#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g4a n SER 2 N 0.00 0.00 0.00 7.83 2.88 -1.26 -4.76 113.62 118.30 1g4a n SER 2 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1g4a n SER 2 Cb 0.00 -0.40 0.00 0.00 -0.75 0.00 0.00 64.21 63.06 1g4a n SER 2 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1g4a n GLU 3 N -0.84 0.00 -0.16 -1.46 -0.58 -1.26 -5.06 120.64 111.28 1g4a n GLU 3 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1g4a n GLU 3 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 1g4a n GLU 3 CO 0.00 0.00 0.00 -0.12 -0.48 0.00 0.00 177.13 176.53 1g4a n MET 4 N 6.73 0.00 -2.32 3.49 1.56 -1.26 -5.05 117.12 120.27 1g4a n MET 4 Ca 0.00 0.16 -0.29 0.00 -0.27 0.00 0.00 57.70 57.30 1g4a n MET 4 Cb 0.00 0.00 0.01 0.00 2.15 0.00 0.00 33.22 35.38 1g4a n MET 4 CO 0.00 0.00 0.00 0.95 -0.73 0.00 0.00 175.97 176.19 1g4a s THR 5 N -0.14 4.70 0.24 1.12 -4.23 -1.26 -4.76 115.64 111.32 1g4a s THR 5 Ca 0.00 0.44 -0.13 0.00 -1.18 0.00 0.00 61.69 60.83 1g4a s THR 5 Cb 0.00 -3.83 0.33 0.00 1.34 0.00 0.00 72.50 70.34 1g4a s THR 5 CO 0.00 -0.93 1.49 -2.65 -0.54 0.00 0.00 174.62 172.00 1g4a n PRO 6 N -2.49 -0.16 -0.20 3.99 -0.02 -1.26 0.86 135.00 135.73 1g4a n PRO 6 Ca 0.03 1.49 -0.01 0.00 -2.02 0.00 0.00 63.50 62.99 1g4a n PRO 6 Cb 0.55 -2.21 0.10 0.00 -0.02 0.00 0.00 33.50 31.91 1g4a n PRO 6 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1g4a h ARG 7 N 0.00 0.41 0.00 -0.52 2.47 -1.92 -1.37 114.38 113.45 1g4a h ARG 7 Ca 0.39 -0.02 -0.04 0.00 -1.26 0.00 0.00 59.98 59.05 1g4a h ARG 7 Cb 0.63 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 28.85 1g4a h ARG 7 CO -0.97 0.27 -0.19 0.93 0.56 0.00 0.00 179.97 180.57 1g4a h GLU 8 N 0.43 0.00 0.00 0.04 5.08 0.12 -2.57 114.58 117.67 1g4a h GLU 8 Ca 0.29 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.51 1g4a h GLU 8 Cb 0.34 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 1g4a h GLU 8 CO -0.28 0.19 -0.71 0.82 -1.00 0.00 0.00 179.01 178.04 1g4a h ILE 9 N 0.00 1.22 0.04 3.13 2.04 0.12 -3.01 117.51 121.04 1g4a h ILE 9 Ca -0.00 -2.71 -0.22 0.00 1.00 0.00 0.00 64.86 62.92 1g4a h ILE 9 Cb 0.67 2.59 -0.02 0.00 -0.74 0.00 0.00 36.82 39.33 1g4a h ILE 9 CO 0.03 0.69 -1.04 0.58 0.00 0.00 0.00 178.15 178.40 1g4a h VAL 10 N 0.00 1.61 0.73 1.67 2.07 -1.18 -2.71 116.25 118.44 1g4a h VAL 10 Ca -0.01 -3.15 -0.04 0.00 0.82 0.00 0.00 66.70 64.33 1g4a h VAL 10 Cb 1.54 2.80 0.01 0.00 -1.52 0.00 0.00 31.29 34.11 1g4a h VAL 10 CO 0.09 0.91 -0.35 -1.28 0.02 0.00 0.00 177.57 176.96 1g4a h SER 11 N 0.04 -0.83 0.24 0.57 0.87 -1.41 -1.06 113.55 111.97 1g4a h SER 11 Ca -0.05 0.03 0.01 0.00 -1.23 0.00 0.00 61.79 60.54 1g4a h SER 11 Cb 1.77 0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 63.91 1g4a h SER 11 CO 0.15 -0.58 -0.40 -0.08 -0.53 0.00 0.00 176.83 175.39 1g4a h GLU 12 N -0.99 -0.69 0.00 2.24 4.22 -1.62 -1.21 114.58 116.53 1g4a h GLU 12 Ca -0.10 0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.39 1g4a h GLU 12 Cb 0.75 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.16 1g4a h GLU 12 CO 0.16 -0.46 0.44 -0.07 -2.18 0.00 0.00 179.01 176.90 1g4a h LEU 13 N -0.72 0.00 0.00 1.64 3.38 -1.33 0.47 115.31 118.76 1g4a h LEU 13 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1g4a h LEU 13 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1g4a h LEU 13 CO -0.16 0.00 -0.63 0.44 0.09 0.00 0.00 178.44 178.18 1g4a h ASP 14 N 0.00 0.00 1.07 -0.43 3.45 0.07 -0.46 116.42 120.12 1g4a h ASP 14 Ca 0.00 -0.18 0.00 0.00 0.43 0.00 0.00 57.03 57.28 1g4a h ASP 14 Cb 0.88 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.65 1g4a h ASP 14 CO 0.00 0.09 0.00 0.11 -1.57 0.00 0.00 179.24 177.87 1g4a h LYS 15 N 0.00 0.00 0.00 3.56 1.79 0.08 -3.35 116.57 118.64 1g4a h LYS 15 Ca 0.00 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.32 1g4a h LYS 15 Cb 0.77 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.40 1g4a h LYS 15 CO 0.00 0.00 -1.50 0.72 -1.08 0.00 0.00 179.45 177.59 1g4a n HIS 16 N -2.53 0.00 -4.04 -1.35 8.25 -1.19 0.13 115.22 114.48 1g4a n HIS 16 Ca 0.03 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.12 1g4a n HIS 16 Cb 0.32 -0.32 -0.07 0.00 1.12 0.00 0.00 29.99 31.03 1g4a n HIS 16 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1g4a s ILE 17 N -2.17 5.10 0.14 1.59 1.09 -0.19 -4.66 121.20 122.10 1g4a s ILE 17 Ca -0.13 0.05 0.01 0.00 -1.10 0.00 0.00 60.65 59.49 1g4a s ILE 17 Cb 0.05 -3.20 -0.04 0.00 -1.06 0.00 0.00 42.46 38.21 1g4a s ILE 17 CO 0.16 0.61 0.29 0.27 -0.10 0.00 0.00 174.94 176.17 1g4a s ILE 18 N -0.92 5.31 0.00 2.92 -4.36 -1.26 -4.29 121.20 118.60 1g4a s ILE 18 Ca 0.14 -0.53 0.00 0.00 -0.26 0.00 0.00 60.65 60.00 1g4a s ILE 18 Cb -0.12 -3.71 0.00 0.00 1.25 0.00 0.00 42.46 39.88 1g4a s ILE 18 CO 0.03 -0.05 0.00 0.61 0.24 0.00 0.00 174.94 175.77 1g4a n GLY 19 N -0.36 0.44 2.98 6.27 0.00 -1.26 -4.88 105.19 108.38 1g4a n GLY 19 Ca -0.06 -0.87 -0.21 0.00 0.00 0.00 0.00 46.02 44.88 1g4a n GLY 19 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1g4a n GLN 20 N -0.53 -3.92 -0.21 1.61 1.13 -1.26 -4.82 117.38 109.39 1g4a n GLN 20 Ca 0.00 0.78 0.26 0.00 -1.94 0.00 0.00 57.00 56.10 1g4a n GLN 20 Cb 0.00 -5.56 0.66 0.00 0.11 0.00 0.00 30.24 25.45 1g4a n GLN 20 CO 0.00 0.00 0.00 0.22 -1.44 0.00 0.00 177.06 175.84 1g4a h ASP 21 N -1.00 0.13 -0.15 1.08 1.82 -1.98 -1.76 116.42 114.56 1g4a h ASP 21 Ca -0.48 0.02 0.03 0.00 -0.39 0.00 0.00 57.03 56.21 1g4a h ASP 21 Cb 1.33 -0.01 -0.03 0.00 0.68 0.00 0.00 39.33 41.31 1g4a h ASP 21 CO 0.54 0.04 -0.04 0.78 -1.61 0.00 0.00 179.24 178.96 1g4a h ASN 22 N 0.12 -0.14 -0.22 2.28 -0.26 -1.94 -0.99 115.58 114.44 1g4a h ASN 22 Ca 0.45 0.05 -0.03 0.00 -0.56 0.00 0.00 56.30 56.21 1g4a h ASN 22 Cb 1.58 0.09 -0.01 0.00 -1.06 0.00 0.00 38.32 38.92 1g4a h ASN 22 CO -0.07 -0.05 0.02 0.00 -1.06 0.00 0.00 177.43 176.28 1g4a h ALA 23 N 1.15 0.29 -0.88 -0.83 0.00 -1.66 0.07 119.26 117.40 1g4a h ALA 23 Ca 0.07 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 54.93 1g4a h ALA 23 Cb 0.11 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 17.73 1g4a h ALA 23 CO -0.16 -0.02 0.48 0.87 0.00 0.00 0.00 179.25 180.42 1g4a h LYS 24 N 0.15 0.68 0.22 0.00 1.79 -1.34 0.82 116.57 118.90 1g4a h LYS 24 Ca 0.06 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.48 1g4a h LYS 24 Cb 0.35 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 30.84 1g4a h LYS 24 CO 0.01 0.45 -0.10 0.00 -1.08 0.00 0.00 179.45 178.72 1g4a h ARG 25 N 0.70 -0.28 -0.15 3.15 3.08 -0.97 -2.45 114.38 117.48 1g4a h ARG 25 Ca 0.47 0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.56 1g4a h ARG 25 Cb 0.61 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.68 1g4a h ARG 25 CO -0.34 0.02 -0.35 0.77 -1.07 0.00 0.00 179.97 179.00 1g4a h SER 26 N -0.57 -1.13 0.10 7.04 0.02 0.14 0.30 113.55 119.44 1g4a h SER 26 Ca -0.03 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1g4a h SER 26 Cb 0.42 0.45 0.00 0.00 0.14 0.00 0.00 62.40 63.41 1g4a h SER 26 CO 0.05 -0.29 0.00 1.33 -1.14 0.00 0.00 176.83 176.78 1g4a n VAL 27 N -4.40 0.41 0.60 2.27 0.24 0.26 -1.41 118.33 116.30 1g4a n VAL 27 Ca -0.03 0.10 0.12 0.00 -2.04 0.00 0.00 64.34 62.49 1g4a n VAL 27 Cb 0.23 -0.94 0.25 0.00 -1.47 0.00 0.00 33.84 31.92 1g4a n VAL 27 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1g4a n ALA 28 N -1.15 2.72 -0.09 2.33 0.00 0.10 -2.96 120.51 121.47 1g4a n ALA 28 Ca 0.06 -0.18 -0.14 0.00 0.00 0.00 0.00 53.44 53.19 1g4a n ALA 28 Cb 0.06 -1.27 -0.06 0.00 0.00 0.00 0.00 19.45 18.18 1g4a n ALA 28 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1g4a n ILE 29 N -2.14 1.48 -0.34 0.00 2.08 -0.50 -2.86 119.36 117.07 1g4a n ILE 29 Ca 0.04 0.06 0.21 0.00 0.56 0.00 0.00 62.75 63.61 1g4a n ILE 29 Cb 0.43 -2.21 0.44 0.00 -0.75 0.00 0.00 39.64 37.55 1g4a n ILE 29 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1g4a h ALA 30 N -0.84 1.91 0.02 -1.39 0.00 -1.70 0.34 119.26 117.60 1g4a h ALA 30 Ca -0.20 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1g4a h ALA 30 Cb 0.97 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1g4a h ALA 30 CO -0.12 -0.44 -0.01 1.25 0.00 0.00 0.00 179.25 179.93 1g4a h LEU 31 N 0.46 -0.02 -0.33 0.00 5.85 -1.69 -3.31 115.31 116.26 1g4a h LEU 31 Ca 0.68 -0.46 0.07 0.00 0.84 0.00 0.00 57.88 59.01 1g4a h LEU 31 Cb 1.45 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 42.42 1g4a h LEU 31 CO -0.51 0.45 -0.11 -0.09 -0.34 0.00 0.00 178.44 177.85 1g4a h ARG 32 N -0.49 -0.03 -1.07 1.25 9.65 -0.29 -1.04 114.38 122.36 1g4a h ARG 32 Ca -0.00 0.00 0.31 0.00 -1.10 0.00 0.00 59.98 59.19 1g4a h ARG 32 Cb 0.47 0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 29.02 1g4a h ARG 32 CO 0.00 -0.02 0.76 -0.91 2.80 0.00 0.00 179.97 182.60 1g4a h ASN 33 N -0.03 0.03 0.44 -3.80 2.35 -1.01 0.18 115.58 113.73 1g4a h ASN 33 Ca 0.16 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.90 1g4a h ASN 33 Cb 0.28 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 1g4a h ASN 33 CO -0.36 0.01 -0.31 0.03 -1.65 0.00 0.00 177.43 175.15 1g4a h ARG 34 N 0.03 -0.69 -0.68 0.81 2.47 -1.27 0.47 114.38 115.52 1g4a h ARG 34 Ca 0.51 0.05 0.14 0.00 -1.26 0.00 0.00 59.98 59.42 1g4a h ARG 34 Cb 2.00 0.16 -0.13 0.00 -1.65 0.00 0.00 29.97 30.35 1g4a h ARG 34 CO -0.03 -0.46 -0.15 2.35 0.56 0.00 0.00 179.97 182.25 1g4a h TRP 35 N -0.72 -0.32 0.00 3.04 7.01 -0.81 -1.58 115.95 122.57 1g4a h TRP 35 Ca -0.06 0.06 0.00 0.00 2.11 0.00 0.00 58.89 61.00 1g4a h TRP 35 Cb 0.59 0.25 0.00 0.00 -2.10 0.00 0.00 29.16 27.89 1g4a h TRP 35 CO -0.08 -0.28 0.00 0.54 -2.79 0.00 0.00 178.44 175.83 1g4a n ARG 36 N -5.44 0.00 -0.13 2.65 1.74 0.02 -3.55 116.66 111.95 1g4a n ARG 36 Ca 0.09 0.06 0.03 0.00 -0.77 0.00 0.00 57.85 57.26 1g4a n ARG 36 Cb 0.36 -0.81 0.07 0.00 -1.02 0.00 0.00 32.46 31.05 1g4a n ARG 36 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1g4a n ARG 37 N -0.37 -0.03 0.00 5.56 0.63 0.16 0.14 116.66 122.75 1g4a n ARG 37 Ca 0.00 0.56 0.02 0.00 -0.92 0.00 0.00 57.85 57.51 1g4a n ARG 37 Cb 0.00 -0.85 0.10 0.00 0.45 0.00 0.00 32.46 32.16 1g4a n ARG 37 CO 0.00 0.00 0.00 -1.33 -2.51 0.00 0.00 177.63 173.79 1g4a n MET 38 N -4.51 0.19 -0.03 -0.14 2.81 -0.61 -1.39 117.12 113.45 1g4a n MET 38 Ca 0.07 0.00 0.06 0.00 -1.81 0.00 0.00 57.70 56.01 1g4a n MET 38 Cb 0.21 -1.29 0.06 0.00 -0.71 0.00 0.00 33.22 31.50 1g4a n MET 38 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1g4a n GLN 39 N -0.79 0.92 0.00 0.03 6.02 0.38 -5.01 117.38 118.93 1g4a n GLN 39 Ca 0.03 -1.31 0.00 0.00 -0.01 0.00 0.00 57.00 55.70 1g4a n GLN 39 Cb 0.01 -1.23 0.00 0.00 1.02 0.00 0.00 30.24 30.04 1g4a n GLN 39 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1g4a n LEU 40 N 0.64 0.00 -4.85 1.08 4.77 -0.48 -5.10 117.00 113.06 1g4a n LEU 40 Ca 0.08 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.74 1g4a n LEU 40 Cb 0.31 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.37 1g4a n LEU 40 CO 0.07 0.00 0.67 0.20 -1.33 0.00 0.00 177.39 177.00 1g4a s ASN 41 N -1.00 6.58 0.59 -1.43 -0.87 -1.26 -4.91 114.94 112.64 1g4a s ASN 41 Ca 0.00 1.52 0.29 0.00 -1.57 0.00 0.00 52.86 53.10 1g4a s ASN 41 Cb 0.00 -2.49 1.54 0.00 -0.02 0.00 0.00 41.25 40.28 1g4a s ASN 41 CO 0.00 -0.60 1.97 -0.08 -2.57 0.00 0.00 177.10 175.82 1g4a h GLU 42 N 0.84 0.00 0.00 -0.60 4.57 -1.98 -1.71 114.58 115.70 1g4a h GLU 42 Ca -0.47 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.71 1g4a h GLU 42 Cb 1.19 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.78 1g4a h GLU 42 CO 0.62 0.00 0.00 -1.91 -1.18 0.00 0.00 179.01 176.54 1g4a n GLU 43 N -3.75 0.00 0.00 1.92 4.07 -1.26 -3.15 120.64 118.47 1g4a n GLU 43 Ca 0.06 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.16 1g4a n GLU 43 Cb 0.54 -0.62 0.00 0.00 -0.06 0.00 0.00 31.44 31.30 1g4a n GLU 43 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 1g4a n LEU 44 N -0.15 0.00 0.01 4.31 4.77 -1.06 -1.54 117.00 123.34 1g4a n LEU 44 Ca 0.00 0.07 -0.12 0.00 -0.03 0.00 0.00 56.01 55.93 1g4a n LEU 44 Cb 0.00 -0.07 -0.07 0.00 -2.33 0.00 0.00 43.42 40.95 1g4a n LEU 44 CO 0.00 -0.07 0.83 -0.09 -1.33 0.00 0.00 177.39 176.73 1g4a h ARG 45 N 0.00 0.08 -0.69 3.23 2.43 -1.27 -1.73 114.38 116.43 1g4a h ARG 45 Ca 0.00 -0.01 -0.20 0.00 -0.81 0.00 0.00 59.98 58.96 1g4a h ARG 45 Cb 0.16 -0.01 -0.12 0.00 -0.42 0.00 0.00 29.97 29.57 1g4a h ARG 45 CO 0.00 0.17 0.24 0.72 -1.51 0.00 0.00 179.97 179.58 1g4a n HIS 46 N -4.99 2.28 0.00 2.20 8.25 -0.59 -4.40 115.22 117.98 1g4a n HIS 46 Ca -0.06 -1.21 0.00 0.00 -0.26 0.00 0.00 57.72 56.18 1g4a n HIS 46 Cb 0.08 -0.66 0.00 0.00 1.12 0.00 0.00 29.99 30.54 1g4a n HIS 46 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1g4a n GLU 47 N -0.25 0.00 -2.68 -0.41 4.07 -1.07 -4.92 120.64 115.38 1g4a n GLU 47 Ca 0.39 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 57.07 1g4a n GLU 47 Cb 1.34 -0.94 -0.03 0.00 -0.06 0.00 0.00 31.44 31.74 1g4a n GLU 47 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 1g4a s VAL 48 N -1.99 4.02 0.72 6.31 1.01 -0.67 -5.00 120.40 124.80 1g4a s VAL 48 Ca 0.00 0.25 -0.11 0.00 0.00 0.00 0.00 61.98 62.11 1g4a s VAL 48 Cb 0.00 -4.78 0.02 0.00 0.00 0.00 0.00 36.38 31.63 1g4a s VAL 48 CO 0.00 -1.57 1.09 0.42 0.00 0.00 0.00 175.10 175.04 1g4a s THR 49 N 4.92 3.50 0.00 3.92 -4.23 -1.26 -4.94 115.64 117.55 1g4a s THR 49 Ca 0.32 0.49 0.00 0.00 -1.18 0.00 0.00 61.69 61.32 1g4a s THR 49 Cb -0.11 -3.41 0.00 0.00 1.34 0.00 0.00 72.50 70.32 1g4a s THR 49 CO 0.16 -0.64 0.00 -2.65 -0.54 0.00 0.00 174.62 170.95 1g4a n PRO 50 N -3.10 1.74 -3.25 3.99 -0.02 -1.26 -4.99 135.00 128.11 1g4a n PRO 50 Ca 0.07 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.37 1g4a n PRO 50 Cb 0.56 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 33.98 1g4a n PRO 50 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1g4a s LYS 51 N -0.37 0.81 0.27 -0.52 -0.14 -1.26 -5.04 119.74 113.50 1g4a s LYS 51 Ca 0.00 -1.30 -0.29 0.00 -1.36 0.00 0.00 55.97 53.02 1g4a s LYS 51 Cb 0.00 -0.80 -0.09 0.00 -1.68 0.00 0.00 37.83 35.25 1g4a s LYS 51 CO 0.00 -1.28 1.02 -0.80 -0.76 0.00 0.00 175.35 173.53 1g4a s ASN 52 N 0.88 7.41 -0.02 2.83 0.01 -1.26 -4.61 114.94 120.18 1g4a s ASN 52 Ca 0.25 2.10 0.02 0.00 -0.71 0.00 0.00 52.86 54.52 1g4a s ASN 52 Cb -0.06 -2.62 -0.03 0.00 0.41 0.00 0.00 41.25 38.95 1g4a s ASN 52 CO -0.08 -0.02 -0.04 -0.63 -1.51 0.00 0.00 177.10 174.81 1g4a s ILE 53 N -1.21 3.86 -0.22 0.60 1.09 -1.06 -1.56 121.20 122.69 1g4a s ILE 53 Ca 0.44 -0.64 -0.02 0.00 -1.10 0.00 0.00 60.65 59.33 1g4a s ILE 53 Cb -0.28 -2.67 0.01 0.00 -1.06 0.00 0.00 42.46 38.45 1g4a s ILE 53 CO 0.36 0.44 -0.08 -0.22 -0.10 0.00 0.00 174.94 175.33 1g4a s LEU 54 N -1.32 2.80 -0.23 2.97 2.96 0.17 -2.67 118.68 123.36 1g4a s LEU 54 Ca 0.17 -0.58 -0.14 0.00 -0.22 0.00 0.00 54.13 53.36 1g4a s LEU 54 Cb -0.11 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 44.88 1g4a s LEU 54 CO 0.07 -0.05 0.32 -0.04 -1.32 0.00 0.00 176.35 175.33 1g4a s MET 55 N 1.39 4.11 -0.24 1.98 -1.94 -0.17 -2.20 119.30 122.23 1g4a s MET 55 Ca 0.04 0.02 -0.03 0.00 -1.71 0.00 0.00 55.69 54.01 1g4a s MET 55 Cb -0.15 -3.56 0.01 0.00 2.01 0.00 0.00 34.83 33.15 1g4a s MET 55 CO -0.06 -0.05 -0.04 0.42 -0.01 0.00 0.00 175.02 175.28 1g4a s ILE 56 N 1.36 3.13 -0.01 2.53 1.01 -0.28 -3.80 121.20 125.15 1g4a s ILE 56 Ca 0.15 -0.81 -0.30 0.00 0.00 0.00 0.00 60.65 59.68 1g4a s ILE 56 Cb -0.15 -2.53 0.11 0.00 0.01 0.00 0.00 42.46 39.90 1g4a s ILE 56 CO 0.07 0.27 1.17 -0.83 0.00 0.00 0.00 174.94 175.62 1g4a s GLY 57 N 1.39 -0.36 1.13 6.18 0.00 -1.17 -1.75 107.32 112.74 1g4a s GLY 57 Ca 0.02 0.75 -0.17 0.00 0.00 0.00 0.00 44.72 45.33 1g4a s GLY 57 CO -0.04 0.18 1.11 2.56 0.00 0.00 0.00 173.10 176.92 1g4a s PRO 58 N -2.67 -0.68 0.18 2.90 0.04 -1.26 -4.00 135.00 129.51 1g4a s PRO 58 Ca 0.12 0.09 -0.30 0.00 0.04 0.00 0.00 61.00 60.95 1g4a s PRO 58 Cb 0.02 -1.65 -0.07 0.00 0.04 0.00 0.00 34.50 32.84 1g4a s PRO 58 CO -0.03 -3.38 0.96 -0.08 0.04 0.00 0.00 177.00 174.51 1g4a s THR 59 N -3.03 4.26 0.00 1.26 -1.32 -1.26 -3.84 115.64 111.71 1g4a s THR 59 Ca 0.69 2.05 0.00 0.00 -1.21 0.00 0.00 61.69 63.23 1g4a s THR 59 Cb -0.12 -4.31 0.00 0.00 -1.51 0.00 0.00 72.50 66.56 1g4a s THR 59 CO 0.56 0.40 0.00 0.61 -2.21 0.00 0.00 174.62 173.98 1g4a n GLY 60 N 1.87 3.00 0.00 6.08 0.00 -1.24 -4.20 105.19 110.70 1g4a n GLY 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1g4a n GLY 60 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1g4a n VAL 61 N -0.30 0.00 0.00 1.61 0.24 -1.25 -4.32 118.33 114.31 1g4a n VAL 61 Ca 0.00 1.30 0.00 0.00 -2.04 0.00 0.00 64.34 63.60 1g4a n VAL 61 Cb 0.00 -1.83 0.00 0.00 -1.47 0.00 0.00 33.84 30.54 1g4a n VAL 61 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1g4a n GLY 62 N -0.98 0.00 0.18 7.63 0.00 -1.26 -4.96 105.19 105.79 1g4a n GLY 62 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 1g4a n GLY 62 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1g4a n LYS 63 N 0.00 -0.19 -0.11 1.61 5.02 -1.26 -0.01 118.16 123.22 1g4a n LYS 63 Ca 0.00 1.13 0.01 0.00 -2.02 0.00 0.00 58.31 57.43 1g4a n LYS 63 Cb 0.00 -1.68 0.30 0.00 -0.02 0.00 0.00 35.03 33.63 1g4a n LYS 63 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1g4a h THR 64 N 0.00 1.17 -0.24 -0.18 2.02 -1.98 -2.73 112.91 110.97 1g4a h THR 64 Ca 0.07 -0.43 -0.05 0.00 0.77 0.00 0.00 66.41 66.77 1g4a h THR 64 Cb 0.18 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 1g4a h THR 64 CO -0.40 0.19 -0.05 -0.08 0.37 0.00 0.00 175.52 175.55 1g4a h GLU 65 N 0.78 0.46 -0.48 6.66 4.57 -1.38 -2.09 114.58 123.10 1g4a h GLU 65 Ca 0.20 -0.17 0.09 0.00 -1.18 0.00 0.00 59.36 58.31 1g4a h GLU 65 Cb 0.02 -0.03 -0.08 0.00 -0.16 0.00 0.00 28.75 28.50 1g4a h GLU 65 CO -0.03 0.67 -0.06 0.82 -1.18 0.00 0.00 179.01 179.23 1g4a h ILE 66 N 0.20 0.57 0.00 2.32 2.04 -0.16 -1.53 117.51 120.95 1g4a h ILE 66 Ca 0.06 -0.02 -0.02 0.00 1.00 0.00 0.00 64.86 65.88 1g4a h ILE 66 Cb 0.50 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1g4a h ILE 66 CO 0.02 0.01 -0.11 0.00 0.00 0.00 0.00 178.15 178.07 1g4a h ALA 67 N 1.45 0.98 0.07 1.87 0.00 -1.45 0.42 119.26 122.60 1g4a h ALA 67 Ca 0.23 -0.10 -0.21 0.00 0.00 0.00 0.00 54.91 54.83 1g4a h ALA 67 Cb 0.36 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.15 1g4a h ALA 67 CO -0.45 0.13 -0.88 -0.09 0.00 0.00 0.00 179.25 177.97 1g4a h ARG 68 N 0.00 0.47 0.05 0.00 2.43 -0.62 -2.42 114.38 114.30 1g4a h ARG 68 Ca -0.00 -0.60 -0.23 0.00 -0.81 0.00 0.00 59.98 58.34 1g4a h ARG 68 Cb 0.76 0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.50 1g4a h ARG 68 CO 0.01 1.24 -1.05 0.00 -1.51 0.00 0.00 179.97 178.66 1g4a h ARG 69 N -0.01 0.19 0.00 0.20 2.47 -1.30 -2.24 114.38 113.69 1g4a h ARG 69 Ca -0.13 -0.28 -0.01 0.00 -1.26 0.00 0.00 59.98 58.30 1g4a h ARG 69 Cb 1.60 0.09 -0.00 0.00 -1.65 0.00 0.00 29.97 30.01 1g4a h ARG 69 CO 0.17 1.08 -0.07 1.25 0.56 0.00 0.00 179.97 182.96 1g4a h LEU 70 N 0.07 0.00 0.11 3.04 5.85 -0.96 0.12 115.31 123.54 1g4a h LEU 70 Ca -0.07 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1g4a h LEU 70 Cb 1.76 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.79 1g4a h LEU 70 CO 0.16 0.07 -0.05 0.00 -0.34 0.00 0.00 178.44 178.27 1g4a h ALA 71 N 1.93 -0.16 -0.99 1.25 0.00 -1.31 -2.40 119.26 117.58 1g4a h ALA 71 Ca -0.00 -0.03 0.34 0.00 0.00 0.00 0.00 54.91 55.22 1g4a h ALA 71 Cb 0.13 0.06 -0.18 0.00 0.00 0.00 0.00 17.79 17.80 1g4a h ALA 71 CO 0.01 -0.15 0.33 -0.22 0.00 0.00 0.00 179.25 179.22 1g4a h LYS 72 N -1.00 0.04 -0.00 0.00 3.64 -1.07 1.46 116.57 119.65 1g4a h LYS 72 Ca -0.02 -0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.20 1g4a h LYS 72 Cb 0.12 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1g4a h LYS 72 CO 0.03 0.03 -0.74 1.37 -2.27 0.00 0.00 179.45 177.86 1g4a h LEU 73 N 0.05 0.04 -0.20 5.20 8.10 -0.85 -2.56 115.31 125.07 1g4a h LEU 73 Ca 0.73 -0.03 0.00 0.00 0.11 0.00 0.00 57.88 58.69 1g4a h LEU 73 Cb 1.74 -0.01 0.00 0.00 -0.44 0.00 0.00 40.66 41.95 1g4a h LEU 73 CO -0.81 0.77 0.00 0.00 -4.11 0.00 0.00 178.44 174.29 1g4a h ALA 74 N 1.23 1.00 -0.22 0.17 0.00 0.22 -3.46 119.26 118.20 1g4a h ALA 74 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 1g4a h ALA 74 Cb 1.31 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.06 1g4a h ALA 74 CO 0.10 0.00 -0.09 -1.71 0.00 0.00 0.00 179.25 177.55 1g4a n ASN 75 N -2.52 -5.55 -4.73 0.00 5.15 0.20 -4.91 115.26 102.89 1g4a n ASN 75 Ca 0.04 0.12 -0.26 0.00 -0.60 0.00 0.00 54.58 53.88 1g4a n ASN 75 Cb 0.42 -3.47 0.10 0.00 -0.53 0.00 0.00 39.78 36.30 1g4a n ASN 75 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1g4a s ALA 76 N -1.51 3.02 0.57 5.20 0.00 -1.18 -5.00 121.76 122.86 1g4a s ALA 76 Ca 0.00 -1.08 -0.16 0.00 0.00 0.00 0.00 51.96 50.72 1g4a s ALA 76 Cb 0.00 -2.57 -0.05 0.00 0.00 0.00 0.00 23.12 20.50 1g4a s ALA 76 CO 0.00 -1.57 1.03 -2.14 0.00 0.00 0.00 175.76 173.08 1g4a s PRO 77 N -5.38 3.52 -0.00 0.00 0.02 -1.26 -4.63 135.00 127.26 1g4a s PRO 77 Ca 0.64 1.09 -0.11 0.00 0.02 0.00 0.00 61.00 62.63 1g4a s PRO 77 Cb -0.09 -2.07 0.01 0.00 0.02 0.00 0.00 34.50 32.38 1g4a s PRO 77 CO 0.47 -0.64 0.23 0.12 -0.33 0.00 0.00 177.00 176.85 1g4a s PHE 78 N -2.57 -0.07 -0.28 6.54 5.36 -1.26 -0.67 117.98 125.03 1g4a s PHE 78 Ca 0.61 0.05 -0.19 0.00 -0.96 0.00 0.00 56.93 56.45 1g4a s PHE 78 Cb -0.14 0.03 0.08 0.00 -0.34 0.00 0.00 43.02 42.65 1g4a s PHE 78 CO 0.37 -0.36 0.70 -1.50 -1.46 0.00 0.00 175.22 172.97 1g4a s ILE 79 N -1.49 -0.00 -0.19 3.12 2.07 -1.06 -4.92 121.20 118.73 1g4a s ILE 79 Ca -0.13 0.00 -0.07 0.00 -1.41 0.00 0.00 60.65 59.04 1g4a s ILE 79 Cb -0.06 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.50 1g4a s ILE 79 CO 0.02 0.00 0.05 -0.75 -1.91 0.00 0.00 174.94 172.35 1g4a s LYS 80 N 1.24 3.88 -0.06 3.50 2.20 -1.26 -1.79 119.74 127.46 1g4a s LYS 80 Ca -0.07 -0.39 0.04 0.00 -0.36 0.00 0.00 55.97 55.19 1g4a s LYS 80 Cb -0.05 -3.18 -0.00 0.00 -1.51 0.00 0.00 37.83 33.09 1g4a s LYS 80 CO -0.13 0.20 -0.19 0.08 -0.36 0.00 0.00 175.35 174.95 1g4a s VAL 81 N 0.54 1.58 -0.62 4.02 1.01 -0.95 -5.01 120.40 120.98 1g4a s VAL 81 Ca 0.02 -0.78 -0.25 0.00 0.00 0.00 0.00 61.98 60.98 1g4a s VAL 81 Cb -0.13 -1.37 0.04 0.00 0.00 0.00 0.00 36.38 34.93 1g4a s VAL 81 CO 0.01 0.45 1.05 -1.61 0.00 0.00 0.00 175.10 175.01 1g4a s GLU 82 N 0.19 3.28 0.40 2.72 0.41 -1.26 0.11 118.70 124.55 1g4a s GLU 82 Ca -0.09 -0.31 0.24 0.00 -0.41 0.00 0.00 54.97 54.40 1g4a s GLU 82 Cb -0.14 -4.11 1.32 0.00 -1.78 0.00 0.00 34.13 29.42 1g4a s GLU 82 CO 0.04 -1.72 1.62 0.00 -0.49 0.00 0.00 175.26 174.71 1g4a h ALA 83 N 9.54 2.39 0.00 5.21 0.00 -1.74 0.27 119.26 134.93 1g4a h ALA 83 Ca -0.27 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1g4a h ALA 83 Cb 1.07 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 1g4a h ALA 83 CO 1.16 -1.06 -0.04 1.79 0.00 0.00 0.00 179.25 181.10 1g4a h THR 84 N 0.12 0.13 0.59 0.00 1.35 -1.86 -3.02 112.91 110.22 1g4a h THR 84 Ca 0.81 -0.52 -0.02 0.00 -0.55 0.00 0.00 66.41 66.12 1g4a h THR 84 Cb 2.27 1.46 -0.01 0.00 -1.73 0.00 0.00 68.15 70.14 1g4a h THR 84 CO -0.56 0.04 -0.40 0.50 -0.25 0.00 0.00 175.52 174.85 1g4a h LYS 85 N 0.00 -0.91 0.00 4.72 3.64 -0.86 0.16 116.57 123.33 1g4a h LYS 85 Ca -0.00 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1g4a h LYS 85 Cb 0.45 0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.48 1g4a h LYS 85 CO 0.01 -0.61 0.00 1.19 -2.27 0.00 0.00 179.45 177.77 1g4a n PHE 86 N -5.52 0.00 0.01 1.91 3.72 -1.14 0.22 117.46 116.66 1g4a n PHE 86 Ca -0.13 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.33 1g4a n PHE 86 Cb 0.41 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.84 1g4a n PHE 86 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 1g4a n THR 87 N -0.80 0.62 -2.10 4.37 5.66 0.54 -4.80 114.28 117.77 1g4a n THR 87 Ca 0.00 -0.61 0.00 0.00 -3.05 0.00 0.00 64.05 60.39 1g4a n THR 87 Cb 0.00 -0.31 0.00 0.00 -1.55 0.00 0.00 70.33 68.47 1g4a n THR 87 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 1g4a n GLU 88 N -2.57 -0.31 0.00 1.09 -0.00 0.61 -4.59 120.64 114.86 1g4a n GLU 88 Ca -0.09 -0.16 0.00 0.00 -0.00 0.00 0.00 57.16 56.92 1g4a n GLU 88 Cb 0.72 0.28 0.00 0.00 -0.00 0.00 0.00 31.44 32.44 1g4a n GLU 88 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 1g4a n VAL 89 N -0.47 0.00 -0.40 3.84 0.24 -1.26 -1.76 118.33 118.52 1g4a n VAL 89 Ca 0.00 0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.41 1g4a n VAL 89 Cb 0.00 -0.32 0.33 0.00 -1.47 0.00 0.00 33.84 32.38 1g4a n VAL 89 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1g4a n GLY 90 N -0.14 2.50 3.28 7.63 0.00 -1.26 -4.99 105.19 112.20 1g4a n GLY 90 Ca 0.00 -0.81 -0.13 0.00 0.00 0.00 0.00 46.02 45.08 1g4a n GLY 90 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1g4a n TYR 91 N 1.54 -2.52 0.00 1.61 0.53 -0.72 -5.02 117.16 112.58 1g4a n TYR 91 Ca 0.25 0.88 0.00 0.00 -1.02 0.00 0.00 57.90 58.01 1g4a n TYR 91 Cb 0.68 -3.98 0.00 0.00 -1.03 0.00 0.00 39.34 35.01 1g4a n TYR 91 CO 0.00 0.00 0.00 0.28 -1.02 0.00 0.00 176.86 176.12 1g4a n VAL 92 N -2.93 0.00 0.00 -0.72 0.31 -1.26 -5.18 118.33 108.54 1g4a n VAL 92 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 1g4a n VAL 92 Cb 0.58 -0.02 0.00 0.00 -0.91 0.00 0.00 33.84 33.49 1g4a n VAL 92 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1g4a n GLY 93 N 4.84 2.40 0.00 2.92 0.00 -1.26 -5.15 105.19 108.94 1g4a n GLY 93 Ca 0.00 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.16 1g4a n GLY 93 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1g4a n LYS 94 N -0.75 0.00 -1.69 1.61 3.00 -1.26 -5.04 118.16 114.03 1g4a n LYS 94 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.88 1g4a n LYS 94 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.00 1g4a n LYS 94 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1g4a n GLU 95 N 0.00 2.65 -0.21 1.64 4.71 -1.26 -4.82 120.64 123.35 1g4a n GLU 95 Ca 0.00 0.96 -0.05 0.00 -0.01 0.00 0.00 57.16 58.06 1g4a n GLU 95 Cb 0.00 -2.83 0.05 0.00 -1.01 0.00 0.00 31.44 27.65 1g4a n GLU 95 CO 0.00 0.00 0.00 -0.39 0.09 0.00 0.00 177.13 176.83 1g4a h VAL 96 N 4.57 1.10 0.00 2.62 -1.51 -1.97 -0.70 116.25 120.35 1g4a h VAL 96 Ca -0.46 -0.26 0.00 0.00 -1.23 0.00 0.00 66.70 64.75 1g4a h VAL 96 Cb 1.23 0.27 0.00 0.00 -2.13 0.00 0.00 31.29 30.66 1g4a h VAL 96 CO 0.94 0.14 0.55 -0.90 -1.23 0.00 0.00 177.57 177.06 1g4a n ASP 97 N -4.71 0.14 0.24 4.19 3.85 -1.26 0.13 116.55 119.13 1g4a n ASP 97 Ca 0.05 0.37 0.09 0.00 -0.71 0.00 0.00 54.79 54.59 1g4a n ASP 97 Cb 0.06 -0.21 0.62 0.00 -1.35 0.00 0.00 41.12 40.24 1g4a n ASP 97 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.20 176.96 1g4a h SER 98 N 0.00 0.00 -0.87 -1.12 4.64 -1.47 -1.41 113.55 113.32 1g4a h SER 98 Ca 0.00 0.00 0.13 0.00 -0.47 0.00 0.00 61.79 61.45 1g4a h SER 98 Cb 1.09 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.09 1g4a h SER 98 CO 0.00 0.15 0.49 0.40 -0.87 0.00 0.00 176.83 177.00 1g4a h ILE 99 N 0.00 0.81 0.07 0.95 2.04 0.83 -1.25 117.51 120.96 1g4a h ILE 99 Ca -0.00 -0.25 -0.15 0.00 1.00 0.00 0.00 64.86 65.46 1g4a h ILE 99 Cb 0.33 0.01 0.02 0.00 -0.74 0.00 0.00 36.82 36.43 1g4a h ILE 99 CO 0.02 0.13 -0.61 0.40 0.00 0.00 0.00 178.15 178.09 1g4a h ILE 100 N 0.74 1.52 0.00 -0.67 1.08 -1.53 -2.99 117.51 115.66 1g4a h ILE 100 Ca 0.46 -2.31 -0.00 0.00 -0.39 0.00 0.00 64.86 62.61 1g4a h ILE 100 Cb 0.56 2.99 -0.00 0.00 -3.07 0.00 0.00 36.82 37.29 1g4a h ILE 100 CO -0.31 0.65 0.01 -1.14 -0.69 0.00 0.00 178.15 176.67 1g4a n ARG 101 N -4.24 0.36 0.21 2.37 0.63 -0.49 -1.82 116.66 113.67 1g4a n ARG 101 Ca -0.12 -0.02 0.00 0.00 -0.92 0.00 0.00 57.85 56.79 1g4a n ARG 101 Cb 0.71 -1.35 0.00 0.00 0.45 0.00 0.00 32.46 32.27 1g4a n ARG 101 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1g4a n ASP 102 N 1.89 -3.25 0.00 6.15 10.43 -1.09 -4.83 116.55 125.85 1g4a n ASP 102 Ca 0.01 0.78 0.00 0.00 2.57 0.00 0.00 54.79 58.15 1g4a n ASP 102 Cb 0.18 3.08 0.00 0.00 1.84 0.00 0.00 41.12 46.22 1g4a n ASP 102 CO 0.00 0.00 0.00 -0.11 -1.07 0.00 0.00 177.20 176.02 1g4a n LEU 103 N -3.40 0.00 -0.11 0.64 7.94 -0.76 0.26 117.00 121.58 1g4a n LEU 103 Ca 0.00 0.00 -0.18 0.00 -1.11 0.00 0.00 56.01 54.72 1g4a n LEU 103 Cb 0.00 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 43.86 1g4a n LEU 103 CO 0.00 0.00 -1.22 0.35 -1.11 0.00 0.00 177.39 175.41 1g4a n THR 104 N -0.64 1.22 0.12 1.96 -2.24 -1.09 -3.70 114.28 109.91 1g4a n THR 104 Ca 0.00 -0.42 -0.14 0.00 -2.27 0.00 0.00 64.05 61.23 1g4a n THR 104 Cb 0.00 -1.41 -0.08 0.00 -2.10 0.00 0.00 70.33 66.74 1g4a n THR 104 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1g4a h ASP 105 N -0.24 -0.21 -0.50 3.42 3.32 0.33 0.53 116.42 123.06 1g4a h ASP 105 Ca -0.50 -0.11 0.09 0.00 0.02 0.00 0.00 57.03 56.53 1g4a h ASP 105 Cb 1.66 0.06 -0.08 0.00 0.22 0.00 0.00 39.33 41.19 1g4a h ASP 105 CO -0.16 -0.02 0.04 0.00 -1.72 0.00 0.00 179.24 177.38 1g4a h ALA 106 N 0.39 0.51 -0.01 3.45 0.00 -1.17 1.64 119.26 124.08 1g4a h ALA 106 Ca -0.03 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1g4a h ALA 106 Cb 0.31 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1g4a h ALA 106 CO 0.04 -0.36 0.00 0.00 0.00 0.00 0.00 179.25 178.93 1g4a n ALA 107 N -2.61 2.50 0.01 0.00 0.00 -0.90 -2.29 120.51 117.22 1g4a n ALA 107 Ca 0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 53.44 53.48 1g4a n ALA 107 Cb 0.26 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 18.71 1g4a n ALA 107 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1g4a n VAL 108 N -0.35 0.49 0.06 0.00 0.31 0.41 -3.99 118.33 115.26 1g4a n VAL 108 Ca 0.00 0.19 0.02 0.00 -0.01 0.00 0.00 64.34 64.55 1g4a n VAL 108 Cb 0.07 -1.33 0.12 0.00 -0.91 0.00 0.00 33.84 31.79 1g4a n VAL 108 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1g4a n LYS 109 N -2.94 0.03 -0.06 5.55 0.00 0.46 0.74 118.16 121.94 1g4a n LYS 109 Ca -0.01 0.38 -0.02 0.00 0.00 0.00 0.00 58.31 58.66 1g4a n LYS 109 Cb 0.04 -1.87 -0.01 0.00 0.00 0.00 0.00 35.03 33.18 1g4a n LYS 109 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.40 179.38 1g4a h MET 110 N 0.00 0.00 -0.19 1.64 4.05 -1.59 -3.07 114.93 115.77 1g4a h MET 110 Ca 0.00 0.00 0.05 0.00 -0.28 0.00 0.00 59.70 59.47 1g4a h MET 110 Cb 0.55 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.34 1g4a h MET 110 CO 0.00 0.03 0.63 -0.39 0.23 0.00 0.00 176.91 177.42 1g4a h VAL 111 N -1.00 0.06 0.00 -5.77 -1.51 0.19 0.96 116.25 109.18 1g4a h VAL 111 Ca -0.00 0.00 -0.15 0.00 -1.23 0.00 0.00 66.70 65.32 1g4a h VAL 111 Cb 0.22 0.41 -0.03 0.00 -2.13 0.00 0.00 31.29 29.76 1g4a h VAL 111 CO -0.00 0.00 -1.63 0.54 -1.23 0.00 0.00 177.57 175.25 1g4a n ARG 112 N -2.96 0.64 0.07 5.19 1.74 -1.00 -3.86 116.66 116.47 1g4a n ARG 112 Ca 0.03 0.09 0.11 0.00 -0.77 0.00 0.00 57.85 57.32 1g4a n ARG 112 Cb 0.72 -1.71 0.01 0.00 -1.02 0.00 0.00 32.46 30.46 1g4a n ARG 112 CO 0.00 0.00 0.00 1.55 -1.52 0.00 0.00 177.63 177.66 1g4a n VAL 113 N -2.72 0.41 -0.48 1.55 3.14 0.26 -3.48 118.33 117.01 1g4a n VAL 113 Ca -0.11 -0.43 -0.03 0.00 -2.96 0.00 0.00 64.34 60.81 1g4a n VAL 113 Cb 0.80 -0.15 0.24 0.00 -1.06 0.00 0.00 33.84 33.68 1g4a n VAL 113 CO 0.00 0.00 0.00 1.67 -6.46 0.00 0.00 176.83 172.04 1g4a n GLN 114 N -2.38 3.21 0.00 1.45 7.27 0.25 -3.59 117.38 123.59 1g4a n GLN 114 Ca 0.01 -2.28 0.00 0.00 0.07 0.00 0.00 57.00 54.79 1g4a n GLN 114 Cb 0.51 -2.00 0.00 0.00 2.41 0.00 0.00 30.24 31.16 1g4a n GLN 114 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1g4a n ALA 115 N 0.06 0.00 0.31 1.69 0.00 -1.24 -4.33 120.51 116.99 1g4a n ALA 115 Ca 0.29 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.88 1g4a n ALA 115 Cb 1.09 0.00 0.70 0.00 0.00 0.00 0.00 19.45 21.24 1g4a n ALA 115 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1g4a h ILE 116 N 0.42 0.00 0.00 0.00 2.04 -1.61 -3.14 117.51 115.22 1g4a h ILE 116 Ca 0.00 -0.23 -0.22 0.00 1.00 0.00 0.00 64.86 65.42 1g4a h ILE 116 Cb 0.21 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 1g4a h ILE 116 CO 0.00 0.00 -1.62 -0.62 0.00 0.00 0.00 178.15 175.91 1g4a n GLU 117 N -2.64 0.40 -0.05 2.37 4.71 -1.26 -3.59 120.64 120.57 1g4a n GLU 117 Ca 0.00 0.17 0.16 0.00 -0.01 0.00 0.00 57.16 57.48 1g4a n GLU 117 Cb 0.18 -1.18 0.24 0.00 -1.01 0.00 0.00 31.44 29.67 1g4a n GLU 117 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 1g4a n LYS 118 N -3.99 0.01 -0.58 3.49 4.81 -1.19 0.75 118.16 121.47 1g4a n LYS 118 Ca -0.29 0.79 0.00 0.00 -0.87 0.00 0.00 58.31 57.94 1g4a n LYS 118 Cb 0.63 -2.00 -0.00 0.00 0.02 0.00 0.00 35.03 33.68 1g4a n LYS 118 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1g4a n ASN 119 N -2.61 0.03 0.00 3.14 4.13 -1.20 -4.96 115.26 113.80 1g4a n ASN 119 Ca 0.13 -1.71 0.00 0.00 1.68 0.00 0.00 54.58 54.68 1g4a n ASN 119 Cb 1.09 -0.13 0.00 0.00 -1.54 0.00 0.00 39.78 39.19 1g4a n ASN 119 CO 0.00 0.00 0.00 -1.14 0.28 0.00 0.00 177.26 176.40 1g4a n ARG 120 N 0.03 0.00 -0.36 3.52 0.63 0.23 -1.29 116.66 119.42 1g4a n ARG 120 Ca -0.00 0.10 -0.08 0.00 -0.92 0.00 0.00 57.85 56.95 1g4a n ARG 120 Cb 0.67 -0.93 -0.06 0.00 0.45 0.00 0.00 32.46 32.59 1g4a n ARG 120 CO 0.00 0.00 0.00 2.48 -2.51 0.00 0.00 177.63 177.60 1g4a n TYR 121 N -0.53 -0.29 -0.23 -0.14 0.18 -1.26 -0.54 117.16 114.35 1g4a n TYR 121 Ca 0.00 1.08 0.04 0.00 1.88 0.00 0.00 57.90 60.90 1g4a n TYR 121 Cb 0.00 -0.63 0.16 0.00 -0.38 0.00 0.00 39.34 38.49 1g4a n TYR 121 CO 0.00 0.00 0.00 -0.09 -2.08 0.00 0.00 176.86 174.69 1g4a h ARG 122 N 0.00 0.27 0.00 -3.48 2.43 -1.91 0.16 114.38 111.86 1g4a h ARG 122 Ca 0.18 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1g4a h ARG 122 Cb 0.39 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 1g4a h ARG 122 CO -0.83 0.18 0.00 0.00 -1.51 0.00 0.00 179.97 177.81 1g4a h ALA 123 N 1.56 1.00 0.00 2.80 0.00 0.54 -2.78 119.26 122.39 1g4a h ALA 123 Ca 0.38 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 55.18 1g4a h ALA 123 Cb 0.62 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1g4a h ALA 123 CO -0.47 0.00 -1.44 0.39 0.00 0.00 0.00 179.25 177.73 1g4a n GLU 124 N -2.46 0.63 -0.01 0.00 4.71 0.42 -3.02 120.64 120.92 1g4a n GLU 124 Ca 0.02 0.13 0.09 0.00 -0.01 0.00 0.00 57.16 57.39 1g4a n GLU 124 Cb 0.27 -1.76 0.51 0.00 -1.01 0.00 0.00 31.44 29.45 1g4a n GLU 124 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 177.13 176.37 1g4a n GLU 125 N -2.75 1.07 -0.07 3.49 0.28 -0.31 -2.08 120.64 120.28 1g4a n GLU 125 Ca -0.08 -0.10 -0.06 0.00 -0.16 0.00 0.00 57.16 56.76 1g4a n GLU 125 Cb 0.75 -1.29 -0.12 0.00 1.43 0.00 0.00 31.44 32.22 1g4a n GLU 125 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1g4a n LEU 126 N -0.68 0.00 0.00 -1.84 4.77 -1.20 -3.63 117.00 114.42 1g4a n LEU 126 Ca 0.14 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.21 1g4a n LEU 126 Cb 0.09 0.33 0.55 0.00 -2.33 0.00 0.00 43.42 42.06 1g4a n LEU 126 CO 0.10 0.33 0.78 0.00 -1.33 0.00 0.00 177.39 177.27 1g4a n ALA 127 N -2.50 2.16 -0.07 -1.18 0.00 -0.88 -2.02 120.51 116.02 1g4a n ALA 127 Ca -0.22 -0.11 -0.07 0.00 0.00 0.00 0.00 53.44 53.04 1g4a n ALA 127 Cb 0.93 -1.31 -0.02 0.00 0.00 0.00 0.00 19.45 19.04 1g4a n ALA 127 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1g4a n GLU 128 N -1.08 0.42 0.04 0.00 2.13 -1.21 -4.06 120.64 116.87 1g4a n GLU 128 Ca 0.13 0.17 0.20 0.00 0.66 0.00 0.00 57.16 58.32 1g4a n GLU 128 Cb 0.09 -1.23 0.55 0.00 0.27 0.00 0.00 31.44 31.12 1g4a n GLU 128 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1g4a h GLU 129 N -0.79 0.00 0.00 5.31 4.39 -1.59 0.68 114.58 122.58 1g4a h GLU 129 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1g4a h GLU 129 Cb 0.79 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.44 1g4a h GLU 129 CO 0.00 0.00 -0.99 -2.13 -1.16 0.00 0.00 179.01 174.73 1g4a n ARG 130 N -3.27 0.26 0.00 2.33 0.63 -0.86 -4.69 116.66 111.06 1g4a n ARG 130 Ca 0.11 -0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.04 1g4a n ARG 130 Cb 0.98 -1.58 0.00 0.00 0.45 0.00 0.00 32.46 32.30 1g4a n ARG 130 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 1g4a n ILE 131 N -1.91 0.00 -0.18 5.15 5.41 0.23 -5.10 119.36 122.96 1g4a n ILE 131 Ca 0.02 0.40 0.00 0.00 1.00 0.00 0.00 62.75 64.17 1g4a n ILE 131 Cb 0.42 -1.39 0.00 0.00 -0.71 0.00 0.00 39.64 37.96 1g4a n ILE 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1g4a n LEU 132 N -2.38 4.50 0.00 1.39 -0.00 -0.88 -5.10 117.00 114.52 1g4a n LEU 132 Ca 0.00 -2.06 0.00 0.00 -0.00 0.00 0.00 56.01 53.95 1g4a n LEU 132 Cb 0.00 -0.93 0.00 0.00 -0.00 0.00 0.00 43.42 42.49 1g4a n LEU 132 CO 0.00 0.84 0.00 -0.67 -0.00 0.00 0.00 177.39 177.56 1g4a n ASP 220 N 1.34 1.57 0.00 1.45 -0.08 -1.26 -4.66 116.55 114.90 1g4a n ASP 220 Ca 0.00 -0.14 0.00 0.00 -1.51 0.00 0.00 54.79 53.14 1g4a n ASP 220 Cb 0.46 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.92 1g4a n ASP 220 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1g4a n ALA 221 N -3.00 0.00 -0.06 -1.67 0.00 -1.26 -5.03 120.51 109.49 1g4a n ALA 221 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1g4a n ALA 221 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.30 1g4a n ALA 221 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1g4a n MET 222 N 0.00 0.67 -0.12 0.00 2.81 -1.26 -4.19 117.12 115.04 1g4a n MET 222 Ca 0.00 0.15 0.08 0.00 -1.81 0.00 0.00 57.70 56.12 1g4a n MET 222 Cb 0.00 -1.65 0.28 0.00 -0.71 0.00 0.00 33.22 31.14 1g4a n MET 222 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1g4a n LYS 223 N -2.98 1.71 -0.12 0.03 3.00 -1.26 -4.04 118.16 114.51 1g4a n LYS 223 Ca -0.28 -1.09 -0.25 0.00 -0.00 0.00 0.00 58.31 56.70 1g4a n LYS 223 Cb 1.09 -1.33 -0.11 0.00 0.00 0.00 0.00 35.03 34.68 1g4a n LYS 223 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1g4a n LEU 224 N 0.34 1.90 0.19 3.14 4.32 -1.26 -4.10 117.00 121.53 1g4a n LEU 224 Ca 0.14 0.39 0.08 0.00 -0.02 0.00 0.00 56.01 56.59 1g4a n LEU 224 Cb 0.29 -0.91 0.41 0.00 -1.62 0.00 0.00 43.42 41.59 1g4a n LEU 224 CO 0.10 0.39 0.85 0.25 -1.22 0.00 0.00 177.39 177.76 1g4a h LEU 225 N -1.00 0.00 0.20 2.23 5.85 -1.76 1.02 115.31 121.85 1g4a h LEU 225 Ca -0.48 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.23 1g4a h LEU 225 Cb 1.42 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.45 1g4a h LEU 225 CO -0.29 0.00 -0.09 0.40 -0.34 0.00 0.00 178.44 178.12 1g4a h ILE 226 N 0.00 0.00 -0.56 4.05 1.08 -1.76 -3.16 117.51 117.15 1g4a h ILE 226 Ca 0.00 -0.13 0.09 0.00 -0.39 0.00 0.00 64.86 64.43 1g4a h ILE 226 Cb 0.66 0.00 -0.07 0.00 -3.07 0.00 0.00 36.82 34.34 1g4a h ILE 226 CO 0.00 0.00 0.16 -0.33 -0.69 0.00 0.00 178.15 177.29 1g4a h GLU 227 N -0.40 0.30 0.00 2.37 4.39 0.60 -0.26 114.58 121.59 1g4a h GLU 227 Ca -0.03 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1g4a h GLU 227 Cb 0.20 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1g4a h GLU 227 CO 0.04 0.20 0.09 -1.91 -1.16 0.00 0.00 179.01 176.27 1g4a n GLU 228 N -5.06 0.00 0.00 2.33 2.13 0.18 0.30 120.64 120.51 1g4a n GLU 228 Ca 0.07 0.15 0.13 0.00 0.66 0.00 0.00 57.16 58.18 1g4a n GLU 228 Cb 0.27 -1.59 0.35 0.00 0.27 0.00 0.00 31.44 30.74 1g4a n GLU 228 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87 1g4a n GLU 229 N -1.06 1.36 0.25 5.31 0.00 -0.11 -3.88 120.64 122.51 1g4a n GLU 229 Ca 0.00 -0.90 0.08 0.00 0.00 0.00 0.00 57.16 56.34 1g4a n GLU 229 Cb 0.09 -1.48 0.61 0.00 0.00 0.00 0.00 31.44 30.66 1g4a n GLU 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1g4a h ALA 230 N 4.07 1.73 0.03 -1.84 0.00 0.43 -0.35 119.26 123.34 1g4a h ALA 230 Ca 0.00 -0.09 -0.27 0.00 0.00 0.00 0.00 54.91 54.55 1g4a h ALA 230 Cb 0.60 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1g4a h ALA 230 CO 0.00 0.13 -1.47 0.00 0.00 0.00 0.00 179.25 177.91 1g4a n ALA 231 N -2.47 0.81 -0.33 0.00 0.00 -1.25 -3.99 120.51 113.28 1g4a n ALA 231 Ca -0.03 -0.52 0.24 0.00 0.00 0.00 0.00 53.44 53.13 1g4a n ALA 231 Cb 0.18 -0.59 0.45 0.00 0.00 0.00 0.00 19.45 19.49 1g4a n ALA 231 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1g4a h LYS 232 N -0.73 0.04 -6.14 0.00 3.64 -1.62 -3.35 116.57 108.40 1g4a h LYS 232 Ca -0.37 -0.00 -0.58 0.00 -1.27 0.00 0.00 60.65 58.43 1g4a h LYS 232 Cb 1.49 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 33.25 1g4a h LYS 232 CO -0.14 0.02 0.82 -0.51 -2.27 0.00 0.00 179.45 177.37 1g4a s LEU 233 N -10.71 4.07 0.06 5.20 1.43 -0.17 -4.98 118.68 113.58 1g4a s LEU 233 Ca -0.11 1.33 -0.37 0.00 -1.03 0.00 0.00 54.13 53.95 1g4a s LEU 233 Cb 0.31 -3.54 -0.17 0.00 0.03 0.00 0.00 46.19 42.83 1g4a s LEU 233 CO 0.78 -0.73 1.36 1.33 0.23 0.00 0.00 176.35 179.32 1g4a n VAL 234 N 5.45 0.02 0.00 -1.59 0.24 -1.26 -4.89 118.33 116.31 1g4a n VAL 234 Ca 0.12 -0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.42 1g4a n VAL 234 Cb 0.46 -0.81 0.00 0.00 -1.47 0.00 0.00 33.84 32.02 1g4a n VAL 234 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1g4a n ASN 235 N 2.67 0.41 -4.74 -1.34 0.23 -1.26 -4.90 115.26 106.33 1g4a n ASN 235 Ca 0.19 -0.05 -0.32 0.00 -0.53 0.00 0.00 54.58 53.88 1g4a n ASN 235 Cb 0.18 0.17 0.10 0.00 -2.08 0.00 0.00 39.78 38.15 1g4a n ASN 235 CO 0.00 0.00 0.00 -2.84 -0.93 0.00 0.00 177.26 173.49 1g4a s PRO 236 N -0.25 2.08 0.12 -0.53 0.02 -1.26 -3.38 135.00 131.80 1g4a s PRO 236 Ca 0.00 1.39 0.00 0.00 0.02 0.00 0.00 61.00 62.41 1g4a s PRO 236 Cb 0.00 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.66 1g4a s PRO 236 CO 0.00 -1.81 0.00 0.39 -0.33 0.00 0.00 177.00 175.25 1g4a n GLU 237 N -3.32 0.00 -0.01 5.54 -0.58 -1.26 -3.95 120.64 117.05 1g4a n GLU 237 Ca 0.11 0.00 -0.02 0.00 -0.42 0.00 0.00 57.16 56.83 1g4a n GLU 237 Cb 0.52 0.00 -0.01 0.00 -0.57 0.00 0.00 31.44 31.38 1g4a n GLU 237 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1g4a h GLU 238 N 0.00 -0.06 -2.28 3.49 3.07 -1.98 1.16 114.58 117.99 1g4a h GLU 238 Ca 0.00 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.77 1g4a h GLU 238 Cb 0.00 0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 27.89 1g4a h GLU 238 CO 0.00 -0.04 -0.06 -0.11 -1.40 0.00 0.00 179.01 177.39 1g4a n LEU 239 N -3.05 3.43 0.00 1.33 0.00 -1.22 -2.17 117.00 115.33 1g4a n LEU 239 Ca -0.01 -2.11 0.00 0.00 0.00 0.00 0.00 56.01 53.89 1g4a n LEU 239 Cb 0.05 -0.89 0.00 0.00 0.00 0.00 0.00 43.42 42.58 1g4a n LEU 239 CO 0.00 0.88 0.00 0.29 0.00 0.00 0.00 177.39 178.56 1g4a n LYS 240 N 2.47 0.00 0.04 1.96 4.76 0.13 -4.84 118.16 122.68 1g4a n LYS 240 Ca 0.22 0.00 -0.16 0.00 -2.87 0.00 0.00 58.31 55.51 1g4a n LYS 240 Cb 0.54 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.68 1g4a n LYS 240 CO 0.00 0.00 0.00 -0.56 -1.37 0.00 0.00 177.40 175.47 1g4a h GLN 241 N 0.00 0.57 0.00 1.97 -0.00 0.12 -2.79 115.11 114.99 1g4a h GLN 241 Ca 0.00 -0.56 0.00 0.00 -0.00 0.00 0.00 58.65 58.09 1g4a h GLN 241 Cb 0.00 0.15 0.00 0.00 -0.00 0.00 0.00 27.48 27.63 1g4a h GLN 241 CO 0.00 1.18 0.00 -3.47 -0.00 0.00 0.00 178.83 176.54 1g4a n ASP 242 N -3.83 0.00 0.08 0.06 2.03 -0.92 -2.39 116.55 111.58 1g4a n ASP 242 Ca -0.08 0.14 -0.18 0.00 0.52 0.00 0.00 54.79 55.19 1g4a n ASP 242 Cb 0.82 -0.29 -0.10 0.00 -0.72 0.00 0.00 41.12 40.83 1g4a n ASP 242 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1g4a h ALA 243 N 2.50 0.14 0.02 -1.67 0.00 -1.57 -3.27 119.26 115.41 1g4a h ALA 243 Ca 0.00 -0.77 -0.21 0.00 0.00 0.00 0.00 54.91 53.93 1g4a h ALA 243 Cb 0.10 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1g4a h ALA 243 CO 0.00 0.78 -0.93 -0.84 0.00 0.00 0.00 179.25 178.26 1g4a h ILE 244 N 0.23 1.52 0.00 0.00 3.07 -1.62 -2.83 117.51 117.89 1g4a h ILE 244 Ca -0.14 -2.77 0.00 0.00 1.55 0.00 0.00 64.86 63.50 1g4a h ILE 244 Cb 1.81 2.57 0.00 0.00 -0.27 0.00 0.00 36.82 40.92 1g4a h ILE 244 CO 0.21 0.80 0.11 0.47 -1.05 0.00 0.00 178.15 178.69 1g4a n ASP 245 N -3.61 0.23 -0.06 2.16 9.92 -1.23 0.17 116.55 124.13 1g4a n ASP 245 Ca -0.04 0.54 -0.03 0.00 -0.53 0.00 0.00 54.79 54.73 1g4a n ASP 245 Cb 0.85 -0.54 -0.01 0.00 -0.64 0.00 0.00 41.12 40.77 1g4a n ASP 245 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1g4a h ALA 246 N 1.64 0.00 0.00 2.24 0.00 -1.58 0.92 119.26 122.47 1g4a h ALA 246 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1g4a h ALA 246 Cb 0.23 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1g4a h ALA 246 CO 0.00 0.33 0.00 0.28 0.00 0.00 0.00 179.25 179.86 1g4a n VAL 247 N -4.64 0.73 0.00 0.00 0.31 0.26 -2.14 118.33 112.84 1g4a n VAL 247 Ca -0.05 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 1g4a n VAL 247 Cb 0.17 -0.87 0.00 0.00 -0.91 0.00 0.00 33.84 32.23 1g4a n VAL 247 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1g4a n GLU 248 N 0.70 0.00 0.00 5.55 2.13 0.46 -4.72 120.64 124.76 1g4a n GLU 248 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1g4a n GLU 248 Cb 0.35 -0.28 0.00 0.00 0.27 0.00 0.00 31.44 31.78 1g4a n GLU 248 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1g4a n GLN 249 N -1.78 0.00 -2.76 5.31 7.27 0.32 -4.61 117.38 121.14 1g4a n GLN 249 Ca 0.00 0.35 -0.10 0.00 0.07 0.00 0.00 57.00 57.32 1g4a n GLN 249 Cb 0.00 -1.25 0.08 0.00 2.41 0.00 0.00 30.24 31.48 1g4a n GLN 249 CO 0.00 0.00 0.00 -2.39 0.07 0.00 0.00 177.06 174.74 1g4a n HIS 250 N -1.40 -2.71 -2.86 3.69 1.44 -1.21 -4.84 115.22 107.34 1g4a n HIS 250 Ca 0.00 -2.22 -0.37 0.00 -2.01 0.00 0.00 57.72 53.12 1g4a n HIS 250 Cb 0.00 1.50 -0.06 0.00 0.12 0.00 0.00 29.99 31.55 1g4a n HIS 250 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 1g4a s GLY 251 N -1.36 2.81 -0.19 -1.39 0.00 -1.21 -4.58 107.32 101.39 1g4a s GLY 251 Ca 0.24 0.45 -0.06 0.00 0.00 0.00 0.00 44.72 45.35 1g4a s GLY 251 CO -0.06 0.90 0.02 -0.42 0.00 0.00 0.00 173.10 173.54 1g4a s ILE 252 N -1.51 4.28 -0.34 0.90 1.09 0.15 -3.08 121.20 122.69 1g4a s ILE 252 Ca 0.47 -0.21 -0.10 0.00 -1.10 0.00 0.00 60.65 59.71 1g4a s ILE 252 Cb -0.19 -2.93 0.01 0.00 -1.06 0.00 0.00 42.46 38.29 1g4a s ILE 252 CO 0.24 0.44 0.16 -0.69 -0.10 0.00 0.00 174.94 174.99 1g4a s VAL 253 N 0.75 4.43 -0.53 2.92 1.01 -0.69 -2.57 120.40 125.71 1g4a s VAL 253 Ca 0.01 -0.71 -0.13 0.00 0.00 0.00 0.00 61.98 61.15 1g4a s VAL 253 Cb -0.14 -3.38 0.13 0.00 0.00 0.00 0.00 36.38 32.99 1g4a s VAL 253 CO 0.02 -0.09 0.46 0.12 0.00 0.00 0.00 175.10 175.61 1g4a s PHE 254 N 1.55 3.35 0.48 5.22 2.19 -0.74 -0.81 117.98 129.23 1g4a s PHE 254 Ca 0.03 -1.58 -0.21 0.00 0.33 0.00 0.00 56.93 55.50 1g4a s PHE 254 Cb -0.18 -3.68 -0.07 0.00 -1.31 0.00 0.00 43.02 37.77 1g4a s PHE 254 CO 0.06 -1.01 1.11 0.42 1.83 0.00 0.00 175.22 177.63 1g4a s ILE 255 N 1.39 3.37 -0.08 3.12 -1.09 0.94 -2.23 121.20 126.61 1g4a s ILE 255 Ca 0.05 0.93 0.03 0.00 -2.23 0.00 0.00 60.65 59.43 1g4a s ILE 255 Cb -0.27 -3.42 0.01 0.00 -1.58 0.00 0.00 42.46 37.19 1g4a s ILE 255 CO 0.01 -0.11 -0.17 -0.62 -1.23 0.00 0.00 174.94 172.82 1g4a s ASP 256 N -1.66 2.28 -0.84 3.58 3.68 0.12 -2.42 116.67 121.40 1g4a s ASP 256 Ca 0.67 -0.40 -0.04 0.00 2.13 0.00 0.00 52.55 54.91 1g4a s ASP 256 Cb -0.23 -1.02 0.00 0.00 -1.45 0.00 0.00 42.92 40.22 1g4a s ASP 256 CO 0.28 0.09 0.72 -0.62 0.13 0.00 0.00 175.17 175.77 1g4a n GLU 257 N 3.66 -4.85 -0.28 4.34 1.02 -1.26 -2.17 120.64 121.10 1g4a n GLU 257 Ca -0.21 0.54 0.09 0.00 -0.02 0.00 0.00 57.16 57.56 1g4a n GLU 257 Cb 0.52 -4.69 0.23 0.00 -0.02 0.00 0.00 31.44 27.49 1g4a n GLU 257 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 1g4a h ILE 258 N -1.57 0.38 -0.79 -3.67 6.09 -1.85 -3.38 117.51 112.72 1g4a h ILE 258 Ca -0.37 -0.07 -0.03 0.00 -1.37 0.00 0.00 64.86 63.02 1g4a h ILE 258 Cb 1.23 0.15 0.02 0.00 0.47 0.00 0.00 36.82 38.69 1g4a h ILE 258 CO 0.35 0.04 -0.01 -0.90 -3.07 0.00 0.00 178.15 174.55 1g4a n ASP 259 N -5.23 -1.45 0.00 2.19 5.75 -1.26 -2.16 116.55 114.39 1g4a n ASP 259 Ca 0.18 -0.07 0.00 0.00 -0.01 0.00 0.00 54.79 54.89 1g4a n ASP 259 Cb 0.58 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.57 1g4a n ASP 259 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1g4a n LYS 260 N -1.32 0.00 0.00 0.11 4.76 -1.26 -4.20 118.16 116.24 1g4a n LYS 260 Ca 0.01 0.00 0.08 0.00 -2.87 0.00 0.00 58.31 55.53 1g4a n LYS 260 Cb 0.04 -3.75 0.05 0.00 -1.84 0.00 0.00 35.03 29.54 1g4a n LYS 260 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 1g4a n ILE 261 N -1.50 0.00 -2.27 -0.18 2.08 -0.92 -4.95 119.36 111.61 1g4a n ILE 261 Ca 0.00 -0.46 -0.26 0.00 0.56 0.00 0.00 62.75 62.59 1g4a n ILE 261 Cb 0.00 1.30 0.13 0.00 -0.75 0.00 0.00 39.64 40.32 1g4a n ILE 261 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1g4a n LYS 263 N -3.17 0.51 -1.50 0.00 0.00 -1.26 -4.82 118.16 107.92 1g4a n LYS 263 Ca 0.13 0.22 -0.26 0.00 0.00 0.00 0.00 58.31 58.40 1g4a n LYS 263 Cb 0.60 -1.36 -0.10 0.00 0.00 0.00 0.00 35.03 34.18 1g4a n LYS 263 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 1g4a n ARG 264 N -4.15 0.64 0.00 1.64 3.00 -1.26 -4.42 116.66 112.11 1g4a n ARG 264 Ca -0.41 -1.82 0.00 0.00 -0.00 0.00 0.00 57.85 55.62 1g4a n ARG 264 Cb 0.77 -3.55 0.00 0.00 0.00 0.00 0.00 32.46 29.67 1g4a n ARG 264 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1g4a n GLY 265 N 5.70 0.00 5.00 5.14 0.00 -1.26 -4.40 105.19 115.37 1g4a n GLY 265 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.46 1g4a n GLY 265 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1g4a n GLU 266 N -1.22 0.00 -0.32 1.61 0.00 -1.26 -3.67 120.64 115.78 1g4a n GLU 266 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 57.16 57.35 1g4a n GLU 266 Cb 0.00 0.00 0.45 0.00 0.00 0.00 0.00 31.44 31.90 1g4a n GLU 266 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1g4a h SER 267 N 0.00 0.54 -2.09 4.31 4.64 -1.97 -2.84 113.55 116.14 1g4a h SER 267 Ca 0.00 0.09 -0.57 0.00 -0.47 0.00 0.00 61.79 60.84 1g4a h SER 267 Cb 0.00 -0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 61.70 1g4a h SER 267 CO 0.00 0.14 -1.07 -1.20 -0.87 0.00 0.00 176.83 173.84 1g4a n SER 268 N -4.67 -0.05 -3.71 4.97 7.64 -1.24 -5.02 113.62 111.53 1g4a n SER 268 Ca 0.24 -2.60 -0.28 0.00 1.01 0.00 0.00 58.87 57.25 1g4a n SER 268 Cb 0.77 -0.59 -0.11 0.00 -1.01 0.00 0.00 64.21 63.27 1g4a n SER 268 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1g4a n GLY 269 N 1.83 3.90 0.01 0.23 0.00 -1.08 -4.39 105.19 105.70 1g4a n GLY 269 Ca 0.24 -2.43 -0.00 0.00 0.00 0.00 0.00 46.02 43.83 1g4a n GLY 269 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1g4a h PRO 270 N 5.10 0.00 0.00 1.61 0.11 -1.90 -3.45 132.00 133.47 1g4a h PRO 270 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1g4a h PRO 270 Cb 0.76 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.87 1g4a h PRO 270 CO 0.69 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.23 1g4a n ASP 271 N -2.32 2.87 0.00 -2.05 10.43 -1.26 -5.05 116.55 119.17 1g4a n ASP 271 Ca -0.00 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.36 1g4a n ASP 271 Cb 0.00 0.00 0.00 0.00 1.84 0.00 0.00 41.12 42.96 1g4a n ASP 271 CO 0.00 0.00 0.00 1.33 -1.07 0.00 0.00 177.20 177.46 1g4a n VAL 272 N 0.00 0.06 0.25 2.53 0.24 -1.26 -4.61 118.33 115.54 1g4a n VAL 272 Ca 0.00 -0.16 0.08 0.00 -2.04 0.00 0.00 64.34 62.22 1g4a n VAL 272 Cb 0.00 1.53 0.62 0.00 -1.47 0.00 0.00 33.84 34.52 1g4a n VAL 272 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1g4a h SER 273 N 0.00 0.00 0.19 -1.34 4.64 -1.99 0.26 113.55 115.31 1g4a h SER 273 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1g4a h SER 273 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1g4a h SER 273 CO 0.00 0.12 -0.09 0.03 -0.87 0.00 0.00 176.83 176.02 1g4a h ARG 274 N 0.00 -0.25 0.00 4.77 3.08 -1.91 -1.38 114.38 118.70 1g4a h ARG 274 Ca -0.00 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1g4a h ARG 274 Cb 0.23 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.34 1g4a h ARG 274 CO 0.02 -0.02 0.00 -1.91 -1.07 0.00 0.00 179.97 176.98 1g4a n GLU 275 N -5.12 0.09 -0.08 0.04 2.13 0.61 -0.63 120.64 117.67 1g4a n GLU 275 Ca -0.09 0.58 -0.11 0.00 0.66 0.00 0.00 57.16 58.19 1g4a n GLU 275 Cb 0.19 -1.80 -0.04 0.00 0.27 0.00 0.00 31.44 30.06 1g4a n GLU 275 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1g4a h GLY 276 N 0.16 0.50 0.25 8.31 0.00 0.48 -1.32 103.07 111.45 1g4a h GLY 276 Ca 0.00 -0.39 0.24 0.00 0.00 0.00 0.00 47.33 47.18 1g4a h GLY 276 CO 0.00 0.36 0.62 -2.08 0.00 0.00 0.00 176.54 175.43 1g4a h VAL 277 N 0.22 0.60 -0.28 4.60 2.07 -0.87 1.09 116.25 123.67 1g4a h VAL 277 Ca 0.07 -0.06 -0.06 0.00 0.82 0.00 0.00 66.70 67.47 1g4a h VAL 277 Cb 0.47 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 1g4a h VAL 277 CO 0.02 0.03 -0.05 1.56 0.02 0.00 0.00 177.57 179.15 1g4a h GLN 278 N 0.16 0.53 0.00 1.57 4.20 -1.31 -2.82 115.11 117.45 1g4a h GLN 278 Ca 0.44 -0.19 0.00 0.00 0.06 0.00 0.00 58.65 58.96 1g4a h GLN 278 Cb 1.48 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.23 1g4a h GLN 278 CO -0.08 0.72 0.00 0.54 -0.67 0.00 0.00 178.83 179.34 1g4a n ARG 279 N -4.53 0.05 0.00 1.46 1.74 0.29 -2.91 116.66 112.77 1g4a n ARG 279 Ca -0.03 0.08 0.13 0.00 -0.77 0.00 0.00 57.85 57.26 1g4a n ARG 279 Cb 0.30 -1.57 0.41 0.00 -1.02 0.00 0.00 32.46 30.57 1g4a n ARG 279 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1g4a n ASP 280 N -1.66 0.81 -0.11 0.55 10.43 0.30 -3.90 116.55 122.95 1g4a n ASP 280 Ca 0.06 -0.69 -0.15 0.00 2.57 0.00 0.00 54.79 56.58 1g4a n ASP 280 Cb 0.34 0.10 -0.13 0.00 1.84 0.00 0.00 41.12 43.26 1g4a n ASP 280 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 1g4a n LEU 281 N -0.87 1.94 -0.20 0.64 4.77 -1.14 -4.53 117.00 117.59 1g4a n LEU 281 Ca 0.11 -0.07 0.08 0.00 -0.03 0.00 0.00 56.01 56.11 1g4a n LEU 281 Cb 0.33 -0.43 0.16 0.00 -2.33 0.00 0.00 43.42 41.16 1g4a n LEU 281 CO 0.27 0.78 0.46 0.18 -1.33 0.00 0.00 177.39 177.74 1g4a n LEU 282 N -3.10 -0.08 -0.05 2.23 4.77 -1.22 0.11 117.00 119.66 1g4a n LEU 282 Ca -0.41 0.99 -0.08 0.00 -0.03 0.00 0.00 56.01 56.48 1g4a n LEU 282 Cb 1.05 -0.35 -0.02 0.00 -2.33 0.00 0.00 43.42 41.77 1g4a n LEU 282 CO 0.33 -1.00 0.70 -0.65 -1.33 0.00 0.00 177.39 175.44 1g4a h PRO 283 N 0.00 -0.24 -0.12 3.23 0.11 -1.83 0.20 132.00 133.35 1g4a h PRO 283 Ca 0.35 0.02 0.02 0.00 0.11 0.00 0.00 66.00 66.49 1g4a h PRO 283 Cb 0.70 0.05 -0.04 0.00 0.11 0.00 0.00 31.00 31.82 1g4a h PRO 283 CO -0.55 -0.16 -0.34 -0.07 -0.21 0.00 0.00 178.00 176.67 1g4a h LEU 284 N -0.25 -1.08 -1.16 2.35 3.38 0.41 -0.62 115.31 118.35 1g4a h LEU 284 Ca 0.14 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1g4a h LEU 284 Cb 0.46 0.43 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1g4a h LEU 284 CO -0.39 -0.28 0.00 1.33 0.09 0.00 0.00 178.44 179.18 1g4a n VAL 285 N -4.32 0.32 -0.28 1.22 0.24 -0.99 -3.18 118.33 111.34 1g4a n VAL 285 Ca -0.03 -0.17 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 1g4a n VAL 285 Cb 0.23 -0.38 0.00 0.00 -1.47 0.00 0.00 33.84 32.21 1g4a n VAL 285 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 1g4a n GLU 286 N 0.03 1.10 0.00 7.34 2.13 0.66 -4.85 120.64 127.05 1g4a n GLU 286 Ca 0.03 -0.06 0.00 0.00 0.66 0.00 0.00 57.16 57.80 1g4a n GLU 286 Cb 0.32 -0.34 0.00 0.00 0.27 0.00 0.00 31.44 31.69 1g4a n GLU 286 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1g4a n GLY 287 N 0.17 1.96 3.66 8.31 0.00 -0.27 -4.98 105.19 114.04 1g4a n GLY 287 Ca 0.00 -1.20 0.01 0.00 0.00 0.00 0.00 46.02 44.83 1g4a n GLY 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g4a s THR 289 N -2.53 1.74 0.11 0.00 -4.23 -1.26 -0.35 115.64 109.12 1g4a s THR 289 Ca 0.15 -1.14 0.09 0.00 -1.18 0.00 0.00 61.69 59.61 1g4a s THR 289 Cb 0.04 -1.49 -0.04 0.00 1.34 0.00 0.00 72.50 72.35 1g4a s THR 289 CO -0.03 0.32 -0.24 -0.69 -0.54 0.00 0.00 174.62 173.44 1g4a s VAL 290 N -0.71 1.95 -0.29 2.29 1.01 -0.81 -5.00 120.40 118.84 1g4a s VAL 290 Ca 0.08 -1.61 -0.11 0.00 0.00 0.00 0.00 61.98 60.34 1g4a s VAL 290 Cb -0.09 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 1g4a s VAL 290 CO 0.01 0.03 0.20 -0.55 0.00 0.00 0.00 175.10 174.79 1g4a s SER 291 N -1.91 6.00 0.18 3.32 0.15 -1.26 -2.70 113.70 117.49 1g4a s SER 291 Ca 0.10 -0.10 0.01 0.00 0.70 0.00 0.00 55.95 56.65 1g4a s SER 291 Cb -0.10 -2.12 -0.05 0.00 -1.71 0.00 0.00 66.02 62.05 1g4a s SER 291 CO 0.05 -0.09 0.04 0.28 1.20 0.00 0.00 173.24 174.72 1g4a s THR 292 N 1.75 0.51 0.00 6.45 -1.32 -1.22 -5.02 115.64 116.80 1g4a s THR 292 Ca 0.07 -1.97 0.00 0.00 -1.21 0.00 0.00 61.69 58.58 1g4a s THR 292 Cb -0.16 -2.23 0.00 0.00 -1.51 0.00 0.00 72.50 68.60 1g4a s THR 292 CO 0.11 -0.36 0.70 1.17 -2.21 0.00 0.00 174.62 174.04 1g4a n LYS 293 N -0.26 0.00 0.00 7.08 4.81 -1.26 -0.76 118.16 127.77 1g4a n LYS 293 Ca -0.05 0.70 0.06 0.00 -0.87 0.00 0.00 58.31 58.16 1g4a n LYS 293 Cb 0.64 -1.11 0.33 0.00 0.02 0.00 0.00 35.03 34.92 1g4a n LYS 293 CO 0.00 0.00 0.00 1.58 1.17 0.00 0.00 177.40 180.15 1g4a n HIS 294 N -2.34 0.00 0.00 5.64 -0.00 -1.26 -4.90 115.22 112.35 1g4a n HIS 294 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1g4a n HIS 294 Cb 0.00 -0.18 0.00 0.00 -0.12 0.00 0.00 29.99 29.69 1g4a n HIS 294 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1g4a n GLY 295 N -0.24 3.68 3.63 1.57 0.00 0.06 -4.82 105.19 109.07 1g4a n GLY 295 Ca 0.07 -1.50 -0.43 0.00 0.00 0.00 0.00 46.02 44.16 1g4a n GLY 295 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1g4a s MET 296 N -2.46 3.96 0.23 1.61 -1.94 -1.26 -3.40 119.30 116.04 1g4a s MET 296 Ca 0.00 1.32 0.07 0.00 -1.71 0.00 0.00 55.69 55.37 1g4a s MET 296 Cb 0.00 -3.86 -0.04 0.00 2.01 0.00 0.00 34.83 32.94 1g4a s MET 296 CO 0.00 -1.06 0.15 0.08 -0.01 0.00 0.00 175.02 174.18 1g4a s VAL 297 N 4.26 4.30 -0.09 -6.03 1.01 -1.10 -4.96 120.40 117.79 1g4a s VAL 297 Ca 0.56 -1.41 0.02 0.00 0.00 0.00 0.00 61.98 61.16 1g4a s VAL 297 Cb -0.18 -3.29 0.01 0.00 0.00 0.00 0.00 36.38 32.93 1g4a s VAL 297 CO 0.22 -0.30 -0.16 -0.75 0.00 0.00 0.00 175.10 174.12 1g4a s LYS 298 N -3.64 2.16 -0.10 2.72 2.20 -1.26 -1.92 119.74 119.90 1g4a s LYS 298 Ca 0.32 -0.56 0.09 0.00 -0.36 0.00 0.00 55.97 55.46 1g4a s LYS 298 Cb -0.08 -1.77 0.43 0.00 -1.51 0.00 0.00 37.83 34.90 1g4a s LYS 298 CO 0.24 0.02 1.22 0.25 -0.36 0.00 0.00 175.35 176.72 1g4a n THR 299 N 3.92 1.27 0.43 3.43 -2.24 0.53 -4.08 114.28 117.54 1g4a n THR 299 Ca -0.20 -0.71 0.12 0.00 -2.27 0.00 0.00 64.05 60.98 1g4a n THR 299 Cb 0.52 -0.20 0.48 0.00 -2.10 0.00 0.00 70.33 69.03 1g4a n THR 299 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1g4a n ASP 300 N 0.44 0.74 -0.16 3.42 4.64 -1.26 -3.18 116.55 121.20 1g4a n ASP 300 Ca 0.15 0.66 0.05 0.00 -1.38 0.00 0.00 54.79 54.27 1g4a n ASP 300 Cb 0.66 -0.83 0.07 0.00 -1.04 0.00 0.00 41.12 39.99 1g4a n ASP 300 CO 0.00 0.00 0.00 1.41 -0.82 0.00 0.00 177.20 177.79 1g4a n HIS 301 N -2.29 0.00 -2.98 -0.67 8.25 -1.26 -4.43 115.22 111.84 1g4a n HIS 301 Ca 0.03 -0.59 -0.35 0.00 -0.26 0.00 0.00 57.72 56.55 1g4a n HIS 301 Cb 0.27 -0.10 -0.06 0.00 1.12 0.00 0.00 29.99 31.22 1g4a n HIS 301 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1g4a s ILE 302 N -1.61 4.48 -0.04 1.59 -1.09 -1.19 -4.60 121.20 118.74 1g4a s ILE 302 Ca 0.16 1.37 -0.12 0.00 -2.23 0.00 0.00 60.65 59.83 1g4a s ILE 302 Cb 0.14 -3.79 -0.05 0.00 -1.58 0.00 0.00 42.46 37.17 1g4a s ILE 302 CO 0.02 0.01 0.33 -0.22 -1.23 0.00 0.00 174.94 173.84 1g4a s LEU 303 N -2.43 4.45 -0.09 2.97 2.96 -1.18 -4.75 118.68 120.61 1g4a s LEU 303 Ca 0.51 0.82 0.03 0.00 -0.22 0.00 0.00 54.13 55.26 1g4a s LEU 303 Cb -0.14 -2.43 0.01 0.00 0.50 0.00 0.00 46.19 44.12 1g4a s LEU 303 CO 0.19 0.35 -0.18 -0.36 -1.32 0.00 0.00 176.35 175.03 1g4a s PHE 304 N -1.06 2.05 -0.27 5.38 0.40 -1.26 -1.71 117.98 121.51 1g4a s PHE 304 Ca 0.21 -0.83 0.02 0.00 -0.60 0.00 0.00 56.93 55.73 1g4a s PHE 304 Cb -0.15 -1.42 0.07 0.00 0.51 0.00 0.00 43.02 42.03 1g4a s PHE 304 CO 0.11 -0.37 -0.04 0.42 0.70 0.00 0.00 175.22 176.03 1g4a s ILE 305 N 0.55 1.83 0.17 0.64 1.01 0.01 -2.55 121.20 122.86 1g4a s ILE 305 Ca -0.16 -1.57 0.06 0.00 0.00 0.00 0.00 60.65 58.98 1g4a s ILE 305 Cb -0.17 -2.11 -0.04 0.00 0.01 0.00 0.00 42.46 40.16 1g4a s ILE 305 CO 0.05 -0.21 0.10 0.00 0.00 0.00 0.00 174.94 174.89 1g4a s ALA 306 N 1.22 3.47 0.00 9.38 0.00 -1.09 -0.04 121.76 134.70 1g4a s ALA 306 Ca -0.03 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 50.68 1g4a s ALA 306 Cb -0.19 -1.26 0.00 0.00 0.00 0.00 0.00 23.12 21.67 1g4a s ALA 306 CO -0.07 0.50 0.00 0.43 0.00 0.00 0.00 175.76 176.62 1g4a n SER 307 N -0.27 0.00 0.00 0.00 7.64 -1.02 -1.00 113.62 118.98 1g4a n SER 307 Ca -0.09 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.79 1g4a n SER 307 Cb 0.55 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.75 1g4a n SER 307 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1g4a n GLY 308 N 3.33 1.79 0.12 0.23 0.00 -1.25 -3.60 105.19 105.82 1g4a n GLY 308 Ca 0.00 -1.86 -0.18 0.00 0.00 0.00 0.00 46.02 43.98 1g4a n GLY 308 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g4a n ALA 309 N 1.63 1.05 -2.18 4.61 0.00 -1.26 -3.07 120.51 121.30 1g4a n ALA 309 Ca 0.00 -0.64 -0.10 0.00 0.00 0.00 0.00 53.44 52.70 1g4a n ALA 309 Cb 0.00 -0.72 -0.01 0.00 0.00 0.00 0.00 19.45 18.72 1g4a n ALA 309 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1g4a n PHE 310 N -3.36 -0.48 0.04 0.00 3.72 -1.26 -4.10 117.46 112.02 1g4a n PHE 310 Ca -0.28 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.01 1g4a n PHE 310 Cb 1.05 -2.45 -0.05 0.00 -0.94 0.00 0.00 39.48 37.09 1g4a n PHE 310 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1g4a h GLN 311 N 0.00 -0.17 0.00 -1.08 3.07 -1.95 -3.33 115.11 111.65 1g4a h GLN 311 Ca -0.24 0.01 -0.20 0.00 0.09 0.00 0.00 58.65 58.31 1g4a h GLN 311 Cb 1.17 0.04 -0.03 0.00 0.08 0.00 0.00 27.48 28.74 1g4a h GLN 311 CO 0.29 -0.11 -1.14 0.82 0.09 0.00 0.00 178.83 178.77 1g4a h ILE 312 N -0.17 0.85 -2.07 1.86 1.08 -1.94 -3.49 117.51 113.63 1g4a h ILE 312 Ca 0.05 -2.07 -0.51 0.00 -0.39 0.00 0.00 64.86 61.94 1g4a h ILE 312 Cb 0.24 2.04 -0.05 0.00 -3.07 0.00 0.00 36.82 35.98 1g4a h ILE 312 CO -0.13 0.29 -0.52 0.00 -0.69 0.00 0.00 178.15 177.10 1g4a s ALA 313 N -2.39 3.59 0.22 1.87 0.00 -1.25 -4.82 121.76 118.97 1g4a s ALA 313 Ca -0.27 -1.55 0.07 0.00 0.00 0.00 0.00 51.96 50.20 1g4a s ALA 313 Cb 0.05 -1.14 -0.04 0.00 0.00 0.00 0.00 23.12 21.99 1g4a s ALA 313 CO 0.56 0.17 0.13 0.15 0.00 0.00 0.00 175.76 176.77 1g4a s LYS 314 N -3.86 2.79 0.44 0.00 1.02 -1.26 -4.33 119.74 114.54 1g4a s LYS 314 Ca 0.35 -1.05 0.30 0.00 0.02 0.00 0.00 55.97 55.59 1g4a s LYS 314 Cb -0.07 -2.52 1.57 0.00 -0.52 0.00 0.00 37.83 36.30 1g4a s LYS 314 CO 0.24 0.43 1.91 -1.35 -0.92 0.00 0.00 175.35 175.66 1g4a h PRO 315 N 1.94 0.00 0.00 -1.68 0.11 -1.98 0.11 132.00 130.50 1g4a h PRO 315 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1g4a h PRO 315 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1g4a h PRO 315 CO 0.61 0.00 -0.09 -1.13 -0.21 0.00 0.00 178.00 177.18 1g4a n SER 316 N -2.56 0.65 -0.73 -2.05 3.41 -1.26 -3.21 113.62 107.86 1g4a n SER 316 Ca -0.01 0.49 0.11 0.00 -0.26 0.00 0.00 58.87 59.19 1g4a n SER 316 Cb 0.08 -0.60 0.31 0.00 -0.26 0.00 0.00 64.21 63.74 1g4a n SER 316 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1g4a n ASP 317 N -2.09 2.20 -4.84 4.04 10.43 0.39 -4.88 116.55 121.80 1g4a n ASP 317 Ca 0.06 -1.81 -0.33 0.00 2.57 0.00 0.00 54.79 55.28 1g4a n ASP 317 Cb 0.41 -0.16 -0.06 0.00 1.84 0.00 0.00 41.12 43.15 1g4a n ASP 317 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1g4a s LEU 318 N -1.50 4.05 0.42 0.64 1.02 -1.20 -4.31 118.68 117.80 1g4a s LEU 318 Ca 0.33 1.37 -0.23 0.00 0.02 0.00 0.00 54.13 55.62 1g4a s LEU 318 Cb 0.19 -4.15 -0.11 0.00 0.02 0.00 0.00 46.19 42.13 1g4a s LEU 318 CO 0.27 -0.22 0.82 2.30 0.02 0.00 0.00 176.35 179.54 1g4a n ILE 319 N -0.36 2.24 -0.22 -0.59 -5.35 -1.26 -4.72 119.36 109.10 1g4a n ILE 319 Ca 0.04 -0.50 0.08 0.00 -0.27 0.00 0.00 62.75 62.10 1g4a n ILE 319 Cb 0.53 -0.89 0.36 0.00 -1.74 0.00 0.00 39.64 37.90 1g4a n ILE 319 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 1g4a h PRO 320 N 1.19 0.72 0.43 6.28 0.13 -1.94 -2.95 132.00 135.86 1g4a h PRO 320 Ca -0.43 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1g4a h PRO 320 Cb 1.36 -0.16 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 1g4a h PRO 320 CO 0.54 0.48 -0.42 0.93 -0.23 0.00 0.00 178.00 179.30 1g4a h GLU 321 N 0.74 -0.83 -0.70 0.86 3.07 -2.00 -2.65 114.58 113.07 1g4a h GLU 321 Ca 0.36 0.06 0.15 0.00 -0.50 0.00 0.00 59.36 59.43 1g4a h GLU 321 Cb 0.42 0.19 -0.11 0.00 -0.84 0.00 0.00 28.75 28.41 1g4a h GLU 321 CO -0.14 -0.56 0.12 -0.07 -1.40 0.00 0.00 179.01 176.96 1g4a h LEU 322 N -0.87 -0.08 -1.50 1.33 4.07 -1.89 0.31 115.31 116.68 1g4a h LEU 322 Ca -0.04 0.15 0.18 0.00 0.08 0.00 0.00 57.88 58.24 1g4a h LEU 322 Cb 0.77 0.22 -0.06 0.00 1.08 0.00 0.00 40.66 42.67 1g4a h LEU 322 CO -0.06 -0.07 0.56 1.56 -1.08 0.00 0.00 178.44 179.36 1g4a h GLN 323 N 0.22 0.44 0.00 1.13 4.20 -1.32 -1.21 115.11 118.57 1g4a h GLN 323 Ca 0.39 -0.03 -0.18 0.00 0.06 0.00 0.00 58.65 58.89 1g4a h GLN 323 Cb 0.65 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.31 1g4a h GLN 323 CO -0.52 0.29 -0.87 0.78 -0.67 0.00 0.00 178.83 177.83 1g4a h GLY 324 N 0.45 0.00 -3.79 3.46 0.00 -0.71 -3.23 103.07 99.25 1g4a h GLY 324 Ca 0.43 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 47.22 1g4a h GLY 324 CO -0.16 0.00 0.70 0.54 0.00 0.00 0.00 176.54 177.62 1g4a n ARG 325 N -3.31 2.34 -2.91 4.80 5.12 -0.47 -4.27 116.66 117.96 1g4a n ARG 325 Ca 0.00 -2.61 -0.12 0.00 -1.93 0.00 0.00 57.85 53.19 1g4a n ARG 325 Cb 0.89 -2.02 0.04 0.00 -1.16 0.00 0.00 32.46 30.21 1g4a n ARG 325 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1g4a n LEU 326 N -0.42 -1.16 -0.29 0.55 4.77 -1.10 -4.65 117.00 114.70 1g4a n LEU 326 Ca 0.50 -4.19 0.09 0.00 -0.03 0.00 0.00 56.01 52.37 1g4a n LEU 326 Cb 0.63 0.85 0.24 0.00 -2.33 0.00 0.00 43.42 42.81 1g4a n LEU 326 CO 0.63 2.16 1.05 1.55 -1.33 0.00 0.00 177.39 181.45 1g4a h PRO 327 N 3.04 0.47 -5.36 3.23 0.13 -1.73 -3.42 132.00 128.35 1g4a h PRO 327 Ca -0.03 -0.03 -0.61 0.00 -0.87 0.00 0.00 66.00 64.46 1g4a h PRO 327 Cb 1.05 -0.11 -0.12 0.00 0.13 0.00 0.00 31.00 31.95 1g4a h PRO 327 CO 0.28 0.31 -0.11 0.42 -0.23 0.00 0.00 178.00 178.67 1g4a s ILE 328 N -5.96 5.13 -0.13 -3.56 1.01 -0.60 -5.03 121.20 112.06 1g4a s ILE 328 Ca -0.12 0.79 0.03 0.00 0.00 0.00 0.00 60.65 61.34 1g4a s ILE 328 Cb 0.23 -3.78 0.01 0.00 0.01 0.00 0.00 42.46 38.92 1g4a s ILE 328 CO 0.77 0.16 -0.22 -0.13 0.00 0.00 0.00 174.94 175.52 1g4a s ARG 329 N 1.89 3.00 -0.02 2.79 1.81 -1.26 0.45 118.95 127.62 1g4a s ARG 329 Ca 0.20 -0.85 -0.00 0.00 -1.72 0.00 0.00 55.73 53.36 1g4a s ARG 329 Cb -0.15 -2.39 0.02 0.00 -0.45 0.00 0.00 34.95 31.98 1g4a s ARG 329 CO 0.09 0.03 0.02 0.54 -0.68 0.00 0.00 175.30 175.30 1g4a s VAL 330 N 0.71 -0.04 -0.29 3.52 0.11 -0.94 -4.97 120.40 118.49 1g4a s VAL 330 Ca -0.10 0.16 -0.13 0.00 -2.93 0.00 0.00 61.98 58.98 1g4a s VAL 330 Cb -0.16 -0.06 -0.04 0.00 -1.53 0.00 0.00 36.38 34.59 1g4a s VAL 330 CO 0.01 0.07 0.27 -1.61 -3.33 0.00 0.00 175.10 170.50 1g4a s GLU 331 N 0.79 3.85 0.35 1.54 2.02 -1.26 -1.12 118.70 124.87 1g4a s GLU 331 Ca -0.07 -0.29 -0.13 0.00 0.02 0.00 0.00 54.97 54.51 1g4a s GLU 331 Cb -0.09 -3.70 -0.08 0.00 0.10 0.00 0.00 34.13 30.36 1g4a s GLU 331 CO -0.02 -0.29 0.74 -0.51 0.02 0.00 0.00 175.26 175.20 1g4a s LEU 332 N 1.87 3.98 0.25 1.80 1.02 -0.72 -4.86 118.68 122.02 1g4a s LEU 332 Ca 0.10 1.21 0.03 0.00 0.02 0.00 0.00 54.13 55.48 1g4a s LEU 332 Cb -0.16 -4.04 -0.03 0.00 0.02 0.00 0.00 46.19 41.98 1g4a s LEU 332 CO 0.11 -0.27 0.40 -1.10 0.02 0.00 0.00 176.35 175.50 1g4a s GLN 333 N -3.30 3.46 -0.03 1.70 1.11 -1.26 -4.53 119.66 116.81 1g4a s GLN 333 Ca 0.53 -0.61 -0.30 0.00 0.01 0.00 0.00 55.36 54.99 1g4a s GLN 333 Cb -0.10 -2.84 -0.04 0.00 -1.01 0.00 0.00 33.01 29.02 1g4a s GLN 333 CO 0.23 0.37 1.23 0.00 0.01 0.00 0.00 175.29 177.13 1g4a s ALA 334 N -2.02 3.49 0.45 6.09 0.00 -1.26 -4.76 121.76 123.74 1g4a s ALA 334 Ca 0.36 0.70 -0.25 0.00 0.00 0.00 0.00 51.96 52.77 1g4a s ALA 334 Cb -0.10 -3.52 -0.08 0.00 0.00 0.00 0.00 23.12 19.43 1g4a s ALA 334 CO 0.31 -0.74 1.32 -0.51 0.00 0.00 0.00 175.76 176.14 1g4a s LEU 335 N 2.07 4.10 0.47 0.00 1.43 -1.26 -5.04 118.68 120.46 1g4a s LEU 335 Ca 0.58 2.68 0.08 0.00 -1.03 0.00 0.00 54.13 56.43 1g4a s LEU 335 Cb -0.26 -4.02 0.03 0.00 0.03 0.00 0.00 46.19 41.97 1g4a s LEU 335 CO 0.24 -1.05 0.64 0.42 0.23 0.00 0.00 176.35 176.83 1g4a s THR 336 N -1.29 2.76 0.37 5.49 -4.23 -1.26 -4.93 115.64 112.55 1g4a s THR 336 Ca 0.61 -0.97 0.05 0.00 -1.18 0.00 0.00 61.69 60.20 1g4a s THR 336 Cb -0.38 -2.79 0.23 0.00 1.34 0.00 0.00 72.50 70.90 1g4a s THR 336 CO 0.48 0.00 1.99 0.74 -0.54 0.00 0.00 174.62 177.29 1g4a h THR 337 N 0.47 1.15 0.00 3.99 2.02 -1.96 0.51 112.91 119.08 1g4a h THR 337 Ca -0.38 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 66.41 1g4a h THR 337 Cb 1.28 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 68.26 1g4a h THR 337 CO 0.44 0.17 0.00 0.77 0.37 0.00 0.00 175.52 177.27 1g4a h SER 338 N 0.62 0.00 0.18 4.18 4.64 -1.99 -2.73 113.55 118.45 1g4a h SER 338 Ca 0.16 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.12 1g4a h SER 338 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1g4a h SER 338 CO -0.02 0.00 -1.81 0.44 -0.87 0.00 0.00 176.83 174.57 1g4a h ASP 339 N 0.00 0.58 -0.12 4.97 3.45 -0.39 -3.26 116.42 121.65 1g4a h ASP 339 Ca 0.00 -0.95 -0.07 0.00 0.43 0.00 0.00 57.03 56.45 1g4a h ASP 339 Cb 0.41 -0.19 -0.02 0.00 -0.56 0.00 0.00 39.33 38.97 1g4a h ASP 339 CO 0.00 1.81 -0.11 -0.26 -1.57 0.00 0.00 179.24 179.10 1g4a h PHE 340 N 0.10 0.49 -0.61 4.55 0.04 -1.09 0.48 116.94 120.91 1g4a h PHE 340 Ca -0.36 -0.07 -0.02 0.00 2.80 0.00 0.00 57.97 60.31 1g4a h PHE 340 Cb 2.09 -0.13 -0.03 0.00 2.20 0.00 0.00 35.95 40.08 1g4a h PHE 340 CO 0.10 0.57 0.29 0.93 -0.60 0.00 0.00 178.31 179.59 1g4a h GLU 341 N 0.43 0.87 0.11 1.51 5.08 -1.61 -1.15 114.58 119.82 1g4a h GLU 341 Ca 0.08 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1g4a h GLU 341 Cb 0.46 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1g4a h GLU 341 CO 0.03 0.68 -0.05 0.00 -1.00 0.00 0.00 179.01 178.67 1g4a h ARG 342 N 0.87 -0.14 0.00 2.33 3.08 -1.34 -3.09 114.38 116.09 1g4a h ARG 342 Ca 0.21 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.27 1g4a h ARG 342 Cb 0.10 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.19 1g4a h ARG 342 CO -0.03 0.32 0.31 0.82 -1.07 0.00 0.00 179.97 180.33 1g4a h ILE 343 N -0.91 0.00 0.04 2.04 2.04 0.09 0.34 117.51 121.15 1g4a h ILE 343 Ca -0.02 0.00 -0.24 0.00 1.00 0.00 0.00 64.86 65.60 1g4a h ILE 343 Cb 0.53 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 1g4a h ILE 343 CO 0.02 0.00 -1.19 -0.07 0.00 0.00 0.00 178.15 176.92 1g4a h LEU 344 N 0.00 0.15 0.00 1.44 3.38 -1.12 -3.39 115.31 115.76 1g4a h LEU 344 Ca 0.00 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1g4a h LEU 344 Cb 0.63 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1g4a h LEU 344 CO 0.00 1.14 -0.65 0.35 0.09 0.00 0.00 178.44 179.36 1g4a n THR 345 N -3.38 0.00 0.00 0.22 -2.24 0.92 -2.96 114.28 106.84 1g4a n THR 345 Ca -0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 1g4a n THR 345 Cb 0.98 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 1g4a n THR 345 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1g4a n GLU 346 N -2.30 0.00 -0.67 -0.78 1.02 0.45 -4.62 120.64 113.73 1g4a n GLU 346 Ca 0.00 0.19 -0.25 0.00 -0.02 0.00 0.00 57.16 57.08 1g4a n GLU 346 Cb 0.33 -0.96 -0.03 0.00 -0.02 0.00 0.00 31.44 30.76 1g4a n GLU 346 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1g4a n PRO 347 N -0.65 0.00 -0.41 3.49 -0.04 -1.26 -4.65 135.00 131.48 1g4a n PRO 347 Ca 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.42 1g4a n PRO 347 Cb 0.00 -0.61 -0.06 0.00 -0.04 0.00 0.00 33.50 32.80 1g4a n PRO 347 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1g4a n ASN 348 N 0.77 2.61 0.00 3.54 2.04 0.34 -0.59 115.26 123.97 1g4a n ASN 348 Ca 0.09 -1.89 0.00 0.00 -0.44 0.00 0.00 54.58 52.34 1g4a n ASN 348 Cb 0.06 -0.65 0.00 0.00 -2.53 0.00 0.00 39.78 36.66 1g4a n ASN 348 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1g4a n ALA 349 N 2.41 0.27 0.00 -2.53 0.00 -1.26 -5.04 120.51 114.36 1g4a n ALA 349 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1g4a n ALA 349 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.83 1g4a n ALA 349 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1g4a n SER 350 N 0.00 0.00 0.29 0.00 2.88 0.25 -4.38 113.62 112.66 1g4a n SER 350 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 1g4a n SER 350 Cb 0.16 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.57 1g4a n SER 350 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 1g4a h ILE 351 N 0.00 0.00 -0.80 2.46 1.08 -1.76 -1.60 117.51 116.89 1g4a h ILE 351 Ca 0.00 -0.11 0.12 0.00 -0.39 0.00 0.00 64.86 64.48 1g4a h ILE 351 Cb 0.00 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 33.67 1g4a h ILE 351 CO 0.00 0.00 0.41 0.71 -0.69 0.00 0.00 178.15 178.58 1g4a h THR 352 N -0.86 0.78 0.00 -0.27 1.35 -1.87 0.68 112.91 112.73 1g4a h THR 352 Ca -0.08 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 1g4a h THR 352 Cb 0.57 0.10 0.00 0.00 -1.73 0.00 0.00 68.15 67.09 1g4a h THR 352 CO 0.12 0.11 0.00 0.58 -0.25 0.00 0.00 175.52 176.09 1g4a h VAL 353 N 0.63 0.00 0.03 6.82 2.07 -1.76 0.30 116.25 124.34 1g4a h VAL 353 Ca 0.42 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 67.76 1g4a h VAL 353 Cb 0.52 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1g4a h VAL 353 CO -0.32 0.00 -0.19 1.56 0.02 0.00 0.00 177.57 178.64 1g4a h GLN 354 N 0.00 0.08 -0.33 1.57 4.20 0.14 -3.01 115.11 117.75 1g4a h GLN 354 Ca 0.00 -0.12 0.06 0.00 0.06 0.00 0.00 58.65 58.65 1g4a h GLN 354 Cb 0.14 0.04 -0.05 0.00 0.30 0.00 0.00 27.48 27.91 1g4a h GLN 354 CO 0.00 1.03 -0.00 1.88 -0.67 0.00 0.00 178.83 181.06 1g4a h TYR 355 N -0.81 -0.02 0.00 2.96 -1.99 -0.53 0.91 116.97 117.49 1g4a h TYR 355 Ca -0.03 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.72 1g4a h TYR 355 Cb 1.11 0.06 0.00 0.00 2.00 0.00 0.00 36.73 39.91 1g4a h TYR 355 CO 0.25 -0.06 0.00 1.17 -0.00 0.00 0.00 178.16 179.52 1g4a n LYS 356 N -5.18 0.00 -0.17 4.88 4.81 0.02 0.12 118.16 122.65 1g4a n LYS 356 Ca 0.01 0.96 -0.02 0.00 -0.87 0.00 0.00 58.31 58.40 1g4a n LYS 356 Cb 0.17 -1.47 0.06 0.00 0.02 0.00 0.00 35.03 33.82 1g4a n LYS 356 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1g4a h ALA 357 N -1.07 0.47 0.05 3.14 0.00 -1.36 -1.98 119.26 118.51 1g4a h ALA 357 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1g4a h ALA 357 Cb 0.00 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1g4a h ALA 357 CO 0.00 -0.40 -0.16 -0.07 0.00 0.00 0.00 179.25 178.61 1g4a h LEU 358 N 0.09 -0.49 0.00 0.00 3.38 0.17 -0.35 115.31 118.11 1g4a h LEU 358 Ca 0.27 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.29 1g4a h LEU 358 Cb 0.42 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1g4a h LEU 358 CO -0.47 -0.18 0.00 0.80 0.09 0.00 0.00 178.44 178.68 1g4a n MET 359 N -3.37 0.02 -0.06 1.13 1.56 0.33 -1.44 117.12 115.29 1g4a n MET 359 Ca -0.03 0.00 -0.14 0.00 -0.27 0.00 0.00 57.70 57.26 1g4a n MET 359 Cb 0.13 -1.41 -0.13 0.00 2.15 0.00 0.00 33.22 33.97 1g4a n MET 359 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1g4a h ALA 360 N 1.85 -0.00 -1.21 -5.12 0.00 -0.29 -3.05 119.26 111.45 1g4a h ALA 360 Ca 0.00 -0.48 0.35 0.00 0.00 0.00 0.00 54.91 54.78 1g4a h ALA 360 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 1g4a h ALA 360 CO 0.00 -0.01 1.20 2.41 0.00 0.00 0.00 179.25 182.84 1g4a n THR 361 N -4.62 0.00 -1.18 0.00 -1.04 -0.52 0.26 114.28 107.17 1g4a n THR 361 Ca -0.10 1.23 -0.16 0.00 -2.04 0.00 0.00 64.05 62.98 1g4a n THR 361 Cb 0.47 -2.16 0.23 0.00 -1.82 0.00 0.00 70.33 67.04 1g4a n THR 361 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1g4a n GLU 362 N -3.29 2.73 -0.10 -2.82 -0.58 -1.22 -4.92 120.64 110.43 1g4a n GLU 362 Ca 0.27 -3.05 0.00 0.00 -0.42 0.00 0.00 57.16 53.96 1g4a n GLU 362 Cb 1.56 -2.16 0.00 0.00 -0.57 0.00 0.00 31.44 30.27 1g4a n GLU 362 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1g4a n GLY 363 N -0.80 0.77 3.84 0.62 0.00 0.72 -3.33 105.19 107.01 1g4a n GLY 363 Ca 0.51 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.18 1g4a n GLY 363 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g4a s VAL 364 N -1.62 4.72 -0.14 1.61 1.01 -1.15 -0.96 120.40 123.85 1g4a s VAL 364 Ca 0.00 0.99 0.01 0.00 0.00 0.00 0.00 61.98 62.98 1g4a s VAL 364 Cb 0.00 -3.74 -0.00 0.00 0.00 0.00 0.00 36.38 32.64 1g4a s VAL 364 CO 0.00 0.10 -0.17 0.21 0.00 0.00 0.00 175.10 175.24 1g4a s ASN 365 N -1.89 3.59 0.35 3.32 2.47 -0.35 -3.77 114.94 118.66 1g4a s ASN 365 Ca 0.45 -0.47 0.09 0.00 0.42 0.00 0.00 52.86 53.34 1g4a s ASN 365 Cb -0.14 -1.54 -0.05 0.00 -1.45 0.00 0.00 41.25 38.07 1g4a s ASN 365 CO 0.20 0.10 0.07 -0.51 -3.72 0.00 0.00 177.10 173.24 1g4a s ILE 366 N 0.71 2.75 -0.29 -5.21 1.10 -1.26 -1.24 121.20 117.76 1g4a s ILE 366 Ca -0.08 -1.85 -0.18 0.00 -0.51 0.00 0.00 60.65 58.03 1g4a s ILE 366 Cb -0.16 -2.88 0.13 0.00 0.15 0.00 0.00 42.46 39.71 1g4a s ILE 366 CO 0.01 -0.18 0.97 -1.83 -2.11 0.00 0.00 174.94 171.81 1g4a s GLU 367 N -3.78 0.44 0.02 3.50 -1.05 -1.23 -5.00 118.70 111.60 1g4a s GLU 367 Ca 0.36 0.68 0.02 0.00 -0.15 0.00 0.00 54.97 55.88 1g4a s GLU 367 Cb -0.01 0.12 -0.04 0.00 -0.44 0.00 0.00 34.13 33.77 1g4a s GLU 367 CO 0.21 -0.08 0.02 -0.06 0.95 0.00 0.00 175.26 176.30 1g4a s PHE 368 N 1.07 3.11 0.21 4.83 0.40 -1.26 -1.23 117.98 125.11 1g4a s PHE 368 Ca -0.06 0.09 -0.15 0.00 -0.60 0.00 0.00 56.93 56.21 1g4a s PHE 368 Cb -0.04 -1.66 -0.08 0.00 0.51 0.00 0.00 43.02 41.75 1g4a s PHE 368 CO -0.13 0.48 0.62 0.99 0.70 0.00 0.00 175.22 177.89 1g4a s THR 369 N -1.16 4.77 0.31 0.64 2.01 -0.58 -4.86 115.64 116.77 1g4a s THR 369 Ca 0.22 0.89 0.06 0.00 0.31 0.00 0.00 61.69 63.17 1g4a s THR 369 Cb -0.12 -3.72 0.33 0.00 0.01 0.00 0.00 72.50 69.00 1g4a s THR 369 CO 0.13 0.10 1.64 0.44 -0.69 0.00 0.00 174.62 176.24 1g4a h ASP 370 N 3.12 0.07 1.29 3.53 5.19 -1.98 1.93 116.42 129.57 1g4a h ASP 370 Ca -0.48 0.21 -0.06 0.00 -0.62 0.00 0.00 57.03 56.08 1g4a h ASP 370 Cb 1.19 0.27 -0.01 0.00 0.18 0.00 0.00 39.33 40.96 1g4a h ASP 370 CO 0.66 -0.20 -0.30 0.28 -3.12 0.00 0.00 179.24 176.56 1g4a h SER 371 N 0.19 0.00 0.03 6.45 0.02 -1.95 0.13 113.55 118.42 1g4a h SER 371 Ca 0.62 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.57 1g4a h SER 371 Cb 1.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.87 1g4a h SER 371 CO -0.69 0.30 -0.02 1.23 -1.14 0.00 0.00 176.83 176.51 1g4a h GLY 372 N 2.87 -0.05 2.00 -3.77 0.00 0.25 -1.99 103.07 102.38 1g4a h GLY 372 Ca -0.00 0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.33 1g4a h GLY 372 CO 0.04 -0.02 -0.06 -2.22 0.00 0.00 0.00 176.54 174.29 1g4a h ILE 373 N -0.38 0.27 0.20 2.60 2.04 0.21 -2.10 117.51 120.35 1g4a h ILE 373 Ca -0.00 -0.37 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 1g4a h ILE 373 Cb 0.35 1.28 0.00 0.00 -0.74 0.00 0.00 36.82 37.72 1g4a h ILE 373 CO 0.01 0.05 -0.10 0.50 0.00 0.00 0.00 178.15 178.62 1g4a h LYS 374 N 0.00 -0.26 -1.18 2.37 3.64 -0.33 -2.85 116.57 117.96 1g4a h LYS 374 Ca -0.00 0.02 0.34 0.00 -1.27 0.00 0.00 60.65 59.74 1g4a h LYS 374 Cb 0.28 0.06 -0.09 0.00 -0.41 0.00 0.00 32.23 32.07 1g4a h LYS 374 CO 0.01 -0.17 0.79 0.00 -2.27 0.00 0.00 179.45 177.80 1g4a h ARG 375 N -0.61 0.21 0.00 1.90 2.47 -1.31 0.99 114.38 118.03 1g4a h ARG 375 Ca -0.03 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.68 1g4a h ARG 375 Cb 0.20 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.48 1g4a h ARG 375 CO 0.04 0.14 0.00 -0.89 0.56 0.00 0.00 179.97 179.82 1g4a n ILE 376 N -4.53 0.00 -0.38 2.04 2.08 -0.80 0.32 119.36 118.09 1g4a n ILE 376 Ca 0.29 1.41 -0.10 0.00 0.56 0.00 0.00 62.75 64.91 1g4a n ILE 376 Cb 1.15 -2.21 -0.09 0.00 -0.75 0.00 0.00 39.64 37.74 1g4a n ILE 376 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1g4a n ALA 377 N -2.06 -0.58 -0.37 -1.39 0.00 0.11 0.15 120.51 116.38 1g4a n ALA 377 Ca 0.00 0.77 0.29 0.00 0.00 0.00 0.00 53.44 54.49 1g4a n ALA 377 Cb 0.00 -0.10 0.57 0.00 0.00 0.00 0.00 19.45 19.92 1g4a n ALA 377 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1g4a h GLU 378 N 0.00 0.25 0.55 0.00 5.08 -0.59 0.18 114.58 120.06 1g4a h GLU 378 Ca 0.14 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.46 1g4a h GLU 378 Cb 0.37 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.57 1g4a h GLU 378 CO -0.85 0.17 -0.27 0.00 -1.00 0.00 0.00 179.01 177.06 1g4a h ALA 379 N 1.61 -0.74 -0.12 3.43 0.00 0.61 0.62 119.26 124.67 1g4a h ALA 379 Ca 0.68 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.44 1g4a h ALA 379 Cb 1.94 0.29 -0.06 0.00 0.00 0.00 0.00 17.79 19.96 1g4a h ALA 379 CO -0.34 -0.82 -0.27 0.00 0.00 0.00 0.00 179.25 177.83 1g4a h ALA 380 N -0.62 -0.28 -0.83 0.00 0.00 -0.35 0.21 119.26 117.40 1g4a h ALA 380 Ca -0.08 0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.00 1g4a h ALA 380 Cb 0.63 0.51 -0.06 0.00 0.00 0.00 0.00 17.79 18.87 1g4a h ALA 380 CO 0.12 -0.74 0.54 2.35 0.00 0.00 0.00 179.25 181.53 1g4a h TRP 381 N -0.34 0.70 0.52 0.00 7.01 -0.70 -0.99 115.95 122.15 1g4a h TRP 381 Ca 0.10 0.02 -0.03 0.00 2.11 0.00 0.00 58.89 61.09 1g4a h TRP 381 Cb 0.49 -0.22 0.01 0.00 -2.10 0.00 0.00 29.16 27.33 1g4a h TRP 381 CO -0.36 0.28 -0.25 0.37 -2.79 0.00 0.00 178.44 175.69 1g4a h GLN 382 N 0.61 -0.68 -0.87 2.65 -0.00 0.15 -1.88 115.11 115.09 1g4a h GLN 382 Ca 0.41 0.05 0.14 0.00 -0.00 0.00 0.00 58.65 59.25 1g4a h GLN 382 Cb 0.70 0.15 -0.07 0.00 0.00 0.00 0.00 27.48 28.27 1g4a h GLN 382 CO -0.16 -0.37 0.56 0.28 0.00 0.00 0.00 178.83 179.14 1g4a h VAL 383 N -0.97 0.83 0.24 2.39 2.07 0.02 -0.31 116.25 120.52 1g4a h VAL 383 Ca -0.07 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 1g4a h VAL 383 Cb 0.62 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 1g4a h VAL 383 CO 0.12 0.12 -0.12 0.78 0.02 0.00 0.00 177.57 178.49 1g4a h ASN 384 N 0.64 -0.28 0.65 0.57 2.35 -1.11 -1.07 115.58 117.33 1g4a h ASN 384 Ca 0.43 -0.12 -0.03 0.00 -0.55 0.00 0.00 56.30 56.03 1g4a h ASN 384 Cb 0.75 0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.19 1g4a h ASN 384 CO -0.19 -0.04 -0.33 -0.33 -1.65 0.00 0.00 177.43 174.89 1g4a h GLU 385 N -0.52 -0.87 -0.65 0.81 4.39 -0.67 -3.03 114.58 114.05 1g4a h GLU 385 Ca -0.03 0.06 0.11 0.00 0.34 0.00 0.00 59.36 59.83 1g4a h GLU 385 Cb 0.38 0.20 -0.08 0.00 -0.10 0.00 0.00 28.75 29.15 1g4a h GLU 385 CO 0.06 -0.58 0.24 0.66 -1.16 0.00 0.00 179.01 178.22 1g4a h SER 386 N -0.90 0.22 0.00 1.42 4.64 -1.11 -3.44 113.55 114.37 1g4a h SER 386 Ca -0.09 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1g4a h SER 386 Cb 0.70 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 1g4a h SER 386 CO 0.13 0.12 0.00 0.35 -0.87 0.00 0.00 176.83 176.55 1g4a n THR 387 N -5.01 0.00 -3.81 2.95 -2.24 -0.41 -5.07 114.28 100.69 1g4a n THR 387 Ca 0.10 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.52 1g4a n THR 387 Cb 0.31 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.43 1g4a n THR 387 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1g4a s GLU 388 N 1.83 3.74 -0.71 -0.78 0.41 -1.25 -4.96 118.70 116.97 1g4a s GLU 388 Ca 0.00 -0.44 -0.26 0.00 -0.41 0.00 0.00 54.97 53.86 1g4a s GLU 388 Cb 0.00 -3.33 -0.01 0.00 -1.78 0.00 0.00 34.13 29.01 1g4a s GLU 388 CO 0.00 -0.10 1.70 1.21 -0.49 0.00 0.00 175.26 177.58 1g4a s ASN 389 N 1.38 5.56 -0.07 -0.19 2.47 -1.15 -4.57 114.94 118.38 1g4a s ASN 389 Ca 0.05 -0.13 0.17 0.00 0.42 0.00 0.00 52.86 53.38 1g4a s ASN 389 Cb -0.15 -2.54 -0.22 0.00 -1.45 0.00 0.00 41.25 36.89 1g4a s ASN 389 CO 0.04 -2.24 0.47 2.30 -3.72 0.00 0.00 177.10 173.95 1g4a n ILE 390 N 7.08 1.14 0.00 -5.21 -5.35 -1.26 -4.88 119.36 110.87 1g4a n ILE 390 Ca 0.20 -0.74 0.00 0.00 -0.27 0.00 0.00 62.75 61.94 1g4a n ILE 390 Cb 0.50 -0.56 0.00 0.00 -1.74 0.00 0.00 39.64 37.84 1g4a n ILE 390 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1g4a n GLY 391 N 1.53 -0.35 0.23 3.28 0.00 -1.26 -3.71 105.19 104.91 1g4a n GLY 391 Ca -0.18 -2.12 0.14 0.00 0.00 0.00 0.00 46.02 43.86 1g4a n GLY 391 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g4a h ALA 392 N 0.00 1.05 0.00 4.61 0.00 -1.85 0.13 119.26 123.20 1g4a h ALA 392 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1g4a h ALA 392 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1g4a h ALA 392 CO 0.00 -0.05 -0.11 0.00 0.00 0.00 0.00 179.25 179.10 1g4a h ARG 393 N 0.00 0.00 0.00 0.00 3.08 -1.85 -2.41 114.38 113.21 1g4a h ARG 393 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1g4a h ARG 393 Cb 0.12 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.17 1g4a h ARG 393 CO 0.00 0.11 -0.03 -0.09 -1.07 0.00 0.00 179.97 178.89 1g4a h ARG 394 N 0.00 0.00 -0.27 0.04 2.43 -1.05 -2.05 114.38 113.48 1g4a h ARG 394 Ca -0.00 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.20 1g4a h ARG 394 Cb 0.19 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.71 1g4a h ARG 394 CO 0.01 0.03 0.06 -0.07 -1.51 0.00 0.00 179.97 178.50 1g4a h LEU 395 N 0.00 0.04 -0.51 3.80 3.38 -1.63 -1.69 115.31 118.70 1g4a h LEU 395 Ca -0.00 0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.10 1g4a h LEU 395 Cb 0.10 0.05 -0.10 0.00 0.09 0.00 0.00 40.66 40.79 1g4a h LEU 395 CO 0.00 0.05 -0.37 0.45 0.09 0.00 0.00 178.44 178.67 1g4a h HIS 396 N 0.17 -1.05 0.34 1.13 3.86 -1.54 0.86 115.15 118.91 1g4a h HIS 396 Ca 0.12 0.07 -0.02 0.00 -1.16 0.00 0.00 60.37 59.39 1g4a h HIS 396 Cb 0.12 0.53 0.00 0.00 1.06 0.00 0.00 27.41 29.12 1g4a h HIS 396 CO -0.15 -0.40 -0.16 1.79 0.86 0.00 0.00 177.93 179.86 1g4a h THR 397 N -0.22 0.43 -0.95 2.45 1.35 -1.62 -2.06 112.91 112.29 1g4a h THR 397 Ca 0.19 -0.73 0.24 0.00 -0.55 0.00 0.00 66.41 65.56 1g4a h THR 397 Cb 0.56 0.69 -0.13 0.00 -1.73 0.00 0.00 68.15 67.54 1g4a h THR 397 CO -0.63 0.10 0.49 0.58 -0.25 0.00 0.00 175.52 175.80 1g4a h VAL 398 N -0.98 0.49 0.00 6.82 2.07 -1.11 -0.07 116.25 123.47 1g4a h VAL 398 Ca -0.05 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.31 1g4a h VAL 398 Cb 0.51 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 1g4a h VAL 398 CO 0.08 0.09 0.00 -0.11 0.02 0.00 0.00 177.57 177.64 1g4a n LEU 399 N -4.98 0.03 -0.31 2.57 0.00 0.30 -2.58 117.00 112.03 1g4a n LEU 399 Ca 0.25 0.90 0.35 0.00 0.00 0.00 0.00 56.01 57.50 1g4a n LEU 399 Cb 0.72 -0.47 0.75 0.00 0.00 0.00 0.00 43.42 44.41 1g4a n LEU 399 CO 0.14 -0.47 1.32 -0.08 0.00 0.00 0.00 177.39 178.30 1g4a h GLU 400 N 0.00 0.00 0.00 1.96 4.57 -1.05 0.51 114.58 120.57 1g4a h GLU 400 Ca 0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1g4a h GLU 400 Cb 0.00 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1g4a h GLU 400 CO 0.00 0.00 -0.06 -0.09 -1.18 0.00 0.00 179.01 177.68 1g4a h ARG 401 N 0.00 0.00 -0.37 1.92 9.65 -0.94 -2.58 114.38 122.06 1g4a h ARG 401 Ca 0.55 0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 59.38 1g4a h ARG 401 Cb 2.23 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 30.79 1g4a h ARG 401 CO -0.01 0.06 0.03 -0.11 2.80 0.00 0.00 179.97 182.74 1g4a n LEU 402 N -3.19 4.44 0.00 3.80 0.00 0.18 -4.10 117.00 118.12 1g4a n LEU 402 Ca 0.00 -3.12 0.00 0.00 0.00 0.00 0.00 56.01 52.89 1g4a n LEU 402 Cb 0.31 -0.60 0.00 0.00 0.00 0.00 0.00 43.42 43.13 1g4a n LEU 402 CO 0.28 0.75 0.07 0.80 0.00 0.00 0.00 177.39 179.30 1g4a n MET 403 N -0.39 -0.01 0.20 1.96 1.56 -1.07 -4.83 117.12 114.54 1g4a n MET 403 Ca 0.26 -0.15 -0.15 0.00 -0.27 0.00 0.00 57.70 57.39 1g4a n MET 403 Cb 1.01 -0.53 -0.07 0.00 2.15 0.00 0.00 33.22 35.78 1g4a n MET 403 CO 0.00 0.00 0.00 0.93 -0.73 0.00 0.00 175.97 176.17 1g4a h GLU 404 N 0.00 -0.67 0.02 2.12 4.39 -1.62 0.27 114.58 119.08 1g4a h GLU 404 Ca 0.00 0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.75 1g4a h GLU 404 Cb 0.58 0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.37 1g4a h GLU 404 CO 0.00 -0.45 -0.07 1.49 -1.16 0.00 0.00 179.01 178.82 1g4a h GLU 405 N -0.70 -0.10 -0.87 2.33 4.81 -1.88 -2.24 114.58 115.94 1g4a h GLU 405 Ca -0.01 0.01 0.20 0.00 -0.13 0.00 0.00 59.36 59.42 1g4a h GLU 405 Cb 0.65 0.02 -0.16 0.00 0.63 0.00 0.00 28.75 29.89 1g4a h GLU 405 CO -0.10 -0.06 -0.09 0.82 -0.73 0.00 0.00 179.01 178.84 1g4a h ILE 406 N -0.10 0.16 0.00 2.32 2.04 -1.88 -1.07 117.51 118.99 1g4a h ILE 406 Ca -0.00 -0.01 -0.05 0.00 1.00 0.00 0.00 64.86 65.80 1g4a h ILE 406 Cb 0.10 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.30 1g4a h ILE 406 CO -0.04 0.01 -0.22 -1.28 0.00 0.00 0.00 178.15 176.61 1g4a h SER 407 N 0.03 0.00 0.15 1.72 0.87 -0.22 1.37 113.55 117.46 1g4a h SER 407 Ca 0.46 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 61.02 1g4a h SER 407 Cb 0.81 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.77 1g4a h SER 407 CO -0.84 0.22 -0.07 0.22 -0.53 0.00 0.00 176.83 175.83 1g4a h TYR 408 N 0.00 -0.18 -0.46 2.24 3.20 -0.60 -3.34 116.97 117.82 1g4a h TYR 408 Ca -0.00 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.85 1g4a h TYR 408 Cb 0.55 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.86 1g4a h TYR 408 CO 0.00 0.23 0.25 -0.44 -1.64 0.00 0.00 178.16 176.56 1g4a h ASP 409 N -0.92 0.58 0.00 -2.11 3.45 -1.26 -3.34 116.42 112.82 1g4a h ASP 409 Ca -0.02 -0.10 0.00 0.00 0.43 0.00 0.00 57.03 57.34 1g4a h ASP 409 Cb 0.50 -0.15 0.00 0.00 -0.56 0.00 0.00 39.33 39.12 1g4a h ASP 409 CO 0.03 0.51 0.00 0.00 -1.57 0.00 0.00 179.24 178.21 1g4a n ALA 410 N -2.27 0.00 -0.33 3.45 0.00 0.47 0.25 120.51 122.07 1g4a n ALA 410 Ca 0.01 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.52 1g4a n ALA 410 Cb 0.09 0.00 0.23 0.00 0.00 0.00 0.00 19.45 19.77 1g4a n ALA 410 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1g4a h SER 411 N 0.00 0.75 0.00 0.00 0.02 -1.81 -3.21 113.55 109.31 1g4a h SER 411 Ca 0.00 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1g4a h SER 411 Cb 0.00 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.47 1g4a h SER 411 CO 0.00 0.36 0.00 0.47 -1.14 0.00 0.00 176.83 176.52 1g4a n ASP 412 N -4.73 0.00 0.00 3.07 8.00 0.68 -3.94 116.55 119.62 1g4a n ASP 412 Ca 0.18 0.09 0.00 0.00 0.71 0.00 0.00 54.79 55.77 1g4a n ASP 412 Cb 0.39 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.49 1g4a n ASP 412 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1g4a n LEU 413 N -0.12 0.00 -2.20 0.64 4.77 -1.21 -4.78 117.00 114.10 1g4a n LEU 413 Ca 0.00 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.77 1g4a n LEU 413 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1g4a n LEU 413 CO 0.00 0.00 -0.25 -0.24 -1.33 0.00 0.00 177.39 175.57 1g4a n SER 414 N -0.22 -1.58 0.00 -1.43 2.88 -1.21 -1.10 113.62 110.96 1g4a n SER 414 Ca 0.00 0.40 0.00 0.00 -1.33 0.00 0.00 58.87 57.94 1g4a n SER 414 Cb 0.00 -0.45 0.00 0.00 -0.75 0.00 0.00 64.21 63.01 1g4a n SER 414 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1g4a n GLY 415 N 1.22 0.24 3.54 0.46 0.00 -0.14 -4.86 105.19 105.66 1g4a n GLY 415 Ca 0.05 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.83 1g4a n GLY 415 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1g4a s GLN 416 N -1.07 1.88 -0.52 1.61 0.74 -0.26 -5.03 119.66 117.02 1g4a s GLN 416 Ca 0.00 -1.74 0.03 0.00 0.05 0.00 0.00 55.36 53.70 1g4a s GLN 416 Cb 0.00 -1.85 0.15 0.00 1.10 0.00 0.00 33.01 32.41 1g4a s GLN 416 CO 0.00 0.26 0.33 0.54 -0.55 0.00 0.00 175.29 175.88 1g4a s ASN 417 N -3.59 3.61 0.31 6.67 2.20 -1.26 -1.21 114.94 121.67 1g4a s ASN 417 Ca 0.32 -3.09 -0.30 0.00 -0.94 0.00 0.00 52.86 48.85 1g4a s ASN 417 Cb -0.03 -1.14 -0.11 0.00 -2.00 0.00 0.00 41.25 37.97 1g4a s ASN 417 CO 0.17 -0.19 1.59 -0.63 -2.94 0.00 0.00 177.10 175.09 1g4a s ILE 418 N -0.27 2.02 -0.13 0.54 1.01 -0.38 -4.89 121.20 119.12 1g4a s ILE 418 Ca 0.23 0.02 0.01 0.00 0.00 0.00 0.00 60.65 60.91 1g4a s ILE 418 Cb -0.13 -3.01 -0.01 0.00 0.01 0.00 0.00 42.46 39.31 1g4a s ILE 418 CO -0.08 0.00 -0.16 0.28 0.00 0.00 0.00 174.94 174.98 1g4a s THR 419 N -0.20 2.71 -0.42 2.92 -1.32 -1.26 -3.49 115.64 114.58 1g4a s THR 419 Ca 0.62 -0.78 -0.05 0.00 -1.21 0.00 0.00 61.69 60.27 1g4a s THR 419 Cb -0.48 -2.12 0.11 0.00 -1.51 0.00 0.00 72.50 68.50 1g4a s THR 419 CO 0.51 0.53 0.25 -0.51 -2.21 0.00 0.00 174.62 173.19 1g4a s ILE 420 N 0.45 3.64 0.48 5.08 2.07 -0.36 -4.98 121.20 127.57 1g4a s ILE 420 Ca -0.12 -1.89 0.07 0.00 -1.41 0.00 0.00 60.65 57.29 1g4a s ILE 420 Cb -0.16 -3.43 0.07 0.00 0.13 0.00 0.00 42.46 39.07 1g4a s ILE 420 CO 0.05 -0.68 0.54 -0.90 -1.91 0.00 0.00 174.94 172.04 1g4a n ASP 421 N 4.72 2.06 -0.14 4.50 3.85 -1.26 -1.53 116.55 128.75 1g4a n ASP 421 Ca -0.05 -2.41 -0.09 0.00 -0.71 0.00 0.00 54.79 51.52 1g4a n ASP 421 Cb 0.41 -0.23 0.04 0.00 -1.35 0.00 0.00 41.12 40.00 1g4a n ASP 421 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1g4a h ALA 422 N 0.38 0.79 0.00 2.12 0.00 -1.86 -2.67 119.26 118.02 1g4a h ALA 422 Ca -0.25 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1g4a h ALA 422 Cb 1.06 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1g4a h ALA 422 CO 0.38 0.66 0.00 -3.47 0.00 0.00 0.00 179.25 176.82 1g4a n ASP 423 N -4.12 0.00 -0.09 0.00 -0.08 -1.26 -1.04 116.55 109.96 1g4a n ASP 423 Ca 0.01 0.12 -0.18 0.00 -1.51 0.00 0.00 54.79 53.22 1g4a n ASP 423 Cb 0.43 -0.15 -0.07 0.00 2.34 0.00 0.00 41.12 43.67 1g4a n ASP 423 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1g4a n TYR 424 N -1.15 0.00 0.05 -0.67 4.19 -1.04 -3.82 117.16 114.71 1g4a n TYR 424 Ca 0.01 0.00 -0.12 0.00 3.31 0.00 0.00 57.90 61.10 1g4a n TYR 424 Cb 0.01 -0.66 -0.05 0.00 0.49 0.00 0.00 39.34 39.13 1g4a n TYR 424 CO 0.00 0.00 0.00 0.28 0.91 0.00 0.00 176.86 178.05 1g4a h VAL 425 N -0.55 0.31 -0.34 2.97 2.07 -1.02 -0.28 116.25 119.40 1g4a h VAL 425 Ca -0.45 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.12 1g4a h VAL 425 Cb 1.44 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 31.47 1g4a h VAL 425 CO -0.25 0.00 0.05 0.28 0.02 0.00 0.00 177.57 177.68 1g4a h SER 426 N -0.45 -0.02 -0.16 0.57 0.02 -1.34 -1.39 113.55 110.77 1g4a h SER 426 Ca 0.07 0.06 0.05 0.00 -0.84 0.00 0.00 61.79 61.13 1g4a h SER 426 Cb 0.55 0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.17 1g4a h SER 426 CO -0.28 0.03 0.56 0.50 -1.14 0.00 0.00 176.83 176.49 1g4a h LYS 427 N 0.16 0.00 0.00 3.45 3.64 -1.19 0.55 116.57 123.18 1g4a h LYS 427 Ca 0.16 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1g4a h LYS 427 Cb 0.19 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1g4a h LYS 427 CO -0.22 0.00 0.00 0.72 -2.27 0.00 0.00 179.45 177.68 1g4a n HIS 428 N -3.00 0.00 0.00 1.91 8.25 -0.66 -4.89 115.22 116.84 1g4a n HIS 428 Ca 0.02 -0.38 0.00 0.00 -0.26 0.00 0.00 57.72 57.10 1g4a n HIS 428 Cb 0.64 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.72 1g4a n HIS 428 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1g4a n LEU 429 N -0.38 0.22 -0.17 2.41 4.77 0.03 -4.78 117.00 119.10 1g4a n LEU 429 Ca 0.00 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.10 1g4a n LEU 429 Cb 0.30 0.00 0.45 0.00 -2.33 0.00 0.00 43.42 41.84 1g4a n LEU 429 CO 0.00 0.04 1.21 0.44 -1.33 0.00 0.00 177.39 177.74 1g4a h ASP 430 N 0.00 0.49 0.00 -1.43 3.45 -1.33 0.05 116.42 117.65 1g4a h ASP 430 Ca 0.00 0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.48 1g4a h ASP 430 Cb 0.16 -0.08 0.00 0.00 -0.56 0.00 0.00 39.33 38.85 1g4a h ASP 430 CO 0.00 0.27 0.00 0.00 -1.57 0.00 0.00 179.24 177.94 1g4a n ALA 431 N -2.49 -0.06 -0.66 3.45 0.00 -1.26 -1.86 120.51 117.62 1g4a n ALA 431 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1g4a n ALA 431 Cb 0.43 0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.92 1g4a n ALA 431 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1g4a n LEU 432 N -0.78 0.00 -0.45 0.00 7.99 -0.89 -0.40 117.00 122.47 1g4a n LEU 432 Ca 0.00 0.24 0.34 0.00 -0.01 0.00 0.00 56.01 56.58 1g4a n LEU 432 Cb 0.00 0.00 0.53 0.00 -0.11 0.00 0.00 43.42 43.84 1g4a n LEU 432 CO 0.00 0.00 0.96 1.33 -1.51 0.00 0.00 177.39 178.17 1g4a n VAL 433 N -0.61 -0.02 -0.06 4.08 0.24 -0.04 0.18 118.33 122.09 1g4a n VAL 433 Ca 0.00 1.01 -0.15 0.00 -2.04 0.00 0.00 64.34 63.16 1g4a n VAL 433 Cb 0.00 -1.67 -0.03 0.00 -1.47 0.00 0.00 33.84 30.66 1g4a n VAL 433 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1g4a h ALA 434 N 0.70 0.47 -1.55 2.33 0.00 0.03 -3.41 119.26 117.82 1g4a h ALA 434 Ca 0.62 -0.53 -0.56 0.00 0.00 0.00 0.00 54.91 54.44 1g4a h ALA 434 Cb 2.43 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 20.06 1g4a h ALA 434 CO -0.04 0.68 0.94 0.34 0.00 0.00 0.00 179.25 181.17 1g4a s ASP 435 N -6.98 6.36 0.35 0.00 3.68 0.46 -4.89 116.67 115.66 1g4a s ASP 435 Ca -0.10 -0.11 0.15 0.00 2.13 0.00 0.00 52.55 54.62 1g4a s ASP 435 Cb 0.10 -2.54 1.07 0.00 -1.45 0.00 0.00 42.92 40.10 1g4a s ASP 435 CO 0.89 -1.54 1.69 -0.08 0.13 0.00 0.00 175.17 176.26 1g4a h GLU 436 N 9.64 0.37 0.13 4.34 4.57 -1.81 -2.42 114.58 129.39 1g4a h GLU 436 Ca -0.26 -0.02 -0.34 0.00 -1.18 0.00 0.00 59.36 57.56 1g4a h GLU 436 Cb 1.06 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.55 1g4a h GLU 436 CO 1.20 0.24 -1.76 0.22 -1.18 0.00 0.00 179.01 177.73 1g4a h ASP 437 N 0.38 0.43 -0.35 1.04 3.58 -1.93 -3.32 116.42 116.25 1g4a h ASP 437 Ca 0.70 -0.73 -0.06 0.00 0.42 0.00 0.00 57.03 57.36 1g4a h ASP 437 Cb 1.62 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 42.51 1g4a h ASP 437 CO -0.51 1.63 0.02 0.25 -2.88 0.00 0.00 179.24 177.75 1g4a h LEU 438 N 0.07 0.67 -2.80 2.28 6.46 -1.83 -0.99 115.31 119.16 1g4a h LEU 438 Ca -0.33 -0.14 -0.00 0.00 -0.12 0.00 0.00 57.88 57.28 1g4a h LEU 438 Cb 2.05 -0.18 -0.00 0.00 -0.73 0.00 0.00 40.66 41.80 1g4a h LEU 438 CO 0.14 0.72 -0.00 0.77 -0.62 0.00 0.00 178.44 179.45 1g4a h SER 439 N 0.67 0.00 0.15 1.25 4.64 -1.57 0.48 113.55 119.17 1g4a h SER 439 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1g4a h SER 439 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1g4a h SER 439 CO 0.01 0.00 -0.05 0.54 -0.87 0.00 0.00 176.83 176.46 1g4a n ARG 440 N -3.36 1.04 -0.02 4.77 1.74 -0.38 -3.26 116.66 117.20 1g4a n ARG 440 Ca -0.03 -0.37 -0.04 0.00 -0.77 0.00 0.00 57.85 56.63 1g4a n ARG 440 Cb 0.07 -1.49 -0.01 0.00 -1.02 0.00 0.00 32.46 30.01 1g4a n ARG 440 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1g4a n PHE 441 N -0.65 0.00 -1.31 -1.55 3.72 0.16 -4.86 117.46 112.96 1g4a n PHE 441 Ca 0.18 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.57 1g4a n PHE 441 Cb 0.25 -0.24 0.21 0.00 -0.94 0.00 0.00 39.48 38.77 1g4a n PHE 441 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 1g4a n ILE 442 N -3.92 2.50 -1.19 4.37 -0.00 -0.64 -5.14 119.36 115.33 1g4a n ILE 442 Ca -0.07 -2.47 0.00 0.00 -0.00 0.00 0.00 62.75 60.20 1g4a n ILE 442 Cb 0.25 -0.31 0.00 0.00 -0.00 0.00 0.00 39.64 39.59 1g4a n ILE 442 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73