#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gxt n ASP 33 N 0.00 3.19 -0.19 1.96 4.64 -1.26 -4.47 116.55 120.41 3gxt n ASP 33 Ca 0.00 -2.38 0.04 0.00 -1.38 0.00 0.00 54.79 51.07 3gxt n ASP 33 Cb 0.00 -0.96 0.08 0.00 -1.04 0.00 0.00 41.12 39.20 3gxt n ASP 33 CO 0.00 0.00 0.00 -0.46 -0.82 0.00 0.00 177.20 175.92 3gxt n ASN 34 N 5.59 2.39 0.00 1.67 6.94 -1.26 -4.98 115.26 125.61 3gxt n ASN 34 Ca 0.39 -2.35 0.00 0.00 -0.02 0.00 0.00 54.58 52.60 3gxt n ASN 34 Cb 0.21 -0.19 0.00 0.00 -2.36 0.00 0.00 39.78 37.44 3gxt n ASN 34 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3gxt n GLY 35 N -0.57 2.64 4.00 4.83 0.00 -1.26 -5.00 105.19 109.82 3gxt n GLY 35 Ca 0.08 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.91 3gxt n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gxt s LEU 36 N 0.00 3.88 -1.56 0.99 1.43 -1.26 -4.57 118.68 117.59 3gxt s LEU 36 Ca 0.00 -0.25 -0.09 0.00 -1.03 0.00 0.00 54.13 52.76 3gxt s LEU 36 Cb 0.00 -2.73 0.07 0.00 0.03 0.00 0.00 46.19 43.56 3gxt s LEU 36 CO 0.00 -0.53 0.54 0.00 0.23 0.00 0.00 176.35 176.60 3gxt n ALA 37 N -1.70 -1.67 0.20 4.21 0.00 -1.26 -4.33 120.51 115.96 3gxt n ALA 37 Ca 0.02 -0.17 0.04 0.00 0.00 0.00 0.00 53.44 53.34 3gxt n ALA 37 Cb 0.58 -2.33 0.43 0.00 0.00 0.00 0.00 19.45 18.14 3gxt n ALA 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gxt h ARG 38 N -1.67 0.03 -5.73 0.00 2.47 -1.93 -0.59 114.38 106.94 3gxt h ARG 38 Ca -0.62 -0.01 -0.51 0.00 -1.26 0.00 0.00 59.98 57.59 3gxt h ARG 38 Cb 1.38 -0.00 -0.14 0.00 -1.65 0.00 0.00 29.97 29.56 3gxt h ARG 38 CO 0.71 0.28 -0.73 0.95 0.56 0.00 0.00 179.97 181.74 3gxt s THR 39 N -4.47 1.93 0.27 2.04 -4.23 -1.26 -4.34 115.64 105.56 3gxt s THR 39 Ca -0.04 -2.24 -0.30 0.00 -1.18 0.00 0.00 61.69 57.93 3gxt s THR 39 Cb 0.15 -2.22 -0.11 0.00 1.34 0.00 0.00 72.50 71.66 3gxt s THR 39 CO 0.71 -0.47 1.55 -2.16 -0.54 0.00 0.00 174.62 173.71 3gxt s PRO 40 N -3.63 4.18 0.26 3.99 0.04 -1.26 -4.89 135.00 133.68 3gxt s PRO 40 Ca 0.26 2.47 -0.31 0.00 0.04 0.00 0.00 61.00 63.47 3gxt s PRO 40 Cb -0.01 -3.06 -0.13 0.00 0.04 0.00 0.00 34.50 31.34 3gxt s PRO 40 CO 0.10 -0.56 1.40 2.41 0.04 0.00 0.00 177.00 180.39 3gxt n THR 41 N 2.41 1.12 -4.92 1.26 -1.04 -1.26 -4.61 114.28 107.24 3gxt n THR 41 Ca 0.08 -0.28 -0.31 0.00 -2.04 0.00 0.00 64.05 61.50 3gxt n THR 41 Cb 0.38 -1.52 -0.14 0.00 -1.82 0.00 0.00 70.33 67.23 3gxt n THR 41 CO 0.00 0.00 0.00 -0.04 -0.64 0.00 0.00 175.07 174.39 3gxt s MET 42 N -0.64 2.16 0.00 -2.82 -1.94 -1.26 -0.53 119.30 114.26 3gxt s MET 42 Ca 0.66 -0.91 0.00 0.00 -1.71 0.00 0.00 55.69 53.73 3gxt s MET 42 Cb -0.62 -2.17 0.00 0.00 2.01 0.00 0.00 34.83 34.04 3gxt s MET 42 CO 0.51 0.56 0.00 0.41 -0.01 0.00 0.00 175.02 176.50 3gxt n GLY 43 N 2.00 -0.91 3.06 -0.03 0.00 -0.09 -1.43 105.19 107.80 3gxt n GLY 43 Ca -0.16 -0.12 -0.10 0.00 0.00 0.00 0.00 46.02 45.63 3gxt n GLY 43 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3gxt s TRP 44 N -4.00 0.13 -0.04 1.61 -0.00 0.34 -1.82 118.94 115.17 3gxt s TRP 44 Ca 0.00 -0.30 -0.01 0.00 -0.00 0.00 0.00 56.10 55.78 3gxt s TRP 44 Cb 0.00 -0.11 0.03 0.00 -0.00 0.00 0.00 33.47 33.40 3gxt s TRP 44 CO 0.00 -0.26 0.06 -1.17 -0.00 0.00 0.00 176.95 175.58 3gxt s LEU 45 N -1.46 0.60 0.43 5.86 0.20 0.17 -0.49 118.68 123.99 3gxt s LEU 45 Ca -0.15 0.09 0.09 0.00 0.69 0.00 0.00 54.13 54.86 3gxt s LEU 45 Cb -0.08 -0.05 0.95 0.00 -0.43 0.00 0.00 46.19 46.58 3gxt s LEU 45 CO 0.00 -0.19 2.07 1.12 -0.29 0.00 0.00 176.35 179.06 3gxt h HIS 46 N 7.82 0.37 -0.00 5.38 2.07 -1.83 -3.37 115.15 125.59 3gxt h HIS 46 Ca -0.30 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.23 3gxt h HIS 46 Cb 1.12 -0.12 -0.00 0.00 2.57 0.00 0.00 27.41 30.97 3gxt h HIS 46 CO 0.49 0.26 -0.03 2.35 -3.07 0.00 0.00 177.93 177.92 3gxt h TRP 47 N 0.39 -0.09 -0.54 6.12 2.91 -1.90 0.12 115.95 122.96 3gxt h TRP 47 Ca 0.10 0.00 0.09 0.00 1.13 0.00 0.00 58.89 60.22 3gxt h TRP 47 Cb -0.00 0.04 -0.07 0.00 -0.51 0.00 0.00 29.16 28.62 3gxt h TRP 47 CO 0.00 -0.03 0.14 1.49 -1.03 0.00 0.00 178.44 179.01 3gxt h GLU 48 N -0.04 0.29 0.00 2.65 4.22 -1.90 1.18 114.58 120.98 3gxt h GLU 48 Ca 0.00 -0.02 -0.13 0.00 0.08 0.00 0.00 59.36 59.29 3gxt h GLU 48 Cb 0.04 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.24 3gxt h GLU 48 CO -0.02 0.19 -0.53 -0.09 -2.18 0.00 0.00 179.01 176.38 3gxt h ARG 49 N 0.30 0.35 0.00 1.92 9.65 -1.73 -3.37 114.38 121.49 3gxt h ARG 49 Ca 0.27 -0.38 0.00 0.00 -1.10 0.00 0.00 59.98 58.77 3gxt h ARG 49 Cb 0.35 0.11 0.00 0.00 -1.39 0.00 0.00 29.97 29.04 3gxt h ARG 49 CO -0.32 1.07 -1.50 1.19 2.80 0.00 0.00 179.97 183.21 3gxt n PHE 50 N -4.28 0.11 -0.84 2.20 3.72 0.39 -5.03 117.46 113.73 3gxt n PHE 50 Ca -0.10 0.03 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 3gxt n PHE 50 Cb 0.64 -0.39 0.00 0.00 -0.94 0.00 0.00 39.48 38.79 3gxt n PHE 50 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 3gxt n MET 51 N -2.03 0.00 -1.52 -1.08 2.81 0.40 -3.40 117.12 112.30 3gxt n MET 51 Ca -0.01 0.00 -0.34 0.00 -1.81 0.00 0.00 57.70 55.54 3gxt n MET 51 Cb 0.48 0.00 0.07 0.00 -0.71 0.00 0.00 33.22 33.06 3gxt n MET 51 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3gxt s ASN 53 N -2.01 4.84 -0.24 0.00 2.47 -1.22 -4.84 114.94 113.95 3gxt s ASN 53 Ca 0.61 0.57 0.14 0.00 0.42 0.00 0.00 52.86 54.60 3gxt s ASN 53 Cb 0.49 -2.52 0.61 0.00 -1.45 0.00 0.00 41.25 38.38 3gxt s ASN 53 CO -0.06 -2.69 1.56 0.18 -3.72 0.00 0.00 177.10 172.38 3gxt n LEU 54 N 14.45 4.66 -4.34 3.21 4.32 -1.26 -2.25 117.00 135.78 3gxt n LEU 54 Ca 0.30 -3.19 -0.46 0.00 -0.02 0.00 0.00 56.01 52.64 3gxt n LEU 54 Cb 0.53 -0.62 -0.03 0.00 -1.62 0.00 0.00 43.42 41.67 3gxt n LEU 54 CO 0.70 0.80 0.42 -0.62 -1.22 0.00 0.00 177.39 177.46 3gxt s ASP 55 N -1.70 6.54 0.33 -1.43 -1.08 -1.26 -4.86 116.67 113.20 3gxt s ASP 55 Ca 0.47 -2.25 0.22 0.00 -0.52 0.00 0.00 52.55 50.47 3gxt s ASP 55 Cb 0.39 -2.24 0.18 0.00 -1.46 0.00 0.00 42.92 39.78 3gxt s ASP 55 CO 0.09 -0.76 1.37 0.00 0.52 0.00 0.00 175.17 176.39 3gxt h GLN 57 N 0.00 -0.90 0.00 0.00 5.75 -1.98 -3.22 115.11 114.77 3gxt h GLN 57 Ca -0.01 0.06 -0.34 0.00 -0.15 0.00 0.00 58.65 58.21 3gxt h GLN 57 Cb 1.07 0.20 -0.06 0.00 1.07 0.00 0.00 27.48 29.76 3gxt h GLN 57 CO 0.01 -0.60 -2.25 0.39 -2.65 0.00 0.00 178.83 173.73 3gxt n GLU 58 N -5.52 0.68 -3.66 1.69 -0.58 -1.25 -4.60 120.64 107.39 3gxt n GLU 58 Ca -0.12 0.04 -0.27 0.00 -0.42 0.00 0.00 57.16 56.38 3gxt n GLU 58 Cb 0.41 -1.57 -0.10 0.00 -0.57 0.00 0.00 31.44 29.61 3gxt n GLU 58 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 3gxt n GLU 59 N -2.78 1.66 0.08 3.49 -0.58 -1.13 -4.92 120.64 116.47 3gxt n GLU 59 Ca -0.29 -4.24 -0.10 0.00 -0.42 0.00 0.00 57.16 52.12 3gxt n GLU 59 Cb 1.12 -2.11 -0.06 0.00 -0.57 0.00 0.00 31.44 29.82 3gxt n GLU 59 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 3gxt h PRO 60 N 5.04 0.16 0.00 3.49 0.13 -1.74 -2.86 132.00 136.22 3gxt h PRO 60 Ca 0.18 -0.21 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 3gxt h PRO 60 Cb 0.76 0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.96 3gxt h PRO 60 CO 0.67 1.01 0.00 -0.25 -0.23 0.00 0.00 178.00 179.21 3gxt n ASP 61 N -3.56 0.00 0.00 1.44 8.00 -1.26 -3.20 116.55 117.97 3gxt n ASP 61 Ca -0.04 0.24 0.00 0.00 0.71 0.00 0.00 54.79 55.70 3gxt n ASP 61 Cb 0.88 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 3gxt n ASP 61 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3gxt n SER 62 N -1.35 0.05 -4.81 -2.24 3.41 -1.23 -5.05 113.62 102.40 3gxt n SER 62 Ca 0.04 -1.02 -0.34 0.00 -0.26 0.00 0.00 58.87 57.30 3gxt n SER 62 Cb 0.10 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.99 3gxt n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gxt s ILE 64 N -2.08 3.48 0.13 0.00 -1.09 -0.96 -4.73 121.20 115.95 3gxt s ILE 64 Ca 0.63 -0.02 0.04 0.00 -2.23 0.00 0.00 60.65 59.07 3gxt s ILE 64 Cb -0.12 -4.19 -0.04 0.00 -1.58 0.00 0.00 42.46 36.53 3gxt s ILE 64 CO 0.16 -1.14 -0.10 -0.94 -1.23 0.00 0.00 174.94 171.68 3gxt s SER 65 N 7.21 1.69 0.20 3.58 1.04 -1.26 -4.79 113.70 121.37 3gxt s SER 65 Ca 0.62 -0.94 -0.10 0.00 0.48 0.00 0.00 55.95 56.00 3gxt s SER 65 Cb -0.09 -0.01 0.20 0.00 0.10 0.00 0.00 66.02 66.22 3gxt s SER 65 CO 0.11 -0.30 1.82 1.05 0.98 0.00 0.00 173.24 176.90 3gxt h GLU 66 N 3.07 0.69 -0.07 4.02 4.11 -1.60 0.66 114.58 125.46 3gxt h GLU 66 Ca -0.37 -0.04 0.02 0.00 0.07 0.00 0.00 59.36 59.04 3gxt h GLU 66 Cb 1.19 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 30.28 3gxt h GLU 66 CO 0.59 0.46 0.32 0.87 0.07 0.00 0.00 179.01 181.32 3gxt h LYS 67 N 0.71 0.00 0.40 1.06 1.57 -1.95 0.51 116.57 118.87 3gxt h LYS 67 Ca 0.27 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.03 3gxt h LYS 67 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.42 3gxt h LYS 67 CO -0.14 0.00 -0.19 1.25 -0.57 0.00 0.00 179.45 179.80 3gxt h LEU 68 N 0.00 -0.45 -1.33 2.94 5.85 -1.15 -0.90 115.31 120.27 3gxt h LEU 68 Ca 0.03 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.59 3gxt h LEU 68 Cb 0.67 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.80 3gxt h LEU 68 CO -0.00 -0.04 0.05 -0.26 -0.34 0.00 0.00 178.44 177.85 3gxt h PHE 69 N -0.95 0.51 -0.59 1.25 0.04 -0.94 0.68 116.94 116.94 3gxt h PHE 69 Ca -0.05 -0.04 0.02 0.00 2.80 0.00 0.00 57.97 60.70 3gxt h PHE 69 Cb 0.55 -0.15 -0.03 0.00 2.20 0.00 0.00 35.95 38.51 3gxt h PHE 69 CO 0.02 0.47 0.39 0.52 -0.60 0.00 0.00 178.31 179.12 3gxt h MET 70 N 0.49 0.72 0.03 1.51 2.86 -0.08 0.87 114.93 121.33 3gxt h MET 70 Ca 0.11 -0.04 -0.12 0.00 -2.06 0.00 0.00 59.70 57.59 3gxt h MET 70 Cb 0.24 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 3gxt h MET 70 CO 0.00 0.48 -0.62 1.49 1.06 0.00 0.00 176.91 179.32 3gxt h GLU 71 N 0.74 0.06 -0.58 1.72 4.81 0.38 -2.85 114.58 118.86 3gxt h GLU 71 Ca 0.23 -0.10 0.10 0.00 -0.13 0.00 0.00 59.36 59.46 3gxt h GLU 71 Cb -0.00 0.04 -0.08 0.00 0.63 0.00 0.00 28.75 29.33 3gxt h GLU 71 CO -0.06 1.05 0.15 0.52 -0.73 0.00 0.00 179.01 179.94 3gxt h MET 72 N -0.86 0.29 0.09 1.92 2.86 -0.88 -2.04 114.93 116.30 3gxt h MET 72 Ca -0.15 -0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.48 3gxt h MET 72 Cb 1.24 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.81 3gxt h MET 72 CO -0.04 0.19 -0.29 0.00 1.06 0.00 0.00 176.91 177.83 3gxt h ALA 73 N 1.45 -0.82 -1.46 6.32 0.00 -0.92 -1.63 119.26 122.20 3gxt h ALA 73 Ca 0.30 -0.07 0.49 0.00 0.00 0.00 0.00 54.91 55.64 3gxt h ALA 73 Cb 0.42 0.68 -0.13 0.00 0.00 0.00 0.00 17.79 18.76 3gxt h ALA 73 CO -0.36 -0.88 0.95 1.49 0.00 0.00 0.00 179.25 180.45 3gxt h GLU 74 N -0.42 0.01 0.00 0.00 4.81 -1.21 -1.79 114.58 115.97 3gxt h GLU 74 Ca -0.01 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 3gxt h GLU 74 Cb 0.42 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.79 3gxt h GLU 74 CO -0.14 0.00 -0.19 -0.07 -0.73 0.00 0.00 179.01 177.88 3gxt h LEU 75 N 0.01 0.00 -0.74 1.64 4.07 -0.73 -3.22 115.31 116.34 3gxt h LEU 75 Ca 0.89 -0.51 0.24 0.00 0.08 0.00 0.00 57.88 58.58 3gxt h LEU 75 Cb 2.95 0.00 -0.14 0.00 1.08 0.00 0.00 40.66 44.55 3gxt h LEU 75 CO -0.41 0.87 0.16 0.23 -1.08 0.00 0.00 178.44 178.20 3gxt n MET 76 N -4.65 -0.05 0.23 1.13 2.81 -0.68 0.11 117.12 116.03 3gxt n MET 76 Ca -0.09 1.07 -0.11 0.00 -1.81 0.00 0.00 57.70 56.76 3gxt n MET 76 Cb 0.32 -1.78 -0.06 0.00 -0.71 0.00 0.00 33.22 31.00 3gxt n MET 76 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3gxt h VAL 77 N 0.00 0.00 0.00 2.03 2.07 -1.66 0.98 116.25 119.67 3gxt h VAL 77 Ca 0.51 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.94 3gxt h VAL 77 Cb 1.19 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 3gxt h VAL 77 CO -0.65 0.00 -0.43 0.77 0.02 0.00 0.00 177.57 177.28 3gxt h SER 78 N -0.67 0.00 0.03 0.57 4.64 0.77 -2.99 113.55 115.91 3gxt h SER 78 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 3gxt h SER 78 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 3gxt h SER 78 CO 0.05 0.43 -0.06 -0.62 -0.87 0.00 0.00 176.83 175.76 3gxt n GLU 79 N -3.42 1.54 -0.71 4.77 -0.58 0.28 -4.93 120.64 117.58 3gxt n GLU 79 Ca 0.00 -0.94 0.00 0.00 -0.42 0.00 0.00 57.16 55.81 3gxt n GLU 79 Cb 0.59 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.98 3gxt n GLU 79 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3gxt n GLY 80 N 1.22 0.59 0.23 0.62 0.00 -1.13 -4.98 105.19 101.76 3gxt n GLY 80 Ca 0.17 -0.49 -0.03 0.00 0.00 0.00 0.00 46.02 45.68 3gxt n GLY 80 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3gxt h TRP 81 N 0.00 0.48 0.60 1.61 4.06 -1.06 -1.34 115.95 120.31 3gxt h TRP 81 Ca 0.00 -0.10 -0.03 0.00 2.06 0.00 0.00 58.89 60.82 3gxt h TRP 81 Cb 0.00 -0.12 0.01 0.00 -1.00 0.00 0.00 29.16 28.05 3gxt h TRP 81 CO 0.00 0.65 -0.29 -0.22 -3.56 0.00 0.00 178.44 175.02 3gxt h LYS 82 N 0.38 -0.78 -1.06 0.49 3.64 -1.42 -1.00 116.57 116.82 3gxt h LYS 82 Ca 0.06 0.05 0.29 0.00 -1.27 0.00 0.00 60.65 59.78 3gxt h LYS 82 Cb 0.64 0.18 -0.11 0.00 -0.41 0.00 0.00 32.23 32.53 3gxt h LYS 82 CO 0.05 -0.52 0.66 -0.44 -2.27 0.00 0.00 179.45 176.92 3gxt h ASP 83 N -1.17 0.49 -0.23 4.20 3.45 -1.85 1.68 116.42 123.00 3gxt h ASP 83 Ca -0.08 0.12 -0.00 0.00 0.43 0.00 0.00 57.03 57.50 3gxt h ASP 83 Cb 0.62 0.05 -0.01 0.00 -0.56 0.00 0.00 39.33 39.43 3gxt h ASP 83 CO 0.14 0.02 0.15 0.00 -1.57 0.00 0.00 179.24 177.97 3gxt h ALA 84 N 1.68 1.80 0.00 3.45 0.00 -1.08 -3.46 119.26 121.65 3gxt h ALA 84 Ca 0.66 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.54 3gxt h ALA 84 Cb 1.59 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.28 3gxt h ALA 84 CO -0.41 0.18 0.00 0.41 0.00 0.00 0.00 179.25 179.43 3gxt n GLY 85 N -1.45 1.15 3.66 0.00 0.00 0.57 -5.02 105.19 104.10 3gxt n GLY 85 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 3gxt n GLY 85 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gxt s TYR 86 N -1.73 3.37 0.00 1.61 2.02 -0.41 -4.47 117.35 117.73 3gxt s TYR 86 Ca 0.00 1.00 0.00 0.00 -0.37 0.00 0.00 57.07 57.70 3gxt s TYR 86 Cb 0.00 -2.87 0.00 0.00 -0.40 0.00 0.00 41.96 38.69 3gxt s TYR 86 CO 0.00 -0.23 0.00 -1.91 -1.57 0.00 0.00 175.55 171.84 3gxt n GLU 87 N 5.26 2.38 -3.55 -0.62 4.07 -0.51 -3.96 120.64 123.71 3gxt n GLU 87 Ca 0.01 0.00 -0.41 0.00 -0.06 0.00 0.00 57.16 56.69 3gxt n GLU 87 Cb 0.49 -0.76 -0.10 0.00 -0.06 0.00 0.00 31.44 31.01 3gxt n GLU 87 CO 0.00 0.00 0.00 0.71 -0.06 0.00 0.00 177.13 177.78 3gxt s TYR 88 N -1.34 3.29 -0.44 4.31 2.02 -0.77 -1.48 117.35 122.93 3gxt s TYR 88 Ca 0.00 -1.24 -0.25 0.00 -0.37 0.00 0.00 57.07 55.22 3gxt s TYR 88 Cb 0.00 -2.86 0.02 0.00 -0.40 0.00 0.00 41.96 38.73 3gxt s TYR 88 CO 0.00 -0.78 0.87 -1.17 -1.57 0.00 0.00 175.55 172.90 3gxt s LEU 89 N 1.51 4.09 -0.22 -1.29 2.96 0.11 -0.51 118.68 125.34 3gxt s LEU 89 Ca 0.03 0.10 0.01 0.00 -0.22 0.00 0.00 54.13 54.04 3gxt s LEU 89 Cb -0.22 -3.11 0.03 0.00 0.50 0.00 0.00 46.19 43.39 3gxt s LEU 89 CO 0.04 -0.97 -0.14 0.00 -1.32 0.00 0.00 176.35 173.96 3gxt s ILE 91 N 1.26 3.04 0.00 0.00 1.01 0.74 -3.08 121.20 124.16 3gxt s ILE 91 Ca 0.00 1.03 0.00 0.00 0.00 0.00 0.00 60.65 61.68 3gxt s ILE 91 Cb -0.16 -3.65 0.00 0.00 0.01 0.00 0.00 42.46 38.66 3gxt s ILE 91 CO -0.09 0.24 0.00 -0.67 0.00 0.00 0.00 174.94 174.42 3gxt n ASP 92 N 1.09 0.78 -4.54 3.58 -0.08 -1.26 -3.65 116.55 112.48 3gxt n ASP 92 Ca 0.00 0.00 -0.35 0.00 -1.51 0.00 0.00 54.79 52.93 3gxt n ASP 92 Cb 0.43 0.00 0.10 0.00 2.34 0.00 0.00 41.12 43.99 3gxt n ASP 92 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 3gxt n ASP 93 N 0.00 -0.55 -0.39 1.67 -0.08 -1.26 -4.10 116.55 111.84 3gxt n ASP 93 Ca 0.00 0.54 -0.00 0.00 -1.51 0.00 0.00 54.79 53.82 3gxt n ASP 93 Cb 0.00 -1.32 0.00 0.00 2.34 0.00 0.00 41.12 42.14 3gxt n ASP 93 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3gxt n TRP 95 N -3.05 0.00 -1.94 0.00 4.27 -1.26 -4.91 117.44 110.55 3gxt n TRP 95 Ca -0.00 0.00 -0.31 0.00 -3.89 0.00 0.00 57.50 53.30 3gxt n TRP 95 Cb 0.50 0.00 0.01 0.00 -1.36 0.00 0.00 31.31 30.46 3gxt n TRP 95 CO 0.00 0.00 0.00 -1.64 -2.29 0.00 0.00 177.69 173.76 3gxt s MET 96 N -1.19 3.61 0.33 -2.67 -1.94 -1.26 -2.44 119.30 113.74 3gxt s MET 96 Ca 0.10 0.72 -0.22 0.00 -1.71 0.00 0.00 55.69 54.58 3gxt s MET 96 Cb 0.09 -2.10 -0.10 0.00 2.01 0.00 0.00 34.83 34.73 3gxt s MET 96 CO 0.21 -0.53 0.88 0.00 -0.01 0.00 0.00 175.02 175.57 3gxt s ALA 97 N -3.13 3.21 0.00 3.03 0.00 0.91 -4.06 121.76 121.73 3gxt s ALA 97 Ca 0.55 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.88 3gxt s ALA 97 Cb -0.11 -3.07 0.00 0.00 0.00 0.00 0.00 23.12 19.95 3gxt s ALA 97 CO 0.52 0.21 0.00 -2.30 0.00 0.00 0.00 175.76 174.19 3gxt n PRO 98 N 0.16 0.00 -3.74 0.00 -0.02 -1.26 -4.65 135.00 125.49 3gxt n PRO 98 Ca 0.03 0.00 -0.15 0.00 -2.02 0.00 0.00 63.50 61.36 3gxt n PRO 98 Cb 0.52 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.95 3gxt n PRO 98 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gxt n GLN 99 N -3.28 0.42 -1.76 -0.52 0.00 -1.26 -4.56 117.38 106.42 3gxt n GLN 99 Ca 0.00 -2.59 -0.31 0.00 0.00 0.00 0.00 57.00 54.10 3gxt n GLN 99 Cb 0.00 2.24 0.04 0.00 0.00 0.00 0.00 30.24 32.52 3gxt n GLN 99 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 3gxt s ARG 100 N -2.96 3.12 0.84 2.61 0.52 -1.26 -4.48 118.95 117.34 3gxt s ARG 100 Ca 0.30 0.74 -0.14 0.00 -0.52 0.00 0.00 55.73 56.10 3gxt s ARG 100 Cb 0.01 -2.03 0.21 0.00 0.52 0.00 0.00 34.95 33.66 3gxt s ARG 100 CO 0.21 -0.91 0.68 -0.40 0.02 0.00 0.00 175.30 174.90 3gxt n ASP 101 N -2.97 -2.14 -3.77 0.23 5.68 0.00 -4.86 116.55 108.71 3gxt n ASP 101 Ca 0.07 -0.84 -0.29 0.00 -0.50 0.00 0.00 54.79 53.22 3gxt n ASP 101 Cb 0.55 -0.65 -0.13 0.00 -1.14 0.00 0.00 41.12 39.74 3gxt n ASP 101 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 3gxt s SER 102 N -3.25 3.82 0.00 -1.12 1.04 -1.26 -2.08 113.70 110.85 3gxt s SER 102 Ca 0.46 -2.84 0.00 0.00 0.48 0.00 0.00 55.95 54.05 3gxt s SER 102 Cb -0.05 -1.21 0.00 0.00 0.10 0.00 0.00 66.02 64.86 3gxt s SER 102 CO 0.36 -0.24 0.00 -0.62 0.98 0.00 0.00 173.24 173.72 3gxt n GLU 103 N 3.28 0.00 0.00 4.02 4.71 -1.26 -5.05 120.64 126.34 3gxt n GLU 103 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.24 3gxt n GLU 103 Cb 0.34 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.77 3gxt n GLU 103 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3gxt n GLY 104 N 0.00 -0.09 3.82 0.62 0.00 -0.88 -5.16 105.19 103.49 3gxt n GLY 104 Ca 0.00 0.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 3gxt n GLY 104 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gxt s ARG 105 N 0.00 3.04 0.30 1.61 0.52 -1.26 -4.71 118.95 118.45 3gxt s ARG 105 Ca 0.00 -0.61 -0.29 0.00 -0.52 0.00 0.00 55.73 54.31 3gxt s ARG 105 Cb 0.00 -2.82 -0.13 0.00 0.52 0.00 0.00 34.95 32.52 3gxt s ARG 105 CO 0.00 0.58 1.32 1.28 0.02 0.00 0.00 175.30 178.51 3gxt n LEU 106 N 0.45 3.26 -4.50 2.53 4.77 -1.26 -0.82 117.00 121.43 3gxt n LEU 106 Ca -0.08 1.18 -0.26 0.00 -0.03 0.00 0.00 56.01 56.82 3gxt n LEU 106 Cb 0.51 -1.45 -0.10 0.00 -2.33 0.00 0.00 43.42 40.05 3gxt n LEU 106 CO 0.46 -0.54 -0.46 -1.10 -1.33 0.00 0.00 177.39 174.42 3gxt s GLN 107 N -1.24 1.79 0.98 3.23 -0.21 -1.26 -4.84 119.66 118.11 3gxt s GLN 107 Ca 0.61 -1.49 -0.13 0.00 0.02 0.00 0.00 55.36 54.37 3gxt s GLN 107 Cb -0.61 -1.95 0.18 0.00 1.00 0.00 0.00 33.01 31.63 3gxt s GLN 107 CO 0.57 0.39 1.11 0.00 -2.12 0.00 0.00 175.29 175.24 3gxt s ALA 108 N -1.92 1.21 0.15 6.09 0.00 -1.26 -0.06 121.76 125.96 3gxt s ALA 108 Ca 0.25 -0.48 -0.30 0.00 0.00 0.00 0.00 51.96 51.42 3gxt s ALA 108 Cb -0.07 -3.06 -0.08 0.00 0.00 0.00 0.00 23.12 19.90 3gxt s ALA 108 CO 0.13 -2.71 1.30 0.34 0.00 0.00 0.00 175.76 174.82 3gxt s ASP 109 N -3.71 6.94 0.38 0.00 2.15 -1.02 -3.51 116.67 117.89 3gxt s ASP 109 Ca 0.65 2.28 0.10 0.00 0.43 0.00 0.00 52.55 56.02 3gxt s ASP 109 Cb -0.17 -2.60 0.75 0.00 -0.30 0.00 0.00 42.92 40.61 3gxt s ASP 109 CO 0.56 -0.53 1.88 -0.65 -0.17 0.00 0.00 175.17 176.26 3gxt h PRO 110 N 6.04 0.16 0.00 4.34 0.11 -1.92 -1.25 132.00 139.48 3gxt h PRO 110 Ca -0.43 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 3gxt h PRO 110 Cb 1.21 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 3gxt h PRO 110 CO 0.80 0.38 -0.20 1.96 -0.21 0.00 0.00 178.00 180.73 3gxt h GLN 111 N 0.15 0.00 0.00 1.05 7.50 -1.95 -3.22 115.11 118.64 3gxt h GLN 111 Ca 0.03 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.18 3gxt h GLN 111 Cb 0.49 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.02 3gxt h GLN 111 CO 0.03 0.76 -0.66 0.54 -1.50 0.00 0.00 178.83 178.00 3gxt n ARG 112 N -4.62 0.18 -2.94 1.46 1.74 -1.24 -4.01 116.66 107.23 3gxt n ARG 112 Ca -0.11 0.04 -0.20 0.00 -0.77 0.00 0.00 57.85 56.81 3gxt n ARG 112 Cb 0.40 -1.60 -0.02 0.00 -1.02 0.00 0.00 32.46 30.23 3gxt n ARG 112 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3gxt n PHE 113 N -1.85 1.78 -0.01 -1.55 3.72 -0.47 -1.47 117.46 117.61 3gxt n PHE 113 Ca 0.04 -3.58 0.04 0.00 -0.05 0.00 0.00 57.45 53.89 3gxt n PHE 113 Cb 0.40 -0.39 0.41 0.00 -0.94 0.00 0.00 39.48 38.96 3gxt n PHE 113 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3gxt h PRO 114 N 2.94 0.55 -0.00 -1.08 0.13 -1.64 -1.27 132.00 131.64 3gxt h PRO 114 Ca 0.09 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 3gxt h PRO 114 Cb 0.88 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.89 3gxt h PRO 114 CO 0.63 0.38 -0.02 0.72 -0.23 0.00 0.00 178.00 179.47 3gxt n HIS 115 N -4.46 0.00 -0.18 1.56 8.25 -1.26 -4.98 115.22 114.14 3gxt n HIS 115 Ca 0.03 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.51 3gxt n HIS 115 Cb 0.07 -0.29 -0.01 0.00 1.12 0.00 0.00 29.99 30.87 3gxt n HIS 115 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3gxt n GLY 116 N 1.31 -2.14 0.11 -1.41 0.00 -0.48 -4.10 105.19 98.49 3gxt n GLY 116 Ca 0.13 -1.44 -0.17 0.00 0.00 0.00 0.00 46.02 44.54 3gxt n GLY 116 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3gxt h ILE 117 N -0.17 1.46 -0.77 -0.61 1.08 -1.96 -3.07 117.51 113.47 3gxt h ILE 117 Ca -0.01 -3.00 0.10 0.00 -0.39 0.00 0.00 64.86 61.55 3gxt h ILE 117 Cb 0.17 2.96 -0.11 0.00 -3.07 0.00 0.00 36.82 36.77 3gxt h ILE 117 CO 0.01 0.88 -0.37 -1.14 -0.69 0.00 0.00 178.15 176.84 3gxt n ARG 118 N -3.57 -0.25 0.02 2.37 0.00 -1.26 -0.17 116.66 113.80 3gxt n ARG 118 Ca -0.10 1.17 -0.16 0.00 -0.00 0.00 0.00 57.85 58.76 3gxt n ARG 118 Cb 1.04 -1.73 -0.06 0.00 0.00 0.00 0.00 32.46 31.71 3gxt n ARG 118 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.63 179.59 3gxt h GLN 119 N 0.00 0.66 -0.01 -0.14 7.50 -1.70 -2.33 115.11 119.08 3gxt h GLN 119 Ca 0.20 -0.60 0.01 0.00 0.50 0.00 0.00 58.65 58.75 3gxt h GLN 119 Cb 0.39 0.15 -0.01 0.00 0.05 0.00 0.00 27.48 28.06 3gxt h GLN 119 CO -0.74 1.21 -0.02 1.25 -1.50 0.00 0.00 178.83 179.03 3gxt h LEU 120 N 0.42 -0.06 -0.27 1.46 5.85 -1.10 0.17 115.31 121.78 3gxt h LEU 120 Ca -0.08 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.69 3gxt h LEU 120 Cb 1.50 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 42.50 3gxt h LEU 120 CO 0.17 -0.03 -0.39 0.00 -0.34 0.00 0.00 178.44 177.85 3gxt h ALA 121 N 0.98 -0.64 -0.71 1.25 0.00 -0.54 0.20 119.26 119.80 3gxt h ALA 121 Ca 0.01 -0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.03 3gxt h ALA 121 Cb 0.05 0.99 -0.13 0.00 0.00 0.00 0.00 17.79 18.70 3gxt h ALA 121 CO -0.03 -0.83 -0.37 -0.91 0.00 0.00 0.00 179.25 177.12 3gxt h ASN 122 N -0.29 -1.30 0.04 0.00 -0.26 -0.77 0.14 115.58 113.15 3gxt h ASN 122 Ca 0.05 0.25 0.03 0.00 -0.56 0.00 0.00 56.30 56.07 3gxt h ASN 122 Cb 0.42 0.65 -0.05 0.00 -1.06 0.00 0.00 38.32 38.28 3gxt h ASN 122 CO -0.41 -0.30 -0.32 0.22 -1.06 0.00 0.00 177.43 175.56 3gxt h TYR 123 N -0.12 -0.88 -0.80 1.19 3.20 -0.56 -1.81 116.97 117.19 3gxt h TYR 123 Ca 0.26 0.03 0.12 0.00 3.14 0.00 0.00 58.73 62.27 3gxt h TYR 123 Cb 0.56 0.38 -0.08 0.00 1.54 0.00 0.00 36.73 39.13 3gxt h TYR 123 CO -0.72 -0.42 0.41 0.28 -1.64 0.00 0.00 178.16 176.07 3gxt h VAL 124 N -0.50 0.80 -0.33 1.81 2.07 0.18 -1.14 116.25 119.14 3gxt h VAL 124 Ca 0.05 -0.22 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 3gxt h VAL 124 Cb 0.57 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 3gxt h VAL 124 CO -0.24 0.12 0.02 0.45 0.02 0.00 0.00 177.57 177.94 3gxt h HIS 125 N 0.64 0.62 -0.30 1.57 3.86 -0.43 -2.35 115.15 118.76 3gxt h HIS 125 Ca 0.41 -0.10 0.09 0.00 -1.16 0.00 0.00 60.37 59.61 3gxt h HIS 125 Cb 0.50 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.80 3gxt h HIS 125 CO -0.10 0.67 0.30 0.66 0.86 0.00 0.00 177.93 180.33 3gxt h SER 126 N 0.39 0.00 0.78 2.45 4.64 -0.36 1.78 113.55 123.22 3gxt h SER 126 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3gxt h SER 126 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 3gxt h SER 126 CO 0.01 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.26 3gxt n LYS 127 N -3.90 0.02 -1.21 4.77 4.76 -0.90 -4.89 118.16 116.81 3gxt n LYS 127 Ca 0.05 0.15 0.00 0.00 -2.87 0.00 0.00 58.31 55.63 3gxt n LYS 127 Cb 0.45 -1.54 0.00 0.00 -1.84 0.00 0.00 35.03 32.11 3gxt n LYS 127 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3gxt n GLY 128 N 0.72 0.88 3.59 0.72 0.00 0.60 -4.99 105.19 106.72 3gxt n GLY 128 Ca 0.05 -0.61 -0.27 0.00 0.00 0.00 0.00 46.02 45.19 3gxt n GLY 128 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gxt s LEU 129 N 0.00 2.54 -0.06 0.99 1.43 -1.10 -5.04 118.68 117.44 3gxt s LEU 129 Ca 0.00 -1.44 0.04 0.00 -1.03 0.00 0.00 54.13 51.70 3gxt s LEU 129 Cb 0.00 -0.69 -0.00 0.00 0.03 0.00 0.00 46.19 45.53 3gxt s LEU 129 CO 0.00 -0.59 -0.19 -0.54 0.23 0.00 0.00 176.35 175.26 3gxt s LYS 130 N -3.78 2.07 -0.05 1.70 1.02 -0.55 -3.78 119.74 116.36 3gxt s LYS 130 Ca 0.30 -0.67 -0.17 0.00 0.02 0.00 0.00 55.97 55.45 3gxt s LYS 130 Cb 0.08 -1.73 -0.05 0.00 -0.52 0.00 0.00 37.83 35.60 3gxt s LYS 130 CO 0.15 0.22 0.45 -1.17 -0.92 0.00 0.00 175.35 174.09 3gxt s LEU 131 N 0.14 4.38 0.15 3.17 2.96 -1.26 0.08 118.68 128.30 3gxt s LEU 131 Ca -0.07 0.91 0.08 0.00 -0.22 0.00 0.00 54.13 54.83 3gxt s LEU 131 Cb -0.13 -2.67 -0.04 0.00 0.50 0.00 0.00 46.19 43.85 3gxt s LEU 131 CO 0.04 0.16 -0.07 -0.83 -1.32 0.00 0.00 176.35 174.32 3gxt s GLY 132 N -0.24 1.76 0.39 7.98 0.00 0.17 -0.33 107.32 117.05 3gxt s GLY 132 Ca 0.25 -1.35 0.03 0.00 0.00 0.00 0.00 44.72 43.65 3gxt s GLY 132 CO 0.12 -1.35 0.11 4.51 0.00 0.00 0.00 173.10 176.49 3gxt n ILE 133 N 0.27 0.00 -4.22 0.90 3.06 -0.64 -0.18 119.36 118.55 3gxt n ILE 133 Ca -0.12 -2.15 -0.17 0.00 -2.50 0.00 0.00 62.75 57.82 3gxt n ILE 133 Cb 0.54 0.70 -0.13 0.00 0.54 0.00 0.00 39.64 41.29 3gxt n ILE 133 CO 0.00 0.00 0.00 -0.47 -2.50 0.00 0.00 176.55 173.58 3gxt s TYR 134 N -2.88 0.88 0.33 9.51 5.04 -1.24 -1.34 117.35 127.66 3gxt s TYR 134 Ca 0.15 -0.34 -0.14 0.00 -2.44 0.00 0.00 57.07 54.30 3gxt s TYR 134 Cb 0.01 -0.53 0.03 0.00 0.35 0.00 0.00 41.96 41.82 3gxt s TYR 134 CO 0.11 -0.01 0.66 0.00 -1.34 0.00 0.00 175.55 174.96 3gxt s ALA 135 N -0.86 -0.44 0.06 3.97 0.00 -0.43 -4.93 121.76 119.14 3gxt s ALA 135 Ca -0.02 -0.85 0.09 0.00 0.00 0.00 0.00 51.96 51.19 3gxt s ALA 135 Cb -0.07 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 23.89 3gxt s ALA 135 CO 0.01 -0.94 -0.26 0.34 0.00 0.00 0.00 175.76 174.91 3gxt s ASP 136 N -3.07 3.27 0.36 0.00 -1.08 -1.26 -0.22 116.67 114.68 3gxt s ASP 136 Ca 0.19 -0.60 0.26 0.00 -0.52 0.00 0.00 52.55 51.88 3gxt s ASP 136 Cb -0.04 -0.31 1.28 0.00 -1.46 0.00 0.00 42.92 42.39 3gxt s ASP 136 CO 0.12 0.24 1.80 1.62 0.52 0.00 0.00 175.17 179.47 3gxt h VAL 137 N 4.13 0.00 0.00 1.11 3.04 0.04 0.24 116.25 124.81 3gxt h VAL 137 Ca -0.47 -0.13 0.00 0.00 -1.01 0.00 0.00 66.70 65.09 3gxt h VAL 137 Cb 1.15 0.81 0.00 0.00 -2.01 0.00 0.00 31.29 31.23 3gxt h VAL 137 CO 0.43 0.00 0.00 0.61 -1.01 0.00 0.00 177.57 177.60 3gxt n GLY 138 N -0.70 0.89 0.00 3.17 0.00 -1.24 -3.97 105.19 103.33 3gxt n GLY 138 Ca -0.00 -0.45 0.04 0.00 0.00 0.00 0.00 46.02 45.62 3gxt n GLY 138 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3gxt n ASN 139 N 0.00 2.31 -3.85 1.61 3.02 -1.10 -2.35 115.26 114.90 3gxt n ASN 139 Ca 0.00 -0.17 -0.10 0.00 -0.03 0.00 0.00 54.58 54.27 3gxt n ASN 139 Cb 0.00 1.31 -0.09 0.00 -0.61 0.00 0.00 39.78 40.40 3gxt n ASN 139 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3gxt s LYS 140 N -2.43 0.68 1.01 3.52 1.02 -1.26 -0.42 119.74 121.85 3gxt s LYS 140 Ca -0.02 -0.62 -0.12 0.00 0.02 0.00 0.00 55.97 55.23 3gxt s LYS 140 Cb 0.06 0.28 0.19 0.00 -0.52 0.00 0.00 37.83 37.84 3gxt s LYS 140 CO 0.37 -0.19 1.09 0.95 -0.92 0.00 0.00 175.35 176.65 3gxt s THR 141 N -2.48 2.06 0.64 2.17 -4.23 0.43 -4.53 115.64 109.71 3gxt s THR 141 Ca -0.06 0.02 0.29 0.00 -1.18 0.00 0.00 61.69 60.76 3gxt s THR 141 Cb -0.01 -2.49 0.32 0.00 1.34 0.00 0.00 72.50 71.66 3gxt s THR 141 CO -0.03 -0.03 1.91 0.00 -0.54 0.00 0.00 174.62 175.92 3gxt h ALA 143 N 1.37 0.51 0.00 0.00 0.00 -2.00 -3.49 119.26 115.65 3gxt h ALA 143 Ca 0.07 -1.26 0.00 0.00 0.00 0.00 0.00 54.91 53.72 3gxt h ALA 143 Cb 0.85 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3gxt h ALA 143 CO -0.00 1.37 0.00 0.41 0.00 0.00 0.00 179.25 181.03 3gxt n GLY 144 N 1.61 0.66 3.79 0.00 0.00 -0.05 -5.13 105.19 106.07 3gxt n GLY 144 Ca -0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 3gxt n GLY 144 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gxt s PHE 145 N -1.45 3.70 0.06 1.61 0.08 -1.26 -4.57 117.98 116.15 3gxt s PHE 145 Ca 0.00 1.70 -0.15 0.00 0.12 0.00 0.00 56.93 58.60 3gxt s PHE 145 Cb 0.00 -2.85 -0.08 0.00 -0.57 0.00 0.00 43.02 39.51 3gxt s PHE 145 CO 0.00 0.26 0.32 -2.30 -0.10 0.00 0.00 175.22 173.40 3gxt n PRO 146 N 0.66 0.00 -0.96 0.24 -0.01 -1.26 0.16 135.00 133.83 3gxt n PRO 146 Ca 0.01 0.00 -0.10 0.00 -0.01 0.00 0.00 63.50 63.39 3gxt n PRO 146 Cb 0.50 -0.54 0.07 0.00 -0.01 0.00 0.00 33.50 33.52 3gxt n PRO 146 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 3gxt n GLY 147 N 0.86 -0.55 0.17 -1.23 0.00 0.44 -4.09 105.19 100.79 3gxt n GLY 147 Ca 0.09 -1.79 0.08 0.00 0.00 0.00 0.00 46.02 44.39 3gxt n GLY 147 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3gxt n SER 148 N -3.20 1.15 -4.75 1.61 7.64 0.83 -4.85 113.62 112.04 3gxt n SER 148 Ca 0.06 -1.07 -0.41 0.00 1.01 0.00 0.00 58.87 58.45 3gxt n SER 148 Cb 0.22 0.75 -0.01 0.00 -1.01 0.00 0.00 64.21 64.16 3gxt n SER 148 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 3gxt n PHE 149 N -0.78 2.92 0.00 1.43 7.35 -0.99 -0.34 117.46 127.05 3gxt n PHE 149 Ca 0.05 0.28 0.00 0.00 -0.76 0.00 0.00 57.45 57.01 3gxt n PHE 149 Cb 0.29 -2.59 0.00 0.00 0.35 0.00 0.00 39.48 37.52 3gxt n PHE 149 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3gxt n GLY 150 N 1.88 2.44 1.42 7.13 0.00 -1.26 -4.73 105.19 112.07 3gxt n GLY 150 Ca 0.07 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.17 3gxt n GLY 150 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3gxt n TYR 151 N -0.34 1.43 0.01 1.61 4.01 0.54 -4.73 117.16 119.69 3gxt n TYR 151 Ca 0.00 -0.70 -0.10 0.00 -0.16 0.00 0.00 57.90 56.94 3gxt n TYR 151 Cb 0.00 -0.32 -0.04 0.00 -0.31 0.00 0.00 39.34 38.68 3gxt n TYR 151 CO 0.00 0.00 0.00 1.88 -0.46 0.00 0.00 176.86 178.28 3gxt h TYR 152 N 3.31 -0.28 -0.81 -0.72 0.05 -1.67 0.37 116.97 117.23 3gxt h TYR 152 Ca 0.00 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.78 3gxt h TYR 152 Cb 1.54 0.14 -0.04 0.00 1.01 0.00 0.00 36.73 39.38 3gxt h TYR 152 CO 0.75 -0.17 0.45 -0.44 -1.05 0.00 0.00 178.16 177.70 3gxt h ASP 153 N -0.14 0.99 0.45 3.88 3.32 -1.89 -2.51 116.42 120.52 3gxt h ASP 153 Ca 0.08 -0.08 -0.31 0.00 0.02 0.00 0.00 57.03 56.74 3gxt h ASP 153 Cb 0.25 -0.25 0.01 0.00 0.22 0.00 0.00 39.33 39.56 3gxt h ASP 153 CO -0.19 0.79 -1.43 0.40 -1.72 0.00 0.00 179.24 177.09 3gxt h ILE 154 N 1.13 1.30 0.41 0.35 5.03 -1.67 -3.10 117.51 120.96 3gxt h ILE 154 Ca 0.29 -2.85 -0.02 0.00 -0.12 0.00 0.00 64.86 62.16 3gxt h ILE 154 Cb 0.01 2.90 0.00 0.00 -3.03 0.00 0.00 36.82 36.70 3gxt h ILE 154 CO -0.05 0.85 -0.20 0.44 -0.68 0.00 0.00 178.15 178.51 3gxt h ASP 155 N 0.09 -0.47 -0.88 1.72 3.45 -0.22 -0.76 116.42 119.36 3gxt h ASP 155 Ca -0.21 -0.02 0.14 0.00 0.43 0.00 0.00 57.03 57.37 3gxt h ASP 155 Cb 2.05 0.12 -0.15 0.00 -0.56 0.00 0.00 39.33 40.79 3gxt h ASP 155 CO 0.21 -0.29 -0.36 0.00 -1.57 0.00 0.00 179.24 177.23 3gxt h ALA 156 N -0.03 0.14 -0.19 3.45 0.00 -1.55 0.14 119.26 121.23 3gxt h ALA 156 Ca -0.06 0.25 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3gxt h ALA 156 Cb 0.45 0.92 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 3gxt h ALA 156 CO 0.09 -0.62 -0.02 0.37 0.00 0.00 0.00 179.25 179.08 3gxt h GLN 157 N -0.05 0.35 -0.49 0.00 5.75 -1.44 -0.97 115.11 118.26 3gxt h GLN 157 Ca 0.32 -0.12 0.08 0.00 -0.15 0.00 0.00 58.65 58.78 3gxt h GLN 157 Cb 0.59 -0.03 -0.10 0.00 1.07 0.00 0.00 27.48 29.02 3gxt h GLN 157 CO -0.90 0.57 -0.44 1.15 -2.65 0.00 0.00 178.83 176.57 3gxt h THR 158 N 0.08 0.09 -0.47 2.39 2.02 0.06 0.52 112.91 117.62 3gxt h THR 158 Ca 0.05 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.29 3gxt h THR 158 Cb 0.43 0.09 -0.05 0.00 -1.74 0.00 0.00 68.15 66.89 3gxt h THR 158 CO 0.01 0.00 0.19 -0.26 0.37 0.00 0.00 175.52 175.83 3gxt h PHE 159 N -0.28 0.34 -0.18 3.16 0.04 -0.57 -1.68 116.94 117.76 3gxt h PHE 159 Ca 0.15 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.93 3gxt h PHE 159 Cb 0.57 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.63 3gxt h PHE 159 CO -0.67 0.14 0.06 0.00 -0.60 0.00 0.00 178.31 177.24 3gxt h ALA 160 N 1.29 1.76 -0.06 2.45 0.00 0.45 -0.28 119.26 124.87 3gxt h ALA 160 Ca 0.22 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 3gxt h ALA 160 Cb 0.19 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3gxt h ALA 160 CO -0.20 0.19 -0.30 -0.44 0.00 0.00 0.00 179.25 178.50 3gxt h ASP 161 N 0.25 0.10 1.56 0.00 5.19 0.86 -3.18 116.42 121.21 3gxt h ASP 161 Ca 0.06 -0.03 -0.07 0.00 -0.62 0.00 0.00 57.03 56.37 3gxt h ASP 161 Cb 0.08 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 39.56 3gxt h ASP 161 CO -0.00 0.41 -0.45 -0.50 -3.12 0.00 0.00 179.24 175.57 3gxt h TRP 162 N 0.09 0.00 0.00 4.55 6.55 -0.65 -3.47 115.95 123.02 3gxt h TRP 162 Ca 0.01 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.85 3gxt h TRP 162 Cb 0.59 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.89 3gxt h TRP 162 CO 0.00 0.30 0.00 0.41 -1.05 0.00 0.00 178.44 178.11 3gxt n GLY 163 N 1.19 1.06 3.77 1.49 0.00 -0.78 -4.54 105.19 107.38 3gxt n GLY 163 Ca 0.02 -0.21 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 3gxt n GLY 163 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3gxt n VAL 164 N -2.06 1.74 0.52 1.61 0.31 -0.97 -4.76 118.33 114.72 3gxt n VAL 164 Ca 0.00 -0.43 0.05 0.00 -0.01 0.00 0.00 64.34 63.95 3gxt n VAL 164 Cb 0.02 -1.96 -0.05 0.00 -0.91 0.00 0.00 33.84 30.94 3gxt n VAL 164 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3gxt n ASP 165 N 0.92 0.70 -3.90 4.52 8.00 0.55 -4.78 116.55 122.55 3gxt n ASP 165 Ca 0.03 -0.85 -0.10 0.00 0.71 0.00 0.00 54.79 54.58 3gxt n ASP 165 Cb 0.38 0.88 -0.09 0.00 -0.02 0.00 0.00 41.12 42.27 3gxt n ASP 165 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3gxt s LEU 166 N -2.35 1.69 -0.07 0.64 0.20 -1.02 -1.01 118.68 116.77 3gxt s LEU 166 Ca 0.05 -0.41 0.01 0.00 0.69 0.00 0.00 54.13 54.48 3gxt s LEU 166 Cb 0.09 0.65 0.02 0.00 -0.43 0.00 0.00 46.19 46.52 3gxt s LEU 166 CO 0.42 -0.46 -0.09 -0.22 -0.29 0.00 0.00 176.35 175.70 3gxt s LEU 167 N -1.87 1.43 -0.31 -0.68 2.96 -0.35 -1.62 118.68 118.25 3gxt s LEU 167 Ca -0.08 -0.25 -0.16 0.00 -0.22 0.00 0.00 54.13 53.41 3gxt s LEU 167 Cb -0.03 -0.73 -0.02 0.00 0.50 0.00 0.00 46.19 45.90 3gxt s LEU 167 CO -0.02 -0.03 0.43 -0.75 -1.32 0.00 0.00 176.35 174.66 3gxt s LYS 168 N 1.00 3.82 -0.41 1.98 2.20 -0.45 -0.48 119.74 127.41 3gxt s LYS 168 Ca -0.09 -0.06 -0.11 0.00 -0.36 0.00 0.00 55.97 55.35 3gxt s LYS 168 Cb -0.15 -3.73 0.06 0.00 -1.51 0.00 0.00 37.83 32.50 3gxt s LYS 168 CO -0.00 -0.44 0.26 0.12 -0.36 0.00 0.00 175.35 174.93 3gxt s PHE 169 N 2.19 3.28 0.48 4.03 5.36 0.14 -1.31 117.98 132.15 3gxt s PHE 169 Ca 0.16 -1.18 -0.08 0.00 -0.96 0.00 0.00 56.93 54.87 3gxt s PHE 169 Cb -0.16 -2.77 -0.05 0.00 -0.34 0.00 0.00 43.02 39.70 3gxt s PHE 169 CO 0.11 -0.76 0.82 0.34 -1.46 0.00 0.00 175.22 174.28 3gxt s ASP 170 N 1.96 6.35 -0.29 6.13 -1.08 0.70 -2.48 116.67 127.96 3gxt s ASP 170 Ca 0.03 1.08 0.09 0.00 -0.52 0.00 0.00 52.55 53.23 3gxt s ASP 170 Cb -0.22 -2.31 0.46 0.00 -1.46 0.00 0.00 42.92 39.40 3gxt s ASP 170 CO 0.05 -0.56 1.18 0.61 0.52 0.00 0.00 175.17 176.96 3gxt n GLY 171 N -2.00 5.85 3.74 2.66 0.00 -1.26 0.73 105.19 114.91 3gxt n GLY 171 Ca 0.02 -2.49 -0.31 0.00 0.00 0.00 0.00 46.02 43.24 3gxt n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gxt n TYR 173 N -3.69 -2.48 -3.70 0.00 4.01 -1.26 -3.66 117.16 106.37 3gxt n TYR 173 Ca 0.09 0.86 -0.21 0.00 -0.16 0.00 0.00 57.90 58.47 3gxt n TYR 173 Cb 0.53 -3.98 -0.18 0.00 -0.31 0.00 0.00 39.34 35.40 3gxt n TYR 173 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3gxt h ASP 175 N 8.40 -0.45 -3.97 0.00 3.45 -1.98 -3.47 116.42 118.39 3gxt h ASP 175 Ca -0.15 0.02 -0.33 0.00 0.43 0.00 0.00 57.03 57.01 3gxt h ASP 175 Cb 1.12 0.13 -0.15 0.00 -0.56 0.00 0.00 39.33 39.88 3gxt h ASP 175 CO 0.19 -0.28 -0.71 -0.94 -1.57 0.00 0.00 179.24 175.94 3gxt s SER 176 N -2.83 1.79 0.55 6.45 1.04 -1.26 -5.05 113.70 114.39 3gxt s SER 176 Ca -0.07 -1.04 0.25 0.00 0.48 0.00 0.00 55.95 55.57 3gxt s SER 176 Cb 0.01 -0.01 1.45 0.00 0.10 0.00 0.00 66.02 67.57 3gxt s SER 176 CO 0.22 -0.36 2.03 -0.07 0.98 0.00 0.00 173.24 176.04 3gxt h LEU 177 N 2.74 0.00 -0.50 2.42 3.38 -2.00 -1.38 115.31 119.98 3gxt h LEU 177 Ca -0.37 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.55 3gxt h LEU 177 Cb 1.19 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 3gxt h LEU 177 CO 0.64 0.00 0.10 -0.33 0.09 0.00 0.00 178.44 178.93 3gxt h GLU 178 N 0.00 0.81 -0.10 1.13 5.08 -1.99 -0.08 114.58 119.44 3gxt h GLU 178 Ca 0.18 -0.21 -0.12 0.00 -1.00 0.00 0.00 59.36 58.21 3gxt h GLU 178 Cb 0.77 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 3gxt h GLU 178 CO -0.00 0.80 -0.47 -0.91 -1.00 0.00 0.00 179.01 177.43 3gxt h ASN 179 N 0.69 0.26 0.62 1.42 4.21 -1.68 -0.21 115.58 120.89 3gxt h ASN 179 Ca 0.15 -0.12 -0.03 0.00 1.21 0.00 0.00 56.30 57.51 3gxt h ASN 179 Cb 0.37 -0.07 0.01 0.00 -1.12 0.00 0.00 38.32 37.50 3gxt h ASN 179 CO 0.01 0.70 -0.30 0.25 -1.29 0.00 0.00 177.43 176.80 3gxt h LEU 180 N 0.20 -0.70 0.38 1.61 5.85 -1.22 0.48 115.31 121.90 3gxt h LEU 180 Ca 0.01 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 3gxt h LEU 180 Cb 0.91 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 42.09 3gxt h LEU 180 CO 0.07 -0.46 -0.52 0.00 -0.34 0.00 0.00 178.44 177.19 3gxt h ALA 181 N -0.53 -1.10 -0.82 1.25 0.00 -0.86 0.44 119.26 117.63 3gxt h ALA 181 Ca -0.08 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3gxt h ALA 181 Cb 0.66 0.79 -0.04 0.00 0.00 0.00 0.00 17.79 19.20 3gxt h ALA 181 CO 0.14 -1.17 0.52 -0.44 0.00 0.00 0.00 179.25 178.30 3gxt h ASP 182 N -0.93 0.96 0.06 0.00 5.19 -1.10 -2.06 116.42 118.54 3gxt h ASP 182 Ca -0.04 -0.04 -0.00 0.00 -0.62 0.00 0.00 57.03 56.32 3gxt h ASP 182 Cb 0.84 -0.24 0.00 0.00 0.18 0.00 0.00 39.33 40.11 3gxt h ASP 182 CO -0.14 0.72 -0.03 1.23 -3.12 0.00 0.00 179.24 177.91 3gxt h GLY 183 N 1.13 -0.08 0.34 2.75 0.00 -0.65 0.56 103.07 107.12 3gxt h GLY 183 Ca 0.30 0.03 0.06 0.00 0.00 0.00 0.00 47.33 47.72 3gxt h GLY 183 CO -0.06 -0.03 -0.13 -0.97 0.00 0.00 0.00 176.54 175.35 3gxt h TYR 184 N -0.30 -0.31 0.21 5.60 0.05 -0.80 -2.50 116.97 118.92 3gxt h TYR 184 Ca -0.01 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.79 3gxt h TYR 184 Cb 0.26 0.18 0.00 0.00 1.01 0.00 0.00 36.73 38.18 3gxt h TYR 184 CO -0.00 -0.20 -0.10 0.87 -1.05 0.00 0.00 178.16 177.68 3gxt h LYS 185 N -0.10 -0.27 -0.99 4.88 1.57 -1.27 -2.91 116.57 117.48 3gxt h LYS 185 Ca 0.14 0.02 0.10 0.00 -1.87 0.00 0.00 60.65 59.04 3gxt h LYS 185 Cb 0.31 0.06 -0.08 0.00 0.08 0.00 0.00 32.23 32.60 3gxt h LYS 185 CO -0.32 -0.10 0.63 1.25 -0.57 0.00 0.00 179.45 180.34 3gxt h HIS 186 N -0.39 1.14 -0.57 -1.35 2.76 -0.81 0.27 115.15 116.21 3gxt h HIS 186 Ca -0.03 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.13 3gxt h HIS 186 Cb 0.30 -0.37 -0.02 0.00 1.55 0.00 0.00 27.41 28.87 3gxt h HIS 186 CO -0.03 0.51 0.18 1.98 -1.30 0.00 0.00 177.93 179.27 3gxt h MET 187 N 1.04 0.88 -0.82 5.26 1.85 -1.37 -2.53 114.93 119.24 3gxt h MET 187 Ca 0.47 -0.19 0.03 0.00 -0.61 0.00 0.00 59.70 59.40 3gxt h MET 187 Cb 0.38 -0.13 -0.05 0.00 0.43 0.00 0.00 31.60 32.23 3gxt h MET 187 CO -0.22 0.79 0.53 1.03 -0.40 0.00 0.00 176.91 178.64 3gxt h SER 188 N 0.79 0.89 -0.22 1.39 0.87 -0.27 0.33 113.55 117.33 3gxt h SER 188 Ca 0.18 -0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.66 3gxt h SER 188 Cb 0.27 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 62.01 3gxt h SER 188 CO -0.01 0.62 -0.10 -0.07 -0.53 0.00 0.00 176.83 176.74 3gxt h LEU 189 N 1.04 0.57 -0.43 2.23 3.38 -1.30 -2.62 115.31 118.18 3gxt h LEU 189 Ca 0.32 -0.15 -0.16 0.00 0.09 0.00 0.00 57.88 57.98 3gxt h LEU 189 Cb -0.02 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 3gxt h LEU 189 CO -0.10 0.71 -0.44 0.00 0.09 0.00 0.00 178.44 178.70 3gxt h ALA 190 N 1.35 0.61 -0.52 1.53 0.00 -0.54 -1.31 119.26 120.37 3gxt h ALA 190 Ca 0.10 -0.47 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 3gxt h ALA 190 Cb 0.50 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3gxt h ALA 190 CO 0.03 0.68 0.26 -0.07 0.00 0.00 0.00 179.25 180.15 3gxt h LEU 191 N 0.66 0.67 -0.59 0.00 3.38 -1.17 -2.02 115.31 116.24 3gxt h LEU 191 Ca 0.04 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 3gxt h LEU 191 Cb 1.02 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 3gxt h LEU 191 CO 0.10 0.60 0.26 -1.13 0.09 0.00 0.00 178.44 178.36 3gxt h ASN 192 N 0.70 0.79 -0.58 -0.43 -0.73 -1.19 -2.97 115.58 111.16 3gxt h ASN 192 Ca 0.18 -0.15 -0.04 0.00 1.87 0.00 0.00 56.30 58.16 3gxt h ASN 192 Cb 0.10 -0.20 -0.03 0.00 0.27 0.00 0.00 38.32 38.46 3gxt h ASN 192 CO -0.02 0.72 0.20 0.03 -0.37 0.00 0.00 177.43 177.99 3gxt h ARG 193 N 0.81 0.89 -0.96 6.67 3.08 -1.16 -2.91 114.38 120.81 3gxt h ARG 193 Ca 0.20 -0.18 0.38 0.00 0.07 0.00 0.00 59.98 60.45 3gxt h ARG 193 Cb 0.15 -0.14 -0.17 0.00 0.08 0.00 0.00 29.97 29.89 3gxt h ARG 193 CO -0.02 0.79 0.45 0.25 -1.07 0.00 0.00 179.97 180.36 3gxt n THR 194 N -4.44 -0.40 0.00 2.04 -2.24 -0.77 -4.72 114.28 103.75 3gxt n THR 194 Ca 0.03 1.97 0.00 0.00 -2.27 0.00 0.00 64.05 63.78 3gxt n THR 194 Cb 0.19 -3.15 0.00 0.00 -2.10 0.00 0.00 70.33 65.27 3gxt n THR 194 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gxt n GLY 195 N -1.28 0.68 3.67 3.38 0.00 -1.10 -5.09 105.19 105.44 3gxt n GLY 195 Ca 0.35 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.02 3gxt n GLY 195 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3gxt s ARG 196 N -0.71 3.14 -0.32 1.61 3.52 -1.26 -5.04 118.95 119.89 3gxt s ARG 196 Ca 0.00 -0.41 -0.28 0.00 -0.13 0.00 0.00 55.73 54.92 3gxt s ARG 196 Cb 0.00 -2.84 -0.04 0.00 -1.56 0.00 0.00 34.95 30.50 3gxt s ARG 196 CO 0.00 0.63 2.09 -1.12 -0.81 0.00 0.00 175.30 176.09 3gxt s SER 197 N -0.67 5.42 -0.16 -2.12 0.01 -1.26 -4.79 113.70 110.13 3gxt s SER 197 Ca 0.11 1.47 -0.02 0.00 1.31 0.00 0.00 55.95 58.82 3gxt s SER 197 Cb -0.12 -2.52 0.05 0.00 0.21 0.00 0.00 66.02 63.65 3gxt s SER 197 CO 0.02 -2.05 0.02 -0.63 0.41 0.00 0.00 173.24 171.01 3gxt s ILE 198 N 8.51 0.52 -0.02 1.44 1.01 -1.26 -4.69 121.20 126.72 3gxt s ILE 198 Ca 0.91 -0.38 -0.30 0.00 0.00 0.00 0.00 60.65 60.88 3gxt s ILE 198 Cb -0.26 -0.91 -0.06 0.00 0.01 0.00 0.00 42.46 41.24 3gxt s ILE 198 CO 0.32 -0.06 1.54 -0.69 0.00 0.00 0.00 174.94 176.06 3gxt s VAL 199 N 1.87 3.55 -0.27 2.92 1.01 -0.18 -4.85 120.40 124.47 3gxt s VAL 199 Ca 0.01 0.85 -0.09 0.00 0.00 0.00 0.00 61.98 62.74 3gxt s VAL 199 Cb -0.16 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 3gxt s VAL 199 CO -0.07 -0.03 0.13 -0.47 0.00 0.00 0.00 175.10 174.66 3gxt s TYR 200 N 3.12 3.15 -0.21 5.22 5.04 -1.26 -1.21 117.35 131.21 3gxt s TYR 200 Ca 0.69 -0.16 -0.00 0.00 -2.44 0.00 0.00 57.07 55.16 3gxt s TYR 200 Cb -0.33 -2.31 0.02 0.00 0.35 0.00 0.00 41.96 39.68 3gxt s TYR 200 CO 0.28 -0.26 -0.14 0.45 -1.34 0.00 0.00 175.55 174.54 3gxt s SER 201 N 1.69 3.68 0.21 4.32 0.15 0.37 -0.60 113.70 123.52 3gxt s SER 201 Ca 0.07 -0.67 0.09 0.00 0.70 0.00 0.00 55.95 56.13 3gxt s SER 201 Cb -0.16 -1.57 -0.04 0.00 -1.71 0.00 0.00 66.02 62.54 3gxt s SER 201 CO 0.07 -0.04 -0.03 0.00 1.20 0.00 0.00 173.24 174.45 3gxt n GLU 203 N -0.38 1.45 -0.29 0.00 1.02 -1.03 -1.19 120.64 120.22 3gxt n GLU 203 Ca -0.09 -2.40 -0.08 0.00 -0.02 0.00 0.00 57.16 54.58 3gxt n GLU 203 Cb 0.57 -1.41 -0.07 0.00 -0.02 0.00 0.00 31.44 30.51 3gxt n GLU 203 CO 0.00 0.00 0.00 2.35 1.18 0.00 0.00 177.13 180.66 3gxt h TRP 204 N 0.00 -1.38 0.61 -0.32 2.91 -1.84 -3.10 115.95 112.83 3gxt h TRP 204 Ca 0.00 0.09 -0.03 0.00 1.13 0.00 0.00 58.89 60.08 3gxt h TRP 204 Cb 0.95 0.69 0.01 0.00 -0.51 0.00 0.00 29.16 30.30 3gxt h TRP 204 CO 0.00 -0.28 -0.29 -1.00 -1.03 0.00 0.00 178.44 175.84 3gxt h PRO 205 N -0.03 -0.79 -0.66 2.65 0.13 -1.89 -2.10 132.00 129.32 3gxt h PRO 205 Ca 0.11 0.05 0.13 0.00 -0.87 0.00 0.00 66.00 65.42 3gxt h PRO 205 Cb 0.31 0.18 -0.12 0.00 0.13 0.00 0.00 31.00 31.50 3gxt h PRO 205 CO -0.67 -0.48 -0.19 -0.11 -0.23 0.00 0.00 178.00 176.33 3gxt n LEU 206 N -5.39 -0.29 -0.02 1.56 7.94 -0.92 0.78 117.00 120.66 3gxt n LEU 206 Ca -0.12 1.15 -0.17 0.00 -1.11 0.00 0.00 56.01 55.75 3gxt n LEU 206 Cb 0.35 -0.33 -0.08 0.00 0.53 0.00 0.00 43.42 43.90 3gxt n LEU 206 CO 0.34 -1.08 0.30 1.88 -1.11 0.00 0.00 177.39 177.72 3gxt h TYR 207 N 0.00 0.94 -0.48 1.96 0.05 -1.45 -3.21 116.97 114.77 3gxt h TYR 207 Ca 0.30 -0.42 -0.00 0.00 0.05 0.00 0.00 58.73 58.66 3gxt h TYR 207 Cb 0.46 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 38.04 3gxt h TYR 207 CO -0.53 1.23 0.28 1.98 -1.05 0.00 0.00 178.16 180.08 3gxt h MET 208 N 0.37 0.65 -0.07 4.88 4.05 0.39 -3.33 114.93 121.87 3gxt h MET 208 Ca -0.05 -0.06 0.01 0.00 -0.28 0.00 0.00 59.70 59.32 3gxt h MET 208 Cb 1.32 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 31.98 3gxt h MET 208 CO 0.14 0.48 -0.04 0.91 0.23 0.00 0.00 176.91 178.63 3gxt n TRP 209 N -4.70 -0.03 1.58 1.39 5.03 0.23 -1.75 117.44 119.18 3gxt n TRP 209 Ca 0.02 0.09 0.15 0.00 3.03 0.00 0.00 57.50 60.79 3gxt n TRP 209 Cb 0.06 -0.28 0.80 0.00 -1.03 0.00 0.00 31.31 30.86 3gxt n TRP 209 CO 0.00 0.00 0.00 -2.30 -0.03 0.00 0.00 177.69 175.36 3gxt n PRO 210 N -3.09 0.63 -0.09 -0.99 -0.02 -1.25 -2.09 135.00 128.10 3gxt n PRO 210 Ca 0.00 0.01 -0.17 0.00 -2.02 0.00 0.00 63.50 61.32 3gxt n PRO 210 Cb 0.02 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 31.93 3gxt n PRO 210 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3gxt n PHE 211 N -1.17 0.00 -3.58 6.00 3.72 -0.72 -5.07 117.46 116.64 3gxt n PHE 211 Ca 0.17 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.42 3gxt n PHE 211 Cb 0.18 -0.63 -0.06 0.00 -0.94 0.00 0.00 39.48 38.03 3gxt n PHE 211 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 176.76 177.85 3gxt s GLN 212 N -2.32 0.99 0.32 -1.08 -2.07 -0.89 -5.14 119.66 109.47 3gxt s GLN 212 Ca -0.24 -0.03 -0.27 0.00 -1.82 0.00 0.00 55.36 53.00 3gxt s GLN 212 Cb 0.09 0.46 -0.13 0.00 -1.09 0.00 0.00 33.01 32.33 3gxt s GLN 212 CO 0.32 -0.33 0.98 1.63 -1.32 0.00 0.00 175.29 176.57 3gxt n LYS 213 N 0.73 1.30 -2.89 9.60 4.01 -1.26 -3.88 118.16 125.77 3gxt n LYS 213 Ca -0.19 0.46 -0.36 0.00 -0.51 0.00 0.00 58.31 57.71 3gxt n LYS 213 Cb 0.58 -1.85 -0.06 0.00 -0.51 0.00 0.00 35.03 33.19 3gxt n LYS 213 CO 0.00 0.00 0.00 -2.14 -1.11 0.00 0.00 177.40 174.15 3gxt s PRO 214 N -1.62 4.44 -0.95 1.97 0.02 -1.26 -4.95 135.00 132.65 3gxt s PRO 214 Ca 0.59 1.16 -0.23 0.00 0.02 0.00 0.00 61.00 62.54 3gxt s PRO 214 Cb -0.67 -2.76 0.06 0.00 0.02 0.00 0.00 34.50 31.14 3gxt s PRO 214 CO 0.59 0.28 1.36 1.21 -0.33 0.00 0.00 177.00 180.12 3gxt s ASN 215 N -1.69 6.44 0.31 2.53 3.84 -1.26 -4.85 114.94 120.26 3gxt s ASN 215 Ca 0.49 -1.33 0.08 0.00 0.21 0.00 0.00 52.86 52.31 3gxt s ASN 215 Cb -0.17 -2.54 0.51 0.00 -0.55 0.00 0.00 41.25 38.50 3gxt s ASN 215 CO 0.22 -1.51 1.73 1.88 -2.79 0.00 0.00 177.10 176.62 3gxt h TYR 216 N 9.72 0.22 -0.17 0.43 0.05 -1.95 0.10 116.97 125.37 3gxt h TYR 216 Ca 0.09 -0.06 0.05 0.00 0.05 0.00 0.00 58.73 58.87 3gxt h TYR 216 Cb 1.02 -0.05 -0.06 0.00 1.01 0.00 0.00 36.73 38.65 3gxt h TYR 216 CO 1.23 0.57 -0.25 1.15 -1.05 0.00 0.00 178.16 179.81 3gxt h THR 217 N 0.16 0.40 -0.46 -2.88 2.02 -1.95 0.14 112.91 110.34 3gxt h THR 217 Ca 0.02 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 3gxt h THR 217 Cb 0.78 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.57 3gxt h THR 217 CO 0.06 0.00 0.20 -0.08 0.37 0.00 0.00 175.52 176.07 3gxt h GLU 218 N -0.29 0.68 -0.03 6.66 4.81 -1.69 -3.10 114.58 121.61 3gxt h GLU 218 Ca 0.11 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3gxt h GLU 218 Cb 0.46 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.73 3gxt h GLU 218 CO -0.34 0.60 0.02 0.82 -0.73 0.00 0.00 179.01 179.38 3gxt h ILE 219 N 0.60 1.01 -1.49 2.32 2.04 -0.40 0.17 117.51 121.76 3gxt h ILE 219 Ca 0.16 -0.02 0.46 0.00 1.00 0.00 0.00 64.86 66.46 3gxt h ILE 219 Cb 0.16 0.96 -0.10 0.00 -0.74 0.00 0.00 36.82 37.10 3gxt h ILE 219 CO -0.02 0.01 1.01 -0.09 0.00 0.00 0.00 178.15 179.07 3gxt h ARG 220 N 0.04 0.06 0.00 2.37 2.43 -0.90 0.32 114.38 118.71 3gxt h ARG 220 Ca 0.01 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 3gxt h ARG 220 Cb -0.00 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 3gxt h ARG 220 CO -0.00 0.04 0.00 1.96 -1.51 0.00 0.00 179.97 180.46 3gxt h GLN 221 N 0.06 0.00 0.00 0.20 4.20 -0.96 0.47 115.11 119.09 3gxt h GLN 221 Ca 0.81 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.52 3gxt h GLN 221 Cb 2.85 0.00 0.00 0.00 0.30 0.00 0.00 27.48 30.63 3gxt h GLN 221 CO -0.24 0.00 -0.04 0.66 -0.67 0.00 0.00 178.83 178.55 3gxt n TYR 222 N -2.95 0.00 -4.47 2.96 4.01 0.11 -4.39 117.16 112.43 3gxt n TYR 222 Ca 0.01 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.54 3gxt n TYR 222 Cb 0.28 0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.16 3gxt n TYR 222 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3gxt h ASN 224 N 6.17 0.31 -5.01 0.00 -0.26 -1.02 -2.99 115.58 112.78 3gxt h ASN 224 Ca -0.33 -0.27 -0.07 0.00 -0.56 0.00 0.00 56.30 55.08 3gxt h ASN 224 Cb 1.17 -0.10 -0.18 0.00 -1.06 0.00 0.00 38.32 38.16 3gxt h ASN 224 CO 0.49 1.09 0.07 -1.38 -1.06 0.00 0.00 177.43 176.64 3gxt s HIS 225 N -3.13 -0.50 -0.07 1.19 -3.43 -1.22 -1.48 115.29 106.65 3gxt s HIS 225 Ca -0.03 0.73 0.04 0.00 -0.80 0.00 0.00 55.06 55.00 3gxt s HIS 225 Cb 0.09 0.35 -0.00 0.00 -1.43 0.00 0.00 32.58 31.59 3gxt s HIS 225 CO 0.84 -0.60 -0.20 1.67 -2.00 0.00 0.00 174.74 174.44 3gxt s TRP 226 N -1.79 2.13 0.01 0.38 -2.14 -0.38 -1.49 118.94 115.66 3gxt s TRP 226 Ca -0.09 -0.75 -0.30 0.00 2.66 0.00 0.00 56.10 57.62 3gxt s TRP 226 Cb -0.01 -1.44 -0.05 0.00 -3.10 0.00 0.00 33.47 28.88 3gxt s TRP 226 CO 0.04 -0.29 1.20 1.03 -2.66 0.00 0.00 176.95 176.27 3gxt s ARG 227 N 0.21 4.40 -0.26 3.25 1.81 -0.33 -0.43 118.95 127.60 3gxt s ARG 227 Ca -0.11 1.74 -0.10 0.00 -1.72 0.00 0.00 55.73 55.54 3gxt s ARG 227 Cb -0.15 -3.44 -0.12 0.00 -0.45 0.00 0.00 34.95 30.79 3gxt s ARG 227 CO 0.05 -0.33 -0.31 0.09 -0.68 0.00 0.00 175.30 174.11 3gxt n ASN 228 N 4.46 1.91 -4.77 0.23 3.02 -1.02 -2.17 115.26 116.92 3gxt n ASN 228 Ca 0.10 0.22 -0.23 0.00 -0.03 0.00 0.00 54.58 54.64 3gxt n ASN 228 Cb 0.46 -0.69 -0.06 0.00 -0.61 0.00 0.00 39.78 38.89 3gxt n ASN 228 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3gxt s PHE 229 N -2.49 2.74 0.20 3.10 5.36 -1.26 -3.77 117.98 121.86 3gxt s PHE 229 Ca -0.36 -0.40 -0.09 0.00 -0.96 0.00 0.00 56.93 55.12 3gxt s PHE 229 Cb 0.13 -1.75 -0.07 0.00 -0.34 0.00 0.00 43.02 40.99 3gxt s PHE 229 CO 0.49 0.25 -0.00 0.00 -1.46 0.00 0.00 175.22 174.50 3gxt n ALA 230 N -1.24 -2.14 -1.01 11.12 0.00 -1.26 -4.93 120.51 121.05 3gxt n ALA 230 Ca -0.02 0.02 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 3gxt n ALA 230 Cb 0.61 -0.65 0.07 0.00 0.00 0.00 0.00 19.45 19.48 3gxt n ALA 230 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3gxt n ASP 231 N 1.09 -3.86 -4.84 0.00 9.92 -1.26 -4.97 116.55 112.63 3gxt n ASP 231 Ca 0.04 0.34 -0.32 0.00 -0.53 0.00 0.00 54.79 54.33 3gxt n ASP 231 Cb 0.19 -0.97 -0.06 0.00 -0.64 0.00 0.00 41.12 39.64 3gxt n ASP 231 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 3gxt s ILE 232 N -2.10 4.95 0.29 0.53 2.07 -1.26 -5.06 121.20 120.61 3gxt s ILE 232 Ca 0.51 -0.49 0.01 0.00 -1.41 0.00 0.00 60.65 59.27 3gxt s ILE 232 Cb -0.25 -3.36 0.01 0.00 0.13 0.00 0.00 42.46 38.99 3gxt s ILE 232 CO 0.73 0.21 0.07 0.47 -1.91 0.00 0.00 174.94 174.50 3gxt n ASP 233 N 0.64 2.53 -3.09 4.50 8.00 -1.26 -4.97 116.55 122.91 3gxt n ASP 233 Ca -0.09 -2.17 -0.38 0.00 0.71 0.00 0.00 54.79 52.86 3gxt n ASP 233 Cb 0.52 0.13 0.02 0.00 -0.02 0.00 0.00 41.12 41.77 3gxt n ASP 233 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 3gxt n ASP 234 N -1.39 7.38 -3.95 -2.24 -0.08 -1.26 -4.87 116.55 110.15 3gxt n ASP 234 Ca -0.09 -3.67 -0.21 0.00 -1.51 0.00 0.00 54.79 49.32 3gxt n ASP 234 Cb 0.35 -1.14 -0.16 0.00 2.34 0.00 0.00 41.12 42.51 3gxt n ASP 234 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 3gxt s SER 235 N -0.86 1.13 0.53 1.67 1.04 -1.26 -4.04 113.70 111.91 3gxt s SER 235 Ca 0.50 -0.17 0.28 0.00 0.48 0.00 0.00 55.95 57.04 3gxt s SER 235 Cb 0.35 -0.48 1.43 0.00 0.10 0.00 0.00 66.02 67.43 3gxt s SER 235 CO -0.30 -0.00 1.93 -0.25 0.98 0.00 0.00 173.24 175.60 3gxt h TRP 236 N 6.90 0.02 0.00 5.02 -0.00 -1.91 -1.63 115.95 124.35 3gxt h TRP 236 Ca -0.36 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.54 3gxt h TRP 236 Cb 1.17 -0.01 0.00 0.00 -0.00 0.00 0.00 29.16 30.32 3gxt h TRP 236 CO 0.48 0.01 0.00 1.17 -0.00 0.00 0.00 178.44 180.10 3gxt n LYS 237 N -4.32 0.00 -0.19 2.65 4.81 -1.26 -1.31 118.16 118.54 3gxt n LYS 237 Ca 0.15 0.54 -0.04 0.00 -0.87 0.00 0.00 58.31 58.09 3gxt n LYS 237 Cb 0.80 -1.40 0.03 0.00 0.02 0.00 0.00 35.03 34.48 3gxt n LYS 237 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 3gxt h SER 238 N 0.00 -0.91 -0.26 3.14 0.87 -1.70 0.16 113.55 114.84 3gxt h SER 238 Ca 0.00 0.21 0.03 0.00 -1.23 0.00 0.00 61.79 60.79 3gxt h SER 238 Cb 0.00 0.49 -0.04 0.00 -0.44 0.00 0.00 62.40 62.41 3gxt h SER 238 CO 0.00 -0.27 -0.22 0.40 -0.53 0.00 0.00 176.83 176.20 3gxt h ILE 239 N -0.12 0.00 -0.90 2.23 1.08 -1.34 -1.12 117.51 117.34 3gxt h ILE 239 Ca 0.25 0.00 0.15 0.00 -0.39 0.00 0.00 64.86 64.87 3gxt h ILE 239 Cb 0.52 0.00 -0.16 0.00 -3.07 0.00 0.00 36.82 34.11 3gxt h ILE 239 CO -0.64 0.00 -0.34 0.11 -0.69 0.00 0.00 178.15 176.59 3gxt h LYS 240 N -0.09 -0.03 -0.77 2.37 1.57 0.62 -0.36 116.57 119.88 3gxt h LYS 240 Ca 0.04 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.85 3gxt h LYS 240 Cb 0.20 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.47 3gxt h LYS 240 CO -0.29 -0.02 0.50 0.66 -0.57 0.00 0.00 179.45 179.72 3gxt h SER 241 N -0.03 0.83 0.35 0.86 4.64 -0.79 0.78 113.55 120.19 3gxt h SER 241 Ca 0.35 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.65 3gxt h SER 241 Cb 0.61 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.49 3gxt h SER 241 CO -0.92 0.58 -0.32 0.40 -0.87 0.00 0.00 176.83 175.70 3gxt h ILE 242 N 0.98 0.00 -0.40 0.95 2.04 0.15 0.46 117.51 121.69 3gxt h ILE 242 Ca 0.30 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.24 3gxt h ILE 242 Cb -0.03 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 35.96 3gxt h ILE 242 CO -0.09 0.00 -0.21 -0.07 0.00 0.00 0.00 178.15 177.77 3gxt h LEU 243 N -0.66 -0.72 -1.00 1.44 3.38 -1.01 0.16 115.31 116.89 3gxt h LEU 243 Ca -0.04 0.16 0.13 0.00 0.09 0.00 0.00 57.88 58.21 3gxt h LEU 243 Cb 0.57 0.38 -0.09 0.00 0.09 0.00 0.00 40.66 41.61 3gxt h LEU 243 CO -0.03 -0.24 0.63 0.44 0.09 0.00 0.00 178.44 179.33 3gxt h ASP 244 N -0.14 0.91 0.53 -0.43 3.32 0.79 0.81 116.42 122.21 3gxt h ASP 244 Ca 0.19 0.05 -0.20 0.00 0.02 0.00 0.00 57.03 57.10 3gxt h ASP 244 Cb 0.44 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 3gxt h ASP 244 CO -0.49 0.47 -0.87 -0.25 -1.72 0.00 0.00 179.24 176.39 3gxt h TRP 245 N 0.97 0.34 0.43 4.55 7.01 0.97 -2.24 115.95 127.98 3gxt h TRP 245 Ca 0.50 -0.18 -0.02 0.00 2.11 0.00 0.00 58.89 61.30 3gxt h TRP 245 Cb 0.53 -0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.55 3gxt h TRP 245 CO -0.01 0.99 -0.21 1.15 -2.79 0.00 0.00 178.44 177.57 3gxt h THR 246 N 0.13 0.00 -0.73 2.65 2.02 0.64 -2.88 112.91 114.74 3gxt h THR 246 Ca -0.05 -0.49 0.21 0.00 0.77 0.00 0.00 66.41 66.86 3gxt h THR 246 Cb 1.49 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.87 3gxt h THR 246 CO 0.13 0.00 0.67 0.77 0.37 0.00 0.00 175.52 177.46 3gxt h SER 247 N -1.07 0.00 -0.39 4.18 4.64 -1.01 -1.09 113.55 118.80 3gxt h SER 247 Ca -0.06 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.22 3gxt h SER 247 Cb 0.45 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.52 3gxt h SER 247 CO 0.10 0.00 0.08 0.15 -0.87 0.00 0.00 176.83 176.28 3gxt h PHE 248 N 0.00 0.68 -2.13 4.77 3.57 -1.19 -3.20 116.94 119.45 3gxt h PHE 248 Ca 0.34 -0.09 -0.61 0.00 3.53 0.00 0.00 57.97 61.15 3gxt h PHE 248 Cb 1.67 -0.19 -0.41 0.00 2.79 0.00 0.00 35.95 39.82 3gxt h PHE 248 CO 0.00 0.67 -0.52 0.27 -2.23 0.00 0.00 178.31 176.50 3gxt n ASN 249 N -4.54 4.77 0.13 0.41 6.94 -0.44 -4.71 115.26 117.81 3gxt n ASN 249 Ca -0.01 -3.70 -0.22 0.00 -0.02 0.00 0.00 54.58 50.63 3gxt n ASN 249 Cb 0.22 -0.59 -0.15 0.00 -2.36 0.00 0.00 39.78 36.90 3gxt n ASN 249 CO 0.00 0.00 0.00 0.06 -1.03 0.00 0.00 177.26 176.29 3gxt h GLN 250 N 2.98 0.46 -0.71 -3.83 3.07 -1.47 -3.12 115.11 112.48 3gxt h GLN 250 Ca 0.20 -0.78 0.10 0.00 0.09 0.00 0.00 58.65 58.26 3gxt h GLN 250 Cb 0.56 0.29 -0.11 0.00 0.08 0.00 0.00 27.48 28.30 3gxt h GLN 250 CO 0.86 1.37 -0.30 0.39 0.09 0.00 0.00 178.83 181.24 3gxt n GLU 251 N -3.65 -0.19 0.15 0.06 1.02 -1.26 -0.47 120.64 116.30 3gxt n GLU 251 Ca -0.15 1.09 0.01 0.00 -0.02 0.00 0.00 57.16 58.09 3gxt n GLU 251 Cb 1.08 -1.62 0.22 0.00 -0.02 0.00 0.00 31.44 31.10 3gxt n GLU 251 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 3gxt h ARG 252 N 0.00 0.00 0.00 3.49 2.43 -1.92 -3.40 114.38 114.98 3gxt h ARG 252 Ca 0.23 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.38 3gxt h ARG 252 Cb 0.40 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.95 3gxt h ARG 252 CO -0.70 0.54 -1.16 0.44 -1.51 0.00 0.00 179.97 177.58 3gxt n ILE 253 N -3.68 0.05 -0.20 1.20 -5.35 0.38 -4.68 119.36 107.08 3gxt n ILE 253 Ca -0.01 -0.09 -0.05 0.00 -0.27 0.00 0.00 62.75 62.34 3gxt n ILE 253 Cb 0.59 0.10 0.12 0.00 -1.74 0.00 0.00 39.64 38.71 3gxt n ILE 253 CO 0.00 0.00 0.00 -0.37 -1.76 0.00 0.00 176.55 174.42 3gxt h VAL 254 N 0.00 1.25 -0.25 7.28 -1.51 -1.44 -3.22 116.25 118.35 3gxt h VAL 254 Ca -0.02 -0.87 -0.13 0.00 -1.23 0.00 0.00 66.70 64.45 3gxt h VAL 254 Cb 0.40 0.56 -0.00 0.00 -2.13 0.00 0.00 31.29 30.12 3gxt h VAL 254 CO 0.00 0.33 -0.34 0.44 -1.23 0.00 0.00 177.57 176.78 3gxt h ASP 255 N 0.96 0.74 -0.99 4.19 3.32 -1.83 -3.16 116.42 119.65 3gxt h ASP 255 Ca 0.21 -0.50 0.27 0.00 0.02 0.00 0.00 57.03 57.03 3gxt h ASP 255 Cb 0.31 -0.21 -0.06 0.00 0.22 0.00 0.00 39.33 39.59 3gxt h ASP 255 CO -0.00 1.10 0.69 0.58 -1.72 0.00 0.00 179.24 179.88 3gxt h VAL 256 N 0.40 0.54 -3.01 -1.35 2.07 -1.83 -3.43 116.25 109.64 3gxt h VAL 256 Ca 0.03 -0.05 -0.53 0.00 0.82 0.00 0.00 66.70 66.96 3gxt h VAL 256 Cb 0.92 0.37 0.01 0.00 -1.52 0.00 0.00 31.29 31.07 3gxt h VAL 256 CO 0.08 0.03 0.73 0.00 0.02 0.00 0.00 177.57 178.42 3gxt s ALA 257 N -5.16 3.55 0.00 1.67 0.00 -1.19 -4.92 121.76 115.71 3gxt s ALA 257 Ca -0.06 0.99 0.00 0.00 0.00 0.00 0.00 51.96 52.89 3gxt s ALA 257 Cb 0.23 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.81 3gxt s ALA 257 CO 0.79 -0.67 0.00 0.41 0.00 0.00 0.00 175.76 176.29 3gxt n GLY 258 N 3.49 0.63 0.46 0.00 0.00 -0.66 -4.34 105.19 104.77 3gxt n GLY 258 Ca 0.11 -0.90 -0.08 0.00 0.00 0.00 0.00 46.02 45.15 3gxt n GLY 258 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3gxt n PRO 259 N -0.24 0.00 0.00 1.61 -0.02 -1.26 -0.39 135.00 134.70 3gxt n PRO 259 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3gxt n PRO 259 Cb 0.00 -0.19 0.00 0.00 -0.02 0.00 0.00 33.50 33.29 3gxt n PRO 259 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gxt n GLY 260 N 0.65 1.50 2.94 -1.23 0.00 -0.23 -4.90 105.19 103.92 3gxt n GLY 260 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 3gxt n GLY 260 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gxt s GLY 261 N -2.28 -0.34 0.12 -0.02 0.00 0.47 -2.56 107.32 102.71 3gxt s GLY 261 Ca 0.00 0.91 0.09 0.00 0.00 0.00 0.00 44.72 45.72 3gxt s GLY 261 CO 0.00 2.54 -0.18 -0.98 0.00 0.00 0.00 173.10 174.48 3gxt s TRP 262 N 2.52 2.53 -0.13 1.90 0.52 -0.55 -1.65 118.94 124.08 3gxt s TRP 262 Ca 0.10 -0.27 -0.29 0.00 0.02 0.00 0.00 56.10 55.66 3gxt s TRP 262 Cb -0.15 -1.34 -0.01 0.00 -1.15 0.00 0.00 33.47 30.82 3gxt s TRP 262 CO -0.15 0.39 1.08 -0.80 0.02 0.00 0.00 176.95 177.49 3gxt s ASN 263 N -2.17 7.14 -0.38 2.95 0.01 -1.26 -1.25 114.94 119.98 3gxt s ASN 263 Ca 0.18 1.58 -0.13 0.00 -0.71 0.00 0.00 52.86 53.78 3gxt s ASN 263 Cb -0.10 -2.55 0.01 0.00 0.41 0.00 0.00 41.25 39.02 3gxt s ASN 263 CO 0.10 -0.55 0.26 -0.62 -1.51 0.00 0.00 177.10 174.77 3gxt s ASP 264 N 1.28 5.97 -0.06 -1.22 -1.08 0.43 -4.49 116.67 117.51 3gxt s ASP 264 Ca 0.50 -0.81 0.11 0.00 -0.52 0.00 0.00 52.55 51.83 3gxt s ASP 264 Cb -0.19 -2.11 0.41 0.00 -1.46 0.00 0.00 42.92 39.56 3gxt s ASP 264 CO 0.16 -0.38 1.26 -0.81 0.52 0.00 0.00 175.17 175.93 3gxt n PRO 265 N 5.10 2.48 -0.33 4.34 -0.04 -1.26 -2.44 135.00 142.85 3gxt n PRO 265 Ca -0.12 -1.61 0.04 0.00 -0.04 0.00 0.00 63.50 61.78 3gxt n PRO 265 Cb 0.47 -1.58 -0.01 0.00 -0.04 0.00 0.00 33.50 32.35 3gxt n PRO 265 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 3gxt n ASP 266 N 0.57 -1.99 -4.74 3.54 2.03 -1.26 -4.95 116.55 109.74 3gxt n ASP 266 Ca 0.15 0.35 -0.35 0.00 0.52 0.00 0.00 54.79 55.45 3gxt n ASP 266 Cb 0.53 -0.99 0.05 0.00 -0.72 0.00 0.00 41.12 40.00 3gxt n ASP 266 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 3gxt s MET 267 N -1.24 2.70 -0.21 -0.67 -1.94 -1.26 -4.87 119.30 111.81 3gxt s MET 267 Ca 0.00 1.81 -0.29 0.00 -1.71 0.00 0.00 55.69 55.50 3gxt s MET 267 Cb 0.00 -1.90 -0.02 0.00 2.01 0.00 0.00 34.83 34.93 3gxt s MET 267 CO 0.00 -1.41 1.42 -0.51 -0.01 0.00 0.00 175.02 174.50 3gxt s LEU 268 N -4.43 4.02 0.00 -0.03 1.43 0.90 -4.89 118.68 115.67 3gxt s LEU 268 Ca 0.77 1.58 0.23 0.00 -1.03 0.00 0.00 54.13 55.68 3gxt s LEU 268 Cb -0.30 -3.54 0.46 0.00 0.03 0.00 0.00 46.19 42.84 3gxt s LEU 268 CO 0.37 -1.02 1.43 1.33 0.23 0.00 0.00 176.35 178.69 3gxt n VAL 269 N 5.93 0.56 -1.95 -1.59 0.24 -1.26 -1.03 118.33 119.24 3gxt n VAL 269 Ca 0.16 -0.78 -0.41 0.00 -2.04 0.00 0.00 64.34 61.27 3gxt n VAL 269 Cb 0.45 0.93 -0.01 0.00 -1.47 0.00 0.00 33.84 33.74 3gxt n VAL 269 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3gxt s ILE 270 N -1.44 2.37 0.00 1.34 1.01 -1.26 -3.02 121.20 120.20 3gxt s ILE 270 Ca 0.40 0.37 0.00 0.00 0.00 0.00 0.00 60.65 61.42 3gxt s ILE 270 Cb 0.23 -3.23 0.00 0.00 0.01 0.00 0.00 42.46 39.47 3gxt s ILE 270 CO 0.32 0.09 0.00 0.61 0.00 0.00 0.00 174.94 175.96 3gxt n GLY 271 N 0.65 1.76 0.00 6.18 0.00 -1.26 -4.86 105.19 107.66 3gxt n GLY 271 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3gxt n GLY 271 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3gxt n ASN 272 N 0.00 0.00 -0.04 1.61 3.02 -1.17 -4.75 115.26 113.93 3gxt n ASN 272 Ca 0.00 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.51 3gxt n ASN 272 Cb 0.00 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.10 3gxt n ASN 272 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3gxt n PHE 273 N 0.00 0.00 0.48 3.10 3.72 -1.26 -4.81 117.46 118.69 3gxt n PHE 273 Ca 0.00 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.53 3gxt n PHE 273 Cb 0.00 -0.41 0.29 0.00 -0.94 0.00 0.00 39.48 38.42 3gxt n PHE 273 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3gxt h GLY 274 N 1.65 0.00 -4.88 1.37 0.00 -1.92 -3.45 103.07 95.83 3gxt h GLY 274 Ca -0.23 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.41 3gxt h GLY 274 CO 0.01 0.00 -0.77 1.08 0.00 0.00 0.00 176.54 176.86 3gxt s LEU 275 N -5.00 2.74 0.85 3.11 1.43 -1.26 -4.41 118.68 116.14 3gxt s LEU 275 Ca 0.09 -0.21 -0.12 0.00 -1.03 0.00 0.00 54.13 52.86 3gxt s LEU 275 Cb 0.10 -1.56 0.10 0.00 0.03 0.00 0.00 46.19 44.87 3gxt s LEU 275 CO 0.64 0.34 1.17 -0.94 0.23 0.00 0.00 176.35 177.79 3gxt s SER 276 N -0.78 4.13 0.02 2.29 1.04 -1.26 -4.67 113.70 114.46 3gxt s SER 276 Ca 0.12 0.83 -0.04 0.00 0.48 0.00 0.00 55.95 57.33 3gxt s SER 276 Cb -0.11 -1.33 -0.02 0.00 0.10 0.00 0.00 66.02 64.67 3gxt s SER 276 CO 0.01 -2.15 1.07 -0.25 0.98 0.00 0.00 173.24 172.90 3gxt h TRP 277 N -1.22 -0.22 -0.19 5.02 -0.00 -2.00 0.95 115.95 118.29 3gxt h TRP 277 Ca -0.47 0.01 0.06 0.00 -0.00 0.00 0.00 58.89 58.48 3gxt h TRP 277 Cb 1.33 0.10 -0.01 0.00 -0.00 0.00 0.00 29.16 30.58 3gxt h TRP 277 CO 0.26 -0.07 0.39 -0.91 -0.00 0.00 0.00 178.44 178.11 3gxt h ASN 278 N -0.07 0.00 -0.03 2.65 2.35 -1.93 0.23 115.58 118.78 3gxt h ASN 278 Ca 0.01 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.53 3gxt h ASN 278 Cb 0.08 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.47 3gxt h ASN 278 CO -0.07 0.00 -0.87 1.56 -1.65 0.00 0.00 177.43 176.41 3gxt h GLN 279 N 0.00 0.65 -0.97 0.81 4.20 -1.22 -2.20 115.11 116.37 3gxt h GLN 279 Ca 0.09 -0.65 0.03 0.00 0.06 0.00 0.00 58.65 58.18 3gxt h GLN 279 Cb 0.87 0.17 -0.05 0.00 0.30 0.00 0.00 27.48 28.77 3gxt h GLN 279 CO -0.00 1.25 0.64 1.96 -0.67 0.00 0.00 178.83 182.01 3gxt h GLN 280 N 0.30 1.22 0.17 1.46 4.20 0.17 -1.37 115.11 121.26 3gxt h GLN 280 Ca -0.10 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.53 3gxt h GLN 280 Cb 1.53 -0.27 0.00 0.00 0.30 0.00 0.00 27.48 29.04 3gxt h GLN 280 CO 0.17 0.81 -0.08 -0.39 -0.67 0.00 0.00 178.83 178.67 3gxt h VAL 281 N 1.25 0.88 -0.84 -0.54 -1.51 -1.06 -1.44 116.25 113.00 3gxt h VAL 281 Ca 0.38 -0.24 0.21 0.00 -1.23 0.00 0.00 66.70 65.82 3gxt h VAL 281 Cb -0.05 1.03 -0.14 0.00 -2.13 0.00 0.00 31.29 30.00 3gxt h VAL 281 CO -0.10 0.06 0.14 0.74 -1.23 0.00 0.00 177.57 177.17 3gxt h THR 282 N -0.35 0.30 -0.45 7.19 2.02 -1.15 0.44 112.91 120.92 3gxt h THR 282 Ca -0.02 -0.05 -0.03 0.00 0.77 0.00 0.00 66.41 67.07 3gxt h THR 282 Cb 0.27 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 3gxt h THR 282 CO 0.04 0.03 0.15 -0.61 0.37 0.00 0.00 175.52 175.50 3gxt h GLN 283 N 0.16 0.70 -0.09 6.66 4.15 -0.85 -0.79 115.11 125.04 3gxt h GLN 283 Ca 0.51 -0.15 -0.01 0.00 0.77 0.00 0.00 58.65 59.77 3gxt h GLN 283 Cb 0.98 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 28.57 3gxt h GLN 283 CO -0.68 0.67 0.01 1.98 -1.93 0.00 0.00 178.83 178.88 3gxt h MET 284 N 0.59 0.15 0.47 1.69 4.05 0.80 -1.90 114.93 120.78 3gxt h MET 284 Ca 0.15 -0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 59.51 3gxt h MET 284 Cb 0.25 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.03 3gxt h MET 284 CO -0.01 0.38 -0.31 0.00 0.23 0.00 0.00 176.91 177.21 3gxt h ALA 285 N 0.76 -0.75 0.00 0.39 0.00 -0.59 -2.39 119.26 116.68 3gxt h ALA 285 Ca 0.03 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3gxt h ALA 285 Cb 0.31 0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3gxt h ALA 285 CO 0.00 -0.94 0.00 -0.07 0.00 0.00 0.00 179.25 178.24 3gxt h LEU 286 N -0.75 0.00 -0.21 0.00 4.07 -1.06 -0.25 115.31 117.12 3gxt h LEU 286 Ca -0.05 0.00 -0.22 0.00 0.08 0.00 0.00 57.88 57.69 3gxt h LEU 286 Cb 0.62 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.37 3gxt h LEU 286 CO 0.04 0.00 -0.76 -0.50 -1.08 0.00 0.00 178.44 176.14 3gxt h TRP 287 N 0.00 0.99 -0.15 1.13 -0.00 -1.10 -0.47 115.95 116.35 3gxt h TRP 287 Ca 0.00 -0.43 -0.02 0.00 -0.00 0.00 0.00 58.89 58.43 3gxt h TRP 287 Cb 0.40 -0.15 -0.01 0.00 -0.00 0.00 0.00 29.16 29.40 3gxt h TRP 287 CO 0.00 1.25 -0.00 0.00 -0.00 0.00 0.00 178.44 179.69 3gxt h ALA 288 N 0.63 0.20 -0.28 1.49 0.00 -0.67 -1.73 119.26 118.90 3gxt h ALA 288 Ca -0.05 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.73 3gxt h ALA 288 Cb 1.38 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 19.05 3gxt h ALA 288 CO 0.15 -0.09 -0.13 0.82 0.00 0.00 0.00 179.25 180.00 3gxt h ILE 289 N 0.01 0.58 0.00 0.00 1.08 -1.12 -2.00 117.51 116.05 3gxt h ILE 289 Ca 0.04 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.51 3gxt h ILE 289 Cb 0.38 0.58 0.00 0.00 -3.07 0.00 0.00 36.82 34.71 3gxt h ILE 289 CO 0.01 0.00 0.00 0.23 -0.69 0.00 0.00 178.15 177.70 3gxt n MET 290 N -5.31 0.03 -3.54 2.37 2.81 -0.19 -1.88 117.12 111.41 3gxt n MET 290 Ca -0.00 0.33 -0.19 0.00 -1.81 0.00 0.00 57.70 56.03 3gxt n MET 290 Cb 0.22 -1.56 0.07 0.00 -0.71 0.00 0.00 33.22 31.23 3gxt n MET 290 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3gxt n ALA 291 N -1.55 -2.02 -2.35 3.04 0.00 -0.75 -4.45 120.51 112.43 3gxt n ALA 291 Ca 0.03 -0.11 -0.33 0.00 0.00 0.00 0.00 53.44 53.03 3gxt n ALA 291 Cb 0.14 -2.23 -0.06 0.00 0.00 0.00 0.00 19.45 17.31 3gxt n ALA 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gxt s ALA 292 N -3.49 3.52 0.85 0.00 0.00 -0.69 -4.56 121.76 117.39 3gxt s ALA 292 Ca 0.00 -0.18 -0.13 0.00 0.00 0.00 0.00 51.96 51.66 3gxt s ALA 292 Cb -0.00 -2.52 0.06 0.00 0.00 0.00 0.00 23.12 20.66 3gxt s ALA 292 CO 0.76 0.46 0.86 -0.35 0.00 0.00 0.00 175.76 177.50 3gxt n PRO 293 N 0.03 -0.04 -3.82 0.00 -0.04 -1.26 -4.79 135.00 125.08 3gxt n PRO 293 Ca -0.00 0.05 -0.35 0.00 -0.04 0.00 0.00 63.50 63.16 3gxt n PRO 293 Cb 0.52 -2.17 -0.12 0.00 -0.04 0.00 0.00 33.50 31.70 3gxt n PRO 293 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3gxt s LEU 294 N -3.67 5.14 -0.47 1.53 1.43 0.31 -4.91 118.68 118.04 3gxt s LEU 294 Ca 0.66 -2.17 -0.07 0.00 -1.03 0.00 0.00 54.13 51.52 3gxt s LEU 294 Cb -0.27 -1.79 0.12 0.00 0.03 0.00 0.00 46.19 44.28 3gxt s LEU 294 CO 0.58 -0.49 0.32 -0.36 0.23 0.00 0.00 176.35 176.63 3gxt s PHE 295 N 0.92 3.48 0.22 0.29 2.99 -1.26 -0.91 117.98 123.72 3gxt s PHE 295 Ca 0.10 -2.07 -0.30 0.00 0.00 0.00 0.00 56.93 54.66 3gxt s PHE 295 Cb -0.22 -3.42 -0.09 0.00 0.00 0.00 0.00 43.02 39.30 3gxt s PHE 295 CO -0.05 -0.98 1.13 -1.64 -0.00 0.00 0.00 175.22 173.68 3gxt s MET 296 N 1.21 4.58 -0.38 0.44 -1.94 -0.75 -0.07 119.30 122.38 3gxt s MET 296 Ca 0.07 1.81 0.02 0.00 -1.71 0.00 0.00 55.69 55.88 3gxt s MET 296 Cb -0.25 -3.23 0.11 0.00 2.01 0.00 0.00 34.83 33.48 3gxt s MET 296 CO -0.02 0.07 0.14 0.45 -0.01 0.00 0.00 175.02 175.66 3gxt s SER 297 N -0.34 4.17 0.24 3.03 0.15 -0.20 0.41 113.70 121.15 3gxt s SER 297 Ca 0.48 -2.22 -0.22 0.00 0.70 0.00 0.00 55.95 54.70 3gxt s SER 297 Cb -0.32 -1.22 0.04 0.00 -1.71 0.00 0.00 66.02 62.81 3gxt s SER 297 CO 0.38 -0.34 0.74 0.54 1.20 0.00 0.00 173.24 175.75 3gxt s ASN 298 N 0.84 -0.30 -0.55 5.45 2.20 -1.26 -4.36 114.94 116.96 3gxt s ASN 298 Ca 0.13 -0.48 -0.27 0.00 -0.94 0.00 0.00 52.86 51.31 3gxt s ASN 298 Cb -0.21 0.67 0.03 0.00 -2.00 0.00 0.00 41.25 39.75 3gxt s ASN 298 CO -0.10 -1.22 1.10 -0.62 -2.94 0.00 0.00 177.10 173.31 3gxt s ASP 299 N -2.89 6.44 0.60 3.54 -1.08 -1.26 -4.86 116.67 117.16 3gxt s ASP 299 Ca 0.09 0.02 0.40 0.00 -0.52 0.00 0.00 52.55 52.54 3gxt s ASP 299 Cb -0.05 -2.51 2.04 0.00 -1.46 0.00 0.00 42.92 40.94 3gxt s ASP 299 CO 0.03 -1.35 2.20 -0.07 0.52 0.00 0.00 175.17 176.50 3gxt h LEU 300 N 11.48 0.00 0.00 -1.34 4.07 -1.98 -2.72 115.31 124.82 3gxt h LEU 300 Ca -0.25 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.71 3gxt h LEU 300 Cb 1.06 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.80 3gxt h LEU 300 CO 1.14 0.00 -0.13 0.54 -1.08 0.00 0.00 178.44 178.91 3gxt n ARG 301 N -2.98 0.09 -3.39 1.13 1.74 -1.26 -4.42 116.66 107.57 3gxt n ARG 301 Ca -0.02 0.06 -0.19 0.00 -0.77 0.00 0.00 57.85 56.94 3gxt n ARG 301 Cb 0.13 -1.59 -0.09 0.00 -1.02 0.00 0.00 32.46 29.88 3gxt n ARG 301 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3gxt s HIS 302 N -3.04 -0.23 -0.11 -1.55 3.76 -1.02 -5.12 115.29 107.98 3gxt s HIS 302 Ca 0.12 -0.69 -0.09 0.00 -0.15 0.00 0.00 55.06 54.26 3gxt s HIS 302 Cb 0.17 -0.50 0.03 0.00 1.11 0.00 0.00 32.58 33.39 3gxt s HIS 302 CO 0.59 -0.93 0.27 -1.50 -0.85 0.00 0.00 174.74 172.32 3gxt s ILE 303 N 1.74 -0.01 0.43 0.60 2.07 -1.26 -4.75 121.20 120.02 3gxt s ILE 303 Ca 0.14 0.03 -0.25 0.00 -1.41 0.00 0.00 60.65 59.16 3gxt s ILE 303 Cb -0.16 -0.39 -0.08 0.00 0.13 0.00 0.00 42.46 41.96 3gxt s ILE 303 CO -0.14 0.01 1.29 -0.94 -1.91 0.00 0.00 174.94 173.24 3gxt s SER 304 N 0.36 6.18 0.22 4.50 1.04 -1.26 -4.83 113.70 119.90 3gxt s SER 304 Ca -0.02 2.61 -0.19 0.00 0.48 0.00 0.00 55.95 58.83 3gxt s SER 304 Cb -0.03 -2.63 0.20 0.00 0.10 0.00 0.00 66.02 63.65 3gxt s SER 304 CO -0.01 -0.94 1.56 -0.65 0.98 0.00 0.00 173.24 174.18 3gxt h PRO 305 N 2.45 -0.03 -0.03 4.02 0.10 -2.01 -0.21 132.00 136.29 3gxt h PRO 305 Ca -0.50 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.61 3gxt h PRO 305 Cb 1.25 0.01 -0.00 0.00 0.10 0.00 0.00 31.00 32.35 3gxt h PRO 305 CO 0.62 -0.02 -0.02 1.04 0.10 0.00 0.00 178.00 179.72 3gxt n GLN 306 N -5.45 -0.01 0.13 1.05 1.13 -1.26 -1.38 117.38 111.59 3gxt n GLN 306 Ca 0.09 0.15 -0.24 0.00 -1.94 0.00 0.00 57.00 55.05 3gxt n GLN 306 Cb 0.38 -0.22 -0.16 0.00 0.11 0.00 0.00 30.24 30.35 3gxt n GLN 306 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3gxt h ALA 307 N -0.08 -0.12 0.26 -1.58 0.00 -1.64 -1.55 119.26 114.55 3gxt h ALA 307 Ca 0.01 -0.89 0.01 0.00 0.00 0.00 0.00 54.91 54.03 3gxt h ALA 307 Cb 0.01 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 3gxt h ALA 307 CO -0.03 0.72 -0.46 -0.22 0.00 0.00 0.00 179.25 179.26 3gxt h LYS 308 N 0.11 -0.75 -0.77 0.00 3.64 -0.60 0.48 116.57 118.68 3gxt h LYS 308 Ca -0.27 0.05 0.16 0.00 -1.27 0.00 0.00 60.65 59.33 3gxt h LYS 308 Cb 2.14 0.17 -0.11 0.00 -0.41 0.00 0.00 32.23 34.02 3gxt h LYS 308 CO 0.26 -0.50 0.26 0.00 -2.27 0.00 0.00 179.45 177.19 3gxt h ALA 309 N -0.44 1.07 0.42 5.00 0.00 -1.25 0.16 119.26 124.23 3gxt h ALA 309 Ca -0.01 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3gxt h ALA 309 Cb 0.75 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.70 3gxt h ALA 309 CO -0.18 -0.29 -0.20 1.25 0.00 0.00 0.00 179.25 179.83 3gxt h LEU 310 N 0.36 -0.48 -1.97 0.00 6.46 -0.53 -2.68 115.31 116.47 3gxt h LEU 310 Ca 0.44 -0.10 0.20 0.00 -0.12 0.00 0.00 57.88 58.29 3gxt h LEU 310 Cb 0.73 0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 40.76 3gxt h LEU 310 CO -0.47 -0.16 0.55 -0.07 -0.62 0.00 0.00 178.44 177.67 3gxt h LEU 311 N -0.84 0.00 -3.72 2.25 3.38 0.20 -2.38 115.31 114.20 3gxt h LEU 311 Ca -0.06 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.54 3gxt h LEU 311 Cb 0.55 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.08 3gxt h LEU 311 CO 0.10 0.00 0.34 0.00 0.09 0.00 0.00 178.44 178.97 3gxt n GLN 312 N -4.07 2.07 -2.35 1.13 6.02 0.55 -4.98 117.38 115.76 3gxt n GLN 312 Ca 0.13 -3.09 -0.43 0.00 -0.01 0.00 0.00 57.00 53.60 3gxt n GLN 312 Cb 0.80 -2.03 -0.02 0.00 1.02 0.00 0.00 30.24 30.01 3gxt n GLN 312 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3gxt s ASP 313 N -1.83 6.50 0.00 1.08 -1.08 -0.90 -4.94 116.67 115.50 3gxt s ASP 313 Ca 0.52 1.12 0.00 0.00 -0.52 0.00 0.00 52.55 53.66 3gxt s ASP 313 Cb 0.45 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 39.37 3gxt s ASP 313 CO 0.06 -1.24 0.92 0.29 0.52 0.00 0.00 175.17 175.72 3gxt n LYS 314 N 7.66 0.00 -0.30 4.34 4.01 -1.26 -1.13 118.16 131.48 3gxt n LYS 314 Ca 0.16 0.59 -0.03 0.00 -0.51 0.00 0.00 58.31 58.52 3gxt n LYS 314 Cb 0.47 -1.42 0.01 0.00 -0.51 0.00 0.00 35.03 33.57 3gxt n LYS 314 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 3gxt n ASP 315 N -2.07 -0.57 0.18 4.39 8.00 -1.26 -0.95 116.55 124.27 3gxt n ASP 315 Ca 0.00 1.34 0.02 0.00 0.71 0.00 0.00 54.79 56.87 3gxt n ASP 315 Cb 0.00 -0.27 0.36 0.00 -0.02 0.00 0.00 41.12 41.18 3gxt n ASP 315 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3gxt h VAL 316 N 0.00 1.26 0.39 2.53 2.07 -1.87 -2.25 116.25 118.39 3gxt h VAL 316 Ca 0.23 -1.26 -0.02 0.00 0.82 0.00 0.00 66.70 66.47 3gxt h VAL 316 Cb 0.42 1.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.86 3gxt h VAL 316 CO -0.75 0.36 -0.19 0.40 0.02 0.00 0.00 177.57 177.41 3gxt h ILE 317 N 0.01 0.54 -0.31 4.57 2.04 0.54 -2.54 117.51 122.37 3gxt h ILE 317 Ca -0.00 -0.53 0.03 0.00 1.00 0.00 0.00 64.86 65.36 3gxt h ILE 317 Cb 0.65 0.76 -0.04 0.00 -0.74 0.00 0.00 36.82 37.46 3gxt h ILE 317 CO 0.05 0.09 -0.18 0.00 0.00 0.00 0.00 178.15 178.10 3gxt n ALA 318 N -2.52 -0.20 -0.19 1.87 0.00 -0.43 -0.05 120.51 118.99 3gxt n ALA 318 Ca -0.10 0.26 -0.04 0.00 0.00 0.00 0.00 53.44 53.57 3gxt n ALA 318 Cb 0.28 0.01 0.06 0.00 0.00 0.00 0.00 19.45 19.81 3gxt n ALA 318 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3gxt h ILE 319 N 0.00 0.98 0.00 0.00 2.04 -1.22 0.60 117.51 119.91 3gxt h ILE 319 Ca 0.05 -0.20 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 3gxt h ILE 319 Cb 0.13 0.34 -0.00 0.00 -0.74 0.00 0.00 36.82 36.55 3gxt h ILE 319 CO -0.29 0.11 -0.01 -1.13 0.00 0.00 0.00 178.15 176.83 3gxt h ASN 320 N 0.59 0.00 -0.68 1.72 -0.73 -0.47 -3.13 115.58 112.87 3gxt h ASN 320 Ca 0.25 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.42 3gxt h ASN 320 Cb 0.13 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.72 3gxt h ASN 320 CO -0.15 0.01 0.00 0.00 -0.37 0.00 0.00 177.43 176.92 3gxt n GLN 321 N -4.25 2.65 -1.72 6.67 1.13 0.20 -4.65 117.38 117.40 3gxt n GLN 321 Ca -0.03 -2.56 -0.42 0.00 -1.94 0.00 0.00 57.00 52.05 3gxt n GLN 321 Cb 0.10 -1.55 -0.01 0.00 0.11 0.00 0.00 30.24 28.88 3gxt n GLN 321 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 3gxt n ASP 322 N 1.60 3.39 0.20 1.08 2.03 -0.29 -4.85 116.55 119.70 3gxt n ASP 322 Ca 0.24 1.17 0.07 0.00 0.52 0.00 0.00 54.79 56.79 3gxt n ASP 322 Cb 0.61 -1.54 0.40 0.00 -0.72 0.00 0.00 41.12 39.87 3gxt n ASP 322 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3gxt h PRO 323 N 3.88 0.00 -0.26 -0.67 0.11 -1.94 -2.90 132.00 130.21 3gxt h PRO 323 Ca -0.47 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.69 3gxt h PRO 323 Cb 1.25 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.31 3gxt h PRO 323 CO 0.72 0.32 -0.05 1.25 -0.21 0.00 0.00 178.00 180.03 3gxt h LEU 324 N 0.00 -0.21 -0.13 2.35 7.12 -1.94 -3.48 115.31 119.02 3gxt h LEU 324 Ca -0.00 0.07 -0.07 0.00 0.13 0.00 0.00 57.88 58.01 3gxt h LEU 324 Cb 0.80 0.15 0.01 0.00 -0.53 0.00 0.00 40.66 41.09 3gxt h LEU 324 CO 0.04 -0.07 -0.10 0.61 -0.13 0.00 0.00 178.44 178.79 3gxt n GLY 325 N -1.23 0.43 3.75 3.75 0.00 -1.10 -4.71 105.19 106.09 3gxt n GLY 325 Ca -0.01 -0.65 -0.37 0.00 0.00 0.00 0.00 46.02 44.99 3gxt n GLY 325 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gxt s LYS 326 N -4.62 4.21 0.58 1.61 -0.14 -1.26 -4.02 119.74 116.10 3gxt s LYS 326 Ca 0.04 0.31 -0.19 0.00 -1.36 0.00 0.00 55.97 54.78 3gxt s LYS 326 Cb -0.02 -3.38 -0.04 0.00 -1.68 0.00 0.00 37.83 32.71 3gxt s LYS 326 CO 0.05 0.31 1.17 -1.14 -0.76 0.00 0.00 175.35 174.98 3gxt s GLN 327 N 0.17 3.09 0.00 1.68 0.74 -1.26 -4.64 119.66 119.44 3gxt s GLN 327 Ca 0.22 1.71 0.00 0.00 0.05 0.00 0.00 55.36 57.34 3gxt s GLN 327 Cb -0.15 -1.96 0.00 0.00 1.10 0.00 0.00 33.01 32.00 3gxt s GLN 327 CO 0.09 -1.08 0.00 0.41 -0.55 0.00 0.00 175.29 174.16 3gxt n GLY 328 N 0.29 -0.85 3.84 2.59 0.00 -0.79 -4.69 105.19 105.59 3gxt n GLY 328 Ca 0.13 -1.71 -0.03 0.00 0.00 0.00 0.00 46.02 44.41 3gxt n GLY 328 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3gxt s TYR 329 N -0.76 0.02 -0.45 1.61 -0.85 -0.44 -4.90 117.35 111.57 3gxt s TYR 329 Ca 0.00 -0.36 -0.21 0.00 -0.52 0.00 0.00 57.07 55.98 3gxt s TYR 329 Cb 0.00 0.67 0.03 0.00 0.38 0.00 0.00 41.96 43.04 3gxt s TYR 329 CO 0.00 -0.82 0.68 -1.14 -1.52 0.00 0.00 175.55 172.75 3gxt s GLN 330 N -2.43 3.28 0.21 -3.49 0.74 -1.26 -1.46 119.66 115.25 3gxt s GLN 330 Ca 0.19 -0.38 0.00 0.00 0.05 0.00 0.00 55.36 55.23 3gxt s GLN 330 Cb -0.02 -3.97 0.17 0.00 1.10 0.00 0.00 33.01 30.29 3gxt s GLN 330 CO 0.04 -1.07 1.52 1.25 -0.55 0.00 0.00 175.29 176.48 3gxt h LEU 331 N 9.83 0.46 -7.13 3.68 5.85 0.17 -3.48 115.31 124.69 3gxt h LEU 331 Ca -0.26 -0.26 0.06 0.00 0.84 0.00 0.00 57.88 58.27 3gxt h LEU 331 Cb 1.09 -0.13 -0.13 0.00 0.37 0.00 0.00 40.66 41.86 3gxt h LEU 331 CO 0.92 0.94 0.36 -0.60 -0.34 0.00 0.00 178.44 179.72 3gxt s ARG 332 N -3.87 1.11 -0.04 1.25 3.52 -1.01 -5.00 118.95 114.91 3gxt s ARG 332 Ca -0.06 -0.45 -0.29 0.00 -0.13 0.00 0.00 55.73 54.80 3gxt s ARG 332 Cb 0.11 0.48 0.11 0.00 -1.56 0.00 0.00 34.95 34.09 3gxt s ARG 332 CO 0.82 -0.49 0.91 -1.14 -0.81 0.00 0.00 175.30 174.59 3gxt s GLN 333 N -3.45 0.77 0.00 5.12 -0.44 -1.26 -1.46 119.66 118.94 3gxt s GLN 333 Ca 0.04 -0.20 0.00 0.00 -2.50 0.00 0.00 55.36 52.71 3gxt s GLN 333 Cb -0.01 0.36 0.00 0.00 -1.64 0.00 0.00 33.01 31.71 3gxt s GLN 333 CO -0.08 -0.32 0.00 0.41 0.50 0.00 0.00 175.29 175.80 3gxt n GLY 334 N -0.02 3.71 2.28 2.59 0.00 -0.92 -5.01 105.19 107.81 3gxt n GLY 334 Ca -0.09 -1.66 -0.10 0.00 0.00 0.00 0.00 46.02 44.18 3gxt n GLY 334 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3gxt n ASP 335 N 0.00 -3.50 -3.66 1.61 2.03 -1.26 -2.67 116.55 109.10 3gxt n ASP 335 Ca 0.00 -0.12 -0.26 0.00 0.52 0.00 0.00 54.79 54.93 3gxt n ASP 335 Cb 0.00 -2.41 -0.04 0.00 -0.72 0.00 0.00 41.12 37.95 3gxt n ASP 335 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 3gxt n ASN 336 N -0.07 -2.13 -4.19 1.67 3.02 -1.26 -4.92 115.26 107.39 3gxt n ASN 336 Ca -0.05 -0.53 -0.18 0.00 -0.03 0.00 0.00 54.58 53.79 3gxt n ASN 336 Cb 0.55 -1.85 -0.12 0.00 -0.61 0.00 0.00 39.78 37.76 3gxt n ASN 336 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3gxt s PHE 337 N -2.82 1.25 -0.03 3.10 0.40 -1.09 0.10 117.98 118.89 3gxt s PHE 337 Ca 0.49 -0.50 -0.00 0.00 -0.60 0.00 0.00 56.93 56.31 3gxt s PHE 337 Cb -0.28 -0.69 0.03 0.00 0.51 0.00 0.00 43.02 42.59 3gxt s PHE 337 CO 0.60 0.07 0.02 -1.21 0.70 0.00 0.00 175.22 175.40 3gxt s GLU 338 N -2.06 0.17 -0.23 0.44 2.02 -0.14 -2.17 118.70 116.72 3gxt s GLU 338 Ca 0.01 0.16 -0.04 0.00 0.02 0.00 0.00 54.97 55.12 3gxt s GLU 338 Cb -0.08 -0.47 0.00 0.00 0.10 0.00 0.00 34.13 33.69 3gxt s GLU 338 CO 0.02 -0.19 -0.03 0.08 0.02 0.00 0.00 175.26 175.16 3gxt s VAL 339 N 1.30 3.33 0.20 2.63 1.01 -0.53 -1.01 120.40 127.33 3gxt s VAL 339 Ca -0.06 -0.63 0.07 0.00 0.00 0.00 0.00 61.98 61.36 3gxt s VAL 339 Cb -0.13 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.64 3gxt s VAL 339 CO -0.03 0.34 0.09 0.26 0.00 0.00 0.00 175.10 175.76 3gxt s TRP 340 N 1.45 2.99 -0.14 5.22 0.52 0.36 0.19 118.94 129.53 3gxt s TRP 340 Ca 0.04 -0.10 -0.20 0.00 0.02 0.00 0.00 56.10 55.86 3gxt s TRP 340 Cb -0.15 -1.41 0.05 0.00 -1.15 0.00 0.00 33.47 30.81 3gxt s TRP 340 CO -0.03 0.53 0.53 -1.83 0.02 0.00 0.00 176.95 176.17 3gxt s GLU 341 N -3.27 0.72 -0.05 4.98 -1.05 -0.53 -1.77 118.70 117.73 3gxt s GLU 341 Ca 0.30 0.49 0.04 0.00 -0.15 0.00 0.00 54.97 55.65 3gxt s GLU 341 Cb -0.09 0.34 -0.00 0.00 -0.44 0.00 0.00 34.13 33.94 3gxt s GLU 341 CO 0.22 -0.14 -0.17 0.50 0.95 0.00 0.00 175.26 176.62 3gxt s ARG 342 N -0.28 1.82 0.03 -4.83 3.52 -0.03 -1.33 118.95 117.86 3gxt s ARG 342 Ca -0.04 -0.59 -0.25 0.00 -0.13 0.00 0.00 55.73 54.72 3gxt s ARG 342 Cb -0.03 -1.56 -0.05 0.00 -1.56 0.00 0.00 34.95 31.75 3gxt s ARG 342 CO 0.03 0.20 0.76 -1.25 -0.81 0.00 0.00 175.30 174.23 3gxt s PRO 343 N 0.15 4.49 0.25 5.12 0.04 -1.26 -0.01 135.00 143.77 3gxt s PRO 343 Ca -0.06 1.05 0.10 0.00 0.04 0.00 0.00 61.00 62.12 3gxt s PRO 343 Cb -0.12 -3.37 -0.04 0.00 0.04 0.00 0.00 34.50 31.00 3gxt s PRO 343 CO 0.03 0.26 -0.08 -0.51 0.04 0.00 0.00 177.00 176.75 3gxt s LEU 344 N 0.02 2.98 0.78 -3.56 1.43 -0.09 -4.48 118.68 115.76 3gxt s LEU 344 Ca 0.38 -0.74 -0.14 0.00 -1.03 0.00 0.00 54.13 52.60 3gxt s LEU 344 Cb -0.20 -1.53 0.06 0.00 0.03 0.00 0.00 46.19 44.55 3gxt s LEU 344 CO 0.22 0.03 1.16 -1.54 0.23 0.00 0.00 176.35 176.45 3gxt n SER 345 N -0.65 0.99 0.00 2.29 3.41 -1.26 -3.48 113.62 114.92 3gxt n SER 345 Ca -0.07 0.62 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 3gxt n SER 345 Cb 0.59 -1.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.04 3gxt n SER 345 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gxt n GLY 346 N 0.70 0.48 2.24 5.00 0.00 -1.26 -3.50 105.19 108.85 3gxt n GLY 346 Ca 0.14 -0.93 -0.01 0.00 0.00 0.00 0.00 46.02 45.22 3gxt n GLY 346 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3gxt n LEU 347 N 0.00 0.13 -4.88 0.99 4.77 -1.26 -4.79 117.00 111.97 3gxt n LEU 347 Ca 0.00 0.03 -0.30 0.00 -0.03 0.00 0.00 56.01 55.71 3gxt n LEU 347 Cb 0.13 -1.05 -0.01 0.00 -2.33 0.00 0.00 43.42 40.15 3gxt n LEU 347 CO 0.00 -0.27 0.55 0.00 -1.33 0.00 0.00 177.39 176.34 3gxt s ALA 348 N -1.83 3.26 -0.05 -1.18 0.00 -1.23 -3.37 121.76 117.36 3gxt s ALA 348 Ca 0.00 -0.19 -0.20 0.00 0.00 0.00 0.00 51.96 51.57 3gxt s ALA 348 Cb 0.00 -2.83 0.04 0.00 0.00 0.00 0.00 23.12 20.33 3gxt s ALA 348 CO 0.00 -0.30 0.44 -1.58 0.00 0.00 0.00 175.76 174.32 3gxt s TRP 349 N -2.70 -0.37 -0.15 0.00 0.52 -0.90 -0.91 118.94 114.43 3gxt s TRP 349 Ca 0.52 0.67 -0.06 0.00 0.02 0.00 0.00 56.10 57.26 3gxt s TRP 349 Cb -0.10 0.20 -0.04 0.00 -1.15 0.00 0.00 33.47 32.38 3gxt s TRP 349 CO 0.40 -0.43 0.06 0.00 0.02 0.00 0.00 176.95 177.00 3gxt s ALA 350 N -1.04 3.44 -0.14 0.98 0.00 0.98 -1.08 121.76 124.89 3gxt s ALA 350 Ca -0.11 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.12 3gxt s ALA 350 Cb -0.03 -1.81 0.02 0.00 0.00 0.00 0.00 23.12 21.29 3gxt s ALA 350 CO 0.05 0.34 -0.17 0.08 0.00 0.00 0.00 175.76 176.06 3gxt s VAL 351 N -0.13 1.76 -0.19 0.00 1.01 -0.95 -0.85 120.40 121.05 3gxt s VAL 351 Ca 0.07 -0.77 -0.04 0.00 0.00 0.00 0.00 61.98 61.23 3gxt s VAL 351 Cb -0.12 -1.60 -0.02 0.00 0.00 0.00 0.00 36.38 34.64 3gxt s VAL 351 CO 0.01 0.49 -0.02 0.00 0.00 0.00 0.00 175.10 175.58 3gxt s ALA 352 N 1.15 2.98 -0.23 5.51 0.00 -0.73 -0.10 121.76 130.34 3gxt s ALA 352 Ca -0.01 -0.97 -0.01 0.00 0.00 0.00 0.00 51.96 50.96 3gxt s ALA 352 Cb -0.14 -1.69 0.02 0.00 0.00 0.00 0.00 23.12 21.31 3gxt s ALA 352 CO -0.06 -0.10 -0.10 -1.64 0.00 0.00 0.00 175.76 173.86 3gxt s MET 353 N 0.91 2.95 0.05 0.00 1.00 -0.20 -0.49 119.30 123.52 3gxt s MET 353 Ca 0.00 -0.89 -0.09 0.00 0.00 0.00 0.00 55.69 54.72 3gxt s MET 353 Cb -0.14 -2.88 -0.05 0.00 0.00 0.00 0.00 34.83 31.76 3gxt s MET 353 CO 0.02 -0.32 0.35 0.42 0.00 0.00 0.00 175.02 175.49 3gxt s ILE 354 N 1.33 5.17 -0.29 2.53 1.01 -0.18 -1.02 121.20 129.75 3gxt s ILE 354 Ca 0.02 0.37 0.02 0.00 0.00 0.00 0.00 60.65 61.06 3gxt s ILE 354 Cb -0.15 -3.62 0.07 0.00 0.01 0.00 0.00 42.46 38.77 3gxt s ILE 354 CO -0.07 0.33 -0.04 0.21 0.00 0.00 0.00 174.94 175.37 3gxt s ASN 355 N -1.71 4.62 0.00 3.58 2.47 -1.03 -0.97 114.94 121.89 3gxt s ASN 355 Ca 0.31 -1.59 0.26 0.00 0.42 0.00 0.00 52.86 52.26 3gxt s ASN 355 Cb -0.14 -1.60 0.70 0.00 -1.45 0.00 0.00 41.25 38.76 3gxt s ASN 355 CO 0.17 -0.26 1.54 0.54 -3.72 0.00 0.00 177.10 175.37 3gxt n ARG 356 N 4.42 1.43 -2.27 0.43 5.12 0.12 0.79 116.66 126.69 3gxt n ARG 356 Ca -0.09 -0.95 -0.43 0.00 -1.93 0.00 0.00 57.85 54.45 3gxt n ARG 356 Cb 0.42 -1.48 -0.02 0.00 -1.16 0.00 0.00 32.46 30.22 3gxt n ARG 356 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 3gxt s GLN 357 N -2.23 3.76 -1.17 5.56 0.74 -1.21 -4.82 119.66 120.30 3gxt s GLN 357 Ca 0.30 1.34 -0.06 0.00 0.05 0.00 0.00 55.36 56.98 3gxt s GLN 357 Cb 0.20 -3.99 0.25 0.00 1.10 0.00 0.00 33.01 30.57 3gxt s GLN 357 CO 0.42 -1.32 1.66 0.39 -0.55 0.00 0.00 175.29 175.89 3gxt n GLU 358 N 7.67 4.11 -3.60 1.67 1.02 -1.26 -4.15 120.64 126.09 3gxt n GLU 358 Ca 0.17 -4.11 -0.00 0.00 -0.02 0.00 0.00 57.16 53.20 3gxt n GLU 358 Cb 0.46 -2.69 -0.01 0.00 -0.02 0.00 0.00 31.44 29.18 3gxt n GLU 358 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 3gxt s ILE 359 N -1.41 0.00 0.00 -3.67 2.07 -1.26 -5.13 121.20 111.80 3gxt s ILE 359 Ca 0.35 -0.05 0.00 0.00 -1.41 0.00 0.00 60.65 59.54 3gxt s ILE 359 Cb 0.07 -1.50 0.00 0.00 0.13 0.00 0.00 42.46 41.16 3gxt s ILE 359 CO 0.06 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 173.70 3gxt n GLY 360 N -0.27 1.40 0.00 1.50 0.00 -1.26 -4.92 105.19 101.64 3gxt n GLY 360 Ca -0.03 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.45 3gxt n GLY 360 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gxt n GLY 361 N 0.00 5.26 3.66 -0.02 0.00 -1.26 -4.91 105.19 107.91 3gxt n GLY 361 Ca 0.00 -2.06 -0.63 0.00 0.00 0.00 0.00 46.02 43.33 3gxt n GLY 361 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3gxt n PRO 362 N 0.00 0.17 -4.08 1.61 -0.02 -1.26 -4.51 135.00 126.91 3gxt n PRO 362 Ca 0.00 0.06 -0.34 0.00 -2.02 0.00 0.00 63.50 61.20 3gxt n PRO 362 Cb 0.00 -1.59 -0.07 0.00 -0.02 0.00 0.00 33.50 31.83 3gxt n PRO 362 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3gxt s ARG 363 N 1.94 3.16 0.09 -0.52 0.52 -0.50 -4.87 118.95 118.77 3gxt s ARG 363 Ca 0.99 -0.40 -0.24 0.00 -0.52 0.00 0.00 55.73 55.56 3gxt s ARG 363 Cb -1.36 -2.93 -0.07 0.00 0.52 0.00 0.00 34.95 31.12 3gxt s ARG 363 CO 0.70 0.68 0.72 0.45 0.02 0.00 0.00 175.30 177.87 3gxt s SER 364 N -1.56 7.23 -0.06 0.23 0.15 -1.26 -0.87 113.70 117.56 3gxt s SER 364 Ca 0.21 1.46 -0.04 0.00 0.70 0.00 0.00 55.95 58.29 3gxt s SER 364 Cb -0.12 -2.45 0.03 0.00 -1.71 0.00 0.00 66.02 61.77 3gxt s SER 364 CO 0.12 0.15 0.15 -0.47 1.20 0.00 0.00 173.24 174.39 3gxt s TYR 365 N -0.70 -0.17 0.02 3.44 5.04 0.25 -4.96 117.35 120.27 3gxt s TYR 365 Ca 0.35 0.47 0.00 0.00 -2.44 0.00 0.00 57.07 55.46 3gxt s TYR 365 Cb -0.21 -0.03 -0.02 0.00 0.35 0.00 0.00 41.96 42.05 3gxt s TYR 365 CO 0.23 -0.14 -0.04 0.95 -1.34 0.00 0.00 175.55 175.21 3gxt s THR 366 N 0.85 0.19 0.16 4.34 -4.23 -1.26 -2.53 115.64 113.17 3gxt s THR 366 Ca -0.06 -0.82 -0.10 0.00 -1.18 0.00 0.00 61.69 59.53 3gxt s THR 366 Cb -0.08 -0.30 -0.01 0.00 1.34 0.00 0.00 72.50 73.45 3gxt s THR 366 CO -0.04 -0.41 0.30 0.27 -0.54 0.00 0.00 174.62 174.20 3gxt s ILE 367 N -1.25 0.06 -0.02 2.99 -4.36 -0.99 -4.99 121.20 112.64 3gxt s ILE 367 Ca -0.13 -1.33 -0.30 0.00 -0.26 0.00 0.00 60.65 58.63 3gxt s ILE 367 Cb -0.09 -1.80 -0.03 0.00 1.25 0.00 0.00 42.46 41.79 3gxt s ILE 367 CO -0.01 -0.30 1.06 0.00 0.24 0.00 0.00 174.94 175.94 3gxt s ALA 368 N -3.96 3.30 0.16 2.27 0.00 -1.26 0.01 121.76 122.28 3gxt s ALA 368 Ca 0.16 0.57 0.28 0.00 0.00 0.00 0.00 51.96 52.97 3gxt s ALA 368 Cb 0.03 -3.41 1.52 0.00 0.00 0.00 0.00 23.12 21.26 3gxt s ALA 368 CO -0.01 -0.43 1.84 -0.39 0.00 0.00 0.00 175.76 176.78 3gxt h VAL 369 N 4.84 0.00 -0.40 0.00 -1.51 -1.68 0.24 116.25 117.73 3gxt h VAL 369 Ca -0.38 0.00 0.12 0.00 -1.23 0.00 0.00 66.70 65.21 3gxt h VAL 369 Cb 1.19 0.62 -0.02 0.00 -2.13 0.00 0.00 31.29 30.96 3gxt h VAL 369 CO 0.80 0.00 0.39 0.00 -1.23 0.00 0.00 177.57 177.53 3gxt h ALA 370 N 1.83 2.15 -0.00 5.19 0.00 -1.77 -1.89 119.26 124.76 3gxt h ALA 370 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3gxt h ALA 370 Cb 0.14 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3gxt h ALA 370 CO 0.00 -0.59 -0.67 0.43 0.00 0.00 0.00 179.25 178.42 3gxt n SER 371 N -3.87 0.71 -4.72 0.00 7.64 0.07 -4.16 113.62 109.29 3gxt n SER 371 Ca 0.07 -0.54 -0.40 0.00 1.01 0.00 0.00 58.87 59.01 3gxt n SER 371 Cb 0.57 0.51 -0.05 0.00 -1.01 0.00 0.00 64.21 64.23 3gxt n SER 371 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3gxt s LEU 372 N -2.98 4.32 -1.00 -3.43 1.02 -0.71 -3.98 118.68 111.91 3gxt s LEU 372 Ca 0.10 1.22 -0.03 0.00 0.02 0.00 0.00 54.13 55.44 3gxt s LEU 372 Cb 0.17 -3.12 0.00 0.00 0.02 0.00 0.00 46.19 43.27 3gxt s LEU 372 CO 0.75 -0.12 0.86 0.61 0.02 0.00 0.00 176.35 178.47 3gxt n GLY 373 N 3.07 -0.21 3.93 -3.19 0.00 -1.26 -1.86 105.19 105.68 3gxt n GLY 373 Ca -0.01 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3gxt n GLY 373 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gxt n LYS 374 N -3.73 -0.12 0.00 1.61 5.02 -1.26 -1.25 118.16 118.43 3gxt n LYS 374 Ca -0.12 0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 3gxt n LYS 374 Cb 0.59 -4.52 0.00 0.00 -0.02 0.00 0.00 35.03 31.09 3gxt n LYS 374 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3gxt n GLY 375 N -1.81 0.80 0.07 0.72 0.00 -0.78 -5.01 105.19 99.18 3gxt n GLY 375 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 3gxt n GLY 375 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3gxt h VAL 376 N 0.00 0.00 -2.51 1.61 2.07 -1.29 -3.39 116.25 112.74 3gxt h VAL 376 Ca 0.00 -1.00 -0.54 0.00 0.82 0.00 0.00 66.70 65.98 3gxt h VAL 376 Cb 0.00 0.01 0.05 0.00 -1.52 0.00 0.00 31.29 29.83 3gxt h VAL 376 CO 0.00 0.00 1.04 0.00 0.02 0.00 0.00 177.57 178.63 3gxt n ALA 377 N -3.51 2.28 -0.28 1.67 0.00 -1.26 -1.34 120.51 118.08 3gxt n ALA 377 Ca -0.06 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.74 3gxt n ALA 377 Cb 0.23 -2.54 0.00 0.00 0.00 0.00 0.00 19.45 17.14 3gxt n ALA 377 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gxt s ASN 379 N -2.50 5.10 0.00 0.00 3.84 -0.45 -1.75 114.94 119.17 3gxt s ASN 379 Ca 0.00 -1.01 0.28 0.00 0.21 0.00 0.00 52.86 52.35 3gxt s ASN 379 Cb 0.00 -1.83 1.12 0.00 -0.55 0.00 0.00 41.25 39.99 3gxt s ASN 379 CO 0.00 -0.26 1.82 -0.81 -2.79 0.00 0.00 177.10 175.06 3gxt n PRO 380 N 4.79 0.21 -3.61 0.43 -0.04 -1.26 -4.69 135.00 130.82 3gxt n PRO 380 Ca -0.14 -0.05 -0.01 0.00 -0.04 0.00 0.00 63.50 63.26 3gxt n PRO 380 Cb 0.46 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.40 3gxt n PRO 380 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3gxt s ALA 381 N -2.83 -2.26 0.04 0.55 0.00 -0.72 -0.44 121.76 116.10 3gxt s ALA 381 Ca 0.19 1.56 -0.02 0.00 0.00 0.00 0.00 51.96 53.68 3gxt s ALA 381 Cb 0.19 -0.16 -0.02 0.00 0.00 0.00 0.00 23.12 23.13 3gxt s ALA 381 CO 0.55 -0.71 0.01 0.00 0.00 0.00 0.00 175.76 175.60 3gxt s PHE 383 N -2.72 3.25 -0.28 0.00 5.36 0.11 -1.03 117.98 122.67 3gxt s PHE 383 Ca -0.04 0.31 -0.06 0.00 -0.96 0.00 0.00 56.93 56.18 3gxt s PHE 383 Cb -0.01 -2.48 0.01 0.00 -0.34 0.00 0.00 43.02 40.20 3gxt s PHE 383 CO -0.05 -0.17 0.05 0.42 -1.46 0.00 0.00 175.22 174.00 3gxt s ILE 384 N 1.85 3.72 -0.07 3.12 1.01 -1.23 -0.88 121.20 128.71 3gxt s ILE 384 Ca 0.12 -0.75 0.04 0.00 0.00 0.00 0.00 60.65 60.06 3gxt s ILE 384 Cb -0.16 -2.90 -0.02 0.00 0.01 0.00 0.00 42.46 39.39 3gxt s ILE 384 CO 0.10 0.12 -0.19 0.42 0.00 0.00 0.00 174.94 175.39 3gxt s THR 385 N 1.46 2.61 0.15 2.92 -4.23 -0.84 -1.48 115.64 116.24 3gxt s THR 385 Ca 0.02 -0.86 -0.29 0.00 -1.18 0.00 0.00 61.69 59.39 3gxt s THR 385 Cb -0.17 -2.02 -0.07 0.00 1.34 0.00 0.00 72.50 71.58 3gxt s THR 385 CO 0.01 0.56 0.90 -1.58 -0.54 0.00 0.00 174.62 173.97 3gxt s GLN 386 N -0.20 4.71 -0.20 3.99 0.74 0.37 -1.09 119.66 127.98 3gxt s GLN 386 Ca -0.01 1.37 0.03 0.00 0.05 0.00 0.00 55.36 56.80 3gxt s GLN 386 Cb -0.13 -3.33 -0.14 0.00 1.10 0.00 0.00 33.01 30.51 3gxt s GLN 386 CO 0.03 0.38 -0.16 1.28 -0.55 0.00 0.00 175.29 176.27 3gxt n LEU 387 N 2.19 2.68 -3.88 3.68 4.32 0.11 -0.09 117.00 126.00 3gxt n LEU 387 Ca -0.01 -0.10 -0.11 0.00 -0.02 0.00 0.00 56.01 55.77 3gxt n LEU 387 Cb 0.49 -0.60 -0.13 0.00 -1.62 0.00 0.00 43.42 41.56 3gxt n LEU 387 CO 0.49 0.80 -0.31 -0.76 -1.22 0.00 0.00 177.39 176.39 3gxt s LEU 388 N -6.08 1.90 0.31 2.23 1.02 -1.07 -3.17 118.68 113.82 3gxt s LEU 388 Ca -0.25 -0.06 0.10 0.00 0.02 0.00 0.00 54.13 53.93 3gxt s LEU 388 Cb 0.07 0.18 0.52 0.00 0.02 0.00 0.00 46.19 46.98 3gxt s LEU 388 CO 0.49 -0.11 1.72 1.55 0.02 0.00 0.00 176.35 180.02 3gxt h PRO 389 N 5.61 0.09 -5.53 1.29 0.13 -1.89 0.24 132.00 131.94 3gxt h PRO 389 Ca -0.27 -0.05 -0.51 0.00 -0.87 0.00 0.00 66.00 64.31 3gxt h PRO 389 Cb 1.21 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.06 3gxt h PRO 389 CO 0.46 0.54 -0.82 0.14 -0.23 0.00 0.00 178.00 178.09 3gxt s VAL 390 N -4.01 1.28 -0.21 1.56 -7.23 -1.26 -5.11 120.40 105.42 3gxt s VAL 390 Ca -0.03 -0.83 -0.29 0.00 -1.81 0.00 0.00 61.98 59.02 3gxt s VAL 390 Cb 0.13 -1.09 -0.02 0.00 0.56 0.00 0.00 36.38 35.97 3gxt s VAL 390 CO 0.75 0.25 1.41 -0.75 -0.31 0.00 0.00 175.10 176.45 3gxt s LYS 391 N -0.67 4.01 -0.20 4.82 2.47 -1.19 -4.26 119.74 124.72 3gxt s LYS 391 Ca 0.05 1.58 -0.08 0.00 -1.56 0.00 0.00 55.97 55.96 3gxt s LYS 391 Cb -0.07 -3.90 0.09 0.00 -1.46 0.00 0.00 37.83 32.49 3gxt s LYS 391 CO 0.00 -1.01 0.45 0.50 0.16 0.00 0.00 175.35 175.45 3gxt s ARG 392 N 4.08 0.38 0.44 4.03 3.52 0.87 -4.99 118.95 127.29 3gxt s ARG 392 Ca 0.61 1.02 -0.26 0.00 -0.13 0.00 0.00 55.73 56.98 3gxt s ARG 392 Cb -0.22 0.28 -0.08 0.00 -1.56 0.00 0.00 34.95 33.37 3gxt s ARG 392 CO 0.23 -0.22 1.42 0.15 -0.81 0.00 0.00 175.30 176.07 3gxt s LYS 393 N 2.30 3.74 0.16 5.12 1.02 -1.26 0.14 119.74 130.96 3gxt s LYS 393 Ca -0.04 2.41 0.08 0.00 0.02 0.00 0.00 55.97 58.44 3gxt s LYS 393 Cb -0.11 -2.69 -0.04 0.00 -0.52 0.00 0.00 37.83 34.47 3gxt s LYS 393 CO -0.14 -0.77 -0.17 -0.51 -0.92 0.00 0.00 175.35 172.84 3gxt s LEU 394 N -2.65 2.45 0.00 3.17 1.43 -0.55 -4.79 118.68 117.74 3gxt s LEU 394 Ca 0.60 -0.88 0.00 0.00 -1.03 0.00 0.00 54.13 52.82 3gxt s LEU 394 Cb -0.43 -0.76 0.00 0.00 0.03 0.00 0.00 46.19 45.03 3gxt s LEU 394 CO 0.56 -0.07 0.00 0.61 0.23 0.00 0.00 176.35 177.68 3gxt n GLY 395 N 0.23 -2.34 3.91 -3.19 0.00 -1.26 -4.19 105.19 98.35 3gxt n GLY 395 Ca -0.13 -0.77 -0.27 0.00 0.00 0.00 0.00 46.02 44.85 3gxt n GLY 395 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gxt s PHE 396 N 0.00 3.23 -0.41 1.61 0.08 -1.26 -3.47 117.98 117.76 3gxt s PHE 396 Ca 0.00 0.71 0.04 0.00 0.12 0.00 0.00 56.93 57.80 3gxt s PHE 396 Cb 0.00 -2.87 0.17 0.00 -0.57 0.00 0.00 43.02 39.75 3gxt s PHE 396 CO 0.00 -0.98 0.43 0.71 -0.10 0.00 0.00 175.22 175.28 3gxt s TYR 397 N -3.10 -0.12 0.61 0.36 1.51 -0.19 -4.95 117.35 111.45 3gxt s TYR 397 Ca 0.56 -1.24 -0.16 0.00 -1.01 0.00 0.00 57.07 55.22 3gxt s TYR 397 Cb -0.11 -0.43 -0.14 0.00 -0.11 0.00 0.00 41.96 41.18 3gxt s TYR 397 CO 0.47 -0.99 -0.31 0.39 -1.11 0.00 0.00 175.55 174.00 3gxt n GLU 398 N 3.58 0.00 -0.27 -0.62 4.71 -1.26 -1.91 120.64 124.86 3gxt n GLU 398 Ca 0.18 0.00 -0.01 0.00 -0.01 0.00 0.00 57.16 57.32 3gxt n GLU 398 Cb 0.48 -0.92 0.06 0.00 -1.01 0.00 0.00 31.44 30.04 3gxt n GLU 398 CO 0.00 0.00 0.00 2.35 0.09 0.00 0.00 177.13 179.57 3gxt h TRP 399 N -0.30 -0.71 0.00 -0.32 7.01 -0.56 -2.38 115.95 118.70 3gxt h TRP 399 Ca -0.39 0.08 0.00 0.00 2.11 0.00 0.00 58.89 60.69 3gxt h TRP 399 Cb 1.29 0.43 0.00 0.00 -2.10 0.00 0.00 29.16 28.77 3gxt h TRP 399 CO 0.21 -0.37 0.00 1.79 -2.79 0.00 0.00 178.44 177.28 3gxt h THR 400 N -0.06 0.00 -3.78 2.65 1.35 -1.87 -3.33 112.91 107.86 3gxt h THR 400 Ca 0.32 -0.13 -0.49 0.00 -0.55 0.00 0.00 66.41 65.56 3gxt h THR 400 Cb 0.57 1.03 0.01 0.00 -1.73 0.00 0.00 68.15 68.04 3gxt h THR 400 CO -0.80 0.00 0.17 -0.94 -0.25 0.00 0.00 175.52 173.70 3gxt s SER 401 N -5.04 6.47 0.05 5.36 1.04 -0.90 -4.95 113.70 115.74 3gxt s SER 401 Ca -0.03 1.17 0.04 0.00 0.48 0.00 0.00 55.95 57.62 3gxt s SER 401 Cb 0.11 -2.34 -0.04 0.00 0.10 0.00 0.00 66.02 63.85 3gxt s SER 401 CO 0.41 -0.48 -0.04 -0.13 0.98 0.00 0.00 173.24 173.97 3gxt s ARG 402 N -4.10 2.51 -0.22 4.02 0.52 -1.26 -2.13 118.95 118.29 3gxt s ARG 402 Ca 0.52 -0.80 -0.13 0.00 -0.52 0.00 0.00 55.73 54.81 3gxt s ARG 402 Cb -0.10 -2.51 -0.05 0.00 0.52 0.00 0.00 34.95 32.82 3gxt s ARG 402 CO 0.35 0.57 0.25 -1.17 0.02 0.00 0.00 175.30 175.32 3gxt s LEU 403 N -1.87 4.14 0.17 2.53 2.96 0.10 -4.90 118.68 121.81 3gxt s LEU 403 Ca 0.21 0.27 -0.03 0.00 -0.22 0.00 0.00 54.13 54.36 3gxt s LEU 403 Cb -0.11 -2.26 -0.05 0.00 0.50 0.00 0.00 46.19 44.27 3gxt s LEU 403 CO 0.13 0.02 0.38 -0.60 -1.32 0.00 0.00 176.35 174.95 3gxt s ARG 404 N 1.10 3.57 -0.28 1.98 6.06 -1.26 -2.36 118.95 127.76 3gxt s ARG 404 Ca 0.12 -0.20 -0.25 0.00 -2.50 0.00 0.00 55.73 52.89 3gxt s ARG 404 Cb -0.14 -2.85 0.15 0.00 0.06 0.00 0.00 34.95 32.17 3gxt s ARG 404 CO 0.05 0.44 1.20 0.45 -2.50 0.00 0.00 175.30 174.94 3gxt s SER 405 N -2.75 -0.28 -0.46 -2.12 0.15 -1.05 -4.98 113.70 102.21 3gxt s SER 405 Ca 0.40 0.53 -0.11 0.00 0.70 0.00 0.00 55.95 57.48 3gxt s SER 405 Cb -0.12 0.54 0.10 0.00 -1.71 0.00 0.00 66.02 64.83 3gxt s SER 405 CO 0.27 -0.10 0.34 -1.00 1.20 0.00 0.00 173.24 173.94 3gxt s HIS 406 N 0.07 3.35 -0.11 3.44 3.76 -1.26 0.85 115.29 125.40 3gxt s HIS 406 Ca 0.05 -1.58 -0.10 0.00 -0.15 0.00 0.00 55.06 53.28 3gxt s HIS 406 Cb -0.05 -3.30 -0.05 0.00 1.11 0.00 0.00 32.58 30.30 3gxt s HIS 406 CO -0.10 -0.92 0.23 0.42 -0.85 0.00 0.00 174.74 173.52 3gxt s ILE 407 N 1.44 5.35 0.33 0.60 1.09 -0.05 -4.81 121.20 125.15 3gxt s ILE 407 Ca 0.04 0.41 -0.28 0.00 -1.10 0.00 0.00 60.65 59.72 3gxt s ILE 407 Cb -0.25 -3.52 -0.09 0.00 -1.06 0.00 0.00 42.46 37.53 3gxt s ILE 407 CO 0.02 0.54 1.16 0.20 -0.10 0.00 0.00 174.94 176.75 3gxt s ASN 408 N -0.55 6.95 -0.26 3.58 0.01 -1.26 -1.41 114.94 121.99 3gxt s ASN 408 Ca 0.16 2.37 -0.37 0.00 -0.71 0.00 0.00 52.86 54.30 3gxt s ASN 408 Cb -0.13 -2.63 -0.14 0.00 0.41 0.00 0.00 41.25 38.77 3gxt s ASN 408 CO 0.05 -0.38 1.92 -2.65 -1.51 0.00 0.00 177.10 174.53 3gxt n PRO 409 N 0.75 1.35 -0.89 -0.60 -0.02 -1.26 -0.29 135.00 134.05 3gxt n PRO 409 Ca 0.01 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 3gxt n PRO 409 Cb 0.45 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 3gxt n PRO 409 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3gxt n THR 410 N 5.53 0.00 -2.35 3.45 -2.24 0.24 -4.90 114.28 114.01 3gxt n THR 410 Ca 0.30 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.84 3gxt n THR 410 Cb 0.19 -0.27 0.15 0.00 -2.10 0.00 0.00 70.33 68.30 3gxt n THR 410 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gxt n GLY 411 N -1.78 -0.11 2.92 3.38 0.00 0.60 -3.91 105.19 106.29 3gxt n GLY 411 Ca 0.00 -1.92 -0.11 0.00 0.00 0.00 0.00 46.02 44.00 3gxt n GLY 411 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gxt s THR 412 N -3.30 0.04 -0.12 2.61 2.01 -1.26 -2.48 115.64 113.14 3gxt s THR 412 Ca 0.68 -0.36 -0.01 0.00 0.31 0.00 0.00 61.69 62.30 3gxt s THR 412 Cb -0.03 -0.12 -0.03 0.00 0.01 0.00 0.00 72.50 72.33 3gxt s THR 412 CO 0.46 -0.20 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.43 3gxt s VAL 413 N -0.59 3.62 -0.09 3.82 1.01 -0.19 -3.86 120.40 124.12 3gxt s VAL 413 Ca -0.06 -0.48 -0.02 0.00 0.00 0.00 0.00 61.98 61.42 3gxt s VAL 413 Cb -0.04 -2.53 0.03 0.00 0.00 0.00 0.00 36.38 33.84 3gxt s VAL 413 CO -0.00 0.54 0.00 -0.22 0.00 0.00 0.00 175.10 175.42 3gxt s LEU 414 N -0.07 0.70 0.24 3.92 2.96 0.84 -1.03 118.68 126.22 3gxt s LEU 414 Ca 0.00 -0.21 0.10 0.00 -0.22 0.00 0.00 54.13 53.80 3gxt s LEU 414 Cb -0.13 -0.48 -0.04 0.00 0.50 0.00 0.00 46.19 46.03 3gxt s LEU 414 CO 0.03 -0.21 -0.10 -0.76 -1.32 0.00 0.00 176.35 173.99 3gxt s LEU 415 N 1.95 2.92 -0.09 -0.68 1.43 0.85 0.04 118.68 125.10 3gxt s LEU 415 Ca 0.04 -0.74 0.00 0.00 -1.03 0.00 0.00 54.13 52.41 3gxt s LEU 415 Cb -0.13 -1.50 0.02 0.00 0.03 0.00 0.00 46.19 44.61 3gxt s LEU 415 CO -0.06 0.05 -0.08 -1.58 0.23 0.00 0.00 176.35 174.92 3gxt s GLN 416 N -3.29 1.39 -0.18 1.70 0.74 -0.25 -2.23 119.66 117.54 3gxt s GLN 416 Ca 0.28 -0.24 -0.04 0.00 0.05 0.00 0.00 55.36 55.41 3gxt s GLN 416 Cb -0.07 -1.39 -0.02 0.00 1.10 0.00 0.00 33.01 32.63 3gxt s GLN 416 CO 0.16 -0.18 -0.03 -0.51 -0.55 0.00 0.00 175.29 174.19 3gxt s LEU 417 N 1.39 3.21 -0.21 3.68 1.02 -0.24 -1.98 118.68 125.54 3gxt s LEU 417 Ca -0.02 -0.18 -0.02 0.00 0.02 0.00 0.00 54.13 53.93 3gxt s LEU 417 Cb -0.14 -1.79 0.01 0.00 0.02 0.00 0.00 46.19 44.29 3gxt s LEU 417 CO -0.04 0.12 -0.09 -1.61 0.02 0.00 0.00 176.35 174.74 3gxt s GLU 418 N 0.68 3.13 0.25 1.70 0.41 -0.06 -2.11 118.70 122.69 3gxt s GLU 418 Ca -0.02 -0.77 -0.16 0.00 -0.41 0.00 0.00 54.97 53.61 3gxt s GLU 418 Cb -0.14 -2.87 -0.08 0.00 -1.78 0.00 0.00 34.13 29.25 3gxt s GLU 418 CO 0.02 -0.25 0.68 1.21 -0.49 0.00 0.00 175.26 176.44 3gxt s ASN 419 N 1.39 6.87 0.00 -0.19 3.84 -1.22 0.10 114.94 125.73 3gxt s ASN 419 Ca 0.04 1.27 0.00 0.00 0.21 0.00 0.00 52.86 54.38 3gxt s ASN 419 Cb -0.14 -2.36 0.00 0.00 -0.55 0.00 0.00 41.25 38.19 3gxt s ASN 419 CO -0.06 -0.05 0.46 0.41 -2.79 0.00 0.00 177.10 175.06 3gxt n THR 420 N 0.25 0.00 0.00 -5.21 -1.04 0.29 -4.90 114.28 103.67 3gxt n THR 420 Ca -0.00 0.72 0.00 0.00 -2.04 0.00 0.00 64.05 62.73 3gxt n THR 420 Cb 0.52 -0.98 0.00 0.00 -1.82 0.00 0.00 70.33 68.05 3gxt n THR 420 CO 0.00 0.00 0.00 0.80 -0.64 0.00 0.00 175.07 175.23