#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oxm n THR 18 N 0.00 0.05 -4.09 0.55 -2.24 -1.26 -4.69 114.28 102.60 1oxm n THR 18 Ca 0.00 0.01 -0.25 0.00 -2.27 0.00 0.00 64.05 61.54 1oxm n THR 18 Cb 0.00 -0.61 -0.17 0.00 -2.10 0.00 0.00 70.33 67.45 1oxm n THR 18 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1oxm s THR 19 N -2.14 0.95 -0.03 4.28 2.01 -1.26 0.09 115.64 119.53 1oxm s THR 19 Ca 0.35 -0.28 -0.01 0.00 0.31 0.00 0.00 61.69 62.06 1oxm s THR 19 Cb 0.18 -0.95 0.03 0.00 0.01 0.00 0.00 72.50 71.77 1oxm s THR 19 CO 0.32 0.34 0.05 -0.13 -0.69 0.00 0.00 174.62 174.51 1oxm s ARG 20 N 1.39 -0.03 -0.31 4.92 1.81 -1.26 -4.97 118.95 120.50 1oxm s ARG 20 Ca -0.01 0.26 0.15 0.00 -1.72 0.00 0.00 55.73 54.40 1oxm s ARG 20 Cb -0.13 -0.30 0.47 0.00 -0.45 0.00 0.00 34.95 34.54 1oxm s ARG 20 CO -0.04 -0.21 1.10 -0.25 -0.68 0.00 0.00 175.30 175.22 1oxm n ASP 21 N 4.45 2.93 -0.18 0.23 8.00 -1.25 -1.44 116.55 129.29 1oxm n ASP 21 Ca -0.22 -2.88 0.16 0.00 0.71 0.00 0.00 54.79 52.57 1oxm n ASP 21 Cb 0.50 -0.45 0.51 0.00 -0.02 0.00 0.00 41.12 41.66 1oxm n ASP 21 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1oxm h ASP 22 N 2.56 0.38 -0.01 -2.24 5.19 -1.67 -1.47 116.42 119.17 1oxm h ASP 22 Ca 0.07 0.02 -0.05 0.00 -0.62 0.00 0.00 57.03 56.46 1oxm h ASP 22 Cb 1.28 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.74 1oxm h ASP 22 CO 0.50 0.19 -0.18 0.25 -3.12 0.00 0.00 179.24 176.88 1oxm h LEU 23 N 0.40 0.17 -1.01 1.55 5.85 -1.90 0.70 115.31 121.07 1oxm h LEU 23 Ca 0.39 -0.75 -0.02 0.00 0.84 0.00 0.00 57.88 58.33 1oxm h LEU 23 Cb 0.91 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.85 1oxm h LEU 23 CO -0.12 0.90 0.39 0.40 -0.34 0.00 0.00 178.44 179.67 1oxm h ILE 24 N -0.54 1.24 0.00 4.05 2.04 -1.89 -3.09 117.51 119.31 1oxm h ILE 24 Ca -0.02 -0.63 -0.20 0.00 1.00 0.00 0.00 64.86 65.00 1oxm h ILE 24 Cb 0.92 0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 1oxm h ILE 24 CO 0.04 0.28 -1.13 0.78 0.00 0.00 0.00 178.15 178.11 1oxm h ASN 25 N 1.09 0.00 -3.95 1.72 2.35 -1.36 -3.48 115.58 111.95 1oxm h ASN 25 Ca 0.27 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 55.46 1oxm h ASN 25 Cb 0.08 0.00 0.16 0.00 0.05 0.00 0.00 38.32 38.61 1oxm h ASN 25 CO -0.04 0.86 0.39 0.61 -1.65 0.00 0.00 177.43 177.60 1oxm n GLY 26 N 1.38 0.27 3.69 2.83 0.00 0.24 -4.99 105.19 108.61 1oxm n GLY 26 Ca -0.05 -0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 1oxm n GLY 26 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1oxm s ASN 27 N -1.36 6.85 0.56 1.61 -0.87 -1.26 -4.95 114.94 115.52 1oxm s ASN 27 Ca 0.81 1.03 0.24 0.00 -1.57 0.00 0.00 52.86 53.38 1oxm s ASN 27 Cb -0.39 -2.39 1.50 0.00 -0.02 0.00 0.00 41.25 39.96 1oxm s ASN 27 CO 0.42 -0.21 2.10 -1.28 -2.57 0.00 0.00 177.10 175.57 1oxm h SER 28 N 7.10 0.00 1.55 -1.22 0.87 -1.94 -1.05 113.55 118.86 1oxm h SER 28 Ca -0.36 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.20 1oxm h SER 28 Cb 1.17 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 1oxm h SER 28 CO 0.78 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 177.08 1oxm h ALA 29 N 1.84 1.00 -2.05 6.23 0.00 -1.92 -3.36 119.26 121.01 1oxm h ALA 29 Ca 0.10 0.00 -0.51 0.00 0.00 0.00 0.00 54.91 54.50 1oxm h ALA 29 Cb 0.44 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 17.82 1oxm h ALA 29 CO -0.00 0.00 -1.04 -1.13 0.00 0.00 0.00 179.25 177.08 1oxm n SER 30 N -2.41 1.93 -4.74 0.00 3.41 -0.40 -5.11 113.62 106.29 1oxm n SER 30 Ca 0.05 -3.20 -0.36 0.00 -0.26 0.00 0.00 58.87 55.10 1oxm n SER 30 Cb 0.44 -0.60 0.05 0.00 -0.26 0.00 0.00 64.21 63.84 1oxm n SER 30 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1oxm s ALA 32 N -1.61 3.43 0.23 0.00 0.00 -1.26 -5.00 121.76 117.55 1oxm s ALA 32 Ca 0.78 -0.42 0.03 0.00 0.00 0.00 0.00 51.96 52.35 1oxm s ALA 32 Cb -0.32 -2.57 0.24 0.00 0.00 0.00 0.00 23.12 20.47 1oxm s ALA 32 CO 0.36 -0.12 1.56 -0.44 0.00 0.00 0.00 175.76 177.12 1oxm h ASP 33 N 0.85 0.34 -4.31 0.00 3.32 -1.74 -3.43 116.42 111.46 1oxm h ASP 33 Ca -0.47 -0.19 -0.55 0.00 0.02 0.00 0.00 57.03 55.84 1oxm h ASP 33 Cb 1.20 -0.10 -0.27 0.00 0.22 0.00 0.00 39.33 40.38 1oxm h ASP 33 CO 0.63 0.84 -0.83 -0.69 -1.72 0.00 0.00 179.24 177.47 1oxm s VAL 34 N -3.84 1.50 -0.10 -1.35 1.01 -0.83 -0.80 120.40 115.99 1oxm s VAL 34 Ca -0.05 -1.02 -0.01 0.00 0.00 0.00 0.00 61.98 60.90 1oxm s VAL 34 Cb 0.12 -1.30 0.03 0.00 0.00 0.00 0.00 36.38 35.23 1oxm s VAL 34 CO 0.80 0.24 -0.06 -0.63 0.00 0.00 0.00 175.10 175.46 1oxm s ILE 35 N -0.68 0.87 -0.28 2.22 1.01 -0.31 -1.38 121.20 122.64 1oxm s ILE 35 Ca 0.06 -0.20 -0.08 0.00 0.00 0.00 0.00 60.65 60.43 1oxm s ILE 35 Cb -0.08 -0.93 -0.02 0.00 0.01 0.00 0.00 42.46 41.45 1oxm s ILE 35 CO 0.01 0.33 0.11 0.12 0.00 0.00 0.00 174.94 175.51 1oxm s PHE 36 N 1.77 3.13 -0.19 3.97 5.36 0.20 -2.12 117.98 130.12 1oxm s PHE 36 Ca 0.05 -0.54 -0.05 0.00 -0.96 0.00 0.00 56.93 55.43 1oxm s PHE 36 Cb -0.13 -2.29 -0.02 0.00 -0.34 0.00 0.00 43.02 40.24 1oxm s PHE 36 CO -0.07 -0.42 -0.01 0.42 -1.46 0.00 0.00 175.22 173.67 1oxm s ILE 37 N 1.60 3.90 -0.01 3.12 1.01 -0.79 -0.69 121.20 129.34 1oxm s ILE 37 Ca 0.05 -0.34 0.04 0.00 0.00 0.00 0.00 60.65 60.40 1oxm s ILE 37 Cb -0.16 -2.75 -0.01 0.00 0.01 0.00 0.00 42.46 39.55 1oxm s ILE 37 CO 0.05 0.45 -0.13 -0.47 0.00 0.00 0.00 174.94 174.84 1oxm s TYR 38 N 0.82 1.15 -0.16 3.97 5.04 -0.46 -2.19 117.35 125.52 1oxm s TYR 38 Ca 0.00 -0.22 -0.01 0.00 -2.44 0.00 0.00 57.07 54.41 1oxm s TYR 38 Cb -0.14 -0.74 -0.01 0.00 0.35 0.00 0.00 41.96 41.42 1oxm s TYR 38 CO 0.02 -0.02 -0.13 0.00 -1.34 0.00 0.00 175.55 174.08 1oxm s ALA 39 N -0.30 2.58 0.79 3.97 0.00 -0.71 -0.80 121.76 127.29 1oxm s ALA 39 Ca 0.05 -1.03 -0.12 0.00 0.00 0.00 0.00 51.96 50.86 1oxm s ALA 39 Cb -0.05 -1.30 0.07 0.00 0.00 0.00 0.00 23.12 21.84 1oxm s ALA 39 CO -0.00 -0.04 1.15 -0.98 0.00 0.00 0.00 175.76 175.88 1oxm s ARG 40 N 0.83 2.10 0.81 0.00 1.70 -1.26 -2.49 118.95 120.64 1oxm s ARG 40 Ca -0.04 0.27 -0.12 0.00 -0.47 0.00 0.00 55.73 55.37 1oxm s ARG 40 Cb -0.15 -1.95 0.08 0.00 -0.57 0.00 0.00 34.95 32.36 1oxm s ARG 40 CO 0.00 -1.53 1.16 0.20 -1.08 0.00 0.00 175.30 174.06 1oxm s GLY 41 N -4.39 1.59 0.28 3.88 0.00 -1.13 -2.73 107.32 104.81 1oxm s GLY 41 Ca 0.61 -0.59 -0.30 0.00 0.00 0.00 0.00 44.72 44.44 1oxm s GLY 41 CO 0.51 -0.11 1.34 1.44 0.00 0.00 0.00 173.10 176.28 1oxm n SER 42 N -3.33 2.64 0.00 1.64 7.64 -1.26 -2.25 113.62 118.69 1oxm n SER 42 Ca 0.08 1.17 0.00 0.00 1.01 0.00 0.00 58.87 61.12 1oxm n SER 42 Cb 0.60 -1.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.37 1oxm n SER 42 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1oxm n THR 43 N 1.26 0.00 -1.32 0.44 -1.04 -0.06 -4.99 114.28 108.58 1oxm n THR 43 Ca 0.09 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.76 1oxm n THR 43 Cb 0.33 0.00 0.11 0.00 -1.82 0.00 0.00 70.33 68.95 1oxm n THR 43 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1oxm s GLU 44 N 0.00 1.95 0.50 -2.82 2.02 -0.95 -5.01 118.70 114.38 1oxm s GLU 44 Ca 0.00 1.80 -0.05 0.00 0.02 0.00 0.00 54.97 56.74 1oxm s GLU 44 Cb 0.00 -1.81 -0.02 0.00 0.10 0.00 0.00 34.13 32.40 1oxm s GLU 44 CO 0.00 -1.99 0.80 0.95 0.02 0.00 0.00 175.26 175.04 1oxm s THR 45 N -1.99 4.57 0.00 3.63 -4.23 -1.26 -4.86 115.64 111.50 1oxm s THR 45 Ca 0.75 0.09 0.00 0.00 -1.18 0.00 0.00 61.69 61.35 1oxm s THR 45 Cb -0.30 -3.75 0.00 0.00 1.34 0.00 0.00 72.50 69.79 1oxm s THR 45 CO 0.47 -0.72 0.00 0.61 -0.54 0.00 0.00 174.62 174.44 1oxm n GLY 46 N -2.31 1.90 0.00 3.99 0.00 -1.26 -1.72 105.19 105.79 1oxm n GLY 46 Ca 0.01 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1oxm n GLY 46 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1oxm n ASN 47 N -1.26 1.80 0.00 1.61 2.04 0.11 -4.72 115.26 114.85 1oxm n ASN 47 Ca 0.00 -1.94 0.00 0.00 -0.44 0.00 0.00 54.58 52.20 1oxm n ASN 47 Cb 0.00 -0.02 0.00 0.00 -2.53 0.00 0.00 39.78 37.23 1oxm n ASN 47 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 1oxm n LEU 48 N -0.48 0.00 0.00 -4.53 4.77 -0.11 -3.54 117.00 113.12 1oxm n LEU 48 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1oxm n LEU 48 Cb 0.29 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 1oxm n LEU 48 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 1oxm n GLY 49 N 2.50 0.50 0.16 -0.72 0.00 -0.70 -2.43 105.19 104.51 1oxm n GLY 49 Ca 0.00 -0.81 -0.16 0.00 0.00 0.00 0.00 46.02 45.05 1oxm n GLY 49 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1oxm h THR 50 N 0.00 1.38 0.07 2.61 1.35 -1.98 -3.39 112.91 112.96 1oxm h THR 50 Ca 0.00 -2.49 -0.33 0.00 -0.55 0.00 0.00 66.41 63.05 1oxm h THR 50 Cb 0.00 2.51 -0.03 0.00 -1.73 0.00 0.00 68.15 68.90 1oxm h THR 50 CO 0.00 0.75 -1.80 -0.07 -0.25 0.00 0.00 175.52 174.15 1oxm h LEU 51 N 0.25 0.25 -0.58 3.87 3.38 -1.99 -3.40 115.31 117.08 1oxm h LEU 51 Ca -0.11 -0.51 0.10 0.00 0.09 0.00 0.00 57.88 57.46 1oxm h LEU 51 Cb 1.69 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 42.28 1oxm h LEU 51 CO 0.18 1.45 0.13 1.23 0.09 0.00 0.00 178.44 181.53 1oxm h GLY 52 N 2.16 0.74 0.98 0.83 0.00 -1.66 -2.36 103.07 103.76 1oxm h GLY 52 Ca -0.34 -0.04 0.08 0.00 0.00 0.00 0.00 47.33 47.03 1oxm h GLY 52 CO 0.10 -0.09 0.48 -2.55 0.00 0.00 0.00 176.54 174.47 1oxm h PRO 53 N 0.27 0.68 -0.34 4.80 0.11 -1.77 -0.50 132.00 135.25 1oxm h PRO 53 Ca 0.30 -0.04 -0.16 0.00 0.11 0.00 0.00 66.00 66.21 1oxm h PRO 53 Cb 0.43 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.38 1oxm h PRO 53 CO -0.37 0.45 -0.42 0.77 -0.21 0.00 0.00 178.00 178.21 1oxm h SER 54 N 0.70 0.92 -0.17 -2.05 0.02 -1.66 -1.85 113.55 109.47 1oxm h SER 54 Ca 0.32 -0.44 -0.06 0.00 -0.84 0.00 0.00 61.79 60.77 1oxm h SER 54 Cb 0.35 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 62.63 1oxm h SER 54 CO -0.11 1.21 -0.15 0.40 -1.14 0.00 0.00 176.83 177.05 1oxm h ILE 55 N 0.69 1.34 -0.42 3.27 2.04 -1.23 -3.07 117.51 120.14 1oxm h ILE 55 Ca 0.05 -1.29 0.06 0.00 1.00 0.00 0.00 64.86 64.68 1oxm h ILE 55 Cb 1.00 1.81 -0.05 0.00 -0.74 0.00 0.00 36.82 38.84 1oxm h ILE 55 CO 0.10 0.38 0.11 0.00 0.00 0.00 0.00 178.15 178.74 1oxm h ALA 56 N 0.63 0.47 -0.51 1.87 0.00 -1.05 -0.04 119.26 120.63 1oxm h ALA 56 Ca 0.03 0.07 0.10 0.00 0.00 0.00 0.00 54.91 55.11 1oxm h ALA 56 Cb 0.67 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.46 1oxm h ALA 56 CO 0.04 -0.29 0.02 0.77 0.00 0.00 0.00 179.25 179.79 1oxm h SER 57 N 0.25 -0.17 -0.54 0.00 0.02 -1.36 0.54 113.55 112.29 1oxm h SER 57 Ca 0.20 0.12 -0.09 0.00 -0.84 0.00 0.00 61.79 61.17 1oxm h SER 57 Cb 0.23 0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.94 1oxm h SER 57 CO -0.24 -0.05 -0.01 0.78 -1.14 0.00 0.00 176.83 176.16 1oxm h ASN 58 N 0.14 0.98 -0.68 3.07 2.35 -1.27 -2.48 115.58 117.68 1oxm h ASN 58 Ca 0.26 -0.28 -0.04 0.00 -0.55 0.00 0.00 56.30 55.69 1oxm h ASN 58 Cb 0.39 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.46 1oxm h ASN 58 CO -0.41 1.04 0.27 -0.07 -1.65 0.00 0.00 177.43 176.61 1oxm h LEU 59 N 0.91 0.95 -1.43 1.61 3.38 0.23 -2.45 115.31 118.51 1oxm h LEU 59 Ca 0.16 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 1oxm h LEU 59 Cb 0.55 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1oxm h LEU 59 CO 0.03 0.86 -0.27 -0.33 0.09 0.00 0.00 178.44 178.83 1oxm h GLU 60 N 0.97 0.03 -0.00 1.13 5.08 -0.76 -0.15 114.58 120.88 1oxm h GLU 60 Ca 0.23 -0.01 -0.14 0.00 -1.00 0.00 0.00 59.36 58.44 1oxm h GLU 60 Cb 0.21 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1oxm h GLU 60 CO -0.02 0.29 -0.69 0.77 -1.00 0.00 0.00 179.01 178.37 1oxm h SER 61 N 0.03 0.01 0.20 1.42 0.02 -1.05 0.44 113.55 114.61 1oxm h SER 61 Ca 0.00 -0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.63 1oxm h SER 61 Cb 0.49 -0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.04 1oxm h SER 61 CO 0.04 0.69 -1.51 0.00 -1.14 0.00 0.00 176.83 174.91 1oxm h ALA 62 N 1.31 0.02 0.00 3.77 0.00 -0.98 -3.40 119.26 119.98 1oxm h ALA 62 Ca -0.01 -0.99 0.00 0.00 0.00 0.00 0.00 54.91 53.91 1oxm h ALA 62 Cb 1.22 0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.34 1oxm h ALA 62 CO 0.09 0.81 -1.06 1.19 0.00 0.00 0.00 179.25 180.28 1oxm n PHE 63 N -3.74 0.00 0.00 0.00 3.72 -0.12 -5.12 117.46 112.20 1oxm n PHE 63 Ca -0.21 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.19 1oxm n PHE 63 Cb 1.03 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 39.45 1oxm n PHE 63 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1oxm n GLY 64 N 1.45 -1.35 0.40 1.37 0.00 0.15 -3.26 105.19 103.96 1oxm n GLY 64 Ca 0.01 -1.44 0.22 0.00 0.00 0.00 0.00 46.02 44.80 1oxm n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1oxm h LYS 65 N 0.00 0.00 0.00 1.61 1.79 -1.90 -0.45 116.57 117.61 1oxm h LYS 65 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1oxm h LYS 65 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1oxm h LYS 65 CO 0.00 0.00 -0.94 -0.40 -1.08 0.00 0.00 179.45 177.03 1oxm n ASP 66 N -3.86 0.72 -0.04 0.86 5.75 -1.26 -4.30 116.55 114.42 1oxm n ASP 66 Ca 0.10 -0.56 0.11 0.00 -0.01 0.00 0.00 54.79 54.43 1oxm n ASP 66 Cb 0.70 0.82 0.14 0.00 -1.03 0.00 0.00 41.12 41.75 1oxm n ASP 66 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1oxm n GLY 67 N 1.45 -1.07 2.90 6.12 0.00 -0.19 -4.54 105.19 109.87 1oxm n GLY 67 Ca 0.03 -0.44 -0.12 0.00 0.00 0.00 0.00 46.02 45.49 1oxm n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oxm s VAL 68 N -2.93 0.00 -0.19 1.61 0.11 -1.17 -1.97 120.40 115.85 1oxm s VAL 68 Ca 0.12 -0.02 -0.03 0.00 -2.93 0.00 0.00 61.98 59.12 1oxm s VAL 68 Cb 0.17 -0.05 -0.01 0.00 -1.53 0.00 0.00 36.38 34.96 1oxm s VAL 68 CO 0.73 -0.01 -0.06 0.26 -3.33 0.00 0.00 175.10 172.69 1oxm s TRP 69 N -0.01 2.94 -0.21 1.54 0.51 -0.48 -4.88 118.94 118.34 1oxm s TRP 69 Ca -0.00 -0.75 -0.11 0.00 -2.12 0.00 0.00 56.10 53.12 1oxm s TRP 69 Cb -0.00 -2.02 -0.05 0.00 -0.81 0.00 0.00 33.47 30.59 1oxm s TRP 69 CO 0.00 -0.38 0.19 0.42 -0.51 0.00 0.00 176.95 176.67 1oxm s ILE 70 N 1.02 5.36 -0.07 2.03 -1.09 -1.26 -0.63 121.20 126.56 1oxm s ILE 70 Ca 0.00 0.28 -0.02 0.00 -2.23 0.00 0.00 60.65 58.67 1oxm s ILE 70 Cb -0.15 -3.53 0.03 0.00 -1.58 0.00 0.00 42.46 37.24 1oxm s ILE 70 CO -0.00 0.38 0.06 -1.58 -1.23 0.00 0.00 174.94 172.56 1oxm s GLN 71 N 0.75 0.05 0.36 2.79 2.00 0.13 -1.59 119.66 124.14 1oxm s GLN 71 Ca 0.10 0.26 -0.04 0.00 -2.00 0.00 0.00 55.36 53.68 1oxm s GLN 71 Cb -0.13 -0.81 -0.04 0.00 0.80 0.00 0.00 33.01 32.83 1oxm s GLN 71 CO 0.02 -0.39 0.62 0.20 -0.50 0.00 0.00 175.29 175.24 1oxm s GLY 72 N 2.13 1.63 -0.65 2.59 0.00 -0.52 -1.36 107.32 111.14 1oxm s GLY 72 Ca 0.04 -0.63 -0.23 0.00 0.00 0.00 0.00 44.72 43.91 1oxm s GLY 72 CO -0.04 -0.51 0.97 0.14 0.00 0.00 0.00 173.10 173.66 1oxm s VAL 73 N -2.32 4.30 0.00 1.40 1.01 0.02 -4.86 120.40 119.96 1oxm s VAL 73 Ca 0.44 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.13 1oxm s VAL 73 Cb -0.10 -4.68 0.00 0.00 0.00 0.00 0.00 36.38 31.59 1oxm s VAL 73 CO 0.35 -1.45 0.00 0.61 0.00 0.00 0.00 175.10 174.61 1oxm n GLY 74 N 5.32 1.24 7.00 4.51 0.00 -1.26 -4.75 105.19 117.25 1oxm n GLY 74 Ca -0.03 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1oxm n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oxm n GLY 75 N 5.00 3.82 0.04 -0.02 0.00 -1.26 -1.82 105.19 110.95 1oxm n GLY 75 Ca 0.00 0.03 0.08 0.00 0.00 0.00 0.00 46.02 46.13 1oxm n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oxm n ALA 76 N 12.05 1.61 -2.61 4.61 0.00 -1.26 -4.54 120.51 130.36 1oxm n ALA 76 Ca 0.00 -0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 1oxm n ALA 76 Cb 0.00 -1.27 -0.03 0.00 0.00 0.00 0.00 19.45 18.15 1oxm n ALA 76 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1oxm s TYR 77 N -3.11 2.43 -0.31 0.00 5.04 -0.76 -4.38 117.35 116.27 1oxm s TYR 77 Ca 0.06 -0.36 0.21 0.00 -2.44 0.00 0.00 57.07 54.53 1oxm s TYR 77 Cb 0.09 -4.58 0.17 0.00 0.35 0.00 0.00 41.96 37.98 1oxm s TYR 77 CO 0.28 -1.96 1.38 0.00 -1.34 0.00 0.00 175.55 173.92 1oxm h ARG 78 N 9.86 0.00 -5.16 4.97 2.47 -1.87 -3.44 114.38 121.21 1oxm h ARG 78 Ca -0.15 0.00 -0.31 0.00 -1.26 0.00 0.00 59.98 58.26 1oxm h ARG 78 Cb 1.04 0.00 0.14 0.00 -1.65 0.00 0.00 29.97 29.50 1oxm h ARG 78 CO 1.29 0.12 -0.63 0.00 0.56 0.00 0.00 179.97 181.31 1oxm n ALA 79 N -2.17 -1.49 -1.78 0.04 0.00 -1.26 -4.72 120.51 109.14 1oxm n ALA 79 Ca 0.02 0.12 -0.36 0.00 0.00 0.00 0.00 53.44 53.21 1oxm n ALA 79 Cb 0.60 -3.27 -0.04 0.00 0.00 0.00 0.00 19.45 16.75 1oxm n ALA 79 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1oxm s THR 80 N -3.30 3.67 0.13 0.00 2.01 -1.26 -0.88 115.64 116.02 1oxm s THR 80 Ca 0.21 1.27 -0.14 0.00 0.31 0.00 0.00 61.69 63.35 1oxm s THR 80 Cb -0.09 -3.65 -0.02 0.00 0.01 0.00 0.00 72.50 68.75 1oxm s THR 80 CO 0.63 -0.00 1.54 -0.07 -0.69 0.00 0.00 174.62 176.03 1oxm h LEU 81 N 2.43 0.79 -2.08 4.42 4.07 -1.95 -3.13 115.31 119.86 1oxm h LEU 81 Ca -0.48 -0.35 -0.02 0.00 0.08 0.00 0.00 57.88 57.11 1oxm h LEU 81 Cb 1.22 -0.21 -0.00 0.00 1.08 0.00 0.00 40.66 42.74 1oxm h LEU 81 CO 0.62 0.95 -0.08 1.23 -1.08 0.00 0.00 178.44 180.09 1oxm h GLY 82 N 0.60 0.00 2.00 0.83 0.00 -2.02 -2.68 103.07 101.80 1oxm h GLY 82 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 1oxm h GLY 82 CO 0.04 0.00 0.00 -0.55 0.00 0.00 0.00 176.54 176.03 1oxm h ASP 83 N 0.00 0.00 0.30 0.19 3.32 -1.91 -2.70 116.42 115.61 1oxm h ASP 83 Ca -0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1oxm h ASP 83 Cb 0.27 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.82 1oxm h ASP 83 CO 0.01 0.00 -0.07 0.78 -1.72 0.00 0.00 179.24 178.24 1oxm h ASN 84 N 0.00 0.00 0.32 6.45 2.35 -1.63 -2.04 115.58 121.02 1oxm h ASN 84 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1oxm h ASN 84 Cb 0.39 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.76 1oxm h ASN 84 CO 0.00 0.07 -0.15 0.00 -1.65 0.00 0.00 177.43 175.71 1oxm n ALA 85 N -2.25 2.84 -1.65 -0.83 0.00 -1.02 -4.42 120.51 113.18 1oxm n ALA 85 Ca -0.02 -0.31 -0.33 0.00 0.00 0.00 0.00 53.44 52.78 1oxm n ALA 85 Cb 0.19 -1.28 0.01 0.00 0.00 0.00 0.00 19.45 18.38 1oxm n ALA 85 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1oxm s LEU 86 N -2.47 3.55 0.20 0.00 1.43 -0.78 -4.91 118.68 115.71 1oxm s LEU 86 Ca 0.28 1.96 -0.12 0.00 -1.03 0.00 0.00 54.13 55.22 1oxm s LEU 86 Cb 0.20 -4.55 0.26 0.00 0.03 0.00 0.00 46.19 42.13 1oxm s LEU 86 CO 0.48 -1.28 1.28 -2.65 0.23 0.00 0.00 176.35 174.42 1oxm n PRO 87 N -1.88 -0.15 -0.10 1.29 -0.02 -1.26 -0.25 135.00 132.62 1oxm n PRO 87 Ca 0.10 1.28 0.10 0.00 -2.02 0.00 0.00 63.50 62.95 1oxm n PRO 87 Cb 0.52 -1.90 0.33 0.00 -0.02 0.00 0.00 33.50 32.43 1oxm n PRO 87 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1oxm n ARG 88 N -5.26 1.76 -0.69 -0.52 1.74 -1.26 -4.90 116.66 107.53 1oxm n ARG 88 Ca 0.10 -1.15 0.00 0.00 -0.77 0.00 0.00 57.85 56.04 1oxm n ARG 88 Cb 0.36 -1.38 0.00 0.00 -1.02 0.00 0.00 32.46 30.42 1oxm n ARG 88 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1oxm n GLY 89 N 1.12 0.77 3.85 -0.13 0.00 0.65 -4.73 105.19 106.72 1oxm n GLY 89 Ca 0.15 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.13 1oxm n GLY 89 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1oxm s THR 90 N -2.81 0.00 0.44 2.61 -1.32 -1.12 -4.16 115.64 109.28 1oxm s THR 90 Ca 0.00 -0.69 -0.07 0.00 -1.21 0.00 0.00 61.69 59.73 1oxm s THR 90 Cb 0.00 -2.77 -0.05 0.00 -1.51 0.00 0.00 72.50 68.18 1oxm s THR 90 CO 0.00 0.00 0.76 -0.94 -2.21 0.00 0.00 174.62 172.23 1oxm s SER 91 N -3.28 6.36 0.16 8.08 1.04 -1.26 -4.75 113.70 120.06 1oxm s SER 91 Ca 0.19 0.97 -0.11 0.00 0.48 0.00 0.00 55.95 57.48 1oxm s SER 91 Cb -0.03 -2.26 0.05 0.00 0.10 0.00 0.00 66.02 63.88 1oxm s SER 91 CO 0.06 -0.48 1.65 0.28 0.98 0.00 0.00 173.24 175.73 1oxm h SER 92 N 0.70 0.90 -0.50 7.02 0.02 -1.99 -2.02 113.55 117.67 1oxm h SER 92 Ca -0.47 -0.27 -0.01 0.00 -0.84 0.00 0.00 61.79 60.20 1oxm h SER 92 Cb 1.20 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 63.47 1oxm h SER 92 CO 0.63 0.94 0.27 0.00 -1.14 0.00 0.00 176.83 177.52 1oxm h ALA 93 N 0.99 1.48 -0.41 3.77 0.00 -1.95 -0.29 119.26 122.86 1oxm h ALA 93 Ca 0.17 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1oxm h ALA 93 Cb 0.43 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1oxm h ALA 93 CO 0.01 0.42 -0.06 0.00 0.00 0.00 0.00 179.25 179.63 1oxm h ALA 94 N 1.56 0.56 -0.20 0.00 0.00 -1.67 -2.10 119.26 117.41 1oxm h ALA 94 Ca 0.19 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1oxm h ALA 94 Cb 0.05 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1oxm h ALA 94 CO -0.03 0.39 0.09 0.82 0.00 0.00 0.00 179.25 180.53 1oxm h ILE 95 N 0.58 1.14 -0.68 0.00 2.04 -0.64 -2.00 117.51 117.94 1oxm h ILE 95 Ca 0.11 -0.39 0.04 0.00 1.00 0.00 0.00 64.86 65.62 1oxm h ILE 95 Cb 0.56 1.03 -0.04 0.00 -0.74 0.00 0.00 36.82 37.64 1oxm h ILE 95 CO 0.03 0.13 0.45 0.03 0.00 0.00 0.00 178.15 178.80 1oxm h ARG 96 N 0.19 0.76 0.29 2.37 3.08 -1.03 0.11 114.38 120.14 1oxm h ARG 96 Ca 0.07 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 1oxm h ARG 96 Cb 0.12 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.01 1oxm h ARG 96 CO -0.01 0.50 -0.14 1.49 -1.07 0.00 0.00 179.97 180.75 1oxm h GLU 97 N 0.78 -0.37 -0.06 0.04 4.57 -0.87 0.36 114.58 119.02 1oxm h GLU 97 Ca 0.28 0.03 -0.09 0.00 -1.18 0.00 0.00 59.36 58.40 1oxm h GLU 97 Cb 0.14 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.80 1oxm h GLU 97 CO -0.08 -0.19 -0.37 1.98 -1.18 0.00 0.00 179.01 179.16 1oxm h MET 98 N -0.46 0.12 -0.25 1.92 4.05 -1.03 -2.01 114.93 117.27 1oxm h MET 98 Ca -0.04 -0.05 -0.01 0.00 -0.28 0.00 0.00 59.70 59.32 1oxm h MET 98 Cb 0.35 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.13 1oxm h MET 98 CO 0.06 0.48 0.11 -0.07 0.23 0.00 0.00 176.91 177.73 1oxm h LEU 99 N 0.11 0.33 -1.02 3.39 3.38 -0.75 -2.39 115.31 118.37 1oxm h LEU 99 Ca 0.01 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 57.90 1oxm h LEU 99 Cb 0.71 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.31 1oxm h LEU 99 CO 0.05 0.39 0.65 1.23 0.09 0.00 0.00 178.44 180.85 1oxm h GLY 100 N 0.26 1.52 1.06 0.83 0.00 -0.52 -1.15 103.07 105.06 1oxm h GLY 100 Ca 0.08 -0.48 -0.05 0.00 0.00 0.00 0.00 47.33 46.88 1oxm h GLY 100 CO -0.01 0.35 0.28 1.41 0.00 0.00 0.00 176.54 178.57 1oxm h LEU 101 N 1.18 1.11 -0.40 3.11 3.38 -1.11 0.25 115.31 122.82 1oxm h LEU 101 Ca 0.43 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 58.13 1oxm h LEU 101 Cb 0.15 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1oxm h LEU 101 CO -0.17 1.00 -0.06 -0.26 0.09 0.00 0.00 178.44 179.04 1oxm h PHE 102 N 1.15 0.83 -0.24 1.13 0.04 -0.88 -1.53 116.94 117.44 1oxm h PHE 102 Ca 0.26 -0.17 -0.11 0.00 2.80 0.00 0.00 57.97 60.75 1oxm h PHE 102 Cb 0.26 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 38.19 1oxm h PHE 102 CO 0.02 0.86 -0.30 1.96 -0.60 0.00 0.00 178.31 180.24 1oxm h GLN 103 N 0.57 0.49 -0.25 1.51 4.20 -0.99 -1.79 115.11 118.85 1oxm h GLN 103 Ca 0.11 -0.21 -0.14 0.00 0.06 0.00 0.00 58.65 58.47 1oxm h GLN 103 Cb 0.56 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.32 1oxm h GLN 103 CO 0.03 0.75 -0.41 0.37 -0.67 0.00 0.00 178.83 178.90 1oxm h GLN 104 N 0.43 0.60 -0.56 1.46 4.15 -0.40 -2.06 115.11 118.72 1oxm h GLN 104 Ca 0.05 -0.31 -0.10 0.00 0.77 0.00 0.00 58.65 59.06 1oxm h GLN 104 Cb 0.75 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.43 1oxm h GLN 104 CO 0.06 0.90 -0.05 0.00 -1.93 0.00 0.00 178.83 177.81 1oxm h ALA 105 N 1.06 0.85 -0.50 3.38 0.00 -0.98 -0.63 119.26 122.44 1oxm h ALA 105 Ca 0.04 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 1oxm h ALA 105 Cb 0.92 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 1oxm h ALA 105 CO 0.08 0.66 0.19 -0.97 0.00 0.00 0.00 179.25 179.21 1oxm h ASN 106 N 0.91 0.70 0.09 0.00 -1.24 -1.14 -0.99 115.58 113.90 1oxm h ASN 106 Ca 0.15 -0.18 -0.00 0.00 0.71 0.00 0.00 56.30 56.98 1oxm h ASN 106 Cb 0.60 -0.18 0.00 0.00 0.73 0.00 0.00 38.32 39.47 1oxm h ASN 106 CO 0.04 0.69 -0.04 0.74 -1.29 0.00 0.00 177.43 177.57 1oxm h THR 107 N 0.67 1.16 -0.48 -3.57 2.02 -1.29 -2.75 112.91 108.66 1oxm h THR 107 Ca 0.16 -1.21 -0.08 0.00 0.77 0.00 0.00 66.41 66.06 1oxm h THR 107 Cb 0.22 1.90 -0.02 0.00 -1.74 0.00 0.00 68.15 68.51 1oxm h THR 107 CO -0.01 0.28 -0.03 0.50 0.37 0.00 0.00 175.52 176.64 1oxm h LYS 108 N -0.70 0.82 -2.42 6.66 3.64 -1.16 -3.38 116.57 120.04 1oxm h LYS 108 Ca -0.01 -0.24 -0.59 0.00 -1.27 0.00 0.00 60.65 58.54 1oxm h LYS 108 Cb 0.55 -0.09 -0.39 0.00 -0.41 0.00 0.00 32.23 31.90 1oxm h LYS 108 CO 0.02 0.84 -0.94 0.00 -2.27 0.00 0.00 179.45 177.11 1oxm h PRO 110 N 5.46 0.00 -0.01 0.00 0.13 -1.66 -2.59 132.00 133.33 1oxm h PRO 110 Ca 0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.37 1oxm h PRO 110 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 1oxm h PRO 110 CO 0.42 0.00 -0.32 -0.25 -0.23 0.00 0.00 178.00 177.63 1oxm n ASP 111 N -3.60 1.78 -4.79 1.44 8.00 -1.26 -4.97 116.55 113.15 1oxm n ASP 111 Ca -0.01 -1.37 -0.35 0.00 0.71 0.00 0.00 54.79 53.77 1oxm n ASP 111 Cb 0.19 0.28 -0.03 0.00 -0.02 0.00 0.00 41.12 41.54 1oxm n ASP 111 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1oxm s ALA 112 N -2.40 2.92 -0.03 2.24 0.00 -0.98 -5.02 121.76 118.50 1oxm s ALA 112 Ca 0.23 0.67 -0.14 0.00 0.00 0.00 0.00 51.96 52.72 1oxm s ALA 112 Cb 0.19 -3.27 -0.05 0.00 0.00 0.00 0.00 23.12 19.98 1oxm s ALA 112 CO 0.51 -0.33 0.37 0.99 0.00 0.00 0.00 175.76 177.30 1oxm s THR 113 N -1.85 5.11 0.05 0.00 2.01 0.02 -4.96 115.64 116.03 1oxm s THR 113 Ca 0.65 0.75 0.02 0.00 0.31 0.00 0.00 61.69 63.42 1oxm s THR 113 Cb -0.19 -3.67 -0.04 0.00 0.01 0.00 0.00 72.50 68.61 1oxm s THR 113 CO 0.23 0.56 0.06 -0.76 -0.69 0.00 0.00 174.62 174.02 1oxm s LEU 114 N -0.91 3.72 0.01 4.42 1.43 -0.55 -1.16 118.68 125.64 1oxm s LEU 114 Ca 0.22 -0.01 -0.05 0.00 -1.03 0.00 0.00 54.13 53.26 1oxm s LEU 114 Cb -0.16 -2.33 -0.00 0.00 0.03 0.00 0.00 46.19 43.72 1oxm s LEU 114 CO 0.12 0.21 0.09 0.27 0.23 0.00 0.00 176.35 177.26 1oxm s ILE 115 N -1.30 0.09 0.29 -0.59 -4.36 -0.90 0.26 121.20 114.70 1oxm s ILE 115 Ca 0.26 -0.75 0.01 0.00 -0.26 0.00 0.00 60.65 59.91 1oxm s ILE 115 Cb -0.12 -0.38 -0.02 0.00 1.25 0.00 0.00 42.46 43.18 1oxm s ILE 115 CO 0.18 -0.41 0.30 0.00 0.24 0.00 0.00 174.94 175.25 1oxm s ALA 116 N -1.41 1.24 -0.04 2.27 0.00 -0.80 -1.89 121.76 121.13 1oxm s ALA 116 Ca -0.15 -1.74 -0.31 0.00 0.00 0.00 0.00 51.96 49.76 1oxm s ALA 116 Cb -0.08 1.35 0.12 0.00 0.00 0.00 0.00 23.12 24.50 1oxm s ALA 116 CO 0.01 -0.69 1.21 0.20 0.00 0.00 0.00 175.76 176.49 1oxm s GLY 117 N -3.25 -0.37 0.01 0.00 0.00 -0.93 -2.09 107.32 100.69 1oxm s GLY 117 Ca 0.36 0.86 -0.28 0.00 0.00 0.00 0.00 44.72 45.67 1oxm s GLY 117 CO 0.20 0.22 0.82 -0.32 0.00 0.00 0.00 173.10 174.02 1oxm s GLY 118 N -2.76 -0.49 -0.06 0.20 0.00 -0.74 -1.74 107.32 101.73 1oxm s GLY 118 Ca 0.12 1.02 0.01 0.00 0.00 0.00 0.00 44.72 45.87 1oxm s GLY 118 CO -0.04 0.40 -0.08 -0.47 0.00 0.00 0.00 173.10 172.91 1oxm s TYR 119 N -2.95 1.14 0.00 1.90 5.04 -1.04 -1.31 117.35 120.13 1oxm s TYR 119 Ca 0.03 -0.40 0.00 0.00 -2.44 0.00 0.00 57.07 54.25 1oxm s TYR 119 Cb -0.01 -0.90 0.00 0.00 0.35 0.00 0.00 41.96 41.40 1oxm s TYR 119 CO -0.08 -0.26 0.00 0.45 -1.34 0.00 0.00 175.55 174.33 1oxm n SER 120 N 4.02 0.00 -0.00 4.32 2.88 -0.06 -0.94 113.62 123.84 1oxm n SER 120 Ca -0.23 0.00 0.10 0.00 -1.33 0.00 0.00 58.87 57.41 1oxm n SER 120 Cb 0.51 0.00 0.52 0.00 -0.75 0.00 0.00 64.21 64.49 1oxm n SER 120 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 1oxm h GLN 121 N 0.00 0.33 0.00 -1.46 4.15 -1.84 0.94 115.11 117.23 1oxm h GLN 121 Ca 0.00 -0.02 -0.04 0.00 0.77 0.00 0.00 58.65 59.36 1oxm h GLN 121 Cb 0.00 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.61 1oxm h GLN 121 CO 0.00 0.22 -0.19 0.78 -1.93 0.00 0.00 178.83 177.72 1oxm h GLY 122 N 0.34 0.00 1.23 2.39 0.00 -0.84 -0.90 103.07 105.29 1oxm h GLY 122 Ca 0.20 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.30 1oxm h GLY 122 CO -0.05 0.00 -0.82 0.00 0.00 0.00 0.00 176.54 175.68 1oxm h ALA 123 N 1.81 0.31 -0.46 3.60 0.00 -0.86 -0.70 119.26 122.96 1oxm h ALA 123 Ca -0.00 -0.62 -0.08 0.00 0.00 0.00 0.00 54.91 54.21 1oxm h ALA 123 Cb 0.56 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1oxm h ALA 123 CO 0.02 0.69 -0.03 0.00 0.00 0.00 0.00 179.25 179.94 1oxm h ALA 124 N 0.57 0.62 -0.54 0.00 0.00 -1.11 -1.92 119.26 116.89 1oxm h ALA 124 Ca -0.06 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 1oxm h ALA 124 Cb 1.45 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 1oxm h ALA 124 CO 0.16 0.45 0.16 1.25 0.00 0.00 0.00 179.25 181.28 1oxm h LEU 125 N 0.68 0.79 -0.81 0.00 5.85 -1.12 -0.82 115.31 119.88 1oxm h LEU 125 Ca 0.13 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.61 1oxm h LEU 125 Cb 0.55 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 1oxm h LEU 125 CO 0.03 0.79 0.39 0.00 -0.34 0.00 0.00 178.44 179.31 1oxm h ALA 126 N 1.03 1.04 -0.27 1.25 0.00 -1.05 -0.55 119.26 120.70 1oxm h ALA 126 Ca 0.17 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1oxm h ALA 126 Cb 0.29 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1oxm h ALA 126 CO -0.00 0.60 0.06 0.00 0.00 0.00 0.00 179.25 179.90 1oxm h ALA 127 N 1.21 0.36 -0.42 0.00 0.00 -1.03 -1.08 119.26 118.29 1oxm h ALA 127 Ca 0.28 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1oxm h ALA 127 Cb 0.11 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1oxm h ALA 127 CO -0.04 0.03 0.06 0.00 0.00 0.00 0.00 179.25 179.30 1oxm h ALA 128 N 0.88 0.57 -0.15 0.00 0.00 -0.96 -1.66 119.26 117.93 1oxm h ALA 128 Ca 0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1oxm h ALA 128 Cb 0.31 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1oxm h ALA 128 CO 0.00 0.30 0.04 0.77 0.00 0.00 0.00 179.25 180.36 1oxm h SER 129 N 0.56 0.23 -0.48 0.00 0.02 -1.09 -1.90 113.55 110.89 1oxm h SER 129 Ca 0.13 -0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 60.84 1oxm h SER 129 Cb 0.40 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.85 1oxm h SER 129 CO 0.01 0.39 0.26 0.40 -1.14 0.00 0.00 176.83 176.75 1oxm h ILE 130 N 0.05 1.17 -0.25 3.27 2.04 -1.16 -0.54 117.51 122.09 1oxm h ILE 130 Ca 0.05 -0.46 -0.02 0.00 1.00 0.00 0.00 64.86 65.43 1oxm h ILE 130 Cb 0.25 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 1oxm h ILE 130 CO -0.00 0.19 0.08 -0.08 0.00 0.00 0.00 178.15 178.34 1oxm h GLU 131 N 0.72 0.38 0.00 2.37 4.81 -1.01 -3.02 114.58 118.83 1oxm h GLU 131 Ca 0.18 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1oxm h GLU 131 Cb 0.06 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1oxm h GLU 131 CO -0.03 0.46 0.00 -0.44 -0.73 0.00 0.00 179.01 178.28 1oxm h ASP 132 N 0.23 0.00 -3.41 1.04 5.19 -0.99 -3.47 116.42 115.01 1oxm h ASP 132 Ca 0.08 0.00 -0.57 0.00 -0.62 0.00 0.00 57.03 55.92 1oxm h ASP 132 Cb 0.24 0.00 0.14 0.00 0.18 0.00 0.00 39.33 39.89 1oxm h ASP 132 CO -0.00 0.00 0.30 -0.11 -3.12 0.00 0.00 179.24 176.31 1oxm n LEU 133 N -2.93 3.55 -4.71 1.55 0.00 -0.24 -4.90 117.00 109.32 1oxm n LEU 133 Ca 0.03 1.01 -0.42 0.00 0.00 0.00 0.00 56.01 56.63 1oxm n LEU 133 Cb 0.41 -1.43 -0.03 0.00 0.00 0.00 0.00 43.42 42.37 1oxm n LEU 133 CO 0.30 -1.20 1.20 -0.62 0.00 0.00 0.00 177.39 177.08 1oxm s ASP 134 N -0.78 6.66 0.39 1.96 -1.08 -1.26 -4.76 116.67 117.79 1oxm s ASP 134 Ca 0.66 2.50 0.17 0.00 -0.52 0.00 0.00 52.55 55.36 1oxm s ASP 134 Cb -0.50 -2.58 1.08 0.00 -1.46 0.00 0.00 42.92 39.45 1oxm s ASP 134 CO 0.55 -0.79 1.76 0.77 0.52 0.00 0.00 175.17 177.97 1oxm h SER 135 N 7.15 0.48 -0.81 -0.34 4.64 -1.95 0.19 113.55 122.90 1oxm h SER 135 Ca -0.42 0.09 0.03 0.00 -0.47 0.00 0.00 61.79 61.02 1oxm h SER 135 Cb 1.20 0.02 -0.05 0.00 -0.31 0.00 0.00 62.40 63.27 1oxm h SER 135 CO 0.91 0.08 0.54 0.00 -0.87 0.00 0.00 176.83 177.48 1oxm h ALA 136 N 1.64 1.49 0.16 5.18 0.00 -2.00 0.13 119.26 125.86 1oxm h ALA 136 Ca 0.61 -0.04 -0.32 0.00 0.00 0.00 0.00 54.91 55.16 1oxm h ALA 136 Cb 1.50 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 19.00 1oxm h ALA 136 CO -0.33 0.43 -1.55 0.82 0.00 0.00 0.00 179.25 178.62 1oxm h ILE 137 N 1.02 1.15 -0.45 0.00 2.04 -1.11 -3.31 117.51 116.85 1oxm h ILE 137 Ca 0.32 -2.74 0.02 0.00 1.00 0.00 0.00 64.86 63.46 1oxm h ILE 137 Cb 0.01 2.82 -0.02 0.00 -0.74 0.00 0.00 36.82 38.89 1oxm h ILE 137 CO -0.09 0.83 0.30 -0.09 0.00 0.00 0.00 178.15 179.11 1oxm h ARG 138 N 0.09 0.55 -0.03 2.37 2.43 -0.45 -0.31 114.38 119.03 1oxm h ARG 138 Ca -0.26 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 58.88 1oxm h ARG 138 Cb 2.06 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 31.48 1oxm h ARG 138 CO 0.19 0.36 0.03 -0.44 -1.51 0.00 0.00 179.97 178.60 1oxm h ASP 139 N 0.57 0.00 1.33 -3.80 3.32 -0.84 -1.18 116.42 115.81 1oxm h ASP 139 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1oxm h ASP 139 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1oxm h ASP 139 CO -0.04 0.00 0.00 0.29 -1.72 0.00 0.00 179.24 177.77 1oxm n LYS 140 N -3.80 0.25 -2.68 3.56 5.02 -0.13 -4.67 118.16 115.72 1oxm n LYS 140 Ca -0.02 0.26 -0.42 0.00 -2.02 0.00 0.00 58.31 56.11 1oxm n LYS 140 Cb 0.12 -1.82 -0.03 0.00 -0.02 0.00 0.00 35.03 33.27 1oxm n LYS 140 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1oxm s ILE 141 N -3.15 3.99 0.49 -0.18 1.01 -0.45 -1.48 121.20 121.44 1oxm s ILE 141 Ca 0.09 -0.05 0.19 0.00 0.00 0.00 0.00 60.65 60.89 1oxm s ILE 141 Cb 0.12 -4.84 0.25 0.00 0.01 0.00 0.00 42.46 37.99 1oxm s ILE 141 CO 0.56 -1.71 2.09 0.00 0.00 0.00 0.00 174.94 175.88 1oxm h ALA 142 N 9.80 1.70 -1.64 9.38 0.00 -0.46 -3.46 119.26 134.57 1oxm h ALA 142 Ca -0.22 -0.09 0.13 0.00 0.00 0.00 0.00 54.91 54.73 1oxm h ALA 142 Cb 1.05 -0.01 -0.21 0.00 0.00 0.00 0.00 17.79 18.61 1oxm h ALA 142 CO 1.25 0.12 0.61 0.20 0.00 0.00 0.00 179.25 181.43 1oxm s GLY 143 N -4.14 -0.27 -0.02 0.00 0.00 -1.26 -4.77 107.32 96.86 1oxm s GLY 143 Ca -0.04 1.85 0.01 0.00 0.00 0.00 0.00 44.72 46.54 1oxm s GLY 143 CO 0.65 0.83 -0.01 -1.59 0.00 0.00 0.00 173.10 172.98 1oxm s THR 144 N -1.67 0.21 -0.06 0.90 2.01 0.53 -1.91 115.64 115.63 1oxm s THR 144 Ca 0.02 -0.02 0.04 0.00 0.31 0.00 0.00 61.69 62.04 1oxm s THR 144 Cb -0.01 -0.24 -0.02 0.00 0.01 0.00 0.00 72.50 72.24 1oxm s THR 144 CO -0.02 0.11 -0.17 0.68 -0.69 0.00 0.00 174.62 174.53 1oxm s VAL 145 N 0.48 2.83 -0.05 3.82 -7.23 -0.89 -1.86 120.40 117.51 1oxm s VAL 145 Ca -0.05 -0.79 0.03 0.00 -1.81 0.00 0.00 61.98 59.36 1oxm s VAL 145 Cb -0.08 -2.10 0.01 0.00 0.56 0.00 0.00 36.38 34.77 1oxm s VAL 145 CO -0.01 0.58 -0.13 -0.76 -0.31 0.00 0.00 175.10 174.47 1oxm s LEU 146 N -0.47 1.72 -0.07 1.32 1.43 -0.38 -1.79 118.68 120.44 1oxm s LEU 146 Ca 0.06 -0.29 0.04 0.00 -1.03 0.00 0.00 54.13 52.91 1oxm s LEU 146 Cb -0.12 -0.80 -0.02 0.00 0.03 0.00 0.00 46.19 45.29 1oxm s LEU 146 CO 0.02 0.06 -0.19 -0.36 0.23 0.00 0.00 176.35 176.11 1oxm s PHE 147 N 0.44 2.62 -1.37 0.29 0.40 -0.43 -0.07 117.98 119.86 1oxm s PHE 147 Ca -0.10 -0.52 -0.02 0.00 -0.60 0.00 0.00 56.93 55.69 1oxm s PHE 147 Cb -0.13 -1.67 -0.00 0.00 0.51 0.00 0.00 43.02 41.72 1oxm s PHE 147 CO 0.03 -0.08 0.49 0.41 0.70 0.00 0.00 175.22 176.76 1oxm n GLY 148 N 2.88 -0.29 3.57 4.36 0.00 -0.18 -0.88 105.19 114.66 1oxm n GLY 148 Ca -0.17 0.17 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 1oxm n GLY 148 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1oxm s TYR 149 N -3.88 1.26 -0.01 1.61 5.04 -1.26 -3.10 117.35 117.01 1oxm s TYR 149 Ca 0.04 1.07 0.28 0.00 -2.44 0.00 0.00 57.07 56.02 1oxm s TYR 149 Cb -0.01 -3.81 1.47 0.00 0.35 0.00 0.00 41.96 39.96 1oxm s TYR 149 CO 0.87 -2.98 1.85 1.79 -1.34 0.00 0.00 175.55 175.75 1oxm h THR 150 N 7.34 0.00 -0.26 4.34 1.35 -1.74 -1.26 112.91 122.67 1oxm h THR 150 Ca -0.30 -0.05 -0.10 0.00 -0.55 0.00 0.00 66.41 65.41 1oxm h THR 150 Cb 1.23 0.70 -0.06 0.00 -1.73 0.00 0.00 68.15 68.30 1oxm h THR 150 CO 1.10 0.00 -0.10 0.29 -0.25 0.00 0.00 175.52 176.56 1oxm n LYS 151 N -2.49 2.00 0.15 4.72 4.76 -1.26 -4.77 118.16 121.27 1oxm n LYS 151 Ca -0.01 -3.06 -0.14 0.00 -2.87 0.00 0.00 58.31 52.22 1oxm n LYS 151 Cb 0.08 -1.77 -0.08 0.00 -1.84 0.00 0.00 35.03 31.41 1oxm n LYS 151 CO 0.00 0.00 0.00 -0.97 -1.37 0.00 0.00 177.40 175.06 1oxm h ASN 152 N 1.08 -0.28 0.79 4.39 -0.73 -1.46 0.28 115.58 119.64 1oxm h ASN 152 Ca 0.13 -0.08 -0.04 0.00 1.87 0.00 0.00 56.30 58.18 1oxm h ASN 152 Cb 1.48 0.07 0.01 0.00 0.27 0.00 0.00 38.32 40.15 1oxm h ASN 152 CO 0.27 -0.10 -0.38 0.25 -0.37 0.00 0.00 177.43 177.11 1oxm h LEU 153 N -0.45 -0.90 -1.04 0.34 5.85 -1.82 0.29 115.31 117.57 1oxm h LEU 153 Ca -0.03 0.02 0.16 0.00 0.84 0.00 0.00 57.88 58.86 1oxm h LEU 153 Cb 0.34 0.23 -0.09 0.00 0.37 0.00 0.00 40.66 41.51 1oxm h LEU 153 CO 0.06 -0.58 0.62 1.56 -0.34 0.00 0.00 178.44 179.75 1oxm h GLN 154 N -1.16 0.82 -0.57 1.25 7.50 -1.89 0.09 115.11 121.14 1oxm h GLN 154 Ca -0.11 -0.05 0.00 0.00 0.50 0.00 0.00 58.65 58.99 1oxm h GLN 154 Cb 0.83 -0.18 0.00 0.00 0.05 0.00 0.00 27.48 28.17 1oxm h GLN 154 CO 0.18 0.54 0.00 0.09 -1.50 0.00 0.00 178.83 178.14 1oxm n ASN 155 N -4.69 3.26 -3.29 1.46 3.02 0.09 -4.95 115.26 110.17 1oxm n ASN 155 Ca 0.21 -1.98 -0.24 0.00 -0.03 0.00 0.00 54.58 52.54 1oxm n ASN 155 Cb 0.49 -0.38 0.02 0.00 -0.61 0.00 0.00 39.78 39.30 1oxm n ASN 155 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1oxm n ARG 156 N 1.30 -4.63 -1.41 3.52 5.12 0.02 -1.63 116.66 118.95 1oxm n ARG 156 Ca 0.20 0.71 -0.12 0.00 -1.93 0.00 0.00 57.85 56.71 1oxm n ARG 156 Cb 0.53 -5.53 -0.05 0.00 -1.16 0.00 0.00 32.46 26.24 1oxm n ARG 156 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1oxm n GLY 157 N -1.45 1.26 3.58 -0.13 0.00 0.88 -5.01 105.19 104.32 1oxm n GLY 157 Ca -0.05 -0.45 -0.27 0.00 0.00 0.00 0.00 46.02 45.26 1oxm n GLY 157 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1oxm s ARG 158 N -3.14 1.88 -0.23 1.61 1.81 -0.64 -4.89 118.95 115.35 1oxm s ARG 158 Ca 0.00 -2.03 -0.03 0.00 -1.72 0.00 0.00 55.73 51.95 1oxm s ARG 158 Cb 0.00 -1.61 0.01 0.00 -0.45 0.00 0.00 34.95 32.90 1oxm s ARG 158 CO 0.00 0.01 -0.05 0.42 -0.68 0.00 0.00 175.30 175.00 1oxm s ILE 159 N -2.72 3.15 0.27 1.52 1.01 -1.26 -4.84 121.20 118.33 1oxm s ILE 159 Ca 0.34 -0.71 -0.29 0.00 0.00 0.00 0.00 60.65 59.99 1oxm s ILE 159 Cb 0.07 -2.49 -0.14 0.00 0.01 0.00 0.00 42.46 39.91 1oxm s ILE 159 CO 0.17 0.34 1.11 -2.65 0.00 0.00 0.00 174.94 173.90 1oxm n PRO 160 N 4.75 1.49 -0.94 2.79 -0.02 -1.26 -1.83 135.00 139.98 1oxm n PRO 160 Ca -0.18 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 1oxm n PRO 160 Cb 0.49 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 1oxm n PRO 160 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1oxm n ASN 161 N 1.37 -4.16 -4.26 2.55 3.02 -1.26 -4.25 115.26 108.27 1oxm n ASN 161 Ca 0.10 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.33 1oxm n ASN 161 Cb 0.31 -2.44 -0.16 0.00 -0.61 0.00 0.00 39.78 36.87 1oxm n ASN 161 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1oxm s TYR 162 N -1.41 2.49 0.24 3.10 5.04 -0.76 -5.04 117.35 121.01 1oxm s TYR 162 Ca 0.00 -0.80 -0.31 0.00 -2.44 0.00 0.00 57.07 53.52 1oxm s TYR 162 Cb 0.00 -1.64 -0.14 0.00 0.35 0.00 0.00 41.96 40.54 1oxm s TYR 162 CO 0.00 -0.27 1.33 -2.30 -1.34 0.00 0.00 175.55 172.98 1oxm n PRO 163 N 3.11 1.86 -0.24 4.97 -0.02 -1.26 -4.57 135.00 138.84 1oxm n PRO 163 Ca -0.18 0.66 -0.02 0.00 -2.02 0.00 0.00 63.50 61.95 1oxm n PRO 163 Cb 0.52 -2.27 0.18 0.00 -0.02 0.00 0.00 33.50 31.91 1oxm n PRO 163 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1oxm h ALA 164 N 3.80 1.31 0.00 3.55 0.00 -1.93 -2.11 119.26 123.88 1oxm h ALA 164 Ca -0.44 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1oxm h ALA 164 Cb 1.29 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1oxm h ALA 164 CO 0.73 0.57 0.00 -0.40 0.00 0.00 0.00 179.25 180.15 1oxm n ASP 165 N -4.36 0.62 -0.65 0.00 5.75 -1.26 -1.60 116.55 115.04 1oxm n ASP 165 Ca 0.08 0.69 0.12 0.00 -0.01 0.00 0.00 54.79 55.66 1oxm n ASP 165 Cb 0.09 -0.81 0.08 0.00 -1.03 0.00 0.00 41.12 39.45 1oxm n ASP 165 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1oxm n ARG 166 N -2.22 1.61 -4.50 0.11 1.74 -0.80 -4.94 116.66 107.66 1oxm n ARG 166 Ca 0.01 -1.31 -0.34 0.00 -0.77 0.00 0.00 57.85 55.44 1oxm n ARG 166 Cb 0.17 -1.47 -0.11 0.00 -1.02 0.00 0.00 32.46 30.03 1oxm n ARG 166 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1oxm s THR 167 N -2.29 3.97 -0.10 0.55 2.01 -0.63 -0.35 115.64 118.80 1oxm s THR 167 Ca 0.23 -0.37 -0.02 0.00 0.31 0.00 0.00 61.69 61.84 1oxm s THR 167 Cb 0.19 -2.65 0.04 0.00 0.01 0.00 0.00 72.50 70.08 1oxm s THR 167 CO 0.46 0.59 0.02 -0.75 -0.69 0.00 0.00 174.62 174.25 1oxm s LYS 168 N -0.71 0.52 -0.11 4.92 2.47 -0.78 -4.96 119.74 121.09 1oxm s LYS 168 Ca 0.11 0.02 -0.03 0.00 -1.56 0.00 0.00 55.97 54.50 1oxm s LYS 168 Cb -0.11 -1.21 -0.03 0.00 -1.46 0.00 0.00 37.83 35.01 1oxm s LYS 168 CO 0.02 -0.40 0.01 0.08 0.16 0.00 0.00 175.35 175.23 1oxm s VAL 169 N 1.98 4.41 -0.31 4.02 1.01 -1.26 -1.25 120.40 128.99 1oxm s VAL 169 Ca 0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 1oxm s VAL 169 Cb -0.13 -2.89 0.06 0.00 0.00 0.00 0.00 36.38 33.42 1oxm s VAL 169 CO -0.06 0.57 0.02 -0.36 0.00 0.00 0.00 175.10 175.27 1oxm s PHE 170 N -0.55 3.33 -0.21 5.22 0.08 0.89 -4.95 117.98 121.79 1oxm s PHE 170 Ca 0.10 -2.04 -0.02 0.00 0.12 0.00 0.00 56.93 55.09 1oxm s PHE 170 Cb -0.12 -2.27 0.06 0.00 -0.57 0.00 0.00 43.02 40.12 1oxm s PHE 170 CO 0.02 -0.84 0.03 0.00 -0.10 0.00 0.00 175.22 174.33 1oxm s ASN 172 N 1.77 6.45 0.23 0.00 0.01 -1.26 -4.98 114.94 117.16 1oxm s ASN 172 Ca -0.01 2.17 -0.31 0.00 -0.71 0.00 0.00 52.86 54.00 1oxm s ASN 172 Cb -0.17 -2.59 -0.11 0.00 0.41 0.00 0.00 41.25 38.78 1oxm s ASN 172 CO -0.09 -0.72 1.61 -0.89 -1.51 0.00 0.00 177.10 175.50 1oxm s THR 173 N -1.61 2.26 0.00 1.60 2.01 -1.26 -1.28 115.64 117.35 1oxm s THR 173 Ca 0.61 0.20 0.00 0.00 0.31 0.00 0.00 61.69 62.81 1oxm s THR 173 Cb -0.25 -3.13 0.00 0.00 0.01 0.00 0.00 72.50 69.13 1oxm s THR 173 CO 0.31 0.02 0.00 0.61 -0.69 0.00 0.00 174.62 174.87 1oxm n GLY 174 N 3.09 1.18 3.51 4.40 0.00 -1.26 -4.84 105.19 111.27 1oxm n GLY 174 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1oxm n GLY 174 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1oxm s ASP 175 N -2.94 6.21 0.56 1.61 -1.08 -0.41 -4.63 116.67 115.99 1oxm s ASP 175 Ca 0.00 -0.82 0.27 0.00 -0.52 0.00 0.00 52.55 51.48 1oxm s ASP 175 Cb 0.00 -2.50 1.49 0.00 -1.46 0.00 0.00 42.92 40.45 1oxm s ASP 175 CO 0.00 -1.62 1.99 -0.07 0.52 0.00 0.00 175.17 175.99 1oxm h LEU 176 N 12.23 0.00 -1.33 -1.34 3.38 -1.88 -2.02 115.31 124.36 1oxm h LEU 176 Ca -0.22 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 1oxm h LEU 176 Cb 1.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 1oxm h LEU 176 CO 1.25 0.00 -0.09 -0.37 0.09 0.00 0.00 178.44 179.32 1oxm h VAL 177 N 0.00 0.23 0.00 1.22 -1.51 -1.71 -1.30 116.25 113.18 1oxm h VAL 177 Ca 0.20 -0.74 0.00 0.00 -1.23 0.00 0.00 66.70 64.93 1oxm h VAL 177 Cb 0.93 1.61 0.00 0.00 -2.13 0.00 0.00 31.29 31.69 1oxm h VAL 177 CO -0.00 0.08 -0.22 0.00 -1.23 0.00 0.00 177.57 176.20 1oxm n THR 179 N -2.41 2.17 -0.31 0.00 5.66 -0.85 -3.24 114.28 115.29 1oxm n THR 179 Ca 0.04 -1.50 0.00 0.00 -3.05 0.00 0.00 64.05 59.54 1oxm n THR 179 Cb 0.46 -0.09 0.00 0.00 -1.55 0.00 0.00 70.33 69.15 1oxm n THR 179 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1oxm n GLY 180 N 0.27 0.84 3.62 1.09 0.00 -1.18 -4.95 105.19 104.88 1oxm n GLY 180 Ca 0.23 -0.01 -0.26 0.00 0.00 0.00 0.00 46.02 45.98 1oxm n GLY 180 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1oxm s SER 181 N -2.01 4.01 -0.31 1.61 0.15 -0.55 -5.02 113.70 111.59 1oxm s SER 181 Ca 0.00 -1.17 0.07 0.00 0.70 0.00 0.00 55.95 55.56 1oxm s SER 181 Cb 0.00 -0.44 0.46 0.00 -1.71 0.00 0.00 66.02 64.33 1oxm s SER 181 CO 0.00 -0.33 1.31 0.18 1.20 0.00 0.00 173.24 175.60 1oxm n LEU 182 N -0.96 4.59 -4.61 3.45 4.77 -1.26 -3.38 117.00 119.60 1oxm n LEU 182 Ca -0.04 -4.40 -0.35 0.00 -0.03 0.00 0.00 56.01 51.19 1oxm n LEU 182 Cb 0.64 -0.48 -0.10 0.00 -2.33 0.00 0.00 43.42 41.16 1oxm n LEU 182 CO 0.45 1.79 -0.25 -0.63 -1.33 0.00 0.00 177.39 177.42 1oxm s ILE 183 N -4.15 4.73 -0.27 -0.08 -1.09 -1.26 -5.02 121.20 114.05 1oxm s ILE 183 Ca 0.49 -0.05 -0.19 0.00 -2.23 0.00 0.00 60.65 58.66 1oxm s ILE 183 Cb 0.41 -3.14 -0.02 0.00 -1.58 0.00 0.00 42.46 38.13 1oxm s ILE 183 CO 0.01 0.45 0.58 -0.69 -1.23 0.00 0.00 174.94 174.05 1oxm s VAL 184 N 0.49 5.01 0.42 2.92 1.01 -1.26 -4.13 120.40 124.85 1oxm s VAL 184 Ca 0.03 0.92 0.06 0.00 0.00 0.00 0.00 61.98 63.00 1oxm s VAL 184 Cb -0.13 -3.91 -0.06 0.00 0.00 0.00 0.00 36.38 32.28 1oxm s VAL 184 CO 0.01 -0.00 0.08 0.00 0.00 0.00 0.00 175.10 175.18 1oxm s ALA 185 N 2.45 3.44 0.28 5.51 0.00 -1.26 -5.03 121.76 127.15 1oxm s ALA 185 Ca 0.24 -2.02 0.02 0.00 0.00 0.00 0.00 51.96 50.19 1oxm s ALA 185 Cb -0.15 -0.06 0.65 0.00 0.00 0.00 0.00 23.12 23.56 1oxm s ALA 185 CO 0.10 -0.14 1.72 0.00 0.00 0.00 0.00 175.76 177.44 1oxm h ALA 186 N 1.58 1.37 0.00 0.00 0.00 -1.97 -1.28 119.26 118.96 1oxm h ALA 186 Ca -0.43 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 1oxm h ALA 186 Cb 1.25 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 1oxm h ALA 186 CO 0.76 -0.25 -0.01 -1.35 0.00 0.00 0.00 179.25 178.40 1oxm h PRO 187 N 0.48 0.00 0.00 0.00 0.11 -1.88 -1.24 132.00 129.46 1oxm h PRO 187 Ca 0.52 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.63 1oxm h PRO 187 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1oxm h PRO 187 CO -0.46 0.01 0.00 1.25 -0.21 0.00 0.00 178.00 178.58 1oxm h HIS 188 N 0.00 0.00 -0.45 0.65 2.76 -1.53 -2.58 115.15 114.00 1oxm h HIS 188 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1oxm h HIS 188 Cb 0.02 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.98 1oxm h HIS 188 CO 0.00 0.00 0.00 1.28 -1.30 0.00 0.00 177.93 177.91 1oxm n LEU 189 N -2.98 4.02 -1.54 0.26 4.77 -0.47 -4.52 117.00 116.54 1oxm n LEU 189 Ca -0.00 -2.51 -0.11 0.00 -0.03 0.00 0.00 56.01 53.36 1oxm n LEU 189 Cb 0.23 -0.47 0.19 0.00 -2.33 0.00 0.00 43.42 41.04 1oxm n LEU 189 CO 0.24 0.74 0.89 0.00 -1.33 0.00 0.00 177.39 177.94 1oxm n ALA 190 N 0.45 4.80 1.54 -1.18 0.00 -0.97 -4.62 120.51 120.53 1oxm n ALA 190 Ca 0.21 -3.08 0.14 0.00 0.00 0.00 0.00 53.44 50.70 1oxm n ALA 190 Cb 0.77 -0.98 0.57 0.00 0.00 0.00 0.00 19.45 19.81 1oxm n ALA 190 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1oxm n TYR 191 N -1.13 0.00 -0.10 0.00 4.01 -1.26 -4.43 117.16 114.25 1oxm n TYR 191 Ca 0.43 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 58.10 1oxm n TYR 191 Cb 1.25 -0.02 -0.00 0.00 -0.31 0.00 0.00 39.34 40.26 1oxm n TYR 191 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1oxm h GLY 192 N 4.88 -0.05 0.72 2.72 0.00 -1.97 -1.69 103.07 107.68 1oxm h GLY 192 Ca 0.00 0.30 0.09 0.00 0.00 0.00 0.00 47.33 47.72 1oxm h GLY 192 CO 0.00 -0.20 0.59 -2.55 0.00 0.00 0.00 176.54 174.37 1oxm h PRO 193 N -0.19 0.90 -0.43 4.80 0.11 -1.99 -2.43 132.00 132.77 1oxm h PRO 193 Ca 0.17 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.15 1oxm h PRO 193 Cb 0.46 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.35 1oxm h PRO 193 CO -0.46 0.60 -0.05 -0.44 -0.21 0.00 0.00 178.00 177.44 1oxm h ASP 194 N 0.93 0.78 0.46 -2.05 3.32 -1.63 -2.32 116.42 115.90 1oxm h ASP 194 Ca 0.42 -0.33 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 1oxm h ASP 194 Cb 0.37 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.71 1oxm h ASP 194 CO -0.18 0.93 -0.10 0.00 -1.72 0.00 0.00 179.24 178.17 1oxm h ALA 195 N 0.88 1.19 0.00 3.45 0.00 -0.96 -1.64 119.26 122.18 1oxm h ALA 195 Ca 0.12 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1oxm h ALA 195 Cb 0.55 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1oxm h ALA 195 CO 0.03 0.12 -1.17 0.54 0.00 0.00 0.00 179.25 178.77 1oxm n ARG 196 N -3.49 0.57 0.00 0.00 1.74 -0.96 -3.54 116.66 110.99 1oxm n ARG 196 Ca -0.01 0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 1oxm n ARG 196 Cb 0.24 -1.74 0.00 0.00 -1.02 0.00 0.00 32.46 29.94 1oxm n ARG 196 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1oxm n GLY 197 N 1.22 0.56 0.36 -0.13 0.00 -0.90 -4.89 105.19 101.41 1oxm n GLY 197 Ca -0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.14 1oxm n GLY 197 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oxm h PRO 198 N 0.00 0.76 0.43 1.61 0.13 -1.78 -2.50 132.00 130.65 1oxm h PRO 198 Ca 0.00 -0.05 -0.02 0.00 -0.87 0.00 0.00 66.00 65.06 1oxm h PRO 198 Cb 0.00 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 30.96 1oxm h PRO 198 CO 0.00 0.50 -0.21 0.00 -0.23 0.00 0.00 178.00 178.06 1oxm h ALA 199 N 1.63 -0.58 -0.06 -0.56 0.00 -1.60 -1.44 119.26 116.66 1oxm h ALA 199 Ca 0.57 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 55.27 1oxm h ALA 199 Cb 0.87 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1oxm h ALA 199 CO -0.36 -0.72 -0.13 -1.00 0.00 0.00 0.00 179.25 177.03 1oxm h PRO 200 N -0.80 0.09 -0.47 0.00 0.13 -1.75 -2.21 132.00 126.99 1oxm h PRO 200 Ca -0.06 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.05 1oxm h PRO 200 Cb 0.54 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.64 1oxm h PRO 200 CO 0.10 0.23 0.27 0.93 -0.23 0.00 0.00 178.00 179.29 1oxm h GLU 201 N 0.08 0.65 0.05 0.86 5.08 -1.34 0.49 114.58 120.46 1oxm h GLU 201 Ca 0.02 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1oxm h GLU 201 Cb 0.29 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1oxm h GLU 201 CO 0.02 0.50 -0.09 0.35 -1.00 0.00 0.00 179.01 178.78 1oxm h PHE 202 N 0.62 -0.23 -0.48 4.33 3.57 -0.80 -0.90 116.94 123.05 1oxm h PHE 202 Ca 0.17 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.72 1oxm h PHE 202 Cb 0.03 0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.82 1oxm h PHE 202 CO -0.02 -0.14 0.23 -0.07 -2.23 0.00 0.00 178.31 176.07 1oxm h LEU 203 N -0.18 0.31 -0.91 0.59 3.38 -1.13 -0.94 115.31 116.42 1oxm h LEU 203 Ca 0.02 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 1oxm h LEU 203 Cb 0.20 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1oxm h LEU 203 CO -0.06 0.22 0.21 0.40 0.09 0.00 0.00 178.44 179.30 1oxm h ILE 204 N 0.45 1.24 -0.39 1.22 2.04 -0.71 -2.11 117.51 119.25 1oxm h ILE 204 Ca 0.21 -0.83 -0.07 0.00 1.00 0.00 0.00 64.86 65.17 1oxm h ILE 204 Cb 0.14 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 1oxm h ILE 204 CO -0.17 0.32 -0.04 -0.08 0.00 0.00 0.00 178.15 178.19 1oxm h GLU 205 N 0.97 0.72 -0.68 2.37 4.81 -0.64 -2.43 114.58 119.70 1oxm h GLU 205 Ca 0.22 -0.25 -0.04 0.00 -0.13 0.00 0.00 59.36 59.15 1oxm h GLU 205 Cb 0.27 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.57 1oxm h GLU 205 CO -0.01 0.83 0.25 0.87 -0.73 0.00 0.00 179.01 180.23 1oxm h LYS 206 N 0.54 1.03 -0.48 1.92 1.79 -0.95 -1.98 116.57 118.44 1oxm h LYS 206 Ca 0.11 -0.20 -0.06 0.00 -2.18 0.00 0.00 60.65 58.32 1oxm h LYS 206 Cb 0.53 -0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 31.00 1oxm h LYS 206 CO 0.03 0.87 0.06 0.28 -1.08 0.00 0.00 179.45 179.61 1oxm h VAL 207 N 0.98 1.25 0.00 0.50 2.07 -1.34 -1.94 116.25 117.76 1oxm h VAL 207 Ca 0.22 -0.95 -0.05 0.00 0.82 0.00 0.00 66.70 66.74 1oxm h VAL 207 Cb 0.24 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 1oxm h VAL 207 CO -0.01 0.34 -0.25 0.03 0.02 0.00 0.00 177.57 177.69 1oxm h ARG 208 N 0.68 0.00 -0.00 1.57 3.08 -1.29 -1.96 114.38 116.46 1oxm h ARG 208 Ca 0.14 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.12 1oxm h ARG 208 Cb 0.42 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.47 1oxm h ARG 208 CO 0.01 0.25 -0.30 0.00 -1.07 0.00 0.00 179.97 178.87 1oxm h ALA 209 N 1.75 0.04 -0.52 0.04 0.00 -1.10 -3.32 119.26 116.14 1oxm h ALA 209 Ca -0.00 -0.48 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 1oxm h ALA 209 Cb 0.56 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1oxm h ALA 209 CO 0.03 0.12 -0.00 -0.39 0.00 0.00 0.00 179.25 179.01 1oxm h VAL 210 N -0.44 1.25 -1.03 0.00 -1.51 -1.26 -3.32 116.25 109.94 1oxm h VAL 210 Ca -0.04 -1.06 -0.68 0.00 -1.23 0.00 0.00 66.70 63.69 1oxm h VAL 210 Cb 1.04 0.86 -0.09 0.00 -2.13 0.00 0.00 31.29 30.97 1oxm h VAL 210 CO 0.06 0.38 2.03 -0.13 -1.23 0.00 0.00 177.57 178.68 1oxm s ARG 211 N -4.99 3.95 0.00 5.19 0.52 -0.75 -5.12 118.95 117.75 1oxm s ARG 211 Ca -0.10 -1.94 0.00 0.00 -0.52 0.00 0.00 55.73 53.17 1oxm s ARG 211 Cb 0.14 -5.47 0.00 0.00 0.52 0.00 0.00 34.95 30.14 1oxm s ARG 211 CO 0.83 -2.20 0.00 0.41 0.02 0.00 0.00 175.30 174.35