#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ied h ALA 10 N 0.00 1.20 -0.50 1.69 0.00 -2.00 -2.33 119.26 117.31 1ied h ALA 10 Ca 0.00 -0.22 -0.22 0.00 0.00 0.00 0.00 54.91 54.47 1ied h ALA 10 Cb 0.00 -0.21 -0.13 0.00 0.00 0.00 0.00 17.79 17.45 1ied h ALA 10 CO 0.00 0.54 0.28 1.33 0.00 0.00 0.00 179.25 181.40 1ied n VAL 11 N -4.26 2.07 -2.14 0.00 0.24 -1.26 -4.81 118.33 108.16 1ied n VAL 11 Ca 0.03 -1.00 -0.28 0.00 -2.04 0.00 0.00 64.34 61.06 1ied n VAL 11 Cb 0.24 -0.63 0.14 0.00 -1.47 0.00 0.00 33.84 32.13 1ied n VAL 11 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ied s ALA 12 N -1.88 2.78 0.66 2.33 0.00 -0.88 -4.94 121.76 119.83 1ied s ALA 12 Ca 0.32 -1.27 -0.17 0.00 0.00 0.00 0.00 51.96 50.84 1ied s ALA 12 Cb 0.26 -2.56 0.00 0.00 0.00 0.00 0.00 23.12 20.82 1ied s ALA 12 CO 0.07 -1.98 1.19 -2.14 0.00 0.00 0.00 175.76 172.91 1ied s PRO 13 N -5.59 2.58 -0.09 0.00 0.02 -1.26 -4.96 135.00 125.71 1ied s PRO 13 Ca 0.69 1.73 0.02 0.00 0.02 0.00 0.00 61.00 63.46 1ied s PRO 13 Cb -0.06 -1.89 0.02 0.00 0.02 0.00 0.00 34.50 32.59 1ied s PRO 13 CO 0.49 -1.49 -0.13 0.08 -0.33 0.00 0.00 177.00 175.63 1ied s VAL 14 N -1.88 1.25 0.14 3.83 1.01 -0.67 -4.78 120.40 119.30 1ied s VAL 14 Ca 0.74 -0.51 -0.06 0.00 0.00 0.00 0.00 61.98 62.15 1ied s VAL 14 Cb -0.28 -1.16 -0.06 0.00 0.00 0.00 0.00 36.38 34.88 1ied s VAL 14 CO 0.40 0.39 0.40 -0.31 0.00 0.00 0.00 175.10 175.98 1ied s TYR 15 N 0.93 3.48 -0.02 5.22 1.51 0.33 0.52 117.35 129.32 1ied s TYR 15 Ca -0.09 0.63 0.01 0.00 -1.01 0.00 0.00 57.07 56.61 1ied s TYR 15 Cb -0.15 -2.06 0.02 0.00 -0.11 0.00 0.00 41.96 39.66 1ied s TYR 15 CO 0.00 0.43 -0.01 0.54 -1.11 0.00 0.00 175.55 175.40 1ied s VAL 16 N -1.63 0.24 0.23 0.71 0.11 0.17 -1.33 120.40 118.90 1ied s VAL 16 Ca 0.40 -0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.49 1ied s VAL 16 Cb -0.12 -0.29 -0.05 0.00 -1.53 0.00 0.00 36.38 34.38 1ied s VAL 16 CO 0.23 0.13 -0.01 -0.83 -3.33 0.00 0.00 175.10 171.29 1ied s GLY 17 N 0.70 1.57 0.00 6.54 0.00 -0.19 0.14 107.32 116.07 1ied s GLY 17 Ca -0.07 -1.77 0.00 0.00 0.00 0.00 0.00 44.72 42.88 1ied s GLY 17 CO -0.01 -1.68 0.00 0.61 0.00 0.00 0.00 173.10 172.02 1ied n GLY 18 N -0.43 2.71 3.75 0.20 0.00 -0.74 -1.04 105.19 109.65 1ied n GLY 18 Ca -0.05 -1.27 -0.40 0.00 0.00 0.00 0.00 46.02 44.30 1ied n GLY 18 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ied s PHE 19 N -2.00 3.89 -1.00 1.61 0.40 -1.26 -0.62 117.98 118.99 1ied s PHE 19 Ca 0.00 1.73 0.24 0.00 -0.60 0.00 0.00 56.93 58.31 1ied s PHE 19 Cb 0.00 -2.90 0.36 0.00 0.51 0.00 0.00 43.02 40.99 1ied s PHE 19 CO 0.00 0.40 1.31 1.28 0.70 0.00 0.00 175.22 178.91 1ied n LEU 20 N 1.99 0.60 -3.63 -0.37 4.77 0.93 -4.09 117.00 117.21 1ied n LEU 20 Ca -0.02 -0.10 -0.07 0.00 -0.03 0.00 0.00 56.01 55.78 1ied n LEU 20 Cb 0.48 -0.20 -0.06 0.00 -2.33 0.00 0.00 43.42 41.31 1ied n LEU 20 CO 0.49 0.15 0.88 0.00 -1.33 0.00 0.00 177.39 177.57 1ied s ALA 21 N -3.00 -2.03 -0.29 -1.18 0.00 -1.24 -4.65 121.76 109.37 1ied s ALA 21 Ca 0.10 1.77 -0.03 0.00 0.00 0.00 0.00 51.96 53.80 1ied s ALA 21 Cb 0.17 -1.36 0.04 0.00 0.00 0.00 0.00 23.12 21.97 1ied s ALA 21 CO 0.73 -0.22 0.01 1.03 0.00 0.00 0.00 175.76 177.31 1ied s ARG 22 N -0.22 2.63 0.58 0.00 1.81 -1.26 -1.67 118.95 120.83 1ied s ARG 22 Ca 0.04 -1.13 0.28 0.00 -1.72 0.00 0.00 55.73 53.19 1ied s ARG 22 Cb -0.04 -3.18 1.59 0.00 -0.45 0.00 0.00 34.95 32.87 1ied s ARG 22 CO -0.07 -0.55 2.06 1.88 -0.68 0.00 0.00 175.30 177.95 1ied h TYR 23 N 8.06 0.00 0.00 -0.53 0.05 -1.49 -0.51 116.97 122.55 1ied h TYR 23 Ca -0.26 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.52 1ied h TYR 23 Cb 1.08 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.82 1ied h TYR 23 CO 0.60 0.00 0.00 0.38 -1.05 0.00 0.00 178.16 178.09 1ied h ASP 24 N 0.00 0.00 -3.39 3.88 2.03 -1.94 -3.45 116.42 113.55 1ied h ASP 24 Ca 0.12 0.00 -0.55 0.00 -0.73 0.00 0.00 57.03 55.87 1ied h ASP 24 Cb 0.62 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 39.08 1ied h ASP 24 CO -0.00 0.00 0.14 -1.10 -1.03 0.00 0.00 179.24 177.24 1ied s GLN 25 N -3.26 4.47 -0.57 4.15 1.11 -0.20 -5.03 119.66 120.33 1ied s GLN 25 Ca 0.07 1.00 -0.19 0.00 0.01 0.00 0.00 55.36 56.24 1ied s GLN 25 Cb 0.06 -3.40 0.08 0.00 -1.01 0.00 0.00 33.01 28.74 1ied s GLN 25 CO 0.65 0.18 0.71 0.45 0.01 0.00 0.00 175.29 177.29 1ied s SER 26 N 0.33 6.20 -0.24 5.90 0.15 -1.26 -4.90 113.70 119.88 1ied s SER 26 Ca 0.39 -1.19 -0.33 0.00 0.70 0.00 0.00 55.95 55.52 1ied s SER 26 Cb -0.19 -2.31 -0.10 0.00 -1.71 0.00 0.00 66.02 61.71 1ied s SER 26 CO 0.21 -1.07 2.12 -2.65 1.20 0.00 0.00 173.24 173.05 1ied n PRO 27 N 6.43 1.63 0.00 5.44 -0.02 -1.26 -4.78 135.00 142.44 1ied n PRO 27 Ca -0.08 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 1ied n PRO 27 Cb 0.44 -2.75 0.02 0.00 -0.02 0.00 0.00 33.50 31.19 1ied n PRO 27 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1ied n ASP 28 N 9.58 0.00 -3.89 2.55 5.75 -1.26 -4.35 116.55 124.94 1ied n ASP 28 Ca 0.33 -0.40 -0.22 0.00 -0.01 0.00 0.00 54.79 54.49 1ied n ASP 28 Cb 0.31 0.00 -0.17 0.00 -1.03 0.00 0.00 41.12 40.24 1ied n ASP 28 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 1ied s GLU 29 N -2.00 0.97 0.21 0.11 2.56 -1.26 -5.02 118.70 114.26 1ied s GLU 29 Ca 0.01 -0.12 0.19 0.00 0.00 0.00 0.00 54.97 55.05 1ied s GLU 29 Cb 0.00 -1.01 0.87 0.00 2.00 0.00 0.00 34.13 35.99 1ied s GLU 29 CO 0.01 -0.13 1.57 0.00 -0.56 0.00 0.00 175.26 176.14 1ied n ALA 30 N 4.33 1.37 0.54 6.30 0.00 -1.26 -1.88 120.51 129.91 1ied n ALA 30 Ca -0.20 0.09 0.11 0.00 0.00 0.00 0.00 53.44 53.45 1ied n ALA 30 Cb 0.51 -1.29 0.04 0.00 0.00 0.00 0.00 19.45 18.71 1ied n ALA 30 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1ied n GLU 31 N -2.05 0.31 0.00 0.00 0.28 -1.26 -4.01 120.64 113.91 1ied n GLU 31 Ca 0.01 0.01 0.12 0.00 -0.16 0.00 0.00 57.16 57.15 1ied n GLU 31 Cb 0.13 -1.62 0.28 0.00 1.43 0.00 0.00 31.44 31.66 1ied n GLU 31 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1ied n LEU 32 N -2.02 1.21 -4.75 -1.84 4.77 -0.79 -4.94 117.00 108.63 1ied n LEU 32 Ca 0.02 -0.36 -0.42 0.00 -0.03 0.00 0.00 56.01 55.22 1ied n LEU 32 Cb 0.44 -0.10 -0.00 0.00 -2.33 0.00 0.00 43.42 41.43 1ied n LEU 32 CO 0.40 0.23 1.06 0.18 -1.33 0.00 0.00 177.39 177.93 1ied n LEU 33 N -0.58 4.36 -3.18 2.23 4.77 -1.23 -4.90 117.00 118.48 1ied n LEU 33 Ca 0.11 1.22 -0.12 0.00 -0.03 0.00 0.00 56.01 57.19 1ied n LEU 33 Cb 0.37 -1.58 -0.04 0.00 -2.33 0.00 0.00 43.42 39.84 1ied n LEU 33 CO 0.27 -0.05 -0.06 -0.22 -1.33 0.00 0.00 177.39 176.00 1ied s LEU 34 N -1.67 -0.48 0.58 2.23 2.96 -1.26 -5.12 118.68 115.92 1ied s LEU 34 Ca 0.54 -1.72 -0.19 0.00 -0.22 0.00 0.00 54.13 52.54 1ied s LEU 34 Cb -0.51 1.04 -0.04 0.00 0.50 0.00 0.00 46.19 47.18 1ied s LEU 34 CO 0.63 -0.17 1.23 -2.84 -1.32 0.00 0.00 176.35 173.88 1ied s PRO 35 N 1.13 3.00 0.14 0.98 0.02 -1.26 -4.82 135.00 134.19 1ied s PRO 35 Ca 0.23 1.89 -0.22 0.00 0.02 0.00 0.00 61.00 62.92 1ied s PRO 35 Cb -0.06 -1.99 0.01 0.00 0.02 0.00 0.00 34.50 32.49 1ied s PRO 35 CO -0.07 -1.20 1.64 -0.09 -0.33 0.00 0.00 177.00 176.95 1ied h ARG 36 N 1.00 -0.23 -0.42 5.54 2.43 -1.99 -2.72 114.38 117.99 1ied h ARG 36 Ca -0.50 0.02 0.07 0.00 -0.81 0.00 0.00 59.98 58.75 1ied h ARG 36 Cb 1.30 0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 30.84 1ied h ARG 36 CO 0.55 -0.15 0.06 0.38 -1.51 0.00 0.00 179.97 179.30 1ied h ASP 37 N -0.23 -0.05 -0.32 -3.80 2.03 -1.98 0.15 116.42 112.22 1ied h ASP 37 Ca 0.12 0.08 -0.01 0.00 -0.73 0.00 0.00 57.03 56.49 1ied h ASP 37 Cb 0.42 0.12 -0.02 0.00 -0.83 0.00 0.00 39.33 39.02 1ied h ASP 37 CO -0.34 0.01 0.18 -0.37 -1.03 0.00 0.00 179.24 177.69 1ied h VAL 38 N 0.18 1.12 -0.02 4.15 -1.51 -1.92 -1.44 116.25 116.81 1ied h VAL 38 Ca 0.21 -0.32 -0.02 0.00 -1.23 0.00 0.00 66.70 65.34 1ied h VAL 38 Cb 0.27 0.66 0.00 0.00 -2.13 0.00 0.00 31.29 30.09 1ied h VAL 38 CO -0.29 0.13 -0.05 0.58 -1.23 0.00 0.00 177.57 176.71 1ied h VAL 39 N 0.48 1.45 0.00 7.19 2.07 -0.90 -3.09 116.25 123.45 1ied h VAL 39 Ca 0.12 -1.41 -0.01 0.00 0.82 0.00 0.00 66.70 66.22 1ied h VAL 39 Cb 0.04 2.35 -0.00 0.00 -1.52 0.00 0.00 31.29 32.15 1ied h VAL 39 CO -0.02 0.38 -0.07 -0.33 0.02 0.00 0.00 177.57 177.55 1ied h GLU 40 N -0.48 0.00 -0.06 1.57 5.08 -0.45 -1.30 114.58 118.94 1ied h GLU 40 Ca 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1ied h GLU 40 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1ied h GLU 40 CO 0.01 0.07 -0.12 1.25 -1.00 0.00 0.00 179.01 179.22 1ied h HIS 41 N 0.00 0.23 0.00 4.33 2.76 -1.26 -3.10 115.15 118.11 1ied h HIS 41 Ca -0.00 -0.09 0.00 0.00 -2.20 0.00 0.00 60.37 58.08 1ied h HIS 41 Cb 0.30 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 29.22 1ied h HIS 41 CO 0.00 0.72 0.00 -1.49 -1.30 0.00 0.00 177.93 175.86 1ied h TRP 42 N -0.32 0.00 -3.35 5.26 6.55 -1.42 -3.45 115.95 119.22 1ied h TRP 42 Ca 0.00 0.00 -0.15 0.00 0.95 0.00 0.00 58.89 59.69 1ied h TRP 42 Cb 0.71 0.00 0.04 0.00 -0.86 0.00 0.00 29.16 29.05 1ied h TRP 42 CO 0.12 0.00 0.09 -0.11 -1.05 0.00 0.00 178.44 177.49 1ied n LEU 43 N -3.08 0.00 0.15 -4.49 7.94 -0.51 -4.97 117.00 112.04 1ied n LEU 43 Ca 0.02 -0.61 0.13 0.00 -1.11 0.00 0.00 56.01 54.44 1ied n LEU 43 Cb 0.38 -0.28 0.35 0.00 0.53 0.00 0.00 43.42 44.40 1ied n LEU 43 CO 0.29 -0.74 0.87 -0.74 -1.11 0.00 0.00 177.39 175.96 1ied h HIS 44 N -0.84 0.00 -0.08 1.96 2.76 -1.87 -3.48 115.15 113.60 1ied h HIS 44 Ca -0.13 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.04 1ied h HIS 44 Cb 0.41 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.37 1ied h HIS 44 CO 0.00 0.00 0.00 0.00 -1.30 0.00 0.00 177.93 176.63 1ied n ALA 45 N -1.89 2.57 -0.14 5.26 0.00 -1.24 -5.08 120.51 119.98 1ied n ALA 45 Ca 0.05 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.07 1ied n ALA 45 Cb 0.45 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.71 1ied n ALA 45 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1ied n VAL 55 N 0.01 -0.02 -1.67 0.00 3.14 -1.26 -4.77 118.33 113.76 1ied n VAL 55 Ca 0.18 0.00 -0.46 0.00 -2.96 0.00 0.00 64.34 61.10 1ied n VAL 55 Cb 0.29 -0.04 -0.04 0.00 -1.06 0.00 0.00 33.84 32.99 1ied n VAL 55 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1ied n ALA 56 N 0.93 1.50 -1.71 1.55 0.00 -1.26 -4.90 120.51 116.62 1ied n ALA 56 Ca 0.00 0.44 -0.43 0.00 0.00 0.00 0.00 53.44 53.45 1ied n ALA 56 Cb 0.00 -2.36 -0.02 0.00 0.00 0.00 0.00 19.45 17.07 1ied n ALA 56 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ied n LEU 57 N 3.39 3.81 -4.77 0.00 4.32 -1.26 -4.78 117.00 117.72 1ied n LEU 57 Ca 0.17 1.14 -0.35 0.00 -0.02 0.00 0.00 56.01 56.95 1ied n LEU 57 Cb 0.29 -1.52 0.02 0.00 -1.62 0.00 0.00 43.42 40.59 1ied n LEU 57 CO 0.63 -0.11 0.78 -2.16 -1.22 0.00 0.00 177.39 175.32 1ied s PRO 58 N -0.33 3.11 -0.19 3.23 0.04 -1.26 -0.73 135.00 138.87 1ied s PRO 58 Ca 0.67 1.60 -0.02 0.00 0.04 0.00 0.00 61.00 63.29 1ied s PRO 58 Cb -0.56 -1.97 -0.00 0.00 0.04 0.00 0.00 34.50 32.01 1ied s PRO 58 CO 0.48 -1.04 -0.11 -1.17 0.04 0.00 0.00 177.00 175.20 1ied s LEU 59 N -4.15 2.62 0.00 -3.56 2.96 -0.15 -2.46 118.68 113.93 1ied s LEU 59 Ca 0.72 -0.46 0.02 0.00 -0.22 0.00 0.00 54.13 54.19 1ied s LEU 59 Cb -0.24 -1.64 -0.01 0.00 0.50 0.00 0.00 46.19 44.80 1ied s LEU 59 CO 0.32 0.02 0.08 -0.46 -1.32 0.00 0.00 176.35 174.99 1ied n ASN 60 N 4.54 0.88 -4.52 3.68 0.23 -0.87 0.23 115.26 119.43 1ied n ASN 60 Ca -0.19 -2.09 -0.36 0.00 -0.53 0.00 0.00 54.58 51.41 1ied n ASN 60 Cb 0.51 0.56 -0.12 0.00 -2.08 0.00 0.00 39.78 38.66 1ied n ASN 60 CO 0.00 0.00 0.00 -0.63 -0.93 0.00 0.00 177.26 175.70 1ied s ILE 61 N -2.36 4.56 -1.70 1.53 1.01 -0.78 -0.75 121.20 122.71 1ied s ILE 61 Ca 0.12 -0.09 -0.20 0.00 0.00 0.00 0.00 60.65 60.47 1ied s ILE 61 Cb 0.01 -3.12 0.19 0.00 0.01 0.00 0.00 42.46 39.55 1ied s ILE 61 CO 0.08 0.36 0.65 -3.20 0.00 0.00 0.00 174.94 172.83 1ied n ASN 62 N 4.56 -2.51 -1.25 3.58 4.05 0.30 -1.05 115.26 122.93 1ied n ASN 62 Ca -0.16 -1.03 -0.16 0.00 0.45 0.00 0.00 54.58 53.68 1ied n ASN 62 Cb 0.52 -2.12 -0.07 0.00 1.23 0.00 0.00 39.78 39.34 1ied n ASN 62 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 177.26 175.62 1ied n HIS 63 N -4.11 0.00 -3.11 1.20 8.25 -1.26 -4.97 115.22 111.21 1ied n HIS 63 Ca 0.09 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.13 1ied n HIS 63 Cb 0.47 -2.84 -0.07 0.00 1.12 0.00 0.00 29.99 28.68 1ied n HIS 63 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1ied s ASP 64 N -2.81 6.40 0.00 0.41 3.68 -0.22 -4.93 116.67 119.20 1ied s ASP 64 Ca 0.00 0.02 0.18 0.00 2.13 0.00 0.00 52.55 54.88 1ied s ASP 64 Cb 0.00 -2.32 1.06 0.00 -1.45 0.00 0.00 42.92 40.20 1ied s ASP 64 CO 0.00 -0.64 1.46 -0.90 0.13 0.00 0.00 175.17 175.22 1ied n ASP 65 N 6.11 0.00 -1.07 -0.34 5.75 -1.26 -0.58 116.55 125.16 1ied n ASP 65 Ca -0.01 -0.60 0.12 0.00 -0.01 0.00 0.00 54.79 54.29 1ied n ASP 65 Cb 0.48 0.00 0.17 0.00 -1.03 0.00 0.00 41.12 40.75 1ied n ASP 65 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1ied n THR 66 N -0.98 0.34 -2.09 2.12 -2.24 -1.26 -4.36 114.28 105.80 1ied n THR 66 Ca 0.13 -0.67 -0.22 0.00 -2.27 0.00 0.00 64.05 61.02 1ied n THR 66 Cb 0.06 1.15 0.02 0.00 -2.10 0.00 0.00 70.33 69.47 1ied n THR 66 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ied n ALA 67 N 1.41 4.81 -2.29 6.98 0.00 0.26 -0.53 120.51 131.15 1ied n ALA 67 Ca 0.17 -3.70 -0.42 0.00 0.00 0.00 0.00 53.44 49.48 1ied n ALA 67 Cb 0.59 -0.37 -0.03 0.00 0.00 0.00 0.00 19.45 19.65 1ied n ALA 67 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1ied s VAL 68 N -4.54 3.97 -0.66 0.00 1.01 -1.26 -1.86 120.40 117.07 1ied s VAL 68 Ca 0.49 1.25 0.13 0.00 0.00 0.00 0.00 61.98 63.85 1ied s VAL 68 Cb 0.40 -3.81 -0.14 0.00 0.00 0.00 0.00 36.38 32.84 1ied s VAL 68 CO 0.03 -0.06 0.57 1.33 0.00 0.00 0.00 175.10 176.97 1ied n VAL 69 N 5.05 0.00 0.00 2.92 0.24 0.14 -2.20 118.33 124.48 1ied n VAL 69 Ca 0.14 -0.20 0.00 0.00 -2.04 0.00 0.00 64.34 62.24 1ied n VAL 69 Cb 0.44 1.01 0.00 0.00 -1.47 0.00 0.00 33.84 33.82 1ied n VAL 69 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ied n GLY 70 N 1.30 -0.87 3.28 7.63 0.00 -0.86 -1.15 105.19 114.52 1ied n GLY 70 Ca 0.03 -0.17 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 1ied n GLY 70 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1ied s HIS 71 N -4.00 0.35 -0.15 1.61 -3.43 -0.89 -0.98 115.29 107.80 1ied s HIS 71 Ca 0.00 -0.74 -0.28 0.00 -0.80 0.00 0.00 55.06 53.24 1ied s HIS 71 Cb 0.00 -0.09 -0.01 0.00 -1.43 0.00 0.00 32.58 31.05 1ied s HIS 71 CO 0.00 -0.65 0.97 0.08 -2.00 0.00 0.00 174.74 173.14 1ied s VAL 72 N -3.94 4.79 -0.17 -5.38 1.01 0.10 -0.89 120.40 115.91 1ied s VAL 72 Ca 0.14 1.93 0.19 0.00 0.00 0.00 0.00 61.98 64.24 1ied s VAL 72 Cb 0.04 -4.27 -0.09 0.00 0.00 0.00 0.00 36.38 32.07 1ied s VAL 72 CO -0.04 -0.03 0.89 0.00 0.00 0.00 0.00 175.10 175.92 1ied n ALA 73 N 5.37 2.19 -3.56 5.51 0.00 0.71 -4.54 120.51 126.19 1ied n ALA 73 Ca 0.08 -0.43 -0.13 0.00 0.00 0.00 0.00 53.44 52.97 1ied n ALA 73 Cb 0.48 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.88 1ied n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ied s ALA 74 N -3.11 -1.88 -0.01 0.00 0.00 -0.82 -3.17 121.76 112.77 1ied s ALA 74 Ca -0.02 1.48 -0.01 0.00 0.00 0.00 0.00 51.96 53.41 1ied s ALA 74 Cb 0.09 -0.44 0.01 0.00 0.00 0.00 0.00 23.12 22.77 1ied s ALA 74 CO 0.81 -0.35 0.03 -1.64 0.00 0.00 0.00 175.76 174.61 1ied s MET 75 N -1.24 0.02 -0.10 0.00 1.00 -1.26 -0.69 119.30 117.04 1ied s MET 75 Ca -0.04 0.05 -0.05 0.00 0.00 0.00 0.00 55.69 55.65 1ied s MET 75 Cb -0.00 -0.02 0.05 0.00 0.00 0.00 0.00 34.83 34.86 1ied s MET 75 CO 0.04 -0.02 0.23 -1.14 0.00 0.00 0.00 175.02 174.13 1ied s GLN 76 N 0.14 0.18 -0.22 2.03 2.00 0.05 -4.91 119.66 118.93 1ied s GLN 76 Ca -0.01 0.54 -0.23 0.00 -2.00 0.00 0.00 55.36 53.66 1ied s GLN 76 Cb -0.02 -0.12 -0.01 0.00 0.80 0.00 0.00 33.01 33.66 1ied s GLN 76 CO -0.00 -0.19 0.77 0.45 -0.50 0.00 0.00 175.29 175.82 1ied s SER 77 N 1.45 6.80 0.49 6.67 0.15 -1.26 -0.77 113.70 127.23 1ied s SER 77 Ca -0.07 0.99 0.01 0.00 0.70 0.00 0.00 55.95 57.57 1ied s SER 77 Cb -0.11 -2.41 -0.00 0.00 -1.71 0.00 0.00 66.02 61.79 1ied s SER 77 CO -0.08 -0.42 0.03 1.33 1.20 0.00 0.00 173.24 175.30 1ied n VAL 78 N 5.01 0.00 -0.17 4.45 0.24 0.52 -4.98 118.33 123.40 1ied n VAL 78 Ca 0.03 -2.42 -0.04 0.00 -2.04 0.00 0.00 64.34 59.88 1ied n VAL 78 Cb 0.48 0.56 0.03 0.00 -1.47 0.00 0.00 33.84 33.45 1ied n VAL 78 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1ied h ARG 79 N 0.00 -0.09 0.00 7.34 2.43 -1.95 -2.80 114.38 119.31 1ied h ARG 79 Ca -0.40 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 1ied h ARG 79 Cb 1.28 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 1ied h ARG 79 CO 0.66 -0.06 -0.28 -0.25 -1.51 0.00 0.00 179.97 178.53 1ied n ASP 80 N -5.41 0.57 0.00 -3.80 8.00 -1.26 -4.90 116.55 109.75 1ied n ASP 80 Ca 0.05 0.28 0.00 0.00 0.71 0.00 0.00 54.79 55.83 1ied n ASP 80 Cb 0.32 -0.26 0.00 0.00 -0.02 0.00 0.00 41.12 41.16 1ied n ASP 80 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ied n GLY 81 N 1.39 -0.51 3.38 0.44 0.00 -1.06 -1.23 105.19 107.60 1ied n GLY 81 Ca 0.05 -0.89 -0.42 0.00 0.00 0.00 0.00 46.02 44.76 1ied n GLY 81 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ied s LEU 82 N 0.00 5.09 0.08 0.99 2.96 -0.67 -0.35 118.68 126.78 1ied s LEU 82 Ca 0.00 -1.12 -0.14 0.00 -0.22 0.00 0.00 54.13 52.65 1ied s LEU 82 Cb 0.00 -2.09 -0.06 0.00 0.50 0.00 0.00 46.19 44.54 1ied s LEU 82 CO 0.00 -0.48 0.48 0.12 -1.32 0.00 0.00 176.35 175.15 1ied s PHE 83 N 1.59 3.66 0.09 5.38 2.19 0.05 -0.05 117.98 130.89 1ied s PHE 83 Ca 0.03 1.01 0.04 0.00 0.33 0.00 0.00 56.93 58.35 1ied s PHE 83 Cb -0.21 -2.32 -0.03 0.00 -1.31 0.00 0.00 43.02 39.15 1ied s PHE 83 CO 0.07 0.53 -0.12 0.00 1.83 0.00 0.00 175.22 177.53 1ied s LEU 85 N -2.13 0.64 0.32 0.00 1.98 0.14 -1.78 118.68 117.84 1ied s LEU 85 Ca 0.02 -0.22 0.08 0.00 -2.89 0.00 0.00 54.13 51.13 1ied s LEU 85 Cb -0.06 -0.44 -0.04 0.00 0.66 0.00 0.00 46.19 46.31 1ied s LEU 85 CO 0.01 -0.22 0.12 -0.83 -1.89 0.00 0.00 176.35 173.54 1ied s GLY 86 N 1.97 1.83 -0.11 7.98 0.00 0.36 -0.21 107.32 119.15 1ied s GLY 86 Ca 0.04 -1.75 -0.01 0.00 0.00 0.00 0.00 44.72 43.00 1ied s GLY 86 CO -0.06 -1.72 -0.06 0.00 0.00 0.00 0.00 173.10 171.27 1ied s VAL 88 N 1.77 4.93 0.00 0.00 1.01 0.18 -2.10 120.40 126.20 1ied s VAL 88 Ca 0.05 0.64 0.00 0.00 0.00 0.00 0.00 61.98 62.67 1ied s VAL 88 Cb -0.13 -4.03 0.00 0.00 0.00 0.00 0.00 36.38 32.23 1ied s VAL 88 CO -0.08 -0.23 0.00 0.35 0.00 0.00 0.00 175.10 175.14 1ied n THR 89 N 5.49 0.00 -1.64 3.92 -2.24 -0.52 -1.67 114.28 117.61 1ied n THR 89 Ca -0.02 -0.16 -0.45 0.00 -2.27 0.00 0.00 64.05 61.16 1ied n THR 89 Cb 0.49 0.63 -0.04 0.00 -2.10 0.00 0.00 70.33 69.31 1ied n THR 89 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1ied n SER 90 N -1.00 3.63 -0.25 3.42 2.88 -0.30 -4.87 113.62 117.14 1ied n SER 90 Ca 0.00 0.76 -0.07 0.00 -1.33 0.00 0.00 58.87 58.23 1ied n SER 90 Cb 0.00 -1.46 0.04 0.00 -0.75 0.00 0.00 64.21 62.04 1ied n SER 90 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1ied h PRO 91 N 11.13 1.06 -0.20 -1.46 0.11 -1.92 -0.26 132.00 140.46 1ied h PRO 91 Ca -0.46 -0.23 0.01 0.00 0.11 0.00 0.00 66.00 65.42 1ied h PRO 91 Cb 1.26 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1ied h PRO 91 CO 0.95 0.92 0.11 -0.09 -0.21 0.00 0.00 178.00 179.69 1ied h ARG 92 N 1.00 0.23 -0.21 1.05 2.43 -1.95 -0.23 114.38 116.71 1ied h ARG 92 Ca 0.22 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.36 1ied h ARG 92 Cb 0.30 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1ied h ARG 92 CO -0.01 0.15 0.08 0.35 -1.51 0.00 0.00 179.97 179.04 1ied h PHE 93 N 0.24 0.32 -0.96 2.20 3.57 -1.89 -1.95 116.94 118.48 1ied h PHE 93 Ca 0.08 -0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.57 1ied h PHE 93 Cb -0.00 -0.10 -0.05 0.00 2.79 0.00 0.00 35.95 38.59 1ied h PHE 93 CO -0.08 0.37 0.63 -0.07 -2.23 0.00 0.00 178.31 176.93 1ied h LEU 94 N 0.18 1.08 -0.70 0.59 4.07 -0.84 -0.80 115.31 118.88 1ied h LEU 94 Ca 0.07 -0.02 -0.12 0.00 0.08 0.00 0.00 57.88 57.89 1ied h LEU 94 Cb 0.19 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.66 1ied h LEU 94 CO -0.00 0.76 -0.30 -0.08 -1.08 0.00 0.00 178.44 177.74 1ied h GLU 95 N 1.26 0.67 -0.36 1.13 4.57 -0.93 0.54 114.58 121.47 1ied h GLU 95 Ca 0.36 -0.29 -0.03 0.00 -1.18 0.00 0.00 59.36 58.22 1ied h GLU 95 Cb -0.10 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.46 1ied h GLU 95 CO -0.09 0.89 0.11 0.82 -1.18 0.00 0.00 179.01 179.55 1ied h ILE 96 N 0.57 1.21 -0.62 2.32 2.04 -0.81 -2.37 117.51 119.85 1ied h ILE 96 Ca 0.07 -0.70 -0.02 0.00 1.00 0.00 0.00 64.86 65.21 1ied h ILE 96 Cb 0.80 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.85 1ied h ILE 96 CO 0.07 0.24 0.31 0.58 0.00 0.00 0.00 178.15 179.35 1ied h VAL 97 N 0.42 1.21 -0.18 1.67 2.07 -0.97 -2.42 116.25 118.05 1ied h VAL 97 Ca 0.11 -0.57 0.04 0.00 0.82 0.00 0.00 66.70 67.10 1ied h VAL 97 Cb 0.26 0.45 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 1ied h VAL 97 CO -0.00 0.24 -0.10 -0.09 0.02 0.00 0.00 177.57 177.64 1ied h ARG 98 N 0.85 -0.08 -0.36 1.57 2.43 -0.66 0.71 114.38 118.83 1ied h ARG 98 Ca 0.21 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.38 1ied h ARG 98 Cb 0.09 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 1ied h ARG 98 CO -0.03 -0.05 0.19 0.00 -1.51 0.00 0.00 179.97 178.56 1ied h ARG 99 N -0.08 0.51 -0.89 0.20 3.08 -1.29 -2.70 114.38 113.21 1ied h ARG 99 Ca 0.10 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 1ied h ARG 99 Cb 0.23 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.14 1ied h ARG 99 CO -0.23 0.44 0.48 0.00 -1.07 0.00 0.00 179.97 179.59 1ied h ALA 100 N 1.04 1.14 -0.06 0.04 0.00 -1.18 -2.61 119.26 117.63 1ied h ALA 100 Ca 0.13 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1ied h ALA 100 Cb 0.09 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1ied h ALA 100 CO -0.02 0.66 0.05 0.66 0.00 0.00 0.00 179.25 180.60 1ied h SER 101 N 1.25 0.00 0.97 0.00 4.64 -0.54 -0.30 113.55 119.58 1ied h SER 101 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 1ied h SER 101 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1ied h SER 101 CO -0.05 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.29 1ied n GLU 102 N -4.32 0.14 -0.59 4.77 -0.58 -0.99 -2.99 120.64 116.09 1ied n GLU 102 Ca -0.01 0.25 0.02 0.00 -0.42 0.00 0.00 57.16 57.00 1ied n GLU 102 Cb 0.15 -1.71 0.20 0.00 -0.57 0.00 0.00 31.44 29.51 1ied n GLU 102 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1ied n LYS 103 N -1.98 1.83 -4.21 3.49 4.76 -0.13 -4.97 118.16 116.95 1ied n LYS 103 Ca 0.04 -3.09 -0.34 0.00 -2.87 0.00 0.00 58.31 52.05 1ied n LYS 103 Cb 0.30 -1.72 -0.15 0.00 -1.84 0.00 0.00 35.03 31.63 1ied n LYS 103 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1ied s SER 104 N -2.71 3.91 0.16 4.39 0.15 -1.16 -4.99 113.70 113.44 1ied s SER 104 Ca 0.41 -0.44 -0.09 0.00 0.70 0.00 0.00 55.95 56.52 1ied s SER 104 Cb 0.37 -1.63 0.00 0.00 -1.71 0.00 0.00 66.02 63.05 1ied s SER 104 CO -0.01 0.04 1.51 -0.08 1.20 0.00 0.00 173.24 175.90 1ied h GLU 105 N 7.68 0.91 -0.32 5.44 4.81 -1.93 -1.24 114.58 129.93 1ied h GLU 105 Ca -0.38 -0.46 0.05 0.00 -0.13 0.00 0.00 59.36 58.45 1ied h GLU 105 Cb 1.17 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.51 1ied h GLU 105 CO 0.60 1.11 0.02 1.25 -0.73 0.00 0.00 179.01 181.26 1ied h LEU 106 N 0.75 -0.08 -0.91 1.64 5.85 -1.96 -1.78 115.31 118.82 1ied h LEU 106 Ca 0.07 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.79 1ied h LEU 106 Cb 0.93 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.05 1ied h LEU 106 CO 0.09 -0.00 0.08 0.58 -0.34 0.00 0.00 178.44 178.84 1ied h VAL 107 N 0.12 1.24 0.00 1.05 2.07 -1.83 -2.57 116.25 116.34 1ied h VAL 107 Ca 0.15 -0.94 -0.02 0.00 0.82 0.00 0.00 66.70 66.72 1ied h VAL 107 Cb 0.20 0.74 -0.00 0.00 -1.52 0.00 0.00 31.29 30.70 1ied h VAL 107 CO -0.24 0.34 -0.09 0.28 0.02 0.00 0.00 177.57 177.89 1ied h SER 108 N 0.83 0.00 1.08 0.57 0.02 -0.41 -1.59 113.55 114.05 1ied h SER 108 Ca 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1ied h SER 108 Cb 0.39 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.93 1ied h SER 108 CO 0.01 0.09 0.00 0.03 -1.14 0.00 0.00 176.83 175.82 1ied h ARG 109 N 0.00 0.00 -1.10 3.45 3.08 -0.93 -3.49 114.38 115.39 1ied h ARG 109 Ca -0.00 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.18 1ied h ARG 109 Cb 0.22 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.23 1ied h ARG 109 CO 0.01 0.00 -0.21 0.41 -1.07 0.00 0.00 179.97 179.11 1ied n GLY 110 N 0.17 -1.68 2.80 0.04 0.00 -0.60 -4.99 105.19 100.93 1ied n GLY 110 Ca 0.01 -1.40 -0.19 0.00 0.00 0.00 0.00 46.02 44.45 1ied n GLY 110 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ied n PRO 111 N -2.38 -0.44 -2.55 1.61 -0.04 -1.26 -4.99 135.00 124.94 1ied n PRO 111 Ca -0.00 -1.72 -0.41 0.00 -0.04 0.00 0.00 63.50 61.33 1ied n PRO 111 Cb 0.22 -0.74 -0.04 0.00 -0.04 0.00 0.00 33.50 32.90 1ied n PRO 111 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1ied s VAL 112 N -2.65 4.05 0.00 0.52 1.01 -1.26 -4.93 120.40 117.14 1ied s VAL 112 Ca 0.51 1.69 0.00 0.00 0.00 0.00 0.00 61.98 64.19 1ied s VAL 112 Cb -0.02 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.28 1ied s VAL 112 CO 0.35 0.25 0.00 -0.24 0.00 0.00 0.00 175.10 175.47 1ied n SER 113 N 2.75 0.00 0.02 3.32 2.88 -1.26 -1.90 113.62 119.42 1ied n SER 113 Ca 0.04 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.46 1ied n SER 113 Cb 0.47 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.87 1ied n SER 113 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1ied h PRO 114 N 0.00 -0.47 -6.26 -1.46 0.13 -1.92 -3.43 132.00 118.59 1ied h PRO 114 Ca 0.00 0.03 -0.66 0.00 -0.87 0.00 0.00 66.00 64.50 1ied h PRO 114 Cb 0.00 0.11 0.09 0.00 0.13 0.00 0.00 31.00 31.32 1ied h PRO 114 CO 0.00 -0.31 0.09 1.28 -0.23 0.00 0.00 178.00 178.83 1ied n LEU 115 N -5.43 0.94 -4.83 1.56 4.77 -0.80 -4.95 117.00 108.26 1ied n LEU 115 Ca -0.04 1.15 -0.36 0.00 -0.03 0.00 0.00 56.01 56.73 1ied n LEU 115 Cb 0.35 -1.15 -0.06 0.00 -2.33 0.00 0.00 43.42 40.24 1ied n LEU 115 CO 0.14 -1.66 0.31 0.00 -1.33 0.00 0.00 177.39 174.85 1ied s GLN 116 N -0.62 4.09 0.37 3.23 -2.07 -1.26 -4.71 119.66 118.69 1ied s GLN 116 Ca 0.71 0.65 -0.27 0.00 -1.82 0.00 0.00 55.36 54.63 1ied s GLN 116 Cb -0.89 -2.92 -0.11 0.00 -1.09 0.00 0.00 33.01 28.00 1ied s GLN 116 CO 0.55 0.45 1.25 -2.30 -1.32 0.00 0.00 175.29 173.91 1ied n PRO 117 N 0.80 1.97 -3.29 9.60 -0.02 -1.26 -4.89 135.00 137.90 1ied n PRO 117 Ca -0.04 0.69 -0.09 0.00 -2.02 0.00 0.00 63.50 62.04 1ied n PRO 117 Cb 0.51 -2.31 -0.05 0.00 -0.02 0.00 0.00 33.50 31.64 1ied n PRO 117 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1ied s ASP 118 N -0.43 -0.01 0.17 2.55 -1.08 -1.26 -5.06 116.67 111.54 1ied s ASP 118 Ca 0.58 -1.16 -0.18 0.00 -0.52 0.00 0.00 52.55 51.28 1ied s ASP 118 Cb -0.55 1.18 0.10 0.00 -1.46 0.00 0.00 42.92 42.19 1ied s ASP 118 CO 0.60 -0.23 1.65 0.11 0.52 0.00 0.00 175.17 177.83 1ied h LYS 119 N 7.12 -0.05 -0.39 4.34 1.57 -1.94 0.26 116.57 127.48 1ied h LYS 119 Ca 0.04 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 1ied h LYS 119 Cb 1.11 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.41 1ied h LYS 119 CO 0.16 -0.03 0.20 0.28 -0.57 0.00 0.00 179.45 179.49 1ied h VAL 120 N -0.05 1.16 -0.55 0.50 2.07 -1.89 0.11 116.25 117.61 1ied h VAL 120 Ca 0.20 -0.44 -0.07 0.00 0.82 0.00 0.00 66.70 67.21 1ied h VAL 120 Cb 0.35 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1ied h VAL 120 CO -0.44 0.17 0.06 0.58 0.02 0.00 0.00 177.57 177.96 1ied h VAL 121 N 0.49 1.25 -0.09 2.57 2.07 -1.79 -1.98 116.25 118.77 1ied h VAL 121 Ca 0.14 -0.97 -0.14 0.00 0.82 0.00 0.00 66.70 66.55 1ied h VAL 121 Cb 0.09 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1ied h VAL 121 CO -0.02 0.35 -0.56 -0.33 0.02 0.00 0.00 177.57 177.04 1ied h GLU 122 N 0.84 0.27 -0.41 1.57 5.08 -0.18 -0.78 114.58 120.97 1ied h GLU 122 Ca 0.17 -0.17 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 1ied h GLU 122 Cb 0.41 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 1ied h GLU 122 CO 0.01 0.76 -0.18 0.35 -1.00 0.00 0.00 179.01 178.95 1ied h PHE 123 N 0.21 0.98 -0.41 4.33 3.57 -0.74 -1.74 116.94 123.13 1ied h PHE 123 Ca 0.00 -0.24 -0.04 0.00 3.53 0.00 0.00 57.97 61.22 1ied h PHE 123 Cb 1.04 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.54 1ied h PHE 123 CO 0.02 1.01 0.10 -0.07 -2.23 0.00 0.00 178.31 177.13 1ied h LEU 124 N 0.67 0.63 -0.95 0.59 3.38 -1.27 0.69 115.31 119.06 1ied h LEU 124 Ca 0.09 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 57.85 1ied h LEU 124 Cb 0.74 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.27 1ied h LEU 124 CO 0.06 0.71 0.62 0.28 0.09 0.00 0.00 178.44 180.20 1ied h SER 125 N 0.53 1.06 0.00 -0.43 0.02 -1.01 -0.64 113.55 113.08 1ied h SER 125 Ca 0.13 -0.02 -0.20 0.00 -0.84 0.00 0.00 61.79 60.86 1ied h SER 125 Cb 0.32 -0.26 0.02 0.00 0.14 0.00 0.00 62.40 62.62 1ied h SER 125 CO 0.00 0.75 -0.77 1.23 -1.14 0.00 0.00 176.83 176.91 1ied h GLY 126 N 1.25 0.58 0.28 -3.77 0.00 -1.11 -3.32 103.07 96.97 1ied h GLY 126 Ca 0.36 -1.02 -0.01 0.00 0.00 0.00 0.00 47.33 46.67 1ied h GLY 126 CO -0.10 0.90 -0.03 1.76 0.00 0.00 0.00 176.54 179.07 1ied h SER 127 N 0.08 0.03 -3.01 0.19 0.02 -0.72 -3.39 113.55 106.74 1ied h SER 127 Ca -0.10 -0.75 -0.66 0.00 -0.84 0.00 0.00 61.79 59.44 1ied h SER 127 Cb 1.46 -0.01 -0.38 0.00 0.14 0.00 0.00 62.40 63.61 1ied h SER 127 CO 0.15 0.78 -0.29 -1.22 -1.14 0.00 0.00 176.83 175.11 1ied n TYR 128 N -4.70 3.69 1.52 3.45 4.02 -0.26 -3.96 117.16 120.91 1ied n TYR 128 Ca -0.09 -4.11 0.15 0.00 -0.01 0.00 0.00 57.90 53.84 1ied n TYR 128 Cb 0.38 -0.87 0.78 0.00 -0.02 0.00 0.00 39.34 39.62 1ied n TYR 128 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1ied n ALA 129 N 1.86 2.53 -2.39 -0.72 0.00 -1.00 -4.65 120.51 116.15 1ied n ALA 129 Ca 0.23 -0.16 -0.20 0.00 0.00 0.00 0.00 53.44 53.31 1ied n ALA 129 Cb 0.37 -1.49 -0.10 0.00 0.00 0.00 0.00 19.45 18.23 1ied n ALA 129 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ied s GLY 130 N -2.48 1.66 0.07 0.00 0.00 0.40 -0.20 107.32 106.76 1ied s GLY 130 Ca 0.32 -1.81 0.09 0.00 0.00 0.00 0.00 44.72 43.32 1ied s GLY 130 CO 0.45 -1.78 -0.24 1.08 0.00 0.00 0.00 173.10 172.61 1ied s LEU 131 N -3.38 2.34 -0.06 0.66 1.02 0.04 -0.92 118.68 118.39 1ied s LEU 131 Ca 0.27 -0.59 -0.02 0.00 0.02 0.00 0.00 54.13 53.81 1ied s LEU 131 Cb 0.03 -1.34 0.04 0.00 0.02 0.00 0.00 46.19 44.93 1ied s LEU 131 CO 0.10 0.24 0.11 -0.55 0.02 0.00 0.00 176.35 176.26 1ied s SER 132 N -1.53 0.58 -0.19 2.29 0.15 0.19 -4.42 113.70 110.76 1ied s SER 132 Ca 0.13 0.21 -0.08 0.00 0.70 0.00 0.00 55.95 56.92 1ied s SER 132 Cb -0.10 0.09 -0.04 0.00 -1.71 0.00 0.00 66.02 64.26 1ied s SER 132 CO 0.04 -0.21 0.08 -0.22 1.20 0.00 0.00 173.24 174.13 1ied s LEU 133 N 1.85 3.83 -0.53 3.45 2.96 -1.26 0.08 118.68 129.06 1ied s LEU 133 Ca -0.01 0.07 0.06 0.00 -0.22 0.00 0.00 54.13 54.03 1ied s LEU 133 Cb -0.12 -1.98 0.36 0.00 0.50 0.00 0.00 46.19 44.95 1ied s LEU 133 CO -0.05 0.15 0.97 -1.54 -1.32 0.00 0.00 176.35 174.56 1ied n SER 134 N 3.73 4.28 0.00 3.68 3.41 -1.17 -4.82 113.62 122.73 1ied n SER 134 Ca -0.16 -3.64 0.01 0.00 -0.26 0.00 0.00 58.87 54.81 1ied n SER 134 Cb 0.52 -0.54 0.04 0.00 -0.26 0.00 0.00 64.21 63.97 1ied n SER 134 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1ied n SER 135 N -0.26 0.00 -4.18 4.04 3.41 -1.26 -4.39 113.62 110.98 1ied n SER 135 Ca 0.32 -0.12 -0.53 0.00 -0.26 0.00 0.00 58.87 58.28 1ied n SER 135 Cb 0.47 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.35 1ied n SER 135 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1ied n ARG 136 N -0.78 0.00 0.00 4.33 0.63 -1.26 -4.63 116.66 114.95 1ied n ARG 136 Ca 0.01 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.94 1ied n ARG 136 Cb 0.00 -1.31 0.00 0.00 0.45 0.00 0.00 32.46 31.60 1ied n ARG 136 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 1ied n ARG 137 N 1.31 0.00 0.00 -0.14 3.00 -1.26 -4.93 116.66 114.65 1ied n ARG 137 Ca 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.03 1ied n ARG 137 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.56 1ied n ARG 137 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1ied n THR 153 N 0.00 0.00 0.00 5.15 -2.24 -1.26 -5.21 114.28 110.72 1ied n THR 153 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1ied n THR 153 Cb 0.00 -0.46 0.00 0.00 -2.10 0.00 0.00 70.33 67.77 1ied n THR 153 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1ied n PRO 154 N -2.12 0.00 -1.80 -0.78 -0.04 -1.26 -4.82 135.00 124.18 1ied n PRO 154 Ca 0.00 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.04 1ied n PRO 154 Cb 0.38 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.81 1ied n PRO 154 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1ied s PHE 155 N 0.00 2.92 -0.18 0.54 0.08 -1.26 -4.47 117.98 115.62 1ied s PHE 155 Ca 0.00 0.42 -0.12 0.00 0.12 0.00 0.00 56.93 57.35 1ied s PHE 155 Cb 0.00 -4.07 -0.07 0.00 -0.57 0.00 0.00 43.02 38.31 1ied s PHE 155 CO 0.00 -4.04 -0.28 1.63 -0.10 0.00 0.00 175.22 172.43 1ied n LYS 156 N 4.07 0.44 -3.54 0.44 4.76 -1.26 -4.96 118.16 118.11 1ied n LYS 156 Ca 0.15 0.19 -0.08 0.00 -2.87 0.00 0.00 58.31 55.70 1ied n LYS 156 Cb 0.36 -1.26 -0.02 0.00 -1.84 0.00 0.00 35.03 32.28 1ied n LYS 156 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 1ied s GLU 157 N -2.54 0.97 -0.10 1.97 -1.05 -1.26 -4.45 118.70 112.24 1ied s GLU 157 Ca -0.27 -0.40 0.03 0.00 -0.15 0.00 0.00 54.97 54.18 1ied s GLU 157 Cb 0.08 0.42 -0.01 0.00 -0.44 0.00 0.00 34.13 34.18 1ied s GLU 157 CO 0.36 -0.43 -0.19 0.08 0.95 0.00 0.00 175.26 176.03 1ied s VAL 158 N -3.26 2.49 -0.01 1.83 1.01 -1.03 -3.02 120.40 118.42 1ied s VAL 158 Ca 0.06 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.20 1ied s VAL 158 Cb -0.01 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.35 1ied s VAL 158 CO -0.07 0.55 -0.11 0.00 0.00 0.00 0.00 175.10 175.47 1ied s ALA 159 N 0.21 2.84 -0.10 5.51 0.00 0.11 -2.06 121.76 128.27 1ied s ALA 159 Ca -0.12 -1.02 -0.19 0.00 0.00 0.00 0.00 51.96 50.62 1ied s ALA 159 Cb -0.16 -1.03 -0.04 0.00 0.00 0.00 0.00 23.12 21.89 1ied s ALA 159 CO 0.07 0.59 0.53 -0.51 0.00 0.00 0.00 175.76 176.43 1ied s LEU 160 N -1.16 4.29 0.15 0.00 1.43 0.07 -0.63 118.68 122.83 1ied s LEU 160 Ca 0.15 0.91 -0.01 0.00 -1.03 0.00 0.00 54.13 54.15 1ied s LEU 160 Cb -0.11 -2.79 -0.04 0.00 0.03 0.00 0.00 46.19 43.29 1ied s LEU 160 CO 0.04 -0.01 0.08 0.00 0.23 0.00 0.00 176.35 176.69 1ied h SER 162 N 2.79 0.19 -3.33 0.00 4.64 -1.84 0.12 113.55 116.13 1ied h SER 162 Ca -0.35 -0.01 0.04 0.00 -0.47 0.00 0.00 61.79 61.00 1ied h SER 162 Cb 1.21 -0.05 -0.25 0.00 -0.31 0.00 0.00 62.40 63.01 1ied h SER 162 CO 0.57 0.18 0.36 0.68 -0.87 0.00 0.00 176.83 177.76 1ied s VAL 163 N -5.13 0.00 0.46 0.95 -7.23 -1.26 -3.32 120.40 104.87 1ied s VAL 163 Ca -0.06 0.00 -0.13 0.00 -1.81 0.00 0.00 61.98 59.98 1ied s VAL 163 Cb 0.17 -1.00 -0.07 0.00 0.56 0.00 0.00 36.38 36.04 1ied s VAL 163 CO 0.70 0.00 0.87 -0.83 -0.31 0.00 0.00 175.10 175.54 1ied s GLY 164 N 0.37 1.97 0.27 2.32 0.00 -1.26 -4.86 107.32 106.14 1ied s GLY 164 Ca 0.01 -0.04 0.13 0.00 0.00 0.00 0.00 44.72 44.82 1ied s GLY 164 CO -0.06 0.19 1.55 3.21 0.00 0.00 0.00 173.10 178.00 1ied h ARG 165 N 1.02 0.00 -6.15 2.90 3.08 -1.99 -3.43 114.38 109.81 1ied h ARG 165 Ca -0.47 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 58.99 1ied h ARG 165 Cb 1.19 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.19 1ied h ARG 165 CO 0.63 0.62 -0.16 1.03 -1.07 0.00 0.00 179.97 181.02 1ied s ARG 166 N -3.33 3.94 0.33 0.04 0.52 -1.26 -4.99 118.95 114.21 1ied s ARG 166 Ca 0.00 0.43 -0.22 0.00 -0.52 0.00 0.00 55.73 55.42 1ied s ARG 166 Cb 0.11 -3.10 -0.10 0.00 0.52 0.00 0.00 34.95 32.38 1ied s ARG 166 CO 0.75 0.60 0.88 1.03 0.02 0.00 0.00 175.30 178.59 1ied s ARG 167 N -1.49 4.36 0.00 3.54 1.81 -1.26 -3.78 118.95 122.13 1ied s ARG 167 Ca 0.30 1.12 0.00 0.00 -1.72 0.00 0.00 55.73 55.43 1ied s ARG 167 Cb -0.16 -2.60 0.00 0.00 -0.45 0.00 0.00 34.95 31.74 1ied s ARG 167 CO 0.17 0.20 0.00 0.41 -0.68 0.00 0.00 175.30 175.40 1ied n GLY 168 N 0.15 0.78 2.07 -3.53 0.00 -1.26 -4.31 105.19 99.09 1ied n GLY 168 Ca 0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.81 1ied n GLY 168 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ied n THR 169 N -2.35 3.05 -1.80 2.61 -2.24 -1.25 -4.20 114.28 108.10 1ied n THR 169 Ca 0.00 -2.02 -0.41 0.00 -2.27 0.00 0.00 64.05 59.34 1ied n THR 169 Cb 0.00 -0.96 -0.01 0.00 -2.10 0.00 0.00 70.33 67.26 1ied n THR 169 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1ied s LEU 170 N -2.82 4.33 -0.18 3.22 2.96 -1.26 -0.78 118.68 124.15 1ied s LEU 170 Ca 0.48 2.99 -0.12 0.00 -0.22 0.00 0.00 54.13 57.26 1ied s LEU 170 Cb 0.39 -3.65 -0.05 0.00 0.50 0.00 0.00 46.19 43.38 1ied s LEU 170 CO 0.03 -0.88 0.21 0.00 -1.32 0.00 0.00 176.35 174.39 1ied s ALA 171 N -0.58 3.64 -0.21 5.97 0.00 0.72 -4.38 121.76 126.91 1ied s ALA 171 Ca 0.58 -0.58 -0.00 0.00 0.00 0.00 0.00 51.96 51.96 1ied s ALA 171 Cb -0.47 -2.28 0.02 0.00 0.00 0.00 0.00 23.12 20.39 1ied s ALA 171 CO 0.56 0.12 -0.13 0.08 0.00 0.00 0.00 175.76 176.39 1ied s VAL 172 N 0.43 2.52 0.09 0.00 1.01 -0.21 -4.82 120.40 119.42 1ied s VAL 172 Ca 0.12 -0.96 -0.01 0.00 0.00 0.00 0.00 61.98 61.14 1ied s VAL 172 Cb -0.12 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 1ied s VAL 172 CO 0.01 0.37 0.25 -0.31 0.00 0.00 0.00 175.10 175.42 1ied s TYR 173 N 1.31 3.51 -0.03 5.22 2.02 -1.26 -1.02 117.35 127.10 1ied s TYR 173 Ca 0.02 0.31 -0.30 0.00 -0.37 0.00 0.00 57.07 56.73 1ied s TYR 173 Cb -0.15 -1.81 0.11 0.00 -0.40 0.00 0.00 41.96 39.71 1ied s TYR 173 CO -0.08 0.55 1.12 0.20 -1.57 0.00 0.00 175.55 175.77 1ied s GLY 174 N -2.56 -0.35 0.04 0.71 0.00 -0.44 -4.69 107.32 100.03 1ied s GLY 174 Ca 0.36 0.88 0.11 0.00 0.00 0.00 0.00 44.72 46.08 1ied s GLY 174 CO 0.27 0.25 0.92 3.21 0.00 0.00 0.00 173.10 177.76 1ied h ARG 175 N 2.00 0.00 -4.95 2.90 2.47 -1.86 0.96 114.38 115.90 1ied h ARG 175 Ca -0.22 0.00 -0.65 0.00 -1.26 0.00 0.00 59.98 57.85 1ied h ARG 175 Cb 1.21 0.00 -0.24 0.00 -1.65 0.00 0.00 29.97 29.29 1ied h ARG 175 CO 0.27 0.65 -0.64 0.34 0.56 0.00 0.00 179.97 181.14 1ied s ASP 176 N -6.29 4.99 0.53 7.04 3.68 -1.26 -4.66 116.67 120.69 1ied s ASP 176 Ca -0.02 -0.27 0.18 0.00 2.13 0.00 0.00 52.55 54.57 1ied s ASP 176 Cb 0.09 -1.89 1.35 0.00 -1.45 0.00 0.00 42.92 41.02 1ied s ASP 176 CO 0.82 -0.04 2.15 1.55 0.13 0.00 0.00 175.17 179.77 1ied h PRO 177 N 8.22 0.00 0.07 4.34 0.13 -1.96 -1.94 132.00 140.86 1ied h PRO 177 Ca -0.39 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1ied h PRO 177 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1ied h PRO 177 CO 0.58 0.00 -0.03 0.93 -0.23 0.00 0.00 178.00 179.25 1ied h GLU 178 N 0.00 -0.09 -0.60 0.86 4.39 -2.00 -2.42 114.58 114.72 1ied h GLU 178 Ca 0.02 0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.78 1ied h GLU 178 Cb 0.09 0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 28.71 1ied h GLU 178 CO -0.00 0.21 0.32 2.35 -1.16 0.00 0.00 179.01 180.73 1ied h TRP 179 N -0.39 0.59 -0.59 4.33 7.01 -1.87 -1.37 115.95 123.67 1ied h TRP 179 Ca -0.01 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.02 1ied h TRP 179 Cb 0.34 -0.18 -0.03 0.00 -2.10 0.00 0.00 29.16 27.19 1ied h TRP 179 CO 0.02 0.28 0.38 -0.24 -2.79 0.00 0.00 178.44 176.10 1ied h VAL 180 N 0.60 1.14 -0.22 2.65 3.04 -1.30 -2.01 116.25 120.14 1ied h VAL 180 Ca 0.27 -0.27 -0.07 0.00 -1.01 0.00 0.00 66.70 65.62 1ied h VAL 180 Cb 0.17 0.29 -0.01 0.00 -2.01 0.00 0.00 31.29 29.72 1ied h VAL 180 CO -0.17 0.14 -0.18 0.71 -1.01 0.00 0.00 177.57 177.05 1ied h THR 181 N 0.78 1.23 0.00 3.17 1.35 -0.96 -2.14 112.91 116.35 1ied h THR 181 Ca 0.22 -1.06 0.00 0.00 -0.55 0.00 0.00 66.41 65.02 1ied h THR 181 Cb -0.07 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 67.62 1ied h THR 181 CO -0.06 0.34 0.00 0.00 -0.25 0.00 0.00 175.52 175.55 1ied n GLN 182 N -4.18 0.32 0.19 4.72 1.13 -0.56 -2.54 117.38 116.46 1ied n GLN 182 Ca -0.00 0.09 0.12 0.00 -1.94 0.00 0.00 57.00 55.27 1ied n GLN 182 Cb 0.34 -1.50 0.22 0.00 0.11 0.00 0.00 30.24 29.42 1ied n GLN 182 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1ied h ARG 183 N 0.00 0.00 -4.47 -1.09 -0.00 -1.16 -3.42 114.38 104.24 1ied h ARG 183 Ca 0.00 0.00 -0.72 0.00 -0.50 0.00 0.00 59.98 58.76 1ied h ARG 183 Cb 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 29.97 29.80 1ied h ARG 183 CO 0.00 0.00 -0.47 -0.06 0.00 0.00 0.00 179.97 179.44 1ied s PHE 184 N -3.19 3.30 0.57 3.04 0.40 -1.05 -4.46 117.98 116.60 1ied s PHE 184 Ca 0.08 -1.33 0.27 0.00 -0.60 0.00 0.00 56.93 55.34 1ied s PHE 184 Cb 0.07 -2.85 1.56 0.00 0.51 0.00 0.00 43.02 42.31 1ied s PHE 184 CO 0.65 -0.80 2.07 -1.35 0.70 0.00 0.00 175.22 176.50 1ied h PRO 185 N 8.45 0.00 -0.16 0.24 0.11 -1.83 -2.41 132.00 136.40 1ied h PRO 185 Ca -0.24 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.80 1ied h PRO 185 Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1ied h PRO 185 CO 0.75 0.00 -0.21 -0.44 -0.21 0.00 0.00 178.00 177.89 1ied h ASP 186 N 0.00 0.27 -3.92 -2.05 3.32 -1.93 -3.44 116.42 108.67 1ied h ASP 186 Ca 0.12 -0.07 -0.52 0.00 0.02 0.00 0.00 57.03 56.58 1ied h ASP 186 Cb 0.61 -0.07 0.06 0.00 0.22 0.00 0.00 39.33 40.14 1ied h ASP 186 CO -0.00 0.49 0.57 -0.76 -1.72 0.00 0.00 179.24 177.82 1ied s LEU 187 N -8.64 4.29 0.34 1.55 1.43 -0.91 -4.98 118.68 111.77 1ied s LEU 187 Ca -0.05 2.52 0.07 0.00 -1.03 0.00 0.00 54.13 55.64 1ied s LEU 187 Cb 0.15 -3.86 -0.02 0.00 0.03 0.00 0.00 46.19 42.48 1ied s LEU 187 CO 0.75 -0.65 0.34 0.42 0.23 0.00 0.00 176.35 177.44 1ied s THR 188 N -1.28 3.55 0.32 5.49 -4.23 -1.26 -4.96 115.64 113.28 1ied s THR 188 Ca 0.54 -1.29 0.03 0.00 -1.18 0.00 0.00 61.69 59.79 1ied s THR 188 Cb -0.35 -3.21 0.28 0.00 1.34 0.00 0.00 72.50 70.56 1ied s THR 188 CO 0.45 -0.15 1.93 0.00 -0.54 0.00 0.00 174.62 176.31 1ied h ALA 189 N 1.15 1.58 -0.58 3.99 0.00 -1.98 0.17 119.26 123.59 1ied h ALA 189 Ca -0.45 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.38 1ied h ALA 189 Cb 1.26 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1ied h ALA 189 CO 0.57 0.29 0.12 0.00 0.00 0.00 0.00 179.25 180.22 1ied h ALA 190 N 1.54 0.77 -0.41 0.00 0.00 -1.99 -0.10 119.26 119.08 1ied h ALA 190 Ca 0.36 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1ied h ALA 190 Cb 0.22 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1ied h ALA 190 CO -0.13 0.50 0.25 -0.44 0.00 0.00 0.00 179.25 179.43 1ied h ASP 191 N 0.85 0.50 -0.37 0.00 3.45 -1.39 -2.61 116.42 116.85 1ied h ASP 191 Ca 0.18 -0.06 -0.07 0.00 0.43 0.00 0.00 57.03 57.51 1ied h ASP 191 Cb 0.39 -0.13 -0.02 0.00 -0.56 0.00 0.00 39.33 39.01 1ied h ASP 191 CO 0.01 0.41 -0.01 0.03 -1.57 0.00 0.00 179.24 178.10 1ied h ARG 192 N 0.54 0.76 -0.67 3.56 3.08 -0.36 -2.49 114.38 118.80 1ied h ARG 192 Ca 0.15 -0.20 -0.04 0.00 0.07 0.00 0.00 59.98 59.95 1ied h ARG 192 Cb 0.01 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 29.94 1ied h ARG 192 CO -0.03 0.78 0.27 -0.44 -1.07 0.00 0.00 179.97 179.48 1ied h ASP 193 N 0.71 0.93 -0.76 7.04 3.32 -0.82 0.53 116.42 127.38 1ied h ASP 193 Ca 0.14 -0.17 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 1ied h ASP 193 Cb 0.45 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.73 1ied h ASP 193 CO 0.02 0.85 0.41 1.23 -1.72 0.00 0.00 179.24 180.03 1ied h GLY 194 N 0.95 1.14 0.94 2.75 0.00 -1.16 -0.90 103.07 106.79 1ied h GLY 194 Ca 0.22 -0.52 -0.18 0.00 0.00 0.00 0.00 47.33 46.86 1ied h GLY 194 CO -0.02 0.49 -0.65 1.41 0.00 0.00 0.00 176.54 177.78 1ied h LEU 195 N 1.07 0.69 -0.95 3.11 3.38 -1.01 -3.23 115.31 118.37 1ied h LEU 195 Ca 0.27 -0.68 0.07 0.00 0.09 0.00 0.00 57.88 57.63 1ied h LEU 195 Cb 0.04 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 40.51 1ied h LEU 195 CO -0.04 1.27 0.60 -0.09 0.09 0.00 0.00 178.44 180.27 1ied h ARG 196 N 0.16 1.04 -0.23 1.13 2.43 0.43 -0.42 114.38 118.93 1ied h ARG 196 Ca -0.06 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.03 1ied h ARG 196 Cb 1.31 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 30.61 1ied h ARG 196 CO 0.13 0.69 0.05 0.00 -1.51 0.00 0.00 179.97 179.34 1ied h ALA 197 N 1.45 1.67 0.09 2.80 0.00 -1.22 -1.18 119.26 122.87 1ied h ALA 197 Ca 0.42 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 1ied h ALA 197 Cb 0.21 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1ied h ALA 197 CO -0.19 0.26 -0.04 1.96 0.00 0.00 0.00 179.25 181.24 1ied h GLN 198 N 0.33 -0.11 0.00 0.00 4.20 -1.13 -3.30 115.11 115.10 1ied h GLN 198 Ca 0.08 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1ied h GLN 198 Cb 0.13 0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.94 1ied h GLN 198 CO -0.00 0.35 0.00 -2.67 -0.67 0.00 0.00 178.83 175.84 1ied n TRP 199 N -4.81 0.07 -3.21 2.96 4.27 -0.66 -4.83 117.44 111.22 1ied n TRP 199 Ca -0.06 0.02 -0.42 0.00 -3.89 0.00 0.00 57.50 53.14 1ied n TRP 199 Cb 0.25 -0.54 -0.00 0.00 -1.36 0.00 0.00 31.31 29.66 1ied n TRP 199 CO 0.00 0.00 0.00 0.94 -2.29 0.00 0.00 177.69 176.34 1ied n GLN 200 N -1.56 3.87 0.00 -2.67 7.27 -0.45 -5.06 117.38 118.77 1ied n GLN 200 Ca 0.04 -4.52 0.00 0.00 0.07 0.00 0.00 57.00 52.60 1ied n GLN 200 Cb 0.23 -2.51 0.00 0.00 2.41 0.00 0.00 30.24 30.37 1ied n GLN 200 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1ied n GLY 211 N 1.92 0.00 3.66 1.69 0.00 -1.26 -5.03 105.19 106.17 1ied n GLY 211 Ca 0.25 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.84 1ied n GLY 211 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ied s ASP 212 N 0.00 6.84 0.33 1.61 -1.08 -1.26 -4.92 116.67 118.19 1ied s ASP 212 Ca 0.00 1.86 0.25 0.00 -0.52 0.00 0.00 52.55 54.14 1ied s ASP 212 Cb 0.00 -2.54 0.69 0.00 -1.46 0.00 0.00 42.92 39.61 1ied s ASP 212 CO 0.00 -0.83 1.72 1.55 0.52 0.00 0.00 175.17 178.14 1ied h PRO 213 N 8.70 0.00 -6.22 4.34 0.13 -1.96 -3.45 132.00 133.53 1ied h PRO 213 Ca -0.31 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.27 1ied h PRO 213 Cb 1.13 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.24 1ied h PRO 213 CO 0.97 0.00 1.02 0.12 -0.23 0.00 0.00 178.00 179.88 1ied s PHE 214 N -3.21 2.29 -0.26 1.56 2.19 -0.93 -4.30 117.98 115.32 1ied s PHE 214 Ca 0.08 0.48 0.09 0.00 0.33 0.00 0.00 56.93 57.91 1ied s PHE 214 Cb 0.09 -3.77 0.46 0.00 -1.31 0.00 0.00 43.02 38.48 1ied s PHE 214 CO 0.60 -3.10 1.32 0.54 1.83 0.00 0.00 175.22 176.41 1ied n ARG 215 N 6.93 1.93 -0.86 10.12 1.74 0.31 -4.97 116.66 131.85 1ied n ARG 215 Ca 0.16 -3.37 0.00 0.00 -0.77 0.00 0.00 57.85 53.87 1ied n ARG 215 Cb 0.43 -1.78 0.00 0.00 -1.02 0.00 0.00 32.46 30.10 1ied n ARG 215 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1ied n SER 216 N -1.07 1.99 -3.25 0.55 2.88 -0.54 -4.82 113.62 109.36 1ied n SER 216 Ca 0.28 -0.43 -0.12 0.00 -1.33 0.00 0.00 58.87 57.27 1ied n SER 216 Cb 0.84 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.28 1ied n SER 216 CO 0.00 0.00 0.00 1.51 -1.23 0.00 0.00 175.04 175.32 1ied s ASP 217 N 0.14 0.46 0.34 -3.46 1.47 -1.26 -5.03 116.67 109.33 1ied s ASP 217 Ca 0.00 -1.28 0.05 0.00 1.18 0.00 0.00 52.55 52.50 1ied s ASP 217 Cb 0.00 0.72 0.70 0.00 -0.34 0.00 0.00 42.92 44.00 1ied s ASP 217 CO 0.00 -1.41 1.90 0.77 0.68 0.00 0.00 175.17 177.11 1ied h SER 218 N 2.09 0.75 -0.78 2.11 4.64 -1.98 -1.76 113.55 118.61 1ied h SER 218 Ca -0.29 0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.03 1ied h SER 218 Cb 1.24 -0.13 -0.04 0.00 -0.31 0.00 0.00 62.40 63.17 1ied h SER 218 CO 0.38 0.44 0.39 1.88 -0.87 0.00 0.00 176.83 179.06 1ied h TYR 219 N 0.82 1.11 -0.47 4.77 0.05 -1.99 -0.72 116.97 120.55 1ied h TYR 219 Ca 0.40 -0.05 -0.06 0.00 0.05 0.00 0.00 58.73 59.07 1ied h TYR 219 Cb 0.44 -0.35 -0.02 0.00 1.01 0.00 0.00 36.73 37.82 1ied h TYR 219 CO -0.00 0.80 0.05 0.78 -1.05 0.00 0.00 178.16 178.74 1ied h GLY 220 N 1.10 0.86 1.27 3.88 0.00 -1.74 -1.28 103.07 107.15 1ied h GLY 220 Ca 0.27 -0.59 -0.07 0.00 0.00 0.00 0.00 47.33 46.94 1ied h GLY 220 CO -0.04 0.54 0.04 1.41 0.00 0.00 0.00 176.54 178.50 1ied h LEU 221 N 0.66 0.85 -0.51 3.11 3.38 -1.19 -2.07 115.31 119.53 1ied h LEU 221 Ca 0.14 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1ied h LEU 221 Cb 0.42 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1ied h LEU 221 CO 0.01 0.89 0.21 0.25 0.09 0.00 0.00 178.44 179.89 1ied h LEU 222 N 0.83 0.70 -0.63 1.67 5.85 -0.86 0.37 115.31 123.25 1ied h LEU 222 Ca 0.16 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ied h LEU 222 Cb 0.44 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 1ied h LEU 222 CO 0.02 0.68 0.39 1.23 -0.34 0.00 0.00 178.44 180.41 1ied h GLY 223 N 0.69 0.91 1.72 3.75 0.00 -0.97 -1.34 103.07 107.83 1ied h GLY 223 Ca 0.17 -0.37 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 1ied h GLY 223 CO -0.01 0.36 -0.01 -0.57 0.00 0.00 0.00 176.54 176.30 1ied h ASN 224 N 0.85 0.32 -0.31 0.19 -0.73 -1.03 -2.78 115.58 112.09 1ied h ASN 224 Ca 0.23 -0.05 -0.04 0.00 1.87 0.00 0.00 56.30 58.31 1ied h ASN 224 Cb -0.04 -0.08 -0.02 0.00 0.27 0.00 0.00 38.32 38.44 1ied h ASN 224 CO -0.04 0.39 0.06 0.77 -0.37 0.00 0.00 177.43 178.24 1ied h SER 225 N 0.34 0.56 0.37 1.15 4.64 0.24 -2.26 113.55 118.59 1ied h SER 225 Ca 0.08 -0.09 -0.15 0.00 -0.47 0.00 0.00 61.79 61.16 1ied h SER 225 Cb 0.25 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 1ied h SER 225 CO 0.01 0.58 -0.62 1.62 -0.87 0.00 0.00 176.83 177.55 1ied h VAL 226 N 0.58 1.39 -0.41 0.95 3.04 -1.26 -3.01 116.25 117.53 1ied h VAL 226 Ca 0.13 -2.02 -0.01 0.00 -1.01 0.00 0.00 66.70 63.80 1ied h VAL 226 Cb 0.27 2.02 -0.02 0.00 -2.01 0.00 0.00 31.29 31.56 1ied h VAL 226 CO 0.00 0.60 0.22 0.44 -1.01 0.00 0.00 177.57 177.82 1ied h ASP 227 N 0.18 0.52 -0.89 3.17 3.45 -1.38 -2.42 116.42 119.04 1ied h ASP 227 Ca -0.01 -0.09 0.17 0.00 0.43 0.00 0.00 57.03 57.53 1ied h ASP 227 Cb 1.13 -0.13 -0.07 0.00 -0.56 0.00 0.00 39.33 39.70 1ied h ASP 227 CO 0.10 0.46 0.58 0.00 -1.57 0.00 0.00 179.24 178.81 1ied h ALA 228 N 1.08 1.98 0.00 3.45 0.00 -1.30 -0.49 119.26 123.98 1ied h ALA 228 Ca 0.14 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1ied h ALA 228 Cb 0.06 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1ied h ALA 228 CO -0.02 -0.24 -0.01 -0.07 0.00 0.00 0.00 179.25 178.91 1ied h LEU 229 N 0.57 0.00 -2.89 0.00 3.38 -1.39 -2.55 115.31 112.43 1ied h LEU 229 Ca 0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.43 1ied h LEU 229 Cb 0.91 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1ied h LEU 229 CO -0.20 0.01 0.00 -1.22 0.09 0.00 0.00 178.44 177.11 1ied n TYR 230 N -3.57 0.73 -2.39 1.13 4.01 -0.20 -4.92 117.16 111.95 1ied n TYR 230 Ca -0.03 -0.53 -0.42 0.00 -0.16 0.00 0.00 57.90 56.76 1ied n TYR 230 Cb 0.09 -0.05 -0.03 0.00 -0.31 0.00 0.00 39.34 39.04 1ied n TYR 230 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1ied s ILE 231 N -1.18 4.08 0.34 -0.72 -1.09 -0.96 -4.97 121.20 116.70 1ied s ILE 231 Ca 0.34 1.44 -0.27 0.00 -2.23 0.00 0.00 60.65 59.93 1ied s ILE 231 Cb 0.19 -3.92 -0.09 0.00 -1.58 0.00 0.00 42.46 37.06 1ied s ILE 231 CO 0.21 0.01 1.05 -0.60 -1.23 0.00 0.00 174.94 174.38 1ied s ARG 232 N 2.14 4.43 -1.44 2.79 6.06 -1.26 -3.41 118.95 128.26 1ied s ARG 232 Ca 0.58 1.59 -0.03 0.00 -2.50 0.00 0.00 55.73 55.37 1ied s ARG 232 Cb -0.27 -2.85 0.02 0.00 0.06 0.00 0.00 34.95 31.90 1ied s ARG 232 CO 0.24 0.08 0.29 0.39 -2.50 0.00 0.00 175.30 173.80 1ied n GLU 233 N 0.56 -3.18 0.15 5.12 -0.58 -1.26 -4.89 120.64 116.56 1ied n GLU 233 Ca 0.02 0.78 -0.14 0.00 -0.42 0.00 0.00 57.16 57.40 1ied n GLU 233 Cb 0.48 -5.50 -0.07 0.00 -0.57 0.00 0.00 31.44 25.78 1ied n GLU 233 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 1ied h ARG 234 N -0.63 -0.59 -0.51 3.49 2.43 -1.94 -0.99 114.38 115.65 1ied h ARG 234 Ca -0.45 0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 58.69 1ied h ARG 234 Cb 1.32 0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.98 1ied h ARG 234 CO 0.51 -0.39 0.04 -0.07 -1.51 0.00 0.00 179.97 178.55 1ied h LEU 235 N -0.61 0.85 -0.78 3.80 3.38 -1.90 -1.22 115.31 118.83 1ied h LEU 235 Ca 0.01 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.71 1ied h LEU 235 Cb 0.60 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 1ied h LEU 235 CO -0.14 0.93 0.51 -0.65 0.09 0.00 0.00 178.44 179.18 1ied h PRO 236 N 0.75 1.01 -0.18 1.13 0.11 -1.93 0.37 132.00 133.26 1ied h PRO 236 Ca 0.15 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.19 1ied h PRO 236 Cb 0.47 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.34 1ied h PRO 236 CO 0.02 0.67 0.07 0.87 -0.21 0.00 0.00 178.00 179.41 1ied h LYS 237 N 1.04 0.27 -0.38 1.05 1.57 -1.04 -0.68 116.57 118.41 1ied h LYS 237 Ca 0.30 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 59.06 1ied h LYS 237 Cb -0.08 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.15 1ied h LYS 237 CO -0.08 0.35 0.16 -0.07 -0.57 0.00 0.00 179.45 179.24 1ied h LEU 238 N 0.13 0.21 -1.29 2.94 4.07 -0.82 0.88 115.31 121.43 1ied h LEU 238 Ca 0.06 0.03 -0.02 0.00 0.08 0.00 0.00 57.88 58.03 1ied h LEU 238 Cb 0.18 -0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.90 1ied h LEU 238 CO -0.00 0.16 0.21 0.03 -1.08 0.00 0.00 178.44 177.75 1ied h ARG 239 N 0.34 0.70 -0.06 1.13 3.08 -0.79 0.12 114.38 118.89 1ied h ARG 239 Ca 0.17 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1ied h ARG 239 Cb 0.11 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 1ied h ARG 239 CO -0.14 0.57 0.02 -0.92 -1.07 0.00 0.00 179.97 178.42 1ied h TYR 240 N 0.69 0.10 -0.59 3.04 3.20 -0.14 -1.26 116.97 122.02 1ied h TYR 240 Ca 0.17 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.05 1ied h TYR 240 Cb 0.12 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.33 1ied h TYR 240 CO 0.01 0.27 0.37 -0.44 -1.64 0.00 0.00 178.16 176.73 1ied h ASP 241 N -0.09 0.62 -0.18 -2.11 3.32 -0.28 -0.21 116.42 117.48 1ied h ASP 241 Ca 0.02 -0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.10 1ied h ASP 241 Cb 0.21 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.60 1ied h ASP 241 CO -0.00 0.44 -0.02 0.50 -1.72 0.00 0.00 179.24 178.44 1ied h LYS 242 N 0.74 0.04 -0.52 3.56 3.64 -0.58 -1.44 116.57 122.00 1ied h LYS 242 Ca 0.23 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.60 1ied h LYS 242 Cb -0.02 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 1ied h LYS 242 CO -0.08 0.02 0.29 0.37 -2.27 0.00 0.00 179.45 177.78 1ied h GLN 243 N 0.04 0.73 -0.80 1.90 4.15 -0.84 -2.30 115.11 117.97 1ied h GLN 243 Ca 0.08 -0.08 0.06 0.00 0.77 0.00 0.00 58.65 59.48 1ied h GLN 243 Cb 0.11 -0.14 -0.06 0.00 0.21 0.00 0.00 27.48 27.60 1ied h GLN 243 CO -0.15 0.56 0.49 1.25 -1.93 0.00 0.00 178.83 179.04 1ied h LEU 244 N 0.70 0.76 -2.06 -2.39 5.85 -0.47 -2.54 115.31 115.15 1ied h LEU 244 Ca 0.18 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.92 1ied h LEU 244 Cb 0.04 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 40.94 1ied h LEU 244 CO -0.03 0.48 0.00 1.33 -0.34 0.00 0.00 178.44 179.88 1ied n VAL 245 N -4.67 0.70 -1.80 1.05 0.24 -0.60 -4.96 118.33 108.30 1ied n VAL 245 Ca 0.11 -0.74 -0.17 0.00 -2.04 0.00 0.00 64.34 61.51 1ied n VAL 245 Cb 0.18 0.45 -0.05 0.00 -1.47 0.00 0.00 33.84 32.95 1ied n VAL 245 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ied n GLY 246 N 1.40 0.93 3.85 7.63 0.00 -0.89 -4.27 105.19 113.85 1ied n GLY 246 Ca 0.19 -0.21 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 1ied n GLY 246 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ied s VAL 247 N -2.70 5.05 0.05 1.61 1.01 -1.06 -4.68 120.40 119.67 1ied s VAL 247 Ca 0.00 0.66 0.08 0.00 0.00 0.00 0.00 61.98 62.72 1ied s VAL 247 Cb 0.00 -3.68 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 1ied s VAL 247 CO 0.00 0.42 -0.21 -0.89 0.00 0.00 0.00 175.10 174.42 1ied s THR 248 N -1.25 1.72 0.45 3.92 2.01 -1.26 -4.64 115.64 116.59 1ied s THR 248 Ca 0.29 -1.23 0.27 0.00 0.31 0.00 0.00 61.69 61.33 1ied s THR 248 Cb -0.15 -1.49 0.30 0.00 0.01 0.00 0.00 72.50 71.16 1ied s THR 248 CO 0.16 0.21 2.10 -0.33 -0.69 0.00 0.00 174.62 176.08 1ied h GLU 249 N 4.83 0.00 0.00 4.92 5.08 -1.85 -1.66 114.58 125.90 1ied h GLU 249 Ca -0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 1ied h GLU 249 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1ied h GLU 249 CO 0.44 0.10 0.00 0.54 -1.00 0.00 0.00 179.01 179.08 1ied n ARG 250 N -3.69 0.26 -0.33 2.33 1.74 -1.26 -3.31 116.66 112.39 1ied n ARG 250 Ca -0.02 0.12 0.00 0.00 -0.77 0.00 0.00 57.85 57.18 1ied n ARG 250 Cb 0.21 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.15 1ied n ARG 250 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 1ied n GLU 251 N -1.24 0.00 -2.93 5.56 0.28 -0.67 -4.93 120.64 116.70 1ied n GLU 251 Ca 0.08 -0.56 -0.08 0.00 -0.16 0.00 0.00 57.16 56.43 1ied n GLU 251 Cb 0.11 -0.34 -0.02 0.00 1.43 0.00 0.00 31.44 32.63 1ied n GLU 251 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 1ied n SER 252 N 0.00 -0.80 -1.08 -1.84 3.41 -0.90 -4.94 113.62 107.46 1ied n SER 252 Ca 0.00 -2.07 0.12 0.00 -0.26 0.00 0.00 58.87 56.66 1ied n SER 252 Cb 0.59 1.48 0.21 0.00 -0.26 0.00 0.00 64.21 66.23 1ied n SER 252 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1ied n TYR 253 N -0.33 0.39 -1.67 7.33 4.01 -1.26 -4.66 117.16 120.97 1ied n TYR 253 Ca 0.00 -0.19 -0.44 0.00 -0.16 0.00 0.00 57.90 57.10 1ied n TYR 253 Cb 0.33 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.34 1ied n TYR 253 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1ied n VAL 254 N 1.40 1.31 -0.02 -0.72 0.31 -1.26 -4.76 118.33 114.59 1ied n VAL 254 Ca 0.18 -0.33 0.08 0.00 -0.01 0.00 0.00 64.34 64.26 1ied n VAL 254 Cb 0.59 -1.43 -0.16 0.00 -0.91 0.00 0.00 33.84 31.94 1ied n VAL 254 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1ied n LYS 255 N 1.52 0.65 0.00 5.55 4.76 -1.26 -4.64 118.16 124.74 1ied n LYS 255 Ca 0.10 -0.16 0.11 0.00 -2.87 0.00 0.00 58.31 55.49 1ied n LYS 255 Cb 0.32 -1.48 0.66 0.00 -1.84 0.00 0.00 35.03 32.70 1ied n LYS 255 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03