#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 0.13 12.58 -7.23 -1.26 -4.83 120.40 119.78 1pma s VAL 14 Ca 0.00 -1.69 -0.30 0.00 -1.81 0.00 0.00 61.98 58.18 1pma s VAL 14 Cb 0.00 -2.45 -0.06 0.00 0.56 0.00 0.00 36.38 34.43 1pma s VAL 14 CO 0.00 0.00 0.97 -0.36 -0.31 0.00 0.00 175.10 175.40 1pma s PHE 15 N -3.72 3.82 0.61 2.82 0.08 -1.26 -4.38 117.98 115.95 1pma s PHE 15 Ca 0.31 1.80 -0.10 0.00 0.12 0.00 0.00 56.93 59.06 1pma s PHE 15 Cb 0.02 -3.06 -0.03 0.00 -0.57 0.00 0.00 43.02 39.38 1pma s PHE 15 CO 0.15 0.19 1.00 -1.54 -0.10 0.00 0.00 175.22 174.92 1pma s SER 16 N -0.14 6.11 0.00 1.36 1.04 -0.33 -4.89 113.70 116.85 1pma s SER 16 Ca 0.46 1.29 0.00 0.00 0.48 0.00 0.00 55.95 58.19 1pma s SER 16 Cb -0.24 -2.34 0.00 0.00 0.10 0.00 0.00 66.02 63.54 1pma s SER 16 CO 0.30 -0.90 0.87 -2.65 0.98 0.00 0.00 173.24 171.84 1pma n PRO 17 N -2.71 0.00 -0.17 4.02 -0.02 -1.26 -0.47 135.00 134.39 1pma n PRO 17 Ca 0.05 0.38 0.08 0.00 -2.02 0.00 0.00 63.50 61.99 1pma n PRO 17 Cb 0.55 -1.55 0.17 0.00 -0.02 0.00 0.00 33.50 32.65 1pma n PRO 17 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1pma n ASP 18 N -1.37 2.99 -0.70 2.55 5.75 -1.26 -5.00 116.55 119.51 1pma n ASP 18 Ca 0.00 -1.89 0.00 0.00 -0.01 0.00 0.00 54.79 52.89 1pma n ASP 18 Cb 0.05 -0.22 0.00 0.00 -1.03 0.00 0.00 41.12 39.92 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 0.93 0.75 3.08 6.12 0.00 0.38 -5.09 105.19 111.35 1pma n GLY 19 Ca 0.14 -0.59 -0.15 0.00 0.00 0.00 0.00 46.02 45.42 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 -4.53 0.61 -0.61 1.61 0.52 -1.25 -4.88 118.95 110.41 1pma s ARG 20 Ca 0.00 -0.76 -0.17 0.00 -0.52 0.00 0.00 55.73 54.28 1pma s ARG 20 Cb 0.00 -0.45 0.14 0.00 0.52 0.00 0.00 34.95 35.16 1pma s ARG 20 CO 0.00 0.09 0.62 -0.51 0.02 0.00 0.00 175.30 175.52 1pma s LEU 21 N -1.49 6.03 0.37 2.53 2.01 -1.26 -1.19 118.68 125.68 1pma s LEU 21 Ca -0.07 -1.85 0.08 0.00 0.01 0.00 0.00 54.13 52.30 1pma s LEU 21 Cb -0.09 -2.24 0.80 0.00 0.01 0.00 0.00 46.19 44.67 1pma s LEU 21 CO 0.01 -0.89 1.94 -0.26 1.01 0.00 0.00 176.35 178.16 1pma h PHE 22 N 8.79 0.72 -0.52 0.29 0.04 -1.98 -1.91 116.94 122.37 1pma h PHE 22 Ca -0.22 0.02 -0.04 0.00 2.80 0.00 0.00 57.97 60.53 1pma h PHE 22 Cb 1.08 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 38.97 1pma h PHE 22 CO 0.82 0.36 0.16 1.96 -0.60 0.00 0.00 178.31 181.01 1pma h GLN 23 N 0.69 0.77 -0.14 1.51 1.08 -1.91 -0.04 115.11 117.06 1pma h GLN 23 Ca 0.33 -0.13 -0.12 0.00 -1.45 0.00 0.00 58.65 57.28 1pma h GLN 23 Cb 0.39 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.68 1pma h GLN 23 CO -0.12 0.67 -0.42 -0.24 -0.95 0.00 0.00 178.83 177.77 1pma h VAL 24 N 0.75 1.31 0.50 -0.54 3.04 -1.77 -2.11 116.25 117.44 1pma h VAL 24 Ca 0.17 -1.57 -0.02 0.00 -1.01 0.00 0.00 66.70 64.27 1pma h VAL 24 Cb 0.22 1.67 0.00 0.00 -2.01 0.00 0.00 31.29 31.18 1pma h VAL 24 CO -0.01 0.48 -0.24 -0.33 -1.01 0.00 0.00 177.57 176.46 1pma h GLU 25 N 0.28 -0.65 -0.91 4.17 4.39 -0.87 -2.27 114.58 118.71 1pma h GLU 25 Ca 0.02 0.04 0.15 0.00 0.34 0.00 0.00 59.36 59.92 1pma h GLU 25 Cb 0.87 0.15 -0.07 0.00 -0.10 0.00 0.00 28.75 29.59 1pma h GLU 25 CO 0.07 -0.36 0.58 1.88 -1.16 0.00 0.00 179.01 180.03 1pma h TYR 26 N -0.88 0.83 -0.42 4.33 0.05 -1.00 0.10 116.97 119.98 1pma h TYR 26 Ca -0.07 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.73 1pma h TYR 26 Cb 0.60 -0.26 -0.02 0.00 1.01 0.00 0.00 36.73 38.06 1pma h TYR 26 CO -0.00 0.29 0.25 0.00 -1.05 0.00 0.00 178.16 177.65 1pma h ALA 27 N 1.60 0.53 -0.88 3.88 0.00 -1.20 -1.99 119.26 121.20 1pma h ALA 27 Ca 0.46 -0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.43 1pma h ALA 27 Cb 0.77 -0.17 -0.08 0.00 0.00 0.00 0.00 17.79 18.31 1pma h ALA 27 CO -0.22 0.03 0.51 0.00 0.00 0.00 0.00 179.25 179.57 1pma h ARG 28 N 0.55 0.79 -0.59 0.00 3.08 -0.21 -0.07 114.38 117.94 1pma h ARG 28 Ca 0.15 -0.05 0.12 0.00 0.07 0.00 0.00 59.98 60.27 1pma h ARG 28 Cb -0.00 -0.18 -0.10 0.00 0.08 0.00 0.00 29.97 29.77 1pma h ARG 28 CO -0.03 0.52 -0.03 0.93 -1.07 0.00 0.00 179.97 180.29 1pma h GLU 29 N 0.81 0.09 -0.75 0.04 4.39 -0.83 0.18 114.58 118.51 1pma h GLU 29 Ca 0.44 -0.01 0.13 0.00 0.34 0.00 0.00 59.36 60.26 1pma h GLU 29 Cb 0.47 -0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 29.05 1pma h GLU 29 CO -0.28 0.06 0.49 0.00 -1.16 0.00 0.00 179.01 178.12 1pma h ALA 30 N 1.54 1.98 0.00 3.43 0.00 -0.85 -0.52 119.26 124.85 1pma h ALA 30 Ca 0.30 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.16 1pma h ALA 30 Cb 0.48 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1pma h ALA 30 CO -0.52 -0.16 -0.22 -0.39 0.00 0.00 0.00 179.25 177.95 1pma h VAL 31 N 0.52 0.45 -0.44 0.00 -1.51 -0.54 -3.08 116.25 111.65 1pma h VAL 31 Ca 0.36 -1.33 -0.09 0.00 -1.23 0.00 0.00 66.70 64.41 1pma h VAL 31 Cb 0.68 1.97 -0.01 0.00 -2.13 0.00 0.00 31.29 31.80 1pma h VAL 31 CO -0.13 0.22 -0.07 0.11 -1.23 0.00 0.00 177.57 176.47 1pma h LYS 32 N 0.00 0.82 -0.08 5.19 1.57 -0.58 -2.87 116.57 120.63 1pma h LYS 32 Ca -0.00 -0.30 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 1pma h LYS 32 Cb 0.96 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.21 1pma h LYS 32 CO 0.03 0.92 0.00 1.63 -0.57 0.00 0.00 179.45 181.46 1pma n LYS 33 N -4.32 0.80 -2.85 3.15 5.02 -1.13 -2.57 118.16 116.26 1pma n LYS 33 Ca -0.00 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.09 1pma n LYS 33 Cb 0.35 -1.04 0.03 0.00 -0.02 0.00 0.00 35.03 34.35 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 -1.09 1.87 1.15 0.72 0.00 -1.08 -4.93 107.32 103.96 1pma s GLY 34 Ca 0.00 -1.61 -0.15 0.00 0.00 0.00 0.00 44.72 42.96 1pma s GLY 34 CO 0.00 -1.33 0.57 -1.26 0.00 0.00 0.00 173.10 171.08 1pma n SER 35 N -2.14 -2.04 -4.62 1.64 2.88 -1.26 -0.87 113.62 107.21 1pma n SER 35 Ca 0.09 -0.15 -0.34 0.00 -1.33 0.00 0.00 58.87 57.14 1pma n SER 35 Cb 0.60 -1.13 -0.10 0.00 -0.75 0.00 0.00 64.21 62.83 1pma n SER 35 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1pma s THR 36 N -2.33 4.34 0.14 2.46 -1.32 -1.26 -2.01 115.64 115.65 1pma s THR 36 Ca 0.63 -0.21 -0.10 0.00 -1.21 0.00 0.00 61.69 60.80 1pma s THR 36 Cb -0.20 -2.88 -0.00 0.00 -1.51 0.00 0.00 72.50 67.91 1pma s THR 36 CO 0.66 0.53 0.27 0.00 -2.21 0.00 0.00 174.62 173.87 1pma s ALA 37 N -0.16 -0.20 0.33 11.08 0.00 -0.22 -0.86 121.76 131.73 1pma s ALA 37 Ca 0.05 -0.69 -0.14 0.00 0.00 0.00 0.00 51.96 51.18 1pma s ALA 37 Cb -0.12 0.72 0.03 0.00 0.00 0.00 0.00 23.12 23.74 1pma s ALA 37 CO 0.02 -0.61 0.66 -0.48 0.00 0.00 0.00 175.76 175.36 1pma s LEU 38 N -2.91 0.20 -0.05 0.00 2.34 0.92 0.12 118.68 119.30 1pma s LEU 38 Ca 0.11 -1.07 -0.29 0.00 0.06 0.00 0.00 54.13 52.94 1pma s LEU 38 Cb 0.03 2.38 0.09 0.00 -0.56 0.00 0.00 46.19 48.14 1pma s LEU 38 CO -0.05 -1.45 0.80 -0.83 -1.06 0.00 0.00 176.35 173.76 1pma s GLY 39 N -3.06 -0.47 -0.02 -3.48 0.00 -0.14 -0.82 107.32 99.33 1pma s GLY 39 Ca 0.19 1.37 -0.21 0.00 0.00 0.00 0.00 44.72 46.06 1pma s GLY 39 CO 0.12 0.76 0.46 -3.16 0.00 0.00 0.00 173.10 171.28 1pma s MET 40 N -1.87 0.85 0.39 2.90 0.23 -0.69 -0.94 119.30 120.17 1pma s MET 40 Ca -0.04 -0.05 -0.20 0.00 -1.03 0.00 0.00 55.69 54.38 1pma s MET 40 Cb -0.00 0.39 -0.10 0.00 -1.53 0.00 0.00 34.83 33.58 1pma s MET 40 CO 0.01 -0.26 0.89 0.15 -2.03 0.00 0.00 175.02 173.78 1pma s LYS 41 N -1.44 4.19 0.00 3.16 1.02 0.29 -1.83 119.74 125.14 1pma s LYS 41 Ca -0.11 1.01 0.00 0.00 0.02 0.00 0.00 55.97 56.89 1pma s LYS 41 Cb -0.03 -2.30 0.00 0.00 -0.52 0.00 0.00 37.83 34.98 1pma s LYS 41 CO 0.05 0.05 0.00 1.97 -0.92 0.00 0.00 175.35 176.50 1pma n PHE 42 N -0.46 -0.01 0.00 3.18 1.16 -0.34 -4.85 117.46 116.15 1pma n PHE 42 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.64 1pma n PHE 42 Cb 0.53 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.40 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 -2.68 1.98 0.00 0.34 -3.52 120.51 113.63 1pma n ALA 43 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 1pma n ALA 43 Cb 0.00 0.01 0.04 0.00 0.00 0.00 0.00 19.45 19.50 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 -0.34 2.18 -0.07 0.00 4.05 -1.26 -4.97 115.26 114.86 1pma n ASN 44 Ca 0.00 -2.41 0.00 0.00 0.45 0.00 0.00 54.58 52.62 1pma n ASN 44 Cb 0.00 -0.46 0.00 0.00 1.23 0.00 0.00 39.78 40.55 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 -0.56 1.33 3.14 8.20 0.00 -1.23 0.29 105.19 116.36 1pma n GLY 45 Ca 0.14 -0.65 -0.10 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.29 0.12 0.04 1.61 0.11 -0.18 -1.20 120.40 118.62 1pma s VAL 46 Ca 0.00 -0.99 0.02 0.00 -2.93 0.00 0.00 61.98 58.08 1pma s VAL 46 Cb 0.00 -0.89 -0.02 0.00 -1.53 0.00 0.00 36.38 33.94 1pma s VAL 46 CO 0.00 -0.55 -0.08 -1.48 -3.33 0.00 0.00 175.10 169.66 1pma s LEU 47 N -2.08 2.24 0.08 2.54 2.34 -0.76 -1.64 118.68 121.40 1pma s LEU 47 Ca -0.05 -0.52 0.10 0.00 0.06 0.00 0.00 54.13 53.71 1pma s LEU 47 Cb -0.01 -0.21 -0.03 0.00 -0.56 0.00 0.00 46.19 45.37 1pma s LEU 47 CO -0.04 -0.17 -0.24 -0.22 -1.06 0.00 0.00 176.35 174.62 1pma s LEU 48 N -1.48 2.35 -0.22 1.48 2.96 0.52 -1.70 118.68 122.59 1pma s LEU 48 Ca -0.08 -0.62 -0.13 0.00 -0.22 0.00 0.00 54.13 53.08 1pma s LEU 48 Cb -0.09 -1.33 0.07 0.00 0.50 0.00 0.00 46.19 45.34 1pma s LEU 48 CO 0.01 0.22 0.55 -0.51 -1.32 0.00 0.00 176.35 175.30 1pma s ILE 49 N -0.95 -0.01 0.08 6.68 1.10 -0.00 -1.17 121.20 126.93 1pma s ILE 49 Ca 0.14 0.04 0.06 0.00 -0.51 0.00 0.00 60.65 60.38 1pma s ILE 49 Cb -0.10 -0.81 -0.03 0.00 0.15 0.00 0.00 42.46 41.67 1pma s ILE 49 CO 0.05 0.02 -0.16 -0.55 -2.11 0.00 0.00 174.94 172.19 1pma s SER 50 N 1.38 1.91 -0.53 4.50 0.15 0.38 -0.06 113.70 121.43 1pma s SER 50 Ca -0.09 -0.65 -0.26 0.00 0.70 0.00 0.00 55.95 55.66 1pma s SER 50 Cb -0.06 -0.07 0.03 0.00 -1.71 0.00 0.00 66.02 64.21 1pma s SER 50 CO -0.14 -0.05 1.03 -0.62 1.20 0.00 0.00 173.24 174.66 1pma s ASP 51 N -1.82 6.43 -1.12 5.45 2.15 -0.04 -0.51 116.67 127.21 1pma s ASP 51 Ca 0.01 -0.03 -0.18 0.00 0.43 0.00 0.00 52.55 52.77 1pma s ASP 51 Cb -0.10 -2.49 0.11 0.00 -0.30 0.00 0.00 42.92 40.15 1pma s ASP 51 CO 0.03 -1.27 1.43 -0.75 -0.17 0.00 0.00 175.17 174.44 1pma s LYS 52 N 4.26 3.84 -0.32 4.34 2.20 -1.19 -4.68 119.74 128.20 1pma s LYS 52 Ca 0.37 -1.96 -0.21 0.00 -0.36 0.00 0.00 55.97 53.81 1pma s LYS 52 Cb -0.10 -5.19 -0.00 0.00 -1.51 0.00 0.00 37.83 31.02 1pma s LYS 52 CO 0.24 -1.97 0.68 0.15 -0.36 0.00 0.00 175.35 174.09 1pma s LYS 53 N 3.13 3.86 0.23 4.03 1.02 -1.26 -4.02 119.74 126.72 1pma s LYS 53 Ca 0.43 0.32 0.07 0.00 0.02 0.00 0.00 55.97 56.82 1pma s LYS 53 Cb -0.01 -3.75 -0.04 0.00 -0.52 0.00 0.00 37.83 33.51 1pma s LYS 53 CO -0.02 -0.65 0.10 0.54 -0.92 0.00 0.00 175.35 174.39 1pma s VAL 54 N 2.75 4.07 0.00 3.17 0.11 -1.26 -5.11 120.40 124.14 1pma s VAL 54 Ca 0.27 -1.49 0.00 0.00 -2.93 0.00 0.00 61.98 57.84 1pma s VAL 54 Cb -0.14 -3.15 0.00 0.00 -1.53 0.00 0.00 36.38 31.56 1pma s VAL 54 CO 0.13 -0.28 0.00 -1.14 -3.33 0.00 0.00 175.10 170.48 1pma n ARG 55 N -0.79 0.00 -0.97 1.54 3.00 -1.26 -5.10 116.66 113.09 1pma n ARG 55 Ca -0.08 0.00 -0.31 0.00 -0.00 0.00 0.00 57.85 57.46 1pma n ARG 55 Cb 0.57 0.00 0.13 0.00 0.00 0.00 0.00 32.46 33.16 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 0.01 3.63 0.30 6.15 0.15 -1.26 -4.92 113.70 117.76 1pma s SER 56 Ca 0.00 2.05 0.16 0.00 0.70 0.00 0.00 55.95 58.85 1pma s SER 56 Cb 0.00 -2.55 0.29 0.00 -1.71 0.00 0.00 66.02 62.05 1pma s SER 56 CO 0.00 -2.63 1.54 0.03 1.20 0.00 0.00 173.24 173.39 1pma h ARG 57 N -1.49 0.00 0.00 5.44 3.08 -2.07 -3.21 114.38 116.12 1pma h ARG 57 Ca -0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.62 1pma h ARG 57 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 1pma h ARG 57 CO 0.46 0.51 0.00 1.28 -1.07 0.00 0.00 179.97 181.15 1pma n LEU 58 N -3.37 0.00 -4.79 3.04 4.32 -1.26 -4.76 117.00 110.18 1pma n LEU 58 Ca 0.01 0.29 -0.37 0.00 -0.02 0.00 0.00 56.01 55.92 1pma n LEU 58 Cb 0.67 -0.29 -0.06 0.00 -1.62 0.00 0.00 43.42 42.12 1pma n LEU 58 CO 0.40 -0.18 0.53 -0.63 -1.22 0.00 0.00 177.39 176.29 1pma s ILE 59 N -2.58 4.38 -1.01 -0.08 -1.09 -1.22 -4.95 121.20 114.65 1pma s ILE 59 Ca 0.11 1.59 -0.08 0.00 -2.23 0.00 0.00 60.65 60.04 1pma s ILE 59 Cb 0.08 -3.97 -0.13 0.00 -1.58 0.00 0.00 42.46 36.86 1pma s ILE 59 CO 0.18 0.23 3.15 -0.62 -1.23 0.00 0.00 174.94 176.65 1pma n GLU 60 N 0.78 3.14 0.00 2.79 -0.58 -1.26 -4.97 120.64 120.55 1pma n GLU 60 Ca -0.01 -1.88 0.00 0.00 -0.42 0.00 0.00 57.16 54.85 1pma n GLU 60 Cb 0.50 -2.49 0.00 0.00 -0.57 0.00 0.00 31.44 28.88 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 2.99 0.00 -0.33 3.49 -0.00 -1.26 -1.60 117.38 120.67 1pma n GLN 61 Ca 0.65 0.00 0.27 0.00 -0.00 0.00 0.00 57.00 57.92 1pma n GLN 61 Cb 0.48 0.00 0.44 0.00 -0.00 0.00 0.00 30.24 31.16 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 0.51 0.10 -0.19 2.61 2.85 -1.26 -1.15 115.26 118.73 1pma n ASN 62 Ca 0.00 0.80 0.30 0.00 -0.11 0.00 0.00 54.58 55.57 1pma n ASN 62 Cb 0.00 -0.39 0.72 0.00 1.24 0.00 0.00 39.78 41.34 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 -0.84 1.20 0.02 -1.72 -2.02 113.55 110.20 1pma h SER 63 Ca 0.56 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.92 1pma h SER 63 Cb 1.91 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 64.34 1pma h SER 63 CO -0.22 0.00 1.58 0.00 -1.14 0.00 0.00 176.83 177.05 1pma n ILE 64 N -3.99 4.21 -2.03 3.27 3.06 -0.30 -4.96 119.36 118.62 1pma n ILE 64 Ca 0.20 -3.31 -0.42 0.00 -2.50 0.00 0.00 62.75 56.72 1pma n ILE 64 Cb 1.08 -1.97 -0.03 0.00 0.54 0.00 0.00 39.64 39.26 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 -0.66 4.26 -0.21 9.51 0.41 -0.76 -4.91 118.70 126.34 1pma s GLU 65 Ca 0.59 2.24 0.09 0.00 -0.41 0.00 0.00 54.97 57.49 1pma s GLU 65 Cb 0.27 -3.23 -0.22 0.00 -1.78 0.00 0.00 34.13 29.17 1pma s GLU 65 CO -0.12 -0.55 -0.00 1.63 -0.49 0.00 0.00 175.26 175.73 1pma n LYS 66 N 4.11 0.67 -3.04 1.61 5.02 -1.26 -4.86 118.16 120.41 1pma n LYS 66 Ca 0.13 0.09 -0.40 0.00 -2.02 0.00 0.00 58.31 56.11 1pma n LYS 66 Cb 0.40 -1.55 -0.05 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 -2.51 4.98 0.06 -0.18 1.01 -1.26 -4.06 121.20 119.24 1pma s ILE 67 Ca -0.21 1.35 0.07 0.00 0.00 0.00 0.00 60.65 61.86 1pma s ILE 67 Cb 0.07 -4.01 -0.03 0.00 0.01 0.00 0.00 42.46 38.50 1pma s ILE 67 CO 0.73 0.10 -0.20 -1.10 0.00 0.00 0.00 174.94 174.46 1pma s GLN 68 N 1.89 1.27 0.03 2.79 -0.21 -0.20 -5.00 119.66 120.23 1pma s GLN 68 Ca 0.32 -1.00 -0.15 0.00 0.02 0.00 0.00 55.36 54.56 1pma s GLN 68 Cb -0.16 -1.42 -0.06 0.00 1.00 0.00 0.00 33.01 32.37 1pma s GLN 68 CO 0.11 0.35 0.44 -0.51 -2.12 0.00 0.00 175.29 173.57 1pma s LEU 69 N -1.40 4.47 -0.18 2.90 1.43 -1.26 -0.75 118.68 123.88 1pma s LEU 69 Ca 0.07 1.01 0.15 0.00 -1.03 0.00 0.00 54.13 54.33 1pma s LEU 69 Cb -0.09 -2.70 -0.22 0.00 0.03 0.00 0.00 46.19 43.21 1pma s LEU 69 CO 0.02 0.30 0.04 -0.38 0.23 0.00 0.00 176.35 176.56 1pma n ILE 70 N 1.69 1.26 -3.59 -0.59 5.41 -0.09 -4.94 119.36 118.51 1pma n ILE 70 Ca -0.12 -0.75 -0.08 0.00 1.00 0.00 0.00 62.75 62.80 1pma n ILE 70 Cb 0.52 -0.59 -0.05 0.00 -0.71 0.00 0.00 39.64 38.82 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 -5.33 -0.27 0.56 4.38 2.15 -0.93 -4.80 116.67 112.43 1pma s ASP 71 Ca -0.11 0.26 0.26 0.00 0.43 0.00 0.00 52.55 53.39 1pma s ASP 71 Cb 0.06 0.22 0.89 0.00 -0.30 0.00 0.00 42.92 43.79 1pma s ASP 71 CO 0.73 -0.26 1.22 0.47 -0.17 0.00 0.00 175.17 177.16 1pma n ASP 72 N 0.58 0.00 -0.49 -0.34 8.00 -1.26 0.36 116.55 123.40 1pma n ASP 72 Ca -0.07 0.72 0.05 0.00 0.71 0.00 0.00 54.79 56.20 1pma n ASP 72 Cb 0.58 -0.25 0.10 0.00 -0.02 0.00 0.00 41.12 41.53 1pma n ASP 72 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1pma n TYR 73 N -3.15 0.25 -3.71 1.24 4.02 -1.26 -1.42 117.16 113.13 1pma n TYR 73 Ca 0.23 -0.31 -0.11 0.00 -0.01 0.00 0.00 57.90 57.70 1pma n TYR 73 Cb 1.46 -0.02 -0.11 0.00 -0.02 0.00 0.00 39.34 40.65 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 -0.93 -0.02 0.17 -0.72 0.11 0.16 -2.74 120.40 116.42 1pma s VAL 74 Ca 0.17 0.09 0.01 0.00 -2.93 0.00 0.00 61.98 59.32 1pma s VAL 74 Cb 0.10 -0.54 -0.04 0.00 -1.53 0.00 0.00 36.38 34.36 1pma s VAL 74 CO 0.13 0.04 0.02 0.00 -3.33 0.00 0.00 175.10 171.95 1pma s ALA 75 N 1.16 1.25 0.04 1.54 0.00 0.10 -0.91 121.76 124.94 1pma s ALA 75 Ca -0.08 -1.57 -0.06 0.00 0.00 0.00 0.00 51.96 50.24 1pma s ALA 75 Cb -0.08 0.63 -0.01 0.00 0.00 0.00 0.00 23.12 23.66 1pma s ALA 75 CO -0.10 -0.36 0.12 0.00 0.00 0.00 0.00 175.76 175.42 1pma s ALA 76 N -3.75 -0.14 0.10 0.00 0.00 0.07 -0.47 121.76 117.57 1pma s ALA 76 Ca 0.24 -0.49 0.07 0.00 0.00 0.00 0.00 51.96 51.79 1pma s ALA 76 Cb 0.06 0.26 -0.03 0.00 0.00 0.00 0.00 23.12 23.41 1pma s ALA 76 CO 0.04 -0.33 -0.19 0.54 0.00 0.00 0.00 175.76 175.82 1pma s VAL 77 N -2.59 1.52 0.23 0.00 0.11 -0.65 -1.03 120.40 117.99 1pma s VAL 77 Ca -0.05 -1.49 0.03 0.00 -2.93 0.00 0.00 61.98 57.54 1pma s VAL 77 Cb -0.01 -1.42 -0.05 0.00 -1.53 0.00 0.00 36.38 33.37 1pma s VAL 77 CO -0.04 -0.13 0.02 0.28 -3.33 0.00 0.00 175.10 171.90 1pma s THR 78 N -1.26 0.88 -0.21 5.04 -1.32 -1.26 -1.24 115.64 116.28 1pma s THR 78 Ca 0.04 -2.01 -0.17 0.00 -1.21 0.00 0.00 61.69 58.34 1pma s THR 78 Cb -0.10 -2.38 0.06 0.00 -1.51 0.00 0.00 72.50 68.57 1pma s THR 78 CO 0.04 -0.27 0.55 -0.55 -2.21 0.00 0.00 174.62 172.17 1pma s SER 79 N -3.29 -0.62 0.00 8.08 0.15 0.02 -4.91 113.70 113.12 1pma s SER 79 Ca 0.30 1.13 0.00 0.00 0.70 0.00 0.00 55.95 58.08 1pma s SER 79 Cb 0.06 1.10 0.00 0.00 -1.71 0.00 0.00 66.02 65.47 1pma s SER 79 CO 0.09 -0.20 0.00 0.61 1.20 0.00 0.00 173.24 174.94 1pma n GLY 80 N 3.32 0.60 3.61 9.45 0.00 -1.26 -1.00 105.19 119.90 1pma n GLY 80 Ca -0.17 -1.75 -0.43 0.00 0.00 0.00 0.00 46.02 43.68 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 3.60 0.20 0.99 2.01 0.37 -4.86 118.68 120.99 1pma s LEU 81 Ca 0.00 1.91 -0.19 0.00 0.01 0.00 0.00 54.13 55.86 1pma s LEU 81 Cb 0.00 -3.52 0.17 0.00 0.01 0.00 0.00 46.19 42.85 1pma s LEU 81 CO 0.00 -1.79 1.58 1.62 1.01 0.00 0.00 176.35 178.77 1pma h VAL 82 N 6.87 0.12 0.14 -1.59 3.04 -1.95 -1.77 116.25 121.11 1pma h VAL 82 Ca -0.41 0.00 0.02 0.00 -1.01 0.00 0.00 66.70 65.30 1pma h VAL 82 Cb 1.23 0.12 -0.04 0.00 -2.01 0.00 0.00 31.29 30.59 1pma h VAL 82 CO 0.97 0.00 -0.32 0.00 -1.01 0.00 0.00 177.57 177.21 1pma h ALA 83 N 1.14 -0.56 -0.66 3.17 0.00 -1.98 -1.14 119.26 119.23 1pma h ALA 83 Ca 0.27 -0.06 0.13 0.00 0.00 0.00 0.00 54.91 55.25 1pma h ALA 83 Cb 0.57 0.51 -0.09 0.00 0.00 0.00 0.00 17.79 18.78 1pma h ALA 83 CO -0.78 -0.87 0.18 -0.44 0.00 0.00 0.00 179.25 177.33 1pma h ASP 84 N -0.56 0.07 -0.24 0.00 5.19 -1.80 -0.02 116.42 119.06 1pma h ASP 84 Ca 0.02 0.12 0.05 0.00 -0.62 0.00 0.00 57.03 56.60 1pma h ASP 84 Cb 0.58 0.14 -0.05 0.00 0.18 0.00 0.00 39.33 40.18 1pma h ASP 84 CO -0.17 0.03 -0.08 0.00 -3.12 0.00 0.00 179.24 175.89 1pma h ALA 85 N 1.51 0.13 0.43 3.45 0.00 -0.65 0.73 119.26 124.87 1pma h ALA 85 Ca 0.35 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.35 1pma h ALA 85 Cb 0.54 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 1pma h ALA 85 CO -0.42 -0.49 -0.47 -0.09 0.00 0.00 0.00 179.25 177.77 1pma h ARG 86 N -0.03 -0.89 -0.87 0.00 2.43 0.18 0.12 114.38 115.31 1pma h ARG 86 Ca 0.12 0.06 0.11 0.00 -0.81 0.00 0.00 59.98 59.46 1pma h ARG 86 Cb 0.22 0.20 -0.06 0.00 -0.42 0.00 0.00 29.97 29.91 1pma h ARG 86 CO -0.27 -0.60 0.56 -0.24 -1.51 0.00 0.00 179.97 177.92 1pma h VAL 87 N -0.93 0.92 -0.44 0.20 3.04 -0.95 0.55 116.25 118.65 1pma h VAL 87 Ca -0.05 -0.27 -0.10 0.00 -1.01 0.00 0.00 66.70 65.27 1pma h VAL 87 Cb 0.82 0.06 -0.02 0.00 -2.01 0.00 0.00 31.29 30.14 1pma h VAL 87 CO -0.09 0.15 -0.12 0.25 -1.01 0.00 0.00 177.57 176.75 1pma h LEU 88 N 0.80 0.79 0.02 3.16 5.85 -0.29 -2.39 115.31 123.24 1pma h LEU 88 Ca 0.41 -0.24 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1pma h LEU 88 Cb 0.51 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.32 1pma h LEU 88 CO -0.18 0.92 -0.01 0.58 -0.34 0.00 0.00 178.44 179.42 1pma h VAL 89 N 0.72 1.18 -0.74 1.05 2.07 0.15 -2.34 116.25 118.32 1pma h VAL 89 Ca 0.12 -0.59 0.08 0.00 0.82 0.00 0.00 66.70 67.13 1pma h VAL 89 Cb 0.61 1.57 -0.07 0.00 -1.52 0.00 0.00 31.29 31.88 1pma h VAL 89 CO 0.04 0.15 0.41 0.44 0.02 0.00 0.00 177.57 178.63 1pma h ASP 90 N -0.27 0.59 -0.22 0.57 3.32 -1.27 -0.09 116.42 119.04 1pma h ASP 90 Ca -0.00 0.04 0.06 0.00 0.02 0.00 0.00 57.03 57.15 1pma h ASP 90 Cb 0.26 -0.07 -0.07 0.00 0.22 0.00 0.00 39.33 39.68 1pma h ASP 90 CO 0.00 0.36 -0.22 0.15 -1.72 0.00 0.00 179.24 177.81 1pma h PHE 91 N 0.72 -0.59 -0.63 4.55 3.04 -1.30 0.33 116.94 123.07 1pma h PHE 91 Ca 0.35 0.04 0.07 0.00 3.98 0.00 0.00 57.97 62.41 1pma h PHE 91 Cb 0.28 0.29 -0.04 0.00 2.56 0.00 0.00 35.95 39.05 1pma h PHE 91 CO -0.08 -0.30 0.42 0.00 -2.02 0.00 0.00 178.31 176.33 1pma h ALA 92 N 0.82 1.86 0.73 2.41 0.00 -0.67 -0.33 119.26 124.07 1pma h ALA 92 Ca 0.13 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1pma h ALA 92 Cb 0.44 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.10 1pma h ALA 92 CO -0.36 0.03 -0.35 0.00 0.00 0.00 0.00 179.25 178.57 1pma h ARG 93 N 0.56 -0.95 -0.70 0.00 3.08 0.14 -0.33 114.38 116.18 1pma h ARG 93 Ca 0.28 0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.36 1pma h ARG 93 Cb 0.37 0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.60 1pma h ARG 93 CO -0.08 -0.61 0.31 -0.84 -1.07 0.00 0.00 179.97 177.67 1pma h ILE 94 N -1.06 1.24 -0.79 2.04 3.07 -0.88 -1.68 117.51 119.45 1pma h ILE 94 Ca -0.10 -0.72 0.05 0.00 1.55 0.00 0.00 64.86 65.64 1pma h ILE 94 Cb 0.77 0.40 -0.05 0.00 -0.27 0.00 0.00 36.82 37.68 1pma h ILE 94 CO 0.16 0.29 0.52 -1.28 -1.05 0.00 0.00 178.15 176.80 1pma h SER 95 N 0.99 0.81 -0.48 2.16 0.87 -1.02 0.23 113.55 117.11 1pma h SER 95 Ca 0.24 -0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.74 1pma h SER 95 Cb 0.17 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 61.93 1pma h SER 95 CO -0.02 0.54 0.08 0.00 -0.53 0.00 0.00 176.83 176.90 1pma h ALA 96 N 1.55 0.63 -0.72 6.23 0.00 -0.17 -2.74 119.26 124.04 1pma h ALA 96 Ca 0.32 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1pma h ALA 96 Cb 0.12 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1pma h ALA 96 CO -0.10 0.36 0.42 1.96 0.00 0.00 0.00 179.25 181.89 1pma h GLN 97 N 0.66 0.99 -0.05 0.00 1.08 -0.49 -2.72 115.11 114.58 1pma h GLN 97 Ca 0.15 -0.10 0.04 0.00 -1.45 0.00 0.00 58.65 57.29 1pma h GLN 97 Cb 0.38 -0.20 -0.06 0.00 -0.05 0.00 0.00 27.48 27.55 1pma h GLN 97 CO 0.01 0.71 -0.34 1.96 -0.95 0.00 0.00 178.83 180.22 1pma h GLN 98 N 0.99 -0.45 -0.80 1.46 4.20 -0.33 -0.12 115.11 120.07 1pma h GLN 98 Ca 0.26 0.03 0.08 0.00 0.06 0.00 0.00 58.65 59.08 1pma h GLN 98 Cb -0.01 0.10 -0.07 0.00 0.30 0.00 0.00 27.48 27.80 1pma h GLN 98 CO -0.05 -0.30 0.47 1.49 -0.67 0.00 0.00 178.83 179.77 1pma h GLU 99 N -0.46 0.79 -0.43 1.46 4.81 -1.29 -1.91 114.58 117.55 1pma h GLU 99 Ca 0.07 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.29 1pma h GLU 99 Cb 0.57 -0.18 -0.04 0.00 0.63 0.00 0.00 28.75 29.74 1pma h GLU 99 CO -0.31 0.53 0.22 0.87 -0.73 0.00 0.00 179.01 179.59 1pma h LYS 100 N 0.82 0.43 -0.01 1.92 1.57 -1.07 0.14 116.57 120.37 1pma h LYS 100 Ca 0.37 -0.03 -0.11 0.00 -1.87 0.00 0.00 60.65 59.02 1pma h LYS 100 Cb 0.27 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1pma h LYS 100 CO -0.21 0.29 -0.49 -0.24 -0.57 0.00 0.00 179.45 178.22 1pma h VAL 101 N 0.45 1.35 0.01 0.50 3.04 -0.33 0.41 116.25 121.67 1pma h VAL 101 Ca 0.19 -1.70 -0.15 0.00 -1.01 0.00 0.00 66.70 64.02 1pma h VAL 101 Cb 0.08 1.90 -0.02 0.00 -2.01 0.00 0.00 31.29 31.24 1pma h VAL 101 CO -0.12 0.49 -0.83 0.00 -1.01 0.00 0.00 177.57 176.09 1pma h THR 102 N 0.02 1.23 0.00 3.17 1.03 -1.12 -3.39 112.91 113.85 1pma h THR 102 Ca -0.00 -2.25 0.00 0.00 -0.01 0.00 0.00 66.41 64.15 1pma h THR 102 Cb 0.88 2.66 0.00 0.00 -1.07 0.00 0.00 68.15 70.62 1pma h THR 102 CO 0.07 0.44 -1.01 -1.22 -0.01 0.00 0.00 175.52 173.78 1pma n TYR 103 N -4.46 0.84 -0.59 0.00 4.01 0.01 -4.96 117.16 112.00 1pma n TYR 103 Ca -0.24 0.24 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1pma n TYR 103 Cb 0.63 -0.87 0.00 0.00 -0.31 0.00 0.00 39.34 38.78 1pma n TYR 103 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1pma n GLY 104 N 1.21 0.79 3.65 2.72 0.00 0.14 -5.00 105.19 108.70 1pma n GLY 104 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.96 -0.23 -1.21 1.61 0.15 -1.20 -4.92 113.70 104.94 1pma s SER 105 Ca 0.00 0.42 -0.17 0.00 0.70 0.00 0.00 55.95 56.90 1pma s SER 105 Cb 0.00 0.64 0.10 0.00 -1.71 0.00 0.00 66.02 65.05 1pma s SER 105 CO 0.00 -0.07 1.56 -0.22 1.20 0.00 0.00 173.24 175.71 1pma s LEU 106 N 0.45 4.25 0.06 3.45 2.96 -1.26 -4.65 118.68 123.93 1pma s LEU 106 Ca 0.01 -2.45 -0.28 0.00 -0.22 0.00 0.00 54.13 51.19 1pma s LEU 106 Cb -0.04 -2.51 -0.17 0.00 0.50 0.00 0.00 46.19 43.96 1pma s LEU 106 CO -0.12 -1.08 1.54 1.62 -1.32 0.00 0.00 176.35 176.99 1pma h VAL 107 N 5.48 0.61 -3.20 1.68 3.04 -1.97 -3.42 116.25 118.47 1pma h VAL 107 Ca 0.35 -0.18 -0.67 0.00 -1.01 0.00 0.00 66.70 65.19 1pma h VAL 107 Cb 0.90 0.71 -0.32 0.00 -2.01 0.00 0.00 31.29 30.56 1pma h VAL 107 CO 1.36 0.04 -0.83 0.21 -1.01 0.00 0.00 177.57 177.34 1pma s ASN 108 N -4.80 3.45 0.35 3.17 3.84 -1.26 -1.75 114.94 117.94 1pma s ASN 108 Ca -0.15 -0.55 0.10 0.00 0.21 0.00 0.00 52.86 52.46 1pma s ASN 108 Cb 0.04 -1.53 0.64 0.00 -0.55 0.00 0.00 41.25 39.84 1pma s ASN 108 CO 0.61 0.04 1.80 -0.29 -2.79 0.00 0.00 177.10 176.46 1pma h ILE 109 N 5.81 1.27 -0.89 -5.21 2.10 -1.97 -2.91 117.51 115.71 1pma h ILE 109 Ca -0.39 -1.29 0.21 0.00 1.08 0.00 0.00 64.86 64.47 1pma h ILE 109 Cb 1.17 1.62 -0.06 0.00 -1.09 0.00 0.00 36.82 38.45 1pma h ILE 109 CO 0.60 0.38 0.59 -0.08 -1.08 0.00 0.00 178.15 178.56 1pma h GLU 110 N 0.10 0.36 -0.41 2.19 4.81 -1.99 0.39 114.58 120.04 1pma h GLU 110 Ca 0.01 -0.02 -0.14 0.00 -0.13 0.00 0.00 59.36 59.08 1pma h GLU 110 Cb 0.67 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 1pma h GLU 110 CO 0.05 0.24 -0.28 -0.97 -0.73 0.00 0.00 179.01 177.32 1pma h ASN 111 N 0.37 0.95 0.08 1.04 -0.73 -1.95 -1.97 115.58 113.38 1pma h ASN 111 Ca 0.46 -0.43 0.02 0.00 1.87 0.00 0.00 56.30 58.22 1pma h ASN 111 Cb 1.20 -0.27 -0.03 0.00 0.27 0.00 0.00 38.32 39.49 1pma h ASN 111 CO -0.16 1.18 -0.23 0.25 -0.37 0.00 0.00 177.43 178.10 1pma h LEU 112 N 0.73 -0.65 -1.08 0.34 5.85 -1.04 -1.31 115.31 118.15 1pma h LEU 112 Ca 0.08 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 1pma h LEU 112 Cb 0.86 0.25 -0.04 0.00 0.37 0.00 0.00 40.66 42.11 1pma h LEU 112 CO 0.08 -0.31 0.48 1.62 -0.34 0.00 0.00 178.44 179.96 1pma h VAL 113 N -0.40 1.23 -0.62 1.05 3.04 -1.51 -1.79 116.25 117.24 1pma h VAL 113 Ca 0.04 -0.53 0.06 0.00 -1.01 0.00 0.00 66.70 65.26 1pma h VAL 113 Cb 0.44 0.10 -0.06 0.00 -2.01 0.00 0.00 31.29 29.77 1pma h VAL 113 CO -0.15 0.25 0.32 0.11 -1.01 0.00 0.00 177.57 177.08 1pma h LYS 114 N 1.13 0.57 -0.40 4.17 1.57 -0.54 0.66 116.57 123.73 1pma h LYS 114 Ca 0.29 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 59.03 1pma h LYS 114 Cb -0.02 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 1pma h LYS 114 CO -0.05 0.38 0.21 -0.09 -0.57 0.00 0.00 179.45 179.33 1pma h ARG 115 N 0.59 0.56 -0.10 3.15 2.43 -0.39 0.41 114.38 121.03 1pma h ARG 115 Ca 0.28 -0.07 -0.09 0.00 -0.81 0.00 0.00 59.98 59.29 1pma h ARG 115 Cb 0.21 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1pma h ARG 115 CO -0.20 0.46 -0.34 -0.24 -1.51 0.00 0.00 179.97 178.14 1pma h VAL 116 N 0.51 1.28 0.00 0.20 3.04 -1.24 -0.98 116.25 119.06 1pma h VAL 116 Ca 0.14 -1.33 -0.00 0.00 -1.01 0.00 0.00 66.70 64.50 1pma h VAL 116 Cb 0.07 1.58 0.00 0.00 -2.01 0.00 0.00 31.29 30.93 1pma h VAL 116 CO -0.02 0.40 -0.00 0.00 -1.01 0.00 0.00 177.57 176.93 1pma h ALA 117 N 1.47 -0.01 -0.83 3.17 0.00 -0.12 -1.80 119.26 121.14 1pma h ALA 117 Ca 0.02 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1pma h ALA 117 Cb 0.70 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 1pma h ALA 117 CO 0.05 -0.46 0.55 -0.44 0.00 0.00 0.00 179.25 178.95 1pma h ASP 118 N -0.10 0.90 -0.60 0.00 5.19 -0.60 0.13 116.42 121.34 1pma h ASP 118 Ca -0.00 -0.01 0.06 0.00 -0.62 0.00 0.00 57.03 56.46 1pma h ASP 118 Cb 0.09 -0.21 -0.06 0.00 0.18 0.00 0.00 39.33 39.34 1pma h ASP 118 CO 0.00 0.63 0.31 -0.61 -3.12 0.00 0.00 179.24 176.44 1pma h GLN 119 N 1.05 0.55 -0.34 3.56 -0.00 -0.51 -1.18 115.11 118.24 1pma h GLN 119 Ca 0.32 -0.03 -0.11 0.00 -0.00 0.00 0.00 58.65 58.83 1pma h GLN 119 Cb -0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 27.48 27.34 1pma h GLN 119 CO -0.09 0.36 -0.21 0.52 0.00 0.00 0.00 178.83 179.42 1pma h MET 120 N 0.57 0.75 -0.88 1.69 2.86 -0.20 -3.12 114.93 116.59 1pma h MET 120 Ca 0.28 -0.34 0.09 0.00 -2.06 0.00 0.00 59.70 57.66 1pma h MET 120 Cb 0.22 -0.01 -0.06 0.00 0.06 0.00 0.00 31.60 31.80 1pma h MET 120 CO -0.20 0.96 0.57 0.37 1.06 0.00 0.00 176.91 179.67 1pma h GLN 121 N 0.52 0.88 -0.99 1.72 -0.00 -0.26 -2.48 115.11 114.51 1pma h GLN 121 Ca 0.07 -0.05 0.11 0.00 -0.00 0.00 0.00 58.65 58.78 1pma h GLN 121 Cb 0.76 -0.20 -0.08 0.00 0.00 0.00 0.00 27.48 27.96 1pma h GLN 121 CO 0.06 0.58 0.63 1.96 0.00 0.00 0.00 178.83 182.06 1pma h GLN 122 N 0.91 0.96 0.00 1.69 4.20 -1.17 -0.39 115.11 121.31 1pma h GLN 122 Ca 0.40 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 59.05 1pma h GLN 122 Cb 0.35 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1pma h GLN 122 CO -0.16 0.64 0.00 1.88 -0.67 0.00 0.00 178.83 180.51 1pma h TYR 123 N 0.99 0.00 0.00 2.96 -1.99 -1.57 -0.52 116.97 116.85 1pma h TYR 123 Ca 0.48 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 61.19 1pma h TYR 123 Cb 0.45 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.18 1pma h TYR 123 CO -0.00 0.00 -0.09 1.15 -0.00 0.00 0.00 178.16 179.21 1pma h THR 124 N 0.00 0.26 0.00 -2.88 2.02 -1.08 -3.36 112.91 107.87 1pma h THR 124 Ca 0.00 -0.72 0.00 0.00 0.77 0.00 0.00 66.41 66.46 1pma h THR 124 Cb 0.44 1.57 0.00 0.00 -1.74 0.00 0.00 68.15 68.42 1pma h THR 124 CO 0.00 0.09 -0.32 0.00 0.37 0.00 0.00 175.52 175.66 1pma n GLN 125 N -3.26 3.40 -0.83 6.66 10.64 -1.05 -4.85 117.38 128.08 1pma n GLN 125 Ca 0.00 0.00 -0.12 0.00 -1.83 0.00 0.00 57.00 55.05 1pma n GLN 125 Cb 0.33 -0.59 -0.13 0.00 -0.86 0.00 0.00 30.24 28.99 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 -0.57 0.18 -0.01 2.61 4.01 -0.23 -4.95 117.16 118.20 1pma n TYR 126 Ca 0.00 -1.34 0.00 0.00 -0.16 0.00 0.00 57.90 56.40 1pma n TYR 126 Cb 0.00 -1.44 0.00 0.00 -0.31 0.00 0.00 39.34 37.59 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 2.69 3.02 3.19 2.72 0.00 -1.26 -4.47 105.19 111.08 1pma n GLY 127 Ca 0.37 -0.03 -0.20 0.00 0.00 0.00 0.00 46.02 46.16 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 0.33 3.64 -0.02 0.00 -1.26 -4.59 105.19 103.30 1pma n GLY 128 Ca 0.00 -0.41 -0.03 0.00 0.00 0.00 0.00 46.02 45.58 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 4.78 0.00 0.25 1.61 0.11 -1.26 -5.16 120.40 120.72 1pma s VAL 129 Ca 0.31 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 59.06 1pma s VAL 129 Cb 0.07 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.83 1pma s VAL 129 CO 0.16 0.00 1.06 -0.60 -3.33 0.00 0.00 175.10 172.38 1pma s ARG 130 N 1.12 4.69 0.66 1.54 3.52 -1.26 -4.91 118.95 124.31 1pma s ARG 130 Ca -0.07 1.70 -0.17 0.00 -0.13 0.00 0.00 55.73 57.07 1pma s ARG 130 Cb -0.04 -3.23 0.00 0.00 -1.56 0.00 0.00 34.95 30.12 1pma s ARG 130 CO -0.13 0.27 1.20 -2.14 -0.81 0.00 0.00 175.30 173.69 1pma s PRO 131 N -1.16 2.56 -0.21 5.12 0.02 -1.26 -4.93 135.00 135.15 1pma s PRO 131 Ca 0.44 1.75 -0.29 0.00 0.02 0.00 0.00 61.00 62.93 1pma s PRO 131 Cb -0.30 -1.89 -0.02 0.00 0.02 0.00 0.00 34.50 32.32 1pma s PRO 131 CO 0.37 -1.51 1.39 0.71 -0.33 0.00 0.00 177.00 177.64 1pma s TYR 132 N -1.85 2.54 -1.28 6.54 2.02 -1.26 -4.92 117.35 119.14 1pma s TYR 132 Ca 0.75 0.78 -0.11 0.00 -0.37 0.00 0.00 57.07 58.12 1pma s TYR 132 Cb -0.29 -3.78 0.15 0.00 -0.40 0.00 0.00 41.96 37.65 1pma s TYR 132 CO 0.40 -2.20 1.82 0.41 -1.57 0.00 0.00 175.55 174.40 1pma n GLY 133 N 4.11 4.37 3.54 0.71 0.00 -1.26 -4.54 105.19 112.12 1pma n GLY 133 Ca 0.16 -2.01 -0.13 0.00 0.00 0.00 0.00 46.02 44.04 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 1.03 0.00 0.05 1.61 0.11 -1.26 -0.48 120.40 121.47 1pma s VAL 134 Ca 0.41 0.00 0.07 0.00 -2.93 0.00 0.00 61.98 59.53 1pma s VAL 134 Cb 0.07 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.90 1pma s VAL 134 CO -0.00 0.00 -0.19 -0.44 -3.33 0.00 0.00 175.10 171.14 1pma s SER 135 N -1.37 2.22 0.18 3.54 0.01 -0.17 -2.98 113.70 115.12 1pma s SER 135 Ca -0.04 -0.54 -0.08 0.00 1.31 0.00 0.00 55.95 56.60 1pma s SER 135 Cb -0.00 -0.16 -0.01 0.00 0.21 0.00 0.00 66.02 66.06 1pma s SER 135 CO 0.03 0.09 0.28 -1.48 0.41 0.00 0.00 173.24 172.57 1pma s LEU 136 N -1.33 0.93 -0.03 2.44 0.05 -0.27 -0.80 118.68 119.66 1pma s LEU 136 Ca 0.05 -0.96 0.01 0.00 0.05 0.00 0.00 54.13 53.29 1pma s LEU 136 Cb -0.09 1.14 0.01 0.00 -2.05 0.00 0.00 46.19 45.20 1pma s LEU 136 CO 0.02 -0.92 -0.05 0.27 -0.55 0.00 0.00 176.35 175.13 1pma s ILE 137 N -4.00 0.50 -0.11 1.48 -4.36 -0.37 -0.30 121.20 114.04 1pma s ILE 137 Ca 0.21 -0.16 -0.03 0.00 -0.26 0.00 0.00 60.65 60.40 1pma s ILE 137 Cb 0.03 -0.49 -0.03 0.00 1.25 0.00 0.00 42.46 43.22 1pma s ILE 137 CO 0.03 0.19 0.03 -0.36 0.24 0.00 0.00 174.94 175.06 1pma s PHE 138 N 0.52 3.22 -0.05 1.37 0.08 -0.11 -1.64 117.98 121.37 1pma s PHE 138 Ca -0.07 0.19 -0.10 0.00 0.12 0.00 0.00 56.93 57.07 1pma s PHE 138 Cb -0.10 -1.86 0.02 0.00 -0.57 0.00 0.00 43.02 40.51 1pma s PHE 138 CO -0.00 0.43 0.25 0.00 -0.10 0.00 0.00 175.22 175.79 1pma s ALA 139 N -0.64 -0.61 0.00 5.36 0.00 0.38 -1.12 121.76 125.12 1pma s ALA 139 Ca 0.11 0.41 0.00 0.00 0.00 0.00 0.00 51.96 52.48 1pma s ALA 139 Cb -0.12 -0.16 0.00 0.00 0.00 0.00 0.00 23.12 22.85 1pma s ALA 139 CO 0.02 -0.18 0.00 0.41 0.00 0.00 0.00 175.76 176.01 1pma n GLY 140 N 2.10 -0.55 3.28 0.00 0.00 -0.79 -0.72 105.19 108.50 1pma n GLY 140 Ca -0.18 -1.20 -0.33 0.00 0.00 0.00 0.00 46.02 44.32 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 -2.00 2.62 0.00 -0.61 -1.16 -1.11 0.29 121.20 119.23 1pma s ILE 141 Ca 0.00 -0.80 0.00 0.00 -0.51 0.00 0.00 60.65 59.34 1pma s ILE 141 Cb 0.00 -2.08 0.00 0.00 0.61 0.00 0.00 42.46 40.99 1pma s ILE 141 CO 0.00 0.53 0.00 -0.90 -2.81 0.00 0.00 174.94 171.76 1pma n ASP 142 N 3.80 1.69 0.11 4.50 3.85 0.07 -4.87 116.55 125.70 1pma n ASP 142 Ca -0.19 -0.59 0.18 0.00 -0.71 0.00 0.00 54.79 53.48 1pma n ASP 142 Cb 0.52 0.00 0.74 0.00 -1.35 0.00 0.00 41.12 41.04 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 0.00 0.13 0.11 5.75 -1.59 -1.33 115.11 118.18 1pma h GLN 143 Ca 0.00 0.00 -0.30 0.00 -0.15 0.00 0.00 58.65 58.20 1pma h GLN 143 Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 1pma h GLN 143 CO 0.00 0.00 -1.44 0.82 -2.65 0.00 0.00 178.83 175.56 1pma h ILE 144 N 0.00 1.27 0.00 2.39 2.04 -1.96 -3.51 117.51 117.74 1pma h ILE 144 Ca 0.17 -2.87 0.00 0.00 1.00 0.00 0.00 64.86 63.15 1pma h ILE 144 Cb 0.77 2.84 0.00 0.00 -0.74 0.00 0.00 36.82 39.69 1pma h ILE 144 CO -0.00 0.84 0.00 0.61 0.00 0.00 0.00 178.15 179.60 1pma n GLY 145 N 1.63 0.31 3.75 5.37 0.00 -0.50 -5.09 105.19 110.65 1pma n GLY 145 Ca -0.14 -1.50 -0.41 0.00 0.00 0.00 0.00 46.02 43.98 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 4.64 0.03 1.61 0.02 -1.26 -0.75 135.00 137.29 1pma s PRO 146 Ca 0.00 1.73 0.03 0.00 0.02 0.00 0.00 61.00 62.78 1pma s PRO 146 Cb 0.00 -3.24 -0.02 0.00 0.02 0.00 0.00 34.50 31.26 1pma s PRO 146 CO 0.00 0.18 -0.09 1.03 -0.33 0.00 0.00 177.00 177.80 1pma s ARG 147 N -0.92 0.60 -0.10 5.54 0.52 0.14 -4.93 118.95 119.80 1pma s ARG 147 Ca 0.46 -0.66 -0.03 0.00 -0.52 0.00 0.00 55.73 54.99 1pma s ARG 147 Cb -0.30 -0.47 0.04 0.00 0.52 0.00 0.00 34.95 34.74 1pma s ARG 147 CO 0.37 0.11 0.06 -1.17 0.02 0.00 0.00 175.30 174.69 1pma s LEU 148 N -1.21 0.35 0.12 2.53 2.96 -1.26 -1.89 118.68 120.28 1pma s LEU 148 Ca -0.05 -0.23 0.06 0.00 -0.22 0.00 0.00 54.13 53.68 1pma s LEU 148 Cb -0.08 -0.25 -0.04 0.00 0.50 0.00 0.00 46.19 46.32 1pma s LEU 148 CO 0.01 -0.28 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.27 1pma s PHE 149 N 2.11 1.35 0.22 5.38 0.40 -0.28 -0.85 117.98 126.32 1pma s PHE 149 Ca 0.04 -0.59 0.06 0.00 -0.60 0.00 0.00 56.93 55.84 1pma s PHE 149 Cb -0.14 -0.70 -0.05 0.00 0.51 0.00 0.00 43.02 42.64 1pma s PHE 149 CO -0.06 0.13 -0.10 0.16 0.70 0.00 0.00 175.22 176.05 1pma s ASP 150 N -2.56 2.40 -0.14 1.36 -4.77 -0.73 -0.94 116.67 111.29 1pma s ASP 150 Ca 0.10 -1.09 -0.10 0.00 -3.30 0.00 0.00 52.55 48.16 1pma s ASP 150 Cb -0.04 -0.10 0.04 0.00 -1.09 0.00 0.00 42.92 41.73 1pma s ASP 150 CO 0.03 -0.28 0.34 0.00 0.70 0.00 0.00 175.17 175.96 1pma s ASP 152 N 0.79 4.68 0.62 0.00 1.47 -1.06 -1.12 116.67 122.06 1pma s ASP 152 Ca -0.05 -1.12 0.33 0.00 1.18 0.00 0.00 52.55 52.89 1pma s ASP 152 Cb -0.06 0.08 1.90 0.00 -0.34 0.00 0.00 42.92 44.51 1pma s ASP 152 CO -0.06 -0.93 2.20 -0.65 0.68 0.00 0.00 175.17 176.42 1pma h PRO 153 N 0.91 0.00 0.00 2.11 0.11 -1.77 -0.69 132.00 132.67 1pma h PRO 153 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1pma h PRO 153 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1pma h PRO 153 CO 0.59 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.38 1pma n ALA 154 N -2.23 2.23 -0.58 -0.75 0.00 -1.26 -4.70 120.51 113.22 1pma n ALA 154 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1pma n ALA 154 Cb 0.19 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.20 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 1.25 0.70 3.74 0.00 0.00 -0.27 -4.54 105.19 106.08 1pma n GLY 155 Ca 0.06 -0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 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 4.40 0.01 2.61 2.01 -1.26 -4.81 115.64 116.60 1pma s THR 156 Ca 0.00 1.95 0.02 0.00 0.31 0.00 0.00 61.69 63.96 1pma s THR 156 Cb 0.00 -4.26 -0.01 0.00 0.01 0.00 0.00 72.50 68.24 1pma s THR 156 CO 0.00 0.41 -0.05 -0.51 -0.69 0.00 0.00 174.62 173.77 1pma s ILE 157 N -0.52 0.39 0.03 1.82 2.07 -1.26 -2.55 121.20 121.19 1pma s ILE 157 Ca 0.42 -0.52 -0.13 0.00 -1.41 0.00 0.00 60.65 59.01 1pma s ILE 157 Cb -0.24 -0.39 0.02 0.00 0.13 0.00 0.00 42.46 41.98 1pma s ILE 157 CO 0.29 -0.09 0.28 0.20 -1.91 0.00 0.00 174.94 173.70 1pma s ASN 158 N -0.66 -0.10 -0.16 4.50 -0.87 -1.15 -4.99 114.94 111.51 1pma s ASN 158 Ca -0.03 -0.18 -0.07 0.00 -1.57 0.00 0.00 52.86 51.00 1pma s ASN 158 Cb -0.05 0.33 -0.04 0.00 -0.02 0.00 0.00 41.25 41.47 1pma s ASN 158 CO -0.00 -0.57 0.09 -0.70 -2.57 0.00 0.00 177.10 173.35 1pma s GLU 159 N -2.32 3.82 0.39 -0.60 2.12 -1.26 -1.77 118.70 119.07 1pma s GLU 159 Ca -0.07 -0.28 0.08 0.00 0.36 0.00 0.00 54.97 55.07 1pma s GLU 159 Cb -0.02 -3.22 -0.07 0.00 0.26 0.00 0.00 34.13 31.08 1pma s GLU 159 CO -0.02 0.43 -0.02 0.71 -0.54 0.00 0.00 175.26 175.82 1pma s TYR 160 N -0.05 2.49 -0.13 5.30 1.51 -0.03 -5.00 117.35 121.44 1pma s TYR 160 Ca 0.08 -0.61 0.19 0.00 -1.01 0.00 0.00 57.07 55.71 1pma s TYR 160 Cb -0.12 -1.66 -0.21 0.00 -0.11 0.00 0.00 41.96 39.87 1pma s TYR 160 CO 0.01 0.49 0.56 1.17 -1.11 0.00 0.00 175.55 176.66 1pma n LYS 161 N -0.92 0.65 -3.59 -0.62 3.00 -1.26 -4.40 118.16 111.02 1pma n LYS 161 Ca -0.05 0.06 -0.06 0.00 -0.00 0.00 0.00 58.31 58.26 1pma n LYS 161 Cb 0.66 -1.67 -0.03 0.00 0.00 0.00 0.00 35.03 33.99 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 -2.97 -2.02 -0.06 3.14 0.00 -1.26 -0.54 121.76 118.04 1pma s ALA 162 Ca -0.06 1.60 -0.32 0.00 0.00 0.00 0.00 51.96 53.18 1pma s ALA 162 Cb 0.09 -0.51 0.13 0.00 0.00 0.00 0.00 23.12 22.84 1pma s ALA 162 CO 0.84 -0.46 1.37 -0.08 0.00 0.00 0.00 175.76 177.43 1pma s THR 163 N -1.87 0.00 0.28 0.00 -1.32 -0.11 -4.98 115.64 107.64 1pma s THR 163 Ca 0.06 -0.10 0.06 0.00 -1.21 0.00 0.00 61.69 60.49 1pma s THR 163 Cb -0.01 -2.04 -0.02 0.00 -1.51 0.00 0.00 72.50 68.92 1pma s THR 163 CO -0.04 0.00 0.21 0.00 -2.21 0.00 0.00 174.62 172.57 1pma n ALA 164 N -0.51 0.56 -3.60 11.08 0.00 -1.26 -0.97 120.51 125.80 1pma n ALA 164 Ca -0.09 -1.61 -0.08 0.00 0.00 0.00 0.00 53.44 51.67 1pma n ALA 164 Cb 0.63 1.25 -0.02 0.00 0.00 0.00 0.00 19.45 21.32 1pma n ALA 164 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1pma s ILE 165 N -3.04 0.00 0.00 0.00 1.10 0.12 -4.93 121.20 114.45 1pma s ILE 165 Ca 0.29 -0.34 0.00 0.00 -0.51 0.00 0.00 60.65 60.09 1pma s ILE 165 Cb 0.01 -1.41 0.00 0.00 0.15 0.00 0.00 42.46 41.21 1pma s ILE 165 CO 0.21 0.00 0.00 0.61 -2.11 0.00 0.00 174.94 173.65 1pma n GLY 166 N -0.38 0.01 0.00 1.50 0.00 -1.26 -1.05 105.19 104.01 1pma n GLY 166 Ca -0.10 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.18 1pma n GLY 166 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1pma n SER 167 N 0.12 0.00 -0.91 1.61 2.88 -0.05 -3.24 113.62 114.03 1pma n SER 167 Ca 0.00 1.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.54 1pma n SER 167 Cb 0.00 -0.50 0.00 0.00 -0.75 0.00 0.00 64.21 62.96 1pma n SER 167 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1pma n GLY 168 N -1.00 1.40 0.19 0.46 0.00 -1.26 -4.49 105.19 100.50 1pma n GLY 168 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 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 0.48 -0.31 -0.84 1.61 3.64 -1.77 -1.03 116.57 118.36 1pma h LYS 169 Ca 0.00 0.02 0.20 0.00 -1.27 0.00 0.00 60.65 59.61 1pma h LYS 169 Cb 0.67 0.07 -0.13 0.00 -0.41 0.00 0.00 32.23 32.43 1pma h LYS 169 CO 0.00 -0.21 0.25 -0.44 -2.27 0.00 0.00 179.45 176.78 1pma h ASP 170 N -0.32 0.08 0.29 4.20 3.32 -1.88 0.19 116.42 122.31 1pma h ASP 170 Ca -0.01 0.17 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1pma h ASP 170 Cb 0.31 0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.08 1pma h ASP 170 CO -0.09 -0.08 -0.14 0.00 -1.72 0.00 0.00 179.24 177.21 1pma h ALA 171 N 1.71 -0.85 -0.88 3.45 0.00 -1.83 -2.80 119.26 118.05 1pma h ALA 171 Ca 0.51 -0.09 0.14 0.00 0.00 0.00 0.00 54.91 55.47 1pma h ALA 171 Cb 0.96 0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.83 1pma h ALA 171 CO -0.58 -0.82 0.57 -0.24 0.00 0.00 0.00 179.25 178.18 1pma h VAL 172 N -0.50 0.84 -0.44 0.00 3.04 -0.89 -0.10 116.25 118.20 1pma h VAL 172 Ca -0.04 -0.24 -0.05 0.00 -1.01 0.00 0.00 66.70 65.36 1pma h VAL 172 Cb 0.30 0.09 -0.02 0.00 -2.01 0.00 0.00 31.29 29.66 1pma h VAL 172 CO 0.07 0.13 0.05 1.62 -1.01 0.00 0.00 177.57 178.42 1pma h VAL 173 N 0.69 1.21 -0.28 1.51 3.04 -0.68 -1.94 116.25 119.80 1pma h VAL 173 Ca 0.44 -0.83 -0.07 0.00 -1.01 0.00 0.00 66.70 65.24 1pma h VAL 173 Cb 0.70 0.83 -0.01 0.00 -2.01 0.00 0.00 31.29 30.80 1pma h VAL 173 CO -0.20 0.29 -0.09 0.28 -1.01 0.00 0.00 177.57 176.85 1pma h SER 174 N 0.65 0.56 -0.07 3.17 0.02 -0.75 0.33 113.55 117.45 1pma h SER 174 Ca 0.14 -0.38 0.04 0.00 -0.84 0.00 0.00 61.79 60.75 1pma h SER 174 Cb 0.33 -0.15 -0.06 0.00 0.14 0.00 0.00 62.40 62.66 1pma h SER 174 CO 0.01 0.81 -0.32 0.15 -1.14 0.00 0.00 176.83 176.34 1pma h PHE 175 N 0.30 -0.89 -0.28 3.45 3.04 -0.95 -0.67 116.94 120.93 1pma h PHE 175 Ca 0.07 0.03 -0.00 0.00 3.98 0.00 0.00 57.97 62.05 1pma h PHE 175 Cb 0.58 0.40 -0.01 0.00 2.56 0.00 0.00 35.95 39.48 1pma h PHE 175 CO 0.05 -0.41 0.17 -0.07 -2.02 0.00 0.00 178.31 176.04 1pma h LEU 176 N -0.43 0.34 -1.88 0.59 -0.00 -1.27 0.39 115.31 113.05 1pma h LEU 176 Ca 0.08 -0.06 0.32 0.00 -0.00 0.00 0.00 57.88 58.22 1pma h LEU 176 Cb 0.55 -0.09 -0.04 0.00 -0.00 0.00 0.00 40.66 41.08 1pma h LEU 176 CO -0.32 0.30 0.87 -0.08 -0.00 0.00 0.00 178.44 179.21 1pma h GLU 177 N 0.36 0.00 0.00 1.13 4.57 0.42 0.21 114.58 121.26 1pma h GLU 177 Ca 0.10 0.00 -0.24 0.00 -1.18 0.00 0.00 59.36 58.04 1pma h GLU 177 Cb 0.02 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.57 1pma h GLU 177 CO -0.02 0.00 -1.77 -2.13 -1.18 0.00 0.00 179.01 173.91 1pma n ARG 178 N -3.96 0.56 -0.35 1.92 0.63 -0.33 -4.73 116.66 110.40 1pma n ARG 178 Ca 0.24 0.26 0.10 0.00 -0.92 0.00 0.00 57.85 57.52 1pma n ARG 178 Cb 1.23 -1.48 0.28 0.00 0.45 0.00 0.00 32.46 32.94 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 -4.36 2.56 -2.18 -0.14 1.02 0.13 -4.97 120.64 112.70 1pma n GLU 179 Ca -0.35 -2.25 -0.42 0.00 -0.02 0.00 0.00 57.16 54.12 1pma n GLU 179 Cb 0.70 -1.53 -0.03 0.00 -0.02 0.00 0.00 31.44 30.57 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 -1.27 2.95 -0.29 -0.32 5.04 0.72 -4.96 117.35 119.23 1pma s TYR 180 Ca 0.42 0.82 -0.08 0.00 -2.44 0.00 0.00 57.07 55.78 1pma s TYR 180 Cb 0.22 -3.70 -0.01 0.00 0.35 0.00 0.00 41.96 38.83 1pma s TYR 180 CO 0.27 -2.56 0.10 0.21 -1.34 0.00 0.00 175.55 172.23 1pma s LYS 181 N 1.96 3.37 0.00 4.97 2.47 -1.26 -5.04 119.74 126.21 1pma s LYS 181 Ca 0.65 -0.68 0.00 0.00 -1.56 0.00 0.00 55.97 54.38 1pma s LYS 181 Cb -0.34 -3.43 0.00 0.00 -1.46 0.00 0.00 37.83 32.60 1pma s LYS 181 CO 0.28 -0.35 0.07 -1.91 0.16 0.00 0.00 175.35 173.60 1pma n GLU 182 N 4.93 0.00 -1.58 4.03 4.07 -1.26 -2.99 120.64 127.84 1pma n GLU 182 Ca -0.15 0.07 -0.30 0.00 -0.06 0.00 0.00 57.16 56.72 1pma n GLU 182 Cb 0.50 -0.38 -0.03 0.00 -0.06 0.00 0.00 31.44 31.46 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 -0.17 6.73 -4.69 4.31 5.03 -1.26 -4.66 115.26 120.54 1pma n ASN 183 Ca 0.00 -3.35 -0.42 0.00 0.87 0.00 0.00 54.58 51.67 1pma n ASN 183 Cb 0.00 -1.19 -0.03 0.00 -1.02 0.00 0.00 39.78 37.54 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 -2.62 4.38 0.31 3.41 2.96 -1.16 -4.15 118.68 121.81 1pma s LEU 184 Ca 0.57 2.56 -0.29 0.00 -0.22 0.00 0.00 54.13 56.75 1pma s LEU 184 Cb 0.40 -3.56 -0.10 0.00 0.50 0.00 0.00 46.19 43.42 1pma s LEU 184 CO -0.26 -0.93 1.36 -2.84 -1.32 0.00 0.00 176.35 172.36 1pma s PRO 185 N 2.77 4.30 0.04 0.98 0.02 -1.26 -0.50 135.00 141.35 1pma s PRO 185 Ca 0.76 2.28 -0.08 0.00 0.02 0.00 0.00 61.00 63.98 1pma s PRO 185 Cb -0.41 -3.07 -0.02 0.00 0.02 0.00 0.00 34.50 31.02 1pma s PRO 185 CO 0.34 -0.29 0.50 -1.91 -0.33 0.00 0.00 177.00 175.31 1pma n GLU 186 N 1.17 -0.12 -0.20 5.54 2.13 -1.26 -0.68 120.64 127.22 1pma n GLU 186 Ca 0.02 0.50 0.01 0.00 0.66 0.00 0.00 57.16 58.35 1pma n GLU 186 Cb 0.41 -0.73 0.10 0.00 0.27 0.00 0.00 31.44 31.49 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 0.16 -0.12 5.31 3.64 -2.00 0.13 116.57 123.69 1pma h LYS 187 Ca 0.04 -0.01 -0.18 0.00 -1.27 0.00 0.00 60.65 59.23 1pma h LYS 187 Cb 0.11 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1pma h LYS 187 CO -0.25 0.10 -0.68 0.93 -2.27 0.00 0.00 179.45 177.28 1pma h GLU 188 N 0.16 0.50 0.23 1.90 5.08 -1.26 -2.82 114.58 118.36 1pma h GLU 188 Ca 0.32 -0.38 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1pma h GLU 188 Cb 0.51 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 1pma h GLU 188 CO -0.49 1.00 -0.17 0.00 -1.00 0.00 0.00 179.01 178.36 1pma h ALA 189 N 0.89 -0.38 -0.50 3.43 0.00 0.22 0.64 119.26 123.57 1pma h ALA 189 Ca -0.02 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1pma h ALA 189 Cb 1.26 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 19.24 1pma h ALA 189 CO 0.12 -0.73 0.33 -0.24 0.00 0.00 0.00 179.25 178.74 1pma h VAL 190 N -0.40 1.09 0.69 0.00 3.04 -0.87 0.10 116.25 119.91 1pma h VAL 190 Ca -0.02 -0.21 -0.03 0.00 -1.01 0.00 0.00 66.70 65.43 1pma h VAL 190 Cb 0.35 0.42 0.01 0.00 -2.01 0.00 0.00 31.29 30.05 1pma h VAL 190 CO -0.00 0.11 -0.33 0.74 -1.01 0.00 0.00 177.57 177.08 1pma h THR 191 N 0.62 0.27 -0.82 3.17 2.02 -1.13 0.27 112.91 117.31 1pma h THR 191 Ca 0.19 -0.13 0.19 0.00 0.77 0.00 0.00 66.41 67.44 1pma h THR 191 Cb 0.02 0.31 -0.12 0.00 -1.74 0.00 0.00 68.15 66.61 1pma h THR 191 CO -0.05 0.01 0.28 0.25 0.37 0.00 0.00 175.52 176.39 1pma h LEU 192 N -1.02 0.16 0.67 2.58 5.85 -0.25 0.23 115.31 123.52 1pma h LEU 192 Ca -0.09 0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 1pma h LEU 192 Cb 0.74 0.17 0.01 0.00 0.37 0.00 0.00 40.66 41.94 1pma h LEU 192 CO 0.16 -0.03 -0.33 1.23 -0.34 0.00 0.00 178.44 179.13 1pma h GLY 193 N 0.33 -0.97 0.66 3.75 0.00 -0.38 -0.53 103.07 105.92 1pma h GLY 193 Ca 0.49 0.37 0.17 0.00 0.00 0.00 0.00 47.33 48.36 1pma h GLY 193 CO -0.53 -0.35 0.49 1.19 0.00 0.00 0.00 176.54 177.34 1pma h ILE 194 N -0.91 0.73 0.24 2.60 2.10 0.62 0.22 117.51 123.10 1pma h ILE 194 Ca -0.09 -0.07 -0.01 0.00 1.08 0.00 0.00 64.86 65.76 1pma h ILE 194 Cb 0.70 0.49 0.00 0.00 -1.09 0.00 0.00 36.82 36.93 1pma h ILE 194 CO 0.14 0.04 -0.12 0.50 -1.08 0.00 0.00 178.15 177.64 1pma h LYS 195 N 0.22 -0.32 -0.38 2.19 3.64 -0.42 -0.07 116.57 121.44 1pma h LYS 195 Ca 0.35 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.81 1pma h LYS 195 Cb 1.06 0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.90 1pma h LYS 195 CO -0.07 -0.02 0.07 0.00 -2.27 0.00 0.00 179.45 177.17 1pma h ALA 196 N 0.04 0.40 -0.31 5.00 0.00 0.64 -0.33 119.26 124.70 1pma h ALA 196 Ca -0.03 0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1pma h ALA 196 Cb 0.44 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1pma h ALA 196 CO 0.05 -0.33 0.14 1.25 0.00 0.00 0.00 179.25 180.37 1pma h LEU 197 N 0.20 0.19 0.00 0.00 5.85 -0.58 -2.57 115.31 118.39 1pma h LEU 197 Ca 0.18 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.92 1pma h LEU 197 Cb 0.21 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1pma h LEU 197 CO -0.24 0.15 0.00 1.17 -0.34 0.00 0.00 178.44 179.18 1pma n LYS 198 N -4.98 0.00 -0.21 1.25 4.81 -0.05 -2.55 118.16 116.43 1pma n LYS 198 Ca -0.00 0.43 -0.02 0.00 -0.87 0.00 0.00 58.31 57.85 1pma n LYS 198 Cb 0.09 -1.19 0.00 0.00 0.02 0.00 0.00 35.03 33.94 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 -1.40 -0.41 0.00 3.14 3.41 -0.23 0.23 113.62 118.35 1pma n SER 199 Ca 0.00 0.94 0.00 0.00 -0.26 0.00 0.00 58.87 59.55 1pma n SER 199 Cb 0.00 -0.19 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 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 -4.76 0.00 0.28 4.04 2.88 -0.97 -3.22 113.62 111.87 1pma n SER 200 Ca 0.04 0.00 0.19 0.00 -1.33 0.00 0.00 58.87 57.77 1pma n SER 200 Cb 0.19 0.00 0.97 0.00 -0.75 0.00 0.00 64.21 64.63 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 -3.94 2.46 7.12 -1.39 -3.32 115.31 116.24 1pma h LEU 201 Ca 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 57.88 57.97 1pma h LEU 201 Cb 0.00 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.12 1pma h LEU 201 CO 0.00 0.00 0.03 -0.62 -0.13 0.00 0.00 178.44 177.72 1pma n GLU 202 N -2.85 0.70 0.08 1.25 4.71 0.14 -3.32 120.64 121.35 1pma n GLU 202 Ca -0.02 -0.21 -0.04 0.00 -0.01 0.00 0.00 57.16 56.88 1pma n GLU 202 Cb 0.10 -1.46 -0.07 0.00 -1.01 0.00 0.00 31.44 29.00 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 3.38 0.00 -0.99 3.49 4.22 -1.77 -3.22 114.58 119.69 1pma h GLU 203 Ca 0.04 0.00 -0.36 0.00 0.08 0.00 0.00 59.36 59.12 1pma h GLU 203 Cb 0.60 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 29.64 1pma h GLU 203 CO 0.16 0.77 0.46 0.41 -2.18 0.00 0.00 179.01 178.63 1pma n GLY 204 N 1.32 3.77 5.08 1.92 0.00 -1.21 -4.99 105.19 111.09 1pma n GLY 204 Ca -0.01 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.66 0.00 -1.87 1.61 4.07 -1.22 -4.82 120.64 117.75 1pma n GLU 205 Ca 0.43 0.00 -0.43 0.00 -0.06 0.00 0.00 57.16 57.10 1pma n GLU 205 Cb 1.34 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 32.70 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 3.84 0.22 5.31 2.12 -1.26 -4.87 118.70 124.05 1pma s GLU 206 Ca 0.00 2.11 0.24 0.00 0.36 0.00 0.00 54.97 57.67 1pma s GLU 206 Cb 0.00 -4.13 0.92 0.00 0.26 0.00 0.00 34.13 31.18 1pma s GLU 206 CO 0.00 -1.27 1.71 -0.11 -0.54 0.00 0.00 175.26 175.05 1pma n LEU 207 N 8.57 0.62 0.00 2.70 7.94 -1.26 -4.98 117.00 130.60 1pma n LEU 207 Ca 0.21 0.63 0.00 0.00 -1.11 0.00 0.00 56.01 55.73 1pma n LEU 207 Cb 0.44 -0.51 0.00 0.00 0.53 0.00 0.00 43.42 43.88 1pma n LEU 207 CO 0.65 -0.43 0.00 1.17 -1.11 0.00 0.00 177.39 177.68 1pma n LYS 208 N -2.15 0.00 -3.71 1.96 3.00 -1.26 -4.33 118.16 111.66 1pma n LYS 208 Ca 0.03 0.00 -0.38 0.00 -0.00 0.00 0.00 58.31 57.96 1pma n LYS 208 Cb 0.27 0.00 -0.11 0.00 0.00 0.00 0.00 35.03 35.19 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 -1.96 3.14 0.75 3.14 0.00 -1.26 -5.06 121.76 120.53 1pma s ALA 209 Ca 0.00 -2.09 -0.11 0.00 0.00 0.00 0.00 51.96 49.76 1pma s ALA 209 Cb 0.00 -2.42 0.04 0.00 0.00 0.00 0.00 23.12 20.74 1pma s ALA 209 CO 0.00 -1.56 1.08 -2.14 0.00 0.00 0.00 175.76 173.13 1pma s PRO 210 N 1.33 2.45 -0.21 0.00 0.02 -1.26 -3.16 135.00 134.17 1pma s PRO 210 Ca 0.02 0.94 -0.02 0.00 0.02 0.00 0.00 61.00 61.96 1pma s PRO 210 Cb -0.22 -1.93 0.00 0.00 0.02 0.00 0.00 34.50 32.37 1pma s PRO 210 CO 0.00 -1.45 -0.10 -2.00 -0.33 0.00 0.00 177.00 173.13 1pma s GLU 211 N -5.02 3.19 -0.01 5.54 2.12 0.34 -4.79 118.70 120.08 1pma s GLU 211 Ca 0.60 -0.73 0.03 0.00 0.36 0.00 0.00 54.97 55.22 1pma s GLU 211 Cb -0.15 -2.86 -0.01 0.00 0.26 0.00 0.00 34.13 31.37 1pma s GLU 211 CO 0.55 -0.22 -0.08 -1.50 -0.54 0.00 0.00 175.26 173.47 1pma s ILE 212 N 1.40 0.66 0.01 -3.70 2.07 -1.26 -0.47 121.20 119.91 1pma s ILE 212 Ca 0.05 -0.36 0.00 0.00 -1.41 0.00 0.00 60.65 58.93 1pma s ILE 212 Cb -0.14 -0.55 -0.01 0.00 0.13 0.00 0.00 42.46 41.88 1pma s ILE 212 CO -0.07 0.18 -0.02 0.00 -1.91 0.00 0.00 174.94 173.13 1pma s ALA 213 N -0.20 0.09 -0.03 1.50 0.00 -0.32 -1.50 121.76 121.31 1pma s ALA 213 Ca 0.03 -0.39 -0.10 0.00 0.00 0.00 0.00 51.96 51.50 1pma s ALA 213 Cb -0.03 0.09 0.01 0.00 0.00 0.00 0.00 23.12 23.20 1pma s ALA 213 CO -0.00 -0.10 0.22 -1.54 0.00 0.00 0.00 175.76 174.34 1pma s SER 214 N -0.95 -0.12 0.04 0.00 1.04 0.81 -0.35 113.70 114.17 1pma s SER 214 Ca -0.10 0.07 0.02 0.00 0.48 0.00 0.00 55.95 56.43 1pma s SER 214 Cb -0.07 0.32 -0.02 0.00 0.10 0.00 0.00 66.02 66.35 1pma s SER 214 CO -0.01 -0.31 -0.08 -0.51 0.98 0.00 0.00 173.24 173.31 1pma s ILE 215 N -0.95 0.58 0.03 -1.02 2.07 -0.65 -0.62 121.20 120.63 1pma s ILE 215 Ca -0.10 -1.05 0.04 0.00 -1.41 0.00 0.00 60.65 58.13 1pma s ILE 215 Cb -0.05 -0.63 -0.02 0.00 0.13 0.00 0.00 42.46 41.89 1pma s ILE 215 CO 0.02 -0.34 -0.13 0.28 -1.91 0.00 0.00 174.94 172.86 1pma s THR 216 N -1.30 0.99 0.22 4.00 -1.32 -1.26 -1.01 115.64 115.96 1pma s THR 216 Ca -0.09 -0.88 -0.29 0.00 -1.21 0.00 0.00 61.69 59.22 1pma s THR 216 Cb -0.10 -0.89 -0.16 0.00 -1.51 0.00 0.00 72.50 69.84 1pma s THR 216 CO 0.00 0.01 0.75 0.55 -2.21 0.00 0.00 174.62 173.73 1pma n VAL 217 N 2.06 1.87 0.00 5.08 3.14 0.14 -1.70 118.33 128.92 1pma n VAL 217 Ca -0.17 -0.47 0.00 0.00 -2.96 0.00 0.00 64.34 60.74 1pma n VAL 217 Cb 0.55 -0.40 0.00 0.00 -1.06 0.00 0.00 33.84 32.93 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 1.70 3.38 3.49 7.55 0.00 -1.26 -5.02 105.19 115.03 1pma n GLY 218 Ca 0.15 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.02 1pma n GLY 218 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pma s ASN 219 N -0.77 0.90 0.73 1.61 4.22 -0.69 -5.17 114.94 115.77 1pma s ASN 219 Ca 0.00 -1.48 -0.11 0.00 -2.14 0.00 0.00 52.86 49.13 1pma s ASN 219 Cb 0.00 0.66 0.03 0.00 1.28 0.00 0.00 41.25 43.22 1pma s ASN 219 CO 0.00 -1.29 1.07 -0.54 -2.04 0.00 0.00 177.10 174.30 1pma s LYS 220 N -3.09 2.67 0.38 3.55 1.02 -1.26 -4.42 119.74 118.58 1pma s LYS 220 Ca 0.31 0.87 -0.27 0.00 0.02 0.00 0.00 55.97 56.89 1pma s LYS 220 Cb -0.00 -1.97 -0.11 0.00 -0.52 0.00 0.00 37.83 35.23 1pma s LYS 220 CO 0.20 -1.27 1.39 0.66 -0.92 0.00 0.00 175.35 175.41 1pma n TYR 221 N -3.23 2.61 -3.99 3.18 4.01 -0.51 -4.64 117.16 114.59 1pma n TYR 221 Ca 0.07 0.49 -0.30 0.00 -0.16 0.00 0.00 57.90 58.01 1pma n TYR 221 Cb 0.54 -2.47 -0.16 0.00 -0.31 0.00 0.00 39.34 36.94 1pma n TYR 221 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 1pma s ARG 222 N -2.07 2.11 -0.17 -0.72 3.52 0.20 -4.99 118.95 116.83 1pma s ARG 222 Ca 0.56 -0.60 -0.15 0.00 -0.13 0.00 0.00 55.73 55.41 1pma s ARG 222 Cb -0.51 -2.13 -0.04 0.00 -1.56 0.00 0.00 34.95 30.71 1pma s ARG 222 CO 0.62 -0.30 0.36 0.42 -0.81 0.00 0.00 175.30 175.59 1pma s ILE 223 N 1.49 5.25 0.43 4.11 1.01 -1.26 -0.13 121.20 132.10 1pma s ILE 223 Ca 0.03 0.67 -0.24 0.00 0.00 0.00 0.00 60.65 61.11 1pma s ILE 223 Cb -0.14 -3.70 -0.08 0.00 0.01 0.00 0.00 42.46 38.56 1pma s ILE 223 CO -0.10 0.33 1.15 -0.31 0.00 0.00 0.00 174.94 176.02 1pma s TYR 224 N 0.78 3.00 0.27 3.97 1.51 -0.56 -5.00 117.35 121.33 1pma s TYR 224 Ca 0.19 1.55 -0.08 0.00 -1.01 0.00 0.00 57.07 57.72 1pma s TYR 224 Cb -0.14 -3.36 -0.06 0.00 -0.11 0.00 0.00 41.96 38.29 1pma s TYR 224 CO 0.06 -1.33 0.58 0.16 -1.11 0.00 0.00 175.55 173.91 1pma s ASP 225 N -1.29 6.55 0.19 2.29 -4.77 -1.26 -4.83 116.67 113.54 1pma s ASP 225 Ca 0.60 0.87 -0.05 0.00 -3.30 0.00 0.00 52.55 50.67 1pma s ASP 225 Cb -0.29 -2.21 0.31 0.00 -1.09 0.00 0.00 42.92 39.64 1pma s ASP 225 CO 0.35 -0.16 1.05 1.67 0.70 0.00 0.00 175.17 178.78 1pma n GLN 226 N -0.57 -0.06 -0.09 2.11 7.27 -1.26 0.04 117.38 124.83 1pma n GLN 226 Ca -0.00 1.05 -0.12 0.00 0.07 0.00 0.00 57.00 58.00 1pma n GLN 226 Cb 0.53 -1.56 -0.05 0.00 2.41 0.00 0.00 30.24 31.57 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 0.50 -0.33 3.69 3.07 -1.97 -1.31 114.58 118.22 1pma h GLU 227 Ca 0.32 -0.20 0.02 0.00 -0.50 0.00 0.00 59.36 59.00 1pma h GLU 227 Cb 0.49 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.35 1pma h GLU 227 CO -0.69 0.73 0.16 1.49 -1.40 0.00 0.00 179.01 179.31 1pma h GLU 228 N 0.23 0.33 -0.56 2.33 4.81 -0.77 -0.75 114.58 120.21 1pma h GLU 228 Ca 0.06 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.22 1pma h GLU 228 Cb 0.56 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.85 1pma h GLU 228 CO 0.03 0.22 0.14 -0.24 -0.73 0.00 0.00 179.01 178.42 1pma h VAL 229 N 0.34 1.25 0.00 0.32 3.04 -1.27 -1.79 116.25 118.14 1pma h VAL 229 Ca 0.14 -0.88 0.00 0.00 -1.01 0.00 0.00 66.70 64.95 1pma h VAL 229 Cb 0.05 0.75 0.00 0.00 -2.01 0.00 0.00 31.29 30.08 1pma h VAL 229 CO -0.10 0.33 0.00 0.50 -1.01 0.00 0.00 177.57 177.29 1pma h LYS 230 N 0.79 0.00 -0.11 4.17 3.64 -0.58 -1.44 116.57 123.05 1pma h LYS 230 Ca 0.18 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.40 1pma h LYS 230 Cb 0.34 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 1pma h LYS 230 CO 0.00 0.00 -0.60 -0.22 -2.27 0.00 0.00 179.45 176.36 1pma h LYS 231 N 0.00 0.37 0.00 1.90 3.64 -0.23 -3.22 116.57 119.03 1pma h LYS 231 Ca 0.00 -0.25 -0.15 0.00 -1.27 0.00 0.00 60.65 58.98 1pma h LYS 231 Cb 0.04 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.87 1pma h LYS 231 CO 0.00 0.86 -1.47 1.19 -2.27 0.00 0.00 179.45 177.76 1pma n PHE 232 N -3.90 0.87 0.00 1.91 3.01 -0.61 -5.13 117.46 113.61 1pma n PHE 232 Ca -0.03 0.29 0.00 0.00 1.01 0.00 0.00 57.45 58.72 1pma n PHE 232 Cb 0.62 -1.04 0.00 0.00 -0.01 0.00 0.00 39.48 39.05 1pma n PHE 232 CO 0.00 0.00 0.00 -0.11 1.01 0.00 0.00 176.76 177.66