#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 0.17 12.58 -7.23 -1.26 -4.87 120.40 119.80 1pma s VAL 14 Ca 0.00 -1.78 -0.26 0.00 -1.81 0.00 0.00 61.98 58.13 1pma s VAL 14 Cb 0.00 -2.48 -0.08 0.00 0.56 0.00 0.00 36.38 34.38 1pma s VAL 14 CO 0.00 0.00 0.82 -0.36 -0.31 0.00 0.00 175.10 175.25 1pma s PHE 15 N -3.68 3.91 0.66 2.82 0.08 -1.26 -4.36 117.98 116.15 1pma s PHE 15 Ca 0.34 1.70 -0.10 0.00 0.12 0.00 0.00 56.93 58.98 1pma s PHE 15 Cb 0.03 -2.83 -0.00 0.00 -0.57 0.00 0.00 43.02 39.64 1pma s PHE 15 CO 0.17 0.48 1.04 -1.54 -0.10 0.00 0.00 175.22 175.27 1pma s SER 16 N -1.05 5.70 0.11 1.36 1.04 -0.72 -4.91 113.70 115.23 1pma s SER 16 Ca 0.37 1.14 0.07 0.00 0.48 0.00 0.00 55.95 58.01 1pma s SER 16 Cb -0.24 -2.05 0.37 0.00 0.10 0.00 0.00 66.02 64.21 1pma s SER 16 CO 0.27 -1.15 1.17 -2.65 0.98 0.00 0.00 173.24 171.87 1pma n PRO 17 N -2.85 0.04 -0.11 4.02 -0.02 -1.26 -1.10 135.00 133.72 1pma n PRO 17 Ca 0.06 0.51 0.09 0.00 -2.02 0.00 0.00 63.50 62.14 1pma n PRO 17 Cb 0.56 -1.70 0.14 0.00 -0.02 0.00 0.00 33.50 32.49 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 -1.72 2.90 -0.38 2.55 5.75 -1.26 -5.00 116.55 119.39 1pma n ASP 18 Ca -0.00 -1.85 0.00 0.00 -0.01 0.00 0.00 54.79 52.92 1pma n ASP 18 Cb 0.06 -0.15 0.00 0.00 -1.03 0.00 0.00 41.12 40.00 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 1.07 0.95 3.09 6.12 0.00 -0.26 -5.10 105.19 111.07 1pma n GLY 19 Ca 0.14 -0.56 -0.13 0.00 0.00 0.00 0.00 46.02 45.47 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 -4.02 0.62 -0.77 1.61 0.52 -1.26 -4.91 118.95 110.73 1pma s ARG 20 Ca 0.00 -0.89 -0.16 0.00 -0.52 0.00 0.00 55.73 54.17 1pma s ARG 20 Cb 0.00 -0.33 0.18 0.00 0.52 0.00 0.00 34.95 35.32 1pma s ARG 20 CO 0.00 0.05 0.78 -0.51 0.02 0.00 0.00 175.30 175.64 1pma s LEU 21 N -1.88 6.21 0.34 2.53 2.01 -1.26 -1.76 118.68 124.88 1pma s LEU 21 Ca -0.05 -2.29 0.12 0.00 0.01 0.00 0.00 54.13 51.92 1pma s LEU 21 Cb -0.07 -2.25 0.95 0.00 0.01 0.00 0.00 46.19 44.82 1pma s LEU 21 CO -0.00 -0.77 1.75 -0.26 1.01 0.00 0.00 176.35 178.07 1pma h PHE 22 N 8.30 0.90 -0.60 0.29 0.04 -1.98 0.03 116.94 123.93 1pma h PHE 22 Ca 0.00 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.78 1pma h PHE 22 Cb 1.05 -0.26 -0.03 0.00 2.20 0.00 0.00 35.95 38.91 1pma h PHE 22 CO 0.99 0.08 0.28 1.96 -0.60 0.00 0.00 178.31 181.02 1pma h GLN 23 N 0.54 0.86 -0.42 1.51 1.08 -1.91 0.12 115.11 116.88 1pma h GLN 23 Ca 0.62 -0.13 -0.08 0.00 -1.45 0.00 0.00 58.65 57.61 1pma h GLN 23 Cb 1.29 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 28.55 1pma h GLN 23 CO -0.41 0.70 -0.08 -0.24 -0.95 0.00 0.00 178.83 177.85 1pma h VAL 24 N 0.81 1.25 0.38 -0.54 3.04 -1.44 -0.65 116.25 119.10 1pma h VAL 24 Ca 0.20 -1.09 -0.02 0.00 -1.01 0.00 0.00 66.70 64.78 1pma h VAL 24 Cb 0.13 1.02 0.00 0.00 -2.01 0.00 0.00 31.29 30.43 1pma h VAL 24 CO -0.02 0.37 -0.18 -0.33 -1.01 0.00 0.00 177.57 176.40 1pma h GLU 25 N 0.67 -0.49 -0.96 4.17 4.39 -0.58 -1.32 114.58 120.45 1pma h GLU 25 Ca 0.12 0.03 0.16 0.00 0.34 0.00 0.00 59.36 60.01 1pma h GLU 25 Cb 0.53 0.11 -0.09 0.00 -0.10 0.00 0.00 28.75 29.21 1pma h GLU 25 CO 0.03 -0.26 0.61 1.88 -1.16 0.00 0.00 179.01 180.11 1pma h TYR 26 N -0.63 0.97 -0.16 4.33 0.05 -0.58 0.12 116.97 121.07 1pma h TYR 26 Ca -0.05 0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.80 1pma h TYR 26 Cb 0.46 -0.30 -0.05 0.00 1.01 0.00 0.00 36.73 37.85 1pma h TYR 26 CO -0.02 0.31 -0.12 0.00 -1.05 0.00 0.00 178.16 177.28 1pma h ALA 27 N 1.60 0.00 -0.83 3.88 0.00 -0.27 -1.22 119.26 122.42 1pma h ALA 27 Ca 0.51 0.06 0.18 0.00 0.00 0.00 0.00 54.91 55.66 1pma h ALA 27 Cb 0.76 0.26 -0.11 0.00 0.00 0.00 0.00 17.79 18.71 1pma h ALA 27 CO -0.28 -0.56 0.35 0.00 0.00 0.00 0.00 179.25 178.76 1pma h ARG 28 N -0.13 0.43 -0.60 0.00 3.08 0.31 0.18 114.38 117.64 1pma h ARG 28 Ca 0.10 -0.03 0.11 0.00 0.07 0.00 0.00 59.98 60.24 1pma h ARG 28 Cb 0.27 -0.10 -0.09 0.00 0.08 0.00 0.00 29.97 30.14 1pma h ARG 28 CO -0.24 0.28 0.13 0.93 -1.07 0.00 0.00 179.97 180.00 1pma h GLU 29 N 0.44 0.25 -0.90 0.04 4.39 -0.78 0.10 114.58 118.12 1pma h GLU 29 Ca 0.48 -0.02 0.11 0.00 0.34 0.00 0.00 59.36 60.27 1pma h GLU 29 Cb 0.81 -0.06 -0.08 0.00 -0.10 0.00 0.00 28.75 29.33 1pma h GLU 29 CO -0.46 0.17 0.53 0.00 -1.16 0.00 0.00 179.01 178.09 1pma h ALA 30 N 1.48 1.32 -0.38 3.43 0.00 -0.46 -0.89 119.26 123.76 1pma h ALA 30 Ca 0.32 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.17 1pma h ALA 30 Cb 0.47 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1pma h ALA 30 CO -0.41 0.14 -0.14 -0.39 0.00 0.00 0.00 179.25 178.46 1pma h VAL 31 N 0.87 1.25 -0.57 0.00 -1.51 -0.65 -2.58 116.25 113.06 1pma h VAL 31 Ca 0.44 -1.16 0.09 0.00 -1.23 0.00 0.00 66.70 64.84 1pma h VAL 31 Cb 0.42 1.12 -0.03 0.00 -2.13 0.00 0.00 31.29 30.67 1pma h VAL 31 CO -0.26 0.39 0.39 0.11 -1.23 0.00 0.00 177.57 176.96 1pma h LYS 32 N 0.61 0.40 -0.19 5.19 1.57 -0.43 0.25 116.57 123.97 1pma h LYS 32 Ca 0.10 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1pma h LYS 32 Cb 0.59 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.81 1pma h LYS 32 CO 0.04 0.26 0.00 1.63 -0.57 0.00 0.00 179.45 180.81 1pma n LYS 33 N -4.47 1.36 -2.74 3.15 5.02 -0.97 -3.39 118.16 116.11 1pma n LYS 33 Ca 0.09 -0.52 -0.21 0.00 -2.02 0.00 0.00 58.31 55.65 1pma n LYS 33 Cb 0.34 -1.15 0.06 0.00 -0.02 0.00 0.00 35.03 34.27 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 -0.94 1.81 1.04 0.72 0.00 0.88 -4.93 107.32 105.89 1pma s GLY 34 Ca 0.10 -1.63 -0.12 0.00 0.00 0.00 0.00 44.72 43.06 1pma s GLY 34 CO 0.06 -1.25 0.87 -1.26 0.00 0.00 0.00 173.10 171.52 1pma n SER 35 N -2.40 -1.07 -4.66 1.64 2.88 -1.26 -1.60 113.62 107.14 1pma n SER 35 Ca 0.11 0.13 -0.35 0.00 -1.33 0.00 0.00 58.87 57.43 1pma n SER 35 Cb 0.60 -1.30 -0.10 0.00 -0.75 0.00 0.00 64.21 62.66 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 -2.47 4.53 0.08 2.46 -1.32 -1.26 -2.92 115.64 114.73 1pma s THR 36 Ca 0.65 -0.15 -0.13 0.00 -1.21 0.00 0.00 61.69 60.85 1pma s THR 36 Cb -0.22 -2.97 0.02 0.00 -1.51 0.00 0.00 72.50 67.81 1pma s THR 36 CO 0.63 0.54 0.31 0.00 -2.21 0.00 0.00 174.62 173.89 1pma s ALA 37 N -0.29 -0.65 0.30 11.08 0.00 0.15 -1.92 121.76 130.43 1pma s ALA 37 Ca 0.07 -0.18 -0.05 0.00 0.00 0.00 0.00 51.96 51.80 1pma s ALA 37 Cb -0.12 0.49 -0.00 0.00 0.00 0.00 0.00 23.12 23.49 1pma s ALA 37 CO 0.02 -0.52 0.43 -0.48 0.00 0.00 0.00 175.76 175.21 1pma s LEU 38 N -2.54 0.83 0.02 0.00 2.34 0.21 0.79 118.68 120.33 1pma s LEU 38 Ca 0.01 -1.31 -0.27 0.00 0.06 0.00 0.00 54.13 52.61 1pma s LEU 38 Cb 0.02 1.42 0.07 0.00 -0.56 0.00 0.00 46.19 47.13 1pma s LEU 38 CO -0.08 -1.20 0.63 -0.83 -1.06 0.00 0.00 176.35 173.81 1pma s GLY 39 N -3.16 -0.57 -0.25 -3.48 0.00 -0.08 -0.98 107.32 98.80 1pma s GLY 39 Ca 0.29 0.98 -0.24 0.00 0.00 0.00 0.00 44.72 45.75 1pma s GLY 39 CO 0.16 0.64 0.68 -3.16 0.00 0.00 0.00 173.10 171.42 1pma s MET 40 N -2.10 0.81 0.40 2.90 0.23 -0.87 -1.07 119.30 119.60 1pma s MET 40 Ca -0.07 0.93 -0.24 0.00 -1.03 0.00 0.00 55.69 55.28 1pma s MET 40 Cb -0.00 0.39 -0.09 0.00 -1.53 0.00 0.00 34.83 33.60 1pma s MET 40 CO 0.02 -0.10 1.07 0.15 -2.03 0.00 0.00 175.02 174.13 1pma s LYS 41 N 0.32 4.14 0.00 3.16 1.02 -0.28 -2.33 119.74 125.77 1pma s LYS 41 Ca -0.00 1.57 0.00 0.00 0.02 0.00 0.00 55.97 57.56 1pma s LYS 41 Cb -0.05 -2.57 0.00 0.00 -0.52 0.00 0.00 37.83 34.70 1pma s LYS 41 CO 0.01 -0.18 0.00 1.97 -0.92 0.00 0.00 175.35 176.23 1pma n PHE 42 N -0.05 0.00 0.00 3.18 1.16 -0.74 -4.85 117.46 116.16 1pma n PHE 42 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.63 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 -2.57 1.98 0.00 0.24 -3.89 120.51 113.27 1pma n ALA 43 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1pma n ALA 43 Cb 0.00 0.09 0.05 0.00 0.00 0.00 0.00 19.45 19.59 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 -0.64 1.83 0.00 0.00 4.05 -1.26 -5.00 115.26 114.24 1pma n ASN 44 Ca 0.00 -2.34 0.00 0.00 0.45 0.00 0.00 54.58 52.69 1pma n ASN 44 Cb 0.00 -0.42 0.00 0.00 1.23 0.00 0.00 39.78 40.59 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 -0.34 2.22 3.19 8.20 0.00 -1.25 -0.28 105.19 116.92 1pma n GLY 45 Ca 0.12 -0.65 -0.12 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.39 0.07 0.09 1.61 0.11 0.00 -1.80 120.40 118.10 1pma s VAL 46 Ca 0.00 -0.59 0.04 0.00 -2.93 0.00 0.00 61.98 58.50 1pma s VAL 46 Cb 0.00 -0.60 -0.03 0.00 -1.53 0.00 0.00 36.38 34.22 1pma s VAL 46 CO 0.00 -0.33 -0.12 -1.48 -3.33 0.00 0.00 175.10 169.85 1pma s LEU 47 N -1.46 2.35 0.03 2.54 2.34 -0.98 -1.54 118.68 121.96 1pma s LEU 47 Ca -0.13 -0.73 0.07 0.00 0.06 0.00 0.00 54.13 53.41 1pma s LEU 47 Cb -0.05 -0.38 -0.02 0.00 -0.56 0.00 0.00 46.19 45.17 1pma s LEU 47 CO 0.02 -0.19 -0.21 -0.22 -1.06 0.00 0.00 176.35 174.69 1pma s LEU 48 N -2.15 2.13 -0.16 1.48 2.96 0.77 -2.05 118.68 121.66 1pma s LEU 48 Ca 0.02 -0.49 -0.08 0.00 -0.22 0.00 0.00 54.13 53.36 1pma s LEU 48 Cb -0.06 -1.04 0.06 0.00 0.50 0.00 0.00 46.19 45.65 1pma s LEU 48 CO 0.01 0.20 0.38 -0.51 -1.32 0.00 0.00 176.35 175.11 1pma s ILE 49 N -0.72 -0.07 0.05 6.68 1.10 -0.15 -0.99 121.20 127.10 1pma s ILE 49 Ca 0.08 0.11 0.06 0.00 -0.51 0.00 0.00 60.65 60.40 1pma s ILE 49 Cb -0.09 -0.57 -0.02 0.00 0.15 0.00 0.00 42.46 41.93 1pma s ILE 49 CO 0.01 0.05 -0.18 -0.55 -2.11 0.00 0.00 174.94 172.16 1pma s SER 50 N 1.46 2.12 -0.45 4.50 0.15 0.11 -0.62 113.70 120.96 1pma s SER 50 Ca -0.09 -0.52 -0.26 0.00 0.70 0.00 0.00 55.95 55.78 1pma s SER 50 Cb -0.09 -0.15 0.03 0.00 -1.71 0.00 0.00 66.02 64.09 1pma s SER 50 CO -0.12 0.09 0.95 -0.62 1.20 0.00 0.00 173.24 174.74 1pma s ASP 51 N -1.27 6.54 -1.10 5.45 2.15 -0.81 0.18 116.67 127.82 1pma s ASP 51 Ca 0.05 0.23 -0.16 0.00 0.43 0.00 0.00 52.55 53.10 1pma s ASP 51 Cb -0.09 -2.46 0.15 0.00 -0.30 0.00 0.00 42.92 40.22 1pma s ASP 51 CO 0.02 -1.04 1.32 -0.75 -0.17 0.00 0.00 175.17 174.55 1pma s LYS 52 N 3.79 3.89 -0.35 4.34 2.20 -1.21 -4.68 119.74 127.72 1pma s LYS 52 Ca 0.38 -2.23 -0.26 0.00 -0.36 0.00 0.00 55.97 53.50 1pma s LYS 52 Cb -0.10 -5.02 0.01 0.00 -1.51 0.00 0.00 37.83 31.21 1pma s LYS 52 CO 0.26 -1.79 0.94 0.15 -0.36 0.00 0.00 175.35 174.55 1pma s LYS 53 N 2.12 3.92 0.14 4.03 1.02 -1.26 -4.29 119.74 125.41 1pma s LYS 53 Ca 0.39 0.70 0.05 0.00 0.02 0.00 0.00 55.97 57.13 1pma s LYS 53 Cb -0.03 -3.77 -0.04 0.00 -0.52 0.00 0.00 37.83 33.46 1pma s LYS 53 CO -0.04 -0.89 0.06 0.54 -0.92 0.00 0.00 175.35 174.11 1pma s VAL 54 N 3.43 4.19 0.00 3.17 0.11 -1.26 -5.10 120.40 124.93 1pma s VAL 54 Ca 0.39 -1.11 0.00 0.00 -2.93 0.00 0.00 61.98 58.33 1pma s VAL 54 Cb -0.12 -3.08 0.00 0.00 -1.53 0.00 0.00 36.38 31.65 1pma s VAL 54 CO 0.17 -0.02 0.00 -1.14 -3.33 0.00 0.00 175.10 170.77 1pma n ARG 55 N 0.03 0.00 -1.10 1.54 3.00 -1.26 -5.09 116.66 113.77 1pma n ARG 55 Ca -0.09 0.00 -0.32 0.00 -0.00 0.00 0.00 57.85 57.44 1pma n ARG 55 Cb 0.54 0.00 0.12 0.00 0.00 0.00 0.00 32.46 33.12 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 -0.33 3.78 0.33 6.15 0.15 -1.26 -4.93 113.70 117.60 1pma s SER 56 Ca 0.00 2.14 0.15 0.00 0.70 0.00 0.00 55.95 58.95 1pma s SER 56 Cb 0.00 -2.56 0.53 0.00 -1.71 0.00 0.00 66.02 62.28 1pma s SER 56 CO 0.00 -2.53 1.68 0.03 1.20 0.00 0.00 173.24 173.62 1pma h ARG 57 N -1.13 0.00 0.00 5.44 3.08 -2.08 -3.17 114.38 116.53 1pma h ARG 57 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.60 1pma h ARG 57 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.32 1pma h ARG 57 CO 0.47 0.47 0.00 1.28 -1.07 0.00 0.00 179.97 181.12 1pma n LEU 58 N -3.63 0.00 -4.84 3.04 4.32 -1.26 -4.79 117.00 109.85 1pma n LEU 58 Ca -0.01 0.24 -0.32 0.00 -0.02 0.00 0.00 56.01 55.90 1pma n LEU 58 Cb 0.56 -0.24 -0.05 0.00 -1.62 0.00 0.00 43.42 42.07 1pma n LEU 58 CO 0.39 -0.12 0.64 -0.63 -1.22 0.00 0.00 177.39 176.45 1pma s ILE 59 N -2.47 4.51 -0.75 -0.08 -1.09 -1.20 -4.96 121.20 115.16 1pma s ILE 59 Ca 0.16 1.26 -0.05 0.00 -2.23 0.00 0.00 60.65 59.79 1pma s ILE 59 Cb 0.10 -3.67 -0.01 0.00 -1.58 0.00 0.00 42.46 37.31 1pma s ILE 59 CO 0.23 -0.50 2.86 -0.62 -1.23 0.00 0.00 174.94 175.68 1pma n GLU 60 N -1.12 3.10 0.00 2.79 -0.58 -1.26 -4.98 120.64 118.58 1pma n GLU 60 Ca 0.06 -2.37 0.00 0.00 -0.42 0.00 0.00 57.16 54.43 1pma n GLU 60 Cb 0.54 -2.33 0.00 0.00 -0.57 0.00 0.00 31.44 29.08 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 1.77 0.00 -0.27 3.49 -0.00 -1.26 -1.28 117.38 119.83 1pma n GLN 61 Ca 0.55 0.00 0.25 0.00 -0.00 0.00 0.00 57.00 57.80 1pma n GLN 61 Cb 0.50 0.00 0.44 0.00 -0.00 0.00 0.00 30.24 31.18 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 0.70 0.20 0.31 2.61 2.85 -1.26 -1.10 115.26 119.56 1pma n ASN 62 Ca 0.00 1.06 0.11 0.00 -0.11 0.00 0.00 54.58 55.65 1pma n ASN 62 Cb 0.00 -0.52 0.60 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 -1.41 1.20 0.02 -1.61 -2.13 113.55 109.62 1pma h SER 63 Ca 0.60 0.00 -0.74 0.00 -0.84 0.00 0.00 61.79 60.81 1pma h SER 63 Cb 1.76 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 64.14 1pma h SER 63 CO -0.43 0.00 1.99 0.00 -1.14 0.00 0.00 176.83 177.24 1pma n ILE 64 N -2.68 5.33 -2.21 3.27 3.06 -0.26 -4.98 119.36 120.90 1pma n ILE 64 Ca -0.01 -4.63 -0.42 0.00 -2.50 0.00 0.00 62.75 55.18 1pma n ILE 64 Cb 0.49 -1.92 -0.03 0.00 0.54 0.00 0.00 39.64 38.72 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 -1.95 4.32 -0.17 9.51 0.41 -0.80 -4.91 118.70 125.11 1pma s GLU 65 Ca 0.51 2.02 0.16 0.00 -0.41 0.00 0.00 54.97 57.25 1pma s GLU 65 Cb 0.20 -3.36 -0.24 0.00 -1.78 0.00 0.00 34.13 28.94 1pma s GLU 65 CO -0.11 -0.47 0.18 1.63 -0.49 0.00 0.00 175.26 176.00 1pma n LYS 66 N 4.41 0.68 -3.25 1.61 5.02 -1.26 -4.83 118.16 120.54 1pma n LYS 66 Ca 0.12 0.06 -0.39 0.00 -2.02 0.00 0.00 58.31 56.07 1pma n LYS 66 Cb 0.43 -1.57 -0.07 0.00 -0.02 0.00 0.00 35.03 33.80 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 5.11 0.03 -0.18 1.01 -1.26 -3.99 121.20 119.40 1pma s ILE 67 Ca -0.10 0.93 0.08 0.00 0.00 0.00 0.00 60.65 61.56 1pma s ILE 67 Cb 0.06 -3.83 -0.02 0.00 0.01 0.00 0.00 42.46 38.68 1pma s ILE 67 CO 0.82 0.17 -0.22 -1.10 0.00 0.00 0.00 174.94 174.61 1pma s GLN 68 N 1.70 1.56 0.12 2.79 -0.21 0.03 -4.98 119.66 120.67 1pma s GLN 68 Ca 0.23 -0.94 -0.18 0.00 0.02 0.00 0.00 55.36 54.50 1pma s GLN 68 Cb -0.15 -1.65 -0.07 0.00 1.00 0.00 0.00 33.01 32.13 1pma s GLN 68 CO 0.09 0.43 0.59 -0.51 -2.12 0.00 0.00 175.29 173.77 1pma s LEU 69 N -1.04 4.44 -0.15 2.90 1.43 -1.26 -0.03 118.68 124.96 1pma s LEU 69 Ca 0.09 1.23 0.14 0.00 -1.03 0.00 0.00 54.13 54.56 1pma s LEU 69 Cb -0.09 -3.13 -0.20 0.00 0.03 0.00 0.00 46.19 42.80 1pma s LEU 69 CO 0.01 0.18 0.07 -0.38 0.23 0.00 0.00 176.35 176.47 1pma n ILE 70 N 1.26 1.04 -3.58 -0.59 5.41 0.27 -4.91 119.36 118.26 1pma n ILE 70 Ca -0.07 -0.67 -0.07 0.00 1.00 0.00 0.00 62.75 62.94 1pma n ILE 70 Cb 0.51 -0.54 -0.04 0.00 -0.71 0.00 0.00 39.64 38.87 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 -4.92 -0.26 0.53 4.38 2.15 -0.84 -4.74 116.67 112.96 1pma s ASP 71 Ca -0.08 0.20 0.09 0.00 0.43 0.00 0.00 52.55 53.19 1pma s ASP 71 Cb 0.05 0.23 0.50 0.00 -0.30 0.00 0.00 42.92 43.40 1pma s ASP 71 CO 0.66 -0.30 1.21 0.44 -0.17 0.00 0.00 175.17 177.01 1pma h ASP 72 N 2.27 0.00 -0.10 -0.34 3.32 -2.00 0.16 116.42 119.74 1pma h ASP 72 Ca -0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.90 1pma h ASP 72 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1pma h ASP 72 CO 0.28 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.58 1pma n TYR 73 N -2.34 0.17 -3.67 4.55 4.02 -1.26 -1.69 117.16 116.94 1pma n TYR 73 Ca -0.01 -0.58 -0.09 0.00 -0.01 0.00 0.00 57.90 57.21 1pma n TYR 73 Cb 0.68 -0.07 -0.09 0.00 -0.02 0.00 0.00 39.34 39.84 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 -1.32 -0.01 0.28 -0.72 0.11 0.58 -2.80 120.40 116.51 1pma s VAL 74 Ca 0.12 0.04 0.02 0.00 -2.93 0.00 0.00 61.98 59.23 1pma s VAL 74 Cb 0.08 -0.80 -0.05 0.00 -1.53 0.00 0.00 36.38 34.07 1pma s VAL 74 CO 0.05 0.02 0.08 0.00 -3.33 0.00 0.00 175.10 171.92 1pma s ALA 75 N 1.44 1.92 -0.00 1.54 0.00 -0.74 -0.56 121.76 125.36 1pma s ALA 75 Ca -0.09 -1.93 -0.18 0.00 0.00 0.00 0.00 51.96 49.76 1pma s ALA 75 Cb -0.07 0.92 0.03 0.00 0.00 0.00 0.00 23.12 24.01 1pma s ALA 75 CO -0.15 -0.41 0.39 0.00 0.00 0.00 0.00 175.76 175.59 1pma s ALA 76 N -3.61 -0.98 -0.00 0.00 0.00 0.95 -1.96 121.76 116.16 1pma s ALA 76 Ca 0.37 0.44 0.06 0.00 0.00 0.00 0.00 51.96 52.83 1pma s ALA 76 Cb 0.08 0.15 -0.02 0.00 0.00 0.00 0.00 23.12 23.34 1pma s ALA 76 CO 0.14 -0.34 -0.18 0.54 0.00 0.00 0.00 175.76 175.92 1pma s VAL 77 N -1.70 1.42 0.22 0.00 0.11 -0.75 -0.79 120.40 118.91 1pma s VAL 77 Ca -0.10 -0.83 0.07 0.00 -2.93 0.00 0.00 61.98 58.18 1pma s VAL 77 Cb -0.03 -1.20 -0.05 0.00 -1.53 0.00 0.00 36.38 33.58 1pma s VAL 77 CO 0.03 0.35 -0.11 0.28 -3.33 0.00 0.00 175.10 172.32 1pma s THR 78 N -0.49 1.60 -0.16 5.04 -1.32 -1.26 -0.90 115.64 118.15 1pma s THR 78 Ca 0.07 -2.16 -0.12 0.00 -1.21 0.00 0.00 61.69 58.27 1pma s THR 78 Cb -0.07 -2.13 0.05 0.00 -1.51 0.00 0.00 72.50 68.84 1pma s THR 78 CO -0.00 -0.53 0.41 -0.55 -2.21 0.00 0.00 174.62 171.73 1pma s SER 79 N -3.33 -0.47 0.00 8.08 0.15 0.29 -4.89 113.70 113.53 1pma s SER 79 Ca 0.24 0.85 0.00 0.00 0.70 0.00 0.00 55.95 57.74 1pma s SER 79 Cb 0.01 0.80 0.00 0.00 -1.71 0.00 0.00 66.02 65.12 1pma s SER 79 CO 0.07 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 174.96 1pma n GLY 80 N 3.58 0.42 3.60 9.45 0.00 -1.26 -1.20 105.19 119.78 1pma n GLY 80 Ca -0.18 -1.50 -0.43 0.00 0.00 0.00 0.00 46.02 43.91 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 3.49 0.19 0.99 2.01 0.19 -4.83 118.68 120.72 1pma s LEU 81 Ca 0.00 1.41 -0.22 0.00 0.01 0.00 0.00 54.13 55.33 1pma s LEU 81 Cb 0.00 -3.51 0.12 0.00 0.01 0.00 0.00 46.19 42.81 1pma s LEU 81 CO 0.00 -1.75 1.57 1.62 1.01 0.00 0.00 176.35 178.79 1pma h VAL 82 N 6.87 0.08 -0.37 -1.59 3.04 -1.95 -0.08 116.25 122.25 1pma h VAL 82 Ca -0.35 0.00 0.07 0.00 -1.01 0.00 0.00 66.70 65.41 1pma h VAL 82 Cb 1.18 0.08 -0.06 0.00 -2.01 0.00 0.00 31.29 30.48 1pma h VAL 82 CO 1.02 0.00 -0.04 0.00 -1.01 0.00 0.00 177.57 177.54 1pma h ALA 83 N 0.97 0.31 -0.45 3.17 0.00 -1.98 -1.17 119.26 120.10 1pma h ALA 83 Ca 0.25 0.12 -0.05 0.00 0.00 0.00 0.00 54.91 55.23 1pma h ALA 83 Cb 0.56 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1pma h ALA 83 CO -0.79 -0.42 0.09 -0.44 0.00 0.00 0.00 179.25 177.68 1pma h ASP 84 N 0.06 0.64 0.73 0.00 5.19 -1.58 -2.82 116.42 118.63 1pma h ASP 84 Ca 0.18 -0.11 -0.04 0.00 -0.62 0.00 0.00 57.03 56.45 1pma h ASP 84 Cb 0.27 -0.17 0.01 0.00 0.18 0.00 0.00 39.33 39.62 1pma h ASP 84 CO -0.34 0.65 -0.35 0.00 -3.12 0.00 0.00 179.24 176.08 1pma h ALA 85 N 1.44 -1.26 -0.56 3.45 0.00 0.07 -2.36 119.26 120.05 1pma h ALA 85 Ca 0.15 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.90 1pma h ALA 85 Cb 0.28 0.38 -0.09 0.00 0.00 0.00 0.00 17.79 18.36 1pma h ALA 85 CO 0.00 -1.19 -0.55 -0.09 0.00 0.00 0.00 179.25 177.42 1pma h ARG 86 N -0.99 -0.27 -0.90 0.00 2.43 -1.20 0.17 114.38 113.61 1pma h ARG 86 Ca -0.10 0.02 0.16 0.00 -0.81 0.00 0.00 59.98 59.25 1pma h ARG 86 Cb 0.75 0.06 -0.10 0.00 -0.42 0.00 0.00 29.97 30.26 1pma h ARG 86 CO 0.16 -0.18 0.49 -0.24 -1.51 0.00 0.00 179.97 178.70 1pma h VAL 87 N -0.28 0.72 -0.57 0.20 3.04 -1.57 -0.67 116.25 117.11 1pma h VAL 87 Ca 0.09 -0.23 -0.04 0.00 -1.01 0.00 0.00 66.70 65.52 1pma h VAL 87 Cb 0.53 -0.01 -0.02 0.00 -2.01 0.00 0.00 31.29 29.78 1pma h VAL 87 CO -0.67 0.12 0.21 0.25 -1.01 0.00 0.00 177.57 176.46 1pma h LEU 88 N 0.67 0.81 0.06 3.16 5.85 -0.22 -1.79 115.31 123.85 1pma h LEU 88 Ca 0.50 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 59.04 1pma h LEU 88 Cb 0.74 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 1pma h LEU 88 CO -0.37 0.78 -0.07 0.58 -0.34 0.00 0.00 178.44 179.02 1pma h VAL 89 N 0.80 0.84 -0.94 1.05 2.07 0.52 -2.09 116.25 118.49 1pma h VAL 89 Ca 0.19 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.80 1pma h VAL 89 Cb 0.24 0.84 -0.07 0.00 -1.52 0.00 0.00 31.29 30.78 1pma h VAL 89 CO -0.01 0.00 0.61 0.44 0.02 0.00 0.00 177.57 178.63 1pma h ASP 90 N -0.15 0.90 -0.51 0.57 3.32 -0.92 -0.75 116.42 118.88 1pma h ASP 90 Ca 0.01 0.02 0.05 0.00 0.02 0.00 0.00 57.03 57.12 1pma h ASP 90 Cb 0.15 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.49 1pma h ASP 90 CO -0.03 0.54 0.25 0.15 -1.72 0.00 0.00 179.24 178.43 1pma h PHE 91 N 1.00 0.46 -0.66 4.55 3.57 -0.68 -1.19 116.94 123.98 1pma h PHE 91 Ca 0.43 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.94 1pma h PHE 91 Cb 0.34 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.91 1pma h PHE 91 CO -0.00 0.22 0.35 0.00 -2.23 0.00 0.00 178.31 176.65 1pma h ALA 92 N 1.28 0.84 0.14 2.41 0.00 -0.60 0.15 119.26 123.48 1pma h ALA 92 Ca 0.22 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1pma h ALA 92 Cb 0.14 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1pma h ALA 92 CO -0.16 0.37 -0.33 0.00 0.00 0.00 0.00 179.25 179.13 1pma h ARG 93 N 0.90 -0.55 -0.25 0.00 3.08 -0.05 0.57 114.38 118.08 1pma h ARG 93 Ca 0.23 0.04 -0.13 0.00 0.07 0.00 0.00 59.98 60.19 1pma h ARG 93 Cb 0.06 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 1pma h ARG 93 CO -0.04 -0.37 -0.37 -0.84 -1.07 0.00 0.00 179.97 177.29 1pma h ILE 94 N -0.57 1.29 -0.84 2.04 3.07 -1.24 -1.71 117.51 119.54 1pma h ILE 94 Ca 0.03 -1.51 0.05 0.00 1.55 0.00 0.00 64.86 64.98 1pma h ILE 94 Cb 0.59 1.51 -0.05 0.00 -0.27 0.00 0.00 36.82 38.60 1pma h ILE 94 CO -0.18 0.48 0.55 -1.28 -1.05 0.00 0.00 178.15 176.66 1pma h SER 95 N 0.46 0.85 0.48 2.16 0.87 0.13 0.78 113.55 119.28 1pma h SER 95 Ca 0.05 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.58 1pma h SER 95 Cb 0.86 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.64 1pma h SER 95 CO 0.07 0.56 -0.23 0.00 -0.53 0.00 0.00 176.83 176.70 1pma h ALA 96 N 1.53 -0.64 -0.77 6.23 0.00 0.74 -2.87 119.26 123.48 1pma h ALA 96 Ca 0.35 -0.18 0.17 0.00 0.00 0.00 0.00 54.91 55.25 1pma h ALA 96 Cb 0.16 0.25 -0.11 0.00 0.00 0.00 0.00 17.79 18.09 1pma h ALA 96 CO -0.12 -0.76 0.24 1.96 0.00 0.00 0.00 179.25 180.57 1pma h GLN 97 N -0.85 0.31 -0.40 0.00 1.08 -0.63 -1.59 115.11 113.03 1pma h GLN 97 Ca -0.07 -0.02 0.08 0.00 -1.45 0.00 0.00 58.65 57.20 1pma h GLN 97 Cb 0.58 -0.07 -0.09 0.00 -0.05 0.00 0.00 27.48 27.85 1pma h GLN 97 CO 0.11 0.21 -0.19 1.96 -0.95 0.00 0.00 178.83 179.97 1pma h GLN 98 N 0.32 -0.11 -0.90 1.46 4.20 -0.65 -0.09 115.11 119.34 1pma h GLN 98 Ca 0.44 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 59.15 1pma h GLN 98 Cb 0.75 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.51 1pma h GLN 98 CO -0.50 -0.07 0.54 1.49 -0.67 0.00 0.00 178.83 179.62 1pma h GLU 99 N -0.11 1.22 -0.17 1.46 4.81 -1.16 -2.31 114.58 118.32 1pma h GLU 99 Ca 0.20 -0.11 0.01 0.00 -0.13 0.00 0.00 59.36 59.33 1pma h GLU 99 Cb 0.42 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 1pma h GLU 99 CO -0.48 0.86 0.08 0.87 -0.73 0.00 0.00 179.01 179.60 1pma h LYS 100 N 1.24 0.16 0.00 1.92 1.57 -0.82 -0.50 116.57 120.14 1pma h LYS 100 Ca 0.32 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 59.04 1pma h LYS 100 Cb -0.05 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 1pma h LYS 100 CO -0.06 0.11 -0.26 -0.24 -0.57 0.00 0.00 179.45 178.42 1pma h VAL 101 N 0.17 0.91 0.03 0.50 3.04 -0.68 0.48 116.25 120.69 1pma h VAL 101 Ca 0.07 -1.01 -0.28 0.00 -1.01 0.00 0.00 66.70 64.47 1pma h VAL 101 Cb 0.02 1.59 -0.03 0.00 -2.01 0.00 0.00 31.29 30.86 1pma h VAL 101 CO -0.05 0.26 -1.53 1.07 -1.01 0.00 0.00 177.57 176.31 1pma n THR 102 N -3.81 1.58 0.70 3.17 5.66 -0.90 -4.44 114.28 116.24 1pma n THR 102 Ca -0.01 -0.19 0.11 0.00 -3.05 0.00 0.00 64.05 60.91 1pma n THR 102 Cb 0.36 -1.96 0.06 0.00 -1.55 0.00 0.00 70.33 67.24 1pma n THR 102 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 1pma n TYR 103 N -4.21 0.20 -0.08 1.09 4.01 -0.22 -4.95 117.16 113.00 1pma n TYR 103 Ca -0.34 0.06 0.00 0.00 -0.16 0.00 0.00 57.90 57.46 1pma n TYR 103 Cb 0.78 -0.36 0.00 0.00 -0.31 0.00 0.00 39.34 39.44 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 1.41 1.57 3.63 2.72 0.00 0.17 -5.00 105.19 109.69 1pma n GLY 104 Ca 0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.94 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 -3.11 -0.54 -1.19 1.61 0.15 -1.22 -4.90 113.70 104.49 1pma s SER 105 Ca 0.00 1.02 -0.18 0.00 0.70 0.00 0.00 55.95 57.50 1pma s SER 105 Cb 0.00 1.03 0.10 0.00 -1.71 0.00 0.00 66.02 65.44 1pma s SER 105 CO 0.00 -0.20 1.54 -0.22 1.20 0.00 0.00 173.24 175.56 1pma s LEU 106 N 0.19 4.25 0.05 3.45 2.96 -1.26 -4.64 118.68 123.68 1pma s LEU 106 Ca 0.02 -2.38 -0.26 0.00 -0.22 0.00 0.00 54.13 51.28 1pma s LEU 106 Cb -0.05 -2.51 -0.17 0.00 0.50 0.00 0.00 46.19 43.96 1pma s LEU 106 CO -0.03 -1.10 1.53 1.62 -1.32 0.00 0.00 176.35 177.05 1pma h VAL 107 N 5.56 0.80 -3.57 1.68 3.04 -1.97 -3.43 116.25 118.36 1pma h VAL 107 Ca 0.34 -0.28 -0.66 0.00 -1.01 0.00 0.00 66.70 65.09 1pma h VAL 107 Cb 0.91 0.96 -0.36 0.00 -2.01 0.00 0.00 31.29 30.79 1pma h VAL 107 CO 1.36 0.06 -0.82 0.21 -1.01 0.00 0.00 177.57 177.37 1pma s ASN 108 N -5.02 3.91 0.43 3.17 3.84 -1.26 -1.47 114.94 118.53 1pma s ASN 108 Ca -0.15 -1.11 0.18 0.00 0.21 0.00 0.00 52.86 51.99 1pma s ASN 108 Cb 0.04 -1.48 0.97 0.00 -0.55 0.00 0.00 41.25 40.23 1pma s ASN 108 CO 0.62 -0.13 1.91 -0.29 -2.79 0.00 0.00 177.10 176.43 1pma h ILE 109 N 6.47 1.00 -0.82 -5.21 2.10 -1.97 -2.37 117.51 116.72 1pma h ILE 109 Ca -0.28 -0.97 0.08 0.00 1.08 0.00 0.00 64.86 64.77 1pma h ILE 109 Cb 1.08 1.55 -0.05 0.00 -1.09 0.00 0.00 36.82 38.31 1pma h ILE 109 CO 0.51 0.26 0.53 -0.08 -1.08 0.00 0.00 178.15 178.30 1pma h GLU 110 N 0.00 0.81 -0.50 2.19 4.81 -2.00 -1.36 114.58 118.53 1pma h GLU 110 Ca -0.00 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.12 1pma h GLU 110 Cb 0.53 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 1pma h GLU 110 CO 0.03 0.53 0.10 -0.97 -0.73 0.00 0.00 179.01 177.98 1pma h ASN 111 N 0.83 0.79 -0.37 1.04 -0.73 -1.86 -1.73 115.58 113.54 1pma h ASN 111 Ca 0.36 -0.25 0.07 0.00 1.87 0.00 0.00 56.30 58.35 1pma h ASN 111 Cb 0.33 -0.21 -0.06 0.00 0.27 0.00 0.00 38.32 38.65 1pma h ASN 111 CO -0.14 0.83 0.01 0.25 -0.37 0.00 0.00 177.43 178.01 1pma h LEU 112 N 0.70 -0.14 -0.43 0.34 5.85 -1.34 -1.47 115.31 118.83 1pma h LEU 112 Ca 0.15 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 1pma h LEU 112 Cb 0.37 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 1pma h LEU 112 CO 0.01 -0.03 0.17 1.62 -0.34 0.00 0.00 178.44 179.87 1pma h VAL 113 N 0.11 1.20 -1.00 1.05 3.04 -1.28 -2.33 116.25 117.04 1pma h VAL 113 Ca 0.18 -0.62 0.17 0.00 -1.01 0.00 0.00 66.70 65.43 1pma h VAL 113 Cb 0.25 0.81 -0.10 0.00 -2.01 0.00 0.00 31.29 30.24 1pma h VAL 113 CO -0.30 0.23 0.61 0.11 -1.01 0.00 0.00 177.57 177.21 1pma h LYS 114 N 0.55 0.80 -0.19 4.17 1.57 -0.37 0.30 116.57 123.39 1pma h LYS 114 Ca 0.14 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.86 1pma h LYS 114 Cb 0.19 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1pma h LYS 114 CO -0.01 0.53 0.05 -0.09 -0.57 0.00 0.00 179.45 179.35 1pma h ARG 115 N 0.82 0.30 0.00 3.15 2.43 -0.78 0.12 114.38 120.41 1pma h ARG 115 Ca 0.55 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.59 1pma h ARG 115 Cb 0.78 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.28 1pma h ARG 115 CO -0.35 0.43 -0.29 -0.24 -1.51 0.00 0.00 179.97 178.01 1pma h VAL 116 N 0.12 1.14 -0.22 0.20 3.04 -1.03 -2.35 116.25 117.16 1pma h VAL 116 Ca 0.06 -1.00 -0.05 0.00 -1.01 0.00 0.00 66.70 64.70 1pma h VAL 116 Cb 0.26 1.55 -0.01 0.00 -2.01 0.00 0.00 31.29 31.08 1pma h VAL 116 CO 0.00 0.28 -0.06 0.00 -1.01 0.00 0.00 177.57 176.78 1pma h ALA 117 N 1.71 0.30 -0.91 3.17 0.00 0.16 -2.95 119.26 120.74 1pma h ALA 117 Ca -0.00 -0.26 0.05 0.00 0.00 0.00 0.00 54.91 54.69 1pma h ALA 117 Cb 0.53 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 1pma h ALA 117 CO 0.04 0.10 0.58 -0.44 0.00 0.00 0.00 179.25 179.53 1pma h ASP 118 N 0.15 0.95 -0.59 0.00 3.32 -0.40 0.22 116.42 120.06 1pma h ASP 118 Ca 0.05 0.00 0.11 0.00 0.02 0.00 0.00 57.03 57.22 1pma h ASP 118 Cb 0.52 -0.20 -0.09 0.00 0.22 0.00 0.00 39.33 39.79 1pma h ASP 118 CO 0.02 0.63 0.10 -0.61 -1.72 0.00 0.00 179.24 177.66 1pma h GLN 119 N 1.10 0.21 -0.07 3.56 -0.00 -1.28 0.57 115.11 119.20 1pma h GLN 119 Ca 0.38 -0.01 -0.01 0.00 -0.00 0.00 0.00 58.65 59.01 1pma h GLN 119 Cb 0.08 -0.05 -0.00 0.00 0.00 0.00 0.00 27.48 27.51 1pma h GLN 119 CO -0.14 0.14 0.01 0.52 0.00 0.00 0.00 178.83 179.36 1pma h MET 120 N 0.22 0.12 -0.78 1.69 2.86 -1.13 -2.95 114.93 114.96 1pma h MET 120 Ca 0.31 -0.03 0.16 0.00 -2.06 0.00 0.00 59.70 58.07 1pma h MET 120 Cb 0.47 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 32.07 1pma h MET 120 CO -0.42 0.35 0.52 0.37 1.06 0.00 0.00 176.91 178.79 1pma h GLN 121 N -0.13 0.42 -0.39 1.72 -0.00 0.24 -1.31 115.11 115.66 1pma h GLN 121 Ca 0.02 -0.03 0.02 0.00 -0.00 0.00 0.00 58.65 58.66 1pma h GLN 121 Cb 0.29 -0.09 -0.03 0.00 0.00 0.00 0.00 27.48 27.65 1pma h GLN 121 CO 0.00 0.28 0.23 1.96 0.00 0.00 0.00 178.83 181.29 1pma h GLN 122 N 0.43 0.45 0.00 1.69 4.20 -0.76 -0.79 115.11 120.33 1pma h GLN 122 Ca 0.39 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.07 1pma h GLN 122 Cb 0.89 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.56 1pma h GLN 122 CO -0.13 0.30 0.00 0.66 -0.67 0.00 0.00 178.83 178.99 1pma n TYR 123 N -4.87 0.00 0.19 2.96 4.02 -0.50 -1.81 117.16 117.15 1pma n TYR 123 Ca 0.01 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.98 1pma n TYR 123 Cb 0.06 -0.25 0.15 0.00 -0.02 0.00 0.00 39.34 39.28 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 0.38 0.00 -0.72 2.02 -1.07 -3.39 112.91 110.13 1pma h THR 124 Ca 0.00 -1.47 0.00 0.00 0.77 0.00 0.00 66.41 65.71 1pma h THR 124 Cb 0.11 2.14 0.00 0.00 -1.74 0.00 0.00 68.15 68.66 1pma h THR 124 CO 0.00 0.21 -0.72 0.00 0.37 0.00 0.00 175.52 175.38 1pma n GLN 125 N -3.17 2.25 -0.47 6.66 10.64 -0.75 -4.86 117.38 127.69 1pma n GLN 125 Ca 0.03 0.00 -0.04 0.00 -1.83 0.00 0.00 57.00 55.16 1pma n GLN 125 Cb 0.60 -0.86 -0.06 0.00 -0.86 0.00 0.00 30.24 29.06 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 -1.32 0.00 -2.40 2.61 4.01 -0.81 -4.93 117.16 114.31 1pma n TYR 126 Ca 0.00 -0.76 0.00 0.00 -0.16 0.00 0.00 57.90 56.98 1pma n TYR 126 Cb 0.17 -0.80 0.00 0.00 -0.31 0.00 0.00 39.34 38.40 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 2.26 2.55 2.11 2.72 0.00 -1.26 -4.55 105.19 109.02 1pma n GLY 127 Ca 0.14 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 0.00 3.64 -0.02 0.00 -1.26 -4.70 105.19 102.85 1pma n GLY 128 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 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 0.90 0.00 -0.15 1.61 0.11 -1.26 -5.15 120.40 116.46 1pma s VAL 129 Ca 0.00 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 58.76 1pma s VAL 129 Cb 0.00 -1.00 -0.00 0.00 -1.53 0.00 0.00 36.38 33.85 1pma s VAL 129 CO 0.00 0.00 1.04 -0.60 -3.33 0.00 0.00 175.10 172.21 1pma s ARG 130 N 1.02 4.35 0.82 1.54 3.52 -1.26 -4.90 118.95 124.03 1pma s ARG 130 Ca -0.05 1.40 -0.14 0.00 -0.13 0.00 0.00 55.73 56.80 1pma s ARG 130 Cb -0.04 -3.59 0.01 0.00 -1.56 0.00 0.00 34.95 29.77 1pma s ARG 130 CO -0.13 -0.46 0.64 -2.30 -0.81 0.00 0.00 175.30 172.25 1pma n PRO 131 N 5.58 0.09 -2.43 5.12 -0.02 -1.26 -4.90 135.00 137.18 1pma n PRO 131 Ca 0.10 0.08 -0.43 0.00 -2.02 0.00 0.00 63.50 61.24 1pma n PRO 131 Cb 0.47 -1.98 -0.02 0.00 -0.02 0.00 0.00 33.50 31.95 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 -2.11 2.95 -1.38 6.00 1.51 -1.26 -4.92 117.35 118.13 1pma s TYR 132 Ca 0.64 1.06 -0.10 0.00 -1.01 0.00 0.00 57.07 57.67 1pma s TYR 132 Cb -0.29 -3.49 0.09 0.00 -0.11 0.00 0.00 41.96 38.17 1pma s TYR 132 CO 0.59 -1.62 2.22 0.41 -1.11 0.00 0.00 175.55 176.05 1pma n GLY 133 N 3.54 4.72 3.45 0.71 0.00 -1.26 -4.56 105.19 111.79 1pma n GLY 133 Ca 0.13 -1.89 -0.12 0.00 0.00 0.00 0.00 46.02 44.13 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 0.91 0.00 0.02 1.61 0.11 -1.26 0.53 120.40 122.32 1pma s VAL 134 Ca 0.49 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.54 1pma s VAL 134 Cb 0.14 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.97 1pma s VAL 134 CO -0.05 0.00 -0.03 -0.44 -3.33 0.00 0.00 175.10 171.26 1pma s SER 135 N -2.46 0.23 0.18 3.54 0.01 -0.34 -2.33 113.70 112.53 1pma s SER 135 Ca -0.00 -0.43 -0.12 0.00 1.31 0.00 0.00 55.95 56.71 1pma s SER 135 Cb -0.01 0.08 0.00 0.00 0.21 0.00 0.00 66.02 66.31 1pma s SER 135 CO -0.09 -0.25 0.37 -1.48 0.41 0.00 0.00 173.24 172.20 1pma s LEU 136 N -1.25 0.64 -0.06 2.44 0.05 -0.13 -0.55 118.68 119.82 1pma s LEU 136 Ca -0.13 -0.78 0.03 0.00 0.05 0.00 0.00 54.13 53.30 1pma s LEU 136 Cb -0.09 1.52 0.00 0.00 -2.05 0.00 0.00 46.19 45.57 1pma s LEU 136 CO -0.01 -0.97 -0.15 0.27 -0.55 0.00 0.00 176.35 174.94 1pma s ILE 137 N -3.95 1.35 -0.15 1.48 -4.36 -0.08 -0.56 121.20 114.93 1pma s ILE 137 Ca 0.16 -0.63 -0.05 0.00 -0.26 0.00 0.00 60.65 59.86 1pma s ILE 137 Cb 0.02 -1.19 -0.04 0.00 1.25 0.00 0.00 42.46 42.50 1pma s ILE 137 CO 0.01 0.40 0.03 -0.36 0.24 0.00 0.00 174.94 175.25 1pma s PHE 138 N 0.36 3.20 -0.04 1.37 0.08 0.83 -1.81 117.98 121.97 1pma s PHE 138 Ca -0.10 0.05 -0.12 0.00 0.12 0.00 0.00 56.93 56.88 1pma s PHE 138 Cb -0.14 -1.98 0.02 0.00 -0.57 0.00 0.00 43.02 40.35 1pma s PHE 138 CO 0.04 0.22 0.27 0.00 -0.10 0.00 0.00 175.22 175.65 1pma s ALA 139 N -0.01 -0.67 0.00 5.36 0.00 -0.83 0.11 121.76 125.73 1pma s ALA 139 Ca 0.04 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.39 1pma s ALA 139 Cb -0.12 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 22.90 1pma s ALA 139 CO 0.01 -0.21 0.00 0.41 0.00 0.00 0.00 175.76 175.97 1pma n GLY 140 N 1.84 -1.92 3.21 0.00 0.00 -0.93 -1.79 105.19 105.59 1pma n GLY 140 Ca -0.19 -1.18 -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 -2.49 2.44 0.03 -0.61 -1.16 -1.12 0.02 121.20 118.31 1pma s ILE 141 Ca 0.00 -0.84 0.00 0.00 -0.51 0.00 0.00 60.65 59.30 1pma s ILE 141 Cb 0.00 -2.02 0.00 0.00 0.61 0.00 0.00 42.46 41.05 1pma s ILE 141 CO 0.00 0.52 0.02 -0.90 -2.81 0.00 0.00 174.94 171.77 1pma n ASP 142 N 4.24 1.19 -0.22 4.50 3.85 0.42 -4.89 116.55 125.64 1pma n ASP 142 Ca -0.20 -1.11 0.18 0.00 -0.71 0.00 0.00 54.79 52.95 1pma n ASP 142 Cb 0.51 0.00 0.51 0.00 -1.35 0.00 0.00 41.12 40.79 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 0.40 -0.06 0.11 5.75 -1.51 0.55 115.11 120.34 1pma h GLN 143 Ca -0.02 -0.02 -0.25 0.00 -0.15 0.00 0.00 58.65 58.20 1pma h GLN 143 Cb 0.07 -0.09 0.02 0.00 1.07 0.00 0.00 27.48 28.55 1pma h GLN 143 CO 0.03 0.26 -0.94 0.82 -2.65 0.00 0.00 178.83 176.35 1pma h ILE 144 N 0.41 1.28 0.00 2.39 2.04 -1.95 -3.51 117.51 118.16 1pma h ILE 144 Ca 0.44 -2.14 0.00 0.00 1.00 0.00 0.00 64.86 64.16 1pma h ILE 144 Cb 1.07 2.22 0.00 0.00 -0.74 0.00 0.00 36.82 39.38 1pma h ILE 144 CO -0.16 0.67 0.00 0.61 0.00 0.00 0.00 178.15 179.27 1pma n GLY 145 N 0.94 0.29 3.73 5.37 0.00 0.18 -5.09 105.19 110.60 1pma n GLY 145 Ca -0.10 -1.50 -0.42 0.00 0.00 0.00 0.00 46.02 44.01 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 4.40 0.14 1.61 0.02 -1.26 -0.43 135.00 137.47 1pma s PRO 146 Ca 0.00 2.00 0.05 0.00 0.02 0.00 0.00 61.00 63.07 1pma s PRO 146 Cb 0.00 -3.23 -0.04 0.00 0.02 0.00 0.00 34.50 31.25 1pma s PRO 146 CO 0.00 -0.26 -0.11 1.03 -0.33 0.00 0.00 177.00 177.32 1pma s ARG 147 N 0.23 1.06 -0.18 5.54 0.52 0.10 -4.93 118.95 121.29 1pma s ARG 147 Ca 0.58 -1.40 -0.07 0.00 -0.52 0.00 0.00 55.73 54.32 1pma s ARG 147 Cb -0.35 -0.71 0.08 0.00 0.52 0.00 0.00 34.95 34.49 1pma s ARG 147 CO 0.35 0.10 0.40 -1.17 0.02 0.00 0.00 175.30 175.01 1pma s LEU 148 N -2.99 -0.49 0.08 2.53 2.96 -1.26 -2.20 118.68 117.32 1pma s LEU 148 Ca 0.15 0.93 0.03 0.00 -0.22 0.00 0.00 54.13 55.02 1pma s LEU 148 Cb 0.00 1.28 -0.03 0.00 0.50 0.00 0.00 46.19 47.94 1pma s LEU 148 CO 0.02 -0.22 -0.09 -0.36 -1.32 0.00 0.00 176.35 174.37 1pma s PHE 149 N 2.32 0.94 0.13 5.38 0.40 0.12 -1.39 117.98 125.88 1pma s PHE 149 Ca -0.03 -0.66 0.07 0.00 -0.60 0.00 0.00 56.93 55.70 1pma s PHE 149 Cb -0.11 -0.53 -0.04 0.00 0.51 0.00 0.00 43.02 42.85 1pma s PHE 149 CO -0.12 -0.05 -0.15 0.16 0.70 0.00 0.00 175.22 175.75 1pma s ASP 150 N -2.33 2.18 -0.12 1.36 -4.77 -0.64 -0.12 116.67 112.23 1pma s ASP 150 Ca 0.03 -0.81 -0.07 0.00 -3.30 0.00 0.00 52.55 48.39 1pma s ASP 150 Cb -0.03 -0.09 0.04 0.00 -1.09 0.00 0.00 42.92 41.75 1pma s ASP 150 CO -0.01 -0.11 0.29 0.00 0.70 0.00 0.00 175.17 176.04 1pma s ASP 152 N 0.95 4.93 0.57 0.00 -4.77 -1.08 -0.95 116.67 116.31 1pma s ASP 152 Ca -0.07 -0.87 0.28 0.00 -3.30 0.00 0.00 52.55 48.60 1pma s ASP 152 Cb -0.07 -0.34 1.51 0.00 -1.09 0.00 0.00 42.92 42.93 1pma s ASP 152 CO -0.07 -0.76 1.98 -0.65 0.70 0.00 0.00 175.17 176.37 1pma h PRO 153 N 0.96 0.00 0.00 2.11 0.11 -1.70 0.73 132.00 134.20 1pma h PRO 153 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1pma h PRO 153 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1pma h PRO 153 CO 0.57 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.36 1pma h ALA 154 N 1.62 1.00 0.00 -0.75 0.00 -1.89 -3.43 119.26 115.81 1pma h ALA 154 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1pma h ALA 154 Cb 0.93 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1pma h ALA 154 CO -0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1pma n GLY 155 N 0.35 0.88 3.74 0.00 0.00 0.25 -4.33 105.19 106.08 1pma n GLY 155 Ca 0.02 -0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 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 4.48 -0.05 2.61 2.01 -1.25 -4.79 115.64 116.64 1pma s THR 156 Ca 0.00 1.93 0.02 0.00 0.31 0.00 0.00 61.69 63.95 1pma s THR 156 Cb 0.00 -4.26 0.01 0.00 0.01 0.00 0.00 72.50 68.27 1pma s THR 156 CO 0.00 0.38 -0.10 -0.51 -0.69 0.00 0.00 174.62 173.70 1pma s ILE 157 N -0.31 0.91 0.02 1.82 2.07 -1.26 -2.64 121.20 121.81 1pma s ILE 157 Ca 0.43 -0.36 -0.00 0.00 -1.41 0.00 0.00 60.65 59.31 1pma s ILE 157 Cb -0.23 -0.85 -0.02 0.00 0.13 0.00 0.00 42.46 41.49 1pma s ILE 157 CO 0.28 0.30 -0.03 0.20 -1.91 0.00 0.00 174.94 173.78 1pma s ASN 158 N 0.64 0.24 -0.13 4.50 -0.87 -1.11 -4.99 114.94 113.22 1pma s ASN 158 Ca -0.12 -0.51 -0.07 0.00 -1.57 0.00 0.00 52.86 50.59 1pma s ASN 158 Cb -0.14 0.10 -0.04 0.00 -0.02 0.00 0.00 41.25 41.15 1pma s ASN 158 CO 0.02 -0.31 0.12 -0.70 -2.57 0.00 0.00 177.10 173.66 1pma s GLU 159 N -1.52 3.56 0.36 -0.60 2.12 -1.26 -1.62 118.70 119.73 1pma s GLU 159 Ca -0.15 -0.19 0.06 0.00 0.36 0.00 0.00 54.97 55.04 1pma s GLU 159 Cb -0.10 -3.19 -0.07 0.00 0.26 0.00 0.00 34.13 31.04 1pma s GLU 159 CO -0.01 0.65 0.02 0.71 -0.54 0.00 0.00 175.26 176.09 1pma s TYR 160 N -0.67 2.24 -0.15 5.30 1.51 -0.49 -5.00 117.35 120.08 1pma s TYR 160 Ca 0.13 -0.79 0.12 0.00 -1.01 0.00 0.00 57.07 55.52 1pma s TYR 160 Cb -0.12 -1.51 -0.23 0.00 -0.11 0.00 0.00 41.96 39.99 1pma s TYR 160 CO 0.02 0.26 0.24 1.17 -1.11 0.00 0.00 175.55 176.13 1pma n LYS 161 N -0.81 0.67 -3.59 -0.62 3.00 -1.26 -4.47 118.16 111.08 1pma n LYS 161 Ca -0.04 0.13 -0.10 0.00 -0.00 0.00 0.00 58.31 58.30 1pma n LYS 161 Cb 0.66 -1.62 -0.05 0.00 0.00 0.00 0.00 35.03 34.02 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 -2.53 -1.95 0.14 3.14 0.00 -1.26 -1.12 121.76 118.17 1pma s ALA 162 Ca -0.13 1.64 -0.25 0.00 0.00 0.00 0.00 51.96 53.22 1pma s ALA 162 Cb 0.07 -0.86 0.08 0.00 0.00 0.00 0.00 23.12 22.40 1pma s ALA 162 CO 0.79 -0.29 1.04 -0.08 0.00 0.00 0.00 175.76 177.22 1pma s THR 163 N -0.88 0.00 0.23 0.00 -1.32 -0.23 -4.99 115.64 108.45 1pma s THR 163 Ca -0.01 -0.57 -0.07 0.00 -1.21 0.00 0.00 61.69 59.83 1pma s THR 163 Cb -0.01 -2.29 -0.02 0.00 -1.51 0.00 0.00 72.50 68.67 1pma s THR 163 CO -0.00 0.00 0.33 0.00 -2.21 0.00 0.00 174.62 172.74 1pma s ALA 164 N -2.79 0.40 0.08 11.08 0.00 -1.26 -0.90 121.76 128.36 1pma s ALA 164 Ca 0.16 -1.25 -0.20 0.00 0.00 0.00 0.00 51.96 50.67 1pma s ALA 164 Cb -0.01 1.21 0.05 0.00 0.00 0.00 0.00 23.12 24.37 1pma s ALA 164 CO 0.02 -0.74 0.47 -1.50 0.00 0.00 0.00 175.76 174.01 1pma s ILE 165 N -4.05 0.04 0.00 0.00 1.10 0.24 -4.91 121.20 113.62 1pma s ILE 165 Ca 0.30 -0.36 0.00 0.00 -0.51 0.00 0.00 60.65 60.07 1pma s ILE 165 Cb 0.03 -1.03 0.00 0.00 0.15 0.00 0.00 42.46 41.61 1pma s ILE 165 CO 0.11 -0.20 0.00 0.61 -2.11 0.00 0.00 174.94 173.35 1pma n GLY 166 N 0.18 0.07 0.13 1.50 0.00 -1.25 0.31 105.19 106.12 1pma n GLY 166 Ca -0.18 -2.01 -0.05 0.00 0.00 0.00 0.00 46.02 43.78 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 -0.31 -0.26 1.61 0.87 -1.17 -3.22 113.55 111.07 1pma h SER 167 Ca 0.00 0.01 -0.17 0.00 -1.23 0.00 0.00 61.79 60.40 1pma h SER 167 Cb 0.00 0.09 -0.08 0.00 -0.44 0.00 0.00 62.40 61.97 1pma h SER 167 CO 0.00 -0.20 0.22 0.61 -0.53 0.00 0.00 176.83 176.94 1pma n GLY 168 N -1.16 3.30 0.39 5.77 0.00 -1.26 -4.58 105.19 107.65 1pma n GLY 168 Ca -0.04 -0.56 -0.15 0.00 0.00 0.00 0.00 46.02 45.27 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 1.14 -0.84 -0.89 1.61 3.64 -1.83 -2.28 116.57 117.13 1pma h LYS 169 Ca 0.16 0.06 0.24 0.00 -1.27 0.00 0.00 60.65 59.84 1pma h LYS 169 Cb 1.01 0.19 -0.14 0.00 -0.41 0.00 0.00 32.23 32.88 1pma h LYS 169 CO 0.40 -0.56 0.28 -0.44 -2.27 0.00 0.00 179.45 176.86 1pma h ASP 170 N -0.87 0.08 0.41 4.20 3.32 -1.89 0.31 116.42 121.98 1pma h ASP 170 Ca -0.07 0.19 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 1pma h ASP 170 Cb 0.72 0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.51 1pma h ASP 170 CO 0.03 -0.14 -0.20 0.00 -1.72 0.00 0.00 179.24 177.22 1pma h ALA 171 N 1.78 -0.96 -0.69 3.45 0.00 -1.87 -2.16 119.26 118.82 1pma h ALA 171 Ca 0.57 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.42 1pma h ALA 171 Cb 1.15 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 19.10 1pma h ALA 171 CO -0.64 -0.92 0.38 -0.24 0.00 0.00 0.00 179.25 177.83 1pma h VAL 172 N -0.64 0.94 -0.64 0.00 3.04 -1.00 0.38 116.25 118.33 1pma h VAL 172 Ca -0.06 -0.23 0.09 0.00 -1.01 0.00 0.00 66.70 65.49 1pma h VAL 172 Cb 0.42 0.20 -0.04 0.00 -2.01 0.00 0.00 31.29 29.86 1pma h VAL 172 CO 0.09 0.12 0.42 1.62 -1.01 0.00 0.00 177.57 178.82 1pma h VAL 173 N 0.68 0.94 -0.10 1.51 3.04 -0.43 -1.78 116.25 120.12 1pma h VAL 173 Ca 0.32 -0.18 -0.06 0.00 -1.01 0.00 0.00 66.70 65.76 1pma h VAL 173 Cb 0.23 0.36 0.00 0.00 -2.01 0.00 0.00 31.29 29.88 1pma h VAL 173 CO -0.20 0.10 -0.19 0.28 -1.01 0.00 0.00 177.57 176.54 1pma h SER 174 N 0.53 0.34 -0.31 3.17 0.02 -0.26 0.06 113.55 117.10 1pma h SER 174 Ca 0.29 -0.55 0.07 0.00 -0.84 0.00 0.00 61.79 60.76 1pma h SER 174 Cb 0.44 -0.10 -0.08 0.00 0.14 0.00 0.00 62.40 62.81 1pma h SER 174 CO -0.09 0.83 -0.23 0.15 -1.14 0.00 0.00 176.83 176.35 1pma h PHE 175 N -0.13 -0.60 0.39 3.45 3.04 -0.50 -1.61 116.94 120.97 1pma h PHE 175 Ca 0.00 0.04 -0.01 0.00 3.98 0.00 0.00 57.97 61.98 1pma h PHE 175 Cb 0.77 0.31 -0.01 0.00 2.56 0.00 0.00 35.95 39.58 1pma h PHE 175 CO 0.11 -0.31 -0.25 -0.07 -2.02 0.00 0.00 178.31 175.77 1pma h LEU 176 N -0.20 -0.63 -1.68 0.59 -0.00 -1.39 0.24 115.31 112.22 1pma h LEU 176 Ca 0.16 0.04 0.49 0.00 -0.00 0.00 0.00 57.88 58.57 1pma h LEU 176 Cb 0.45 0.19 -0.07 0.00 -0.00 0.00 0.00 40.66 41.23 1pma h LEU 176 CO -0.43 -0.39 1.21 1.21 -0.00 0.00 0.00 178.44 180.04 1pma n GLU 177 N -5.38 -0.00 -0.09 1.13 4.07 0.00 -0.35 120.64 120.02 1pma n GLU 177 Ca -0.10 0.95 -0.18 0.00 -0.06 0.00 0.00 57.16 57.77 1pma n GLU 177 Cb 0.28 -2.16 -0.06 0.00 -0.06 0.00 0.00 31.44 29.44 1pma n GLU 177 CO 0.00 0.00 0.00 -2.13 -0.06 0.00 0.00 177.13 174.94 1pma n ARG 178 N -3.71 0.46 -0.62 5.31 0.63 -0.74 -4.72 116.66 113.27 1pma n ARG 178 Ca 0.38 0.20 0.06 0.00 -0.92 0.00 0.00 57.85 57.57 1pma n ARG 178 Cb 1.73 -1.29 0.30 0.00 0.45 0.00 0.00 32.46 33.65 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 -4.12 3.69 -2.53 -0.14 1.02 0.76 -4.95 120.64 114.36 1pma n GLU 179 Ca -0.32 -2.36 -0.42 0.00 -0.02 0.00 0.00 57.16 54.04 1pma n GLU 179 Cb 0.66 -1.97 -0.03 0.00 -0.02 0.00 0.00 31.44 30.09 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 -2.14 3.32 -0.41 -0.32 5.04 0.53 -4.93 117.35 118.44 1pma s TYR 180 Ca 0.41 1.35 -0.12 0.00 -2.44 0.00 0.00 57.07 56.27 1pma s TYR 180 Cb 0.30 -3.35 0.05 0.00 0.35 0.00 0.00 41.96 39.31 1pma s TYR 180 CO 0.15 -0.96 0.28 0.21 -1.34 0.00 0.00 175.55 173.89 1pma s LYS 181 N 2.00 2.82 0.00 4.97 2.47 -1.26 -5.04 119.74 125.70 1pma s LYS 181 Ca 0.54 -1.23 0.00 0.00 -1.56 0.00 0.00 55.97 53.72 1pma s LYS 181 Cb -0.23 -3.87 0.00 0.00 -1.46 0.00 0.00 37.83 32.27 1pma s LYS 181 CO 0.22 -0.85 0.03 -1.91 0.16 0.00 0.00 175.35 173.01 1pma n GLU 182 N 5.05 0.00 -1.24 4.03 4.07 -1.26 -1.99 120.64 129.30 1pma n GLU 182 Ca -0.11 0.03 -0.26 0.00 -0.06 0.00 0.00 57.16 56.76 1pma n GLU 182 Cb 0.45 -0.17 0.03 0.00 -0.06 0.00 0.00 31.44 31.68 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 -0.15 6.94 -4.69 4.31 5.03 -1.26 -4.64 115.26 120.79 1pma n ASN 183 Ca 0.00 -3.38 -0.44 0.00 0.87 0.00 0.00 54.58 51.63 1pma n ASN 183 Cb 0.00 -1.07 -0.03 0.00 -1.02 0.00 0.00 39.78 37.66 1pma n ASN 183 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 1pma n LEU 184 N 0.00 3.46 -4.77 3.41 7.94 -0.84 -4.03 117.00 122.17 1pma n LEU 184 Ca 0.46 1.11 -0.39 0.00 -1.11 0.00 0.00 56.01 56.07 1pma n LEU 184 Cb 0.56 -1.48 -0.02 0.00 0.53 0.00 0.00 43.42 43.01 1pma n LEU 184 CO 0.50 -0.20 0.88 -2.84 -1.11 0.00 0.00 177.39 174.62 1pma s PRO 185 N 0.29 4.22 0.01 1.96 0.02 -1.26 -0.59 135.00 139.64 1pma s PRO 185 Ca 0.72 1.95 -0.01 0.00 0.02 0.00 0.00 61.00 63.68 1pma s PRO 185 Cb -0.61 -2.87 -0.00 0.00 0.02 0.00 0.00 34.50 31.04 1pma s PRO 185 CO 0.42 -0.21 0.55 -1.91 -0.33 0.00 0.00 177.00 175.53 1pma n GLU 186 N 0.44 -0.01 -0.31 5.54 2.13 -1.26 -0.28 120.64 126.88 1pma n GLU 186 Ca 0.02 0.55 0.17 0.00 0.66 0.00 0.00 57.16 58.57 1pma n GLU 186 Cb 0.45 -0.83 0.36 0.00 0.27 0.00 0.00 31.44 31.69 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 0.24 -0.01 5.31 3.64 -2.00 0.53 116.57 124.29 1pma h LYS 187 Ca 0.01 -0.01 -0.25 0.00 -1.27 0.00 0.00 60.65 59.12 1pma h LYS 187 Cb 0.01 -0.05 0.01 0.00 -0.41 0.00 0.00 32.23 31.79 1pma h LYS 187 CO -0.03 0.16 -0.99 0.93 -2.27 0.00 0.00 179.45 177.25 1pma h GLU 188 N 0.25 0.60 -0.07 1.90 5.08 -1.01 -2.78 114.58 118.55 1pma h GLU 188 Ca 0.62 -0.63 0.03 0.00 -1.00 0.00 0.00 59.36 58.37 1pma h GLU 188 Cb 1.32 0.18 -0.03 0.00 0.50 0.00 0.00 28.75 30.72 1pma h GLU 188 CO -0.64 1.24 -0.09 0.00 -1.00 0.00 0.00 179.01 178.52 1pma h ALA 189 N 0.54 -0.04 -0.39 3.43 0.00 0.24 0.25 119.26 123.30 1pma h ALA 189 Ca -0.11 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1pma h ALA 189 Cb 1.63 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.58 1pma h ALA 189 CO 0.19 -0.56 0.23 -0.24 0.00 0.00 0.00 179.25 178.87 1pma h VAL 190 N -0.12 1.11 0.18 0.00 3.04 -0.84 -0.21 116.25 119.41 1pma h VAL 190 Ca 0.06 -0.26 -0.01 0.00 -1.01 0.00 0.00 66.70 65.48 1pma h VAL 190 Cb 0.20 0.57 0.00 0.00 -2.01 0.00 0.00 31.29 30.06 1pma h VAL 190 CO -0.14 0.12 -0.09 0.74 -1.01 0.00 0.00 177.57 177.19 1pma h THR 191 N 0.53 0.91 -0.82 3.17 2.02 -0.70 0.63 112.91 118.65 1pma h THR 191 Ca 0.14 -0.43 0.10 0.00 0.77 0.00 0.00 66.41 66.98 1pma h THR 191 Cb -0.02 1.17 -0.07 0.00 -1.74 0.00 0.00 68.15 67.49 1pma h THR 191 CO -0.03 0.10 0.47 0.25 0.37 0.00 0.00 175.52 176.68 1pma h LEU 192 N -0.46 0.66 0.83 2.58 5.85 -0.12 -0.03 115.31 124.63 1pma h LEU 192 Ca -0.02 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.70 1pma h LEU 192 Cb 0.35 -0.08 0.01 0.00 0.37 0.00 0.00 40.66 41.31 1pma h LEU 192 CO 0.04 0.37 -0.40 1.23 -0.34 0.00 0.00 178.44 179.35 1pma h GLY 193 N 0.78 -1.16 0.13 3.75 0.00 -0.71 0.71 103.07 106.56 1pma h GLY 193 Ca 0.40 0.43 0.19 0.00 0.00 0.00 0.00 47.33 48.35 1pma h GLY 193 CO -0.25 -0.42 0.60 1.19 0.00 0.00 0.00 176.54 177.65 1pma h ILE 194 N -1.15 0.70 0.37 2.60 2.10 -0.61 0.57 117.51 122.10 1pma h ILE 194 Ca -0.11 -0.26 -0.02 0.00 1.08 0.00 0.00 64.86 65.55 1pma h ILE 194 Cb 0.85 -0.12 0.00 0.00 -1.09 0.00 0.00 36.82 36.47 1pma h ILE 194 CO 0.19 0.14 -0.18 0.50 -1.08 0.00 0.00 178.15 177.72 1pma h LYS 195 N 0.75 -0.48 -0.68 2.19 3.64 -0.83 0.32 116.57 121.48 1pma h LYS 195 Ca 0.57 0.03 0.07 0.00 -1.27 0.00 0.00 60.65 60.06 1pma h LYS 195 Cb 0.89 0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 32.76 1pma h LYS 195 CO -0.38 -0.29 0.37 0.00 -2.27 0.00 0.00 179.45 176.87 1pma h ALA 196 N 0.07 0.93 -0.50 5.00 0.00 0.18 -0.56 119.26 124.38 1pma h ALA 196 Ca -0.05 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1pma h ALA 196 Cb 0.41 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1pma h ALA 196 CO 0.08 0.02 0.23 1.25 0.00 0.00 0.00 179.25 180.83 1pma h LEU 197 N 0.66 0.66 0.00 0.00 5.85 0.37 -2.97 115.31 119.88 1pma h LEU 197 Ca 0.32 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1pma h LEU 197 Cb 0.24 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.10 1pma h LEU 197 CO -0.21 0.62 0.00 1.17 -0.34 0.00 0.00 178.44 179.68 1pma n LYS 198 N -4.59 0.00 -0.16 1.25 4.81 0.11 -2.87 118.16 116.71 1pma n LYS 198 Ca 0.02 0.51 -0.04 0.00 -0.87 0.00 0.00 58.31 57.93 1pma n LYS 198 Cb 0.13 -1.34 -0.04 0.00 0.02 0.00 0.00 35.03 33.80 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 -1.82 -0.41 0.00 3.14 3.41 -0.43 0.53 113.62 118.04 1pma n SER 199 Ca 0.00 0.84 0.00 0.00 -0.26 0.00 0.00 58.87 59.45 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 -4.07 0.00 0.25 4.04 2.88 -1.12 -2.48 113.62 113.11 1pma n SER 200 Ca 0.01 0.20 0.17 0.00 -1.33 0.00 0.00 58.87 57.92 1pma n SER 200 Cb 0.10 0.00 0.77 0.00 -0.75 0.00 0.00 64.21 64.33 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 -3.44 2.46 7.12 -1.38 -3.33 115.31 116.74 1pma h LEU 201 Ca 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 57.88 58.00 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 -0.01 -0.62 -0.13 0.00 0.00 178.44 177.68 1pma n GLU 202 N -2.78 0.75 0.09 1.25 4.71 0.19 -3.26 120.64 121.58 1pma n GLU 202 Ca -0.00 -0.08 -0.07 0.00 -0.01 0.00 0.00 57.16 57.00 1pma n GLU 202 Cb 0.19 -1.24 0.01 0.00 -1.01 0.00 0.00 31.44 29.39 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 0.15 -0.97 3.49 4.22 -1.74 -2.96 114.58 118.99 1pma h GLU 203 Ca 0.01 -0.16 -0.18 0.00 0.08 0.00 0.00 59.36 59.11 1pma h GLU 203 Cb 0.71 0.04 -0.11 0.00 0.50 0.00 0.00 28.75 29.90 1pma h GLU 203 CO 0.04 0.90 0.23 0.41 -2.18 0.00 0.00 179.01 178.41 1pma n GLY 204 N 0.80 2.90 5.14 1.92 0.00 -1.20 -4.97 105.19 109.77 1pma n GLY 204 Ca -0.03 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.12 0.00 -1.70 1.61 4.07 -1.12 -4.83 120.64 118.56 1pma n GLU 205 Ca 0.23 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 56.91 1pma n GLU 205 Cb 0.94 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 32.29 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 0.27 5.31 2.12 -1.26 -4.85 118.70 124.43 1pma s GLU 206 Ca 0.00 2.60 0.25 0.00 0.36 0.00 0.00 54.97 58.19 1pma s GLU 206 Cb 0.00 -3.84 0.74 0.00 0.26 0.00 0.00 34.13 31.29 1pma s GLU 206 CO 0.00 -0.89 1.74 1.25 -0.54 0.00 0.00 175.26 176.82 1pma h LEU 207 N 9.51 0.00 0.00 2.70 5.85 -1.97 -3.48 115.31 127.91 1pma h LEU 207 Ca -0.48 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.24 1pma h LEU 207 Cb 1.23 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.26 1pma h LEU 207 CO 0.95 0.00 0.00 1.17 -0.34 0.00 0.00 178.44 180.22 1pma n LYS 208 N -2.46 0.00 -3.69 1.25 3.00 -1.26 -4.39 118.16 110.61 1pma n LYS 208 Ca 0.05 0.00 -0.39 0.00 -0.00 0.00 0.00 58.31 57.97 1pma n LYS 208 Cb 0.43 0.00 -0.11 0.00 0.00 0.00 0.00 35.03 35.35 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 -1.90 3.16 0.61 3.14 0.00 -1.26 -5.06 121.76 120.44 1pma s ALA 209 Ca 0.00 -1.92 -0.15 0.00 0.00 0.00 0.00 51.96 49.89 1pma s ALA 209 Cb 0.00 -2.44 -0.03 0.00 0.00 0.00 0.00 23.12 20.65 1pma s ALA 209 CO 0.00 -1.47 1.06 -2.14 0.00 0.00 0.00 175.76 173.20 1pma s PRO 210 N 1.41 3.28 -0.22 0.00 0.02 -1.26 -3.36 135.00 134.87 1pma s PRO 210 Ca 0.01 1.17 -0.05 0.00 0.02 0.00 0.00 61.00 62.15 1pma s PRO 210 Cb -0.21 -2.03 -0.02 0.00 0.02 0.00 0.00 34.50 32.27 1pma s PRO 210 CO 0.03 -0.84 -0.01 -2.00 -0.33 0.00 0.00 177.00 173.85 1pma s GLU 211 N -4.20 3.50 0.02 5.54 2.12 0.13 -4.83 118.70 120.99 1pma s GLU 211 Ca 0.63 -0.57 0.02 0.00 0.36 0.00 0.00 54.97 55.41 1pma s GLU 211 Cb -0.16 -3.09 -0.02 0.00 0.26 0.00 0.00 34.13 31.13 1pma s GLU 211 CO 0.39 -0.13 -0.06 -1.50 -0.54 0.00 0.00 175.26 173.42 1pma s ILE 212 N 1.36 0.39 0.00 -3.70 2.07 -1.26 0.04 121.20 120.10 1pma s ILE 212 Ca 0.04 -0.74 -0.13 0.00 -1.41 0.00 0.00 60.65 58.41 1pma s ILE 212 Cb -0.15 -0.44 0.02 0.00 0.13 0.00 0.00 42.46 42.03 1pma s ILE 212 CO -0.00 -0.24 0.27 0.00 -1.91 0.00 0.00 174.94 173.06 1pma s ALA 213 N -0.95 -0.65 -0.08 1.50 0.00 -0.16 -1.85 121.76 119.58 1pma s ALA 213 Ca -0.07 0.13 -0.15 0.00 0.00 0.00 0.00 51.96 51.87 1pma s ALA 213 Cb -0.07 0.14 0.03 0.00 0.00 0.00 0.00 23.12 23.22 1pma s ALA 213 CO -0.00 -0.28 0.37 -1.54 0.00 0.00 0.00 175.76 174.31 1pma s SER 214 N -1.53 -0.32 0.05 0.00 1.04 0.34 -0.16 113.70 113.12 1pma s SER 214 Ca -0.12 0.45 0.05 0.00 0.48 0.00 0.00 55.95 56.81 1pma s SER 214 Cb -0.05 0.55 -0.02 0.00 0.10 0.00 0.00 66.02 66.60 1pma s SER 214 CO 0.02 -0.32 -0.15 -0.51 0.98 0.00 0.00 173.24 173.26 1pma s ILE 215 N -0.62 1.19 -0.01 -1.02 2.07 -0.59 -1.48 121.20 120.74 1pma s ILE 215 Ca -0.07 -1.09 0.06 0.00 -1.41 0.00 0.00 60.65 58.14 1pma s ILE 215 Cb -0.04 -1.08 -0.01 0.00 0.13 0.00 0.00 42.46 41.46 1pma s ILE 215 CO 0.03 -0.01 -0.18 0.28 -1.91 0.00 0.00 174.94 173.15 1pma s THR 216 N -0.92 1.41 0.16 4.00 -1.32 -1.26 -0.82 115.64 116.90 1pma s THR 216 Ca 0.02 -0.77 -0.31 0.00 -1.21 0.00 0.00 61.69 59.42 1pma s THR 216 Cb -0.08 -1.17 -0.17 0.00 -1.51 0.00 0.00 72.50 69.56 1pma s THR 216 CO 0.02 0.40 0.80 0.55 -2.21 0.00 0.00 174.62 174.17 1pma n VAL 217 N 2.64 1.37 0.00 5.08 3.14 0.61 -1.82 118.33 129.35 1pma n VAL 217 Ca -0.15 -0.34 0.00 0.00 -2.96 0.00 0.00 64.34 60.89 1pma n VAL 217 Cb 0.54 -0.24 0.00 0.00 -1.06 0.00 0.00 33.84 33.08 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 1.81 3.34 2.21 7.55 0.00 -1.26 -5.02 105.19 113.82 1pma n GLY 218 Ca 0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.08 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 0.00 -0.77 -4.91 1.61 6.94 -0.76 -5.17 115.26 112.21 1pma n ASN 219 Ca 0.00 -2.32 -0.28 0.00 -0.02 0.00 0.00 54.58 51.96 1pma n ASN 219 Cb 0.00 1.51 0.05 0.00 -2.36 0.00 0.00 39.78 38.99 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 -2.65 2.58 0.53 -3.83 1.02 -1.26 -4.54 119.74 111.59 1pma s LYS 220 Ca 0.22 0.11 -0.22 0.00 0.02 0.00 0.00 55.97 56.09 1pma s LYS 220 Cb -0.00 -2.12 -0.05 0.00 -0.52 0.00 0.00 37.83 35.14 1pma s LYS 220 CO 0.15 -1.07 1.34 0.71 -0.92 0.00 0.00 175.35 175.56 1pma s TYR 221 N -3.26 2.37 -0.11 3.18 2.02 -0.68 -4.60 117.35 116.27 1pma s TYR 221 Ca 0.58 1.38 0.02 0.00 -0.37 0.00 0.00 57.07 58.68 1pma s TYR 221 Cb -0.11 -3.76 0.02 0.00 -0.40 0.00 0.00 41.96 37.71 1pma s TYR 221 CO 0.48 -2.73 -0.15 0.50 -1.57 0.00 0.00 175.55 172.08 1pma s ARG 222 N -2.84 2.18 -0.21 -0.62 3.52 -0.55 -4.99 118.95 115.44 1pma s ARG 222 Ca 0.70 -0.54 -0.09 0.00 -0.13 0.00 0.00 55.73 55.67 1pma s ARG 222 Cb -0.39 -1.87 -0.04 0.00 -1.56 0.00 0.00 34.95 31.08 1pma s ARG 222 CO 0.47 -0.08 0.10 0.42 -0.81 0.00 0.00 175.30 175.40 1pma s ILE 223 N 1.03 5.00 0.26 4.11 1.01 -1.26 -0.50 121.20 130.86 1pma s ILE 223 Ca -0.06 0.05 -0.29 0.00 0.00 0.00 0.00 60.65 60.35 1pma s ILE 223 Cb -0.15 -3.29 -0.10 0.00 0.01 0.00 0.00 42.46 38.94 1pma s ILE 223 CO -0.02 0.41 1.30 -0.31 0.00 0.00 0.00 174.94 176.32 1pma s TYR 224 N 0.70 3.18 0.38 3.97 1.51 -0.77 -5.01 117.35 121.31 1pma s TYR 224 Ca 0.05 1.32 -0.18 0.00 -1.01 0.00 0.00 57.07 57.26 1pma s TYR 224 Cb -0.13 -3.63 -0.10 0.00 -0.11 0.00 0.00 41.96 38.00 1pma s TYR 224 CO 0.02 -1.84 0.84 0.16 -1.11 0.00 0.00 175.55 173.62 1pma s ASP 225 N -0.10 6.84 0.14 2.29 -4.77 -1.26 -4.80 116.67 115.01 1pma s ASP 225 Ca 0.53 1.48 -0.09 0.00 -3.30 0.00 0.00 52.55 51.16 1pma s ASP 225 Cb -0.38 -2.45 0.17 0.00 -1.09 0.00 0.00 42.92 39.16 1pma s ASP 225 CO 0.45 -0.29 0.91 1.67 0.70 0.00 0.00 175.17 178.61 1pma n GLN 226 N -0.54 -0.12 -0.09 2.11 7.27 -1.26 0.29 117.38 125.04 1pma n GLN 226 Ca 0.05 0.91 -0.11 0.00 0.07 0.00 0.00 57.00 57.92 1pma n GLN 226 Cb 0.54 -1.35 -0.04 0.00 2.41 0.00 0.00 30.24 31.80 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 0.48 -0.15 3.69 3.07 -1.98 -0.74 114.58 118.94 1pma h GLU 227 Ca 0.22 -0.14 0.04 0.00 -0.50 0.00 0.00 59.36 58.98 1pma h GLU 227 Cb 0.37 -0.05 -0.04 0.00 -0.84 0.00 0.00 28.75 28.19 1pma h GLU 227 CO -0.59 0.62 -0.11 1.49 -1.40 0.00 0.00 179.01 179.02 1pma h GLU 228 N 0.27 -0.11 -0.75 2.33 4.81 -0.53 0.45 114.58 121.07 1pma h GLU 228 Ca 0.08 0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.26 1pma h GLU 228 Cb 0.40 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 1pma h GLU 228 CO 0.01 -0.07 0.25 -0.24 -0.73 0.00 0.00 179.01 178.23 1pma h VAL 229 N -0.11 1.26 -0.25 0.32 3.04 -1.15 -0.78 116.25 118.58 1pma h VAL 229 Ca 0.09 -0.88 0.07 0.00 -1.01 0.00 0.00 66.70 64.98 1pma h VAL 229 Cb 0.25 0.42 -0.01 0.00 -2.01 0.00 0.00 31.29 29.94 1pma h VAL 229 CO -0.22 0.35 0.20 0.50 -1.01 0.00 0.00 177.57 177.39 1pma h LYS 230 N 1.10 0.00 -0.77 4.17 3.64 0.25 -0.36 116.57 124.61 1pma h LYS 230 Ca 0.24 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.58 1pma h LYS 230 Cb 0.28 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.07 1pma h LYS 230 CO -0.01 0.00 0.33 -0.22 -2.27 0.00 0.00 179.45 177.28 1pma h LYS 231 N 0.00 1.12 0.00 1.90 3.64 0.58 -2.46 116.57 121.36 1pma h LYS 231 Ca 0.12 -0.19 -0.14 0.00 -1.27 0.00 0.00 60.65 59.17 1pma h LYS 231 Cb 0.51 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 1pma h LYS 231 CO -0.00 0.90 -1.02 0.74 -2.27 0.00 0.00 179.45 177.79 1pma h PHE 232 N 1.10 0.00 0.00 1.91 -1.00 -1.13 -3.52 116.94 114.30 1pma h PHE 232 Ca 0.26 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.04 1pma h PHE 232 Cb 0.18 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.74 1pma h PHE 232 CO 0.02 0.57 0.00 -0.11 -1.61 0.00 0.00 178.31 177.18