 175.26 177.16 2rlo h GLU 87 N 8.04 -0.05 -3.22 4.30 4.11 -2.02 -3.45 114.58 122.29 2rlo h GLU 87 Ca -0.18 0.00 -0.22 0.00 0.07 0.00 0.00 59.36 59.03 2rlo h GLU 87 Cb 1.12 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.35 2rlo h GLU 87 CO 0.15 -0.03 -0.26 0.39 0.07 0.00 0.00 179.01 179.33 2rlo n GLU 88 N -5.21 -1.99 -1.66 1.06 1.02 -1.26 -4.81 120.64 107.78 2rlo n GLU 88 Ca -0.03 0.56 -0.40 0.00 -0.02 0.00 0.00 57.16 57.27 2rlo n GLU 88 Cb 0.14 -5.03 -0.03 0.00 -0.02 0.00 0.00 31.44 26.50 2rlo n GLU 88 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2rlo s ASN 89 N -1.99 5.01 0.08 1.62 -0.87 -1.26 -4.92 114.94 112.61 2rlo s ASN 89 Ca 0.00 1.34 -0.24 0.00 -1.57 0.00 0.00 52.86 52.39 2rlo s ASN 89 Cb 0.00 -2.51 -0.06 0.00 -0.02 0.00 0.00 41.25 38.66 2rlo s ASN 89 CO 0.00 -2.39 0.72 -0.36 -2.57 0.00 0.00 177.10 172.50 2rlo s PHE 90 N 10.02 3.79 -0.03 2.20 0.08 -1.26 -4.60 117.98 128.18 2rlo s PHE 90 Ca 0.94 1.46 0.00 0.00 0.12 0.00 0.00 56.93 59.46 2rlo s PHE 90 Cb -0.23 -2.74 0.03 0.00 -0.57 0.00 0.00 43.02 39.51 2rlo s PHE 90 CO 0.30 0.40 0.01 -1.21 -0.10 0.00 0.00 175.22 174.62 2rlo s GLU 91 N -0.55 0.16 0.12 0.44 8.01 -1.26 -2.35 118.70 123.26 2rlo s GLU 91 Ca 0.35 0.13 0.10 0.00 0.01 0.00 0.00 54.97 55.56 2rlo s GLU 91 Cb -0.21 -0.39 -0.04 0.00 -4.31 0.00 0.00 34.13 29.18 2rlo s GLU 91 CO 0.23 -0.15 -0.25 -0.59 0.01 0.00 0.00 175.26 174.50 2rlo s PHE 92 N 1.06 2.36 -0.04 1.61 -0.71 -0.33 -4.68 117.98 117.24 2rlo s PHE 92 Ca -0.09 -0.36 0.03 0.00 -1.04 0.00 0.00 56.93 55.47 2rlo s PHE 92 Cb -0.13 -1.28 -0.03 0.00 -1.21 0.00 0.00 43.02 40.37 2rlo s PHE 92 CO -0.02 0.34 -0.10 -0.51 -1.34 0.00 0.00 175.22 173.58 2rlo s LEU 93 N -2.02 2.97 -0.34 -1.99 1.43 0.65 -1.38 118.68 118.00 2rlo s LEU 93 Ca 0.15 -0.14 -0.05 0.00 -1.03 0.00 0.00 54.13 53.06 2rlo s LEU 93 Cb -0.10 -1.66 0.05 0.00 0.03 0.00 0.00 46.19 44.52 2rlo s LEU 93 CO 0.07 0.33 0.09 -0.63 0.23 0.00 0.00 176.35 176.44 2rlo s ILE 94 N -0.83 3.51 -0.14 -0.59 -1.09 0.69 -2.13 121.20 120.61 2rlo s ILE 94 Ca 0.13 -1.33 -0.13 0.00 -2.23 0.00 0.00 60.65 57.10 2rlo s ILE 94 Cb -0.11 -3.05 -0.05 0.00 -1.58 0.00 0.00 42.46 37.68 2rlo s ILE 94 CO 0.03 -0.23 0.27 -0.69 -1.23 0.00 0.00 174.94 173.08 2rlo s VAL 95 N 1.33 5.31 0.27 2.92 1.01 -0.38 0.36 120.40 131.22 2rlo s VAL 95 Ca -0.01 0.50 0.02 0.00 0.00 0.00 0.00 61.98 62.49 2rlo s VAL 95 Cb -0.20 -3.59 0.05 0.00 0.00 0.00 0.00 36.38 32.64 2rlo s VAL 95 CO 0.01 0.45 0.38 -0.24 0.00 0.00 0.00 175.10 175.69 2rlo n SER 96 N 3.14 0.73 0.18 3.32 2.88 0.26 -0.78 113.62 123.35 2rlo n SER 96 Ca -0.14 -1.56 0.11 0.00 -1.33 0.00 0.00 58.87 55.96 2rlo n SER 96 Cb 0.52 -0.22 0.11 0.00 -0.75 0.00 0.00 64.21 63.87 2rlo n SER 96 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 2rlo h SER 97 N -0.10 0.00 -0.72 -3.46 4.64 -1.86 -3.25 113.55 108.79 2rlo h SER 97 Ca -0.13 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.01 2rlo h SER 97 Cb 0.52 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.50 2rlo h SER 97 CO 0.16 0.02 0.23 1.07 -0.87 0.00 0.00 176.83 177.44 2rlo n THR 98 N -2.96 2.93 0.00 2.95 5.66 -1.26 -4.90 114.28 116.71 2rlo n THR 98 Ca 0.02 -1.60 0.00 0.00 -3.05 0.00 0.00 64.05 59.42 2rlo n THR 98 Cb 0.55 -0.35 0.00 0.00 -1.55 0.00 0.00 70.33 68.98 2rlo n THR 98 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2rlo n GLY 99 N -0.02 3.01 3.67 1.09 0.00 -1.23 -4.98 105.19 106.74 2rlo n GLY 99 Ca 0.39 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.87 2rlo n GLY 99 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2rlo n GLN 100 N -1.64 1.28 -3.98 1.61 -0.06 -1.26 -4.57 117.38 108.77 2rlo n GLN 100 Ca 0.00 0.47 -0.30 0.00 -2.00 0.00 0.00 57.00 55.17 2rlo n GLN 100 Cb 0.00 -2.15 -0.16 0.00 -4.06 0.00 0.00 30.24 23.87 2rlo n GLN 100 CO 0.00 0.00 0.00 0.99 -0.20 0.00 0.00 177.06 177.85 2rlo s THR 101 N 2.43 1.54 -0.51 1.69 2.01 -1.25 0.92 115.64 122.46 2rlo s THR 101 Ca 0.92 -0.93 -0.20 0.00 0.31 0.00 0.00 61.69 61.79 2rlo s THR 101 Cb -0.98 -1.63 0.06 0.00 0.01 0.00 0.00 72.50 69.95 2rlo s THR 101 CO 0.57 0.16 0.68 0.26 -0.69 0.00 0.00 174.62 175.60 2rlo s TRP 102 N 1.44 3.00 -0.33 4.92 0.52 0.16 -4.85 118.94 123.80 2rlo s TRP 102 Ca -0.01 -0.45 -0.17 0.00 0.02 0.00 0.00 56.10 55.49 2rlo s TRP 102 Cb -0.16 -3.63 -0.01 0.00 -1.15 0.00 0.00 33.47 28.51 2rlo s TRP 102 CO -0.08 -1.09 0.47 -1.58 0.02 0.00 0.00 176.95 174.69 2rlo s HIS 103 N 2.86 3.20 0.29 -1.98 2.46 -1.26 -0.22 115.29 120.64 2rlo s HIS 103 Ca 0.18 0.21 0.08 0.00 0.47 0.00 0.00 55.06 56.00 2rlo s HIS 103 Cb -0.18 -2.81 -0.06 0.00 -0.13 0.00 0.00 32.58 29.40 2rlo s HIS 103 CO 0.13 -0.46 -0.09 -0.06 -2.47 0.00 0.00 174.74 171.79 2rlo s PHE 104 N 2.28 2.07 -0.24 3.88 0.08 -0.48 -4.15 117.98 121.41 2rlo s PHE 104 Ca 0.17 -0.60 0.01 0.00 0.12 0.00 0.00 56.93 56.63 2rlo s PHE 104 Cb -0.16 -1.14 0.06 0.00 -0.57 0.00 0.00 43.02 41.22 2rlo s PHE 104 CO 0.12 0.41 -0.04 -2.00 -0.10 0.00 0.00 175.22 173.61 2rlo s GLU 105 N -3.67 1.52 -0.06 0.44 2.12 0.08 -1.18 118.70 117.95 2rlo s GLU 105 Ca 0.30 -1.03 -0.35 0.00 0.36 0.00 0.00 54.97 54.25 2rlo s GLU 105 Cb 0.02 -2.57 -0.13 0.00 0.26 0.00 0.00 34.13 31.71 2rlo s GLU 105 CO 0.13 -0.64 1.77 0.00 -0.54 0.00 0.00 175.26 175.97 2rlo n ALA 106 N 4.67 0.67 0.07 6.30 0.00 -0.99 -2.30 120.51 128.94 2rlo n ALA 106 Ca -0.10 0.35 0.01 0.00 0.00 0.00 0.00 53.44 53.69 2rlo n ALA 106 Cb 0.44 -2.40 0.34 0.00 0.00 0.00 0.00 19.45 17.83 2rlo n ALA 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rlo h ALA 107 N 7.96 1.41 -4.14 0.00 0.00 -1.89 -3.42 119.26 119.19 2rlo h ALA 107 Ca -0.47 -0.22 -0.69 0.00 0.00 0.00 0.00 54.91 53.52 2rlo h ALA 107 Cb 1.28 -0.11 -0.26 0.00 0.00 0.00 0.00 17.79 18.70 2rlo h ALA 107 CO 0.93 0.41 -0.81 -1.12 0.00 0.00 0.00 179.25 178.65 2rlo s SER 108 N -6.83 3.69 0.36 0.00 0.01 -1.26 -5.02 113.70 104.65 2rlo s SER 108 Ca -0.06 -0.30 0.06 0.00 1.31 0.00 0.00 55.95 56.96 2rlo s SER 108 Cb 0.15 -0.76 0.76 0.00 0.21 0.00 0.00 66.02 66.38 2rlo s SER 108 CO 0.75 0.32 1.95 -0.26 0.41 0.00 0.00 173.24 176.41 2rlo h PHE 109 N 5.53 0.75 -0.08 2.43 0.04 -1.95 -1.31 116.94 122.35 2rlo h PHE 109 Ca -0.43 0.02 -0.20 0.00 2.80 0.00 0.00 57.97 60.16 2rlo h PHE 109 Cb 1.15 -0.25 -0.00 0.00 2.20 0.00 0.00 35.95 39.05 2rlo h PHE 109 CO 0.46 0.39 -0.78 0.93 -0.60 0.00 0.00 178.31 178.71 2rlo h GLU 110 N 0.74 0.47 -0.16 1.51 3.07 -1.96 -3.17 114.58 115.08 2rlo h GLU 110 Ca 0.32 -0.41 -0.05 0.00 -0.50 0.00 0.00 59.36 58.72 2rlo h GLU 110 Cb 0.30 0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.29 2rlo h GLU 110 CO -0.11 1.05 -0.14 1.49 -1.40 0.00 0.00 179.01 179.90 2rlo h GLU 111 N 0.31 0.25 -0.90 2.33 4.57 -1.67 -2.51 114.58 116.96 2rlo h GLU 111 Ca -0.04 -0.06 0.07 0.00 -1.18 0.00 0.00 59.36 58.15 2rlo h GLU 111 Cb 1.37 -0.03 -0.07 0.00 -0.16 0.00 0.00 28.75 29.87 2rlo h GLU 111 CO 0.14 0.39 0.56 0.07 -1.18 0.00 0.00 179.01 178.99 2rlo h ARG 112 N 0.24 0.98 -0.02 1.92 -0.00 -1.32 0.14 114.38 116.32 2rlo h ARG 112 Ca 0.05 -0.06 -0.08 0.00 -0.00 0.00 0.00 59.98 59.89 2rlo h ARG 112 Cb 0.39 -0.22 0.01 0.00 -0.00 0.00 0.00 29.97 30.14 2rlo h ARG 112 CO 0.02 0.65 -0.30 0.22 -0.00 0.00 0.00 179.97 180.56 2rlo h ASP 113 N 1.01 0.31 -0.15 0.08 1.82 -1.62 -2.09 116.42 115.77 2rlo h ASP 113 Ca 0.40 -0.72 0.05 0.00 -0.39 0.00 0.00 57.03 56.36 2rlo h ASP 113 Cb 0.21 -0.09 -0.05 0.00 0.68 0.00 0.00 39.33 40.08 2rlo h ASP 113 CO -0.19 0.99 -0.16 0.00 -1.61 0.00 0.00 179.24 178.27 2rlo h ALA 114 N 0.33 -0.06 0.22 -0.78 0.00 -1.09 0.58 119.26 118.46 2rlo h ALA 114 Ca -0.03 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2rlo h ALA 114 Cb 1.01 0.33 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 2rlo h ALA 114 CO 0.06 -0.60 -0.14 -1.49 0.00 0.00 0.00 179.25 177.08 2rlo h TRP 115 N -0.19 -0.36 -0.53 0.00 4.06 -0.81 1.27 115.95 119.39 2rlo h TRP 115 Ca 0.10 -0.00 0.07 0.00 2.06 0.00 0.00 58.89 61.12 2rlo h TRP 115 Cb 0.34 0.13 -0.03 0.00 -1.00 0.00 0.00 29.16 28.60 2rlo h TRP 115 CO -0.29 -0.22 0.36 0.28 -3.56 0.00 0.00 178.44 175.02 2rlo h VAL 116 N -0.35 0.97 0.00 1.49 2.07 -0.99 0.26 116.25 119.70 2rlo h VAL 116 Ca -0.02 -0.16 -0.18 0.00 0.82 0.00 0.00 66.70 67.16 2rlo h VAL 116 Cb 0.29 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 2rlo h VAL 116 CO 0.02 0.08 -0.89 -0.61 0.02 0.00 0.00 177.57 176.19 2rlo h GLN 117 N 0.46 0.00 -0.19 1.57 -0.00 0.88 -2.47 115.11 115.35 2rlo h GLN 117 Ca 0.23 0.00 -0.11 0.00 -0.00 0.00 0.00 58.65 58.77 2rlo h GLN 117 Cb 0.34 0.00 -0.00 0.00 0.00 0.00 0.00 27.48 27.82 2rlo h GLN 117 CO -0.06 0.79 -0.32 0.00 0.00 0.00 0.00 178.83 179.24 2rlo h ALA 118 N 1.17 0.30 -0.07 3.38 0.00 0.38 0.32 119.26 124.74 2rlo h ALA 118 Ca -0.03 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 2rlo h ALA 118 Cb 1.65 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.39 2rlo h ALA 118 CO 0.10 0.33 -0.02 0.82 0.00 0.00 0.00 179.25 180.49 2rlo h ILE 119 N 0.22 1.29 -0.18 0.00 5.03 -0.68 -0.27 117.51 122.92 2rlo h ILE 119 Ca 0.01 -0.91 -0.07 0.00 -0.12 0.00 0.00 64.86 63.77 2rlo h ILE 119 Cb 0.90 1.76 -0.01 0.00 -3.03 0.00 0.00 36.82 36.44 2rlo h ILE 119 CO 0.07 0.25 -0.19 -0.33 -0.68 0.00 0.00 178.15 177.28 2rlo h GLU 120 N -0.20 0.31 -0.28 2.37 5.08 -1.48 -1.88 114.58 118.49 2rlo h GLU 120 Ca 0.02 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 58.24 2rlo h GLU 120 Cb 0.41 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 2rlo h GLU 120 CO 0.01 0.50 -0.01 1.03 -1.00 0.00 0.00 179.01 179.53 2rlo h SER 121 N 0.29 0.49 -0.23 1.42 0.87 -0.17 -0.52 113.55 115.70 2rlo h SER 121 Ca 0.05 -0.32 -0.04 0.00 -1.23 0.00 0.00 61.79 60.26 2rlo h SER 121 Cb 0.50 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.31 2rlo h SER 121 CO 0.03 0.69 0.04 1.56 -0.53 0.00 0.00 176.83 178.62 2rlo h GLN 122 N 0.28 0.48 -0.17 2.24 1.08 -0.77 -1.70 115.11 116.56 2rlo h GLN 122 Ca 0.08 -0.09 -0.18 0.00 -1.45 0.00 0.00 58.65 57.01 2rlo h GLN 122 Cb 0.44 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 27.79 2rlo h GLN 122 CO 0.02 0.48 -0.64 0.82 -0.95 0.00 0.00 178.83 178.55 2rlo h ILE 123 N 0.47 1.32 -0.33 2.54 2.04 -1.09 -1.53 117.51 120.92 2rlo h ILE 123 Ca 0.11 -1.91 -0.09 0.00 1.00 0.00 0.00 64.86 63.97 2rlo h ILE 123 Cb 0.25 1.88 -0.02 0.00 -0.74 0.00 0.00 36.82 38.19 2rlo h ILE 123 CO 0.00 0.59 -0.17 -0.07 0.00 0.00 0.00 178.15 178.50 2rlo h LEU 124 N 0.45 0.60 -0.33 1.44 4.07 -0.58 0.27 115.31 121.23 2rlo h LEU 124 Ca -0.01 -0.19 -0.18 0.00 0.08 0.00 0.00 57.88 57.58 2rlo h LEU 124 Cb 1.22 -0.16 -0.02 0.00 1.08 0.00 0.00 40.66 42.78 2rlo h LEU 124 CO 0.12 0.79 -0.84 0.00 -1.08 0.00 0.00 178.44 177.43 2rlo h ALA 125 N 1.27 0.61 0.13 1.53 0.00 -1.25 -3.22 119.26 118.31 2rlo h ALA 125 Ca 0.09 -0.75 -0.28 0.00 0.00 0.00 0.00 54.91 53.97 2rlo h ALA 125 Cb 0.61 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2rlo h ALA 125 CO 0.04 1.01 -1.29 0.77 0.00 0.00 0.00 179.25 179.77 2rlo h SER 126 N 0.02 0.42 -0.43 0.00 0.02 -0.98 -3.28 113.55 109.32 2rlo h SER 126 Ca -0.02 -0.47 0.02 0.00 -0.84 0.00 0.00 61.79 60.48 2rlo h SER 126 Cb 1.48 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.86 2rlo h SER 126 CO 0.11 1.37 0.29 0.25 -1.14 0.00 0.00 176.83 177.71 2rlo h LEU 127 N 0.07 0.46 0.00 5.07 7.12 -0.50 -3.49 115.31 124.03 2rlo h LEU 127 Ca -0.15 -0.01 0.00 0.00 0.13 0.00 0.00 57.88 57.85 2rlo h LEU 127 Cb 1.98 -0.11 0.00 0.00 -0.53 0.00 0.00 40.66 42.00 2rlo h LEU 127 CO 0.20 0.33 0.00 0.00 -0.13 0.00 0.00 178.44 178.83