#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rex s GLN 8 N 0.00 1.40 -0.29 -0.52 -0.21 -1.26 -5.12 119.66 113.66 2rex s GLN 8 Ca 0.00 -1.21 -0.41 0.00 0.02 0.00 0.00 55.36 53.76 2rex s GLN 8 Cb 0.00 0.44 -0.16 0.00 1.00 0.00 0.00 33.01 34.28 2rex s GLN 8 CO 0.00 -0.56 1.70 -2.30 -2.12 0.00 0.00 175.29 172.01 2rex n PRO 9 N -0.32 0.99 -0.02 2.91 -0.02 -1.26 -4.90 135.00 132.38 2rex n PRO 9 Ca -0.04 0.36 -0.11 0.00 -2.02 0.00 0.00 63.50 61.70 2rex n PRO 9 Cb 0.63 -2.02 0.04 0.00 -0.02 0.00 0.00 33.50 32.12 2rex n PRO 9 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2rex h VAL 10 N 5.09 1.31 -3.47 -1.45 2.07 -1.94 -3.39 116.25 114.46 2rex h VAL 10 Ca -0.46 -1.75 -0.63 0.00 0.82 0.00 0.00 66.70 64.68 2rex h VAL 10 Cb 1.33 1.70 -0.17 0.00 -1.52 0.00 0.00 31.29 32.62 2rex h VAL 10 CO 0.95 0.55 -0.57 -0.69 0.02 0.00 0.00 177.57 177.84 2rex s VAL 11 N -4.07 4.80 0.14 2.57 1.01 -1.26 -2.45 120.40 121.13 2rex s VAL 11 Ca -0.08 -0.02 0.06 0.00 0.00 0.00 0.00 61.98 61.94 2rex s VAL 11 Cb 0.11 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.25 2rex s VAL 11 CO 0.85 0.40 -0.14 0.00 0.00 0.00 0.00 175.10 176.21 2rex s ALA 12 N 0.88 1.62 -0.13 5.51 0.00 -0.49 -5.00 121.76 124.15 2rex s ALA 12 Ca 0.05 -1.39 -0.02 0.00 0.00 0.00 0.00 51.96 50.60 2rex s ALA 12 Cb -0.14 -0.07 -0.02 0.00 0.00 0.00 0.00 23.12 22.89 2rex s ALA 12 CO 0.03 0.08 -0.07 1.03 0.00 0.00 0.00 175.76 176.83 2rex s ARG 13 N -2.96 3.43 -0.06 0.00 0.52 -1.26 -0.13 118.95 118.48 2rex s ARG 13 Ca 0.13 -0.57 0.01 0.00 -0.52 0.00 0.00 55.73 54.78 2rex s ARG 13 Cb -0.03 -2.78 0.02 0.00 0.52 0.00 0.00 34.95 32.68 2rex s ARG 13 CO 0.04 0.31 -0.08 0.00 0.02 0.00 0.00 175.30 175.58 2rex s LYS 15 N 0.91 3.82 0.02 0.00 2.20 -1.26 -0.34 119.74 125.09 2rex s LYS 15 Ca -0.11 -0.39 0.06 0.00 -0.36 0.00 0.00 55.97 55.17 2rex s LYS 15 Cb -0.15 -3.70 -0.03 0.00 -1.51 0.00 0.00 37.83 32.44 2rex s LYS 15 CO 0.01 -0.26 -0.16 -0.51 -0.36 0.00 0.00 175.35 174.06 2rex s LEU 16 N 1.77 2.69 -0.11 5.43 1.43 -0.38 -0.24 118.68 129.26 2rex s LEU 16 Ca 0.07 -0.35 0.03 0.00 -1.03 0.00 0.00 54.13 52.85 2rex s LEU 16 Cb -0.16 -1.56 0.01 0.00 0.03 0.00 0.00 46.19 44.50 2rex s LEU 16 CO 0.11 0.28 -0.19 -0.69 0.23 0.00 0.00 176.35 176.08 2rex s VAL 17 N -0.89 1.76 -0.22 -1.59 1.01 -1.00 -0.78 120.40 118.69 2rex s VAL 17 Ca 0.14 -0.82 -0.09 0.00 0.00 0.00 0.00 61.98 61.21 2rex s VAL 17 Cb -0.11 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 2rex s VAL 17 CO 0.04 0.49 0.10 -0.76 0.00 0.00 0.00 175.10 174.98 2rex s LEU 18 N 0.68 3.85 0.14 3.92 1.02 -0.53 -0.25 118.68 127.51 2rex s LEU 18 Ca -0.12 0.03 0.02 0.00 0.02 0.00 0.00 54.13 54.08 2rex s LEU 18 Cb -0.16 -2.01 -0.04 0.00 0.02 0.00 0.00 46.19 43.99 2rex s LEU 18 CO 0.03 0.09 -0.05 0.68 0.02 0.00 0.00 176.35 177.12 2rex s VAL 19 N 0.90 0.81 0.00 -1.59 -7.23 -0.38 -3.64 120.40 109.27 2rex s VAL 19 Ca 0.05 -1.98 0.00 0.00 -1.81 0.00 0.00 61.98 58.24 2rex s VAL 19 Cb -0.13 -1.90 0.00 0.00 0.56 0.00 0.00 36.38 34.91 2rex s VAL 19 CO 0.03 -0.68 0.00 0.61 -0.31 0.00 0.00 175.10 174.74 2rex n GLY 20 N -0.16 2.06 3.63 2.32 0.00 -1.26 -0.06 105.19 111.71 2rex n GLY 20 Ca -0.09 -1.57 -0.33 0.00 0.00 0.00 0.00 46.02 44.02 2rex n GLY 20 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2rex n ASP 21 N 0.00 0.21 -4.75 1.61 9.92 -1.26 -3.74 116.55 118.54 2rex n ASP 21 Ca 0.00 0.51 -0.38 0.00 -0.53 0.00 0.00 54.79 54.39 2rex n ASP 21 Cb 0.00 -1.43 0.04 0.00 -0.64 0.00 0.00 41.12 39.09 2rex n ASP 21 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 2rex s VAL 22 N -2.28 2.22 -1.74 2.53 -7.23 -1.25 -2.60 120.40 110.04 2rex s VAL 22 Ca 0.69 0.15 0.00 0.00 -1.81 0.00 0.00 61.98 61.01 2rex s VAL 22 Cb -0.27 -3.07 0.00 0.00 0.56 0.00 0.00 36.38 33.60 2rex s VAL 22 CO 0.56 -0.01 0.00 0.00 -0.31 0.00 0.00 175.10 175.34 2rex n GLN 23 N -1.23 -1.52 0.16 4.82 6.02 -1.26 -4.87 117.38 119.49 2rex n GLN 23 Ca 0.12 1.04 0.05 0.00 -0.01 0.00 0.00 57.00 58.20 2rex n GLN 23 Cb 0.46 -5.41 0.10 0.00 1.02 0.00 0.00 30.24 26.41 2rex n GLN 23 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2rex n GLY 25 N 1.08 1.42 0.35 0.00 0.00 -1.26 -4.33 105.19 102.44 2rex n GLY 25 Ca 0.02 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.87 2rex n GLY 25 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rex h LYS 26 N 0.00 -0.81 -0.58 1.61 1.57 -1.92 -2.53 116.57 113.92 2rex h LYS 26 Ca 0.00 0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 2rex h LYS 26 Cb 0.00 0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 2rex h LYS 26 CO 0.00 -0.53 0.28 1.15 -0.57 0.00 0.00 179.45 179.79 2rex h THR 27 N -0.87 1.20 -0.92 -0.16 2.02 -1.97 -2.72 112.91 109.50 2rex h THR 27 Ca -0.09 -0.57 0.16 0.00 0.77 0.00 0.00 66.41 66.68 2rex h THR 27 Cb 0.65 0.52 -0.10 0.00 -1.74 0.00 0.00 68.15 67.48 2rex h THR 27 CO 0.14 0.23 0.52 0.00 0.37 0.00 0.00 175.52 176.78 2rex h ALA 28 N 1.12 1.44 -0.47 6.16 0.00 -1.89 -0.32 119.26 125.31 2rex h ALA 28 Ca 0.20 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 2rex h ALA 28 Cb 0.11 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2rex h ALA 28 CO -0.03 -0.04 0.13 0.52 0.00 0.00 0.00 179.25 179.84 2rex h MET 29 N 0.71 0.73 -0.33 0.00 2.07 -1.15 -2.01 114.93 114.95 2rex h MET 29 Ca 0.51 -0.17 -0.18 0.00 -2.07 0.00 0.00 59.70 57.80 2rex h MET 29 Cb 0.72 -0.10 -0.00 0.00 -1.87 0.00 0.00 31.60 30.35 2rex h MET 29 CO -0.36 0.71 -0.48 -0.07 1.07 0.00 0.00 176.91 177.78 2rex h LEU 30 N 0.62 0.99 -0.44 1.22 3.38 -1.15 0.10 115.31 120.03 2rex h LEU 30 Ca 0.15 -0.50 -0.04 0.00 0.09 0.00 0.00 57.88 57.58 2rex h LEU 30 Cb 0.29 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2rex h LEU 30 CO -0.00 1.30 0.13 1.56 0.09 0.00 0.00 178.44 181.52 2rex h GLN 31 N 0.71 0.69 -0.57 1.13 4.20 -1.12 0.50 115.11 120.65 2rex h GLN 31 Ca 0.03 -0.15 -0.03 0.00 0.06 0.00 0.00 58.65 58.56 2rex h GLN 31 Cb 1.08 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.74 2rex h GLN 31 CO 0.11 0.68 0.24 0.28 -0.67 0.00 0.00 178.83 179.47 2rex h VAL 32 N 0.58 1.22 -0.15 -0.54 2.07 -0.64 0.18 116.25 118.97 2rex h VAL 32 Ca 0.14 -0.66 -0.04 0.00 0.82 0.00 0.00 66.70 66.96 2rex h VAL 32 Cb 0.28 0.59 -0.00 0.00 -1.52 0.00 0.00 31.29 30.64 2rex h VAL 32 CO -0.00 0.26 -0.06 0.25 0.02 0.00 0.00 177.57 178.04 2rex h LEU 33 N 0.78 0.32 0.00 2.57 5.85 -0.40 -3.22 115.31 121.22 2rex h LEU 33 Ca 0.19 -0.40 -0.13 0.00 0.84 0.00 0.00 57.88 58.39 2rex h LEU 33 Cb 0.18 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 2rex h LEU 33 CO -0.02 0.64 -1.96 0.00 -0.34 0.00 0.00 178.44 176.76 2rex n ALA 34 N -2.36 2.22 -0.08 1.25 0.00 0.17 -4.63 120.51 117.08 2rex n ALA 34 Ca -0.06 -0.71 0.00 0.00 0.00 0.00 0.00 53.44 52.67 2rex n ALA 34 Cb 0.28 -0.41 0.00 0.00 0.00 0.00 0.00 19.45 19.32 2rex n ALA 34 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2rex n LYS 35 N -2.33 0.53 -3.83 0.00 4.76 0.56 -5.01 118.16 112.84 2rex n LYS 35 Ca -0.13 -0.84 -0.29 0.00 -2.87 0.00 0.00 58.31 54.18 2rex n LYS 35 Cb 0.71 -0.96 0.04 0.00 -1.84 0.00 0.00 35.03 32.98 2rex n LYS 35 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2rex n ASP 36 N -0.18 -5.15 -3.70 4.39 10.43 -0.67 -4.93 116.55 116.74 2rex n ASP 36 Ca 0.00 -0.72 -0.11 0.00 2.57 0.00 0.00 54.79 56.53 2rex n ASP 36 Cb 0.12 -4.18 -0.10 0.00 1.84 0.00 0.00 41.12 38.80 2rex n ASP 36 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2rex s TYR 38 N 1.07 3.19 -0.84 0.00 5.04 -1.26 -1.89 117.35 122.65 2rex s TYR 38 Ca -0.07 -0.43 -0.22 0.00 -2.44 0.00 0.00 57.07 53.92 2rex s TYR 38 Cb -0.06 -2.38 0.08 0.00 0.35 0.00 0.00 41.96 39.95 2rex s TYR 38 CO -0.09 -0.41 1.17 -1.25 -1.34 0.00 0.00 175.55 173.63 2rex s PRO 39 N 1.65 3.38 0.46 4.97 0.04 -1.26 -4.87 135.00 139.38 2rex s PRO 39 Ca 0.05 -1.10 0.26 0.00 0.04 0.00 0.00 61.00 60.25 2rex s PRO 39 Cb -0.17 -4.69 0.97 0.00 0.04 0.00 0.00 34.50 30.65 2rex s PRO 39 CO 0.07 -1.94 1.84 1.05 0.04 0.00 0.00 177.00 178.07 2rex h GLU 40 N 9.46 0.00 -5.22 4.56 9.09 -2.01 -3.42 114.58 127.03 2rex h GLU 40 Ca -0.04 0.00 -0.61 0.00 0.05 0.00 0.00 59.36 58.76 2rex h GLU 40 Cb 1.04 0.00 -0.14 0.00 -1.65 0.00 0.00 28.75 27.99 2rex h GLU 40 CO 1.23 0.17 -0.53 0.99 0.05 0.00 0.00 179.01 180.92 2rex s THR 41 N -3.62 5.11 -0.13 -1.06 2.01 -1.26 -5.06 115.64 111.63 2rex s THR 41 Ca 0.01 0.08 -0.29 0.00 0.31 0.00 0.00 61.69 61.80 2rex s THR 41 Cb 0.10 -3.33 -0.03 0.00 0.01 0.00 0.00 72.50 69.24 2rex s THR 41 CO 0.62 0.43 1.40 -0.47 -0.69 0.00 0.00 174.62 175.90 2rex s TYR 42 N 0.55 2.54 -0.24 4.92 5.04 -1.26 -5.00 117.35 123.90 2rex s TYR 42 Ca 0.06 0.72 0.02 0.00 -2.44 0.00 0.00 57.07 55.43 2rex s TYR 42 Cb -0.12 -3.65 0.06 0.00 0.35 0.00 0.00 41.96 38.59 2rex s TYR 42 CO 0.00 -2.44 -0.08 0.08 -1.34 0.00 0.00 175.55 171.77 2rex s VAL 43 N 3.70 1.80 0.20 3.14 1.01 -1.26 -5.12 120.40 123.88 2rex s VAL 43 Ca 0.61 -1.35 -0.32 0.00 0.00 0.00 0.00 61.98 60.92 2rex s VAL 43 Cb -0.26 -1.97 -0.14 0.00 0.00 0.00 0.00 36.38 34.02 2rex s VAL 43 CO 0.20 -0.03 1.46 -2.65 0.00 0.00 0.00 175.10 174.08 2rex n PRO 44 N 4.58 2.02 -3.21 2.72 -0.02 -1.26 -5.00 135.00 134.83 2rex n PRO 44 Ca -0.13 0.72 -0.31 0.00 -2.02 0.00 0.00 63.50 61.77 2rex n PRO 44 Cb 0.44 -2.42 -0.04 0.00 -0.02 0.00 0.00 33.50 31.46 2rex n PRO 44 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2rex s THR 45 N 0.31 4.89 0.00 3.45 2.01 -1.26 -5.03 115.64 120.01 2rex s THR 45 Ca 0.73 0.45 0.00 0.00 0.31 0.00 0.00 61.69 63.18 2rex s THR 45 Cb -0.68 -3.68 0.00 0.00 0.01 0.00 0.00 72.50 68.15 2rex s THR 45 CO 0.45 -0.28 0.00 0.52 -0.69 0.00 0.00 174.62 174.63 2rex n VAL 46 N -0.70 0.00 -3.64 3.82 0.31 -1.26 -4.06 118.33 112.79 2rex n VAL 46 Ca 0.01 0.17 -0.15 0.00 -0.01 0.00 0.00 64.34 64.36 2rex n VAL 46 Cb 0.53 -1.09 -0.08 0.00 -0.91 0.00 0.00 33.84 32.30 2rex n VAL 46 CO 0.00 0.00 0.00 0.72 -1.32 0.00 0.00 176.83 176.23 2rex s PHE 47 N -0.55 -0.59 -0.03 3.52 -0.71 -1.26 -1.96 117.98 116.41 2rex s PHE 47 Ca 0.00 1.28 -0.20 0.00 -1.04 0.00 0.00 56.93 56.97 2rex s PHE 47 Cb 0.00 0.26 0.04 0.00 -1.21 0.00 0.00 43.02 42.10 2rex s PHE 47 CO 0.00 -0.41 0.42 -2.00 -1.34 0.00 0.00 175.22 171.90 2rex s GLU 48 N -0.33 0.77 -0.14 1.99 2.56 -0.46 -4.99 118.70 118.09 2rex s GLU 48 Ca -0.05 -0.02 0.02 0.00 0.00 0.00 0.00 54.97 54.92 2rex s GLU 48 Cb -0.03 0.35 0.01 0.00 2.00 0.00 0.00 34.13 36.46 2rex s GLU 48 CO 0.04 -0.22 -0.20 1.21 -0.56 0.00 0.00 175.26 175.53 2rex s ASN 49 N -1.21 3.25 0.15 -1.70 2.47 -1.26 0.12 114.94 116.75 2rex s ASN 49 Ca -0.12 -0.57 0.05 0.00 0.42 0.00 0.00 52.86 52.63 2rex s ASN 49 Cb -0.04 -1.47 -0.04 0.00 -1.45 0.00 0.00 41.25 38.25 2rex s ASN 49 CO 0.06 0.08 0.10 -0.31 -3.72 0.00 0.00 177.10 173.31 2rex s TYR 50 N 0.83 3.11 0.11 0.43 2.02 0.43 -4.98 117.35 119.30 2rex s TYR 50 Ca -0.06 -0.02 0.09 0.00 -0.37 0.00 0.00 57.07 56.71 2rex s TYR 50 Cb -0.15 -1.52 -0.04 0.00 -0.40 0.00 0.00 41.96 39.85 2rex s TYR 50 CO -0.02 0.52 -0.19 0.99 -1.57 0.00 0.00 175.55 175.28 2rex s THR 51 N -1.66 2.81 0.00 -0.71 2.01 -1.26 -0.47 115.64 116.36 2rex s THR 51 Ca 0.30 -1.50 -0.20 0.00 0.31 0.00 0.00 61.69 60.60 2rex s THR 51 Cb -0.10 -2.28 0.04 0.00 0.01 0.00 0.00 72.50 70.17 2rex s THR 51 CO 0.22 0.12 0.45 0.00 -0.69 0.00 0.00 174.62 174.72 2rex s ALA 52 N -1.12 -1.14 -0.19 7.40 0.00 -0.48 -4.83 121.76 121.40 2rex s ALA 52 Ca 0.17 0.59 -0.01 0.00 0.00 0.00 0.00 51.96 52.72 2rex s ALA 52 Cb -0.11 0.17 0.01 0.00 0.00 0.00 0.00 23.12 23.19 2rex s ALA 52 CO 0.09 -0.37 -0.14 0.00 0.00 0.00 0.00 175.76 175.34 2rex s LEU 54 N 1.26 2.33 -0.14 0.00 1.02 -0.54 -4.97 118.68 117.64 2rex s LEU 54 Ca 0.03 -0.75 -0.02 0.00 0.02 0.00 0.00 54.13 53.41 2rex s LEU 54 Cb -0.14 -1.14 -0.03 0.00 0.02 0.00 0.00 46.19 44.90 2rex s LEU 54 CO -0.08 0.15 -0.06 -1.83 0.02 0.00 0.00 176.35 174.55 2rex s GLU 55 N -2.11 3.47 0.00 1.70 1.03 -1.26 0.30 118.70 121.83 2rex s GLU 55 Ca 0.13 -0.55 0.00 0.00 0.03 0.00 0.00 54.97 54.58 2rex s GLU 55 Cb -0.10 -2.81 0.00 0.00 -0.80 0.00 0.00 34.13 30.42 2rex s GLU 55 CO 0.06 0.31 0.00 0.25 -1.33 0.00 0.00 175.26 174.55 2rex n THR 56 N 3.31 0.00 0.49 1.83 -2.24 0.12 -4.96 114.28 112.82 2rex n THR 56 Ca -0.18 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.73 2rex n THR 56 Cb 0.53 -0.98 0.45 0.00 -2.10 0.00 0.00 70.33 68.23 2rex n THR 56 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2rex h GLU 57 N 0.00 0.00 0.00 -0.78 3.07 -1.99 -3.30 114.58 111.57 2rex h GLU 57 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2rex h GLU 57 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 2rex h GLU 57 CO 0.00 0.00 0.00 0.39 -1.40 0.00 0.00 179.01 178.00 2rex n GLU 58 N -2.31 0.04 -3.96 2.33 4.71 -1.26 -5.13 120.64 115.06 2rex n GLU 58 Ca 0.04 -0.03 -0.09 0.00 -0.01 0.00 0.00 57.16 57.06 2rex n GLU 58 Cb 0.33 -0.45 -0.10 0.00 -1.01 0.00 0.00 31.44 30.21 2rex n GLU 58 CO 0.00 0.00 0.00 -0.65 0.09 0.00 0.00 177.13 176.57 2rex s GLN 59 N -0.02 0.53 -0.28 3.49 -0.21 -1.25 -4.96 119.66 116.97 2rex s GLN 59 Ca 0.00 -0.79 -0.09 0.00 0.02 0.00 0.00 55.36 54.50 2rex s GLN 59 Cb 0.00 0.20 -0.03 0.00 1.00 0.00 0.00 33.01 34.18 2rex s GLN 59 CO 0.00 -0.12 0.13 -0.98 -2.12 0.00 0.00 175.29 172.20 2rex s ARG 60 N -2.55 3.63 -0.26 2.91 1.04 -1.03 0.10 118.95 122.81 2rex s ARG 60 Ca -0.06 -0.51 -0.05 0.00 -1.04 0.00 0.00 55.73 54.07 2rex s ARG 60 Cb -0.02 -3.48 0.00 0.00 -2.04 0.00 0.00 34.95 29.41 2rex s ARG 60 CO -0.05 -0.26 0.01 0.08 -0.04 0.00 0.00 175.30 175.05 2rex s VAL 61 N 1.65 3.63 -0.40 4.99 1.01 0.15 -1.40 120.40 130.03 2rex s VAL 61 Ca 0.06 -0.61 -0.29 0.00 0.00 0.00 0.00 61.98 61.14 2rex s VAL 61 Cb -0.16 -2.77 0.02 0.00 0.00 0.00 0.00 36.38 33.47 2rex s VAL 61 CO 0.06 0.25 1.18 -0.70 0.00 0.00 0.00 175.10 175.90 2rex s GLU 62 N 1.48 3.82 -0.20 2.72 -6.30 0.81 -1.47 118.70 119.56 2rex s GLU 62 Ca 0.04 0.85 -0.14 0.00 -2.50 0.00 0.00 54.97 53.21 2rex s GLU 62 Cb -0.16 -3.88 -0.04 0.00 0.00 0.00 0.00 34.13 30.05 2rex s GLU 62 CO -0.01 -1.25 0.32 -0.51 0.02 0.00 0.00 175.26 173.84 2rex s LEU 63 N 4.38 4.16 -0.38 2.70 1.43 0.14 -1.93 118.68 129.18 2rex s LEU 63 Ca 0.50 0.42 -0.11 0.00 -1.03 0.00 0.00 54.13 53.92 2rex s LEU 63 Cb -0.11 -2.39 0.03 0.00 0.03 0.00 0.00 46.19 43.75 2rex s LEU 63 CO 0.26 -0.01 0.21 -0.55 0.23 0.00 0.00 176.35 176.49 2rex s SER 64 N 0.93 5.70 -0.19 2.29 0.15 0.53 -1.38 113.70 121.73 2rex s SER 64 Ca 0.16 -1.07 -0.04 0.00 0.70 0.00 0.00 55.95 55.70 2rex s SER 64 Cb -0.14 -2.01 -0.02 0.00 -1.71 0.00 0.00 66.02 62.14 2rex s SER 64 CO 0.06 -0.40 -0.03 -0.76 1.20 0.00 0.00 173.24 173.31 2rex s LEU 65 N 1.53 3.11 -0.29 3.45 1.43 0.38 -1.25 118.68 127.04 2rex s LEU 65 Ca 0.02 -0.25 -0.06 0.00 -1.03 0.00 0.00 54.13 52.81 2rex s LEU 65 Cb -0.20 -1.78 0.02 0.00 0.03 0.00 0.00 46.19 44.26 2rex s LEU 65 CO 0.06 0.07 0.06 0.26 0.23 0.00 0.00 176.35 177.03 2rex s TRP 66 N 0.95 3.15 -0.04 0.29 0.52 0.04 -0.43 118.94 123.42 2rex s TRP 66 Ca 0.00 -1.17 -0.15 0.00 0.02 0.00 0.00 56.10 54.81 2rex s TRP 66 Cb -0.14 -2.22 -0.05 0.00 -1.15 0.00 0.00 33.47 29.90 2rex s TRP 66 CO 0.01 -0.63 0.40 0.34 0.02 0.00 0.00 176.95 177.09 2rex s ASP 67 N 1.45 6.74 0.09 2.95 2.15 0.12 -1.45 116.67 128.72 2rex s ASP 67 Ca 0.01 0.88 0.01 0.00 0.43 0.00 0.00 52.55 53.88 2rex s ASP 67 Cb -0.17 -2.24 -0.04 0.00 -0.30 0.00 0.00 42.92 40.16 2rex s ASP 67 CO 0.01 0.25 -0.05 0.42 -0.17 0.00 0.00 175.17 175.63 2rex s THR 68 N -0.65 0.57 0.13 1.71 -4.23 -1.24 -1.35 115.64 110.57 2rex s THR 68 Ca 0.23 -1.91 -0.30 0.00 -1.18 0.00 0.00 61.69 58.53 2rex s THR 68 Cb -0.16 -1.67 -0.07 0.00 1.34 0.00 0.00 72.50 71.95 2rex s THR 68 CO 0.12 -0.88 1.16 -0.55 -0.54 0.00 0.00 174.62 173.92 2rex s SER 69 N -3.02 7.16 0.00 3.99 0.15 -0.83 -4.88 113.70 116.27 2rex s SER 69 Ca 0.11 2.08 0.08 0.00 0.70 0.00 0.00 55.95 58.93 2rex s SER 69 Cb 0.06 -2.59 0.37 0.00 -1.71 0.00 0.00 66.02 62.14 2rex s SER 69 CO -0.06 -0.35 1.26 0.61 1.20 0.00 0.00 173.24 175.90 2rex n GLY 70 N 2.54 -0.44 3.81 9.45 0.00 -1.25 -4.87 105.19 114.44 2rex n GLY 70 Ca 0.05 -0.16 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 2rex n GLY 70 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2rex s SER 71 N -1.17 7.08 0.57 1.61 0.15 -1.26 -3.92 113.70 116.76 2rex s SER 71 Ca 0.15 1.31 0.27 0.00 0.70 0.00 0.00 55.95 58.37 2rex s SER 71 Cb 0.07 -2.38 1.51 0.00 -1.71 0.00 0.00 66.02 63.52 2rex s SER 71 CO 0.11 0.23 2.02 -0.65 1.20 0.00 0.00 173.24 176.15 2rex h PRO 72 N 4.32 0.00 -0.48 5.44 0.11 -2.01 -2.48 132.00 136.90 2rex h PRO 72 Ca -0.49 0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.70 2rex h PRO 72 Cb 1.21 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.29 2rex h PRO 72 CO 0.64 0.00 0.33 -0.92 -0.21 0.00 0.00 178.00 177.84 2rex h TYR 73 N 0.00 0.29 -0.57 0.65 3.20 -1.98 -2.15 116.97 116.42 2rex h TYR 73 Ca 0.17 0.01 -0.17 0.00 3.14 0.00 0.00 58.73 61.88 2rex h TYR 73 Cb 0.80 -0.10 -0.10 0.00 1.54 0.00 0.00 36.73 38.88 2rex h TYR 73 CO 0.00 0.15 0.16 0.66 -1.64 0.00 0.00 178.16 177.49 2rex n TYR 74 N -4.46 1.90 0.23 -3.82 4.01 -0.93 -4.63 117.16 109.45 2rex n TYR 74 Ca 0.07 -1.22 0.14 0.00 -0.16 0.00 0.00 57.90 56.73 2rex n TYR 74 Cb 0.34 -0.58 0.78 0.00 -0.31 0.00 0.00 39.34 39.57 2rex n TYR 74 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 2rex h ASP 75 N 2.14 0.00 1.42 7.72 3.32 -1.48 -1.60 116.42 127.95 2rex h ASP 75 Ca 0.21 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.24 2rex h ASP 75 Cb 2.03 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.58 2rex h ASP 75 CO 0.57 0.00 -0.59 0.78 -1.72 0.00 0.00 179.24 178.28 2rex h ASN 76 N 0.00 0.00 0.00 6.45 2.35 -1.84 -3.39 115.58 119.15 2rex h ASN 76 Ca 0.05 0.00 -0.30 0.00 -0.55 0.00 0.00 56.30 55.50 2rex h ASN 76 Cb 0.23 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.55 2rex h ASN 76 CO -0.00 0.09 -2.14 0.55 -1.65 0.00 0.00 177.43 174.28 2rex n VAL 77 N -2.91 1.14 -0.30 2.81 3.14 -0.95 -4.63 118.33 116.62 2rex n VAL 77 Ca 0.01 -0.68 -0.04 0.00 -2.96 0.00 0.00 64.34 60.67 2rex n VAL 77 Cb 0.58 -0.61 0.07 0.00 -1.06 0.00 0.00 33.84 32.82 2rex n VAL 77 CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 2rex h ARG 78 N 0.00 1.10 -0.16 1.45 2.43 -1.49 -2.17 114.38 115.54 2rex h ARG 78 Ca -0.45 -0.10 0.05 0.00 -0.81 0.00 0.00 59.98 58.67 2rex h ARG 78 Cb 1.99 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 31.31 2rex h ARG 78 CO 0.02 0.77 0.20 -1.35 -1.51 0.00 0.00 179.97 178.10 2rex h PRO 79 N 1.11 0.00 0.00 0.20 0.11 -1.82 -1.78 132.00 129.82 2rex h PRO 79 Ca 0.29 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.38 2rex h PRO 79 Cb -0.05 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.06 2rex h PRO 79 CO -0.06 0.00 -0.08 -0.07 -0.21 0.00 0.00 178.00 177.59 2rex h LEU 80 N 0.00 0.00 -1.79 2.35 3.38 -1.66 -2.71 115.31 114.88 2rex h LEU 80 Ca 0.08 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 2rex h LEU 80 Cb 0.47 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 2rex h LEU 80 CO -0.00 0.08 -0.13 0.00 0.09 0.00 0.00 178.44 178.48 2rex h TYR 82 N 0.00 0.00 -2.36 0.00 0.05 -1.64 -3.45 116.97 109.57 2rex h TYR 82 Ca -0.00 0.00 -0.56 0.00 0.05 0.00 0.00 58.73 58.22 2rex h TYR 82 Cb 0.41 0.00 0.04 0.00 1.01 0.00 0.00 36.73 38.19 2rex h TYR 82 CO 0.00 0.00 1.04 0.43 -1.05 0.00 0.00 178.16 178.58 2rex n SER 83 N -2.36 3.72 -1.60 3.88 7.64 -1.21 -2.45 113.62 121.25 2rex n SER 83 Ca 0.03 1.01 -0.15 0.00 1.01 0.00 0.00 58.87 60.76 2rex n SER 83 Cb 0.31 -1.49 -0.02 0.00 -1.01 0.00 0.00 64.21 62.00 2rex n SER 83 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2rex n ASP 84 N 5.34 -4.68 -4.87 6.43 8.00 -1.26 -4.99 116.55 120.52 2rex n ASP 84 Ca 0.19 0.09 -0.30 0.00 0.71 0.00 0.00 54.79 55.47 2rex n ASP 84 Cb 0.34 -3.74 -0.01 0.00 -0.02 0.00 0.00 41.12 37.69 2rex n ASP 84 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2rex s SER 85 N -2.45 6.37 -0.06 -2.24 1.04 -1.02 -4.77 113.70 110.56 2rex s SER 85 Ca 0.00 1.31 0.20 0.00 0.48 0.00 0.00 55.95 57.94 2rex s SER 85 Cb 0.00 -2.41 -0.30 0.00 0.10 0.00 0.00 66.02 63.41 2rex s SER 85 CO 0.00 -0.68 0.38 0.47 0.98 0.00 0.00 173.24 174.39 2rex n ASP 86 N -2.18 0.31 -3.56 7.02 8.00 0.66 -4.91 116.55 121.90 2rex n ASP 86 Ca 0.04 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.41 2rex n ASP 86 Cb 0.54 1.76 -0.05 0.00 -0.02 0.00 0.00 41.12 43.35 2rex n ASP 86 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2rex s ALA 87 N -3.25 -1.87 -0.18 2.24 0.00 -1.16 -4.12 121.76 113.42 2rex s ALA 87 Ca -0.08 1.49 -0.07 0.00 0.00 0.00 0.00 51.96 53.30 2rex s ALA 87 Cb 0.12 -0.46 -0.04 0.00 0.00 0.00 0.00 23.12 22.74 2rex s ALA 87 CO 0.84 -0.33 0.06 0.08 0.00 0.00 0.00 175.76 176.41 2rex s VAL 88 N -1.13 4.80 -0.57 0.00 1.01 -0.04 -2.39 120.40 122.09 2rex s VAL 88 Ca -0.05 -0.03 -0.19 0.00 0.00 0.00 0.00 61.98 61.71 2rex s VAL 88 Cb -0.00 -3.15 0.09 0.00 0.00 0.00 0.00 36.38 33.32 2rex s VAL 88 CO 0.05 0.47 0.67 -0.76 0.00 0.00 0.00 175.10 175.53 2rex s LEU 89 N 0.27 5.36 -0.58 3.92 1.43 0.65 -1.43 118.68 128.29 2rex s LEU 89 Ca 0.04 -1.35 -0.28 0.00 -1.03 0.00 0.00 54.13 51.51 2rex s LEU 89 Cb -0.12 -2.32 0.03 0.00 0.03 0.00 0.00 46.19 43.80 2rex s LEU 89 CO 0.00 -1.04 1.24 -0.22 0.23 0.00 0.00 176.35 176.56 2rex s LEU 90 N 2.58 3.43 -0.02 1.79 0.20 -0.33 -1.25 118.68 125.08 2rex s LEU 90 Ca 0.11 0.12 -0.05 0.00 0.69 0.00 0.00 54.13 55.00 2rex s LEU 90 Cb -0.24 -3.13 -0.04 0.00 -0.43 0.00 0.00 46.19 42.35 2rex s LEU 90 CO 0.07 -1.54 0.22 0.00 -0.29 0.00 0.00 176.35 174.81 2rex s PHE 92 N -1.26 1.05 -0.28 0.00 -0.71 -0.66 -4.19 117.98 111.94 2rex s PHE 92 Ca 0.25 -1.29 -0.07 0.00 -1.04 0.00 0.00 56.93 54.78 2rex s PHE 92 Cb -0.13 -0.46 -0.01 0.00 -1.21 0.00 0.00 43.02 41.22 2rex s PHE 92 CO 0.15 -0.69 0.08 0.34 -1.34 0.00 0.00 175.22 173.76 2rex s ASP 93 N -3.14 5.13 0.51 1.98 -1.08 -1.26 -0.50 116.67 118.31 2rex s ASP 93 Ca 0.37 -0.50 0.22 0.00 -0.52 0.00 0.00 52.55 52.12 2rex s ASP 93 Cb 0.06 -1.90 1.31 0.00 -1.46 0.00 0.00 42.92 40.93 2rex s ASP 93 CO 0.12 -0.13 2.01 0.40 0.52 0.00 0.00 175.17 178.09 2rex h ILE 94 N 5.72 0.80 -0.03 4.11 5.03 -1.64 -1.83 117.51 129.66 2rex h ILE 94 Ca -0.34 -0.03 0.00 0.00 -0.12 0.00 0.00 64.86 64.37 2rex h ILE 94 Cb 1.15 0.71 0.00 0.00 -3.03 0.00 0.00 36.82 35.65 2rex h ILE 94 CO 0.60 0.01 0.00 -1.54 -0.68 0.00 0.00 178.15 176.54 2rex n SER 95 N -4.42 0.53 -3.46 1.72 3.41 -1.26 -1.23 113.62 108.92 2rex n SER 95 Ca 0.08 -1.35 -0.27 0.00 -0.26 0.00 0.00 58.87 57.07 2rex n SER 95 Cb 0.50 -0.02 -0.10 0.00 -0.26 0.00 0.00 64.21 64.33 2rex n SER 95 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2rex n ARG 96 N -0.50 0.58 0.00 4.33 1.74 -0.69 -4.91 116.66 117.20 2rex n ARG 96 Ca 0.18 -3.44 0.00 0.00 -0.77 0.00 0.00 57.85 53.82 2rex n ARG 96 Cb 0.17 -1.75 0.00 0.00 -1.02 0.00 0.00 32.46 29.87 2rex n ARG 96 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2rex n PRO 97 N 2.49 0.00 -0.07 5.56 -0.04 -1.26 -0.24 135.00 141.44 2rex n PRO 97 Ca 0.27 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.65 2rex n PRO 97 Cb 0.46 -0.94 -0.08 0.00 -0.04 0.00 0.00 33.50 32.90 2rex n PRO 97 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2rex n GLU 98 N 0.50 1.22 0.31 0.54 4.71 -1.26 -4.31 120.64 122.34 2rex n GLU 98 Ca 0.00 0.04 0.19 0.00 -0.01 0.00 0.00 57.16 57.39 2rex n GLU 98 Cb 0.00 -1.30 1.05 0.00 -1.01 0.00 0.00 31.44 30.18 2rex n GLU 98 CO 0.00 0.00 0.00 1.79 0.09 0.00 0.00 177.13 179.01 2rex h THR 99 N 0.00 0.16 -0.56 2.62 1.35 -0.90 -3.02 112.91 112.56 2rex h THR 99 Ca -0.33 0.00 -0.71 0.00 -0.55 0.00 0.00 66.41 64.82 2rex h THR 99 Cb 1.62 0.92 -0.06 0.00 -1.73 0.00 0.00 68.15 68.90 2rex h THR 99 CO -0.02 0.00 3.03 0.52 -0.25 0.00 0.00 175.52 178.80 2rex n VAL 100 N -3.29 4.46 0.00 6.82 0.31 -1.21 -3.81 118.33 121.60 2rex n VAL 100 Ca -0.02 -3.45 0.00 0.00 -0.01 0.00 0.00 64.34 60.85 2rex n VAL 100 Cb 0.16 -2.41 0.00 0.00 -0.91 0.00 0.00 33.84 30.68 2rex n VAL 100 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2rex n ALA 103 N 3.49 0.00 0.10 3.52 0.00 -1.14 -4.64 120.51 121.85 2rex n ALA 103 Ca 0.63 0.00 0.20 0.00 0.00 0.00 0.00 53.44 54.27 2rex n ALA 103 Cb 0.28 0.00 0.75 0.00 0.00 0.00 0.00 19.45 20.48 2rex n ALA 103 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2rex h LEU 104 N 0.00 0.00 0.02 0.00 4.07 -1.85 0.48 115.31 118.03 2rex h LEU 104 Ca 0.00 0.00 0.01 0.00 0.08 0.00 0.00 57.88 57.97 2rex h LEU 104 Cb 0.00 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.71 2rex h LEU 104 CO 0.00 0.00 -0.27 0.11 -1.08 0.00 0.00 178.44 177.20 2rex h LYS 105 N 0.00 -0.34 -0.63 1.13 6.56 -1.94 0.91 116.57 122.27 2rex h LYS 105 Ca 0.18 0.02 0.12 0.00 -1.06 0.00 0.00 60.65 59.91 2rex h LYS 105 Cb 1.03 0.08 -0.12 0.00 -0.57 0.00 0.00 32.23 32.65 2rex h LYS 105 CO -0.00 -0.23 -0.28 -0.22 -2.06 0.00 0.00 179.45 176.66 2rex h LYS 106 N -0.35 -0.11 -0.36 3.15 3.64 -1.39 -1.51 116.57 119.64 2rex h LYS 106 Ca 0.00 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.33 2rex h LYS 106 Cb 0.37 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 2rex h LYS 106 CO -0.17 -0.07 0.01 -1.49 -2.27 0.00 0.00 179.45 175.46 2rex h TRP 107 N -0.11 0.69 -0.61 1.91 -0.00 -1.14 0.49 115.95 117.18 2rex h TRP 107 Ca 0.27 -0.12 -0.06 0.00 -0.00 0.00 0.00 58.89 58.98 2rex h TRP 107 Cb 0.54 -0.18 -0.02 0.00 -0.00 0.00 0.00 29.16 29.49 2rex h TRP 107 CO -0.61 0.73 0.14 -0.09 -0.00 0.00 0.00 178.44 178.60 2rex h ARG 108 N 0.45 0.98 -0.44 0.49 9.65 -0.72 -1.20 114.38 123.60 2rex h ARG 108 Ca 0.10 -0.24 -0.01 0.00 -1.10 0.00 0.00 59.98 58.73 2rex h ARG 108 Cb 0.44 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.88 2rex h ARG 108 CO 0.02 0.90 0.23 1.15 2.80 0.00 0.00 179.97 185.07 2rex h THR 109 N 0.89 1.17 -0.40 0.20 2.02 -0.98 -1.17 112.91 114.64 2rex h THR 109 Ca 0.19 -0.45 0.04 0.00 0.77 0.00 0.00 66.41 66.96 2rex h THR 109 Cb 0.37 0.66 -0.04 0.00 -1.74 0.00 0.00 68.15 67.40 2rex h THR 109 CO 0.00 0.18 0.18 -0.08 0.37 0.00 0.00 175.52 176.17 2rex h GLU 110 N 0.57 0.36 -0.78 6.66 4.81 -0.67 -1.94 114.58 123.60 2rex h GLU 110 Ca 0.15 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 2rex h GLU 110 Cb 0.08 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.34 2rex h GLU 110 CO -0.02 0.24 0.35 0.82 -0.73 0.00 0.00 179.01 179.66 2rex h ILE 111 N 0.37 1.25 -0.45 2.32 2.04 -0.99 -2.24 117.51 119.81 2rex h ILE 111 Ca 0.17 -0.75 -0.04 0.00 1.00 0.00 0.00 64.86 65.25 2rex h ILE 111 Cb 0.10 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 2rex h ILE 111 CO -0.14 0.31 0.14 0.25 0.00 0.00 0.00 178.15 178.71 2rex h LEU 112 N 1.11 0.66 -0.47 1.44 5.85 -1.02 0.28 115.31 123.16 2rex h LEU 112 Ca 0.26 -0.21 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 2rex h LEU 112 Cb 0.16 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 2rex h LEU 112 CO -0.03 0.69 0.13 0.44 -0.34 0.00 0.00 178.44 179.33 2rex h ASP 113 N 0.59 0.71 0.61 1.25 3.32 -1.18 -3.00 116.42 118.72 2rex h ASP 113 Ca 0.14 -0.22 -0.09 0.00 0.02 0.00 0.00 57.03 56.88 2rex h ASP 113 Cb 0.27 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 2rex h ASP 113 CO -0.00 0.75 -1.46 -1.22 -1.72 0.00 0.00 179.24 175.58 2rex n TYR 114 N -4.50 0.70 -2.72 4.55 4.01 -0.86 -4.70 117.16 113.64 2rex n TYR 114 Ca 0.01 0.22 -0.05 0.00 -0.16 0.00 0.00 57.90 57.91 2rex n TYR 114 Cb 0.21 -0.91 0.06 0.00 -0.31 0.00 0.00 39.34 38.39 2rex n TYR 114 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2rex h PRO 116 N 2.47 0.00 -0.73 0.00 0.13 -1.56 -2.66 132.00 129.66 2rex h PRO 116 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 2rex h PRO 116 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2rex h PRO 116 CO 0.23 0.04 0.00 -1.13 -0.23 0.00 0.00 178.00 176.91 2rex n SER 117 N -3.23 3.97 -4.80 1.44 3.41 -1.26 -4.95 113.62 108.20 2rex n SER 117 Ca -0.01 -2.01 -0.36 0.00 -0.26 0.00 0.00 58.87 56.23 2rex n SER 117 Cb 0.24 -0.49 -0.07 0.00 -0.26 0.00 0.00 64.21 63.63 2rex n SER 117 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2rex s THR 118 N -1.02 5.02 0.49 6.66 2.01 -1.00 -5.09 115.64 122.70 2rex s THR 118 Ca 0.49 -0.02 -0.21 0.00 0.31 0.00 0.00 61.69 62.26 2rex s THR 118 Cb 0.26 -3.18 -0.07 0.00 0.01 0.00 0.00 72.50 69.52 2rex s THR 118 CO 0.33 0.58 1.14 -0.13 -0.69 0.00 0.00 174.62 175.85 2rex s ARG 119 N -1.08 3.61 -0.15 4.92 0.52 -1.26 -4.84 118.95 120.67 2rex s ARG 119 Ca 0.16 1.67 0.00 0.00 -0.52 0.00 0.00 55.73 57.04 2rex s ARG 119 Cb -0.12 -2.22 0.02 0.00 0.52 0.00 0.00 34.95 33.15 2rex s ARG 119 CO 0.05 -0.65 -0.14 0.08 0.02 0.00 0.00 175.30 174.66 2rex s VAL 120 N -1.67 1.57 -0.19 3.52 1.01 -1.26 -0.86 120.40 122.52 2rex s VAL 120 Ca 0.67 -0.66 -0.06 0.00 0.00 0.00 0.00 61.98 61.93 2rex s VAL 120 Cb -0.26 -1.49 -0.03 0.00 0.00 0.00 0.00 36.38 34.60 2rex s VAL 120 CO 0.30 0.43 0.03 -0.76 0.00 0.00 0.00 175.10 175.10 2rex s LEU 121 N 1.48 3.56 -0.15 3.92 1.43 -0.52 0.13 118.68 128.55 2rex s LEU 121 Ca 0.04 -0.04 -0.17 0.00 -1.03 0.00 0.00 54.13 52.94 2rex s LEU 121 Cb -0.13 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.15 2rex s LEU 121 CO -0.10 0.14 0.43 -0.22 0.23 0.00 0.00 176.35 176.82 2rex s LEU 122 N 0.59 4.24 -0.19 1.79 2.96 -0.41 -1.19 118.68 126.47 2rex s LEU 122 Ca 0.01 0.69 0.00 0.00 -0.22 0.00 0.00 54.13 54.62 2rex s LEU 122 Cb -0.13 -2.60 0.04 0.00 0.50 0.00 0.00 46.19 43.99 2rex s LEU 122 CO 0.02 -0.01 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.32 2rex s ILE 123 N 0.80 1.49 -0.00 6.68 -1.09 -0.34 -1.52 121.20 127.21 2rex s ILE 123 Ca 0.23 -0.90 -0.19 0.00 -2.23 0.00 0.00 60.65 57.56 2rex s ILE 123 Cb -0.15 -1.59 -0.06 0.00 -1.58 0.00 0.00 42.46 39.09 2rex s ILE 123 CO 0.08 0.16 0.53 -0.83 -1.23 0.00 0.00 174.94 173.66 2rex s GLY 124 N 1.46 2.57 0.16 6.18 0.00 -0.50 -1.65 107.32 115.54 2rex s GLY 124 Ca -0.01 -0.05 0.10 0.00 0.00 0.00 0.00 44.72 44.76 2rex s GLY 124 CO -0.08 0.57 -0.22 0.00 0.00 0.00 0.00 173.10 173.36 2rex n LYS 126 N 0.49 -4.65 0.21 0.00 5.02 -1.08 -1.82 118.16 116.33 2rex n LYS 126 Ca -0.15 0.55 0.08 0.00 -2.02 0.00 0.00 58.31 56.78 2rex n LYS 126 Cb 0.55 -4.71 0.47 0.00 -0.02 0.00 0.00 35.03 31.33 2rex n LYS 126 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 2rex h THR 127 N -1.43 0.77 -0.31 -0.18 1.35 -1.72 -1.86 112.91 109.52 2rex h THR 127 Ca -0.38 -1.15 0.09 0.00 -0.55 0.00 0.00 66.41 64.42 2rex h THR 127 Cb 1.23 1.71 -0.01 0.00 -1.73 0.00 0.00 68.15 69.35 2rex h THR 127 CO 0.34 0.27 0.48 -2.24 -0.25 0.00 0.00 175.52 174.12 2rex h ASP 128 N 0.00 0.00 0.85 5.36 2.03 -1.92 -2.26 116.42 120.47 2rex h ASP 128 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2rex h ASP 128 Cb 0.69 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.19 2rex h ASP 128 CO 0.04 0.00 0.00 0.18 -1.03 0.00 0.00 179.24 178.43 2rex n LEU 129 N -3.39 0.00 0.17 0.15 4.77 -0.70 -2.96 117.00 115.05 2rex n LEU 129 Ca 0.05 0.48 0.09 0.00 -0.03 0.00 0.00 56.01 56.61 2rex n LEU 129 Cb 0.62 -0.48 0.61 0.00 -2.33 0.00 0.00 43.42 41.84 2rex n LEU 129 CO 0.22 -0.06 1.10 0.03 -1.33 0.00 0.00 177.39 177.35 2rex h ARG 130 N 0.00 0.09 -0.31 3.23 3.08 -1.62 -2.37 114.38 116.48 2rex h ARG 130 Ca 0.00 -0.01 -0.07 0.00 0.07 0.00 0.00 59.98 59.97 2rex h ARG 130 Cb 0.42 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.41 2rex h ARG 130 CO 0.00 0.06 0.00 0.25 -1.07 0.00 0.00 179.97 179.21 2rex n THR 131 N -4.51 2.40 -3.44 2.04 -2.24 -1.15 -4.92 114.28 102.45 2rex n THR 131 Ca 0.00 -2.14 -0.40 0.00 -2.27 0.00 0.00 64.05 59.25 2rex n THR 131 Cb 0.17 -0.28 -0.10 0.00 -2.10 0.00 0.00 70.33 68.02 2rex n THR 131 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2rex s ASP 132 N -2.10 6.16 0.30 3.42 3.68 -0.89 -4.99 116.67 122.24 2rex s ASP 132 Ca 0.43 -0.09 0.02 0.00 2.13 0.00 0.00 52.55 55.04 2rex s ASP 132 Cb 0.37 -2.18 0.47 0.00 -1.45 0.00 0.00 42.92 40.12 2rex s ASP 132 CO 0.06 -0.25 1.81 0.25 0.13 0.00 0.00 175.17 177.17 2rex h LEU 133 N 8.63 0.59 -0.10 -1.34 5.85 -1.93 -0.88 115.31 126.13 2rex h LEU 133 Ca -0.31 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.26 2rex h LEU 133 Cb 1.16 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 42.03 2rex h LEU 133 CO 0.65 0.69 0.03 0.28 -0.34 0.00 0.00 178.44 179.75 2rex h SER 134 N 0.58 0.14 -0.26 1.25 0.02 -1.96 0.02 113.55 113.33 2rex h SER 134 Ca 0.11 -0.20 0.06 0.00 -0.84 0.00 0.00 61.79 60.92 2rex h SER 134 Cb 0.43 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 62.88 2rex h SER 134 CO 0.02 0.30 -0.09 0.74 -1.14 0.00 0.00 176.83 176.67 2rex h THR 135 N -0.03 0.69 -0.63 -2.27 2.02 -1.77 -0.71 112.91 110.20 2rex h THR 135 Ca 0.03 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.12 2rex h THR 135 Cb 0.21 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 2rex h THR 135 CO -0.00 0.00 0.06 -0.07 0.37 0.00 0.00 175.52 175.87 2rex h LEU 136 N -0.03 1.05 -0.05 2.58 3.38 -1.09 0.40 115.31 121.54 2rex h LEU 136 Ca 0.13 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 2rex h LEU 136 Cb 0.23 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 2rex h LEU 136 CO -0.29 1.07 -0.00 0.24 0.09 0.00 0.00 178.44 179.54 2rex h MET 137 N 0.99 0.08 -0.65 1.13 2.86 -0.85 -0.97 114.93 117.52 2rex h MET 137 Ca 0.19 -0.03 0.02 0.00 -2.06 0.00 0.00 59.70 57.81 2rex h MET 137 Cb 0.50 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.12 2rex h MET 137 CO 0.02 0.40 0.42 0.93 1.06 0.00 0.00 176.91 179.74 2rex h GLU 138 N -0.24 0.82 -0.63 1.72 3.07 -1.08 -1.78 114.58 116.46 2rex h GLU 138 Ca 0.01 -0.05 -0.08 0.00 -0.50 0.00 0.00 59.36 58.74 2rex h GLU 138 Cb 0.36 -0.19 -0.02 0.00 -0.84 0.00 0.00 28.75 28.06 2rex h GLU 138 CO 0.00 0.54 0.07 -0.07 -1.40 0.00 0.00 179.01 178.16 2rex h LEU 139 N 0.85 1.01 -1.07 1.33 3.38 -0.89 -2.84 115.31 117.07 2rex h LEU 139 Ca 0.25 -0.25 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2rex h LEU 139 Cb -0.05 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 2rex h LEU 139 CO -0.08 1.02 -0.30 -1.28 0.09 0.00 0.00 178.44 177.89 2rex h SER 140 N 0.98 0.00 -0.07 -0.43 0.87 -1.03 0.13 113.55 114.00 2rex h SER 140 Ca 0.19 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.69 2rex h SER 140 Cb 0.46 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 2rex h SER 140 CO 0.02 0.30 -0.10 -0.74 -0.53 0.00 0.00 176.83 175.78 2rex h HIS 141 N 0.00 0.38 -0.37 2.24 6.17 -1.07 -2.25 115.15 120.25 2rex h HIS 141 Ca -0.00 -0.05 0.00 0.00 0.71 0.00 0.00 60.37 61.03 2rex h HIS 141 Cb 0.80 -0.11 0.00 0.00 2.52 0.00 0.00 27.41 30.62 2rex h HIS 141 CO 0.00 0.46 0.00 1.04 0.71 0.00 0.00 177.93 180.14 2rex n GLN 142 N -4.26 3.20 -4.05 5.26 6.02 -1.06 -4.92 117.38 117.59 2rex n GLN 142 Ca 0.00 -1.89 -0.33 0.00 -0.01 0.00 0.00 57.00 54.77 2rex n GLN 142 Cb 0.28 -1.88 0.00 0.00 1.02 0.00 0.00 30.24 29.66 2rex n GLN 142 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2rex n LYS 143 N 0.45 -4.58 -4.49 -1.09 5.02 -0.84 -5.01 118.16 107.63 2rex n LYS 143 Ca 0.17 0.51 -0.24 0.00 -2.02 0.00 0.00 58.31 56.73 2rex n LYS 143 Cb 0.77 -5.34 -0.10 0.00 -0.02 0.00 0.00 35.03 30.33 2rex n LYS 143 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2rex s GLN 144 N -6.76 1.69 0.03 1.97 -0.21 0.44 -4.98 119.66 111.84 2rex s GLN 144 Ca 0.70 -1.88 0.00 0.00 0.02 0.00 0.00 55.36 54.21 2rex s GLN 144 Cb -0.37 -1.38 -0.02 0.00 1.00 0.00 0.00 33.01 32.24 2rex s GLN 144 CO 0.87 0.05 -0.03 0.00 -2.12 0.00 0.00 175.29 174.06 2rex s ALA 145 N -2.86 0.20 0.40 6.09 0.00 -1.26 -2.93 121.76 121.40 2rex s ALA 145 Ca 0.32 -0.68 -0.26 0.00 0.00 0.00 0.00 51.96 51.34 2rex s ALA 145 Cb 0.04 0.16 -0.11 0.00 0.00 0.00 0.00 23.12 23.21 2rex s ALA 145 CO 0.14 -0.18 1.20 -2.30 0.00 0.00 0.00 175.76 174.62 2rex n PRO 146 N 1.40 1.80 -1.68 0.00 -0.02 -1.26 -4.78 135.00 130.46 2rex n PRO 146 Ca -0.23 0.64 -0.46 0.00 -2.02 0.00 0.00 63.50 61.44 2rex n PRO 146 Cb 0.56 -2.26 -0.04 0.00 -0.02 0.00 0.00 33.50 31.74 2rex n PRO 146 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2rex n ILE 147 N -0.14 0.06 -2.07 4.25 2.08 -0.36 -4.99 119.36 118.19 2rex n ILE 147 Ca 0.07 -0.01 -0.28 0.00 0.56 0.00 0.00 62.75 63.09 2rex n ILE 147 Cb 0.38 -1.63 0.11 0.00 -0.75 0.00 0.00 39.64 37.76 2rex n ILE 147 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 2rex s SER 148 N 1.25 4.18 0.17 4.38 1.04 -1.26 -4.92 113.70 118.55 2rex s SER 148 Ca 0.80 0.42 -0.10 0.00 0.48 0.00 0.00 55.95 57.54 2rex s SER 148 Cb -0.66 -0.82 0.03 0.00 0.10 0.00 0.00 66.02 64.68 2rex s SER 148 CO 0.38 -2.05 1.60 0.22 0.98 0.00 0.00 173.24 174.37 2rex h TYR 149 N -1.03 1.14 -0.19 5.02 3.20 -1.99 -2.13 116.97 120.98 2rex h TYR 149 Ca -0.44 -0.23 -0.20 0.00 3.14 0.00 0.00 58.73 60.99 2rex h TYR 149 Cb 1.29 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 39.28 2rex h TYR 149 CO -0.16 1.05 -0.68 0.93 -1.64 0.00 0.00 178.16 177.66 2rex h GLU 150 N 0.90 0.76 -0.77 1.82 3.07 -2.00 -2.26 114.58 116.11 2rex h GLU 150 Ca 0.14 -0.56 0.11 0.00 -0.50 0.00 0.00 59.36 58.55 2rex h GLU 150 Cb 0.66 0.10 -0.05 0.00 -0.84 0.00 0.00 28.75 28.61 2rex h GLU 150 CO 0.05 1.18 0.50 1.96 -1.40 0.00 0.00 179.01 181.30 2rex h GLN 151 N 0.55 0.61 -0.14 2.33 4.20 -1.94 -1.29 115.11 119.42 2rex h GLN 151 Ca -0.02 -0.04 -0.15 0.00 0.06 0.00 0.00 58.65 58.50 2rex h GLN 151 Cb 1.29 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.93 2rex h GLN 151 CO 0.14 0.40 -0.56 0.78 -0.67 0.00 0.00 178.83 178.92 2rex h GLY 152 N 0.62 0.48 0.99 3.46 0.00 -1.07 -0.69 103.07 106.88 2rex h GLY 152 Ca 0.36 -0.57 -0.03 0.00 0.00 0.00 0.00 47.33 47.10 2rex h GLY 152 CO -0.13 0.51 0.25 0.00 0.00 0.00 0.00 176.54 177.17 2rex h ALA 154 N 1.10 0.58 -0.59 0.00 0.00 -1.09 -2.49 119.26 116.77 2rex h ALA 154 Ca 0.20 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2rex h ALA 154 Cb 0.18 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2rex h ALA 154 CO -0.02 0.36 0.24 0.82 0.00 0.00 0.00 179.25 180.66 2rex h ILE 155 N 0.60 1.23 -0.55 0.00 2.04 -1.11 -1.29 117.51 118.42 2rex h ILE 155 Ca 0.12 -0.69 0.07 0.00 1.00 0.00 0.00 64.86 65.36 2rex h ILE 155 Cb 0.47 0.58 -0.06 0.00 -0.74 0.00 0.00 36.82 37.07 2rex h ILE 155 CO 0.02 0.27 0.23 0.00 0.00 0.00 0.00 178.15 178.67 2rex h ALA 156 N 1.09 0.71 -0.21 1.87 0.00 -1.03 0.14 119.26 121.83 2rex h ALA 156 Ca 0.20 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.10 2rex h ALA 156 Cb 0.19 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2rex h ALA 156 CO -0.02 -0.16 -0.13 -0.22 0.00 0.00 0.00 179.25 178.72 2rex h LYS 157 N 0.43 0.46 -0.67 0.00 3.64 -1.32 0.44 116.57 119.54 2rex h LYS 157 Ca 0.27 -0.21 0.08 0.00 -1.27 0.00 0.00 60.65 59.52 2rex h LYS 157 Cb 0.28 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.05 2rex h LYS 157 CO -0.25 0.76 0.45 0.37 -2.27 0.00 0.00 179.45 178.51 2rex h GLN 158 N 0.15 0.58 -0.20 1.90 4.15 -0.98 -2.12 115.11 118.58 2rex h GLN 158 Ca 0.04 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.43 2rex h GLN 158 Cb 0.64 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.20 2rex h GLN 158 CO 0.04 0.38 0.00 1.28 -1.93 0.00 0.00 178.83 178.60 2rex n LEU 159 N -4.48 1.84 -2.47 -2.39 4.77 0.48 -4.94 117.00 109.82 2rex n LEU 159 Ca 0.11 -0.79 -0.18 0.00 -0.03 0.00 0.00 56.01 55.12 2rex n LEU 159 Cb 0.30 -0.13 0.03 0.00 -2.33 0.00 0.00 43.42 41.29 2rex n LEU 159 CO 0.33 0.39 0.01 0.61 -1.33 0.00 0.00 177.39 177.41 2rex n GLY 160 N 1.16 -0.27 3.85 -0.72 0.00 -0.80 -5.00 105.19 103.41 2rex n GLY 160 Ca 0.16 -0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 2rex n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rex s ALA 161 N -3.06 3.53 0.33 4.61 0.00 0.15 -4.74 121.76 122.57 2rex s ALA 161 Ca 0.25 -0.11 0.06 0.00 0.00 0.00 0.00 51.96 52.16 2rex s ALA 161 Cb -0.11 -2.56 0.58 0.00 0.00 0.00 0.00 23.12 21.02 2rex s ALA 161 CO 0.31 0.44 1.80 1.49 0.00 0.00 0.00 175.76 179.81 2rex h GLU 162 N 3.13 0.34 -2.70 0.00 4.81 0.84 -3.40 114.58 117.59 2rex h GLU 162 Ca -0.48 -0.11 -0.04 0.00 -0.13 0.00 0.00 59.36 58.60 2rex h GLU 162 Cb 1.18 -0.03 -0.15 0.00 0.63 0.00 0.00 28.75 30.39 2rex h GLU 162 CO 0.67 0.55 0.15 -1.50 -0.73 0.00 0.00 179.01 178.15 2rex s ILE 163 N -4.56 0.01 -0.18 2.32 2.07 -1.26 -5.06 121.20 114.56 2rex s ILE 163 Ca -0.06 -0.08 -0.02 0.00 -1.41 0.00 0.00 60.65 59.08 2rex s ILE 163 Cb 0.14 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.72 2rex s ILE 163 CO 0.76 -0.04 -0.08 -0.47 -1.91 0.00 0.00 174.94 173.20 2rex s TYR 164 N -2.79 2.91 0.12 3.50 5.04 -1.26 -1.29 117.35 123.59 2rex s TYR 164 Ca -0.03 -0.73 0.06 0.00 -2.44 0.00 0.00 57.07 53.93 2rex s TYR 164 Cb -0.01 -1.98 -0.04 0.00 0.35 0.00 0.00 41.96 40.29 2rex s TYR 164 CO -0.04 -0.34 -0.16 -0.51 -1.34 0.00 0.00 175.55 173.16 2rex s LEU 165 N 0.87 2.37 0.09 6.97 1.43 -0.58 -4.93 118.68 124.90 2rex s LEU 165 Ca -0.02 -0.77 -0.12 0.00 -1.03 0.00 0.00 54.13 52.19 2rex s LEU 165 Cb -0.15 -0.63 0.02 0.00 0.03 0.00 0.00 46.19 45.46 2rex s LEU 165 CO 0.01 -0.09 0.29 -1.83 0.23 0.00 0.00 176.35 174.96 2rex s GLU 166 N -2.43 0.91 0.02 1.70 -1.05 -1.26 -1.41 118.70 115.18 2rex s GLU 166 Ca 0.08 -0.76 -0.01 0.00 -0.15 0.00 0.00 54.97 54.12 2rex s GLU 166 Cb -0.07 0.39 0.00 0.00 -0.44 0.00 0.00 34.13 34.01 2rex s GLU 166 CO 0.04 -0.31 0.05 0.41 0.95 0.00 0.00 175.26 176.39 2rex n GLY 167 N 0.04 1.63 2.74 -3.83 0.00 -0.94 -4.89 105.19 99.95 2rex n GLY 167 Ca -0.16 -0.98 -0.25 0.00 0.00 0.00 0.00 46.02 44.62 2rex n GLY 167 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2rex s SER 168 N -1.11 2.23 0.44 1.61 0.15 -1.26 -2.09 113.70 113.66 2rex s SER 168 Ca 0.01 -0.45 0.22 0.00 0.70 0.00 0.00 55.95 56.43 2rex s SER 168 Cb -0.00 -0.49 1.03 0.00 -1.71 0.00 0.00 66.02 64.85 2rex s SER 168 CO 0.00 -0.26 1.89 0.00 1.20 0.00 0.00 173.24 176.08 2rex h ALA 169 N 8.30 1.17 0.06 5.45 0.00 -1.92 -1.19 119.26 131.14 2rex h ALA 169 Ca -0.18 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 2rex h ALA 169 Cb 1.13 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.89 2rex h ALA 169 CO 0.29 0.31 -0.39 0.35 0.00 0.00 0.00 179.25 179.82 2rex h PHE 170 N 0.00 0.27 -0.00 0.00 -0.00 -1.95 -3.40 116.94 111.86 2rex h PHE 170 Ca -0.00 -0.19 0.00 0.00 -0.00 0.00 0.00 57.97 57.78 2rex h PHE 170 Cb 0.62 -0.01 0.00 0.00 -0.00 0.00 0.00 35.95 36.55 2rex h PHE 170 CO 0.00 1.13 -0.67 0.25 -0.00 0.00 0.00 178.31 179.02 2rex n THR 171 N -4.38 0.00 -3.16 4.41 -2.24 -1.24 -4.87 114.28 102.80 2rex n THR 171 Ca -0.12 -0.16 -0.16 0.00 -2.27 0.00 0.00 64.05 61.34 2rex n THR 171 Cb 0.64 1.01 -0.05 0.00 -2.10 0.00 0.00 70.33 69.83 2rex n THR 171 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2rex s SER 172 N -2.36 0.26 0.30 3.42 0.15 -0.45 -4.95 113.70 110.07 2rex s SER 172 Ca 0.06 -2.16 0.02 0.00 0.70 0.00 0.00 55.95 54.57 2rex s SER 172 Cb 0.11 0.70 0.72 0.00 -1.71 0.00 0.00 66.02 65.85 2rex s SER 172 CO 0.59 -0.15 1.61 -0.08 1.20 0.00 0.00 173.24 176.41 2rex h GLU 173 N 5.83 0.08 -0.85 5.44 4.81 -1.80 -2.41 114.58 125.68 2rex h GLU 173 Ca 0.14 -0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.37 2rex h GLU 173 Cb 1.03 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.34 2rex h GLU 173 CO 0.19 0.05 0.56 -0.22 -0.73 0.00 0.00 179.01 178.87 2rex h LYS 174 N 0.09 1.12 -0.29 1.92 3.64 -1.92 -1.50 116.57 119.62 2rex h LYS 174 Ca 0.57 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.85 2rex h LYS 174 Cb 1.17 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 32.72 2rex h LYS 174 CO -0.79 0.74 0.04 0.66 -2.27 0.00 0.00 179.45 177.83 2rex h SER 175 N 1.15 0.39 -0.09 4.20 4.64 -1.76 -0.33 113.55 121.76 2rex h SER 175 Ca 0.31 -0.05 -0.06 0.00 -0.47 0.00 0.00 61.79 61.52 2rex h SER 175 Cb -0.13 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 61.86 2rex h SER 175 CO -0.07 0.43 -0.19 0.40 -0.87 0.00 0.00 176.83 176.53 2rex h ILE 176 N 0.42 1.40 -0.83 0.95 1.08 -1.17 -2.41 117.51 116.95 2rex h ILE 176 Ca 0.10 -1.50 0.05 0.00 -0.39 0.00 0.00 64.86 63.12 2rex h ILE 176 Cb 0.22 2.17 -0.05 0.00 -3.07 0.00 0.00 36.82 36.09 2rex h ILE 176 CO 0.00 0.43 0.54 0.45 -0.69 0.00 0.00 178.15 178.88 2rex h HIS 177 N -0.18 0.96 -0.12 1.37 3.86 -1.07 -2.66 115.15 117.31 2rex h HIS 177 Ca 0.00 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2rex h HIS 177 Cb 0.78 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.93 2rex h HIS 177 CO 0.11 0.54 0.08 1.03 0.86 0.00 0.00 177.93 180.55 2rex h SER 178 N 0.98 0.14 -0.55 2.45 0.87 -0.99 0.74 113.55 117.18 2rex h SER 178 Ca 0.34 -0.00 0.11 0.00 -1.23 0.00 0.00 61.79 61.01 2rex h SER 178 Cb 0.12 -0.03 -0.09 0.00 -0.44 0.00 0.00 62.40 61.95 2rex h SER 178 CO -0.11 0.10 0.02 0.40 -0.53 0.00 0.00 176.83 176.71 2rex h ILE 179 N 0.16 0.57 0.00 2.23 2.04 -1.12 -0.97 117.51 120.43 2rex h ILE 179 Ca 0.04 -0.05 -0.14 0.00 1.00 0.00 0.00 64.86 65.72 2rex h ILE 179 Cb -0.02 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 2rex h ILE 179 CO -0.01 0.02 -0.71 -0.26 0.00 0.00 0.00 178.15 177.20 2rex h PHE 180 N 0.14 0.00 -0.37 1.37 -1.00 -1.14 0.35 116.94 116.28 2rex h PHE 180 Ca 0.29 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 61.01 2rex h PHE 180 Cb 0.44 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.99 2rex h PHE 180 CO -0.32 0.66 0.01 -0.09 -1.61 0.00 0.00 178.31 176.96 2rex h ARG 181 N 0.00 0.65 -0.07 1.51 2.43 -0.54 0.65 114.38 119.01 2rex h ARG 181 Ca -0.02 -0.20 -0.01 0.00 -0.81 0.00 0.00 59.98 58.94 2rex h ARG 181 Cb 1.52 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 31.00 2rex h ARG 181 CO 0.08 0.75 -0.00 1.15 -1.51 0.00 0.00 179.97 180.44 2rex h THR 182 N 0.48 1.26 -0.70 0.20 2.02 -1.10 -1.79 112.91 113.27 2rex h THR 182 Ca 0.11 -0.80 0.15 0.00 0.77 0.00 0.00 66.41 66.64 2rex h THR 182 Cb 0.44 1.66 -0.11 0.00 -1.74 0.00 0.00 68.15 68.40 2rex h THR 182 CO 0.02 0.22 0.14 0.00 0.37 0.00 0.00 175.52 176.27 2rex h ALA 183 N 0.72 0.87 -0.93 6.16 0.00 -0.95 -1.58 119.26 123.55 2rex h ALA 183 Ca 0.02 0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.12 2rex h ALA 183 Cb 0.35 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 2rex h ALA 183 CO 0.00 -0.34 0.61 0.77 0.00 0.00 0.00 179.25 180.29 2rex h SER 184 N 0.24 1.05 1.44 0.00 0.02 -0.57 -2.12 113.55 113.60 2rex h SER 184 Ca 0.39 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 2rex h SER 184 Cb 0.65 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.94 2rex h SER 184 CO -0.51 0.75 0.00 0.00 -1.14 0.00 0.00 176.83 175.93 2rex h MET 185 N 1.23 0.00 0.14 3.45 -0.00 -0.73 -3.10 114.93 115.92 2rex h MET 185 Ca 0.35 0.00 -0.25 0.00 -0.00 0.00 0.00 59.70 59.80 2rex h MET 185 Cb -0.10 0.00 0.03 0.00 -0.00 0.00 0.00 31.60 31.53 2rex h MET 185 CO -0.09 0.00 -1.06 -0.07 -0.00 0.00 0.00 176.91 175.69 2rex h LEU 186 N 0.00 0.70 0.00 -0.10 3.38 -0.87 -3.27 115.31 115.15 2rex h LEU 186 Ca 0.00 -0.87 0.00 0.00 0.09 0.00 0.00 57.88 57.10 2rex h LEU 186 Cb 0.72 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2rex h LEU 186 CO 0.00 1.51 0.00 0.00 0.09 0.00 0.00 178.44 180.04