#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pma s VAL 14 N 0.00 0.00 0.02 12.58 -7.23 -1.26 -4.88 120.40 119.63 1pma s VAL 14 Ca 0.00 -1.75 -0.26 0.00 -1.81 0.00 0.00 61.98 58.15 1pma s VAL 14 Cb 0.00 -2.57 -0.05 0.00 0.56 0.00 0.00 36.38 34.32 1pma s VAL 14 CO 0.00 0.00 0.81 -0.36 -0.31 0.00 0.00 175.10 175.24 1pma s PHE 15 N -3.27 3.70 0.74 2.82 0.08 -1.26 -4.35 117.98 116.43 1pma s PHE 15 Ca 0.34 1.51 -0.11 0.00 0.12 0.00 0.00 56.93 58.79 1pma s PHE 15 Cb 0.01 -2.90 0.03 0.00 -0.57 0.00 0.00 43.02 39.59 1pma s PHE 15 CO 0.22 0.17 1.08 -1.54 -0.10 0.00 0.00 175.22 175.05 1pma s SER 16 N 0.33 5.05 0.41 1.36 1.04 0.35 -4.85 113.70 117.39 1pma s SER 16 Ca 0.42 1.37 0.25 0.00 0.48 0.00 0.00 55.95 58.47 1pma s SER 16 Cb -0.20 -2.18 1.37 0.00 0.10 0.00 0.00 66.02 65.11 1pma s SER 16 CO 0.24 -1.62 1.76 -0.65 0.98 0.00 0.00 173.24 173.95 1pma h PRO 17 N -0.84 0.00 -0.26 4.02 0.11 -1.97 0.17 132.00 133.22 1pma h PRO 17 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1pma h PRO 17 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1pma h PRO 17 CO 0.60 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.99 1pma n ASP 18 N -2.42 2.82 -0.30 -2.05 5.75 -1.26 -4.95 116.55 114.14 1pma n ASP 18 Ca -0.02 -1.90 0.00 0.00 -0.01 0.00 0.00 54.79 52.86 1pma n ASP 18 Cb 0.10 -0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.03 1pma n ASP 18 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1pma n GLY 19 N 1.37 0.83 3.31 6.12 0.00 0.58 -5.09 105.19 112.32 1pma n GLY 19 Ca 0.18 -0.66 -0.23 0.00 0.00 0.00 0.00 46.02 45.30 1pma n GLY 19 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pma s ARG 20 N -4.18 1.21 -0.84 1.61 0.52 -1.25 -4.83 118.95 111.18 1pma s ARG 20 Ca 0.00 -1.28 -0.12 0.00 -0.52 0.00 0.00 55.73 53.81 1pma s ARG 20 Cb 0.00 -1.41 0.22 0.00 0.52 0.00 0.00 34.95 34.28 1pma s ARG 20 CO 0.00 0.31 0.77 -0.51 0.02 0.00 0.00 175.30 175.89 1pma s LEU 21 N -2.24 6.51 0.32 2.53 2.01 -1.26 -0.50 118.68 126.06 1pma s LEU 21 Ca 0.11 -2.85 0.08 0.00 0.01 0.00 0.00 54.13 51.48 1pma s LEU 21 Cb -0.08 -2.16 0.80 0.00 0.01 0.00 0.00 46.19 44.75 1pma s LEU 21 CO 0.05 -0.50 1.79 -0.26 1.01 0.00 0.00 176.35 178.44 1pma h PHE 22 N 7.51 0.98 -0.60 0.29 0.04 -1.99 -0.57 116.94 122.60 1pma h PHE 22 Ca 0.10 0.03 0.04 0.00 2.80 0.00 0.00 57.97 60.95 1pma h PHE 22 Cb 1.00 -0.30 -0.05 0.00 2.20 0.00 0.00 35.95 38.81 1pma h PHE 22 CO 0.96 0.23 0.34 1.96 -0.60 0.00 0.00 178.31 181.20 1pma h GLN 23 N 0.71 0.63 -0.05 1.51 1.08 -1.91 0.33 115.11 117.41 1pma h GLN 23 Ca 0.56 -0.04 -0.05 0.00 -1.45 0.00 0.00 58.65 57.67 1pma h GLN 23 Cb 0.95 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 28.23 1pma h GLN 23 CO -0.34 0.42 -0.22 -0.24 -0.95 0.00 0.00 178.83 177.49 1pma h VAL 24 N 0.65 1.18 0.38 -0.54 3.04 -1.55 -1.15 116.25 118.26 1pma h VAL 24 Ca 0.26 -0.86 -0.02 0.00 -1.01 0.00 0.00 66.70 65.08 1pma h VAL 24 Cb 0.12 1.39 0.00 0.00 -2.01 0.00 0.00 31.29 30.80 1pma h VAL 24 CO -0.15 0.25 -0.18 -0.33 -1.01 0.00 0.00 177.57 176.15 1pma h GLU 25 N 0.08 -0.50 -0.33 4.17 4.39 0.20 -2.20 114.58 120.40 1pma h GLU 25 Ca 0.01 0.03 0.09 0.00 0.34 0.00 0.00 59.36 59.83 1pma h GLU 25 Cb 0.43 0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.18 1pma h GLU 25 CO 0.03 -0.18 0.23 1.88 -1.16 0.00 0.00 179.01 179.81 1pma h TYR 26 N -0.85 0.04 0.07 4.33 0.05 -0.13 0.25 116.97 120.74 1pma h TYR 26 Ca -0.05 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.73 1pma h TYR 26 Cb 0.54 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.27 1pma h TYR 26 CO 0.02 0.02 -0.04 0.00 -1.05 0.00 0.00 178.16 177.11 1pma h ALA 27 N 1.83 -0.10 -0.98 3.88 0.00 -1.03 -2.56 119.26 120.30 1pma h ALA 27 Ca 0.16 -0.07 0.21 0.00 0.00 0.00 0.00 54.91 55.20 1pma h ALA 27 Cb 0.57 0.04 -0.11 0.00 0.00 0.00 0.00 17.79 18.28 1pma h ALA 27 CO -0.01 -0.50 0.57 0.00 0.00 0.00 0.00 179.25 179.31 1pma h ARG 28 N -0.21 0.63 -0.41 0.00 3.08 -0.31 0.60 114.38 117.76 1pma h ARG 28 Ca -0.01 -0.04 0.08 0.00 0.07 0.00 0.00 59.98 60.08 1pma h ARG 28 Cb 0.17 -0.14 -0.07 0.00 0.08 0.00 0.00 29.97 30.01 1pma h ARG 28 CO 0.02 0.42 -0.05 0.93 -1.07 0.00 0.00 179.97 180.21 1pma h GLU 29 N 0.65 0.05 -0.99 0.04 4.39 -1.11 -0.21 114.58 117.39 1pma h GLU 29 Ca 0.59 -0.00 0.13 0.00 0.34 0.00 0.00 59.36 60.42 1pma h GLU 29 Cb 1.01 -0.01 -0.08 0.00 -0.10 0.00 0.00 28.75 29.57 1pma h GLU 29 CO -0.43 0.03 0.62 0.00 -1.16 0.00 0.00 179.01 178.07 1pma h ALA 30 N 1.39 1.58 0.00 3.43 0.00 -0.79 0.49 119.26 125.36 1pma h ALA 30 Ca 0.20 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 1pma h ALA 30 Cb 0.30 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1pma h ALA 30 CO -0.38 0.17 -0.29 -0.39 0.00 0.00 0.00 179.25 178.35 1pma h VAL 31 N 0.94 0.66 0.00 0.00 -1.51 -0.87 -2.88 116.25 112.59 1pma h VAL 31 Ca 0.50 -1.35 -0.08 0.00 -1.23 0.00 0.00 66.70 64.54 1pma h VAL 31 Cb 0.55 1.89 -0.01 0.00 -2.13 0.00 0.00 31.29 31.59 1pma h VAL 31 CO -0.26 0.29 -0.37 0.11 -1.23 0.00 0.00 177.57 176.10 1pma h LYS 32 N 0.00 0.00 -0.12 5.19 1.57 -0.15 -2.00 116.57 121.05 1pma h LYS 32 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1pma h LYS 32 Cb 0.87 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.18 1pma h LYS 32 CO 0.04 0.37 0.00 1.63 -0.57 0.00 0.00 179.45 180.92 1pma n LYS 33 N -4.05 1.46 -2.17 3.15 5.02 -1.06 -3.42 118.16 117.08 1pma n LYS 33 Ca -0.02 -0.69 -0.27 0.00 -2.02 0.00 0.00 58.31 55.32 1pma n LYS 33 Cb 0.41 -1.32 0.10 0.00 -0.02 0.00 0.00 35.03 34.20 1pma n LYS 33 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1pma s GLY 34 N -1.46 1.71 1.00 0.72 0.00 -0.75 -4.88 107.32 103.65 1pma s GLY 34 Ca 0.27 -1.08 -0.12 0.00 0.00 0.00 0.00 44.72 43.80 1pma s GLY 34 CO 0.22 -0.56 1.08 -0.45 0.00 0.00 0.00 173.10 173.38 1pma s SER 35 N -4.64 2.40 -0.12 1.64 0.15 -1.26 -1.72 113.70 110.15 1pma s SER 35 Ca 0.64 1.71 -0.05 0.00 0.70 0.00 0.00 55.95 58.95 1pma s SER 35 Cb -0.08 -2.34 -0.04 0.00 -1.71 0.00 0.00 66.02 61.85 1pma s SER 35 CO 0.47 -3.35 0.08 0.28 1.20 0.00 0.00 173.24 171.92 1pma s THR 36 N -2.68 4.96 0.13 6.45 -1.32 -1.26 -3.17 115.64 118.75 1pma s THR 36 Ca 0.66 0.00 -0.16 0.00 -1.21 0.00 0.00 61.69 60.98 1pma s THR 36 Cb -0.22 -3.15 0.04 0.00 -1.51 0.00 0.00 72.50 67.66 1pma s THR 36 CO 0.60 0.58 0.41 0.00 -2.21 0.00 0.00 174.62 174.01 1pma s ALA 37 N -0.71 -0.94 0.31 11.08 0.00 -0.48 -0.46 121.76 130.55 1pma s ALA 37 Ca 0.12 -0.05 -0.15 0.00 0.00 0.00 0.00 51.96 51.89 1pma s ALA 37 Cb -0.12 0.71 0.02 0.00 0.00 0.00 0.00 23.12 23.73 1pma s ALA 37 CO 0.03 -0.66 0.64 -0.48 0.00 0.00 0.00 175.76 175.29 1pma s LEU 38 N -2.81 0.16 0.01 0.00 2.34 0.11 0.18 118.68 118.67 1pma s LEU 38 Ca 0.03 -0.97 -0.28 0.00 0.06 0.00 0.00 54.13 52.97 1pma s LEU 38 Cb 0.02 2.32 0.09 0.00 -0.56 0.00 0.00 46.19 48.05 1pma s LEU 38 CO -0.11 -1.38 0.76 -0.83 -1.06 0.00 0.00 176.35 173.72 1pma s GLY 39 N -3.03 -0.52 -0.12 -3.48 0.00 -0.47 -0.53 107.32 99.17 1pma s GLY 39 Ca 0.18 1.09 -0.20 0.00 0.00 0.00 0.00 44.72 45.79 1pma s GLY 39 CO 0.11 0.56 0.51 -3.16 0.00 0.00 0.00 173.10 171.12 1pma s MET 40 N -2.47 0.73 0.37 2.90 0.23 -1.08 -1.66 119.30 118.32 1pma s MET 40 Ca -0.02 0.40 -0.25 0.00 -1.03 0.00 0.00 55.69 54.79 1pma s MET 40 Cb -0.01 0.35 -0.09 0.00 -1.53 0.00 0.00 34.83 33.55 1pma s MET 40 CO -0.03 -0.16 1.04 0.15 -2.03 0.00 0.00 175.02 173.99 1pma s LYS 41 N -0.45 4.31 0.00 3.16 1.02 -0.30 -2.64 119.74 124.85 1pma s LYS 41 Ca -0.06 1.54 0.00 0.00 0.02 0.00 0.00 55.97 57.47 1pma s LYS 41 Cb -0.03 -2.70 0.00 0.00 -0.52 0.00 0.00 37.83 34.58 1pma s LYS 41 CO 0.04 -0.02 0.00 1.97 -0.92 0.00 0.00 175.35 176.42 1pma n PHE 42 N 0.25 0.00 0.00 3.18 1.16 -0.33 -4.84 117.46 116.87 1pma n PHE 42 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.61 1pma n PHE 42 Cb 0.49 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.36 1pma n PHE 42 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1pma n ALA 43 N -3.00 0.00 -2.73 1.98 0.00 -0.21 -3.81 120.51 112.74 1pma n ALA 43 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1pma n ALA 43 Cb 0.00 0.05 0.04 0.00 0.00 0.00 0.00 19.45 19.54 1pma n ALA 43 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1pma n ASN 44 N -0.63 1.25 -0.49 0.00 4.05 -1.26 -4.98 115.26 113.19 1pma n ASN 44 Ca 0.00 -2.02 0.00 0.00 0.45 0.00 0.00 54.58 53.01 1pma n ASN 44 Cb 0.00 -0.37 0.00 0.00 1.23 0.00 0.00 39.78 40.64 1pma n ASN 44 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1pma n GLY 45 N -0.35 1.35 3.16 8.20 0.00 -1.25 0.10 105.19 116.40 1pma n GLY 45 Ca 0.05 -0.77 -0.12 0.00 0.00 0.00 0.00 46.02 45.18 1pma n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pma s VAL 46 N -2.41 0.07 0.32 1.61 0.11 0.26 -1.19 120.40 119.18 1pma s VAL 46 Ca 0.00 -0.58 0.07 0.00 -2.93 0.00 0.00 61.98 58.54 1pma s VAL 46 Cb 0.00 -0.50 -0.06 0.00 -1.53 0.00 0.00 36.38 34.29 1pma s VAL 46 CO 0.00 -0.32 -0.03 -1.48 -3.33 0.00 0.00 175.10 169.94 1pma s LEU 47 N -1.30 2.53 0.01 2.54 2.34 -1.08 -0.93 118.68 122.78 1pma s LEU 47 Ca -0.14 -1.26 0.03 0.00 0.06 0.00 0.00 54.13 52.83 1pma s LEU 47 Cb -0.06 -0.70 -0.01 0.00 -0.56 0.00 0.00 46.19 44.86 1pma s LEU 47 CO 0.03 -0.39 -0.10 -0.22 -1.06 0.00 0.00 176.35 174.61 1pma s LEU 48 N -3.52 2.06 -0.17 1.48 2.96 0.31 -2.63 118.68 119.17 1pma s LEU 48 Ca 0.32 -0.25 -0.08 0.00 -0.22 0.00 0.00 54.13 53.90 1pma s LEU 48 Cb 0.05 -0.47 0.06 0.00 0.50 0.00 0.00 46.19 46.34 1pma s LEU 48 CO 0.14 0.07 0.39 -0.51 -1.32 0.00 0.00 176.35 175.13 1pma s ILE 49 N -0.42 -0.15 0.13 6.68 1.10 0.31 -0.52 121.20 128.33 1pma s ILE 49 Ca 0.02 0.12 0.06 0.00 -0.51 0.00 0.00 60.65 60.34 1pma s ILE 49 Cb -0.05 -0.60 -0.04 0.00 0.15 0.00 0.00 42.46 41.93 1pma s ILE 49 CO -0.00 0.05 -0.14 -0.55 -2.11 0.00 0.00 174.94 172.19 1pma s SER 50 N 1.64 2.04 -0.44 4.50 0.15 0.11 0.09 113.70 121.78 1pma s SER 50 Ca -0.08 -0.85 -0.23 0.00 0.70 0.00 0.00 55.95 55.49 1pma s SER 50 Cb -0.09 -0.07 0.02 0.00 -1.71 0.00 0.00 66.02 64.17 1pma s SER 50 CO -0.12 -0.16 0.80 -0.62 1.20 0.00 0.00 173.24 174.34 1pma s ASP 51 N -2.59 6.44 -0.89 5.45 2.15 0.39 -1.06 116.67 126.56 1pma s ASP 51 Ca 0.11 -0.01 -0.17 0.00 0.43 0.00 0.00 52.55 52.91 1pma s ASP 51 Cb -0.04 -2.40 0.15 0.00 -0.30 0.00 0.00 42.92 40.34 1pma s ASP 51 CO 0.03 -0.90 1.01 -0.75 -0.17 0.00 0.00 175.17 174.39 1pma s LYS 52 N 3.32 3.58 -0.37 4.34 2.20 -1.16 -4.64 119.74 127.02 1pma s LYS 52 Ca 0.31 -1.93 -0.19 0.00 -0.36 0.00 0.00 55.97 53.80 1pma s LYS 52 Cb -0.12 -4.75 0.00 0.00 -1.51 0.00 0.00 37.83 31.45 1pma s LYS 52 CO 0.22 -1.63 0.56 0.15 -0.36 0.00 0.00 175.35 174.29 1pma s LYS 53 N 1.99 3.57 0.15 4.03 1.02 -1.26 -3.87 119.74 125.38 1pma s LYS 53 Ca 0.28 -0.15 0.05 0.00 0.02 0.00 0.00 55.97 56.16 1pma s LYS 53 Cb -0.07 -3.83 -0.04 0.00 -0.52 0.00 0.00 37.83 33.37 1pma s LYS 53 CO -0.09 -0.72 0.14 0.54 -0.92 0.00 0.00 175.35 174.30 1pma s VAL 54 N 2.52 4.56 0.00 3.17 0.11 -1.26 -5.09 120.40 124.41 1pma s VAL 54 Ca 0.20 -1.02 0.00 0.00 -2.93 0.00 0.00 61.98 58.24 1pma s VAL 54 Cb -0.15 -3.32 0.00 0.00 -1.53 0.00 0.00 36.38 31.38 1pma s VAL 54 CO 0.14 -0.08 0.00 -1.14 -3.33 0.00 0.00 175.10 170.69 1pma n ARG 55 N -0.28 0.00 -1.31 1.54 3.00 -1.26 -5.08 116.66 113.26 1pma n ARG 55 Ca -0.08 0.00 -0.32 0.00 -0.00 0.00 0.00 57.85 57.45 1pma n ARG 55 Cb 0.54 0.00 0.09 0.00 0.00 0.00 0.00 32.46 33.10 1pma n ARG 55 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1pma s SER 56 N -0.35 4.33 0.23 6.15 0.15 -1.26 -4.93 113.70 118.02 1pma s SER 56 Ca 0.00 2.01 0.08 0.00 0.70 0.00 0.00 55.95 58.74 1pma s SER 56 Cb 0.00 -2.55 0.22 0.00 -1.71 0.00 0.00 66.02 61.98 1pma s SER 56 CO 0.00 -2.16 1.53 0.03 1.20 0.00 0.00 173.24 173.84 1pma h ARG 57 N -0.85 0.07 0.00 5.44 3.08 -2.07 -3.18 114.38 116.87 1pma h ARG 57 Ca -0.45 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.55 1pma h ARG 57 Cb 1.25 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.31 1pma h ARG 57 CO 0.50 0.74 0.00 1.28 -1.07 0.00 0.00 179.97 181.42 1pma n LEU 58 N -3.74 0.00 -4.84 3.04 4.32 -1.26 -4.75 117.00 109.77 1pma n LEU 58 Ca -0.02 0.15 -0.34 0.00 -0.02 0.00 0.00 56.01 55.79 1pma n LEU 58 Cb 0.68 -0.15 -0.06 0.00 -1.62 0.00 0.00 43.42 42.27 1pma n LEU 58 CO 0.44 -0.10 0.45 -0.63 -1.22 0.00 0.00 177.39 176.32 1pma s ILE 59 N -2.30 4.61 -0.48 -0.08 -1.09 -1.20 -4.95 121.20 115.71 1pma s ILE 59 Ca 0.12 1.11 -0.07 0.00 -2.23 0.00 0.00 60.65 59.58 1pma s ILE 59 Cb 0.07 -3.68 -0.19 0.00 -1.58 0.00 0.00 42.46 37.07 1pma s ILE 59 CO 0.13 -0.09 3.36 -0.62 -1.23 0.00 0.00 174.94 176.50 1pma n GLU 60 N -0.09 2.53 0.00 2.79 -0.58 -1.26 -4.95 120.64 119.08 1pma n GLU 60 Ca 0.02 -1.47 0.00 0.00 -0.42 0.00 0.00 57.16 55.29 1pma n GLU 60 Cb 0.53 -2.23 0.00 0.00 -0.57 0.00 0.00 31.44 29.17 1pma n GLU 60 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1pma n GLN 61 N 2.62 0.00 -0.24 3.49 -0.00 -1.26 -1.21 117.38 120.78 1pma n GLN 61 Ca 0.53 0.00 0.21 0.00 -0.00 0.00 0.00 57.00 57.74 1pma n GLN 61 Cb 0.70 0.00 0.37 0.00 -0.00 0.00 0.00 30.24 31.31 1pma n GLN 61 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 1pma n ASN 62 N 0.66 0.15 0.30 2.61 2.85 -1.26 -0.82 115.26 119.75 1pma n ASN 62 Ca 0.00 0.86 0.11 0.00 -0.11 0.00 0.00 54.58 55.44 1pma n ASN 62 Cb 0.00 -0.42 0.50 0.00 1.24 0.00 0.00 39.78 41.10 1pma n ASN 62 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 1pma h SER 63 N 0.00 0.00 -1.63 1.20 0.02 -1.58 -1.99 113.55 109.57 1pma h SER 63 Ca 0.50 0.00 -0.74 0.00 -0.84 0.00 0.00 61.79 60.71 1pma h SER 63 Cb 1.49 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 63.84 1pma h SER 63 CO -0.34 0.00 1.52 0.00 -1.14 0.00 0.00 176.83 176.87 1pma n ILE 64 N -2.81 5.16 -2.24 3.27 3.06 -0.00 -4.99 119.36 120.80 1pma n ILE 64 Ca 0.00 -4.76 -0.42 0.00 -2.50 0.00 0.00 62.75 55.07 1pma n ILE 64 Cb 0.67 -1.73 -0.03 0.00 0.54 0.00 0.00 39.64 39.09 1pma n ILE 64 CO 0.00 0.00 0.00 -1.61 -2.50 0.00 0.00 176.55 172.44 1pma s GLU 65 N -2.70 4.31 -0.18 9.51 0.41 -0.75 -4.91 118.70 124.39 1pma s GLU 65 Ca 0.49 1.96 0.13 0.00 -0.41 0.00 0.00 54.97 57.14 1pma s GLU 65 Cb 0.24 -3.48 -0.23 0.00 -1.78 0.00 0.00 34.13 28.88 1pma s GLU 65 CO -0.16 -0.51 0.12 1.63 -0.49 0.00 0.00 175.26 175.85 1pma n LYS 66 N 4.91 0.68 -3.12 1.61 5.02 -1.26 -4.83 118.16 121.17 1pma n LYS 66 Ca 0.12 0.08 -0.41 0.00 -2.02 0.00 0.00 58.31 56.08 1pma n LYS 66 Cb 0.44 -1.57 -0.07 0.00 -0.02 0.00 0.00 35.03 33.81 1pma n LYS 66 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1pma s ILE 67 N -2.52 4.94 -0.02 -0.18 1.01 -1.26 -3.98 121.20 119.19 1pma s ILE 67 Ca -0.15 0.85 0.08 0.00 0.00 0.00 0.00 60.65 61.43 1pma s ILE 67 Cb 0.07 -4.00 -0.02 0.00 0.01 0.00 0.00 42.46 38.52 1pma s ILE 67 CO 0.78 -0.14 -0.25 -1.10 0.00 0.00 0.00 174.94 174.23 1pma s GLN 68 N 2.61 2.06 0.12 2.79 -0.21 0.14 -4.99 119.66 122.17 1pma s GLN 68 Ca 0.25 -0.89 -0.23 0.00 0.02 0.00 0.00 55.36 54.51 1pma s GLN 68 Cb -0.15 -1.97 -0.07 0.00 1.00 0.00 0.00 33.01 31.82 1pma s GLN 68 CO 0.12 0.53 0.70 -0.51 -2.12 0.00 0.00 175.29 174.01 1pma s LEU 69 N -0.56 4.55 -0.07 2.90 1.43 -1.26 -0.45 118.68 125.23 1pma s LEU 69 Ca 0.09 1.48 0.19 0.00 -1.03 0.00 0.00 54.13 54.86 1pma s LEU 69 Cb -0.10 -3.15 -0.28 0.00 0.03 0.00 0.00 46.19 42.69 1pma s LEU 69 CO -0.01 0.20 0.33 -0.38 0.23 0.00 0.00 176.35 176.73 1pma n ILE 70 N 1.83 0.33 -3.62 -0.59 5.41 0.18 -4.94 119.36 117.96 1pma n ILE 70 Ca -0.07 -0.53 -0.03 0.00 1.00 0.00 0.00 62.75 63.12 1pma n ILE 70 Cb 0.50 -0.10 -0.03 0.00 -0.71 0.00 0.00 39.64 39.30 1pma n ILE 70 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1pma s ASP 71 N -4.50 -0.09 0.60 4.38 2.15 -0.97 -4.79 116.67 113.45 1pma s ASP 71 Ca -0.08 0.05 0.31 0.00 0.43 0.00 0.00 52.55 53.26 1pma s ASP 71 Cb 0.11 0.08 1.14 0.00 -0.30 0.00 0.00 42.92 43.95 1pma s ASP 71 CO 0.79 -0.12 1.45 0.44 -0.17 0.00 0.00 175.17 177.56 1pma h ASP 72 N 2.07 0.00 -0.09 -0.34 3.32 -2.00 0.75 116.42 120.13 1pma h ASP 72 Ca -0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.97 1pma h ASP 72 Cb 1.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.71 1pma h ASP 72 CO 0.22 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.52 1pma n TYR 73 N -3.43 0.10 -3.72 4.55 4.02 -1.26 -1.82 117.16 115.59 1pma n TYR 73 Ca 0.24 -0.10 -0.12 0.00 -0.01 0.00 0.00 57.90 57.91 1pma n TYR 73 Cb 1.46 -0.01 -0.12 0.00 -0.02 0.00 0.00 39.34 40.66 1pma n TYR 73 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1pma s VAL 74 N -0.96 -0.02 0.37 -0.72 0.11 0.26 -2.71 120.40 116.71 1pma s VAL 74 Ca 0.16 0.09 0.04 0.00 -2.93 0.00 0.00 61.98 59.33 1pma s VAL 74 Cb 0.10 -0.50 -0.04 0.00 -1.53 0.00 0.00 36.38 34.41 1pma s VAL 74 CO 0.15 0.04 0.11 0.00 -3.33 0.00 0.00 175.10 172.07 1pma s ALA 75 N 1.08 2.59 -0.05 1.54 0.00 -0.66 -0.64 121.76 125.61 1pma s ALA 75 Ca -0.07 -1.54 -0.19 0.00 0.00 0.00 0.00 51.96 50.16 1pma s ALA 75 Cb -0.08 0.80 0.04 0.00 0.00 0.00 0.00 23.12 23.88 1pma s ALA 75 CO -0.08 -0.36 0.42 0.00 0.00 0.00 0.00 175.76 175.74 1pma s ALA 76 N -3.32 -1.08 0.02 0.00 0.00 0.41 -1.65 121.76 116.14 1pma s ALA 76 Ca 0.29 0.75 0.06 0.00 0.00 0.00 0.00 51.96 53.06 1pma s ALA 76 Cb 0.05 -0.11 -0.02 0.00 0.00 0.00 0.00 23.12 23.04 1pma s ALA 76 CO 0.15 -0.28 -0.16 0.54 0.00 0.00 0.00 175.76 176.01 1pma s VAL 77 N -0.97 1.31 0.23 0.00 0.11 -0.63 -0.69 120.40 119.76 1pma s VAL 77 Ca -0.10 -0.93 0.04 0.00 -2.93 0.00 0.00 61.98 58.05 1pma s VAL 77 Cb -0.04 -1.14 -0.05 0.00 -1.53 0.00 0.00 36.38 33.62 1pma s VAL 77 CO 0.05 0.19 -0.02 0.28 -3.33 0.00 0.00 175.10 172.27 1pma s THR 78 N -0.66 1.09 -0.18 5.04 -1.32 -1.26 -0.99 115.64 117.35 1pma s THR 78 Ca 0.05 -2.04 -0.17 0.00 -1.21 0.00 0.00 61.69 58.31 1pma s THR 78 Cb -0.07 -2.30 0.05 0.00 -1.51 0.00 0.00 72.50 68.66 1pma s THR 78 CO 0.01 -0.37 0.50 -0.55 -2.21 0.00 0.00 174.62 172.00 1pma s SER 79 N -3.30 -0.52 0.00 8.08 0.15 0.44 -4.88 113.70 113.67 1pma s SER 79 Ca 0.27 0.99 0.00 0.00 0.70 0.00 0.00 55.95 57.91 1pma s SER 79 Cb 0.05 1.00 0.00 0.00 -1.71 0.00 0.00 66.02 65.36 1pma s SER 79 CO 0.08 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 174.95 1pma n GLY 80 N 2.76 0.29 3.64 9.45 0.00 -1.26 -0.46 105.19 119.60 1pma n GLY 80 Ca -0.14 -1.59 -0.43 0.00 0.00 0.00 0.00 46.02 43.87 1pma n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pma s LEU 81 N 0.00 4.07 0.15 0.99 2.01 0.50 -4.84 118.68 121.55 1pma s LEU 81 Ca 0.00 2.03 -0.19 0.00 0.01 0.00 0.00 54.13 55.98 1pma s LEU 81 Cb 0.00 -3.53 0.04 0.00 0.01 0.00 0.00 46.19 42.71 1pma s LEU 81 CO 0.00 -1.21 1.67 1.62 1.01 0.00 0.00 176.35 179.44 1pma h VAL 82 N 6.00 0.61 -0.02 -1.59 3.04 -1.95 -1.77 116.25 120.56 1pma h VAL 82 Ca -0.39 0.00 0.02 0.00 -1.01 0.00 0.00 66.70 65.32 1pma h VAL 82 Cb 1.19 0.61 -0.02 0.00 -2.01 0.00 0.00 31.29 31.05 1pma h VAL 82 CO 0.97 0.00 -0.10 0.00 -1.01 0.00 0.00 177.57 177.43 1pma h ALA 83 N 1.19 -0.09 -0.76 3.17 0.00 -1.99 -0.97 119.26 119.81 1pma h ALA 83 Ca 0.15 0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.13 1pma h ALA 83 Cb 0.29 0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 1pma h ALA 83 CO -0.34 -0.58 0.50 -0.44 0.00 0.00 0.00 179.25 178.38 1pma h ASP 84 N -0.16 0.75 0.42 0.00 5.19 -1.91 -1.82 116.42 118.89 1pma h ASP 84 Ca 0.05 -0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.43 1pma h ASP 84 Cb 0.22 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 39.57 1pma h ASP 84 CO -0.12 0.50 -0.20 0.00 -3.12 0.00 0.00 179.24 176.30 1pma h ALA 85 N 1.57 -0.56 -0.16 3.45 0.00 -0.90 -1.77 119.26 120.89 1pma h ALA 85 Ca 0.32 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.08 1pma h ALA 85 Cb 0.15 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1pma h ALA 85 CO -0.10 -0.72 -0.29 -0.09 0.00 0.00 0.00 179.25 178.05 1pma h ARG 86 N -0.76 -0.24 -0.95 0.00 2.43 -0.55 0.30 114.38 114.60 1pma h ARG 86 Ca -0.06 0.02 0.14 0.00 -0.81 0.00 0.00 59.98 59.27 1pma h ARG 86 Cb 0.53 0.05 -0.09 0.00 -0.42 0.00 0.00 29.97 30.04 1pma h ARG 86 CO 0.09 -0.16 0.57 -0.24 -1.51 0.00 0.00 179.97 178.72 1pma h VAL 87 N -0.25 0.82 -0.85 0.20 3.04 -1.44 0.12 116.25 117.88 1pma h VAL 87 Ca 0.03 -0.28 -0.02 0.00 -1.01 0.00 0.00 66.70 65.42 1pma h VAL 87 Cb 0.33 -0.08 -0.04 0.00 -2.01 0.00 0.00 31.29 29.49 1pma h VAL 87 CO -0.29 0.15 0.46 0.25 -1.01 0.00 0.00 177.57 177.14 1pma h LEU 88 N 0.83 1.06 -0.05 3.16 5.85 -0.15 -1.37 115.31 124.64 1pma h LEU 88 Ca 0.50 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 59.12 1pma h LEU 88 Cb 0.63 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.39 1pma h LEU 88 CO -0.32 0.85 0.02 0.58 -0.34 0.00 0.00 178.44 179.24 1pma h VAL 89 N 1.18 1.11 -0.84 1.05 2.07 0.20 -1.81 116.25 119.21 1pma h VAL 89 Ca 0.30 -0.34 0.09 0.00 0.82 0.00 0.00 66.70 67.57 1pma h VAL 89 Cb 0.03 1.25 -0.06 0.00 -1.52 0.00 0.00 31.29 30.99 1pma h VAL 89 CO -0.05 0.09 0.55 0.44 0.02 0.00 0.00 177.57 178.62 1pma h ASP 90 N -0.06 0.74 0.28 0.57 3.32 -0.59 -0.30 116.42 120.39 1pma h ASP 90 Ca 0.02 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1pma h ASP 90 Cb 0.13 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.54 1pma h ASP 90 CO -0.00 0.45 -0.17 0.15 -1.72 0.00 0.00 179.24 177.94 1pma h PHE 91 N 0.83 -0.45 -0.58 4.55 3.57 -0.76 -1.28 116.94 122.82 1pma h PHE 91 Ca 0.39 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.99 1pma h PHE 91 Cb 0.40 0.16 -0.09 0.00 2.79 0.00 0.00 35.95 39.21 1pma h PHE 91 CO -0.00 -0.27 0.09 0.00 -2.23 0.00 0.00 178.31 175.90 1pma h ALA 92 N 0.26 0.65 -0.03 2.41 0.00 -0.43 0.85 119.26 122.97 1pma h ALA 92 Ca -0.03 0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1pma h ALA 92 Cb 0.37 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 1pma h ALA 92 CO 0.03 -0.33 -0.43 0.00 0.00 0.00 0.00 179.25 178.52 1pma h ARG 93 N 0.22 -0.54 -0.54 0.00 3.08 -0.48 0.40 114.38 116.51 1pma h ARG 93 Ca 0.30 0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.35 1pma h ARG 93 Cb 0.45 0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.60 1pma h ARG 93 CO -0.41 -0.36 0.18 -0.84 -1.07 0.00 0.00 179.97 177.47 1pma h ILE 94 N -0.56 1.23 -0.97 2.04 3.07 -0.86 -2.00 117.51 119.47 1pma h ILE 94 Ca 0.05 -0.76 0.14 0.00 1.55 0.00 0.00 64.86 65.83 1pma h ILE 94 Cb 0.65 0.71 -0.08 0.00 -0.27 0.00 0.00 36.82 37.83 1pma h ILE 94 CO -0.34 0.29 0.61 -1.28 -1.05 0.00 0.00 178.15 176.37 1pma h SER 95 N 0.74 0.82 -0.08 2.16 0.87 -0.04 0.24 113.55 118.26 1pma h SER 95 Ca 0.18 0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.78 1pma h SER 95 Cb 0.26 -0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 62.11 1pma h SER 95 CO -0.01 0.41 0.02 0.00 -0.53 0.00 0.00 176.83 176.72 1pma h ALA 96 N 1.57 0.11 -0.75 6.23 0.00 0.24 -2.93 119.26 123.73 1pma h ALA 96 Ca 0.49 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 55.35 1pma h ALA 96 Cb 0.62 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.31 1pma h ALA 96 CO -0.26 -0.26 0.40 1.96 0.00 0.00 0.00 179.25 181.10 1pma h GLN 97 N -0.08 0.66 0.05 0.00 1.08 0.09 -2.40 115.11 114.50 1pma h GLN 97 Ca 0.03 -0.04 0.03 0.00 -1.45 0.00 0.00 58.65 57.21 1pma h GLN 97 Cb 0.26 -0.15 -0.05 0.00 -0.05 0.00 0.00 27.48 27.49 1pma h GLN 97 CO 0.00 0.44 -0.40 1.96 -0.95 0.00 0.00 178.83 179.88 1pma h GLN 98 N 0.68 -0.56 -0.90 1.46 4.20 -0.84 0.77 115.11 119.92 1pma h GLN 98 Ca 0.36 0.04 0.12 0.00 0.06 0.00 0.00 58.65 59.23 1pma h GLN 98 Cb 0.35 0.13 -0.07 0.00 0.30 0.00 0.00 27.48 28.19 1pma h GLN 98 CO -0.25 -0.37 0.58 1.49 -0.67 0.00 0.00 178.83 179.61 1pma h GLU 99 N -0.58 0.81 -0.09 1.46 4.81 -1.28 -0.79 114.58 118.92 1pma h GLU 99 Ca 0.04 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1pma h GLU 99 Cb 0.64 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.84 1pma h GLU 99 CO -0.28 0.54 0.03 0.87 -0.73 0.00 0.00 179.01 179.44 1pma h LYS 100 N 0.83 0.13 0.00 1.92 1.57 -0.81 -1.11 116.57 119.10 1pma h LYS 100 Ca 0.44 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 59.18 1pma h LYS 100 Cb 0.52 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.81 1pma h LYS 100 CO -0.20 0.24 -0.04 -0.24 -0.57 0.00 0.00 179.45 178.64 1pma h VAL 101 N -0.02 0.10 0.00 0.50 3.04 0.34 0.29 116.25 120.51 1pma h VAL 101 Ca 0.03 -0.64 -0.23 0.00 -1.01 0.00 0.00 66.70 64.84 1pma h VAL 101 Cb 0.16 1.58 -0.03 0.00 -2.01 0.00 0.00 31.29 30.99 1pma h VAL 101 CO -0.00 0.04 -1.35 1.07 -1.01 0.00 0.00 177.57 176.32 1pma n THR 102 N -3.15 1.52 0.56 3.17 5.66 -0.42 -4.50 114.28 117.11 1pma n THR 102 Ca 0.01 -0.04 0.12 0.00 -3.05 0.00 0.00 64.05 61.08 1pma n THR 102 Cb 0.34 -2.06 0.15 0.00 -1.55 0.00 0.00 70.33 67.20 1pma n THR 102 CO 0.00 0.00 0.00 1.88 -3.05 0.00 0.00 175.07 173.90 1pma h TYR 103 N -1.00 0.00 0.00 1.09 0.05 -1.30 -3.48 116.97 112.33 1pma h TYR 103 Ca -0.35 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.43 1pma h TYR 103 Cb 1.26 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.00 1pma h TYR 103 CO 0.03 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.55 1pma n GLY 104 N 1.34 1.35 3.64 3.88 0.00 1.00 -5.00 105.19 111.39 1pma n GLY 104 Ca 0.03 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.96 1pma n GLY 104 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1pma s SER 105 N -2.98 -0.43 -1.14 1.61 0.15 -1.20 -4.89 113.70 104.82 1pma s SER 105 Ca 0.00 0.83 -0.18 0.00 0.70 0.00 0.00 55.95 57.29 1pma s SER 105 Cb 0.00 0.86 0.10 0.00 -1.71 0.00 0.00 66.02 65.27 1pma s SER 105 CO 0.00 -0.14 1.49 -0.22 1.20 0.00 0.00 173.24 175.56 1pma s LEU 106 N 0.28 4.27 0.03 3.45 2.96 -1.26 -4.65 118.68 123.76 1pma s LEU 106 Ca 0.03 -2.27 -0.27 0.00 -0.22 0.00 0.00 54.13 51.40 1pma s LEU 106 Cb -0.05 -2.50 -0.17 0.00 0.50 0.00 0.00 46.19 43.97 1pma s LEU 106 CO -0.07 -1.13 1.39 1.62 -1.32 0.00 0.00 176.35 176.84 1pma h VAL 107 N 5.69 0.66 -3.47 1.68 3.04 -1.97 -3.43 116.25 118.45 1pma h VAL 107 Ca 0.30 -0.39 -0.67 0.00 -1.01 0.00 0.00 66.70 64.93 1pma h VAL 107 Cb 0.93 0.86 -0.33 0.00 -2.01 0.00 0.00 31.29 30.75 1pma h VAL 107 CO 1.34 0.08 -0.77 0.21 -1.01 0.00 0.00 177.57 177.41 1pma s ASN 108 N -4.94 4.13 0.37 3.17 3.84 -1.26 -1.66 114.94 118.58 1pma s ASN 108 Ca -0.15 -0.87 0.12 0.00 0.21 0.00 0.00 52.86 52.17 1pma s ASN 108 Cb 0.03 -1.62 0.71 0.00 -0.55 0.00 0.00 41.25 39.82 1pma s ASN 108 CO 0.58 -0.11 1.83 -0.29 -2.79 0.00 0.00 177.10 176.32 1pma h ILE 109 N 6.15 1.26 -0.97 -5.21 2.10 -1.96 -2.49 117.51 116.39 1pma h ILE 109 Ca -0.34 -1.24 0.22 0.00 1.08 0.00 0.00 64.86 64.58 1pma h ILE 109 Cb 1.11 1.64 -0.08 0.00 -1.09 0.00 0.00 36.82 38.40 1pma h ILE 109 CO 0.57 0.36 0.62 -0.08 -1.08 0.00 0.00 178.15 178.54 1pma h GLU 110 N 0.03 0.49 -0.48 2.19 4.81 -1.99 0.34 114.58 119.96 1pma h GLU 110 Ca 0.00 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.11 1pma h GLU 110 Cb 0.64 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 1pma h GLU 110 CO 0.05 0.32 -0.06 -0.97 -0.73 0.00 0.00 179.01 177.62 1pma h ASN 111 N 0.50 0.89 -0.42 1.04 -0.73 -1.88 -1.54 115.58 113.44 1pma h ASN 111 Ca 0.53 -0.34 0.08 0.00 1.87 0.00 0.00 56.30 58.44 1pma h ASN 111 Cb 1.18 -0.24 -0.07 0.00 0.27 0.00 0.00 38.32 39.46 1pma h ASN 111 CO -0.26 1.01 -0.02 0.25 -0.37 0.00 0.00 177.43 178.05 1pma h LEU 112 N 0.74 -0.21 -0.61 0.34 5.85 -1.04 -0.94 115.31 119.43 1pma h LEU 112 Ca 0.13 0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.88 1pma h LEU 112 Cb 0.60 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.79 1pma h LEU 112 CO 0.04 -0.07 0.11 1.62 -0.34 0.00 0.00 178.44 179.80 1pma h VAL 113 N 0.09 1.26 -0.79 1.05 3.04 -1.38 -2.59 116.25 116.93 1pma h VAL 113 Ca 0.21 -0.98 0.14 0.00 -1.01 0.00 0.00 66.70 65.05 1pma h VAL 113 Cb 0.30 0.72 -0.09 0.00 -2.01 0.00 0.00 31.29 30.21 1pma h VAL 113 CO -0.36 0.36 0.37 0.11 -1.01 0.00 0.00 177.57 177.04 1pma h LYS 114 N 0.91 0.53 0.26 4.17 1.57 -0.14 -0.02 116.57 123.85 1pma h LYS 114 Ca 0.19 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 1pma h LYS 114 Cb 0.41 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1pma h LYS 114 CO 0.01 0.35 -0.13 -0.09 -0.57 0.00 0.00 179.45 179.02 1pma h ARG 115 N 0.55 -0.34 -0.06 3.15 2.43 -0.94 0.15 114.38 119.31 1pma h ARG 115 Ca 0.42 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.61 1pma h ARG 115 Cb 0.59 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.22 1pma h ARG 115 CO -0.36 -0.20 -0.00 -0.24 -1.51 0.00 0.00 179.97 177.65 1pma h VAL 116 N -0.39 1.04 0.27 0.20 3.04 -1.25 -0.81 116.25 118.35 1pma h VAL 116 Ca -0.04 -0.16 -0.01 0.00 -1.01 0.00 0.00 66.70 65.48 1pma h VAL 116 Cb 0.30 1.00 0.00 0.00 -2.01 0.00 0.00 31.29 30.58 1pma h VAL 116 CO 0.06 0.05 -0.13 0.00 -1.01 0.00 0.00 177.57 176.54 1pma h ALA 117 N 1.92 -0.36 -0.70 3.17 0.00 -0.25 -2.21 119.26 120.84 1pma h ALA 117 Ca 0.02 -0.14 0.12 0.00 0.00 0.00 0.00 54.91 54.91 1pma h ALA 117 Cb 0.06 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1pma h ALA 117 CO 0.00 -0.61 0.46 -0.44 0.00 0.00 0.00 179.25 178.67 1pma h ASP 118 N -0.55 0.42 0.43 0.00 5.19 0.21 -0.31 116.42 121.80 1pma h ASP 118 Ca -0.04 0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.38 1pma h ASP 118 Cb 0.41 -0.07 -0.01 0.00 0.18 0.00 0.00 39.33 39.84 1pma h ASP 118 CO 0.06 0.24 -0.28 -0.61 -3.12 0.00 0.00 179.24 175.53 1pma h GLN 119 N 0.46 -0.65 -0.35 3.56 -0.00 -0.71 -2.09 115.11 115.33 1pma h GLN 119 Ca 0.33 0.04 0.06 0.00 -0.00 0.00 0.00 58.65 59.08 1pma h GLN 119 Cb 0.67 0.15 -0.05 0.00 0.00 0.00 0.00 27.48 28.24 1pma h GLN 119 CO -0.10 -0.44 0.04 0.52 0.00 0.00 0.00 178.83 178.85 1pma h MET 120 N -0.68 0.14 -0.32 1.69 2.86 -0.54 -1.61 114.93 116.48 1pma h MET 120 Ca -0.05 -0.01 0.09 0.00 -2.06 0.00 0.00 59.70 57.68 1pma h MET 120 Cb 0.56 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 1pma h MET 120 CO 0.04 0.10 0.23 0.37 1.06 0.00 0.00 176.91 178.71 1pma h GLN 121 N 0.15 0.00 -0.61 1.72 -0.00 -1.03 -1.59 115.11 113.75 1pma h GLN 121 Ca 0.17 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.79 1pma h GLN 121 Cb 0.21 0.00 -0.03 0.00 0.00 0.00 0.00 27.48 27.66 1pma h GLN 121 CO -0.24 0.00 0.28 1.96 0.00 0.00 0.00 178.83 180.82 1pma h GLN 122 N 0.00 0.89 0.00 1.69 4.20 -0.57 -2.39 115.11 118.93 1pma h GLN 122 Ca 0.15 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1pma h GLN 122 Cb 0.62 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.24 1pma h GLN 122 CO -0.00 0.73 0.00 0.66 -0.67 0.00 0.00 178.83 179.55 1pma n TYR 123 N -4.50 0.53 0.24 2.96 4.02 -0.60 -1.65 117.16 118.17 1pma n TYR 123 Ca 0.04 0.22 0.14 0.00 -0.01 0.00 0.00 57.90 58.29 1pma n TYR 123 Cb 0.14 -0.86 0.32 0.00 -0.02 0.00 0.00 39.34 38.92 1pma n TYR 123 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 176.86 177.00 1pma h THR 124 N 0.00 0.00 0.00 -0.72 2.02 -1.40 -3.39 112.91 109.43 1pma h THR 124 Ca 0.00 -0.86 0.00 0.00 0.77 0.00 0.00 66.41 66.32 1pma h THR 124 Cb 0.26 1.86 0.00 0.00 -1.74 0.00 0.00 68.15 68.53 1pma h THR 124 CO 0.00 0.00 -0.21 0.00 0.37 0.00 0.00 175.52 175.68 1pma n GLN 125 N -3.09 3.21 -1.26 6.66 10.64 -0.91 -4.86 117.38 127.77 1pma n GLN 125 Ca 0.03 0.00 -0.32 0.00 -1.83 0.00 0.00 57.00 54.88 1pma n GLN 125 Cb 0.46 -0.46 -0.06 0.00 -0.86 0.00 0.00 30.24 29.32 1pma n GLN 125 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1pma n TYR 126 N -0.54 1.81 -0.21 2.61 4.01 -0.66 -4.97 117.16 119.22 1pma n TYR 126 Ca 0.00 -2.67 0.00 0.00 -0.16 0.00 0.00 57.90 55.07 1pma n TYR 126 Cb 0.00 -2.23 0.00 0.00 -0.31 0.00 0.00 39.34 36.80 1pma n TYR 126 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1pma n GLY 127 N 3.20 2.47 3.04 2.72 0.00 -1.26 -4.40 105.19 110.97 1pma n GLY 127 Ca 0.69 -0.07 -0.11 0.00 0.00 0.00 0.00 46.02 46.53 1pma n GLY 127 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pma n GLY 128 N 0.00 0.26 3.63 -0.02 0.00 -1.26 -4.65 105.19 103.16 1pma n GLY 128 Ca 0.00 -0.23 -0.07 0.00 0.00 0.00 0.00 46.02 45.72 1pma n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pma s VAL 129 N 3.84 0.00 -0.07 1.61 0.11 -1.26 -5.16 120.40 119.46 1pma s VAL 129 Ca 0.17 0.00 -0.27 0.00 -2.93 0.00 0.00 61.98 58.96 1pma s VAL 129 Cb 0.04 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.86 1pma s VAL 129 CO 0.09 0.00 0.85 -0.60 -3.33 0.00 0.00 175.10 172.11 1pma s ARG 130 N -0.15 4.44 0.75 1.54 3.52 -1.26 -4.90 118.95 122.88 1pma s ARG 130 Ca 0.04 1.13 -0.15 0.00 -0.13 0.00 0.00 55.73 56.62 1pma s ARG 130 Cb -0.04 -3.49 0.01 0.00 -1.56 0.00 0.00 34.95 29.87 1pma s ARG 130 CO -0.07 -0.10 0.86 -2.30 -0.81 0.00 0.00 175.30 172.87 1pma n PRO 131 N 4.29 0.37 -2.60 5.12 -0.02 -1.26 -4.91 135.00 135.99 1pma n PRO 131 Ca 0.03 0.18 -0.43 0.00 -2.02 0.00 0.00 63.50 61.26 1pma n PRO 131 Cb 0.50 -2.13 -0.02 0.00 -0.02 0.00 0.00 33.50 31.83 1pma n PRO 131 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1pma s TYR 132 N -1.91 3.15 -1.23 6.00 1.51 -1.26 -4.94 117.35 118.67 1pma s TYR 132 Ca 0.70 1.26 -0.07 0.00 -1.01 0.00 0.00 57.07 57.95 1pma s TYR 132 Cb -0.33 -3.50 0.20 0.00 -0.11 0.00 0.00 41.96 38.22 1pma s TYR 132 CO 0.53 -0.86 1.89 0.41 -1.11 0.00 0.00 175.55 176.40 1pma n GLY 133 N 3.63 5.05 3.41 0.71 0.00 -1.26 -4.44 105.19 112.28 1pma n GLY 133 Ca 0.13 -2.25 -0.15 0.00 0.00 0.00 0.00 46.02 43.75 1pma n GLY 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pma s VAL 134 N -0.94 0.02 0.02 1.61 0.11 -1.26 -0.37 120.40 119.58 1pma s VAL 134 Ca 0.40 -0.13 0.06 0.00 -2.93 0.00 0.00 61.98 59.39 1pma s VAL 134 Cb 0.11 -0.78 -0.02 0.00 -1.53 0.00 0.00 36.38 34.16 1pma s VAL 134 CO 0.00 -0.07 -0.19 -0.44 -3.33 0.00 0.00 175.10 171.07 1pma s SER 135 N -0.56 2.24 0.10 3.54 0.01 0.39 -3.14 113.70 116.28 1pma s SER 135 Ca -0.07 -0.45 -0.11 0.00 1.31 0.00 0.00 55.95 56.63 1pma s SER 135 Cb -0.03 -0.20 0.01 0.00 0.21 0.00 0.00 66.02 66.01 1pma s SER 135 CO 0.04 0.16 0.27 -1.48 0.41 0.00 0.00 173.24 172.64 1pma s LEU 136 N -0.93 1.05 -0.03 2.44 0.05 0.19 -0.42 118.68 121.03 1pma s LEU 136 Ca 0.06 -0.54 0.04 0.00 0.05 0.00 0.00 54.13 53.74 1pma s LEU 136 Cb -0.08 1.32 -0.00 0.00 -2.05 0.00 0.00 46.19 45.38 1pma s LEU 136 CO 0.01 -0.78 -0.14 0.27 -0.55 0.00 0.00 176.35 175.16 1pma s ILE 137 N -3.84 1.20 0.02 1.48 -4.36 -0.16 0.17 121.20 115.70 1pma s ILE 137 Ca 0.05 -0.60 0.03 0.00 -0.26 0.00 0.00 60.65 59.86 1pma s ILE 137 Cb 0.04 -1.03 -0.04 0.00 1.25 0.00 0.00 42.46 42.68 1pma s ILE 137 CO -0.11 0.35 -0.03 -0.36 0.24 0.00 0.00 174.94 175.03 1pma s PHE 138 N -0.00 2.96 0.00 1.37 0.08 0.51 -1.60 117.98 121.30 1pma s PHE 138 Ca -0.02 -0.00 -0.26 0.00 0.12 0.00 0.00 56.93 56.78 1pma s PHE 138 Cb -0.09 -1.61 0.06 0.00 -0.57 0.00 0.00 43.02 40.81 1pma s PHE 138 CO 0.01 0.43 0.58 0.00 -0.10 0.00 0.00 175.22 176.13 1pma s ALA 139 N -1.10 -1.49 0.00 5.36 0.00 -0.66 -0.67 121.76 123.20 1pma s ALA 139 Ca 0.20 0.89 0.00 0.00 0.00 0.00 0.00 51.96 53.05 1pma s ALA 139 Cb -0.11 0.21 0.00 0.00 0.00 0.00 0.00 23.12 23.22 1pma s ALA 139 CO 0.11 -0.44 0.00 0.41 0.00 0.00 0.00 175.76 175.84 1pma n GLY 140 N 0.67 -2.55 3.38 0.00 0.00 -0.28 -1.65 105.19 104.77 1pma n GLY 140 Ca -0.19 -1.35 -0.33 0.00 0.00 0.00 0.00 46.02 44.15 1pma n GLY 140 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1pma s ILE 141 N -2.10 3.20 0.00 -0.61 -1.16 -1.10 0.30 121.20 119.73 1pma s ILE 141 Ca 0.00 -0.60 0.00 0.00 -0.51 0.00 0.00 60.65 59.54 1pma s ILE 141 Cb 0.00 -2.37 0.00 0.00 0.61 0.00 0.00 42.46 40.70 1pma s ILE 141 CO 0.00 0.51 0.00 -0.90 -2.81 0.00 0.00 174.94 171.74 1pma n ASP 142 N 3.72 1.61 -0.00 4.50 3.85 0.00 -4.86 116.55 125.37 1pma n ASP 142 Ca -0.18 -0.33 0.04 0.00 -0.71 0.00 0.00 54.79 53.61 1pma n ASP 142 Cb 0.52 0.00 0.43 0.00 -1.35 0.00 0.00 41.12 40.72 1pma n ASP 142 CO 0.00 0.00 0.00 -0.61 -1.01 0.00 0.00 177.20 175.58 1pma h GLN 143 N 0.00 0.53 -0.00 0.11 5.75 -1.58 -2.27 115.11 117.64 1pma h GLN 143 Ca 0.00 -0.03 -0.23 0.00 -0.15 0.00 0.00 58.65 58.24 1pma h GLN 143 Cb 0.00 -0.12 0.01 0.00 1.07 0.00 0.00 27.48 28.43 1pma h GLN 143 CO 0.00 0.35 -0.95 0.82 -2.65 0.00 0.00 178.83 176.40 1pma h ILE 144 N 0.55 1.38 0.00 2.39 2.04 -1.96 -3.50 117.51 118.41 1pma h ILE 144 Ca 0.15 -2.41 0.00 0.00 1.00 0.00 0.00 64.86 63.60 1pma h ILE 144 Cb -0.05 2.40 0.00 0.00 -0.74 0.00 0.00 36.82 38.44 1pma h ILE 144 CO -0.03 0.72 0.00 0.61 0.00 0.00 0.00 178.15 179.45 1pma n GLY 145 N 0.96 0.28 3.72 5.37 0.00 -0.86 -5.09 105.19 109.57 1pma n GLY 145 Ca -0.07 -1.60 -0.42 0.00 0.00 0.00 0.00 46.02 43.93 1pma n GLY 145 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1pma s PRO 146 N -2.00 4.32 0.07 1.61 0.02 -1.26 -0.82 135.00 136.94 1pma s PRO 146 Ca 0.00 2.12 0.04 0.00 0.02 0.00 0.00 61.00 63.17 1pma s PRO 146 Cb 0.00 -3.22 -0.03 0.00 0.02 0.00 0.00 34.50 31.27 1pma s PRO 146 CO 0.00 -0.42 -0.11 1.03 -0.33 0.00 0.00 177.00 177.17 1pma s ARG 147 N 0.81 0.75 -0.09 5.54 0.52 0.15 -4.94 118.95 121.68 1pma s ARG 147 Ca 0.64 -0.98 -0.04 0.00 -0.52 0.00 0.00 55.73 54.83 1pma s ARG 147 Cb -0.38 -0.55 0.05 0.00 0.52 0.00 0.00 34.95 34.59 1pma s ARG 147 CO 0.32 0.10 0.19 -1.17 0.02 0.00 0.00 175.30 174.76 1pma s LEU 148 N -1.98 -0.08 0.05 2.53 2.96 -1.26 -1.12 118.68 119.77 1pma s LEU 148 Ca -0.01 0.40 0.02 0.00 -0.22 0.00 0.00 54.13 54.32 1pma s LEU 148 Cb -0.07 0.39 -0.03 0.00 0.50 0.00 0.00 46.19 46.98 1pma s LEU 148 CO 0.01 -0.24 -0.08 -0.36 -1.32 0.00 0.00 176.35 174.36 1pma s PHE 149 N 2.24 0.70 0.18 5.38 0.40 0.15 -1.41 117.98 125.62 1pma s PHE 149 Ca 0.02 -0.52 0.09 0.00 -0.60 0.00 0.00 56.93 55.92 1pma s PHE 149 Cb -0.12 -0.42 -0.04 0.00 0.51 0.00 0.00 43.02 42.95 1pma s PHE 149 CO -0.06 -0.08 -0.18 0.16 0.70 0.00 0.00 175.22 175.76 1pma s ASP 150 N -1.65 2.72 -0.08 1.36 -4.77 -0.96 -0.36 116.67 112.93 1pma s ASP 150 Ca -0.09 -0.90 -0.04 0.00 -3.30 0.00 0.00 52.55 48.22 1pma s ASP 150 Cb -0.09 -0.16 0.04 0.00 -1.09 0.00 0.00 42.92 41.61 1pma s ASP 150 CO 0.00 -0.06 0.19 0.00 0.70 0.00 0.00 175.17 176.00 1pma s ASP 152 N 0.99 4.98 0.63 0.00 -4.77 -1.07 -0.64 116.67 116.79 1pma s ASP 152 Ca -0.07 -0.77 0.30 0.00 -3.30 0.00 0.00 52.55 48.70 1pma s ASP 152 Cb -0.09 -0.58 1.61 0.00 -1.09 0.00 0.00 42.92 42.77 1pma s ASP 152 CO -0.06 -0.62 1.95 -0.65 0.70 0.00 0.00 175.17 176.50 1pma h PRO 153 N 1.10 0.00 -0.00 2.11 0.11 -1.76 0.33 132.00 133.89 1pma h PRO 153 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1pma h PRO 153 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1pma h PRO 153 CO 0.59 0.00 -0.04 0.00 -0.21 0.00 0.00 178.00 178.34 1pma n ALA 154 N -2.10 2.64 -0.70 -0.75 0.00 -1.26 -4.67 120.51 113.67 1pma n ALA 154 Ca 0.02 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1pma n ALA 154 Cb 0.45 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.48 1pma n ALA 154 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pma n GLY 155 N 1.22 0.64 3.74 0.00 0.00 0.11 -4.50 105.19 106.40 1pma n GLY 155 Ca 0.17 -0.13 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1pma n GLY 155 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pma s THR 156 N -2.00 3.76 0.00 2.61 2.01 -1.25 -4.78 115.64 116.00 1pma s THR 156 Ca 0.00 1.60 0.02 0.00 0.31 0.00 0.00 61.69 63.62 1pma s THR 156 Cb 0.00 -4.02 -0.01 0.00 0.01 0.00 0.00 72.50 68.48 1pma s THR 156 CO 0.00 0.31 -0.07 -0.51 -0.69 0.00 0.00 174.62 173.66 1pma s ILE 157 N -0.56 0.55 0.11 1.82 2.07 -1.26 -2.60 121.20 121.34 1pma s ILE 157 Ca 0.47 -0.42 -0.13 0.00 -1.41 0.00 0.00 60.65 59.17 1pma s ILE 157 Cb -0.30 -0.49 0.02 0.00 0.13 0.00 0.00 42.46 41.82 1pma s ILE 157 CO 0.37 0.07 0.31 0.20 -1.91 0.00 0.00 174.94 173.98 1pma s ASN 158 N -0.38 -0.07 -0.11 4.50 -0.87 -1.18 -5.01 114.94 111.82 1pma s ASN 158 Ca 0.01 -0.48 -0.03 0.00 -1.57 0.00 0.00 52.86 50.79 1pma s ASN 158 Cb -0.04 0.42 -0.03 0.00 -0.02 0.00 0.00 41.25 41.58 1pma s ASN 158 CO -0.00 -0.81 0.01 -0.70 -2.57 0.00 0.00 177.10 173.03 1pma s GLU 159 N -3.84 3.22 0.42 -0.60 2.12 -1.26 -2.25 118.70 116.51 1pma s GLU 159 Ca 0.04 -0.40 0.05 0.00 0.36 0.00 0.00 54.97 55.01 1pma s GLU 159 Cb 0.03 -2.88 -0.05 0.00 0.26 0.00 0.00 34.13 31.49 1pma s GLU 159 CO -0.11 0.59 0.03 0.71 -0.54 0.00 0.00 175.26 175.94 1pma s TYR 160 N -0.56 2.17 -0.17 5.30 1.51 -0.50 -5.00 117.35 120.10 1pma s TYR 160 Ca 0.10 -0.86 0.18 0.00 -1.01 0.00 0.00 57.07 55.48 1pma s TYR 160 Cb -0.12 -1.58 -0.25 0.00 -0.11 0.00 0.00 41.96 39.89 1pma s TYR 160 CO 0.02 0.24 0.19 1.17 -1.11 0.00 0.00 175.55 176.06 1pma n LYS 161 N -0.99 0.68 -3.59 -0.62 3.00 -1.26 -4.50 118.16 110.88 1pma n LYS 161 Ca -0.08 0.01 -0.07 0.00 -0.00 0.00 0.00 58.31 58.17 1pma n LYS 161 Cb 0.67 -1.56 -0.04 0.00 0.00 0.00 0.00 35.03 34.10 1pma n LYS 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1pma s ALA 162 N -2.61 -2.00 0.03 3.14 0.00 -1.26 -1.15 121.76 117.91 1pma s ALA 162 Ca -0.09 1.63 -0.28 0.00 0.00 0.00 0.00 51.96 53.22 1pma s ALA 162 Cb 0.07 -0.73 0.10 0.00 0.00 0.00 0.00 23.12 22.56 1pma s ALA 162 CO 0.84 -0.38 1.21 -0.08 0.00 0.00 0.00 175.76 177.35 1pma s THR 163 N -1.51 0.00 0.34 0.00 -1.32 -0.66 -5.00 115.64 107.48 1pma s THR 163 Ca 0.04 -0.31 -0.00 0.00 -1.21 0.00 0.00 61.69 60.20 1pma s THR 163 Cb -0.01 -2.39 -0.01 0.00 -1.51 0.00 0.00 72.50 68.59 1pma s THR 163 CO -0.03 0.00 0.42 0.00 -2.21 0.00 0.00 174.62 172.80 1pma s ALA 164 N -2.38 1.03 0.20 11.08 0.00 -1.26 -1.37 121.76 129.05 1pma s ALA 164 Ca 0.19 -1.65 -0.23 0.00 0.00 0.00 0.00 51.96 50.27 1pma s ALA 164 Cb 0.02 1.23 0.05 0.00 0.00 0.00 0.00 23.12 24.42 1pma s ALA 164 CO -0.01 -0.76 0.73 -1.50 0.00 0.00 0.00 175.76 174.22 1pma s ILE 165 N -3.17 0.00 0.00 0.00 1.10 0.13 -4.92 121.20 114.34 1pma s ILE 165 Ca 0.33 -0.54 0.00 0.00 -0.51 0.00 0.00 60.65 59.93 1pma s ILE 165 Cb 0.00 -1.58 0.00 0.00 0.15 0.00 0.00 42.46 41.03 1pma s ILE 165 CO 0.22 0.00 0.00 0.61 -2.11 0.00 0.00 174.94 173.66 1pma n GLY 166 N -0.42 0.03 0.15 1.50 0.00 -1.26 -1.37 105.19 103.82 1pma n GLY 166 Ca -0.09 -1.83 -0.06 0.00 0.00 0.00 0.00 46.02 44.05 1pma n GLY 166 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1pma h SER 167 N 0.00 -0.32 0.00 1.61 0.87 -1.29 -3.24 113.55 111.18 1pma h SER 167 Ca 0.00 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1pma h SER 167 Cb 0.00 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 1pma h SER 167 CO 0.00 -0.20 0.00 0.61 -0.53 0.00 0.00 176.83 176.71 1pma n GLY 168 N -0.76 1.73 0.27 5.77 0.00 -1.26 -4.48 105.19 106.45 1pma n GLY 168 Ca -0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.87 1pma n GLY 168 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1pma h LYS 169 N 0.68 -0.61 -0.83 1.61 3.64 -1.79 -1.64 116.57 117.63 1pma h LYS 169 Ca 0.00 0.04 0.17 0.00 -1.27 0.00 0.00 60.65 59.59 1pma h LYS 169 Cb 0.80 0.14 -0.16 0.00 -0.41 0.00 0.00 32.23 32.61 1pma h LYS 169 CO 0.00 -0.41 -0.20 -0.44 -2.27 0.00 0.00 179.45 176.13 1pma h ASP 170 N -0.64 -0.76 0.23 4.20 3.32 -1.89 0.53 116.42 121.41 1pma h ASP 170 Ca -0.06 0.25 -0.01 0.00 0.02 0.00 0.00 57.03 57.23 1pma h ASP 170 Cb 0.51 0.51 0.00 0.00 0.22 0.00 0.00 39.33 40.57 1pma h ASP 170 CO 0.07 -0.27 -0.12 0.00 -1.72 0.00 0.00 179.24 177.20 1pma h ALA 171 N 1.83 -1.05 -0.97 3.45 0.00 -1.88 -1.57 119.26 119.06 1pma h ALA 171 Ca 0.40 -0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.36 1pma h ALA 171 Cb 0.61 0.17 -0.08 0.00 0.00 0.00 0.00 17.79 18.49 1pma h ALA 171 CO -0.85 -1.03 0.62 -0.24 0.00 0.00 0.00 179.25 177.75 1pma h VAL 172 N -0.32 0.92 -0.67 0.00 3.04 -0.86 0.35 116.25 118.72 1pma h VAL 172 Ca -0.03 -0.32 -0.02 0.00 -1.01 0.00 0.00 66.70 65.32 1pma h VAL 172 Cb 0.25 -0.10 -0.03 0.00 -2.01 0.00 0.00 31.29 29.39 1pma h VAL 172 CO 0.04 0.17 0.34 1.62 -1.01 0.00 0.00 177.57 178.74 1pma h VAL 173 N 0.94 1.21 -0.07 1.51 3.04 0.10 -2.40 116.25 120.58 1pma h VAL 173 Ca 0.47 -0.56 -0.01 0.00 -1.01 0.00 0.00 66.70 65.60 1pma h VAL 173 Cb 0.50 0.33 -0.00 0.00 -2.01 0.00 0.00 31.29 30.10 1pma h VAL 173 CO -0.24 0.24 0.00 0.28 -1.01 0.00 0.00 177.57 176.84 1pma h SER 174 N 0.94 0.11 -0.50 3.17 0.02 0.10 -0.50 113.55 116.90 1pma h SER 174 Ca 0.24 -0.30 0.10 0.00 -0.84 0.00 0.00 61.79 60.98 1pma h SER 174 Cb 0.06 -0.03 -0.10 0.00 0.14 0.00 0.00 62.40 62.47 1pma h SER 174 CO -0.03 0.39 -0.27 0.15 -1.14 0.00 0.00 176.83 175.92 1pma h PHE 175 N -0.16 -0.72 -0.24 3.45 3.04 -0.92 -0.22 116.94 121.16 1pma h PHE 175 Ca 0.02 0.06 -0.02 0.00 3.98 0.00 0.00 57.97 62.01 1pma h PHE 175 Cb 0.32 0.39 -0.01 0.00 2.56 0.00 0.00 35.95 39.22 1pma h PHE 175 CO 0.03 -0.34 0.09 -0.07 -2.02 0.00 0.00 178.31 176.00 1pma h LEU 176 N -0.16 0.34 -1.95 0.59 -0.00 -1.43 0.30 115.31 113.01 1pma h LEU 176 Ca 0.22 -0.18 0.47 0.00 -0.00 0.00 0.00 57.88 58.40 1pma h LEU 176 Cb 0.51 -0.09 -0.07 0.00 -0.00 0.00 0.00 40.66 41.02 1pma h LEU 176 CO -0.59 0.42 1.20 -0.08 -0.00 0.00 0.00 178.44 179.39 1pma h GLU 177 N 0.24 0.00 0.00 1.13 4.57 0.63 0.49 114.58 121.64 1pma h GLU 177 Ca 0.08 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.17 1pma h GLU 177 Cb 0.19 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 1pma h GLU 177 CO -0.01 0.00 -1.22 -2.13 -1.18 0.00 0.00 179.01 174.47 1pma n ARG 178 N -3.98 0.48 -0.33 1.92 0.63 -0.54 -4.74 116.66 110.11 1pma n ARG 178 Ca 0.36 0.20 0.07 0.00 -0.92 0.00 0.00 57.85 57.56 1pma n ARG 178 Cb 1.70 -1.34 0.23 0.00 0.45 0.00 0.00 32.46 33.51 1pma n ARG 178 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1pma n GLU 179 N -4.29 2.46 -2.37 -0.14 1.02 0.10 -4.94 120.64 112.48 1pma n GLU 179 Ca -0.21 -1.88 -0.42 0.00 -0.02 0.00 0.00 57.16 54.63 1pma n GLU 179 Cb 0.55 -1.51 -0.03 0.00 -0.02 0.00 0.00 31.44 30.42 1pma n GLU 179 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 1pma s TYR 180 N -1.49 3.22 -0.27 -0.32 5.04 0.17 -4.93 117.35 118.76 1pma s TYR 180 Ca 0.34 1.14 -0.08 0.00 -2.44 0.00 0.00 57.07 56.03 1pma s TYR 180 Cb 0.20 -3.50 -0.02 0.00 0.35 0.00 0.00 41.96 38.99 1pma s TYR 180 CO 0.21 -1.64 0.11 0.21 -1.34 0.00 0.00 175.55 173.09 1pma s LYS 181 N 1.70 3.59 0.00 4.97 2.47 -1.26 -5.02 119.74 126.18 1pma s LYS 181 Ca 0.59 -0.53 0.00 0.00 -1.56 0.00 0.00 55.97 54.47 1pma s LYS 181 Cb -0.29 -3.43 0.00 0.00 -1.46 0.00 0.00 37.83 32.65 1pma s LYS 181 CO 0.27 -0.26 0.14 -1.91 0.16 0.00 0.00 175.35 173.75 1pma n GLU 182 N 4.95 0.00 -1.57 4.03 4.07 -1.26 -2.87 120.64 127.99 1pma n GLU 182 Ca -0.15 0.14 -0.32 0.00 -0.06 0.00 0.00 57.16 56.77 1pma n GLU 182 Cb 0.51 -0.49 0.01 0.00 -0.06 0.00 0.00 31.44 31.42 1pma n GLU 182 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1pma n ASN 183 N -0.35 7.10 -4.69 4.31 5.03 -1.26 -4.63 115.26 120.78 1pma n ASN 183 Ca 0.00 -3.54 -0.42 0.00 0.87 0.00 0.00 54.58 51.49 1pma n ASN 183 Cb 0.00 -1.11 -0.03 0.00 -1.02 0.00 0.00 39.78 37.62 1pma n ASN 183 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 1pma s LEU 184 N -3.16 4.40 0.41 3.41 2.96 -1.14 -4.14 118.68 121.42 1pma s LEU 184 Ca 0.54 2.68 -0.26 0.00 -0.22 0.00 0.00 54.13 56.88 1pma s LEU 184 Cb 0.41 -3.56 -0.09 0.00 0.50 0.00 0.00 46.19 43.46 1pma s LEU 184 CO -0.24 -0.99 1.33 -2.84 -1.32 0.00 0.00 176.35 172.29 1pma s PRO 185 N 3.02 3.92 0.02 0.98 0.02 -1.26 -1.04 135.00 140.66 1pma s PRO 185 Ca 0.81 2.22 -0.04 0.00 0.02 0.00 0.00 61.00 64.01 1pma s PRO 185 Cb -0.44 -2.75 -0.01 0.00 0.02 0.00 0.00 34.50 31.32 1pma s PRO 185 CO 0.36 -0.55 0.59 -1.91 -0.33 0.00 0.00 177.00 175.16 1pma n GLU 186 N 0.08 -0.06 -0.28 5.54 2.13 -1.26 -0.67 120.64 126.12 1pma n GLU 186 Ca 0.04 0.59 0.07 0.00 0.66 0.00 0.00 57.16 58.52 1pma n GLU 186 Cb 0.43 -0.87 0.19 0.00 0.27 0.00 0.00 31.44 31.46 1pma n GLU 186 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 1pma h LYS 187 N 0.00 0.09 -0.12 5.31 3.64 -2.00 0.28 116.57 123.77 1pma h LYS 187 Ca 0.02 -0.01 -0.19 0.00 -1.27 0.00 0.00 60.65 59.21 1pma h LYS 187 Cb 0.05 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.85 1pma h LYS 187 CO -0.12 0.06 -0.70 0.93 -2.27 0.00 0.00 179.45 177.35 1pma h GLU 188 N 0.09 0.54 0.26 1.90 5.08 -1.26 -2.73 114.58 118.46 1pma h GLU 188 Ca 0.46 -0.41 0.01 0.00 -1.00 0.00 0.00 59.36 58.41 1pma h GLU 188 Cb 0.84 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.14 1pma h GLU 188 CO -0.72 1.04 -0.33 0.00 -1.00 0.00 0.00 179.01 177.99 1pma h ALA 189 N 0.85 -0.66 -0.75 3.43 0.00 0.16 0.19 119.26 122.47 1pma h ALA 189 Ca -0.03 -0.09 0.12 0.00 0.00 0.00 0.00 54.91 54.91 1pma h ALA 189 Cb 1.28 0.50 -0.05 0.00 0.00 0.00 0.00 17.79 19.51 1pma h ALA 189 CO 0.13 -0.91 0.50 -0.24 0.00 0.00 0.00 179.25 178.72 1pma h VAL 190 N -0.64 0.87 0.83 0.00 3.04 -0.89 0.16 116.25 119.63 1pma h VAL 190 Ca -0.00 -0.19 -0.04 0.00 -1.01 0.00 0.00 66.70 65.45 1pma h VAL 190 Cb 0.61 0.27 0.01 0.00 -2.01 0.00 0.00 31.29 30.16 1pma h VAL 190 CO -0.10 0.10 -0.40 0.74 -1.01 0.00 0.00 177.57 176.90 1pma h THR 191 N 0.56 0.04 -0.92 3.17 2.02 -0.86 0.32 112.91 117.24 1pma h THR 191 Ca 0.36 -0.16 0.20 0.00 0.77 0.00 0.00 66.41 67.58 1pma h THR 191 Cb 0.63 0.05 -0.11 0.00 -1.74 0.00 0.00 68.15 66.98 1pma h THR 191 CO -0.13 0.00 0.48 0.25 0.37 0.00 0.00 175.52 176.50 1pma h LEU 192 N -1.27 0.53 0.84 2.58 5.85 0.09 0.14 115.31 124.07 1pma h LEU 192 Ca -0.11 0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 1pma h LEU 192 Cb 0.86 0.05 0.01 0.00 0.37 0.00 0.00 40.66 41.95 1pma h LEU 192 CO 0.19 0.13 -0.40 1.23 -0.34 0.00 0.00 178.44 179.25 1pma h GLY 193 N 0.56 -1.17 0.86 3.75 0.00 -0.32 0.37 103.07 107.13 1pma h GLY 193 Ca 0.55 0.43 0.10 0.00 0.00 0.00 0.00 47.33 48.42 1pma h GLY 193 CO -0.45 -0.43 0.49 1.19 0.00 0.00 0.00 176.54 177.35 1pma h ILE 194 N -1.26 0.92 0.53 2.60 2.10 0.31 0.29 117.51 122.99 1pma h ILE 194 Ca -0.11 -0.21 -0.03 0.00 1.08 0.00 0.00 64.86 65.59 1pma h ILE 194 Cb 0.87 0.24 0.01 0.00 -1.09 0.00 0.00 36.82 36.85 1pma h ILE 194 CO 0.19 0.11 -0.26 0.50 -1.08 0.00 0.00 178.15 177.62 1pma h LYS 195 N 0.62 -0.69 -0.45 2.19 3.64 -0.61 0.13 116.57 121.40 1pma h LYS 195 Ca 0.35 0.05 0.07 0.00 -1.27 0.00 0.00 60.65 59.85 1pma h LYS 195 Cb 0.51 0.16 -0.06 0.00 -0.41 0.00 0.00 32.23 32.43 1pma h LYS 195 CO -0.12 -0.42 0.08 0.00 -2.27 0.00 0.00 179.45 176.71 1pma h ALA 196 N -0.38 0.49 -0.31 5.00 0.00 0.31 -0.57 119.26 123.80 1pma h ALA 196 Ca -0.07 0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.98 1pma h ALA 196 Cb 0.59 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 1pma h ALA 196 CO 0.12 -0.32 0.05 1.25 0.00 0.00 0.00 179.25 180.35 1pma h LEU 197 N 0.21 -0.00 0.00 0.00 5.85 -0.29 -2.79 115.31 118.28 1pma h LEU 197 Ca 0.22 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.99 1pma h LEU 197 Cb 0.29 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.39 1pma h LEU 197 CO -0.30 0.04 0.00 1.17 -0.34 0.00 0.00 178.44 179.01 1pma n LYS 198 N -5.10 0.00 -0.20 1.25 4.81 0.43 -2.83 118.16 116.53 1pma n LYS 198 Ca 0.00 0.39 -0.03 0.00 -0.87 0.00 0.00 58.31 57.81 1pma n LYS 198 Cb 0.14 -1.18 -0.01 0.00 0.02 0.00 0.00 35.03 34.00 1pma n LYS 198 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1pma n SER 199 N -1.32 -0.41 0.00 3.14 3.41 -0.38 -0.00 113.62 118.06 1pma n SER 199 Ca 0.00 0.86 0.00 0.00 -0.26 0.00 0.00 58.87 59.47 1pma n SER 199 Cb 0.00 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 63.79 1pma n SER 199 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1pma n SER 200 N -4.67 0.00 0.26 4.04 2.88 -1.06 -3.18 113.62 111.88 1pma n SER 200 Ca 0.03 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.75 1pma n SER 200 Cb 0.16 0.00 0.85 0.00 -0.75 0.00 0.00 64.21 64.48 1pma n SER 200 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1pma h LEU 201 N 0.00 0.00 -3.34 2.46 7.12 -1.43 -3.29 115.31 116.83 1pma h LEU 201 Ca 0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 1pma h LEU 201 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.13 1pma h LEU 201 CO 0.00 0.00 0.00 -0.62 -0.13 0.00 0.00 178.44 177.69 1pma n GLU 202 N -2.79 0.56 0.10 1.25 4.71 1.00 -3.16 120.64 122.31 1pma n GLU 202 Ca -0.01 0.00 -0.05 0.00 -0.01 0.00 0.00 57.16 57.09 1pma n GLU 202 Cb 0.14 -1.22 0.10 0.00 -1.01 0.00 0.00 31.44 29.45 1pma n GLU 202 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 1pma h GLU 203 N 2.22 0.14 -1.03 3.49 4.22 -1.75 -2.90 114.58 118.97 1pma h GLU 203 Ca 0.00 -0.11 -0.31 0.00 0.08 0.00 0.00 59.36 59.02 1pma h GLU 203 Cb 0.56 0.02 -0.18 0.00 0.50 0.00 0.00 28.75 29.65 1pma h GLU 203 CO 0.00 0.76 0.39 0.41 -2.18 0.00 0.00 179.01 178.39 1pma n GLY 204 N 0.42 3.51 5.05 1.92 0.00 -1.19 -4.97 105.19 109.92 1pma n GLY 204 Ca -0.02 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1pma n GLY 204 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1pma n GLU 205 N -0.42 0.00 -2.00 1.61 4.07 -1.10 -4.82 120.64 117.98 1pma n GLU 205 Ca 0.35 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 57.02 1pma n GLU 205 Cb 1.15 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 32.50 1pma n GLU 205 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 1pma s GLU 206 N 0.00 4.14 0.44 5.31 2.12 -1.26 -4.88 118.70 124.56 1pma s GLU 206 Ca 0.00 2.16 0.28 0.00 0.36 0.00 0.00 54.97 57.77 1pma s GLU 206 Cb 0.00 -4.00 0.95 0.00 0.26 0.00 0.00 34.13 31.34 1pma s GLU 206 CO 0.00 -0.90 1.81 1.25 -0.54 0.00 0.00 175.26 176.88 1pma h LEU 207 N 10.42 0.00 0.00 2.70 5.85 -1.97 -3.48 115.31 128.83 1pma h LEU 207 Ca -0.39 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.33 1pma h LEU 207 Cb 1.18 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1pma h LEU 207 CO 0.96 0.00 0.00 1.17 -0.34 0.00 0.00 178.44 180.23 1pma n LYS 208 N -2.88 0.00 -3.95 1.25 3.00 -1.26 -4.49 118.16 109.83 1pma n LYS 208 Ca 0.02 0.00 -0.34 0.00 -0.00 0.00 0.00 58.31 58.00 1pma n LYS 208 Cb 0.37 0.00 -0.14 0.00 0.00 0.00 0.00 35.03 35.26 1pma n LYS 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1pma s ALA 209 N -1.95 2.78 0.58 3.14 0.00 -1.25 -5.07 121.76 119.99 1pma s ALA 209 Ca 0.00 -1.92 -0.14 0.00 0.00 0.00 0.00 51.96 49.90 1pma s ALA 209 Cb 0.00 -1.88 -0.05 0.00 0.00 0.00 0.00 23.12 21.19 1pma s ALA 209 CO 0.00 -1.34 1.02 -2.14 0.00 0.00 0.00 175.76 173.30 1pma s PRO 210 N 1.16 3.61 -0.20 0.00 0.02 -1.26 -2.99 135.00 135.34 1pma s PRO 210 Ca -0.03 0.94 -0.04 0.00 0.02 0.00 0.00 61.00 61.88 1pma s PRO 210 Cb -0.20 -2.08 -0.02 0.00 0.02 0.00 0.00 34.50 32.22 1pma s PRO 210 CO -0.03 -0.56 -0.02 -2.00 -0.33 0.00 0.00 177.00 174.06 1pma s GLU 211 N -4.52 3.55 -0.02 5.54 2.12 -0.22 -4.83 118.70 120.31 1pma s GLU 211 Ca 0.58 -0.56 0.02 0.00 0.36 0.00 0.00 54.97 55.38 1pma s GLU 211 Cb -0.12 -3.03 -0.00 0.00 0.26 0.00 0.00 34.13 31.24 1pma s GLU 211 CO 0.42 -0.02 -0.08 -1.50 -0.54 0.00 0.00 175.26 173.54 1pma s ILE 212 N 1.05 0.71 0.02 -3.70 2.07 -1.26 -0.71 121.20 119.38 1pma s ILE 212 Ca 0.02 -0.34 -0.00 0.00 -1.41 0.00 0.00 60.65 58.91 1pma s ILE 212 Cb -0.14 -0.62 -0.02 0.00 0.13 0.00 0.00 42.46 41.81 1pma s ILE 212 CO 0.01 0.22 -0.02 0.00 -1.91 0.00 0.00 174.94 173.23 1pma s ALA 213 N 0.05 0.10 -0.03 1.50 0.00 0.32 -1.42 121.76 122.29 1pma s ALA 213 Ca -0.01 -0.52 -0.14 0.00 0.00 0.00 0.00 51.96 51.29 1pma s ALA 213 Cb -0.06 0.13 0.02 0.00 0.00 0.00 0.00 23.12 23.21 1pma s ALA 213 CO 0.00 -0.14 0.31 -1.54 0.00 0.00 0.00 175.76 174.39 1pma s SER 214 N -1.31 -0.21 0.00 0.00 1.04 0.16 0.11 113.70 113.50 1pma s SER 214 Ca -0.14 0.16 0.03 0.00 0.48 0.00 0.00 55.95 56.48 1pma s SER 214 Cb -0.09 0.36 -0.01 0.00 0.10 0.00 0.00 66.02 66.38 1pma s SER 214 CO -0.01 -0.40 -0.09 -0.51 0.98 0.00 0.00 173.24 173.21 1pma s ILE 215 N -1.11 0.69 0.10 -1.02 2.07 -0.11 -0.65 121.20 121.16 1pma s ILE 215 Ca -0.12 -0.50 0.09 0.00 -1.41 0.00 0.00 60.65 58.72 1pma s ILE 215 Cb -0.05 -0.61 -0.03 0.00 0.13 0.00 0.00 42.46 41.90 1pma s ILE 215 CO 0.04 0.11 -0.24 0.28 -1.91 0.00 0.00 174.94 173.21 1pma s THR 216 N -0.38 2.00 0.27 4.00 -1.32 -1.26 -0.57 115.64 118.37 1pma s THR 216 Ca 0.02 -1.56 -0.29 0.00 -1.21 0.00 0.00 61.69 58.65 1pma s THR 216 Cb -0.04 -1.77 -0.14 0.00 -1.51 0.00 0.00 72.50 69.03 1pma s THR 216 CO -0.00 0.11 0.99 0.55 -2.21 0.00 0.00 174.62 174.06 1pma n VAL 217 N 1.24 1.85 0.00 5.08 3.14 0.12 -2.30 118.33 127.45 1pma n VAL 217 Ca -0.18 -0.46 0.00 0.00 -2.96 0.00 0.00 64.34 60.74 1pma n VAL 217 Cb 0.53 -0.90 0.00 0.00 -1.06 0.00 0.00 33.84 32.41 1pma n VAL 217 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1pma n GLY 218 N 1.39 2.82 3.09 7.55 0.00 -1.26 -5.01 105.19 113.76 1pma n GLY 218 Ca 0.11 -0.11 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 1pma n GLY 218 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1pma n ASN 219 N 0.11 -0.27 -4.83 1.61 6.94 -0.97 -5.16 115.26 112.68 1pma n ASN 219 Ca 0.00 -3.09 -0.30 0.00 -0.02 0.00 0.00 54.58 51.18 1pma n ASN 219 Cb 0.00 1.46 0.08 0.00 -2.36 0.00 0.00 39.78 38.96 1pma n ASN 219 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1pma s LYS 220 N -3.33 2.32 0.58 -3.83 1.02 -1.26 -4.47 119.74 110.77 1pma s LYS 220 Ca 0.34 0.55 -0.20 0.00 0.02 0.00 0.00 55.97 56.68 1pma s LYS 220 Cb 0.02 -1.95 -0.03 0.00 -0.52 0.00 0.00 37.83 35.34 1pma s LYS 220 CO 0.24 -1.43 1.31 0.71 -0.92 0.00 0.00 175.35 175.25 1pma s TYR 221 N -3.24 2.25 -0.08 3.18 2.02 -0.76 -4.60 117.35 116.12 1pma s TYR 221 Ca 0.60 1.44 0.03 0.00 -0.37 0.00 0.00 57.07 58.76 1pma s TYR 221 Cb -0.13 -3.70 0.01 0.00 -0.40 0.00 0.00 41.96 37.74 1pma s TYR 221 CO 0.53 -2.75 -0.15 0.50 -1.57 0.00 0.00 175.55 172.10 1pma s ARG 222 N -3.12 2.10 -0.19 -0.62 3.52 0.17 -4.99 118.95 115.82 1pma s ARG 222 Ca 0.76 -0.54 -0.08 0.00 -0.13 0.00 0.00 55.73 55.74 1pma s ARG 222 Cb -0.38 -1.70 -0.04 0.00 -1.56 0.00 0.00 34.95 31.28 1pma s ARG 222 CO 0.42 0.04 0.08 0.42 -0.81 0.00 0.00 175.30 175.45 1pma s ILE 223 N 0.66 4.86 0.21 4.11 1.01 -1.26 -0.66 121.20 130.12 1pma s ILE 223 Ca -0.14 -0.01 -0.30 0.00 0.00 0.00 0.00 60.65 60.20 1pma s ILE 223 Cb -0.16 -3.21 -0.09 0.00 0.01 0.00 0.00 42.46 39.02 1pma s ILE 223 CO 0.04 0.44 1.24 -0.31 0.00 0.00 0.00 174.94 176.35 1pma s TYR 224 N 0.53 3.35 0.39 3.97 1.51 -0.51 -5.01 117.35 121.58 1pma s TYR 224 Ca 0.04 1.37 -0.18 0.00 -1.01 0.00 0.00 57.07 57.29 1pma s TYR 224 Cb -0.13 -3.50 -0.10 0.00 -0.11 0.00 0.00 41.96 38.13 1pma s TYR 224 CO 0.01 -1.45 0.86 0.16 -1.11 0.00 0.00 175.55 174.02 1pma s ASP 225 N 0.08 6.84 0.21 2.29 -4.77 -1.26 -4.77 116.67 115.28 1pma s ASP 225 Ca 0.53 1.50 -0.03 0.00 -3.30 0.00 0.00 52.55 51.26 1pma s ASP 225 Cb -0.34 -2.47 0.41 0.00 -1.09 0.00 0.00 42.92 39.43 1pma s ASP 225 CO 0.39 -0.32 1.10 1.67 0.70 0.00 0.00 175.17 178.71 1pma n GLN 226 N -0.64 -0.06 -0.04 2.11 7.27 -1.26 0.61 117.38 125.38 1pma n GLN 226 Ca 0.05 1.08 -0.12 0.00 0.07 0.00 0.00 57.00 58.08 1pma n GLN 226 Cb 0.54 -1.65 -0.07 0.00 2.41 0.00 0.00 30.24 31.46 1pma n GLN 226 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 1pma h GLU 227 N 0.00 0.22 -0.69 3.69 3.07 -1.98 -1.66 114.58 117.23 1pma h GLU 227 Ca 0.37 -0.08 0.05 0.00 -0.50 0.00 0.00 59.36 59.20 1pma h GLU 227 Cb 0.66 -0.01 -0.05 0.00 -0.84 0.00 0.00 28.75 28.51 1pma h GLU 227 CO -0.70 0.51 0.41 1.49 -1.40 0.00 0.00 179.01 179.32 1pma h GLU 228 N -0.10 0.75 -0.42 2.33 4.81 -0.19 -0.69 114.58 121.07 1pma h GLU 228 Ca 0.03 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.13 1pma h GLU 228 Cb 0.43 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1pma h GLU 228 CO 0.01 0.49 -0.07 -0.24 -0.73 0.00 0.00 179.01 178.48 1pma h VAL 229 N 0.77 1.27 -0.09 0.32 3.04 -1.12 -2.72 116.25 117.72 1pma h VAL 229 Ca 0.29 -1.15 0.03 0.00 -1.01 0.00 0.00 66.70 64.86 1pma h VAL 229 Cb 0.11 1.16 -0.00 0.00 -2.01 0.00 0.00 31.29 30.55 1pma h VAL 229 CO -0.15 0.39 0.07 0.50 -1.01 0.00 0.00 177.57 177.37 1pma h LYS 230 N 0.62 0.00 -0.52 4.17 3.64 -0.65 -0.53 116.57 123.30 1pma h LYS 230 Ca 0.11 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1pma h LYS 230 Cb 0.59 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.38 1pma h LYS 230 CO 0.04 0.00 0.35 -0.22 -2.27 0.00 0.00 179.45 177.34 1pma h LYS 231 N 0.00 0.69 0.00 1.90 3.64 -0.81 -2.13 116.57 119.86 1pma h LYS 231 Ca 0.04 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 1pma h LYS 231 Cb 0.18 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1pma h LYS 231 CO -0.00 0.46 -0.40 0.74 -2.27 0.00 0.00 179.45 177.98 1pma h PHE 232 N 0.71 0.00 0.00 1.91 -1.00 -1.26 -3.52 116.94 113.78 1pma h PHE 232 Ca 0.19 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.97 1pma h PHE 232 Cb -0.08 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.48 1pma h PHE 232 CO -0.04 0.33 0.00 -0.11 -1.61 0.00 0.00 178.31 176.88