#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 0.16 12.58 -7.23 -1.26 -4.86 120.40 119.79 1pma s VAL 14 Ca 0.00 -1.71 -0.25 0.00 -1.81 0.00 0.00 61.98 58.21 1pma s VAL 14 Cb 0.00 -2.55 -0.08 0.00 0.56 0.00 0.00 36.38 34.32 1pma s VAL 14 CO 0.00 0.00 0.77 -0.36 -0.31 0.00 0.00 175.10 175.20 1pma s PHE 15 N -3.38 3.90 0.67 2.82 0.08 -1.26 -4.27 117.98 116.54 1pma s PHE 15 Ca 0.33 1.62 -0.09 0.00 0.12 0.00 0.00 56.93 58.91 1pma s PHE 15 Cb 0.01 -2.77 0.02 0.00 -0.57 0.00 0.00 43.02 39.71 1pma s PHE 15 CO 0.19 0.50 1.03 -1.54 -0.10 0.00 0.00 175.22 175.31 1pma s SER 16 N -1.09 5.38 0.15 1.36 1.04 0.11 -4.86 113.70 115.79 1pma s SER 16 Ca 0.36 0.91 0.09 0.00 0.48 0.00 0.00 55.95 57.79 1pma s SER 16 Cb -0.23 -1.74 0.51 0.00 0.10 0.00 0.00 66.02 64.66 1pma s SER 16 CO 0.26 -1.31 1.25 -2.65 0.98 0.00 0.00 173.24 171.78 1pma n PRO 17 N -2.88 0.06 -0.40 4.02 -0.02 -1.26 -0.06 135.00 134.46 1pma n PRO 17 Ca 0.06 0.54 0.08 0.00 -2.02 0.00 0.00 63.50 62.16 1pma n PRO 17 Cb 0.58 -1.75 0.26 0.00 -0.02 0.00 0.00 33.50 32.56 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 -1.82 3.84 -1.89 2.55 5.75 -1.26 -4.98 116.55 118.75 1pma n ASP 18 Ca -0.01 -2.40 -0.08 0.00 -0.01 0.00 0.00 54.79 52.30 1pma n ASP 18 Cb 0.07 -0.44 0.03 0.00 -1.03 0.00 0.00 41.12 39.75 1pma n ASP 18 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1pma n GLY 19 N 0.54 0.21 3.18 6.12 0.00 0.92 -5.07 105.19 111.09 1pma n GLY 19 Ca 0.19 -0.27 -0.17 0.00 0.00 0.00 0.00 46.02 45.78 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 -4.94 0.85 -0.82 1.61 0.52 -1.25 -4.84 118.95 110.06 1pma s ARG 20 Ca 0.10 -1.06 -0.15 0.00 -0.52 0.00 0.00 55.73 54.10 1pma s ARG 20 Cb -0.04 -0.72 0.21 0.00 0.52 0.00 0.00 34.95 34.92 1pma s ARG 20 CO 0.29 0.14 0.79 -0.51 0.02 0.00 0.00 175.30 176.04 1pma s LEU 21 N -2.08 6.57 0.38 2.53 2.01 -1.26 -0.71 118.68 126.12 1pma s LEU 21 Ca 0.02 -2.58 0.15 0.00 0.01 0.00 0.00 54.13 51.72 1pma s LEU 21 Cb -0.07 -2.23 1.01 0.00 0.01 0.00 0.00 46.19 44.91 1pma s LEU 21 CO 0.02 -0.64 1.79 -0.26 1.01 0.00 0.00 176.35 178.27 1pma h PHE 22 N 7.94 0.75 -0.63 0.29 0.04 -1.97 -0.58 116.94 122.77 1pma h PHE 22 Ca 0.09 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.87 1pma h PHE 22 Cb 1.04 -0.22 -0.03 0.00 2.20 0.00 0.00 35.95 38.94 1pma h PHE 22 CO 1.04 0.12 0.31 1.96 -0.60 0.00 0.00 178.31 181.13 1pma h GLN 23 N 0.49 0.90 -0.16 1.51 1.08 -1.92 -0.10 115.11 116.90 1pma h GLN 23 Ca 0.57 -0.13 -0.11 0.00 -1.45 0.00 0.00 58.65 57.54 1pma h GLN 23 Cb 1.29 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 28.54 1pma h GLN 23 CO -0.30 0.71 -0.36 -0.24 -0.95 0.00 0.00 178.83 177.68 1pma h VAL 24 N 0.86 1.29 0.39 -0.54 3.04 -1.54 -0.97 116.25 118.79 1pma h VAL 24 Ca 0.22 -1.44 -0.02 0.00 -1.01 0.00 0.00 66.70 64.44 1pma h VAL 24 Cb 0.10 1.57 0.00 0.00 -2.01 0.00 0.00 31.29 30.96 1pma h VAL 24 CO -0.03 0.44 -0.19 -0.33 -1.01 0.00 0.00 177.57 176.45 1pma h GLU 25 N 0.29 -0.51 -0.98 4.17 4.39 -0.72 -1.40 114.58 119.83 1pma h GLU 25 Ca 0.03 0.03 0.13 0.00 0.34 0.00 0.00 59.36 59.90 1pma h GLU 25 Cb 0.78 0.12 -0.08 0.00 -0.10 0.00 0.00 28.75 29.46 1pma h GLU 25 CO 0.06 -0.30 0.62 1.88 -1.16 0.00 0.00 179.01 180.11 1pma h TYR 26 N -0.59 1.07 -0.07 4.33 -1.99 -0.82 0.70 116.97 119.60 1pma h TYR 26 Ca -0.05 0.03 0.02 0.00 2.00 0.00 0.00 58.73 60.73 1pma h TYR 26 Cb 0.44 -0.34 -0.03 0.00 2.00 0.00 0.00 36.73 38.81 1pma h TYR 26 CO -0.03 0.40 -0.07 0.00 -0.00 0.00 0.00 178.16 178.45 1pma h ALA 27 N 1.56 -0.02 -0.93 3.88 0.00 -0.70 -1.82 119.26 121.24 1pma h ALA 27 Ca 0.50 0.03 0.21 0.00 0.00 0.00 0.00 54.91 55.65 1pma h ALA 27 Cb 0.59 0.15 -0.12 0.00 0.00 0.00 0.00 17.79 18.41 1pma h ALA 27 CO -0.27 -0.54 0.49 0.00 0.00 0.00 0.00 179.25 178.93 1pma h ARG 28 N -0.09 0.53 -0.65 0.00 3.08 0.23 0.21 114.38 117.68 1pma h ARG 28 Ca 0.05 -0.03 0.12 0.00 0.07 0.00 0.00 59.98 60.19 1pma h ARG 28 Cb 0.17 -0.12 -0.08 0.00 0.08 0.00 0.00 29.97 30.02 1pma h ARG 28 CO -0.13 0.35 0.22 0.93 -1.07 0.00 0.00 179.97 180.27 1pma h GLU 29 N 0.55 0.36 0.00 0.04 4.39 -0.87 -0.52 114.58 118.53 1pma h GLU 29 Ca 0.57 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 60.24 1pma h GLU 29 Cb 1.00 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 29.57 1pma h GLU 29 CO -0.46 0.24 -0.05 0.00 -1.16 0.00 0.00 179.01 177.57 1pma h ALA 30 N 1.48 1.84 0.01 3.43 0.00 -0.43 -2.21 119.26 123.39 1pma h ALA 30 Ca 0.34 -0.05 -0.21 0.00 0.00 0.00 0.00 54.91 54.99 1pma h ALA 30 Cb 0.49 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1pma h ALA 30 CO -0.37 0.07 -1.00 -0.39 0.00 0.00 0.00 179.25 177.56 1pma h VAL 31 N 0.00 1.67 0.00 0.00 -1.51 -0.98 -3.14 116.25 112.29 1pma h VAL 31 Ca -0.00 -3.28 -0.03 0.00 -1.23 0.00 0.00 66.70 62.16 1pma h VAL 31 Cb 0.10 2.80 -0.00 0.00 -2.13 0.00 0.00 31.29 32.06 1pma h VAL 31 CO 0.01 0.94 -0.12 0.11 -1.23 0.00 0.00 177.57 177.27 1pma h LYS 32 N 0.01 0.00 -0.44 5.19 1.57 -0.87 -0.83 116.57 121.21 1pma h LYS 32 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1pma h LYS 32 Cb 1.74 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.05 1pma h LYS 32 CO 0.13 0.12 0.00 1.63 -0.57 0.00 0.00 179.45 180.77 1pma n LYS 33 N -4.15 1.56 -3.09 3.15 5.02 -1.11 -3.55 118.16 115.99 1pma n LYS 33 Ca -0.02 -0.63 -0.20 0.00 -2.02 0.00 0.00 58.31 55.44 1pma n LYS 33 Cb 0.20 -1.33 0.05 0.00 -0.02 0.00 0.00 35.03 33.94 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 -0.70 1.79 0.82 0.72 0.00 -0.32 -4.95 107.32 104.69 1pma s GLY 34 Ca 0.11 -2.05 -0.11 0.00 0.00 0.00 0.00 44.72 42.68 1pma s GLY 34 CO 0.06 -1.69 1.12 -0.45 0.00 0.00 0.00 173.10 172.14 1pma s SER 35 N -4.61 3.91 -0.02 1.64 0.15 -1.26 -1.39 113.70 112.11 1pma s SER 35 Ca 0.59 1.99 -0.10 0.00 0.70 0.00 0.00 55.95 59.13 1pma s SER 35 Cb -0.06 -2.54 -0.05 0.00 -1.71 0.00 0.00 66.02 61.66 1pma s SER 35 CO 0.37 -2.44 0.30 0.28 1.20 0.00 0.00 173.24 172.95 1pma s THR 36 N -2.75 5.23 0.18 6.45 -1.32 -1.26 -3.06 115.64 119.10 1pma s THR 36 Ca 0.64 0.47 -0.20 0.00 -1.21 0.00 0.00 61.69 61.38 1pma s THR 36 Cb -0.20 -3.59 0.05 0.00 -1.51 0.00 0.00 72.50 67.25 1pma s THR 36 CO 0.56 0.50 0.57 0.00 -2.21 0.00 0.00 174.62 174.04 1pma s ALA 37 N -1.16 -1.27 0.37 11.08 0.00 0.24 -1.38 121.76 129.65 1pma s ALA 37 Ca 0.23 0.10 -0.14 0.00 0.00 0.00 0.00 51.96 52.15 1pma s ALA 37 Cb -0.14 0.85 0.05 0.00 0.00 0.00 0.00 23.12 23.87 1pma s ALA 37 CO 0.12 -0.80 0.74 -0.48 0.00 0.00 0.00 175.76 175.34 1pma s LEU 38 N -2.82 0.12 -0.00 0.00 2.34 0.19 -0.14 118.68 118.38 1pma s LEU 38 Ca 0.05 -1.15 -0.28 0.00 0.06 0.00 0.00 54.13 52.80 1pma s LEU 38 Cb -0.01 2.65 0.10 0.00 -0.56 0.00 0.00 46.19 48.37 1pma s LEU 38 CO -0.07 -1.61 0.87 -0.83 -1.06 0.00 0.00 176.35 173.65 1pma s GLY 39 N -3.08 -0.47 -0.03 -3.48 0.00 -0.24 -0.51 107.32 99.51 1pma s GLY 39 Ca 0.17 1.03 -0.30 0.00 0.00 0.00 0.00 44.72 45.62 1pma s GLY 39 CO 0.12 0.36 0.66 -3.16 0.00 0.00 0.00 173.10 171.09 1pma s MET 40 N -3.05 1.07 0.35 2.90 0.23 -1.02 -1.09 119.30 118.70 1pma s MET 40 Ca 0.04 0.17 -0.23 0.00 -1.03 0.00 0.00 55.69 54.64 1pma s MET 40 Cb -0.01 0.50 -0.10 0.00 -1.53 0.00 0.00 34.83 33.69 1pma s MET 40 CO -0.09 -0.35 0.92 0.15 -2.03 0.00 0.00 175.02 173.62 1pma s LYS 41 N -1.47 4.40 0.00 3.16 1.02 0.26 -2.03 119.74 125.08 1pma s LYS 41 Ca -0.10 1.19 0.00 0.00 0.02 0.00 0.00 55.97 57.08 1pma s LYS 41 Cb -0.00 -2.56 0.00 0.00 -0.52 0.00 0.00 37.83 34.74 1pma s LYS 41 CO 0.07 0.17 0.00 1.97 -0.92 0.00 0.00 175.35 176.65 1pma n PHE 42 N 0.10 0.00 0.00 3.18 1.16 -0.75 -4.84 117.46 116.31 1pma n PHE 42 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.62 1pma n PHE 42 Cb 0.52 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.39 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 -2.69 1.98 0.00 0.94 -3.88 120.51 113.86 1pma n ALA 43 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1pma n ALA 43 Cb 0.00 0.10 0.04 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 -1.15 1.03 0.00 0.00 4.05 -1.26 -4.99 115.26 112.94 1pma n ASN 44 Ca 0.00 -2.03 0.00 0.00 0.45 0.00 0.00 54.58 53.00 1pma n ASN 44 Cb 0.00 -0.29 0.00 0.00 1.23 0.00 0.00 39.78 40.72 1pma n ASN 44 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1pma n GLY 45 N -0.35 2.53 3.42 8.20 0.00 -1.25 0.14 105.19 117.88 1pma n GLY 45 Ca 0.03 -0.61 -0.15 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.17 0.02 0.18 1.61 0.11 -0.10 -1.81 120.40 118.24 1pma s VAL 46 Ca 0.00 -0.13 0.08 0.00 -2.93 0.00 0.00 61.98 59.00 1pma s VAL 46 Cb 0.00 -0.82 -0.04 0.00 -1.53 0.00 0.00 36.38 33.99 1pma s VAL 46 CO 0.00 -0.07 -0.17 -1.48 -3.33 0.00 0.00 175.10 170.05 1pma s LEU 47 N -0.73 2.48 -0.02 2.54 2.34 -0.86 -1.58 118.68 122.84 1pma s LEU 47 Ca -0.08 -0.91 0.06 0.00 0.06 0.00 0.00 54.13 53.26 1pma s LEU 47 Cb -0.03 -0.76 -0.01 0.00 -0.56 0.00 0.00 46.19 44.83 1pma s LEU 47 CO 0.05 -0.08 -0.19 -0.22 -1.06 0.00 0.00 176.35 174.85 1pma s LEU 48 N -2.87 2.02 -0.11 1.48 2.96 0.18 -2.42 118.68 119.91 1pma s LEU 48 Ca 0.18 -0.35 -0.05 0.00 -0.22 0.00 0.00 54.13 53.68 1pma s LEU 48 Cb -0.04 -1.00 0.05 0.00 0.50 0.00 0.00 46.19 45.70 1pma s LEU 48 CO 0.07 0.22 0.26 -0.51 -1.32 0.00 0.00 176.35 175.07 1pma s ILE 49 N -0.35 -0.08 0.03 6.68 1.10 0.34 -0.79 121.20 128.12 1pma s ILE 49 Ca 0.05 0.16 0.04 0.00 -0.51 0.00 0.00 60.65 60.39 1pma s ILE 49 Cb -0.08 -0.40 -0.02 0.00 0.15 0.00 0.00 42.46 42.11 1pma s ILE 49 CO -0.00 0.07 -0.12 -0.55 -2.11 0.00 0.00 174.94 172.23 1pma s SER 50 N 1.40 1.39 -0.44 4.50 0.15 0.03 0.57 113.70 121.31 1pma s SER 50 Ca -0.08 -0.42 -0.28 0.00 0.70 0.00 0.00 55.95 55.87 1pma s SER 50 Cb -0.10 -0.08 0.03 0.00 -1.71 0.00 0.00 66.02 64.15 1pma s SER 50 CO -0.09 0.01 1.09 -0.62 1.20 0.00 0.00 173.24 174.83 1pma s ASP 51 N -1.04 6.67 -0.99 5.45 2.15 -0.48 -0.43 116.67 128.01 1pma s ASP 51 Ca -0.00 0.54 -0.17 0.00 0.43 0.00 0.00 52.55 53.34 1pma s ASP 51 Cb -0.07 -2.53 0.15 0.00 -0.30 0.00 0.00 42.92 40.16 1pma s ASP 51 CO 0.01 -1.15 1.17 -0.75 -0.17 0.00 0.00 175.17 174.28 1pma s LYS 52 N 4.20 3.72 -0.31 4.34 2.20 -1.17 -4.69 119.74 128.04 1pma s LYS 52 Ca 0.46 -2.02 -0.21 0.00 -0.36 0.00 0.00 55.97 53.84 1pma s LYS 52 Cb -0.09 -4.91 -0.01 0.00 -1.51 0.00 0.00 37.83 31.32 1pma s LYS 52 CO 0.28 -1.73 0.65 0.15 -0.36 0.00 0.00 175.35 174.34 1pma s LYS 53 N 2.18 3.91 0.20 4.03 1.02 -1.26 -3.95 119.74 125.86 1pma s LYS 53 Ca 0.34 0.34 0.07 0.00 0.02 0.00 0.00 55.97 56.74 1pma s LYS 53 Cb -0.05 -3.73 -0.04 0.00 -0.52 0.00 0.00 37.83 33.49 1pma s LYS 53 CO -0.07 -0.59 0.07 0.54 -0.92 0.00 0.00 175.35 174.38 1pma s VAL 54 N 2.66 4.01 0.00 3.17 0.11 -1.26 -5.10 120.40 123.98 1pma s VAL 54 Ca 0.26 -1.40 0.00 0.00 -2.93 0.00 0.00 61.98 57.91 1pma s VAL 54 Cb -0.15 -3.07 0.00 0.00 -1.53 0.00 0.00 36.38 31.63 1pma s VAL 54 CO 0.12 -0.19 0.00 -1.14 -3.33 0.00 0.00 175.10 170.56 1pma n ARG 55 N -0.48 0.00 -1.63 1.54 3.00 -1.26 -5.09 116.66 112.74 1pma n ARG 55 Ca -0.09 0.00 -0.33 0.00 -0.00 0.00 0.00 57.85 57.44 1pma n ARG 55 Cb 0.56 0.00 0.06 0.00 0.00 0.00 0.00 32.46 33.08 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 0.08 4.91 0.42 6.15 0.15 -1.26 -4.93 113.70 119.22 1pma s SER 56 Ca 0.00 2.00 0.23 0.00 0.70 0.00 0.00 55.95 58.88 1pma s SER 56 Cb 0.00 -2.55 0.69 0.00 -1.71 0.00 0.00 66.02 62.45 1pma s SER 56 CO 0.00 -1.77 1.73 0.03 1.20 0.00 0.00 173.24 174.43 1pma h ARG 57 N -0.22 0.00 0.00 5.44 3.08 -2.07 -3.17 114.38 117.44 1pma h ARG 57 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 1pma h ARG 57 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 1pma h ARG 57 CO 0.53 0.23 0.00 1.28 -1.07 0.00 0.00 179.97 180.94 1pma n LEU 58 N -3.28 0.00 -4.83 3.04 4.32 -1.26 -4.80 117.00 110.20 1pma n LEU 58 Ca 0.01 0.33 -0.33 0.00 -0.02 0.00 0.00 56.01 56.00 1pma n LEU 58 Cb 0.50 -0.33 -0.06 0.00 -1.62 0.00 0.00 43.42 41.92 1pma n LEU 58 CO 0.34 -0.15 0.66 -0.63 -1.22 0.00 0.00 177.39 176.40 1pma s ILE 59 N -2.65 4.40 -0.47 -0.08 -1.09 -1.20 -4.94 121.20 115.17 1pma s ILE 59 Ca 0.14 1.39 -0.06 0.00 -2.23 0.00 0.00 60.65 59.89 1pma s ILE 59 Cb 0.11 -3.63 -0.11 0.00 -1.58 0.00 0.00 42.46 37.26 1pma s ILE 59 CO 0.26 -0.43 3.16 -0.62 -1.23 0.00 0.00 174.94 176.08 1pma n GLU 60 N -0.95 2.59 0.00 2.79 -0.58 -1.26 -4.97 120.64 118.25 1pma n GLU 60 Ca 0.07 -1.81 0.00 0.00 -0.42 0.00 0.00 57.16 55.00 1pma n GLU 60 Cb 0.54 -2.21 0.00 0.00 -0.57 0.00 0.00 31.44 29.20 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 2.05 0.00 -0.37 3.49 -0.00 -1.26 -1.53 117.38 119.76 1pma n GLN 61 Ca 0.51 0.00 0.31 0.00 -0.00 0.00 0.00 57.00 57.82 1pma n GLN 61 Cb 0.65 0.00 0.51 0.00 -0.00 0.00 0.00 30.24 31.40 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 1.00 0.13 0.04 2.61 2.85 -1.26 -1.37 115.26 119.26 1pma n ASN 62 Ca 0.00 0.98 0.22 0.00 -0.11 0.00 0.00 54.58 55.67 1pma n ASN 62 Cb 0.00 -0.48 0.66 0.00 1.24 0.00 0.00 39.78 41.20 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 -1.08 1.20 0.02 -1.70 -2.39 113.55 109.60 1pma h SER 63 Ca 0.65 0.00 -0.64 0.00 -0.84 0.00 0.00 61.79 60.96 1pma h SER 63 Cb 2.17 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 64.57 1pma h SER 63 CO -0.30 0.00 1.60 0.00 -1.14 0.00 0.00 176.83 176.99 1pma n ILE 64 N -3.51 4.46 -2.15 3.27 3.06 -0.47 -4.97 119.36 119.05 1pma n ILE 64 Ca 0.11 -3.74 -0.42 0.00 -2.50 0.00 0.00 62.75 56.19 1pma n ILE 64 Cb 0.84 -1.89 -0.03 0.00 0.54 0.00 0.00 39.64 39.10 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 -1.29 4.26 -0.19 9.51 0.41 -0.90 -4.90 118.70 125.61 1pma s GLU 65 Ca 0.56 2.06 0.11 0.00 -0.41 0.00 0.00 54.97 57.30 1pma s GLU 65 Cb 0.26 -3.55 -0.23 0.00 -1.78 0.00 0.00 34.13 28.83 1pma s GLU 65 CO -0.14 -0.60 0.09 1.63 -0.49 0.00 0.00 175.26 175.75 1pma n LYS 66 N 5.32 0.68 -2.98 1.61 5.02 -1.26 -4.81 118.16 121.73 1pma n LYS 66 Ca 0.14 0.09 -0.41 0.00 -2.02 0.00 0.00 58.31 56.11 1pma n LYS 66 Cb 0.43 -1.57 -0.05 0.00 -0.02 0.00 0.00 35.03 33.82 1pma n LYS 66 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1pma s ILE 67 N -2.52 4.94 0.02 -0.18 1.01 -1.26 -4.05 121.20 119.16 1pma s ILE 67 Ca -0.17 1.46 0.07 0.00 0.00 0.00 0.00 60.65 62.01 1pma s ILE 67 Cb 0.07 -4.06 -0.02 0.00 0.01 0.00 0.00 42.46 38.46 1pma s ILE 67 CO 0.76 0.07 -0.21 -1.10 0.00 0.00 0.00 174.94 174.46 1pma s GLN 68 N 2.02 1.51 0.05 2.79 -0.21 -0.12 -4.99 119.66 120.70 1pma s GLN 68 Ca 0.35 -0.86 -0.19 0.00 0.02 0.00 0.00 55.36 54.68 1pma s GLN 68 Cb -0.16 -1.56 -0.06 0.00 1.00 0.00 0.00 33.01 32.23 1pma s GLN 68 CO 0.12 0.41 0.54 -0.51 -2.12 0.00 0.00 175.29 173.73 1pma s LEU 69 N -0.90 4.51 -0.09 2.90 1.43 -1.26 -0.27 118.68 125.00 1pma s LEU 69 Ca 0.08 1.20 0.15 0.00 -1.03 0.00 0.00 54.13 54.53 1pma s LEU 69 Cb -0.08 -2.84 -0.22 0.00 0.03 0.00 0.00 46.19 43.07 1pma s LEU 69 CO 0.01 0.27 0.20 -0.38 0.23 0.00 0.00 176.35 176.68 1pma n ILE 70 N 1.84 0.55 -3.63 -0.59 5.41 0.45 -4.94 119.36 118.45 1pma n ILE 70 Ca -0.11 -0.52 -0.03 0.00 1.00 0.00 0.00 62.75 63.09 1pma n ILE 70 Cb 0.51 -0.25 -0.03 0.00 -0.71 0.00 0.00 39.64 39.17 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 -4.43 -0.07 0.45 4.38 2.15 -0.94 -4.77 116.67 113.44 1pma s ASP 71 Ca -0.07 0.02 0.09 0.00 0.43 0.00 0.00 52.55 53.02 1pma s ASP 71 Cb 0.07 0.07 0.49 0.00 -0.30 0.00 0.00 42.92 43.25 1pma s ASP 71 CO 0.66 -0.10 1.16 0.44 -0.17 0.00 0.00 175.17 177.16 1pma h ASP 72 N 2.03 0.00 0.00 -0.34 3.32 -2.00 -0.10 116.42 119.33 1pma h ASP 72 Ca -0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1pma h ASP 72 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 1pma h ASP 72 CO 0.21 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.51 1pma n TYR 73 N -2.18 0.00 -3.69 4.55 4.02 -1.26 -1.83 117.16 116.78 1pma n TYR 73 Ca -0.01 -0.19 -0.12 0.00 -0.01 0.00 0.00 57.90 57.58 1pma n TYR 73 Cb 0.61 -0.02 -0.12 0.00 -0.02 0.00 0.00 39.34 39.79 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 -0.38 -0.26 0.27 -0.72 0.11 -0.05 -2.47 120.40 116.89 1pma s VAL 74 Ca 0.00 0.18 0.06 0.00 -2.93 0.00 0.00 61.98 59.30 1pma s VAL 74 Cb 0.00 -0.50 -0.06 0.00 -1.53 0.00 0.00 36.38 34.30 1pma s VAL 74 CO 0.00 0.08 -0.06 0.00 -3.33 0.00 0.00 175.10 171.79 1pma s ALA 75 N 1.90 2.25 0.05 1.54 0.00 -0.56 -0.41 121.76 126.52 1pma s ALA 75 Ca -0.05 -1.86 -0.06 0.00 0.00 0.00 0.00 51.96 49.99 1pma s ALA 75 Cb -0.11 0.19 -0.01 0.00 0.00 0.00 0.00 23.12 23.19 1pma s ALA 75 CO -0.10 -0.08 0.10 0.00 0.00 0.00 0.00 175.76 175.68 1pma s ALA 76 N -3.05 -0.04 0.04 0.00 0.00 0.63 -0.91 121.76 118.43 1pma s ALA 76 Ca 0.29 -0.63 0.04 0.00 0.00 0.00 0.00 51.96 51.66 1pma s ALA 76 Cb 0.03 0.30 -0.02 0.00 0.00 0.00 0.00 23.12 23.43 1pma s ALA 76 CO 0.11 -0.36 -0.12 0.54 0.00 0.00 0.00 175.76 175.93 1pma s VAL 77 N -2.99 0.94 0.26 0.00 0.11 -0.51 -0.95 120.40 117.25 1pma s VAL 77 Ca -0.02 -0.97 0.04 0.00 -2.93 0.00 0.00 61.98 58.10 1pma s VAL 77 Cb 0.01 -0.88 -0.05 0.00 -1.53 0.00 0.00 36.38 33.93 1pma s VAL 77 CO -0.06 -0.08 0.00 0.28 -3.33 0.00 0.00 175.10 171.91 1pma s THR 78 N -0.92 1.14 -0.19 5.04 -1.32 -1.26 -1.13 115.64 117.00 1pma s THR 78 Ca -0.01 -2.04 -0.14 0.00 -1.21 0.00 0.00 61.69 58.29 1pma s THR 78 Cb -0.08 -2.46 0.05 0.00 -1.51 0.00 0.00 72.50 68.51 1pma s THR 78 CO 0.01 -0.25 0.48 -0.55 -2.21 0.00 0.00 174.62 172.10 1pma s SER 79 N -3.36 -0.55 0.00 8.08 0.15 0.15 -4.90 113.70 113.27 1pma s SER 79 Ca 0.30 1.00 0.00 0.00 0.70 0.00 0.00 55.95 57.95 1pma s SER 79 Cb 0.06 0.96 0.00 0.00 -1.71 0.00 0.00 66.02 65.33 1pma s SER 79 CO 0.11 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 174.97 1pma n GLY 80 N 3.41 0.30 3.63 9.45 0.00 -1.26 -1.28 105.19 119.44 1pma n GLY 80 Ca -0.17 -1.47 -0.43 0.00 0.00 0.00 0.00 46.02 43.95 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 3.96 0.14 0.99 2.01 0.92 -4.82 118.68 121.88 1pma s LEU 81 Ca 0.00 1.69 -0.23 0.00 0.01 0.00 0.00 54.13 55.61 1pma s LEU 81 Cb 0.00 -3.53 0.00 0.00 0.01 0.00 0.00 46.19 42.67 1pma s LEU 81 CO 0.00 -1.20 1.64 1.62 1.01 0.00 0.00 176.35 179.43 1pma h VAL 82 N 6.05 0.46 -0.15 -1.59 3.04 -1.96 -0.19 116.25 121.91 1pma h VAL 82 Ca -0.34 0.00 0.04 0.00 -1.01 0.00 0.00 66.70 65.39 1pma h VAL 82 Cb 1.15 0.46 -0.05 0.00 -2.01 0.00 0.00 31.29 30.85 1pma h VAL 82 CO 0.99 0.00 -0.14 0.00 -1.01 0.00 0.00 177.57 177.42 1pma h ALA 83 N 0.78 -0.03 -0.33 3.17 0.00 -1.98 0.44 119.26 121.32 1pma h ALA 83 Ca 0.11 0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.14 1pma h ALA 83 Cb 0.42 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 1pma h ALA 83 CO -0.32 -0.58 0.03 -0.44 0.00 0.00 0.00 179.25 177.94 1pma h ASP 84 N -0.16 -0.07 -0.06 0.00 5.19 -1.86 -2.44 116.42 117.03 1pma h ASP 84 Ca 0.10 0.07 0.04 0.00 -0.62 0.00 0.00 57.03 56.61 1pma h ASP 84 Cb 0.30 0.11 -0.06 0.00 0.18 0.00 0.00 39.33 39.86 1pma h ASP 84 CO -0.25 0.00 -0.38 0.00 -3.12 0.00 0.00 179.24 175.49 1pma h ALA 85 N 1.26 -0.55 0.14 3.45 0.00 0.44 -1.25 119.26 122.75 1pma h ALA 85 Ca 0.16 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1pma h ALA 85 Cb 0.20 0.69 -0.05 0.00 0.00 0.00 0.00 17.79 18.63 1pma h ALA 85 CO -0.24 -0.89 -0.52 -0.09 0.00 0.00 0.00 179.25 177.51 1pma h ARG 86 N -0.50 -0.73 -0.88 0.00 2.43 -0.65 -1.05 114.38 112.99 1pma h ARG 86 Ca 0.07 0.05 0.15 0.00 -0.81 0.00 0.00 59.98 59.44 1pma h ARG 86 Cb 0.61 0.17 -0.10 0.00 -0.42 0.00 0.00 29.97 30.23 1pma h ARG 86 CO -0.33 -0.49 0.48 -0.24 -1.51 0.00 0.00 179.97 177.87 1pma h VAL 87 N -0.76 0.74 -0.53 0.20 3.04 -1.27 0.23 116.25 117.89 1pma h VAL 87 Ca -0.00 -0.23 -0.04 0.00 -1.01 0.00 0.00 66.70 65.42 1pma h VAL 87 Cb 0.76 0.01 -0.03 0.00 -2.01 0.00 0.00 31.29 30.03 1pma h VAL 87 CO -0.28 0.12 0.19 0.25 -1.01 0.00 0.00 177.57 176.84 1pma h LEU 88 N 0.67 0.72 0.27 3.16 5.85 -0.55 -2.16 115.31 123.27 1pma h LEU 88 Ca 0.48 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 59.09 1pma h LEU 88 Cb 0.68 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.53 1pma h LEU 88 CO -0.36 0.67 -0.13 0.58 -0.34 0.00 0.00 178.44 178.86 1pma h VAL 89 N 0.77 0.78 -0.91 1.05 2.07 0.30 -2.33 116.25 117.98 1pma h VAL 89 Ca 0.18 -0.49 0.17 0.00 0.82 0.00 0.00 66.70 67.38 1pma h VAL 89 Cb 0.20 1.05 -0.07 0.00 -1.52 0.00 0.00 31.29 30.94 1pma h VAL 89 CO -0.01 0.10 0.59 0.44 0.02 0.00 0.00 177.57 178.71 1pma h ASP 90 N -0.62 0.58 0.24 0.57 3.32 -1.15 0.39 116.42 119.76 1pma h ASP 90 Ca -0.04 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1pma h ASP 90 Cb 0.44 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 1pma h ASP 90 CO 0.06 0.26 -0.25 0.15 -1.72 0.00 0.00 179.24 177.74 1pma h PHE 91 N 0.60 -0.67 -0.73 4.55 3.57 -1.21 -0.41 116.94 122.64 1pma h PHE 91 Ca 0.48 0.00 0.13 0.00 3.53 0.00 0.00 57.97 62.11 1pma h PHE 91 Cb 0.91 0.26 -0.09 0.00 2.79 0.00 0.00 35.95 39.83 1pma h PHE 91 CO -0.00 -0.37 0.29 0.00 -2.23 0.00 0.00 178.31 176.00 1pma h ALA 92 N 0.13 1.01 0.38 2.41 0.00 0.19 0.20 119.26 123.58 1pma h ALA 92 Ca -0.00 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1pma h ALA 92 Cb 0.50 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1pma h ALA 92 CO -0.06 -0.19 -0.36 0.00 0.00 0.00 0.00 179.25 178.64 1pma h ARG 93 N 0.45 -0.73 -0.40 0.00 3.08 0.28 0.37 114.38 117.44 1pma h ARG 93 Ca 0.39 0.05 -0.09 0.00 0.07 0.00 0.00 59.98 60.40 1pma h ARG 93 Cb 0.56 0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.76 1pma h ARG 93 CO -0.38 -0.49 -0.12 -0.84 -1.07 0.00 0.00 179.97 177.07 1pma h ILE 94 N -0.76 1.25 -0.87 2.04 3.07 -0.71 -1.77 117.51 119.77 1pma h ILE 94 Ca -0.03 -1.16 0.04 0.00 1.55 0.00 0.00 64.86 65.26 1pma h ILE 94 Cb 0.67 1.08 -0.05 0.00 -0.27 0.00 0.00 36.82 38.26 1pma h ILE 94 CO -0.05 0.39 0.57 -1.28 -1.05 0.00 0.00 178.15 176.73 1pma h SER 95 N 0.65 0.92 0.34 2.16 0.87 -0.08 0.89 113.55 119.30 1pma h SER 95 Ca 0.11 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.64 1pma h SER 95 Cb 0.59 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 1pma h SER 95 CO 0.04 0.63 -0.16 0.00 -0.53 0.00 0.00 176.83 176.80 1pma h ALA 96 N 1.50 -0.46 -0.68 6.23 0.00 0.53 -2.80 119.26 123.58 1pma h ALA 96 Ca 0.35 -0.13 0.14 0.00 0.00 0.00 0.00 54.91 55.26 1pma h ALA 96 Cb 0.05 0.18 -0.10 0.00 0.00 0.00 0.00 17.79 17.92 1pma h ALA 96 CO -0.11 -0.71 0.15 1.96 0.00 0.00 0.00 179.25 180.55 1pma h GLN 97 N -0.56 0.26 -0.49 0.00 1.08 -0.44 -1.29 115.11 113.66 1pma h GLN 97 Ca -0.05 -0.02 0.10 0.00 -1.45 0.00 0.00 58.65 57.23 1pma h GLN 97 Cb 0.42 -0.06 -0.10 0.00 -0.05 0.00 0.00 27.48 27.69 1pma h GLN 97 CO 0.08 0.17 -0.27 1.96 -0.95 0.00 0.00 178.83 179.82 1pma h GLN 98 N 0.26 -0.15 -0.86 1.46 4.20 -0.62 0.25 115.11 119.64 1pma h GLN 98 Ca 0.37 0.01 -0.00 0.00 0.06 0.00 0.00 58.65 59.09 1pma h GLN 98 Cb 0.60 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.37 1pma h GLN 98 CO -0.47 -0.10 0.52 1.49 -0.67 0.00 0.00 178.83 179.60 1pma h GLU 99 N -0.16 1.17 -0.05 1.46 4.81 -1.04 -2.22 114.58 118.56 1pma h GLU 99 Ca 0.22 -0.11 -0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1pma h GLU 99 Cb 0.51 -0.25 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 1pma h GLU 99 CO -0.58 0.82 0.03 0.87 -0.73 0.00 0.00 179.01 179.42 1pma h LYS 100 N 1.19 0.06 0.00 1.92 1.57 -0.44 -0.92 116.57 119.95 1pma h LYS 100 Ca 0.31 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 59.06 1pma h LYS 100 Cb -0.05 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.24 1pma h LYS 100 CO -0.06 0.10 -0.11 -0.24 -0.57 0.00 0.00 179.45 178.58 1pma h VAL 101 N 0.01 0.90 0.05 0.50 3.04 -0.21 0.77 116.25 121.30 1pma h VAL 101 Ca 0.02 -0.39 -0.34 0.00 -1.01 0.00 0.00 66.70 64.98 1pma h VAL 101 Cb 0.05 1.22 -0.04 0.00 -2.01 0.00 0.00 31.29 30.52 1pma h VAL 101 CO -0.00 0.10 -1.89 1.07 -1.01 0.00 0.00 177.57 175.84 1pma n THR 102 N -4.15 1.63 0.56 3.17 5.66 -0.87 -4.44 114.28 115.83 1pma n THR 102 Ca -0.03 -0.40 0.11 0.00 -3.05 0.00 0.00 64.05 60.69 1pma n THR 102 Cb 0.19 -1.82 0.06 0.00 -1.55 0.00 0.00 70.33 67.21 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 -3.88 0.34 -0.35 1.09 4.01 -0.37 -4.98 117.16 113.03 1pma n TYR 103 Ca -0.37 0.10 0.00 0.00 -0.16 0.00 0.00 57.90 57.47 1pma n TYR 103 Cb 0.90 -0.49 0.00 0.00 -0.31 0.00 0.00 39.34 39.43 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 1.36 1.18 3.64 2.72 0.00 0.27 -5.00 105.19 109.35 1pma n GLY 104 Ca 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.99 1pma n GLY 104 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1pma s SER 105 N -3.07 -0.17 -0.96 1.61 0.15 -1.22 -4.94 113.70 105.11 1pma s SER 105 Ca 0.00 0.29 -0.22 0.00 0.70 0.00 0.00 55.95 56.73 1pma s SER 105 Cb 0.00 0.29 0.08 0.00 -1.71 0.00 0.00 66.02 64.68 1pma s SER 105 CO 0.00 -0.08 1.31 -0.22 1.20 0.00 0.00 173.24 175.45 1pma s LEU 106 N -0.17 4.09 -0.01 3.45 2.96 -1.26 -4.65 118.68 123.08 1pma s LEU 106 Ca 0.06 -1.61 -0.24 0.00 -0.22 0.00 0.00 54.13 52.11 1pma s LEU 106 Cb -0.04 -2.50 -0.18 0.00 0.50 0.00 0.00 46.19 43.97 1pma s LEU 106 CO -0.11 -1.36 1.18 1.62 -1.32 0.00 0.00 176.35 176.37 1pma h VAL 107 N 6.39 1.01 -3.63 1.68 3.04 -1.98 -3.42 116.25 119.34 1pma h VAL 107 Ca 0.15 -0.91 -0.67 0.00 -1.01 0.00 0.00 66.70 64.26 1pma h VAL 107 Cb 1.02 1.55 -0.36 0.00 -2.01 0.00 0.00 31.29 31.49 1pma h VAL 107 CO 1.30 0.21 -0.82 0.21 -1.01 0.00 0.00 177.57 177.46 1pma s ASN 108 N -5.41 4.07 0.55 3.17 3.84 -1.26 -1.22 114.94 118.68 1pma s ASN 108 Ca -0.14 -1.18 0.31 0.00 0.21 0.00 0.00 52.86 52.06 1pma s ASN 108 Cb 0.02 -1.53 1.60 0.00 -0.55 0.00 0.00 41.25 40.79 1pma s ASN 108 CO 0.58 -0.13 2.11 -0.29 -2.79 0.00 0.00 177.10 176.58 1pma h ILE 109 N 6.52 0.40 -0.91 -5.21 2.10 -1.96 -1.66 117.51 116.80 1pma h ILE 109 Ca -0.27 -0.43 0.03 0.00 1.08 0.00 0.00 64.86 65.28 1pma h ILE 109 Cb 1.07 1.30 -0.05 0.00 -1.09 0.00 0.00 36.82 38.05 1pma h ILE 109 CO 0.51 0.08 0.59 -0.08 -1.08 0.00 0.00 178.15 178.17 1pma h GLU 110 N 0.00 1.11 -0.75 2.19 4.81 -2.00 -2.18 114.58 117.76 1pma h GLU 110 Ca -0.00 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 1pma h GLU 110 Cb 0.29 -0.25 -0.04 0.00 0.63 0.00 0.00 28.75 29.39 1pma h GLU 110 CO 0.01 0.73 0.40 -0.97 -0.73 0.00 0.00 179.01 178.45 1pma h ASN 111 N 1.14 0.95 -0.03 1.04 -0.73 -1.73 -0.98 115.58 115.23 1pma h ASN 111 Ca 0.36 -0.11 0.03 0.00 1.87 0.00 0.00 56.30 58.45 1pma h ASN 111 Cb -0.00 -0.24 -0.03 0.00 0.27 0.00 0.00 38.32 38.32 1pma h ASN 111 CO -0.12 0.78 -0.14 0.25 -0.37 0.00 0.00 177.43 177.83 1pma h LEU 112 N 1.04 -0.41 -0.78 0.34 5.85 -1.48 -1.58 115.31 118.28 1pma h LEU 112 Ca 0.26 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 59.04 1pma h LEU 112 Cb 0.06 0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 1pma h LEU 112 CO -0.04 -0.19 0.44 1.62 -0.34 0.00 0.00 178.44 179.93 1pma h VAL 113 N -0.22 1.23 -0.69 1.05 3.04 -1.14 -1.92 116.25 117.60 1pma h VAL 113 Ca 0.06 -0.55 0.11 0.00 -1.01 0.00 0.00 66.70 65.31 1pma h VAL 113 Cb 0.30 0.18 -0.08 0.00 -2.01 0.00 0.00 31.29 29.68 1pma h VAL 113 CO -0.16 0.25 0.29 0.11 -1.01 0.00 0.00 177.57 177.05 1pma h LYS 114 N 1.07 0.46 0.07 4.17 1.57 -0.57 -0.36 116.57 122.99 1pma h LYS 114 Ca 0.27 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 1pma h LYS 114 Cb 0.01 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 1pma h LYS 114 CO -0.05 0.31 -0.08 -0.09 -0.57 0.00 0.00 179.45 178.97 1pma h ARG 115 N 0.48 -0.16 -0.22 3.15 2.43 -0.51 0.23 114.38 119.78 1pma h ARG 115 Ca 0.36 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.52 1pma h ARG 115 Cb 0.46 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 1pma h ARG 115 CO -0.33 -0.11 0.03 -0.24 -1.51 0.00 0.00 179.97 177.82 1pma h VAL 116 N -0.17 1.12 -0.31 0.20 3.04 -1.09 -1.69 116.25 117.35 1pma h VAL 116 Ca 0.01 -0.45 -0.06 0.00 -1.01 0.00 0.00 66.70 65.18 1pma h VAL 116 Cb 0.17 0.92 -0.01 0.00 -2.01 0.00 0.00 31.29 30.36 1pma h VAL 116 CO -0.03 0.16 -0.04 0.00 -1.01 0.00 0.00 177.57 176.64 1pma h ALA 117 N 1.73 0.43 -0.53 3.17 0.00 -0.24 -2.44 119.26 121.38 1pma h ALA 117 Ca 0.08 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1pma h ALA 117 Cb 0.16 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1pma h ALA 117 CO -0.00 0.23 0.35 -0.44 0.00 0.00 0.00 179.25 179.39 1pma h ASP 118 N 0.37 0.60 -0.80 0.00 5.19 -0.32 0.11 116.42 121.56 1pma h ASP 118 Ca 0.08 -0.01 0.01 0.00 -0.62 0.00 0.00 57.03 56.49 1pma h ASP 118 Cb 0.51 -0.15 -0.04 0.00 0.18 0.00 0.00 39.33 39.83 1pma h ASP 118 CO 0.02 0.43 0.53 -0.61 -3.12 0.00 0.00 179.24 176.49 1pma h GLN 119 N 0.70 1.04 -0.20 3.56 -0.00 -0.87 -2.42 115.11 116.92 1pma h GLN 119 Ca 0.20 -0.06 -0.06 0.00 -0.00 0.00 0.00 58.65 58.73 1pma h GLN 119 Cb -0.06 -0.23 -0.01 0.00 0.00 0.00 0.00 27.48 27.18 1pma h GLN 119 CO -0.04 0.69 -0.10 0.52 0.00 0.00 0.00 178.83 179.90 1pma h MET 120 N 1.07 0.42 -0.54 1.69 2.86 -0.62 -3.20 114.93 116.62 1pma h MET 120 Ca 0.30 -0.18 0.10 0.00 -2.06 0.00 0.00 59.70 57.86 1pma h MET 120 Cb -0.10 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.52 1pma h MET 120 CO -0.07 0.71 0.37 0.37 1.06 0.00 0.00 176.91 179.34 1pma h GLN 121 N 0.12 0.28 -0.62 1.72 -0.00 -0.71 -1.94 115.11 113.96 1pma h GLN 121 Ca 0.04 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.65 58.66 1pma h GLN 121 Cb 0.58 -0.06 -0.03 0.00 0.00 0.00 0.00 27.48 27.97 1pma h GLN 121 CO 0.03 0.19 0.33 1.96 0.00 0.00 0.00 178.83 181.34 1pma h GLN 122 N 0.29 0.87 0.00 1.69 4.20 -1.42 -1.62 115.11 119.12 1pma h GLN 122 Ca 0.25 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.85 1pma h GLN 122 Cb 0.60 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.21 1pma h GLN 122 CO -0.06 0.67 0.00 0.66 -0.67 0.00 0.00 178.83 179.44 1pma n TYR 123 N -4.54 0.00 0.11 2.96 4.02 -0.73 -1.07 117.16 117.90 1pma n TYR 123 Ca 0.04 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 57.94 1pma n TYR 123 Cb 0.10 -0.09 -0.02 0.00 -0.02 0.00 0.00 39.34 39.31 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 0.89 0.00 -0.72 2.02 -1.28 -3.37 112.91 110.45 1pma h THR 124 Ca 0.00 -2.32 0.00 0.00 0.77 0.00 0.00 66.41 64.86 1pma h THR 124 Cb 0.05 2.39 0.00 0.00 -1.74 0.00 0.00 68.15 68.85 1pma h THR 124 CO 0.00 0.51 -0.67 0.00 0.37 0.00 0.00 175.52 175.73 1pma n GLN 125 N -3.17 2.04 -0.74 6.66 10.64 -0.73 -4.86 117.38 127.23 1pma n GLN 125 Ca -0.01 0.00 -0.10 0.00 -1.83 0.00 0.00 57.00 55.06 1pma n GLN 125 Cb 0.78 -0.83 -0.11 0.00 -0.86 0.00 0.00 30.24 29.22 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 -1.03 0.17 -0.95 2.61 4.01 -0.23 -4.94 117.16 116.79 1pma n TYR 126 Ca 0.00 -1.20 0.00 0.00 -0.16 0.00 0.00 57.90 56.54 1pma n TYR 126 Cb 0.02 -1.33 0.00 0.00 -0.31 0.00 0.00 39.34 37.72 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 2.74 2.56 2.54 2.72 0.00 -1.26 -4.46 105.19 110.04 1pma n GLY 127 Ca 0.33 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 0.16 3.63 -0.02 0.00 -1.26 -4.66 105.19 103.04 1pma n GLY 128 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 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 1.24 0.00 -0.11 1.61 0.11 -1.26 -5.15 120.40 116.84 1pma s VAL 129 Ca 0.00 0.00 -0.26 0.00 -2.93 0.00 0.00 61.98 58.79 1pma s VAL 129 Cb 0.00 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.83 1pma s VAL 129 CO 0.00 0.00 0.84 -0.60 -3.33 0.00 0.00 175.10 172.01 1pma s ARG 130 N 0.23 4.39 0.81 1.54 3.52 -1.26 -4.89 118.95 123.29 1pma s ARG 130 Ca 0.01 1.08 -0.14 0.00 -0.13 0.00 0.00 55.73 56.56 1pma s ARG 130 Cb -0.05 -3.52 0.06 0.00 -1.56 0.00 0.00 34.95 29.89 1pma s ARG 130 CO -0.03 -0.17 1.03 -2.30 -0.81 0.00 0.00 175.30 173.03 1pma n PRO 131 N 4.58 0.17 -2.28 5.12 -0.02 -1.26 -4.89 135.00 136.42 1pma n PRO 131 Ca 0.04 0.13 -0.43 0.00 -2.02 0.00 0.00 63.50 61.21 1pma n PRO 131 Cb 0.50 -2.30 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 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 2.41 -1.41 6.00 2.02 -1.26 -4.91 117.35 118.10 1pma s TYR 132 Ca 0.71 0.72 -0.11 0.00 -0.37 0.00 0.00 57.07 58.02 1pma s TYR 132 Cb -0.29 -3.95 0.07 0.00 -0.40 0.00 0.00 41.96 37.39 1pma s TYR 132 CO 0.53 -2.27 2.24 0.41 -1.57 0.00 0.00 175.55 174.89 1pma n GLY 133 N 4.49 4.61 3.55 0.71 0.00 -1.26 -4.48 105.19 112.81 1pma n GLY 133 Ca 0.17 -1.80 -0.15 0.00 0.00 0.00 0.00 46.02 44.24 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 0.12 1.61 0.11 -1.26 -0.06 120.40 122.53 1pma s VAL 134 Ca 0.49 0.00 0.07 0.00 -2.93 0.00 0.00 61.98 59.60 1pma s VAL 134 Cb 0.14 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.95 1pma s VAL 134 CO -0.05 0.00 -0.17 -0.44 -3.33 0.00 0.00 175.10 171.11 1pma s SER 135 N -0.95 2.25 0.16 3.54 0.01 -0.41 -3.08 113.70 115.21 1pma s SER 135 Ca -0.06 -0.77 -0.19 0.00 1.31 0.00 0.00 55.95 56.24 1pma s SER 135 Cb -0.01 -0.10 0.04 0.00 0.21 0.00 0.00 66.02 66.16 1pma s SER 135 CO 0.06 -0.06 0.50 -1.48 0.41 0.00 0.00 173.24 172.66 1pma s LEU 136 N -2.29 0.00 -0.03 2.44 0.05 0.01 -0.67 118.68 118.19 1pma s LEU 136 Ca 0.09 -0.26 0.05 0.00 0.05 0.00 0.00 54.13 54.05 1pma s LEU 136 Cb -0.07 2.17 -0.01 0.00 -2.05 0.00 0.00 46.19 46.23 1pma s LEU 136 CO 0.04 -0.95 -0.18 0.27 -0.55 0.00 0.00 176.35 174.99 1pma s ILE 137 N -3.81 1.43 -0.11 1.48 -4.36 -0.28 0.17 121.20 115.73 1pma s ILE 137 Ca 0.04 -0.74 -0.02 0.00 -0.26 0.00 0.00 60.65 59.67 1pma s ILE 137 Cb 0.00 -1.21 -0.03 0.00 1.25 0.00 0.00 42.46 42.47 1pma s ILE 137 CO -0.10 0.41 -0.03 -0.36 0.24 0.00 0.00 174.94 175.10 1pma s PHE 138 N -0.14 3.06 -0.07 1.37 0.08 0.10 -1.43 117.98 120.95 1pma s PHE 138 Ca 0.00 -0.02 -0.12 0.00 0.12 0.00 0.00 56.93 56.91 1pma s PHE 138 Cb -0.10 -1.83 0.03 0.00 -0.57 0.00 0.00 43.02 40.55 1pma s PHE 138 CO 0.01 0.26 0.30 0.00 -0.10 0.00 0.00 175.22 175.69 1pma s ALA 139 N -0.42 -0.75 0.00 5.36 0.00 -0.08 -0.85 121.76 125.02 1pma s ALA 139 Ca 0.07 0.57 0.00 0.00 0.00 0.00 0.00 51.96 52.60 1pma s ALA 139 Cb -0.12 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.78 1pma s ALA 139 CO 0.02 -0.20 0.00 0.41 0.00 0.00 0.00 175.76 175.99 1pma n GLY 140 N 2.11 -1.65 3.18 0.00 0.00 -0.99 -1.50 105.19 106.33 1pma n GLY 140 Ca -0.17 -1.15 -0.31 0.00 0.00 0.00 0.00 46.02 44.38 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 -2.72 1.97 0.00 -0.61 -1.16 -1.03 -0.54 121.20 117.11 1pma s ILE 141 Ca 0.00 -0.95 0.00 0.00 -0.51 0.00 0.00 60.65 59.19 1pma s ILE 141 Cb 0.00 -1.72 0.00 0.00 0.61 0.00 0.00 42.46 41.35 1pma s ILE 141 CO 0.00 0.54 0.00 -0.90 -2.81 0.00 0.00 174.94 171.77 1pma n ASP 142 N 3.75 1.72 0.08 4.50 3.85 -0.21 -4.87 116.55 125.38 1pma n ASP 142 Ca -0.20 -0.60 0.16 0.00 -0.71 0.00 0.00 54.79 53.45 1pma n ASP 142 Cb 0.52 0.00 0.66 0.00 -1.35 0.00 0.00 41.12 40.96 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 0.02 0.14 0.11 5.75 -1.42 -1.38 115.11 118.33 1pma h GLN 143 Ca 0.00 -0.00 -0.28 0.00 -0.15 0.00 0.00 58.65 58.22 1pma h GLN 143 Cb 0.00 -0.00 0.01 0.00 1.07 0.00 0.00 27.48 28.55 1pma h GLN 143 CO 0.00 0.01 -1.26 0.82 -2.65 0.00 0.00 178.83 175.76 1pma h ILE 144 N 0.02 1.48 0.00 2.39 2.04 -1.96 -3.51 117.51 117.97 1pma h ILE 144 Ca 0.17 -3.02 0.00 0.00 1.00 0.00 0.00 64.86 63.01 1pma h ILE 144 Cb 0.66 2.94 0.00 0.00 -0.74 0.00 0.00 36.82 39.68 1pma h ILE 144 CO -0.01 0.88 0.00 0.61 0.00 0.00 0.00 178.15 179.64 1pma n GLY 145 N 1.53 0.74 3.73 5.37 0.00 -0.52 -5.08 105.19 110.95 1pma n GLY 145 Ca -0.09 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.76 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 4.38 0.09 1.61 0.02 -1.26 -1.05 135.00 136.79 1pma s PRO 146 Ca 0.00 1.99 0.03 0.00 0.02 0.00 0.00 61.00 63.04 1pma s PRO 146 Cb 0.00 -3.24 -0.04 0.00 0.02 0.00 0.00 34.50 31.24 1pma s PRO 146 CO 0.00 -0.30 -0.09 1.03 -0.33 0.00 0.00 177.00 177.31 1pma s ARG 147 N 0.50 0.79 -0.13 5.54 0.52 0.30 -4.96 118.95 121.51 1pma s ARG 147 Ca 0.59 -1.15 -0.04 0.00 -0.52 0.00 0.00 55.73 54.62 1pma s ARG 147 Cb -0.35 -0.39 0.07 0.00 0.52 0.00 0.00 34.95 34.80 1pma s ARG 147 CO 0.34 0.04 0.23 -1.17 0.02 0.00 0.00 175.30 174.76 1pma s LEU 148 N -2.49 -0.21 0.06 2.53 2.96 -1.26 -2.35 118.68 117.92 1pma s LEU 148 Ca 0.05 0.37 0.06 0.00 -0.22 0.00 0.00 54.13 54.38 1pma s LEU 148 Cb -0.02 0.53 -0.03 0.00 0.50 0.00 0.00 46.19 47.18 1pma s LEU 148 CO -0.01 -0.26 -0.15 -0.36 -1.32 0.00 0.00 176.35 174.24 1pma s PHE 149 N 2.37 1.33 0.19 5.38 0.40 -0.03 -0.90 117.98 126.72 1pma s PHE 149 Ca 0.03 -0.41 0.11 0.00 -0.60 0.00 0.00 56.93 56.06 1pma s PHE 149 Cb -0.13 -0.76 -0.04 0.00 0.51 0.00 0.00 43.02 42.60 1pma s PHE 149 CO -0.08 0.07 -0.22 0.16 0.70 0.00 0.00 175.22 175.85 1pma s ASP 150 N -1.49 3.22 -0.10 1.36 -4.77 -0.75 0.01 116.67 114.14 1pma s ASP 150 Ca 0.01 -0.88 -0.04 0.00 -3.30 0.00 0.00 52.55 48.34 1pma s ASP 150 Cb -0.09 -0.23 0.05 0.00 -1.09 0.00 0.00 42.92 41.56 1pma s ASP 150 CO 0.02 0.07 0.21 0.00 0.70 0.00 0.00 175.17 176.16 1pma s ASP 152 N 1.74 5.57 0.58 0.00 -4.77 -0.98 -0.81 116.67 118.00 1pma s ASP 152 Ca -0.04 -0.47 0.28 0.00 -3.30 0.00 0.00 52.55 49.02 1pma s ASP 152 Cb -0.11 -0.60 1.56 0.00 -1.09 0.00 0.00 42.92 42.67 1pma s ASP 152 CO -0.07 -0.78 2.03 -0.65 0.70 0.00 0.00 175.17 176.40 1pma h PRO 153 N 0.66 0.00 0.00 2.11 0.11 -1.76 0.17 132.00 133.28 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 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1pma h PRO 153 CO 0.46 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.25 1pma h ALA 154 N 1.68 1.00 0.00 -0.75 0.00 -1.89 -3.43 119.26 115.87 1pma h ALA 154 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1pma h ALA 154 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.54 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 0.28 0.87 3.73 0.00 0.00 0.61 -4.39 105.19 106.29 1pma n GLY 155 Ca 0.02 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 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 4.19 -0.00 2.61 2.01 -1.25 -4.80 115.64 116.39 1pma s THR 156 Ca 0.00 1.82 0.02 0.00 0.31 0.00 0.00 61.69 63.84 1pma s THR 156 Cb 0.00 -4.16 -0.01 0.00 0.01 0.00 0.00 72.50 68.34 1pma s THR 156 CO 0.00 0.28 -0.06 -0.51 -0.69 0.00 0.00 174.62 173.63 1pma s ILE 157 N 0.01 0.50 0.07 1.82 2.07 -1.26 -2.33 121.20 122.08 1pma s ILE 157 Ca 0.49 -0.34 -0.15 0.00 -1.41 0.00 0.00 60.65 59.24 1pma s ILE 157 Cb -0.26 -0.44 0.03 0.00 0.13 0.00 0.00 42.46 41.91 1pma s ILE 157 CO 0.32 0.10 0.35 0.20 -1.91 0.00 0.00 174.94 174.00 1pma s ASN 158 N -0.27 -0.18 -0.10 4.50 -0.87 -1.16 -5.00 114.94 111.85 1pma s ASN 158 Ca 0.01 -0.20 -0.04 0.00 -1.57 0.00 0.00 52.86 51.07 1pma s ASN 158 Cb -0.03 0.40 -0.04 0.00 -0.02 0.00 0.00 41.25 41.57 1pma s ASN 158 CO -0.00 -0.69 0.05 -0.70 -2.57 0.00 0.00 177.10 173.19 1pma s GLU 159 N -2.92 3.21 0.39 -0.60 2.12 -1.26 -1.82 118.70 117.81 1pma s GLU 159 Ca -0.02 -0.31 0.06 0.00 0.36 0.00 0.00 54.97 55.05 1pma s GLU 159 Cb 0.00 -2.96 -0.07 0.00 0.26 0.00 0.00 34.13 31.36 1pma s GLU 159 CO -0.06 0.70 0.03 0.71 -0.54 0.00 0.00 175.26 176.11 1pma s TYR 160 N -0.85 2.28 -0.12 5.30 1.51 -0.07 -5.00 117.35 120.39 1pma s TYR 160 Ca 0.13 -0.80 0.08 0.00 -1.01 0.00 0.00 57.07 55.48 1pma s TYR 160 Cb -0.12 -1.59 -0.24 0.00 -0.11 0.00 0.00 41.96 39.91 1pma s TYR 160 CO 0.03 0.27 0.36 1.17 -1.11 0.00 0.00 175.55 176.26 1pma n LYS 161 N -0.89 0.68 -3.53 -0.62 3.00 -1.26 -4.41 118.16 111.12 1pma n LYS 161 Ca -0.05 0.20 -0.11 0.00 -0.00 0.00 0.00 58.31 58.35 1pma n LYS 161 Cb 0.67 -1.68 -0.04 0.00 0.00 0.00 0.00 35.03 33.98 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 -2.56 -1.85 -0.07 3.14 0.00 -1.26 -0.58 121.76 118.59 1pma s ALA 162 Ca -0.13 1.30 -0.32 0.00 0.00 0.00 0.00 51.96 52.81 1pma s ALA 162 Cb 0.07 -0.13 0.13 0.00 0.00 0.00 0.00 23.12 23.19 1pma s ALA 162 CO 0.79 -0.47 1.30 -0.08 0.00 0.00 0.00 175.76 177.29 1pma s THR 163 N -1.94 0.00 0.37 0.00 -1.32 -0.25 -4.99 115.64 107.52 1pma s THR 163 Ca -0.01 -0.15 0.06 0.00 -1.21 0.00 0.00 61.69 60.37 1pma s THR 163 Cb -0.01 -1.79 -0.03 0.00 -1.51 0.00 0.00 72.50 69.17 1pma s THR 163 CO -0.01 0.00 0.21 0.00 -2.21 0.00 0.00 174.62 172.60 1pma s ALA 164 N -2.36 2.43 0.02 11.08 0.00 -1.26 -1.08 121.76 130.59 1pma s ALA 164 Ca 0.13 -1.61 -0.28 0.00 0.00 0.00 0.00 51.96 50.21 1pma s ALA 164 Cb 0.04 1.11 0.08 0.00 0.00 0.00 0.00 23.12 24.36 1pma s ALA 164 CO -0.04 -0.50 0.73 -1.50 0.00 0.00 0.00 175.76 174.44 1pma s ILE 165 N -3.32 0.00 0.00 0.00 1.10 0.80 -4.94 121.20 114.83 1pma s ILE 165 Ca 0.31 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.45 1pma s ILE 165 Cb 0.02 -1.00 0.00 0.00 0.15 0.00 0.00 42.46 41.63 1pma s ILE 165 CO 0.21 0.00 0.00 0.61 -2.11 0.00 0.00 174.94 173.65 1pma n GLY 166 N 0.21 -0.05 0.47 1.50 0.00 -1.25 -0.59 105.19 105.47 1pma n GLY 166 Ca -0.15 -1.95 -0.18 0.00 0.00 0.00 0.00 46.02 43.74 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 -1.07 -0.27 1.61 0.87 -1.15 -3.21 113.55 110.33 1pma h SER 167 Ca 0.00 0.05 -0.15 0.00 -1.23 0.00 0.00 61.79 60.46 1pma h SER 167 Cb 0.00 0.30 -0.08 0.00 -0.44 0.00 0.00 62.40 62.18 1pma h SER 167 CO 0.00 -0.69 0.19 0.61 -0.53 0.00 0.00 176.83 176.40 1pma n GLY 168 N -1.57 2.77 0.24 5.77 0.00 -1.26 -4.64 105.19 106.51 1pma n GLY 168 Ca -0.14 -0.34 -0.09 0.00 0.00 0.00 0.00 46.02 45.46 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 0.40 -0.40 -0.88 1.61 3.64 -1.82 -1.48 116.57 117.64 1pma h LYS 169 Ca 0.17 0.03 0.23 0.00 -1.27 0.00 0.00 60.65 59.81 1pma h LYS 169 Cb 1.43 0.09 -0.13 0.00 -0.41 0.00 0.00 32.23 33.21 1pma h LYS 169 CO 0.32 -0.27 0.29 -0.44 -2.27 0.00 0.00 179.45 177.08 1pma h ASP 170 N -0.42 0.11 0.17 4.20 3.32 -1.89 0.33 116.42 122.25 1pma h ASP 170 Ca -0.01 0.18 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 1pma h ASP 170 Cb 0.40 0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.17 1pma h ASP 170 CO -0.11 -0.11 -0.08 0.00 -1.72 0.00 0.00 179.24 177.22 1pma h ALA 171 N 1.75 -0.88 -0.48 3.45 0.00 -1.83 -2.68 119.26 118.60 1pma h ALA 171 Ca 0.55 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.47 1pma h ALA 171 Cb 1.10 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 1pma h ALA 171 CO -0.61 -0.86 0.32 -0.24 0.00 0.00 0.00 179.25 177.86 1pma h VAL 172 N -0.27 0.97 -0.44 0.00 3.04 -0.98 -1.16 116.25 117.40 1pma h VAL 172 Ca -0.02 -0.14 -0.07 0.00 -1.01 0.00 0.00 66.70 65.46 1pma h VAL 172 Cb 0.18 0.53 -0.02 0.00 -2.01 0.00 0.00 31.29 29.97 1pma h VAL 172 CO 0.04 0.07 -0.01 1.62 -1.01 0.00 0.00 177.57 178.28 1pma h VAL 173 N 0.40 1.24 -0.02 1.51 3.04 -0.39 -2.46 116.25 119.56 1pma h VAL 173 Ca 0.21 -0.97 -0.01 0.00 -1.01 0.00 0.00 66.70 64.92 1pma h VAL 173 Cb 0.32 0.91 -0.00 0.00 -2.01 0.00 0.00 31.29 30.51 1pma h VAL 173 CO -0.05 0.34 -0.01 0.28 -1.01 0.00 0.00 177.57 177.12 1pma h SER 174 N 0.68 0.05 -0.50 3.17 0.02 -0.86 0.11 113.55 116.22 1pma h SER 174 Ca 0.13 -0.41 0.10 0.00 -0.84 0.00 0.00 61.79 60.77 1pma h SER 174 Cb 0.44 -0.01 -0.10 0.00 0.14 0.00 0.00 62.40 62.86 1pma h SER 174 CO 0.02 0.45 -0.19 0.15 -1.14 0.00 0.00 176.83 176.12 1pma h PHE 175 N -0.35 -0.47 -0.23 3.45 3.04 -1.32 0.67 116.94 121.73 1pma h PHE 175 Ca 0.01 0.05 -0.02 0.00 3.98 0.00 0.00 57.97 61.99 1pma h PHE 175 Cb 0.43 0.29 -0.01 0.00 2.56 0.00 0.00 35.95 39.22 1pma h PHE 175 CO 0.07 -0.28 0.06 -0.07 -2.02 0.00 0.00 178.31 176.06 1pma h LEU 176 N -0.08 0.34 -1.84 0.59 -0.00 -1.40 0.26 115.31 113.18 1pma h LEU 176 Ca 0.24 -0.23 0.40 0.00 -0.00 0.00 0.00 57.88 58.29 1pma h LEU 176 Cb 0.45 -0.09 -0.06 0.00 -0.00 0.00 0.00 40.66 40.96 1pma h LEU 176 CO -0.56 0.48 1.09 -0.08 -0.00 0.00 0.00 178.44 179.38 1pma h GLU 177 N 0.19 0.00 0.00 1.13 4.57 0.13 0.38 114.58 120.98 1pma h GLU 177 Ca 0.07 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.21 1pma h GLU 177 Cb 0.27 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 1pma h GLU 177 CO 0.00 0.00 -1.12 -2.13 -1.18 0.00 0.00 179.01 174.58 1pma n ARG 178 N -3.89 0.53 -0.46 1.92 0.63 -0.05 -4.72 116.66 110.62 1pma n ARG 178 Ca 0.31 0.21 0.06 0.00 -0.92 0.00 0.00 57.85 57.51 1pma n ARG 178 Cb 1.53 -1.43 0.25 0.00 0.45 0.00 0.00 32.46 33.26 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 -4.43 3.01 -2.34 -0.14 1.02 0.87 -4.95 120.64 113.68 1pma n GLU 179 Ca -0.17 -1.97 -0.42 0.00 -0.02 0.00 0.00 57.16 54.57 1pma n GLU 179 Cb 0.55 -1.75 -0.03 0.00 -0.02 0.00 0.00 31.44 30.19 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 -1.83 2.86 -0.41 -0.32 5.04 0.13 -4.93 117.35 117.88 1pma s TYR 180 Ca 0.35 0.93 -0.14 0.00 -2.44 0.00 0.00 57.07 55.77 1pma s TYR 180 Cb 0.23 -3.57 0.03 0.00 0.35 0.00 0.00 41.96 39.01 1pma s TYR 180 CO 0.16 -2.02 0.29 0.21 -1.34 0.00 0.00 175.55 172.85 1pma s LYS 181 N 2.87 2.93 0.00 4.97 2.47 -1.26 -5.04 119.74 126.69 1pma s LYS 181 Ca 0.59 -1.08 0.00 0.00 -1.56 0.00 0.00 55.97 53.92 1pma s LYS 181 Cb -0.26 -3.95 0.00 0.00 -1.46 0.00 0.00 37.83 32.15 1pma s LYS 181 CO 0.22 -0.78 0.01 -1.91 0.16 0.00 0.00 175.35 173.04 1pma n GLU 182 N 5.13 0.00 -1.24 4.03 4.07 -1.26 -2.12 120.64 129.24 1pma n GLU 182 Ca -0.11 0.01 -0.26 0.00 -0.06 0.00 0.00 57.16 56.73 1pma n GLU 182 Cb 0.46 -0.14 0.03 0.00 -0.06 0.00 0.00 31.44 31.74 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 -0.03 6.95 -4.69 4.31 4.13 -1.26 -4.64 115.26 120.02 1pma n ASN 183 Ca 0.00 -3.39 -0.44 0.00 1.68 0.00 0.00 54.58 52.43 1pma n ASN 183 Cb 0.00 -1.07 -0.04 0.00 -1.54 0.00 0.00 39.78 37.13 1pma n ASN 183 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1pma n LEU 184 N -0.01 3.51 -4.77 3.41 7.94 -0.90 -3.87 117.00 122.30 1pma n LEU 184 Ca 0.46 1.08 -0.35 0.00 -1.11 0.00 0.00 56.01 56.09 1pma n LEU 184 Cb 0.56 -1.49 0.00 0.00 0.53 0.00 0.00 43.42 43.02 1pma n LEU 184 CO 0.51 -0.08 0.78 -2.84 -1.11 0.00 0.00 177.39 174.64 1pma s PRO 185 N 0.94 3.34 0.00 1.96 0.02 -1.26 -0.04 135.00 139.96 1pma s PRO 185 Ca 0.77 1.60 0.00 0.00 0.02 0.00 0.00 61.00 63.39 1pma s PRO 185 Cb -0.60 -2.00 0.00 0.00 0.02 0.00 0.00 34.50 31.92 1pma s PRO 185 CO 0.36 -0.86 0.54 -1.91 -0.33 0.00 0.00 177.00 174.80 1pma n GLU 186 N -1.34 0.00 -0.31 5.54 2.13 -1.26 -0.57 120.64 124.83 1pma n GLU 186 Ca 0.12 0.54 0.11 0.00 0.66 0.00 0.00 57.16 58.59 1pma n GLU 186 Cb 0.51 -0.83 0.24 0.00 0.27 0.00 0.00 31.44 31.63 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 -0.05 5.31 3.64 -1.99 0.44 116.57 123.97 1pma h LYS 187 Ca 0.00 -0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.16 1pma h LYS 187 Cb 0.00 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1pma h LYS 187 CO 0.00 0.04 -0.84 0.93 -2.27 0.00 0.00 179.45 177.31 1pma h GLU 188 N 0.06 0.49 0.01 1.90 5.08 -1.56 -2.39 114.58 118.17 1pma h GLU 188 Ca 0.53 -0.46 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1pma h GLU 188 Cb 1.04 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.40 1pma h GLU 188 CO -0.82 1.09 -0.01 0.00 -1.00 0.00 0.00 179.01 178.28 1pma h ALA 189 N 0.76 -0.02 -0.89 3.43 0.00 0.22 0.34 119.26 123.11 1pma h ALA 189 Ca -0.06 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1pma h ALA 189 Cb 1.46 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.21 1pma h ALA 189 CO 0.15 -0.51 0.59 -0.24 0.00 0.00 0.00 179.25 179.24 1pma h VAL 190 N -0.02 1.21 0.58 0.00 3.04 -0.73 0.25 116.25 120.58 1pma h VAL 190 Ca -0.00 -0.41 -0.03 0.00 -1.01 0.00 0.00 66.70 65.26 1pma h VAL 190 Cb 0.01 -0.08 0.00 0.00 -2.01 0.00 0.00 31.29 29.22 1pma h VAL 190 CO 0.00 0.22 -0.31 0.74 -1.01 0.00 0.00 177.57 177.20 1pma h THR 191 N 1.18 0.00 -0.85 3.17 2.02 -0.78 0.34 112.91 118.00 1pma h THR 191 Ca 0.33 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.72 1pma h THR 191 Cb -0.10 0.00 -0.15 0.00 -1.74 0.00 0.00 68.15 66.16 1pma h THR 191 CO -0.08 0.00 0.07 0.25 0.37 0.00 0.00 175.52 176.13 1pma h LEU 192 N -0.82 -0.29 0.24 2.58 5.85 -0.03 0.18 115.31 123.02 1pma h LEU 192 Ca -0.08 0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 1pma h LEU 192 Cb 0.64 0.36 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 1pma h LEU 192 CO 0.11 -0.21 -0.26 1.23 -0.34 0.00 0.00 178.44 178.97 1pma h GLY 193 N 0.11 -1.00 1.17 3.75 0.00 0.14 0.19 103.07 107.43 1pma h GLY 193 Ca 0.49 0.46 0.11 0.00 0.00 0.00 0.00 47.33 48.39 1pma h GLY 193 CO -0.72 -0.32 0.31 1.19 0.00 0.00 0.00 176.54 176.99 1pma h ILE 194 N -0.50 0.64 0.17 2.60 2.10 0.92 0.33 117.51 123.77 1pma h ILE 194 Ca -0.03 0.00 -0.01 0.00 1.08 0.00 0.00 64.86 65.90 1pma h ILE 194 Cb 0.44 0.77 0.00 0.00 -1.09 0.00 0.00 36.82 36.94 1pma h ILE 194 CO -0.04 0.00 -0.08 0.50 -1.08 0.00 0.00 178.15 177.45 1pma h LYS 195 N 0.00 -0.22 -0.39 2.19 3.64 0.01 -1.07 116.57 120.73 1pma h LYS 195 Ca 0.18 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.60 1pma h LYS 195 Cb 0.80 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.64 1pma h LYS 195 CO -0.00 0.16 0.22 0.00 -2.27 0.00 0.00 179.45 177.56 1pma h ALA 196 N 0.06 0.49 -0.40 5.00 0.00 0.16 -1.95 119.26 122.62 1pma h ALA 196 Ca -0.02 0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.93 1pma h ALA 196 Cb 0.48 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 1pma h ALA 196 CO 0.04 -0.13 0.16 1.25 0.00 0.00 0.00 179.25 180.56 1pma h LEU 197 N 0.44 0.19 0.00 0.00 5.85 -0.45 -3.01 115.31 118.33 1pma h LEU 197 Ca 0.16 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.92 1pma h LEU 197 Cb 0.03 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.08 1pma h LEU 197 CO -0.09 0.14 0.00 1.17 -0.34 0.00 0.00 178.44 179.32 1pma n LYS 198 N -4.99 0.00 -0.18 1.25 4.81 -0.41 -2.98 118.16 115.67 1pma n LYS 198 Ca 0.02 0.47 -0.05 0.00 -0.87 0.00 0.00 58.31 57.89 1pma n LYS 198 Cb 0.14 -1.23 -0.04 0.00 0.02 0.00 0.00 35.03 33.91 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 -1.55 -0.45 0.00 3.14 3.41 -0.80 0.52 113.62 117.89 1pma n SER 199 Ca 0.00 0.77 0.00 0.00 -0.26 0.00 0.00 58.87 59.38 1pma n SER 199 Cb 0.00 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 63.84 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 -4.48 0.00 0.32 4.04 2.88 -1.14 -2.81 113.62 112.43 1pma n SER 200 Ca 0.01 0.00 0.21 0.00 -1.33 0.00 0.00 58.87 57.76 1pma n SER 200 Cb 0.11 0.00 1.10 0.00 -0.75 0.00 0.00 64.21 64.67 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 -3.88 2.46 7.12 -1.46 -3.29 115.31 116.27 1pma h LEU 201 Ca 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 57.88 57.97 1pma h LEU 201 Cb 0.00 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.12 1pma h LEU 201 CO 0.00 0.00 0.02 -0.62 -0.13 0.00 0.00 178.44 177.71 1pma n GLU 202 N -3.01 0.69 0.06 1.25 4.71 0.18 -2.99 120.64 121.53 1pma n GLU 202 Ca -0.02 -0.19 -0.06 0.00 -0.01 0.00 0.00 57.16 56.88 1pma n GLU 202 Cb 0.10 -1.44 -0.11 0.00 -1.01 0.00 0.00 31.44 28.98 1pma n GLU 202 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 1pma h GLU 203 N 3.25 0.00 -1.05 3.49 4.22 -1.74 -3.20 114.58 119.55 1pma h GLU 203 Ca 0.04 0.00 -0.36 0.00 0.08 0.00 0.00 59.36 59.12 1pma h GLU 203 Cb 0.60 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 29.65 1pma h GLU 203 CO 0.14 0.92 0.45 0.41 -2.18 0.00 0.00 179.01 178.74 1pma n GLY 204 N 1.36 3.78 5.22 1.92 0.00 -1.16 -4.98 105.19 111.33 1pma n GLY 204 Ca -0.01 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.19 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 -0.52 0.00 -1.85 1.61 4.07 -1.21 -4.78 120.64 117.96 1pma n GLU 205 Ca 0.40 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 57.07 1pma n GLU 205 Cb 1.18 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 32.54 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 4.06 0.20 5.31 2.12 -1.26 -4.88 118.70 124.25 1pma s GLU 206 Ca 0.00 2.31 0.24 0.00 0.36 0.00 0.00 54.97 57.87 1pma s GLU 206 Cb 0.00 -4.09 0.91 0.00 0.26 0.00 0.00 34.13 31.21 1pma s GLU 206 CO 0.00 -1.02 1.72 -0.11 -0.54 0.00 0.00 175.26 175.32 1pma n LEU 207 N 7.73 0.60 0.00 2.70 7.94 -1.26 -4.98 117.00 129.73 1pma n LEU 207 Ca 0.19 0.61 0.00 0.00 -1.11 0.00 0.00 56.01 55.70 1pma n LEU 207 Cb 0.42 -0.48 0.00 0.00 0.53 0.00 0.00 43.42 43.89 1pma n LEU 207 CO 0.65 -0.37 0.00 1.17 -1.11 0.00 0.00 177.39 177.73 1pma n LYS 208 N -2.12 0.00 -3.66 1.96 3.00 -1.26 -4.40 118.16 111.68 1pma n LYS 208 Ca 0.04 0.00 -0.39 0.00 -0.00 0.00 0.00 58.31 57.96 1pma n LYS 208 Cb 0.29 0.00 -0.11 0.00 0.00 0.00 0.00 35.03 35.22 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 -1.88 3.21 0.50 3.14 0.00 -1.25 -5.05 121.76 120.42 1pma s ALA 209 Ca 0.00 -2.05 -0.20 0.00 0.00 0.00 0.00 51.96 49.71 1pma s ALA 209 Cb 0.00 -2.52 -0.08 0.00 0.00 0.00 0.00 23.12 20.53 1pma s ALA 209 CO 0.00 -1.56 1.05 -2.14 0.00 0.00 0.00 175.76 173.11 1pma s PRO 210 N 1.40 3.71 -0.23 0.00 0.02 -1.26 -3.02 135.00 135.62 1pma s PRO 210 Ca 0.02 1.39 -0.07 0.00 0.02 0.00 0.00 61.00 62.36 1pma s PRO 210 Cb -0.22 -2.08 -0.03 0.00 0.02 0.00 0.00 34.50 32.19 1pma s PRO 210 CO 0.02 -0.51 0.07 -2.00 -0.33 0.00 0.00 177.00 174.25 1pma s GLU 211 N -3.28 3.77 0.00 5.54 2.12 0.42 -4.83 118.70 122.44 1pma s GLU 211 Ca 0.68 -0.43 0.02 0.00 0.36 0.00 0.00 54.97 55.60 1pma s GLU 211 Cb -0.17 -3.29 -0.01 0.00 0.26 0.00 0.00 34.13 30.92 1pma s GLU 211 CO 0.22 -0.03 -0.06 -1.50 -0.54 0.00 0.00 175.26 173.35 1pma s ILE 212 N 1.19 0.49 -0.05 -3.70 2.07 -1.26 -0.79 121.20 119.14 1pma s ILE 212 Ca 0.05 -0.34 -0.11 0.00 -1.41 0.00 0.00 60.65 58.83 1pma s ILE 212 Cb -0.14 -0.43 0.02 0.00 0.13 0.00 0.00 42.46 42.04 1pma s ILE 212 CO 0.03 0.08 0.25 0.00 -1.91 0.00 0.00 174.94 173.40 1pma s ALA 213 N -0.27 -0.63 0.06 1.50 0.00 0.03 -1.20 121.76 121.24 1pma s ALA 213 Ca 0.01 0.40 -0.11 0.00 0.00 0.00 0.00 51.96 52.26 1pma s ALA 213 Cb -0.03 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 22.97 1pma s ALA 213 CO -0.00 -0.19 0.25 -1.54 0.00 0.00 0.00 175.76 174.27 1pma s SER 214 N -0.73 -0.02 0.04 0.00 1.04 0.39 0.49 113.70 114.90 1pma s SER 214 Ca -0.08 -0.36 0.01 0.00 0.48 0.00 0.00 55.95 55.99 1pma s SER 214 Cb -0.04 0.34 -0.03 0.00 0.10 0.00 0.00 66.02 66.38 1pma s SER 214 CO 0.02 -0.64 -0.05 -0.51 0.98 0.00 0.00 173.24 173.05 1pma s ILE 215 N -2.93 0.33 0.02 -1.02 2.07 -0.62 -0.11 121.20 118.95 1pma s ILE 215 Ca -0.02 -1.30 0.03 0.00 -1.41 0.00 0.00 60.65 57.95 1pma s ILE 215 Cb 0.01 -0.83 -0.02 0.00 0.13 0.00 0.00 42.46 41.75 1pma s ILE 215 CO -0.06 -0.63 -0.09 0.28 -1.91 0.00 0.00 174.94 172.53 1pma s THR 216 N -2.29 0.68 0.26 4.00 -1.32 -1.26 -0.92 115.64 114.79 1pma s THR 216 Ca -0.05 -0.77 -0.27 0.00 -1.21 0.00 0.00 61.69 59.39 1pma s THR 216 Cb -0.04 -0.65 -0.15 0.00 -1.51 0.00 0.00 72.50 70.15 1pma s THR 216 CO -0.03 -0.09 0.68 0.55 -2.21 0.00 0.00 174.62 173.52 1pma n VAL 217 N 2.11 1.92 0.00 5.08 3.14 0.12 -1.99 118.33 128.71 1pma n VAL 217 Ca -0.18 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.70 1pma n VAL 217 Cb 0.56 -0.42 0.00 0.00 -1.06 0.00 0.00 33.84 32.92 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 1.71 3.06 1.48 7.55 0.00 -1.26 -5.01 105.19 112.71 1pma n GLY 218 Ca 0.14 0.00 -0.08 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 -0.45 -4.88 1.61 6.94 -0.84 -5.16 115.26 112.47 1pma n ASN 219 Ca 0.00 -1.93 -0.30 0.00 -0.02 0.00 0.00 54.58 52.33 1pma n ASN 219 Cb 0.00 0.93 0.03 0.00 -2.36 0.00 0.00 39.78 38.38 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 -2.50 3.24 0.54 -3.83 1.02 -1.26 -4.55 119.74 112.40 1pma s LYS 220 Ca 0.16 0.51 -0.22 0.00 0.02 0.00 0.00 55.97 56.44 1pma s LYS 220 Cb 0.00 -2.10 -0.05 0.00 -0.52 0.00 0.00 37.83 35.16 1pma s LYS 220 CO 0.11 -0.73 1.35 0.66 -0.92 0.00 0.00 175.35 175.82 1pma n TYR 221 N -2.79 2.26 -4.27 3.18 4.01 -0.76 -4.63 117.16 114.16 1pma n TYR 221 Ca 0.06 0.43 -0.28 0.00 -0.16 0.00 0.00 57.90 57.95 1pma n TYR 221 Cb 0.56 -2.36 -0.17 0.00 -0.31 0.00 0.00 39.34 37.06 1pma n TYR 221 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 1pma s ARG 222 N -2.85 2.04 -0.20 -0.72 3.52 0.85 -4.99 118.95 116.60 1pma s ARG 222 Ca 0.71 -0.48 -0.11 0.00 -0.13 0.00 0.00 55.73 55.72 1pma s ARG 222 Cb -0.42 -1.82 -0.05 0.00 -1.56 0.00 0.00 34.95 31.10 1pma s ARG 222 CO 0.50 -0.13 0.18 0.42 -0.81 0.00 0.00 175.30 175.46 1pma s ILE 223 N 1.20 5.37 0.10 4.11 1.01 -1.26 -0.47 121.20 131.26 1pma s ILE 223 Ca -0.03 0.29 -0.31 0.00 0.00 0.00 0.00 60.65 60.61 1pma s ILE 223 Cb -0.14 -3.52 -0.07 0.00 0.01 0.00 0.00 42.46 38.74 1pma s ILE 223 CO -0.04 0.40 1.25 -0.31 0.00 0.00 0.00 174.94 176.24 1pma s TYR 224 N 0.58 3.38 0.51 3.97 1.51 -0.34 -5.00 117.35 121.96 1pma s TYR 224 Ca 0.10 1.23 -0.18 0.00 -1.01 0.00 0.00 57.07 57.22 1pma s TYR 224 Cb -0.12 -3.49 -0.08 0.00 -0.11 0.00 0.00 41.96 38.16 1pma s TYR 224 CO 0.01 -1.56 1.00 0.16 -1.11 0.00 0.00 175.55 174.05 1pma s ASP 225 N 0.89 6.51 0.17 2.29 -4.77 -1.26 -4.71 116.67 115.78 1pma s ASP 225 Ca 0.59 1.68 -0.07 0.00 -3.30 0.00 0.00 52.55 51.45 1pma s ASP 225 Cb -0.32 -2.53 0.25 0.00 -1.09 0.00 0.00 42.92 39.24 1pma s ASP 225 CO 0.31 -0.66 0.98 1.67 0.70 0.00 0.00 175.17 178.17 1pma n GLN 226 N -1.39 -0.08 -0.10 2.11 7.27 -1.26 0.15 117.38 124.09 1pma n GLN 226 Ca 0.07 0.98 -0.13 0.00 0.07 0.00 0.00 57.00 57.99 1pma n GLN 226 Cb 0.54 -1.46 -0.04 0.00 2.41 0.00 0.00 30.24 31.69 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 0.69 -0.71 3.69 3.07 -1.98 -1.96 114.58 117.39 1pma h GLU 227 Ca 0.28 -0.35 0.02 0.00 -0.50 0.00 0.00 59.36 58.81 1pma h GLU 227 Cb 0.44 0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 28.31 1pma h GLU 227 CO -0.64 0.96 0.46 1.49 -1.40 0.00 0.00 179.01 179.88 1pma h GLU 228 N 0.44 0.88 -0.34 2.33 4.81 -0.65 -1.61 114.58 120.44 1pma h GLU 228 Ca 0.05 -0.05 -0.17 0.00 -0.13 0.00 0.00 59.36 59.06 1pma h GLU 228 Cb 0.82 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 30.00 1pma h GLU 228 CO 0.07 0.59 -0.45 -0.24 -0.73 0.00 0.00 179.01 178.24 1pma h VAL 229 N 0.91 1.27 -0.02 0.32 3.04 -1.38 -2.88 116.25 117.52 1pma h VAL 229 Ca 0.27 -1.63 0.01 0.00 -1.01 0.00 0.00 66.70 64.34 1pma h VAL 229 Cb -0.04 1.49 -0.00 0.00 -2.01 0.00 0.00 31.29 30.73 1pma h VAL 229 CO -0.09 0.54 0.03 0.50 -1.01 0.00 0.00 177.57 177.55 1pma h LYS 230 N 0.72 0.00 -0.31 4.17 3.64 -0.83 -0.28 116.57 123.68 1pma h LYS 230 Ca 0.04 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.30 1pma h LYS 230 Cb 1.05 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 1pma h LYS 230 CO 0.11 0.00 -0.32 -0.22 -2.27 0.00 0.00 179.45 176.75 1pma h LYS 231 N 0.00 0.66 0.00 1.90 3.64 -1.08 -2.97 116.57 118.72 1pma h LYS 231 Ca 0.01 -0.30 -0.09 0.00 -1.27 0.00 0.00 60.65 59.00 1pma h LYS 231 Cb 0.07 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 1pma h LYS 231 CO -0.00 0.89 -1.10 0.74 -2.27 0.00 0.00 179.45 177.70 1pma h PHE 232 N 0.56 0.00 0.00 1.91 -1.00 -1.26 -3.52 116.94 113.62 1pma h PHE 232 Ca 0.06 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.84 1pma h PHE 232 Cb 0.82 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.38 1pma h PHE 232 CO 0.04 0.31 0.00 -0.11 -1.61 0.00 0.00 178.31 176.94