#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pwl s ALA 1 N 0.00 3.64 -0.68 -5.12 0.00 -1.26 -4.92 121.76 113.42 1pwl s ALA 1 Ca 0.00 1.55 0.25 0.00 0.00 0.00 0.00 51.96 53.76 1pwl s ALA 1 Cb 0.00 -3.62 0.59 0.00 0.00 0.00 0.00 23.12 20.09 1pwl s ALA 1 CO 0.00 -1.00 1.57 0.66 0.00 0.00 0.00 175.76 176.99 1pwl h SER 2 N 3.81 0.00 -4.01 0.00 4.64 -2.02 -3.46 113.55 112.52 1pwl h SER 2 Ca -0.49 -0.09 -0.41 0.00 -0.47 0.00 0.00 61.79 60.33 1pwl h SER 2 Cb 1.23 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.14 1pwl h SER 2 CO 0.71 0.05 -0.75 -0.13 -0.87 0.00 0.00 176.83 175.83 1pwl s ARG 3 N -3.13 1.04 -0.03 4.77 0.52 -1.26 -0.90 118.95 119.96 1pwl s ARG 3 Ca 0.09 -1.27 0.07 0.00 -0.52 0.00 0.00 55.73 54.10 1pwl s ARG 3 Cb 0.13 -0.88 -0.02 0.00 0.52 0.00 0.00 34.95 34.69 1pwl s ARG 3 CO 0.65 0.16 -0.25 -1.50 0.02 0.00 0.00 175.30 174.39 1pwl s ILE 4 N -2.29 2.16 -0.03 1.52 2.07 0.03 -4.87 121.20 119.80 1pwl s ILE 4 Ca 0.10 -1.06 -0.30 0.00 -1.41 0.00 0.00 60.65 57.98 1pwl s ILE 4 Cb -0.04 -1.76 -0.04 0.00 0.13 0.00 0.00 42.46 40.76 1pwl s ILE 4 CO 0.03 0.58 1.20 -0.22 -1.91 0.00 0.00 174.94 174.62 1pwl s LEU 5 N -0.59 4.30 0.46 8.50 2.96 -1.26 -0.71 118.68 132.33 1pwl s LEU 5 Ca 0.09 1.85 0.01 0.00 -0.22 0.00 0.00 54.13 55.87 1pwl s LEU 5 Cb -0.10 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 43.03 1pwl s LEU 5 CO -0.01 -0.56 0.67 -0.76 -1.32 0.00 0.00 176.35 174.37 1pwl s LEU 6 N 1.99 3.61 0.00 -0.68 1.43 0.30 -4.97 118.68 120.36 1pwl s LEU 6 Ca 0.56 0.16 0.00 0.00 -1.03 0.00 0.00 54.13 53.83 1pwl s LEU 6 Cb -0.26 -3.05 0.00 0.00 0.03 0.00 0.00 46.19 42.91 1pwl s LEU 6 CO 0.23 -0.76 0.65 -0.46 0.23 0.00 0.00 176.35 176.25 1pwl n ASN 7 N -2.08 0.63 -0.65 2.29 0.23 -1.26 -1.74 115.26 112.69 1pwl n ASN 7 Ca 0.03 -1.93 0.06 0.00 -0.53 0.00 0.00 54.58 52.21 1pwl n ASN 7 Cb 0.58 -0.32 0.13 0.00 -2.08 0.00 0.00 39.78 38.09 1pwl n ASN 7 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1pwl n ASN 8 N -0.16 2.68 0.00 0.53 6.94 -1.26 -4.99 115.26 119.00 1pwl n ASN 8 Ca 0.00 -1.82 0.00 0.00 -0.02 0.00 0.00 54.58 52.74 1pwl n ASN 8 Cb 0.16 -0.16 0.00 0.00 -2.36 0.00 0.00 39.78 37.41 1pwl n ASN 8 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1pwl n GLY 9 N 0.68 1.25 3.90 4.83 0.00 -0.71 -5.04 105.19 110.10 1pwl n GLY 9 Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 1pwl n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pwl s ALA 10 N -3.18 3.48 -0.17 4.61 0.00 -1.26 -4.84 121.76 120.40 1pwl s ALA 10 Ca 0.00 -0.51 -0.05 0.00 0.00 0.00 0.00 51.96 51.40 1pwl s ALA 10 Cb 0.00 -2.49 -0.03 0.00 0.00 0.00 0.00 23.12 20.60 1pwl s ALA 10 CO 0.00 -0.11 -0.01 0.15 0.00 0.00 0.00 175.76 175.79 1pwl s LYS 11 N -4.25 3.72 -0.21 0.00 1.02 -1.26 -0.54 119.74 118.23 1pwl s LYS 11 Ca 0.46 -0.49 -0.06 0.00 0.02 0.00 0.00 55.97 55.91 1pwl s LYS 11 Cb -0.10 -3.00 -0.03 0.00 -0.52 0.00 0.00 37.83 34.18 1pwl s LYS 11 CO 0.38 0.21 0.02 1.41 -0.92 0.00 0.00 175.35 176.45 1pwl s MET 12 N 0.47 3.67 0.30 1.68 -2.45 0.11 -4.87 119.30 118.21 1pwl s MET 12 Ca -0.02 -0.49 -0.30 0.00 -1.25 0.00 0.00 55.69 53.63 1pwl s MET 12 Cb -0.14 -3.14 -0.11 0.00 1.25 0.00 0.00 34.83 32.69 1pwl s MET 12 CO 0.02 0.01 1.55 -2.14 1.05 0.00 0.00 175.02 175.51 1pwl s PRO 13 N 1.03 4.15 0.30 4.11 0.02 -1.26 -0.79 135.00 142.56 1pwl s PRO 13 Ca 0.03 2.52 0.26 0.00 0.02 0.00 0.00 61.00 63.82 1pwl s PRO 13 Cb -0.14 -3.03 0.89 0.00 0.02 0.00 0.00 34.50 32.24 1pwl s PRO 13 CO 0.02 -0.57 1.76 -0.84 -0.33 0.00 0.00 177.00 177.04 1pwl h ILE 14 N 3.36 0.00 -3.22 2.83 3.07 -1.35 -3.41 117.51 118.79 1pwl h ILE 14 Ca -0.47 -0.45 -0.67 0.00 1.55 0.00 0.00 64.86 64.81 1pwl h ILE 14 Cb 1.22 1.35 -0.33 0.00 -0.27 0.00 0.00 36.82 38.80 1pwl h ILE 14 CO 0.77 0.00 -0.85 -0.22 -1.05 0.00 0.00 178.15 176.80 1pwl s LEU 15 N -4.94 2.23 0.29 0.16 2.96 -1.26 -0.45 118.68 117.68 1pwl s LEU 15 Ca 0.07 -0.56 0.04 0.00 -0.22 0.00 0.00 54.13 53.45 1pwl s LEU 15 Cb 0.10 -1.49 -0.06 0.00 0.50 0.00 0.00 46.19 45.24 1pwl s LEU 15 CO 0.52 0.08 0.03 -0.83 -1.32 0.00 0.00 176.35 174.82 1pwl s GLY 16 N 0.84 1.87 -0.26 7.98 0.00 -0.41 -4.34 107.32 113.01 1pwl s GLY 16 Ca -0.06 -1.94 -0.14 0.00 0.00 0.00 0.00 44.72 42.59 1pwl s GLY 16 CO -0.02 -1.76 0.31 -2.27 0.00 0.00 0.00 173.10 169.35 1pwl s LEU 17 N -3.42 4.06 0.52 0.66 2.96 -0.21 -3.31 118.68 119.95 1pwl s LEU 17 Ca 0.33 0.23 -0.17 0.00 -0.22 0.00 0.00 54.13 54.30 1pwl s LEU 17 Cb 0.07 -2.33 -0.07 0.00 0.50 0.00 0.00 46.19 44.36 1pwl s LEU 17 CO 0.13 -0.10 1.01 -0.83 -1.32 0.00 0.00 176.35 175.23 1pwl s GLY 18 N 1.50 2.16 0.00 7.98 0.00 -0.53 -0.86 107.32 117.57 1pwl s GLY 18 Ca 0.13 0.30 0.00 0.00 0.00 0.00 0.00 44.72 45.15 1pwl s GLY 18 CO 0.09 0.59 0.46 -1.30 0.00 0.00 0.00 173.10 172.94 1pwl n THR 19 N -1.54 0.17 -2.04 0.90 -2.24 -1.15 -4.21 114.28 104.18 1pwl n THR 19 Ca 0.07 -0.22 -0.42 0.00 -2.27 0.00 0.00 64.05 61.21 1pwl n THR 19 Cb 0.54 1.18 -0.03 0.00 -2.10 0.00 0.00 70.33 69.91 1pwl n THR 19 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1pwl s TRP 20 N -0.17 2.31 0.00 4.78 -0.00 -1.26 -2.40 118.94 122.19 1pwl s TRP 20 Ca 0.00 0.38 0.00 0.00 -0.00 0.00 0.00 56.10 56.48 1pwl s TRP 20 Cb 0.00 -3.86 0.00 0.00 -0.00 0.00 0.00 33.47 29.61 1pwl s TRP 20 CO 0.00 -3.50 0.00 1.63 -0.00 0.00 0.00 176.95 175.08 1pwl n LYS 21 N 6.32 0.00 -2.06 5.86 5.02 -1.26 -4.99 118.16 127.05 1pwl n LYS 21 Ca 0.16 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 56.05 1pwl n LYS 21 Cb 0.42 -2.53 -0.03 0.00 -0.02 0.00 0.00 35.03 32.88 1pwl n LYS 21 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1pwl s SER 22 N -2.58 5.58 0.55 4.39 0.01 -1.01 -4.95 113.70 115.70 1pwl s SER 22 Ca 0.00 0.71 -0.20 0.00 1.31 0.00 0.00 55.95 57.76 1pwl s SER 22 Cb 0.00 -2.53 -0.05 0.00 0.21 0.00 0.00 66.02 63.65 1pwl s SER 22 CO 0.00 -2.06 1.22 -2.84 0.41 0.00 0.00 173.24 169.96 1pwl s PRO 23 N 6.38 3.20 0.38 12.44 0.02 -1.26 -4.58 135.00 151.57 1pwl s PRO 23 Ca 0.71 1.87 0.15 0.00 0.02 0.00 0.00 61.00 63.75 1pwl s PRO 23 Cb -0.16 -2.09 1.02 0.00 0.02 0.00 0.00 34.50 33.29 1pwl s PRO 23 CO 0.26 -1.04 1.79 -1.35 -0.33 0.00 0.00 177.00 176.33 1pwl h PRO 24 N 1.25 0.46 0.00 5.54 0.11 -1.92 0.28 132.00 137.72 1pwl h PRO 24 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1pwl h PRO 24 Cb 1.28 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1pwl h PRO 24 CO 0.57 0.31 0.00 0.41 -0.21 0.00 0.00 178.00 179.07 1pwl n GLY 25 N -1.44 -1.18 0.00 -0.55 0.00 -1.26 -3.70 105.19 97.06 1pwl n GLY 25 Ca 0.24 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1pwl n GLY 25 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1pwl n GLN 26 N -1.44 1.02 0.15 1.61 6.02 0.74 -4.83 117.38 120.64 1pwl n GLN 26 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.06 1pwl n GLN 26 Cb 0.23 -0.91 0.19 0.00 1.02 0.00 0.00 30.24 30.77 1pwl n GLN 26 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.06 175.81 1pwl h VAL 27 N 0.00 1.29 -0.23 5.09 3.04 -0.94 -2.48 116.25 122.03 1pwl h VAL 27 Ca 0.00 -2.04 -0.00 0.00 -1.01 0.00 0.00 66.70 63.65 1pwl h VAL 27 Cb 0.00 2.13 -0.01 0.00 -2.01 0.00 0.00 31.29 31.40 1pwl h VAL 27 CO 0.00 0.56 0.14 0.74 -1.01 0.00 0.00 177.57 178.00 1pwl h THR 28 N 0.00 1.09 -0.58 3.17 2.02 -1.75 -0.92 112.91 115.94 1pwl h THR 28 Ca -0.01 -0.22 -0.06 0.00 0.77 0.00 0.00 66.41 66.90 1pwl h THR 28 Cb 1.09 0.82 -0.03 0.00 -1.74 0.00 0.00 68.15 68.29 1pwl h THR 28 CO 0.07 0.09 0.13 -0.33 0.37 0.00 0.00 175.52 175.85 1pwl h GLU 29 N 0.29 0.90 -0.40 6.66 3.07 -1.89 -1.57 114.58 121.64 1pwl h GLU 29 Ca 0.08 -0.20 0.01 0.00 -0.50 0.00 0.00 59.36 58.75 1pwl h GLU 29 Cb 0.02 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 27.78 1pwl h GLU 29 CO -0.02 0.82 0.26 0.00 -1.40 0.00 0.00 179.01 178.67 1pwl h ALA 30 N 1.27 0.51 -0.36 3.43 0.00 -0.97 -0.56 119.26 122.59 1pwl h ALA 30 Ca 0.18 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.93 1pwl h ALA 30 Cb 0.33 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1pwl h ALA 30 CO 0.00 -0.04 -0.34 0.28 0.00 0.00 0.00 179.25 179.15 1pwl h VAL 31 N 0.54 1.28 -0.20 0.00 2.07 -0.99 -0.26 116.25 118.68 1pwl h VAL 31 Ca 0.15 -1.50 0.01 0.00 0.82 0.00 0.00 66.70 66.18 1pwl h VAL 31 Cb -0.05 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1pwl h VAL 31 CO -0.04 0.50 0.10 0.11 0.02 0.00 0.00 177.57 178.26 1pwl h LYS 32 N 0.68 0.21 -0.46 1.57 1.57 -0.98 -0.63 116.57 118.54 1pwl h LYS 32 Ca 0.07 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 1pwl h LYS 32 Cb 0.90 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.14 1pwl h LYS 32 CO 0.08 0.14 0.17 0.28 -0.57 0.00 0.00 179.45 179.55 1pwl h VAL 33 N 0.22 1.21 -0.29 0.50 2.07 -0.98 -1.38 116.25 117.60 1pwl h VAL 33 Ca 0.08 -0.67 0.05 0.00 0.82 0.00 0.00 66.70 66.97 1pwl h VAL 33 Cb 0.01 0.79 -0.05 0.00 -1.52 0.00 0.00 31.29 30.53 1pwl h VAL 33 CO -0.05 0.25 0.00 0.00 0.02 0.00 0.00 177.57 177.79 1pwl h ALA 34 N 1.02 0.26 -0.62 1.67 0.00 -0.77 -0.97 119.26 119.85 1pwl h ALA 34 Ca 0.15 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1pwl h ALA 34 Cb 0.22 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1pwl h ALA 34 CO -0.01 -0.41 0.40 0.82 0.00 0.00 0.00 179.25 180.06 1pwl h ILE 35 N 0.09 1.16 -0.83 0.00 2.04 -0.92 -0.28 117.51 118.77 1pwl h ILE 35 Ca 0.14 -0.31 0.05 0.00 1.00 0.00 0.00 64.86 65.74 1pwl h ILE 35 Cb 0.19 0.26 -0.05 0.00 -0.74 0.00 0.00 36.82 36.48 1pwl h ILE 35 CO -0.24 0.16 0.54 0.44 0.00 0.00 0.00 178.15 179.06 1pwl h ASP 36 N 0.84 0.84 -0.05 1.72 3.32 -0.50 -2.58 116.42 120.01 1pwl h ASP 36 Ca 0.23 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 1pwl h ASP 36 Cb -0.08 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.28 1pwl h ASP 36 CO -0.05 0.56 0.00 1.33 -1.72 0.00 0.00 179.24 179.36 1pwl n VAL 37 N -4.47 0.04 0.00 -1.35 0.24 -0.44 -4.94 118.33 107.42 1pwl n VAL 37 Ca 0.12 -0.37 0.00 0.00 -2.04 0.00 0.00 64.34 62.05 1pwl n VAL 37 Cb 0.16 0.85 0.00 0.00 -1.47 0.00 0.00 33.84 33.38 1pwl n VAL 37 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1pwl n GLY 38 N 1.25 1.09 3.77 7.63 0.00 -0.80 -5.05 105.19 113.08 1pwl n GLY 38 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1pwl n GLY 38 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1pwl s TYR 39 N -1.64 2.86 0.00 1.61 1.51 -0.18 -4.89 117.35 116.61 1pwl s TYR 39 Ca 0.00 1.27 0.00 0.00 -1.01 0.00 0.00 57.07 57.33 1pwl s TYR 39 Cb 0.00 -3.84 0.00 0.00 -0.11 0.00 0.00 41.96 38.01 1pwl s TYR 39 CO 0.00 -2.41 0.19 0.54 -1.11 0.00 0.00 175.55 172.76 1pwl n ARG 40 N 0.82 1.18 -4.71 -0.62 5.12 -1.26 -4.24 116.66 112.95 1pwl n ARG 40 Ca 0.01 -0.19 -0.33 0.00 -1.93 0.00 0.00 57.85 55.42 1pwl n ARG 40 Cb 0.41 -0.62 -0.16 0.00 -1.16 0.00 0.00 32.46 30.93 1pwl n ARG 40 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1pwl s HIS 41 N -0.22 2.69 -0.10 -1.55 2.46 -1.26 0.13 115.29 117.44 1pwl s HIS 41 Ca 0.00 -1.21 0.03 0.00 0.47 0.00 0.00 55.06 54.35 1pwl s HIS 41 Cb 0.00 -1.82 0.01 0.00 -0.13 0.00 0.00 32.58 30.64 1pwl s HIS 41 CO 0.00 -0.54 -0.19 0.42 -2.47 0.00 0.00 174.74 171.96 1pwl s ILE 42 N 0.74 1.71 -0.31 0.89 1.01 -0.80 -1.05 121.20 123.40 1pwl s ILE 42 Ca -0.08 -0.79 -0.12 0.00 0.00 0.00 0.00 60.65 59.65 1pwl s ILE 42 Cb -0.16 -1.52 -0.03 0.00 0.01 0.00 0.00 42.46 40.76 1pwl s ILE 42 CO 0.00 0.48 0.22 -0.62 0.00 0.00 0.00 174.94 175.03 1pwl s ASP 43 N 0.66 6.05 0.41 3.58 2.15 -0.04 -1.72 116.67 127.76 1pwl s ASP 43 Ca -0.13 -0.20 0.05 0.00 0.43 0.00 0.00 52.55 52.71 1pwl s ASP 43 Cb -0.16 -2.13 -0.07 0.00 -0.30 0.00 0.00 42.92 40.26 1pwl s ASP 43 CO 0.03 -0.15 0.02 0.00 -0.17 0.00 0.00 175.17 174.91 1pwl s ALA 45 N -2.86 -1.89 0.29 0.00 0.00 -1.26 -3.79 121.76 112.25 1pwl s ALA 45 Ca 0.31 1.63 -0.01 0.00 0.00 0.00 0.00 51.96 53.88 1pwl s ALA 45 Cb 0.08 -0.74 0.47 0.00 0.00 0.00 0.00 23.12 22.93 1pwl s ALA 45 CO 0.15 -0.31 1.91 1.25 0.00 0.00 0.00 175.76 178.76 1pwl h HIS 46 N 3.24 1.11 0.00 0.00 -0.00 -1.98 -1.75 115.15 115.77 1pwl h HIS 46 Ca -0.23 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.16 1pwl h HIS 46 Cb 1.16 -0.37 0.00 0.00 -0.00 0.00 0.00 27.41 28.20 1pwl h HIS 46 CO 0.33 0.59 0.00 -0.24 -0.00 0.00 0.00 177.93 178.61 1pwl h VAL 47 N 1.10 0.00 0.00 5.26 3.04 -1.96 -2.36 116.25 121.33 1pwl h VAL 47 Ca 0.40 -0.22 0.00 0.00 -1.01 0.00 0.00 66.70 65.86 1pwl h VAL 47 Cb 0.15 0.98 0.00 0.00 -2.01 0.00 0.00 31.29 30.41 1pwl h VAL 47 CO -0.15 0.00 0.00 -1.22 -1.01 0.00 0.00 177.57 175.19 1pwl n TYR 48 N -2.50 0.34 -1.97 3.17 4.01 -0.66 -4.91 117.16 114.64 1pwl n TYR 48 Ca 0.01 0.11 -0.15 0.00 -0.16 0.00 0.00 57.90 57.70 1pwl n TYR 48 Cb 0.19 -0.68 -0.03 0.00 -0.31 0.00 0.00 39.34 38.51 1pwl n TYR 48 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1pwl n GLN 49 N -1.79 -1.16 -0.10 -0.72 6.02 -0.89 -4.72 117.38 114.03 1pwl n GLN 49 Ca 0.05 0.85 0.00 0.00 -0.01 0.00 0.00 57.00 57.90 1pwl n GLN 49 Cb 0.31 -5.12 0.00 0.00 1.02 0.00 0.00 30.24 26.45 1pwl n GLN 49 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1pwl n ASN 50 N -0.74 0.00 0.08 1.08 0.23 -1.26 -4.80 115.26 109.85 1pwl n ASN 50 Ca -0.17 -1.20 0.02 0.00 -0.53 0.00 0.00 54.58 52.70 1pwl n ASN 50 Cb 0.59 -0.04 0.37 0.00 -2.08 0.00 0.00 39.78 38.61 1pwl n ASN 50 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1pwl h GLU 51 N 0.00 0.32 -0.72 -3.83 5.08 -1.88 -1.62 114.58 111.93 1pwl h GLU 51 Ca 0.00 -0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1pwl h GLU 51 Cb 1.08 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.24 1pwl h GLU 51 CO 0.00 0.42 0.47 -0.97 -1.00 0.00 0.00 179.01 177.93 1pwl h ASN 52 N 0.31 0.80 0.65 1.42 -0.73 -1.90 0.19 115.58 116.31 1pwl h ASN 52 Ca 0.07 -0.01 -0.17 0.00 1.87 0.00 0.00 56.30 58.05 1pwl h ASN 52 Cb 0.35 -0.19 -0.02 0.00 0.27 0.00 0.00 38.32 38.73 1pwl h ASN 52 CO 0.02 0.57 -0.77 -0.33 -0.37 0.00 0.00 177.43 176.54 1pwl h GLU 53 N 0.94 0.09 -0.28 6.67 3.07 -1.68 -1.02 114.58 122.37 1pwl h GLU 53 Ca 0.27 -0.09 -0.00 0.00 -0.50 0.00 0.00 59.36 59.04 1pwl h GLU 53 Cb -0.07 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 27.85 1pwl h GLU 53 CO -0.07 0.82 0.16 0.28 -1.40 0.00 0.00 179.01 178.80 1pwl h VAL 54 N 0.06 1.11 -0.89 3.13 2.07 -1.08 -2.94 116.25 117.72 1pwl h VAL 54 Ca -0.02 -0.28 0.03 0.00 0.82 0.00 0.00 66.70 67.25 1pwl h VAL 54 Cb 1.36 0.79 -0.05 0.00 -1.52 0.00 0.00 31.29 31.86 1pwl h VAL 54 CO 0.11 0.11 0.58 1.23 0.02 0.00 0.00 177.57 179.62 1pwl h GLY 55 N 0.35 1.26 0.48 2.17 0.00 -0.48 -1.80 103.07 105.05 1pwl h GLY 55 Ca 0.10 -0.44 0.07 0.00 0.00 0.00 0.00 47.33 47.05 1pwl h GLY 55 CO -0.02 0.40 0.09 -2.08 0.00 0.00 0.00 176.54 174.93 1pwl h VAL 56 N 1.13 0.78 -0.19 4.60 2.07 -1.11 0.01 116.25 123.54 1pwl h VAL 56 Ca 0.35 -0.08 -0.02 0.00 0.82 0.00 0.00 66.70 67.77 1pwl h VAL 56 Cb -0.02 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1pwl h VAL 56 CO -0.10 0.04 0.05 0.00 0.02 0.00 0.00 177.57 177.59 1pwl h ALA 57 N 1.32 0.25 -0.47 1.67 0.00 -1.22 -1.56 119.26 119.26 1pwl h ALA 57 Ca 0.21 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1pwl h ALA 57 Cb 0.25 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1pwl h ALA 57 CO -0.27 -0.12 0.30 0.82 0.00 0.00 0.00 179.25 179.99 1pwl h ILE 58 N 0.12 1.13 -0.59 0.00 2.04 -1.10 -1.62 117.51 117.49 1pwl h ILE 58 Ca 0.06 -0.26 0.01 0.00 1.00 0.00 0.00 64.86 65.67 1pwl h ILE 58 Cb 0.25 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 1pwl h ILE 58 CO -0.00 0.13 0.39 -0.61 0.00 0.00 0.00 178.15 178.06 1pwl h GLN 59 N 0.64 0.76 -0.04 2.37 4.15 -0.85 -0.53 115.11 121.61 1pwl h GLN 59 Ca 0.17 -0.05 -0.18 0.00 0.77 0.00 0.00 58.65 59.37 1pwl h GLN 59 Cb -0.05 -0.17 0.01 0.00 0.21 0.00 0.00 27.48 27.48 1pwl h GLN 59 CO -0.04 0.50 -0.67 1.49 -1.93 0.00 0.00 178.83 178.19 1pwl h GLU 60 N 0.78 0.53 -0.10 1.69 4.81 -0.79 -0.40 114.58 121.11 1pwl h GLU 60 Ca 0.22 -0.51 -0.16 0.00 -0.13 0.00 0.00 59.36 58.78 1pwl h GLU 60 Cb -0.07 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1pwl h GLU 60 CO -0.05 1.14 -0.61 0.87 -0.73 0.00 0.00 179.01 179.63 1pwl h LYS 61 N 0.11 0.35 -0.52 1.92 1.79 -0.89 -0.49 116.57 118.84 1pwl h LYS 61 Ca -0.07 -0.24 -0.01 0.00 -2.18 0.00 0.00 60.65 58.14 1pwl h LYS 61 Cb 1.34 0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 32.01 1pwl h LYS 61 CO 0.13 0.85 0.28 -0.07 -1.08 0.00 0.00 179.45 179.57 1pwl h LEU 62 N 0.26 0.66 -1.01 2.94 3.38 -1.00 -1.95 115.31 118.59 1pwl h LEU 62 Ca -0.01 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.77 1pwl h LEU 62 Cb 1.14 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1pwl h LEU 62 CO 0.10 0.57 -0.31 -0.09 0.09 0.00 0.00 178.44 178.80 1pwl h ARG 63 N 0.70 0.33 0.00 1.13 2.43 -0.59 -2.15 114.38 116.23 1pwl h ARG 63 Ca 0.18 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1pwl h ARG 63 Cb 0.06 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1pwl h ARG 63 CO -0.03 0.61 0.00 0.39 -1.51 0.00 0.00 179.97 179.43 1pwl n GLU 64 N -4.10 0.10 -2.09 0.20 1.02 -0.23 -4.91 120.64 110.63 1pwl n GLU 64 Ca -0.01 0.06 -0.09 0.00 -0.02 0.00 0.00 57.16 57.10 1pwl n GLU 64 Cb 0.42 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.33 1pwl n GLU 64 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1pwl n GLN 65 N -1.44 -0.72 0.10 3.49 6.02 -0.81 -4.94 117.38 119.09 1pwl n GLN 65 Ca 0.08 0.47 -0.15 0.00 -0.01 0.00 0.00 57.00 57.39 1pwl n GLN 65 Cb 0.27 -4.47 -0.12 0.00 1.02 0.00 0.00 30.24 26.94 1pwl n GLN 65 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1pwl h VAL 66 N 0.00 1.50 -3.64 5.09 2.07 -1.59 -3.47 116.25 116.20 1pwl h VAL 66 Ca -0.21 -2.99 -0.10 0.00 0.82 0.00 0.00 66.70 64.22 1pwl h VAL 66 Cb 1.11 2.87 -0.16 0.00 -1.52 0.00 0.00 31.29 33.60 1pwl h VAL 66 CO 0.26 0.87 -0.36 0.68 0.02 0.00 0.00 177.57 179.04 1pwl s VAL 67 N -2.74 0.12 0.21 2.57 -7.23 -1.25 -5.07 120.40 107.01 1pwl s VAL 67 Ca -0.04 -0.99 0.07 0.00 -1.81 0.00 0.00 61.98 59.20 1pwl s VAL 67 Cb 0.07 -1.12 -0.04 0.00 0.56 0.00 0.00 36.38 35.86 1pwl s VAL 67 CO 0.88 -0.55 0.11 -1.59 -0.31 0.00 0.00 175.10 173.64 1pwl s LYS 68 N -3.20 2.75 0.27 4.82 -2.85 -1.26 -4.37 119.74 115.90 1pwl s LYS 68 Ca -0.00 -1.04 -0.02 0.00 -1.00 0.00 0.00 55.97 53.91 1pwl s LYS 68 Cb 0.02 -2.51 0.43 0.00 -2.06 0.00 0.00 37.83 33.71 1pwl s LYS 68 CO -0.07 0.44 1.88 -0.09 0.10 0.00 0.00 175.35 177.60 1pwl h ARG 69 N 2.10 1.13 0.00 1.78 9.65 -1.97 -1.32 114.38 125.74 1pwl h ARG 69 Ca -0.47 -0.07 -0.00 0.00 -1.10 0.00 0.00 59.98 58.33 1pwl h ARG 69 Cb 1.22 -0.25 -0.00 0.00 -1.39 0.00 0.00 29.97 29.54 1pwl h ARG 69 CO 0.61 0.74 -0.02 0.93 2.80 0.00 0.00 179.97 185.04 1pwl h GLU 70 N 1.16 0.00 0.00 0.20 3.07 -2.03 -1.83 114.58 115.14 1pwl h GLU 70 Ca 0.44 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.30 1pwl h GLU 70 Cb 0.21 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.12 1pwl h GLU 70 CO -0.18 0.02 -0.31 0.39 -1.40 0.00 0.00 179.01 177.52 1pwl n GLU 71 N -3.23 0.25 -3.41 2.33 1.02 -0.50 -4.86 120.64 112.24 1pwl n GLU 71 Ca -0.02 0.13 -0.30 0.00 -0.02 0.00 0.00 57.16 56.96 1pwl n GLU 71 Cb 0.15 -1.72 -0.04 0.00 -0.02 0.00 0.00 31.44 29.81 1pwl n GLU 71 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1pwl s LEU 72 N -4.24 4.12 -0.33 -4.62 1.43 -0.69 -4.84 118.68 109.52 1pwl s LEU 72 Ca 0.09 0.74 0.00 0.00 -1.03 0.00 0.00 54.13 53.93 1pwl s LEU 72 Cb 0.13 -3.53 0.10 0.00 0.03 0.00 0.00 46.19 42.93 1pwl s LEU 72 CO 0.66 -0.13 0.11 0.12 0.23 0.00 0.00 176.35 177.33 1pwl s PHE 73 N -1.96 2.03 -0.22 0.29 2.19 0.12 -4.95 117.98 115.49 1pwl s PHE 73 Ca 0.44 -2.00 -0.07 0.00 0.33 0.00 0.00 56.93 55.63 1pwl s PHE 73 Cb -0.11 -1.91 -0.03 0.00 -1.31 0.00 0.00 43.02 39.66 1pwl s PHE 73 CO 0.27 -0.88 0.06 0.42 1.83 0.00 0.00 175.22 176.93 1pwl s ILE 74 N 1.37 4.52 -0.09 3.12 -1.09 -1.26 -1.90 121.20 125.87 1pwl s ILE 74 Ca 0.11 -0.12 0.01 0.00 -2.23 0.00 0.00 60.65 58.43 1pwl s ILE 74 Cb -0.18 -3.07 -0.02 0.00 -1.58 0.00 0.00 42.46 37.60 1pwl s ILE 74 CO -0.20 0.39 -0.12 -0.69 -1.23 0.00 0.00 174.94 173.10 1pwl s VAL 75 N 1.02 3.24 0.27 2.92 1.01 -0.70 -1.35 120.40 126.82 1pwl s VAL 75 Ca 0.04 -0.63 0.05 0.00 0.00 0.00 0.00 61.98 61.44 1pwl s VAL 75 Cb -0.14 -2.32 -0.02 0.00 0.00 0.00 0.00 36.38 33.90 1pwl s VAL 75 CO 0.03 0.56 0.19 -0.24 0.00 0.00 0.00 175.10 175.64 1pwl n SER 76 N 2.78 -0.06 -3.81 3.32 2.88 -0.82 -0.75 113.62 117.17 1pwl n SER 76 Ca -0.18 -2.69 -0.12 0.00 -1.33 0.00 0.00 58.87 54.55 1pwl n SER 76 Cb 0.52 1.15 -0.12 0.00 -0.75 0.00 0.00 64.21 65.01 1pwl n SER 76 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1pwl s LYS 77 N -3.09 0.19 -0.24 -1.46 1.02 -1.25 -1.18 119.74 113.74 1pwl s LYS 77 Ca 0.27 0.24 -0.29 0.00 0.02 0.00 0.00 55.97 56.21 1pwl s LYS 77 Cb 0.01 0.09 -0.00 0.00 -0.52 0.00 0.00 37.83 37.41 1pwl s LYS 77 CO 0.19 -0.03 1.20 -1.17 -0.92 0.00 0.00 175.35 174.62 1pwl s LEU 78 N 0.13 4.04 0.67 3.17 2.96 0.46 -3.86 118.68 126.25 1pwl s LEU 78 Ca -0.00 1.40 -0.12 0.00 -0.22 0.00 0.00 54.13 55.19 1pwl s LEU 78 Cb -0.02 -3.54 -0.00 0.00 0.50 0.00 0.00 46.19 43.13 1pwl s LEU 78 CO -0.00 -0.85 1.06 0.86 -1.32 0.00 0.00 176.35 176.10 1pwl s TRP 79 N 3.71 3.08 0.53 5.38 -0.11 -1.26 -2.08 118.94 128.19 1pwl s TRP 79 Ca 0.52 1.44 0.20 0.00 1.22 0.00 0.00 56.10 59.48 1pwl s TRP 79 Cb -0.18 -2.91 1.40 0.00 -1.50 0.00 0.00 33.47 30.29 1pwl s TRP 79 CO 0.15 -1.21 2.16 0.00 -4.62 0.00 0.00 176.95 173.43 1pwl n THR 81 N -4.27 0.00 -1.43 0.00 -2.24 -1.26 -0.63 114.28 104.46 1pwl n THR 81 Ca -0.03 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.83 1pwl n THR 81 Cb 0.12 -0.41 0.18 0.00 -2.10 0.00 0.00 70.33 68.12 1pwl n THR 81 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1pwl n TYR 82 N -0.88 0.00 0.24 4.78 4.01 -0.65 -4.17 117.16 120.50 1pwl n TYR 82 Ca 0.17 -1.27 0.13 0.00 -0.16 0.00 0.00 57.90 56.77 1pwl n TYR 82 Cb 0.08 -0.21 0.45 0.00 -0.31 0.00 0.00 39.34 39.35 1pwl n TYR 82 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1pwl h HIS 83 N 0.61 0.00 -3.12 -0.72 3.86 -1.71 -3.33 115.15 110.73 1pwl h HIS 83 Ca -0.00 0.00 -0.56 0.00 -1.16 0.00 0.00 60.37 58.65 1pwl h HIS 83 Cb 1.02 0.00 0.09 0.00 1.06 0.00 0.00 27.41 29.59 1pwl h HIS 83 CO 0.46 0.10 0.69 0.39 0.86 0.00 0.00 177.93 180.43 1pwl n GLU 84 N -3.19 2.33 -0.20 2.45 4.71 -1.26 -4.47 120.64 121.00 1pwl n GLU 84 Ca 0.01 0.82 0.11 0.00 -0.01 0.00 0.00 57.16 58.10 1pwl n GLU 84 Cb 0.43 -2.51 0.42 0.00 -1.01 0.00 0.00 31.44 28.76 1pwl n GLU 84 CO 0.00 0.00 0.00 1.57 0.09 0.00 0.00 177.13 178.79 1pwl h LYS 85 N 3.91 0.58 0.00 3.49 2.10 -1.87 0.65 116.57 125.43 1pwl h LYS 85 Ca -0.46 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.15 1pwl h LYS 85 Cb 1.26 -0.13 0.00 0.00 -0.90 0.00 0.00 32.23 32.46 1pwl h LYS 85 CO 0.73 0.39 0.00 0.41 -2.00 0.00 0.00 179.45 178.97 1pwl n GLY 86 N -1.47 -1.07 0.00 0.07 0.00 -1.26 -3.27 105.19 98.20 1pwl n GLY 86 Ca 0.14 -0.09 0.08 0.00 0.00 0.00 0.00 46.02 46.14 1pwl n GLY 86 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1pwl n LEU 87 N -1.36 0.30 -0.02 0.99 4.77 0.21 -4.72 117.00 117.17 1pwl n LEU 87 Ca 0.08 -0.21 -0.12 0.00 -0.03 0.00 0.00 56.01 55.74 1pwl n LEU 87 Cb 0.19 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.22 1pwl n LEU 87 CO 0.17 0.07 0.81 0.58 -1.33 0.00 0.00 177.39 177.70 1pwl h VAL 88 N 0.00 1.16 -0.42 4.08 2.07 -1.51 -2.21 116.25 119.43 1pwl h VAL 88 Ca 0.00 -0.49 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 1pwl h VAL 88 Cb 0.56 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 1pwl h VAL 88 CO 0.00 0.14 0.23 0.50 0.02 0.00 0.00 177.57 178.47 1pwl h LYS 89 N -0.03 0.57 -0.84 1.57 3.64 -1.84 -1.13 116.57 118.50 1pwl h LYS 89 Ca 0.03 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1pwl h LYS 89 Cb 0.20 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 31.86 1pwl h LYS 89 CO -0.00 0.45 0.54 0.78 -2.27 0.00 0.00 179.45 178.95 1pwl h GLY 90 N 0.54 1.20 1.02 5.01 0.00 -1.83 0.54 103.07 109.54 1pwl h GLY 90 Ca 0.15 -0.46 -0.07 0.00 0.00 0.00 0.00 47.33 46.95 1pwl h GLY 90 CO -0.02 0.45 0.09 0.00 0.00 0.00 0.00 176.54 177.06 1pwl h ALA 91 N 1.45 0.76 -0.35 3.60 0.00 -0.94 -0.27 119.26 123.51 1pwl h ALA 91 Ca 0.31 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1pwl h ALA 91 Cb -0.11 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1pwl h ALA 91 CO -0.06 0.51 0.11 0.00 0.00 0.00 0.00 179.25 179.80 1pwl h GLN 93 N 0.42 0.23 -0.28 0.00 4.20 -0.72 0.07 115.11 119.03 1pwl h GLN 93 Ca 0.11 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 1pwl h GLN 93 Cb 0.26 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 1pwl h GLN 93 CO -0.00 0.43 0.09 -0.22 -0.67 0.00 0.00 178.83 178.45 1pwl h LYS 94 N 0.21 0.44 -0.43 1.46 1.63 -0.86 0.41 116.57 119.42 1pwl h LYS 94 Ca 0.04 -0.09 0.03 0.00 -0.85 0.00 0.00 60.65 59.77 1pwl h LYS 94 Cb 0.48 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 32.01 1pwl h LYS 94 CO 0.03 0.50 0.24 1.15 -3.45 0.00 0.00 179.45 177.92 1pwl h THR 95 N 0.30 1.02 -0.55 1.00 2.02 -0.94 0.32 112.91 116.06 1pwl h THR 95 Ca 0.09 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 67.10 1pwl h THR 95 Cb 0.24 0.49 -0.03 0.00 -1.74 0.00 0.00 68.15 67.11 1pwl h THR 95 CO -0.00 0.09 0.33 -0.07 0.37 0.00 0.00 175.52 176.24 1pwl h LEU 96 N 0.48 0.67 -0.42 2.58 3.38 -0.77 0.09 115.31 121.32 1pwl h LEU 96 Ca 0.18 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 1pwl h LEU 96 Cb 0.04 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1pwl h LEU 96 CO -0.10 0.53 0.19 -1.28 0.09 0.00 0.00 178.44 177.87 1pwl h SER 97 N 0.75 0.56 -0.50 -0.43 0.87 -0.59 0.22 113.55 114.44 1pwl h SER 97 Ca 0.20 -0.14 -0.02 0.00 -1.23 0.00 0.00 61.79 60.60 1pwl h SER 97 Cb -0.01 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 61.78 1pwl h SER 97 CO -0.04 0.55 0.24 0.44 -0.53 0.00 0.00 176.83 177.49 1pwl h ASP 98 N 0.54 0.66 0.68 6.23 3.32 -0.68 -2.27 116.42 124.89 1pwl h ASP 98 Ca 0.14 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1pwl h ASP 98 Cb 0.15 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.53 1pwl h ASP 98 CO -0.02 0.61 0.00 0.18 -1.72 0.00 0.00 179.24 178.29 1pwl n LEU 99 N -4.60 0.00 -2.80 1.55 4.77 -0.00 -3.92 117.00 112.00 1pwl n LEU 99 Ca 0.02 0.43 -0.20 0.00 -0.03 0.00 0.00 56.01 56.23 1pwl n LEU 99 Cb 0.12 -0.43 0.04 0.00 -2.33 0.00 0.00 43.42 40.81 1pwl n LEU 99 CO 0.37 -0.09 0.02 0.29 -1.33 0.00 0.00 177.39 176.65 1pwl n LYS 100 N -1.43 -4.73 -4.31 3.23 4.01 -0.04 -4.39 118.16 110.49 1pwl n LYS 100 Ca 0.07 0.82 -0.24 0.00 -0.51 0.00 0.00 58.31 58.45 1pwl n LYS 100 Cb 0.24 -5.52 -0.08 0.00 -0.51 0.00 0.00 35.03 29.16 1pwl n LYS 100 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1pwl s LEU 101 N -6.15 3.06 0.00 -0.35 1.43 -0.54 -4.99 118.68 111.13 1pwl s LEU 101 Ca 0.30 -0.67 0.18 0.00 -1.03 0.00 0.00 54.13 52.91 1pwl s LEU 101 Cb -0.13 -1.63 -0.03 0.00 0.03 0.00 0.00 46.19 44.43 1pwl s LEU 101 CO 0.37 0.04 0.91 0.47 0.23 0.00 0.00 176.35 178.36 1pwl n ASP 102 N -0.57 1.63 -3.56 2.29 8.00 -1.26 -4.51 116.55 118.56 1pwl n ASP 102 Ca -0.08 -1.32 -0.12 0.00 0.71 0.00 0.00 54.79 53.99 1pwl n ASP 102 Cb 0.58 0.55 -0.04 0.00 -0.02 0.00 0.00 41.12 42.18 1pwl n ASP 102 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1pwl s TYR 103 N -2.17 -0.36 -0.01 1.24 -0.85 -1.26 -4.75 117.35 109.19 1pwl s TYR 103 Ca 0.14 0.20 -0.02 0.00 -0.52 0.00 0.00 57.07 56.87 1pwl s TYR 103 Cb 0.14 0.36 -0.04 0.00 0.38 0.00 0.00 41.96 42.81 1pwl s TYR 103 CO 0.50 -0.71 0.14 -0.51 -1.52 0.00 0.00 175.55 173.44 1pwl s LEU 104 N -2.48 4.16 0.23 -3.49 1.43 -0.53 -4.99 118.68 113.01 1pwl s LEU 104 Ca -0.01 0.26 0.04 0.00 -1.03 0.00 0.00 54.13 53.39 1pwl s LEU 104 Cb 0.00 -2.46 0.23 0.00 0.03 0.00 0.00 46.19 44.00 1pwl s LEU 104 CO -0.08 0.27 1.55 0.44 0.23 0.00 0.00 176.35 178.75 1pwl h ASP 105 N 3.95 0.29 -3.58 2.29 3.32 -1.56 -0.08 116.42 121.06 1pwl h ASP 105 Ca -0.49 -0.17 -0.11 0.00 0.02 0.00 0.00 57.03 56.28 1pwl h ASP 105 Cb 1.19 -0.08 -0.25 0.00 0.22 0.00 0.00 39.33 40.40 1pwl h ASP 105 CO 0.66 0.83 -0.22 -0.22 -1.72 0.00 0.00 179.24 178.56 1pwl s LEU 106 N -7.93 0.07 -0.07 1.55 2.96 -1.11 -2.61 118.68 111.54 1pwl s LEU 106 Ca -0.04 0.93 0.02 0.00 -0.22 0.00 0.00 54.13 54.81 1pwl s LEU 106 Cb 0.12 1.50 0.02 0.00 0.50 0.00 0.00 46.19 48.33 1pwl s LEU 106 CO 0.80 -0.17 -0.11 -0.47 -1.32 0.00 0.00 176.35 175.08 1pwl s TYR 107 N 0.78 1.41 0.05 5.38 5.04 -0.59 -1.94 117.35 127.49 1pwl s TYR 107 Ca -0.04 -0.56 0.06 0.00 -2.44 0.00 0.00 57.07 54.09 1pwl s TYR 107 Cb -0.05 -1.07 -0.04 0.00 0.35 0.00 0.00 41.96 41.15 1pwl s TYR 107 CO -0.06 -0.32 -0.10 -0.51 -1.34 0.00 0.00 175.55 173.22 1pwl s LEU 108 N 0.90 3.01 -0.26 6.97 1.43 -0.32 -1.40 118.68 129.01 1pwl s LEU 108 Ca -0.10 -0.30 -0.29 0.00 -1.03 0.00 0.00 54.13 52.41 1pwl s LEU 108 Cb -0.15 -1.78 -0.01 0.00 0.03 0.00 0.00 46.19 44.28 1pwl s LEU 108 CO 0.01 0.23 1.39 -0.63 0.23 0.00 0.00 176.35 177.58 1pwl s ILE 109 N -1.08 4.02 0.18 -0.59 1.01 -0.39 -0.41 121.20 123.94 1pwl s ILE 109 Ca 0.19 1.16 -0.11 0.00 0.00 0.00 0.00 60.65 61.89 1pwl s ILE 109 Cb -0.11 -4.01 0.08 0.00 0.01 0.00 0.00 42.46 38.44 1pwl s ILE 109 CO 0.10 -0.39 1.72 -0.74 0.00 0.00 0.00 174.94 175.63 1pwl h HIS 110 N 9.59 0.99 -4.01 3.97 2.76 -1.70 -1.09 115.15 125.66 1pwl h HIS 110 Ca -0.28 -0.09 -0.14 0.00 -2.20 0.00 0.00 60.37 57.66 1pwl h HIS 110 Cb 1.11 -0.29 -0.18 0.00 1.55 0.00 0.00 27.41 29.61 1pwl h HIS 110 CO 0.88 0.81 -0.63 -1.58 -1.30 0.00 0.00 177.93 176.11 1pwl s TRP 111 N -5.44 0.33 -0.86 5.26 0.52 -1.25 -4.35 118.94 113.15 1pwl s TRP 111 Ca -0.13 -0.72 0.20 0.00 0.02 0.00 0.00 56.10 55.47 1pwl s TRP 111 Cb 0.13 -0.24 0.81 0.00 -1.15 0.00 0.00 33.47 33.02 1pwl s TRP 111 CO 0.81 -0.32 1.61 -0.35 0.02 0.00 0.00 176.95 178.72 1pwl n PRO 112 N 0.77 0.06 -3.07 4.98 -0.04 -1.26 -4.72 135.00 131.71 1pwl n PRO 112 Ca -0.19 0.25 -0.41 0.00 -0.04 0.00 0.00 63.50 63.12 1pwl n PRO 112 Cb 0.58 -1.60 -0.06 0.00 -0.04 0.00 0.00 33.50 32.38 1pwl n PRO 112 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1pwl s THR 113 N -3.08 4.97 0.09 0.52 -1.32 -1.26 -4.73 115.64 110.82 1pwl s THR 113 Ca 0.08 1.23 -0.23 0.00 -1.21 0.00 0.00 61.69 61.56 1pwl s THR 113 Cb 0.11 -3.97 -0.07 0.00 -1.51 0.00 0.00 72.50 67.06 1pwl s THR 113 CO 0.36 0.03 0.68 -0.83 -2.21 0.00 0.00 174.62 172.64 1pwl s GLY 114 N 1.38 2.77 0.17 6.08 0.00 -1.26 -4.63 107.32 111.82 1pwl s GLY 114 Ca 0.28 0.19 0.08 0.00 0.00 0.00 0.00 44.72 45.27 1pwl s GLY 114 CO 0.09 0.76 -0.05 -1.36 0.00 0.00 0.00 173.10 172.53 1pwl s PHE 115 N -0.80 2.74 0.06 1.90 0.08 0.20 -1.34 117.98 120.83 1pwl s PHE 115 Ca 0.33 -0.17 -0.37 0.00 0.12 0.00 0.00 56.93 56.84 1pwl s PHE 115 Cb -0.21 -1.35 -0.17 0.00 -0.57 0.00 0.00 43.02 40.73 1pwl s PHE 115 CO 0.22 0.50 1.33 1.17 -0.10 0.00 0.00 175.22 178.34 1pwl n LYS 116 N 0.06 1.04 -1.91 0.44 4.81 0.04 -4.17 118.16 118.48 1pwl n LYS 116 Ca -0.11 0.38 -0.35 0.00 -0.87 0.00 0.00 58.31 57.36 1pwl n LYS 116 Cb 0.55 -2.01 0.04 0.00 0.02 0.00 0.00 35.03 33.63 1pwl n LYS 116 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1pwl s PRO 117 N 0.55 2.88 0.00 1.64 0.04 -1.26 -4.77 135.00 134.07 1pwl s PRO 117 Ca 0.86 1.65 0.00 0.00 0.04 0.00 0.00 61.00 63.55 1pwl s PRO 117 Cb -0.99 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 31.62 1pwl s PRO 117 CO 0.48 -1.24 0.00 0.41 0.04 0.00 0.00 177.00 176.69 1pwl n GLY 118 N 0.14 -0.51 0.12 0.56 0.00 -1.26 -4.97 105.19 99.28 1pwl n GLY 118 Ca 0.12 -1.62 -0.01 0.00 0.00 0.00 0.00 46.02 44.51 1pwl n GLY 118 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pwl h LYS 119 N 3.65 0.00 -6.50 1.61 1.79 -1.99 -3.44 116.57 111.70 1pwl h LYS 119 Ca 0.00 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 57.94 1pwl h LYS 119 Cb 0.00 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1pwl h LYS 119 CO 0.00 0.67 0.48 -2.00 -1.08 0.00 0.00 179.45 177.53 1pwl s GLU 120 N -3.34 4.51 0.34 3.15 2.56 -1.26 -4.93 118.70 119.72 1pwl s GLU 120 Ca -0.00 1.65 0.13 0.00 0.00 0.00 0.00 54.97 56.75 1pwl s GLU 120 Cb 0.11 -3.37 0.61 0.00 2.00 0.00 0.00 34.13 33.49 1pwl s GLU 120 CO 0.76 -0.12 1.74 0.74 -0.56 0.00 0.00 175.26 177.83 1pwl h PHE 121 N 6.45 0.00 -2.60 5.30 0.04 -1.96 -3.35 116.94 120.81 1pwl h PHE 121 Ca -0.42 0.00 -0.60 0.00 2.80 0.00 0.00 57.97 59.75 1pwl h PHE 121 Cb 1.22 0.00 -0.41 0.00 2.20 0.00 0.00 35.95 38.96 1pwl h PHE 121 CO 0.66 0.45 -0.72 1.19 -0.60 0.00 0.00 178.31 179.30 1pwl n PHE 122 N -3.90 2.09 -2.28 -0.55 3.01 -1.26 -4.75 117.46 109.84 1pwl n PHE 122 Ca -0.01 -3.99 -0.43 0.00 1.01 0.00 0.00 57.45 54.03 1pwl n PHE 122 Cb 0.49 -0.40 -0.02 0.00 -0.01 0.00 0.00 39.48 39.54 1pwl n PHE 122 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1pwl s PRO 123 N -1.37 4.23 0.11 -1.08 0.04 -1.26 -4.98 135.00 130.70 1pwl s PRO 123 Ca 0.31 1.86 0.09 0.00 0.04 0.00 0.00 61.00 63.30 1pwl s PRO 123 Cb 0.04 -3.80 -0.04 0.00 0.04 0.00 0.00 34.50 30.75 1pwl s PRO 123 CO -0.13 -0.72 -0.19 -0.51 0.04 0.00 0.00 177.00 175.49 1pwl s LEU 124 N 3.45 2.66 1.00 -3.56 1.43 -1.26 -0.86 118.68 121.54 1pwl s LEU 124 Ca 0.61 -0.57 -0.17 0.00 -1.03 0.00 0.00 54.13 52.98 1pwl s LEU 124 Cb -0.26 -1.51 0.23 0.00 0.03 0.00 0.00 46.19 44.67 1pwl s LEU 124 CO 0.21 0.18 1.35 1.51 0.23 0.00 0.00 176.35 179.84 1pwl s ASP 125 N -2.09 2.81 0.19 2.29 1.47 0.02 -4.87 116.67 116.48 1pwl s ASP 125 Ca 0.17 0.16 0.21 0.00 1.18 0.00 0.00 52.55 54.27 1pwl s ASP 125 Cb -0.11 -0.11 0.88 0.00 -0.34 0.00 0.00 42.92 43.25 1pwl s ASP 125 CO 0.09 -2.91 1.63 -0.62 0.68 0.00 0.00 175.17 174.04 1pwl n GLU 126 N -3.87 0.14 -0.31 2.11 1.02 -1.26 -1.79 120.64 116.68 1pwl n GLU 126 Ca 0.17 0.40 0.08 0.00 -0.02 0.00 0.00 57.16 57.79 1pwl n GLU 126 Cb 0.59 -1.78 0.24 0.00 -0.02 0.00 0.00 31.44 30.47 1pwl n GLU 126 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1pwl n SER 127 N -2.04 3.55 0.00 1.62 3.41 -1.26 -4.98 113.62 113.91 1pwl n SER 127 Ca 0.02 -2.13 0.00 0.00 -0.26 0.00 0.00 58.87 56.50 1pwl n SER 127 Cb 0.20 -0.38 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 1pwl n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pwl n GLY 128 N 0.87 0.73 3.80 5.00 0.00 -0.74 -5.05 105.19 109.79 1pwl n GLY 128 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 1pwl n GLY 128 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1pwl s ASN 129 N -2.33 7.16 0.43 1.61 0.01 -1.26 -4.61 114.94 115.95 1pwl s ASN 129 Ca 0.00 1.42 -0.25 0.00 -0.71 0.00 0.00 52.86 53.32 1pwl s ASN 129 Cb 0.00 -2.42 -0.08 0.00 0.41 0.00 0.00 41.25 39.16 1pwl s ASN 129 CO 0.00 0.18 1.34 0.54 -1.51 0.00 0.00 177.10 177.65 1pwl s VAL 130 N -1.24 2.45 -0.37 1.60 0.11 -0.40 -0.80 120.40 121.75 1pwl s VAL 130 Ca 0.35 0.39 -0.20 0.00 -2.93 0.00 0.00 61.98 59.60 1pwl s VAL 130 Cb -0.20 -3.23 0.00 0.00 -1.53 0.00 0.00 36.38 31.43 1pwl s VAL 130 CO 0.22 0.05 0.59 -0.69 -3.33 0.00 0.00 175.10 171.94 1pwl s VAL 131 N -1.26 4.93 0.84 2.04 1.01 -0.04 -4.81 120.40 123.12 1pwl s VAL 131 Ca 0.59 0.40 -0.12 0.00 0.00 0.00 0.00 61.98 62.86 1pwl s VAL 131 Cb -0.39 -4.05 0.09 0.00 0.00 0.00 0.00 36.38 32.03 1pwl s VAL 131 CO 0.50 -0.32 1.10 -2.84 0.00 0.00 0.00 175.10 173.54 1pwl s PRO 132 N 2.60 1.74 0.22 2.72 0.02 -1.26 -0.78 135.00 140.25 1pwl s PRO 132 Ca 0.22 0.69 0.06 0.00 0.02 0.00 0.00 61.00 61.99 1pwl s PRO 132 Cb -0.15 -1.87 -0.04 0.00 0.02 0.00 0.00 34.50 32.46 1pwl s PRO 132 CO 0.15 -1.88 0.16 -1.54 -0.33 0.00 0.00 177.00 173.56 1pwl s SER 133 N -3.73 5.44 -0.09 2.53 1.04 -0.45 -3.61 113.70 114.84 1pwl s SER 133 Ca 0.62 -0.23 0.03 0.00 0.48 0.00 0.00 55.95 56.85 1pwl s SER 133 Cb -0.16 -1.38 0.23 0.00 0.10 0.00 0.00 66.02 64.82 1pwl s SER 133 CO 0.55 0.01 0.98 -0.90 0.98 0.00 0.00 173.24 174.86 1pwl n ASP 134 N -0.82 2.64 -4.78 7.02 5.68 -1.26 -4.75 116.55 120.28 1pwl n ASP 134 Ca -0.08 -2.33 -0.31 0.00 -0.50 0.00 0.00 54.79 51.56 1pwl n ASP 134 Cb 0.57 -0.57 0.07 0.00 -1.14 0.00 0.00 41.12 40.05 1pwl n ASP 134 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1pwl s THR 135 N -1.38 3.51 0.09 2.12 -4.23 -1.26 -5.08 115.64 109.41 1pwl s THR 135 Ca 0.16 0.53 0.02 0.00 -1.18 0.00 0.00 61.69 61.22 1pwl s THR 135 Cb 0.13 -3.08 -0.04 0.00 1.34 0.00 0.00 72.50 70.85 1pwl s THR 135 CO 0.04 -0.61 -0.07 0.54 -0.54 0.00 0.00 174.62 173.99 1pwl s ASN 136 N -3.36 1.08 0.21 3.99 2.20 -1.26 -4.82 114.94 112.98 1pwl s ASN 136 Ca 0.61 -0.92 -0.10 0.00 -0.94 0.00 0.00 52.86 51.51 1pwl s ASN 136 Cb -0.17 0.08 0.18 0.00 -2.00 0.00 0.00 41.25 39.35 1pwl s ASN 136 CO 0.53 -0.42 1.86 0.40 -2.94 0.00 0.00 177.10 176.53 1pwl h ILE 137 N 3.26 1.12 -0.40 0.54 2.04 -1.98 -2.17 117.51 119.93 1pwl h ILE 137 Ca -0.35 -0.31 -0.14 0.00 1.00 0.00 0.00 64.86 65.05 1pwl h ILE 137 Cb 1.17 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 1pwl h ILE 137 CO 0.60 0.17 -0.31 -0.07 0.00 0.00 0.00 178.15 178.53 1pwl h LEU 138 N 0.90 0.93 -0.51 1.44 3.38 -1.97 0.47 115.31 119.95 1pwl h LEU 138 Ca 0.28 -0.39 -0.15 0.00 0.09 0.00 0.00 57.88 57.71 1pwl h LEU 138 Cb -0.02 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 1pwl h LEU 138 CO -0.09 1.16 -0.43 0.44 0.09 0.00 0.00 178.44 179.61 1pwl h ASP 139 N 0.75 0.78 -0.76 -0.43 3.32 -1.94 -1.54 116.42 116.60 1pwl h ASP 139 Ca 0.08 -0.37 -0.03 0.00 0.02 0.00 0.00 57.03 56.73 1pwl h ASP 139 Cb 0.88 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 40.18 1pwl h ASP 139 CO 0.08 1.11 0.35 0.74 -1.72 0.00 0.00 179.24 179.80 1pwl h THR 140 N 0.59 1.25 -0.61 0.35 2.02 -1.15 -2.12 112.91 113.23 1pwl h THR 140 Ca 0.04 -0.71 0.01 0.00 0.77 0.00 0.00 66.41 66.52 1pwl h THR 140 Cb 0.99 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.67 1pwl h THR 140 CO 0.09 0.30 0.40 -0.25 0.37 0.00 0.00 175.52 176.43 1pwl h TRP 141 N 1.08 0.76 -0.70 3.16 2.91 -0.71 -1.20 115.95 121.25 1pwl h TRP 141 Ca 0.26 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.30 1pwl h TRP 141 Cb 0.14 -0.26 -0.03 0.00 -0.51 0.00 0.00 29.16 28.50 1pwl h TRP 141 CO 0.01 0.48 0.45 0.00 -1.03 0.00 0.00 178.44 178.35 1pwl h ALA 142 N 1.23 1.49 -0.26 2.65 0.00 -0.99 -0.16 119.26 123.21 1pwl h ALA 142 Ca 0.23 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 1pwl h ALA 142 Cb -0.08 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 1pwl h ALA 142 CO -0.05 0.47 -0.30 0.00 0.00 0.00 0.00 179.25 179.36 1pwl h ALA 143 N 1.55 0.98 -0.81 0.00 0.00 -0.70 -2.65 119.26 117.63 1pwl h ALA 143 Ca 0.26 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1pwl h ALA 143 Cb -0.10 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 1pwl h ALA 143 CO -0.05 0.60 0.43 0.52 0.00 0.00 0.00 179.25 180.75 1pwl h MET 144 N 0.47 1.15 -0.71 0.00 2.07 -0.12 -2.75 114.93 115.03 1pwl h MET 144 Ca 0.06 -0.14 0.01 0.00 -2.07 0.00 0.00 59.70 57.55 1pwl h MET 144 Cb 0.76 -0.22 -0.04 0.00 -1.87 0.00 0.00 31.60 30.24 1pwl h MET 144 CO 0.06 0.86 0.47 0.93 1.07 0.00 0.00 176.91 180.30 1pwl h GLU 145 N 1.14 0.93 -0.16 1.72 5.08 -0.74 -1.37 114.58 121.18 1pwl h GLU 145 Ca 0.28 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.58 1pwl h GLU 145 Cb 0.06 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 1pwl h GLU 145 CO -0.04 0.62 0.07 1.49 -1.00 0.00 0.00 179.01 180.15 1pwl h GLU 146 N 0.96 0.21 -0.52 2.33 4.81 -1.17 -1.97 114.58 119.23 1pwl h GLU 146 Ca 0.26 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.42 1pwl h GLU 146 Cb -0.11 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.20 1pwl h GLU 146 CO -0.06 0.17 0.10 -0.07 -0.73 0.00 0.00 179.01 178.42 1pwl h LEU 147 N 0.21 0.75 -0.15 1.64 3.38 -1.23 -0.88 115.31 119.05 1pwl h LEU 147 Ca 0.06 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 1pwl h LEU 147 Cb 0.03 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 1pwl h LEU 147 CO -0.01 0.76 -0.02 0.58 0.09 0.00 0.00 178.44 179.84 1pwl h VAL 148 N 0.77 1.28 0.00 1.22 2.07 -1.35 -1.44 116.25 118.80 1pwl h VAL 148 Ca 0.17 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.74 1pwl h VAL 148 Cb 0.32 1.60 -0.00 0.00 -1.52 0.00 0.00 31.29 31.70 1pwl h VAL 148 CO 0.00 0.27 -0.04 0.44 0.02 0.00 0.00 177.57 178.26 1pwl h ASP 149 N -0.02 0.00 0.04 0.57 3.32 -1.03 -1.71 116.42 117.58 1pwl h ASP 149 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1pwl h ASP 149 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1pwl h ASP 149 CO 0.01 0.04 -0.12 -0.62 -1.72 0.00 0.00 179.24 176.84 1pwl n GLU 150 N -3.83 1.58 -0.89 3.56 1.02 -0.37 -4.97 120.64 116.75 1pwl n GLU 150 Ca -0.03 -1.09 0.00 0.00 -0.02 0.00 0.00 57.16 56.02 1pwl n GLU 150 Cb 0.14 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.08 1pwl n GLU 150 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1pwl n GLY 151 N 1.28 0.63 0.12 0.62 0.00 -0.64 -4.92 105.19 102.28 1pwl n GLY 151 Ca 0.15 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.14 1pwl n GLY 151 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1pwl h LEU 152 N 0.00 0.02 -7.85 0.99 4.07 -1.51 -3.45 115.31 107.58 1pwl h LEU 152 Ca 0.00 -0.01 -0.20 0.00 0.08 0.00 0.00 57.88 57.75 1pwl h LEU 152 Cb 0.00 -0.01 -0.24 0.00 1.08 0.00 0.00 40.66 41.49 1pwl h LEU 152 CO 0.00 0.74 -0.69 0.68 -1.08 0.00 0.00 178.44 178.08 1pwl s VAL 153 N -3.37 0.06 -0.09 1.22 -7.23 -1.18 -1.45 120.40 108.35 1pwl s VAL 153 Ca -0.01 -0.47 0.15 0.00 -1.81 0.00 0.00 61.98 59.83 1pwl s VAL 153 Cb 0.12 -0.16 -0.10 0.00 0.56 0.00 0.00 36.38 36.80 1pwl s VAL 153 CO 0.78 -0.26 1.02 0.11 -0.31 0.00 0.00 175.10 176.44 1pwl h LYS 154 N 5.33 0.00 -3.15 4.82 1.79 -1.13 -3.37 116.57 120.87 1pwl h LYS 154 Ca -0.28 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 58.08 1pwl h LYS 154 Cb 1.21 0.00 -0.18 0.00 -1.58 0.00 0.00 32.23 31.67 1pwl h LYS 154 CO 0.45 0.45 -0.26 0.00 -1.08 0.00 0.00 179.45 179.01 1pwl s ALA 155 N -2.87 -0.75 0.16 3.86 0.00 -1.07 -4.95 121.76 116.14 1pwl s ALA 155 Ca -0.01 0.19 0.08 0.00 0.00 0.00 0.00 51.96 52.22 1pwl s ALA 155 Cb 0.08 0.19 -0.04 0.00 0.00 0.00 0.00 23.12 23.36 1pwl s ALA 155 CO 0.80 -0.33 -0.18 0.96 0.00 0.00 0.00 175.76 177.00 1pwl s ILE 156 N -1.91 1.80 0.00 0.00 -4.36 -1.26 -1.54 121.20 113.93 1pwl s ILE 156 Ca -0.09 -1.89 0.00 0.00 -0.26 0.00 0.00 60.65 58.40 1pwl s ILE 156 Cb -0.03 -1.82 0.00 0.00 1.25 0.00 0.00 42.46 41.86 1pwl s ILE 156 CO 0.01 -0.30 0.00 0.61 0.24 0.00 0.00 174.94 175.49 1pwl n GLY 157 N 0.34 2.47 3.28 6.27 0.00 -0.50 -0.88 105.19 116.17 1pwl n GLY 157 Ca -0.14 -0.93 -0.15 0.00 0.00 0.00 0.00 46.02 44.80 1pwl n GLY 157 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1pwl s ILE 158 N -2.95 0.74 -0.11 -0.61 -4.36 -0.31 -1.26 121.20 112.33 1pwl s ILE 158 Ca 0.00 -2.00 -0.09 0.00 -0.26 0.00 0.00 60.65 58.30 1pwl s ILE 158 Cb 0.00 -2.31 0.03 0.00 1.25 0.00 0.00 42.46 41.43 1pwl s ILE 158 CO 0.00 -0.31 0.28 -0.55 0.24 0.00 0.00 174.94 174.59 1pwl s SER 159 N -3.24 -0.29 -1.50 4.36 0.15 -0.41 -1.35 113.70 111.41 1pwl s SER 159 Ca 0.29 0.56 0.00 0.00 0.70 0.00 0.00 55.95 57.50 1pwl s SER 159 Cb 0.06 0.55 0.00 0.00 -1.71 0.00 0.00 66.02 64.92 1pwl s SER 159 CO 0.08 -0.11 0.00 0.59 1.20 0.00 0.00 173.24 175.00 1pwl n ASN 160 N 3.15 -5.03 -4.76 5.45 3.02 -0.31 -3.91 115.26 112.87 1pwl n ASN 160 Ca -0.15 0.04 -0.38 0.00 -0.03 0.00 0.00 54.58 54.06 1pwl n ASN 160 Cb 0.57 -4.11 -0.06 0.00 -0.61 0.00 0.00 39.78 35.57 1pwl n ASN 160 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1pwl s PHE 161 N -2.83 3.61 0.85 3.10 0.40 -1.26 -4.51 117.98 117.34 1pwl s PHE 161 Ca 0.00 0.98 -0.12 0.00 -0.60 0.00 0.00 56.93 57.18 1pwl s PHE 161 Cb 0.00 -2.48 0.12 0.00 0.51 0.00 0.00 43.02 41.17 1pwl s PHE 161 CO 0.00 0.35 1.21 0.54 0.70 0.00 0.00 175.22 178.02 1pwl s ASN 162 N -0.07 4.05 0.38 1.36 2.20 -1.26 -4.80 114.94 116.80 1pwl s ASN 162 Ca 0.26 0.54 0.13 0.00 -0.94 0.00 0.00 52.86 52.85 1pwl s ASN 162 Cb -0.16 -0.89 0.75 0.00 -2.00 0.00 0.00 41.25 38.95 1pwl s ASN 162 CO 0.12 -2.16 1.83 1.12 -2.94 0.00 0.00 177.10 175.08 1pwl h HIS 163 N -1.20 0.00 -0.13 1.54 2.07 -1.92 -1.14 115.15 114.37 1pwl h HIS 163 Ca -0.45 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 56.96 1pwl h HIS 163 Cb 1.29 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.26 1pwl h HIS 163 CO -0.20 0.36 -0.42 -0.07 -3.07 0.00 0.00 177.93 174.53 1pwl h LEU 164 N 0.00 0.33 -0.34 6.12 3.38 -1.94 -0.50 115.31 122.36 1pwl h LEU 164 Ca -0.00 -0.14 -0.19 0.00 0.09 0.00 0.00 57.88 57.64 1pwl h LEU 164 Cb 0.65 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1pwl h LEU 164 CO 0.05 0.71 -0.59 1.56 0.09 0.00 0.00 178.44 180.26 1pwl h GLN 165 N 0.26 0.78 -0.27 1.13 4.20 -1.70 -1.30 115.11 118.21 1pwl h GLN 165 Ca 0.02 -0.51 0.00 0.00 0.06 0.00 0.00 58.65 58.22 1pwl h GLN 165 Cb 0.85 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.69 1pwl h GLN 165 CO 0.07 1.14 0.17 0.28 -0.67 0.00 0.00 178.83 179.82 1pwl h VAL 166 N 0.59 1.06 -0.96 -0.54 2.07 -1.13 -2.81 116.25 114.52 1pwl h VAL 166 Ca 0.00 -0.12 0.04 0.00 0.82 0.00 0.00 66.70 67.44 1pwl h VAL 166 Cb 1.18 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 31.57 1pwl h VAL 166 CO 0.12 0.06 0.63 -0.08 0.02 0.00 0.00 177.57 178.33 1pwl h GLU 167 N 0.35 1.17 -0.64 1.57 4.81 -0.92 -0.77 114.58 120.15 1pwl h GLU 167 Ca 0.10 -0.07 0.07 0.00 -0.13 0.00 0.00 59.36 59.32 1pwl h GLU 167 Cb -0.03 -0.26 -0.06 0.00 0.63 0.00 0.00 28.75 29.02 1pwl h GLU 167 CO -0.03 0.77 0.33 1.98 -0.73 0.00 0.00 179.01 181.34 1pwl h MET 168 N 1.21 0.59 -0.11 1.92 4.05 -0.98 0.09 114.93 121.71 1pwl h MET 168 Ca 0.39 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.76 1pwl h MET 168 Cb 0.03 -0.13 -0.00 0.00 -0.80 0.00 0.00 31.60 30.69 1pwl h MET 168 CO -0.12 0.39 0.01 0.82 0.23 0.00 0.00 176.91 178.24 1pwl h ILE 169 N 0.61 1.24 -0.51 1.77 2.04 -1.23 -3.05 117.51 118.39 1pwl h ILE 169 Ca 0.30 -0.75 0.10 0.00 1.00 0.00 0.00 64.86 65.50 1pwl h ILE 169 Cb 0.23 1.54 -0.03 0.00 -0.74 0.00 0.00 36.82 37.82 1pwl h ILE 169 CO -0.21 0.22 0.35 -0.07 0.00 0.00 0.00 178.15 178.44 1pwl h LEU 170 N -0.08 0.25 -1.21 1.44 3.38 -0.70 -1.91 115.31 116.49 1pwl h LEU 170 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1pwl h LEU 170 Cb 0.33 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1pwl h LEU 170 CO 0.00 0.15 0.00 0.59 0.09 0.00 0.00 178.44 179.28 1pwl n ASN 171 N -4.46 1.83 -4.64 -0.43 3.02 -0.02 -4.90 115.26 105.65 1pwl n ASN 171 Ca 0.08 -1.70 -0.42 0.00 -0.03 0.00 0.00 54.58 52.50 1pwl n ASN 171 Cb 0.38 -0.09 -0.03 0.00 -0.61 0.00 0.00 39.78 39.43 1pwl n ASN 171 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1pwl s LYS 172 N -1.81 3.90 0.21 3.52 2.20 -0.72 -4.89 119.74 122.16 1pwl s LYS 172 Ca 0.34 2.34 -0.09 0.00 -0.36 0.00 0.00 55.97 58.20 1pwl s LYS 172 Cb 0.19 -4.17 0.28 0.00 -1.51 0.00 0.00 37.83 32.61 1pwl s LYS 172 CO 0.28 -1.21 1.79 -1.35 -0.36 0.00 0.00 175.35 174.50 1pwl h PRO 173 N 11.38 0.58 -0.91 4.03 0.11 -1.91 -1.75 132.00 143.53 1pwl h PRO 173 Ca -0.45 -0.04 -0.21 0.00 0.11 0.00 0.00 66.00 65.42 1pwl h PRO 173 Cb 1.22 -0.13 -0.13 0.00 0.11 0.00 0.00 31.00 32.07 1pwl h PRO 173 CO 0.95 0.39 0.27 0.41 -0.21 0.00 0.00 178.00 179.80 1pwl n GLY 174 N -1.29 3.16 3.59 -0.55 0.00 -1.26 -4.97 105.19 103.88 1pwl n GLY 174 Ca 0.09 -0.64 -0.49 0.00 0.00 0.00 0.00 46.02 44.98 1pwl n GLY 174 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1pwl n LEU 175 N -0.20 1.77 -0.12 0.99 7.94 -0.66 -4.91 117.00 121.80 1pwl n LEU 175 Ca 0.30 1.13 -0.17 0.00 -1.11 0.00 0.00 56.01 56.16 1pwl n LEU 175 Cb 1.10 -1.24 -0.11 0.00 0.53 0.00 0.00 43.42 43.70 1pwl n LEU 175 CO 0.32 -1.12 -1.30 0.29 -1.11 0.00 0.00 177.39 174.47 1pwl n LYS 176 N 2.04 0.60 -4.17 1.96 4.76 -1.26 -4.97 118.16 117.12 1pwl n LYS 176 Ca 0.16 0.15 -0.20 0.00 -2.87 0.00 0.00 58.31 55.54 1pwl n LYS 176 Cb 0.24 -1.48 -0.16 0.00 -1.84 0.00 0.00 35.03 31.79 1pwl n LYS 176 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1pwl s TYR 177 N -2.48 0.75 0.48 2.13 2.02 -1.26 -5.14 117.35 113.84 1pwl s TYR 177 Ca -0.33 -0.21 -0.21 0.00 -0.37 0.00 0.00 57.07 55.95 1pwl s TYR 177 Cb 0.09 -0.66 -0.08 0.00 -0.40 0.00 0.00 41.96 40.91 1pwl s TYR 177 CO 0.55 -0.19 1.09 0.15 -1.57 0.00 0.00 175.55 175.59 1pwl s LYS 178 N 0.89 3.75 0.26 -0.62 1.02 -1.26 -4.98 119.74 118.81 1pwl s LYS 178 Ca -0.11 1.55 -0.31 0.00 0.02 0.00 0.00 55.97 57.11 1pwl s LYS 178 Cb -0.14 -2.23 -0.12 0.00 -0.52 0.00 0.00 37.83 34.82 1pwl s LYS 178 CO 0.00 -0.51 1.58 -0.35 -0.92 0.00 0.00 175.35 175.16 1pwl n PRO 179 N -0.77 2.57 0.05 -1.68 -0.04 -1.26 -4.84 135.00 129.02 1pwl n PRO 179 Ca 0.09 0.92 -0.09 0.00 -0.04 0.00 0.00 63.50 64.37 1pwl n PRO 179 Cb 0.51 -2.69 -0.13 0.00 -0.04 0.00 0.00 33.50 31.15 1pwl n PRO 179 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1pwl h ALA 180 N 5.08 0.41 -3.12 0.55 0.00 -1.38 -3.44 119.26 117.37 1pwl h ALA 180 Ca -0.46 -1.06 -0.17 0.00 0.00 0.00 0.00 54.91 53.22 1pwl h ALA 180 Cb 1.23 0.05 -0.24 0.00 0.00 0.00 0.00 17.79 18.84 1pwl h ALA 180 CO 0.82 1.29 -0.55 0.08 0.00 0.00 0.00 179.25 180.89 1pwl s VAL 181 N -2.67 0.04 -0.21 0.00 1.01 -1.26 -1.59 120.40 115.72 1pwl s VAL 181 Ca -0.02 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 61.62 1pwl s VAL 181 Cb 0.09 -0.29 0.03 0.00 0.00 0.00 0.00 36.38 36.21 1pwl s VAL 181 CO 0.83 -0.20 -0.16 0.21 0.00 0.00 0.00 175.10 175.79 1pwl s ASN 182 N -0.64 3.70 -0.29 3.32 2.47 -0.35 -1.17 114.94 122.00 1pwl s ASN 182 Ca -0.07 -0.93 -0.14 0.00 0.42 0.00 0.00 52.86 52.13 1pwl s ASN 182 Cb -0.04 -1.52 -0.03 0.00 -1.45 0.00 0.00 41.25 38.20 1pwl s ASN 182 CO 0.01 -0.08 0.35 -1.58 -3.72 0.00 0.00 177.10 172.08 1pwl s GLN 183 N 1.23 3.92 0.08 0.43 0.74 -0.46 -2.02 119.66 123.58 1pwl s GLN 183 Ca -0.00 -0.09 0.02 0.00 0.05 0.00 0.00 55.36 55.33 1pwl s GLN 183 Cb -0.16 -3.69 -0.04 0.00 1.10 0.00 0.00 33.01 30.23 1pwl s GLN 183 CO -0.09 -0.32 -0.07 0.96 -0.55 0.00 0.00 175.29 175.22 1pwl s ILE 184 N 2.03 0.64 0.28 -2.34 -4.36 -0.08 -1.16 121.20 116.20 1pwl s ILE 184 Ca 0.13 -1.70 -0.30 0.00 -0.26 0.00 0.00 60.65 58.53 1pwl s ILE 184 Cb -0.16 -1.39 -0.10 0.00 1.25 0.00 0.00 42.46 42.06 1pwl s ILE 184 CO 0.10 -0.74 1.43 -0.70 0.24 0.00 0.00 174.94 175.27 1pwl s GLU 185 N -3.23 4.26 -0.28 0.37 2.12 -1.26 -0.93 118.70 119.75 1pwl s GLU 185 Ca 0.06 2.32 -0.17 0.00 0.36 0.00 0.00 54.97 57.54 1pwl s GLU 185 Cb 0.01 -3.09 0.09 0.00 0.26 0.00 0.00 34.13 31.40 1pwl s GLU 185 CO -0.04 -0.40 0.74 0.00 -0.54 0.00 0.00 175.26 175.03 1pwl s HIS 187 N 1.51 0.02 0.67 0.00 -3.43 -0.90 -4.21 115.29 108.94 1pwl s HIS 187 Ca -0.09 -0.32 0.43 0.00 -0.80 0.00 0.00 55.06 54.28 1pwl s HIS 187 Cb -0.05 0.65 2.37 0.00 -1.43 0.00 0.00 32.58 34.12 1pwl s HIS 187 CO -0.18 -0.73 2.35 -1.35 -2.00 0.00 0.00 174.74 172.83 1pwl h PRO 188 N 2.00 0.00 -0.00 -0.38 0.11 -1.87 -1.01 132.00 130.85 1pwl h PRO 188 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1pwl h PRO 188 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1pwl h PRO 188 CO 0.33 0.00 -0.46 0.66 -0.21 0.00 0.00 178.00 178.31 1pwl n TYR 189 N -3.11 0.00 -3.17 0.65 4.01 -1.26 -1.32 117.16 112.95 1pwl n TYR 189 Ca -0.03 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.51 1pwl n TYR 189 Cb 0.09 -0.17 -0.06 0.00 -0.31 0.00 0.00 39.34 38.89 1pwl n TYR 189 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 1pwl n LEU 190 N -1.12 -1.28 0.07 7.72 7.94 -0.40 -1.23 117.00 128.70 1pwl n LEU 190 Ca 0.08 -3.99 0.13 0.00 -1.11 0.00 0.00 56.01 51.12 1pwl n LEU 190 Cb 0.35 0.63 0.42 0.00 0.53 0.00 0.00 43.42 45.35 1pwl n LEU 190 CO 0.32 1.92 0.82 0.35 -1.11 0.00 0.00 177.39 179.69 1pwl n THR 191 N 2.61 0.40 -3.26 1.96 -2.24 -1.11 -2.11 114.28 110.53 1pwl n THR 191 Ca 0.25 -0.20 -0.23 0.00 -2.27 0.00 0.00 64.05 61.59 1pwl n THR 191 Cb 0.51 -0.47 0.05 0.00 -2.10 0.00 0.00 70.33 68.32 1pwl n THR 191 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1pwl n GLN 192 N -2.03 -6.16 -0.16 -0.78 1.13 -1.26 -4.85 117.38 103.27 1pwl n GLN 192 Ca 0.06 0.88 -0.06 0.00 -1.94 0.00 0.00 57.00 55.94 1pwl n GLN 192 Cb 0.41 -5.83 0.03 0.00 0.11 0.00 0.00 30.24 24.96 1pwl n GLN 192 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 1pwl h GLU 193 N -1.93 0.57 -0.27 -1.09 3.07 -1.99 -0.35 114.58 112.58 1pwl h GLU 193 Ca -0.55 -0.03 -0.17 0.00 -0.50 0.00 0.00 59.36 58.11 1pwl h GLU 193 Cb 1.37 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 29.15 1pwl h GLU 193 CO 0.57 0.37 -0.48 0.87 -1.40 0.00 0.00 179.01 178.95 1pwl h LYS 194 N 0.58 0.80 -0.22 2.33 1.57 -1.99 -1.04 116.57 118.61 1pwl h LYS 194 Ca 0.20 -0.50 -0.16 0.00 -1.87 0.00 0.00 60.65 58.31 1pwl h LYS 194 Cb 0.02 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.38 1pwl h LYS 194 CO -0.09 1.13 -0.53 1.25 -0.57 0.00 0.00 179.45 180.64 1pwl h LEU 195 N 0.56 0.71 -0.31 2.94 5.85 -1.92 -0.99 115.31 122.16 1pwl h LEU 195 Ca 0.02 -0.37 -0.02 0.00 0.84 0.00 0.00 57.88 58.34 1pwl h LEU 195 Cb 1.08 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 1pwl h LEU 195 CO 0.11 1.11 0.11 0.40 -0.34 0.00 0.00 178.44 179.83 1pwl h ILE 196 N 0.50 1.19 -0.71 4.05 2.04 -1.03 -0.20 117.51 123.36 1pwl h ILE 196 Ca 0.01 -0.60 0.03 0.00 1.00 0.00 0.00 64.86 65.31 1pwl h ILE 196 Cb 1.09 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 38.13 1pwl h ILE 196 CO 0.11 0.20 0.44 1.56 0.00 0.00 0.00 178.15 180.46 1pwl h GLN 197 N 0.34 0.83 0.57 2.37 4.20 -1.04 0.33 115.11 122.72 1pwl h GLN 197 Ca 0.10 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 1pwl h GLN 197 Cb 0.21 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 27.80 1pwl h GLN 197 CO -0.01 0.55 -0.33 -0.92 -0.67 0.00 0.00 178.83 177.46 1pwl h TYR 198 N 0.86 -0.86 -0.51 2.96 3.20 -0.92 -1.25 116.97 120.44 1pwl h TYR 198 Ca 0.29 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.15 1pwl h TYR 198 Cb 0.03 0.30 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 1pwl h TYR 198 CO -0.04 -0.51 0.34 0.00 -1.64 0.00 0.00 178.16 176.31 1pwl h GLN 200 N 0.69 0.55 0.00 0.00 4.20 -0.92 -1.11 115.11 118.52 1pwl h GLN 200 Ca 0.19 -0.15 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 1pwl h GLN 200 Cb -0.07 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 27.65 1pwl h GLN 200 CO -0.05 0.64 -0.08 0.66 -0.67 0.00 0.00 178.83 179.32 1pwl h SER 201 N 0.51 0.00 -0.42 1.46 4.64 -0.68 -2.16 113.55 116.90 1pwl h SER 201 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1pwl h SER 201 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1pwl h SER 201 CO 0.02 0.08 0.00 0.29 -0.87 0.00 0.00 176.83 176.36 1pwl n LYS 202 N -3.41 2.44 -1.78 4.77 4.76 -0.52 -4.96 118.16 119.47 1pwl n LYS 202 Ca -0.01 -2.19 -0.08 0.00 -2.87 0.00 0.00 58.31 53.16 1pwl n LYS 202 Cb 0.24 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 31.91 1pwl n LYS 202 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1pwl n GLY 203 N 1.48 0.42 3.56 0.72 0.00 -0.81 -5.01 105.19 105.55 1pwl n GLY 203 Ca 0.20 -0.61 -0.35 0.00 0.00 0.00 0.00 46.02 45.26 1pwl n GLY 203 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pwl s ILE 204 N -2.35 4.48 0.18 -0.61 1.01 -0.60 -4.79 121.20 118.53 1pwl s ILE 204 Ca 0.00 -0.14 -0.30 0.00 0.00 0.00 0.00 60.65 60.22 1pwl s ILE 204 Cb 0.00 -3.03 -0.08 0.00 0.01 0.00 0.00 42.46 39.36 1pwl s ILE 204 CO 0.00 0.43 1.04 -0.69 0.00 0.00 0.00 174.94 175.72 1pwl s VAL 205 N 0.72 4.00 -0.18 2.92 1.01 -0.62 -3.73 120.40 124.51 1pwl s VAL 205 Ca 0.02 1.78 -0.08 0.00 0.00 0.00 0.00 61.98 63.70 1pwl s VAL 205 Cb -0.14 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.07 1pwl s VAL 205 CO 0.02 0.33 0.08 -0.69 0.00 0.00 0.00 175.10 174.84 1pwl s VAL 206 N -0.45 4.95 -0.18 2.92 1.01 -1.26 -1.20 120.40 126.19 1pwl s VAL 206 Ca 0.47 0.02 -0.07 0.00 0.00 0.00 0.00 61.98 62.40 1pwl s VAL 206 Cb -0.28 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.83 1pwl s VAL 206 CO 0.34 0.46 0.05 -0.89 0.00 0.00 0.00 175.10 175.06 1pwl s THR 207 N 0.33 4.63 -0.29 3.92 2.01 -0.86 -1.41 115.64 123.98 1pwl s THR 207 Ca 0.05 -0.09 -0.19 0.00 0.31 0.00 0.00 61.69 61.77 1pwl s THR 207 Cb -0.12 -3.08 -0.02 0.00 0.01 0.00 0.00 72.50 69.29 1pwl s THR 207 CO -0.00 0.46 0.57 0.00 -0.69 0.00 0.00 174.62 174.95 1pwl s ALA 208 N 0.42 3.56 0.36 7.40 0.00 0.10 -0.90 121.76 132.69 1pwl s ALA 208 Ca 0.02 -0.65 0.07 0.00 0.00 0.00 0.00 51.96 51.40 1pwl s ALA 208 Cb -0.13 -3.00 -0.01 0.00 0.00 0.00 0.00 23.12 19.99 1pwl s ALA 208 CO 0.01 -0.93 0.46 1.52 0.00 0.00 0.00 175.76 176.82 1pwl s TYR 209 N 2.45 2.99 -1.49 0.00 -0.85 -0.11 -2.84 117.35 117.49 1pwl s TYR 209 Ca 0.23 -0.29 -0.03 0.00 -0.52 0.00 0.00 57.07 56.45 1pwl s TYR 209 Cb -0.15 -2.07 0.03 0.00 0.38 0.00 0.00 41.96 40.15 1pwl s TYR 209 CO 0.11 -0.08 0.39 0.43 -1.52 0.00 0.00 175.55 174.87 1pwl n SER 210 N -1.64 -0.54 0.27 -0.18 7.64 -1.26 -2.07 113.62 115.84 1pwl n SER 210 Ca 0.02 -1.07 0.17 0.00 1.01 0.00 0.00 58.87 59.01 1pwl n SER 210 Cb 0.59 -2.68 0.73 0.00 -1.01 0.00 0.00 64.21 61.84 1pwl n SER 210 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1pwl h PRO 211 N -1.76 0.00 -0.26 1.43 0.13 -1.80 -1.10 132.00 128.64 1pwl h PRO 211 Ca -0.63 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 1pwl h PRO 211 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1pwl h PRO 211 CO 0.67 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.72 1pwl n LEU 212 N -3.01 2.74 0.00 1.56 4.77 -1.26 -4.80 117.00 116.99 1pwl n LEU 212 Ca 0.00 -1.13 0.00 0.00 -0.03 0.00 0.00 56.01 54.85 1pwl n LEU 212 Cb 0.27 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1pwl n LEU 212 CO 0.26 0.57 0.00 0.61 -1.33 0.00 0.00 177.39 177.49 1pwl n GLY 213 N 1.35 0.53 3.99 -0.72 0.00 -0.42 -4.24 105.19 105.68 1pwl n GLY 213 Ca 0.18 -0.37 -0.40 0.00 0.00 0.00 0.00 46.02 45.43 1pwl n GLY 213 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1pwl n SER 214 N 0.67 -3.75 0.30 1.61 2.88 -1.26 -4.83 113.62 109.24 1pwl n SER 214 Ca 0.00 -1.21 0.20 0.00 -1.33 0.00 0.00 58.87 56.54 1pwl n SER 214 Cb 0.00 -2.21 1.07 0.00 -0.75 0.00 0.00 64.21 62.33 1pwl n SER 214 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1pwl h PRO 215 N -2.32 0.00 -0.51 -1.46 0.13 -1.98 -1.27 132.00 124.58 1pwl h PRO 215 Ca -0.69 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.44 1pwl h PRO 215 Cb 1.39 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.52 1pwl h PRO 215 CO 0.53 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.90 1pwl n ASP 216 N -2.93 4.81 -4.61 1.44 5.75 -1.26 -4.94 116.55 114.81 1pwl n ASP 216 Ca -0.02 -2.75 -0.52 0.00 -0.01 0.00 0.00 54.79 51.49 1pwl n ASP 216 Cb 0.08 -0.59 -0.06 0.00 -1.03 0.00 0.00 41.12 39.52 1pwl n ASP 216 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1pwl n ARG 217 N 0.49 1.22 0.00 0.11 1.85 -0.48 -4.78 116.66 115.06 1pwl n ARG 217 Ca 0.25 0.44 0.00 0.00 -1.00 0.00 0.00 57.85 57.54 1pwl n ARG 217 Cb 0.98 -2.10 0.01 0.00 -1.05 0.00 0.00 32.46 30.31 1pwl n ARG 217 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 1pwl n PRO 218 N 2.93 0.00 -0.19 2.89 -0.04 -1.26 -1.47 135.00 137.86 1pwl n PRO 218 Ca 0.19 0.49 0.06 0.00 -0.04 0.00 0.00 63.50 64.20 1pwl n PRO 218 Cb 0.19 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.31 1pwl n PRO 218 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1pwl n TRP 219 N -1.50 0.50 -1.71 0.54 2.14 -1.26 -5.01 117.44 111.14 1pwl n TRP 219 Ca 0.00 -0.51 -0.40 0.00 2.07 0.00 0.00 57.50 58.65 1pwl n TRP 219 Cb 0.01 -0.04 0.02 0.00 -0.81 0.00 0.00 31.31 30.49 1pwl n TRP 219 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1pwl n ALA 220 N 0.50 1.34 -2.46 -1.67 0.00 -0.54 -5.02 120.51 112.66 1pwl n ALA 220 Ca 0.12 0.23 -0.31 0.00 0.00 0.00 0.00 53.44 53.49 1pwl n ALA 220 Cb 0.45 -2.28 -0.13 0.00 0.00 0.00 0.00 19.45 17.49 1pwl n ALA 220 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1pwl s LYS 221 N -2.34 2.13 0.53 0.00 -0.14 -1.26 -5.03 119.74 113.64 1pwl s LYS 221 Ca 0.63 -0.94 0.21 0.00 -1.36 0.00 0.00 55.97 54.50 1pwl s LYS 221 Cb -0.49 -2.21 1.42 0.00 -1.68 0.00 0.00 37.83 34.87 1pwl s LYS 221 CO 0.56 0.55 2.16 -1.00 -0.76 0.00 0.00 175.35 176.86 1pwl h PRO 222 N 4.64 0.00 -0.00 -1.68 0.13 -2.02 -0.88 132.00 132.19 1pwl h PRO 222 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1pwl h PRO 222 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1pwl h PRO 222 CO 0.48 0.03 -0.00 -0.85 -0.23 0.00 0.00 178.00 177.43 1pwl n GLU 223 N -4.24 0.65 -1.98 0.86 0.00 -1.26 -4.89 120.64 109.78 1pwl n GLU 223 Ca -0.03 -0.01 -0.37 0.00 0.00 0.00 0.00 57.16 56.76 1pwl n GLU 223 Cb 0.12 -1.50 0.03 0.00 0.00 0.00 0.00 31.44 30.09 1pwl n GLU 223 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1pwl s ASP 224 N -2.36 5.31 0.53 -1.84 1.01 -0.34 -4.96 116.67 114.02 1pwl s ASP 224 Ca 0.36 2.48 -0.21 0.00 0.71 0.00 0.00 52.55 55.89 1pwl s ASP 224 Cb 0.21 -2.61 -0.07 0.00 1.01 0.00 0.00 42.92 41.46 1pwl s ASP 224 CO 0.43 -1.52 1.05 -2.65 0.21 0.00 0.00 175.17 172.68 1pwl n PRO 225 N -1.32 1.20 -3.85 8.23 -0.02 -1.26 -5.01 135.00 132.97 1pwl n PRO 225 Ca 0.12 0.45 -0.30 0.00 -2.02 0.00 0.00 63.50 61.75 1pwl n PRO 225 Cb 0.48 -2.20 -0.15 0.00 -0.02 0.00 0.00 33.50 31.61 1pwl n PRO 225 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1pwl s SER 226 N -1.01 3.86 0.15 2.55 0.15 -1.26 -5.02 113.70 113.11 1pwl s SER 226 Ca 0.71 -1.38 -0.17 0.00 0.70 0.00 0.00 55.95 55.80 1pwl s SER 226 Cb -0.46 -1.04 0.03 0.00 -1.71 0.00 0.00 66.02 62.84 1pwl s SER 226 CO 0.51 -0.32 1.75 -0.07 1.20 0.00 0.00 173.24 176.31 1pwl h LEU 227 N 8.00 0.11 -1.98 3.45 3.38 -1.92 -2.26 115.31 124.10 1pwl h LEU 227 Ca -0.14 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1pwl h LEU 227 Cb 1.06 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.83 1pwl h LEU 227 CO 0.43 0.10 -0.02 -0.07 0.09 0.00 0.00 178.44 178.97 1pwl h LEU 228 N 0.24 0.00 -2.63 1.67 3.38 -1.96 -2.18 115.31 113.84 1pwl h LEU 228 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1pwl h LEU 228 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1pwl h LEU 228 CO -0.14 0.02 0.00 -0.62 0.09 0.00 0.00 178.44 177.79 1pwl n GLU 229 N -3.15 2.60 -2.13 1.13 -0.58 -0.91 -4.89 120.64 112.71 1pwl n GLU 229 Ca -0.01 -2.31 -0.43 0.00 -0.42 0.00 0.00 57.16 54.00 1pwl n GLU 229 Cb 0.23 -1.44 -0.03 0.00 -0.57 0.00 0.00 31.44 29.63 1pwl n GLU 229 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1pwl s ASP 230 N -1.10 6.52 0.56 1.62 -1.08 -0.82 -4.87 116.67 117.50 1pwl s ASP 230 Ca 0.37 1.77 0.32 0.00 -0.52 0.00 0.00 52.55 54.49 1pwl s ASP 230 Cb 0.20 -2.53 1.62 0.00 -1.46 0.00 0.00 42.92 40.75 1pwl s ASP 230 CO 0.26 -1.12 2.11 1.55 0.52 0.00 0.00 175.17 178.50 1pwl h PRO 231 N 10.13 0.00 -0.27 4.34 0.13 -1.91 -0.93 132.00 143.49 1pwl h PRO 231 Ca -0.34 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.62 1pwl h PRO 231 Cb 1.15 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.28 1pwl h PRO 231 CO 0.99 0.07 -0.52 0.00 -0.23 0.00 0.00 178.00 178.31 1pwl h ARG 232 N 0.00 0.78 -0.19 0.86 3.08 -1.97 -1.80 114.38 115.14 1pwl h ARG 232 Ca -0.00 -0.48 -0.20 0.00 0.07 0.00 0.00 59.98 59.37 1pwl h ARG 232 Cb 0.31 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.41 1pwl h ARG 232 CO 0.01 1.11 -0.68 0.82 -1.07 0.00 0.00 179.97 180.16 1pwl h ILE 233 N 0.61 1.29 -0.90 2.04 2.04 -1.73 -2.79 117.51 118.07 1pwl h ILE 233 Ca 0.02 -1.89 0.12 0.00 1.00 0.00 0.00 64.86 64.11 1pwl h ILE 233 Cb 1.10 1.86 -0.09 0.00 -0.74 0.00 0.00 36.82 38.95 1pwl h ILE 233 CO 0.11 0.60 0.52 0.50 0.00 0.00 0.00 178.15 179.88 1pwl h LYS 234 N 0.55 0.78 -0.45 2.37 3.64 -1.10 -0.84 116.57 121.51 1pwl h LYS 234 Ca -0.02 -0.05 -0.12 0.00 -1.27 0.00 0.00 60.65 59.19 1pwl h LYS 234 Cb 1.29 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.92 1pwl h LYS 234 CO 0.14 0.51 -0.18 0.00 -2.27 0.00 0.00 179.45 177.65 1pwl h ALA 235 N 1.52 0.83 -0.55 5.00 0.00 -1.18 0.47 119.26 125.35 1pwl h ALA 235 Ca 0.46 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1pwl h ALA 235 Cb 0.53 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1pwl h ALA 235 CO -0.30 0.65 0.25 0.82 0.00 0.00 0.00 179.25 180.67 1pwl h ILE 236 N 0.77 1.21 -0.57 0.00 2.04 -1.14 -2.43 117.51 117.39 1pwl h ILE 236 Ca 0.11 -0.61 -0.00 0.00 1.00 0.00 0.00 64.86 65.35 1pwl h ILE 236 Cb 0.71 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 1pwl h ILE 236 CO 0.05 0.24 0.34 0.00 0.00 0.00 0.00 178.15 178.79 1pwl h ALA 237 N 1.09 0.73 -0.49 1.87 0.00 -0.86 -2.76 119.26 118.84 1pwl h ALA 237 Ca 0.19 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1pwl h ALA 237 Cb 0.15 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1pwl h ALA 237 CO -0.02 0.21 0.17 0.00 0.00 0.00 0.00 179.25 179.61 1pwl h ALA 238 N 1.17 1.38 -0.11 0.00 0.00 -0.73 -0.94 119.26 120.02 1pwl h ALA 238 Ca 0.20 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1pwl h ALA 238 Cb -0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1pwl h ALA 238 CO -0.04 0.46 -0.06 -0.22 0.00 0.00 0.00 179.25 179.40 1pwl h LYS 239 N 0.70 0.17 -0.27 0.00 3.64 -1.15 -2.21 116.57 117.44 1pwl h LYS 239 Ca 0.16 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 1pwl h LYS 239 Cb 0.19 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1pwl h LYS 239 CO -0.01 0.24 0.00 0.72 -2.27 0.00 0.00 179.45 178.13 1pwl n HIS 240 N -4.38 0.34 -3.85 1.91 8.25 -0.47 -4.95 115.22 112.07 1pwl n HIS 240 Ca -0.01 -0.17 -0.26 0.00 -0.26 0.00 0.00 57.72 57.02 1pwl n HIS 240 Cb 0.19 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.32 1pwl n HIS 240 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1pwl n ASN 241 N 1.12 -2.27 -4.40 0.41 4.05 -0.61 -5.00 115.26 108.56 1pwl n ASN 241 Ca 0.18 -0.85 -0.20 0.00 0.45 0.00 0.00 54.58 54.16 1pwl n ASN 241 Cb 0.52 -3.73 -0.10 0.00 1.23 0.00 0.00 39.78 37.70 1pwl n ASN 241 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 1pwl s LYS 242 N -6.35 1.52 0.59 1.20 -0.14 -0.56 -5.03 119.74 110.96 1pwl s LYS 242 Ca 0.26 -1.80 -0.07 0.00 -1.36 0.00 0.00 55.97 52.99 1pwl s LYS 242 Cb -0.13 -0.80 -0.01 0.00 -1.68 0.00 0.00 37.83 35.21 1pwl s LYS 242 CO 0.84 -0.12 0.92 0.95 -0.76 0.00 0.00 175.35 177.18 1pwl s THR 243 N -3.31 4.06 0.21 2.17 -4.23 -1.26 -4.08 115.64 109.20 1pwl s THR 243 Ca 0.33 0.23 -0.09 0.00 -1.18 0.00 0.00 61.69 60.97 1pwl s THR 243 Cb 0.07 -3.61 0.14 0.00 1.34 0.00 0.00 72.50 70.44 1pwl s THR 243 CO 0.12 -0.67 1.82 0.71 -0.54 0.00 0.00 174.62 176.07 1pwl h THR 244 N -0.17 1.01 -0.64 3.99 1.35 -1.91 -1.75 112.91 114.79 1pwl h THR 244 Ca -0.46 -0.25 0.03 0.00 -0.55 0.00 0.00 66.41 65.18 1pwl h THR 244 Cb 1.24 0.21 -0.04 0.00 -1.73 0.00 0.00 68.15 67.82 1pwl h THR 244 CO 0.62 0.13 0.39 0.00 -0.25 0.00 0.00 175.52 176.41 1pwl h ALA 245 N 1.33 0.83 -0.93 6.62 0.00 -1.94 -0.19 119.26 124.99 1pwl h ALA 245 Ca 0.29 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.20 1pwl h ALA 245 Cb 0.14 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 1pwl h ALA 245 CO -0.16 0.13 0.61 1.96 0.00 0.00 0.00 179.25 181.79 1pwl h GLN 246 N 0.76 1.22 -0.44 0.00 4.20 -1.73 -0.81 115.11 118.32 1pwl h GLN 246 Ca 0.26 -0.08 -0.02 0.00 0.06 0.00 0.00 58.65 58.87 1pwl h GLN 246 Cb 0.04 -0.27 -0.02 0.00 0.30 0.00 0.00 27.48 27.53 1pwl h GLN 246 CO -0.11 0.81 0.18 0.28 -0.67 0.00 0.00 178.83 179.32 1pwl h VAL 247 N 1.26 1.20 0.00 -0.54 2.07 -0.74 -0.69 116.25 118.81 1pwl h VAL 247 Ca 0.34 -0.61 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 1pwl h VAL 247 Cb -0.14 0.78 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1pwl h VAL 247 CO -0.07 0.23 -0.14 -0.07 0.02 0.00 0.00 177.57 177.53 1pwl h LEU 248 N 0.57 0.00 0.23 2.57 3.38 -0.49 -1.15 115.31 120.42 1pwl h LEU 248 Ca 0.15 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.77 1pwl h LEU 248 Cb 0.18 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.96 1pwl h LEU 248 CO -0.01 0.14 -1.58 0.40 0.09 0.00 0.00 178.44 177.48 1pwl h ILE 249 N 0.00 1.15 -0.13 1.22 2.04 -0.96 -3.35 117.51 117.49 1pwl h ILE 249 Ca -0.00 -2.64 -0.09 0.00 1.00 0.00 0.00 64.86 63.13 1pwl h ILE 249 Cb 0.37 2.94 -0.01 0.00 -0.74 0.00 0.00 36.82 39.38 1pwl h ILE 249 CO 0.02 0.83 -0.33 -0.09 0.00 0.00 0.00 178.15 178.58 1pwl h ARG 250 N 0.13 0.26 0.13 2.37 9.65 -0.83 -3.23 114.38 122.85 1pwl h ARG 250 Ca -0.29 -0.10 0.02 0.00 -1.10 0.00 0.00 59.98 58.50 1pwl h ARG 250 Cb 2.15 -0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 30.67 1pwl h ARG 250 CO 0.24 0.57 -0.47 0.35 2.80 0.00 0.00 179.97 183.46 1pwl h PHE 251 N 0.23 -1.34 -0.15 2.20 3.57 -1.34 -1.91 116.94 118.20 1pwl h PHE 251 Ca 0.03 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.50 1pwl h PHE 251 Cb 0.70 0.57 -0.01 0.00 2.79 0.00 0.00 35.95 40.00 1pwl h PHE 251 CO 0.01 -0.56 -0.18 -1.00 -2.23 0.00 0.00 178.31 174.35 1pwl h PRO 252 N -0.71 0.25 -0.91 6.41 0.13 -1.74 -2.47 132.00 132.96 1pwl h PRO 252 Ca 0.01 -0.07 0.08 0.00 -0.87 0.00 0.00 66.00 65.15 1pwl h PRO 252 Cb 0.72 -0.03 -0.06 0.00 0.13 0.00 0.00 31.00 31.76 1pwl h PRO 252 CO -0.26 0.43 0.59 0.52 -0.23 0.00 0.00 178.00 179.04 1pwl h MET 253 N 0.23 0.94 0.00 0.86 2.86 -1.39 -0.99 114.93 117.44 1pwl h MET 253 Ca 0.04 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1pwl h MET 253 Cb 0.46 -0.21 0.00 0.00 0.06 0.00 0.00 31.60 31.91 1pwl h MET 253 CO 0.03 0.62 0.00 1.04 1.06 0.00 0.00 176.91 179.66 1pwl n GLN 254 N -4.51 0.67 -0.49 1.72 6.02 -0.80 -2.29 117.38 117.70 1pwl n GLN 254 Ca 0.15 0.01 0.10 0.00 -0.01 0.00 0.00 57.00 57.25 1pwl n GLN 254 Cb 0.25 -1.50 0.34 0.00 1.02 0.00 0.00 30.24 30.35 1pwl n GLN 254 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1pwl n ARG 255 N -1.15 3.23 -3.04 -1.09 1.74 -0.43 -4.94 116.66 110.98 1pwl n ARG 255 Ca 0.18 -2.76 -0.21 0.00 -0.77 0.00 0.00 57.85 54.29 1pwl n ARG 255 Cb 0.17 -1.72 0.04 0.00 -1.02 0.00 0.00 32.46 29.93 1pwl n ARG 255 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1pwl n ASN 256 N 1.35 -5.85 -4.85 0.55 5.15 -0.97 -5.02 115.26 105.63 1pwl n ASN 256 Ca 0.25 -0.30 -0.24 0.00 -0.60 0.00 0.00 54.58 53.69 1pwl n ASN 256 Cb 0.75 -4.64 -0.04 0.00 -0.53 0.00 0.00 39.78 35.32 1pwl n ASN 256 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1pwl s LEU 257 N -6.29 3.94 0.29 1.20 1.43 -0.88 -4.71 118.68 113.67 1pwl s LEU 257 Ca 0.32 -0.11 -0.14 0.00 -1.03 0.00 0.00 54.13 53.17 1pwl s LEU 257 Cb -0.14 -2.51 -0.09 0.00 0.03 0.00 0.00 46.19 43.48 1pwl s LEU 257 CO 0.40 0.01 0.70 -0.69 0.23 0.00 0.00 176.35 177.00 1pwl s VAL 258 N -1.91 4.72 0.00 -1.59 1.01 -0.50 -4.19 120.40 117.94 1pwl s VAL 258 Ca 0.32 0.90 -0.00 0.00 0.00 0.00 0.00 61.98 63.20 1pwl s VAL 258 Cb -0.09 -3.64 -0.00 0.00 0.00 0.00 0.00 36.38 32.65 1pwl s VAL 258 CO 0.25 -0.12 -0.00 0.54 0.00 0.00 0.00 175.10 175.77 1pwl s VAL 259 N -1.90 0.02 -0.47 2.92 0.11 0.40 0.01 120.40 121.50 1pwl s VAL 259 Ca 0.52 -0.19 0.09 0.00 -2.93 0.00 0.00 61.98 59.46 1pwl s VAL 259 Cb -0.11 -0.07 0.31 0.00 -1.53 0.00 0.00 36.38 34.98 1pwl s VAL 259 CO 0.18 -0.11 0.75 2.30 -3.33 0.00 0.00 175.10 174.90 1pwl n ILE 260 N 2.76 0.94 -1.82 7.04 -5.35 -1.13 -1.28 119.36 120.51 1pwl n ILE 260 Ca -0.15 -4.83 -0.40 0.00 -0.27 0.00 0.00 62.75 57.10 1pwl n ILE 260 Cb 0.59 -1.15 0.01 0.00 -1.74 0.00 0.00 39.64 37.35 1pwl n ILE 260 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 1pwl s PRO 261 N -2.47 3.86 -0.13 6.28 0.04 -1.21 -3.31 135.00 138.06 1pwl s PRO 261 Ca 0.41 2.46 -0.06 0.00 0.04 0.00 0.00 61.00 63.85 1pwl s PRO 261 Cb 0.27 -2.78 -0.04 0.00 0.04 0.00 0.00 34.50 31.99 1pwl s PRO 261 CO -0.09 -0.69 0.10 0.21 0.04 0.00 0.00 177.00 176.57 1pwl s LYS 262 N -2.30 3.51 -0.01 4.56 2.36 -1.26 -1.45 119.74 125.16 1pwl s LYS 262 Ca 0.58 -0.23 -0.20 0.00 -2.55 0.00 0.00 55.97 53.57 1pwl s LYS 262 Cb -0.44 -3.14 0.04 0.00 -1.05 0.00 0.00 37.83 33.24 1pwl s LYS 262 CO 0.58 0.63 0.43 0.45 1.55 0.00 0.00 175.35 178.99 1pwl s SER 263 N -0.63 -0.33 0.00 1.43 0.15 -1.26 -4.95 113.70 108.11 1pwl s SER 263 Ca 0.12 0.22 0.12 0.00 0.70 0.00 0.00 55.95 57.11 1pwl s SER 263 Cb -0.12 0.40 0.11 0.00 -1.71 0.00 0.00 66.02 64.70 1pwl s SER 263 CO 0.02 -0.54 0.90 1.33 1.20 0.00 0.00 173.24 176.15 1pwl n VAL 264 N 0.98 0.06 -3.11 4.45 0.24 -1.26 -4.87 118.33 114.82 1pwl n VAL 264 Ca -0.20 -0.53 -0.42 0.00 -2.04 0.00 0.00 64.34 61.15 1pwl n VAL 264 Cb 0.57 1.21 -0.07 0.00 -1.47 0.00 0.00 33.84 34.08 1pwl n VAL 264 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1pwl s THR 265 N -0.99 4.89 0.29 3.34 2.01 -1.26 -4.70 115.64 119.21 1pwl s THR 265 Ca 0.15 0.57 0.04 0.00 0.31 0.00 0.00 61.69 62.75 1pwl s THR 265 Cb 0.10 -4.08 0.28 0.00 0.01 0.00 0.00 72.50 68.81 1pwl s THR 265 CO 0.15 -0.32 1.76 -0.65 -0.69 0.00 0.00 174.62 174.87 1pwl h PRO 266 N 8.47 0.64 -0.45 4.92 0.11 -1.96 -0.39 132.00 143.35 1pwl h PRO 266 Ca -0.26 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.74 1pwl h PRO 266 Cb 1.11 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 1pwl h PRO 266 CO 0.84 0.43 -0.01 1.49 -0.21 0.00 0.00 178.00 180.53 1pwl h GLU 267 N 0.66 0.74 -0.18 1.05 4.22 -2.00 -2.19 114.58 116.89 1pwl h GLU 267 Ca 0.55 -0.20 -0.21 0.00 0.08 0.00 0.00 59.36 59.58 1pwl h GLU 267 Cb 0.87 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.03 1pwl h GLU 267 CO -0.40 0.76 -0.70 0.00 -2.18 0.00 0.00 179.01 176.48 1pwl h ARG 268 N 0.69 0.74 -0.48 1.92 3.08 -1.59 -1.02 114.38 117.72 1pwl h ARG 268 Ca 0.14 -0.56 0.07 0.00 0.07 0.00 0.00 59.98 59.69 1pwl h ARG 268 Cb 0.45 0.10 -0.06 0.00 0.08 0.00 0.00 29.97 30.54 1pwl h ARG 268 CO 0.02 1.18 0.15 0.82 -1.07 0.00 0.00 179.97 181.07 1pwl h ILE 269 N 0.52 0.82 -0.25 2.04 2.04 -0.87 0.10 117.51 121.91 1pwl h ILE 269 Ca -0.03 -0.11 -0.04 0.00 1.00 0.00 0.00 64.86 65.68 1pwl h ILE 269 Cb 1.32 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 1pwl h ILE 269 CO 0.14 0.06 -0.02 0.00 0.00 0.00 0.00 178.15 178.33 1pwl h ALA 270 N 1.33 0.34 -0.64 1.87 0.00 -1.33 -3.06 119.26 117.77 1pwl h ALA 270 Ca 0.23 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 54.96 1pwl h ALA 270 Cb 0.26 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1pwl h ALA 270 CO -0.25 0.09 0.35 1.49 0.00 0.00 0.00 179.25 180.93 1pwl h GLU 271 N 0.21 0.63 0.00 0.00 4.81 -0.80 -2.56 114.58 116.87 1pwl h GLU 271 Ca 0.07 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 1pwl h GLU 271 Cb 0.45 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 1pwl h GLU 271 CO 0.02 0.42 -0.06 -0.91 -0.73 0.00 0.00 179.01 177.75 1pwl h ASN 272 N 0.65 0.00 1.28 1.04 2.35 -0.75 -1.53 115.58 118.61 1pwl h ASN 272 Ca 0.29 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.04 1pwl h ASN 272 Cb 0.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.56 1pwl h ASN 272 CO -0.18 0.06 -0.24 0.15 -1.65 0.00 0.00 177.43 175.57 1pwl h PHE 273 N 0.00 0.00 -1.09 1.19 3.57 -1.35 -3.40 116.94 115.86 1pwl h PHE 273 Ca -0.00 0.00 -0.74 0.00 3.53 0.00 0.00 57.97 60.76 1pwl h PHE 273 Cb 0.36 0.00 -0.12 0.00 2.79 0.00 0.00 35.95 38.98 1pwl h PHE 273 CO 0.00 0.00 2.36 1.63 -2.23 0.00 0.00 178.31 180.07 1pwl n LYS 274 N -2.25 3.80 -0.02 1.11 5.02 -0.58 -4.31 118.16 120.93 1pwl n LYS 274 Ca 0.05 -3.33 0.00 0.00 -2.02 0.00 0.00 58.31 53.01 1pwl n LYS 274 Cb 0.44 -2.88 0.01 0.00 -0.02 0.00 0.00 35.03 32.58 1pwl n LYS 274 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1pwl n VAL 275 N 3.12 0.53 0.89 -0.18 0.24 -1.26 -4.73 118.33 116.94 1pwl n VAL 275 Ca 0.49 -0.55 0.12 0.00 -2.04 0.00 0.00 64.34 62.37 1pwl n VAL 275 Cb 0.33 0.70 0.16 0.00 -1.47 0.00 0.00 33.84 33.56 1pwl n VAL 275 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1pwl n PHE 276 N -0.29 0.11 -0.63 6.34 3.72 -1.26 -4.45 117.46 121.00 1pwl n PHE 276 Ca 0.01 -0.05 0.07 0.00 -0.05 0.00 0.00 57.45 57.42 1pwl n PHE 276 Cb 0.40 0.00 0.16 0.00 -0.94 0.00 0.00 39.48 39.10 1pwl n PHE 276 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1pwl n ASP 277 N 1.29 2.97 -3.80 4.37 5.75 -1.26 -4.75 116.55 121.11 1pwl n ASP 277 Ca 0.15 -2.60 -0.10 0.00 -0.01 0.00 0.00 54.79 52.24 1pwl n ASP 277 Cb 0.58 -0.35 -0.06 0.00 -1.03 0.00 0.00 41.12 40.27 1pwl n ASP 277 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 1pwl s PHE 278 N -2.06 0.07 -0.04 2.11 -0.71 -1.26 -5.17 117.98 110.92 1pwl s PHE 278 Ca 0.28 -0.43 0.03 0.00 -1.04 0.00 0.00 56.93 55.76 1pwl s PHE 278 Cb 0.21 0.13 0.00 0.00 -1.21 0.00 0.00 43.02 42.16 1pwl s PHE 278 CO 0.08 -0.72 -0.11 -2.00 -1.34 0.00 0.00 175.22 171.13 1pwl s GLU 279 N -3.88 1.19 0.21 1.99 2.12 -1.26 -5.05 118.70 114.02 1pwl s GLU 279 Ca 0.09 -0.36 -0.30 0.00 0.36 0.00 0.00 54.97 54.77 1pwl s GLU 279 Cb 0.02 -1.07 -0.08 0.00 0.26 0.00 0.00 34.13 33.25 1pwl s GLU 279 CO -0.06 0.11 1.11 -0.51 -0.54 0.00 0.00 175.26 175.37 1pwl s LEU 280 N 0.28 4.51 0.89 2.70 1.43 -1.26 -5.05 118.68 122.19 1pwl s LEU 280 Ca -0.05 2.16 -0.12 0.00 -1.03 0.00 0.00 54.13 55.09 1pwl s LEU 280 Cb -0.10 -3.61 0.12 0.00 0.03 0.00 0.00 46.19 42.63 1pwl s LEU 280 CO 0.01 -0.20 1.11 -0.94 0.23 0.00 0.00 176.35 176.56 1pwl s SER 281 N -0.36 3.64 0.24 2.29 1.04 -1.26 -4.80 113.70 114.49 1pwl s SER 281 Ca 0.48 1.21 -0.05 0.00 0.48 0.00 0.00 55.95 58.07 1pwl s SER 281 Cb -0.30 -1.87 0.39 0.00 0.10 0.00 0.00 66.02 64.33 1pwl s SER 281 CO 0.37 -2.50 1.79 -1.28 0.98 0.00 0.00 173.24 172.60 1pwl h SER 282 N -1.46 0.54 -0.39 7.02 0.87 -1.99 -0.22 113.55 117.93 1pwl h SER 282 Ca -0.50 0.06 -0.04 0.00 -1.23 0.00 0.00 61.79 60.08 1pwl h SER 282 Cb 1.30 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 63.21 1pwl h SER 282 CO 0.59 0.30 0.07 -0.61 -0.53 0.00 0.00 176.83 176.65 1pwl h GLN 283 N 0.67 0.64 -0.54 2.24 5.75 -1.99 -0.84 115.11 121.04 1pwl h GLN 283 Ca 0.38 -0.17 0.07 0.00 -0.15 0.00 0.00 58.65 58.79 1pwl h GLN 283 Cb 0.41 -0.08 -0.06 0.00 1.07 0.00 0.00 27.48 28.82 1pwl h GLN 283 CO -0.28 0.69 0.21 -0.44 -2.65 0.00 0.00 178.83 176.36 1pwl h ASP 284 N 0.49 0.23 -0.33 -0.69 3.32 -1.72 0.18 116.42 117.89 1pwl h ASP 284 Ca 0.12 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.22 1pwl h ASP 284 Cb 0.36 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 1pwl h ASP 284 CO 0.01 0.15 0.19 0.24 -1.72 0.00 0.00 179.24 178.11 1pwl h MET 285 N 0.40 0.46 -0.53 3.56 2.86 -0.79 -0.48 114.93 120.41 1pwl h MET 285 Ca 0.26 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.85 1pwl h MET 285 Cb 0.27 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.82 1pwl h MET 285 CO -0.25 0.38 0.33 1.15 1.06 0.00 0.00 176.91 179.58 1pwl h THR 286 N 0.42 1.16 -0.12 2.22 2.02 -0.87 -0.83 112.91 116.91 1pwl h THR 286 Ca 0.12 -0.34 -0.00 0.00 0.77 0.00 0.00 66.41 66.96 1pwl h THR 286 Cb 0.05 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 66.88 1pwl h THR 286 CO -0.02 0.16 0.06 0.74 0.37 0.00 0.00 175.52 176.83 1pwl h THR 287 N 0.71 1.10 -0.64 3.16 2.02 -0.36 -1.25 112.91 117.67 1pwl h THR 287 Ca 0.19 -0.30 0.01 0.00 0.77 0.00 0.00 66.41 67.08 1pwl h THR 287 Cb -0.03 1.08 -0.03 0.00 -1.74 0.00 0.00 68.15 67.43 1pwl h THR 287 CO -0.04 0.09 0.42 -0.07 0.37 0.00 0.00 175.52 176.30 1pwl h LEU 288 N 0.08 0.72 -1.65 2.58 3.38 -0.93 -1.68 115.31 117.82 1pwl h LEU 288 Ca 0.04 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1pwl h LEU 288 Cb 0.10 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1pwl h LEU 288 CO -0.01 0.52 -0.08 -0.07 0.09 0.00 0.00 178.44 178.89 1pwl h LEU 289 N 0.86 0.11 -0.20 1.67 3.38 -0.92 -2.27 115.31 117.93 1pwl h LEU 289 Ca 0.23 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1pwl h LEU 289 Cb -0.09 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1pwl h LEU 289 CO -0.05 0.21 0.00 -1.54 0.09 0.00 0.00 178.44 177.15 1pwl n SER 290 N -4.37 0.22 -0.13 -0.43 3.41 -0.49 -2.45 113.62 109.37 1pwl n SER 290 Ca -0.02 0.55 0.15 0.00 -0.26 0.00 0.00 58.87 59.30 1pwl n SER 290 Cb 0.20 -0.60 0.81 0.00 -0.26 0.00 0.00 64.21 64.36 1pwl n SER 290 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1pwl n TYR 291 N -1.73 0.00 -1.69 7.33 4.01 -0.85 -4.91 117.16 119.31 1pwl n TYR 291 Ca 0.03 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.34 1pwl n TYR 291 Cb 0.20 -0.03 -0.02 0.00 -0.31 0.00 0.00 39.34 39.18 1pwl n TYR 291 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1pwl n ASN 292 N -0.72 3.06 0.00 7.72 5.15 -0.44 -4.33 115.26 125.70 1pwl n ASN 292 Ca 0.21 1.15 0.00 0.00 -0.60 0.00 0.00 54.58 55.34 1pwl n ASN 292 Cb 0.19 -1.48 0.00 0.00 -0.53 0.00 0.00 39.78 37.96 1pwl n ASN 292 CO 0.00 0.00 0.00 -2.11 1.40 0.00 0.00 177.26 176.55 1pwl n ARG 293 N 1.97 1.14 -3.91 1.20 1.85 -0.37 -4.97 116.66 113.56 1pwl n ARG 293 Ca 0.10 -0.87 -0.29 0.00 -1.00 0.00 0.00 57.85 55.79 1pwl n ARG 293 Cb 0.33 -0.71 0.02 0.00 -1.05 0.00 0.00 32.46 31.05 1pwl n ARG 293 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1pwl n ASN 294 N -0.19 -4.00 -4.39 2.89 3.02 -0.53 -4.94 115.26 107.12 1pwl n ASN 294 Ca 0.00 -0.81 -0.39 0.00 -0.03 0.00 0.00 54.58 53.35 1pwl n ASN 294 Cb 0.38 -3.79 -0.12 0.00 -0.61 0.00 0.00 39.78 35.64 1pwl n ASN 294 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 1pwl s TRP 295 N -3.38 3.20 -0.21 3.10 -0.00 -0.52 -4.99 118.94 116.14 1pwl s TRP 295 Ca 0.55 -0.82 -0.07 0.00 -0.00 0.00 0.00 56.10 55.76 1pwl s TRP 295 Cb -0.28 -2.37 -0.04 0.00 -0.00 0.00 0.00 33.47 30.79 1pwl s TRP 295 CO 0.84 -0.56 0.07 0.50 -0.00 0.00 0.00 176.95 177.80 1pwl s ARG 296 N 1.56 3.84 0.03 5.86 3.52 -1.26 -4.28 118.95 128.22 1pwl s ARG 296 Ca 0.03 -0.40 0.01 0.00 -0.13 0.00 0.00 55.73 55.24 1pwl s ARG 296 Cb -0.18 -3.26 -0.26 0.00 -1.56 0.00 0.00 34.95 29.69 1pwl s ARG 296 CO 0.06 0.08 0.95 0.28 -0.81 0.00 0.00 175.30 175.85 1pwl h VAL 297 N 5.17 1.27 -3.16 7.11 2.07 -1.97 -3.42 116.25 123.31 1pwl h VAL 297 Ca -0.37 -2.94 -0.75 0.00 0.82 0.00 0.00 66.70 63.46 1pwl h VAL 297 Cb 1.17 2.75 -0.25 0.00 -1.52 0.00 0.00 31.29 33.44 1pwl h VAL 297 CO 0.64 0.81 -0.26 0.00 0.02 0.00 0.00 177.57 178.79 1pwl s ALA 299 N 1.51 -0.88 -0.22 0.00 0.00 -1.26 -5.07 121.76 115.83 1pwl s ALA 299 Ca 0.04 0.08 -0.04 0.00 0.00 0.00 0.00 51.96 52.04 1pwl s ALA 299 Cb -0.29 0.47 0.12 0.00 0.00 0.00 0.00 23.12 23.42 1pwl s ALA 299 CO 0.02 -0.52 0.35 -1.17 0.00 0.00 0.00 175.76 174.44 1pwl s LEU 300 N -2.35 -0.54 0.30 0.00 2.96 -1.26 -5.03 118.68 112.77 1pwl s LEU 300 Ca -0.02 0.32 0.02 0.00 -0.22 0.00 0.00 54.13 54.23 1pwl s LEU 300 Cb 0.00 1.03 0.56 0.00 0.50 0.00 0.00 46.19 48.28 1pwl s LEU 300 CO -0.06 -0.29 1.90 0.25 -1.32 0.00 0.00 176.35 176.83 1pwl h LEU 301 N 8.21 0.88 -2.20 -0.68 5.85 -2.01 -1.22 115.31 124.13 1pwl h LEU 301 Ca -0.18 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.55 1pwl h LEU 301 Cb 1.14 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.00 1pwl h LEU 301 CO 0.24 0.55 0.00 0.77 -0.34 0.00 0.00 178.44 179.66 1pwl h SER 302 N 0.99 0.00 -0.02 1.25 4.64 -1.96 -2.34 113.55 116.10 1pwl h SER 302 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 1pwl h SER 302 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1pwl h SER 302 CO -0.16 0.00 -0.07 0.00 -0.87 0.00 0.00 176.83 175.73 1pwl h THR 304 N 3.37 0.00 -0.01 0.00 1.35 -1.42 -1.56 112.91 114.64 1pwl h THR 304 Ca 0.00 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 1pwl h THR 304 Cb 0.75 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 68.31 1pwl h THR 304 CO 0.00 0.00 -0.17 -1.54 -0.25 0.00 0.00 175.52 173.56 1pwl n SER 305 N -2.53 1.58 -4.77 5.36 3.41 -1.26 -4.87 113.62 110.54 1pwl n SER 305 Ca 0.02 -1.32 -0.41 0.00 -0.26 0.00 0.00 58.87 56.90 1pwl n SER 305 Cb 0.25 0.12 -0.00 0.00 -0.26 0.00 0.00 64.21 64.32 1pwl n SER 305 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1pwl s HIS 306 N -2.27 2.72 0.50 7.33 5.04 -0.59 -4.86 115.29 123.17 1pwl s HIS 306 Ca 0.28 1.28 0.20 0.00 -1.54 0.00 0.00 55.06 55.28 1pwl s HIS 306 Cb 0.20 -3.88 1.26 0.00 0.04 0.00 0.00 32.58 30.20 1pwl s HIS 306 CO 0.44 -2.57 2.03 1.57 -2.34 0.00 0.00 174.74 173.87 1pwl h LYS 307 N 2.99 0.11 -0.55 2.88 2.10 -1.91 -1.39 116.57 120.80 1pwl h LYS 307 Ca -0.50 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.14 1pwl h LYS 307 Cb 1.24 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 1pwl h LYS 307 CO 0.64 0.07 0.00 -0.25 -2.00 0.00 0.00 179.45 177.91 1pwl n ASP 308 N -4.45 4.35 -4.70 7.07 8.00 -1.26 -4.99 116.55 120.57 1pwl n ASP 308 Ca 0.06 -2.46 -0.44 0.00 0.71 0.00 0.00 54.79 52.67 1pwl n ASP 308 Cb 0.40 -0.52 -0.03 0.00 -0.02 0.00 0.00 41.12 40.95 1pwl n ASP 308 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1pwl n TYR 309 N 0.79 2.57 0.64 1.24 9.36 -0.53 -4.44 117.16 126.80 1pwl n TYR 309 Ca 0.23 0.09 0.13 0.00 3.32 0.00 0.00 57.90 61.67 1pwl n TYR 309 Cb 0.82 -2.64 0.33 0.00 -0.63 0.00 0.00 39.34 37.22 1pwl n TYR 309 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1pwl n PRO 310 N 4.07 0.25 -0.47 2.98 -0.04 -1.26 -4.23 135.00 136.30 1pwl n PRO 310 Ca 0.17 0.15 0.09 0.00 -0.04 0.00 0.00 63.50 63.87 1pwl n PRO 310 Cb 0.33 -1.74 0.31 0.00 -0.04 0.00 0.00 33.50 32.36 1pwl n PRO 310 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1pwl n PHE 311 N -2.15 1.15 0.02 0.54 3.72 -1.26 -3.97 117.46 115.51 1pwl n PHE 311 Ca 0.05 -0.59 -0.19 0.00 -0.05 0.00 0.00 57.45 56.66 1pwl n PHE 311 Cb 0.43 -0.16 -0.10 0.00 -0.94 0.00 0.00 39.48 38.71 1pwl n PHE 311 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1pwl h HIS 312 N 3.58 1.02 -4.15 1.38 3.86 -1.97 -3.46 115.15 115.41 1pwl h HIS 312 Ca 0.00 -0.52 -0.54 0.00 -1.16 0.00 0.00 60.37 58.15 1pwl h HIS 312 Cb 1.23 -0.13 0.15 0.00 1.06 0.00 0.00 27.41 29.72 1pwl h HIS 312 CO 0.59 1.36 0.43 -1.21 0.86 0.00 0.00 177.93 179.96 1pwl s GLU 313 N -3.43 2.33 0.22 2.45 0.41 -1.25 -4.92 118.70 114.50 1pwl s GLU 313 Ca -0.10 1.85 -0.08 0.00 -0.41 0.00 0.00 54.97 56.23 1pwl s GLU 313 Cb 0.07 -1.85 0.28 0.00 -1.78 0.00 0.00 34.13 30.86 1pwl s GLU 313 CO 0.91 -1.71 1.79 1.49 -0.49 0.00 0.00 175.26 177.25 1pwl h GLU 314 N 0.06 0.61 0.00 1.61 4.81 -1.92 -3.51 114.58 116.23 1pwl h GLU 314 Ca -0.49 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.70 1pwl h GLU 314 Cb 1.31 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.55 1pwl h GLU 314 CO 0.51 0.41 0.00 1.97 -0.73 0.00 0.00 179.01 181.17