#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gdk s ALA 4 N 0.00 1.43 0.77 7.82 0.00 -1.26 -5.02 121.76 125.50 3gdk s ALA 4 Ca 0.00 -0.79 -0.11 0.00 0.00 0.00 0.00 51.96 51.06 3gdk s ALA 4 Cb 0.00 -2.94 0.05 0.00 0.00 0.00 0.00 23.12 20.24 3gdk s ALA 4 CO 0.00 -2.78 1.08 0.95 0.00 0.00 0.00 175.76 175.01 3gdk s THR 5 N -3.30 3.39 0.26 0.00 -4.23 -1.26 -4.81 115.64 105.70 3gdk s THR 5 Ca 0.68 0.45 -0.02 0.00 -1.18 0.00 0.00 61.69 61.62 3gdk s THR 5 Cb -0.11 -3.10 0.26 0.00 1.34 0.00 0.00 72.50 70.89 3gdk s THR 5 CO 0.54 -0.59 1.87 1.88 -0.54 0.00 0.00 174.62 177.78 3gdk h TYR 6 N -1.04 1.15 -0.25 3.99 0.05 -1.95 -1.11 116.97 117.81 3gdk h TYR 6 Ca -0.45 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.35 3gdk h TYR 6 Cb 1.24 -0.38 -0.01 0.00 1.01 0.00 0.00 36.73 38.60 3gdk h TYR 6 CO 0.54 0.57 0.12 -0.22 -1.05 0.00 0.00 178.16 178.12 3gdk h LYS 7 N 1.11 0.37 -0.44 4.88 3.64 -1.92 -1.93 116.57 122.27 3gdk h LYS 7 Ca 0.43 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.76 3gdk h LYS 7 Cb 0.22 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 3gdk h LYS 7 CO -0.19 0.38 0.29 0.93 -2.27 0.00 0.00 179.45 178.58 3gdk h GLU 8 N 0.27 0.59 -0.31 1.90 5.08 -1.77 -2.48 114.58 117.86 3gdk h GLU 8 Ca 0.09 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 3gdk h GLU 8 Cb 0.13 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 3gdk h GLU 8 CO -0.01 0.40 0.11 0.00 -1.00 0.00 0.00 179.01 178.51 3gdk h ARG 9 N 0.59 0.43 -0.60 2.33 3.08 -1.09 -2.41 114.38 116.71 3gdk h ARG 9 Ca 0.16 -0.05 -0.07 0.00 0.07 0.00 0.00 59.98 60.08 3gdk h ARG 9 Cb -0.05 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 3gdk h ARG 9 CO -0.03 0.37 0.07 0.00 -1.07 0.00 0.00 179.97 179.31 3gdk h ALA 10 N 1.69 1.00 0.00 0.04 0.00 -0.90 -1.21 119.26 119.89 3gdk h ALA 10 Ca 0.11 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 3gdk h ALA 10 Cb 0.11 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 3gdk h ALA 10 CO -0.01 0.63 -0.07 0.00 0.00 0.00 0.00 179.25 179.80 3gdk h ALA 11 N 1.16 0.99 -0.02 0.00 0.00 -1.17 -3.29 119.26 116.92 3gdk h ALA 11 Ca 0.18 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3gdk h ALA 11 Cb 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3gdk h ALA 11 CO 0.01 0.09 0.00 0.25 0.00 0.00 0.00 179.25 179.60 3gdk n THR 12 N -3.16 0.12 -2.56 0.00 -2.24 -1.12 -5.03 114.28 100.28 3gdk n THR 12 Ca 0.01 -0.56 -0.42 0.00 -2.27 0.00 0.00 64.05 60.82 3gdk n THR 12 Cb 0.41 1.03 -0.03 0.00 -2.10 0.00 0.00 70.33 69.64 3gdk n THR 12 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3gdk s HIS 13 N -0.49 3.57 0.37 4.78 2.46 -0.47 -4.94 115.29 120.56 3gdk s HIS 13 Ca 0.06 1.52 0.35 0.00 0.47 0.00 0.00 55.06 57.46 3gdk s HIS 13 Cb 0.04 -3.26 1.70 0.00 -0.13 0.00 0.00 32.58 30.93 3gdk s HIS 13 CO 0.06 -0.62 2.12 -1.00 -2.47 0.00 0.00 174.74 172.84 3gdk h PRO 14 N 6.53 0.00 -5.28 2.88 0.13 -1.91 -3.43 132.00 130.92 3gdk h PRO 14 Ca -0.42 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.10 3gdk h PRO 14 Cb 1.22 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.21 3gdk h PRO 14 CO 0.77 0.04 -0.18 0.45 -0.23 0.00 0.00 178.00 178.85 3gdk s SER 15 N -5.69 6.35 0.31 1.44 0.15 -1.26 -4.81 113.70 110.18 3gdk s SER 15 Ca -0.02 0.41 0.02 0.00 0.70 0.00 0.00 55.95 57.06 3gdk s SER 15 Cb 0.11 -2.23 0.58 0.00 -1.71 0.00 0.00 66.02 62.77 3gdk s SER 15 CO 0.52 -0.17 1.89 -0.65 1.20 0.00 0.00 173.24 176.03 3gdk h PRO 16 N 7.88 0.94 -0.37 5.44 0.11 -1.82 -0.10 132.00 144.08 3gdk h PRO 16 Ca -0.32 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 65.65 3gdk h PRO 16 Cb 1.16 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 3gdk h PRO 16 CO 0.68 0.62 -0.07 0.28 -0.21 0.00 0.00 178.00 179.30 3gdk h VAL 17 N 0.97 1.27 -0.59 3.15 2.07 -1.90 -1.33 116.25 119.90 3gdk h VAL 17 Ca 0.41 -1.13 -0.10 0.00 0.82 0.00 0.00 66.70 66.70 3gdk h VAL 17 Cb 0.32 1.26 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 3gdk h VAL 17 CO -0.17 0.38 -0.03 0.00 0.02 0.00 0.00 177.57 177.76 3gdk h ALA 18 N 0.83 0.82 -0.34 1.67 0.00 -1.74 -0.72 119.26 119.78 3gdk h ALA 18 Ca 0.10 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 3gdk h ALA 18 Cb 0.58 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3gdk h ALA 18 CO 0.03 0.67 0.16 0.00 0.00 0.00 0.00 179.25 180.11 3gdk h ALA 19 N 0.99 0.44 -0.21 0.00 0.00 -0.98 -0.22 119.26 119.28 3gdk h ALA 19 Ca 0.16 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.98 3gdk h ALA 19 Cb 0.60 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 3gdk h ALA 19 CO 0.04 0.01 0.08 -0.22 0.00 0.00 0.00 179.25 179.16 3gdk h LYS 20 N 0.42 0.18 -0.24 0.00 3.64 -1.01 -1.52 116.57 118.04 3gdk h LYS 20 Ca 0.12 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.48 3gdk h LYS 20 Cb 0.13 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 3gdk h LYS 20 CO -0.01 0.12 0.14 1.25 -2.27 0.00 0.00 179.45 178.67 3gdk h LEU 21 N 0.18 0.29 -0.98 5.20 5.85 -0.91 -1.10 115.31 123.83 3gdk h LEU 21 Ca 0.09 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.75 3gdk h LEU 21 Cb 0.05 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 3gdk h LEU 21 CO -0.09 0.27 0.64 -0.26 -0.34 0.00 0.00 178.44 178.67 3gdk h PHE 22 N 0.28 1.25 -0.77 1.25 0.04 -0.91 -0.43 116.94 117.65 3gdk h PHE 22 Ca 0.08 0.02 -0.04 0.00 2.80 0.00 0.00 57.97 60.83 3gdk h PHE 22 Cb 0.04 -0.42 -0.03 0.00 2.20 0.00 0.00 35.95 37.73 3gdk h PHE 22 CO -0.04 0.80 0.31 -0.91 -0.60 0.00 0.00 178.31 177.86 3gdk h ASN 23 N 1.34 1.05 -0.30 2.17 -0.26 -1.00 -1.21 115.58 117.37 3gdk h ASN 23 Ca 0.36 -0.16 -0.02 0.00 -0.56 0.00 0.00 56.30 55.93 3gdk h ASN 23 Cb -0.14 -0.27 -0.01 0.00 -1.06 0.00 0.00 38.32 36.84 3gdk h ASN 23 CO -0.08 0.93 0.12 0.40 -1.06 0.00 0.00 177.43 177.74 3gdk h ILE 24 N 1.11 1.18 -0.48 2.81 2.04 -0.48 -0.71 117.51 122.99 3gdk h ILE 24 Ca 0.26 -0.55 0.05 0.00 1.00 0.00 0.00 64.86 65.62 3gdk h ILE 24 Cb 0.20 0.98 -0.05 0.00 -0.74 0.00 0.00 36.82 37.22 3gdk h ILE 24 CO -0.02 0.19 0.22 0.24 0.00 0.00 0.00 178.15 178.78 3gdk h MET 25 N 0.34 0.42 0.19 2.37 2.86 -0.71 -0.27 114.93 120.13 3gdk h MET 25 Ca 0.10 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.71 3gdk h MET 25 Cb 0.18 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 31.75 3gdk h MET 25 CO -0.01 0.28 -0.09 1.25 1.06 0.00 0.00 176.91 179.40 3gdk h HIS 26 N 0.43 -0.24 -0.81 -0.22 -0.00 -1.09 0.18 115.15 113.41 3gdk h HIS 26 Ca 0.22 -0.01 0.04 0.00 -0.00 0.00 0.00 60.37 60.63 3gdk h HIS 26 Cb 0.16 0.08 -0.05 0.00 -0.00 0.00 0.00 27.41 27.60 3gdk h HIS 26 CO -0.12 0.09 0.53 0.93 -0.00 0.00 0.00 177.93 179.37 3gdk h GLU 27 N -0.59 0.94 -0.03 5.26 5.08 -0.97 -2.48 114.58 121.80 3gdk h GLU 27 Ca -0.03 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3gdk h GLU 27 Cb 0.44 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.47 3gdk h GLU 27 CO 0.04 0.62 -0.11 1.63 -1.00 0.00 0.00 179.01 180.19 3gdk n LYS 28 N -4.46 2.05 -3.70 2.33 5.02 -0.13 -4.99 118.16 114.28 3gdk n LYS 28 Ca 0.11 -1.69 -0.28 0.00 -2.02 0.00 0.00 58.31 54.44 3gdk n LYS 28 Cb 0.15 -1.47 0.03 0.00 -0.02 0.00 0.00 35.03 33.72 3gdk n LYS 28 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3gdk n GLN 29 N 1.00 -2.23 -3.75 1.97 6.02 -0.05 -5.00 117.38 115.34 3gdk n GLN 29 Ca 0.13 0.50 -0.13 0.00 -0.01 0.00 0.00 57.00 57.49 3gdk n GLN 29 Cb 0.56 -4.47 -0.11 0.00 1.02 0.00 0.00 30.24 27.25 3gdk n GLN 29 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 3gdk s THR 30 N -3.58 -0.00 -0.13 5.09 -1.32 -0.60 -4.84 115.64 110.26 3gdk s THR 30 Ca 0.32 0.01 0.15 0.00 -1.21 0.00 0.00 61.69 60.95 3gdk s THR 30 Cb -0.11 -0.49 0.36 0.00 -1.51 0.00 0.00 72.50 70.75 3gdk s THR 30 CO 0.85 0.00 1.18 -0.46 -2.21 0.00 0.00 174.62 173.98 3gdk n ASN 31 N 2.95 1.54 -4.73 8.08 0.23 -1.26 -4.30 115.26 117.78 3gdk n ASN 31 Ca -0.13 -3.16 -0.37 0.00 -0.53 0.00 0.00 54.58 50.38 3gdk n ASN 31 Cb 0.57 -0.43 -0.07 0.00 -2.08 0.00 0.00 39.78 37.78 3gdk n ASN 31 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 3gdk s LEU 32 N -2.19 4.26 -0.17 -4.53 2.96 -1.26 -1.44 118.68 116.31 3gdk s LEU 32 Ca 0.33 0.66 0.00 0.00 -0.22 0.00 0.00 54.13 54.90 3gdk s LEU 32 Cb 0.32 -2.53 0.01 0.00 0.50 0.00 0.00 46.19 44.49 3gdk s LEU 32 CO -0.06 0.06 -0.17 0.00 -1.32 0.00 0.00 176.35 174.85 3gdk s ALA 34 N 1.02 3.57 -0.41 0.00 0.00 -0.75 -1.16 121.76 124.02 3gdk s ALA 34 Ca -0.02 -0.62 -0.13 0.00 0.00 0.00 0.00 51.96 51.20 3gdk s ALA 34 Cb -0.15 -2.58 0.05 0.00 0.00 0.00 0.00 23.12 20.44 3gdk s ALA 34 CO -0.04 -0.31 0.28 0.45 0.00 0.00 0.00 175.76 176.14 3gdk s SER 35 N 1.10 5.90 -0.51 0.00 0.15 0.56 -0.45 113.70 120.44 3gdk s SER 35 Ca 0.16 -1.14 -0.08 0.00 0.70 0.00 0.00 55.95 55.59 3gdk s SER 35 Cb -0.15 -2.08 0.13 0.00 -1.71 0.00 0.00 66.02 62.21 3gdk s SER 35 CO 0.07 -0.49 0.37 -0.76 1.20 0.00 0.00 173.24 173.64 3gdk s LEU 36 N 1.58 5.68 -1.10 3.45 1.43 -0.65 -4.19 118.68 124.88 3gdk s LEU 36 Ca 0.03 -2.09 -0.08 0.00 -1.03 0.00 0.00 54.13 50.96 3gdk s LEU 36 Cb -0.21 -1.99 0.28 0.00 0.03 0.00 0.00 46.19 44.30 3gdk s LEU 36 CO 0.07 -0.63 1.12 -0.90 0.23 0.00 0.00 176.35 176.23 3gdk n ASP 37 N 4.64 5.48 -4.69 2.29 5.75 -1.26 -4.14 116.55 124.62 3gdk n ASP 37 Ca -0.04 -3.08 -0.23 0.00 -0.01 0.00 0.00 54.79 51.43 3gdk n ASP 37 Cb 0.41 -1.34 -0.07 0.00 -1.03 0.00 0.00 41.12 39.09 3gdk n ASP 37 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 3gdk s VAL 38 N -1.42 2.97 -0.19 2.12 -7.23 -1.26 -5.07 120.40 110.32 3gdk s VAL 38 Ca 0.31 -1.80 0.22 0.00 -1.81 0.00 0.00 61.98 58.90 3gdk s VAL 38 Cb -0.09 -2.91 -0.08 0.00 0.56 0.00 0.00 36.38 33.86 3gdk s VAL 38 CO -0.07 -0.21 0.91 -2.11 -0.31 0.00 0.00 175.10 173.31 3gdk n ARG 39 N -1.06 0.62 -4.91 4.82 1.85 -1.26 -4.34 116.66 112.37 3gdk n ARG 39 Ca -0.04 0.06 -0.31 0.00 -1.00 0.00 0.00 57.85 56.56 3gdk n ARG 39 Cb 0.61 -1.76 -0.14 0.00 -1.05 0.00 0.00 32.46 30.12 3gdk n ARG 39 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 3gdk s THR 40 N -3.37 2.54 0.34 8.89 -4.23 -1.26 0.21 115.64 118.77 3gdk s THR 40 Ca -0.02 -1.12 0.04 0.00 -1.18 0.00 0.00 61.69 59.41 3gdk s THR 40 Cb 0.10 -2.00 0.28 0.00 1.34 0.00 0.00 72.50 72.23 3gdk s THR 40 CO 0.82 0.45 1.95 0.74 -0.54 0.00 0.00 174.62 178.04 3gdk h THR 41 N 4.21 1.06 0.14 3.99 2.02 -1.91 -2.06 112.91 120.35 3gdk h THR 41 Ca -0.46 -0.29 0.01 0.00 0.77 0.00 0.00 66.41 66.44 3gdk h THR 41 Cb 1.14 0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 67.65 3gdk h THR 41 CO 0.47 0.16 -0.23 0.50 0.37 0.00 0.00 175.52 176.79 3gdk h LYS 42 N 0.86 -0.43 -0.87 6.66 3.64 -1.94 -0.80 116.57 123.68 3gdk h LYS 42 Ca 0.32 0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.71 3gdk h LYS 42 Cb 0.19 0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 32.06 3gdk h LYS 42 CO -0.11 -0.28 0.46 1.49 -2.27 0.00 0.00 179.45 178.74 3gdk h GLU 43 N -0.44 1.23 0.15 1.90 4.81 -1.90 -2.31 114.58 118.01 3gdk h GLU 43 Ca 0.02 -0.15 0.01 0.00 -0.13 0.00 0.00 59.36 59.11 3gdk h GLU 43 Cb 0.45 -0.24 -0.03 0.00 0.63 0.00 0.00 28.75 29.57 3gdk h GLU 43 CO -0.11 0.91 -0.22 1.25 -0.73 0.00 0.00 179.01 180.10 3gdk h LEU 44 N 1.23 -0.62 -1.59 1.64 5.85 -0.95 -1.00 115.31 119.87 3gdk h LEU 44 Ca 0.31 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 59.07 3gdk h LEU 44 Cb 0.05 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 3gdk h LEU 44 CO -0.05 -0.32 -0.00 -0.07 -0.34 0.00 0.00 178.44 177.67 3gdk h LEU 45 N -0.43 0.23 -0.12 2.25 3.38 -1.02 -0.01 115.31 119.58 3gdk h LEU 45 Ca 0.02 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3gdk h LEU 45 Cb 0.44 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 3gdk h LEU 45 CO -0.10 0.28 -0.05 -0.33 0.09 0.00 0.00 178.44 178.32 3gdk h GLU 46 N 0.25 0.25 -0.69 1.13 5.08 -0.97 -2.01 114.58 117.62 3gdk h GLU 46 Ca 0.06 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.25 3gdk h GLU 46 Cb 0.18 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 3gdk h GLU 46 CO 0.00 0.59 0.20 -0.07 -1.00 0.00 0.00 179.01 178.73 3gdk h LEU 47 N -0.10 1.02 -0.73 1.33 3.38 -0.82 -2.33 115.31 117.07 3gdk h LEU 47 Ca 0.03 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 3gdk h LEU 47 Cb 0.51 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 3gdk h LEU 47 CO 0.02 0.97 0.27 0.58 0.09 0.00 0.00 178.44 180.36 3gdk h VAL 48 N 1.02 1.26 -0.49 1.22 2.07 -1.00 -0.08 116.25 120.25 3gdk h VAL 48 Ca 0.22 -0.84 0.00 0.00 0.82 0.00 0.00 66.70 66.90 3gdk h VAL 48 Cb 0.33 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 3gdk h VAL 48 CO -0.00 0.33 0.31 -0.08 0.02 0.00 0.00 177.57 178.15 3gdk h GLU 49 N 1.07 0.66 -0.22 1.57 4.57 -1.17 0.38 114.58 121.43 3gdk h GLU 49 Ca 0.24 -0.05 -0.12 0.00 -1.18 0.00 0.00 59.36 58.25 3gdk h GLU 49 Cb 0.25 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.69 3gdk h GLU 49 CO -0.01 0.46 -0.38 0.00 -1.18 0.00 0.00 179.01 177.90 3gdk h ALA 50 N 1.16 0.95 0.00 2.92 0.00 -1.08 -3.25 119.26 119.96 3gdk h ALA 50 Ca 0.18 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3gdk h ALA 50 Cb -0.04 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.64 3gdk h ALA 50 CO -0.04 0.62 -0.98 1.28 0.00 0.00 0.00 179.25 180.13 3gdk n LEU 51 N -4.04 0.78 -0.32 0.00 4.77 -0.07 -4.37 117.00 113.73 3gdk n LEU 51 Ca -0.01 0.27 0.01 0.00 -0.03 0.00 0.00 56.01 56.25 3gdk n LEU 51 Cb 0.49 -0.08 0.07 0.00 -2.33 0.00 0.00 43.42 41.57 3gdk n LEU 51 CO 0.44 -0.14 0.53 0.61 -1.33 0.00 0.00 177.39 177.50 3gdk n GLY 52 N 1.22 -1.66 0.20 -0.72 0.00 0.13 -0.64 105.19 103.72 3gdk n GLY 52 Ca 0.01 0.95 0.14 0.00 0.00 0.00 0.00 46.02 47.12 3gdk n GLY 52 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3gdk h PRO 53 N 0.00 0.00 0.00 1.61 0.11 -1.82 -3.23 132.00 128.67 3gdk h PRO 53 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 3gdk h PRO 53 Cb 0.56 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.67 3gdk h PRO 53 CO -0.87 0.00 -1.16 1.63 -0.21 0.00 0.00 178.00 177.39 3gdk n LYS 54 N -2.61 0.23 -4.30 1.05 4.76 0.19 -5.01 118.16 112.47 3gdk n LYS 54 Ca 0.01 -0.04 -0.23 0.00 -2.87 0.00 0.00 58.31 55.18 3gdk n LYS 54 Cb 0.26 -1.54 -0.08 0.00 -1.84 0.00 0.00 35.03 31.84 3gdk n LYS 54 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 3gdk s ILE 55 N -3.17 3.21 -0.02 -0.18 -4.36 -1.07 -4.58 121.20 111.04 3gdk s ILE 55 Ca 0.04 -1.95 0.11 0.00 -0.26 0.00 0.00 60.65 58.58 3gdk s ILE 55 Cb 0.15 -2.79 -0.17 0.00 1.25 0.00 0.00 42.46 40.90 3gdk s ILE 55 CO 0.84 -0.34 0.23 0.00 0.24 0.00 0.00 174.94 175.91 3gdk s LEU 57 N -3.79 0.81 -0.19 0.00 2.96 -1.22 -2.34 118.68 114.91 3gdk s LEU 57 Ca -0.04 0.62 -0.01 0.00 -0.22 0.00 0.00 54.13 54.48 3gdk s LEU 57 Cb 0.07 1.08 0.01 0.00 0.50 0.00 0.00 46.19 47.84 3gdk s LEU 57 CO 0.45 -0.12 -0.14 -0.22 -1.32 0.00 0.00 176.35 175.00 3gdk s LEU 58 N 0.13 2.44 -0.32 -0.68 2.96 -0.23 -1.80 118.68 121.17 3gdk s LEU 58 Ca -0.00 -0.54 -0.12 0.00 -0.22 0.00 0.00 54.13 53.25 3gdk s LEU 58 Cb -0.02 -1.58 -0.03 0.00 0.50 0.00 0.00 46.19 45.06 3gdk s LEU 58 CO 0.01 0.01 0.23 -0.75 -1.32 0.00 0.00 176.35 174.53 3gdk s LYS 59 N 1.28 3.64 0.37 1.98 2.20 0.40 -0.56 119.74 129.05 3gdk s LYS 59 Ca 0.04 -0.53 0.01 0.00 -0.36 0.00 0.00 55.97 55.13 3gdk s LYS 59 Cb -0.14 -3.76 -0.02 0.00 -1.51 0.00 0.00 37.83 32.40 3gdk s LYS 59 CO -0.08 -0.37 0.57 0.95 -0.36 0.00 0.00 175.35 176.06 3gdk s THR 60 N 1.75 4.63 -0.41 3.43 -4.23 -0.05 -1.63 115.64 119.13 3gdk s THR 60 Ca 0.07 -0.56 0.07 0.00 -1.18 0.00 0.00 61.69 60.09 3gdk s THR 60 Cb -0.17 -3.68 0.23 0.00 1.34 0.00 0.00 72.50 70.22 3gdk s THR 60 CO 0.11 -0.43 0.50 1.41 -0.54 0.00 0.00 174.62 175.67 3gdk n HIS 61 N -1.85 -0.28 0.14 3.99 -0.00 -1.26 -0.75 115.22 115.22 3gdk n HIS 61 Ca -0.02 -3.54 0.08 0.00 -0.00 0.00 0.00 57.72 54.23 3gdk n HIS 61 Cb 0.57 -0.25 0.57 0.00 -0.00 0.00 0.00 29.99 30.88 3gdk n HIS 61 CO 0.00 0.00 0.00 -0.39 -0.00 0.00 0.00 176.34 175.95 3gdk h VAL 62 N 2.55 1.01 -0.10 1.59 -1.51 -1.95 -2.65 116.25 115.19 3gdk h VAL 62 Ca 0.11 -0.07 0.03 0.00 -1.23 0.00 0.00 66.70 65.54 3gdk h VAL 62 Cb 0.88 0.79 -0.00 0.00 -2.13 0.00 0.00 31.29 30.82 3gdk h VAL 62 CO 0.46 0.04 0.14 0.44 -1.23 0.00 0.00 177.57 177.42 3gdk h ASP 63 N 0.20 0.00 -0.02 4.19 3.32 -1.99 -1.70 116.42 120.43 3gdk h ASP 63 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3gdk h ASP 63 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 3gdk h ASP 63 CO -0.02 0.00 -0.26 2.30 -1.72 0.00 0.00 179.24 179.54 3gdk n ILE 64 N -3.63 0.00 -2.19 0.35 -5.35 -1.00 -4.95 119.36 102.59 3gdk n ILE 64 Ca -0.00 -0.37 -0.41 0.00 -0.27 0.00 0.00 62.75 61.70 3gdk n ILE 64 Cb 0.24 1.37 -0.03 0.00 -1.74 0.00 0.00 39.64 39.48 3gdk n ILE 64 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 3gdk s LEU 65 N -2.25 4.44 0.25 7.28 1.43 -0.64 -4.54 118.68 124.65 3gdk s LEU 65 Ca 0.23 2.55 0.23 0.00 -1.03 0.00 0.00 54.13 56.10 3gdk s LEU 65 Cb 0.19 -3.63 0.06 0.00 0.03 0.00 0.00 46.19 42.84 3gdk s LEU 65 CO 0.45 -0.47 1.15 0.71 0.23 0.00 0.00 176.35 178.41 3gdk h THR 66 N 3.24 0.00 -0.94 5.49 1.35 -0.56 -3.39 112.91 118.10 3gdk h THR 66 Ca -0.47 -1.00 -0.40 0.00 -0.55 0.00 0.00 66.41 63.99 3gdk h THR 66 Cb 1.22 1.59 -0.41 0.00 -1.73 0.00 0.00 68.15 68.82 3gdk h THR 66 CO 0.69 0.00 -1.04 -0.90 -0.25 0.00 0.00 175.52 174.02 3gdk n ASP 67 N -2.75 2.51 -4.77 5.36 5.68 -1.26 -5.09 116.55 116.23 3gdk n ASP 67 Ca 0.01 -2.86 -0.39 0.00 -0.50 0.00 0.00 54.79 51.05 3gdk n ASP 67 Cb 0.55 -0.48 -0.02 0.00 -1.14 0.00 0.00 41.12 40.02 3gdk n ASP 67 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 3gdk s PHE 68 N -3.42 3.16 -0.16 2.11 5.36 -1.26 -4.74 117.98 119.01 3gdk s PHE 68 Ca 0.34 1.56 -0.29 0.00 -0.96 0.00 0.00 56.93 57.59 3gdk s PHE 68 Cb 0.41 -3.40 0.10 0.00 -0.34 0.00 0.00 43.02 39.79 3gdk s PHE 68 CO -0.03 -1.22 0.86 -1.54 -1.46 0.00 0.00 175.22 171.83 3gdk s SER 69 N -1.04 -0.54 0.25 6.13 1.04 -1.26 -4.99 113.70 113.28 3gdk s SER 69 Ca 0.54 0.76 -0.06 0.00 0.48 0.00 0.00 55.95 57.67 3gdk s SER 69 Cb -0.31 0.67 0.26 0.00 0.10 0.00 0.00 66.02 66.74 3gdk s SER 69 CO 0.40 -0.38 1.91 0.24 0.98 0.00 0.00 173.24 176.40 3gdk h MET 70 N 3.39 1.24 -0.04 4.02 2.86 -1.96 0.49 114.93 124.93 3gdk h MET 70 Ca -0.25 -0.07 -0.17 0.00 -2.06 0.00 0.00 59.70 57.15 3gdk h MET 70 Cb 1.16 -0.28 0.01 0.00 0.06 0.00 0.00 31.60 32.55 3gdk h MET 70 CO 0.26 0.82 -0.65 0.93 1.06 0.00 0.00 176.91 179.33 3gdk h GLU 71 N 1.28 0.52 0.00 1.72 4.39 -1.96 -1.32 114.58 119.21 3gdk h GLU 71 Ca 0.36 -0.50 -0.10 0.00 0.34 0.00 0.00 59.36 59.47 3gdk h GLU 71 Cb -0.10 0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 3gdk h GLU 71 CO -0.09 1.13 -1.06 0.78 -1.16 0.00 0.00 179.01 178.61 3gdk h GLY 72 N 0.09 0.00 0.00 -3.84 0.00 -1.93 -3.38 103.07 94.01 3gdk h GLY 72 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.26 3gdk h GLY 72 CO 0.13 0.00 -0.60 2.41 0.00 0.00 0.00 176.54 178.48 3gdk n THR 73 N -2.89 1.31 -0.03 4.70 -1.04 0.15 -4.64 114.28 111.84 3gdk n THR 73 Ca -0.04 0.24 -0.11 0.00 -2.04 0.00 0.00 64.05 62.10 3gdk n THR 73 Cb 0.72 -2.03 -0.05 0.00 -1.82 0.00 0.00 70.33 67.14 3gdk n THR 73 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 3gdk h VAL 74 N -0.60 1.14 0.19 12.58 2.07 -1.40 -2.46 116.25 127.77 3gdk h VAL 74 Ca 0.00 -0.41 0.01 0.00 0.82 0.00 0.00 66.70 67.12 3gdk h VAL 74 Cb 0.60 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.50 3gdk h VAL 74 CO 0.00 0.13 -0.33 0.50 0.02 0.00 0.00 177.57 177.89 3gdk h LYS 75 N 0.07 -0.57 -0.09 1.57 1.63 -1.41 0.55 116.57 118.32 3gdk h LYS 75 Ca 0.05 0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.85 3gdk h LYS 75 Cb 0.15 0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.90 3gdk h LYS 75 CO -0.00 -0.38 -0.11 -1.00 -3.45 0.00 0.00 179.45 174.50 3gdk h PRO 76 N -0.60 0.14 -0.49 1.90 0.13 -1.76 -1.71 132.00 129.62 3gdk h PRO 76 Ca 0.01 -0.03 -0.12 0.00 -0.87 0.00 0.00 66.00 65.00 3gdk h PRO 76 Cb 0.59 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.69 3gdk h PRO 76 CO -0.15 0.26 -0.16 1.25 -0.23 0.00 0.00 178.00 178.97 3gdk h LEU 77 N 0.14 0.98 -0.97 1.56 5.85 -0.92 -0.91 115.31 121.03 3gdk h LEU 77 Ca 0.03 -0.38 -0.08 0.00 0.84 0.00 0.00 57.88 58.29 3gdk h LEU 77 Cb 0.28 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 3gdk h LEU 77 CO 0.02 1.13 -0.14 0.11 -0.34 0.00 0.00 178.44 179.21 3gdk h LYS 78 N 0.82 0.58 -0.46 1.25 1.79 -0.40 -0.33 116.57 119.82 3gdk h LYS 78 Ca 0.12 -0.19 -0.10 0.00 -2.18 0.00 0.00 60.65 58.30 3gdk h LYS 78 Cb 0.73 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.31 3gdk h LYS 78 CO 0.06 0.71 -0.10 0.00 -1.08 0.00 0.00 179.45 179.04 3gdk h ALA 79 N 1.32 0.64 -0.67 3.86 0.00 -1.02 -1.46 119.26 121.93 3gdk h ALA 79 Ca 0.09 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 3gdk h ALA 79 Cb 0.56 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3gdk h ALA 79 CO 0.04 0.52 0.12 -0.07 0.00 0.00 0.00 179.25 179.86 3gdk h LEU 80 N 0.73 1.05 -0.72 0.00 3.38 -0.85 0.66 115.31 119.55 3gdk h LEU 80 Ca 0.12 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3gdk h LEU 80 Cb 0.64 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 3gdk h LEU 80 CO 0.04 1.04 0.46 -1.28 0.09 0.00 0.00 178.44 178.79 3gdk h SER 81 N 1.02 0.85 -0.17 -0.43 0.87 -0.87 -0.14 113.55 114.69 3gdk h SER 81 Ca 0.20 -0.04 -0.12 0.00 -1.23 0.00 0.00 61.79 60.60 3gdk h SER 81 Cb 0.43 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 3gdk h SER 81 CO 0.01 0.64 -0.37 0.00 -0.53 0.00 0.00 176.83 176.57 3gdk h ALA 82 N 1.25 0.27 -0.07 6.23 0.00 -0.99 -0.90 119.26 125.06 3gdk h ALA 82 Ca 0.26 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 3gdk h ALA 82 Cb -0.08 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 3gdk h ALA 82 CO -0.05 0.35 0.03 -0.22 0.00 0.00 0.00 179.25 179.36 3gdk h LYS 83 N 0.20 0.10 -0.01 0.00 3.64 -0.65 -3.25 116.57 116.61 3gdk h LYS 83 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3gdk h LYS 83 Cb 0.98 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.78 3gdk h LYS 83 CO 0.08 0.20 -0.43 0.66 -2.27 0.00 0.00 179.45 177.69 3gdk n TYR 84 N -4.97 0.00 -2.68 1.91 4.01 -0.08 -5.02 117.16 110.33 3gdk n TYR 84 Ca -0.06 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.66 3gdk n TYR 84 Cb 0.09 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 39.02 3gdk n TYR 84 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3gdk n ASN 85 N -0.74 -6.68 -3.73 7.72 5.15 -0.38 -4.67 115.26 111.94 3gdk n ASN 85 Ca 0.09 0.13 -0.12 0.00 -0.60 0.00 0.00 54.58 54.09 3gdk n ASN 85 Cb 0.37 -4.47 -0.07 0.00 -0.53 0.00 0.00 39.78 35.09 3gdk n ASN 85 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 3gdk s PHE 86 N -2.72 -0.15 0.42 1.20 -0.12 -0.97 -4.84 117.98 110.79 3gdk s PHE 86 Ca 0.08 0.02 0.02 0.00 -0.05 0.00 0.00 56.93 57.00 3gdk s PHE 86 Cb -0.02 0.13 -0.00 0.00 -0.63 0.00 0.00 43.02 42.50 3gdk s PHE 86 CO 0.60 -0.53 0.61 -0.51 -0.05 0.00 0.00 175.22 175.34 3gdk s LEU 87 N -2.11 3.74 -0.14 -1.99 1.43 -0.99 -4.68 118.68 113.95 3gdk s LEU 87 Ca -0.04 0.14 -0.03 0.00 -1.03 0.00 0.00 54.13 53.16 3gdk s LEU 87 Cb -0.01 -3.03 -0.03 0.00 0.03 0.00 0.00 46.19 43.15 3gdk s LEU 87 CO -0.04 -0.63 -0.02 -0.76 0.23 0.00 0.00 176.35 175.14 3gdk s LEU 88 N -4.44 3.40 -0.24 1.79 1.43 -1.26 -1.07 118.68 118.29 3gdk s LEU 88 Ca 0.47 -0.03 -0.00 0.00 -1.03 0.00 0.00 54.13 53.54 3gdk s LEU 88 Cb -0.10 -1.81 0.07 0.00 0.03 0.00 0.00 46.19 44.38 3gdk s LEU 88 CO 0.36 0.23 -0.01 0.12 0.23 0.00 0.00 176.35 177.29 3gdk s PHE 89 N -0.02 2.00 0.09 0.29 5.36 0.28 -0.99 117.98 124.99 3gdk s PHE 89 Ca 0.02 -1.57 -0.27 0.00 -0.96 0.00 0.00 56.93 54.15 3gdk s PHE 89 Cb -0.13 -1.51 -0.06 0.00 -0.34 0.00 0.00 43.02 40.98 3gdk s PHE 89 CO 0.02 -0.75 0.85 -2.00 -1.46 0.00 0.00 175.22 171.88 3gdk s GLU 90 N 1.53 4.60 0.33 10.12 2.56 -0.91 -0.88 118.70 136.05 3gdk s GLU 90 Ca -0.02 1.24 0.09 0.00 0.00 0.00 0.00 54.97 56.29 3gdk s GLU 90 Cb -0.18 -3.36 0.59 0.00 2.00 0.00 0.00 34.13 33.18 3gdk s GLU 90 CO -0.09 0.29 1.77 0.22 -0.56 0.00 0.00 175.26 176.89 3gdk h ASP 91 N 5.47 0.15 -0.26 -1.70 3.58 -1.28 -3.38 116.42 118.99 3gdk h ASP 91 Ca -0.44 -0.05 -0.42 0.00 0.42 0.00 0.00 57.03 56.53 3gdk h ASP 91 Cb 1.21 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 42.21 3gdk h ASP 91 CO 0.71 0.51 0.51 -1.14 -2.88 0.00 0.00 179.24 176.94 3gdk n ARG 92 N -4.08 0.00 -3.00 0.28 3.00 -1.26 -4.77 116.66 106.82 3gdk n ARG 92 Ca -0.01 0.00 -0.44 0.00 -0.00 0.00 0.00 57.85 57.39 3gdk n ARG 92 Cb 0.43 -0.77 -0.02 0.00 0.00 0.00 0.00 32.46 32.10 3gdk n ARG 92 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 3gdk s LYS 93 N 2.28 3.78 0.33 -0.14 1.02 -1.26 -4.28 119.74 121.48 3gdk s LYS 93 Ca 0.58 -2.17 -0.28 0.00 0.02 0.00 0.00 55.97 54.11 3gdk s LYS 93 Cb -0.77 -4.89 -0.12 0.00 -0.52 0.00 0.00 37.83 31.53 3gdk s LYS 93 CO 0.38 -1.69 1.29 1.19 -0.92 0.00 0.00 175.35 175.60 3gdk n PHE 94 N 5.76 2.23 -2.69 3.18 3.72 -1.12 -4.73 117.46 123.82 3gdk n PHE 94 Ca 0.27 0.55 -0.07 0.00 -0.05 0.00 0.00 57.45 58.14 3gdk n PHE 94 Cb 0.46 -2.41 0.08 0.00 -0.94 0.00 0.00 39.48 36.67 3gdk n PHE 94 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3gdk n ALA 95 N 0.48 2.33 -3.40 4.37 0.00 -1.26 -1.14 120.51 121.90 3gdk n ALA 95 Ca 0.05 -2.16 -0.04 0.00 0.00 0.00 0.00 53.44 51.30 3gdk n ALA 95 Cb 0.35 -0.96 -0.00 0.00 0.00 0.00 0.00 19.45 18.84 3gdk n ALA 95 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3gdk n ASP 96 N -0.40 -0.70 -3.60 0.00 -0.08 -1.26 -4.91 116.55 105.61 3gdk n ASP 96 Ca 0.02 -1.74 -0.22 0.00 -1.51 0.00 0.00 54.79 51.34 3gdk n ASP 96 Cb 0.84 1.24 -0.08 0.00 2.34 0.00 0.00 41.12 45.45 3gdk n ASP 96 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 3gdk s ILE 97 N -2.61 0.18 0.00 5.18 -4.36 -1.26 -4.31 121.20 114.03 3gdk s ILE 97 Ca 0.10 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.49 3gdk s ILE 97 Cb -0.01 -2.43 0.00 0.00 1.25 0.00 0.00 42.46 41.27 3gdk s ILE 97 CO 0.07 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.86 3gdk n GLY 98 N -0.74 0.94 0.43 6.27 0.00 -1.26 -2.33 105.19 108.50 3gdk n GLY 98 Ca 0.03 -0.63 0.24 0.00 0.00 0.00 0.00 46.02 45.65 3gdk n GLY 98 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 3gdk h ASN 99 N 4.87 0.10 0.48 1.61 -0.00 -1.98 -0.78 115.58 119.87 3gdk h ASN 99 Ca 0.00 0.01 -0.02 0.00 -0.00 0.00 0.00 56.30 56.29 3gdk h ASN 99 Cb 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 38.32 38.32 3gdk h ASN 99 CO 0.00 0.04 -0.23 0.74 -0.00 0.00 0.00 177.43 177.98 3gdk h THR 100 N 0.10 0.44 -0.07 -3.57 2.02 -1.96 -1.63 112.91 108.24 3gdk h THR 100 Ca 0.38 -0.40 -0.07 0.00 0.77 0.00 0.00 66.41 67.09 3gdk h THR 100 Cb 1.37 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 68.36 3gdk h THR 100 CO -0.04 0.06 -0.28 1.62 0.37 0.00 0.00 175.52 177.25 3gdk h VAL 101 N -0.91 1.23 -0.25 3.16 3.04 -1.00 -1.23 116.25 120.29 3gdk h VAL 101 Ca -0.07 -1.08 -0.03 0.00 -1.01 0.00 0.00 66.70 64.52 3gdk h VAL 101 Cb 0.59 1.49 -0.01 0.00 -2.01 0.00 0.00 31.29 31.34 3gdk h VAL 101 CO 0.11 0.32 0.05 0.11 -1.01 0.00 0.00 177.57 177.15 3gdk h LYS 102 N 0.11 0.41 0.00 4.17 1.57 -1.13 -2.18 116.57 119.53 3gdk h LYS 102 Ca 0.02 -0.10 -0.08 0.00 -1.87 0.00 0.00 60.65 58.61 3gdk h LYS 102 Cb 0.55 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 3gdk h LYS 102 CO 0.04 0.52 -0.39 -0.07 -0.57 0.00 0.00 179.45 178.98 3gdk h LEU 103 N 0.23 0.00 -0.95 2.94 3.38 -1.06 0.18 115.31 120.03 3gdk h LEU 103 Ca 0.08 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.95 3gdk h LEU 103 Cb 0.30 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3gdk h LEU 103 CO 0.00 0.39 -0.45 1.56 0.09 0.00 0.00 178.44 180.04 3gdk h GLN 104 N 0.00 0.00 0.08 1.13 4.20 -1.06 -0.27 115.11 119.19 3gdk h GLN 104 Ca -0.00 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.37 3gdk h GLN 104 Cb 0.95 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.70 3gdk h GLN 104 CO 0.05 0.45 -1.83 -0.92 -0.67 0.00 0.00 178.83 175.91 3gdk h TYR 105 N 0.00 0.32 0.02 2.96 3.20 -1.05 -3.41 116.97 119.00 3gdk h TYR 105 Ca -0.00 -0.23 -0.33 0.00 3.14 0.00 0.00 58.73 61.30 3gdk h TYR 105 Cb 0.92 -0.01 -0.05 0.00 1.54 0.00 0.00 36.73 39.12 3gdk h TYR 105 CO 0.00 1.46 -1.98 -1.13 -1.64 0.00 0.00 178.16 174.87 3gdk n SER 106 N -3.33 0.89 0.00 -2.11 3.41 0.60 -0.42 113.62 112.65 3gdk n SER 106 Ca -0.24 0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3gdk n SER 106 Cb 1.05 0.08 0.00 0.00 -0.26 0.00 0.00 64.21 65.08 3gdk n SER 106 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gdk n ALA 107 N -2.71 0.00 -0.57 7.33 0.00 -0.12 -4.44 120.51 120.01 3gdk n ALA 107 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.19 3gdk n ALA 107 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.53 3gdk n ALA 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gdk n GLY 108 N 5.00 -0.34 0.09 0.00 0.00 -1.26 -1.04 105.19 107.65 3gdk n GLY 108 Ca 0.00 -1.06 0.02 0.00 0.00 0.00 0.00 46.02 44.97 3gdk n GLY 108 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3gdk n VAL 109 N -0.20 1.08 0.10 1.61 0.31 -1.26 -4.21 118.33 115.77 3gdk n VAL 109 Ca 0.00 -0.67 -0.03 0.00 -0.01 0.00 0.00 64.34 63.63 3gdk n VAL 109 Cb 0.00 -0.65 -0.02 0.00 -0.91 0.00 0.00 33.84 32.25 3gdk n VAL 109 CO 0.00 0.00 0.00 1.88 -1.32 0.00 0.00 176.83 177.39 3gdk h TYR 110 N 0.00 0.00 -7.05 3.52 0.05 -1.97 -3.46 116.97 108.07 3gdk h TYR 110 Ca -0.15 0.00 -0.61 0.00 0.05 0.00 0.00 58.73 58.02 3gdk h TYR 110 Cb 1.51 0.00 -0.17 0.00 1.01 0.00 0.00 36.73 39.08 3gdk h TYR 110 CO 0.00 0.77 -0.98 0.54 -1.05 0.00 0.00 178.16 177.45 3gdk n ARG 111 N -3.35 -0.88 -0.29 4.88 1.74 -0.21 -4.80 116.66 113.75 3gdk n ARG 111 Ca 0.01 0.09 0.11 0.00 -0.77 0.00 0.00 57.85 57.29 3gdk n ARG 111 Cb 0.82 -3.42 0.26 0.00 -1.02 0.00 0.00 32.46 29.10 3gdk n ARG 111 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 3gdk h ILE 112 N -1.95 0.31 0.00 0.55 2.04 -1.73 -1.14 117.51 115.59 3gdk h ILE 112 Ca -0.67 -0.06 -0.00 0.00 1.00 0.00 0.00 64.86 65.13 3gdk h ILE 112 Cb 1.40 0.12 -0.00 0.00 -0.74 0.00 0.00 36.82 37.60 3gdk h ILE 112 CO 0.67 0.03 -0.00 0.00 0.00 0.00 0.00 178.15 178.86 3gdk h ALA 113 N 1.77 1.12 0.00 1.87 0.00 -1.03 -0.46 119.26 122.52 3gdk h ALA 113 Ca 0.52 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.43 3gdk h ALA 113 Cb 1.02 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.81 3gdk h ALA 113 CO -0.67 0.00 0.00 0.93 0.00 0.00 0.00 179.25 179.51 3gdk h GLU 114 N 0.00 0.00 0.00 0.00 5.08 -1.47 -3.39 114.58 114.80 3gdk h GLU 114 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3gdk h GLU 114 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3gdk h GLU 114 CO 0.00 0.00 -0.10 -2.67 -1.00 0.00 0.00 179.01 175.24 3gdk n TRP 115 N -2.75 0.00 -2.88 4.33 4.27 -0.75 -5.05 117.44 114.61 3gdk n TRP 115 Ca 0.03 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.21 3gdk n TRP 115 Cb 0.37 0.00 -0.05 0.00 -1.36 0.00 0.00 31.31 30.28 3gdk n TRP 115 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 3gdk s ALA 116 N -0.22 3.35 0.24 -1.67 0.00 -0.26 -4.76 121.76 118.44 3gdk s ALA 116 Ca 0.00 -0.70 -0.07 0.00 0.00 0.00 0.00 51.96 51.19 3gdk s ALA 116 Cb 0.00 -3.50 0.22 0.00 0.00 0.00 0.00 23.12 19.84 3gdk s ALA 116 CO 0.00 -1.74 1.88 -0.44 0.00 0.00 0.00 175.76 175.46 3gdk h ASP 117 N 8.73 1.12 -4.30 0.00 3.32 -1.39 -3.43 116.42 120.46 3gdk h ASP 117 Ca -0.24 -0.07 -0.47 0.00 0.02 0.00 0.00 57.03 56.27 3gdk h ASP 117 Cb 1.08 -0.28 -0.25 0.00 0.22 0.00 0.00 39.33 40.10 3gdk h ASP 117 CO 0.97 0.85 -0.80 -0.63 -1.72 0.00 0.00 179.24 177.91 3gdk s ILE 118 N -5.97 1.20 0.23 0.35 1.01 -0.23 -0.92 121.20 116.87 3gdk s ILE 118 Ca -0.13 -0.98 0.00 0.00 0.00 0.00 0.00 60.65 59.54 3gdk s ILE 118 Cb 0.17 -1.07 -0.04 0.00 0.01 0.00 0.00 42.46 41.53 3gdk s ILE 118 CO 0.82 0.07 0.13 0.42 0.00 0.00 0.00 174.94 176.38 3gdk s THR 119 N -0.78 0.18 0.08 2.92 -4.23 -0.93 -2.14 115.64 110.74 3gdk s THR 119 Ca 0.03 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.57 3gdk s THR 119 Cb -0.08 -2.54 -0.03 0.00 1.34 0.00 0.00 72.50 71.19 3gdk s THR 119 CO 0.01 0.00 -0.08 0.54 -0.54 0.00 0.00 174.62 174.55 3gdk s ASN 120 N -3.22 1.22 0.03 3.99 2.20 -1.26 -0.71 114.94 117.18 3gdk s ASN 120 Ca 0.39 -0.81 -0.03 0.00 -0.94 0.00 0.00 52.86 51.46 3gdk s ASN 120 Cb 0.07 0.04 -0.02 0.00 -2.00 0.00 0.00 41.25 39.35 3gdk s ASN 120 CO 0.13 -0.31 0.04 0.00 -2.94 0.00 0.00 177.10 174.02 3gdk s ALA 121 N -2.56 0.02 0.23 3.54 0.00 -0.10 -2.78 121.76 120.12 3gdk s ALA 121 Ca 0.04 -0.56 -0.29 0.00 0.00 0.00 0.00 51.96 51.15 3gdk s ALA 121 Cb -0.02 0.19 -0.09 0.00 0.00 0.00 0.00 23.12 23.20 3gdk s ALA 121 CO -0.01 -0.24 0.91 -1.01 0.00 0.00 0.00 175.76 175.41 3gdk s HIS 122 N -2.07 3.97 -0.70 0.00 3.76 -0.29 -0.68 115.29 119.27 3gdk s HIS 122 Ca -0.10 1.86 0.25 0.00 -0.15 0.00 0.00 55.06 56.93 3gdk s HIS 122 Cb -0.05 -2.94 0.56 0.00 1.11 0.00 0.00 32.58 31.26 3gdk s HIS 122 CO -0.03 0.46 1.52 0.41 -0.85 0.00 0.00 174.74 176.26 3gdk n GLY 123 N 1.48 -1.53 0.42 -2.22 0.00 -1.26 -4.27 105.19 97.81 3gdk n GLY 123 Ca -0.03 -0.16 0.28 0.00 0.00 0.00 0.00 46.02 46.12 3gdk n GLY 123 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3gdk h VAL 124 N 0.00 0.34 0.00 1.61 3.04 -1.94 0.17 116.25 119.47 3gdk h VAL 124 Ca 0.00 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.60 3gdk h VAL 124 Cb 0.73 0.05 0.00 0.00 -2.01 0.00 0.00 31.29 30.06 3gdk h VAL 124 CO 0.00 0.05 0.00 1.33 -1.01 0.00 0.00 177.57 177.94 3gdk n VAL 125 N -4.70 0.04 0.00 1.51 0.24 -1.26 -5.03 118.33 109.12 3gdk n VAL 125 Ca 0.31 0.01 0.00 0.00 -2.04 0.00 0.00 64.34 62.62 3gdk n VAL 125 Cb 1.10 -0.54 0.00 0.00 -1.47 0.00 0.00 33.84 32.94 3gdk n VAL 125 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3gdk n GLY 126 N 1.03 -0.03 0.27 7.63 0.00 0.60 -4.53 105.19 110.17 3gdk n GLY 126 Ca 0.17 -1.88 0.17 0.00 0.00 0.00 0.00 46.02 44.48 3gdk n GLY 126 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gdk h PRO 127 N 0.00 0.00 -0.14 1.61 0.13 -1.93 -2.72 132.00 128.95 3gdk h PRO 127 Ca 0.00 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.17 3gdk h PRO 127 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 3gdk h PRO 127 CO 0.00 0.00 0.16 0.78 -0.23 0.00 0.00 178.00 178.71 3gdk h GLY 128 N 0.00 0.00 1.59 1.56 0.00 -1.95 -0.60 103.07 103.68 3gdk h GLY 128 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.20 3gdk h GLY 128 CO 0.00 0.00 -0.45 1.19 0.00 0.00 0.00 176.54 177.28 3gdk h ILE 129 N 0.00 1.31 0.15 2.60 2.10 -1.67 -1.32 117.51 120.69 3gdk h ILE 129 Ca 0.07 -1.63 -0.01 0.00 1.08 0.00 0.00 64.86 64.37 3gdk h ILE 129 Cb 0.38 1.66 0.00 0.00 -1.09 0.00 0.00 36.82 37.77 3gdk h ILE 129 CO -0.00 0.50 -0.07 0.58 -1.08 0.00 0.00 178.15 178.08 3gdk h VAL 130 N 0.36 0.98 -0.51 2.19 2.07 -1.34 -2.16 116.25 117.84 3gdk h VAL 130 Ca 0.03 -0.96 -0.02 0.00 0.82 0.00 0.00 66.70 66.56 3gdk h VAL 130 Cb 0.93 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 32.21 3gdk h VAL 130 CO 0.08 0.21 0.23 0.77 0.02 0.00 0.00 177.57 178.88 3gdk h SER 131 N -0.70 0.65 0.00 0.57 4.64 -1.48 -0.04 113.55 117.20 3gdk h SER 131 Ca -0.02 -0.06 -0.00 0.00 -0.47 0.00 0.00 61.79 61.23 3gdk h SER 131 Cb 0.50 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 3gdk h SER 131 CO 0.03 0.57 -0.00 1.23 -0.87 0.00 0.00 176.83 177.79 3gdk h GLY 132 N 0.84 -0.00 1.14 -0.77 0.00 -1.28 -2.10 103.07 100.89 3gdk h GLY 132 Ca 0.18 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.44 3gdk h GLY 132 CO -0.02 -0.00 0.11 1.41 0.00 0.00 0.00 176.54 178.04 3gdk h LEU 133 N -0.41 1.01 -0.21 3.11 3.38 -1.23 -2.29 115.31 118.67 3gdk h LEU 133 Ca -0.00 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 57.78 3gdk h LEU 133 Cb 0.41 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 3gdk h LEU 133 CO 0.00 1.00 -0.03 0.50 0.09 0.00 0.00 178.44 180.01 3gdk h LYS 134 N 1.00 0.03 -0.66 1.13 3.64 -0.99 -0.71 116.57 120.01 3gdk h LYS 134 Ca 0.20 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.51 3gdk h LYS 134 Cb 0.42 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.20 3gdk h LYS 134 CO 0.01 0.02 0.15 0.37 -2.27 0.00 0.00 179.45 177.73 3gdk h GLN 135 N 0.03 1.06 -0.61 1.90 4.15 -1.21 -2.56 115.11 117.88 3gdk h GLN 135 Ca 0.10 -0.25 -0.04 0.00 0.77 0.00 0.00 58.65 59.23 3gdk h GLN 135 Cb 0.14 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 27.66 3gdk h GLN 135 CO -0.19 0.94 0.21 0.00 -1.93 0.00 0.00 178.83 177.86 3gdk h ALA 136 N 1.16 0.79 -0.53 3.38 0.00 -1.06 -2.22 119.26 120.78 3gdk h ALA 136 Ca 0.21 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.97 3gdk h ALA 136 Cb 0.37 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 3gdk h ALA 136 CO 0.00 0.44 0.28 0.00 0.00 0.00 0.00 179.25 179.97 3gdk h ALA 137 N 1.07 0.68 -0.59 0.00 0.00 -0.85 -0.04 119.26 119.53 3gdk h ALA 137 Ca 0.20 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 3gdk h ALA 137 Cb 0.26 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3gdk h ALA 137 CO -0.01 -0.05 0.11 0.93 0.00 0.00 0.00 179.25 180.22 3gdk h GLU 138 N 0.55 0.94 -0.01 0.00 5.08 -1.23 -2.40 114.58 117.50 3gdk h GLU 138 Ca 0.23 -0.22 -0.16 0.00 -1.00 0.00 0.00 59.36 58.20 3gdk h GLU 138 Cb 0.11 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 3gdk h GLU 138 CO -0.15 0.86 -0.75 0.93 -1.00 0.00 0.00 179.01 178.91 3gdk h GLU 139 N 0.89 0.06 0.05 2.33 5.08 -0.92 -3.35 114.58 118.71 3gdk h GLU 139 Ca 0.19 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.37 3gdk h GLU 139 Cb 0.37 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.65 3gdk h GLU 139 CO 0.01 0.78 -0.49 0.28 -1.00 0.00 0.00 179.01 178.59 3gdk h VAL 140 N 0.04 1.54 -3.65 3.13 2.07 -0.81 -3.49 116.25 115.07 3gdk h VAL 140 Ca -0.01 -2.24 -0.08 0.00 0.82 0.00 0.00 66.70 65.19 3gdk h VAL 140 Cb 1.33 2.96 -0.14 0.00 -1.52 0.00 0.00 31.29 33.91 3gdk h VAL 140 CO 0.10 0.62 -0.30 0.28 0.02 0.00 0.00 177.57 178.30 3gdk s THR 141 N -2.78 0.12 -0.09 2.57 -1.32 -0.92 -4.98 115.64 108.23 3gdk s THR 141 Ca -0.15 -0.99 0.13 0.00 -1.21 0.00 0.00 61.69 59.48 3gdk s THR 141 Cb 0.01 -1.23 -0.02 0.00 -1.51 0.00 0.00 72.50 69.75 3gdk s THR 141 CO 0.78 -0.55 1.36 0.07 -2.21 0.00 0.00 174.62 174.08 3gdk h LYS 142 N 2.78 0.00 -6.98 7.08 2.10 -1.86 -3.42 116.57 116.29 3gdk h LYS 142 Ca -0.34 0.00 -0.54 0.00 -2.00 0.00 0.00 60.65 57.77 3gdk h LYS 142 Cb 1.21 0.00 0.12 0.00 -0.90 0.00 0.00 32.23 32.66 3gdk h LYS 142 CO 0.53 0.61 0.73 0.39 -2.00 0.00 0.00 179.45 179.71 3gdk n GLU 143 N -3.24 2.38 -1.96 0.07 -0.58 -1.26 -4.95 120.64 111.11 3gdk n GLU 143 Ca 0.01 0.84 -0.36 0.00 -0.42 0.00 0.00 57.16 57.23 3gdk n GLU 143 Cb 0.79 -2.65 0.04 0.00 -0.57 0.00 0.00 31.44 29.05 3gdk n GLU 143 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 3gdk s PRO 144 N -2.36 2.92 0.04 3.49 0.04 -1.26 -5.00 135.00 132.87 3gdk s PRO 144 Ca 0.59 1.89 0.02 0.00 0.04 0.00 0.00 61.00 63.55 3gdk s PRO 144 Cb -0.45 -1.94 -0.02 0.00 0.04 0.00 0.00 34.50 32.12 3gdk s PRO 144 CO 0.59 -1.27 -0.08 1.03 0.04 0.00 0.00 177.00 177.31 3gdk s ARG 145 N -3.30 0.55 0.08 4.56 1.81 -1.26 -4.84 118.95 116.54 3gdk s ARG 145 Ca 0.78 -0.77 0.01 0.00 -1.72 0.00 0.00 55.73 54.03 3gdk s ARG 145 Cb -0.32 -0.33 -0.04 0.00 -0.45 0.00 0.00 34.95 33.81 3gdk s ARG 145 CO 0.35 0.06 -0.06 0.20 -0.68 0.00 0.00 175.30 175.17 3gdk s GLY 146 N -1.59 0.64 -0.02 -3.53 0.00 -0.10 -4.78 107.32 97.94 3gdk s GLY 146 Ca -0.09 -1.21 0.03 0.00 0.00 0.00 0.00 44.72 43.45 3gdk s GLY 146 CO 0.01 -1.30 -0.12 -2.27 0.00 0.00 0.00 173.10 169.41 3gdk s LEU 147 N -2.75 1.89 -0.07 0.66 2.96 0.48 -2.19 118.68 119.65 3gdk s LEU 147 Ca 0.07 -0.23 0.01 0.00 -0.22 0.00 0.00 54.13 53.76 3gdk s LEU 147 Cb 0.03 -0.67 -0.03 0.00 0.50 0.00 0.00 46.19 46.03 3gdk s LEU 147 CO -0.05 0.11 -0.09 -0.76 -1.32 0.00 0.00 176.35 174.24 3gdk s LEU 148 N 0.01 3.02 -0.07 -0.68 1.43 0.12 -1.28 118.68 121.21 3gdk s LEU 148 Ca -0.01 -0.10 -0.11 0.00 -1.03 0.00 0.00 54.13 52.89 3gdk s LEU 148 Cb -0.08 -1.65 -0.05 0.00 0.03 0.00 0.00 46.19 44.44 3gdk s LEU 148 CO 0.00 0.34 0.26 -0.04 0.23 0.00 0.00 176.35 177.14 3gdk s MET 149 N -0.66 3.69 -1.26 1.70 -1.94 -0.48 -0.92 119.30 119.42 3gdk s MET 149 Ca 0.10 0.10 -0.17 0.00 -1.71 0.00 0.00 55.69 54.01 3gdk s MET 149 Cb -0.11 -3.22 0.10 0.00 2.01 0.00 0.00 34.83 33.61 3gdk s MET 149 CO 0.01 0.71 1.63 -0.51 -0.01 0.00 0.00 175.02 176.85 3gdk s LEU 150 N -0.95 4.25 0.11 -0.03 1.43 0.14 -1.77 118.68 121.86 3gdk s LEU 150 Ca 0.19 -2.61 -0.11 0.00 -1.03 0.00 0.00 54.13 50.57 3gdk s LEU 150 Cb -0.14 -2.52 -0.12 0.00 0.03 0.00 0.00 46.19 43.44 3gdk s LEU 150 CO 0.08 -1.04 1.33 0.00 0.23 0.00 0.00 176.35 176.96 3gdk h ALA 151 N 7.49 0.36 -3.21 4.21 0.00 -1.79 -3.42 119.26 122.90 3gdk h ALA 151 Ca 0.40 -0.59 -0.46 0.00 0.00 0.00 0.00 54.91 54.26 3gdk h ALA 151 Cb 0.88 -0.03 -0.40 0.00 0.00 0.00 0.00 17.79 18.24 3gdk h ALA 151 CO 1.38 0.69 -0.76 -1.21 0.00 0.00 0.00 179.25 179.36 3gdk s GLU 152 N -3.80 0.38 0.38 0.00 2.02 -1.07 -4.34 118.70 112.28 3gdk s GLU 152 Ca -0.10 -0.07 -0.07 0.00 0.02 0.00 0.00 54.97 54.75 3gdk s GLU 152 Cb 0.09 -1.50 -0.05 0.00 0.10 0.00 0.00 34.13 32.77 3gdk s GLU 152 CO 0.90 -0.51 0.69 -0.51 0.02 0.00 0.00 175.26 175.85 3gdk s LEU 153 N 2.01 3.86 0.00 1.80 1.43 -1.26 -4.27 118.68 122.25 3gdk s LEU 153 Ca 0.02 0.90 0.10 0.00 -1.03 0.00 0.00 54.13 54.12 3gdk s LEU 153 Cb -0.15 -3.78 0.05 0.00 0.03 0.00 0.00 46.19 42.34 3gdk s LEU 153 CO -0.07 -0.38 0.74 -1.54 0.23 0.00 0.00 176.35 175.33 3gdk n SER 154 N -1.47 1.58 -4.79 2.29 3.41 -1.26 -4.94 113.62 108.44 3gdk n SER 154 Ca 0.00 -1.29 -0.34 0.00 -0.26 0.00 0.00 58.87 56.98 3gdk n SER 154 Cb 0.54 0.17 -0.01 0.00 -0.26 0.00 0.00 64.21 64.65 3gdk n SER 154 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gdk n LYS 156 N -1.37 1.94 -1.65 0.00 4.81 -1.26 -2.42 118.16 118.22 3gdk n LYS 156 Ca 0.10 0.71 -0.10 0.00 -0.87 0.00 0.00 58.31 58.15 3gdk n LYS 156 Cb 0.52 -2.50 -0.03 0.00 0.02 0.00 0.00 35.03 33.04 3gdk n LYS 156 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3gdk n GLY 157 N 4.09 0.69 3.74 3.14 0.00 -1.26 -5.00 105.19 110.58 3gdk n GLY 157 Ca 0.22 -0.52 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 3gdk n GLY 157 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3gdk s SER 158 N -2.75 4.36 -0.21 1.61 1.04 -1.01 -4.93 113.70 111.81 3gdk s SER 158 Ca 0.00 2.16 0.15 0.00 0.48 0.00 0.00 55.95 58.74 3gdk s SER 158 Cb 0.00 -2.57 0.75 0.00 0.10 0.00 0.00 66.02 64.31 3gdk s SER 158 CO 0.00 -2.14 1.67 0.18 0.98 0.00 0.00 173.24 173.93 3gdk n LEU 159 N -2.91 5.25 -3.45 2.42 4.77 -1.26 -4.71 117.00 117.11 3gdk n LEU 159 Ca 0.12 -2.88 -0.40 0.00 -0.03 0.00 0.00 56.01 52.82 3gdk n LEU 159 Cb 0.51 -0.64 -0.02 0.00 -2.33 0.00 0.00 43.42 40.95 3gdk n LEU 159 CO 0.48 0.67 2.88 0.00 -1.33 0.00 0.00 177.39 180.09 3gdk n ALA 160 N 0.48 6.94 -2.67 -1.18 0.00 -1.26 -4.75 120.51 118.06 3gdk n ALA 160 Ca 0.26 -3.82 -0.03 0.00 0.00 0.00 0.00 53.44 49.86 3gdk n ALA 160 Cb 1.10 -3.16 0.01 0.00 0.00 0.00 0.00 19.45 17.40 3gdk n ALA 160 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3gdk n THR 161 N 3.08 0.00 0.00 0.00 -2.24 -1.26 -4.57 114.28 109.29 3gdk n THR 161 Ca 0.68 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 62.25 3gdk n THR 161 Cb 0.26 -1.12 0.00 0.00 -2.10 0.00 0.00 70.33 67.37 3gdk n THR 161 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gdk n GLY 162 N 4.15 -1.45 0.26 3.38 0.00 -1.26 -0.08 105.19 110.20 3gdk n GLY 162 Ca 0.02 0.28 -0.02 0.00 0.00 0.00 0.00 46.02 46.30 3gdk n GLY 162 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3gdk h GLU 163 N 0.00 0.56 -0.30 1.61 4.39 -1.96 -1.21 114.58 117.67 3gdk h GLU 163 Ca 0.00 -0.15 -0.02 0.00 0.34 0.00 0.00 59.36 59.52 3gdk h GLU 163 Cb 0.00 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 3gdk h GLU 163 CO 0.00 0.65 0.09 -0.92 -1.16 0.00 0.00 179.01 177.67 3gdk h TYR 164 N 0.52 0.48 -0.40 4.33 3.20 -1.52 -0.13 116.97 123.44 3gdk h TYR 164 Ca 0.10 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.92 3gdk h TYR 164 Cb 0.47 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.58 3gdk h TYR 164 CO 0.02 0.51 0.26 1.15 -1.64 0.00 0.00 178.16 178.45 3gdk h THR 165 N 0.32 1.11 -0.48 1.81 2.02 -0.24 -0.23 112.91 117.21 3gdk h THR 165 Ca 0.10 -0.22 0.02 0.00 0.77 0.00 0.00 66.41 67.07 3gdk h THR 165 Cb 0.25 0.54 -0.03 0.00 -1.74 0.00 0.00 68.15 67.18 3gdk h THR 165 CO -0.00 0.11 0.30 0.50 0.37 0.00 0.00 175.52 176.79 3gdk h LYS 166 N 0.54 0.58 -0.38 6.66 3.64 -1.03 -0.56 116.57 126.02 3gdk h LYS 166 Ca 0.15 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 3gdk h LYS 166 Cb -0.04 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.63 3gdk h LYS 166 CO -0.03 0.38 0.12 0.78 -2.27 0.00 0.00 179.45 178.44 3gdk h GLY 167 N 0.60 0.58 1.15 5.01 0.00 -0.61 -1.84 103.07 107.95 3gdk h GLY 167 Ca 0.19 -0.29 -0.15 0.00 0.00 0.00 0.00 47.33 47.08 3gdk h GLY 167 CO -0.07 0.27 -0.35 -0.84 0.00 0.00 0.00 176.54 175.55 3gdk h THR 168 N 0.54 1.27 -0.75 4.70 2.02 -0.22 -2.31 112.91 118.17 3gdk h THR 168 Ca 0.13 -1.52 0.00 0.00 0.77 0.00 0.00 66.41 65.79 3gdk h THR 168 Cb 0.16 1.32 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 3gdk h THR 168 CO -0.01 0.51 0.48 0.58 0.37 0.00 0.00 175.52 177.46 3gdk h VAL 169 N 0.78 1.20 -0.64 3.16 2.07 -0.54 -1.30 116.25 120.98 3gdk h VAL 169 Ca 0.07 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.18 3gdk h VAL 169 Cb 0.94 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 3gdk h VAL 169 CO 0.09 0.20 0.34 0.44 0.02 0.00 0.00 177.57 178.65 3gdk h ASP 170 N 1.02 0.81 -0.59 0.57 3.32 -1.22 -1.57 116.42 118.76 3gdk h ASP 170 Ca 0.27 -0.11 0.05 0.00 0.02 0.00 0.00 57.03 57.27 3gdk h ASP 170 Cb -0.09 -0.21 -0.05 0.00 0.22 0.00 0.00 39.33 39.20 3gdk h ASP 170 CO -0.06 0.69 0.32 0.40 -1.72 0.00 0.00 179.24 178.87 3gdk h ILE 171 N 0.88 0.97 -0.86 0.35 2.04 -0.86 -1.65 117.51 118.37 3gdk h ILE 171 Ca 0.22 -0.21 0.08 0.00 1.00 0.00 0.00 64.86 65.96 3gdk h ILE 171 Cb 0.07 0.31 -0.07 0.00 -0.74 0.00 0.00 36.82 36.39 3gdk h ILE 171 CO -0.03 0.11 0.52 0.00 0.00 0.00 0.00 178.15 178.75 3gdk h ALA 172 N 1.31 1.21 0.00 1.87 0.00 -0.54 -1.61 119.26 121.51 3gdk h ALA 172 Ca 0.26 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3gdk h ALA 172 Cb 0.15 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3gdk h ALA 172 CO -0.17 0.20 0.09 0.87 0.00 0.00 0.00 179.25 180.25 3gdk h LYS 173 N 0.91 0.00 0.00 0.00 1.57 -0.35 -2.59 116.57 116.11 3gdk h LYS 173 Ca 0.40 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.18 3gdk h LYS 173 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 3gdk h LYS 173 CO -0.21 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.33 3gdk h SER 174 N 0.00 0.00 -1.51 0.86 4.64 -1.25 -3.39 113.55 112.90 3gdk h SER 174 Ca 0.00 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.07 3gdk h SER 174 Cb 0.17 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 62.01 3gdk h SER 174 CO 0.00 0.00 -0.60 -0.62 -0.87 0.00 0.00 176.83 174.74 3gdk s ASP 175 N -5.07 -0.15 0.00 4.97 -1.08 -0.97 -4.99 116.67 109.38 3gdk s ASP 175 Ca 0.02 -1.47 0.20 0.00 -0.52 0.00 0.00 52.55 50.77 3gdk s ASP 175 Cb 0.09 1.17 0.89 0.00 -1.46 0.00 0.00 42.92 43.61 3gdk s ASP 175 CO 0.46 -0.19 1.63 2.29 0.52 0.00 0.00 175.17 179.89 3gdk n LYS 176 N 3.96 0.07 0.05 4.34 2.85 -1.26 -1.13 118.16 127.05 3gdk n LYS 176 Ca 0.14 0.14 -0.15 0.00 -1.05 0.00 0.00 58.31 57.40 3gdk n LYS 176 Cb 0.51 -1.50 -0.14 0.00 -0.65 0.00 0.00 35.03 33.25 3gdk n LYS 176 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 3gdk h ASP 177 N 0.00 0.30 0.00 -5.58 3.32 -1.94 -3.39 116.42 109.13 3gdk h ASP 177 Ca 0.00 -0.42 -0.39 0.00 0.02 0.00 0.00 57.03 56.25 3gdk h ASP 177 Cb 0.30 -0.10 -0.07 0.00 0.22 0.00 0.00 39.33 39.68 3gdk h ASP 177 CO 0.00 1.35 -2.46 0.33 -1.72 0.00 0.00 179.24 176.74 3gdk n PHE 178 N -3.40 0.00 -2.89 4.55 7.35 -1.15 -4.42 117.46 117.50 3gdk n PHE 178 Ca -0.14 0.00 -0.43 0.00 -0.76 0.00 0.00 57.45 56.12 3gdk n PHE 178 Cb 1.03 -0.99 -0.04 0.00 0.35 0.00 0.00 39.48 39.83 3gdk n PHE 178 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 3gdk s VAL 179 N -2.51 4.44 -1.23 -2.13 1.01 -0.28 -0.39 120.40 119.30 3gdk s VAL 179 Ca -0.34 -0.08 0.26 0.00 0.00 0.00 0.00 61.98 61.82 3gdk s VAL 179 Cb 0.09 -4.56 0.10 0.00 0.00 0.00 0.00 36.38 32.01 3gdk s VAL 179 CO 0.60 -1.19 1.48 2.30 0.00 0.00 0.00 175.10 178.29 3gdk n ILE 180 N 6.00 0.00 -1.30 2.22 -5.35 -0.41 -4.62 119.36 115.92 3gdk n ILE 180 Ca -0.02 -0.04 0.00 0.00 -0.27 0.00 0.00 62.75 62.43 3gdk n ILE 180 Cb 0.46 0.26 0.00 0.00 -1.74 0.00 0.00 39.64 38.63 3gdk n ILE 180 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3gdk n GLY 181 N 1.45 -0.53 3.13 3.28 0.00 -1.24 -1.07 105.19 110.21 3gdk n GLY 181 Ca 0.08 -0.81 -0.08 0.00 0.00 0.00 0.00 46.02 45.21 3gdk n GLY 181 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gdk s PHE 182 N -3.66 0.42 -0.33 1.61 0.08 0.12 -1.39 117.98 114.83 3gdk s PHE 182 Ca 0.00 -0.92 -0.13 0.00 0.12 0.00 0.00 56.93 56.00 3gdk s PHE 182 Cb 0.00 -0.28 -0.02 0.00 -0.57 0.00 0.00 43.02 42.14 3gdk s PHE 182 CO 0.00 -0.44 0.28 0.42 -0.10 0.00 0.00 175.22 175.37 3gdk s ILE 183 N -3.91 5.25 0.29 0.64 -1.09 -0.73 -0.99 121.20 120.66 3gdk s ILE 183 Ca 0.07 -0.03 -0.16 0.00 -2.23 0.00 0.00 60.65 58.30 3gdk s ILE 183 Cb 0.07 -3.72 0.02 0.00 -1.58 0.00 0.00 42.46 37.25 3gdk s ILE 183 CO -0.10 0.02 0.63 0.00 -1.23 0.00 0.00 174.94 174.26 3gdk s ALA 184 N 1.84 -0.67 -1.37 9.38 0.00 -0.77 -2.39 121.76 127.78 3gdk s ALA 184 Ca 0.08 -0.66 0.14 0.00 0.00 0.00 0.00 51.96 51.53 3gdk s ALA 184 Cb -0.17 0.92 0.33 0.00 0.00 0.00 0.00 23.12 24.21 3gdk s ALA 184 CO 0.11 -0.95 1.25 1.04 0.00 0.00 0.00 175.76 177.21 3gdk n GLN 185 N -0.45 2.41 -3.76 0.00 1.13 -1.26 -4.02 117.38 111.42 3gdk n GLN 185 Ca -0.03 -2.02 -0.03 0.00 -1.94 0.00 0.00 57.00 52.97 3gdk n GLN 185 Cb 0.60 -1.34 -0.01 0.00 0.11 0.00 0.00 30.24 29.61 3gdk n GLN 185 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 3gdk s ARG 186 N -1.05 1.16 0.34 -1.09 1.70 -1.26 -4.96 118.95 113.79 3gdk s ARG 186 Ca 0.27 -0.66 -0.29 0.00 -0.47 0.00 0.00 55.73 54.59 3gdk s ARG 186 Cb 0.15 0.38 -0.11 0.00 -0.57 0.00 0.00 34.95 34.80 3gdk s ARG 186 CO 0.20 -0.53 1.52 0.34 -1.08 0.00 0.00 175.30 175.75 3gdk s ASP 187 N -3.01 6.37 -0.09 -2.89 2.15 -1.19 -4.90 116.67 113.12 3gdk s ASP 187 Ca 0.14 3.00 0.15 0.00 0.43 0.00 0.00 52.55 56.27 3gdk s ASP 187 Cb -0.01 -2.65 0.52 0.00 -0.30 0.00 0.00 42.92 40.47 3gdk s ASP 187 CO 0.02 -0.88 1.44 0.23 -0.17 0.00 0.00 175.17 175.81 3gdk n MET 188 N 1.16 3.18 0.00 4.34 2.81 -1.26 -5.07 117.12 122.28 3gdk n MET 188 Ca 0.04 -2.57 0.00 0.00 -1.81 0.00 0.00 57.70 53.36 3gdk n MET 188 Cb 0.39 -1.64 0.00 0.00 -0.71 0.00 0.00 33.22 31.25 3gdk n MET 188 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3gdk n GLY 189 N 0.49 2.66 1.48 3.03 0.00 -1.26 -4.92 105.19 106.67 3gdk n GLY 189 Ca 0.19 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.79 3gdk n GLY 189 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gdk n GLY 190 N 0.00 2.78 0.35 -0.02 0.00 -1.26 -4.73 105.19 102.32 3gdk n GLY 190 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 3gdk n GLY 190 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3gdk h ARG 191 N 2.46 1.22 -0.71 1.61 3.08 -1.91 -0.80 114.38 119.33 3gdk h ARG 191 Ca 0.00 -0.10 0.12 0.00 0.07 0.00 0.00 59.98 60.07 3gdk h ARG 191 Cb 0.00 -0.26 -0.05 0.00 0.08 0.00 0.00 29.97 29.74 3gdk h ARG 191 CO 0.00 0.84 0.47 -0.44 -1.07 0.00 0.00 179.97 179.77 3gdk h ASP 192 N 1.25 0.45 -0.59 7.04 3.32 -1.91 -2.14 116.42 123.84 3gdk h ASP 192 Ca 0.33 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.40 3gdk h ASP 192 Cb -0.09 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.38 3gdk h ASP 192 CO -0.07 0.26 0.00 -0.62 -1.72 0.00 0.00 179.24 177.09 3gdk n GLU 193 N -4.48 4.09 -0.78 3.56 1.02 -0.91 -4.93 120.64 118.20 3gdk n GLU 193 Ca 0.12 -2.86 0.00 0.00 -0.02 0.00 0.00 57.16 54.41 3gdk n GLU 193 Cb 0.42 -2.03 0.00 0.00 -0.02 0.00 0.00 31.44 29.81 3gdk n GLU 193 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gdk n GLY 194 N 0.90 0.58 3.85 0.62 0.00 -0.80 -5.05 105.19 105.28 3gdk n GLY 194 Ca 0.26 -0.26 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 3gdk n GLY 194 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gdk s TYR 195 N -2.00 3.54 -0.57 1.61 2.02 -0.36 -5.01 117.35 116.59 3gdk s TYR 195 Ca 0.00 0.48 0.04 0.00 -0.37 0.00 0.00 57.07 57.22 3gdk s TYR 195 Cb 0.00 -1.94 0.16 0.00 -0.40 0.00 0.00 41.96 39.78 3gdk s TYR 195 CO 0.00 0.68 0.39 0.34 -1.57 0.00 0.00 175.55 175.39 3gdk s ASP 196 N -0.93 3.76 0.06 2.29 2.15 -1.26 -3.28 116.67 119.46 3gdk s ASP 196 Ca 0.14 -3.36 -0.24 0.00 0.43 0.00 0.00 52.55 49.52 3gdk s ASP 196 Cb -0.12 -1.24 -0.06 0.00 -0.30 0.00 0.00 42.92 41.20 3gdk s ASP 196 CO 0.03 -0.15 0.72 0.26 -0.17 0.00 0.00 175.17 175.86 3gdk s TRP 197 N -0.66 3.76 -0.03 -5.34 0.51 -1.26 -4.90 118.94 111.03 3gdk s TRP 197 Ca 0.25 1.44 -0.30 0.00 -2.12 0.00 0.00 56.10 55.36 3gdk s TRP 197 Cb -0.08 -2.75 -0.03 0.00 -0.81 0.00 0.00 33.47 29.80 3gdk s TRP 197 CO -0.13 0.35 1.08 -0.51 -0.51 0.00 0.00 176.95 177.24 3gdk s LEU 198 N -0.35 4.31 -0.35 2.99 1.43 -0.24 -4.91 118.68 121.56 3gdk s LEU 198 Ca 0.36 1.73 -0.09 0.00 -1.03 0.00 0.00 54.13 55.10 3gdk s LEU 198 Cb -0.20 -3.57 0.03 0.00 0.03 0.00 0.00 46.19 42.48 3gdk s LEU 198 CO 0.22 -0.43 0.16 -0.63 0.23 0.00 0.00 176.35 175.90 3gdk s ILE 199 N 1.58 4.23 -0.21 -0.59 -1.09 -1.26 -0.71 121.20 123.16 3gdk s ILE 199 Ca 0.53 -0.94 -0.05 0.00 -2.23 0.00 0.00 60.65 57.96 3gdk s ILE 199 Cb -0.23 -3.36 -0.02 0.00 -1.58 0.00 0.00 42.46 37.27 3gdk s ILE 199 CO 0.24 -0.18 0.00 -0.04 -1.23 0.00 0.00 174.94 173.73 3gdk s MET 200 N 1.49 3.59 -0.18 2.79 -1.94 -0.16 -0.44 119.30 124.45 3gdk s MET 200 Ca 0.01 -0.53 0.01 0.00 -1.71 0.00 0.00 55.69 53.47 3gdk s MET 200 Cb -0.19 -3.09 0.03 0.00 2.01 0.00 0.00 34.83 33.58 3gdk s MET 200 CO 0.05 -0.03 -0.17 0.99 -0.01 0.00 0.00 175.02 175.84 3gdk s THR 201 N 1.12 1.91 0.76 2.05 2.01 -0.31 -1.85 115.64 121.34 3gdk s THR 201 Ca 0.03 -0.92 -0.04 0.00 0.31 0.00 0.00 61.69 61.07 3gdk s THR 201 Cb -0.14 -1.78 0.14 0.00 0.01 0.00 0.00 72.50 70.72 3gdk s THR 201 CO 0.01 0.44 1.05 -2.16 -0.69 0.00 0.00 174.62 173.28 3gdk s PRO 202 N 1.33 1.50 -0.63 4.92 0.04 -1.26 -0.71 135.00 140.20 3gdk s PRO 202 Ca 0.03 -0.96 -0.00 0.00 0.04 0.00 0.00 61.00 60.11 3gdk s PRO 202 Cb -0.14 -2.24 0.00 0.00 0.04 0.00 0.00 34.50 32.16 3gdk s PRO 202 CO -0.11 -1.62 0.53 0.41 0.04 0.00 0.00 177.00 176.25 3gdk n GLY 203 N -3.01 0.04 3.30 0.56 0.00 -1.25 -4.89 105.19 99.93 3gdk n GLY 203 Ca 0.15 -0.18 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 3gdk n GLY 203 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gdk s VAL 204 N -3.19 2.10 0.34 1.61 1.01 -1.26 -2.66 120.40 118.36 3gdk s VAL 204 Ca 0.03 -1.07 0.07 0.00 0.00 0.00 0.00 61.98 61.00 3gdk s VAL 204 Cb -0.01 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.61 3gdk s VAL 204 CO 0.38 0.58 0.24 0.61 0.00 0.00 0.00 175.10 176.90 3gdk n GLY 205 N 2.65 3.03 0.18 4.51 0.00 0.77 -4.87 105.19 111.47 3gdk n GLY 205 Ca -0.17 -1.95 0.07 0.00 0.00 0.00 0.00 46.02 43.97 3gdk n GLY 205 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3gdk n LEU 206 N 0.00 2.48 -3.72 0.99 4.77 -1.26 -1.76 117.00 118.50 3gdk n LEU 206 Ca 0.04 -2.76 -0.29 0.00 -0.03 0.00 0.00 56.01 52.97 3gdk n LEU 206 Cb 0.59 -0.33 0.03 0.00 -2.33 0.00 0.00 43.42 41.38 3gdk n LEU 206 CO 0.31 0.65 -0.10 0.47 -1.33 0.00 0.00 177.39 177.39 3gdk n ASP 207 N -1.00 -3.99 -4.76 -1.43 9.92 -1.26 -4.91 116.55 109.12 3gdk n ASP 207 Ca 0.12 -0.98 -0.39 0.00 -0.53 0.00 0.00 54.79 53.01 3gdk n ASP 207 Cb 0.56 -3.47 -0.04 0.00 -0.64 0.00 0.00 41.12 37.54 3gdk n ASP 207 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 3gdk s ASP 208 N -3.73 7.07 0.12 -2.24 1.01 -1.26 -4.94 116.67 112.70 3gdk s ASP 208 Ca 0.34 2.23 -0.35 0.00 0.71 0.00 0.00 52.55 55.48 3gdk s ASP 208 Cb -0.12 -2.62 -0.15 0.00 1.01 0.00 0.00 42.92 41.05 3gdk s ASP 208 CO 0.86 -0.28 1.54 1.17 0.21 0.00 0.00 175.17 178.66 3gdk n LYS 209 N 0.79 1.88 -0.94 8.23 4.81 -1.26 -1.54 118.16 130.12 3gdk n LYS 209 Ca 0.01 0.68 0.00 0.00 -0.87 0.00 0.00 58.31 58.13 3gdk n LYS 209 Cb 0.46 -2.42 0.00 0.00 0.02 0.00 0.00 35.03 33.09 3gdk n LYS 209 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3gdk n GLY 210 N 3.26 0.39 3.36 3.14 0.00 -1.26 -4.95 105.19 109.11 3gdk n GLY 210 Ca 0.18 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.74 3gdk n GLY 210 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3gdk s ASP 211 N -2.18 6.94 0.14 1.61 2.15 -0.59 -4.89 116.67 119.85 3gdk s ASP 211 Ca 0.00 -2.90 -0.17 0.00 0.43 0.00 0.00 52.55 49.90 3gdk s ASP 211 Cb 0.00 -2.25 -0.00 0.00 -0.30 0.00 0.00 42.92 40.37 3gdk s ASP 211 CO 0.00 -0.56 1.78 0.00 -0.17 0.00 0.00 175.17 176.22 3gdk h ALA 212 N 7.53 0.39 -0.23 3.66 0.00 -1.93 -0.73 119.26 127.96 3gdk h ALA 212 Ca 0.15 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.09 3gdk h ALA 212 Cb 0.98 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 3gdk h ALA 212 CO 0.90 -0.19 0.05 1.25 0.00 0.00 0.00 179.25 181.26 3gdk h LEU 213 N 0.36 0.02 -1.21 0.00 5.85 -1.99 -2.55 115.31 115.80 3gdk h LEU 213 Ca 0.12 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.80 3gdk h LEU 213 Cb 0.01 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 3gdk h LEU 213 CO -0.06 0.04 -0.39 1.23 -0.34 0.00 0.00 178.44 178.92 3gdk h GLY 214 N 0.14 0.00 1.43 3.75 0.00 -1.91 -2.63 103.07 103.85 3gdk h GLY 214 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 3gdk h GLY 214 CO -0.13 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.35 3gdk n GLN 215 N -4.01 0.36 0.19 4.80 6.02 -0.29 -2.27 117.38 122.17 3gdk n GLN 215 Ca -0.02 0.08 0.08 0.00 -0.01 0.00 0.00 57.00 57.13 3gdk n GLN 215 Cb 0.43 -1.50 0.21 0.00 1.02 0.00 0.00 30.24 30.40 3gdk n GLN 215 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 3gdk h GLN 216 N 0.00 0.00 -7.08 -1.09 4.20 -1.38 -3.45 115.11 106.30 3gdk h GLN 216 Ca 0.00 0.00 -0.46 0.00 0.06 0.00 0.00 58.65 58.25 3gdk h GLN 216 Cb 0.14 0.00 0.06 0.00 0.30 0.00 0.00 27.48 27.98 3gdk h GLN 216 CO 0.00 0.26 0.12 0.71 -0.67 0.00 0.00 178.83 179.25 3gdk s TYR 217 N -3.24 3.05 0.43 2.96 2.02 -0.96 -5.08 117.35 116.53 3gdk s TYR 217 Ca 0.04 0.40 -0.12 0.00 -0.37 0.00 0.00 57.07 57.02 3gdk s TYR 217 Cb 0.08 -2.86 -0.07 0.00 -0.40 0.00 0.00 41.96 38.71 3gdk s TYR 217 CO 0.68 -0.99 0.82 1.03 -1.57 0.00 0.00 175.55 175.53 3gdk s ARG 218 N -4.99 3.81 0.63 -0.62 0.52 -1.09 -4.69 118.95 112.52 3gdk s ARG 218 Ca 0.56 0.58 -0.09 0.00 -0.52 0.00 0.00 55.73 56.27 3gdk s ARG 218 Cb -0.10 -2.33 0.00 0.00 0.52 0.00 0.00 34.95 33.04 3gdk s ARG 218 CO 0.43 -0.10 0.98 0.95 0.02 0.00 0.00 175.30 177.58 3gdk s THR 219 N -2.45 3.85 0.11 0.02 -4.23 -1.26 -0.16 115.64 111.53 3gdk s THR 219 Ca 0.53 0.32 -0.22 0.00 -1.18 0.00 0.00 61.69 61.14 3gdk s THR 219 Cb -0.10 -3.56 -0.07 0.00 1.34 0.00 0.00 72.50 70.11 3gdk s THR 219 CO 0.32 -0.65 1.71 0.58 -0.54 0.00 0.00 174.62 176.03 3gdk h VAL 220 N -0.34 0.83 -0.76 2.29 2.07 -1.71 -1.69 116.25 116.94 3gdk h VAL 220 Ca -0.45 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.14 3gdk h VAL 220 Cb 1.24 0.83 -0.06 0.00 -1.52 0.00 0.00 31.29 31.78 3gdk h VAL 220 CO 0.62 0.00 0.44 0.44 0.02 0.00 0.00 177.57 179.09 3gdk h ASP 221 N -0.05 0.66 0.19 0.57 3.32 -1.87 -0.13 116.42 119.10 3gdk h ASP 221 Ca 0.06 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 3gdk h ASP 221 Cb 0.14 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 3gdk h ASP 221 CO -0.13 0.41 -0.11 -0.78 -1.72 0.00 0.00 179.24 176.91 3gdk h ASP 222 N 0.79 -0.27 -0.21 6.45 3.58 -1.80 -0.84 116.42 124.12 3gdk h ASP 222 Ca 0.35 0.02 -0.09 0.00 0.42 0.00 0.00 57.03 57.72 3gdk h ASP 222 Cb 0.23 0.08 -0.00 0.00 1.72 0.00 0.00 39.33 41.36 3gdk h ASP 222 CO -0.20 -0.18 -0.23 -0.37 -2.88 0.00 0.00 179.24 175.38 3gdk h VAL 223 N -0.28 1.33 -0.68 2.25 -1.51 -1.06 -2.51 116.25 113.79 3gdk h VAL 223 Ca -0.02 -1.41 -0.03 0.00 -1.23 0.00 0.00 66.70 64.01 3gdk h VAL 223 Cb 0.23 1.77 -0.03 0.00 -2.13 0.00 0.00 31.29 31.13 3gdk h VAL 223 CO 0.02 0.43 0.32 0.58 -1.23 0.00 0.00 177.57 177.69 3gdk h VAL 224 N 0.20 1.22 0.00 7.19 2.07 -1.04 -1.63 116.25 124.25 3gdk h VAL 224 Ca 0.03 -0.64 -0.07 0.00 0.82 0.00 0.00 66.70 66.85 3gdk h VAL 224 Cb 0.79 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 3gdk h VAL 224 CO 0.06 0.27 -0.32 0.77 0.02 0.00 0.00 177.57 178.36 3gdk h SER 225 N 0.97 0.00 -0.46 0.57 4.64 -1.10 -2.86 113.55 115.31 3gdk h SER 225 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 3gdk h SER 225 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 3gdk h SER 225 CO -0.03 0.32 0.00 0.35 -0.87 0.00 0.00 176.83 176.60 3gdk n THR 226 N -3.91 1.73 0.00 2.95 -2.24 -0.72 -4.92 114.28 107.18 3gdk n THR 226 Ca -0.02 -0.96 0.00 0.00 -2.27 0.00 0.00 64.05 60.80 3gdk n THR 226 Cb 0.39 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 3gdk n THR 226 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gdk n GLY 227 N 0.69 2.04 3.74 3.38 0.00 -1.08 -3.15 105.19 110.81 3gdk n GLY 227 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3gdk n GLY 227 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gdk s SER 228 N -1.90 6.55 -0.05 1.61 0.01 -0.70 -4.68 113.70 114.54 3gdk s SER 228 Ca 0.00 2.74 0.19 0.00 1.31 0.00 0.00 55.95 60.19 3gdk s SER 228 Cb 0.00 -2.62 -0.23 0.00 0.21 0.00 0.00 66.02 63.38 3gdk s SER 228 CO 0.00 -0.80 0.47 0.47 0.41 0.00 0.00 173.24 173.79 3gdk n ASP 229 N 2.76 0.34 -3.81 2.44 8.00 0.41 -4.51 116.55 122.18 3gdk n ASP 229 Ca 0.09 0.15 -0.14 0.00 0.71 0.00 0.00 54.79 55.60 3gdk n ASP 229 Cb 0.39 0.92 -0.15 0.00 -0.02 0.00 0.00 41.12 42.26 3gdk n ASP 229 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3gdk s ILE 230 N -2.92 -0.03 -0.18 0.53 1.01 -0.76 -4.81 121.20 114.03 3gdk s ILE 230 Ca -0.07 0.13 -0.11 0.00 0.00 0.00 0.00 60.65 60.60 3gdk s ILE 230 Cb 0.09 -0.05 -0.05 0.00 0.01 0.00 0.00 42.46 42.46 3gdk s ILE 230 CO 0.84 0.05 0.17 0.27 0.00 0.00 0.00 174.94 176.28 3gdk s ILE 231 N 0.63 5.39 -0.31 2.92 -4.36 -0.52 -1.16 121.20 123.79 3gdk s ILE 231 Ca -0.05 0.28 -0.10 0.00 -0.26 0.00 0.00 60.65 60.52 3gdk s ILE 231 Cb -0.08 -3.51 -0.02 0.00 1.25 0.00 0.00 42.46 40.11 3gdk s ILE 231 CO -0.02 0.44 0.17 -0.63 0.24 0.00 0.00 174.94 175.15 3gdk s ILE 232 N 0.28 4.86 -0.07 8.37 1.01 0.11 -0.93 121.20 134.82 3gdk s ILE 232 Ca 0.11 -0.26 0.05 0.00 0.00 0.00 0.00 60.65 60.55 3gdk s ILE 232 Cb -0.12 -3.44 -0.01 0.00 0.01 0.00 0.00 42.46 38.91 3gdk s ILE 232 CO -0.00 0.10 -0.24 -0.69 0.00 0.00 0.00 174.94 174.10 3gdk s VAL 233 N 1.66 2.00 0.00 2.92 1.01 -0.31 -3.91 120.40 123.78 3gdk s VAL 233 Ca 0.05 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 61.01 3gdk s VAL 233 Cb -0.17 -1.71 0.00 0.00 0.00 0.00 0.00 36.38 34.51 3gdk s VAL 233 CO 0.08 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.34 3gdk n GLY 234 N 3.14 0.85 0.49 4.51 0.00 -1.26 -0.33 105.19 112.59 3gdk n GLY 234 Ca -0.18 0.00 0.31 0.00 0.00 0.00 0.00 46.02 46.15 3gdk n GLY 234 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3gdk h ARG 235 N 0.00 0.05 0.00 1.61 2.47 -1.99 -0.93 114.38 115.59 3gdk h ARG 235 Ca 0.00 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 3gdk h ARG 235 Cb 0.00 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.31 3gdk h ARG 235 CO 0.00 0.03 0.00 0.41 0.56 0.00 0.00 179.97 180.97 3gdk n GLY 236 N -1.71 -0.40 0.02 0.04 0.00 -1.26 -0.26 105.19 101.61 3gdk n GLY 236 Ca 0.23 -0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.32 3gdk n GLY 236 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3gdk n LEU 237 N -1.37 0.00 0.00 0.99 4.77 -0.35 -4.81 117.00 116.23 3gdk n LEU 237 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3gdk n LEU 237 Cb 0.01 0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 3gdk n LEU 237 CO 0.01 0.06 0.00 2.22 -1.33 0.00 0.00 177.39 178.35 3gdk n PHE 238 N -2.28 0.00 -1.61 -1.77 1.16 -0.64 -3.31 117.46 109.02 3gdk n PHE 238 Ca -0.07 0.00 -0.30 0.00 -1.87 0.00 0.00 57.45 55.21 3gdk n PHE 238 Cb 0.61 0.00 0.08 0.00 -1.61 0.00 0.00 39.48 38.56 3gdk n PHE 238 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3gdk s ALA 239 N 0.00 2.38 -1.51 1.98 0.00 0.64 -3.77 121.76 121.48 3gdk s ALA 239 Ca 0.00 -0.21 -0.05 0.00 0.00 0.00 0.00 51.96 51.70 3gdk s ALA 239 Cb 0.00 -3.10 0.02 0.00 0.00 0.00 0.00 23.12 20.04 3gdk s ALA 239 CO 0.00 -1.61 0.52 1.63 0.00 0.00 0.00 175.76 176.31 3gdk n LYS 240 N -3.35 -4.31 -1.21 0.00 4.76 -1.26 -2.25 118.16 110.53 3gdk n LYS 240 Ca 0.07 0.83 -0.07 0.00 -2.87 0.00 0.00 58.31 56.26 3gdk n LYS 240 Cb 0.56 -5.64 -0.03 0.00 -1.84 0.00 0.00 35.03 28.08 3gdk n LYS 240 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3gdk n GLY 241 N -1.40 0.93 3.76 0.72 0.00 -1.26 -5.01 105.19 102.92 3gdk n GLY 241 Ca -0.11 -0.47 -0.31 0.00 0.00 0.00 0.00 46.02 45.13 3gdk n GLY 241 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gdk s ARG 242 N -2.39 1.99 -0.37 1.61 0.52 -0.95 -4.99 118.95 114.36 3gdk s ARG 242 Ca 0.00 1.04 -0.15 0.00 -0.52 0.00 0.00 55.73 56.10 3gdk s ARG 242 Cb 0.00 -1.88 0.00 0.00 0.52 0.00 0.00 34.95 33.60 3gdk s ARG 242 CO 0.00 -1.80 0.33 0.34 0.02 0.00 0.00 175.30 174.19 3gdk s ASP 243 N -3.44 6.13 0.24 0.23 2.15 -1.26 -4.76 116.67 115.97 3gdk s ASP 243 Ca 0.62 -0.53 -0.06 0.00 0.43 0.00 0.00 52.55 53.01 3gdk s ASP 243 Cb -0.17 -2.18 0.44 0.00 -0.30 0.00 0.00 42.92 40.71 3gdk s ASP 243 CO 0.56 -0.39 1.68 0.00 -0.17 0.00 0.00 175.17 176.85 3gdk h ALA 244 N 8.56 0.89 -0.58 3.66 0.00 -1.90 -0.78 119.26 129.11 3gdk h ALA 244 Ca -0.29 0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 3gdk h ALA 244 Cb 1.14 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 19.16 3gdk h ALA 244 CO 0.71 -0.36 0.25 -0.22 0.00 0.00 0.00 179.25 179.63 3gdk h LYS 245 N 0.23 0.86 -0.13 0.00 3.64 -1.86 0.30 116.57 119.61 3gdk h LYS 245 Ca 0.40 -0.14 -0.02 0.00 -1.27 0.00 0.00 60.65 59.62 3gdk h LYS 245 Cb 0.69 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.36 3gdk h LYS 245 CO -0.53 0.72 0.01 0.28 -2.27 0.00 0.00 179.45 177.66 3gdk h VAL 246 N 0.80 1.24 -0.71 2.00 2.07 -1.75 -2.22 116.25 117.68 3gdk h VAL 246 Ca 0.20 -0.79 -0.03 0.00 0.82 0.00 0.00 66.70 66.90 3gdk h VAL 246 Cb 0.17 1.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 3gdk h VAL 246 CO -0.02 0.23 0.32 -0.33 0.02 0.00 0.00 177.57 177.79 3gdk h GLU 247 N -0.02 1.04 -0.51 1.57 4.39 -1.07 -1.46 114.58 118.52 3gdk h GLU 247 Ca 0.04 -0.17 0.09 0.00 0.34 0.00 0.00 59.36 59.66 3gdk h GLU 247 Cb 0.35 -0.18 -0.07 0.00 -0.10 0.00 0.00 28.75 28.74 3gdk h GLU 247 CO 0.01 0.84 0.09 0.78 -1.16 0.00 0.00 179.01 179.57 3gdk h GLY 248 N 1.00 0.61 0.97 -3.84 0.00 -0.26 -0.04 103.07 101.52 3gdk h GLY 248 Ca 0.24 -0.02 -0.06 0.00 0.00 0.00 0.00 47.33 47.50 3gdk h GLY 248 CO -0.03 -0.08 0.06 -2.09 0.00 0.00 0.00 176.54 174.41 3gdk h GLU 249 N 0.23 0.78 -0.06 4.80 4.57 -1.06 0.09 114.58 123.93 3gdk h GLU 249 Ca 0.26 -0.22 0.03 0.00 -1.18 0.00 0.00 59.36 58.25 3gdk h GLU 249 Cb 0.35 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.82 3gdk h GLU 249 CO -0.34 0.80 -0.12 -0.09 -1.18 0.00 0.00 179.01 178.08 3gdk h ARG 250 N 0.64 -0.17 -0.52 1.92 2.43 -0.42 0.20 114.38 118.47 3gdk h ARG 250 Ca 0.14 0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.21 3gdk h ARG 250 Cb 0.41 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 3gdk h ARG 250 CO 0.01 -0.11 -0.11 1.88 -1.51 0.00 0.00 179.97 180.13 3gdk h TYR 251 N -0.17 1.12 -0.13 2.20 -1.99 -0.98 -1.63 116.97 115.37 3gdk h TYR 251 Ca 0.07 -0.24 0.00 0.00 2.00 0.00 0.00 58.73 60.56 3gdk h TYR 251 Cb 0.26 -0.27 -0.01 0.00 2.00 0.00 0.00 36.73 38.71 3gdk h TYR 251 CO -0.21 1.05 0.08 -0.09 -0.00 0.00 0.00 178.16 178.98 3gdk h ARG 252 N 0.86 0.16 0.02 4.88 2.43 -0.61 0.68 114.38 122.80 3gdk h ARG 252 Ca 0.13 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.31 3gdk h ARG 252 Cb 0.68 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.17 3gdk h ARG 252 CO 0.05 0.10 -0.11 -0.22 -1.51 0.00 0.00 179.97 178.28 3gdk h LYS 253 N 0.16 -0.19 -0.59 0.20 3.64 -0.52 0.19 116.57 119.47 3gdk h LYS 253 Ca 0.05 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3gdk h LYS 253 Cb -0.00 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 3gdk h LYS 253 CO -0.02 -0.13 0.37 0.00 -2.27 0.00 0.00 179.45 177.40 3gdk h ALA 254 N 0.75 0.75 -0.29 5.00 0.00 -1.16 0.12 119.26 124.43 3gdk h ALA 254 Ca 0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3gdk h ALA 254 Cb 0.24 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3gdk h ALA 254 CO -0.09 0.20 0.13 0.78 0.00 0.00 0.00 179.25 180.27 3gdk h GLY 255 N 0.79 0.45 0.85 0.00 0.00 -0.49 -1.13 103.07 103.55 3gdk h GLY 255 Ca 0.21 -0.23 -0.04 0.00 0.00 0.00 0.00 47.33 47.27 3gdk h GLY 255 CO -0.04 0.22 -0.00 -0.25 0.00 0.00 0.00 176.54 176.46 3gdk h TRP 256 N 0.32 0.49 -0.98 5.60 2.91 -0.41 -1.67 115.95 122.21 3gdk h TRP 256 Ca 0.10 -0.09 0.02 0.00 1.13 0.00 0.00 58.89 60.05 3gdk h TRP 256 Cb 0.15 -0.13 -0.05 0.00 -0.51 0.00 0.00 29.16 28.62 3gdk h TRP 256 CO -0.01 0.62 0.65 0.93 -1.03 0.00 0.00 178.44 179.59 3gdk h GLU 257 N 0.22 1.26 -0.61 2.65 5.08 -0.92 0.43 114.58 122.71 3gdk h GLU 257 Ca 0.07 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 3gdk h GLU 257 Cb 0.42 -0.29 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 3gdk h GLU 257 CO 0.01 0.84 0.07 0.00 -1.00 0.00 0.00 179.01 178.93 3gdk h ALA 258 N 1.40 0.81 -0.43 3.43 0.00 -1.10 -1.84 119.26 121.53 3gdk h ALA 258 Ca 0.37 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3gdk h ALA 258 Cb -0.11 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 3gdk h ALA 258 CO -0.09 0.59 0.28 -0.92 0.00 0.00 0.00 179.25 179.10 3gdk h TYR 259 N 0.92 0.56 0.00 0.00 3.20 -0.30 -1.90 116.97 119.45 3gdk h TYR 259 Ca 0.18 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.02 3gdk h TYR 259 Cb 0.46 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.54 3gdk h TYR 259 CO 0.03 0.37 -0.15 -0.07 -1.64 0.00 0.00 178.16 176.70 3gdk h LEU 260 N 0.58 0.00 -1.41 2.82 3.38 -0.75 -2.23 115.31 117.70 3gdk h LEU 260 Ca 0.16 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.07 3gdk h LEU 260 Cb -0.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 3gdk h LEU 260 CO -0.03 0.15 -0.29 -0.09 0.09 0.00 0.00 178.44 178.27 3gdk h ARG 261 N 0.00 0.00 0.00 1.13 2.43 -0.50 -3.51 114.38 113.92 3gdk h ARG 261 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3gdk h ARG 261 Cb 0.37 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 3gdk h ARG 261 CO 0.02 0.29 0.00 0.54 -1.51 0.00 0.00 179.97 179.31