#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 -4.85 120.40 119.80 1pma s VAL 14 Ca 0.00 -1.63 -0.30 0.00 -1.81 0.00 0.00 61.98 58.24 1pma s VAL 14 Cb 0.00 -2.35 -0.07 0.00 0.56 0.00 0.00 36.38 34.52 1pma s VAL 14 CO 0.00 0.00 1.03 -0.36 -0.31 0.00 0.00 175.10 175.46 1pma s PHE 15 N -3.97 3.73 0.54 2.82 0.08 -1.26 -4.36 117.98 115.55 1pma s PHE 15 Ca 0.29 1.72 -0.08 0.00 0.12 0.00 0.00 56.93 58.98 1pma s PHE 15 Cb 0.02 -3.16 -0.04 0.00 -0.57 0.00 0.00 43.02 39.27 1pma s PHE 15 CO 0.11 -0.17 0.89 -1.54 -0.10 0.00 0.00 175.22 174.41 1pma s SER 16 N -0.25 6.26 0.19 1.36 1.04 -0.42 -4.88 113.70 117.00 1pma s SER 16 Ca 0.47 1.14 0.09 0.00 0.48 0.00 0.00 55.95 58.13 1pma s SER 16 Cb -0.27 -2.34 0.49 0.00 0.10 0.00 0.00 66.02 64.00 1pma s SER 16 CO 0.33 -0.70 1.17 -2.65 0.98 0.00 0.00 173.24 172.38 1pma n PRO 17 N -2.44 0.06 -0.16 4.02 -0.02 -1.26 0.40 135.00 135.60 1pma n PRO 17 Ca 0.03 0.49 0.08 0.00 -2.02 0.00 0.00 63.50 62.08 1pma n PRO 17 Cb 0.55 -1.88 0.17 0.00 -0.02 0.00 0.00 33.50 32.31 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 -1.79 3.00 -0.79 2.55 5.75 -1.26 -4.99 116.55 119.02 1pma n ASP 18 Ca -0.01 -1.88 0.00 0.00 -0.01 0.00 0.00 54.79 52.90 1pma n ASP 18 Cb 0.20 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.08 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 1.01 0.64 3.09 6.12 0.00 0.16 -5.10 105.19 111.11 1pma n GLY 19 Ca 0.14 -0.54 -0.15 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 -4.27 0.61 -0.66 1.61 0.52 -1.25 -4.85 118.95 110.66 1pma s ARG 20 Ca 0.00 -0.77 -0.19 0.00 -0.52 0.00 0.00 55.73 54.25 1pma s ARG 20 Cb 0.00 -0.46 0.12 0.00 0.52 0.00 0.00 34.95 35.13 1pma s ARG 20 CO 0.00 0.09 0.77 -0.51 0.02 0.00 0.00 175.30 175.68 1pma s LEU 21 N -1.51 5.45 0.34 2.53 2.01 -1.26 -1.30 118.68 124.94 1pma s LEU 21 Ca -0.07 -1.62 0.05 0.00 0.01 0.00 0.00 54.13 52.51 1pma s LEU 21 Cb -0.09 -2.31 0.71 0.00 0.01 0.00 0.00 46.19 44.51 1pma s LEU 21 CO 0.01 -1.07 1.92 -0.26 1.01 0.00 0.00 176.35 177.96 1pma h PHE 22 N 9.02 0.85 -0.60 0.29 0.04 -1.98 -1.39 116.94 123.16 1pma h PHE 22 Ca -0.20 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.59 1pma h PHE 22 Cb 1.07 -0.28 -0.03 0.00 2.20 0.00 0.00 35.95 38.92 1pma h PHE 22 CO 0.90 0.41 0.38 1.96 -0.60 0.00 0.00 178.31 181.36 1pma h GLN 23 N 0.80 0.81 -0.44 1.51 1.08 -1.91 0.86 115.11 117.82 1pma h GLN 23 Ca 0.37 -0.06 -0.05 0.00 -1.45 0.00 0.00 58.65 57.46 1pma h GLN 23 Cb 0.38 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 27.62 1pma h GLN 23 CO -0.14 0.56 0.07 -0.24 -0.95 0.00 0.00 178.83 178.12 1pma h VAL 24 N 0.82 1.21 0.48 -0.54 3.04 -1.71 -1.51 116.25 118.04 1pma h VAL 24 Ca 0.22 -0.80 -0.02 0.00 -1.01 0.00 0.00 66.70 65.09 1pma h VAL 24 Cb -0.05 0.81 0.00 0.00 -2.01 0.00 0.00 31.29 30.04 1pma h VAL 24 CO -0.04 0.29 -0.23 -0.33 -1.01 0.00 0.00 177.57 176.24 1pma h GLU 25 N 0.65 -0.62 -0.79 4.17 4.39 -0.31 -2.03 114.58 120.05 1pma h GLU 25 Ca 0.14 0.04 0.13 0.00 0.34 0.00 0.00 59.36 60.01 1pma h GLU 25 Cb 0.31 0.14 -0.06 0.00 -0.10 0.00 0.00 28.75 29.05 1pma h GLU 25 CO 0.00 -0.36 0.52 1.88 -1.16 0.00 0.00 179.01 179.89 1pma h TYR 26 N -0.76 0.66 -0.21 4.33 0.05 -0.55 -0.42 116.97 120.08 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 0.55 -0.21 -0.01 0.00 1.01 0.00 0.00 36.73 38.07 1pma h TYR 26 CO -0.02 0.27 0.13 0.00 -1.05 0.00 0.00 178.16 177.49 1pma h ALA 27 N 1.62 0.26 -0.99 3.88 0.00 -0.96 -2.23 119.26 120.86 1pma h ALA 27 Ca 0.38 -0.03 0.17 0.00 0.00 0.00 0.00 54.91 55.43 1pma h ALA 27 Cb 0.67 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.27 1pma h ALA 27 CO -0.14 -0.24 0.59 0.00 0.00 0.00 0.00 179.25 179.46 1pma h ARG 28 N 0.26 0.77 -0.08 0.00 3.08 -0.35 -1.36 114.38 116.69 1pma h ARG 28 Ca 0.07 -0.05 0.04 0.00 0.07 0.00 0.00 59.98 60.12 1pma h ARG 28 Cb 0.01 -0.17 -0.05 0.00 0.08 0.00 0.00 29.97 29.83 1pma h ARG 28 CO -0.01 0.51 -0.25 0.93 -1.07 0.00 0.00 179.97 180.07 1pma h GLU 29 N 0.79 -0.34 -0.62 0.04 4.39 -1.10 -0.83 114.58 116.91 1pma h GLU 29 Ca 0.55 0.02 0.16 0.00 0.34 0.00 0.00 59.36 60.44 1pma h GLU 29 Cb 0.80 0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.49 1pma h GLU 29 CO -0.36 -0.22 0.44 0.00 -1.16 0.00 0.00 179.01 177.70 1pma h ALA 30 N 0.54 2.43 0.00 3.43 0.00 -1.16 0.39 119.26 124.89 1pma h ALA 30 Ca 0.09 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 1pma h ALA 30 Cb 0.47 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1pma h ALA 30 CO -0.28 -0.60 -0.50 -0.39 0.00 0.00 0.00 179.25 177.48 1pma h VAL 31 N 0.11 1.11 -0.66 0.00 -1.51 -1.04 -2.95 116.25 111.31 1pma h VAL 31 Ca 0.30 -1.90 -0.07 0.00 -1.23 0.00 0.00 66.70 63.81 1pma h VAL 31 Cb 1.03 2.10 -0.03 0.00 -2.13 0.00 0.00 31.29 32.26 1pma h VAL 31 CO -0.03 0.49 0.16 0.11 -1.23 0.00 0.00 177.57 177.06 1pma h LYS 32 N 0.00 1.05 -0.18 5.19 1.57 0.26 -2.30 116.57 122.16 1pma h LYS 32 Ca -0.01 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 1pma h LYS 32 Cb 1.06 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.23 1pma h LYS 32 CO 0.07 0.94 0.00 1.63 -0.57 0.00 0.00 179.45 181.51 1pma n LYS 33 N -4.24 0.94 -2.89 3.15 5.02 -1.05 -2.55 118.16 116.55 1pma n LYS 33 Ca 0.05 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.14 1pma n LYS 33 Cb 0.26 -1.09 0.06 0.00 -0.02 0.00 0.00 35.03 34.23 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 -0.86 1.80 1.08 0.72 0.00 -0.86 -4.93 107.32 104.26 1pma s GLY 34 Ca 0.00 -1.86 -0.12 0.00 0.00 0.00 0.00 44.72 42.74 1pma s GLY 34 CO 0.00 -1.46 1.06 -0.45 0.00 0.00 0.00 173.10 172.26 1pma s SER 35 N -4.58 1.69 -0.11 1.64 0.15 -1.26 -1.50 113.70 109.72 1pma s SER 35 Ca 0.61 1.64 -0.04 0.00 0.70 0.00 0.00 55.95 58.86 1pma s SER 35 Cb -0.07 -2.32 -0.04 0.00 -1.71 0.00 0.00 66.02 61.88 1pma s SER 35 CO 0.39 -3.78 0.05 0.28 1.20 0.00 0.00 173.24 171.38 1pma s THR 36 N -2.57 4.75 0.14 6.45 -1.32 -1.26 -2.73 115.64 119.10 1pma s THR 36 Ca 0.67 -0.07 -0.15 0.00 -1.21 0.00 0.00 61.69 60.93 1pma s THR 36 Cb -0.23 -3.04 0.02 0.00 -1.51 0.00 0.00 72.50 67.74 1pma s THR 36 CO 0.62 0.59 0.39 0.00 -2.21 0.00 0.00 174.62 174.01 1pma s ALA 37 N -0.73 -0.76 0.32 11.08 0.00 -0.12 -1.58 121.76 129.98 1pma s ALA 37 Ca 0.12 -0.24 -0.12 0.00 0.00 0.00 0.00 51.96 51.72 1pma s ALA 37 Cb -0.12 0.73 0.02 0.00 0.00 0.00 0.00 23.12 23.75 1pma s ALA 37 CO 0.03 -0.67 0.61 -0.48 0.00 0.00 0.00 175.76 175.25 1pma s LEU 38 N -2.84 0.33 0.03 0.00 2.34 1.00 0.11 118.68 119.65 1pma s LEU 38 Ca 0.06 -1.11 -0.27 0.00 0.06 0.00 0.00 54.13 52.87 1pma s LEU 38 Cb 0.02 2.17 0.08 0.00 -0.56 0.00 0.00 46.19 47.90 1pma s LEU 38 CO -0.08 -1.39 0.72 -0.83 -1.06 0.00 0.00 176.35 173.70 1pma s GLY 39 N -3.08 -0.54 -0.18 -3.48 0.00 0.54 -0.92 107.32 99.65 1pma s GLY 39 Ca 0.21 1.00 -0.26 0.00 0.00 0.00 0.00 44.72 45.67 1pma s GLY 39 CO 0.13 0.53 0.67 -3.16 0.00 0.00 0.00 173.10 171.26 1pma s MET 40 N -2.58 0.88 0.36 2.90 0.23 -1.06 0.11 119.30 120.14 1pma s MET 40 Ca -0.02 0.67 -0.25 0.00 -1.03 0.00 0.00 55.69 55.06 1pma s MET 40 Cb -0.01 0.42 -0.09 0.00 -1.53 0.00 0.00 34.83 33.62 1pma s MET 40 CO -0.04 -0.18 1.00 0.15 -2.03 0.00 0.00 175.02 173.93 1pma s LYS 41 N -0.23 4.39 0.00 3.16 1.02 0.49 -2.52 119.74 126.05 1pma s LYS 41 Ca -0.04 1.44 0.00 0.00 0.02 0.00 0.00 55.97 57.39 1pma s LYS 41 Cb -0.03 -2.70 0.00 0.00 -0.52 0.00 0.00 37.83 34.58 1pma s LYS 41 CO 0.04 0.08 0.00 1.97 -0.92 0.00 0.00 175.35 176.52 1pma n PHE 42 N 0.30 0.00 0.00 3.18 1.16 0.35 -4.84 117.46 117.60 1pma n PHE 42 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.61 1pma n PHE 42 Cb 0.50 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.37 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 -2.43 1.98 0.00 -0.40 -3.66 120.51 112.99 1pma n ALA 43 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 1pma n ALA 43 Cb 0.00 0.14 0.05 0.00 0.00 0.00 0.00 19.45 19.64 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 -1.20 1.42 0.00 0.00 4.05 -1.26 -5.00 115.26 113.27 1pma n ASN 44 Ca 0.00 -2.35 0.00 0.00 0.45 0.00 0.00 54.58 52.68 1pma n ASN 44 Cb 0.00 -0.37 0.00 0.00 1.23 0.00 0.00 39.78 40.64 1pma n ASN 44 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1pma n GLY 45 N -0.02 2.60 3.26 8.20 0.00 -1.24 -0.88 105.19 117.12 1pma n GLY 45 Ca 0.10 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.57 0.06 0.07 1.61 0.11 -0.82 -0.50 120.40 118.36 1pma s VAL 46 Ca 0.00 -0.51 0.03 0.00 -2.93 0.00 0.00 61.98 58.57 1pma s VAL 46 Cb 0.00 -0.76 -0.03 0.00 -1.53 0.00 0.00 36.38 34.05 1pma s VAL 46 CO 0.00 -0.28 -0.09 -1.48 -3.33 0.00 0.00 175.10 169.92 1pma s LEU 47 N -1.61 2.35 0.10 2.54 2.34 -1.05 -1.80 118.68 121.56 1pma s LEU 47 Ca -0.10 -0.72 0.09 0.00 0.06 0.00 0.00 54.13 53.46 1pma s LEU 47 Cb -0.03 -0.25 -0.04 0.00 -0.56 0.00 0.00 46.19 45.31 1pma s LEU 47 CO 0.02 -0.24 -0.22 -0.22 -1.06 0.00 0.00 176.35 174.63 1pma s LEU 48 N -2.13 2.51 -0.19 1.48 2.96 0.14 -2.57 118.68 120.88 1pma s LEU 48 Ca -0.00 -0.59 -0.08 0.00 -0.22 0.00 0.00 54.13 53.23 1pma s LEU 48 Cb -0.05 -1.41 0.08 0.00 0.50 0.00 0.00 46.19 45.30 1pma s LEU 48 CO -0.00 0.20 0.42 -0.51 -1.32 0.00 0.00 176.35 175.14 1pma s ILE 49 N -1.04 -0.37 0.07 6.68 1.10 -0.10 -1.60 121.20 125.94 1pma s ILE 49 Ca 0.15 0.13 0.06 0.00 -0.51 0.00 0.00 60.65 60.48 1pma s ILE 49 Cb -0.10 -0.65 -0.03 0.00 0.15 0.00 0.00 42.46 41.82 1pma s ILE 49 CO 0.07 0.05 -0.16 -0.55 -2.11 0.00 0.00 174.94 172.24 1pma s SER 50 N 2.07 1.91 -0.46 4.50 0.15 -0.16 -0.00 113.70 121.72 1pma s SER 50 Ca -0.05 -0.58 -0.27 0.00 0.70 0.00 0.00 55.95 55.75 1pma s SER 50 Cb -0.10 -0.09 0.03 0.00 -1.71 0.00 0.00 66.02 64.14 1pma s SER 50 CO -0.13 -0.00 1.00 -0.62 1.20 0.00 0.00 173.24 174.69 1pma s ASP 51 N -1.58 6.56 -0.96 5.45 -1.08 -0.61 -0.54 116.67 123.92 1pma s ASP 51 Ca 0.01 0.28 -0.17 0.00 -0.52 0.00 0.00 52.55 52.16 1pma s ASP 51 Cb -0.09 -2.49 0.15 0.00 -1.46 0.00 0.00 42.92 39.03 1pma s ASP 51 CO 0.02 -1.10 1.12 -0.75 0.52 0.00 0.00 175.17 174.98 1pma s LYS 52 N 3.96 3.68 -0.30 4.34 2.20 -1.15 -4.70 119.74 127.78 1pma s LYS 52 Ca 0.41 -2.00 -0.20 0.00 -0.36 0.00 0.00 55.97 53.82 1pma s LYS 52 Cb -0.09 -4.86 -0.01 0.00 -1.51 0.00 0.00 37.83 31.35 1pma s LYS 52 CO 0.27 -1.69 0.60 0.15 -0.36 0.00 0.00 175.35 174.32 1pma s LYS 53 N 2.10 3.90 0.16 4.03 1.02 -1.26 -4.00 119.74 125.69 1pma s LYS 53 Ca 0.32 0.26 0.07 0.00 0.02 0.00 0.00 55.97 56.64 1pma s LYS 53 Cb -0.05 -3.72 -0.04 0.00 -0.52 0.00 0.00 37.83 33.50 1pma s LYS 53 CO -0.08 -0.54 -0.00 0.54 -0.92 0.00 0.00 175.35 174.35 1pma s VAL 54 N 2.53 3.77 0.00 3.17 0.11 -1.26 -5.11 120.40 123.61 1pma s VAL 54 Ca 0.24 -1.34 0.00 0.00 -2.93 0.00 0.00 61.98 57.95 1pma s VAL 54 Cb -0.15 -2.87 0.00 0.00 -1.53 0.00 0.00 36.38 31.83 1pma s VAL 54 CO 0.11 -0.06 0.00 -1.14 -3.33 0.00 0.00 175.10 170.68 1pma n ARG 55 N 0.03 0.00 -1.18 1.54 3.00 -1.26 -5.08 116.66 113.71 1pma n ARG 55 Ca -0.10 0.00 -0.32 0.00 -0.00 0.00 0.00 57.85 57.43 1pma n ARG 55 Cb 0.54 0.00 0.11 0.00 0.00 0.00 0.00 32.46 33.11 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 -0.36 4.01 0.45 6.15 0.15 -1.26 -4.92 113.70 117.92 1pma s SER 56 Ca 0.00 2.08 0.25 0.00 0.70 0.00 0.00 55.95 58.98 1pma s SER 56 Cb 0.00 -2.56 0.69 0.00 -1.71 0.00 0.00 66.02 62.45 1pma s SER 56 CO 0.00 -2.38 1.73 0.03 1.20 0.00 0.00 173.24 173.82 1pma h ARG 57 N -1.03 0.00 0.00 5.44 3.08 -2.08 -3.16 114.38 116.63 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 1.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.31 1pma h ARG 57 CO 0.48 0.10 0.00 1.28 -1.07 0.00 0.00 179.97 180.76 1pma n LEU 58 N -3.16 0.00 -4.81 3.04 4.32 -1.26 -4.82 117.00 110.32 1pma n LEU 58 Ca 0.02 0.33 -0.34 0.00 -0.02 0.00 0.00 56.01 56.00 1pma n LEU 58 Cb 0.48 -0.33 -0.06 0.00 -1.62 0.00 0.00 43.42 41.88 1pma n LEU 58 CO 0.33 -0.14 0.66 -0.63 -1.22 0.00 0.00 177.39 176.39 1pma s ILE 59 N -2.67 4.23 -0.76 -0.08 -1.09 -1.20 -4.95 121.20 114.69 1pma s ILE 59 Ca 0.15 1.51 -0.07 0.00 -2.23 0.00 0.00 60.65 60.01 1pma s ILE 59 Cb 0.12 -3.68 -0.11 0.00 -1.58 0.00 0.00 42.46 37.20 1pma s ILE 59 CO 0.28 -0.18 3.13 -0.62 -1.23 0.00 0.00 174.94 176.32 1pma n GLU 60 N -0.36 2.94 0.00 2.79 -0.58 -1.26 -4.97 120.64 119.21 1pma n GLU 60 Ca 0.06 -1.90 0.00 0.00 -0.42 0.00 0.00 57.16 54.90 1pma n GLU 60 Cb 0.53 -2.36 0.00 0.00 -0.57 0.00 0.00 31.44 29.04 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 2.50 0.00 -0.21 3.49 -0.00 -1.26 -1.12 117.38 120.79 1pma n GLN 61 Ca 0.58 0.00 0.20 0.00 -0.00 0.00 0.00 57.00 57.78 1pma n GLN 61 Cb 0.56 0.00 0.36 0.00 -0.00 0.00 0.00 30.24 31.15 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 0.50 0.19 -0.04 2.61 2.85 -1.26 -0.93 115.26 119.18 1pma n ASN 62 Ca 0.00 0.94 0.23 0.00 -0.11 0.00 0.00 54.58 55.65 1pma n ASN 62 Cb 0.00 -0.46 0.58 0.00 1.24 0.00 0.00 39.78 41.14 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 -1.14 1.20 0.02 -1.54 -1.89 113.55 110.20 1pma h SER 63 Ca 0.50 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 60.78 1pma h SER 63 Cb 1.39 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.79 1pma h SER 63 CO -0.42 0.00 1.86 0.00 -1.14 0.00 0.00 176.83 177.13 1pma n ILE 64 N -3.41 4.75 -2.08 3.27 3.06 -0.10 -4.97 119.36 119.88 1pma n ILE 64 Ca 0.15 -3.98 -0.42 0.00 -2.50 0.00 0.00 62.75 55.99 1pma n ILE 64 Cb 1.07 -1.94 -0.03 0.00 0.54 0.00 0.00 39.64 39.28 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 -1.33 4.22 -0.13 9.51 0.41 -0.71 -4.89 118.70 125.78 1pma s GLU 65 Ca 0.55 2.13 0.16 0.00 -0.41 0.00 0.00 54.97 57.40 1pma s GLU 65 Cb 0.24 -3.73 -0.24 0.00 -1.78 0.00 0.00 34.13 28.62 1pma s GLU 65 CO -0.13 -0.72 0.33 1.63 -0.49 0.00 0.00 175.26 175.89 1pma n LYS 66 N 6.08 0.66 -3.31 1.61 5.02 -1.26 -4.80 118.16 122.16 1pma n LYS 66 Ca 0.15 0.11 -0.39 0.00 -2.02 0.00 0.00 58.31 56.17 1pma n LYS 66 Cb 0.42 -1.64 -0.07 0.00 -0.02 0.00 0.00 35.03 33.73 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 -2.57 5.15 0.06 -0.18 1.01 -1.26 -4.00 121.20 119.40 1pma s ILE 67 Ca -0.08 0.82 0.07 0.00 0.00 0.00 0.00 60.65 61.47 1pma s ILE 67 Cb 0.07 -3.79 -0.03 0.00 0.01 0.00 0.00 42.46 38.73 1pma s ILE 67 CO 0.83 0.20 -0.20 -1.10 0.00 0.00 0.00 174.94 174.67 1pma s GLN 68 N 1.59 1.27 0.29 2.79 -0.21 -0.31 -5.00 119.66 120.07 1pma s GLN 68 Ca 0.21 -0.96 -0.12 0.00 0.02 0.00 0.00 55.36 54.51 1pma s GLN 68 Cb -0.15 -1.40 -0.08 0.00 1.00 0.00 0.00 33.01 32.38 1pma s GLN 68 CO 0.09 0.35 0.65 -0.51 -2.12 0.00 0.00 175.29 173.75 1pma s LEU 69 N -1.33 4.09 -0.11 2.90 1.43 -1.26 -0.82 118.68 123.58 1pma s LEU 69 Ca 0.06 1.10 0.08 0.00 -1.03 0.00 0.00 54.13 54.34 1pma s LEU 69 Cb -0.09 -3.89 -0.12 0.00 0.03 0.00 0.00 46.19 42.11 1pma s LEU 69 CO 0.02 -0.16 0.00 -0.38 0.23 0.00 0.00 176.35 176.06 1pma n ILE 70 N -0.35 0.75 -3.59 -0.59 5.41 0.09 -4.89 119.36 116.19 1pma n ILE 70 Ca 0.02 -0.42 -0.07 0.00 1.00 0.00 0.00 62.75 63.27 1pma n ILE 70 Cb 0.53 -0.78 -0.04 0.00 -0.71 0.00 0.00 39.64 38.64 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 -4.56 -0.25 0.08 4.38 2.15 -1.00 -4.80 116.67 112.67 1pma s ASP 71 Ca -0.08 0.22 0.01 0.00 0.43 0.00 0.00 52.55 53.13 1pma s ASP 71 Cb 0.04 0.22 0.06 0.00 -0.30 0.00 0.00 42.92 42.94 1pma s ASP 71 CO 0.41 -0.27 0.69 0.47 -0.17 0.00 0.00 175.17 176.30 1pma n ASP 72 N 0.47 0.03 0.00 -0.34 8.00 -1.26 -0.21 116.55 123.25 1pma n ASP 72 Ca -0.06 0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.61 1pma n ASP 72 Cb 0.59 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.56 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 -1.29 0.00 -3.66 1.24 4.02 -1.26 -1.51 117.16 114.71 1pma n TYR 73 Ca -0.00 -0.39 -0.06 0.00 -0.01 0.00 0.00 57.90 57.44 1pma n TYR 73 Cb 0.43 -0.04 -0.07 0.00 -0.02 0.00 0.00 39.34 39.64 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 -0.78 -0.46 0.20 -0.72 0.11 0.71 -2.41 120.40 117.07 1pma s VAL 74 Ca 0.00 0.05 0.06 0.00 -2.93 0.00 0.00 61.98 59.16 1pma s VAL 74 Cb 0.00 -0.87 -0.05 0.00 -1.53 0.00 0.00 36.38 33.93 1pma s VAL 74 CO 0.00 0.02 -0.10 0.00 -3.33 0.00 0.00 175.10 171.69 1pma s ALA 75 N 2.20 1.88 0.03 1.54 0.00 0.27 -0.74 121.76 126.95 1pma s ALA 75 Ca -0.07 -1.66 -0.04 0.00 0.00 0.00 0.00 51.96 50.19 1pma s ALA 75 Cb -0.09 0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.07 1pma s ALA 75 CO -0.17 -0.03 0.07 0.00 0.00 0.00 0.00 175.76 175.63 1pma s ALA 76 N -3.13 -0.05 0.04 0.00 0.00 0.00 -0.02 121.76 118.61 1pma s ALA 76 Ca 0.22 -0.52 0.06 0.00 0.00 0.00 0.00 51.96 51.72 1pma s ALA 76 Cb 0.01 0.20 -0.02 0.00 0.00 0.00 0.00 23.12 23.32 1pma s ALA 76 CO 0.06 -0.27 -0.16 0.54 0.00 0.00 0.00 175.76 175.93 1pma s VAL 77 N -2.21 1.27 0.28 0.00 0.11 -0.29 -1.17 120.40 118.39 1pma s VAL 77 Ca -0.08 -1.04 0.05 0.00 -2.93 0.00 0.00 61.98 57.97 1pma s VAL 77 Cb -0.04 -1.13 -0.06 0.00 -1.53 0.00 0.00 36.38 33.62 1pma s VAL 77 CO -0.03 0.07 -0.01 0.28 -3.33 0.00 0.00 175.10 172.08 1pma s THR 78 N -0.82 1.36 -0.16 5.04 -1.32 -1.26 -0.54 115.64 117.94 1pma s THR 78 Ca 0.03 -2.06 -0.13 0.00 -1.21 0.00 0.00 61.69 58.32 1pma s THR 78 Cb -0.08 -2.51 0.05 0.00 -1.51 0.00 0.00 72.50 68.45 1pma s THR 78 CO 0.01 -0.23 0.42 -0.55 -2.21 0.00 0.00 174.62 172.06 1pma s SER 79 N -3.42 -0.47 0.00 8.08 0.15 0.40 -4.92 113.70 113.52 1pma s SER 79 Ca 0.31 0.87 0.00 0.00 0.70 0.00 0.00 55.95 57.83 1pma s SER 79 Cb 0.06 0.84 0.00 0.00 -1.71 0.00 0.00 66.02 65.21 1pma s SER 79 CO 0.12 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 175.01 1pma n GLY 80 N 3.26 0.55 3.59 9.45 0.00 -1.26 -1.38 105.19 119.40 1pma n GLY 80 Ca -0.16 -1.87 -0.44 0.00 0.00 0.00 0.00 46.02 43.55 1pma n GLY 80 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1pma n LEU 81 N 0.00 3.19 -0.10 0.99 7.99 0.90 -4.85 117.00 125.12 1pma n LEU 81 Ca 0.00 0.22 -0.07 0.00 -0.01 0.00 0.00 56.01 56.15 1pma n LEU 81 Cb 0.00 -1.54 -0.01 0.00 -0.11 0.00 0.00 43.42 41.76 1pma n LEU 81 CO 0.00 -0.69 0.66 1.62 -1.51 0.00 0.00 177.39 177.47 1pma h VAL 82 N 7.13 0.28 -0.10 4.08 3.04 -1.95 0.29 116.25 129.03 1pma h VAL 82 Ca -0.40 0.00 0.04 0.00 -1.01 0.00 0.00 66.70 65.33 1pma h VAL 82 Cb 1.25 0.28 -0.06 0.00 -2.01 0.00 0.00 31.29 30.74 1pma h VAL 82 CO 0.96 0.00 -0.37 0.00 -1.01 0.00 0.00 177.57 177.15 1pma h ALA 83 N 0.81 -0.51 -0.89 3.17 0.00 -1.97 -0.61 119.26 119.26 1pma h ALA 83 Ca 0.17 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.18 1pma h ALA 83 Cb 0.52 0.70 -0.08 0.00 0.00 0.00 0.00 17.79 18.92 1pma h ALA 83 CO -0.50 -0.87 0.52 -0.44 0.00 0.00 0.00 179.25 177.96 1pma h ASP 84 N -0.47 0.76 0.16 0.00 5.19 -1.76 -1.81 116.42 118.50 1pma h ASP 84 Ca 0.08 0.05 0.01 0.00 -0.62 0.00 0.00 57.03 56.54 1pma h ASP 84 Cb 0.60 -0.10 -0.02 0.00 0.18 0.00 0.00 39.33 39.99 1pma h ASP 84 CO -0.36 0.42 -0.20 0.00 -3.12 0.00 0.00 179.24 175.98 1pma h ALA 85 N 1.48 -0.38 -0.06 3.45 0.00 0.23 -1.15 119.26 122.83 1pma h ALA 85 Ca 0.43 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.31 1pma h ALA 85 Cb 0.40 0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 1pma h ALA 85 CO -0.25 -0.74 -0.46 -0.09 0.00 0.00 0.00 179.25 177.71 1pma h ARG 86 N -0.41 -0.51 -0.83 0.00 2.43 -0.29 0.18 114.38 114.95 1pma h ARG 86 Ca 0.01 0.03 0.10 0.00 -0.81 0.00 0.00 59.98 59.32 1pma h ARG 86 Cb 0.40 0.12 -0.06 0.00 -0.42 0.00 0.00 29.97 30.01 1pma h ARG 86 CO -0.07 -0.34 0.54 -0.24 -1.51 0.00 0.00 179.97 178.34 1pma h VAL 87 N -0.53 0.94 -0.59 0.20 3.04 -1.50 0.98 116.25 118.79 1pma h VAL 87 Ca 0.02 -0.26 -0.06 0.00 -1.01 0.00 0.00 66.70 65.39 1pma h VAL 87 Cb 0.59 0.11 -0.03 0.00 -2.01 0.00 0.00 31.29 29.96 1pma h VAL 87 CO -0.34 0.14 0.13 0.25 -1.01 0.00 0.00 177.57 176.74 1pma h LEU 88 N 0.76 0.86 0.12 3.16 5.85 0.21 -2.09 115.31 124.18 1pma h LEU 88 Ca 0.39 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 1pma h LEU 88 Cb 0.48 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1pma h LEU 88 CO -0.16 0.85 -0.06 0.58 -0.34 0.00 0.00 178.44 179.31 1pma h VAL 89 N 0.88 1.05 -0.94 1.05 2.07 0.16 -2.78 116.25 117.74 1pma h VAL 89 Ca 0.19 -0.72 0.14 0.00 0.82 0.00 0.00 66.70 67.12 1pma h VAL 89 Cb 0.33 1.51 -0.08 0.00 -1.52 0.00 0.00 31.29 31.53 1pma h VAL 89 CO 0.00 0.17 0.60 0.44 0.02 0.00 0.00 177.57 178.80 1pma h ASP 90 N -0.50 0.77 -0.15 0.57 3.32 -0.96 -0.59 116.42 118.89 1pma h ASP 90 Ca -0.02 0.05 0.03 0.00 0.02 0.00 0.00 57.03 57.11 1pma h ASP 90 Cb 0.40 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.82 1pma h ASP 90 CO 0.03 0.39 -0.04 0.15 -1.72 0.00 0.00 179.24 178.05 1pma h PHE 91 N 0.81 -0.08 -0.13 4.55 3.57 -1.25 -1.06 116.94 123.36 1pma h PHE 91 Ca 0.47 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.96 1pma h PHE 91 Cb 0.64 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.43 1pma h PHE 91 CO -0.00 -0.06 -0.04 0.00 -2.23 0.00 0.00 178.31 175.97 1pma h ALA 92 N 1.15 1.69 0.16 2.41 0.00 -0.88 0.27 119.26 124.06 1pma h ALA 92 Ca 0.07 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1pma h ALA 92 Cb 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1pma h ALA 92 CO -0.15 0.23 -0.08 0.00 0.00 0.00 0.00 179.25 179.26 1pma h ARG 93 N 0.18 -0.20 -0.52 0.00 3.08 -0.12 -0.33 114.38 116.47 1pma h ARG 93 Ca 0.04 0.01 -0.08 0.00 0.07 0.00 0.00 59.98 60.03 1pma h ARG 93 Cb 0.21 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 1pma h ARG 93 CO 0.01 0.08 0.01 -0.84 -1.07 0.00 0.00 179.97 178.16 1pma h ILE 94 N -0.48 1.26 -0.83 2.04 3.07 -1.04 -2.05 117.51 119.48 1pma h ILE 94 Ca -0.02 -1.07 0.14 0.00 1.55 0.00 0.00 64.86 65.46 1pma h ILE 94 Cb 0.37 0.92 -0.06 0.00 -0.27 0.00 0.00 36.82 37.79 1pma h ILE 94 CO 0.04 0.38 0.54 -1.28 -1.05 0.00 0.00 178.15 176.78 1pma h SER 95 N 0.78 0.55 -0.09 2.16 0.87 -0.37 0.31 113.55 117.76 1pma h SER 95 Ca 0.15 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.71 1pma h SER 95 Cb 0.51 -0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 62.39 1pma h SER 95 CO 0.02 0.28 -0.06 0.00 -0.53 0.00 0.00 176.83 176.54 1pma h ALA 96 N 1.62 0.13 -0.96 6.23 0.00 -0.39 -2.90 119.26 123.00 1pma h ALA 96 Ca 0.41 -0.26 0.11 0.00 0.00 0.00 0.00 54.91 55.17 1pma h ALA 96 Cb 0.75 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 18.43 1pma h ALA 96 CO -0.16 -0.08 0.59 1.96 0.00 0.00 0.00 179.25 181.56 1pma h GLN 97 N -0.18 0.92 0.09 0.00 1.08 -0.50 -1.79 115.11 114.73 1pma h GLN 97 Ca 0.02 -0.06 0.02 0.00 -1.45 0.00 0.00 58.65 57.18 1pma h GLN 97 Cb 0.54 -0.21 -0.05 0.00 -0.05 0.00 0.00 27.48 27.71 1pma h GLN 97 CO 0.02 0.61 -0.45 1.96 -0.95 0.00 0.00 178.83 180.02 1pma h GLN 98 N 0.95 -0.64 -0.78 1.46 4.20 -0.81 0.11 115.11 119.60 1pma h GLN 98 Ca 0.47 0.04 0.06 0.00 0.06 0.00 0.00 58.65 59.29 1pma h GLN 98 Cb 0.44 0.14 -0.06 0.00 0.30 0.00 0.00 27.48 28.31 1pma h GLN 98 CO -0.26 -0.42 0.46 1.49 -0.67 0.00 0.00 178.83 179.43 1pma h GLU 99 N -0.66 0.82 -0.41 1.46 4.81 -1.20 -1.37 114.58 118.03 1pma h GLU 99 Ca 0.02 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.24 1pma h GLU 99 Cb 0.70 -0.18 -0.04 0.00 0.63 0.00 0.00 28.75 29.86 1pma h GLU 99 CO -0.28 0.54 0.20 0.87 -0.73 0.00 0.00 179.01 179.62 1pma h LYS 100 N 0.84 0.40 0.00 1.92 1.57 -0.93 0.64 116.57 121.02 1pma h LYS 100 Ca 0.35 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 59.07 1pma h LYS 100 Cb 0.19 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 1pma h LYS 100 CO -0.18 0.27 -0.16 -0.24 -0.57 0.00 0.00 179.45 178.56 1pma h VAL 101 N 0.42 0.57 0.02 0.50 3.04 0.28 0.49 116.25 121.56 1pma h VAL 101 Ca 0.18 -0.76 -0.37 0.00 -1.01 0.00 0.00 66.70 64.74 1pma h VAL 101 Cb 0.09 1.50 -0.05 0.00 -2.01 0.00 0.00 31.29 30.82 1pma h VAL 101 CO -0.13 0.16 -2.05 1.07 -1.01 0.00 0.00 177.57 175.61 1pma n THR 102 N -3.55 1.57 0.36 3.17 5.66 -0.76 -4.52 114.28 116.20 1pma n THR 102 Ca -0.01 -0.35 0.11 0.00 -3.05 0.00 0.00 64.05 60.75 1pma n THR 102 Cb 0.31 -1.83 0.00 0.00 -1.55 0.00 0.00 70.33 67.26 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 -4.01 0.47 -0.54 1.09 4.01 0.18 -4.97 117.16 113.37 1pma n TYR 103 Ca -0.43 0.14 0.00 0.00 -0.16 0.00 0.00 57.90 57.45 1pma n TYR 103 Cb 0.87 -0.62 0.00 0.00 -0.31 0.00 0.00 39.34 39.28 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 1.30 0.89 3.65 2.72 0.00 0.17 -5.00 105.19 108.92 1pma n GLY 104 Ca 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 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 -3.02 -0.13 -0.91 1.61 0.15 -1.20 -4.95 113.70 105.25 1pma s SER 105 Ca 0.00 0.23 -0.25 0.00 0.70 0.00 0.00 55.95 56.64 1pma s SER 105 Cb 0.00 0.63 0.04 0.00 -1.71 0.00 0.00 66.02 64.98 1pma s SER 105 CO 0.00 -0.04 1.42 -0.22 1.20 0.00 0.00 173.24 175.60 1pma s LEU 106 N 0.56 3.37 -0.03 3.45 2.96 -1.26 -4.70 118.68 123.02 1pma s LEU 106 Ca -0.00 -1.04 -0.25 0.00 -0.22 0.00 0.00 54.13 52.62 1pma s LEU 106 Cb -0.04 -2.57 -0.21 0.00 0.50 0.00 0.00 46.19 43.88 1pma s LEU 106 CO -0.13 -1.68 1.18 1.62 -1.32 0.00 0.00 176.35 176.02 1pma h VAL 107 N 6.55 1.46 -3.56 1.68 3.04 -1.98 -3.43 116.25 120.01 1pma h VAL 107 Ca 0.02 -1.46 -0.61 0.00 -1.01 0.00 0.00 66.70 63.64 1pma h VAL 107 Cb 1.03 2.37 -0.38 0.00 -2.01 0.00 0.00 31.29 32.30 1pma h VAL 107 CO 1.37 0.39 -0.79 0.21 -1.01 0.00 0.00 177.57 177.73 1pma s ASN 108 N -5.94 3.68 0.58 3.17 3.84 -1.26 -1.96 114.94 117.05 1pma s ASN 108 Ca -0.16 -1.06 0.33 0.00 0.21 0.00 0.00 52.86 52.18 1pma s ASN 108 Cb 0.02 -1.20 1.79 0.00 -0.55 0.00 0.00 41.25 41.31 1pma s ASN 108 CO 0.70 -0.20 2.19 -0.29 -2.79 0.00 0.00 177.10 176.71 1pma h ILE 109 N 6.57 0.34 -0.92 -5.21 2.10 -1.96 -2.23 117.51 116.21 1pma h ILE 109 Ca -0.22 -0.27 0.02 0.00 1.08 0.00 0.00 64.86 65.48 1pma h ILE 109 Cb 1.08 1.19 -0.05 0.00 -1.09 0.00 0.00 36.82 37.95 1pma h ILE 109 CO 0.43 0.05 0.60 -0.08 -1.08 0.00 0.00 178.15 178.07 1pma h GLU 110 N 0.00 1.15 -0.65 2.19 4.81 -2.00 -1.90 114.58 118.18 1pma h GLU 110 Ca -0.00 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.13 1pma h GLU 110 Cb 0.19 -0.26 -0.03 0.00 0.63 0.00 0.00 28.75 29.28 1pma h GLU 110 CO 0.01 0.76 0.27 -0.97 -0.73 0.00 0.00 179.01 178.35 1pma h ASN 111 N 1.19 0.89 -0.01 1.04 -0.73 -1.83 0.09 115.58 116.21 1pma h ASN 111 Ca 0.35 -0.16 0.03 0.00 1.87 0.00 0.00 56.30 58.38 1pma h ASN 111 Cb -0.05 -0.23 -0.03 0.00 0.27 0.00 0.00 38.32 38.28 1pma h ASN 111 CO -0.10 0.81 -0.16 0.25 -0.37 0.00 0.00 177.43 177.86 1pma h LEU 112 N 0.91 -0.47 -0.45 0.34 5.85 -1.46 -1.06 115.31 118.98 1pma h LEU 112 Ca 0.22 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 59.00 1pma h LEU 112 Cb 0.19 0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1pma h LEU 112 CO -0.02 -0.22 0.27 1.62 -0.34 0.00 0.00 178.44 179.75 1pma h VAL 113 N -0.26 1.14 -0.88 1.05 3.04 -1.17 -2.28 116.25 116.89 1pma h VAL 113 Ca 0.05 -0.32 0.16 0.00 -1.01 0.00 0.00 66.70 65.58 1pma h VAL 113 Cb 0.33 0.54 -0.10 0.00 -2.01 0.00 0.00 31.29 30.05 1pma h VAL 113 CO -0.16 0.14 0.46 0.11 -1.01 0.00 0.00 177.57 177.12 1pma h LYS 114 N 0.60 0.62 -0.49 4.17 1.57 -0.24 0.76 116.57 123.56 1pma h LYS 114 Ca 0.16 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 1pma h LYS 114 Cb -0.01 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 1pma h LYS 114 CO -0.03 0.41 0.27 -0.09 -0.57 0.00 0.00 179.45 179.44 1pma h ARG 115 N 0.64 0.68 0.00 3.15 2.43 -0.65 -0.23 114.38 120.40 1pma h ARG 115 Ca 0.49 -0.08 -0.07 0.00 -0.81 0.00 0.00 59.98 59.51 1pma h ARG 115 Cb 0.71 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 1pma h ARG 115 CO -0.37 0.53 -0.32 -0.24 -1.51 0.00 0.00 179.97 178.05 1pma h VAL 116 N 0.65 1.20 0.01 0.20 3.04 -0.82 -2.39 116.25 118.13 1pma h VAL 116 Ca 0.17 -1.12 -0.00 0.00 -1.01 0.00 0.00 66.70 64.74 1pma h VAL 116 Cb 0.05 1.61 0.00 0.00 -2.01 0.00 0.00 31.29 30.94 1pma h VAL 116 CO -0.03 0.32 -0.00 0.00 -1.01 0.00 0.00 177.57 176.84 1pma h ALA 117 N 1.68 -0.01 -0.85 3.17 0.00 0.14 -2.71 119.26 120.67 1pma h ALA 117 Ca -0.00 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 54.79 1pma h ALA 117 Cb 0.58 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 1pma h ALA 117 CO 0.04 -0.33 0.56 -0.44 0.00 0.00 0.00 179.25 179.08 1pma h ASP 118 N -0.37 0.85 -0.10 0.00 3.32 -0.93 0.22 116.42 119.42 1pma h ASP 118 Ca -0.00 0.00 0.04 0.00 0.02 0.00 0.00 57.03 57.09 1pma h ASP 118 Cb 0.36 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.69 1pma h ASP 118 CO 0.00 0.56 -0.14 -0.61 -1.72 0.00 0.00 179.24 177.33 1pma h GLN 119 N 0.97 -0.18 0.37 3.56 -0.00 -1.35 -1.00 115.11 117.48 1pma h GLN 119 Ca 0.36 0.01 -0.01 0.00 -0.00 0.00 0.00 58.65 59.01 1pma h GLN 119 Cb 0.17 0.04 -0.02 0.00 0.00 0.00 0.00 27.48 27.68 1pma h GLN 119 CO -0.12 -0.12 -0.30 0.52 0.00 0.00 0.00 178.83 178.81 1pma h MET 120 N -0.19 -0.64 -1.10 1.69 2.86 -0.76 -2.37 114.93 114.42 1pma h MET 120 Ca 0.08 0.04 0.30 0.00 -2.06 0.00 0.00 59.70 58.07 1pma h MET 120 Cb 0.31 0.15 -0.07 0.00 0.06 0.00 0.00 31.60 32.04 1pma h MET 120 CO -0.21 -0.43 0.75 0.37 1.06 0.00 0.00 176.91 178.45 1pma h GLN 121 N -0.67 0.18 -0.58 1.72 -0.00 -0.29 0.13 115.11 115.60 1pma h GLN 121 Ca -0.03 -0.01 0.01 0.00 -0.00 0.00 0.00 58.65 58.62 1pma h GLN 121 Cb 0.58 -0.04 -0.03 0.00 0.00 0.00 0.00 27.48 28.00 1pma h GLN 121 CO -0.02 0.12 0.38 1.96 0.00 0.00 0.00 178.83 181.28 1pma h GLN 122 N 0.18 0.76 0.00 1.69 4.20 -0.63 -0.14 115.11 121.17 1pma h GLN 122 Ca 0.57 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 59.24 1pma h GLN 122 Cb 1.87 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 29.48 1pma h GLN 122 CO -0.15 0.50 0.00 0.66 -0.67 0.00 0.00 178.83 179.17 1pma n TYR 123 N -4.69 0.00 0.11 2.96 4.02 0.44 -1.34 117.16 118.68 1pma n TYR 123 Ca 0.04 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.91 1pma n TYR 123 Cb 0.02 -0.23 0.04 0.00 -0.02 0.00 0.00 39.34 39.16 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 1.33 0.00 -0.72 2.02 -0.97 -3.39 112.91 111.18 1pma h THR 124 Ca 0.00 -2.58 0.00 0.00 0.77 0.00 0.00 66.41 64.60 1pma h THR 124 Cb 0.11 2.46 0.00 0.00 -1.74 0.00 0.00 68.15 68.99 1pma h THR 124 CO 0.00 0.69 -0.10 0.00 0.37 0.00 0.00 175.52 176.48 1pma n GLN 125 N -3.44 3.52 -0.76 6.66 10.64 -0.45 -4.85 117.38 128.70 1pma n GLN 125 Ca 0.00 0.00 -0.07 0.00 -1.83 0.00 0.00 57.00 55.11 1pma n GLN 125 Cb 0.76 -0.36 -0.09 0.00 -0.86 0.00 0.00 30.24 29.68 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 -0.58 0.00 -1.17 2.61 4.01 -0.58 -4.97 117.16 116.48 1pma n TYR 126 Ca 0.00 -1.25 0.00 0.00 -0.16 0.00 0.00 57.90 56.49 1pma n TYR 126 Cb 0.00 -1.09 0.00 0.00 -0.31 0.00 0.00 39.34 37.94 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 2.06 2.87 3.05 2.72 0.00 -1.26 -4.55 105.19 110.08 1pma n GLY 127 Ca 0.23 -0.16 -0.04 0.00 0.00 0.00 0.00 46.02 46.05 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 0.04 3.54 -0.02 0.00 -1.26 -4.68 105.19 102.82 1pma n GLY 128 Ca 0.00 -0.09 0.01 0.00 0.00 0.00 0.00 46.02 45.95 1pma n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pma s VAL 129 N 3.27 -0.05 0.11 1.61 0.11 -1.26 -5.15 120.40 119.04 1pma s VAL 129 Ca 0.07 0.00 -0.31 0.00 -2.93 0.00 0.00 61.98 58.81 1pma s VAL 129 Cb 0.01 -1.00 -0.07 0.00 -1.53 0.00 0.00 36.38 33.79 1pma s VAL 129 CO 0.03 0.00 1.27 -0.60 -3.33 0.00 0.00 175.10 172.48 1pma s ARG 130 N 1.41 4.40 0.89 1.54 3.52 -1.26 -4.91 118.95 124.54 1pma s ARG 130 Ca -0.06 1.92 -0.10 0.00 -0.13 0.00 0.00 55.73 57.35 1pma s ARG 130 Cb -0.03 -3.28 0.13 0.00 -1.56 0.00 0.00 34.95 30.22 1pma s ARG 130 CO -0.13 -0.29 1.13 -2.14 -0.81 0.00 0.00 175.30 173.06 1pma s PRO 131 N 0.74 1.21 -0.18 5.12 0.02 -1.26 -4.92 135.00 135.74 1pma s PRO 131 Ca 0.59 1.41 -0.29 0.00 0.02 0.00 0.00 61.00 62.73 1pma s PRO 131 Cb -0.33 -1.76 -0.01 0.00 0.02 0.00 0.00 34.50 32.42 1pma s PRO 131 CO 0.32 -2.45 1.24 0.71 -0.33 0.00 0.00 177.00 176.48 1pma s TYR 132 N -2.71 2.90 -1.31 6.54 2.02 -1.26 -4.94 117.35 118.60 1pma s TYR 132 Ca 0.65 1.05 -0.12 0.00 -0.37 0.00 0.00 57.07 58.29 1pma s TYR 132 Cb -0.21 -3.49 0.13 0.00 -0.40 0.00 0.00 41.96 37.99 1pma s TYR 132 CO 0.58 -1.57 1.85 0.41 -1.57 0.00 0.00 175.55 175.25 1pma n GLY 133 N 3.60 4.18 3.56 0.71 0.00 -1.26 -4.55 105.19 111.43 1pma n GLY 133 Ca 0.14 -1.91 -0.09 0.00 0.00 0.00 0.00 46.02 44.16 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 1.61 0.00 0.08 1.61 0.11 -1.26 -0.07 120.40 122.48 1pma s VAL 134 Ca 0.43 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.52 1pma s VAL 134 Cb 0.07 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.89 1pma s VAL 134 CO -0.01 0.00 -0.10 -0.44 -3.33 0.00 0.00 175.10 171.22 1pma s SER 135 N -1.63 1.33 0.14 3.54 0.01 -0.48 -3.10 113.70 113.51 1pma s SER 135 Ca 0.01 -0.71 -0.15 0.00 1.31 0.00 0.00 55.95 56.41 1pma s SER 135 Cb -0.01 0.01 0.03 0.00 0.21 0.00 0.00 66.02 66.26 1pma s SER 135 CO -0.02 -0.22 0.39 -1.48 0.41 0.00 0.00 173.24 172.32 1pma s LEU 136 N -2.10 0.47 -0.04 2.44 0.05 -0.48 -0.45 118.68 118.57 1pma s LEU 136 Ca 0.00 -0.40 0.04 0.00 0.05 0.00 0.00 54.13 53.82 1pma s LEU 136 Cb -0.06 1.78 -0.00 0.00 -2.05 0.00 0.00 46.19 45.86 1pma s LEU 136 CO 0.00 -0.88 -0.14 0.27 -0.55 0.00 0.00 176.35 175.06 1pma s ILE 137 N -3.83 1.18 -0.10 1.48 -4.36 0.30 -0.77 121.20 115.11 1pma s ILE 137 Ca 0.05 -0.58 -0.03 0.00 -0.26 0.00 0.00 60.65 59.83 1pma s ILE 137 Cb 0.02 -1.03 -0.03 0.00 1.25 0.00 0.00 42.46 42.67 1pma s ILE 137 CO -0.10 0.35 0.02 -0.36 0.24 0.00 0.00 174.94 175.09 1pma s PHE 138 N 0.08 3.20 -0.03 1.37 0.08 0.06 -1.14 117.98 121.60 1pma s PHE 138 Ca -0.03 0.19 -0.07 0.00 0.12 0.00 0.00 56.93 57.14 1pma s PHE 138 Cb -0.10 -1.83 0.01 0.00 -0.57 0.00 0.00 43.02 40.53 1pma s PHE 138 CO 0.01 0.45 0.16 0.00 -0.10 0.00 0.00 175.22 175.74 1pma s ALA 139 N -0.75 -0.38 0.00 5.36 0.00 0.97 -1.06 121.76 125.90 1pma s ALA 139 Ca 0.12 0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.25 1pma s ALA 139 Cb -0.12 -0.08 0.00 0.00 0.00 0.00 0.00 23.12 22.92 1pma s ALA 139 CO 0.02 -0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.05 1pma n GLY 140 N 2.21 -1.64 3.14 0.00 0.00 -0.99 -0.56 105.19 107.35 1pma n GLY 140 Ca -0.18 -1.09 -0.29 0.00 0.00 0.00 0.00 46.02 44.47 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 -2.57 1.65 0.00 -0.61 -1.16 -1.01 -0.03 121.20 117.47 1pma s ILE 141 Ca 0.00 -0.79 0.00 0.00 -0.51 0.00 0.00 60.65 59.35 1pma s ILE 141 Cb 0.00 -1.44 0.00 0.00 0.61 0.00 0.00 42.46 41.63 1pma s ILE 141 CO 0.00 0.47 0.00 -0.90 -2.81 0.00 0.00 174.94 171.70 1pma n ASP 142 N 3.56 1.95 0.24 4.50 3.85 0.01 -4.84 116.55 125.82 1pma n ASP 142 Ca -0.20 -0.30 0.07 0.00 -0.71 0.00 0.00 54.79 53.65 1pma n ASP 142 Cb 0.52 0.00 0.60 0.00 -1.35 0.00 0.00 41.12 40.90 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 0.03 0.12 0.11 5.75 -1.65 -1.68 115.11 117.79 1pma h GLN 143 Ca 0.00 -0.00 -0.29 0.00 -0.15 0.00 0.00 58.65 58.21 1pma h GLN 143 Cb 0.00 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 28.54 1pma h GLN 143 CO 0.00 0.05 -1.34 0.82 -2.65 0.00 0.00 178.83 175.71 1pma h ILE 144 N 0.03 1.38 0.00 2.39 2.04 -1.97 -3.51 117.51 117.87 1pma h ILE 144 Ca 0.01 -2.97 0.00 0.00 1.00 0.00 0.00 64.86 62.90 1pma h ILE 144 Cb 0.06 2.88 0.00 0.00 -0.74 0.00 0.00 36.82 39.02 1pma h ILE 144 CO 0.00 0.86 0.00 0.61 0.00 0.00 0.00 178.15 179.63 1pma n GLY 145 N 1.58 0.62 3.76 5.37 0.00 -0.63 -5.09 105.19 110.80 1pma n GLY 145 Ca -0.11 -1.75 -0.41 0.00 0.00 0.00 0.00 46.02 43.74 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 4.19 0.03 1.61 0.02 -1.26 -0.81 135.00 136.79 1pma s PRO 146 Ca 0.00 2.45 0.01 0.00 0.02 0.00 0.00 61.00 63.49 1pma s PRO 146 Cb 0.00 -3.04 -0.02 0.00 0.02 0.00 0.00 34.50 31.46 1pma s PRO 146 CO 0.00 -0.49 -0.05 1.03 -0.33 0.00 0.00 177.00 177.15 1pma s ARG 147 N -1.02 0.45 -0.11 5.54 0.52 0.96 -4.91 118.95 120.38 1pma s ARG 147 Ca 0.58 -0.74 -0.04 0.00 -0.52 0.00 0.00 55.73 55.01 1pma s ARG 147 Cb -0.45 -0.09 0.06 0.00 0.52 0.00 0.00 34.95 34.99 1pma s ARG 147 CO 0.51 -0.00 0.22 -1.17 0.02 0.00 0.00 175.30 174.87 1pma s LEU 148 N -1.64 -0.11 0.09 2.53 2.96 -1.26 -2.33 118.68 118.91 1pma s LEU 148 Ca -0.11 0.48 0.04 0.00 -0.22 0.00 0.00 54.13 54.32 1pma s LEU 148 Cb -0.09 0.53 -0.03 0.00 0.50 0.00 0.00 46.19 47.10 1pma s LEU 148 CO -0.01 -0.23 -0.11 -0.36 -1.32 0.00 0.00 176.35 174.32 1pma s PHE 149 N 2.22 1.13 0.16 5.38 0.40 -0.23 -0.69 117.98 126.36 1pma s PHE 149 Ca 0.01 -0.59 0.08 0.00 -0.60 0.00 0.00 56.93 55.82 1pma s PHE 149 Cb -0.12 -0.62 -0.04 0.00 0.51 0.00 0.00 43.02 42.75 1pma s PHE 149 CO -0.07 0.03 -0.16 0.16 0.70 0.00 0.00 175.22 175.88 1pma s ASP 150 N -2.26 2.46 -0.18 1.36 -4.77 -0.60 -0.76 116.67 111.91 1pma s ASP 150 Ca 0.04 -0.89 -0.09 0.00 -3.30 0.00 0.00 52.55 48.30 1pma s ASP 150 Cb -0.05 -0.13 0.06 0.00 -1.09 0.00 0.00 42.92 41.72 1pma s ASP 150 CO 0.01 -0.10 0.43 0.00 0.70 0.00 0.00 175.17 176.21 1pma s ASP 152 N 1.58 5.08 0.57 0.00 -4.77 -1.11 -1.38 116.67 116.63 1pma s ASP 152 Ca -0.09 -0.87 0.28 0.00 -3.30 0.00 0.00 52.55 48.58 1pma s ASP 152 Cb -0.09 0.23 1.69 0.00 -1.09 0.00 0.00 42.92 43.66 1pma s ASP 152 CO -0.13 -1.26 2.20 -0.65 0.70 0.00 0.00 175.17 176.03 1pma h PRO 153 N 0.30 0.00 0.00 2.11 0.11 -1.78 -0.56 132.00 132.18 1pma h PRO 153 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 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 0.44 0.04 0.00 0.00 -0.21 0.00 0.00 178.00 178.26 1pma h ALA 154 N 1.96 1.00 0.00 -0.75 0.00 -1.89 -3.43 119.26 116.15 1pma h ALA 154 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pma h ALA 154 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 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 0.81 3.74 0.00 0.00 -0.22 -4.46 105.19 105.42 1pma n GLY 155 Ca 0.02 -0.17 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 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 4.55 0.03 2.61 2.01 -1.26 -4.79 115.64 116.80 1pma s THR 156 Ca 0.00 1.83 0.04 0.00 0.31 0.00 0.00 61.69 63.87 1pma s THR 156 Cb 0.00 -4.21 -0.02 0.00 0.01 0.00 0.00 72.50 68.28 1pma s THR 156 CO 0.00 0.38 -0.12 -0.51 -0.69 0.00 0.00 174.62 173.67 1pma s ILE 157 N -0.26 0.98 -0.03 1.82 2.07 -1.26 -2.76 121.20 121.75 1pma s ILE 157 Ca 0.41 -0.89 -0.16 0.00 -1.41 0.00 0.00 60.65 58.61 1pma s ILE 157 Cb -0.22 -0.89 0.03 0.00 0.13 0.00 0.00 42.46 41.51 1pma s ILE 157 CO 0.26 0.01 0.35 0.20 -1.91 0.00 0.00 174.94 173.85 1pma s ASN 158 N -1.00 -0.26 -0.13 4.50 -0.87 -1.08 -4.99 114.94 111.12 1pma s ASN 158 Ca 0.01 0.22 -0.07 0.00 -1.57 0.00 0.00 52.86 51.45 1pma s ASN 158 Cb -0.07 0.39 -0.04 0.00 -0.02 0.00 0.00 41.25 41.50 1pma s ASN 158 CO 0.01 -0.42 0.13 -0.70 -2.57 0.00 0.00 177.10 173.55 1pma s GLU 159 N -1.14 3.52 0.38 -0.60 2.12 -1.26 -1.56 118.70 120.16 1pma s GLU 159 Ca -0.12 -0.15 0.05 0.00 0.36 0.00 0.00 54.97 55.11 1pma s GLU 159 Cb -0.04 -3.20 -0.07 0.00 0.26 0.00 0.00 34.13 31.07 1pma s GLU 159 CO 0.04 0.71 0.03 0.71 -0.54 0.00 0.00 175.26 176.22 1pma s TYR 160 N -0.84 2.25 -0.12 5.30 1.51 0.14 -4.99 117.35 120.59 1pma s TYR 160 Ca 0.14 -0.82 0.15 0.00 -1.01 0.00 0.00 57.07 55.53 1pma s TYR 160 Cb -0.12 -1.55 -0.24 0.00 -0.11 0.00 0.00 41.96 39.94 1pma s TYR 160 CO 0.03 0.24 0.38 1.17 -1.11 0.00 0.00 175.55 176.26 1pma n LYS 161 N -0.85 0.66 -3.61 -0.62 3.00 -1.26 -4.44 118.16 111.04 1pma n LYS 161 Ca -0.04 0.15 -0.06 0.00 -0.00 0.00 0.00 58.31 58.36 1pma n LYS 161 Cb 0.67 -1.66 -0.05 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 -2.55 -2.02 0.14 3.14 0.00 -1.26 -0.38 121.76 118.83 1pma s ALA 162 Ca -0.08 1.72 -0.24 0.00 0.00 0.00 0.00 51.96 53.36 1pma s ALA 162 Cb 0.07 -1.05 0.08 0.00 0.00 0.00 0.00 23.12 22.22 1pma s ALA 162 CO 0.83 -0.29 1.05 -0.08 0.00 0.00 0.00 175.76 177.26 1pma s THR 163 N -1.12 0.00 0.25 0.00 -1.32 0.12 -4.96 115.64 108.61 1pma s THR 163 Ca 0.03 -0.56 0.04 0.00 -1.21 0.00 0.00 61.69 60.00 1pma s THR 163 Cb -0.01 -2.45 -0.01 0.00 -1.51 0.00 0.00 72.50 68.52 1pma s THR 163 CO -0.03 0.00 0.26 0.00 -2.21 0.00 0.00 174.62 172.64 1pma n ALA 164 N -0.60 0.33 -3.51 11.08 0.00 -1.26 -0.34 120.51 126.21 1pma n ALA 164 Ca -0.05 -1.41 -0.08 0.00 0.00 0.00 0.00 53.44 51.90 1pma n ALA 164 Cb 0.60 1.14 -0.02 0.00 0.00 0.00 0.00 19.45 21.17 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 -2.94 0.00 0.00 0.00 1.10 0.12 -4.93 121.20 114.54 1pma s ILE 165 Ca 0.28 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.42 1pma s ILE 165 Cb 0.01 -1.00 0.00 0.00 0.15 0.00 0.00 42.46 41.62 1pma s ILE 165 CO 0.20 0.00 0.00 0.61 -2.11 0.00 0.00 174.94 173.64 1pma n GLY 166 N -0.21 0.13 0.00 1.50 0.00 -1.26 -0.95 105.19 104.41 1pma n GLY 166 Ca -0.09 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.11 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 0.00 0.00 -1.28 1.61 2.88 -0.57 -3.42 113.62 112.84 1pma n SER 167 Ca 0.00 0.75 0.00 0.00 -1.33 0.00 0.00 58.87 58.29 1pma n SER 167 Cb 0.00 -0.25 0.00 0.00 -0.75 0.00 0.00 64.21 63.21 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 -0.79 2.01 0.27 0.46 0.00 -1.26 -4.54 105.19 101.34 1pma n GLY 168 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 0.81 -0.51 -0.85 1.61 3.64 -1.81 -1.73 116.57 117.73 1pma h LYS 169 Ca 0.00 0.03 0.21 0.00 -1.27 0.00 0.00 60.65 59.63 1pma h LYS 169 Cb 0.88 0.11 -0.13 0.00 -0.41 0.00 0.00 32.23 32.68 1pma h LYS 169 CO 0.00 -0.34 0.28 -0.44 -2.27 0.00 0.00 179.45 176.68 1pma h ASP 170 N -0.53 0.12 0.34 4.20 3.32 -1.89 0.32 116.42 122.31 1pma h ASP 170 Ca -0.03 0.17 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 1pma h ASP 170 Cb 0.46 0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.22 1pma h ASP 170 CO -0.05 -0.08 -0.17 0.00 -1.72 0.00 0.00 179.24 177.23 1pma h ALA 171 N 1.72 -1.11 -0.74 3.45 0.00 -1.84 -2.17 119.26 118.57 1pma h ALA 171 Ca 0.53 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.37 1pma h ALA 171 Cb 1.01 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.96 1pma h ALA 171 CO -0.58 -1.08 0.49 -0.24 0.00 0.00 0.00 179.25 177.83 1pma h VAL 172 N -0.47 1.11 -0.77 0.00 3.04 -0.99 -1.96 116.25 116.21 1pma h VAL 172 Ca -0.05 -0.31 -0.00 0.00 -1.01 0.00 0.00 66.70 65.33 1pma h VAL 172 Cb 0.36 0.14 -0.04 0.00 -2.01 0.00 0.00 31.29 29.74 1pma h VAL 172 CO 0.07 0.16 0.46 1.62 -1.01 0.00 0.00 177.57 178.88 1pma h VAL 173 N 0.90 1.21 -0.05 1.51 3.04 -0.33 -2.11 116.25 120.43 1pma h VAL 173 Ca 0.29 -0.47 -0.00 0.00 -1.01 0.00 0.00 66.70 65.51 1pma h VAL 173 Cb 0.05 0.13 -0.00 0.00 -2.01 0.00 0.00 31.29 29.46 1pma h VAL 173 CO -0.08 0.22 0.01 0.28 -1.01 0.00 0.00 177.57 177.00 1pma h SER 174 N 1.06 0.08 -0.46 3.17 0.02 -0.69 0.35 113.55 117.08 1pma h SER 174 Ca 0.28 -0.22 0.09 0.00 -0.84 0.00 0.00 61.79 61.09 1pma h SER 174 Cb -0.04 -0.02 -0.10 0.00 0.14 0.00 0.00 62.40 62.38 1pma h SER 174 CO -0.05 0.28 -0.32 0.15 -1.14 0.00 0.00 176.83 175.75 1pma h PHE 175 N -0.13 -0.88 -0.06 3.45 3.04 -1.06 0.80 116.94 122.10 1pma h PHE 175 Ca 0.02 0.06 -0.00 0.00 3.98 0.00 0.00 57.97 62.03 1pma h PHE 175 Cb 0.23 0.45 -0.00 0.00 2.56 0.00 0.00 35.95 39.19 1pma h PHE 175 CO 0.00 -0.37 0.03 -0.07 -2.02 0.00 0.00 178.31 175.88 1pma h LEU 176 N -0.21 0.08 -1.55 0.59 -0.00 -1.21 0.40 115.31 113.41 1pma h LEU 176 Ca 0.20 -0.08 0.22 0.00 -0.00 0.00 0.00 57.88 58.21 1pma h LEU 176 Cb 0.54 -0.02 -0.03 0.00 -0.00 0.00 0.00 40.66 41.15 1pma h LEU 176 CO -0.58 0.14 0.84 -0.08 -0.00 0.00 0.00 178.44 178.75 1pma h GLU 177 N 0.01 0.00 0.00 1.13 4.57 0.15 0.22 114.58 120.66 1pma h GLU 177 Ca 0.02 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 58.09 1pma h GLU 177 Cb 0.08 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.65 1pma h GLU 177 CO -0.00 0.00 -1.21 -2.13 -1.18 0.00 0.00 179.01 174.49 1pma n ARG 178 N -3.49 0.43 -0.57 1.92 0.63 0.10 -4.76 116.66 110.92 1pma n ARG 178 Ca 0.16 0.18 0.07 0.00 -0.92 0.00 0.00 57.85 57.33 1pma n ARG 178 Cb 1.09 -1.24 0.30 0.00 0.45 0.00 0.00 32.46 33.06 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 -4.17 3.49 -2.40 -0.14 1.02 0.13 -4.95 120.64 113.61 1pma n GLU 179 Ca -0.20 -2.38 -0.42 0.00 -0.02 0.00 0.00 57.16 54.13 1pma n GLU 179 Cb 0.52 -1.88 -0.03 0.00 -0.02 0.00 0.00 31.44 30.04 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 -1.97 3.32 -0.34 -0.32 5.04 0.74 -4.94 117.35 118.89 1pma s TYR 180 Ca 0.42 1.22 -0.09 0.00 -2.44 0.00 0.00 57.07 56.18 1pma s TYR 180 Cb 0.29 -3.45 0.02 0.00 0.35 0.00 0.00 41.96 39.16 1pma s TYR 180 CO 0.18 -1.43 0.16 0.21 -1.34 0.00 0.00 175.55 173.33 1pma s LYS 181 N 1.45 2.98 0.00 4.97 2.47 -1.26 -5.04 119.74 125.31 1pma s LYS 181 Ca 0.59 -0.96 0.00 0.00 -1.56 0.00 0.00 55.97 54.04 1pma s LYS 181 Cb -0.29 -3.59 0.00 0.00 -1.46 0.00 0.00 37.83 32.49 1pma s LYS 181 CO 0.27 -0.58 0.05 -1.91 0.16 0.00 0.00 175.35 173.35 1pma n GLU 182 N 4.95 0.00 -1.93 4.03 4.07 -1.26 -2.40 120.64 128.09 1pma n GLU 182 Ca -0.13 0.05 -0.36 0.00 -0.06 0.00 0.00 57.16 56.66 1pma n GLU 182 Cb 0.47 -0.27 -0.00 0.00 -0.06 0.00 0.00 31.44 31.57 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 7.26 -4.70 4.31 5.03 -1.26 -4.67 115.26 121.05 1pma n ASN 183 Ca 0.00 -3.48 -0.42 0.00 0.87 0.00 0.00 54.58 51.55 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 -3.17 4.35 0.47 3.41 2.96 -1.01 -4.38 118.68 121.32 1pma s LEU 184 Ca 0.52 2.34 -0.23 0.00 -0.22 0.00 0.00 54.13 56.55 1pma s LEU 184 Cb 0.33 -3.57 -0.07 0.00 0.50 0.00 0.00 46.19 43.37 1pma s LEU 184 CO -0.24 -0.75 1.21 -2.84 -1.32 0.00 0.00 176.35 172.41 1pma s PRO 185 N 1.86 3.68 0.04 0.98 0.02 -1.26 -1.27 135.00 139.05 1pma s PRO 185 Ca 0.67 1.90 -0.08 0.00 0.02 0.00 0.00 61.00 63.51 1pma s PRO 185 Cb -0.37 -2.43 -0.02 0.00 0.02 0.00 0.00 34.50 31.70 1pma s PRO 185 CO 0.30 -0.65 0.68 -1.91 -0.33 0.00 0.00 177.00 175.08 1pma n GLU 186 N -0.50 -0.12 -0.24 5.54 2.13 -1.26 -0.40 120.64 125.80 1pma n GLU 186 Ca 0.07 0.67 0.02 0.00 0.66 0.00 0.00 57.16 58.59 1pma n GLU 186 Cb 0.47 -0.99 0.11 0.00 0.27 0.00 0.00 31.44 31.30 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 0.06 -0.11 5.31 3.64 -2.00 0.42 116.57 123.89 1pma h LYS 187 Ca 0.04 -0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.26 1pma h LYS 187 Cb 0.11 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1pma h LYS 187 CO -0.25 0.04 -0.63 0.93 -2.27 0.00 0.00 179.45 177.27 1pma h GLU 188 N 0.06 0.39 0.37 1.90 5.08 -1.16 -2.50 114.58 118.73 1pma h GLU 188 Ca 0.36 -0.27 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 1pma h GLU 188 Cb 0.60 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1pma h GLU 188 CO -0.66 0.89 -0.18 0.00 -1.00 0.00 0.00 179.01 178.06 1pma h ALA 189 N 1.05 -0.50 -0.89 3.43 0.00 0.24 0.18 119.26 122.77 1pma h ALA 189 Ca -0.01 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 54.87 1pma h ALA 189 Cb 1.16 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 19.09 1pma h ALA 189 CO 0.11 -0.78 0.58 -0.24 0.00 0.00 0.00 179.25 178.91 1pma h VAL 190 N -0.50 1.00 0.58 0.00 3.04 -0.38 0.14 116.25 120.13 1pma h VAL 190 Ca -0.05 -0.32 -0.03 0.00 -1.01 0.00 0.00 66.70 65.29 1pma h VAL 190 Cb 0.39 -0.01 0.00 0.00 -2.01 0.00 0.00 31.29 29.66 1pma h VAL 190 CO 0.08 0.17 -0.30 0.74 -1.01 0.00 0.00 177.57 177.25 1pma h THR 191 N 0.93 0.00 -1.13 3.17 2.02 -0.88 0.32 112.91 117.34 1pma h THR 191 Ca 0.40 0.00 0.33 0.00 0.77 0.00 0.00 66.41 67.91 1pma h THR 191 Cb 0.33 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.63 1pma h THR 191 CO -0.16 0.00 0.73 0.25 0.37 0.00 0.00 175.52 176.70 1pma h LEU 192 N -0.81 0.38 0.21 2.58 5.85 -0.23 0.80 115.31 124.09 1pma h LEU 192 Ca -0.08 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1pma h LEU 192 Cb 0.63 0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.72 1pma h LEU 192 CO 0.12 -0.02 -0.10 1.23 -0.34 0.00 0.00 178.44 179.33 1pma h GLY 193 N 0.28 -0.29 -0.15 3.75 0.00 -0.40 -1.61 103.07 104.65 1pma h GLY 193 Ca 0.68 0.11 0.28 0.00 0.00 0.00 0.00 47.33 48.39 1pma h GLY 193 CO -0.35 -0.11 0.69 1.19 0.00 0.00 0.00 176.54 177.96 1pma h ILE 194 N -0.36 0.51 0.12 2.60 2.10 0.15 0.60 117.51 123.23 1pma h ILE 194 Ca -0.03 -0.11 -0.01 0.00 1.08 0.00 0.00 64.86 65.79 1pma h ILE 194 Cb 0.21 0.16 0.00 0.00 -1.09 0.00 0.00 36.82 36.10 1pma h ILE 194 CO 0.05 0.06 -0.06 0.50 -1.08 0.00 0.00 178.15 177.62 1pma h LYS 195 N 0.32 -0.15 -0.03 2.19 3.64 -0.99 0.91 116.57 122.47 1pma h LYS 195 Ca 0.58 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 60.00 1pma h LYS 195 Cb 1.61 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 33.43 1pma h LYS 195 CO -0.25 0.14 -0.18 0.00 -2.27 0.00 0.00 179.45 176.89 1pma h ALA 196 N 0.39 -0.20 -0.55 5.00 0.00 0.11 0.02 119.26 124.02 1pma h ALA 196 Ca -0.02 0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.97 1pma h ALA 196 Cb 0.36 0.33 -0.06 0.00 0.00 0.00 0.00 17.79 18.42 1pma h ALA 196 CO 0.03 -0.67 0.24 1.25 0.00 0.00 0.00 179.25 180.10 1pma h LEU 197 N -0.28 0.30 0.00 0.00 5.85 -0.56 -2.65 115.31 117.97 1pma h LEU 197 Ca 0.06 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1pma h LEU 197 Cb 0.37 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.40 1pma h LEU 197 CO -0.19 0.20 0.00 1.17 -0.34 0.00 0.00 178.44 179.28 1pma n LYS 198 N -4.94 0.00 -0.19 1.25 4.81 0.31 -2.88 118.16 116.52 1pma n LYS 198 Ca 0.06 0.39 -0.02 0.00 -0.87 0.00 0.00 58.31 57.88 1pma n LYS 198 Cb 0.20 -1.18 0.00 0.00 0.02 0.00 0.00 35.03 34.07 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 -1.33 -0.36 0.00 3.14 3.41 -0.09 -0.25 113.62 118.13 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 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.78 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 -4.68 0.00 0.33 4.04 2.88 -1.02 -3.32 113.62 111.84 1pma n SER 200 Ca 0.04 0.00 0.21 0.00 -1.33 0.00 0.00 58.87 57.79 1pma n SER 200 Cb 0.18 0.00 1.12 0.00 -0.75 0.00 0.00 64.21 64.76 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 -3.41 2.46 7.12 -1.42 -3.28 115.31 116.79 1pma h LEU 201 Ca 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 57.88 58.01 1pma h LEU 201 Cb 0.00 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.13 1pma h LEU 201 CO 0.00 0.00 -0.00 -0.62 -0.13 0.00 0.00 178.44 177.69 1pma n GLU 202 N -2.99 0.62 0.11 1.25 4.71 0.65 -3.08 120.64 121.92 1pma n GLU 202 Ca -0.03 -0.01 -0.02 0.00 -0.01 0.00 0.00 57.16 57.09 1pma n GLU 202 Cb 0.12 -1.21 0.05 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 2.21 0.00 -0.91 3.49 4.22 -1.76 -2.91 114.58 118.92 1pma h GLU 203 Ca 0.00 0.00 -0.18 0.00 0.08 0.00 0.00 59.36 59.27 1pma h GLU 203 Cb 0.61 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.76 1pma h GLU 203 CO 0.01 0.73 0.22 0.41 -2.18 0.00 0.00 179.01 178.20 1pma n GLY 204 N 0.82 2.98 5.05 1.92 0.00 -1.18 -4.98 105.19 109.81 1pma n GLY 204 Ca -0.00 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.11 0.00 -1.91 1.61 4.07 -1.10 -4.83 120.64 118.37 1pma n GLU 205 Ca 0.26 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 56.94 1pma n GLU 205 Cb 1.01 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 32.36 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 4.00 0.19 5.31 2.12 -1.26 -4.87 118.70 124.19 1pma s GLU 206 Ca 0.00 2.18 0.24 0.00 0.36 0.00 0.00 54.97 57.76 1pma s GLU 206 Cb 0.00 -4.08 0.91 0.00 0.26 0.00 0.00 34.13 31.22 1pma s GLU 206 CO 0.00 -1.07 1.74 -0.11 -0.54 0.00 0.00 175.26 175.28 1pma n LEU 207 N 7.90 0.60 0.00 2.70 7.94 -1.26 -4.96 117.00 129.91 1pma n LEU 207 Ca 0.19 0.60 0.00 0.00 -1.11 0.00 0.00 56.01 55.69 1pma n LEU 207 Cb 0.43 -0.46 0.00 0.00 0.53 0.00 0.00 43.42 43.92 1pma n LEU 207 CO 0.65 -0.32 0.00 1.17 -1.11 0.00 0.00 177.39 177.78 1pma n LYS 208 N -2.11 0.00 -3.71 1.96 3.00 -1.26 -4.41 118.16 111.63 1pma n LYS 208 Ca 0.04 0.00 -0.39 0.00 -0.00 0.00 0.00 58.31 57.97 1pma n LYS 208 Cb 0.32 0.00 -0.12 0.00 0.00 0.00 0.00 35.03 35.23 1pma n LYS 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1pma s ALA 209 N -1.95 3.11 0.40 3.14 0.00 -1.26 -5.06 121.76 120.14 1pma s ALA 209 Ca 0.00 -1.73 -0.23 0.00 0.00 0.00 0.00 51.96 50.00 1pma s ALA 209 Cb 0.00 -2.36 -0.11 0.00 0.00 0.00 0.00 23.12 20.66 1pma s ALA 209 CO 0.00 -1.35 0.95 -2.14 0.00 0.00 0.00 175.76 173.23 1pma s PRO 210 N 1.45 4.32 -0.21 0.00 0.02 -1.26 -2.92 135.00 136.39 1pma s PRO 210 Ca -0.01 1.20 -0.08 0.00 0.02 0.00 0.00 61.00 62.14 1pma s PRO 210 Cb -0.19 -2.38 -0.04 0.00 0.02 0.00 0.00 34.50 31.91 1pma s PRO 210 CO 0.04 0.05 0.07 -2.00 -0.33 0.00 0.00 177.00 174.83 1pma s GLU 211 N -2.82 3.84 -0.01 5.54 2.12 0.30 -4.86 118.70 122.82 1pma s GLU 211 Ca 0.58 -0.40 0.02 0.00 0.36 0.00 0.00 54.97 55.53 1pma s GLU 211 Cb -0.13 -3.28 -0.00 0.00 0.26 0.00 0.00 34.13 30.98 1pma s GLU 211 CO 0.17 0.06 -0.05 -1.50 -0.54 0.00 0.00 175.26 173.40 1pma s ILE 212 N 0.95 0.41 0.00 -3.70 2.07 -1.26 -0.99 121.20 118.69 1pma s ILE 212 Ca 0.04 -0.21 -0.03 0.00 -1.41 0.00 0.00 60.65 59.04 1pma s ILE 212 Cb -0.14 -0.35 -0.01 0.00 0.13 0.00 0.00 42.46 42.09 1pma s ILE 212 CO 0.03 0.12 0.06 0.00 -1.91 0.00 0.00 174.94 173.23 1pma s ALA 213 N -0.07 -0.11 0.03 1.50 0.00 -0.63 -1.25 121.76 121.24 1pma s ALA 213 Ca 0.01 -0.26 -0.15 0.00 0.00 0.00 0.00 51.96 51.57 1pma s ALA 213 Cb -0.03 0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.20 1pma s ALA 213 CO -0.00 -0.15 0.33 -1.54 0.00 0.00 0.00 175.76 174.39 1pma s SER 214 N -1.14 -0.17 0.05 0.00 1.04 0.12 0.24 113.70 113.85 1pma s SER 214 Ca -0.12 -0.10 0.01 0.00 0.48 0.00 0.00 55.95 56.21 1pma s SER 214 Cb -0.07 0.36 -0.03 0.00 0.10 0.00 0.00 66.02 66.38 1pma s SER 214 CO 0.00 -0.60 -0.05 -0.51 0.98 0.00 0.00 173.24 173.06 1pma s ILE 215 N -2.33 0.39 0.02 -1.02 2.07 -0.74 0.04 121.20 119.62 1pma s ILE 215 Ca -0.06 -1.34 0.05 0.00 -1.41 0.00 0.00 60.65 57.88 1pma s ILE 215 Cb -0.02 -0.90 -0.02 0.00 0.13 0.00 0.00 42.46 41.66 1pma s ILE 215 CO -0.02 -0.63 -0.15 0.28 -1.91 0.00 0.00 174.94 172.52 1pma s THR 216 N -2.33 1.15 0.27 4.00 -1.32 -1.26 -1.94 115.64 114.20 1pma s THR 216 Ca -0.04 -0.85 -0.28 0.00 -1.21 0.00 0.00 61.69 59.31 1pma s THR 216 Cb -0.04 -1.01 -0.15 0.00 -1.51 0.00 0.00 72.50 69.80 1pma s THR 216 CO -0.03 0.14 0.90 0.55 -2.21 0.00 0.00 174.62 173.98 1pma n VAL 217 N 2.23 2.00 0.00 5.08 3.14 -0.06 -1.38 118.33 129.34 1pma n VAL 217 Ca -0.16 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.72 1pma n VAL 217 Cb 0.55 -0.79 0.00 0.00 -1.06 0.00 0.00 33.84 32.54 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 1.38 3.27 3.37 7.55 0.00 -1.26 -5.02 105.19 114.47 1pma n GLY 218 Ca 0.11 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.11 1.30 0.68 1.61 4.22 -0.48 -5.17 114.94 117.00 1pma s ASN 219 Ca 0.00 -1.63 -0.11 0.00 -2.14 0.00 0.00 52.86 48.98 1pma s ASN 219 Cb 0.00 0.60 -0.00 0.00 1.28 0.00 0.00 41.25 43.13 1pma s ASN 219 CO 0.00 -1.16 1.07 -0.54 -2.04 0.00 0.00 177.10 174.43 1pma s LYS 220 N -3.30 3.06 0.62 3.55 1.02 -1.26 -4.40 119.74 119.03 1pma s LYS 220 Ca 0.36 0.63 -0.19 0.00 0.02 0.00 0.00 55.97 56.79 1pma s LYS 220 Cb 0.01 -2.03 -0.03 0.00 -0.52 0.00 0.00 37.83 35.27 1pma s LYS 220 CO 0.24 -0.93 1.24 0.66 -0.92 0.00 0.00 175.35 175.64 1pma n TYR 221 N -2.97 1.79 -4.00 3.18 4.01 -0.57 -4.60 117.16 114.00 1pma n TYR 221 Ca 0.07 0.43 -0.27 0.00 -0.16 0.00 0.00 57.90 57.96 1pma n TYR 221 Cb 0.56 -2.26 -0.17 0.00 -0.31 0.00 0.00 39.34 37.15 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 -3.13 1.69 -0.16 -0.72 3.52 0.11 -4.98 118.95 115.27 1pma s ARG 222 Ca 0.79 -0.33 -0.11 0.00 -0.13 0.00 0.00 55.73 55.95 1pma s ARG 222 Cb -0.40 -1.66 -0.05 0.00 -1.56 0.00 0.00 34.95 31.28 1pma s ARG 222 CO 0.44 -0.23 0.19 0.42 -0.81 0.00 0.00 175.30 175.31 1pma s ILE 223 N 1.55 5.38 0.31 4.11 1.01 -1.26 0.15 121.20 132.45 1pma s ILE 223 Ca 0.03 0.33 -0.28 0.00 0.00 0.00 0.00 60.65 60.73 1pma s ILE 223 Cb -0.13 -3.51 -0.09 0.00 0.01 0.00 0.00 42.46 38.73 1pma s ILE 223 CO -0.07 0.47 1.11 -0.31 0.00 0.00 0.00 174.94 176.14 1pma s TYR 224 N 0.00 3.45 0.45 3.97 1.51 -0.38 -4.99 117.35 121.37 1pma s TYR 224 Ca 0.13 1.66 -0.16 0.00 -1.01 0.00 0.00 57.07 57.69 1pma s TYR 224 Cb -0.12 -3.29 -0.08 0.00 -0.11 0.00 0.00 41.96 38.36 1pma s TYR 224 CO 0.02 -0.70 0.91 0.16 -1.11 0.00 0.00 175.55 174.83 1pma s ASP 225 N -1.00 6.68 0.24 2.29 -4.77 -1.26 -4.80 116.67 114.05 1pma s ASP 225 Ca 0.48 1.47 -0.05 0.00 -3.30 0.00 0.00 52.55 51.15 1pma s ASP 225 Cb -0.31 -2.46 0.44 0.00 -1.09 0.00 0.00 42.92 39.51 1pma s ASP 225 CO 0.39 -0.46 1.31 1.67 0.70 0.00 0.00 175.17 178.78 1pma n GLN 226 N -1.21 -0.07 -0.08 2.11 7.27 -1.26 -0.60 117.38 123.53 1pma n GLN 226 Ca 0.05 1.29 -0.12 0.00 0.07 0.00 0.00 57.00 58.30 1pma n GLN 226 Cb 0.54 -1.96 -0.05 0.00 2.41 0.00 0.00 30.24 31.18 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 -0.33 3.69 3.07 -1.97 -1.94 114.58 117.57 1pma h GLU 227 Ca 0.43 -0.20 0.05 0.00 -0.50 0.00 0.00 59.36 59.14 1pma h GLU 227 Cb 0.71 -0.02 -0.05 0.00 -0.84 0.00 0.00 28.75 28.56 1pma h GLU 227 CO -0.84 0.73 0.06 1.49 -1.40 0.00 0.00 179.01 179.04 1pma h GLU 228 N 0.20 0.17 -0.59 2.33 4.81 -1.23 0.56 114.58 120.84 1pma h GLU 228 Ca 0.06 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.20 1pma h GLU 228 Cb 0.57 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 1pma h GLU 228 CO 0.03 0.11 0.06 -0.24 -0.73 0.00 0.00 179.01 178.24 1pma h VAL 229 N 0.17 1.26 -0.01 0.32 3.04 -1.42 -1.62 116.25 117.99 1pma h VAL 229 Ca 0.16 -1.04 0.00 0.00 -1.01 0.00 0.00 66.70 64.81 1pma h VAL 229 Cb 0.18 0.78 -0.00 0.00 -2.01 0.00 0.00 31.29 30.24 1pma h VAL 229 CO -0.21 0.38 0.02 0.50 -1.01 0.00 0.00 177.57 177.24 1pma h LYS 230 N 0.90 0.00 -0.23 4.17 3.64 -0.49 0.25 116.57 124.80 1pma h LYS 230 Ca 0.18 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.40 1pma h LYS 230 Cb 0.47 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 1pma h LYS 230 CO 0.02 0.00 -0.49 -0.22 -2.27 0.00 0.00 179.45 176.49 1pma h LYS 231 N 0.00 0.63 0.00 1.90 3.64 0.10 -3.17 116.57 119.67 1pma h LYS 231 Ca 0.00 -0.37 -0.20 0.00 -1.27 0.00 0.00 60.65 58.81 1pma h LYS 231 Cb 0.04 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 1pma h LYS 231 CO -0.00 0.97 -1.08 0.74 -2.27 0.00 0.00 179.45 177.81 1pma h PHE 232 N 0.50 0.00 0.00 1.91 -1.00 -0.56 -3.52 116.94 114.27 1pma h PHE 232 Ca 0.02 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.80 1pma h PHE 232 Cb 1.03 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.59 1pma h PHE 232 CO 0.05 0.88 0.00 -0.11 -1.61 0.00 0.00 178.31 177.52