#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fg0 s LEU 14 N 0.00 -0.43 0.00 -0.35 2.96 -1.26 -4.78 118.68 114.81 2fg0 s LEU 14 Ca 0.00 0.67 0.00 0.00 -0.22 0.00 0.00 54.13 54.58 2fg0 s LEU 14 Cb 0.00 1.60 0.00 0.00 0.50 0.00 0.00 46.19 48.29 2fg0 s LEU 14 CO 0.00 -0.10 0.00 0.61 -1.32 0.00 0.00 176.35 175.54 2fg0 n GLY 15 N 3.81 -0.55 3.70 7.98 0.00 -0.48 -4.93 105.19 114.72 2fg0 n GLY 15 Ca -0.17 -2.10 -0.38 0.00 0.00 0.00 0.00 46.02 43.37 2fg0 n GLY 15 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2fg0 s GLU 16 N 0.00 4.30 0.20 1.61 2.12 -1.26 -0.76 118.70 124.92 2fg0 s GLU 16 Ca 0.00 0.46 0.05 0.00 0.36 0.00 0.00 54.97 55.84 2fg0 s GLU 16 Cb 0.00 -3.47 -0.05 0.00 0.26 0.00 0.00 34.13 30.87 2fg0 s GLU 16 CO 0.00 0.07 -0.08 0.71 -0.54 0.00 0.00 175.26 175.42 2fg0 s TYR 17 N 0.92 1.55 0.02 5.30 1.51 0.78 -1.49 117.35 125.93 2fg0 s TYR 17 Ca 0.26 -0.75 0.08 0.00 -1.01 0.00 0.00 57.07 55.64 2fg0 s TYR 17 Cb -0.15 -0.82 -0.03 0.00 -0.11 0.00 0.00 41.96 40.85 2fg0 s TYR 17 CO 0.10 0.14 -0.22 1.14 -1.11 0.00 0.00 175.55 175.61 2fg0 s GLN 18 N -3.75 2.04 -0.00 -0.62 -2.07 0.61 0.18 119.66 116.04 2fg0 s GLN 18 Ca 0.23 -0.98 -0.29 0.00 -1.82 0.00 0.00 55.36 52.50 2fg0 s GLN 18 Cb 0.03 -2.11 -0.03 0.00 -1.09 0.00 0.00 33.01 29.80 2fg0 s GLN 18 CO 0.06 0.54 0.93 0.00 -1.32 0.00 0.00 175.29 175.50 2fg0 n LEU 20 N 3.78 1.42 -3.73 0.00 4.77 0.62 -0.05 117.00 123.81 2fg0 n LEU 20 Ca 0.04 -0.46 -0.10 0.00 -0.03 0.00 0.00 56.01 55.46 2fg0 n LEU 20 Cb 0.51 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.49 2fg0 n LEU 20 CO 0.51 0.27 0.22 0.00 -1.33 0.00 0.00 177.39 177.06 2fg0 s ALA 21 N -2.51 -0.86 0.06 -1.18 0.00 -1.26 -4.89 121.76 111.13 2fg0 s ALA 21 Ca 0.21 -0.24 -0.31 0.00 0.00 0.00 0.00 51.96 51.63 2fg0 s ALA 21 Cb 0.19 0.82 -0.08 0.00 0.00 0.00 0.00 23.12 24.05 2fg0 s ALA 21 CO 0.55 -0.75 1.64 -0.51 0.00 0.00 0.00 175.76 176.68 2fg0 s ASP 22 N -2.87 6.62 -0.06 0.00 1.01 -1.26 -3.60 116.67 116.52 2fg0 s ASP 22 Ca 0.09 2.45 0.04 0.00 0.71 0.00 0.00 52.55 55.84 2fg0 s ASP 22 Cb 0.00 -2.56 -0.02 0.00 1.01 0.00 0.00 42.92 41.35 2fg0 s ASP 22 CO -0.05 -0.88 -0.19 -0.76 0.21 0.00 0.00 175.17 173.51 2fg0 s LEU 23 N 2.71 2.44 0.05 1.23 1.43 0.76 -4.92 118.68 122.38 2fg0 s LEU 23 Ca 0.73 -0.35 -0.28 0.00 -1.03 0.00 0.00 54.13 53.20 2fg0 s LEU 23 Cb -0.39 -1.48 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 2fg0 s LEU 23 CO 0.32 0.28 0.90 0.20 0.23 0.00 0.00 176.35 178.28 2fg0 s ASN 24 N -0.37 7.35 -0.10 2.29 0.01 -1.26 0.04 114.94 122.90 2fg0 s ASN 24 Ca 0.03 1.62 0.01 0.00 -0.71 0.00 0.00 52.86 53.81 2fg0 s ASN 24 Cb -0.12 -2.54 -0.02 0.00 0.41 0.00 0.00 41.25 38.98 2fg0 s ASN 24 CO 0.02 -0.11 -0.12 -0.76 -1.51 0.00 0.00 177.10 174.63 2fg0 s LEU 25 N 0.35 2.84 0.28 0.60 1.02 -0.36 -4.60 118.68 118.81 2fg0 s LEU 25 Ca 0.46 -0.23 0.08 0.00 0.02 0.00 0.00 54.13 54.46 2fg0 s LEU 25 Cb -0.22 -1.62 -0.04 0.00 0.02 0.00 0.00 46.19 44.33 2fg0 s LEU 25 CO 0.27 0.24 0.13 -0.36 0.02 0.00 0.00 176.35 176.65 2fg0 s PHE 26 N -0.11 2.90 -2.16 0.29 0.08 0.14 -0.13 117.98 118.98 2fg0 s PHE 26 Ca -0.01 -0.20 0.28 0.00 0.12 0.00 0.00 56.93 57.12 2fg0 s PHE 26 Cb -0.14 -1.40 1.12 0.00 -0.57 0.00 0.00 43.02 42.03 2fg0 s PHE 26 CO 0.03 0.50 1.78 -0.40 -0.10 0.00 0.00 175.22 177.03 2fg0 n ASP 27 N -1.10 1.07 -3.90 1.36 5.68 -0.51 -0.39 116.55 118.77 2fg0 n ASP 27 Ca -0.06 -1.18 -0.09 0.00 -0.50 0.00 0.00 54.79 52.96 2fg0 n ASP 27 Cb 0.59 0.02 -0.06 0.00 -1.14 0.00 0.00 41.12 40.52 2fg0 n ASP 27 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 2fg0 s SER 28 N -2.17 -0.00 0.59 -1.12 1.04 -1.26 -4.90 113.70 105.88 2fg0 s SER 28 Ca 0.35 -0.75 0.38 0.00 0.48 0.00 0.00 55.95 56.40 2fg0 s SER 28 Cb 0.21 0.44 2.05 0.00 0.10 0.00 0.00 66.02 68.82 2fg0 s SER 28 CO 0.40 -0.89 2.15 -0.65 0.98 0.00 0.00 173.24 175.24 2fg0 h PRO 29 N 2.52 0.00 0.00 4.02 0.11 -1.90 -1.86 132.00 134.89 2fg0 h PRO 29 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2fg0 h PRO 29 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2fg0 h PRO 29 CO 0.48 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.66 2fg0 n GLU 30 N -2.86 0.18 -3.66 1.05 4.71 -1.26 -4.41 120.64 114.39 2fg0 n GLU 30 Ca -0.03 0.19 -0.23 0.00 -0.01 0.00 0.00 57.16 57.09 2fg0 n GLU 30 Cb 0.10 -1.73 0.06 0.00 -1.01 0.00 0.00 31.44 28.86 2fg0 n GLU 30 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2fg0 n THR 32 N -4.51 0.00 -3.90 0.00 -2.24 -1.26 -4.92 114.28 97.44 2fg0 n THR 32 Ca -0.14 -0.33 -0.21 0.00 -2.27 0.00 0.00 64.05 61.10 2fg0 n THR 32 Cb 0.61 0.29 -0.17 0.00 -2.10 0.00 0.00 70.33 68.96 2fg0 n THR 32 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2fg0 s ARG 33 N -3.03 0.56 0.11 -0.78 0.52 -1.26 -5.09 118.95 109.98 2fg0 s ARG 33 Ca -0.04 0.06 -0.31 0.00 -0.52 0.00 0.00 55.73 54.93 2fg0 s ARG 33 Cb 0.11 -0.81 -0.07 0.00 0.52 0.00 0.00 34.95 34.70 2fg0 s ARG 33 CO 0.68 -0.21 1.26 -1.17 0.02 0.00 0.00 175.30 175.89 2fg0 s LEU 34 N 1.51 4.39 -0.26 2.53 2.96 -1.26 -1.42 118.68 127.12 2fg0 s LEU 34 Ca -0.02 2.17 -0.15 0.00 -0.22 0.00 0.00 54.13 55.91 2fg0 s LEU 34 Cb -0.13 -3.59 -0.11 0.00 0.50 0.00 0.00 46.19 42.86 2fg0 s LEU 34 CO -0.03 -0.51 -0.34 0.00 -1.32 0.00 0.00 176.35 174.15 2fg0 n ALA 35 N 3.63 1.14 -3.37 5.97 0.00 0.81 -4.30 120.51 124.40 2fg0 n ALA 35 Ca 0.09 -1.05 -0.11 0.00 0.00 0.00 0.00 53.44 52.37 2fg0 n ALA 35 Cb 0.45 0.10 -0.01 0.00 0.00 0.00 0.00 19.45 19.98 2fg0 n ALA 35 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2fg0 s THR 36 N -2.55 0.00 -0.03 0.00 -1.32 -1.04 -4.49 115.64 106.20 2fg0 s THR 36 Ca -0.37 -1.29 0.04 0.00 -1.21 0.00 0.00 61.69 58.86 2fg0 s THR 36 Cb 0.13 -2.67 -0.01 0.00 -1.51 0.00 0.00 72.50 68.45 2fg0 s THR 36 CO 0.48 0.00 -0.15 -1.10 -2.21 0.00 0.00 174.62 171.64 2fg0 s GLN 37 N -2.87 1.46 -0.35 7.08 -0.21 -1.22 -1.22 119.66 122.33 2fg0 s GLN 37 Ca 0.22 -0.55 -0.12 0.00 0.02 0.00 0.00 55.36 54.94 2fg0 s GLN 37 Cb -0.03 -1.33 -0.00 0.00 1.00 0.00 0.00 33.01 32.65 2fg0 s GLN 37 CO 0.15 0.26 0.22 0.45 -2.12 0.00 0.00 175.29 174.25 2fg0 s SER 38 N -0.10 5.86 0.44 5.90 0.15 0.11 -4.60 113.70 121.45 2fg0 s SER 38 Ca 0.00 -0.60 -0.25 0.00 0.70 0.00 0.00 55.95 55.80 2fg0 s SER 38 Cb -0.09 -2.08 -0.08 0.00 -1.71 0.00 0.00 66.02 62.06 2fg0 s SER 38 CO 0.01 -0.27 1.37 0.00 1.20 0.00 0.00 173.24 175.54 2fg0 s ALA 39 N 1.66 3.21 0.21 5.45 0.00 -1.26 -0.17 121.76 130.86 2fg0 s ALA 39 Ca 0.05 1.35 -0.32 0.00 0.00 0.00 0.00 51.96 53.04 2fg0 s ALA 39 Cb -0.18 -3.54 -0.14 0.00 0.00 0.00 0.00 23.12 19.26 2fg0 s ALA 39 CO 0.09 -1.05 1.27 0.45 0.00 0.00 0.00 175.76 176.51 2fg0 n SER 40 N -0.14 2.01 0.00 0.00 2.88 -1.24 -1.36 113.62 115.77 2fg0 n SER 40 Ca 0.05 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.74 2fg0 n SER 40 Cb 0.43 -1.32 0.00 0.00 -0.75 0.00 0.00 64.21 62.57 2fg0 n SER 40 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2fg0 n GLY 41 N 2.00 3.41 3.75 0.46 0.00 0.93 -4.95 105.19 110.78 2fg0 n GLY 41 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 2fg0 n GLY 41 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fg0 s ARG 42 N -0.94 2.46 -0.09 1.61 0.52 -0.46 -4.55 118.95 117.50 2fg0 s ARG 42 Ca 0.00 1.45 -0.08 0.00 -0.52 0.00 0.00 55.73 56.59 2fg0 s ARG 42 Cb 0.00 -1.90 -0.04 0.00 0.52 0.00 0.00 34.95 33.53 2fg0 s ARG 42 CO 0.00 -1.53 0.19 -1.01 0.02 0.00 0.00 175.30 172.97 2fg0 s HIS 43 N -2.36 3.61 0.03 -0.53 3.76 -1.26 -0.32 115.29 118.23 2fg0 s HIS 43 Ca 0.68 0.59 -0.01 0.00 -0.15 0.00 0.00 55.06 56.17 2fg0 s HIS 43 Cb -0.22 -1.99 -0.03 0.00 1.11 0.00 0.00 32.58 31.46 2fg0 s HIS 43 CO 0.45 0.71 -0.01 -0.48 -0.85 0.00 0.00 174.74 174.56 2fg0 s LEU 44 N -1.14 2.28 -0.22 0.89 0.05 0.13 -1.27 118.68 119.39 2fg0 s LEU 44 Ca 0.18 -0.70 -0.09 0.00 0.05 0.00 0.00 54.13 53.57 2fg0 s LEU 44 Cb -0.13 0.20 -0.04 0.00 -2.05 0.00 0.00 46.19 44.17 2fg0 s LEU 44 CO 0.07 -0.44 0.10 0.86 -0.55 0.00 0.00 176.35 176.39 2fg0 s TRP 45 N -2.56 3.23 -0.26 3.48 -0.11 0.74 -0.16 118.94 123.30 2fg0 s TRP 45 Ca -0.06 0.02 -0.11 0.00 1.22 0.00 0.00 56.10 57.17 2fg0 s TRP 45 Cb -0.02 -2.19 -0.05 0.00 -1.50 0.00 0.00 33.47 29.71 2fg0 s TRP 45 CO -0.05 0.00 0.18 0.08 -4.62 0.00 0.00 176.95 172.54 2fg0 s VAL 46 N 0.92 5.32 0.84 5.86 1.01 0.06 -1.57 120.40 132.85 2fg0 s VAL 46 Ca 0.05 0.17 -0.08 0.00 0.00 0.00 0.00 61.98 62.12 2fg0 s VAL 46 Cb -0.14 -3.51 0.17 0.00 0.00 0.00 0.00 36.38 32.90 2fg0 s VAL 46 CO 0.03 0.29 1.16 0.42 0.00 0.00 0.00 175.10 177.00 2fg0 s THR 47 N 1.48 2.06 -2.11 3.92 -4.23 -0.62 -1.39 115.64 114.76 2fg0 s THR 47 Ca 0.07 -0.30 0.16 0.00 -1.18 0.00 0.00 61.69 60.45 2fg0 s THR 47 Cb -0.15 -2.76 0.42 0.00 1.34 0.00 0.00 72.50 71.35 2fg0 s THR 47 CO 0.08 0.00 1.39 -1.54 -0.54 0.00 0.00 174.62 174.01 2fg0 n SER 48 N -3.31 2.39 -4.51 3.99 3.41 -1.26 -4.79 113.62 109.54 2fg0 n SER 48 Ca 0.15 -1.94 -0.42 0.00 -0.26 0.00 0.00 58.87 56.40 2fg0 n SER 48 Cb 0.60 -0.26 -0.03 0.00 -0.26 0.00 0.00 64.21 64.26 2fg0 n SER 48 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2fg0 s ASN 49 N -1.17 6.45 -0.08 4.04 2.47 -1.26 -4.99 114.94 120.39 2fg0 s ASN 49 Ca 0.32 -1.44 -0.14 0.00 0.42 0.00 0.00 52.86 52.02 2fg0 s ASN 49 Cb 0.17 -2.49 -0.05 0.00 -1.45 0.00 0.00 41.25 37.43 2fg0 s ASN 49 CO 0.23 -1.40 0.35 -1.00 -3.72 0.00 0.00 177.10 171.56 2fg0 s HIS 50 N 4.21 3.60 -0.16 0.43 3.76 -1.26 -1.16 115.29 124.70 2fg0 s HIS 50 Ca 0.37 0.79 -0.13 0.00 -0.15 0.00 0.00 55.06 55.94 2fg0 s HIS 50 Cb -0.05 -2.29 0.05 0.00 1.11 0.00 0.00 32.58 31.39 2fg0 s HIS 50 CO -0.03 0.47 0.42 -0.65 -0.85 0.00 0.00 174.74 174.09 2fg0 s GLN 51 N -0.36 0.47 5.93 1.40 -0.21 -0.32 -5.01 119.66 121.56 2fg0 s GLN 51 Ca 0.21 0.65 0.00 0.00 0.02 0.00 0.00 55.36 56.23 2fg0 s GLN 51 Cb -0.15 0.17 0.00 0.00 1.00 0.00 0.00 33.01 34.03 2fg0 s GLN 51 CO 0.09 -0.09 0.00 -1.71 -2.12 0.00 0.00 175.29 171.46 2fg0 n ASN 52 N 3.24 0.00 -2.32 5.90 2.85 -1.26 -1.48 115.26 122.20 2fg0 n ASN 52 Ca -0.16 0.00 -0.31 0.00 -0.11 0.00 0.00 54.58 54.00 2fg0 n ASN 52 Cb 0.57 0.00 0.04 0.00 1.24 0.00 0.00 39.78 41.63 2fg0 n ASN 52 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2fg0 n LEU 53 N 0.00 6.26 -4.10 1.20 4.77 -1.26 -4.98 117.00 118.89 2fg0 n LEU 53 Ca 0.00 -4.66 -0.10 0.00 -0.03 0.00 0.00 56.01 51.21 2fg0 n LEU 53 Cb 0.00 -0.69 -0.08 0.00 -2.33 0.00 0.00 43.42 40.32 2fg0 n LEU 53 CO 0.00 1.85 -0.12 0.00 -1.33 0.00 0.00 177.39 177.79 2fg0 s ALA 54 N -3.74 0.58 0.00 -1.18 0.00 -0.55 -1.08 121.76 115.79 2fg0 s ALA 54 Ca 0.56 -1.31 0.02 0.00 0.00 0.00 0.00 51.96 51.22 2fg0 s ALA 54 Cb 0.45 1.10 -0.01 0.00 0.00 0.00 0.00 23.12 24.66 2fg0 s ALA 54 CO -0.07 -0.63 -0.06 0.54 0.00 0.00 0.00 175.76 175.54 2fg0 s VAL 55 N -4.07 0.44 0.14 0.00 0.11 0.01 -1.18 120.40 115.86 2fg0 s VAL 55 Ca 0.28 -0.33 -0.30 0.00 -2.93 0.00 0.00 61.98 58.70 2fg0 s VAL 55 Cb 0.05 -0.39 -0.07 0.00 -1.53 0.00 0.00 36.38 34.43 2fg0 s VAL 55 CO 0.07 0.07 1.19 -0.70 -3.33 0.00 0.00 175.10 172.40 2fg0 s GLU 56 N -0.29 4.48 0.20 1.54 2.12 -0.31 -0.71 118.70 125.74 2fg0 s GLU 56 Ca 0.01 1.83 0.01 0.00 0.36 0.00 0.00 54.97 57.18 2fg0 s GLU 56 Cb -0.03 -3.28 -0.05 0.00 0.26 0.00 0.00 34.13 31.04 2fg0 s GLU 56 CO -0.00 -0.13 0.07 0.14 -0.54 0.00 0.00 175.26 174.79 2fg0 s VAL 57 N 0.30 0.44 0.03 3.70 -7.23 0.13 -1.58 120.40 116.19 2fg0 s VAL 57 Ca 0.55 -1.98 0.01 0.00 -1.81 0.00 0.00 61.98 58.75 2fg0 s VAL 57 Cb -0.31 -2.37 -0.02 0.00 0.56 0.00 0.00 36.38 34.24 2fg0 s VAL 57 CO 0.34 -0.22 -0.05 -0.72 -0.31 0.00 0.00 175.10 174.14 2fg0 s TYR 58 N -3.83 0.46 0.11 2.82 -0.85 -0.61 -1.54 117.35 113.92 2fg0 s TYR 58 Ca 0.32 -0.44 -0.26 0.00 -0.52 0.00 0.00 57.07 56.16 2fg0 s TYR 58 Cb 0.07 -0.29 -0.07 0.00 0.38 0.00 0.00 41.96 42.05 2fg0 s TYR 58 CO 0.09 -0.11 0.81 -0.51 -1.52 0.00 0.00 175.55 174.30 2fg0 s LEU 59 N -1.31 4.53 0.28 -3.49 1.43 -0.02 -0.19 118.68 119.91 2fg0 s LEU 59 Ca -0.11 1.60 0.03 0.00 -1.03 0.00 0.00 54.13 54.62 2fg0 s LEU 59 Cb -0.09 -3.32 0.40 0.00 0.03 0.00 0.00 46.19 43.21 2fg0 s LEU 59 CO -0.00 0.09 1.70 0.00 0.23 0.00 0.00 176.35 178.37 2fg0 h GLU 61 N 0.38 0.00 0.00 0.00 3.07 -1.94 -3.35 114.58 112.74 2fg0 h GLU 61 Ca 0.05 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.91 2fg0 h GLU 61 Cb 0.72 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.63 2fg0 h GLU 61 CO 0.06 0.88 0.00 -0.40 -1.40 0.00 0.00 179.01 178.15 2fg0 n ASP 62 N -3.35 1.30 -1.60 1.42 5.75 -1.24 -4.67 116.55 114.17 2fg0 n ASP 62 Ca 0.00 -1.62 -0.18 0.00 -0.01 0.00 0.00 54.79 52.98 2fg0 n ASP 62 Cb 0.88 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.90 2fg0 n ASP 62 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2fg0 n ASP 63 N -0.31 -4.88 -4.69 -1.12 8.00 -0.19 -4.79 116.55 108.58 2fg0 n ASP 63 Ca 0.00 0.42 -0.42 0.00 0.71 0.00 0.00 54.79 55.50 2fg0 n ASP 63 Cb 0.31 -4.34 -0.03 0.00 -0.02 0.00 0.00 41.12 37.04 2fg0 n ASP 63 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2fg0 s TYR 64 N -2.58 3.22 0.20 1.24 5.04 -1.19 -4.61 117.35 118.66 2fg0 s TYR 64 Ca 0.00 1.25 -0.04 0.00 -2.44 0.00 0.00 57.07 55.83 2fg0 s TYR 64 Cb 0.00 -3.40 -0.05 0.00 0.35 0.00 0.00 41.96 38.85 2fg0 s TYR 64 CO 0.00 -1.22 0.44 -1.25 -1.34 0.00 0.00 175.55 172.18 2fg0 s PRO 65 N 2.18 3.61 0.00 4.97 0.04 -1.26 -0.84 135.00 143.71 2fg0 s PRO 65 Ca 0.55 -0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.50 2fg0 s PRO 65 Cb -0.24 -2.78 0.00 0.00 0.04 0.00 0.00 34.50 31.52 2fg0 s PRO 65 CO 0.22 0.38 0.00 0.41 0.04 0.00 0.00 177.00 178.04 2fg0 n GLY 66 N -0.36 0.79 3.20 0.56 0.00 -0.59 -4.95 105.19 103.85 2fg0 n GLY 66 Ca -0.02 -0.74 -0.30 0.00 0.00 0.00 0.00 46.02 44.95 2fg0 n GLY 66 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2fg0 s TRP 67 N -2.66 2.24 -0.13 1.61 0.52 0.48 -0.69 118.94 120.31 2fg0 s TRP 67 Ca 0.00 -0.77 -0.02 0.00 0.02 0.00 0.00 56.10 55.34 2fg0 s TRP 67 Cb 0.00 -1.50 -0.02 0.00 -1.15 0.00 0.00 33.47 30.80 2fg0 s TRP 67 CO 0.00 -0.28 -0.08 -1.17 0.02 0.00 0.00 176.95 175.44 2fg0 s LEU 68 N 0.12 3.03 0.29 2.99 2.96 0.11 -0.69 118.68 127.49 2fg0 s LEU 68 Ca -0.10 -0.19 -0.30 0.00 -0.22 0.00 0.00 54.13 53.33 2fg0 s LEU 68 Cb -0.15 -1.70 -0.11 0.00 0.50 0.00 0.00 46.19 44.74 2fg0 s LEU 68 CO 0.05 0.20 1.46 -0.55 -1.32 0.00 0.00 176.35 176.19 2fg0 s SER 69 N 0.17 6.56 0.59 3.68 0.15 -1.26 -0.81 113.70 122.78 2fg0 s SER 69 Ca -0.04 2.80 0.30 0.00 0.70 0.00 0.00 55.95 59.70 2fg0 s SER 69 Cb -0.14 -2.64 1.83 0.00 -1.71 0.00 0.00 66.02 63.36 2fg0 s SER 69 CO 0.04 -0.75 2.26 -0.07 1.20 0.00 0.00 173.24 175.91 2fg0 h LEU 70 N 4.44 0.00 -1.65 3.45 3.38 -1.43 -0.13 115.31 123.38 2fg0 h LEU 70 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 2fg0 h LEU 70 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2fg0 h LEU 70 CO 0.74 0.00 0.00 0.77 0.09 0.00 0.00 178.44 180.04 2fg0 h SER 71 N 0.00 0.00 -0.26 -0.43 4.64 -1.90 -1.52 113.55 114.08 2fg0 h SER 71 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2fg0 h SER 71 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2fg0 h SER 71 CO 0.00 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.43 2fg0 n ASP 72 N -2.46 2.27 0.25 4.97 8.00 -0.06 -4.33 116.55 125.19 2fg0 n ASP 72 Ca -0.01 -1.83 0.08 0.00 0.71 0.00 0.00 54.79 53.73 2fg0 n ASP 72 Cb 0.08 -0.17 0.62 0.00 -0.02 0.00 0.00 41.12 41.63 2fg0 n ASP 72 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 2fg0 h PHE 73 N 2.92 0.00 0.00 1.24 -1.00 -1.40 -0.57 116.94 118.12 2fg0 h PHE 73 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2fg0 h PHE 73 Cb 0.64 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.20 2fg0 h PHE 73 CO 0.17 0.05 0.00 -0.25 -1.61 0.00 0.00 178.31 176.67 2fg0 n ASP 74 N -4.45 0.28 -1.59 2.17 9.92 -1.26 -2.00 116.55 119.62 2fg0 n ASP 74 Ca -0.03 0.57 0.10 0.00 -0.53 0.00 0.00 54.79 54.90 2fg0 n ASP 74 Cb 0.13 -0.63 0.36 0.00 -0.64 0.00 0.00 41.12 40.34 2fg0 n ASP 74 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2fg0 n SER 75 N -1.81 4.71 -4.39 -2.24 7.64 -0.22 -4.87 113.62 112.43 2fg0 n SER 75 Ca 0.03 -2.39 -0.33 0.00 1.01 0.00 0.00 58.87 57.19 2fg0 n SER 75 Cb 0.20 -0.57 -0.14 0.00 -1.01 0.00 0.00 64.21 62.69 2fg0 n SER 75 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2fg0 s LEU 76 N -1.73 2.87 -0.06 -3.43 1.43 -0.85 -0.28 118.68 116.63 2fg0 s LEU 76 Ca 0.52 -0.29 0.05 0.00 -1.03 0.00 0.00 54.13 53.38 2fg0 s LEU 76 Cb 0.32 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.86 2fg0 s LEU 76 CO 0.26 0.14 -0.20 -1.58 0.23 0.00 0.00 176.35 175.21 2fg0 s GLN 77 N 0.50 2.59 0.33 1.70 0.74 -0.28 -4.93 119.66 120.32 2fg0 s GLN 77 Ca -0.07 -0.81 -0.29 0.00 0.05 0.00 0.00 55.36 54.24 2fg0 s GLN 77 Cb -0.15 -2.28 -0.12 0.00 1.10 0.00 0.00 33.01 31.56 2fg0 s GLN 77 CO 0.04 0.46 1.51 -2.30 -0.55 0.00 0.00 175.29 174.44 2fg0 n PRO 78 N 2.76 2.60 -2.70 1.67 -0.02 -1.26 -0.28 135.00 137.77 2fg0 n PRO 78 Ca -0.17 0.92 -0.41 0.00 -2.02 0.00 0.00 63.50 61.82 2fg0 n PRO 78 Cb 0.52 -2.65 -0.05 0.00 -0.02 0.00 0.00 33.50 31.30 2fg0 n PRO 78 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2fg0 s ALA 79 N -0.61 3.30 -0.32 3.55 0.00 -0.55 -4.70 121.76 122.43 2fg0 s ALA 79 Ca 0.59 0.64 0.18 0.00 0.00 0.00 0.00 51.96 53.36 2fg0 s ALA 79 Cb -0.50 -3.27 -0.24 0.00 0.00 0.00 0.00 23.12 19.11 2fg0 s ALA 79 CO 0.57 0.03 0.52 0.25 0.00 0.00 0.00 175.76 177.12 2fg0 n THR 80 N 2.19 0.00 -4.02 0.00 -2.24 -1.26 -4.83 114.28 104.12 2fg0 n THR 80 Ca 0.01 -0.29 -0.31 0.00 -2.27 0.00 0.00 64.05 61.19 2fg0 n THR 80 Cb 0.48 0.43 -0.16 0.00 -2.10 0.00 0.00 70.33 68.98 2fg0 n THR 80 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2fg0 s VAL 81 N -3.01 1.72 0.47 2.28 1.01 -1.26 -5.12 120.40 116.48 2fg0 s VAL 81 Ca -0.02 -1.01 -0.22 0.00 0.00 0.00 0.00 61.98 60.73 2fg0 s VAL 81 Cb 0.12 -1.75 -0.07 0.00 0.00 0.00 0.00 36.38 34.68 2fg0 s VAL 81 CO 0.73 0.22 1.15 -2.16 0.00 0.00 0.00 175.10 175.05 2fg0 s PRO 82 N 1.37 3.71 0.20 2.72 0.04 -1.26 -4.94 135.00 136.83 2fg0 s PRO 82 Ca -0.01 1.73 -0.31 0.00 0.04 0.00 0.00 61.00 62.46 2fg0 s PRO 82 Cb -0.16 -2.34 -0.10 0.00 0.04 0.00 0.00 34.50 31.94 2fg0 s PRO 82 CO -0.09 -0.59 1.57 -0.47 0.04 0.00 0.00 177.00 177.47 2fg0 s TYR 83 N -1.59 2.99 -0.09 0.56 5.04 -1.26 -5.00 117.35 118.00 2fg0 s TYR 83 Ca 0.65 0.68 0.00 0.00 -2.44 0.00 0.00 57.07 55.96 2fg0 s TYR 83 Cb -0.27 -3.96 0.02 0.00 0.35 0.00 0.00 41.96 38.10 2fg0 s TYR 83 CO 0.33 -3.44 -0.07 -0.65 -1.34 0.00 0.00 175.55 170.38 2fg0 s GLN 84 N 0.67 1.35 0.22 4.97 -1.52 -1.26 -5.11 119.66 118.98 2fg0 s GLN 84 Ca 0.68 -0.22 -0.30 0.00 -1.95 0.00 0.00 55.36 53.57 2fg0 s GLN 84 Cb -0.45 -1.35 -0.09 0.00 -0.22 0.00 0.00 33.01 30.90 2fg0 s GLN 84 CO 0.36 -0.17 1.17 0.00 -0.25 0.00 0.00 175.29 176.39 2fg0 s ALA 85 N 1.37 3.43 0.49 6.09 0.00 -1.26 -5.01 121.76 126.86 2fg0 s ALA 85 Ca -0.02 0.95 -0.18 0.00 0.00 0.00 0.00 51.96 52.70 2fg0 s ALA 85 Cb -0.14 -3.39 -0.09 0.00 0.00 0.00 0.00 23.12 19.51 2fg0 s ALA 85 CO -0.04 -0.32 0.98 0.00 0.00 0.00 0.00 175.76 176.39 2fg0 s ALA 86 N -0.47 3.02 -0.13 0.00 0.00 -1.26 -5.07 121.76 117.85 2fg0 s ALA 86 Ca 0.50 0.32 -0.02 0.00 0.00 0.00 0.00 51.96 52.76 2fg0 s ALA 86 Cb -0.33 -3.15 -0.03 0.00 0.00 0.00 0.00 23.12 19.62 2fg0 s ALA 86 CO 0.39 -0.15 -0.06 0.99 0.00 0.00 0.00 175.76 176.93 2fg0 s THR 87 N -2.39 3.74 -0.09 0.00 2.01 -1.26 -4.82 115.64 112.83 2fg0 s THR 87 Ca 0.61 -0.43 0.04 0.00 0.31 0.00 0.00 61.69 62.22 2fg0 s THR 87 Cb -0.11 -2.60 -0.00 0.00 0.01 0.00 0.00 72.50 69.81 2fg0 s THR 87 CO 0.24 0.53 -0.23 -0.36 -0.69 0.00 0.00 174.62 174.11 2fg0 s PHE 88 N 0.00 2.42 0.72 4.92 0.40 -1.26 -5.06 117.98 120.12 2fg0 s PHE 88 Ca -0.00 -0.92 -0.11 0.00 -0.60 0.00 0.00 56.93 55.30 2fg0 s PHE 88 Cb -0.13 -1.62 0.02 0.00 0.51 0.00 0.00 43.02 41.80 2fg0 s PHE 88 CO 0.03 -0.36 1.07 -1.54 0.70 0.00 0.00 175.22 175.12 2fg0 s SER 89 N 0.24 5.08 0.42 1.36 1.04 -1.26 -4.58 113.70 116.00 2fg0 s SER 89 Ca -0.15 1.68 0.12 0.00 0.48 0.00 0.00 55.95 58.09 2fg0 s SER 89 Cb -0.17 -2.50 0.91 0.00 0.10 0.00 0.00 66.02 64.36 2fg0 s SER 89 CO 0.07 -1.65 1.97 -0.08 0.98 0.00 0.00 173.24 174.54 2fg0 h GLU 90 N -0.86 0.14 0.22 4.02 4.81 -1.95 -0.79 114.58 120.17 2fg0 h GLU 90 Ca -0.44 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 58.76 2fg0 h GLU 90 Cb 1.22 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.56 2fg0 h GLU 90 CO 0.55 0.27 -0.18 1.03 -0.73 0.00 0.00 179.01 179.95 2fg0 h SER 91 N 0.14 -0.46 -0.86 1.04 0.87 -1.94 0.58 113.55 112.91 2fg0 h SER 91 Ca 0.03 0.04 0.04 0.00 -1.23 0.00 0.00 61.79 60.67 2fg0 h SER 91 Cb 0.30 0.15 -0.06 0.00 -0.44 0.00 0.00 62.40 62.36 2fg0 h SER 91 CO 0.02 -0.27 0.55 -0.33 -0.53 0.00 0.00 176.83 176.26 2fg0 h GLU 92 N -0.41 1.01 -0.25 2.24 5.08 -1.80 -2.00 114.58 118.44 2fg0 h GLU 92 Ca -0.01 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 2fg0 h GLU 92 Cb 0.37 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 2fg0 h GLU 92 CO -0.02 0.67 0.13 0.82 -1.00 0.00 0.00 179.01 179.62 2fg0 h ILE 93 N 1.04 1.13 -0.96 3.13 2.04 -0.95 -2.97 117.51 119.97 2fg0 h ILE 93 Ca 0.36 -0.35 0.09 0.00 1.00 0.00 0.00 64.86 65.96 2fg0 h ILE 93 Cb 0.07 0.90 -0.07 0.00 -0.74 0.00 0.00 36.82 36.98 2fg0 h ILE 93 CO -0.14 0.13 0.60 0.50 0.00 0.00 0.00 178.15 179.24 2fg0 h LYS 94 N 0.29 0.99 0.00 2.37 1.63 -0.26 -0.96 116.57 120.63 2fg0 h LYS 94 Ca 0.09 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 59.83 2fg0 h LYS 94 Cb 0.08 -0.22 -0.00 0.00 -0.60 0.00 0.00 32.23 31.49 2fg0 h LYS 94 CO -0.01 0.65 -0.01 0.87 -3.45 0.00 0.00 179.45 177.50 2fg0 h LYS 95 N 1.02 0.00 -0.01 1.90 1.57 -1.23 -2.90 116.57 116.92 2fg0 h LYS 95 Ca 0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.22 2fg0 h LYS 95 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2fg0 h LYS 95 CO -0.22 0.01 -0.49 1.28 -0.57 0.00 0.00 179.45 179.45 2fg0 n LEU 96 N -3.14 1.82 0.24 2.94 4.77 -0.38 -4.47 117.00 118.77 2fg0 n LEU 96 Ca -0.02 -0.73 0.08 0.00 -0.03 0.00 0.00 56.01 55.31 2fg0 n LEU 96 Cb 0.14 0.00 0.60 0.00 -2.33 0.00 0.00 43.42 41.83 2fg0 n LEU 96 CO 0.23 0.35 0.94 -0.07 -1.33 0.00 0.00 177.39 177.50 2fg0 h LEU 97 N 2.02 0.00 -0.84 2.23 3.38 -1.31 -2.06 115.31 118.73 2fg0 h LEU 97 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2fg0 h LEU 97 Cb 0.68 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.39 2fg0 h LEU 97 CO 0.00 0.15 0.40 0.00 0.09 0.00 0.00 178.44 179.09 2fg0 h ALA 98 N 1.85 1.09 -0.18 1.53 0.00 -1.80 -0.60 119.26 121.14 2fg0 h ALA 98 Ca -0.00 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 2fg0 h ALA 98 Cb 0.31 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2fg0 h ALA 98 CO 0.02 0.66 -0.35 0.93 0.00 0.00 0.00 179.25 180.50 2fg0 h GLU 99 N 1.20 0.39 -0.16 0.00 4.39 -1.70 -0.42 114.58 118.29 2fg0 h GLU 99 Ca 0.29 -0.17 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 2fg0 h GLU 99 Cb 0.12 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 2fg0 h GLU 99 CO -0.04 0.70 -0.02 0.28 -1.16 0.00 0.00 179.01 178.77 2fg0 h VAL 100 N 0.33 1.27 -0.45 3.13 2.07 -0.98 -0.80 116.25 120.83 2fg0 h VAL 100 Ca 0.04 -0.93 0.01 0.00 0.82 0.00 0.00 66.70 66.63 2fg0 h VAL 100 Cb 0.78 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 32.10 2fg0 h VAL 100 CO 0.06 0.28 0.29 0.40 0.02 0.00 0.00 177.57 178.62 2fg0 h ILE 101 N 0.01 1.11 -0.75 4.57 2.04 -1.07 -2.62 117.51 120.81 2fg0 h ILE 101 Ca 0.04 -0.21 0.03 0.00 1.00 0.00 0.00 64.86 65.73 2fg0 h ILE 101 Cb 0.43 0.46 -0.04 0.00 -0.74 0.00 0.00 36.82 36.93 2fg0 h ILE 101 CO 0.01 0.11 0.49 0.00 0.00 0.00 0.00 178.15 178.76 2fg0 h ALA 102 N 1.17 1.56 -0.62 1.87 0.00 -0.95 -1.13 119.26 121.14 2fg0 h ALA 102 Ca 0.16 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.10 2fg0 h ALA 102 Cb -0.07 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 17.41 2fg0 h ALA 102 CO -0.04 0.37 0.32 0.35 0.00 0.00 0.00 179.25 180.25 2fg0 h PHE 103 N 0.91 0.58 -0.16 0.00 3.04 -0.78 -0.26 116.94 120.28 2fg0 h PHE 103 Ca 0.30 0.02 -0.13 0.00 3.98 0.00 0.00 57.97 62.15 2fg0 h PHE 103 Cb 0.05 -0.17 -0.01 0.00 2.56 0.00 0.00 35.95 38.38 2fg0 h PHE 103 CO -0.00 0.26 -0.45 1.79 -2.02 0.00 0.00 178.31 177.89 2fg0 h THR 104 N 0.59 1.32 -0.35 4.41 1.35 -0.99 -0.69 112.91 118.55 2fg0 h THR 104 Ca 0.29 -1.63 -0.08 0.00 -0.55 0.00 0.00 66.41 64.44 2fg0 h THR 104 Cb 0.22 1.69 -0.01 0.00 -1.73 0.00 0.00 68.15 68.32 2fg0 h THR 104 CO -0.20 0.50 -0.09 1.56 -0.25 0.00 0.00 175.52 177.03 2fg0 h GLN 105 N 0.32 0.67 -0.80 4.72 4.20 -0.97 -2.93 115.11 120.32 2fg0 h GLN 105 Ca 0.02 -0.26 -0.03 0.00 0.06 0.00 0.00 58.65 58.44 2fg0 h GLN 105 Cb 0.91 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.62 2fg0 h GLN 105 CO 0.08 0.84 0.38 -0.22 -0.67 0.00 0.00 178.83 179.24 2fg0 h LYS 106 N 0.46 1.14 -1.88 1.46 3.64 -0.83 -2.86 116.57 117.71 2fg0 h LYS 106 Ca 0.09 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2fg0 h LYS 106 Cb 0.60 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 2fg0 h LYS 106 CO 0.04 0.88 0.00 0.00 -2.27 0.00 0.00 179.45 178.10 2fg0 n ALA 107 N -2.43 1.72 0.00 5.00 0.00 -0.29 -3.40 120.51 121.12 2fg0 n ALA 107 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2fg0 n ALA 107 Cb 0.14 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.38 2fg0 n ALA 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2fg0 n GLN 109 N 1.17 0.00 -3.43 0.00 1.13 -1.08 -4.76 117.38 110.41 2fg0 n GLN 109 Ca 0.00 0.00 -0.32 0.00 -1.94 0.00 0.00 57.00 54.74 2fg0 n GLN 109 Cb 0.08 0.00 -0.05 0.00 0.11 0.00 0.00 30.24 30.38 2fg0 n GLN 109 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2fg0 s GLN 110 N 0.00 3.80 0.21 -1.09 -1.52 -1.22 -5.03 119.66 114.81 2fg0 s GLN 110 Ca 0.00 0.27 -0.32 0.00 -1.95 0.00 0.00 55.36 53.36 2fg0 s GLN 110 Cb 0.00 -2.68 -0.13 0.00 -0.22 0.00 0.00 33.01 29.99 2fg0 s GLN 110 CO 0.00 0.34 1.60 0.43 -0.25 0.00 0.00 175.29 177.41 2fg0 n SER 111 N -0.06 3.45 -3.59 5.90 7.64 -1.26 -4.96 113.62 120.75 2fg0 n SER 111 Ca -0.00 1.10 -0.16 0.00 1.01 0.00 0.00 58.87 60.81 2fg0 n SER 111 Cb 0.52 -1.50 -0.07 0.00 -1.01 0.00 0.00 64.21 62.16 2fg0 n SER 111 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2fg0 s ASN 112 N 0.83 -0.51 0.24 6.43 2.20 -1.26 -4.79 114.94 118.09 2fg0 s ASN 112 Ca 0.74 0.48 0.02 0.00 -0.94 0.00 0.00 52.86 53.15 2fg0 s ASN 112 Cb -0.59 0.47 -0.05 0.00 -2.00 0.00 0.00 41.25 39.08 2fg0 s ASN 112 CO 0.40 -0.58 0.07 -0.72 -2.94 0.00 0.00 177.10 173.33 2fg0 s TYR 113 N -1.38 1.49 -0.11 1.54 -0.85 -1.26 -4.65 117.35 112.13 2fg0 s TYR 113 Ca -0.11 -1.13 -0.30 0.00 -0.52 0.00 0.00 57.07 55.02 2fg0 s TYR 113 Cb -0.01 -0.87 -0.02 0.00 0.38 0.00 0.00 41.96 41.44 2fg0 s TYR 113 CO 0.07 -0.28 1.09 -0.47 -1.52 0.00 0.00 175.55 174.44 2fg0 s TYR 114 N -3.70 3.34 -0.16 -3.49 5.04 -1.23 -3.43 117.35 113.72 2fg0 s TYR 114 Ca 0.35 1.41 -0.00 0.00 -2.44 0.00 0.00 57.07 56.38 2fg0 s TYR 114 Cb 0.07 -3.30 0.04 0.00 0.35 0.00 0.00 41.96 39.12 2fg0 s TYR 114 CO 0.12 -0.73 -0.07 -1.17 -1.34 0.00 0.00 175.55 172.36 2fg0 s LEU 115 N 2.33 1.64 0.18 6.97 2.96 -0.89 -4.95 118.68 126.91 2fg0 s LEU 115 Ca 0.51 -0.62 -0.32 0.00 -0.22 0.00 0.00 54.13 53.48 2fg0 s LEU 115 Cb -0.20 -0.96 -0.11 0.00 0.50 0.00 0.00 46.19 45.41 2fg0 s LEU 115 CO 0.18 -0.16 1.75 0.26 -1.32 0.00 0.00 176.35 177.06 2fg0 s TRP 116 N 1.60 2.69 0.00 5.38 0.23 -1.26 -0.80 118.94 126.78 2fg0 s TRP 116 Ca 0.02 0.24 0.00 0.00 -2.03 0.00 0.00 56.10 54.33 2fg0 s TRP 116 Cb -0.15 -4.15 0.00 0.00 0.03 0.00 0.00 33.47 29.21 2fg0 s TRP 116 CO -0.08 -4.45 0.00 0.41 0.96 0.00 0.00 176.95 173.79 2fg0 n GLY 117 N 4.05 0.92 3.67 0.98 0.00 -1.26 -4.72 105.19 108.83 2fg0 n GLY 117 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2fg0 n GLY 117 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fg0 s GLY 118 N -1.88 1.71 0.00 -0.02 0.00 0.02 -3.46 107.32 103.69 2fg0 s GLY 118 Ca 0.00 0.74 0.00 0.00 0.00 0.00 0.00 44.72 45.46 2fg0 s GLY 118 CO 0.00 2.64 0.00 2.41 0.00 0.00 0.00 173.10 178.15 2fg0 n THR 119 N 5.13 0.00 0.18 0.90 -1.04 -1.26 -2.28 114.28 115.91 2fg0 n THR 119 Ca 0.14 0.00 0.11 0.00 -2.04 0.00 0.00 64.05 62.26 2fg0 n THR 119 Cb 0.44 -0.02 -0.11 0.00 -1.82 0.00 0.00 70.33 68.81 2fg0 n THR 119 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2fg0 n VAL 120 N -0.39 0.12 0.00 12.58 0.24 -1.26 -4.63 118.33 124.99 2fg0 n VAL 120 Ca 0.00 -0.43 0.00 0.00 -2.04 0.00 0.00 64.34 61.87 2fg0 n VAL 120 Cb 0.02 0.07 0.00 0.00 -1.47 0.00 0.00 33.84 32.45 2fg0 n VAL 120 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2fg0 n GLY 121 N 1.28 0.67 0.01 7.63 0.00 -1.26 -4.93 105.19 108.60 2fg0 n GLY 121 Ca -0.02 -1.69 0.14 0.00 0.00 0.00 0.00 46.02 44.46 2fg0 n GLY 121 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2fg0 n PRO 122 N 0.82 0.14 -3.58 1.61 -0.04 -1.26 -5.04 135.00 127.65 2fg0 n PRO 122 Ca 0.00 -0.02 -0.39 0.00 -0.04 0.00 0.00 63.50 63.05 2fg0 n PRO 122 Cb 0.00 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 31.85 2fg0 n PRO 122 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2fg0 s ASN 123 N -2.87 5.92 0.23 3.54 0.01 -1.26 -4.62 114.94 115.88 2fg0 s ASN 123 Ca 0.18 -0.28 0.10 0.00 -0.71 0.00 0.00 52.86 52.16 2fg0 s ASN 123 Cb 0.19 -2.10 -0.04 0.00 0.41 0.00 0.00 41.25 39.71 2fg0 s ASN 123 CO 0.53 -0.15 -0.13 -0.31 -1.51 0.00 0.00 177.10 175.52 2fg0 s TYR 124 N 1.71 2.49 0.55 2.20 2.02 -1.22 -4.02 117.35 121.08 2fg0 s TYR 124 Ca 0.06 -0.28 0.07 0.00 -0.37 0.00 0.00 57.07 56.55 2fg0 s TYR 124 Cb -0.17 -1.16 0.06 0.00 -0.40 0.00 0.00 41.96 40.30 2fg0 s TYR 124 CO 0.10 0.58 0.75 0.16 -1.57 0.00 0.00 175.55 175.58 2fg0 s ASP 125 N -3.14 5.17 0.09 2.29 1.47 -0.97 -2.11 116.67 119.47 2fg0 s ASP 125 Ca 0.27 -0.56 -0.25 0.00 1.18 0.00 0.00 52.55 53.18 2fg0 s ASP 125 Cb -0.07 -0.16 -0.16 0.00 -0.34 0.00 0.00 42.92 42.20 2fg0 s ASP 125 CO 0.15 -1.23 1.71 0.00 0.68 0.00 0.00 175.17 176.48 2fg0 h SER 127 N -0.22 0.00 -0.60 0.00 4.64 -1.84 -3.01 113.55 112.51 2fg0 h SER 127 Ca -0.02 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.22 2fg0 h SER 127 Cb 0.17 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.23 2fg0 h SER 127 CO 0.03 0.39 0.07 1.23 -0.87 0.00 0.00 176.83 177.68 2fg0 h GLY 128 N 2.53 1.12 -1.73 -0.77 0.00 -1.67 -0.98 103.07 101.58 2fg0 h GLY 128 Ca -0.00 -0.76 0.00 0.00 0.00 0.00 0.00 47.33 46.56 2fg0 h GLY 128 CO 0.05 0.71 0.00 -0.10 0.00 0.00 0.00 176.54 177.20 2fg0 n LEU 129 N -4.20 0.69 0.00 3.11 7.94 -0.67 -0.73 117.00 123.13 2fg0 n LEU 129 Ca 0.04 -0.34 0.00 0.00 -1.11 0.00 0.00 56.01 54.59 2fg0 n LEU 129 Cb 0.31 -0.14 0.00 0.00 0.53 0.00 0.00 43.42 44.12 2fg0 n LEU 129 CO 0.43 0.12 0.00 1.67 -1.11 0.00 0.00 177.39 178.50 2fg0 n GLN 131 N 0.72 0.00 -0.17 1.96 7.27 -0.37 -0.97 117.38 125.83 2fg0 n GLN 131 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 57.00 57.03 2fg0 n GLN 131 Cb 0.12 0.00 0.14 0.00 2.41 0.00 0.00 30.24 32.91 2fg0 n GLN 131 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2fg0 h ALA 132 N 0.00 1.12 -0.21 1.69 0.00 -1.19 0.10 119.26 120.77 2fg0 h ALA 132 Ca 0.00 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 2fg0 h ALA 132 Cb 0.00 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 2fg0 h ALA 132 CO 0.00 0.59 -0.21 0.00 0.00 0.00 0.00 179.25 179.63 2fg0 h ALA 133 N 1.25 0.31 -0.26 0.00 0.00 -1.29 -1.26 119.26 118.01 2fg0 h ALA 133 Ca 0.19 -0.36 -0.13 0.00 0.00 0.00 0.00 54.91 54.61 2fg0 h ALA 133 Cb 0.34 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2fg0 h ALA 133 CO 0.00 0.25 -0.37 0.74 0.00 0.00 0.00 179.25 179.87 2fg0 h PHE 134 N 0.19 0.70 0.00 0.00 -1.00 -1.79 -2.83 116.94 112.21 2fg0 h PHE 134 Ca 0.03 -0.19 -0.01 0.00 2.81 0.00 0.00 57.97 60.61 2fg0 h PHE 134 Cb 0.76 -0.15 -0.00 0.00 3.61 0.00 0.00 35.95 40.16 2fg0 h PHE 134 CO 0.08 0.88 -0.06 0.00 -1.61 0.00 0.00 178.31 177.60 2fg0 h ALA 135 N 1.10 1.03 0.00 2.45 0.00 -0.16 -1.46 119.26 122.22 2fg0 h ALA 135 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2fg0 h ALA 135 Cb 0.87 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2fg0 h ALA 135 CO 0.08 0.08 0.00 0.66 0.00 0.00 0.00 179.25 180.07 2fg0 h SER 136 N 0.00 0.00 -0.21 0.00 4.64 -0.96 0.30 113.55 117.32 2fg0 h SER 136 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2fg0 h SER 136 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 2fg0 h SER 136 CO 0.01 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.30 2fg0 n VAL 137 N -2.81 0.45 -0.40 0.95 0.24 -0.71 -4.98 118.33 111.06 2fg0 n VAL 137 Ca -0.01 -0.72 0.00 0.00 -2.04 0.00 0.00 64.34 61.56 2fg0 n VAL 137 Cb 0.13 0.94 0.00 0.00 -1.47 0.00 0.00 33.84 33.44 2fg0 n VAL 137 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2fg0 n GLY 138 N 0.81 0.79 3.64 7.63 0.00 0.10 -5.05 105.19 113.11 2fg0 n GLY 138 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 2fg0 n GLY 138 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fg0 s ILE 139 N -2.03 5.25 -0.22 -0.61 1.01 -0.63 -4.92 121.20 119.05 2fg0 s ILE 139 Ca 0.00 0.46 -0.12 0.00 0.00 0.00 0.00 60.65 60.99 2fg0 s ILE 139 Cb 0.00 -3.63 -0.05 0.00 0.01 0.00 0.00 42.46 38.79 2fg0 s ILE 139 CO 0.00 0.26 0.24 0.26 0.00 0.00 0.00 174.94 175.70 2fg0 s TRP 140 N 1.46 3.35 0.17 3.97 0.52 -1.26 -2.00 118.94 125.15 2fg0 s TRP 140 Ca 0.13 0.38 0.06 0.00 0.02 0.00 0.00 56.10 56.69 2fg0 s TRP 140 Cb -0.15 -2.35 -0.04 0.00 -1.15 0.00 0.00 33.47 29.78 2fg0 s TRP 140 CO 0.08 0.06 0.07 -0.51 0.02 0.00 0.00 176.95 176.67 2fg0 s LEU 141 N 1.07 3.57 1.01 2.99 1.43 -1.26 -0.33 118.68 127.17 2fg0 s LEU 141 Ca 0.12 -0.27 -0.11 0.00 -1.03 0.00 0.00 54.13 52.84 2fg0 s LEU 141 Cb -0.14 -2.19 0.20 0.00 0.03 0.00 0.00 46.19 44.09 2fg0 s LEU 141 CO 0.05 0.07 1.08 -2.16 0.23 0.00 0.00 176.35 175.63 2fg0 s PRO 142 N -3.07 0.26 0.03 1.29 0.04 -1.26 -4.86 135.00 127.42 2fg0 s PRO 142 Ca 0.29 1.10 -0.00 0.00 0.04 0.00 0.00 61.00 62.43 2fg0 s PRO 142 Cb -0.10 -1.67 -0.26 0.00 0.04 0.00 0.00 34.50 32.51 2fg0 s PRO 142 CO 0.21 -3.01 0.96 -0.09 0.04 0.00 0.00 177.00 175.11 2fg0 h ARG 143 N -2.12 0.19 -6.11 4.56 9.65 -1.92 -3.43 114.38 115.21 2fg0 h ARG 143 Ca -0.52 -0.32 -0.57 0.00 -1.10 0.00 0.00 59.98 57.46 2fg0 h ARG 143 Cb 1.30 0.12 -0.03 0.00 -1.39 0.00 0.00 29.97 29.97 2fg0 h ARG 143 CO 0.48 1.05 -0.38 -0.51 2.80 0.00 0.00 179.97 183.41 2fg0 s ASP 144 N -6.88 6.41 0.27 -3.80 1.01 -1.26 -4.40 116.67 108.02 2fg0 s ASP 144 Ca -0.06 0.41 -0.03 0.00 0.71 0.00 0.00 52.55 53.58 2fg0 s ASP 144 Cb 0.07 -2.02 0.38 0.00 1.01 0.00 0.00 42.92 42.36 2fg0 s ASP 144 CO 0.85 0.05 1.92 0.00 0.21 0.00 0.00 175.17 178.20 2fg0 h ALA 145 N 2.58 1.37 -0.18 5.23 0.00 -1.90 -0.20 119.26 126.16 2fg0 h ALA 145 Ca -0.46 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.31 2fg0 h ALA 145 Cb 1.17 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2fg0 h ALA 145 CO 0.72 0.54 -0.29 0.10 0.00 0.00 0.00 179.25 180.31 2fg0 h TYR 146 N 1.22 0.39 -0.36 0.00 -0.00 -1.94 -1.08 116.97 115.19 2fg0 h TYR 146 Ca 0.38 -0.08 -0.17 0.00 -0.00 0.00 0.00 58.73 58.86 2fg0 h TYR 146 Cb -0.00 -0.09 -0.00 0.00 -0.00 0.00 0.00 36.73 36.63 2fg0 h TYR 146 CO -0.00 0.61 -0.42 1.96 -0.00 0.00 0.00 178.16 180.31 2fg0 h GLN 147 N 0.30 0.92 -0.61 0.10 4.20 -1.66 -2.13 115.11 116.23 2fg0 h GLN 147 Ca 0.04 -0.50 -0.02 0.00 0.06 0.00 0.00 58.65 58.23 2fg0 h GLN 147 Cb 0.68 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.45 2fg0 h GLN 147 CO 0.05 1.15 0.32 1.96 -0.67 0.00 0.00 178.83 181.64 2fg0 h GLN 148 N 0.74 0.85 -0.63 1.46 4.20 -0.64 0.58 115.11 121.68 2fg0 h GLN 148 Ca 0.05 -0.10 -0.08 0.00 0.06 0.00 0.00 58.65 58.59 2fg0 h GLN 148 Cb 1.02 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.60 2fg0 h GLN 148 CO 0.10 0.64 0.09 1.49 -0.67 0.00 0.00 178.83 180.48 2fg0 h GLU 149 N 0.86 1.05 0.00 1.46 4.81 -1.07 -1.77 114.58 119.92 2fg0 h GLU 149 Ca 0.22 -0.29 -0.06 0.00 -0.13 0.00 0.00 59.36 59.10 2fg0 h GLU 149 Cb 0.05 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 2fg0 h GLU 149 CO -0.03 0.99 -0.26 0.78 -0.73 0.00 0.00 179.01 179.75 2fg0 h GLY 150 N 0.96 0.00 1.08 1.92 0.00 -0.72 -3.27 103.07 103.05 2fg0 h GLY 150 Ca 0.19 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.26 2fg0 h GLY 150 CO 0.02 0.00 -1.57 -2.75 0.00 0.00 0.00 176.54 172.24 2fg0 h PHE 151 N 0.00 0.00 -3.86 5.60 3.57 -0.58 -3.47 116.94 118.20 2fg0 h PHE 151 Ca -0.00 0.00 -0.47 0.00 3.53 0.00 0.00 57.97 61.03 2fg0 h PHE 151 Cb 0.81 0.00 0.07 0.00 2.79 0.00 0.00 35.95 39.62 2fg0 h PHE 151 CO 0.00 0.90 0.24 0.95 -2.23 0.00 0.00 178.31 178.18 2fg0 s THR 152 N -2.68 2.83 -0.27 4.41 -4.23 -0.69 -4.83 115.64 110.18 2fg0 s THR 152 Ca -0.04 -0.08 -0.23 0.00 -1.18 0.00 0.00 61.69 60.16 2fg0 s THR 152 Cb 0.08 -3.20 -0.01 0.00 1.34 0.00 0.00 72.50 70.72 2fg0 s THR 152 CO 0.82 -0.22 0.77 -1.58 -0.54 0.00 0.00 174.62 173.87 2fg0 s GLN 153 N -5.20 4.09 0.30 3.99 2.00 -0.01 -4.82 119.66 120.01 2fg0 s GLN 153 Ca 0.58 0.72 -0.29 0.00 -2.00 0.00 0.00 55.36 54.37 2fg0 s GLN 153 Cb -0.11 -3.68 -0.11 0.00 0.80 0.00 0.00 33.01 29.92 2fg0 s GLN 153 CO 0.46 -0.55 1.48 -2.14 -0.50 0.00 0.00 175.29 174.04 2fg0 s PRO 154 N 2.80 4.19 0.27 1.67 0.02 -1.26 -0.84 135.00 141.86 2fg0 s PRO 154 Ca 0.32 2.44 0.04 0.00 0.02 0.00 0.00 61.00 63.82 2fg0 s PRO 154 Cb -0.15 -3.04 -0.06 0.00 0.02 0.00 0.00 34.50 31.27 2fg0 s PRO 154 CO 0.09 -0.48 0.03 0.96 -0.33 0.00 0.00 177.00 177.27 2fg0 s ILE 155 N -0.43 1.06 0.65 2.83 -4.36 -0.60 -4.89 121.20 115.46 2fg0 s ILE 155 Ca 0.58 -2.02 -0.11 0.00 -0.26 0.00 0.00 60.65 58.83 2fg0 s ILE 155 Cb -0.45 -2.54 -0.02 0.00 1.25 0.00 0.00 42.46 40.70 2fg0 s ILE 155 CO 0.51 -0.17 1.04 0.42 0.24 0.00 0.00 174.94 176.98 2fg0 s THR 156 N -3.40 4.43 0.31 8.37 -4.23 -1.26 -3.94 115.64 115.91 2fg0 s THR 156 Ca 0.33 0.79 -0.01 0.00 -1.18 0.00 0.00 61.69 61.61 2fg0 s THR 156 Cb 0.07 -3.73 0.25 0.00 1.34 0.00 0.00 72.50 70.43 2fg0 s THR 156 CO 0.12 -1.03 1.96 0.40 -0.54 0.00 0.00 174.62 175.53 2fg0 h ILE 157 N -0.44 1.20 0.00 2.99 1.08 -1.94 -1.22 117.51 119.18 2fg0 h ILE 157 Ca -0.44 -0.41 -0.00 0.00 -0.39 0.00 0.00 64.86 63.62 2fg0 h ILE 157 Cb 1.20 0.11 -0.00 0.00 -3.07 0.00 0.00 36.82 35.06 2fg0 h ILE 157 CO 0.61 0.21 -0.01 0.00 -0.69 0.00 0.00 178.15 178.27 2fg0 h ALA 158 N 1.49 1.84 -0.00 1.87 0.00 -2.04 -2.06 119.26 120.36 2fg0 h ALA 158 Ca 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2fg0 h ALA 158 Cb -0.08 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2fg0 h ALA 158 CO -0.06 0.02 -0.12 0.39 0.00 0.00 0.00 179.25 179.48 2fg0 n GLU 159 N -4.33 0.79 -1.69 0.00 1.02 -0.47 -4.93 120.64 111.03 2fg0 n GLU 159 Ca -0.03 -0.31 -0.44 0.00 -0.02 0.00 0.00 57.16 56.36 2fg0 n GLU 159 Cb 0.10 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.00 2fg0 n GLU 159 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2fg0 n LEU 160 N -0.84 3.45 -4.20 -4.62 4.77 -0.78 -4.96 117.00 109.82 2fg0 n LEU 160 Ca 0.15 1.12 -0.12 0.00 -0.03 0.00 0.00 56.01 57.13 2fg0 n LEU 160 Cb 0.28 -1.48 -0.10 0.00 -2.33 0.00 0.00 43.42 39.80 2fg0 n LEU 160 CO 0.23 -0.24 -0.36 0.68 -1.33 0.00 0.00 177.39 176.37 2fg0 s VAL 161 N 0.32 0.68 0.05 4.08 -7.23 -1.26 -4.99 120.40 112.06 2fg0 s VAL 161 Ca 0.71 -1.96 -0.37 0.00 -1.81 0.00 0.00 61.98 58.55 2fg0 s VAL 161 Cb -0.61 -1.87 -0.17 0.00 0.56 0.00 0.00 36.38 34.30 2fg0 s VAL 161 CO 0.45 -0.70 1.38 0.00 -0.31 0.00 0.00 175.10 175.91 2fg0 n ALA 162 N -0.13 -0.91 -0.07 1.32 0.00 -1.18 -1.41 120.51 118.14 2fg0 n ALA 162 Ca -0.10 0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.85 2fg0 n ALA 162 Cb 0.62 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.98 2fg0 n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fg0 n GLY 163 N 2.68 0.55 3.83 0.00 0.00 -0.14 -4.99 105.19 107.11 2fg0 n GLY 163 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 2fg0 n GLY 163 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2fg0 s ASP 164 N -2.61 5.57 -0.03 1.61 1.01 -0.50 -4.73 116.67 116.99 2fg0 s ASP 164 Ca 0.00 1.60 -0.08 0.00 0.71 0.00 0.00 52.55 54.79 2fg0 s ASP 164 Cb 0.00 -2.49 -0.05 0.00 1.01 0.00 0.00 42.92 41.39 2fg0 s ASP 164 CO 0.00 -1.31 0.25 -0.76 0.21 0.00 0.00 175.17 173.56 2fg0 s LEU 165 N -5.37 4.39 -0.12 1.23 1.43 0.38 -0.16 118.68 120.46 2fg0 s LEU 165 Ca 0.58 0.58 0.01 0.00 -1.03 0.00 0.00 54.13 54.27 2fg0 s LEU 165 Cb -0.14 -2.49 -0.01 0.00 0.03 0.00 0.00 46.19 43.58 2fg0 s LEU 165 CO 0.53 0.31 -0.15 -0.69 0.23 0.00 0.00 176.35 176.57 2fg0 s VAL 166 N -1.20 2.84 0.01 -1.59 1.01 0.33 -0.70 120.40 121.10 2fg0 s VAL 166 Ca 0.24 -0.74 0.05 0.00 0.00 0.00 0.00 61.98 61.52 2fg0 s VAL 166 Cb -0.13 -2.17 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 2fg0 s VAL 166 CO 0.12 0.53 -0.11 -0.36 0.00 0.00 0.00 175.10 175.28 2fg0 s PHE 167 N 0.31 2.75 0.07 5.22 0.08 0.30 -0.93 117.98 125.78 2fg0 s PHE 167 Ca -0.12 -0.13 0.03 0.00 0.12 0.00 0.00 56.93 56.83 2fg0 s PHE 167 Cb -0.16 -1.56 -0.03 0.00 -0.57 0.00 0.00 43.02 40.70 2fg0 s PHE 167 CO 0.06 0.31 -0.09 -0.06 -0.10 0.00 0.00 175.22 175.35 2fg0 s PHE 168 N -0.94 0.84 0.00 0.36 0.40 -0.31 -0.53 117.98 117.80 2fg0 s PHE 168 Ca 0.16 -0.61 0.00 0.00 -0.60 0.00 0.00 56.93 55.87 2fg0 s PHE 168 Cb -0.11 -0.49 0.00 0.00 0.51 0.00 0.00 43.02 42.94 2fg0 s PHE 168 CO 0.06 -0.07 0.00 0.41 0.70 0.00 0.00 175.22 176.32 2fg0 n GLY 169 N 0.97 -0.54 2.94 4.36 0.00 -0.04 -1.11 105.19 111.78 2fg0 n GLY 169 Ca -0.19 -0.35 -0.19 0.00 0.00 0.00 0.00 46.02 45.28 2fg0 n GLY 169 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2fg0 n THR 170 N 0.00 0.00 0.30 2.61 -1.04 -0.73 -4.71 114.28 110.71 2fg0 n THR 170 Ca 0.00 -1.04 0.15 0.00 -2.04 0.00 0.00 64.05 61.11 2fg0 n THR 170 Cb 0.00 -1.22 0.50 0.00 -1.82 0.00 0.00 70.33 67.79 2fg0 n THR 170 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 2fg0 h SER 171 N -0.75 0.00 0.20 8.00 4.64 -1.99 -3.37 113.55 120.28 2fg0 h SER 171 Ca -0.28 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.03 2fg0 h SER 171 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 2fg0 h SER 171 CO 0.26 0.00 -0.10 1.56 -0.87 0.00 0.00 176.83 177.68 2fg0 h GLN 172 N 0.00 -0.26 -3.76 4.77 7.50 -2.03 -3.49 115.11 117.86 2fg0 h GLN 172 Ca 0.00 0.02 -0.08 0.00 0.50 0.00 0.00 58.65 59.08 2fg0 h GLN 172 Cb 0.64 0.06 -0.13 0.00 0.05 0.00 0.00 27.48 28.10 2fg0 h GLN 172 CO 0.00 -0.17 -0.28 -1.59 -1.50 0.00 0.00 178.83 175.29 2fg0 s LYS 173 N -2.41 1.06 0.05 1.46 -2.85 -1.26 -5.12 119.74 110.67 2fg0 s LYS 173 Ca -0.04 -1.02 -0.30 0.00 -1.00 0.00 0.00 55.97 53.61 2fg0 s LYS 173 Cb 0.00 0.39 -0.05 0.00 -2.06 0.00 0.00 37.83 36.12 2fg0 s LYS 173 CO 0.12 -0.38 1.05 0.00 0.10 0.00 0.00 175.35 176.24 2fg0 s ALA 174 N -3.91 3.26 0.00 0.59 0.00 -1.26 -1.78 121.76 118.67 2fg0 s ALA 174 Ca 0.11 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.73 2fg0 s ALA 174 Cb 0.03 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.79 2fg0 s ALA 174 CO -0.05 -0.26 0.39 0.25 0.00 0.00 0.00 175.76 176.09 2fg0 n THR 175 N 3.58 0.00 -3.79 0.00 -2.24 -0.26 -3.42 114.28 108.15 2fg0 n THR 175 Ca 0.06 -0.43 -0.13 0.00 -2.27 0.00 0.00 64.05 61.28 2fg0 n THR 175 Cb 0.49 1.12 -0.09 0.00 -2.10 0.00 0.00 70.33 69.75 2fg0 n THR 175 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2fg0 s HIS 176 N -0.08 -0.12 -0.02 4.78 2.46 -0.87 -4.92 115.29 116.51 2fg0 s HIS 176 Ca 0.00 0.16 -0.11 0.00 0.47 0.00 0.00 55.06 55.58 2fg0 s HIS 176 Cb 0.00 0.06 0.01 0.00 -0.13 0.00 0.00 32.58 32.52 2fg0 s HIS 176 CO 0.00 -0.37 0.23 0.54 -2.47 0.00 0.00 174.74 172.67 2fg0 s VAL 177 N -1.38 0.06 0.24 0.89 0.11 -1.26 -1.16 120.40 117.90 2fg0 s VAL 177 Ca -0.14 -0.48 -0.04 0.00 -2.93 0.00 0.00 61.98 58.39 2fg0 s VAL 177 Cb -0.06 -0.49 -0.02 0.00 -1.53 0.00 0.00 36.38 34.28 2fg0 s VAL 177 CO 0.03 -0.27 0.28 -0.83 -3.33 0.00 0.00 175.10 170.99 2fg0 s GLY 178 N -1.10 1.26 -0.22 6.54 0.00 -0.10 -4.68 107.32 109.02 2fg0 s GLY 178 Ca -0.12 -1.47 -0.05 0.00 0.00 0.00 0.00 44.72 43.08 2fg0 s GLY 178 CO 0.02 -1.14 -0.01 -2.27 0.00 0.00 0.00 173.10 169.71 2fg0 s LEU 179 N -3.15 3.06 0.36 0.66 2.96 0.18 -0.51 118.68 122.25 2fg0 s LEU 179 Ca 0.33 -0.33 -0.27 0.00 -0.22 0.00 0.00 54.13 53.65 2fg0 s LEU 179 Cb 0.04 -1.79 -0.09 0.00 0.50 0.00 0.00 46.19 44.84 2fg0 s LEU 179 CO 0.13 -0.01 1.22 -0.47 -1.32 0.00 0.00 176.35 175.90 2fg0 s TYR 180 N 1.45 3.11 0.00 5.38 5.04 0.77 -0.87 117.35 132.23 2fg0 s TYR 180 Ca 0.05 1.52 0.00 0.00 -2.44 0.00 0.00 57.07 56.20 2fg0 s TYR 180 Cb -0.14 -3.50 0.00 0.00 0.35 0.00 0.00 41.96 38.67 2fg0 s TYR 180 CO -0.01 -1.46 0.00 1.28 -1.34 0.00 0.00 175.55 174.02 2fg0 n LEU 181 N 0.46 0.00 -3.60 6.97 4.77 0.33 -0.97 117.00 124.97 2fg0 n LEU 181 Ca 0.02 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.87 2fg0 n LEU 181 Cb 0.44 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.47 2fg0 n LEU 181 CO 0.54 0.00 0.59 0.00 -1.33 0.00 0.00 177.39 177.20 2fg0 s ALA 182 N -3.16 -1.87 -1.45 -1.18 0.00 -1.15 -3.09 121.76 109.86 2fg0 s ALA 182 Ca 0.00 1.73 -0.08 0.00 0.00 0.00 0.00 51.96 53.61 2fg0 s ALA 182 Cb 0.00 -0.88 0.05 0.00 0.00 0.00 0.00 23.12 22.29 2fg0 s ALA 182 CO 0.00 -0.31 0.84 -0.25 0.00 0.00 0.00 175.76 176.04 2fg0 n ASP 183 N 1.72 -3.14 0.00 0.00 8.00 -1.26 -1.17 116.55 120.70 2fg0 n ASP 183 Ca -0.14 -0.81 0.00 0.00 0.71 0.00 0.00 54.79 54.55 2fg0 n ASP 183 Cb 0.56 -3.87 0.00 0.00 -0.02 0.00 0.00 41.12 37.80 2fg0 n ASP 183 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2fg0 n GLY 184 N -1.66 2.38 3.80 0.44 0.00 -1.26 -4.91 105.19 103.98 2fg0 n GLY 184 Ca -0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.55 2fg0 n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2fg0 s TYR 185 N -2.40 3.68 0.08 1.61 2.02 -0.32 -0.23 117.35 121.79 2fg0 s TYR 185 Ca 0.00 1.51 -0.09 0.00 -0.37 0.00 0.00 57.07 58.11 2fg0 s TYR 185 Cb 0.00 -2.71 0.00 0.00 -0.40 0.00 0.00 41.96 38.85 2fg0 s TYR 185 CO 0.00 0.32 0.20 1.52 -1.57 0.00 0.00 175.55 176.02 2fg0 s TYR 186 N -1.52 0.12 -0.02 2.71 1.13 -0.35 -0.51 117.35 118.91 2fg0 s TYR 186 Ca 0.44 -0.51 0.04 0.00 -1.41 0.00 0.00 57.07 55.63 2fg0 s TYR 186 Cb -0.18 -0.04 -0.03 0.00 -1.10 0.00 0.00 41.96 40.62 2fg0 s TYR 186 CO 0.22 -0.53 -0.15 -1.50 -2.51 0.00 0.00 175.55 171.08 2fg0 s ILE 187 N -3.67 3.01 0.09 -3.49 2.07 -0.05 -1.34 121.20 117.82 2fg0 s ILE 187 Ca 0.03 -0.84 -0.25 0.00 -1.41 0.00 0.00 60.65 58.18 2fg0 s ILE 187 Cb 0.04 -2.20 0.07 0.00 0.13 0.00 0.00 42.46 40.49 2fg0 s ILE 187 CO -0.10 0.52 0.61 -1.38 -1.91 0.00 0.00 174.94 172.68 2fg0 s HIS 188 N -0.79 -0.55 -0.21 3.50 -3.43 -0.32 -0.65 115.29 112.83 2fg0 s HIS 188 Ca 0.13 0.57 -0.14 0.00 -0.80 0.00 0.00 55.06 54.81 2fg0 s HIS 188 Cb -0.11 0.48 -0.04 0.00 -1.43 0.00 0.00 32.58 31.49 2fg0 s HIS 188 CO 0.02 -0.75 0.31 0.45 -2.00 0.00 0.00 174.74 172.77 2fg0 s SER 189 N -2.21 6.32 0.09 7.38 0.15 -1.26 -0.65 113.70 123.52 2fg0 s SER 189 Ca -0.03 0.37 0.06 0.00 0.70 0.00 0.00 55.95 57.05 2fg0 s SER 189 Cb -0.01 -2.18 -0.03 0.00 -1.71 0.00 0.00 66.02 62.09 2fg0 s SER 189 CO -0.05 -0.02 -0.16 -0.94 1.20 0.00 0.00 173.24 173.27 2fg0 s SER 190 N 1.02 1.97 1.00 5.45 1.04 -0.59 -3.78 113.70 119.81 2fg0 s SER 190 Ca 0.15 -0.68 -0.13 0.00 0.48 0.00 0.00 55.95 55.77 2fg0 s SER 190 Cb -0.14 -0.08 0.19 0.00 0.10 0.00 0.00 66.02 66.09 2fg0 s SER 190 CO 0.06 -0.06 1.10 -0.83 0.98 0.00 0.00 173.24 174.50 2fg0 s GLY 191 N -1.96 1.57 0.25 7.32 0.00 -1.26 -0.57 107.32 112.66 2fg0 s GLY 191 Ca 0.03 -0.46 0.03 0.00 0.00 0.00 0.00 44.72 44.32 2fg0 s GLY 191 CO 0.03 0.17 1.61 1.70 0.00 0.00 0.00 173.10 176.61 2fg0 h LYS 192 N -1.89 0.36 0.27 2.90 3.64 -1.92 -1.21 116.57 118.71 2fg0 h LYS 192 Ca -0.54 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 58.63 2fg0 h LYS 192 Cb 1.33 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.17 2fg0 h LYS 192 CO 0.57 0.76 -0.13 -0.44 -2.27 0.00 0.00 179.45 177.95 2fg0 h ASP 193 N 0.29 -0.30 0.00 4.20 5.19 -2.00 -3.38 116.42 120.41 2fg0 h ASP 193 Ca 0.02 -0.23 -0.09 0.00 -0.62 0.00 0.00 57.03 56.11 2fg0 h ASP 193 Cb 0.95 0.08 -0.02 0.00 0.18 0.00 0.00 39.33 40.52 2fg0 h ASP 193 CO 0.08 0.16 -1.99 1.67 -3.12 0.00 0.00 179.24 176.05 2fg0 n GLN 194 N -5.04 0.71 0.00 3.56 7.27 -1.26 -5.05 117.38 117.57 2fg0 n GLN 194 Ca -0.08 -0.13 0.00 0.00 0.07 0.00 0.00 57.00 56.85 2fg0 n GLN 194 Cb 0.26 -1.46 0.00 0.00 2.41 0.00 0.00 30.24 31.45 2fg0 n GLN 194 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2fg0 n GLY 195 N 1.52 4.20 0.74 1.69 0.00 -0.50 -4.72 105.19 108.12 2fg0 n GLY 195 Ca -0.10 -1.73 0.09 0.00 0.00 0.00 0.00 46.02 44.28 2fg0 n GLY 195 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fg0 n ARG 196 N 0.00 1.60 -3.57 1.61 1.74 -1.07 -4.71 116.66 112.25 2fg0 n ARG 196 Ca 0.00 -1.65 -0.22 0.00 -0.77 0.00 0.00 57.85 55.21 2fg0 n ARG 196 Cb 0.00 -1.34 0.05 0.00 -1.02 0.00 0.00 32.46 30.14 2fg0 n ARG 196 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2fg0 n ASP 197 N 0.99 -3.69 0.00 0.55 2.03 -0.29 -4.83 116.55 111.32 2fg0 n ASP 197 Ca 0.11 -0.84 0.00 0.00 0.52 0.00 0.00 54.79 54.58 2fg0 n ASP 197 Cb 0.45 -4.21 0.00 0.00 -0.72 0.00 0.00 41.12 36.64 2fg0 n ASP 197 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2fg0 n GLY 198 N -1.50 0.96 3.74 0.27 0.00 0.26 -3.52 105.19 105.41 2fg0 n GLY 198 Ca -0.19 -1.92 -0.41 0.00 0.00 0.00 0.00 46.02 43.51 2fg0 n GLY 198 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fg0 s ILE 199 N -2.35 4.59 0.30 -0.61 1.01 -1.26 -1.54 121.20 121.34 2fg0 s ILE 199 Ca 0.00 1.88 -0.18 0.00 0.00 0.00 0.00 60.65 62.34 2fg0 s ILE 199 Cb 0.00 -4.23 0.07 0.00 0.01 0.00 0.00 42.46 38.30 2fg0 s ILE 199 CO 0.00 0.34 0.90 -0.83 0.00 0.00 0.00 174.94 175.36 2fg0 s GLY 200 N -0.07 0.27 -0.12 6.18 0.00 0.18 -4.98 107.32 108.78 2fg0 s GLY 200 Ca 0.43 -0.58 0.02 0.00 0.00 0.00 0.00 44.72 44.58 2fg0 s GLY 200 CO 0.27 0.98 -0.17 -0.42 0.00 0.00 0.00 173.10 173.75 2fg0 s ILE 201 N -2.20 2.67 0.36 0.90 1.01 -1.26 -1.18 121.20 121.50 2fg0 s ILE 201 Ca 0.19 -0.80 0.03 0.00 0.00 0.00 0.00 60.65 60.07 2fg0 s ILE 201 Cb -0.04 -2.08 -0.04 0.00 0.01 0.00 0.00 42.46 40.31 2fg0 s ILE 201 CO 0.09 0.54 0.12 -1.81 0.00 0.00 0.00 174.94 173.87 2fg0 s ASP 202 N 0.32 2.38 0.00 3.58 1.01 -0.45 -4.97 116.67 118.54 2fg0 s ASP 202 Ca -0.13 -1.57 0.03 0.00 0.71 0.00 0.00 52.55 51.59 2fg0 s ASP 202 Cb -0.17 0.32 -0.01 0.00 1.01 0.00 0.00 42.92 44.08 2fg0 s ASP 202 CO 0.07 -0.83 -0.11 -0.51 0.21 0.00 0.00 175.17 173.99 2fg0 s ILE 203 N -3.33 0.87 -1.30 0.77 2.07 -1.26 -1.21 121.20 117.81 2fg0 s ILE 203 Ca 0.30 -0.55 -0.13 0.00 -1.41 0.00 0.00 60.65 58.85 2fg0 s ILE 203 Cb 0.05 -0.75 0.13 0.00 0.13 0.00 0.00 42.46 42.02 2fg0 s ILE 203 CO 0.15 0.19 1.81 0.18 -1.91 0.00 0.00 174.94 175.35 2fg0 n LEU 204 N 2.64 6.03 -3.57 8.50 4.77 0.68 -4.69 117.00 131.36 2fg0 n LEU 204 Ca -0.15 -4.38 -0.16 0.00 -0.03 0.00 0.00 56.01 51.29 2fg0 n LEU 204 Cb 0.56 -1.60 -0.07 0.00 -2.33 0.00 0.00 43.42 39.99 2fg0 n LEU 204 CO 0.24 0.95 0.42 -0.55 -1.33 0.00 0.00 177.39 177.12 2fg0 s SER 205 N 2.40 -0.68 0.15 -1.43 0.15 -1.26 -4.92 113.70 108.10 2fg0 s SER 205 Ca 0.44 1.00 0.22 0.00 0.70 0.00 0.00 55.95 58.32 2fg0 s SER 205 Cb 0.06 0.91 0.88 0.00 -1.71 0.00 0.00 66.02 66.17 2fg0 s SER 205 CO -0.00 -0.46 1.68 -0.62 1.20 0.00 0.00 173.24 175.05 2fg0 n GLU 206 N 1.66 0.13 -0.00 5.44 1.02 -1.26 -2.50 120.64 125.12 2fg0 n GLU 206 Ca -0.17 0.28 0.13 0.00 -0.02 0.00 0.00 57.16 57.39 2fg0 n GLU 206 Cb 0.56 -1.71 0.76 0.00 -0.02 0.00 0.00 31.44 31.03 2fg0 n GLU 206 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2fg0 n GLN 207 N -1.95 1.07 -1.69 3.49 1.13 -1.26 -4.90 117.38 113.26 2fg0 n GLN 207 Ca 0.04 -0.10 -0.29 0.00 -1.94 0.00 0.00 57.00 54.70 2fg0 n GLN 207 Cb 0.26 -1.42 0.15 0.00 0.11 0.00 0.00 30.24 29.35 2fg0 n GLN 207 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2fg0 s GLY 208 N -1.84 1.65 1.16 1.08 0.00 -1.04 -5.08 107.32 103.26 2fg0 s GLY 208 Ca 0.40 -0.83 -0.20 0.00 0.00 0.00 0.00 44.72 44.09 2fg0 s GLY 208 CO 0.31 -0.18 0.96 2.09 0.00 0.00 0.00 173.10 176.29 2fg0 n ASP 209 N -3.79 -2.36 -0.28 1.64 5.68 -1.26 -4.59 116.55 111.60 2fg0 n ASP 209 Ca 0.11 -1.06 -0.04 0.00 -0.50 0.00 0.00 54.79 53.29 2fg0 n ASP 209 Cb 0.60 -0.92 0.07 0.00 -1.14 0.00 0.00 41.12 39.73 2fg0 n ASP 209 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2fg0 h ALA 210 N -2.83 0.97 0.00 2.12 0.00 -1.99 0.16 119.26 117.70 2fg0 h ALA 210 Ca -0.37 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 2fg0 h ALA 210 Cb 1.16 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2fg0 h ALA 210 CO 0.24 0.40 -0.00 0.28 0.00 0.00 0.00 179.25 180.17 2fg0 h VAL 211 N 1.04 1.09 -0.09 0.00 2.07 -1.92 -2.03 116.25 116.41 2fg0 h VAL 211 Ca 0.28 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.54 2fg0 h VAL 211 Cb -0.11 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 2fg0 h VAL 211 CO -0.06 0.07 -0.04 0.28 0.02 0.00 0.00 177.57 177.85 2fg0 h SER 212 N -0.13 -0.12 -0.43 0.57 0.02 -1.74 -2.58 113.55 109.15 2fg0 h SER 212 Ca -0.00 0.03 0.09 0.00 -0.84 0.00 0.00 61.79 61.07 2fg0 h SER 212 Cb 0.12 0.07 -0.09 0.00 0.14 0.00 0.00 62.40 62.65 2fg0 h SER 212 CO 0.00 -0.05 -0.17 -0.07 -1.14 0.00 0.00 176.83 175.41 2fg0 h LEU 213 N -0.02 -0.58 0.16 5.07 3.38 -0.60 -0.26 115.31 122.46 2fg0 h LEU 213 Ca 0.05 0.15 0.01 0.00 0.09 0.00 0.00 57.88 58.18 2fg0 h LEU 213 Cb 0.10 0.33 -0.04 0.00 0.09 0.00 0.00 40.66 41.14 2fg0 h LEU 213 CO -0.11 -0.20 -0.45 0.28 0.09 0.00 0.00 178.44 178.05 2fg0 h SER 214 N -0.08 -1.31 -0.81 -0.43 0.02 -1.11 -1.22 113.55 108.62 2fg0 h SER 214 Ca 0.21 0.14 0.03 0.00 -0.84 0.00 0.00 61.79 61.32 2fg0 h SER 214 Cb 0.39 0.48 -0.04 0.00 0.14 0.00 0.00 62.40 63.37 2fg0 h SER 214 CO -0.48 -0.52 0.54 1.88 -1.14 0.00 0.00 176.83 177.11 2fg0 h TYR 215 N -0.71 0.99 -0.72 3.45 0.05 -1.24 -2.49 116.97 116.30 2fg0 h TYR 215 Ca 0.01 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.79 2fg0 h TYR 215 Cb 0.71 -0.33 -0.03 0.00 1.01 0.00 0.00 36.73 38.09 2fg0 h TYR 215 CO -0.37 0.59 0.36 -0.92 -1.05 0.00 0.00 178.16 176.77 2fg0 h TYR 216 N 1.04 1.00 0.00 4.88 3.20 -0.31 -0.41 116.97 126.36 2fg0 h TYR 216 Ca 0.31 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.15 2fg0 h TYR 216 Cb -0.02 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 37.93 2fg0 h TYR 216 CO -0.00 0.72 0.00 1.04 -1.64 0.00 0.00 178.16 178.28 2fg0 n GLN 217 N -4.34 0.17 -0.16 1.82 6.02 -0.53 -1.95 117.38 118.41 2fg0 n GLN 217 Ca 0.07 0.51 0.08 0.00 -0.01 0.00 0.00 57.00 57.64 2fg0 n GLN 217 Cb 0.12 -1.90 0.16 0.00 1.02 0.00 0.00 30.24 29.64 2fg0 n GLN 217 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2fg0 n GLN 218 N -2.24 2.23 -1.74 -1.09 6.02 -0.20 -5.01 117.38 115.36 2fg0 n GLN 218 Ca 0.01 -1.98 -0.42 0.00 -0.01 0.00 0.00 57.00 54.60 2fg0 n GLN 218 Cb 0.15 -1.35 -0.03 0.00 1.02 0.00 0.00 30.24 30.03 2fg0 n GLN 218 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 2fg0 s LEU 219 N -1.12 4.38 -0.22 1.08 2.96 -0.82 -0.86 118.68 124.08 2fg0 s LEU 219 Ca 0.28 2.81 -0.00 0.00 -0.22 0.00 0.00 54.13 57.00 2fg0 s LEU 219 Cb 0.16 -3.59 -0.14 0.00 0.50 0.00 0.00 46.19 43.12 2fg0 s LEU 219 CO 0.21 -0.97 -0.21 0.54 -1.32 0.00 0.00 176.35 174.60 2fg0 n ARG 220 N 4.53 0.54 -3.66 1.98 1.74 0.31 -4.85 116.66 117.26 2fg0 n ARG 220 Ca 0.16 0.14 0.00 0.00 -0.77 0.00 0.00 57.85 57.38 2fg0 n ARG 220 Cb 0.36 -1.43 0.00 0.00 -1.02 0.00 0.00 32.46 30.38 2fg0 n ARG 220 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2fg0 n GLY 221 N 2.32 -0.75 3.26 -0.13 0.00 -1.06 -5.01 105.19 103.82 2fg0 n GLY 221 Ca -0.40 -0.98 -0.14 0.00 0.00 0.00 0.00 46.02 44.50 2fg0 n GLY 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fg0 s ALA 222 N -1.00 -0.85 -0.02 4.61 0.00 -1.25 -0.54 121.76 122.70 2fg0 s ALA 222 Ca 0.00 0.40 -0.05 0.00 0.00 0.00 0.00 51.96 52.30 2fg0 s ALA 222 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.19 2fg0 s ALA 222 CO 0.00 -0.27 0.12 0.20 0.00 0.00 0.00 175.76 175.81 2fg0 s GLY 223 N -1.31 -0.00 -0.15 0.00 0.00 0.12 -1.55 107.32 104.42 2fg0 s GLY 223 Ca -0.13 0.06 -0.05 0.00 0.00 0.00 0.00 44.72 44.60 2fg0 s GLY 223 CO 0.05 -0.03 0.03 -1.60 0.00 0.00 0.00 173.10 171.55 2fg0 s ARG 224 N -0.71 3.64 -0.23 2.90 3.52 -0.02 -0.47 118.95 127.59 2fg0 s ARG 224 Ca -0.08 -0.38 -0.29 0.00 -0.13 0.00 0.00 55.73 54.85 2fg0 s ARG 224 Cb -0.05 -3.05 -0.00 0.00 -1.56 0.00 0.00 34.95 30.29 2fg0 s ARG 224 CO 0.01 0.40 1.23 0.08 -0.81 0.00 0.00 175.30 176.21 2fg0 s VAL 225 N -0.03 4.31 0.00 7.11 1.01 -1.26 -0.83 120.40 130.71 2fg0 s VAL 225 Ca 0.05 1.55 0.00 0.00 0.00 0.00 0.00 61.98 63.58 2fg0 s VAL 225 Cb -0.12 -4.13 0.00 0.00 0.00 0.00 0.00 36.38 32.13 2fg0 s VAL 225 CO 0.01 -0.27 0.33 2.22 0.00 0.00 0.00 175.10 177.39 2fg0 n PHE 226 N 6.90 0.00 -3.53 5.22 -1.74 -1.26 -4.94 117.46 118.11 2fg0 n PHE 226 Ca 0.14 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.93 2fg0 n PHE 226 Cb 0.46 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.44 2fg0 n PHE 226 CO 0.00 0.00 0.00 -1.59 -0.56 0.00 0.00 176.76 174.61 2fg0 s LYS 227 N -0.22 1.28 0.19 3.97 -2.85 -1.26 -4.20 119.74 116.65 2fg0 s LYS 227 Ca 0.00 -0.54 -0.03 0.00 -1.00 0.00 0.00 55.97 54.40 2fg0 s LYS 227 Cb 0.00 0.55 -0.05 0.00 -2.06 0.00 0.00 37.83 36.27 2fg0 s LYS 227 CO 0.00 -0.57 0.40 0.45 0.10 0.00 0.00 175.35 175.74 2fg0 s SER 228 N -2.74 6.43 0.22 0.03 0.15 -1.26 -4.90 113.70 111.62 2fg0 s SER 228 Ca 0.04 0.51 -0.30 0.00 0.70 0.00 0.00 55.95 56.90 2fg0 s SER 228 Cb -0.02 -2.06 -0.10 0.00 -1.71 0.00 0.00 66.02 62.14 2fg0 s SER 228 CO -0.08 -0.02 1.45 -0.47 1.20 0.00 0.00 173.24 175.32 2fg0 s TYR 229 N -1.81 3.06 -0.24 3.44 5.04 0.55 -4.92 117.35 122.47 2fg0 s TYR 229 Ca 0.40 0.95 -0.05 0.00 -2.44 0.00 0.00 57.07 55.93 2fg0 s TYR 229 Cb -0.11 -3.82 -0.01 0.00 0.35 0.00 0.00 41.96 38.37 2fg0 s TYR 229 CO 0.27 -2.75 0.01 -1.83 -1.34 0.00 0.00 175.55 169.91 2fg0 s GLU 230 N 0.08 3.42 0.69 4.97 -1.05 -1.26 -4.83 118.70 120.71 2fg0 s GLU 230 Ca 0.62 -0.62 -0.17 0.00 -0.15 0.00 0.00 54.97 54.65 2fg0 s GLU 230 Cb -0.41 -3.16 0.00 0.00 -0.44 0.00 0.00 34.13 30.11 2fg0 s GLU 230 CO 0.39 -0.23 1.14 -2.30 0.95 0.00 0.00 175.26 175.21 2fg0 n PRO 231 N 4.85 0.77 -1.95 -4.83 -0.02 -1.26 -4.94 135.00 127.62 2fg0 n PRO 231 Ca -0.17 0.32 -0.38 0.00 -2.02 0.00 0.00 63.50 61.26 2fg0 n PRO 231 Cb 0.50 -2.38 0.03 0.00 -0.02 0.00 0.00 33.50 31.64 2fg0 n PRO 231 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 2fg0 s GLN 232 N -3.37 3.29 0.29 -0.52 -2.07 -1.26 -4.95 119.66 111.07 2fg0 s GLN 232 Ca 0.78 2.04 -0.30 0.00 -1.82 0.00 0.00 55.36 56.06 2fg0 s GLN 232 Cb -0.36 -2.25 -0.12 0.00 -1.09 0.00 0.00 33.01 29.18 2fg0 s GLN 232 CO 0.45 -1.01 1.47 2.89 -1.32 0.00 0.00 175.29 177.77 2fg0 n ARG 233 N -0.95 2.37 -0.26 9.60 1.85 -1.26 -5.13 116.66 122.87 2fg0 n ARG 233 Ca 0.10 0.84 0.00 0.00 -1.00 0.00 0.00 57.85 57.79 2fg0 n ARG 233 Cb 0.47 -2.54 0.00 0.00 -1.05 0.00 0.00 32.46 29.34 2fg0 n ARG 233 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51