#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3abq s LYS 2 N 0.00 4.26 -0.22 0.03 -0.14 -1.26 -4.95 119.74 117.46 3abq s LYS 2 Ca 0.00 0.34 0.14 0.00 -1.36 0.00 0.00 55.97 55.09 3abq s LYS 2 Cb 0.00 -3.48 0.47 0.00 -1.68 0.00 0.00 37.83 33.13 3abq s LYS 2 CO 0.00 0.06 1.37 1.28 -0.76 0.00 0.00 175.35 177.30 3abq n LEU 3 N 4.07 3.58 -3.83 3.17 4.77 -1.26 -4.88 117.00 122.61 3abq n LEU 3 Ca -0.07 -3.40 -0.12 0.00 -0.03 0.00 0.00 56.01 52.38 3abq n LEU 3 Cb 0.51 -0.56 -0.10 0.00 -2.33 0.00 0.00 43.42 40.95 3abq n LEU 3 CO 0.42 0.97 -0.11 -0.75 -1.33 0.00 0.00 177.39 176.59 3abq s LYS 4 N -3.04 0.51 0.12 3.23 2.20 -1.26 -0.89 119.74 120.61 3abq s LYS 4 Ca 0.41 -0.25 -0.12 0.00 -0.36 0.00 0.00 55.97 55.65 3abq s LYS 4 Cb 0.36 0.22 0.01 0.00 -1.51 0.00 0.00 37.83 36.91 3abq s LYS 4 CO 0.03 -0.12 0.30 -0.08 -0.36 0.00 0.00 175.35 175.11 3abq s THR 5 N -1.17 0.10 -0.22 3.43 -1.32 -0.20 -4.93 115.64 111.33 3abq s THR 5 Ca -0.12 -0.98 -0.08 0.00 -1.21 0.00 0.00 61.69 59.30 3abq s THR 5 Cb -0.06 -1.37 -0.04 0.00 -1.51 0.00 0.00 72.50 69.52 3abq s THR 5 CO 0.02 -0.45 0.08 -0.89 -2.21 0.00 0.00 174.62 171.18 3abq s THR 6 N -3.86 4.67 -0.16 5.08 2.01 -1.26 0.30 115.64 122.41 3abq s THR 6 Ca 0.06 -0.06 -0.00 0.00 0.31 0.00 0.00 61.69 62.00 3abq s THR 6 Cb 0.03 -3.15 0.04 0.00 0.01 0.00 0.00 72.50 69.43 3abq s THR 6 CO -0.09 0.38 -0.08 -0.22 -0.69 0.00 0.00 174.62 173.92 3abq s LEU 7 N 1.05 1.71 -1.46 4.42 0.20 0.57 -4.70 118.68 120.46 3abq s LEU 7 Ca 0.05 -0.64 -0.02 0.00 0.69 0.00 0.00 54.13 54.22 3abq s LEU 7 Cb -0.14 -1.01 0.01 0.00 -0.43 0.00 0.00 46.19 44.62 3abq s LEU 7 CO 0.03 -0.15 0.14 0.49 -0.29 0.00 0.00 176.35 176.57 3abq n PHE 8 N 4.83 -1.37 0.00 5.38 3.01 -1.26 -1.66 117.46 126.39 3abq n PHE 8 Ca -0.13 0.12 0.00 0.00 1.01 0.00 0.00 57.45 58.45 3abq n PHE 8 Cb 0.48 -3.56 0.00 0.00 -0.01 0.00 0.00 39.48 36.39 3abq n PHE 8 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3abq n GLY 9 N -1.04 2.67 3.69 1.37 0.00 -1.26 -5.03 105.19 105.59 3abq n GLY 9 Ca -0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.45 3abq n GLY 9 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3abq s ASN 10 N -1.55 6.87 -0.15 1.61 0.01 -0.67 -5.04 114.94 116.03 3abq s ASN 10 Ca 0.00 1.05 -0.29 0.00 -0.71 0.00 0.00 52.86 52.90 3abq s ASN 10 Cb 0.00 -2.39 -0.01 0.00 0.41 0.00 0.00 41.25 39.26 3abq s ASN 10 CO 0.00 -0.20 1.08 -0.69 -1.51 0.00 0.00 177.10 175.78 3abq s VAL 11 N 1.32 4.61 -0.27 1.60 1.01 -1.26 -0.32 120.40 127.09 3abq s VAL 11 Ca 0.34 1.91 -0.05 0.00 0.00 0.00 0.00 61.98 64.19 3abq s VAL 11 Cb -0.17 -4.23 0.01 0.00 0.00 0.00 0.00 36.38 31.99 3abq s VAL 11 CO 0.14 -0.08 0.02 -0.31 0.00 0.00 0.00 175.10 174.88 3abq s TYR 12 N 2.62 3.10 -0.06 5.22 1.51 0.15 -4.98 117.35 124.91 3abq s TYR 12 Ca 0.49 -1.16 0.03 0.00 -1.01 0.00 0.00 57.07 55.42 3abq s TYR 12 Cb -0.18 -2.17 -0.02 0.00 -0.11 0.00 0.00 41.96 39.47 3abq s TYR 12 CO 0.14 -0.62 -0.14 -1.14 -1.11 0.00 0.00 175.55 172.68 3abq s GLN 13 N 1.44 2.62 0.21 -0.62 2.00 -1.26 -1.04 119.66 123.01 3abq s GLN 13 Ca 0.02 -0.69 0.11 0.00 -2.00 0.00 0.00 55.36 52.80 3abq s GLN 13 Cb -0.17 -2.41 -0.05 0.00 0.80 0.00 0.00 33.01 31.19 3abq s GLN 13 CO -0.00 0.57 -0.20 -0.06 -0.50 0.00 0.00 175.29 175.10 3abq s PHE 14 N -0.59 2.36 0.01 1.67 0.40 -0.07 -5.01 117.98 116.75 3abq s PHE 14 Ca 0.09 -0.33 -0.19 0.00 -0.60 0.00 0.00 56.93 55.90 3abq s PHE 14 Cb -0.11 -1.13 -0.25 0.00 0.51 0.00 0.00 43.02 42.04 3abq s PHE 14 CO 0.01 0.56 1.09 -0.22 0.70 0.00 0.00 175.22 177.36 3abq h LYS 15 N 2.90 0.46 -3.57 0.44 3.64 -1.96 -3.46 116.57 115.02 3abq h LYS 15 Ca -0.45 -0.53 -0.16 0.00 -1.27 0.00 0.00 60.65 58.24 3abq h LYS 15 Cb 1.22 0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 33.17 3abq h LYS 15 CO 0.52 1.17 0.05 0.16 -2.27 0.00 0.00 179.45 179.09 3abq s ASP 16 N -6.91 0.55 0.23 4.20 3.84 -1.26 -5.05 116.67 112.28 3abq s ASP 16 Ca -0.12 -1.38 -0.07 0.00 -0.00 0.00 0.00 52.55 50.98 3abq s ASP 16 Cb 0.04 0.78 0.29 0.00 -1.38 0.00 0.00 42.92 42.65 3abq s ASP 16 CO 0.85 -1.54 1.85 0.58 -0.00 0.00 0.00 175.17 176.91 3abq h VAL 17 N 2.03 1.06 -0.65 2.11 2.07 -1.94 -2.51 116.25 118.43 3abq h VAL 17 Ca -0.31 -0.32 0.01 0.00 0.82 0.00 0.00 66.70 66.90 3abq h VAL 17 Cb 1.24 0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 3abq h VAL 17 CO 0.41 0.17 0.42 0.50 0.02 0.00 0.00 177.57 179.09 3abq h LYS 18 N 0.94 0.83 -0.14 1.57 3.64 -1.96 0.66 116.57 122.10 3abq h LYS 18 Ca 0.35 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.57 3abq h LYS 18 Cb 0.12 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 3abq h LYS 18 CO -0.15 0.55 -0.40 1.49 -2.27 0.00 0.00 179.45 178.67 3abq h GLU 19 N 0.86 0.31 -0.29 1.90 4.81 -1.86 -0.92 114.58 119.39 3abq h GLU 19 Ca 0.24 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 59.29 3abq h GLU 19 Cb -0.07 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 3abq h GLU 19 CO -0.06 0.67 0.03 0.28 -0.73 0.00 0.00 179.01 179.19 3abq h VAL 20 N 0.26 1.24 -0.79 0.32 2.07 -0.96 -1.79 116.25 116.61 3abq h VAL 20 Ca 0.02 -0.84 0.01 0.00 0.82 0.00 0.00 66.70 66.71 3abq h VAL 20 Cb 0.82 1.24 -0.04 0.00 -1.52 0.00 0.00 31.29 31.79 3abq h VAL 20 CO 0.07 0.27 0.53 -0.07 0.02 0.00 0.00 177.57 178.38 3abq h LEU 21 N 0.29 0.91 -0.17 2.57 3.38 -0.65 -2.04 115.31 119.60 3abq h LEU 21 Ca 0.08 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 3abq h LEU 21 Cb 0.37 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 3abq h LEU 21 CO 0.01 0.65 -0.09 0.00 0.09 0.00 0.00 178.44 179.10 3abq h ALA 22 N 1.29 0.23 0.00 1.53 0.00 -1.09 -3.28 119.26 117.94 3abq h ALA 22 Ca 0.29 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3abq h ALA 22 Cb -0.11 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.62 3abq h ALA 22 CO -0.07 0.06 -0.12 0.87 0.00 0.00 0.00 179.25 179.99 3abq h LYS 23 N 0.02 0.00 0.00 0.00 1.57 -1.28 -3.03 116.57 113.85 3abq h LYS 23 Ca 0.04 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 3abq h LYS 23 Cb 0.58 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.89 3abq h LYS 23 CO 0.03 0.00 -0.04 0.00 -0.57 0.00 0.00 179.45 178.87 3abq h ALA 24 N 2.38 1.00 -2.86 3.86 0.00 -1.42 -3.40 119.26 118.82 3abq h ALA 24 Ca 0.00 -0.04 -0.56 0.00 0.00 0.00 0.00 54.91 54.32 3abq h ALA 24 Cb 0.81 -0.01 0.13 0.00 0.00 0.00 0.00 17.79 18.73 3abq h ALA 24 CO 0.00 0.05 0.51 0.09 0.00 0.00 0.00 179.25 179.90 3abq n ASN 25 N -3.14 2.49 -4.70 0.00 3.02 -1.15 -4.76 115.26 107.02 3abq n ASN 25 Ca 0.01 1.03 -0.40 0.00 -0.03 0.00 0.00 54.58 55.20 3abq n ASN 25 Cb 0.36 -1.53 0.03 0.00 -0.61 0.00 0.00 39.78 38.03 3abq n ASN 25 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3abq n GLU 26 N -0.45 1.69 -1.66 3.52 -0.58 -1.26 -4.90 120.64 117.01 3abq n GLU 26 Ca 0.08 0.61 -0.49 0.00 -0.42 0.00 0.00 57.16 56.95 3abq n GLU 26 Cb 0.42 -2.41 -0.05 0.00 -0.57 0.00 0.00 31.44 28.84 3abq n GLU 26 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 3abq n LEU 27 N -0.32 2.81 -3.88 -4.62 -0.00 -1.26 -5.00 117.00 104.74 3abq n LEU 27 Ca 0.09 1.07 -0.09 0.00 -0.00 0.00 0.00 56.01 57.07 3abq n LEU 27 Cb 0.42 -1.35 -0.08 0.00 -0.00 0.00 0.00 43.42 42.42 3abq n LEU 27 CO 0.56 -0.41 -0.13 0.00 -0.00 0.00 0.00 177.39 177.41 3abq s ARG 28 N 1.62 0.73 0.34 1.96 1.70 -1.26 -4.87 118.95 119.17 3abq s ARG 28 Ca 0.84 -0.81 0.07 0.00 -0.47 0.00 0.00 55.73 55.36 3abq s ARG 28 Cb -0.77 0.30 0.63 0.00 -0.57 0.00 0.00 34.95 34.54 3abq s ARG 28 CO 0.44 -0.21 1.85 0.66 -1.08 0.00 0.00 175.30 176.96 3abq h SER 29 N 3.20 0.35 -0.66 -2.89 4.64 -1.83 -2.88 113.55 113.47 3abq h SER 29 Ca -0.33 -0.08 0.01 0.00 -0.47 0.00 0.00 61.79 60.92 3abq h SER 29 Cb 1.19 -0.09 -0.04 0.00 -0.31 0.00 0.00 62.40 63.15 3abq h SER 29 CO 0.53 0.52 0.43 1.23 -0.87 0.00 0.00 176.83 178.67 3abq h GLY 30 N 0.87 0.94 0.96 -0.77 0.00 -0.93 -0.43 103.07 103.71 3abq h GLY 30 Ca 0.06 -0.34 -0.08 0.00 0.00 0.00 0.00 47.33 46.98 3abq h GLY 30 CO 0.03 0.32 -0.05 -0.55 0.00 0.00 0.00 176.54 176.29 3abq h ASP 31 N 0.87 0.73 -0.33 0.19 3.32 -1.78 0.60 116.42 120.02 3abq h ASP 31 Ca 0.25 -0.34 0.00 0.00 0.02 0.00 0.00 57.03 56.97 3abq h ASP 31 Cb -0.07 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.27 3abq h ASP 31 CO -0.07 0.89 0.21 0.58 -1.72 0.00 0.00 179.24 179.13 3abq h VAL 32 N 0.55 1.10 -0.91 -1.35 2.07 -1.44 -0.66 116.25 115.61 3abq h VAL 32 Ca 0.11 -0.22 0.11 0.00 0.82 0.00 0.00 66.70 67.52 3abq h VAL 32 Cb 0.55 0.65 -0.08 0.00 -1.52 0.00 0.00 31.29 30.89 3abq h VAL 32 CO 0.03 0.10 0.55 0.25 0.02 0.00 0.00 177.57 178.52 3abq h LEU 33 N 0.43 0.80 0.00 2.57 5.85 -0.91 -0.86 115.31 123.20 3abq h LEU 33 Ca 0.12 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3abq h LEU 33 Cb -0.02 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 40.90 3abq h LEU 33 CO -0.02 0.44 0.00 0.00 -0.34 0.00 0.00 178.44 178.51 3abq n ALA 34 N -2.37 2.11 -1.24 1.25 0.00 0.19 -4.89 120.51 115.56 3abq n ALA 34 Ca 0.16 -0.09 -0.06 0.00 0.00 0.00 0.00 53.44 53.45 3abq n ALA 34 Cb 0.32 -1.39 -0.03 0.00 0.00 0.00 0.00 19.45 18.35 3abq n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3abq n GLY 35 N 0.97 0.83 0.15 0.00 0.00 -0.33 -4.90 105.19 101.91 3abq n GLY 35 Ca 0.06 -0.76 0.04 0.00 0.00 0.00 0.00 46.02 45.37 3abq n GLY 35 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3abq n VAL 36 N -2.89 0.00 -1.44 1.61 0.24 -0.46 -5.02 118.33 110.39 3abq n VAL 36 Ca -0.06 -0.39 -0.30 0.00 -2.04 0.00 0.00 64.34 61.54 3abq n VAL 36 Cb 0.23 1.08 0.10 0.00 -1.47 0.00 0.00 33.84 33.78 3abq n VAL 36 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3abq s ALA 37 N -1.32 2.10 0.73 2.33 0.00 -1.14 -3.81 121.76 120.66 3abq s ALA 37 Ca 0.06 -0.10 -0.14 0.00 0.00 0.00 0.00 51.96 51.78 3abq s ALA 37 Cb 0.07 -3.15 0.04 0.00 0.00 0.00 0.00 23.12 20.08 3abq s ALA 37 CO 0.23 -1.85 1.17 0.00 0.00 0.00 0.00 175.76 175.32 3abq s ALA 38 N -3.06 2.14 -0.80 0.00 0.00 -1.26 -4.88 121.76 113.89 3abq s ALA 38 Ca 0.61 0.75 0.24 0.00 0.00 0.00 0.00 51.96 53.56 3abq s ALA 38 Cb -0.16 -3.42 0.33 0.00 0.00 0.00 0.00 23.12 19.87 3abq s ALA 38 CO 0.55 -1.82 1.28 0.00 0.00 0.00 0.00 175.76 175.77 3abq n ALA 39 N -2.83 3.36 -3.61 0.00 0.00 -1.26 -4.97 120.51 111.19 3abq n ALA 39 Ca 0.12 -0.34 -0.10 0.00 0.00 0.00 0.00 53.44 53.13 3abq n ALA 39 Cb 0.51 -1.09 -0.02 0.00 0.00 0.00 0.00 19.45 18.85 3abq n ALA 39 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3abq s SER 40 N -3.59 -0.43 0.30 0.00 1.04 -1.26 -5.03 113.70 104.73 3abq s SER 40 Ca 0.08 -0.26 -0.01 0.00 0.48 0.00 0.00 55.95 56.24 3abq s SER 40 Cb 0.15 0.65 0.46 0.00 0.10 0.00 0.00 66.02 67.38 3abq s SER 40 CO 0.73 -1.12 1.88 0.28 0.98 0.00 0.00 173.24 176.00 3abq h SER 41 N 2.00 0.78 -0.45 7.02 0.02 -2.00 -2.18 113.55 118.74 3abq h SER 41 Ca -0.27 -0.10 -0.04 0.00 -0.84 0.00 0.00 61.79 60.54 3abq h SER 41 Cb 1.28 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.60 3abq h SER 41 CO 0.31 0.70 0.14 1.56 -1.14 0.00 0.00 176.83 178.40 3abq h GLN 42 N 0.85 0.70 -0.54 3.45 7.50 -1.99 -1.66 115.11 123.42 3abq h GLN 42 Ca 0.20 -0.15 -0.05 0.00 0.50 0.00 0.00 58.65 59.15 3abq h GLN 42 Cb 0.16 -0.10 -0.03 0.00 0.05 0.00 0.00 27.48 27.56 3abq h GLN 42 CO -0.02 0.68 0.14 1.49 -1.50 0.00 0.00 178.83 179.62 3abq h GLU 43 N 0.59 0.82 -0.35 1.46 4.81 -1.92 0.56 114.58 120.56 3abq h GLU 43 Ca 0.14 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 3abq h GLU 43 Cb 0.28 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 3abq h GLU 43 CO -0.00 0.73 0.22 -0.09 -0.73 0.00 0.00 179.01 179.14 3abq h ARG 44 N 0.80 0.46 -0.50 1.92 2.43 -1.06 0.18 114.38 118.61 3abq h ARG 44 Ca 0.18 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.20 3abq h ARG 44 Cb 0.27 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 3abq h ARG 44 CO -0.00 0.33 -0.14 0.28 -1.51 0.00 0.00 179.97 178.93 3abq h VAL 45 N 0.46 1.27 -0.63 0.20 2.07 -0.93 -0.05 116.25 118.64 3abq h VAL 45 Ca 0.13 -1.28 -0.02 0.00 0.82 0.00 0.00 66.70 66.35 3abq h VAL 45 Cb -0.02 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 3abq h VAL 45 CO -0.03 0.45 0.33 0.00 0.02 0.00 0.00 177.57 178.34 3abq h ALA 46 N 0.98 0.81 -0.80 1.67 0.00 -0.68 -1.13 119.26 120.11 3abq h ALA 46 Ca 0.13 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3abq h ALA 46 Cb 0.69 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 3abq h ALA 46 CO 0.05 0.34 0.42 0.00 0.00 0.00 0.00 179.25 180.06 3abq h ALA 47 N 1.15 1.03 -0.55 0.00 0.00 -0.34 -1.27 119.26 119.29 3abq h ALA 47 Ca 0.22 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3abq h ALA 47 Cb 0.07 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 3abq h ALA 47 CO -0.03 0.56 0.29 0.87 0.00 0.00 0.00 179.25 180.94 3abq h LYS 48 N 1.12 0.77 -0.10 0.00 1.57 -0.62 -0.49 116.57 118.84 3abq h LYS 48 Ca 0.28 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.94 3abq h LYS 48 Cb 0.07 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.23 3abq h LYS 48 CO -0.04 0.61 -0.00 0.37 -0.57 0.00 0.00 179.45 179.82 3abq h GLN 49 N 0.74 0.18 -0.56 3.15 4.15 -1.04 0.16 115.11 121.88 3abq h GLN 49 Ca 0.19 -0.06 0.08 0.00 0.77 0.00 0.00 58.65 59.63 3abq h GLN 49 Cb 0.08 -0.02 -0.06 0.00 0.21 0.00 0.00 27.48 27.69 3abq h GLN 49 CO -0.03 0.44 0.22 0.28 -1.93 0.00 0.00 178.83 177.81 3abq h VAL 50 N -0.11 0.82 -0.81 2.39 2.07 -1.16 -0.75 116.25 118.70 3abq h VAL 50 Ca 0.03 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 3abq h VAL 50 Cb 0.36 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.47 3abq h VAL 50 CO 0.01 0.07 0.43 0.25 0.02 0.00 0.00 177.57 178.35 3abq h LEU 51 N 0.41 1.03 -1.71 2.57 5.85 -0.97 -2.15 115.31 120.35 3abq h LEU 51 Ca 0.27 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.85 3abq h LEU 51 Cb 0.30 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 3abq h LEU 51 CO -0.26 0.85 -0.09 0.77 -0.34 0.00 0.00 178.44 179.37 3abq h SER 52 N 1.14 0.07 0.33 1.25 4.64 0.67 -2.55 113.55 119.09 3abq h SER 52 Ca 0.28 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 3abq h SER 52 Cb 0.06 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 3abq h SER 52 CO -0.04 0.17 -0.76 -0.62 -0.87 0.00 0.00 176.83 174.70 3abq n GLU 53 N -4.39 0.06 -2.29 4.77 -0.58 -0.44 -1.19 120.64 116.58 3abq n GLU 53 Ca -0.02 -0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.37 3abq n GLU 53 Cb 0.19 -1.52 -0.00 0.00 -0.57 0.00 0.00 31.44 29.54 3abq n GLU 53 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 3abq s MET 54 N -3.04 3.43 0.54 3.49 -1.94 -0.84 -4.81 119.30 116.13 3abq s MET 54 Ca 0.09 1.53 -0.01 0.00 -1.71 0.00 0.00 55.69 55.58 3abq s MET 54 Cb 0.16 -2.02 0.02 0.00 2.01 0.00 0.00 34.83 35.00 3abq s MET 54 CO 0.77 -0.77 0.79 0.95 -0.01 0.00 0.00 175.02 176.75 3abq s THR 55 N -1.88 3.22 0.27 2.05 -4.23 -1.26 -0.91 115.64 112.90 3abq s THR 55 Ca 0.71 -0.45 -0.02 0.00 -1.18 0.00 0.00 61.69 60.75 3abq s THR 55 Cb -0.22 -3.23 0.26 0.00 1.34 0.00 0.00 72.50 70.65 3abq s THR 55 CO 0.26 -0.19 1.86 0.58 -0.54 0.00 0.00 174.62 176.60 3abq h VAL 56 N 0.06 1.01 -0.73 2.29 2.07 -0.71 -2.44 116.25 117.80 3abq h VAL 56 Ca -0.44 -0.37 -0.05 0.00 0.82 0.00 0.00 66.70 66.66 3abq h VAL 56 Cb 1.28 -0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 3abq h VAL 56 CO 0.56 0.19 0.25 0.00 0.02 0.00 0.00 177.57 178.60 3abq h ALA 57 N 1.48 1.07 -0.61 1.67 0.00 -1.21 0.77 119.26 122.43 3abq h ALA 57 Ca 0.45 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 55.17 3abq h ALA 57 Cb 0.29 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 3abq h ALA 57 CO -0.21 0.64 0.38 -0.44 0.00 0.00 0.00 179.25 179.62 3abq h ASP 58 N 1.07 0.62 0.11 0.00 3.32 -1.70 -1.52 116.42 118.31 3abq h ASP 58 Ca 0.24 -0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.13 3abq h ASP 58 Cb 0.26 -0.13 0.02 0.00 0.22 0.00 0.00 39.33 39.69 3abq h ASP 58 CO -0.01 0.44 -0.67 0.40 -1.72 0.00 0.00 179.24 177.67 3abq h ILE 59 N 0.75 1.54 -0.92 0.35 1.08 -1.26 -3.16 117.51 115.89 3abq h ILE 59 Ca 0.24 -2.45 0.09 0.00 -0.39 0.00 0.00 64.86 62.35 3abq h ILE 59 Cb 0.01 3.16 -0.07 0.00 -3.07 0.00 0.00 36.82 36.85 3abq h ILE 59 CO -0.10 0.69 0.57 -0.09 -0.69 0.00 0.00 178.15 178.53 3abq h ARG 60 N -0.43 0.93 -0.00 2.37 1.12 -0.87 -2.04 114.38 115.46 3abq h ARG 60 Ca -0.11 -0.06 0.00 0.00 -1.11 0.00 0.00 59.98 58.70 3abq h ARG 60 Cb 1.51 -0.21 0.00 0.00 -0.01 0.00 0.00 29.97 31.26 3abq h ARG 60 CO 0.13 0.62 -0.01 0.09 -3.11 0.00 0.00 179.97 177.69 3abq n ASN 61 N -4.64 0.02 -3.21 -3.80 3.02 -0.58 -4.15 115.26 101.93 3abq n ASN 61 Ca 0.16 -0.05 -0.24 0.00 -0.03 0.00 0.00 54.58 54.41 3abq n ASN 61 Cb 0.27 -0.31 -0.06 0.00 -0.61 0.00 0.00 39.78 39.07 3abq n ASN 61 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3abq n ASN 62 N -1.31 2.15 -4.75 6.41 3.02 -0.77 -5.08 115.26 114.93 3abq n ASN 62 Ca 0.13 -3.16 -0.34 0.00 -0.03 0.00 0.00 54.58 51.18 3abq n ASN 62 Cb 0.26 -0.63 0.06 0.00 -0.61 0.00 0.00 39.78 38.86 3abq n ASN 62 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3abq s PRO 63 N -2.25 2.56 0.48 3.52 0.04 -1.25 -4.81 135.00 133.29 3abq s PRO 63 Ca 0.40 1.56 0.26 0.00 0.04 0.00 0.00 61.00 63.26 3abq s PRO 63 Cb 0.22 -1.91 1.16 0.00 0.04 0.00 0.00 34.50 34.02 3abq s PRO 63 CO -0.08 -1.47 1.93 -0.39 0.04 0.00 0.00 177.00 177.03 3abq h VAL 64 N -0.03 0.51 -3.89 -0.36 -1.51 -1.98 -3.40 116.25 105.58 3abq h VAL 64 Ca -0.47 -0.86 -0.55 0.00 -1.23 0.00 0.00 66.70 63.58 3abq h VAL 64 Cb 1.27 1.59 -0.31 0.00 -2.13 0.00 0.00 31.29 31.71 3abq h VAL 64 CO 0.52 0.17 -0.83 -0.63 -1.23 0.00 0.00 177.57 175.57 3abq s ILE 65 N -3.84 1.38 0.67 7.19 1.01 -1.26 -4.94 121.20 121.41 3abq s ILE 65 Ca -0.01 -0.69 -0.17 0.00 0.00 0.00 0.00 60.65 59.79 3abq s ILE 65 Cb 0.11 -1.19 0.00 0.00 0.01 0.00 0.00 42.46 41.40 3abq s ILE 65 CO 0.61 0.40 1.21 0.00 0.00 0.00 0.00 174.94 177.15 3abq s ALA 66 N 0.06 2.33 0.09 9.38 0.00 -1.26 -4.82 121.76 127.54 3abq s ALA 66 Ca -0.04 0.93 -0.22 0.00 0.00 0.00 0.00 51.96 52.63 3abq s ALA 66 Cb -0.11 -3.46 -0.14 0.00 0.00 0.00 0.00 23.12 19.41 3abq s ALA 66 CO 0.02 -1.54 1.74 -0.92 0.00 0.00 0.00 175.76 175.06 3abq h TYR 67 N 0.24 0.04 0.00 0.00 5.03 -1.93 -2.53 116.97 117.82 3abq h TYR 67 Ca -0.49 0.00 0.00 0.00 2.58 0.00 0.00 58.73 60.82 3abq h TYR 67 Cb 1.30 -0.01 0.00 0.00 1.55 0.00 0.00 36.73 39.56 3abq h TYR 67 CO 0.47 0.03 0.00 0.93 -1.32 0.00 0.00 178.16 178.27 3abq h GLU 68 N 0.04 0.00 -0.00 1.82 3.07 -2.00 -3.07 114.58 114.45 3abq h GLU 68 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 3abq h GLU 68 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3abq h GLU 68 CO -0.00 0.00 -0.89 -0.25 -1.40 0.00 0.00 179.01 176.47 3abq n ASP 69 N -2.75 0.89 -3.67 1.42 8.00 -1.10 -4.94 116.55 114.40 3abq n ASP 69 Ca 0.01 -0.94 -0.17 0.00 0.71 0.00 0.00 54.79 54.40 3abq n ASP 69 Cb 0.29 1.00 -0.16 0.00 -0.02 0.00 0.00 41.12 42.23 3abq n ASP 69 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3abq s ASP 70 N -2.77 0.77 0.39 -2.24 2.15 -0.97 -4.93 116.67 109.06 3abq s ASP 70 Ca 0.07 0.31 0.20 0.00 0.43 0.00 0.00 52.55 53.55 3abq s ASP 70 Cb 0.14 0.23 0.69 0.00 -0.30 0.00 0.00 42.92 43.68 3abq s ASP 70 CO 0.77 -0.24 1.74 0.00 -0.17 0.00 0.00 175.17 177.26 3abq h VAL 72 N 0.00 1.35 -0.74 0.00 2.07 -1.91 -0.37 116.25 116.66 3abq h VAL 72 Ca -0.00 -1.51 0.10 0.00 0.82 0.00 0.00 66.70 66.10 3abq h VAL 72 Cb 0.89 1.95 -0.07 0.00 -1.52 0.00 0.00 31.29 32.54 3abq h VAL 72 CO 0.04 0.45 0.37 0.74 0.02 0.00 0.00 177.57 179.20 3abq h THR 73 N 0.09 0.84 -0.28 2.57 2.02 -1.85 -0.62 112.91 115.67 3abq h THR 73 Ca 0.01 -0.21 -0.01 0.00 0.77 0.00 0.00 66.41 66.96 3abq h THR 73 Cb 0.86 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 3abq h THR 73 CO 0.06 0.11 0.12 0.03 0.37 0.00 0.00 175.52 176.21 3abq h ARG 74 N 0.62 0.42 -0.58 6.66 3.08 -1.27 0.07 114.38 123.37 3abq h ARG 74 Ca 0.37 -0.07 0.01 0.00 0.07 0.00 0.00 59.98 60.36 3abq h ARG 74 Cb 0.40 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.34 3abq h ARG 74 CO -0.28 0.43 0.37 1.25 -1.07 0.00 0.00 179.97 180.68 3abq h LEU 75 N 0.31 0.63 0.27 3.04 5.85 -0.68 0.12 115.31 124.85 3abq h LEU 75 Ca 0.09 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 3abq h LEU 75 Cb 0.17 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.05 3abq h LEU 75 CO -0.01 0.45 -0.13 0.40 -0.34 0.00 0.00 178.44 178.81 3abq h ILE 76 N 0.75 0.76 -0.50 4.05 2.04 -0.94 -2.85 117.51 120.82 3abq h ILE 76 Ca 0.22 -0.19 -0.09 0.00 1.00 0.00 0.00 64.86 65.80 3abq h ILE 76 Cb -0.05 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 3abq h ILE 76 CO -0.07 0.04 -0.05 1.56 0.00 0.00 0.00 178.15 179.64 3abq h GLN 77 N -0.47 0.87 0.00 2.37 1.08 -0.79 -2.54 115.11 115.63 3abq h GLN 77 Ca -0.04 -0.27 0.00 0.00 -1.45 0.00 0.00 58.65 56.90 3abq h GLN 77 Cb 0.35 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.70 3abq h GLN 77 CO 0.06 0.89 0.00 -0.25 -0.95 0.00 0.00 178.83 178.59 3abq n ASP 78 N -4.18 0.00 -0.65 1.46 8.00 0.39 -2.74 116.55 118.83 3abq n ASP 78 Ca 0.02 0.24 0.12 0.00 0.71 0.00 0.00 54.79 55.88 3abq n ASP 78 Cb 0.34 -0.40 0.09 0.00 -0.02 0.00 0.00 41.12 41.14 3abq n ASP 78 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3abq n ASP 79 N -1.40 2.30 -4.71 -2.24 9.92 -0.96 -4.95 116.55 114.51 3abq n ASP 79 Ca 0.08 -1.66 -0.42 0.00 -0.53 0.00 0.00 54.79 52.26 3abq n ASP 79 Cb 0.22 0.25 -0.03 0.00 -0.64 0.00 0.00 41.12 40.92 3abq n ASP 79 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 3abq s VAL 80 N -2.27 3.09 -0.42 2.53 1.01 -1.11 -4.97 120.40 118.26 3abq s VAL 80 Ca 0.24 0.73 -0.29 0.00 0.00 0.00 0.00 61.98 62.66 3abq s VAL 80 Cb 0.19 -3.47 0.01 0.00 0.00 0.00 0.00 36.38 33.11 3abq s VAL 80 CO 0.45 0.04 1.47 0.21 0.00 0.00 0.00 175.10 177.28 3abq s ASN 81 N 1.37 6.24 0.41 3.32 3.84 0.06 -4.90 114.94 125.28 3abq s ASN 81 Ca 0.68 0.82 0.22 0.00 0.21 0.00 0.00 52.86 54.79 3abq s ASN 81 Cb -0.39 -2.54 0.75 0.00 -0.55 0.00 0.00 41.25 38.52 3abq s ASN 81 CO 0.30 -1.51 1.75 -0.33 -2.79 0.00 0.00 177.10 174.52 3abq h GLU 82 N 11.10 0.00 -0.24 0.43 4.39 -1.93 -0.42 114.58 127.91 3abq h GLU 82 Ca -0.28 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.30 3abq h GLU 82 Cb 1.11 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.76 3abq h GLU 82 CO 1.09 0.27 -0.33 1.15 -1.16 0.00 0.00 179.01 180.03 3abq h THR 83 N 0.00 1.32 -0.51 1.13 2.02 -1.96 -0.25 112.91 114.65 3abq h THR 83 Ca -0.00 -1.53 -0.05 0.00 0.77 0.00 0.00 66.41 65.60 3abq h THR 83 Cb 0.87 1.74 -0.02 0.00 -1.74 0.00 0.00 68.15 68.99 3abq h THR 83 CO 0.04 0.48 0.12 0.00 0.37 0.00 0.00 175.52 176.53 3abq h ALA 84 N 0.65 0.68 -0.43 6.16 0.00 -1.81 -2.84 119.26 121.67 3abq h ALA 84 Ca 0.03 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3abq h ALA 84 Cb 0.92 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 3abq h ALA 84 CO 0.08 0.38 0.28 -0.92 0.00 0.00 0.00 179.25 179.06 3abq h TYR 85 N 0.71 0.55 -0.13 0.00 3.20 -1.04 -2.65 116.97 117.62 3abq h TYR 85 Ca 0.16 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.08 3abq h TYR 85 Cb 0.34 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.42 3abq h TYR 85 CO 0.02 0.36 0.10 -0.91 -1.64 0.00 0.00 178.16 176.08 3abq h ASN 86 N 0.58 0.00 0.63 -2.11 2.35 -0.94 0.11 115.58 116.20 3abq h ASN 86 Ca 0.16 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.78 3abq h ASN 86 Cb -0.05 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 3abq h ASN 86 CO -0.03 0.00 -0.59 1.56 -1.65 0.00 0.00 177.43 176.72 3abq h GLN 87 N 0.00 0.00 -0.00 0.81 4.20 -1.23 -3.34 115.11 115.55 3abq h GLN 87 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 3abq h GLN 87 Cb 0.25 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.03 3abq h GLN 87 CO -0.00 0.59 -0.11 0.44 -0.67 0.00 0.00 178.83 179.08 3abq n ILE 88 N -3.79 0.00 0.27 2.54 -5.35 -0.69 -4.74 119.36 107.60 3abq n ILE 88 Ca -0.01 -0.44 0.10 0.00 -0.27 0.00 0.00 62.75 62.13 3abq n ILE 88 Cb 0.60 1.07 0.73 0.00 -1.74 0.00 0.00 39.64 40.30 3abq n ILE 88 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 3abq h LYS 89 N 0.66 0.00 -0.02 6.28 2.10 -0.94 0.39 116.57 125.04 3abq h LYS 89 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3abq h LYS 89 Cb 0.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.53 3abq h LYS 89 CO 0.00 0.00 -0.02 0.09 -2.00 0.00 0.00 179.45 177.52 3abq n ASN 90 N -4.31 2.19 -4.76 7.07 3.02 -1.26 -0.75 115.26 116.46 3abq n ASN 90 Ca -0.03 -1.71 -0.41 0.00 -0.03 0.00 0.00 54.58 52.40 3abq n ASN 90 Cb 0.09 0.02 -0.03 0.00 -0.61 0.00 0.00 39.78 39.25 3abq n ASN 90 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 3abq s TRP 91 N -2.03 3.20 0.69 3.10 0.52 0.13 -4.83 118.94 119.72 3abq s TRP 91 Ca 0.32 1.37 -0.13 0.00 0.02 0.00 0.00 56.10 57.68 3abq s TRP 91 Cb 0.20 -3.60 0.01 0.00 -1.15 0.00 0.00 33.47 28.94 3abq s TRP 91 CO 0.33 -1.71 1.09 -1.54 0.02 0.00 0.00 176.95 175.15 3abq s SER 92 N -0.23 5.03 0.45 2.95 1.04 -1.26 -0.43 113.70 121.24 3abq s SER 92 Ca 0.51 1.89 0.13 0.00 0.48 0.00 0.00 55.95 58.96 3abq s SER 92 Cb -0.38 -2.53 1.00 0.00 0.10 0.00 0.00 66.02 64.21 3abq s SER 92 CO 0.46 -1.68 2.02 0.40 0.98 0.00 0.00 173.24 175.41 3abq h ILE 93 N -0.34 1.11 -0.17 -1.02 1.08 -0.85 -1.29 117.51 116.02 3abq h ILE 93 Ca -0.45 -0.49 0.02 0.00 -0.39 0.00 0.00 64.86 63.55 3abq h ILE 93 Cb 1.24 1.18 -0.02 0.00 -3.07 0.00 0.00 36.82 36.14 3abq h ILE 93 CO 0.54 0.15 0.03 -1.28 -0.69 0.00 0.00 178.15 176.89 3abq h SER 94 N 0.09 -0.01 -0.46 1.72 0.87 -1.42 -0.94 113.55 113.40 3abq h SER 94 Ca 0.02 0.03 -0.07 0.00 -1.23 0.00 0.00 61.79 60.53 3abq h SER 94 Cb 0.23 0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.21 3abq h SER 94 CO 0.01 0.02 0.02 -0.33 -0.53 0.00 0.00 176.83 176.03 3abq h GLU 95 N 0.09 0.86 -0.58 2.24 5.08 -1.62 -1.96 114.58 118.70 3abq h GLU 95 Ca 0.08 -0.23 -0.07 0.00 -1.00 0.00 0.00 59.36 58.14 3abq h GLU 95 Cb 0.08 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 3abq h GLU 95 CO -0.11 0.85 0.10 1.25 -1.00 0.00 0.00 179.01 180.10 3abq h LEU 96 N 0.80 0.90 0.02 1.33 5.85 -1.12 0.13 115.31 123.23 3abq h LEU 96 Ca 0.16 -0.25 0.01 0.00 0.84 0.00 0.00 57.88 58.63 3abq h LEU 96 Cb 0.45 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 3abq h LEU 96 CO 0.02 0.93 -0.08 -0.09 -0.34 0.00 0.00 178.44 178.88 3abq h ARG 97 N 0.84 -0.14 -0.37 1.25 2.43 -0.96 -0.30 114.38 117.13 3abq h ARG 97 Ca 0.18 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.32 3abq h ARG 97 Cb 0.40 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.97 3abq h ARG 97 CO 0.01 -0.10 0.09 0.93 -1.51 0.00 0.00 179.97 179.39 3abq h GLU 98 N -0.15 0.54 -0.10 0.20 5.08 -1.17 -2.16 114.58 116.83 3abq h GLU 98 Ca 0.02 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 3abq h GLU 98 Cb 0.18 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 3abq h GLU 98 CO -0.06 0.50 0.04 -0.92 -1.00 0.00 0.00 179.01 177.56 3abq h TYR 99 N 0.53 0.15 -0.47 4.33 3.20 -0.38 -1.41 116.97 122.92 3abq h TYR 99 Ca 0.12 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.95 3abq h TYR 99 Cb 0.20 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.41 3abq h TYR 99 CO 0.01 0.26 0.17 0.28 -1.64 0.00 0.00 178.16 177.23 3abq h VAL 100 N -0.00 1.18 0.00 1.81 2.07 -0.70 -2.98 116.25 117.62 3abq h VAL 100 Ca 0.03 -0.60 0.00 0.00 0.82 0.00 0.00 66.70 66.96 3abq h VAL 100 Cb 0.17 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 3abq h VAL 100 CO -0.00 0.23 -0.57 -0.07 0.02 0.00 0.00 177.57 177.18 3abq h LEU 101 N 0.67 0.00 -9.80 2.57 3.38 -1.28 -3.47 115.31 107.38 3abq h LEU 101 Ca 0.16 -0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.60 3abq h LEU 101 Cb 0.17 0.00 0.08 0.00 0.09 0.00 0.00 40.66 41.00 3abq h LEU 101 CO -0.01 0.00 0.87 -0.55 0.09 0.00 0.00 178.44 178.84 3abq s SER 102 N -5.69 6.40 0.14 -0.43 0.15 -0.54 -4.88 113.70 108.84 3abq s SER 102 Ca 0.03 2.93 0.21 0.00 0.70 0.00 0.00 55.95 59.81 3abq s SER 102 Cb 0.08 -2.63 0.85 0.00 -1.71 0.00 0.00 66.02 62.60 3abq s SER 102 CO 0.74 -0.89 1.64 0.47 1.20 0.00 0.00 173.24 176.39 3abq n ASP 103 N 2.14 0.39 -0.04 5.45 10.43 -1.26 -2.08 116.55 131.59 3abq n ASP 103 Ca 0.08 0.59 0.13 0.00 2.57 0.00 0.00 54.79 58.16 3abq n ASP 103 Cb 0.38 -0.67 0.45 0.00 1.84 0.00 0.00 41.12 43.11 3abq n ASP 103 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 3abq n GLU 104 N -1.92 0.19 -3.13 -1.24 -0.58 -1.26 -4.71 120.64 107.99 3abq n GLU 104 Ca 0.03 -0.08 -0.41 0.00 -0.42 0.00 0.00 57.16 56.28 3abq n GLU 104 Cb 0.23 -1.50 -0.07 0.00 -0.57 0.00 0.00 31.44 29.54 3abq n GLU 104 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 3abq s THR 105 N -2.86 4.95 0.64 2.62 2.01 -0.88 -5.07 115.64 117.05 3abq s THR 105 Ca 0.16 0.82 -0.06 0.00 0.31 0.00 0.00 61.69 62.93 3abq s THR 105 Cb 0.19 -3.99 0.03 0.00 0.01 0.00 0.00 72.50 68.74 3abq s THR 105 CO 0.59 -0.13 0.95 -0.94 -0.69 0.00 0.00 174.62 174.40 3abq s SER 106 N 1.64 5.30 0.27 3.53 1.04 -1.26 -4.91 113.70 119.31 3abq s SER 106 Ca 0.24 0.63 -0.01 0.00 0.48 0.00 0.00 55.95 57.29 3abq s SER 106 Cb -0.15 -1.49 0.47 0.00 0.10 0.00 0.00 66.02 64.95 3abq s SER 106 CO 0.12 -1.27 1.84 0.58 0.98 0.00 0.00 173.24 175.49 3abq h VAL 107 N -0.35 0.96 -0.10 5.02 2.07 -1.98 -2.05 116.25 119.82 3abq h VAL 107 Ca -0.45 -0.34 -0.12 0.00 0.82 0.00 0.00 66.70 66.61 3abq h VAL 107 Cb 1.28 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 3abq h VAL 107 CO 0.61 0.18 -0.46 0.44 0.02 0.00 0.00 177.57 178.35 3abq h ASP 108 N 0.99 0.25 0.08 0.57 3.45 -1.96 -0.11 116.42 119.69 3abq h ASP 108 Ca 0.45 -0.12 -0.00 0.00 0.43 0.00 0.00 57.03 57.80 3abq h ASP 108 Cb 0.37 -0.07 -0.00 0.00 -0.56 0.00 0.00 39.33 39.07 3abq h ASP 108 CO -0.24 0.68 -0.04 0.44 -1.57 0.00 0.00 179.24 178.51 3abq h ASP 109 N 0.19 -0.11 0.04 6.45 3.32 -1.81 -2.90 116.42 121.61 3abq h ASP 109 Ca 0.01 0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.00 3abq h ASP 109 Cb 0.90 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.46 3abq h ASP 109 CO 0.07 -0.07 -0.18 0.40 -1.72 0.00 0.00 179.24 177.74 3abq h ILE 110 N -0.12 1.21 -0.75 0.35 2.04 -1.22 -1.81 117.51 117.21 3abq h ILE 110 Ca -0.01 -0.95 0.10 0.00 1.00 0.00 0.00 64.86 65.00 3abq h ILE 110 Cb 0.10 1.28 -0.08 0.00 -0.74 0.00 0.00 36.82 37.38 3abq h ILE 110 CO 0.01 0.29 0.38 0.00 0.00 0.00 0.00 178.15 178.84 3abq h ALA 111 N 1.57 1.05 0.15 1.87 0.00 -0.82 -0.43 119.26 122.65 3abq h ALA 111 Ca 0.05 0.06 -0.21 0.00 0.00 0.00 0.00 54.91 54.81 3abq h ALA 111 Cb 0.47 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.23 3abq h ALA 111 CO 0.03 -0.04 -0.92 0.35 0.00 0.00 0.00 179.25 178.67 3abq h PHE 112 N 0.62 0.58 -0.83 0.00 3.04 -1.35 -3.37 116.94 115.63 3abq h PHE 112 Ca 0.38 -0.43 0.06 0.00 3.98 0.00 0.00 57.97 61.96 3abq h PHE 112 Cb 0.42 -0.02 -0.06 0.00 2.56 0.00 0.00 35.95 38.85 3abq h PHE 112 CO -0.10 1.35 0.51 1.15 -2.02 0.00 0.00 178.31 179.20 3abq h THR 113 N -0.32 1.05 0.00 4.41 2.02 -1.11 -2.44 112.91 116.51 3abq h THR 113 Ca -0.16 -0.32 -0.03 0.00 0.77 0.00 0.00 66.41 66.66 3abq h THR 113 Cb 1.70 0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 68.13 3abq h THR 113 CO 0.16 0.17 -0.15 0.08 0.37 0.00 0.00 175.52 176.15 3abq h ARG 114 N 0.94 0.00 0.00 6.66 0.11 -1.24 -1.17 114.38 119.68 3abq h ARG 114 Ca 0.36 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.44 3abq h ARG 114 Cb 0.15 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.23 3abq h ARG 114 CO -0.16 0.15 0.00 0.87 0.10 0.00 0.00 179.97 180.92 3abq h LYS 115 N 0.00 0.00 -0.03 0.08 1.57 -1.59 -1.59 116.57 115.00 3abq h LYS 115 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3abq h LYS 115 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 3abq h LYS 115 CO 0.02 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.31 3abq n GLY 116 N -0.50 0.11 3.94 3.86 0.00 -0.44 -0.76 105.19 111.39 3abq n GLY 116 Ca -0.00 -0.46 -0.25 0.00 0.00 0.00 0.00 46.02 45.31 3abq n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3abq s LEU 117 N -1.96 4.09 0.41 0.99 1.43 -0.60 -4.31 118.68 118.72 3abq s LEU 117 Ca 0.37 0.42 0.07 0.00 -1.03 0.00 0.00 54.13 53.96 3abq s LEU 117 Cb 0.21 -3.25 -0.05 0.00 0.03 0.00 0.00 46.19 43.12 3abq s LEU 117 CO 0.33 -0.21 0.18 0.42 0.23 0.00 0.00 176.35 177.29 3abq s THR 118 N -2.17 2.37 0.29 5.49 -4.23 -1.26 -4.81 115.64 111.32 3abq s THR 118 Ca 0.39 -1.70 -0.02 0.00 -1.18 0.00 0.00 61.69 59.18 3abq s THR 118 Cb -0.10 -2.99 0.26 0.00 1.34 0.00 0.00 72.50 71.01 3abq s THR 118 CO 0.33 -0.02 1.97 0.28 -0.54 0.00 0.00 174.62 176.64 3abq h SER 119 N 1.44 0.97 -0.99 3.99 0.02 -1.94 -1.29 113.55 115.76 3abq h SER 119 Ca -0.43 -0.03 0.03 0.00 -0.84 0.00 0.00 61.79 60.53 3abq h SER 119 Cb 1.25 -0.24 -0.06 0.00 0.14 0.00 0.00 62.40 63.49 3abq h SER 119 CO 0.69 0.70 0.65 -0.33 -1.14 0.00 0.00 176.83 177.40 3abq h GLU 120 N 1.15 1.23 -0.48 3.45 3.07 -1.91 0.52 114.58 121.61 3abq h GLU 120 Ca 0.31 -0.07 -0.12 0.00 -0.50 0.00 0.00 59.36 58.98 3abq h GLU 120 Cb -0.13 -0.28 -0.01 0.00 -0.84 0.00 0.00 28.75 27.49 3abq h GLU 120 CO -0.07 0.81 -0.16 0.28 -1.40 0.00 0.00 179.01 178.48 3abq h VAL 121 N 1.27 1.27 -0.59 3.13 2.07 -1.58 -0.85 116.25 120.97 3abq h VAL 121 Ca 0.39 -1.31 0.05 0.00 0.82 0.00 0.00 66.70 66.65 3abq h VAL 121 Cb -0.03 1.11 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 3abq h VAL 121 CO -0.11 0.45 0.32 0.58 0.02 0.00 0.00 177.57 178.83 3abq h VAL 122 N 0.81 0.98 -0.32 2.57 2.07 -0.78 -2.18 116.25 119.39 3abq h VAL 122 Ca 0.12 -0.21 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 3abq h VAL 122 Cb 0.73 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 3abq h VAL 122 CO 0.06 0.11 0.20 0.00 0.02 0.00 0.00 177.57 177.95 3abq h ALA 123 N 1.30 0.41 -0.95 1.67 0.00 -0.66 -2.86 119.26 118.17 3abq h ALA 123 Ca 0.26 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.21 3abq h ALA 123 Cb 0.14 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.73 3abq h ALA 123 CO -0.16 -0.10 0.60 0.00 0.00 0.00 0.00 179.25 179.58 3abq h ALA 124 N 1.08 1.36 -0.24 0.00 0.00 -0.75 -1.54 119.26 119.17 3abq h ALA 124 Ca 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3abq h ALA 124 Cb -0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 3abq h ALA 124 CO -0.02 0.30 0.11 0.28 0.00 0.00 0.00 179.25 179.92 3abq h VAL 125 N 1.03 1.16 -0.02 0.00 2.07 -1.29 -2.84 116.25 116.35 3abq h VAL 125 Ca 0.43 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 3abq h VAL 125 Cb 0.29 1.01 -0.00 0.00 -1.52 0.00 0.00 31.29 31.07 3abq h VAL 125 CO -0.21 0.16 -0.06 0.00 0.02 0.00 0.00 177.57 177.48 3abq h ALA 126 N 0.96 1.86 0.00 1.67 0.00 -1.13 -2.86 119.26 119.75 3abq h ALA 126 Ca 0.08 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 3abq h ALA 126 Cb 0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3abq h ALA 126 CO -0.01 0.11 -0.38 0.87 0.00 0.00 0.00 179.25 179.84 3abq h LYS 127 N 0.03 0.00 -0.51 0.00 1.57 -1.06 -2.73 116.57 113.87 3abq h LYS 127 Ca 0.01 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 3abq h LYS 127 Cb 0.13 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.34 3abq h LYS 127 CO 0.01 0.38 0.13 0.44 -0.57 0.00 0.00 179.45 179.84 3abq n ILE 128 N -3.64 2.67 -4.51 1.86 -5.35 -1.08 -4.75 119.36 104.55 3abq n ILE 128 Ca -0.01 -2.07 -0.34 0.00 -0.27 0.00 0.00 62.75 60.06 3abq n ILE 128 Cb 0.49 -0.33 -0.11 0.00 -1.74 0.00 0.00 39.64 37.95 3abq n ILE 128 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3abq s SER 130 N -0.55 3.37 0.20 0.00 1.04 -1.26 -4.80 113.70 111.69 3abq s SER 130 Ca 0.09 0.65 -0.11 0.00 0.48 0.00 0.00 55.95 57.06 3abq s SER 130 Cb -0.12 -1.00 0.13 0.00 0.10 0.00 0.00 66.02 65.14 3abq s SER 130 CO 0.02 -2.61 1.83 0.78 0.98 0.00 0.00 173.24 174.24 3abq h ASN 131 N -1.55 0.87 -0.19 7.02 4.21 -1.99 -0.31 115.58 123.64 3abq h ASN 131 Ca -0.47 -0.08 -0.10 0.00 1.21 0.00 0.00 56.30 56.87 3abq h ASN 131 Cb 1.30 -0.22 -0.02 0.00 -1.12 0.00 0.00 38.32 38.26 3abq h ASN 131 CO 0.52 0.69 -0.20 0.00 -1.29 0.00 0.00 177.43 177.15 3abq h ALA 132 N 1.21 1.02 0.03 -0.83 0.00 -1.99 -1.78 119.26 116.92 3abq h ALA 132 Ca 0.25 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 54.84 3abq h ALA 132 Cb -0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3abq h ALA 132 CO -0.04 0.58 -0.12 -0.44 0.00 0.00 0.00 179.25 179.23 3abq h ASP 133 N 0.56 -0.33 -0.96 0.00 3.32 -1.76 0.89 116.42 118.14 3abq h ASP 133 Ca 0.09 0.05 0.05 0.00 0.02 0.00 0.00 57.03 57.23 3abq h ASP 133 Cb 0.66 0.13 -0.06 0.00 0.22 0.00 0.00 39.33 40.28 3abq h ASP 133 CO 0.05 -0.17 0.63 -0.07 -1.72 0.00 0.00 179.24 177.95 3abq h LEU 134 N -0.21 1.02 -0.01 1.55 3.38 -0.85 0.29 115.31 120.49 3abq h LEU 134 Ca 0.03 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3abq h LEU 134 Cb 0.25 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3abq h LEU 134 CO -0.09 0.68 -0.02 0.40 0.09 0.00 0.00 178.44 179.49 3abq h ILE 135 N 1.17 1.51 -0.40 1.22 2.04 -1.07 -2.32 117.51 119.66 3abq h ILE 135 Ca 0.39 -1.52 -0.14 0.00 1.00 0.00 0.00 64.86 64.59 3abq h ILE 135 Cb 0.08 2.52 -0.01 0.00 -0.74 0.00 0.00 36.82 38.67 3abq h ILE 135 CO -0.13 0.40 -0.31 0.22 0.00 0.00 0.00 178.15 178.32 3abq h TYR 136 N -0.61 1.07 -0.32 1.37 3.20 -0.68 -1.59 116.97 119.41 3abq h TYR 136 Ca -0.00 -0.30 0.04 0.00 3.14 0.00 0.00 58.73 61.60 3abq h TYR 136 Cb 0.66 -0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.66 3abq h TYR 136 CO 0.15 1.11 0.11 0.78 -1.64 0.00 0.00 178.16 178.67 3abq h GLY 137 N 0.73 0.40 1.03 1.82 0.00 -0.52 -2.72 103.07 103.82 3abq h GLY 137 Ca 0.07 -0.06 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 3abq h GLY 137 CO 0.08 0.03 0.30 0.00 0.00 0.00 0.00 176.54 176.94 3abq h ALA 138 N 1.21 0.96 -0.70 3.60 0.00 -1.31 -3.02 119.26 120.00 3abq h ALA 138 Ca 0.15 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3abq h ALA 138 Cb 0.12 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 3abq h ALA 138 CO -0.15 0.58 0.45 -0.22 0.00 0.00 0.00 179.25 179.91 3abq h LYS 139 N 1.06 0.93 -0.31 0.00 1.63 -0.78 -1.34 116.57 117.76 3abq h LYS 139 Ca 0.25 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.98 3abq h LYS 139 Cb 0.21 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 3abq h LYS 139 CO -0.02 0.63 0.00 0.36 -3.45 0.00 0.00 179.45 176.97 3abq n LYS 140 N -4.42 1.71 -3.26 1.90 2.85 -1.04 -4.15 118.16 111.75 3abq n LYS 140 Ca 0.07 -1.05 -0.26 0.00 -1.05 0.00 0.00 58.31 56.02 3abq n LYS 140 Cb 0.05 -1.25 -0.07 0.00 -0.65 0.00 0.00 35.03 33.11 3abq n LYS 140 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 177.40 176.02 3abq n MET 141 N 0.34 2.49 -2.16 -1.58 2.81 -0.51 -4.58 117.12 113.92 3abq n MET 141 Ca 0.10 -4.53 -0.37 0.00 -1.81 0.00 0.00 57.70 51.08 3abq n MET 141 Cb 0.26 -2.13 0.00 0.00 -0.71 0.00 0.00 33.22 30.64 3abq n MET 141 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 3abq s PRO 142 N -2.63 3.65 -0.09 0.03 0.04 -1.26 -4.82 135.00 129.93 3abq s PRO 142 Ca 0.42 1.87 0.00 0.00 0.04 0.00 0.00 61.00 63.34 3abq s PRO 142 Cb 0.20 -2.39 0.02 0.00 0.04 0.00 0.00 34.50 32.36 3abq s PRO 142 CO -0.06 -0.67 -0.08 0.08 0.04 0.00 0.00 177.00 176.31 3abq s VAL 143 N -1.49 0.98 -0.09 -0.36 1.01 -1.26 -5.08 120.40 114.10 3abq s VAL 143 Ca 0.65 -0.31 0.03 0.00 0.00 0.00 0.00 61.98 62.36 3abq s VAL 143 Cb -0.31 -0.97 -0.01 0.00 0.00 0.00 0.00 36.38 35.09 3abq s VAL 143 CO 0.38 0.35 -0.21 -0.63 0.00 0.00 0.00 175.10 174.99 3abq s ILE 144 N 1.36 2.39 0.20 2.22 1.01 -1.26 -4.33 121.20 122.80 3abq s ILE 144 Ca -0.02 -0.92 0.01 0.00 0.00 0.00 0.00 60.65 59.73 3abq s ILE 144 Cb -0.14 -1.93 -0.05 0.00 0.01 0.00 0.00 42.46 40.36 3abq s ILE 144 CO -0.04 0.56 0.05 -0.54 0.00 0.00 0.00 174.94 174.96 3abq s LYS 145 N 0.13 1.20 -0.05 2.79 -0.14 -0.82 -5.00 119.74 117.86 3abq s LYS 145 Ca -0.11 -1.61 -0.02 0.00 -1.36 0.00 0.00 55.97 52.87 3abq s LYS 145 Cb -0.16 -0.18 0.03 0.00 -1.68 0.00 0.00 37.83 35.85 3abq s LYS 145 CO 0.06 -0.22 0.08 0.21 -0.76 0.00 0.00 175.35 174.73 3abq s LYS 146 N -3.99 -0.04 0.00 1.68 2.20 -1.26 -1.32 119.74 117.02 3abq s LYS 146 Ca 0.30 0.39 0.00 0.00 -0.36 0.00 0.00 55.97 56.30 3abq s LYS 146 Cb 0.07 -0.39 0.00 0.00 -1.51 0.00 0.00 37.83 36.00 3abq s LYS 146 CO 0.08 -0.29 0.00 0.00 -0.36 0.00 0.00 175.35 174.78 3abq n ALA 147 N 5.05 0.00 0.73 3.13 0.00 -1.26 -2.09 120.51 126.07 3abq n ALA 147 Ca -0.09 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.46 3abq n ALA 147 Cb 0.50 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.98 3abq n ALA 147 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3abq n ASN 148 N 0.00 0.65 -4.40 0.00 3.02 -1.26 0.84 115.26 114.11 3abq n ASN 148 Ca 0.00 -0.38 -0.27 0.00 -0.03 0.00 0.00 54.58 53.90 3abq n ASN 148 Cb 0.00 0.77 -0.12 0.00 -0.61 0.00 0.00 39.78 39.82 3abq n ASN 148 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3abq s THR 149 N -3.13 2.26 -0.15 3.41 -4.23 -1.26 -4.63 115.64 107.92 3abq s THR 149 Ca 0.06 -1.95 -0.16 0.00 -1.18 0.00 0.00 61.69 58.46 3abq s THR 149 Cb 0.15 -2.05 -0.04 0.00 1.34 0.00 0.00 72.50 71.90 3abq s THR 149 CO 0.80 -0.09 0.40 -0.89 -0.54 0.00 0.00 174.62 174.31 3abq s THR 150 N -1.55 5.23 0.11 3.99 2.01 -1.26 -4.32 115.64 119.84 3abq s THR 150 Ca 0.18 0.77 0.10 0.00 0.31 0.00 0.00 61.69 63.06 3abq s THR 150 Cb -0.08 -3.74 -0.04 0.00 0.01 0.00 0.00 72.50 68.65 3abq s THR 150 CO 0.09 0.33 -0.26 -0.51 -0.69 0.00 0.00 174.62 173.57 3abq s ILE 151 N 0.73 2.28 0.00 1.82 2.07 -0.43 -4.40 121.20 123.26 3abq s ILE 151 Ca 0.21 -1.65 0.00 0.00 -1.41 0.00 0.00 60.65 57.80 3abq s ILE 151 Cb -0.14 -1.99 0.00 0.00 0.13 0.00 0.00 42.46 40.46 3abq s ILE 151 CO 0.08 0.16 0.00 0.61 -1.91 0.00 0.00 174.94 173.87 3abq n GLY 152 N 1.10 0.15 3.70 1.50 0.00 -1.26 -1.94 105.19 108.44 3abq n GLY 152 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 3abq n GLY 152 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3abq s ILE 153 N -2.04 2.48 0.17 -0.61 1.01 -1.26 -4.37 121.20 116.57 3abq s ILE 153 Ca 0.00 0.09 -0.34 0.00 0.00 0.00 0.00 60.65 60.40 3abq s ILE 153 Cb 0.00 -3.06 -0.14 0.00 0.01 0.00 0.00 42.46 39.28 3abq s ILE 153 CO 0.00 0.00 1.56 -2.65 0.00 0.00 0.00 174.94 173.85 3abq n PRO 154 N 5.31 2.12 -0.07 2.79 -0.02 -1.26 -1.06 135.00 142.81 3abq n PRO 154 Ca 0.17 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 3abq n PRO 154 Cb 0.38 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 3abq n PRO 154 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3abq n GLY 155 N 3.26 0.48 3.61 -1.23 0.00 -1.26 -5.08 105.19 104.96 3abq n GLY 155 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 3abq n GLY 155 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3abq s THR 156 N -2.16 2.27 -0.29 2.61 -4.23 -0.22 -1.19 115.64 112.43 3abq s THR 156 Ca 0.00 -2.03 -0.09 0.00 -1.18 0.00 0.00 61.69 58.39 3abq s THR 156 Cb 0.00 -2.83 0.13 0.00 1.34 0.00 0.00 72.50 71.14 3abq s THR 156 CO 0.00 -0.12 0.62 0.12 -0.54 0.00 0.00 174.62 174.70 3abq s PHE 157 N -2.62 -1.30 0.43 3.99 2.19 0.13 -4.77 117.98 116.03 3abq s PHE 157 Ca 0.35 2.20 0.08 0.00 0.33 0.00 0.00 56.93 59.88 3abq s PHE 157 Cb 0.04 0.73 -0.02 0.00 -1.31 0.00 0.00 43.02 42.47 3abq s PHE 157 CO 0.18 -0.66 0.37 -1.12 1.83 0.00 0.00 175.22 175.82 3abq s SER 158 N 2.86 4.96 -0.13 6.13 0.01 -0.63 -4.22 113.70 122.69 3abq s SER 158 Ca -0.04 -0.82 -0.09 0.00 1.31 0.00 0.00 55.95 56.32 3abq s SER 158 Cb -0.12 -0.47 0.04 0.00 0.21 0.00 0.00 66.02 65.68 3abq s SER 158 CO -0.18 -0.69 0.31 0.00 0.41 0.00 0.00 173.24 173.09 3abq s ALA 159 N -2.51 -0.77 -0.06 1.44 0.00 -1.26 -2.67 121.76 115.92 3abq s ALA 159 Ca 0.47 1.08 -0.30 0.00 0.00 0.00 0.00 51.96 53.21 3abq s ALA 159 Cb -0.02 -0.66 -0.02 0.00 0.00 0.00 0.00 23.12 22.41 3abq s ALA 159 CO 0.27 -0.19 1.08 0.50 0.00 0.00 0.00 175.76 177.42 3abq s ARG 160 N 0.84 4.42 -0.27 0.00 3.52 0.15 -1.85 118.95 125.75 3abq s ARG 160 Ca -0.05 1.51 -0.29 0.00 -0.13 0.00 0.00 55.73 56.77 3abq s ARG 160 Cb -0.06 -3.52 0.01 0.00 -1.56 0.00 0.00 34.95 29.81 3abq s ARG 160 CO -0.06 -0.32 1.09 -1.17 -0.81 0.00 0.00 175.30 174.04 3abq s LEU 161 N 1.87 4.02 -0.75 -0.88 0.20 -0.14 0.26 118.68 123.25 3abq s LEU 161 Ca 0.52 1.25 0.02 0.00 0.69 0.00 0.00 54.13 56.60 3abq s LEU 161 Cb -0.21 -3.54 0.18 0.00 -0.43 0.00 0.00 46.19 42.19 3abq s LEU 161 CO 0.21 -0.80 0.58 -1.58 -0.29 0.00 0.00 176.35 174.47 3abq s GLN 162 N 3.50 2.75 -1.22 1.98 0.74 -0.66 -1.10 119.66 125.64 3abq s GLN 162 Ca 0.46 -3.18 -0.08 0.00 0.05 0.00 0.00 55.36 52.62 3abq s GLN 162 Cb -0.14 -3.65 0.21 0.00 1.10 0.00 0.00 33.01 30.52 3abq s GLN 162 CO 0.12 -1.25 1.75 -0.35 -0.55 0.00 0.00 175.29 175.01 3abq n PRO 163 N 2.36 3.85 -3.02 1.67 -0.04 -1.26 -4.70 135.00 133.87 3abq n PRO 163 Ca 0.18 -3.82 -0.36 0.00 -0.04 0.00 0.00 63.50 59.46 3abq n PRO 163 Cb 0.36 -2.81 -0.06 0.00 -0.04 0.00 0.00 33.50 30.94 3abq n PRO 163 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3abq s ASN 164 N 0.21 7.07 0.05 3.54 0.01 -1.26 -4.59 114.94 119.96 3abq s ASN 164 Ca 0.37 1.51 0.03 0.00 -0.71 0.00 0.00 52.86 54.07 3abq s ASN 164 Cb 0.08 -2.46 -0.02 0.00 0.41 0.00 0.00 41.25 39.26 3abq s ASN 164 CO 0.03 -0.05 -0.11 -0.62 -1.51 0.00 0.00 177.10 174.84 3abq s ASP 165 N -1.78 1.22 0.44 -1.22 2.15 -1.26 -4.69 116.67 111.54 3abq s ASP 165 Ca 0.48 -0.52 0.11 0.00 0.43 0.00 0.00 52.55 53.05 3abq s ASP 165 Cb -0.16 -0.02 0.99 0.00 -0.30 0.00 0.00 42.92 43.43 3abq s ASP 165 CO 0.20 -0.10 2.05 0.74 -0.17 0.00 0.00 175.17 177.90 3abq h THR 166 N 4.48 1.09 -0.00 1.71 2.02 -1.96 -2.85 112.91 117.39 3abq h THR 166 Ca -0.37 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 66.53 3abq h THR 166 Cb 1.19 0.87 0.00 0.00 -1.74 0.00 0.00 68.15 68.47 3abq h THR 166 CO 0.42 0.10 0.00 0.54 0.37 0.00 0.00 175.52 176.95 3abq n ARG 167 N -4.45 1.82 -3.32 6.66 1.74 -1.26 -4.88 116.66 112.97 3abq n ARG 167 Ca -0.00 -2.24 -0.24 0.00 -0.77 0.00 0.00 57.85 54.60 3abq n ARG 167 Cb 0.12 -1.34 0.01 0.00 -1.02 0.00 0.00 32.46 30.23 3abq n ARG 167 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3abq n ASP 168 N -1.14 -4.49 -4.66 0.55 8.00 -1.08 -4.88 116.55 108.84 3abq n ASP 168 Ca 0.11 -0.40 -0.43 0.00 0.71 0.00 0.00 54.79 54.79 3abq n ASP 168 Cb 0.52 -3.67 -0.02 0.00 -0.02 0.00 0.00 41.12 37.92 3abq n ASP 168 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3abq s ASP 169 N -2.77 6.83 0.53 -2.24 2.15 -1.26 -4.89 116.67 115.02 3abq s ASP 169 Ca 0.40 1.93 0.29 0.00 0.43 0.00 0.00 52.55 55.60 3abq s ASP 169 Cb -0.20 -2.54 1.47 0.00 -0.30 0.00 0.00 42.92 41.35 3abq s ASP 169 CO 0.49 -0.83 2.06 -0.37 -0.17 0.00 0.00 175.17 176.36 3abq h VAL 170 N 5.50 0.46 0.06 1.11 -1.51 -1.97 -0.72 116.25 119.19 3abq h VAL 170 Ca -0.32 -0.55 -0.25 0.00 -1.23 0.00 0.00 66.70 64.35 3abq h VAL 170 Cb 1.14 1.38 0.01 0.00 -2.13 0.00 0.00 31.29 31.68 3abq h VAL 170 CO 0.96 0.11 -1.09 1.56 -1.23 0.00 0.00 177.57 177.88 3abq h GLN 171 N 0.00 0.41 -0.25 5.19 1.08 -1.99 -1.95 115.11 117.60 3abq h GLN 171 Ca -0.00 -0.52 -0.09 0.00 -1.45 0.00 0.00 58.65 56.59 3abq h GLN 171 Cb 0.37 0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.96 3abq h GLN 171 CO 0.01 1.19 -0.19 1.03 -0.95 0.00 0.00 178.83 179.93 3abq h SER 172 N 0.19 0.60 -0.27 1.46 0.87 -1.71 -1.84 113.55 112.84 3abq h SER 172 Ca -0.12 -0.45 0.01 0.00 -1.23 0.00 0.00 61.79 60.01 3abq h SER 172 Cb 1.76 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 63.53 3abq h SER 172 CO 0.19 0.92 0.15 0.40 -0.53 0.00 0.00 176.83 177.95 3abq h ILE 173 N 0.28 1.01 -0.73 2.23 2.04 -1.22 -2.55 117.51 118.58 3abq h ILE 173 Ca 0.05 -0.11 -0.04 0.00 1.00 0.00 0.00 64.86 65.76 3abq h ILE 173 Cb 0.72 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 3abq h ILE 173 CO 0.05 0.06 0.28 0.00 0.00 0.00 0.00 178.15 178.54 3abq h ALA 174 N 1.13 0.95 -0.46 1.87 0.00 -1.36 -1.89 119.26 119.50 3abq h ALA 174 Ca 0.11 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.90 3abq h ALA 174 Cb 0.01 -0.29 -0.06 0.00 0.00 0.00 0.00 17.79 17.46 3abq h ALA 174 CO -0.06 0.58 0.11 0.00 0.00 0.00 0.00 179.25 179.89 3abq h ALA 175 N 1.14 0.52 0.00 0.00 0.00 -1.10 -1.25 119.26 118.56 3abq h ALA 175 Ca 0.24 0.08 -0.11 0.00 0.00 0.00 0.00 54.91 55.13 3abq h ALA 175 Cb 0.23 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3abq h ALA 175 CO -0.02 -0.29 -0.51 1.96 0.00 0.00 0.00 179.25 180.39 3abq h GLN 176 N 0.26 0.00 0.19 0.00 4.20 -1.18 -1.81 115.11 116.77 3abq h GLN 176 Ca 0.22 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.92 3abq h GLN 176 Cb 0.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.05 3abq h GLN 176 CO -0.27 0.51 -0.09 0.82 -0.67 0.00 0.00 178.83 179.13 3abq h ILE 177 N 0.00 0.90 -0.70 2.54 2.04 -0.80 0.51 117.51 122.00 3abq h ILE 177 Ca -0.01 -0.51 0.04 0.00 1.00 0.00 0.00 64.86 65.39 3abq h ILE 177 Cb 0.95 1.20 -0.04 0.00 -0.74 0.00 0.00 36.82 38.19 3abq h ILE 177 CO 0.07 0.12 0.46 1.88 0.00 0.00 0.00 178.15 180.67 3abq h TYR 178 N -0.51 0.79 -0.20 1.37 0.05 -1.13 0.01 116.97 117.35 3abq h TYR 178 Ca -0.03 0.02 -0.04 0.00 0.05 0.00 0.00 58.73 58.74 3abq h TYR 178 Cb 0.39 -0.26 -0.01 0.00 1.01 0.00 0.00 36.73 37.86 3abq h TYR 178 CO 0.01 0.45 -0.02 1.49 -1.05 0.00 0.00 178.16 179.04 3abq h GLU 179 N 0.81 0.37 -0.23 4.88 4.57 -1.25 -2.62 114.58 121.12 3abq h GLU 179 Ca 0.28 -0.13 -0.00 0.00 -1.18 0.00 0.00 59.36 58.33 3abq h GLU 179 Cb 0.11 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.66 3abq h GLU 179 CO -0.08 0.60 0.14 0.78 -1.18 0.00 0.00 179.01 179.26 3abq h GLY 180 N 0.12 0.33 0.89 1.92 0.00 -0.19 -2.91 103.07 103.22 3abq h GLY 180 Ca 0.06 -0.13 0.03 0.00 0.00 0.00 0.00 47.33 47.29 3abq h GLY 180 CO 0.01 0.13 0.61 1.41 0.00 0.00 0.00 176.54 178.71 3abq h LEU 181 N 0.28 1.02 -1.90 3.11 3.38 -1.05 -0.12 115.31 120.03 3abq h LEU 181 Ca 0.08 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3abq h LEU 181 Cb 0.01 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.52 3abq h LEU 181 CO -0.02 0.70 0.00 0.77 0.09 0.00 0.00 178.44 179.99 3abq h SER 182 N 1.19 0.00 -0.03 -0.43 4.64 -1.26 0.20 113.55 117.86 3abq h SER 182 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 3abq h SER 182 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 3abq h SER 182 CO -0.12 0.00 -0.02 0.49 -0.87 0.00 0.00 176.83 176.32 3abq n PHE 183 N -2.68 0.00 -1.44 4.77 3.72 -0.69 -0.65 117.46 120.49 3abq n PHE 183 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 3abq n PHE 183 Cb 0.12 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 3abq n PHE 183 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3abq n GLY 184 N 1.29 0.52 3.83 1.37 0.00 0.69 -4.51 105.19 108.38 3abq n GLY 184 Ca 0.13 -0.86 -0.37 0.00 0.00 0.00 0.00 46.02 44.92 3abq n GLY 184 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3abq s VAL 185 N -2.00 5.35 0.00 1.61 1.01 -0.14 -4.65 120.40 121.57 3abq s VAL 185 Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.40 3abq s VAL 185 Cb 0.00 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.86 3abq s VAL 185 CO 0.00 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.27 3abq n GLY 186 N 2.27 0.03 0.14 4.51 0.00 -0.77 -3.50 105.19 107.87 3abq n GLY 186 Ca -0.17 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.87 3abq n GLY 186 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3abq h ASP 187 N 0.00 0.00 0.17 1.61 2.03 -1.77 -3.27 116.42 115.20 3abq h ASP 187 Ca 0.00 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.29 3abq h ASP 187 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 3abq h ASP 187 CO 0.00 0.52 -0.08 0.00 -1.03 0.00 0.00 179.24 178.65 3abq h ALA 188 N 1.48 -0.23 -1.14 4.15 0.00 -1.83 -3.44 119.26 118.25 3abq h ALA 188 Ca -0.01 -0.22 0.24 0.00 0.00 0.00 0.00 54.91 54.92 3abq h ALA 188 Cb 1.29 0.09 -0.26 0.00 0.00 0.00 0.00 17.79 18.91 3abq h ALA 188 CO 0.07 -0.34 0.91 0.54 0.00 0.00 0.00 179.25 180.43 3abq s VAL 189 N -3.64 0.00 -0.53 0.00 0.11 -1.23 -4.73 120.40 110.37 3abq s VAL 189 Ca -0.13 0.00 -0.16 0.00 -2.93 0.00 0.00 61.98 58.76 3abq s VAL 189 Cb 0.01 -1.00 0.12 0.00 -1.53 0.00 0.00 36.38 33.98 3abq s VAL 189 CO 0.50 0.00 0.49 -0.63 -3.33 0.00 0.00 175.10 172.13 3abq s ILE 190 N -1.25 5.21 -0.14 7.04 1.01 0.44 -0.96 121.20 132.54 3abq s ILE 190 Ca 0.08 -1.44 0.00 0.00 0.00 0.00 0.00 60.65 59.29 3abq s ILE 190 Cb -0.01 -4.32 0.02 0.00 0.01 0.00 0.00 42.46 38.17 3abq s ILE 190 CO -0.06 -0.84 -0.13 -0.83 0.00 0.00 0.00 174.94 173.08 3abq s GLY 191 N 3.49 1.06 -0.19 6.18 0.00 -0.26 -1.17 107.32 116.43 3abq s GLY 191 Ca 0.03 -0.83 -0.06 0.00 0.00 0.00 0.00 44.72 43.86 3abq s GLY 191 CO 0.03 0.59 0.04 0.14 0.00 0.00 0.00 173.10 173.90 3abq s VAL 192 N 1.53 4.44 -0.48 1.40 1.01 0.11 -4.02 120.40 124.38 3abq s VAL 192 Ca 0.05 -0.15 -0.27 0.00 0.00 0.00 0.00 61.98 61.61 3abq s VAL 192 Cb -0.13 -3.00 0.03 0.00 0.00 0.00 0.00 36.38 33.28 3abq s VAL 192 CO -0.10 0.44 1.03 0.20 0.00 0.00 0.00 175.10 176.67 3abq s ASN 193 N 0.63 6.53 0.43 3.32 -0.87 -1.26 -0.52 114.94 123.21 3abq s ASN 193 Ca 0.02 0.21 -0.21 0.00 -1.57 0.00 0.00 52.86 51.30 3abq s ASN 193 Cb -0.13 -2.49 -0.11 0.00 -0.02 0.00 0.00 41.25 38.49 3abq s ASN 193 CO 0.02 -1.18 0.96 -2.16 -2.57 0.00 0.00 177.10 172.17 3abq s PRO 194 N 4.13 4.19 0.16 -0.60 0.04 -1.26 -4.64 135.00 137.01 3abq s PRO 194 Ca 0.41 1.15 0.14 0.00 0.04 0.00 0.00 61.00 62.74 3abq s PRO 194 Cb -0.09 -2.18 -0.07 0.00 0.04 0.00 0.00 34.50 32.20 3abq s PRO 194 CO 0.28 -0.07 1.16 -0.39 0.04 0.00 0.00 177.00 178.02 3abq h VAL 195 N 1.88 0.88 -3.30 -0.36 -1.51 -1.90 -3.45 116.25 108.49 3abq h VAL 195 Ca -0.49 -2.38 -0.67 0.00 -1.23 0.00 0.00 66.70 61.93 3abq h VAL 195 Cb 1.18 2.37 -0.31 0.00 -2.13 0.00 0.00 31.29 32.40 3abq h VAL 195 CO 0.61 0.50 -0.83 0.42 -1.23 0.00 0.00 177.57 177.04 3abq s THR 196 N -2.88 2.46 -1.13 7.19 -4.23 -1.26 -5.06 115.64 110.74 3abq s THR 196 Ca 0.01 -0.86 -0.06 0.00 -1.18 0.00 0.00 61.69 59.59 3abq s THR 196 Cb 0.08 -2.00 0.27 0.00 1.34 0.00 0.00 72.50 72.20 3abq s THR 196 CO 0.79 0.54 1.50 -0.67 -0.54 0.00 0.00 174.62 176.23 3abq n ASP 197 N 3.71 5.99 -4.10 3.99 -0.08 -1.26 -4.72 116.55 120.07 3abq n ASP 197 Ca -0.19 -3.28 -0.08 0.00 -1.51 0.00 0.00 54.79 49.73 3abq n ASP 197 Cb 0.52 -1.34 -0.10 0.00 2.34 0.00 0.00 41.12 42.54 3abq n ASP 197 CO 0.00 0.00 0.00 1.51 0.12 0.00 0.00 177.20 178.83 3abq s ASP 198 N -0.58 0.61 0.09 1.67 1.47 -1.26 -5.04 116.67 113.63 3abq s ASP 198 Ca 0.33 -0.97 -0.19 0.00 1.18 0.00 0.00 52.55 52.89 3abq s ASP 198 Cb 0.03 0.17 -0.09 0.00 -0.34 0.00 0.00 42.92 42.70 3abq s ASP 198 CO 0.05 -0.56 1.57 0.58 0.68 0.00 0.00 175.17 177.50 3abq h VAL 199 N 3.19 1.21 -0.47 2.11 2.07 -1.93 -0.90 116.25 121.55 3abq h VAL 199 Ca -0.34 -0.69 0.05 0.00 0.82 0.00 0.00 66.70 66.54 3abq h VAL 199 Cb 1.15 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 32.12 3abq h VAL 199 CO 0.64 0.22 0.19 -0.08 0.02 0.00 0.00 177.57 178.56 3abq h GLU 200 N 0.17 0.37 -0.42 1.57 4.81 -1.98 0.42 114.58 119.53 3abq h GLU 200 Ca 0.07 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.14 3abq h GLU 200 Cb 0.28 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 3abq h GLU 200 CO 0.00 0.25 -0.27 -0.97 -0.73 0.00 0.00 179.01 177.29 3abq h ASN 201 N 0.38 0.93 -0.58 1.04 -1.24 -1.87 -1.89 115.58 112.35 3abq h ASN 201 Ca 0.21 -0.37 0.01 0.00 0.71 0.00 0.00 56.30 56.86 3abq h ASN 201 Cb 0.18 -0.26 -0.03 0.00 0.73 0.00 0.00 38.32 38.95 3abq h ASN 201 CO -0.19 1.14 0.38 -0.07 -1.29 0.00 0.00 177.43 177.40 3abq h LEU 202 N 0.77 0.66 -0.81 0.34 3.38 -0.75 -1.66 115.31 117.23 3abq h LEU 202 Ca 0.09 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.95 3abq h LEU 202 Cb 0.83 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 3abq h LEU 202 CO 0.07 0.47 -0.10 -1.28 0.09 0.00 0.00 178.44 177.70 3abq h SER 203 N 0.78 0.78 -0.31 -0.43 0.87 -0.78 -0.78 113.55 113.68 3abq h SER 203 Ca 0.22 -0.23 -0.14 0.00 -1.23 0.00 0.00 61.79 60.41 3abq h SER 203 Cb -0.08 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.66 3abq h SER 203 CO -0.05 0.90 -0.32 -0.09 -0.53 0.00 0.00 176.83 176.75 3abq h ARG 204 N 0.72 0.83 -0.29 2.24 2.43 -1.11 0.10 114.38 119.30 3abq h ARG 204 Ca 0.12 -0.39 -0.10 0.00 -0.81 0.00 0.00 59.98 58.80 3abq h ARG 204 Cb 0.58 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 3abq h ARG 204 CO 0.04 1.03 -0.20 0.28 -1.51 0.00 0.00 179.97 179.60 3abq h VAL 205 N 0.70 1.30 -0.68 0.20 2.07 -1.11 -2.30 116.25 116.43 3abq h VAL 205 Ca 0.08 -1.34 0.00 0.00 0.82 0.00 0.00 66.70 66.26 3abq h VAL 205 Cb 0.87 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 32.14 3abq h VAL 205 CO 0.08 0.43 0.43 -0.07 0.02 0.00 0.00 177.57 178.45 3abq h LEU 206 N 0.39 0.80 -0.94 2.57 3.38 -1.07 -1.60 115.31 118.84 3abq h LEU 206 Ca 0.06 -0.04 0.11 0.00 0.09 0.00 0.00 57.88 58.10 3abq h LEU 206 Cb 0.75 -0.20 -0.08 0.00 0.09 0.00 0.00 40.66 41.22 3abq h LEU 206 CO 0.05 0.60 0.57 0.44 0.09 0.00 0.00 178.44 180.20 3abq h ASP 207 N 0.92 0.83 -0.08 -0.43 3.32 -0.86 0.13 116.42 120.25 3abq h ASP 207 Ca 0.25 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.32 3abq h ASP 207 Cb -0.07 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.36 3abq h ASP 207 CO -0.05 0.45 -0.04 0.74 -1.72 0.00 0.00 179.24 178.62 3abq h THR 208 N 0.92 1.32 -0.16 0.35 2.02 -0.85 0.29 112.91 116.79 3abq h THR 208 Ca 0.46 -1.04 0.02 0.00 0.77 0.00 0.00 66.41 66.62 3abq h THR 208 Cb 0.45 1.85 -0.02 0.00 -1.74 0.00 0.00 68.15 68.69 3abq h THR 208 CO -0.26 0.29 0.05 0.40 0.37 0.00 0.00 175.52 176.36 3abq h ILE 209 N -0.20 0.95 0.00 3.11 2.04 -1.02 -2.87 117.51 119.51 3abq h ILE 209 Ca 0.02 -0.04 -0.03 0.00 1.00 0.00 0.00 64.86 65.80 3abq h ILE 209 Cb 0.48 0.82 -0.00 0.00 -0.74 0.00 0.00 36.82 37.37 3abq h ILE 209 CO 0.01 0.02 -0.16 1.88 0.00 0.00 0.00 178.15 179.90 3abq h TYR 210 N 0.12 0.00 -0.46 1.37 -1.99 -0.71 -1.98 116.97 113.32 3abq h TYR 210 Ca 0.07 0.00 0.07 0.00 2.00 0.00 0.00 58.73 60.87 3abq h TYR 210 Cb 0.05 0.00 -0.06 0.00 2.00 0.00 0.00 36.73 38.72 3abq h TYR 210 CO -0.12 0.16 0.12 0.78 -0.00 0.00 0.00 178.16 179.10 3abq h GLY 211 N 2.88 0.57 0.54 3.88 0.00 -0.22 -0.25 103.07 110.47 3abq h GLY 211 Ca -0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 3abq h GLY 211 CO 0.02 -0.03 -0.00 -2.08 0.00 0.00 0.00 176.54 174.45 3abq h VAL 212 N 0.27 1.34 -0.69 4.60 2.07 -1.25 -2.39 116.25 120.19 3abq h VAL 212 Ca 0.22 -1.06 0.14 0.00 0.82 0.00 0.00 66.70 66.83 3abq h VAL 212 Cb 0.26 2.06 -0.10 0.00 -1.52 0.00 0.00 31.29 31.99 3abq h VAL 212 CO -0.27 0.27 0.16 0.40 0.02 0.00 0.00 177.57 178.16 3abq h ILE 213 N -0.47 0.56 -0.00 4.57 2.04 -1.32 -2.70 117.51 120.18 3abq h ILE 213 Ca -0.00 -0.09 -0.24 0.00 1.00 0.00 0.00 64.86 65.53 3abq h ILE 213 Cb 0.46 0.26 0.01 0.00 -0.74 0.00 0.00 36.82 36.81 3abq h ILE 213 CO 0.00 0.05 -0.97 0.44 0.00 0.00 0.00 178.15 177.67 3abq h ASP 214 N 0.27 0.67 -0.31 1.72 3.32 -1.06 -0.05 116.42 120.98 3abq h ASP 214 Ca 0.38 -0.53 -0.06 0.00 0.02 0.00 0.00 57.03 56.83 3abq h ASP 214 Cb 0.62 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 3abq h ASP 214 CO -0.48 1.33 -0.01 0.50 -1.72 0.00 0.00 179.24 178.87 3abq h LYS 215 N 0.29 0.66 -0.35 3.56 3.64 -1.19 -3.10 116.57 120.09 3abq h LYS 215 Ca -0.10 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 3abq h LYS 215 Cb 1.62 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.35 3abq h LYS 215 CO 0.18 0.69 0.00 1.19 -2.27 0.00 0.00 179.45 179.23 3abq n PHE 216 N -4.24 0.46 -3.83 1.91 3.72 -1.04 -4.99 117.46 109.45 3abq n PHE 216 Ca 0.02 -0.39 -0.25 0.00 -0.05 0.00 0.00 57.45 56.78 3abq n PHE 216 Cb 0.28 -0.02 0.01 0.00 -0.94 0.00 0.00 39.48 38.82 3abq n PHE 216 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3abq n ASN 217 N 0.77 -1.64 -4.68 4.37 3.02 -0.49 -4.90 115.26 111.70 3abq n ASN 217 Ca 0.13 -0.87 -0.43 0.00 -0.03 0.00 0.00 54.58 53.38 3abq n ASN 217 Cb 0.44 -3.69 -0.02 0.00 -0.61 0.00 0.00 39.78 35.90 3abq n ASN 217 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3abq s ILE 218 N -3.67 4.44 -0.78 2.41 1.01 -0.15 -4.97 121.20 119.49 3abq s ILE 218 Ca 0.15 1.75 -0.25 0.00 0.00 0.00 0.00 60.65 62.29 3abq s ILE 218 Cb -0.08 -4.12 -0.01 0.00 0.01 0.00 0.00 42.46 38.26 3abq s ILE 218 CO 0.84 -0.04 1.70 -2.16 0.00 0.00 0.00 174.94 175.28 3abq s PRO 219 N 2.46 2.88 0.00 2.79 0.04 -1.26 -4.85 135.00 137.06 3abq s PRO 219 Ca 0.52 -0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.47 3abq s PRO 219 Cb -0.21 -4.69 0.00 0.00 0.04 0.00 0.00 34.50 29.64 3abq s PRO 219 CO 0.18 -2.71 0.00 -2.37 0.04 0.00 0.00 177.00 172.14 3abq n THR 220 N 7.17 0.00 -3.79 1.26 5.66 -1.26 -4.46 114.28 118.86 3abq n THR 220 Ca 0.24 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 61.12 3abq n THR 220 Cb 0.50 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.19 3abq n THR 220 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3abq s GLN 221 N -0.01 0.62 0.32 1.09 0.00 -1.26 -4.67 119.66 115.75 3abq s GLN 221 Ca 0.00 -0.22 0.07 0.00 -0.00 0.00 0.00 55.36 55.20 3abq s GLN 221 Cb 0.00 0.27 -0.02 0.00 0.00 0.00 0.00 33.01 33.26 3abq s GLN 221 CO 0.00 -0.16 0.37 0.20 0.00 0.00 0.00 175.29 175.70 3abq s GLY 222 N -1.30 1.61 -0.28 2.60 0.00 -1.26 -0.42 107.32 108.28 3abq s GLY 222 Ca -0.13 -1.51 -0.23 0.00 0.00 0.00 0.00 44.72 42.85 3abq s GLY 222 CO 0.04 -1.45 0.82 0.00 0.00 0.00 0.00 173.10 172.51 3abq s VAL 224 N 0.64 2.36 -0.60 0.00 1.01 -1.26 -0.71 120.40 121.84 3abq s VAL 224 Ca -0.02 -0.88 -0.04 0.00 0.00 0.00 0.00 61.98 61.04 3abq s VAL 224 Cb -0.05 -2.04 0.06 0.00 0.00 0.00 0.00 36.38 34.35 3abq s VAL 224 CO -0.06 0.48 2.74 0.18 0.00 0.00 0.00 175.10 178.44 3abq n LEU 225 N 4.65 6.73 0.00 3.92 4.32 0.32 -4.77 117.00 132.17 3abq n LEU 225 Ca -0.20 -4.19 -0.17 0.00 -0.02 0.00 0.00 56.01 51.43 3abq n LEU 225 Cb 0.50 -1.27 0.12 0.00 -1.62 0.00 0.00 43.42 41.15 3abq n LEU 225 CO 0.26 1.79 0.51 0.00 -1.22 0.00 0.00 177.39 178.74 3abq n ALA 226 N 1.11 -0.82 -1.73 -1.18 0.00 -1.26 -4.65 120.51 111.97 3abq n ALA 226 Ca 0.51 -1.04 -0.37 0.00 0.00 0.00 0.00 53.44 52.54 3abq n ALA 226 Cb 0.51 -0.03 0.07 0.00 0.00 0.00 0.00 19.45 19.99 3abq n ALA 226 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 3abq n HIS 227 N -3.02 1.94 -0.33 0.00 -0.00 -1.26 -4.81 115.22 107.74 3abq n HIS 227 Ca 0.10 0.42 0.13 0.00 0.46 0.00 0.00 57.72 58.83 3abq n HIS 227 Cb 0.34 -2.28 0.31 0.00 -0.12 0.00 0.00 29.99 28.25 3abq n HIS 227 CO 0.00 0.00 0.00 -0.39 0.46 0.00 0.00 176.34 176.41 3abq h VAL 228 N 0.66 0.63 -0.31 3.57 -1.51 -1.97 -2.30 116.25 115.03 3abq h VAL 228 Ca -0.51 -0.21 -0.09 0.00 -1.23 0.00 0.00 66.70 64.66 3abq h VAL 228 Cb 1.34 -0.05 -0.02 0.00 -2.13 0.00 0.00 31.29 30.43 3abq h VAL 228 CO 0.53 0.11 -0.18 0.71 -1.23 0.00 0.00 177.57 177.52 3abq h THR 229 N 0.62 1.25 -0.01 7.19 1.35 -1.93 -1.40 112.91 119.98 3abq h THR 229 Ca 0.56 -1.17 -0.23 0.00 -0.55 0.00 0.00 66.41 65.03 3abq h THR 229 Cb 0.95 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 68.59 3abq h THR 229 CO -0.43 0.38 -0.93 0.74 -0.25 0.00 0.00 175.52 175.03 3abq h THR 230 N 0.50 1.38 -0.01 6.82 2.02 -1.78 -1.82 112.91 120.02 3abq h THR 230 Ca 0.08 -2.38 0.00 0.00 0.77 0.00 0.00 66.41 64.88 3abq h THR 230 Cb 0.60 2.37 -0.00 0.00 -1.74 0.00 0.00 68.15 69.37 3abq h THR 230 CO 0.04 0.72 -0.02 1.56 0.37 0.00 0.00 175.52 178.19 3abq h GLN 231 N 0.26 -0.03 -0.08 6.66 4.20 -1.23 -0.55 115.11 124.34 3abq h GLN 231 Ca -0.08 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.65 3abq h GLN 231 Cb 1.56 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 29.33 3abq h GLN 231 CO 0.16 -0.02 -0.02 0.82 -0.67 0.00 0.00 178.83 179.11 3abq h ILE 232 N -0.03 0.92 -0.36 2.54 2.04 -1.26 -1.07 117.51 120.28 3abq h ILE 232 Ca 0.01 -0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.89 3abq h ILE 232 Cb 0.04 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 3abq h ILE 232 CO -0.02 0.00 0.19 -0.08 0.00 0.00 0.00 178.15 178.24 3abq h GLU 233 N 0.01 0.38 -0.52 2.37 4.81 -1.21 0.66 114.58 121.07 3abq h GLU 233 Ca 0.04 -0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.29 3abq h GLU 233 Cb 0.06 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.31 3abq h GLU 233 CO -0.08 0.25 0.27 0.00 -0.73 0.00 0.00 179.01 178.72 3abq h ALA 234 N 1.18 0.67 -0.32 2.92 0.00 -0.90 -2.11 119.26 120.71 3abq h ALA 234 Ca 0.15 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 3abq h ALA 234 Cb 0.05 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3abq h ALA 234 CO -0.10 -0.07 -0.34 0.82 0.00 0.00 0.00 179.25 179.57 3abq h ILE 235 N 0.53 1.28 -0.10 0.00 2.04 -0.55 -1.75 117.51 118.96 3abq h ILE 235 Ca 0.23 -1.48 -0.05 0.00 1.00 0.00 0.00 64.86 64.55 3abq h ILE 235 Cb 0.13 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 3abq h ILE 235 CO -0.16 0.48 -0.18 0.03 0.00 0.00 0.00 178.15 178.33 3abq h ARG 236 N 0.59 0.17 -0.19 2.37 3.08 -0.72 -2.48 114.38 117.21 3abq h ARG 236 Ca 0.06 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.07 3abq h ARG 236 Cb 0.86 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.89 3abq h ARG 236 CO 0.07 0.35 0.00 0.54 -1.07 0.00 0.00 179.97 179.87 3abq n ARG 237 N -4.25 1.70 0.00 0.04 1.74 -0.81 -4.91 116.66 110.17 3abq n ARG 237 Ca -0.01 -1.06 0.00 0.00 -0.77 0.00 0.00 57.85 56.01 3abq n ARG 237 Cb 0.29 -1.37 0.00 0.00 -1.02 0.00 0.00 32.46 30.36 3abq n ARG 237 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3abq n GLY 238 N 1.10 0.91 3.77 -0.13 0.00 -0.93 -5.06 105.19 104.84 3abq n GLY 238 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 3abq n GLY 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3abq s ALA 239 N -2.00 3.15 0.06 4.61 0.00 -0.69 -4.93 121.76 121.96 3abq s ALA 239 Ca 0.00 1.15 -0.30 0.00 0.00 0.00 0.00 51.96 52.81 3abq s ALA 239 Cb 0.00 -3.46 -0.09 0.00 0.00 0.00 0.00 23.12 19.57 3abq s ALA 239 CO 0.00 -0.81 1.89 -1.25 0.00 0.00 0.00 175.76 175.59 3abq s PRO 240 N -2.39 4.14 -0.25 0.00 0.04 -1.26 -4.39 135.00 130.89 3abq s PRO 240 Ca 0.59 2.57 -0.15 0.00 0.04 0.00 0.00 61.00 64.05 3abq s PRO 240 Cb -0.36 -3.93 -0.04 0.00 0.04 0.00 0.00 34.50 30.22 3abq s PRO 240 CO 0.45 -0.90 0.39 0.20 0.04 0.00 0.00 177.00 177.18 3abq s GLY 241 N 3.68 1.92 0.00 0.56 0.00 -1.26 -4.98 107.32 107.24 3abq s GLY 241 Ca 0.84 -0.73 0.00 0.00 0.00 0.00 0.00 44.72 44.84 3abq s GLY 241 CO 0.39 0.97 0.00 0.61 0.00 0.00 0.00 173.10 175.07 3abq n GLY 242 N 4.47 0.49 3.85 0.20 0.00 -1.24 0.08 105.19 113.04 3abq n GLY 242 Ca -0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 3abq n GLY 242 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3abq s LEU 243 N 0.00 4.26 -0.19 0.99 1.43 -0.31 -4.71 118.68 120.15 3abq s LEU 243 Ca 0.00 1.08 -0.05 0.00 -1.03 0.00 0.00 54.13 54.13 3abq s LEU 243 Cb 0.00 -3.50 -0.03 0.00 0.03 0.00 0.00 46.19 42.70 3abq s LEU 243 CO 0.00 0.01 -0.00 -0.63 0.23 0.00 0.00 176.35 175.96 3abq s ILE 244 N -1.62 4.01 0.07 -0.59 1.01 -0.41 -4.60 121.20 119.07 3abq s ILE 244 Ca 0.43 -0.30 0.03 0.00 0.00 0.00 0.00 60.65 60.81 3abq s ILE 244 Cb -0.14 -2.80 -0.04 0.00 0.01 0.00 0.00 42.46 39.50 3abq s ILE 244 CO 0.20 0.45 0.03 0.12 0.00 0.00 0.00 174.94 175.73 3abq s PHE 245 N 0.80 3.09 -0.23 3.97 2.19 -1.26 -1.08 117.98 125.46 3abq s PHE 245 Ca 0.00 0.04 -0.17 0.00 0.33 0.00 0.00 56.93 57.14 3abq s PHE 245 Cb -0.14 -1.60 0.07 0.00 -1.31 0.00 0.00 43.02 40.03 3abq s PHE 245 CO 0.02 0.50 0.59 -1.14 1.83 0.00 0.00 175.22 177.01 3abq s GLN 246 N -2.18 0.63 0.30 10.12 2.00 -0.62 -4.15 119.66 125.77 3abq s GLN 246 Ca 0.26 0.96 -0.28 0.00 -2.00 0.00 0.00 55.36 54.30 3abq s GLN 246 Cb -0.12 0.19 -0.09 0.00 0.80 0.00 0.00 33.01 33.79 3abq s GLN 246 CO 0.18 -0.12 1.09 -1.12 -0.50 0.00 0.00 175.29 174.82 3abq s SER 247 N 1.02 7.17 0.20 6.67 0.01 -1.26 -3.24 113.70 124.26 3abq s SER 247 Ca -0.06 2.23 0.07 0.00 1.31 0.00 0.00 55.95 59.51 3abq s SER 247 Cb -0.05 -2.62 -0.05 0.00 0.21 0.00 0.00 66.02 63.51 3abq s SER 247 CO -0.09 -0.21 -0.14 0.27 0.41 0.00 0.00 173.24 173.47 3abq s ILE 248 N -1.25 1.69 0.14 1.44 -4.36 -1.02 -4.94 121.20 112.90 3abq s ILE 248 Ca 0.47 -2.18 0.05 0.00 -0.26 0.00 0.00 60.65 58.73 3abq s ILE 248 Cb -0.30 -2.01 -0.04 0.00 1.25 0.00 0.00 42.46 41.35 3abq s ILE 248 CO 0.39 -0.60 -0.12 0.00 0.24 0.00 0.00 174.94 174.85 3abq n GLY 250 N 0.00 1.63 3.12 0.00 0.00 -1.26 -4.62 105.19 104.06 3abq n GLY 250 Ca -0.12 -0.43 -0.08 0.00 0.00 0.00 0.00 46.02 45.39 3abq n GLY 250 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3abq s SER 251 N -0.63 0.29 0.17 1.61 1.04 -1.26 -4.78 113.70 110.13 3abq s SER 251 Ca 0.26 -0.73 -0.15 0.00 0.48 0.00 0.00 55.95 55.81 3abq s SER 251 Cb 0.17 0.23 0.05 0.00 0.10 0.00 0.00 66.02 66.57 3abq s SER 251 CO 0.11 -0.57 1.83 -0.08 0.98 0.00 0.00 173.24 175.51 3abq h GLU 252 N 3.35 0.64 -0.73 4.02 4.81 -1.91 -0.97 114.58 123.78 3abq h GLU 252 Ca -0.33 -0.04 0.10 0.00 -0.13 0.00 0.00 59.36 58.95 3abq h GLU 252 Cb 1.17 -0.14 -0.07 0.00 0.63 0.00 0.00 28.75 30.34 3abq h GLU 252 CO 0.57 0.43 0.37 -0.22 -0.73 0.00 0.00 179.01 179.43 3abq h LYS 253 N 0.66 0.61 -0.42 1.92 3.11 -1.93 -1.19 116.57 119.32 3abq h LYS 253 Ca 0.18 -0.04 -0.13 0.00 -2.81 0.00 0.00 60.65 57.85 3abq h LYS 253 Cb -0.07 -0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 31.01 3abq h LYS 253 CO -0.04 0.40 -0.26 0.78 -2.81 0.00 0.00 179.45 177.52 3abq h GLY 254 N 0.63 0.97 1.01 5.01 0.00 -1.72 -1.59 103.07 107.38 3abq h GLY 254 Ca 0.36 -0.88 -0.01 0.00 0.00 0.00 0.00 47.33 46.80 3abq h GLY 254 CO -0.27 0.80 0.46 1.41 0.00 0.00 0.00 176.54 178.94 3abq h LEU 255 N 0.76 0.97 -0.21 3.11 3.38 -0.81 -1.82 115.31 120.69 3abq h LEU 255 Ca 0.09 -0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.01 3abq h LEU 255 Cb 0.82 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 3abq h LEU 255 CO 0.07 0.76 0.07 0.11 0.09 0.00 0.00 178.44 179.54 3abq h LYS 256 N 1.09 0.16 -0.77 1.13 6.56 -0.96 0.12 116.57 123.91 3abq h LYS 256 Ca 0.28 -0.01 0.17 0.00 -1.06 0.00 0.00 60.65 60.03 3abq h LYS 256 Cb -0.01 -0.04 -0.11 0.00 -0.57 0.00 0.00 32.23 31.50 3abq h LYS 256 CO -0.05 0.11 0.25 1.49 -2.06 0.00 0.00 179.45 179.19 3abq h GLU 257 N 0.17 0.33 0.00 3.15 4.57 -0.99 0.20 114.58 122.00 3abq h GLU 257 Ca 0.09 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.25 3abq h GLU 257 Cb 0.06 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.57 3abq h GLU 257 CO -0.09 0.22 0.00 0.74 -1.18 0.00 0.00 179.01 178.70 3abq h PHE 258 N 0.34 0.00 0.00 0.92 -1.00 -0.64 -3.47 116.94 113.09 3abq h PHE 258 Ca 0.44 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.22 3abq h PHE 258 Cb 0.75 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.31 3abq h PHE 258 CO -0.21 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 176.90 3abq n GLY 259 N 0.69 0.55 3.54 -1.45 0.00 0.28 -5.06 105.19 103.74 3abq n GLY 259 Ca 0.03 -0.82 -0.33 0.00 0.00 0.00 0.00 46.02 44.89 3abq n GLY 259 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3abq s VAL 260 N -2.00 3.46 0.06 1.61 -7.23 -0.34 -5.01 120.40 110.95 3abq s VAL 260 Ca 0.00 -0.59 0.05 0.00 -1.81 0.00 0.00 61.98 59.63 3abq s VAL 260 Cb 0.00 -2.40 -0.04 0.00 0.56 0.00 0.00 36.38 34.50 3abq s VAL 260 CO 0.00 0.58 -0.07 -1.61 -0.31 0.00 0.00 175.10 173.69 3abq s GLU 261 N -0.83 2.39 0.45 4.82 2.02 -1.26 -4.28 118.70 122.01 3abq s GLU 261 Ca 0.12 -0.86 0.17 0.00 0.02 0.00 0.00 54.97 54.43 3abq s GLU 261 Cb -0.11 -2.43 1.11 0.00 0.10 0.00 0.00 34.13 32.80 3abq s GLU 261 CO 0.02 0.56 1.95 -0.07 0.02 0.00 0.00 175.26 177.73 3abq h LEU 262 N 4.00 0.31 -1.99 1.80 3.38 -2.00 -0.59 115.31 120.22 3abq h LEU 262 Ca -0.48 0.01 0.03 0.00 0.09 0.00 0.00 57.88 57.53 3abq h LEU 262 Cb 1.17 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 3abq h LEU 262 CO 0.54 0.17 0.07 0.00 0.09 0.00 0.00 178.44 179.32 3abq h ALA 263 N 1.67 2.08 -0.29 1.53 0.00 -1.99 -1.68 119.26 120.58 3abq h ALA 263 Ca 0.33 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 55.11 3abq h ALA 263 Cb 0.80 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 3abq h ALA 263 CO -0.09 -0.11 -0.31 0.52 0.00 0.00 0.00 179.25 179.27 3abq h MET 264 N 0.01 0.60 -0.00 0.00 2.86 -1.51 -1.09 114.93 115.79 3abq h MET 264 Ca 0.05 -0.26 -0.14 0.00 -2.06 0.00 0.00 59.70 57.28 3abq h MET 264 Cb 0.18 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.80 3abq h MET 264 CO -0.00 0.84 -0.68 -0.07 1.06 0.00 0.00 176.91 178.05 3abq h LEU 265 N 0.52 0.03 -0.27 1.22 3.38 -1.39 -0.11 115.31 118.69 3abq h LEU 265 Ca 0.06 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 3abq h LEU 265 Cb 0.78 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 3abq h LEU 265 CO 0.06 0.70 0.13 0.44 0.09 0.00 0.00 178.44 179.86 3abq h ASP 266 N 0.01 0.35 -0.41 -0.43 3.45 -1.17 -2.46 116.42 115.77 3abq h ASP 266 Ca -0.01 -0.13 -0.10 0.00 0.43 0.00 0.00 57.03 57.23 3abq h ASP 266 Cb 1.21 -0.09 -0.02 0.00 -0.56 0.00 0.00 39.33 39.87 3abq h ASP 266 CO 0.09 0.38 -0.09 -0.08 -1.57 0.00 0.00 179.24 177.97 3abq h GLU 267 N 0.29 0.86 -0.95 3.56 4.81 -0.95 -2.52 114.58 119.68 3abq h GLU 267 Ca 0.09 -0.28 0.01 0.00 -0.13 0.00 0.00 59.36 59.04 3abq h GLU 267 Cb 0.12 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.38 3abq h GLU 267 CO -0.01 0.91 0.61 0.00 -0.73 0.00 0.00 179.01 179.79 3abq h ALA 268 N 1.12 1.21 -0.27 2.92 0.00 -0.97 0.24 119.26 123.50 3abq h ALA 268 Ca 0.13 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3abq h ALA 268 Cb 0.59 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3abq h ALA 268 CO 0.04 0.62 0.16 -0.09 0.00 0.00 0.00 179.25 179.98 3abq h ARG 269 N 1.29 0.36 -0.12 0.00 2.43 -1.13 -0.31 114.38 116.91 3abq h ARG 269 Ca 0.35 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.34 3abq h ARG 269 Cb -0.12 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.34 3abq h ARG 269 CO -0.07 0.28 -0.57 0.00 -1.51 0.00 0.00 179.97 178.10 3abq h ALA 270 N 1.06 0.81 -0.42 2.80 0.00 -1.00 -2.02 119.26 120.48 3abq h ALA 270 Ca 0.10 -0.52 -0.13 0.00 0.00 0.00 0.00 54.91 54.36 3abq h ALA 270 Cb 0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3abq h ALA 270 CO -0.02 0.70 -0.23 0.28 0.00 0.00 0.00 179.25 179.98 3abq h VAL 271 N 0.28 1.28 -0.59 0.00 2.07 -0.44 -2.24 116.25 116.61 3abq h VAL 271 Ca 0.00 -1.39 0.10 0.00 0.82 0.00 0.00 66.70 66.23 3abq h VAL 271 Cb 1.08 1.26 -0.07 0.00 -1.52 0.00 0.00 31.29 32.03 3abq h VAL 271 CO 0.10 0.47 0.18 1.23 0.02 0.00 0.00 177.57 179.57 3abq h GLY 272 N 0.73 0.79 2.00 2.17 0.00 -0.88 -0.20 103.07 107.68 3abq h GLY 272 Ca 0.09 -0.08 -0.07 0.00 0.00 0.00 0.00 47.33 47.27 3abq h GLY 272 CO 0.07 -0.05 -0.31 0.00 0.00 0.00 0.00 176.54 176.25 3abq h ALA 273 N 1.43 1.40 0.04 3.60 0.00 -1.11 -1.14 119.26 123.48 3abq h ALA 273 Ca 0.30 -0.28 -0.31 0.00 0.00 0.00 0.00 54.91 54.62 3abq h ALA 273 Cb 0.39 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 3abq h ALA 273 CO -0.33 0.39 -1.72 1.49 0.00 0.00 0.00 179.25 179.08 3abq h GLU 274 N 0.00 0.08 0.00 0.00 4.81 -1.06 -3.44 114.58 114.98 3abq h GLU 274 Ca -0.00 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.06 3abq h GLU 274 Cb 0.58 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.01 3abq h GLU 274 CO 0.04 0.74 -1.10 1.19 -0.73 0.00 0.00 179.01 179.16 3abq n PHE 275 N -3.20 0.00 -2.95 0.92 3.72 -0.12 -5.08 117.46 110.75 3abq n PHE 275 Ca -0.19 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 56.84 3abq n PHE 275 Cb 1.04 -0.07 -0.06 0.00 -0.94 0.00 0.00 39.48 39.45 3abq n PHE 275 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 3abq s ASN 276 N -3.05 7.25 -1.45 4.37 -0.87 -0.44 -4.57 114.94 116.19 3abq s ASN 276 Ca -0.01 1.63 -0.10 0.00 -1.57 0.00 0.00 52.86 52.82 3abq s ASN 276 Cb 0.01 -2.50 0.04 0.00 -0.02 0.00 0.00 41.25 38.78 3abq s ASN 276 CO 0.06 0.04 2.44 0.54 -2.57 0.00 0.00 177.10 177.61 3abq n ARG 277 N 0.87 3.70 -4.15 -0.60 1.74 0.11 -4.89 116.66 113.44 3abq n ARG 277 Ca -0.01 -2.85 -0.28 0.00 -0.77 0.00 0.00 57.85 53.93 3abq n ARG 277 Cb 0.50 -2.90 -0.17 0.00 -1.02 0.00 0.00 32.46 28.87 3abq n ARG 277 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3abq s ILE 278 N 1.28 1.32 0.04 0.55 -1.09 -1.26 -4.87 121.20 117.16 3abq s ILE 278 Ca 0.55 -0.50 -0.19 0.00 -2.23 0.00 0.00 60.65 58.28 3abq s ILE 278 Cb 0.16 -1.25 -0.16 0.00 -1.58 0.00 0.00 42.46 39.63 3abq s ILE 278 CO -0.06 0.41 1.28 0.00 -1.23 0.00 0.00 174.94 175.34 3abq h ALA 279 N 7.81 0.22 -3.15 9.38 0.00 -1.90 -3.46 119.26 128.16 3abq h ALA 279 Ca -0.33 -0.41 -0.08 0.00 0.00 0.00 0.00 54.91 54.09 3abq h ALA 279 Cb 1.15 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 18.94 3abq h ALA 279 CO 0.47 0.24 0.07 0.41 0.00 0.00 0.00 179.25 180.44 3abq n GLY 280 N 0.45 -1.29 0.56 0.00 0.00 0.25 -5.01 105.19 100.16 3abq n GLY 280 Ca -0.07 -1.66 0.11 0.00 0.00 0.00 0.00 46.02 44.40 3abq n GLY 280 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3abq n GLU 281 N -1.55 1.38 -4.53 1.61 -0.58 -1.06 -4.85 120.64 111.05 3abq n GLU 281 Ca 0.03 -1.14 -0.34 0.00 -0.42 0.00 0.00 57.16 55.30 3abq n GLU 281 Cb 0.11 -1.48 -0.12 0.00 -0.57 0.00 0.00 31.44 29.38 3abq n GLU 281 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 3abq s ASN 282 N -2.40 4.60 0.00 1.62 -0.87 -0.89 -4.98 114.94 112.02 3abq s ASN 282 Ca 0.20 -0.15 0.00 0.00 -1.57 0.00 0.00 52.86 51.35 3abq s ASN 282 Cb 0.18 -1.62 0.00 0.00 -0.02 0.00 0.00 41.25 39.80 3abq s ASN 282 CO 0.53 0.21 0.06 0.00 -2.57 0.00 0.00 177.10 175.32 3abq s LEU 284 N 0.00 4.23 -0.10 0.00 1.43 -1.26 -1.28 118.68 121.69 3abq s LEU 284 Ca 0.00 0.57 -0.03 0.00 -1.03 0.00 0.00 54.13 53.64 3abq s LEU 284 Cb 0.00 -3.32 0.04 0.00 0.03 0.00 0.00 46.19 42.94 3abq s LEU 284 CO 0.00 -0.01 0.06 -0.47 0.23 0.00 0.00 176.35 176.16 3abq s TYR 285 N -1.77 0.32 0.06 0.29 5.04 -0.24 -0.49 117.35 120.56 3abq s TYR 285 Ca 0.41 -0.13 0.05 0.00 -2.44 0.00 0.00 57.07 54.97 3abq s TYR 285 Cb -0.12 -0.67 -0.04 0.00 0.35 0.00 0.00 41.96 41.49 3abq s TYR 285 CO 0.26 -0.36 -0.07 -0.06 -1.34 0.00 0.00 175.55 173.98 3abq s PHE 286 N 2.09 2.85 0.11 4.97 0.08 -1.02 -1.59 117.98 125.47 3abq s PHE 286 Ca 0.03 -0.08 0.10 0.00 0.12 0.00 0.00 56.93 57.10 3abq s PHE 286 Cb -0.14 -1.52 -0.04 0.00 -0.57 0.00 0.00 43.02 40.75 3abq s PHE 286 CO -0.06 0.42 -0.23 -1.21 -0.10 0.00 0.00 175.22 174.04 3abq s GLU 287 N -1.92 1.61 0.16 0.44 2.02 -1.20 -2.47 118.70 117.34 3abq s GLU 287 Ca 0.21 -1.25 0.03 0.00 0.02 0.00 0.00 54.97 53.98 3abq s GLU 287 Cb -0.11 -2.00 -0.01 0.00 0.10 0.00 0.00 34.13 32.10 3abq s GLU 287 CO 0.12 0.47 0.16 0.25 0.02 0.00 0.00 175.26 176.28 3abq n THR 288 N 0.96 0.00 0.00 3.63 -2.24 -0.67 -2.44 114.28 113.52 3abq n THR 288 Ca -0.17 -1.11 0.00 0.00 -2.27 0.00 0.00 64.05 60.50 3abq n THR 288 Cb 0.53 0.58 0.00 0.00 -2.10 0.00 0.00 70.33 69.33 3abq n THR 288 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3abq n GLY 289 N -0.30 3.35 3.73 3.38 0.00 -1.26 0.67 105.19 114.76 3abq n GLY 289 Ca 0.03 -0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 3abq n GLY 289 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3abq s GLN 290 N -1.25 4.13 0.00 1.61 -0.21 -1.26 -3.28 119.66 119.40 3abq s GLN 290 Ca 0.00 2.59 0.00 0.00 0.02 0.00 0.00 55.36 57.97 3abq s GLN 290 Cb 0.00 -3.06 0.00 0.00 1.00 0.00 0.00 33.01 30.95 3abq s GLN 290 CO 0.00 -0.71 0.00 0.41 -2.12 0.00 0.00 175.29 172.87 3abq n GLY 291 N 3.47 1.54 0.19 3.09 0.00 -1.26 -4.91 105.19 107.31 3abq n GLY 291 Ca 0.14 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.08 3abq n GLY 291 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3abq h SER 292 N 0.94 0.49 -0.28 1.61 4.64 -1.94 0.76 113.55 119.77 3abq h SER 292 Ca 0.00 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3abq h SER 292 Cb 0.00 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 61.96 3abq h SER 292 CO 0.00 0.35 0.16 0.00 -0.87 0.00 0.00 176.83 176.47 3abq h ALA 293 N 1.16 0.35 -0.97 5.18 0.00 -1.90 -1.43 119.26 121.65 3abq h ALA 293 Ca 0.16 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.02 3abq h ALA 293 Cb -0.06 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.57 3abq h ALA 293 CO -0.04 -0.12 0.64 1.25 0.00 0.00 0.00 179.25 180.97 3abq h LEU 294 N 0.34 1.12 -0.91 0.00 5.85 -1.76 0.17 115.31 120.11 3abq h LEU 294 Ca 0.10 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 3abq h LEU 294 Cb 0.05 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.76 3abq h LEU 294 CO -0.02 0.82 0.35 -1.28 -0.34 0.00 0.00 178.44 177.97 3abq h SER 295 N 1.32 1.04 0.38 1.25 0.87 -0.62 -2.78 113.55 115.00 3abq h SER 295 Ca 0.35 -0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.78 3abq h SER 295 Cb -0.14 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 61.55 3abq h SER 295 CO -0.08 0.89 0.00 0.00 -0.53 0.00 0.00 176.83 177.12 3abq n ALA 296 N -2.43 2.45 -2.08 6.23 0.00 -0.56 -4.86 120.51 119.26 3abq n ALA 296 Ca 0.07 -0.15 -0.11 0.00 0.00 0.00 0.00 53.44 53.26 3abq n ALA 296 Cb 0.15 -1.46 -0.01 0.00 0.00 0.00 0.00 19.45 18.13 3abq n ALA 296 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3abq n GLY 297 N 1.03 0.10 0.48 0.00 0.00 -0.90 -4.90 105.19 101.00 3abq n GLY 297 Ca 0.16 -0.43 0.07 0.00 0.00 0.00 0.00 46.02 45.81 3abq n GLY 297 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3abq n ALA 298 N -1.14 2.72 0.67 4.61 0.00 0.49 -4.59 120.51 123.27 3abq n ALA 298 Ca -0.13 -2.61 0.11 0.00 0.00 0.00 0.00 53.44 50.81 3abq n ALA 298 Cb 0.57 -0.43 -0.09 0.00 0.00 0.00 0.00 19.45 19.50 3abq n ALA 298 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3abq n ASN 299 N -0.91 0.66 -3.97 0.00 6.94 -1.20 -4.67 115.26 112.11 3abq n ASN 299 Ca 0.14 -0.57 -0.31 0.00 -0.02 0.00 0.00 54.58 53.82 3abq n ASN 299 Cb 0.73 1.16 0.02 0.00 -2.36 0.00 0.00 39.78 39.32 3abq n ASN 299 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 3abq n PHE 300 N -1.77 -2.22 -0.85 -2.53 3.01 -1.26 -0.16 117.46 111.67 3abq n PHE 300 Ca 0.02 0.89 0.00 0.00 1.01 0.00 0.00 57.45 59.37 3abq n PHE 300 Cb 0.41 -3.80 0.00 0.00 -0.01 0.00 0.00 39.48 36.08 3abq n PHE 300 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3abq n GLY 301 N -1.64 0.77 3.89 1.37 0.00 -1.26 -4.97 105.19 103.34 3abq n GLY 301 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 3abq n GLY 301 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3abq s ALA 302 N -2.95 3.79 0.77 4.61 0.00 0.77 -4.90 121.76 123.84 3abq s ALA 302 Ca 0.00 -0.54 -0.11 0.00 0.00 0.00 0.00 51.96 51.31 3abq s ALA 302 Cb 0.00 -2.14 0.05 0.00 0.00 0.00 0.00 23.12 21.03 3abq s ALA 302 CO 0.00 0.66 1.08 0.16 0.00 0.00 0.00 175.76 177.66 3abq s ASP 303 N -2.32 4.65 0.28 0.00 -4.77 -1.26 -4.85 116.67 108.40 3abq s ASP 303 Ca 0.40 1.60 0.26 0.00 -3.30 0.00 0.00 52.55 51.50 3abq s ASP 303 Cb -0.12 -2.36 0.86 0.00 -1.09 0.00 0.00 42.92 40.20 3abq s ASP 303 CO 0.23 -1.91 1.76 0.06 0.70 0.00 0.00 175.17 176.01 3abq h GLN 304 N -1.04 0.00 0.05 2.11 3.07 -1.97 -2.59 115.11 114.73 3abq h GLN 304 Ca -0.45 0.00 -0.14 0.00 0.09 0.00 0.00 58.65 58.15 3abq h GLN 304 Cb 1.24 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.81 3abq h GLN 304 CO 0.55 0.00 -0.57 0.28 0.09 0.00 0.00 178.83 179.19 3abq h VAL 305 N 0.00 1.50 -0.71 1.86 2.07 -1.97 -2.05 116.25 116.95 3abq h VAL 305 Ca 0.00 -2.22 -0.03 0.00 0.82 0.00 0.00 66.70 65.27 3abq h VAL 305 Cb 0.63 2.88 -0.03 0.00 -1.52 0.00 0.00 31.29 33.25 3abq h VAL 305 CO 0.00 0.63 0.33 0.74 0.02 0.00 0.00 177.57 179.28 3abq h THR 306 N -0.32 1.24 -0.55 2.57 2.02 -1.91 -1.68 112.91 114.28 3abq h THR 306 Ca -0.08 -0.69 -0.10 0.00 0.77 0.00 0.00 66.41 66.31 3abq h THR 306 Cb 1.34 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 68.11 3abq h THR 306 CO 0.11 0.28 -0.03 0.24 0.37 0.00 0.00 175.52 176.49 3abq h MET 307 N 1.00 0.98 -0.56 6.66 2.07 -1.54 -2.55 114.93 120.98 3abq h MET 307 Ca 0.24 -0.31 -0.01 0.00 -2.07 0.00 0.00 59.70 57.55 3abq h MET 307 Cb 0.14 -0.09 -0.03 0.00 -1.87 0.00 0.00 31.60 29.76 3abq h MET 307 CO -0.03 0.98 0.30 1.49 1.07 0.00 0.00 176.91 180.73 3abq h GLU 308 N 0.89 0.79 -0.83 1.72 4.57 -1.15 -2.26 114.58 118.31 3abq h GLU 308 Ca 0.16 -0.10 0.09 0.00 -1.18 0.00 0.00 59.36 58.33 3abq h GLU 308 Cb 0.57 -0.15 -0.06 0.00 -0.16 0.00 0.00 28.75 28.95 3abq h GLU 308 CO 0.03 0.61 0.54 0.00 -1.18 0.00 0.00 179.01 179.02 3abq h ALA 309 N 1.13 1.68 0.00 2.92 0.00 -1.11 -1.66 119.26 122.22 3abq h ALA 309 Ca 0.20 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 3abq h ALA 309 Cb 0.06 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3abq h ALA 309 CO -0.03 0.16 -0.24 0.00 0.00 0.00 0.00 179.25 179.14 3abq h ARG 310 N 0.83 0.00 -0.95 0.00 3.08 -1.00 -0.84 114.38 115.50 3abq h ARG 310 Ca 0.38 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.52 3abq h ARG 310 Cb 0.38 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.35 3abq h ARG 310 CO -0.15 0.24 0.59 -0.91 -1.07 0.00 0.00 179.97 178.68 3abq h ASN 311 N 0.00 0.90 0.47 7.04 2.35 -1.03 -1.39 115.58 123.92 3abq h ASN 311 Ca -0.00 0.03 -0.19 0.00 -0.55 0.00 0.00 56.30 55.59 3abq h ASN 311 Cb 0.44 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 3abq h ASN 311 CO 0.03 0.52 -0.82 1.88 -1.65 0.00 0.00 177.43 177.40 3abq h TYR 312 N 1.00 0.36 -0.73 1.19 0.05 -1.14 0.18 116.97 117.88 3abq h TYR 312 Ca 0.45 -0.18 -0.05 0.00 0.05 0.00 0.00 58.73 59.00 3abq h TYR 312 Cb 0.34 -0.05 -0.03 0.00 1.01 0.00 0.00 36.73 38.00 3abq h TYR 312 CO -0.02 0.96 0.28 0.78 -1.05 0.00 0.00 178.16 179.11 3abq h GLY 313 N 1.64 1.19 0.88 3.88 0.00 -1.29 0.34 103.07 109.71 3abq h GLY 313 Ca -0.04 -0.66 -0.02 0.00 0.00 0.00 0.00 47.33 46.61 3abq h GLY 313 CO 0.13 0.62 -0.22 -2.00 0.00 0.00 0.00 176.54 175.07 3abq h LEU 314 N 1.06 -0.52 -0.92 3.11 5.85 -1.00 -3.22 115.31 119.66 3abq h LEU 314 Ca 0.24 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.97 3abq h LEU 314 Cb 0.23 0.13 -0.06 0.00 0.37 0.00 0.00 40.66 41.34 3abq h LEU 314 CO -0.02 -0.27 0.59 0.00 -0.34 0.00 0.00 178.44 178.40 3abq h ALA 315 N -0.25 1.25 -0.38 1.25 0.00 -0.56 -2.46 119.26 118.11 3abq h ALA 315 Ca -0.06 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.85 3abq h ALA 315 Cb 0.53 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3abq h ALA 315 CO 0.10 0.40 0.26 -0.09 0.00 0.00 0.00 179.25 179.92 3abq h ARG 316 N 1.11 0.39 -0.37 0.00 9.65 -0.96 -0.76 114.38 123.43 3abq h ARG 316 Ca 0.39 -0.02 0.11 0.00 -1.10 0.00 0.00 59.98 59.35 3abq h ARG 316 Cb 0.10 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 28.58 3abq h ARG 316 CO -0.15 0.26 0.27 1.25 2.80 0.00 0.00 179.97 184.39 3abq h HIS 317 N 0.40 0.02 -0.37 2.20 2.76 -1.45 -2.34 115.15 116.36 3abq h HIS 317 Ca 0.16 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.33 3abq h HIS 317 Cb 0.13 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.08 3abq h HIS 317 CO -0.00 0.01 0.00 0.66 -1.30 0.00 0.00 177.93 177.30 3abq n TYR 318 N -4.43 0.48 -3.97 5.26 4.02 -0.30 -5.01 117.16 113.21 3abq n TYR 318 Ca 0.06 -0.32 -0.38 0.00 -0.01 0.00 0.00 57.90 57.25 3abq n TYR 318 Cb 0.44 -0.01 0.01 0.00 -0.02 0.00 0.00 39.34 39.77 3abq n TYR 318 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 3abq n ASP 319 N 1.10 -4.42 -4.79 7.72 2.03 -0.88 -4.87 116.55 112.44 3abq n ASP 319 Ca 0.16 -1.17 -0.31 0.00 0.52 0.00 0.00 54.79 53.99 3abq n ASP 319 Cb 0.51 -1.61 0.07 0.00 -0.72 0.00 0.00 41.12 39.37 3abq n ASP 319 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3abq s PRO 320 N -6.39 2.55 0.10 -0.67 0.04 -1.26 -4.65 135.00 124.72 3abq s PRO 320 Ca 0.28 1.08 -0.16 0.00 0.04 0.00 0.00 61.00 62.24 3abq s PRO 320 Cb -0.16 -1.94 -0.08 0.00 0.04 0.00 0.00 34.50 32.37 3abq s PRO 320 CO 0.94 -1.41 1.45 0.35 0.04 0.00 0.00 177.00 178.37 3abq h PHE 321 N -0.95 0.75 -3.65 0.56 3.57 -1.05 -3.43 116.94 112.75 3abq h PHE 321 Ca -0.44 -0.20 -0.17 0.00 3.53 0.00 0.00 57.97 60.69 3abq h PHE 321 Cb 1.22 -0.17 -0.22 0.00 2.79 0.00 0.00 35.95 39.57 3abq h PHE 321 CO 0.60 0.90 -0.58 0.96 -2.23 0.00 0.00 178.31 177.95 3abq s ILE 322 N -4.51 0.07 -0.01 1.41 -4.36 -1.16 -4.69 121.20 107.95 3abq s ILE 322 Ca -0.13 -0.58 0.02 0.00 -0.26 0.00 0.00 60.65 59.70 3abq s ILE 322 Cb 0.08 -0.30 0.00 0.00 1.25 0.00 0.00 42.46 43.49 3abq s ILE 322 CO 0.81 -0.32 -0.05 -0.69 0.24 0.00 0.00 174.94 174.93 3abq s VAL 323 N -1.03 0.44 -0.02 8.37 1.01 -0.71 -2.45 120.40 126.01 3abq s VAL 323 Ca -0.11 -0.20 0.02 0.00 0.00 0.00 0.00 61.98 61.69 3abq s VAL 323 Cb -0.07 -0.40 0.00 0.00 0.00 0.00 0.00 36.38 35.92 3abq s VAL 323 CO 0.00 0.14 -0.05 0.54 0.00 0.00 0.00 175.10 175.74 3abq s ASN 324 N 0.13 0.75 0.50 3.32 4.22 -1.03 0.95 114.94 123.77 3abq s ASN 324 Ca -0.01 -0.11 -0.23 0.00 -2.14 0.00 0.00 52.86 50.37 3abq s ASN 324 Cb -0.05 -0.19 -0.06 0.00 1.28 0.00 0.00 41.25 42.23 3abq s ASN 324 CO -0.00 0.03 1.31 0.28 -2.04 0.00 0.00 177.10 176.68 3abq s THR 325 N 0.22 2.39 -0.86 0.54 -1.32 -1.17 -1.67 115.64 113.76 3abq s THR 325 Ca -0.02 0.30 -0.08 0.00 -1.21 0.00 0.00 61.69 60.68 3abq s THR 325 Cb -0.06 -3.16 0.22 0.00 -1.51 0.00 0.00 72.50 67.98 3abq s THR 325 CO -0.00 0.01 0.77 -0.69 -2.21 0.00 0.00 174.62 172.50 3abq s VAL 326 N -1.34 5.01 0.10 5.08 1.01 0.21 -0.77 120.40 129.70 3abq s VAL 326 Ca 0.66 -3.09 -0.22 0.00 0.00 0.00 0.00 61.98 59.34 3abq s VAL 326 Cb -0.38 -4.10 -0.12 0.00 0.00 0.00 0.00 36.38 31.79 3abq s VAL 326 CO 0.46 -1.04 1.74 1.62 0.00 0.00 0.00 175.10 177.88 3abq h VAL 327 N 4.50 0.99 -1.18 2.92 3.04 -1.76 -2.79 116.25 121.96 3abq h VAL 327 Ca 0.11 -0.02 -0.58 0.00 -1.01 0.00 0.00 66.70 65.20 3abq h VAL 327 Cb 0.94 0.92 -0.42 0.00 -2.01 0.00 0.00 31.29 30.72 3abq h VAL 327 CO 0.82 0.01 -0.71 0.61 -1.01 0.00 0.00 177.57 177.30 3abq n GLY 328 N -1.12 6.17 0.14 3.17 0.00 -1.22 -4.65 105.19 107.68 3abq n GLY 328 Ca -0.05 -2.71 0.01 0.00 0.00 0.00 0.00 46.02 43.26 3abq n GLY 328 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3abq h PHE 329 N 2.40 0.00 0.00 1.61 3.04 -1.76 -3.23 116.94 119.01 3abq h PHE 329 Ca 0.34 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.29 3abq h PHE 329 Cb 1.17 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.68 3abq h PHE 329 CO 0.85 0.58 -0.27 -0.89 -2.02 0.00 0.00 178.31 176.57 3abq n ILE 330 N -3.39 0.57 0.00 1.41 5.41 -1.26 -4.84 119.36 117.25 3abq n ILE 330 Ca 0.01 0.38 0.00 0.00 1.00 0.00 0.00 62.75 64.14 3abq n ILE 330 Cb 0.71 -1.84 0.00 0.00 -0.71 0.00 0.00 39.64 37.79 3abq n ILE 330 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3abq n GLY 331 N 1.62 0.05 0.20 7.39 0.00 -1.26 -4.95 105.19 108.24 3abq n GLY 331 Ca -0.04 -1.08 0.14 0.00 0.00 0.00 0.00 46.02 45.05 3abq n GLY 331 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3abq h PRO 332 N 0.00 0.00 0.00 1.61 0.13 -1.79 -2.62 132.00 129.34 3abq h PRO 332 Ca 0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 3abq h PRO 332 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 3abq h PRO 332 CO 0.00 0.00 -0.08 1.05 -0.23 0.00 0.00 178.00 178.74 3abq h GLU 333 N 0.00 0.00 0.00 0.86 9.09 -1.94 -3.21 114.58 119.39 3abq h GLU 333 Ca 0.00 0.00 -0.22 0.00 0.05 0.00 0.00 59.36 59.19 3abq h GLU 333 Cb 0.22 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.28 3abq h GLU 333 CO 0.00 0.08 -1.83 0.66 0.05 0.00 0.00 179.01 177.97 3abq n TYR 334 N -3.32 0.00 -3.77 2.06 4.02 -1.00 -2.43 117.16 112.72 3abq n TYR 334 Ca -0.01 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.62 3abq n TYR 334 Cb 0.26 -0.56 -0.17 0.00 -0.02 0.00 0.00 39.34 38.86 3abq n TYR 334 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 3abq s LEU 335 N -5.86 0.97 -0.09 7.72 1.43 -1.15 -1.54 118.68 120.16 3abq s LEU 335 Ca -0.20 -0.47 -0.21 0.00 -1.03 0.00 0.00 54.13 52.22 3abq s LEU 335 Cb 0.05 -0.58 -0.28 0.00 0.03 0.00 0.00 46.19 45.41 3abq s LEU 335 CO 0.33 -0.24 0.72 0.22 0.23 0.00 0.00 176.35 177.62 3abq h TYR 336 N 8.26 0.39 -3.70 0.29 5.03 -1.83 -3.31 116.97 122.09 3abq h TYR 336 Ca -0.19 -0.28 -0.28 0.00 2.58 0.00 0.00 58.73 60.55 3abq h TYR 336 Cb 1.12 -0.02 -0.07 0.00 1.55 0.00 0.00 36.73 39.31 3abq h TYR 336 CO 0.39 1.35 -0.27 0.27 -1.32 0.00 0.00 178.16 178.58 3abq n ASN 337 N -4.16 -0.24 -0.08 -2.11 0.23 -1.26 -1.68 115.26 105.96 3abq n ASN 337 Ca -0.18 -2.27 -0.10 0.00 -0.53 0.00 0.00 54.58 51.50 3abq n ASN 337 Cb 0.78 0.93 -0.04 0.00 -2.08 0.00 0.00 39.78 39.37 3abq n ASN 337 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 3abq h ASP 338 N 1.16 -1.26 -0.38 0.53 3.45 -1.94 -1.49 116.42 116.50 3abq h ASP 338 Ca -0.14 0.19 0.05 0.00 0.43 0.00 0.00 57.03 57.56 3abq h ASP 338 Cb 0.70 0.55 -0.05 0.00 -0.56 0.00 0.00 39.33 39.97 3abq h ASP 338 CO 0.21 -0.37 0.11 -0.09 -1.57 0.00 0.00 179.24 177.52 3abq h ARG 339 N -0.36 0.24 -0.23 3.56 2.43 -1.97 -0.28 114.38 117.77 3abq h ARG 339 Ca 0.13 -0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 59.15 3abq h ARG 339 Cb 0.58 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.06 3abq h ARG 339 CO -0.49 0.16 -0.39 1.96 -1.51 0.00 0.00 179.97 179.69 3abq h GLN 340 N 0.25 0.52 -0.27 0.20 4.20 -1.85 -1.71 115.11 116.45 3abq h GLN 340 Ca 0.18 -0.26 -0.19 0.00 0.06 0.00 0.00 58.65 58.44 3abq h GLN 340 Cb 0.18 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.97 3abq h GLN 340 CO -0.21 0.83 -0.58 0.82 -0.67 0.00 0.00 178.83 179.03 3abq h ILE 341 N 0.44 1.28 -0.03 2.54 2.04 -0.65 -0.85 117.51 122.27 3abq h ILE 341 Ca 0.04 -1.76 -0.00 0.00 1.00 0.00 0.00 64.86 64.14 3abq h ILE 341 Cb 0.88 1.68 -0.00 0.00 -0.74 0.00 0.00 36.82 38.63 3abq h ILE 341 CO 0.07 0.57 0.01 0.40 0.00 0.00 0.00 178.15 179.21 3abq h ILE 342 N 0.65 1.09 -0.47 -0.67 2.04 -1.03 -1.04 117.51 118.08 3abq h ILE 342 Ca 0.01 -0.28 0.04 0.00 1.00 0.00 0.00 64.86 65.63 3abq h ILE 342 Cb 1.19 1.23 -0.04 0.00 -0.74 0.00 0.00 36.82 38.45 3abq h ILE 342 CO 0.13 0.08 0.22 -0.09 0.00 0.00 0.00 178.15 178.49 3abq h ARG 343 N -0.06 0.43 -0.37 2.37 9.65 -1.27 -0.72 114.38 124.41 3abq h ARG 343 Ca 0.01 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 3abq h ARG 343 Cb 0.11 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.58 3abq h ARG 343 CO -0.00 0.28 0.24 0.00 2.80 0.00 0.00 179.97 183.29 3abq h ALA 344 N 1.27 0.47 -0.65 2.80 0.00 -1.09 -0.21 119.26 121.84 3abq h ALA 344 Ca 0.21 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.14 3abq h ALA 344 Cb 0.14 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 3abq h ALA 344 CO -0.16 -0.06 0.36 0.78 0.00 0.00 0.00 179.25 180.17 3abq h GLY 345 N 0.50 0.96 0.99 0.00 0.00 -0.61 0.29 103.07 105.19 3abq h GLY 345 Ca 0.14 -0.25 -0.09 0.00 0.00 0.00 0.00 47.33 47.13 3abq h GLY 345 CO -0.03 0.16 -0.06 1.41 0.00 0.00 0.00 176.54 178.02 3abq h LEU 346 N 0.67 0.80 0.52 3.11 3.38 -0.84 -2.02 115.31 120.93 3abq h LEU 346 Ca 0.29 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 3abq h LEU 346 Cb 0.17 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 40.71 3abq h LEU 346 CO -0.18 0.96 -0.25 -0.33 0.09 0.00 0.00 178.44 178.73 3abq h GLU 347 N 0.63 -0.67 -0.54 1.13 5.08 -0.60 -1.51 114.58 118.10 3abq h GLU 347 Ca 0.11 0.05 0.08 0.00 -1.00 0.00 0.00 59.36 58.60 3abq h GLU 347 Cb 0.58 0.15 -0.07 0.00 0.50 0.00 0.00 28.75 29.92 3abq h GLU 347 CO 0.03 -0.44 0.17 -0.44 -1.00 0.00 0.00 179.01 177.33 3abq h ASP 348 N -0.71 0.13 -0.25 1.42 3.32 -0.43 0.56 116.42 120.45 3abq h ASP 348 Ca -0.07 0.08 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 3abq h ASP 348 Cb 0.54 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 3abq h ASP 348 CO 0.12 0.09 -0.03 -0.74 -1.72 0.00 0.00 179.24 176.96 3abq h HIS 349 N 0.33 0.52 -0.12 4.55 -0.00 -1.33 -0.44 115.15 118.66 3abq h HIS 349 Ca 0.27 -0.10 0.02 0.00 -0.00 0.00 0.00 60.37 60.55 3abq h HIS 349 Cb 0.33 -0.13 -0.02 0.00 -0.00 0.00 0.00 27.41 27.59 3abq h HIS 349 CO -0.19 0.66 0.02 0.35 -0.00 0.00 0.00 177.93 178.77 3abq h PHE 350 N 0.23 0.03 -0.87 5.26 3.57 -0.87 -0.99 116.94 123.30 3abq h PHE 350 Ca 0.07 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.55 3abq h PHE 350 Cb 0.48 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.18 3abq h PHE 350 CO 0.04 0.01 0.45 0.52 -2.23 0.00 0.00 178.31 177.10 3abq h MET 351 N 0.07 1.22 -0.38 1.11 2.86 -0.82 0.62 114.93 119.61 3abq h MET 351 Ca 0.05 -0.16 0.01 0.00 -2.06 0.00 0.00 59.70 57.54 3abq h MET 351 Cb 0.05 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.46 3abq h MET 351 CO -0.08 0.92 0.23 0.78 1.06 0.00 0.00 176.91 179.83 3abq h GLY 352 N 1.22 0.53 1.19 8.32 0.00 -0.83 -0.68 103.07 112.82 3abq h GLY 352 Ca 0.30 -0.18 -0.16 0.00 0.00 0.00 0.00 47.33 47.29 3abq h GLY 352 CO -0.04 0.17 -0.43 0.50 0.00 0.00 0.00 176.54 176.74 3abq h LYS 353 N 0.48 0.88 -0.44 4.80 1.79 -0.73 -2.19 116.57 121.15 3abq h LYS 353 Ca 0.15 -0.48 -0.02 0.00 -2.18 0.00 0.00 60.65 58.11 3abq h LYS 353 Cb -0.02 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.63 3abq h LYS 353 CO -0.05 1.13 0.20 1.25 -1.08 0.00 0.00 179.45 180.90 3abq h LEU 354 N 0.71 0.55 0.00 2.94 5.85 -0.79 -1.74 115.31 122.83 3abq h LEU 354 Ca 0.05 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3abq h LEU 354 Cb 1.02 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.91 3abq h LEU 354 CO 0.10 0.48 0.00 -1.20 -0.34 0.00 0.00 178.44 177.48 3abq n SER 355 N -4.39 0.00 0.00 1.25 7.64 -0.27 -4.84 113.62 113.01 3abq n SER 355 Ca 0.03 0.35 0.00 0.00 1.01 0.00 0.00 58.87 60.27 3abq n SER 355 Cb 0.13 -0.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.89 3abq n SER 355 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3abq n GLY 356 N 0.69 0.44 3.72 0.23 0.00 -0.66 -4.90 105.19 104.72 3abq n GLY 356 Ca 0.07 -0.85 -0.23 0.00 0.00 0.00 0.00 46.02 45.01 3abq n GLY 356 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3abq s ILE 357 N -2.00 3.86 -1.34 -0.61 -4.36 -0.86 -4.99 121.20 110.90 3abq s ILE 357 Ca 0.00 -1.70 -0.17 0.00 -0.26 0.00 0.00 60.65 58.52 3abq s ILE 357 Cb 0.00 -3.08 0.05 0.00 1.25 0.00 0.00 42.46 40.68 3abq s ILE 357 CO 0.00 -0.36 1.93 -0.24 0.24 0.00 0.00 174.94 176.51 3abq n SER 358 N -1.01 4.41 -4.65 4.36 2.88 -1.26 -4.33 113.62 114.01 3abq n SER 358 Ca -0.07 -2.88 -0.40 0.00 -1.33 0.00 0.00 58.87 54.19 3abq n SER 358 Cb 0.59 -1.70 -0.06 0.00 -0.75 0.00 0.00 64.21 62.29 3abq n SER 358 CO 0.00 0.00 0.00 -0.32 -1.23 0.00 0.00 175.04 173.49 3abq s MET 359 N 3.96 4.19 0.04 -1.46 1.75 -1.26 -1.74 119.30 124.79 3abq s MET 359 Ca 0.52 0.64 0.00 0.00 -1.25 0.00 0.00 55.69 55.61 3abq s MET 359 Cb 0.08 -3.60 0.00 0.00 2.84 0.00 0.00 34.83 34.15 3abq s MET 359 CO 0.02 -0.30 0.01 0.41 -0.65 0.00 0.00 175.02 174.51 3abq n GLY 360 N 3.85 3.92 3.13 2.11 0.00 0.27 -2.03 105.19 116.44 3abq n GLY 360 Ca -0.00 -2.21 -0.12 0.00 0.00 0.00 0.00 46.02 43.68 3abq n GLY 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3abq s ASP 362 N 1.46 6.32 -0.39 0.00 -1.08 0.05 -4.15 116.67 118.88 3abq s ASP 362 Ca -0.08 -0.92 -0.28 0.00 -0.52 0.00 0.00 52.55 50.74 3abq s ASP 362 Cb -0.10 -2.56 -0.00 0.00 -1.46 0.00 0.00 42.92 38.79 3abq s ASP 362 CO -0.10 -1.68 1.59 0.00 0.52 0.00 0.00 175.17 175.49 3abq s TYR 365 N -3.94 -0.09 0.37 0.00 -0.85 -0.96 -3.41 117.35 108.47 3abq s TYR 365 Ca 0.14 -0.26 0.08 0.00 -0.52 0.00 0.00 57.07 56.51 3abq s TYR 365 Cb -0.04 0.41 -0.03 0.00 0.38 0.00 0.00 41.96 42.67 3abq s TYR 365 CO 0.07 -0.95 0.25 0.95 -1.52 0.00 0.00 175.55 174.35 3abq s THR 366 N -3.89 2.95 -0.81 -3.49 -4.23 -1.22 -2.27 115.64 102.68 3abq s THR 366 Ca 0.10 -1.51 0.27 0.00 -1.18 0.00 0.00 61.69 59.37 3abq s THR 366 Cb -0.01 -3.04 0.27 0.00 1.34 0.00 0.00 72.50 71.05 3abq s THR 366 CO -0.01 -0.10 1.82 0.59 -0.54 0.00 0.00 174.62 176.37 3abq n ASN 367 N -1.33 0.55 -1.27 3.99 3.02 -1.26 -2.29 115.26 116.66 3abq n ASN 367 Ca -0.01 0.55 0.11 0.00 -0.03 0.00 0.00 54.58 55.21 3abq n ASN 367 Cb 0.61 -0.70 0.30 0.00 -0.61 0.00 0.00 39.78 39.38 3abq n ASN 367 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3abq n HIS 368 N -2.02 0.87 -3.86 3.10 1.44 -1.26 -4.93 115.22 108.57 3abq n HIS 368 Ca 0.06 -0.43 -0.23 0.00 -2.01 0.00 0.00 57.72 55.10 3abq n HIS 368 Cb 0.39 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.48 3abq n HIS 368 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3abq s ALA 369 N -1.13 3.90 -1.36 1.59 0.00 -0.97 -4.48 121.76 119.30 3abq s ALA 369 Ca 0.46 -1.10 -0.14 0.00 0.00 0.00 0.00 51.96 51.18 3abq s ALA 369 Cb 0.24 -1.82 0.09 0.00 0.00 0.00 0.00 23.12 21.63 3abq s ALA 369 CO 0.32 0.29 1.98 -3.47 0.00 0.00 0.00 175.76 174.88 3abq n ASP 370 N -1.20 4.49 -3.68 0.00 4.64 -0.68 -4.85 116.55 115.28 3abq n ASP 370 Ca -0.08 -2.93 -0.09 0.00 -1.38 0.00 0.00 54.79 50.31 3abq n ASP 370 Cb 0.56 -1.63 -0.03 0.00 -1.04 0.00 0.00 41.12 38.99 3abq n ASP 370 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3abq s ALA 371 N 2.59 -1.26 0.16 -1.67 0.00 -1.26 -3.09 121.76 117.22 3abq s ALA 371 Ca 0.46 -0.03 -0.03 0.00 0.00 0.00 0.00 51.96 52.37 3abq s ALA 371 Cb 0.09 0.87 0.01 0.00 0.00 0.00 0.00 23.12 24.10 3abq s ALA 371 CO -0.03 -0.88 0.26 -0.40 0.00 0.00 0.00 175.76 174.71 3abq n ASP 372 N -0.40 -0.74 0.20 0.00 5.68 -1.26 -4.98 116.55 115.04 3abq n ASP 372 Ca -0.10 -1.74 0.03 0.00 -0.50 0.00 0.00 54.79 52.48 3abq n ASP 372 Cb 0.62 1.31 0.40 0.00 -1.14 0.00 0.00 41.12 42.30 3abq n ASP 372 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 3abq h GLN 373 N 0.00 0.00 -0.02 0.11 5.75 -1.99 -1.81 115.11 117.16 3abq h GLN 373 Ca -0.13 -0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.36 3abq h GLN 373 Cb 0.51 -0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.06 3abq h GLN 373 CO 0.17 0.32 -0.05 -0.91 -2.65 0.00 0.00 178.83 175.70 3abq h ASN 374 N 0.00 0.03 -0.21 -0.69 2.35 -1.99 -1.29 115.58 113.78 3abq h ASN 374 Ca -0.00 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 3abq h ASN 374 Cb 0.56 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.91 3abq h ASN 374 CO 0.04 0.08 0.09 0.25 -1.65 0.00 0.00 177.43 176.24 3abq h LEU 375 N 0.03 0.29 -0.97 1.61 5.85 -1.74 -0.98 115.31 119.40 3abq h LEU 375 Ca 0.01 -0.16 0.08 0.00 0.84 0.00 0.00 57.88 58.65 3abq h LEU 375 Cb 0.11 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 40.99 3abq h LEU 375 CO 0.01 0.37 0.61 0.78 -0.34 0.00 0.00 178.44 179.88 3abq h ASN 376 N 0.19 0.95 0.05 1.25 2.35 -1.27 -1.06 115.58 118.05 3abq h ASN 376 Ca 0.07 0.02 -0.18 0.00 -0.55 0.00 0.00 56.30 55.66 3abq h ASN 376 Cb 0.17 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.37 3abq h ASN 376 CO -0.01 0.58 -0.66 -0.33 -1.65 0.00 0.00 177.43 175.36 3abq h GLU 377 N 1.07 0.57 0.01 0.81 5.08 -1.19 -1.26 114.58 119.68 3abq h GLU 377 Ca 0.44 -0.42 0.02 0.00 -1.00 0.00 0.00 59.36 58.40 3abq h GLU 377 Cb 0.27 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 3abq h GLU 377 CO -0.20 1.04 -0.11 -0.91 -1.00 0.00 0.00 179.01 177.83 3abq h ASN 378 N 0.41 -0.31 -0.15 1.42 2.35 -0.76 -3.10 115.58 115.44 3abq h ASN 378 Ca -0.02 0.05 -0.20 0.00 -0.55 0.00 0.00 56.30 55.57 3abq h ASN 378 Cb 1.24 0.13 0.00 0.00 0.05 0.00 0.00 38.32 39.75 3abq h ASN 378 CO 0.12 -0.16 -0.68 0.25 -1.65 0.00 0.00 177.43 175.32 3abq h LEU 379 N -0.20 0.90 -1.28 1.61 5.85 -1.09 -2.46 115.31 118.65 3abq h LEU 379 Ca 0.04 -0.54 -0.05 0.00 0.84 0.00 0.00 57.88 58.16 3abq h LEU 379 Cb 0.24 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 3abq h LEU 379 CO -0.10 1.33 -0.06 0.00 -0.34 0.00 0.00 178.44 179.27 3abq h MET 380 N 0.56 0.42 -0.01 1.25 -0.00 -1.32 0.28 114.93 116.12 3abq h MET 380 Ca -0.02 -0.09 -0.08 0.00 -0.00 0.00 0.00 59.70 59.51 3abq h MET 380 Cb 1.29 -0.06 0.01 0.00 -0.00 0.00 0.00 31.60 32.84 3abq h MET 380 CO 0.14 0.50 -0.29 0.82 -0.00 0.00 0.00 176.91 178.07 3abq h ILE 381 N 0.40 1.52 -0.53 -0.10 2.04 -1.45 -0.80 117.51 118.59 3abq h ILE 381 Ca 0.08 -1.93 0.09 0.00 1.00 0.00 0.00 64.86 64.10 3abq h ILE 381 Cb 0.36 2.70 -0.07 0.00 -0.74 0.00 0.00 36.82 39.07 3abq h ILE 381 CO 0.02 0.53 0.14 -0.07 0.00 0.00 0.00 178.15 178.77 3abq h LEU 382 N -0.42 0.07 -0.69 1.44 3.38 -1.33 -1.64 115.31 116.11 3abq h LEU 382 Ca -0.03 0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 3abq h LEU 382 Cb 1.03 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 3abq h LEU 382 CO 0.06 0.06 -0.20 -0.07 0.09 0.00 0.00 178.44 178.38 3abq h LEU 383 N 0.29 0.81 -0.70 1.67 3.38 -0.97 -2.21 115.31 117.57 3abq h LEU 383 Ca 0.26 -0.28 0.08 0.00 0.09 0.00 0.00 57.88 58.03 3abq h LEU 383 Cb 0.34 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 3abq h LEU 383 CO -0.32 0.99 0.38 0.00 0.09 0.00 0.00 178.44 179.58 3abq h ALA 384 N 1.07 0.96 0.00 1.53 0.00 -0.74 -0.44 119.26 121.65 3abq h ALA 384 Ca 0.10 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3abq h ALA 384 Cb 0.71 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3abq h ALA 384 CO 0.05 0.02 -0.20 1.79 0.00 0.00 0.00 179.25 180.92 3abq h THR 385 N 0.67 0.93 0.00 0.00 1.35 -0.97 -1.36 112.91 113.52 3abq h THR 385 Ca 0.33 -0.73 0.00 0.00 -0.55 0.00 0.00 66.41 65.46 3abq h THR 385 Cb 0.27 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.11 3abq h THR 385 CO -0.22 0.19 0.00 0.00 -0.25 0.00 0.00 175.52 175.24 3abq n ALA 386 N -2.41 2.35 -1.17 6.62 0.00 -0.36 -4.79 120.51 120.76 3abq n ALA 386 Ca -0.02 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.29 3abq n ALA 386 Cb 0.28 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.29 3abq n ALA 386 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3abq n GLY 387 N 0.94 0.46 3.58 0.00 0.00 -0.51 -2.17 105.19 107.49 3abq n GLY 387 Ca 0.14 -0.94 -0.56 0.00 0.00 0.00 0.00 46.02 44.65 3abq n GLY 387 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3abq h ASN 389 N 4.20 0.51 -4.64 0.00 4.21 -1.75 -3.44 115.58 114.67 3abq h ASN 389 Ca -0.49 -0.25 0.05 0.00 1.21 0.00 0.00 56.30 56.82 3abq h ASN 389 Cb 1.37 -0.15 -0.17 0.00 -1.12 0.00 0.00 38.32 38.26 3abq h ASN 389 CO 0.76 0.92 0.41 -0.72 -1.29 0.00 0.00 177.43 177.51 3abq s TYR 390 N -4.06 -0.43 0.42 1.19 1.13 -1.26 -1.61 117.35 112.73 3abq s TYR 390 Ca -0.06 0.47 0.01 0.00 -1.41 0.00 0.00 57.07 56.08 3abq s TYR 390 Cb 0.12 0.50 -0.01 0.00 -1.10 0.00 0.00 41.96 41.48 3abq s TYR 390 CO 0.82 -0.56 0.05 0.44 -2.51 0.00 0.00 175.55 173.79 3abq n ILE 391 N 0.14 0.00 -2.40 -3.49 -5.35 -1.09 -1.55 119.36 105.62 3abq n ILE 391 Ca -0.12 -2.13 -0.26 0.00 -0.27 0.00 0.00 62.75 59.96 3abq n ILE 391 Cb 0.61 0.56 0.04 0.00 -1.74 0.00 0.00 39.64 39.10 3abq n ILE 391 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 3abq s MET 392 N -3.54 2.81 -0.03 6.28 -1.94 -1.26 -0.67 119.30 120.96 3abq s MET 392 Ca 0.07 -0.08 -0.00 0.00 -1.71 0.00 0.00 55.69 53.97 3abq s MET 392 Cb 0.00 -2.27 0.03 0.00 2.01 0.00 0.00 34.83 34.60 3abq s MET 392 CO 0.05 -0.76 0.02 0.20 -0.01 0.00 0.00 175.02 174.52 3abq s GLY 393 N -4.33 0.17 0.08 -0.03 0.00 0.14 -4.47 107.32 98.88 3abq s GLY 393 Ca 0.55 0.24 -0.02 0.00 0.00 0.00 0.00 44.72 45.49 3abq s GLY 393 CO 0.45 0.73 0.02 1.06 0.00 0.00 0.00 173.10 175.36 3abq s MET 394 N 1.17 0.75 -0.22 2.90 -1.94 -0.82 -1.66 119.30 119.49 3abq s MET 394 Ca -0.08 -1.29 -0.28 0.00 -1.71 0.00 0.00 55.69 52.33 3abq s MET 394 Cb -0.13 0.23 -0.05 0.00 2.01 0.00 0.00 34.83 36.89 3abq s MET 394 CO -0.03 -0.18 2.20 -2.14 -0.01 0.00 0.00 175.02 174.86 3abq s PRO 395 N -3.97 3.15 0.00 2.03 0.02 -1.26 -1.25 135.00 133.73 3abq s PRO 395 Ca 0.14 2.01 0.00 0.00 0.02 0.00 0.00 61.00 63.17 3abq s PRO 395 Cb 0.08 -4.36 0.00 0.00 0.02 0.00 0.00 34.50 30.23 3abq s PRO 395 CO -0.05 -2.08 0.00 1.28 -0.33 0.00 0.00 177.00 175.81 3abq n LEU 396 N 11.58 0.95 0.00 -5.54 4.77 -1.26 -2.48 117.00 125.02 3abq n LEU 396 Ca 0.29 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 3abq n LEU 396 Cb 0.45 -1.81 0.00 0.00 -2.33 0.00 0.00 43.42 39.73 3abq n LEU 396 CO 0.66 -0.66 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 3abq n GLY 397 N -0.78 0.76 3.53 -0.72 0.00 -0.38 -4.42 105.19 103.18 3abq n GLY 397 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3abq n GLY 397 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3abq s ASP 398 N -2.73 6.37 -0.24 1.61 3.68 -1.03 -0.79 116.67 123.53 3abq s ASP 398 Ca 0.00 -0.28 -0.23 0.00 2.13 0.00 0.00 52.55 54.17 3abq s ASP 398 Cb 0.00 -2.43 -0.01 0.00 -1.45 0.00 0.00 42.92 39.03 3abq s ASP 398 CO 0.00 -1.15 0.76 -0.62 0.13 0.00 0.00 175.17 174.29 3abq s ASP 399 N 2.67 6.77 0.00 -0.34 3.68 -1.06 -4.68 116.67 123.71 3abq s ASP 399 Ca 0.31 0.95 0.27 0.00 2.13 0.00 0.00 52.55 56.21 3abq s ASP 399 Cb -0.12 -2.41 0.90 0.00 -1.45 0.00 0.00 42.92 39.84 3abq s ASP 399 CO 0.20 -0.45 1.66 2.30 0.13 0.00 0.00 175.17 179.01 3abq n ILE 400 N 5.15 0.00 0.00 4.11 -5.35 -1.26 -3.03 119.36 118.98 3abq n ILE 400 Ca 0.03 -0.10 0.00 0.00 -0.27 0.00 0.00 62.75 62.42 3abq n ILE 400 Cb 0.48 0.21 0.00 0.00 -1.74 0.00 0.00 39.64 38.60 3abq n ILE 400 CO 0.00 0.00 0.00 1.15 -1.76 0.00 0.00 176.55 175.94 3abq n MET 401 N -0.81 2.63 0.00 6.28 0.00 -1.26 -4.68 117.12 119.27 3abq n MET 401 Ca 0.12 0.00 0.12 0.00 0.00 0.00 0.00 57.70 57.94 3abq n MET 401 Cb 0.32 -0.75 0.24 0.00 0.00 0.00 0.00 33.22 33.03 3abq n MET 401 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 3abq n LEU 402 N -0.94 0.70 -3.42 3.17 4.77 -1.26 -5.00 117.00 115.02 3abq n LEU 402 Ca 0.00 -0.12 -0.21 0.00 -0.03 0.00 0.00 56.01 55.64 3abq n LEU 402 Cb 0.09 -0.19 0.06 0.00 -2.33 0.00 0.00 43.42 41.05 3abq n LEU 402 CO 0.00 0.16 -0.01 0.59 -1.33 0.00 0.00 177.39 176.80 3abq n ASN 403 N -1.27 -6.08 -3.72 -1.43 3.02 -1.17 -5.01 115.26 99.60 3abq n ASN 403 Ca 0.07 -0.83 -0.06 0.00 -0.03 0.00 0.00 54.58 53.73 3abq n ASN 403 Cb 0.34 -4.51 -0.01 0.00 -0.61 0.00 0.00 39.78 34.99 3abq n ASN 403 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 3abq s TYR 404 N -3.42 -0.14 -0.22 3.10 1.13 -1.25 -4.74 117.35 111.81 3abq s TYR 404 Ca 0.46 -0.32 -0.02 0.00 -1.41 0.00 0.00 57.07 55.78 3abq s TYR 404 Cb -0.10 0.71 0.01 0.00 -1.10 0.00 0.00 41.96 41.48 3abq s TYR 404 CO 0.79 -1.19 -0.08 -0.65 -2.51 0.00 0.00 175.55 171.91 3abq s GLN 405 N -3.56 3.16 0.00 -3.49 1.11 -0.96 -2.58 119.66 113.33 3abq s GLN 405 Ca 0.12 -0.76 0.00 0.00 0.01 0.00 0.00 55.36 54.73 3abq s GLN 405 Cb -0.05 -2.92 0.00 0.00 -1.01 0.00 0.00 33.01 29.03 3abq s GLN 405 CO 0.07 -0.25 0.00 -2.37 0.01 0.00 0.00 175.29 172.74 3abq n THR 406 N 4.73 0.00 -3.15 -0.19 5.66 0.03 -2.27 114.28 119.08 3abq n THR 406 Ca -0.18 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.48 3abq n THR 406 Cb 0.50 -0.73 -0.06 0.00 -1.55 0.00 0.00 70.33 68.49 3abq n THR 406 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3abq s THR 407 N 1.68 4.67 0.66 1.09 -4.23 -1.23 -4.38 115.64 113.90 3abq s THR 407 Ca 0.00 1.00 -0.12 0.00 -1.18 0.00 0.00 61.69 61.39 3abq s THR 407 Cb 0.00 -3.68 -0.01 0.00 1.34 0.00 0.00 72.50 70.15 3abq s THR 407 CO 0.00 -0.06 1.05 0.00 -0.54 0.00 0.00 174.62 175.08 3abq s ALA 408 N -1.83 2.74 0.29 3.99 0.00 -1.26 -1.93 121.76 123.77 3abq s ALA 408 Ca 0.50 0.14 0.02 0.00 0.00 0.00 0.00 51.96 52.62 3abq s ALA 408 Cb -0.12 -3.18 0.58 0.00 0.00 0.00 0.00 23.12 20.40 3abq s ALA 408 CO 0.19 -1.06 1.85 0.74 0.00 0.00 0.00 175.76 177.48 3abq h PHE 409 N -0.39 1.09 -1.00 0.00 0.05 -1.72 -1.04 116.94 113.93 3abq h PHE 409 Ca -0.44 0.03 0.25 0.00 3.82 0.00 0.00 57.97 61.62 3abq h PHE 409 Cb 1.21 -0.35 -0.08 0.00 2.00 0.00 0.00 35.95 38.73 3abq h PHE 409 CO 0.62 0.46 0.66 0.45 -0.18 0.00 0.00 178.31 180.31 3abq h HIS 410 N 0.97 0.56 -0.08 -0.55 3.86 -1.92 -2.71 115.15 115.28 3abq h HIS 410 Ca 0.47 0.02 -0.14 0.00 -1.16 0.00 0.00 60.37 59.56 3abq h HIS 410 Cb 0.46 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.75 3abq h HIS 410 CO -0.00 0.09 -0.57 -0.44 0.86 0.00 0.00 177.93 177.87 3abq h ASP 411 N 0.37 0.29 -0.22 2.45 3.32 -1.54 0.41 116.42 121.51 3abq h ASP 411 Ca 0.55 -0.16 -0.13 0.00 0.02 0.00 0.00 57.03 57.31 3abq h ASP 411 Cb 1.44 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 40.91 3abq h ASP 411 CO -0.23 0.80 -0.36 0.74 -1.72 0.00 0.00 179.24 178.47 3abq h THR 412 N 0.20 1.32 -0.48 0.35 2.02 -1.55 -0.81 112.91 113.97 3abq h THR 412 Ca -0.00 -1.57 -0.07 0.00 0.77 0.00 0.00 66.41 65.54 3abq h THR 412 Cb 1.06 1.80 -0.02 0.00 -1.74 0.00 0.00 68.15 69.25 3abq h THR 412 CO 0.09 0.49 0.02 0.00 0.37 0.00 0.00 175.52 176.49 3abq h ALA 413 N 0.62 1.13 0.06 6.16 0.00 -1.50 -1.22 119.26 124.51 3abq h ALA 413 Ca 0.02 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 3abq h ALA 413 Cb 0.95 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3abq h ALA 413 CO 0.08 0.56 -0.03 1.15 0.00 0.00 0.00 179.25 181.01 3abq h THR 414 N 0.73 1.03 -0.49 0.00 2.02 -0.85 -2.13 112.91 113.23 3abq h THR 414 Ca 0.15 -0.31 0.03 0.00 0.77 0.00 0.00 66.41 67.04 3abq h THR 414 Cb 0.42 1.24 -0.04 0.00 -1.74 0.00 0.00 68.15 68.04 3abq h THR 414 CO 0.02 0.08 0.28 0.58 0.37 0.00 0.00 175.52 176.84 3abq h VAL 415 N -0.22 1.02 -0.34 3.16 2.07 -0.98 0.16 116.25 121.12 3abq h VAL 415 Ca -0.01 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 3abq h VAL 415 Cb 0.19 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 3abq h VAL 415 CO 0.01 0.10 0.14 0.03 0.02 0.00 0.00 177.57 177.88 3abq h ARG 416 N 0.55 0.50 0.00 1.57 3.08 -1.20 -1.13 114.38 117.76 3abq h ARG 416 Ca 0.20 -0.09 -0.17 0.00 0.07 0.00 0.00 59.98 59.99 3abq h ARG 416 Cb 0.05 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 3abq h ARG 416 CO -0.11 0.49 -0.83 1.96 -1.07 0.00 0.00 179.97 180.41 3abq h GLN 417 N 0.41 0.00 -0.28 0.04 4.20 -1.19 0.15 115.11 118.43 3abq h GLN 417 Ca 0.11 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.77 3abq h GLN 417 Cb 0.17 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 3abq h GLN 417 CO -0.01 0.83 -0.04 1.25 -0.67 0.00 0.00 178.83 180.18 3abq h LEU 418 N 0.00 0.53 -2.55 1.46 5.85 -0.58 -3.32 115.31 116.69 3abq h LEU 418 Ca -0.01 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.37 3abq h LEU 418 Cb 1.54 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.42 3abq h LEU 418 CO 0.11 0.75 0.00 0.18 -0.34 0.00 0.00 178.44 179.14 3abq n LEU 419 N -4.54 3.30 -3.78 2.25 4.77 -0.44 -4.96 117.00 113.60 3abq n LEU 419 Ca -0.03 -1.76 -0.25 0.00 -0.03 0.00 0.00 56.01 53.94 3abq n LEU 419 Cb 0.29 -0.29 0.03 0.00 -2.33 0.00 0.00 43.42 41.12 3abq n LEU 419 CO 0.39 0.78 0.02 -3.20 -1.33 0.00 0.00 177.39 174.05 3abq n ASN 420 N 1.15 -2.87 -4.85 -1.43 5.15 -0.02 -5.00 115.26 107.39 3abq n ASN 420 Ca 0.17 -0.79 -0.29 0.00 -0.60 0.00 0.00 54.58 53.07 3abq n ASN 420 Cb 0.52 -4.04 -0.05 0.00 -0.53 0.00 0.00 39.78 35.68 3abq n ASN 420 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3abq s LEU 421 N -6.95 4.06 0.28 1.20 1.43 0.30 -4.95 118.68 114.06 3abq s LEU 421 Ca 0.30 0.09 0.08 0.00 -1.03 0.00 0.00 54.13 53.56 3abq s LEU 421 Cb -0.15 -2.69 -0.04 0.00 0.03 0.00 0.00 46.19 43.35 3abq s LEU 421 CO 0.81 0.14 0.14 -0.13 0.23 0.00 0.00 176.35 177.54 3abq s ARG 422 N -2.66 2.61 1.19 1.70 1.81 -0.33 -4.57 118.95 118.71 3abq s ARG 422 Ca 0.32 -1.28 -0.18 0.00 -1.72 0.00 0.00 55.73 52.87 3abq s ARG 422 Cb -0.12 -2.36 0.28 0.00 -0.45 0.00 0.00 34.95 32.30 3abq s ARG 422 CO 0.25 0.30 1.08 -2.14 -0.68 0.00 0.00 175.30 174.10 3abq s PRO 423 N -3.81 -1.14 0.13 3.54 0.02 -1.26 0.22 135.00 132.71 3abq s PRO 423 Ca 0.34 0.13 -0.34 0.00 0.02 0.00 0.00 61.00 61.16 3abq s PRO 423 Cb -0.06 -1.59 -0.17 0.00 0.02 0.00 0.00 34.50 32.70 3abq s PRO 423 CO 0.23 -3.70 0.97 0.43 -0.33 0.00 0.00 177.00 174.61 3abq n SER 424 N -4.79 0.31 -0.22 2.53 7.64 -1.26 -4.64 113.62 113.20 3abq n SER 424 Ca 0.11 1.14 0.05 0.00 1.01 0.00 0.00 58.87 61.18 3abq n SER 424 Cb 0.59 -1.07 0.31 0.00 -1.01 0.00 0.00 64.21 63.03 3abq n SER 424 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3abq h PRO 425 N 2.66 0.84 -0.47 1.43 0.13 -1.93 0.16 132.00 134.82 3abq h PRO 425 Ca -0.42 -0.05 -0.10 0.00 -0.87 0.00 0.00 66.00 64.57 3abq h PRO 425 Cb 1.39 -0.19 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 3abq h PRO 425 CO 0.65 0.56 -0.08 0.93 -0.23 0.00 0.00 178.00 179.83 3abq h GLU 426 N 0.87 0.89 -0.25 0.86 3.07 -1.90 -2.44 114.58 115.67 3abq h GLU 426 Ca 0.32 -0.32 -0.20 0.00 -0.50 0.00 0.00 59.36 58.66 3abq h GLU 426 Cb 0.17 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.03 3abq h GLU 426 CO -0.11 0.97 -0.61 0.35 -1.40 0.00 0.00 179.01 178.21 3abq h PHE 427 N 0.74 1.11 -0.71 4.33 3.04 -1.58 -2.83 116.94 121.03 3abq h PHE 427 Ca 0.12 -0.42 0.07 0.00 3.98 0.00 0.00 57.97 61.72 3abq h PHE 427 Cb 0.62 -0.20 -0.06 0.00 2.56 0.00 0.00 35.95 38.87 3abq h PHE 427 CO 0.05 1.26 0.40 1.49 -2.02 0.00 0.00 178.31 179.48 3abq h GLU 428 N 0.64 0.71 -0.75 1.11 4.81 -0.68 0.11 114.58 120.53 3abq h GLU 428 Ca -0.00 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.20 3abq h GLU 428 Cb 1.23 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 30.41 3abq h GLU 428 CO 0.13 0.47 0.49 0.00 -0.73 0.00 0.00 179.01 179.37 3abq h ARG 429 N 0.73 0.94 -0.56 1.92 3.08 -1.35 -0.07 114.38 119.07 3abq h ARG 429 Ca 0.32 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.29 3abq h ARG 429 Cb 0.22 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 3abq h ARG 429 CO -0.19 0.62 0.26 2.35 -1.07 0.00 0.00 179.97 181.94 3abq h TRP 430 N 0.97 0.82 -0.77 3.04 7.01 -1.09 -1.93 115.95 124.00 3abq h TRP 430 Ca 0.29 -0.05 -0.02 0.00 2.11 0.00 0.00 58.89 61.22 3abq h TRP 430 Cb -0.04 -0.25 -0.04 0.00 -2.10 0.00 0.00 29.16 26.73 3abq h TRP 430 CO -0.03 0.64 0.39 -0.07 -2.79 0.00 0.00 178.44 176.58 3abq h LEU 431 N 0.76 1.00 -0.97 0.65 3.38 -0.55 -0.85 115.31 118.73 3abq h LEU 431 Ca 0.19 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 3abq h LEU 431 Cb 0.14 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 3abq h LEU 431 CO -0.02 0.83 0.44 -0.33 0.09 0.00 0.00 178.44 179.46 3abq h GLU 432 N 1.08 1.17 0.00 1.13 5.08 -0.81 -0.94 114.58 121.29 3abq h GLU 432 Ca 0.27 -0.14 -0.06 0.00 -1.00 0.00 0.00 59.36 58.42 3abq h GLU 432 Cb 0.09 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 3abq h GLU 432 CO -0.04 0.87 -0.29 0.66 -1.00 0.00 0.00 179.01 179.21 3abq h SER 433 N 1.18 0.00 0.95 1.42 4.64 -0.89 -2.63 113.55 118.21 3abq h SER 433 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 3abq h SER 433 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 3abq h SER 433 CO -0.04 0.29 -0.11 0.23 -0.87 0.00 0.00 176.83 176.33 3abq n MET 434 N -3.30 0.03 -1.01 4.77 2.81 -0.37 -4.92 117.12 115.14 3abq n MET 434 Ca 0.01 0.02 -0.00 0.00 -1.81 0.00 0.00 57.70 55.92 3abq n MET 434 Cb 0.55 -1.53 -0.00 0.00 -0.71 0.00 0.00 33.22 31.52 3abq n MET 434 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3abq n GLY 435 N 1.48 0.47 0.08 3.03 0.00 -0.86 -4.93 105.19 104.46 3abq n GLY 435 Ca 0.06 -0.32 -0.10 0.00 0.00 0.00 0.00 46.02 45.67 3abq n GLY 435 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3abq h ILE 436 N 0.00 1.19 -4.20 -0.61 2.04 -1.43 -3.43 117.51 111.07 3abq h ILE 436 Ca -0.00 -2.95 -0.51 0.00 1.00 0.00 0.00 64.86 62.40 3abq h ILE 436 Cb 0.04 2.63 -0.29 0.00 -0.74 0.00 0.00 36.82 38.46 3abq h ILE 436 CO 0.01 0.73 -0.82 -0.32 0.00 0.00 0.00 178.15 177.75 3abq s MET 437 N -2.64 1.28 -0.04 2.37 0.00 -1.06 -1.43 119.30 117.78 3abq s MET 437 Ca -0.04 -0.54 0.00 0.00 0.00 0.00 0.00 55.69 55.11 3abq s MET 437 Cb 0.08 -1.22 0.03 0.00 0.00 0.00 0.00 34.83 33.72 3abq s MET 437 CO 0.83 0.31 0.00 0.00 0.00 0.00 0.00 175.02 176.16 3abq s ALA 438 N -0.30 0.38 -1.59 4.11 0.00 -0.13 -3.97 121.76 120.26 3abq s ALA 438 Ca 0.05 0.12 -0.12 0.00 0.00 0.00 0.00 51.96 52.01 3abq s ALA 438 Cb -0.07 -0.39 0.10 0.00 0.00 0.00 0.00 23.12 22.77 3abq s ALA 438 CO -0.00 -0.13 0.65 0.09 0.00 0.00 0.00 175.76 176.37 3abq n ASN 439 N 4.29 -2.28 0.00 0.00 3.02 -1.26 -1.06 115.26 117.97 3abq n ASN 439 Ca -0.23 -1.00 0.00 0.00 -0.03 0.00 0.00 54.58 53.31 3abq n ASN 439 Cb 0.50 -2.89 0.00 0.00 -0.61 0.00 0.00 39.78 36.79 3abq n ASN 439 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3abq n GLY 440 N -1.65 1.57 3.52 7.41 0.00 -1.26 -5.01 105.19 109.77 3abq n GLY 440 Ca -0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 3abq n GLY 440 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3abq s ARG 441 N -0.08 2.46 0.10 1.61 0.52 -0.23 -4.65 118.95 118.68 3abq s ARG 441 Ca 0.00 -0.74 -0.33 0.00 -0.52 0.00 0.00 55.73 54.14 3abq s ARG 441 Cb 0.00 -2.40 -0.12 0.00 0.52 0.00 0.00 34.95 32.95 3abq s ARG 441 CO 0.00 0.61 1.76 1.28 0.02 0.00 0.00 175.30 178.97 3abq n LEU 442 N 1.94 3.62 -4.69 2.53 4.77 -1.26 -0.95 117.00 122.96 3abq n LEU 442 Ca -0.17 1.02 -0.29 0.00 -0.03 0.00 0.00 56.01 56.55 3abq n LEU 442 Cb 0.52 -1.47 0.17 0.00 -2.33 0.00 0.00 43.42 40.31 3abq n LEU 442 CO 0.27 -0.02 0.65 0.42 -1.33 0.00 0.00 177.39 177.38 3abq s THR 443 N 2.33 2.02 0.33 -5.08 -4.23 -0.52 -4.87 115.64 105.63 3abq s THR 443 Ca 0.83 0.01 0.05 0.00 -1.18 0.00 0.00 61.69 61.40 3abq s THR 443 Cb -0.59 -2.53 0.30 0.00 1.34 0.00 0.00 72.50 71.02 3abq s THR 443 CO 0.40 -0.01 1.88 0.11 -0.54 0.00 0.00 174.62 176.47 3abq h LYS 444 N -1.88 0.81 -0.00 3.99 1.57 -1.90 -1.78 116.57 117.37 3abq h LYS 444 Ca -0.54 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.19 3abq h LYS 444 Cb 1.33 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.46 3abq h LYS 444 CO 0.58 0.53 -0.03 2.89 -0.57 0.00 0.00 179.45 182.85 3abq n ARG 445 N -4.54 0.77 -1.55 3.15 1.85 -1.26 -4.86 116.66 110.21 3abq n ARG 445 Ca 0.16 -0.14 -0.30 0.00 -1.00 0.00 0.00 57.85 56.57 3abq n ARG 445 Cb 0.35 -1.50 0.10 0.00 -1.05 0.00 0.00 32.46 30.36 3abq n ARG 445 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3abq s ALA 446 N -2.33 2.19 -0.02 2.89 0.00 -0.67 -4.02 121.76 119.81 3abq s ALA 446 Ca 0.35 -0.25 0.00 0.00 0.00 0.00 0.00 51.96 52.07 3abq s ALA 446 Cb 0.21 -3.10 0.00 0.00 0.00 0.00 0.00 23.12 20.23 3abq s ALA 446 CO 0.43 -1.79 0.00 0.41 0.00 0.00 0.00 175.76 174.80 3abq n GLY 447 N -2.12 0.47 2.85 0.00 0.00 0.18 -4.96 105.19 101.61 3abq n GLY 447 Ca 0.07 -0.25 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 3abq n GLY 447 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3abq s ASP 448 N -2.23 4.29 0.63 1.61 2.15 -1.26 -4.96 116.67 116.90 3abq s ASP 448 Ca 0.00 -1.81 0.39 0.00 0.43 0.00 0.00 52.55 51.56 3abq s ASP 448 Cb 0.00 -1.16 2.12 0.00 -0.30 0.00 0.00 42.92 43.58 3abq s ASP 448 CO 0.00 -0.39 2.29 1.55 -0.17 0.00 0.00 175.17 178.44 3abq h PRO 449 N 7.91 0.00 0.00 4.34 0.13 -1.89 -1.40 132.00 141.09 3abq h PRO 449 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 3abq h PRO 449 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 3abq h PRO 449 CO 0.49 0.01 0.00 -1.13 -0.23 0.00 0.00 178.00 177.14 3abq n SER 450 N -3.30 0.00 0.27 1.44 3.41 -1.26 -2.48 113.62 111.70 3abq n SER 450 Ca -0.03 0.30 0.11 0.00 -0.26 0.00 0.00 58.87 59.00 3abq n SER 450 Cb 0.11 -0.40 0.74 0.00 -0.26 0.00 0.00 64.21 64.40 3abq n SER 450 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3abq h LEU 451 N 0.00 0.00 -0.22 1.04 6.46 -1.60 -1.63 115.31 119.36 3abq h LEU 451 Ca 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 3abq h LEU 451 Cb 0.21 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.14 3abq h LEU 451 CO 0.00 0.06 -0.05 0.49 -0.62 0.00 0.00 178.44 178.32 3abq n PHE 452 N -4.04 0.00 0.25 1.25 3.72 -1.04 -5.19 117.46 112.42 3abq n PHE 452 Ca -0.03 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.40 3abq n PHE 452 Cb 0.15 -0.12 0.03 0.00 -0.94 0.00 0.00 39.48 38.59 3abq n PHE 452 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90