#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xrs s VAL 34 N 0.00 -0.02 -0.07 -0.18 1.01 0.02 -4.97 120.40 116.19 1xrs s VAL 34 Ca 0.00 0.07 -0.17 0.00 0.00 0.00 0.00 61.98 61.88 1xrs s VAL 34 Cb 0.00 -0.37 -0.05 0.00 0.00 0.00 0.00 36.38 35.97 1xrs s VAL 34 CO 0.00 0.03 0.46 -1.58 0.00 0.00 0.00 175.10 174.01 1xrs s GLN 35 N 0.70 4.21 -0.14 2.72 -0.44 -1.26 -2.76 119.66 122.69 1xrs s GLN 35 Ca -0.05 0.46 -0.06 0.00 -2.50 0.00 0.00 55.36 53.21 1xrs s GLN 35 Cb -0.06 -3.36 0.06 0.00 -1.64 0.00 0.00 33.01 28.01 1xrs s GLN 35 CO -0.04 0.35 0.31 -1.17 0.50 0.00 0.00 175.29 175.24 1xrs s LEU 36 N -0.00 -0.13 0.10 3.68 1.98 -0.63 -5.03 118.68 118.65 1xrs s LEU 36 Ca 0.25 0.70 0.05 0.00 -2.89 0.00 0.00 54.13 52.24 1xrs s LEU 36 Cb -0.16 0.93 -0.04 0.00 0.66 0.00 0.00 46.19 47.59 1xrs s LEU 36 CO 0.12 -0.21 -0.13 -0.94 -1.89 0.00 0.00 176.35 173.29 1xrs s SER 37 N 1.96 1.83 0.01 3.68 1.04 -1.26 -0.26 113.70 120.70 1xrs s SER 37 Ca -0.04 -0.76 -0.12 0.00 0.48 0.00 0.00 55.95 55.51 1xrs s SER 37 Cb -0.11 -0.05 0.04 0.00 0.10 0.00 0.00 66.02 66.00 1xrs s SER 37 CO -0.10 -0.15 0.56 2.22 0.98 0.00 0.00 173.24 176.76 1xrs n PHE 38 N 0.74 -0.38 -3.77 5.02 -1.74 -0.08 -5.01 117.46 112.24 1xrs n PHE 38 Ca -0.17 -0.37 -0.13 0.00 -0.56 0.00 0.00 57.45 56.21 1xrs n PHE 38 Cb 0.56 0.17 -0.14 0.00 1.52 0.00 0.00 39.48 41.59 1xrs n PHE 38 CO 0.00 0.00 0.00 -0.08 -0.56 0.00 0.00 176.76 176.12 1xrs s THR 39 N -2.14 -0.04 0.25 1.97 -1.32 -1.26 0.89 115.64 113.99 1xrs s THR 39 Ca 0.13 0.14 0.06 0.00 -1.21 0.00 0.00 61.69 60.80 1xrs s THR 39 Cb -0.01 -0.21 -0.03 0.00 -1.51 0.00 0.00 72.50 70.74 1xrs s THR 39 CO 0.00 0.06 0.32 -0.76 -2.21 0.00 0.00 174.62 172.03 1xrs s LEU 40 N 0.87 4.16 -0.93 9.08 1.02 -0.32 -4.97 118.68 127.59 1xrs s LEU 40 Ca -0.07 -0.03 -0.02 0.00 0.02 0.00 0.00 54.13 54.04 1xrs s LEU 40 Cb -0.09 -2.71 0.32 0.00 0.02 0.00 0.00 46.19 43.74 1xrs s LEU 40 CO -0.04 -0.07 1.96 -0.81 0.02 0.00 0.00 176.35 177.41 1xrs n PRO 41 N -1.35 4.03 -4.47 1.29 -0.04 -1.26 -1.71 135.00 131.49 1xrs n PRO 41 Ca -0.08 -4.02 -0.20 0.00 -0.04 0.00 0.00 63.50 59.15 1xrs n PRO 41 Cb 0.57 -2.37 -0.14 0.00 -0.04 0.00 0.00 33.50 31.52 1xrs n PRO 41 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1xrs s LEU 42 N -4.12 2.07 0.37 1.53 1.43 -1.03 -4.73 118.68 114.21 1xrs s LEU 42 Ca 0.46 -0.30 -0.26 0.00 -1.03 0.00 0.00 54.13 53.01 1xrs s LEU 42 Cb 0.32 -0.60 -0.12 0.00 0.03 0.00 0.00 46.19 45.82 1xrs s LEU 42 CO -0.27 0.11 1.01 2.29 0.23 0.00 0.00 176.35 179.71 1xrs n LYS 43 N 2.49 1.39 -1.16 1.70 2.85 -1.25 -3.82 118.16 120.36 1xrs n LYS 43 Ca -0.15 0.49 -0.25 0.00 -1.05 0.00 0.00 58.31 57.35 1xrs n LYS 43 Cb 0.55 -1.98 -0.11 0.00 -0.65 0.00 0.00 35.03 32.84 1xrs n LYS 43 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1xrs n ASN 44 N 0.78 1.06 -4.82 -5.58 5.15 -1.26 -4.64 115.26 105.95 1xrs n ASN 44 Ca 0.09 -2.42 -0.27 0.00 -0.60 0.00 0.00 54.58 51.37 1xrs n ASN 44 Cb 0.37 -1.22 -0.04 0.00 -0.53 0.00 0.00 39.78 38.35 1xrs n ASN 44 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 1xrs s ASN 45 N 7.64 4.45 0.00 1.20 0.02 -1.26 -5.00 114.94 121.99 1xrs s ASN 45 Ca 0.73 -1.30 0.29 0.00 -1.02 0.00 0.00 52.86 51.56 1xrs s ASN 45 Cb 0.02 0.18 1.21 0.00 0.02 0.00 0.00 41.25 42.69 1xrs s ASN 45 CO 0.24 -0.88 1.88 -1.84 0.02 0.00 0.00 177.10 176.52 1xrs n GLU 46 N -1.49 0.25 -0.06 -0.60 0.28 -1.26 -1.80 120.64 115.96 1xrs n GLU 46 Ca -0.06 -0.05 -0.09 0.00 -0.16 0.00 0.00 57.16 56.80 1xrs n GLU 46 Cb 0.65 -1.50 -0.08 0.00 1.43 0.00 0.00 31.44 31.94 1xrs n GLU 46 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1xrs h ARG 47 N 0.12 0.00 -0.96 3.44 3.08 -1.94 -2.60 114.38 115.52 1xrs h ARG 47 Ca 0.00 0.00 0.14 0.00 0.07 0.00 0.00 59.98 60.19 1xrs h ARG 47 Cb 0.42 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.38 1xrs h ARG 47 CO 0.00 0.64 0.61 0.66 -1.07 0.00 0.00 179.97 180.81 1xrs h SER 48 N -1.00 0.79 -0.36 7.04 4.64 -1.81 0.56 113.55 123.41 1xrs h SER 48 Ca -0.02 0.05 0.07 0.00 -0.47 0.00 0.00 61.79 61.43 1xrs h SER 48 Cb 0.67 -0.10 -0.07 0.00 -0.31 0.00 0.00 62.40 62.59 1xrs h SER 48 CO -0.01 0.39 -0.12 0.00 -0.87 0.00 0.00 176.83 176.22 1xrs h ALA 49 N 1.58 0.20 -0.55 5.18 0.00 -1.40 0.47 119.26 124.74 1xrs h ALA 49 Ca 0.49 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.50 1xrs h ALA 49 Cb 0.67 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1xrs h ALA 49 CO -0.26 -0.48 0.19 0.93 0.00 0.00 0.00 179.25 179.62 1xrs h GLU 50 N -0.04 0.84 -0.75 0.00 4.39 0.29 -1.37 114.58 117.95 1xrs h GLU 50 Ca 0.18 -0.17 0.11 0.00 0.34 0.00 0.00 59.36 59.81 1xrs h GLU 50 Cb 0.30 -0.13 -0.08 0.00 -0.10 0.00 0.00 28.75 28.75 1xrs h GLU 50 CO -0.39 0.76 0.37 0.00 -1.16 0.00 0.00 179.01 178.58 1xrs h ALA 51 N 1.04 1.05 -0.31 3.43 0.00 0.95 0.50 119.26 125.93 1xrs h ALA 51 Ca 0.18 0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.21 1xrs h ALA 51 Cb 0.25 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1xrs h ALA 51 CO -0.01 -0.07 0.01 0.00 0.00 0.00 0.00 179.25 179.18 1xrs h ALA 52 N 1.47 0.28 -0.38 0.00 0.00 0.91 0.38 119.26 121.93 1xrs h ALA 52 Ca 0.38 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.39 1xrs h ALA 52 Cb 0.45 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 1xrs h ALA 52 CO -0.30 -0.40 0.22 0.87 0.00 0.00 0.00 179.25 179.64 1xrs h LYS 53 N 0.10 0.43 0.36 0.00 1.79 0.08 -1.82 116.57 117.52 1xrs h LYS 53 Ca 0.15 -0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 58.58 1xrs h LYS 53 Cb 0.19 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 30.73 1xrs h LYS 53 CO -0.24 0.28 -0.34 1.96 -1.08 0.00 0.00 179.45 180.03 1xrs h GLN 54 N 0.44 -0.67 -0.34 3.15 1.08 0.10 -0.71 115.11 118.16 1xrs h GLN 54 Ca 0.15 0.05 0.10 0.00 -1.45 0.00 0.00 58.65 57.50 1xrs h GLN 54 Cb 0.01 0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.58 1xrs h GLN 54 CO -0.07 -0.45 0.54 0.97 -0.95 0.00 0.00 178.83 178.87 1xrs h ILE 55 N -0.69 0.20 0.01 2.54 -0.00 -0.22 0.14 117.51 119.48 1xrs h ILE 55 Ca -0.05 0.00 -0.00 0.00 -0.00 0.00 0.00 64.86 64.81 1xrs h ILE 55 Cb 0.59 0.54 0.00 0.00 -0.00 0.00 0.00 36.82 37.95 1xrs h ILE 55 CO -0.03 0.00 -0.00 0.00 -0.00 0.00 0.00 178.15 178.12 1xrs h ALA 56 N 1.25 -0.17 -0.66 0.18 0.00 -0.41 -3.31 119.26 116.13 1xrs h ALA 56 Ca 0.16 -0.00 0.14 0.00 0.00 0.00 0.00 54.91 55.21 1xrs h ALA 56 Cb 1.24 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.93 1xrs h ALA 56 CO -0.00 -0.17 0.08 1.37 0.00 0.00 0.00 179.25 180.52 1xrs h LEU 57 N -0.06 -0.15 -0.55 0.00 8.10 -0.73 0.60 115.31 122.53 1xrs h LEU 57 Ca -0.00 0.15 0.00 0.00 0.11 0.00 0.00 57.88 58.14 1xrs h LEU 57 Cb 0.01 0.23 0.00 0.00 -0.44 0.00 0.00 40.66 40.46 1xrs h LEU 57 CO 0.00 -0.08 0.50 0.50 -4.11 0.00 0.00 178.44 175.26 1xrs h LYS 58 N 0.18 0.00 -1.51 0.17 3.64 -0.89 -1.68 116.57 116.49 1xrs h LYS 58 Ca 0.36 0.00 -0.61 0.00 -1.27 0.00 0.00 60.65 59.12 1xrs h LYS 58 Cb 0.59 0.00 -0.40 0.00 -0.41 0.00 0.00 32.23 32.01 1xrs h LYS 58 CO -0.51 0.00 -0.48 0.00 -2.27 0.00 0.00 179.45 176.19 1xrs n MET 59 N -1.98 3.35 0.00 1.90 0.00 0.21 -5.06 117.12 115.54 1xrs n MET 59 Ca -0.01 -4.33 0.00 0.00 0.00 0.00 0.00 57.70 53.36 1xrs n MET 59 Cb 0.51 -2.26 0.00 0.00 0.00 0.00 0.00 33.22 31.48 1xrs n MET 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1xrs n GLY 60 N -0.51 1.70 1.93 3.17 0.00 -0.63 -5.00 105.19 105.83 1xrs n GLY 60 Ca 0.42 -2.03 -0.35 0.00 0.00 0.00 0.00 46.02 44.06 1xrs n GLY 60 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xrs n LEU 61 N 0.00 0.62 0.00 0.99 4.32 -1.26 -4.58 117.00 117.08 1xrs n LEU 61 Ca 0.00 0.61 0.00 0.00 -0.02 0.00 0.00 56.01 56.60 1xrs n LEU 61 Cb 0.00 -0.45 0.00 0.00 -1.62 0.00 0.00 43.42 41.35 1xrs n LEU 61 CO 0.00 -0.43 0.00 -1.84 -1.22 0.00 0.00 177.39 173.90 1xrs n GLU 62 N 2.05 0.00 -1.91 3.23 0.00 -1.26 -2.99 120.64 119.76 1xrs n GLU 62 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.32 1xrs n GLU 62 Cb -0.03 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.41 1xrs n GLU 62 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1xrs n GLU 63 N 0.00 0.00 -1.84 3.44 0.00 -1.26 -1.57 120.64 119.41 1xrs n GLU 63 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 57.16 56.79 1xrs n GLU 63 Cb 0.00 -2.29 0.05 0.00 0.00 0.00 0.00 31.44 29.19 1xrs n GLU 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.13 175.88 1xrs s PRO 64 N -3.74 2.89 -0.12 5.31 0.04 -1.25 -4.59 135.00 133.53 1xrs s PRO 64 Ca 0.00 2.06 -0.01 0.00 0.04 0.00 0.00 61.00 63.09 1xrs s PRO 64 Cb 0.00 -2.02 0.03 0.00 0.04 0.00 0.00 34.50 32.55 1xrs s PRO 64 CO 0.00 -1.33 -0.04 0.45 0.04 0.00 0.00 177.00 176.12 1xrs s SER 65 N -1.29 2.17 -1.16 6.66 0.15 0.30 -4.93 113.70 115.60 1xrs s SER 65 Ca 0.77 -0.34 -0.15 0.00 0.70 0.00 0.00 55.95 56.93 1xrs s SER 65 Cb -0.37 -0.71 0.16 0.00 -1.71 0.00 0.00 66.02 63.40 1xrs s SER 65 CO 0.41 -0.17 1.38 -0.69 1.20 0.00 0.00 173.24 175.37 1xrs s VAL 66 N 1.79 4.98 0.39 4.45 1.01 -1.26 0.34 120.40 132.10 1xrs s VAL 66 Ca 0.04 -2.46 0.13 0.00 0.00 0.00 0.00 61.98 59.69 1xrs s VAL 66 Cb -0.13 -4.89 0.35 0.00 0.00 0.00 0.00 36.38 31.71 1xrs s VAL 66 CO -0.07 -1.60 1.88 0.58 0.00 0.00 0.00 175.10 175.88 1xrs h VAL 67 N 4.86 0.78 -3.42 2.92 2.07 -1.74 -3.43 116.25 118.28 1xrs h VAL 67 Ca 0.29 -0.18 -0.16 0.00 0.82 0.00 0.00 66.70 67.46 1xrs h VAL 67 Cb 0.90 0.19 -0.23 0.00 -1.52 0.00 0.00 31.29 30.63 1xrs h VAL 67 CO 1.22 0.10 -0.50 -0.32 0.02 0.00 0.00 177.57 178.09 1xrs s MET 68 N -5.54 0.37 -0.26 1.57 -2.45 -1.11 -5.01 119.30 106.87 1xrs s MET 68 Ca -0.09 -0.12 -0.01 0.00 -1.25 0.00 0.00 55.69 54.22 1xrs s MET 68 Cb 0.22 0.16 0.14 0.00 1.25 0.00 0.00 34.83 36.60 1xrs s MET 68 CO 0.78 -0.08 0.40 1.14 1.05 0.00 0.00 175.02 178.31 1xrs s GLN 69 N -0.75 0.38 0.01 4.11 -2.07 -1.26 -2.14 119.66 117.95 1xrs s GLN 69 Ca -0.08 0.42 0.00 0.00 -1.82 0.00 0.00 55.36 53.88 1xrs s GLN 69 Cb -0.05 -0.37 -0.01 0.00 -1.09 0.00 0.00 33.01 31.48 1xrs s GLN 69 CO 0.01 -0.77 -0.02 1.14 -1.32 0.00 0.00 175.29 174.32 1xrs s GLN 70 N 2.56 0.22 0.12 9.60 -2.07 -0.96 -4.99 119.66 124.14 1xrs s GLN 70 Ca 0.12 -0.38 -0.23 0.00 -1.82 0.00 0.00 55.36 53.06 1xrs s GLN 70 Cb -0.14 0.01 -0.07 0.00 -1.09 0.00 0.00 33.01 31.72 1xrs s GLN 70 CO -0.21 -0.02 0.68 -1.54 -1.32 0.00 0.00 175.29 172.89 1xrs s SER 71 N -0.87 7.24 -0.09 12.60 1.04 -1.26 0.92 113.70 133.27 1xrs s SER 71 Ca -0.09 1.47 0.15 0.00 0.48 0.00 0.00 55.95 57.95 1xrs s SER 71 Cb -0.06 -2.44 -0.24 0.00 0.10 0.00 0.00 66.02 63.39 1xrs s SER 71 CO -0.00 0.23 0.46 0.18 0.98 0.00 0.00 173.24 175.09 1xrs n LEU 72 N 1.71 0.57 -3.98 2.42 4.77 -1.08 -4.87 117.00 116.54 1xrs n LEU 72 Ca -0.08 0.27 -0.09 0.00 -0.03 0.00 0.00 56.01 56.08 1xrs n LEU 72 Cb 0.50 0.28 -0.06 0.00 -2.33 0.00 0.00 43.42 41.81 1xrs n LEU 72 CO 0.44 0.42 0.13 -0.62 -1.33 0.00 0.00 177.39 176.42 1xrs s ASP 73 N -5.86 -0.07 0.61 -1.43 3.68 -1.16 -4.95 116.67 107.49 1xrs s ASP 73 Ca -0.06 -0.90 0.39 0.00 2.13 0.00 0.00 52.55 54.11 1xrs s ASP 73 Cb 0.07 0.54 1.97 0.00 -1.45 0.00 0.00 42.92 44.06 1xrs s ASP 73 CO 0.83 -1.07 2.21 -0.08 0.13 0.00 0.00 175.17 177.19 1xrs h GLU 74 N 2.32 0.00 -0.03 4.34 4.81 -1.97 -1.82 114.58 122.25 1xrs h GLU 74 Ca -0.28 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 1xrs h GLU 74 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 1xrs h GLU 74 CO 0.39 0.01 0.00 0.39 -0.73 0.00 0.00 179.01 179.07 1xrs n GLU 75 N -3.17 1.13 -4.21 1.92 4.71 -1.26 -3.77 120.64 115.98 1xrs n GLU 75 Ca -0.02 -1.42 -0.14 0.00 -0.01 0.00 0.00 57.16 55.57 1xrs n GLU 75 Cb 0.17 -1.29 -0.10 0.00 -1.01 0.00 0.00 31.44 29.20 1xrs n GLU 75 CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 1xrs s PHE 76 N -1.26 1.17 -0.20 -0.32 0.08 -0.68 -2.46 117.98 114.31 1xrs s PHE 76 Ca 0.18 -0.71 -0.14 0.00 0.12 0.00 0.00 56.93 56.38 1xrs s PHE 76 Cb 0.13 -0.62 0.06 0.00 -0.57 0.00 0.00 43.02 42.02 1xrs s PHE 76 CO 0.19 0.04 0.50 0.99 -0.10 0.00 0.00 175.22 176.84 1xrs s THR 77 N -2.90 -0.01 0.25 0.64 2.01 -0.69 -2.62 115.64 112.32 1xrs s THR 77 Ca 0.11 0.04 -0.07 0.00 0.31 0.00 0.00 61.69 62.08 1xrs s THR 77 Cb -0.00 -0.72 -0.06 0.00 0.01 0.00 0.00 72.50 71.73 1xrs s THR 77 CO 0.00 0.02 0.55 0.12 -0.69 0.00 0.00 174.62 174.61 1xrs s PHE 78 N 0.96 3.45 -0.01 4.92 5.36 0.26 -1.17 117.98 131.75 1xrs s PHE 78 Ca -0.06 0.76 -0.03 0.00 -0.96 0.00 0.00 56.93 56.65 1xrs s PHE 78 Cb -0.06 -2.18 0.00 0.00 -0.34 0.00 0.00 43.02 40.44 1xrs s PHE 78 CO -0.08 0.23 0.06 -0.06 -1.46 0.00 0.00 175.22 173.90 1xrs s PHE 79 N -1.94 0.01 -0.04 10.12 0.40 0.26 -2.25 117.98 124.54 1xrs s PHE 79 Ca 0.46 -0.00 0.03 0.00 -0.60 0.00 0.00 56.93 56.81 1xrs s PHE 79 Cb -0.11 -0.03 0.00 0.00 0.51 0.00 0.00 43.02 43.39 1xrs s PHE 79 CO 0.25 -0.10 -0.13 0.08 0.70 0.00 0.00 175.22 176.02 1xrs s VAL 80 N -0.46 1.13 0.04 -0.44 1.01 -0.91 -0.90 120.40 119.87 1xrs s VAL 80 Ca -0.05 -0.53 -0.15 0.00 0.00 0.00 0.00 61.98 61.25 1xrs s VAL 80 Cb -0.03 -0.99 0.02 0.00 0.00 0.00 0.00 36.38 35.38 1xrs s VAL 80 CO 0.00 0.34 0.33 0.68 0.00 0.00 0.00 175.10 176.44 1xrs s VAL 81 N 0.21 0.08 -0.02 2.92 -7.23 0.65 -1.91 120.40 115.09 1xrs s VAL 81 Ca -0.05 -0.63 0.06 0.00 -1.81 0.00 0.00 61.98 59.55 1xrs s VAL 81 Cb -0.11 -0.93 -0.02 0.00 0.56 0.00 0.00 36.38 35.88 1xrs s VAL 81 CO 0.02 -0.35 -0.21 -0.31 -0.31 0.00 0.00 175.10 173.94 1xrs s TYR 82 N -2.50 1.87 0.14 2.82 1.51 0.15 -1.61 117.35 119.74 1xrs s TYR 82 Ca -0.05 -0.37 -0.03 0.00 -1.01 0.00 0.00 57.07 55.61 1xrs s TYR 82 Cb -0.01 -1.21 0.01 0.00 -0.11 0.00 0.00 41.96 40.64 1xrs s TYR 82 CO -0.03 -0.05 0.23 0.41 -1.11 0.00 0.00 175.55 175.01 1xrs n GLY 83 N 2.61 2.26 0.00 0.71 0.00 -1.11 0.11 105.19 109.77 1xrs n GLY 83 Ca -0.15 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.56 1xrs n GLY 83 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xrs n ASN 84 N -1.62 1.79 -4.32 1.61 4.13 -0.61 -0.80 115.26 115.44 1xrs n ASN 84 Ca -0.01 0.00 -0.27 0.00 1.68 0.00 0.00 54.58 55.98 1xrs n ASN 84 Cb 0.22 0.04 -0.14 0.00 -1.54 0.00 0.00 39.78 38.36 1xrs n ASN 84 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 1xrs s GLU 102 N -1.43 1.43 -0.30 3.52 2.56 -1.26 -4.48 118.70 118.74 1xrs s GLU 102 Ca 0.00 -1.14 -0.01 0.00 0.00 0.00 0.00 54.97 53.81 1xrs s GLU 102 Cb 0.00 -1.70 0.05 0.00 2.00 0.00 0.00 34.13 34.49 1xrs s GLU 102 CO 0.00 0.42 -0.00 0.42 -0.56 0.00 0.00 175.26 175.54 1xrs s ILE 103 N -0.95 2.94 1.23 -3.70 1.01 -1.26 -4.97 121.20 115.49 1xrs s ILE 103 Ca 0.10 -1.44 -0.14 0.00 0.00 0.00 0.00 60.65 59.17 1xrs s ILE 103 Cb -0.10 -2.71 0.31 0.00 0.01 0.00 0.00 42.46 39.98 1xrs s ILE 103 CO 0.04 -0.13 0.98 0.18 0.00 0.00 0.00 174.94 176.01 1xrs n LEU 104 N 4.60 -1.83 -4.61 2.97 4.77 -1.26 -5.03 117.00 116.61 1xrs n LEU 104 Ca -0.13 -0.28 -0.27 0.00 -0.03 0.00 0.00 56.01 55.30 1xrs n LEU 104 Cb 0.43 -1.22 -0.10 0.00 -2.33 0.00 0.00 43.42 40.20 1xrs n LEU 104 CO 0.26 -3.51 -0.31 -0.94 -1.33 0.00 0.00 177.39 171.56 1xrs s SER 105 N -2.43 3.89 0.20 -1.43 1.04 -1.26 -4.85 113.70 108.86 1xrs s SER 105 Ca 0.69 -1.28 -0.13 0.00 0.48 0.00 0.00 55.95 55.70 1xrs s SER 105 Cb -0.25 -0.40 0.22 0.00 0.10 0.00 0.00 66.02 65.70 1xrs s SER 105 CO 0.65 -0.38 1.65 -0.03 0.98 0.00 0.00 173.24 176.11 1xrs h MET 106 N 1.82 0.04 -0.36 4.02 4.05 -1.98 0.23 114.93 122.75 1xrs h MET 106 Ca -0.43 -0.00 0.06 0.00 -0.28 0.00 0.00 59.70 59.05 1xrs h MET 106 Cb 1.24 -0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 31.98 1xrs h MET 106 CO 0.77 0.03 0.03 1.05 0.23 0.00 0.00 176.91 179.01 1xrs h GLU 107 N 0.04 0.13 0.35 0.39 4.11 -2.00 -2.52 114.58 115.09 1xrs h GLU 107 Ca 0.28 -0.01 -0.02 0.00 0.07 0.00 0.00 59.36 59.69 1xrs h GLU 107 Cb 0.44 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1xrs h GLU 107 CO -0.55 0.09 -0.17 0.93 0.07 0.00 0.00 179.01 179.38 1xrs h GLU 108 N 0.13 -0.45 -0.41 1.06 5.08 -1.44 -2.62 114.58 115.94 1xrs h GLU 108 Ca 0.17 0.03 0.12 0.00 -1.00 0.00 0.00 59.36 58.68 1xrs h GLU 108 Cb 0.23 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1xrs h GLU 108 CO -0.27 -0.14 0.29 0.00 -1.00 0.00 0.00 179.01 177.89 1xrs h THR 109 N -0.77 0.80 -0.19 1.13 1.03 -0.65 0.47 112.91 114.74 1xrs h THR 109 Ca -0.05 -0.00 -0.13 0.00 -0.01 0.00 0.00 66.41 66.22 1xrs h THR 109 Cb 0.51 0.79 -0.01 0.00 -1.07 0.00 0.00 68.15 68.37 1xrs h THR 109 CO 0.08 0.00 -0.42 0.44 -0.01 0.00 0.00 175.52 175.61 1xrs h ASP 110 N 0.01 0.47 -0.02 0.00 3.32 -1.36 -0.73 116.42 118.11 1xrs h ASP 110 Ca 0.19 -0.21 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 1xrs h ASP 110 Cb 0.76 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.18 1xrs h ASP 110 CO -0.00 0.84 -0.14 -0.33 -1.72 0.00 0.00 179.24 177.88 1xrs h GLU 111 N 0.37 0.14 -0.78 3.56 4.39 0.13 -2.91 114.58 119.48 1xrs h GLU 111 Ca 0.03 -0.11 0.17 0.00 0.34 0.00 0.00 59.36 59.78 1xrs h GLU 111 Cb 0.89 0.02 -0.11 0.00 -0.10 0.00 0.00 28.75 29.46 1xrs h GLU 111 CO 0.08 0.79 0.26 -0.92 -1.16 0.00 0.00 179.01 178.05 1xrs h TYR 112 N -0.48 0.43 -0.55 4.33 3.20 -0.46 0.14 116.97 123.59 1xrs h TYR 112 Ca -0.01 0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.91 1xrs h TYR 112 Cb 0.81 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.98 1xrs h TYR 112 CO 0.15 -0.03 0.35 0.82 -1.64 0.00 0.00 178.16 177.81 1xrs h ILE 113 N 0.35 1.10 -0.11 1.81 2.04 -1.11 0.35 117.51 121.95 1xrs h ILE 113 Ca 0.45 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 66.04 1xrs h ILE 113 Cb 0.76 0.34 -0.00 0.00 -0.74 0.00 0.00 36.82 37.18 1xrs h ILE 113 CO -0.48 0.13 -0.06 0.11 0.00 0.00 0.00 178.15 177.84 1xrs h LYS 114 N 0.70 0.23 0.00 2.37 1.57 -0.60 0.25 116.57 121.09 1xrs h LYS 114 Ca 0.21 -0.11 -0.05 0.00 -1.87 0.00 0.00 60.65 58.83 1xrs h LYS 114 Cb -0.04 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1xrs h LYS 114 CO -0.07 0.59 -0.24 1.05 -0.57 0.00 0.00 179.45 180.21 1xrs h GLU 115 N -0.13 0.00 0.00 3.15 4.11 -1.07 -3.09 114.58 117.54 1xrs h GLU 115 Ca 0.02 0.00 -0.20 0.00 0.07 0.00 0.00 59.36 59.25 1xrs h GLU 115 Cb 0.53 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 1xrs h GLU 115 CO 0.02 0.24 -1.76 0.09 0.07 0.00 0.00 179.01 177.67 1xrs n ASN 116 N -3.26 2.48 -0.06 3.06 3.02 0.11 -4.82 115.26 115.78 1xrs n ASN 116 Ca 0.01 -0.02 -0.07 0.00 -0.03 0.00 0.00 54.58 54.48 1xrs n ASN 116 Cb 0.53 0.50 -0.09 0.00 -0.61 0.00 0.00 39.78 40.11 1xrs n ASN 116 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1xrs n ILE 117 N -2.54 0.82 -1.02 2.41 5.41 0.65 -4.98 119.36 120.11 1xrs n ILE 117 Ca -0.20 -0.46 -0.01 0.00 1.00 0.00 0.00 62.75 63.09 1xrs n ILE 117 Cb 0.83 -0.77 -0.00 0.00 -0.71 0.00 0.00 39.64 38.98 1xrs n ILE 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1xrs n GLY 118 N 2.40 0.44 3.74 7.39 0.00 0.01 -4.99 105.19 114.18 1xrs n GLY 118 Ca -0.21 -0.13 -0.08 0.00 0.00 0.00 0.00 46.02 45.60 1xrs n GLY 118 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1xrs s ARG 119 N -0.76 1.62 0.28 1.61 1.70 -1.26 -5.02 118.95 117.11 1xrs s ARG 119 Ca 0.00 -0.83 -0.29 0.00 -0.47 0.00 0.00 55.73 54.14 1xrs s ARG 119 Cb 0.00 0.59 -0.09 0.00 -0.57 0.00 0.00 34.95 34.88 1xrs s ARG 119 CO 0.00 -0.74 1.02 0.15 -1.08 0.00 0.00 175.30 174.66 1xrs s LYS 120 N -3.84 4.67 0.17 3.89 1.02 -1.26 -4.83 119.74 119.56 1xrs s LYS 120 Ca 0.08 1.63 -0.05 0.00 0.02 0.00 0.00 55.97 57.65 1xrs s LYS 120 Cb -0.04 -3.13 -0.06 0.00 -0.52 0.00 0.00 37.83 34.07 1xrs s LYS 120 CO 0.01 0.30 0.41 0.96 -0.92 0.00 0.00 175.35 176.12 1xrs s ILE 121 N -1.25 5.13 -0.06 2.17 -4.36 -0.79 -4.95 121.20 117.08 1xrs s ILE 121 Ca 0.45 0.06 0.04 0.00 -0.26 0.00 0.00 60.65 60.94 1xrs s ILE 121 Cb -0.28 -3.64 -0.02 0.00 1.25 0.00 0.00 42.46 39.77 1xrs s ILE 121 CO 0.35 -0.02 -0.18 0.68 0.24 0.00 0.00 174.94 176.01 1xrs s VAL 122 N -1.73 2.67 -0.04 8.37 -7.23 -1.26 -1.65 120.40 119.53 1xrs s VAL 122 Ca 0.42 -0.85 0.03 0.00 -1.81 0.00 0.00 61.98 59.77 1xrs s VAL 122 Cb -0.12 -2.03 0.00 0.00 0.56 0.00 0.00 36.38 34.80 1xrs s VAL 122 CO 0.25 0.57 -0.13 0.68 -0.31 0.00 0.00 175.10 176.16 1xrs s VAL 123 N -0.37 1.15 -0.14 1.32 -7.23 -0.43 -0.48 120.40 114.21 1xrs s VAL 123 Ca 0.03 -0.55 0.02 0.00 -1.81 0.00 0.00 61.98 59.68 1xrs s VAL 123 Cb -0.12 -1.01 0.01 0.00 0.56 0.00 0.00 36.38 35.81 1xrs s VAL 123 CO 0.02 0.34 -0.22 -0.69 -0.31 0.00 0.00 175.10 174.25 1xrs s VAL 124 N 0.23 2.05 0.28 1.32 1.01 0.00 -0.30 120.40 124.99 1xrs s VAL 124 Ca -0.06 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 60.98 1xrs s VAL 124 Cb -0.11 -1.81 -0.06 0.00 0.00 0.00 0.00 36.38 34.40 1xrs s VAL 124 CO 0.02 0.55 0.04 -0.83 0.00 0.00 0.00 175.10 174.88 1xrs s GLY 125 N 0.82 1.85 0.00 4.51 0.00 -1.15 0.25 107.32 113.59 1xrs s GLY 125 Ca -0.07 -1.93 0.00 0.00 0.00 0.00 0.00 44.72 42.72 1xrs s GLY 125 CO -0.02 -1.73 0.00 0.00 0.00 0.00 0.00 173.10 171.35 1xrs n ALA 126 N -0.56 0.00 -2.57 3.20 0.00 0.48 -1.86 120.51 119.20 1xrs n ALA 126 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.99 1xrs n ALA 126 Cb 0.66 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.00 1xrs n ALA 126 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1xrs s SER 127 N 0.00 6.00 0.42 0.00 0.01 0.11 -1.87 113.70 118.37 1xrs s SER 127 Ca 0.00 -0.90 -0.08 0.00 1.31 0.00 0.00 55.95 56.29 1xrs s SER 127 Cb 0.00 -2.12 -0.05 0.00 0.21 0.00 0.00 66.02 64.06 1xrs s SER 127 CO 0.00 -0.42 0.75 0.42 0.41 0.00 0.00 173.24 174.40 1xrs s THR 128 N 1.65 4.86 0.00 1.44 -4.23 -1.22 -1.47 115.64 116.67 1xrs s THR 128 Ca 0.04 0.38 0.00 0.00 -1.18 0.00 0.00 61.69 60.93 1xrs s THR 128 Cb -0.19 -3.79 0.00 0.00 1.34 0.00 0.00 72.50 69.86 1xrs s THR 128 CO 0.09 -0.63 0.00 0.61 -0.54 0.00 0.00 174.62 174.15 1xrs n GLY 129 N -1.64 0.33 0.41 3.99 0.00 0.31 -3.59 105.19 105.00 1xrs n GLY 129 Ca 0.01 -0.80 0.12 0.00 0.00 0.00 0.00 46.02 45.35 1xrs n GLY 129 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xrs n THR 130 N 0.00 0.00 -2.15 2.61 -1.04 -1.26 -3.04 114.28 109.40 1xrs n THR 130 Ca 0.00 -0.21 -0.43 0.00 -2.04 0.00 0.00 64.05 61.37 1xrs n THR 130 Cb 0.00 0.81 -0.02 0.00 -1.82 0.00 0.00 70.33 69.29 1xrs n THR 130 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1xrs s ASP 131 N -2.41 6.08 0.00 8.00 3.68 -1.24 -4.75 116.67 126.03 1xrs s ASP 131 Ca 0.24 1.08 0.19 0.00 2.13 0.00 0.00 52.55 56.18 1xrs s ASP 131 Cb 0.19 -2.53 0.98 0.00 -1.45 0.00 0.00 42.92 40.11 1xrs s ASP 131 CO 0.51 -1.60 1.65 0.00 0.13 0.00 0.00 175.17 175.86 1xrs n ALA 132 N 9.68 2.58 -2.59 3.66 0.00 -1.26 -2.59 120.51 129.99 1xrs n ALA 132 Ca 0.20 -0.24 -0.43 0.00 0.00 0.00 0.00 53.44 52.97 1xrs n ALA 132 Cb 0.47 -1.23 -0.02 0.00 0.00 0.00 0.00 19.45 18.67 1xrs n ALA 132 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1xrs s HIS 133 N -1.93 3.31 0.00 0.00 3.76 -1.26 -4.88 115.29 114.28 1xrs s HIS 133 Ca 0.29 1.39 0.00 0.00 -0.15 0.00 0.00 55.06 56.59 1xrs s HIS 133 Cb 0.14 -3.31 0.00 0.00 1.11 0.00 0.00 32.58 30.52 1xrs s HIS 133 CO 0.23 -0.75 0.00 0.25 -0.85 0.00 0.00 174.74 173.61 1xrs n THR 134 N 4.84 0.00 -0.29 1.30 -2.24 -1.26 -4.77 114.28 111.85 1xrs n THR 134 Ca 0.11 -0.05 0.08 0.00 -2.27 0.00 0.00 64.05 61.92 1xrs n THR 134 Cb 0.47 0.42 0.20 0.00 -2.10 0.00 0.00 70.33 69.32 1xrs n THR 134 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1xrs h VAL 135 N 0.00 0.22 0.17 2.28 2.07 -1.98 -0.18 116.25 118.84 1xrs h VAL 135 Ca 0.00 -0.03 0.01 0.00 0.82 0.00 0.00 66.70 67.50 1xrs h VAL 135 Cb 0.00 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 29.87 1xrs h VAL 135 CO 0.00 0.01 -0.50 1.23 0.02 0.00 0.00 177.57 178.34 1xrs h GLY 136 N 0.08 -1.09 2.00 2.17 0.00 -2.00 0.21 103.07 104.44 1xrs h GLY 136 Ca 0.48 0.60 -0.02 0.00 0.00 0.00 0.00 47.33 48.39 1xrs h GLY 136 CO -0.77 -0.28 -0.09 1.19 0.00 0.00 0.00 176.54 176.59 1xrs h ILE 137 N -0.77 0.96 0.00 2.60 6.09 -1.68 0.03 117.51 124.74 1xrs h ILE 137 Ca -0.01 -0.32 -0.08 0.00 -1.37 0.00 0.00 64.86 63.08 1xrs h ILE 137 Cb 0.76 1.18 -0.01 0.00 0.47 0.00 0.00 36.82 39.22 1xrs h ILE 137 CO -0.25 0.09 -0.38 0.44 -3.07 0.00 0.00 178.15 174.99 1xrs h ASP 138 N 0.00 0.00 0.50 2.19 3.45 -0.03 0.98 116.42 123.52 1xrs h ASP 138 Ca -0.00 0.00 -0.09 0.00 0.43 0.00 0.00 57.03 57.37 1xrs h ASP 138 Cb 0.17 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.93 1xrs h ASP 138 CO 0.01 0.38 -0.41 0.00 -1.57 0.00 0.00 179.24 177.65 1xrs h ALA 139 N 1.62 1.22 0.01 3.45 0.00 0.14 -1.49 119.26 124.21 1xrs h ALA 139 Ca -0.00 -0.37 -0.35 0.00 0.00 0.00 0.00 54.91 54.18 1xrs h ALA 139 Cb 0.80 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.46 1xrs h ALA 139 CO 0.05 0.51 -2.22 -0.89 0.00 0.00 0.00 179.25 176.70 1xrs n ILE 140 N -3.90 1.47 -0.06 0.00 -0.00 -1.00 -2.87 119.36 113.01 1xrs n ILE 140 Ca -0.01 -0.80 -0.11 0.00 -0.00 0.00 0.00 62.75 61.83 1xrs n ILE 140 Cb 0.46 -0.76 -0.15 0.00 -0.00 0.00 0.00 39.64 39.19 1xrs n ILE 140 CO 0.00 0.00 0.00 0.23 -0.00 0.00 0.00 176.55 176.78 1xrs n MET 141 N -2.91 0.67 -1.71 0.38 2.81 0.31 0.18 117.12 116.83 1xrs n MET 141 Ca -0.31 0.16 -0.38 0.00 -1.81 0.00 0.00 57.70 55.37 1xrs n MET 141 Cb 1.11 -1.66 0.06 0.00 -0.71 0.00 0.00 33.22 32.02 1xrs n MET 141 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1xrs n ASN 142 N -2.97 2.04 -0.08 7.83 5.03 -0.56 -2.27 115.26 124.28 1xrs n ASN 142 Ca -0.26 0.87 -0.08 0.00 0.87 0.00 0.00 54.58 55.98 1xrs n ASN 142 Cb 1.09 -1.54 -0.01 0.00 -1.02 0.00 0.00 39.78 38.30 1xrs n ASN 142 CO 0.00 0.00 0.00 -0.03 -1.83 0.00 0.00 177.26 175.40 1xrs h MET 143 N 0.77 -0.23 0.00 3.52 -1.53 -1.88 0.15 114.93 115.73 1xrs h MET 143 Ca -0.50 0.02 0.00 0.00 -3.44 0.00 0.00 59.70 55.77 1xrs h MET 143 Cb 1.33 0.05 0.00 0.00 -0.55 0.00 0.00 31.60 32.44 1xrs h MET 143 CO 0.54 -0.15 0.00 -0.22 0.14 0.00 0.00 176.91 177.21 1xrs h LYS 144 N -0.24 0.00 0.00 0.39 1.63 -1.92 -3.16 116.57 113.27 1xrs h LYS 144 Ca 0.16 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.96 1xrs h LYS 144 Cb 0.49 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.12 1xrs h LYS 144 CO -0.45 0.00 0.00 0.41 -3.45 0.00 0.00 179.45 175.96 1xrs n GLY 145 N -0.33 1.98 2.97 5.01 0.00 0.34 -4.49 105.19 110.67 1xrs n GLY 145 Ca -0.00 -0.48 -0.12 0.00 0.00 0.00 0.00 46.02 45.41 1xrs n GLY 145 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1xrs s TYR 146 N 0.00 -0.06 -1.31 1.61 5.04 0.16 -4.64 117.35 118.15 1xrs s TYR 146 Ca 0.00 0.15 -0.10 0.00 -2.44 0.00 0.00 57.07 54.68 1xrs s TYR 146 Cb 0.00 0.01 0.10 0.00 0.35 0.00 0.00 41.96 42.42 1xrs s TYR 146 CO 0.00 -0.07 0.25 0.00 -1.34 0.00 0.00 175.55 174.40 1xrs n ALA 147 N 2.86 -1.29 0.00 3.97 0.00 -1.26 0.15 120.51 124.95 1xrs n ALA 147 Ca -0.14 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.08 1xrs n ALA 147 Cb 0.59 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.72 1xrs n ALA 147 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xrs n GLY 148 N -1.49 3.01 3.57 0.00 0.00 -1.26 -5.02 105.19 104.00 1xrs n GLY 148 Ca -0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 1xrs n GLY 148 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1xrs s HIS 149 N -2.58 2.90 0.41 1.61 3.76 0.12 -5.01 115.29 116.51 1xrs s HIS 149 Ca 0.00 0.39 -0.26 0.00 -0.15 0.00 0.00 55.06 55.05 1xrs s HIS 149 Cb 0.00 -4.02 -0.08 0.00 1.11 0.00 0.00 32.58 29.59 1xrs s HIS 149 CO 0.00 -1.13 1.28 0.71 -0.85 0.00 0.00 174.74 174.75 1xrs s TYR 150 N 3.83 2.84 1.01 1.40 2.02 -1.26 -0.66 117.35 126.52 1xrs s TYR 150 Ca 0.38 1.44 -0.12 0.00 -0.37 0.00 0.00 57.07 58.39 1xrs s TYR 150 Cb -0.10 -3.62 0.20 0.00 -0.40 0.00 0.00 41.96 38.04 1xrs s TYR 150 CO 0.27 -1.98 1.08 0.20 -1.57 0.00 0.00 175.55 173.55 1xrs s GLY 151 N -0.83 1.57 0.48 0.71 0.00 -0.11 -4.59 107.32 104.56 1xrs s GLY 151 Ca 0.58 -0.26 0.17 0.00 0.00 0.00 0.00 44.72 45.20 1xrs s GLY 151 CO 0.47 0.35 2.06 1.41 0.00 0.00 0.00 173.10 177.39 1xrs h LEU 152 N -1.97 0.00 -0.11 0.66 3.38 -0.28 -1.70 115.31 115.29 1xrs h LEU 152 Ca -0.55 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.42 1xrs h LEU 152 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1xrs h LEU 152 CO 0.56 0.11 0.00 -1.84 0.09 0.00 0.00 178.44 177.36 1xrs n GLU 153 N -4.32 0.03 0.03 1.13 0.28 -0.96 -1.63 120.64 115.20 1xrs n GLU 153 Ca -0.03 0.26 0.12 0.00 -0.16 0.00 0.00 57.16 57.36 1xrs n GLU 153 Cb 0.19 -1.56 0.29 0.00 1.43 0.00 0.00 31.44 31.79 1xrs n GLU 153 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 1xrs n ARG 154 N -1.62 0.12 -2.90 3.44 3.00 -0.64 -4.86 116.66 113.20 1xrs n ARG 154 Ca 0.03 0.04 -0.37 0.00 -0.00 0.00 0.00 57.85 57.55 1xrs n ARG 154 Cb 0.19 -1.58 -0.06 0.00 0.00 0.00 0.00 32.46 31.01 1xrs n ARG 154 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 1xrs s TYR 155 N -3.06 3.74 0.04 -0.14 1.51 -0.65 -5.00 117.35 113.79 1xrs s TYR 155 Ca 0.10 1.66 -0.20 0.00 -1.01 0.00 0.00 57.07 57.62 1xrs s TYR 155 Cb 0.16 -2.82 -0.14 0.00 -0.11 0.00 0.00 41.96 39.06 1xrs s TYR 155 CO 0.67 0.31 1.37 1.49 -1.11 0.00 0.00 175.55 178.28 1xrs h GLU 156 N 3.48 0.35 -0.97 -0.62 4.81 -1.89 -3.23 114.58 116.52 1xrs h GLU 156 Ca -0.47 -0.17 -0.29 0.00 -0.13 0.00 0.00 59.36 58.30 1xrs h GLU 156 Cb 1.19 -0.00 -0.17 0.00 0.63 0.00 0.00 28.75 30.40 1xrs h GLU 156 CO 0.65 0.71 0.37 -1.33 -0.73 0.00 0.00 179.01 178.68 1xrs n MET 157 N -4.58 1.98 -3.75 1.92 2.81 -1.26 -4.84 117.12 109.40 1xrs n MET 157 Ca -0.06 -1.90 -0.14 0.00 -1.81 0.00 0.00 57.70 53.79 1xrs n MET 157 Cb 0.34 -1.77 -0.14 0.00 -0.71 0.00 0.00 33.22 30.94 1xrs n MET 157 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1xrs s ILE 158 N -2.08 -0.05 -0.46 2.02 1.01 -1.22 -1.89 121.20 118.54 1xrs s ILE 158 Ca 0.36 0.17 -0.10 0.00 0.00 0.00 0.00 60.65 61.08 1xrs s ILE 158 Cb 0.30 -0.24 0.11 0.00 0.01 0.00 0.00 42.46 42.63 1xrs s ILE 158 CO 0.07 0.07 0.34 -1.81 0.00 0.00 0.00 174.94 173.61 1xrs s ASP 159 N 1.14 5.75 -0.18 3.58 -0.00 -0.66 -4.63 116.67 121.68 1xrs s ASP 159 Ca -0.09 -1.76 -0.14 0.00 -0.00 0.00 0.00 52.55 50.57 1xrs s ASP 159 Cb -0.11 -2.03 -0.05 0.00 -0.00 0.00 0.00 42.92 40.73 1xrs s ASP 159 CO -0.06 -0.66 0.29 0.00 -0.00 0.00 0.00 175.17 174.73 1xrs s ALA 160 N 1.42 3.59 -0.54 5.23 0.00 -1.26 -1.32 121.76 128.89 1xrs s ALA 160 Ca 0.05 -0.53 -0.03 0.00 0.00 0.00 0.00 51.96 51.44 1xrs s ALA 160 Cb -0.26 -2.41 0.14 0.00 0.00 0.00 0.00 23.12 20.59 1xrs s ALA 160 CO 0.01 -0.01 0.34 0.71 0.00 0.00 0.00 175.76 176.81 1xrs s TYR 161 N 0.69 3.48 -0.40 0.00 1.51 0.59 -4.84 117.35 118.38 1xrs s TYR 161 Ca 0.15 -2.59 -0.29 0.00 -1.01 0.00 0.00 57.07 53.33 1xrs s TYR 161 Cb -0.13 -3.21 0.02 0.00 -0.11 0.00 0.00 41.96 38.53 1xrs s TYR 161 CO 0.04 -0.89 1.13 1.21 -1.11 0.00 0.00 175.55 175.93 1xrs s ASN 162 N 1.15 6.76 0.00 2.29 3.84 -1.26 -2.94 114.94 124.78 1xrs s ASN 162 Ca 0.13 0.78 0.22 0.00 0.21 0.00 0.00 52.86 54.20 1xrs s ASN 162 Cb -0.21 -2.55 0.73 0.00 -0.55 0.00 0.00 41.25 38.67 1xrs s ASN 162 CO -0.04 -1.08 1.54 0.18 -2.79 0.00 0.00 177.10 174.92 1xrs n LEU 163 N 7.43 1.89 0.00 3.21 4.32 -0.78 -5.01 117.00 128.06 1xrs n LEU 163 Ca 0.12 -0.77 0.00 0.00 -0.02 0.00 0.00 56.01 55.34 1xrs n LEU 163 Cb 0.48 -0.11 0.00 0.00 -1.62 0.00 0.00 43.42 42.17 1xrs n LEU 163 CO 0.66 0.39 0.00 0.61 -1.22 0.00 0.00 177.39 177.82 1xrs n GLY 164 N 1.18 0.06 3.91 -0.72 0.00 -1.26 -4.89 105.19 103.47 1xrs n GLY 164 Ca 0.17 -0.96 -0.28 0.00 0.00 0.00 0.00 46.02 44.95 1xrs n GLY 164 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xrs s SER 165 N -4.00 5.52 -1.28 1.61 1.04 -1.26 -0.71 113.70 114.61 1xrs s SER 165 Ca 0.00 0.83 -0.22 0.00 0.48 0.00 0.00 55.95 57.04 1xrs s SER 165 Cb 0.00 -1.75 0.02 0.00 0.10 0.00 0.00 66.02 64.39 1xrs s SER 165 CO 0.00 -1.17 0.55 0.00 0.98 0.00 0.00 173.24 173.60 1xrs n GLN 166 N -2.72 -0.87 -3.60 4.02 6.02 -0.54 -4.84 117.38 114.84 1xrs n GLN 166 Ca 0.05 0.18 -0.39 0.00 -0.01 0.00 0.00 57.00 56.83 1xrs n GLN 166 Cb 0.58 -3.23 -0.11 0.00 1.02 0.00 0.00 30.24 28.49 1xrs n GLN 166 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1xrs s VAL 167 N -3.72 4.91 0.24 5.09 1.01 -0.64 -4.67 120.40 122.62 1xrs s VAL 167 Ca 0.35 -0.30 -0.31 0.00 0.00 0.00 0.00 61.98 61.71 1xrs s VAL 167 Cb -0.17 -3.50 -0.12 0.00 0.00 0.00 0.00 36.38 32.58 1xrs s VAL 167 CO 0.95 0.05 1.64 0.00 0.00 0.00 0.00 175.10 177.74 1xrs n ALA 168 N 5.04 2.45 -0.34 5.51 0.00 -1.26 -0.53 120.51 131.38 1xrs n ALA 168 Ca -0.13 0.40 0.21 0.00 0.00 0.00 0.00 53.44 53.91 1xrs n ALA 168 Cb 0.50 -2.47 0.44 0.00 0.00 0.00 0.00 19.45 17.92 1xrs n ALA 168 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1xrs h ASN 169 N 5.76 0.58 -0.13 0.00 -0.26 -1.95 0.50 115.58 120.08 1xrs h ASN 169 Ca -0.45 0.16 -0.02 0.00 -0.56 0.00 0.00 56.30 55.43 1xrs h ASN 169 Cb 1.22 0.08 -0.01 0.00 -1.06 0.00 0.00 38.32 38.55 1xrs h ASN 169 CO 0.87 -0.01 0.04 -0.33 -1.06 0.00 0.00 177.43 176.95 1xrs h GLU 170 N 0.44 0.26 0.12 0.81 3.07 -2.00 -1.45 114.58 115.85 1xrs h GLU 170 Ca 0.69 -0.03 -0.17 0.00 -0.50 0.00 0.00 59.36 59.34 1xrs h GLU 170 Cb 1.48 -0.05 0.02 0.00 -0.84 0.00 0.00 28.75 29.35 1xrs h GLU 170 CO -0.52 0.26 -0.79 -0.44 -1.40 0.00 0.00 179.01 176.12 1xrs h ASP 171 N 0.27 0.41 -0.45 1.42 3.45 -0.44 -2.96 116.42 118.11 1xrs h ASP 171 Ca 0.07 -0.95 0.09 0.00 0.43 0.00 0.00 57.03 56.67 1xrs h ASP 171 Cb 0.12 -0.13 -0.10 0.00 -0.56 0.00 0.00 39.33 38.66 1xrs h ASP 171 CO -0.00 1.37 -0.30 0.15 -1.57 0.00 0.00 179.24 178.89 1xrs h PHE 172 N -0.44 -0.80 -0.75 4.55 3.57 -0.69 0.13 116.94 122.52 1xrs h PHE 172 Ca -0.14 0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.38 1xrs h PHE 172 Cb 1.58 0.42 -0.03 0.00 2.79 0.00 0.00 35.95 40.71 1xrs h PHE 172 CO 0.20 -0.36 0.34 0.82 -2.23 0.00 0.00 178.31 177.08 1xrs h ILE 173 N -0.20 1.25 -0.40 1.41 2.04 -1.39 0.79 117.51 121.01 1xrs h ILE 173 Ca 0.20 -0.72 0.04 0.00 1.00 0.00 0.00 64.86 65.37 1xrs h ILE 173 Cb 0.52 0.33 -0.04 0.00 -0.74 0.00 0.00 36.82 36.90 1xrs h ILE 173 CO -0.57 0.30 0.18 0.11 0.00 0.00 0.00 178.15 178.17 1xrs h LYS 174 N 1.06 0.36 -0.17 2.37 1.57 -1.04 -1.42 116.57 119.29 1xrs h LYS 174 Ca 0.25 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.94 1xrs h LYS 174 Cb 0.15 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1xrs h LYS 174 CO -0.03 0.24 -0.23 0.87 -0.57 0.00 0.00 179.45 179.73 1xrs h LYS 175 N 0.37 0.31 -0.26 3.15 1.79 -0.10 -2.39 116.57 119.44 1xrs h LYS 175 Ca 0.18 -0.10 -0.07 0.00 -2.18 0.00 0.00 60.65 58.48 1xrs h LYS 175 Cb 0.11 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.73 1xrs h LYS 175 CO -0.14 0.53 -0.10 0.00 -1.08 0.00 0.00 179.45 178.65 1xrs h ALA 176 N 1.48 0.36 -0.21 3.86 0.00 -0.37 -2.41 119.26 121.98 1xrs h ALA 176 Ca 0.05 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1xrs h ALA 176 Cb 0.57 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1xrs h ALA 176 CO 0.04 0.20 0.08 0.28 0.00 0.00 0.00 179.25 179.85 1xrs h VAL 177 N 0.25 1.09 0.12 0.00 2.07 -1.12 -0.70 116.25 117.97 1xrs h VAL 177 Ca 0.06 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 1xrs h VAL 177 Cb 0.59 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1xrs h VAL 177 CO 0.03 0.11 -0.06 -0.08 0.02 0.00 0.00 177.57 177.59 1xrs h GLU 178 N 0.29 -0.16 -0.31 1.57 4.81 -1.21 -3.04 114.58 116.54 1xrs h GLU 178 Ca 0.08 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1xrs h GLU 178 Cb 0.08 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.49 1xrs h GLU 178 CO -0.01 -0.10 0.00 1.28 -0.73 0.00 0.00 179.01 179.45 1xrs n LEU 179 N -2.72 0.31 -3.69 1.64 4.77 -0.93 -4.82 117.00 111.56 1xrs n LEU 179 Ca -0.02 -0.16 -0.26 0.00 -0.03 0.00 0.00 56.01 55.55 1xrs n LEU 179 Cb 0.06 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1xrs n LEU 179 CO 0.05 0.08 -0.19 -0.62 -1.33 0.00 0.00 177.39 175.38 1xrs n GLU 180 N 0.04 -0.98 -1.87 3.23 1.02 -0.85 -4.87 120.64 116.35 1xrs n GLU 180 Ca 0.00 0.40 -0.33 0.00 -0.02 0.00 0.00 57.16 57.20 1xrs n GLU 180 Cb 0.08 -1.77 0.03 0.00 -0.02 0.00 0.00 31.44 29.76 1xrs n GLU 180 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xrs s ALA 181 N -3.10 2.55 -0.10 0.62 0.00 -0.33 -4.76 121.76 116.64 1xrs s ALA 181 Ca 0.12 0.56 0.08 0.00 0.00 0.00 0.00 51.96 52.72 1xrs s ALA 181 Cb -0.07 -3.31 -0.12 0.00 0.00 0.00 0.00 23.12 19.63 1xrs s ALA 181 CO 0.74 -1.13 0.02 -0.25 0.00 0.00 0.00 175.76 175.14 1xrs n ASP 182 N -2.20 2.63 -3.96 0.00 9.92 0.36 -4.85 116.55 118.45 1xrs n ASP 182 Ca 0.10 -0.01 -0.24 0.00 -0.53 0.00 0.00 54.79 54.12 1xrs n ASP 182 Cb 0.52 0.64 -0.17 0.00 -0.64 0.00 0.00 41.12 41.47 1xrs n ASP 182 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1xrs s VAL 183 N -2.24 0.94 -0.13 2.53 1.01 -0.84 -2.06 120.40 119.62 1xrs s VAL 183 Ca -0.06 -0.34 -0.04 0.00 0.00 0.00 0.00 61.98 61.54 1xrs s VAL 183 Cb 0.03 -0.90 -0.03 0.00 0.00 0.00 0.00 36.38 35.47 1xrs s VAL 183 CO 0.39 0.32 0.02 -0.76 0.00 0.00 0.00 175.10 175.07 1xrs s LEU 184 N 0.96 3.63 -0.18 3.92 1.02 -0.56 -0.82 118.68 126.64 1xrs s LEU 184 Ca -0.10 0.10 0.01 0.00 0.02 0.00 0.00 54.13 54.16 1xrs s LEU 184 Cb -0.15 -1.86 0.04 0.00 0.02 0.00 0.00 46.19 44.23 1xrs s LEU 184 CO 0.00 0.29 -0.11 -0.76 0.02 0.00 0.00 176.35 175.79 1xrs s LEU 185 N -0.33 2.04 -0.13 1.79 1.43 0.14 -1.73 118.68 121.89 1xrs s LEU 185 Ca 0.07 -0.75 0.01 0.00 -1.03 0.00 0.00 54.13 52.44 1xrs s LEU 185 Cb -0.12 -1.18 -0.01 0.00 0.03 0.00 0.00 46.19 44.91 1xrs s LEU 185 CO 0.02 -0.12 -0.17 0.54 0.23 0.00 0.00 176.35 176.85 1xrs s VAL 186 N 1.45 2.65 -0.10 -1.59 0.11 -0.50 -0.39 120.40 122.03 1xrs s VAL 186 Ca 0.01 -0.79 -0.00 0.00 -2.93 0.00 0.00 61.98 58.26 1xrs s VAL 186 Cb -0.15 -2.09 -0.03 0.00 -1.53 0.00 0.00 36.38 32.58 1xrs s VAL 186 CO -0.09 0.53 -0.07 -0.55 -3.33 0.00 0.00 175.10 171.59 1xrs s SER 187 N 0.53 4.58 -0.01 3.54 0.15 -0.78 -2.49 113.70 119.21 1xrs s SER 187 Ca -0.11 -0.09 0.01 0.00 0.70 0.00 0.00 55.95 56.46 1xrs s SER 187 Cb -0.16 -1.37 0.00 0.00 -1.71 0.00 0.00 66.02 62.78 1xrs s SER 187 CO 0.04 0.29 -0.04 -1.10 1.20 0.00 0.00 173.24 173.63 1xrs s GLN 188 N -0.36 0.40 0.00 5.44 -1.52 -0.77 -3.45 119.66 119.40 1xrs s GLN 188 Ca 0.05 -0.12 0.00 0.00 -1.95 0.00 0.00 55.36 53.34 1xrs s GLN 188 Cb -0.12 -0.42 0.00 0.00 -0.22 0.00 0.00 33.01 32.25 1xrs s GLN 188 CO 0.02 0.05 0.00 2.41 -0.25 0.00 0.00 175.29 177.52 1xrs n THR 189 N 3.24 0.00 -2.29 -0.19 -1.04 -1.26 -4.11 114.28 108.63 1xrs n THR 189 Ca -0.16 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.43 1xrs n THR 189 Cb 0.56 -1.06 -0.03 0.00 -1.82 0.00 0.00 70.33 67.99 1xrs n THR 189 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1xrs s VAL 190 N -1.97 3.80 -1.27 12.58 1.01 -1.26 -4.68 120.40 128.62 1xrs s VAL 190 Ca 0.00 1.21 0.11 0.00 0.00 0.00 0.00 61.98 63.30 1xrs s VAL 190 Cb 0.00 -3.78 0.06 0.00 0.00 0.00 0.00 36.38 32.66 1xrs s VAL 190 CO 0.00 0.02 0.79 0.35 0.00 0.00 0.00 175.10 176.27 1xrs n THR 191 N 4.47 0.00 0.00 3.92 -2.24 -1.26 -4.01 114.28 115.15 1xrs n THR 191 Ca 0.12 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 1xrs n THR 191 Cb 0.44 1.20 0.00 0.00 -2.10 0.00 0.00 70.33 69.87 1xrs n THR 191 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xrs n GLN 192 N 0.36 0.00 -1.57 -0.78 10.64 -1.26 0.51 117.38 125.28 1xrs n GLN 192 Ca 0.06 0.00 -0.34 0.00 -1.83 0.00 0.00 57.00 54.89 1xrs n GLN 192 Cb 0.26 0.00 0.06 0.00 -0.86 0.00 0.00 30.24 29.71 1xrs n GLN 192 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 1xrs n LYS 193 N 0.00 2.85 -2.07 2.61 5.02 -1.26 -4.74 118.16 120.56 1xrs n LYS 193 Ca 0.00 -3.49 -0.16 0.00 -2.02 0.00 0.00 58.31 52.65 1xrs n LYS 193 Cb 0.00 -2.28 -0.02 0.00 -0.02 0.00 0.00 35.03 32.70 1xrs n LYS 193 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1xrs n ASN 194 N -0.81 -4.77 0.21 4.39 5.03 0.18 -4.86 115.26 114.64 1xrs n ASN 194 Ca 0.58 0.10 0.15 0.00 0.87 0.00 0.00 54.58 56.28 1xrs n ASN 194 Cb 0.62 -3.83 0.78 0.00 -1.02 0.00 0.00 39.78 36.34 1xrs n ASN 194 CO 0.00 0.00 0.00 1.62 -1.83 0.00 0.00 177.26 177.05 1xrs h VAL 195 N 0.00 0.64 -0.09 2.41 3.04 -1.83 0.00 116.25 120.42 1xrs h VAL 195 Ca -0.36 0.00 -0.13 0.00 -1.01 0.00 0.00 66.70 65.20 1xrs h VAL 195 Cb 1.21 0.89 0.01 0.00 -2.01 0.00 0.00 31.29 31.39 1xrs h VAL 195 CO 0.45 0.00 -0.46 1.12 -1.01 0.00 0.00 177.57 177.67 1xrs h HIS 196 N 0.00 0.64 -0.70 3.17 2.07 -1.85 0.10 115.15 118.58 1xrs h HIS 196 Ca 0.07 -0.28 -0.06 0.00 -2.85 0.00 0.00 60.37 57.25 1xrs h HIS 196 Cb 0.36 -0.10 -0.03 0.00 2.57 0.00 0.00 27.41 30.21 1xrs h HIS 196 CO 0.00 1.05 0.19 0.82 -3.07 0.00 0.00 177.93 176.92 1xrs h ILE 197 N 0.05 1.26 0.07 6.12 2.04 -1.43 0.14 117.51 125.76 1xrs h ILE 197 Ca -0.03 -0.93 -0.00 0.00 1.00 0.00 0.00 64.86 64.89 1xrs h ILE 197 Cb 1.11 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 37.71 1xrs h ILE 197 CO 0.10 0.36 -0.03 1.56 0.00 0.00 0.00 178.15 180.13 1xrs h GLN 198 N 1.05 -0.09 -0.36 2.37 4.20 -1.02 -1.13 115.11 120.12 1xrs h GLN 198 Ca 0.22 0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.96 1xrs h GLN 198 Cb 0.34 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.11 1xrs h GLN 198 CO -0.00 0.10 0.20 -0.97 -0.67 0.00 0.00 178.83 177.48 1xrs h ASN 199 N -0.26 0.31 -0.19 1.46 -1.24 -0.42 -0.34 115.58 114.89 1xrs h ASN 199 Ca -0.01 0.01 -0.07 0.00 0.71 0.00 0.00 56.30 56.94 1xrs h ASN 199 Cb 0.23 -0.05 -0.02 0.00 0.73 0.00 0.00 38.32 39.21 1xrs h ASN 199 CO 0.02 0.22 -0.11 0.24 -1.29 0.00 0.00 177.43 176.51 1xrs h MET 200 N 0.40 0.55 -0.60 6.67 2.86 -0.71 -1.82 114.93 122.29 1xrs h MET 200 Ca 0.15 -0.16 -0.09 0.00 -2.06 0.00 0.00 59.70 57.54 1xrs h MET 200 Cb 0.03 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.61 1xrs h MET 200 CO -0.08 0.66 0.04 1.15 1.06 0.00 0.00 176.91 179.73 1xrs h THR 201 N 0.51 1.26 -0.59 2.22 2.02 -0.76 -2.74 112.91 114.84 1xrs h THR 201 Ca 0.09 -1.08 -0.06 0.00 0.77 0.00 0.00 66.41 66.13 1xrs h THR 201 Cb 0.50 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 1xrs h THR 201 CO 0.03 0.40 0.13 -0.74 0.37 0.00 0.00 175.52 175.70 1xrs h HIS 202 N 0.94 1.00 -0.61 3.16 6.17 -0.48 -2.27 115.15 123.06 1xrs h HIS 202 Ca 0.18 -0.12 0.00 0.00 0.71 0.00 0.00 60.37 61.14 1xrs h HIS 202 Cb 0.49 -0.28 -0.03 0.00 2.52 0.00 0.00 27.41 30.11 1xrs h HIS 202 CO 0.03 0.85 0.39 1.25 0.71 0.00 0.00 177.93 181.17 1xrs h LEU 203 N 0.85 0.71 -0.15 0.26 7.12 -1.20 -0.11 115.31 122.79 1xrs h LEU 203 Ca 0.18 -0.02 -0.03 0.00 0.13 0.00 0.00 57.88 58.14 1xrs h LEU 203 Cb 0.37 -0.18 -0.00 0.00 -0.53 0.00 0.00 40.66 40.32 1xrs h LEU 203 CO 0.00 0.52 -0.03 0.40 -0.13 0.00 0.00 178.44 179.21 1xrs h ILE 204 N 0.83 1.28 -0.20 4.05 1.08 -1.16 -1.83 117.51 121.56 1xrs h ILE 204 Ca 0.22 -0.95 0.04 0.00 -0.39 0.00 0.00 64.86 63.79 1xrs h ILE 204 Cb -0.08 1.61 -0.04 0.00 -3.07 0.00 0.00 36.82 35.24 1xrs h ILE 204 CO -0.05 0.28 -0.06 -0.33 -0.69 0.00 0.00 178.15 177.31 1xrs h GLU 205 N -0.02 -0.01 0.03 2.37 5.08 -0.85 -0.17 114.58 121.02 1xrs h GLU 205 Ca 0.04 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.42 1xrs h GLU 205 Cb 0.44 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.64 1xrs h GLU 205 CO 0.01 -0.01 -0.53 -0.07 -1.00 0.00 0.00 179.01 177.41 1xrs h LEU 206 N -0.01 -1.63 -0.52 1.33 3.38 -1.00 0.41 115.31 117.26 1xrs h LEU 206 Ca 0.10 0.18 0.11 0.00 0.09 0.00 0.00 57.88 58.35 1xrs h LEU 206 Cb 0.16 0.62 -0.10 0.00 0.09 0.00 0.00 40.66 41.42 1xrs h LEU 206 CO -0.21 -0.53 -0.16 -0.07 0.09 0.00 0.00 178.44 177.55 1xrs h LEU 207 N -0.70 -0.59 -0.54 1.67 -0.00 -0.98 -2.54 115.31 111.64 1xrs h LEU 207 Ca 0.01 0.17 -0.13 0.00 -0.00 0.00 0.00 57.88 57.93 1xrs h LEU 207 Cb 0.73 0.36 -0.01 0.00 -0.00 0.00 0.00 40.66 41.74 1xrs h LEU 207 CO -0.34 -0.20 -0.24 -0.33 -0.00 0.00 0.00 178.44 177.33 1xrs h GLU 208 N -0.04 0.93 -0.86 1.13 5.08 -0.40 0.27 114.58 120.69 1xrs h GLU 208 Ca 0.25 -0.40 0.08 0.00 -1.00 0.00 0.00 59.36 58.29 1xrs h GLU 208 Cb 0.42 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.58 1xrs h GLU 208 CO -0.56 1.06 0.56 0.00 -1.00 0.00 0.00 179.01 179.07 1xrs h ALA 209 N 0.92 1.62 -0.10 3.43 0.00 0.21 0.29 119.26 125.63 1xrs h ALA 209 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1xrs h ALA 209 Cb 0.80 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1xrs h ALA 209 CO 0.07 0.23 0.00 0.39 0.00 0.00 0.00 179.25 179.94 1xrs n GLU 210 N -4.50 1.51 -2.78 0.00 1.02 -1.02 -4.91 120.64 109.95 1xrs n GLU 210 Ca 0.14 -0.76 -0.09 0.00 -0.02 0.00 0.00 57.16 56.43 1xrs n GLU 210 Cb 0.26 -1.39 0.04 0.00 -0.02 0.00 0.00 31.44 30.33 1xrs n GLU 210 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xrs n GLY 211 N 1.05 0.08 0.00 0.62 0.00 0.10 -4.98 105.19 102.06 1xrs n GLY 211 Ca 0.16 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1xrs n GLY 211 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xrs n LEU 212 N -2.60 0.00 -0.35 0.99 4.32 0.93 -4.88 117.00 115.41 1xrs n LEU 212 Ca -0.11 -0.00 -0.09 0.00 -0.02 0.00 0.00 56.01 55.78 1xrs n LEU 212 Cb 0.57 0.00 -0.08 0.00 -1.62 0.00 0.00 43.42 42.29 1xrs n LEU 212 CO 0.31 0.00 0.42 -1.14 -1.22 0.00 0.00 177.39 175.76 1xrs n ARG 213 N -1.32 -0.37 0.22 3.23 3.00 -1.22 -1.41 116.66 118.78 1xrs n ARG 213 Ca 0.00 1.29 0.13 0.00 -0.00 0.00 0.00 57.85 59.28 1xrs n ARG 213 Cb 0.00 -1.90 0.72 0.00 0.00 0.00 0.00 32.46 31.28 1xrs n ARG 213 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 1xrs h ASP 214 N 0.00 0.00 0.75 6.15 3.32 -1.94 -0.87 116.42 123.83 1xrs h ASP 214 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1xrs h ASP 214 Cb 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 1xrs h ASP 214 CO -0.79 0.00 0.00 0.03 -1.72 0.00 0.00 179.24 176.76 1xrs h ARG 215 N 0.00 0.00 -5.56 3.56 3.08 -1.60 -3.45 114.38 110.41 1xrs h ARG 215 Ca 0.00 0.00 -0.45 0.00 0.07 0.00 0.00 59.98 59.60 1xrs h ARG 215 Cb 0.14 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 30.03 1xrs h ARG 215 CO 0.00 0.00 -0.74 -0.06 -1.07 0.00 0.00 179.97 178.10 1xrs s PHE 216 N -3.61 1.65 -0.44 3.04 0.08 -0.33 -4.81 117.98 113.56 1xrs s PHE 216 Ca 0.01 -0.57 -0.17 0.00 0.12 0.00 0.00 56.93 56.32 1xrs s PHE 216 Cb 0.09 -0.79 0.03 0.00 -0.57 0.00 0.00 43.02 41.78 1xrs s PHE 216 CO 0.46 0.30 0.45 0.08 -0.10 0.00 0.00 175.22 176.41 1xrs s VAL 217 N -2.75 5.08 -0.32 -0.44 1.01 -0.87 -4.99 120.40 117.11 1xrs s VAL 217 Ca 0.19 -0.44 -0.15 0.00 0.00 0.00 0.00 61.98 61.58 1xrs s VAL 217 Cb -0.02 -4.07 -0.02 0.00 0.00 0.00 0.00 36.38 32.27 1xrs s VAL 217 CO 0.06 -0.48 0.34 -0.76 0.00 0.00 0.00 175.10 174.26 1xrs s LEU 218 N 2.13 4.33 -0.02 3.92 1.02 -1.26 -1.50 118.68 127.30 1xrs s LEU 218 Ca 0.11 -0.13 0.04 0.00 0.02 0.00 0.00 54.13 54.18 1xrs s LEU 218 Cb -0.18 -2.32 -0.03 0.00 0.02 0.00 0.00 46.19 43.68 1xrs s LEU 218 CO 0.13 -0.28 -0.14 -0.76 0.02 0.00 0.00 176.35 175.32 1xrs s LEU 219 N 1.99 2.77 0.17 1.79 1.43 -0.70 -1.17 118.68 124.95 1xrs s LEU 219 Ca 0.12 -0.24 0.04 0.00 -1.03 0.00 0.00 54.13 53.01 1xrs s LEU 219 Cb -0.16 -1.59 -0.05 0.00 0.03 0.00 0.00 46.19 44.42 1xrs s LEU 219 CO 0.11 0.31 -0.05 0.00 0.23 0.00 0.00 176.35 176.95 1xrs s GLY 221 N -3.20 -0.39 0.00 0.00 0.00 -1.04 -0.50 107.32 102.19 1xrs s GLY 221 Ca 0.21 0.65 0.00 0.00 0.00 0.00 0.00 44.72 45.58 1xrs s GLY 221 CO 0.03 2.35 0.00 0.61 0.00 0.00 0.00 173.10 176.09 1xrs n GLY 222 N -0.66 2.62 0.28 0.20 0.00 -1.09 -1.85 105.19 104.69 1xrs n GLY 222 Ca -0.04 -1.29 0.07 0.00 0.00 0.00 0.00 46.02 44.75 1xrs n GLY 222 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xrs h PRO 223 N 0.00 0.38 -1.00 1.61 0.13 -1.88 -0.80 132.00 130.44 1xrs h PRO 223 Ca 0.00 -0.02 -0.54 0.00 -0.87 0.00 0.00 66.00 64.57 1xrs h PRO 223 Cb 0.00 -0.09 -0.31 0.00 0.13 0.00 0.00 31.00 30.74 1xrs h PRO 223 CO 0.00 0.25 0.69 0.54 -0.23 0.00 0.00 178.00 179.25 1xrs n ARG 224 N -5.05 2.31 -4.32 0.86 5.12 -1.26 -4.53 116.66 109.78 1xrs n ARG 224 Ca 0.16 -3.04 -0.23 0.00 -1.93 0.00 0.00 57.85 52.80 1xrs n ARG 224 Cb 0.48 -2.19 -0.08 0.00 -1.16 0.00 0.00 32.46 29.51 1xrs n ARG 224 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1xrs s ILE 225 N -3.50 3.28 0.25 0.55 -1.09 -0.31 -5.10 121.20 115.29 1xrs s ILE 225 Ca 0.58 -2.00 -0.22 0.00 -2.23 0.00 0.00 60.65 56.79 1xrs s ILE 225 Cb 0.48 -2.75 0.03 0.00 -1.58 0.00 0.00 42.46 38.64 1xrs s ILE 225 CO 0.09 -0.38 0.74 0.54 -1.23 0.00 0.00 174.94 174.71 1xrs s ASN 226 N -3.65 -0.28 0.51 3.58 2.20 -1.26 -3.80 114.94 112.24 1xrs s ASN 226 Ca 0.31 -0.52 0.29 0.00 -0.94 0.00 0.00 52.86 52.00 1xrs s ASN 226 Cb -0.06 0.68 1.32 0.00 -2.00 0.00 0.00 41.25 41.19 1xrs s ASN 226 CO 0.19 -1.25 1.99 -1.13 -2.94 0.00 0.00 177.10 173.96 1xrs h ASN 227 N 2.00 0.00 0.39 3.54 -1.24 -1.93 -0.91 115.58 117.43 1xrs h ASN 227 Ca -0.21 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 56.78 1xrs h ASN 227 Cb 1.25 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.31 1xrs h ASN 227 CO 0.25 0.12 -0.19 -0.33 -1.29 0.00 0.00 177.43 175.99 1xrs h GLU 228 N 0.00 -0.50 -0.68 6.67 4.39 -1.96 -1.60 114.58 120.90 1xrs h GLU 228 Ca -0.00 0.03 0.13 0.00 0.34 0.00 0.00 59.36 59.86 1xrs h GLU 228 Cb 0.50 0.11 -0.09 0.00 -0.10 0.00 0.00 28.75 29.17 1xrs h GLU 228 CO 0.01 -0.21 0.20 0.82 -1.16 0.00 0.00 179.01 178.67 1xrs h ILE 229 N -1.01 0.63 0.29 3.13 2.04 -1.94 -2.48 117.51 118.17 1xrs h ILE 229 Ca -0.05 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1xrs h ILE 229 Cb 0.52 0.27 -0.04 0.00 -0.74 0.00 0.00 36.82 36.84 1xrs h ILE 229 CO 0.09 0.06 -0.47 0.00 0.00 0.00 0.00 178.15 177.82 1xrs h ALA 230 N 1.52 -0.96 -1.00 1.87 0.00 -1.11 -2.99 119.26 116.59 1xrs h ALA 230 Ca 0.36 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.17 1xrs h ALA 230 Cb 0.56 0.74 -0.06 0.00 0.00 0.00 0.00 17.79 19.03 1xrs h ALA 230 CO -0.42 -1.10 0.65 0.87 0.00 0.00 0.00 179.25 179.26 1xrs h LYS 231 N -0.83 1.24 -0.74 0.00 1.57 -0.92 -2.00 116.57 114.89 1xrs h LYS 231 Ca -0.02 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1xrs h LYS 231 Cb 0.78 -0.28 0.00 0.00 0.08 0.00 0.00 32.23 32.81 1xrs h LYS 231 CO -0.17 0.82 0.00 -0.85 -0.57 0.00 0.00 179.45 178.69 1xrs n GLU 232 N -4.43 0.97 0.00 3.15 0.28 -0.97 -2.63 120.64 117.01 1xrs n GLU 232 Ca 0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.13 1xrs n GLU 232 Cb 0.08 -1.37 0.00 0.00 1.43 0.00 0.00 31.44 31.57 1xrs n GLU 232 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 1xrs n LEU 233 N -0.11 0.00 0.00 -1.84 7.94 -0.78 -5.02 117.00 117.19 1xrs n LEU 233 Ca 0.00 -0.18 0.00 0.00 -1.11 0.00 0.00 56.01 54.72 1xrs n LEU 233 Cb 0.19 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.14 1xrs n LEU 233 CO 0.00 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 176.89 1xrs n GLY 234 N 1.38 1.61 3.85 -3.96 0.00 -1.08 -4.84 105.19 102.15 1xrs n GLY 234 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1xrs n GLY 234 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xrs s TYR 235 N -1.87 3.40 -0.40 1.61 2.02 -1.03 -4.98 117.35 116.10 1xrs s TYR 235 Ca 0.00 1.23 0.26 0.00 -0.37 0.00 0.00 57.07 58.19 1xrs s TYR 235 Cb 0.00 -2.56 0.95 0.00 -0.40 0.00 0.00 41.96 39.94 1xrs s TYR 235 CO 0.00 -0.03 1.78 -0.44 -1.57 0.00 0.00 175.55 175.29 1xrs h ASP 236 N 1.81 0.00 -3.60 2.29 3.32 -1.44 -3.32 116.42 115.48 1xrs h ASP 236 Ca -0.48 0.00 0.24 0.00 0.02 0.00 0.00 57.03 56.81 1xrs h ASP 236 Cb 1.18 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.49 1xrs h ASP 236 CO 0.64 0.00 0.88 0.00 -1.72 0.00 0.00 179.24 179.04 1xrs s ALA 237 N -3.33 -2.10 0.02 3.45 0.00 -1.24 -4.93 121.76 113.64 1xrs s ALA 237 Ca 0.05 1.80 0.04 0.00 0.00 0.00 0.00 51.96 53.85 1xrs s ALA 237 Cb 0.09 -0.98 -0.02 0.00 0.00 0.00 0.00 23.12 22.22 1xrs s ALA 237 CO 0.51 -0.36 -0.12 0.20 0.00 0.00 0.00 175.76 175.99 1xrs s GLY 238 N -1.40 0.65 -0.15 0.00 0.00 -1.25 -1.73 107.32 103.44 1xrs s GLY 238 Ca 0.08 -0.68 0.00 0.00 0.00 0.00 0.00 44.72 44.12 1xrs s GLY 238 CO -0.05 -0.65 -0.11 -1.36 0.00 0.00 0.00 173.10 170.93 1xrs s PHE 239 N -0.71 1.93 0.81 1.90 0.40 0.34 -3.32 117.98 119.34 1xrs s PHE 239 Ca 0.01 -1.10 -0.14 0.00 -0.60 0.00 0.00 56.93 55.10 1xrs s PHE 239 Cb -0.07 -1.45 0.20 0.00 0.51 0.00 0.00 43.02 42.20 1xrs s PHE 239 CO 0.01 -0.62 0.85 0.41 0.70 0.00 0.00 175.22 176.56 1xrs n GLY 240 N 4.83 -2.19 0.28 4.36 0.00 -1.25 -2.67 105.19 108.54 1xrs n GLY 240 Ca -0.15 -1.56 0.16 0.00 0.00 0.00 0.00 46.02 44.47 1xrs n GLY 240 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xrs h PRO 241 N 0.00 0.00 -0.01 1.61 0.13 -1.80 -2.78 132.00 129.16 1xrs h PRO 241 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1xrs h PRO 241 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 1xrs h PRO 241 CO 0.20 0.00 -0.37 0.41 -0.23 0.00 0.00 178.00 178.01 1xrs n GLY 242 N -1.19 -0.70 3.85 1.56 0.00 -1.26 -4.97 105.19 102.48 1xrs n GLY 242 Ca -0.02 -0.43 -0.32 0.00 0.00 0.00 0.00 46.02 45.25 1xrs n GLY 242 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xrs s ARG 243 N -2.63 3.94 0.28 1.61 1.81 -1.05 -5.10 118.95 117.80 1xrs s ARG 243 Ca 0.20 0.76 0.02 0.00 -1.72 0.00 0.00 55.73 54.99 1xrs s ARG 243 Cb 0.19 -2.28 -0.06 0.00 -0.45 0.00 0.00 34.95 32.34 1xrs s ARG 243 CO 0.58 -0.08 0.07 -0.06 -0.68 0.00 0.00 175.30 175.13 1xrs s PHE 244 N -2.36 1.69 0.30 -0.53 0.40 -1.26 -5.01 117.98 111.21 1xrs s PHE 244 Ca 0.56 -1.06 0.05 0.00 -0.60 0.00 0.00 56.93 55.87 1xrs s PHE 244 Cb -0.10 -1.04 0.79 0.00 0.51 0.00 0.00 43.02 43.18 1xrs s PHE 244 CO 0.26 -0.17 1.64 0.00 0.70 0.00 0.00 175.22 177.66 1xrs h ALA 245 N 2.30 1.40 -0.83 5.36 0.00 -1.83 0.33 119.26 125.99 1xrs h ALA 245 Ca -0.39 0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.78 1xrs h ALA 245 Cb 1.24 0.31 -0.05 0.00 0.00 0.00 0.00 17.79 19.29 1xrs h ALA 245 CO 0.65 -0.50 0.53 0.38 0.00 0.00 0.00 179.25 180.30 1xrs h ASP 246 N 0.21 0.87 -0.38 0.00 2.03 -1.91 0.59 116.42 117.82 1xrs h ASP 246 Ca 0.59 -0.00 0.05 0.00 -0.73 0.00 0.00 57.03 56.94 1xrs h ASP 246 Cb 1.24 -0.19 -0.05 0.00 -0.83 0.00 0.00 39.33 39.50 1xrs h ASP 246 CO -0.67 0.59 0.10 0.44 -1.03 0.00 0.00 179.24 178.68 1xrs h ASP 247 N 1.02 0.07 -0.04 4.15 5.19 -0.70 -0.19 116.42 125.91 1xrs h ASP 247 Ca 0.34 0.05 -0.00 0.00 -0.62 0.00 0.00 57.03 56.80 1xrs h ASP 247 Cb 0.04 0.06 -0.00 0.00 0.18 0.00 0.00 39.33 39.61 1xrs h ASP 247 CO -0.12 0.07 0.01 0.58 -3.12 0.00 0.00 179.24 176.66 1xrs h VAL 248 N 0.24 1.17 0.07 -1.35 2.07 -0.71 -2.57 116.25 115.17 1xrs h VAL 248 Ca 0.18 -0.51 0.01 0.00 0.82 0.00 0.00 66.70 67.20 1xrs h VAL 248 Cb 0.19 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.38 1xrs h VAL 248 CO -0.21 0.14 -0.15 0.00 0.02 0.00 0.00 177.57 177.37 1xrs h ALA 249 N 0.81 -0.24 -0.79 1.67 0.00 0.42 0.50 119.26 121.63 1xrs h ALA 249 Ca 0.01 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1xrs h ALA 249 Cb 0.21 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 1xrs h ALA 249 CO -0.00 -0.66 0.52 0.00 0.00 0.00 0.00 179.25 179.10 1xrs h THR 250 N -0.29 1.09 -0.11 0.00 1.03 -1.07 -1.09 112.91 112.48 1xrs h THR 250 Ca 0.03 -0.32 -0.10 0.00 -0.01 0.00 0.00 66.41 66.01 1xrs h THR 250 Cb 0.31 0.08 0.00 0.00 -1.07 0.00 0.00 68.15 67.47 1xrs h THR 250 CO -0.09 0.17 -0.31 0.15 -0.01 0.00 0.00 175.52 175.43 1xrs h PHE 251 N 0.93 0.52 -0.65 0.00 3.57 -1.02 -2.95 116.94 117.34 1xrs h PHE 251 Ca 0.32 -0.21 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 1xrs h PHE 251 Cb 0.11 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 1xrs h PHE 251 CO -0.00 0.93 0.38 0.00 -2.23 0.00 0.00 178.31 177.39 1xrs h ALA 252 N 0.50 0.83 -0.49 2.41 0.00 -0.51 -1.72 119.26 120.26 1xrs h ALA 252 Ca -0.01 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1xrs h ALA 252 Cb 0.93 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1xrs h ALA 252 CO 0.07 0.31 -0.09 0.28 0.00 0.00 0.00 179.25 179.82 1xrs h VAL 253 N 0.88 1.26 -0.15 0.00 2.07 -1.30 -0.34 116.25 118.68 1xrs h VAL 253 Ca 0.23 -1.18 -0.08 0.00 0.82 0.00 0.00 66.70 66.48 1xrs h VAL 253 Cb -0.01 0.97 -0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1xrs h VAL 253 CO -0.04 0.41 -0.24 0.11 0.02 0.00 0.00 177.57 177.84 1xrs h LYS 254 N 0.80 0.42 -0.33 1.57 1.57 -1.38 -2.40 116.57 116.82 1xrs h LYS 254 Ca 0.13 -0.25 0.03 0.00 -1.87 0.00 0.00 60.65 58.69 1xrs h LYS 254 Cb 0.60 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.90 1xrs h LYS 254 CO 0.04 0.84 0.14 1.15 -0.57 0.00 0.00 179.45 181.05 1xrs h THR 255 N 0.03 0.94 -0.24 -0.16 2.02 -1.24 0.30 112.91 114.56 1xrs h THR 255 Ca 0.01 -0.10 0.06 0.00 0.77 0.00 0.00 66.41 67.15 1xrs h THR 255 Cb 0.81 0.62 -0.06 0.00 -1.74 0.00 0.00 68.15 67.78 1xrs h THR 255 CO 0.05 0.05 -0.19 -0.07 0.37 0.00 0.00 175.52 175.74 1xrs h LEU 256 N 0.29 -0.60 -0.13 2.58 3.38 -1.05 0.71 115.31 120.49 1xrs h LEU 256 Ca 0.15 0.12 0.03 0.00 0.09 0.00 0.00 57.88 58.27 1xrs h LEU 256 Cb 0.10 0.30 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 1xrs h LEU 256 CO -0.13 -0.23 -0.07 -1.13 0.09 0.00 0.00 178.44 176.97 1xrs h ASN 257 N -0.18 -0.23 -0.99 -0.43 -0.73 -0.86 0.42 115.58 112.57 1xrs h ASN 257 Ca 0.14 0.06 0.12 0.00 1.87 0.00 0.00 56.30 58.49 1xrs h ASN 257 Cb 0.39 0.13 -0.08 0.00 0.27 0.00 0.00 38.32 39.02 1xrs h ASN 257 CO -0.35 -0.10 0.63 0.44 -0.37 0.00 0.00 177.43 177.68 1xrs h ASP 258 N -0.07 0.90 0.23 1.15 3.32 0.27 0.44 116.42 122.67 1xrs h ASP 258 Ca 0.08 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 1xrs h ASP 258 Cb 0.18 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.60 1xrs h ASP 258 CO -0.17 0.48 -0.11 0.03 -1.72 0.00 0.00 179.24 177.74 1xrs h ARG 259 N 0.96 -0.30 -0.20 3.56 3.08 0.25 -3.25 114.38 118.49 1xrs h ARG 259 Ca 0.49 0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.62 1xrs h ARG 259 Cb 0.51 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.62 1xrs h ARG 259 CO -0.26 -0.01 0.17 0.52 -1.07 0.00 0.00 179.97 179.33 1xrs h MET 260 N -1.00 0.00 0.00 0.04 2.86 -0.05 -3.51 114.93 113.26 1xrs h MET 260 Ca -0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1xrs h MET 260 Cb 0.43 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.09 1xrs h MET 260 CO 0.05 0.00 0.00 0.09 1.06 0.00 0.00 176.91 178.11