#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g3x s ASN 2 N 0.00 0.08 0.32 6.12 2.20 -1.26 -5.02 114.94 117.38 3g3x s ASN 2 Ca 0.00 -1.05 0.02 0.00 -0.94 0.00 0.00 52.86 50.88 3g3x s ASN 2 Cb 0.00 0.76 0.57 0.00 -2.00 0.00 0.00 41.25 40.58 3g3x s ASN 2 CO 0.00 -1.48 1.93 -0.29 -2.94 0.00 0.00 177.10 174.32 3g3x h ILE 3 N 2.05 1.07 -0.06 0.54 6.09 -1.96 0.79 117.51 126.03 3g3x h ILE 3 Ca -0.28 -0.33 -0.01 0.00 -1.37 0.00 0.00 64.86 62.87 3g3x h ILE 3 Cb 1.25 0.01 -0.00 0.00 0.47 0.00 0.00 36.82 38.55 3g3x h ILE 3 CO 0.36 0.18 0.01 -0.26 -3.07 0.00 0.00 178.15 175.37 3g3x h PHE 4 N 0.97 0.09 -0.46 2.19 0.04 -1.99 -0.82 116.94 116.97 3g3x h PHE 4 Ca 0.36 -0.01 -0.04 0.00 2.80 0.00 0.00 57.97 61.08 3g3x h PHE 4 Cb 0.18 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.28 3g3x h PHE 4 CO -0.00 0.29 0.12 0.93 -0.60 0.00 0.00 178.31 179.05 3g3x h GLU 5 N -0.13 0.67 0.16 1.51 5.08 -1.82 -0.59 114.58 119.46 3g3x h GLU 5 Ca 0.02 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 3g3x h GLU 5 Cb 0.24 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.38 3g3x h GLU 5 CO 0.00 0.60 -0.08 1.98 -1.00 0.00 0.00 179.01 180.52 3g3x h MET 6 N 0.66 -0.20 -0.21 2.33 4.05 -0.71 -2.16 114.93 118.68 3g3x h MET 6 Ca 0.15 0.01 -0.09 0.00 -0.28 0.00 0.00 59.70 59.50 3g3x h MET 6 Cb 0.23 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.06 3g3x h MET 6 CO -0.01 0.12 -0.25 -0.07 0.23 0.00 0.00 176.91 176.93 3g3x h LEU 7 N -0.54 0.39 -0.91 3.39 3.38 -1.06 -1.91 115.31 118.05 3g3x h LEU 7 Ca -0.02 -0.13 0.04 0.00 0.09 0.00 0.00 57.88 57.86 3g3x h LEU 7 Cb 0.42 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.00 3g3x h LEU 7 CO 0.04 0.65 0.59 -0.09 0.09 0.00 0.00 178.44 179.71 3g3x h ARG 8 N 0.35 1.09 -0.09 1.13 9.65 -1.02 0.24 114.38 125.74 3g3x h ARG 8 Ca 0.05 -0.07 -0.01 0.00 -1.10 0.00 0.00 59.98 58.86 3g3x h ARG 8 Cb 0.63 -0.25 -0.00 0.00 -1.39 0.00 0.00 29.97 28.96 3g3x h ARG 8 CO 0.05 0.72 0.03 0.82 2.80 0.00 0.00 179.97 184.39 3g3x h ILE 9 N 1.13 1.18 -0.14 1.20 2.04 -0.94 -0.97 117.51 121.00 3g3x h ILE 9 Ca 0.37 -0.54 -0.12 0.00 1.00 0.00 0.00 64.86 65.57 3g3x h ILE 9 Cb 0.03 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 3g3x h ILE 9 CO -0.13 0.15 -0.44 0.44 0.00 0.00 0.00 178.15 178.18 3g3x h ASP 10 N -0.05 0.35 0.00 1.72 3.32 -0.87 -3.32 116.42 117.57 3g3x h ASP 10 Ca 0.03 -0.16 -0.05 0.00 0.02 0.00 0.00 57.03 56.87 3g3x h ASP 10 Cb 0.22 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 3g3x h ASP 10 CO -0.00 0.74 -1.94 -0.62 -1.72 0.00 0.00 179.24 175.70 3g3x n GLU 11 N -4.00 0.66 -0.09 3.56 -0.58 0.79 -5.08 120.64 115.89 3g3x n GLU 11 Ca -0.02 -0.15 0.01 0.00 -0.42 0.00 0.00 57.16 56.58 3g3x n GLU 11 Cb 0.51 -1.46 -0.00 0.00 -0.57 0.00 0.00 31.44 29.91 3g3x n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3g3x n GLY 12 N 1.47 -1.85 2.72 0.62 0.00 -0.37 -4.27 105.19 103.52 3g3x n GLY 12 Ca -0.08 -1.33 -0.20 0.00 0.00 0.00 0.00 46.02 44.42 3g3x n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3g3x s LEU 13 N 0.00 0.08 -0.03 0.99 2.96 -1.26 -4.24 118.68 117.18 3g3x s LEU 13 Ca 0.00 -0.02 0.02 0.00 -0.22 0.00 0.00 54.13 53.91 3g3x s LEU 13 Cb 0.00 0.03 0.01 0.00 0.50 0.00 0.00 46.19 46.73 3g3x s LEU 13 CO 0.00 -0.28 -0.06 -0.13 -1.32 0.00 0.00 176.35 174.56 3g3x s ARG 14 N 2.22 0.85 0.00 1.98 0.52 -0.63 -5.00 118.95 118.89 3g3x s ARG 14 Ca 0.04 -0.20 0.24 0.00 -0.52 0.00 0.00 55.73 55.29 3g3x s ARG 14 Cb -0.13 -0.82 0.31 0.00 0.52 0.00 0.00 34.95 34.83 3g3x s ARG 14 CO -0.06 0.02 1.28 1.28 0.02 0.00 0.00 175.30 177.84 3g3x n LEU 15 N 3.61 1.04 -4.45 2.53 4.77 -1.26 0.39 117.00 123.62 3g3x n LEU 15 Ca -0.21 -0.33 -0.29 0.00 -0.03 0.00 0.00 56.01 55.15 3g3x n LEU 15 Cb 0.53 -0.11 -0.12 0.00 -2.33 0.00 0.00 43.42 41.39 3g3x n LEU 15 CO 0.24 0.22 -0.52 -0.54 -1.33 0.00 0.00 177.39 175.47 3g3x s LYS 16 N -2.77 1.71 0.16 3.23 1.02 -1.26 -0.91 119.74 120.91 3g3x s LYS 16 Ca 0.15 -1.21 -0.34 0.00 0.02 0.00 0.00 55.97 54.60 3g3x s LYS 16 Cb 0.18 -2.06 -0.15 0.00 -0.52 0.00 0.00 37.83 35.28 3g3x s LYS 16 CO 0.67 0.48 1.40 -0.89 -0.92 0.00 0.00 175.35 176.09 3g3x n ILE 17 N 0.93 0.35 -4.14 2.17 5.41 -0.67 -4.74 119.36 118.66 3g3x n ILE 17 Ca -0.16 -0.09 -0.11 0.00 1.00 0.00 0.00 62.75 63.39 3g3x n ILE 17 Cb 0.53 -1.19 -0.09 0.00 -0.71 0.00 0.00 39.64 38.18 3g3x n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 3g3x s TYR 18 N 0.40 0.92 -0.15 1.39 1.13 -0.23 -4.96 117.35 115.85 3g3x s TYR 18 Ca 0.77 -1.18 -0.10 0.00 -1.41 0.00 0.00 57.07 55.15 3g3x s TYR 18 Cb -0.78 -0.33 -0.05 0.00 -1.10 0.00 0.00 41.96 39.69 3g3x s TYR 18 CO 0.45 -0.75 0.19 0.15 -2.51 0.00 0.00 175.55 173.08 3g3x s LYS 19 N -4.12 3.94 0.00 -3.49 1.02 -1.26 0.15 119.74 115.98 3g3x s LYS 19 Ca 0.34 -0.08 0.00 0.00 0.02 0.00 0.00 55.97 56.25 3g3x s LYS 19 Cb 0.05 -3.33 0.00 0.00 -0.52 0.00 0.00 37.83 34.03 3g3x s LYS 19 CO 0.11 0.47 0.00 -0.40 -0.92 0.00 0.00 175.35 174.61 3g3x n ASP 20 N 2.90 -0.27 0.28 2.83 5.68 0.22 -4.79 116.55 123.41 3g3x n ASP 20 Ca -0.16 -0.78 0.15 0.00 -0.50 0.00 0.00 54.79 53.50 3g3x n ASP 20 Cb 0.53 0.00 0.84 0.00 -1.14 0.00 0.00 41.12 41.35 3g3x n ASP 20 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 3g3x h THR 21 N -1.07 0.40 -0.01 2.12 1.35 -1.99 -1.08 112.91 112.64 3g3x h THR 21 Ca 0.00 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.50 3g3x h THR 21 Cb 0.00 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 67.67 3g3x h THR 21 CO 0.00 0.07 -0.16 -0.62 -0.25 0.00 0.00 175.52 174.56 3g3x n GLU 22 N -3.52 1.35 -0.66 4.72 -0.58 -1.26 -4.93 120.64 115.76 3g3x n GLU 22 Ca -0.02 -0.88 0.00 0.00 -0.42 0.00 0.00 57.16 55.84 3g3x n GLU 22 Cb 0.19 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.58 3g3x n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3g3x n GLY 23 N 1.29 0.63 3.87 0.62 0.00 -0.41 -5.06 105.19 106.12 3g3x n GLY 23 Ca 0.15 -0.41 -0.37 0.00 0.00 0.00 0.00 46.02 45.39 3g3x n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g3x s TYR 24 N -2.00 3.64 0.24 1.61 2.02 -1.26 -4.72 117.35 116.87 3g3x s TYR 24 Ca 0.00 0.69 -0.31 0.00 -0.37 0.00 0.00 57.07 57.08 3g3x s TYR 24 Cb 0.00 -2.06 -0.11 0.00 -0.40 0.00 0.00 41.96 39.38 3g3x s TYR 24 CO 0.00 0.69 1.65 0.71 -1.57 0.00 0.00 175.55 177.03 3g3x s TYR 25 N -1.09 2.87 0.14 2.71 2.02 -1.21 -0.61 117.35 122.17 3g3x s TYR 25 Ca 0.20 0.55 -0.09 0.00 -0.37 0.00 0.00 57.07 57.36 3g3x s TYR 25 Cb -0.14 -4.08 -0.00 0.00 -0.40 0.00 0.00 41.96 37.33 3g3x s TYR 25 CO 0.09 -3.92 0.27 0.99 -1.57 0.00 0.00 175.55 171.41 3g3x s THR 26 N 0.70 0.09 0.15 -0.71 2.01 0.12 -1.16 115.64 116.84 3g3x s THR 26 Ca 0.70 -1.29 -0.19 0.00 0.31 0.00 0.00 61.69 61.22 3g3x s THR 26 Cb -0.48 -1.68 0.04 0.00 0.01 0.00 0.00 72.50 70.40 3g3x s THR 26 CO 0.38 -0.39 0.50 -0.51 -0.69 0.00 0.00 174.62 173.91 3g3x s ILE 27 N -3.93 0.04 0.00 1.82 2.07 -0.53 -1.07 121.20 119.60 3g3x s ILE 27 Ca 0.13 -0.43 0.00 0.00 -1.41 0.00 0.00 60.65 58.94 3g3x s ILE 27 Cb 0.04 -1.21 0.00 0.00 0.13 0.00 0.00 42.46 41.42 3g3x s ILE 27 CO -0.03 -0.17 0.00 0.61 -1.91 0.00 0.00 174.94 173.44 3g3x n GLY 28 N -0.30 1.68 3.05 1.50 0.00 0.16 -1.54 105.19 109.74 3g3x n GLY 28 Ca -0.15 -0.45 -0.40 0.00 0.00 0.00 0.00 46.02 45.02 3g3x n GLY 28 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3g3x n ILE 29 N 0.00 4.20 -2.07 -0.61 5.41 -1.26 -1.60 119.36 123.43 3g3x n ILE 29 Ca 0.00 -5.50 -0.13 0.00 1.00 0.00 0.00 62.75 58.12 3g3x n ILE 29 Cb 0.00 -2.29 -0.02 0.00 -0.71 0.00 0.00 39.64 36.62 3g3x n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3g3x n GLY 30 N 1.87 0.14 3.53 7.39 0.00 -1.25 -4.88 105.19 112.00 3g3x n GLY 30 Ca 0.25 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 3g3x n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3g3x s HIS 31 N -2.61 2.64 0.08 1.61 5.04 -0.59 -4.93 115.29 116.54 3g3x s HIS 31 Ca 0.00 0.03 -0.31 0.00 -1.54 0.00 0.00 55.06 53.24 3g3x s HIS 31 Cb 0.00 -4.32 -0.08 0.00 0.04 0.00 0.00 32.58 28.22 3g3x s HIS 31 CO 0.00 -1.58 1.54 -1.17 -2.34 0.00 0.00 174.74 171.20 3g3x s LEU 32 N 4.54 4.36 -0.20 8.88 2.96 -1.26 -1.46 118.68 136.50 3g3x s LEU 32 Ca 0.34 2.41 -0.14 0.00 -0.22 0.00 0.00 54.13 56.52 3g3x s LEU 32 Cb -0.11 -3.57 -0.20 0.00 0.50 0.00 0.00 46.19 42.81 3g3x s LEU 32 CO 0.19 -0.80 0.12 0.18 -1.32 0.00 0.00 176.35 174.72 3g3x n LEU 33 N 4.95 2.22 -3.56 -0.68 4.77 -0.31 -4.97 117.00 119.41 3g3x n LEU 33 Ca 0.14 0.29 -0.08 0.00 -0.03 0.00 0.00 56.01 56.33 3g3x n LEU 33 Cb 0.41 -0.98 -0.04 0.00 -2.33 0.00 0.00 43.42 40.48 3g3x n LEU 33 CO 0.61 0.56 0.81 0.28 -1.33 0.00 0.00 177.39 178.32 3g3x s THR 34 N -2.46 0.00 -2.55 -5.08 -1.32 -1.21 -4.90 115.64 98.11 3g3x s THR 34 Ca -0.29 0.00 0.26 0.00 -1.21 0.00 0.00 61.69 60.45 3g3x s THR 34 Cb 0.08 -1.00 0.39 0.00 -1.51 0.00 0.00 72.50 70.46 3g3x s THR 34 CO 0.63 0.00 1.55 0.29 -2.21 0.00 0.00 174.62 174.88 3g3x n LYS 35 N 0.28 1.76 -2.02 7.08 5.02 -1.26 -3.35 118.16 125.68 3g3x n LYS 35 Ca -0.07 -1.21 -0.41 0.00 -2.02 0.00 0.00 58.31 54.60 3g3x n LYS 35 Cb 0.59 -1.47 -0.02 0.00 -0.02 0.00 0.00 35.03 34.11 3g3x n LYS 35 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3g3x s SER 36 N -2.07 6.64 0.00 4.39 0.15 -1.26 -4.91 113.70 116.64 3g3x s SER 36 Ca 0.33 2.78 0.22 0.00 0.70 0.00 0.00 55.95 59.98 3g3x s SER 36 Cb 0.20 -2.65 1.12 0.00 -1.71 0.00 0.00 66.02 62.99 3g3x s SER 36 CO 0.35 -0.65 1.72 -2.65 1.20 0.00 0.00 173.24 173.22 3g3x n PRO 37 N 0.96 0.32 -3.01 5.44 -0.02 -1.26 -4.69 135.00 132.73 3g3x n PRO 37 Ca 0.01 0.08 -0.42 0.00 -2.02 0.00 0.00 63.50 61.15 3g3x n PRO 37 Cb 0.41 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.33 3g3x n PRO 37 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3g3x s SER 38 N -2.57 6.59 0.32 2.55 0.15 -1.26 -4.93 113.70 114.55 3g3x s SER 38 Ca 0.21 0.55 -0.00 0.00 0.70 0.00 0.00 55.95 57.41 3g3x s SER 38 Cb 0.15 -2.38 0.53 0.00 -1.71 0.00 0.00 66.02 62.61 3g3x s SER 38 CO 0.34 -0.57 1.97 0.25 1.20 0.00 0.00 173.24 176.43 3g3x h LEU 39 N 9.35 0.83 -0.88 3.45 5.85 -2.00 -1.66 115.31 130.26 3g3x h LEU 39 Ca -0.25 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.42 3g3x h LEU 39 Cb 1.10 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.88 3g3x h LEU 39 CO 0.85 0.62 0.48 0.78 -0.34 0.00 0.00 178.44 180.84 3g3x h ASN 40 N 0.97 1.11 -0.80 1.25 2.35 -1.98 0.37 115.58 118.85 3g3x h ASN 40 Ca 0.26 -0.10 -0.02 0.00 -0.55 0.00 0.00 56.30 55.89 3g3x h ASN 40 Cb -0.07 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 37.98 3g3x h ASN 40 CO -0.05 0.89 0.43 0.00 -1.65 0.00 0.00 177.43 177.05 3g3x h ALA 41 N 1.26 1.03 -0.63 -0.83 0.00 -1.78 -1.31 119.26 116.99 3g3x h ALA 41 Ca 0.31 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 3g3x h ALA 41 Cb 0.03 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 3g3x h ALA 41 CO -0.05 0.54 0.11 0.00 0.00 0.00 0.00 179.25 179.86 3g3x h ALA 42 N 1.23 0.84 -0.61 0.00 0.00 -0.61 -1.92 119.26 118.18 3g3x h ALA 42 Ca 0.28 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 3g3x h ALA 42 Cb 0.05 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 3g3x h ALA 42 CO -0.04 0.59 0.17 0.87 0.00 0.00 0.00 179.25 180.84 3g3x h LYS 43 N 0.96 0.94 -0.72 0.00 1.57 -0.66 -1.02 116.57 117.65 3g3x h LYS 43 Ca 0.19 -0.19 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 3g3x h LYS 43 Cb 0.42 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.56 3g3x h LYS 43 CO 0.01 0.83 0.17 0.77 -0.57 0.00 0.00 179.45 180.66 3g3x h SER 44 N 0.91 1.08 -0.76 0.86 0.02 -0.99 -1.08 113.55 113.59 3g3x h SER 44 Ca 0.20 -0.23 -0.05 0.00 -0.84 0.00 0.00 61.79 60.87 3g3x h SER 44 Cb 0.30 -0.29 -0.03 0.00 0.14 0.00 0.00 62.40 62.52 3g3x h SER 44 CO -0.00 1.04 0.27 -0.33 -1.14 0.00 0.00 176.83 176.66 3g3x h GLU 45 N 1.08 1.16 -0.12 3.45 4.39 -0.99 -2.27 114.58 121.30 3g3x h GLU 45 Ca 0.22 -0.23 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 3g3x h GLU 45 Cb 0.37 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 3g3x h GLU 45 CO 0.00 0.97 0.05 1.25 -1.16 0.00 0.00 179.01 180.11 3g3x h LEU 46 N 1.12 0.16 -0.78 1.33 5.85 -0.76 0.09 115.31 122.32 3g3x h LEU 46 Ca 0.25 -0.16 0.05 0.00 0.84 0.00 0.00 57.88 58.86 3g3x h LEU 46 Cb 0.26 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.19 3g3x h LEU 46 CO -0.01 0.28 0.47 0.44 -0.34 0.00 0.00 178.44 179.28 3g3x h ASP 47 N 0.03 0.75 -0.53 1.25 3.32 -1.14 0.01 116.42 120.10 3g3x h ASP 47 Ca 0.04 0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.03 3g3x h ASP 47 Cb 0.17 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 3g3x h ASP 47 CO -0.00 0.49 0.04 0.50 -1.72 0.00 0.00 179.24 178.55 3g3x h LYS 48 N 0.88 0.91 -0.59 3.56 3.64 -1.19 0.14 116.57 123.92 3g3x h LYS 48 Ca 0.34 -0.27 -0.08 0.00 -1.27 0.00 0.00 60.65 59.36 3g3x h LYS 48 Cb 0.14 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 3g3x h LYS 48 CO -0.16 0.91 0.05 0.00 -2.27 0.00 0.00 179.45 177.98 3g3x h ALA 49 N 0.97 0.80 0.00 5.00 0.00 -0.21 -3.25 119.26 122.56 3g3x h ALA 49 Ca 0.16 -0.28 -0.22 0.00 0.00 0.00 0.00 54.91 54.57 3g3x h ALA 49 Cb 0.47 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 3g3x h ALA 49 CO 0.02 0.59 -1.38 0.82 0.00 0.00 0.00 179.25 179.30 3g3x h ILE 50 N 0.91 0.83 0.00 0.00 1.08 -0.97 -3.49 117.51 115.88 3g3x h ILE 50 Ca 0.18 -2.49 0.00 0.00 -0.39 0.00 0.00 64.86 62.16 3g3x h ILE 50 Cb 0.49 2.33 0.00 0.00 -3.07 0.00 0.00 36.82 36.57 3g3x h ILE 50 CO 0.02 0.48 0.00 0.61 -0.69 0.00 0.00 178.15 178.57 3g3x n GLY 51 N 1.43 0.87 3.41 5.37 0.00 0.45 -5.07 105.19 111.66 3g3x n GLY 51 Ca -0.10 -0.56 -0.12 0.00 0.00 0.00 0.00 46.02 45.24 3g3x n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3g3x s ARG 52 N -1.96 1.24 -0.69 1.61 1.70 -1.03 -5.05 118.95 114.79 3g3x s ARG 52 Ca 0.00 -0.47 -0.27 0.00 -0.47 0.00 0.00 55.73 54.53 3g3x s ARG 52 Cb 0.00 0.57 0.01 0.00 -0.57 0.00 0.00 34.95 34.96 3g3x s ARG 52 CO 0.00 -0.53 1.54 1.21 -1.08 0.00 0.00 175.30 176.44 3g3x s ASN 53 N -2.69 5.76 0.72 -2.89 2.47 -1.26 -4.40 114.94 112.65 3g3x s ASN 53 Ca 0.01 -0.11 -0.04 0.00 0.42 0.00 0.00 52.86 53.13 3g3x s ASN 53 Cb -0.01 -2.55 0.10 0.00 -1.45 0.00 0.00 41.25 37.34 3g3x s ASN 53 CO -0.12 -2.08 1.00 0.42 -3.72 0.00 0.00 177.10 172.60 3g3x s THR 54 N 7.25 2.26 -0.33 -5.21 -4.23 -1.26 -5.01 115.64 109.12 3g3x s THR 54 Ca 0.50 -0.42 0.08 0.00 -1.18 0.00 0.00 61.69 60.67 3g3x s THR 54 Cb -0.10 -2.84 0.57 0.00 1.34 0.00 0.00 72.50 71.46 3g3x s THR 54 CO 0.17 0.00 1.61 -0.46 -0.54 0.00 0.00 174.62 175.40 3g3x n ASN 55 N -2.90 3.04 0.00 3.99 6.94 -1.26 -4.84 115.26 120.23 3g3x n ASN 55 Ca 0.11 -3.66 0.00 0.00 -0.02 0.00 0.00 54.58 51.02 3g3x n ASN 55 Cb 0.60 -0.69 0.00 0.00 -2.36 0.00 0.00 39.78 37.33 3g3x n ASN 55 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3g3x n GLY 56 N -1.04 0.55 3.03 4.83 0.00 -1.26 -5.02 105.19 106.28 3g3x n GLY 56 Ca 0.40 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.21 3g3x n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g3x s VAL 57 N -2.14 0.90 0.38 1.61 1.01 -1.26 -1.68 120.40 119.22 3g3x s VAL 57 Ca 0.00 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.61 3g3x s VAL 57 Cb 0.00 -0.79 -0.07 0.00 0.00 0.00 0.00 36.38 35.53 3g3x s VAL 57 CO 0.00 0.27 0.04 0.27 0.00 0.00 0.00 175.10 175.68 3g3x s ILE 58 N 0.15 1.52 0.57 2.22 -4.36 -0.09 -4.90 121.20 116.32 3g3x s ILE 58 Ca -0.03 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 58.34 3g3x s ILE 58 Cb -0.09 -2.82 0.02 0.00 1.25 0.00 0.00 42.46 40.83 3g3x s ILE 58 CO 0.01 0.00 0.83 0.42 0.24 0.00 0.00 174.94 176.44 3g3x s THR 59 N -3.00 3.16 0.21 8.37 -4.23 -1.26 -4.80 115.64 114.09 3g3x s THR 59 Ca 0.33 -0.37 -0.09 0.00 -1.18 0.00 0.00 61.69 60.38 3g3x s THR 59 Cb 0.08 -3.23 0.16 0.00 1.34 0.00 0.00 72.50 70.85 3g3x s THR 59 CO 0.16 -0.20 1.83 0.50 -0.54 0.00 0.00 174.62 176.36 3g3x h LYS 60 N -0.06 1.09 -0.70 3.99 3.64 -1.99 -0.22 116.57 122.32 3g3x h LYS 60 Ca -0.44 -0.13 0.02 0.00 -1.27 0.00 0.00 60.65 58.83 3g3x h LYS 60 Cb 1.28 -0.21 -0.04 0.00 -0.41 0.00 0.00 32.23 32.85 3g3x h LYS 60 CO 0.57 0.81 0.45 -0.44 -2.27 0.00 0.00 179.45 178.57 3g3x h ASP 61 N 1.08 0.76 -0.56 4.20 5.19 -1.99 0.14 116.42 125.24 3g3x h ASP 61 Ca 0.27 -0.01 -0.06 0.00 -0.62 0.00 0.00 57.03 56.62 3g3x h ASP 61 Cb 0.03 -0.18 -0.02 0.00 0.18 0.00 0.00 39.33 39.34 3g3x h ASP 61 CO -0.04 0.54 0.13 -0.33 -3.12 0.00 0.00 179.24 176.41 3g3x h GLU 62 N 0.90 0.91 -0.81 3.56 5.08 -1.83 -0.60 114.58 121.79 3g3x h GLU 62 Ca 0.27 -0.22 0.02 0.00 -1.00 0.00 0.00 59.36 58.43 3g3x h GLU 62 Cb -0.05 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.04 3g3x h GLU 62 CO -0.08 0.85 0.52 0.00 -1.00 0.00 0.00 179.01 179.30 3g3x h ALA 63 N 1.02 1.04 0.00 3.43 0.00 -0.53 -1.98 119.26 122.25 3g3x h ALA 63 Ca 0.17 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 3g3x h ALA 63 Cb 0.36 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3g3x h ALA 63 CO 0.00 0.37 -0.48 0.93 0.00 0.00 0.00 179.25 180.08 3g3x h GLU 64 N 1.04 0.00 -0.07 0.00 5.08 -0.62 -1.58 114.58 118.42 3g3x h GLU 64 Ca 0.31 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.66 3g3x h GLU 64 Cb -0.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.20 3g3x h GLU 64 CO -0.09 0.48 0.00 -0.22 -1.00 0.00 0.00 179.01 178.18 3g3x h LYS 65 N 0.00 0.13 -0.92 2.33 3.64 -0.52 -0.75 116.57 120.48 3g3x h LYS 65 Ca -0.00 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.38 3g3x h LYS 65 Cb 0.93 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.68 3g3x h LYS 65 CO 0.06 0.40 0.60 -0.07 -2.27 0.00 0.00 179.45 178.17 3g3x h LEU 66 N -0.15 0.96 -0.14 5.20 3.38 -1.26 -1.81 115.31 121.49 3g3x h LEU 66 Ca 0.02 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3g3x h LEU 66 Cb 0.34 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3g3x h LEU 66 CO 0.00 0.63 0.05 0.15 0.09 0.00 0.00 178.44 179.37 3g3x h PHE 67 N 1.10 0.21 -0.52 1.13 3.57 -1.03 0.14 116.94 121.55 3g3x h PHE 67 Ca 0.38 -0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.94 3g3x h PHE 67 Cb 0.11 -0.06 -0.06 0.00 2.79 0.00 0.00 35.95 38.73 3g3x h PHE 67 CO -0.00 0.30 0.17 -0.91 -2.23 0.00 0.00 178.31 175.64 3g3x h ASN 68 N 0.06 0.15 -0.72 0.41 2.35 -0.90 0.11 115.58 117.04 3g3x h ASN 68 Ca 0.05 0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.85 3g3x h ASN 68 Cb 0.18 0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.58 3g3x h ASN 68 CO -0.00 0.11 0.40 1.56 -1.65 0.00 0.00 177.43 177.85 3g3x h GLN 69 N 0.34 1.01 -0.44 0.81 4.20 -1.00 -1.83 115.11 118.20 3g3x h GLN 69 Ca 0.25 -0.11 -0.15 0.00 0.06 0.00 0.00 58.65 58.70 3g3x h GLN 69 Cb 0.29 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 3g3x h GLN 69 CO -0.27 0.75 -0.30 -0.44 -0.67 0.00 0.00 178.83 177.90 3g3x h ASP 70 N 1.00 1.02 -0.26 1.46 3.32 -0.05 0.12 116.42 123.03 3g3x h ASP 70 Ca 0.26 -0.43 -0.03 0.00 0.02 0.00 0.00 57.03 56.85 3g3x h ASP 70 Cb 0.03 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.28 3g3x h ASP 70 CO -0.04 1.23 0.06 0.58 -1.72 0.00 0.00 179.24 179.35 3g3x h VAL 71 N 0.82 1.22 -0.83 -1.35 2.07 -0.92 -0.91 116.25 116.34 3g3x h VAL 71 Ca 0.09 -0.72 0.03 0.00 0.82 0.00 0.00 66.70 66.91 3g3x h VAL 71 Cb 0.89 1.20 -0.05 0.00 -1.52 0.00 0.00 31.29 31.81 3g3x h VAL 71 CO 0.08 0.23 0.54 -0.78 0.02 0.00 0.00 177.57 177.66 3g3x h ASP 72 N 0.24 0.90 -0.52 0.57 3.58 -1.19 -1.68 116.42 118.31 3g3x h ASP 72 Ca 0.08 -0.01 -0.05 0.00 0.42 0.00 0.00 57.03 57.47 3g3x h ASP 72 Cb 0.30 -0.20 -0.03 0.00 1.72 0.00 0.00 39.33 41.12 3g3x h ASP 72 CO 0.00 0.62 0.14 0.00 -2.88 0.00 0.00 179.24 177.13 3g3x h ALA 73 N 1.34 1.18 -0.34 -0.78 0.00 -0.50 -0.37 119.26 119.78 3g3x h ALA 73 Ca 0.33 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 3g3x h ALA 73 Cb -0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 3g3x h ALA 73 CO -0.11 0.56 0.01 0.00 0.00 0.00 0.00 179.25 179.71 3g3x h ALA 74 N 1.31 0.46 -0.33 0.00 0.00 -0.51 0.57 119.26 120.75 3g3x h ALA 74 Ca 0.18 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3g3x h ALA 74 Cb 0.30 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3g3x h ALA 74 CO -0.00 0.21 0.16 0.28 0.00 0.00 0.00 179.25 179.90 3g3x h VAL 75 N 0.40 1.15 -0.46 0.00 2.07 -1.13 -1.38 116.25 116.91 3g3x h VAL 75 Ca 0.10 -0.43 -0.05 0.00 0.82 0.00 0.00 66.70 67.14 3g3x h VAL 75 Cb 0.43 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 3g3x h VAL 75 CO 0.02 0.16 0.09 0.03 0.02 0.00 0.00 177.57 177.88 3g3x h ARG 76 N 0.40 0.70 -0.63 1.57 3.08 -0.95 -1.16 114.38 117.38 3g3x h ARG 76 Ca 0.11 -0.14 -0.09 0.00 0.07 0.00 0.00 59.98 59.93 3g3x h ARG 76 Cb 0.11 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 3g3x h ARG 76 CO -0.02 0.65 0.04 0.78 -1.07 0.00 0.00 179.97 180.35 3g3x h GLY 77 N 0.90 1.18 0.90 0.04 0.00 -0.62 -1.93 103.07 103.55 3g3x h GLY 77 Ca 0.15 -0.84 -0.01 0.00 0.00 0.00 0.00 47.33 46.63 3g3x h GLY 77 CO 0.00 0.77 0.10 -2.22 0.00 0.00 0.00 176.54 175.19 3g3x h ILE 78 N 1.01 1.17 0.00 2.60 2.04 -0.74 -2.79 117.51 120.79 3g3x h ILE 78 Ca 0.18 -0.50 -0.02 0.00 1.00 0.00 0.00 64.86 65.53 3g3x h ILE 78 Cb 0.52 1.05 -0.00 0.00 -0.74 0.00 0.00 36.82 37.65 3g3x h ILE 78 CO 0.03 0.17 -0.08 -0.07 0.00 0.00 0.00 178.15 178.19 3g3x h LEU 79 N 0.24 0.00 -0.16 1.44 3.38 -1.07 -2.49 115.31 116.65 3g3x h LEU 79 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3g3x h LEU 79 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 3g3x h LEU 79 CO -0.01 0.08 -0.49 -2.11 0.09 0.00 0.00 178.44 176.01 3g3x n ARG 80 N -3.20 0.26 -3.48 1.13 1.85 -0.74 -4.81 116.66 107.68 3g3x n ARG 80 Ca 0.01 -0.16 -0.37 0.00 -1.00 0.00 0.00 57.85 56.33 3g3x n ARG 80 Cb 0.37 -1.50 -0.07 0.00 -1.05 0.00 0.00 32.46 30.21 3g3x n ARG 80 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 3g3x s ASN 81 N -2.85 6.45 0.45 2.89 3.84 -0.96 -4.98 114.94 119.79 3g3x s ASN 81 Ca 0.14 0.53 0.21 0.00 0.21 0.00 0.00 52.86 53.95 3g3x s ASN 81 Cb 0.18 -2.20 1.10 0.00 -0.55 0.00 0.00 41.25 39.77 3g3x s ASN 81 CO 0.67 0.04 1.95 0.00 -2.79 0.00 0.00 177.10 176.97 3g3x h ALA 82 N 6.90 1.33 0.10 1.71 0.00 -1.90 -1.19 119.26 126.21 3g3x h ALA 82 Ca -0.40 -0.20 -0.32 0.00 0.00 0.00 0.00 54.91 54.00 3g3x h ALA 82 Cb 1.17 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 3g3x h ALA 82 CO 0.74 0.28 -1.66 0.87 0.00 0.00 0.00 179.25 179.48 3g3x h LYS 83 N 0.00 0.21 0.08 0.00 1.57 -1.93 -3.40 116.57 113.10 3g3x h LYS 83 Ca -0.00 -0.36 -0.30 0.00 -1.87 0.00 0.00 60.65 58.12 3g3x h LYS 83 Cb 0.49 0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 3g3x h LYS 83 CO 0.03 1.03 -1.55 -0.07 -0.57 0.00 0.00 179.45 178.33 3g3x h LEU 84 N 0.06 0.26 -0.17 2.94 3.38 -1.76 -3.37 115.31 116.65 3g3x h LEU 84 Ca -0.29 -0.40 0.03 0.00 0.09 0.00 0.00 57.88 57.32 3g3x h LEU 84 Cb 2.02 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 42.65 3g3x h LEU 84 CO 0.13 1.34 -0.03 0.50 0.09 0.00 0.00 178.44 180.47 3g3x h LYS 85 N 0.05 0.02 -1.00 1.13 3.64 -0.98 -0.54 116.57 118.88 3g3x h LYS 85 Ca -0.24 -0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.18 3g3x h LYS 85 Cb 1.99 -0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 33.74 3g3x h LYS 85 CO 0.13 0.01 0.66 -1.35 -2.27 0.00 0.00 179.45 176.63 3g3x h PRO 86 N 0.02 1.22 0.05 1.90 0.11 -1.78 0.95 132.00 134.46 3g3x h PRO 86 Ca 0.08 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 66.12 3g3x h PRO 86 Cb 0.12 -0.28 0.00 0.00 0.11 0.00 0.00 31.00 30.95 3g3x h PRO 86 CO -0.16 0.81 -0.02 0.28 -0.21 0.00 0.00 178.00 178.69 3g3x h VAL 87 N 1.26 1.15 -0.39 3.15 2.07 -1.60 -2.27 116.25 119.61 3g3x h VAL 87 Ca 0.40 -0.63 0.07 0.00 0.82 0.00 0.00 66.70 67.36 3g3x h VAL 87 Cb 0.01 1.57 -0.06 0.00 -1.52 0.00 0.00 31.29 31.29 3g3x h VAL 87 CO -0.13 0.16 -0.01 0.22 0.02 0.00 0.00 177.57 177.83 3g3x h TYR 88 N -0.34 -0.05 -0.24 1.57 3.20 -0.82 -1.48 116.97 118.81 3g3x h TYR 88 Ca -0.01 0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.94 3g3x h TYR 88 Cb 0.31 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 3g3x h TYR 88 CO 0.02 -0.09 0.16 -0.44 -1.64 0.00 0.00 178.16 176.17 3g3x h ASP 89 N 0.09 0.09 1.02 -2.11 3.32 -0.74 -2.15 116.42 115.94 3g3x h ASP 89 Ca 0.19 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3g3x h ASP 89 Cb 0.27 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.80 3g3x h ASP 89 CO -0.33 0.06 -0.08 -1.54 -1.72 0.00 0.00 179.24 175.63 3g3x n SER 90 N -4.49 0.24 -4.94 6.45 3.41 -0.58 -4.90 113.62 108.81 3g3x n SER 90 Ca 0.02 0.41 -0.25 0.00 -0.26 0.00 0.00 58.87 58.79 3g3x n SER 90 Cb 0.24 -0.44 -0.02 0.00 -0.26 0.00 0.00 64.21 63.73 3g3x n SER 90 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3g3x s LEU 91 N -3.33 4.15 0.96 1.04 1.43 -0.81 -5.06 118.68 117.05 3g3x s LEU 91 Ca 0.13 0.39 -0.13 0.00 -1.03 0.00 0.00 54.13 53.49 3g3x s LEU 91 Cb 0.17 -3.20 0.16 0.00 0.03 0.00 0.00 46.19 43.36 3g3x s LEU 91 CO 0.57 -0.15 1.14 1.51 0.23 0.00 0.00 176.35 179.65 3g3x s ASP 92 N -3.62 3.09 0.34 2.29 -4.77 -1.26 -4.80 116.67 107.95 3g3x s ASP 92 Ca 0.39 0.90 0.06 0.00 -3.30 0.00 0.00 52.55 50.59 3g3x s ASP 92 Cb -0.10 -1.41 0.63 0.00 -1.09 0.00 0.00 42.92 40.95 3g3x s ASP 92 CO 0.32 -2.81 1.87 0.00 0.70 0.00 0.00 175.17 175.25 3g3x h ALA 93 N -1.67 1.38 -0.05 2.11 0.00 -1.98 -0.42 119.26 118.63 3g3x h ALA 93 Ca -0.50 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.17 3g3x h ALA 93 Cb 1.32 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 3g3x h ALA 93 CO 0.57 0.43 -0.04 0.28 0.00 0.00 0.00 179.25 180.49 3g3x h VAL 94 N 0.41 1.36 0.00 0.00 2.07 -1.94 -2.63 116.25 115.53 3g3x h VAL 94 Ca 0.08 -1.14 -0.08 0.00 0.82 0.00 0.00 66.70 66.38 3g3x h VAL 94 Cb 0.38 2.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.16 3g3x h VAL 94 CO 0.02 0.31 -0.40 0.03 0.02 0.00 0.00 177.57 177.55 3g3x h ARG 95 N -0.32 0.00 -0.74 1.57 3.08 -1.81 -2.24 114.38 113.92 3g3x h ARG 95 Ca 0.01 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.10 3g3x h ARG 95 Cb 0.52 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.52 3g3x h ARG 95 CO 0.01 0.40 0.45 0.00 -1.07 0.00 0.00 179.97 179.75 3g3x h ARG 96 N 0.00 0.82 -0.96 0.04 3.08 -1.04 -1.56 114.38 114.76 3g3x h ARG 96 Ca -0.00 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.00 3g3x h ARG 96 Cb 0.71 -0.19 -0.05 0.00 0.08 0.00 0.00 29.97 30.53 3g3x h ARG 96 CO 0.05 0.55 0.61 0.00 -1.07 0.00 0.00 179.97 180.11 3g3x h ALA 97 N 1.34 1.27 -0.92 0.04 0.00 -1.02 -0.88 119.26 119.09 3g3x h ALA 97 Ca 0.31 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 3g3x h ALA 97 Cb 0.10 -0.39 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 3g3x h ALA 97 CO -0.14 0.65 0.53 0.00 0.00 0.00 0.00 179.25 180.28 3g3x h ALA 98 N 1.37 1.19 -0.38 0.00 0.00 -1.04 0.37 119.26 120.76 3g3x h ALA 98 Ca 0.35 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 55.02 3g3x h ALA 98 Cb -0.11 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.30 3g3x h ALA 98 CO -0.07 0.67 -0.21 1.25 0.00 0.00 0.00 179.25 180.88 3g3x h LEU 99 N 1.29 0.85 -0.90 0.00 5.85 -0.81 -2.10 115.31 119.49 3g3x h LEU 99 Ca 0.33 -0.42 0.03 0.00 0.84 0.00 0.00 57.88 58.66 3g3x h LEU 99 Cb -0.01 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 40.74 3g3x h LEU 99 CO -0.06 1.08 0.59 0.40 -0.34 0.00 0.00 178.44 180.11 3g3x h ILE 100 N 0.62 1.17 -0.13 4.05 2.04 -0.87 -1.49 117.51 122.90 3g3x h ILE 100 Ca 0.08 -0.40 0.03 0.00 1.00 0.00 0.00 64.86 65.58 3g3x h ILE 100 Cb 0.77 -0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 3g3x h ILE 100 CO 0.06 0.21 -0.07 -1.13 0.00 0.00 0.00 178.15 177.23 3g3x h ASN 101 N 1.15 -0.22 -0.53 1.72 -0.73 -0.68 0.14 115.58 116.43 3g3x h ASN 101 Ca 0.35 0.05 0.04 0.00 1.87 0.00 0.00 56.30 58.61 3g3x h ASN 101 Cb -0.03 0.12 -0.04 0.00 0.27 0.00 0.00 38.32 38.64 3g3x h ASN 101 CO -0.11 -0.09 0.29 0.24 -0.37 0.00 0.00 177.43 177.39 3g3x h MET 102 N -0.06 0.55 -0.57 6.67 2.86 -0.99 -1.83 114.93 121.57 3g3x h MET 102 Ca 0.07 -0.03 -0.08 0.00 -2.06 0.00 0.00 59.70 57.59 3g3x h MET 102 Cb 0.17 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 3g3x h MET 102 CO -0.16 0.37 0.02 0.28 1.06 0.00 0.00 176.91 178.48 3g3x h VAL 103 N 0.57 1.26 -0.56 -2.22 2.07 -0.90 -0.30 116.25 116.17 3g3x h VAL 103 Ca 0.22 -1.08 0.07 0.00 0.82 0.00 0.00 66.70 66.73 3g3x h VAL 103 Cb 0.09 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 30.59 3g3x h VAL 103 CO -0.13 0.39 0.25 0.15 0.02 0.00 0.00 177.57 178.25 3g3x h PHE 104 N 0.90 0.45 0.00 1.57 3.04 -0.38 0.26 116.94 122.78 3g3x h PHE 104 Ca 0.17 0.02 -0.20 0.00 3.98 0.00 0.00 57.97 61.94 3g3x h PHE 104 Cb 0.49 -0.12 0.02 0.00 2.56 0.00 0.00 35.95 38.90 3g3x h PHE 104 CO 0.03 0.18 -0.79 0.37 -2.02 0.00 0.00 178.31 176.08 3g3x h GLN 105 N 0.47 0.53 0.00 1.11 4.15 -1.01 -3.39 115.11 116.97 3g3x h GLN 105 Ca 0.27 -0.57 0.00 0.00 0.77 0.00 0.00 58.65 59.11 3g3x h GLN 105 Cb 0.25 0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.10 3g3x h GLN 105 CO -0.23 1.20 -0.86 -1.33 -1.93 0.00 0.00 178.83 175.69 3g3x n MET 106 N -4.07 2.40 0.00 1.69 2.81 -0.15 -5.12 117.12 114.68 3g3x n MET 106 Ca -0.11 -0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.75 3g3x n MET 106 Cb 0.76 -1.05 0.00 0.00 -0.71 0.00 0.00 33.22 32.22 3g3x n MET 106 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g3x n GLY 107 N 1.55 -0.13 0.17 3.03 0.00 0.90 -4.21 105.19 106.49 3g3x n GLY 107 Ca 0.00 -1.64 -0.10 0.00 0.00 0.00 0.00 46.02 44.28 3g3x n GLY 107 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3g3x h GLU 108 N 0.00 -0.17 -0.81 1.61 4.81 -1.93 -2.49 114.58 115.59 3g3x h GLU 108 Ca 0.00 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 3g3x h GLU 108 Cb 0.00 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.38 3g3x h GLU 108 CO 0.00 -0.11 0.42 1.15 -0.73 0.00 0.00 179.01 179.74 3g3x h THR 109 N -0.17 1.24 -0.10 0.32 2.02 -1.96 -1.54 112.91 112.71 3g3x h THR 109 Ca 0.07 -0.64 -0.00 0.00 0.77 0.00 0.00 66.41 66.61 3g3x h THR 109 Cb 0.27 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 66.85 3g3x h THR 109 CO -0.17 0.28 0.04 1.23 0.37 0.00 0.00 175.52 177.27 3g3x h GLY 110 N 1.16 0.16 1.65 2.16 0.00 -1.66 -2.88 103.07 103.67 3g3x h GLY 110 Ca 0.28 -0.09 -0.14 0.00 0.00 0.00 0.00 47.33 47.39 3g3x h GLY 110 CO -0.04 0.08 -0.49 -2.08 0.00 0.00 0.00 176.54 174.00 3g3x h VAL 111 N 0.02 1.33 0.00 4.60 2.07 -1.34 -2.79 116.25 120.15 3g3x h VAL 111 Ca 0.03 -1.72 -0.00 0.00 0.82 0.00 0.00 66.70 65.83 3g3x h VAL 111 Cb 0.15 1.77 -0.00 0.00 -1.52 0.00 0.00 31.29 31.68 3g3x h VAL 111 CO -0.00 0.52 -0.02 0.00 0.02 0.00 0.00 177.57 178.09 3g3x h ALA 112 N 1.18 1.09 0.00 1.67 0.00 -1.16 -1.11 119.26 120.93 3g3x h ALA 112 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3g3x h ALA 112 Cb 0.98 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3g3x h ALA 112 CO 0.08 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.77 3g3x n GLY 113 N -0.80 -1.53 2.25 0.00 0.00 -1.05 -4.24 105.19 99.82 3g3x n GLY 113 Ca -0.02 -0.05 -0.20 0.00 0.00 0.00 0.00 46.02 45.75 3g3x n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3g3x n PHE 114 N -1.85 0.91 -0.15 1.61 3.01 -0.42 -4.72 117.46 115.83 3g3x n PHE 114 Ca 0.06 -1.86 -0.02 0.00 1.01 0.00 0.00 57.45 56.63 3g3x n PHE 114 Cb 0.36 -1.73 0.05 0.00 -0.01 0.00 0.00 39.48 38.15 3g3x n PHE 114 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 3g3x h THR 115 N 2.65 0.59 -0.36 4.37 2.02 -1.84 0.04 112.91 120.38 3g3x h THR 115 Ca 0.41 -0.03 -0.17 0.00 0.77 0.00 0.00 66.41 67.40 3g3x h THR 115 Cb 0.77 0.50 -0.00 0.00 -1.74 0.00 0.00 68.15 67.68 3g3x h THR 115 CO 0.91 0.02 -0.43 0.78 0.37 0.00 0.00 175.52 177.16 3g3x h ASN 116 N 0.09 0.99 -0.44 4.18 2.35 -1.97 -2.12 115.58 118.67 3g3x h ASN 116 Ca 0.24 -0.49 -0.03 0.00 -0.55 0.00 0.00 56.30 55.48 3g3x h ASN 116 Cb 0.37 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 3g3x h ASN 116 CO -0.43 1.28 0.17 0.28 -1.65 0.00 0.00 177.43 177.08 3g3x h SER 117 N 0.73 0.61 -0.94 5.81 0.02 -1.81 -2.14 113.55 115.83 3g3x h SER 117 Ca 0.05 -0.18 0.02 0.00 -0.84 0.00 0.00 61.79 60.84 3g3x h SER 117 Cb 1.03 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 63.36 3g3x h SER 117 CO 0.10 0.62 0.62 -0.07 -1.14 0.00 0.00 176.83 176.97 3g3x h LEU 118 N 0.57 1.07 -0.37 5.07 3.38 -0.95 -0.86 115.31 123.22 3g3x h LEU 118 Ca 0.15 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 3g3x h LEU 118 Cb 0.21 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 3g3x h LEU 118 CO -0.01 0.76 0.16 -0.09 0.09 0.00 0.00 178.44 179.36 3g3x h ARG 119 N 1.26 0.54 -0.63 1.13 2.43 -1.13 -0.91 114.38 117.07 3g3x h ARG 119 Ca 0.35 -0.09 -0.04 0.00 -0.81 0.00 0.00 59.98 59.40 3g3x h ARG 119 Cb -0.11 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.32 3g3x h ARG 119 CO -0.09 0.50 0.23 0.52 -1.51 0.00 0.00 179.97 179.63 3g3x h MET 120 N 0.46 0.94 -0.47 0.20 2.86 -0.99 -0.15 114.93 117.77 3g3x h MET 120 Ca 0.13 -0.16 -0.04 0.00 -2.06 0.00 0.00 59.70 57.56 3g3x h MET 120 Cb 0.15 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 3g3x h MET 120 CO -0.01 0.78 0.12 -0.07 1.06 0.00 0.00 176.91 178.78 3g3x h LEU 121 N 0.92 0.70 -1.33 1.22 3.38 -0.94 -1.21 115.31 118.06 3g3x h LEU 121 Ca 0.21 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 3g3x h LEU 121 Cb 0.21 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3g3x h LEU 121 CO -0.02 0.75 -0.15 -0.61 0.09 0.00 0.00 178.44 178.50 3g3x h GLN 122 N 0.62 0.26 0.00 1.13 4.15 -0.73 -1.12 115.11 119.42 3g3x h GLN 122 Ca 0.15 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.50 3g3x h GLN 122 Cb 0.32 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.98 3g3x h GLN 122 CO 0.00 0.42 0.00 1.04 -1.93 0.00 0.00 178.83 178.36 3g3x n GLN 123 N -4.24 0.07 -2.77 1.69 6.02 -0.11 -4.91 117.38 113.13 3g3x n GLN 123 Ca -0.01 0.08 -0.21 0.00 -0.01 0.00 0.00 57.00 56.86 3g3x n GLN 123 Cb 0.29 -1.50 0.02 0.00 1.02 0.00 0.00 30.24 30.07 3g3x n GLN 123 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3g3x n LYS 124 N -1.46 -3.61 -3.08 -1.09 5.02 -0.43 -4.93 118.16 108.58 3g3x n LYS 124 Ca 0.07 0.89 -0.44 0.00 -2.02 0.00 0.00 58.31 56.81 3g3x n LYS 124 Cb 0.27 -5.59 0.00 0.00 -0.02 0.00 0.00 35.03 29.68 3g3x n LYS 124 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3g3x n ARG 125 N -3.53 3.48 -0.12 1.97 1.74 -0.55 -4.90 116.66 114.76 3g3x n ARG 125 Ca -0.15 -4.10 -0.10 0.00 -0.77 0.00 0.00 57.85 52.73 3g3x n ARG 125 Cb 0.64 -2.83 -0.02 0.00 -1.02 0.00 0.00 32.46 29.23 3g3x n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 3g3x h TRP 126 N 6.83 0.63 -0.48 -1.55 -0.00 -1.89 0.08 115.95 119.57 3g3x h TRP 126 Ca 0.26 -0.09 -0.04 0.00 -0.00 0.00 0.00 58.89 59.03 3g3x h TRP 126 Cb 0.85 -0.17 -0.02 0.00 -0.00 0.00 0.00 29.16 29.82 3g3x h TRP 126 CO 0.97 0.64 0.14 -0.44 -0.00 0.00 0.00 178.44 179.75 3g3x h ASP 127 N 0.43 0.71 -0.59 -3.49 5.19 -1.90 -1.10 116.42 115.67 3g3x h ASP 127 Ca 0.11 -0.22 -0.09 0.00 -0.62 0.00 0.00 57.03 56.22 3g3x h ASP 127 Cb 0.35 -0.19 -0.02 0.00 0.18 0.00 0.00 39.33 39.65 3g3x h ASP 127 CO 0.01 0.74 0.02 -0.33 -3.12 0.00 0.00 179.24 176.56 3g3x h GLU 128 N 0.64 1.03 -0.85 3.56 5.08 -1.93 -1.95 114.58 120.17 3g3x h GLU 128 Ca 0.15 -0.32 -0.01 0.00 -1.00 0.00 0.00 59.36 58.19 3g3x h GLU 128 Cb 0.29 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.40 3g3x h GLU 128 CO -0.00 1.00 0.51 0.00 -1.00 0.00 0.00 179.01 179.52 3g3x h ALA 129 N 0.99 1.08 -0.55 3.43 0.00 -0.87 -0.98 119.26 122.36 3g3x h ALA 129 Ca 0.17 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 3g3x h ALA 129 Cb 0.52 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3g3x h ALA 129 CO 0.03 0.55 0.23 0.00 0.00 0.00 0.00 179.25 180.06 3g3x h ALA 130 N 1.28 0.71 -0.57 0.00 0.00 -0.86 0.17 119.26 119.99 3g3x h ALA 130 Ca 0.30 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3g3x h ALA 130 Cb -0.04 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 3g3x h ALA 130 CO -0.06 0.31 0.27 0.28 0.00 0.00 0.00 179.25 180.05 3g3x h VAL 131 N 0.74 1.21 -0.49 0.00 2.07 -1.12 -2.95 116.25 115.70 3g3x h VAL 131 Ca 0.18 -0.58 -0.12 0.00 0.82 0.00 0.00 66.70 67.00 3g3x h VAL 131 Cb 0.17 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 3g3x h VAL 131 CO -0.02 0.23 -0.18 -1.13 0.02 0.00 0.00 177.57 176.50 3g3x h ASN 132 N 0.77 1.00 -0.07 0.57 -0.73 -0.72 -2.93 115.58 113.46 3g3x h ASN 132 Ca 0.19 -0.36 -0.02 0.00 1.87 0.00 0.00 56.30 57.99 3g3x h ASN 132 Cb 0.12 -0.27 -0.01 0.00 0.27 0.00 0.00 38.32 38.43 3g3x h ASN 132 CO -0.02 1.15 0.01 -0.07 -0.37 0.00 0.00 177.43 178.12 3g3x h LEU 133 N 0.86 0.16 -0.48 0.34 3.38 -0.63 -2.40 115.31 116.54 3g3x h LEU 133 Ca 0.12 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3g3x h LEU 133 Cb 0.74 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.45 3g3x h LEU 133 CO 0.06 0.19 0.00 0.00 0.09 0.00 0.00 178.44 178.78 3g3x h ALA 134 N 1.83 1.00 -0.61 1.53 0.00 -1.34 -3.33 119.26 118.34 3g3x h ALA 134 Ca 0.05 0.00 -0.74 0.00 0.00 0.00 0.00 54.91 54.22 3g3x h ALA 134 Cb 0.11 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 17.80 3g3x h ALA 134 CO 0.00 0.00 2.50 1.63 0.00 0.00 0.00 179.25 183.38 3g3x n LYS 135 N -2.35 3.91 -3.76 0.00 5.02 -0.90 -4.66 118.16 115.41 3g3x n LYS 135 Ca 0.03 -3.25 -0.12 0.00 -2.02 0.00 0.00 58.31 52.95 3g3x n LYS 135 Cb 0.32 -2.84 -0.08 0.00 -0.02 0.00 0.00 35.03 32.41 3g3x n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3g3x s SER 136 N 1.07 -0.13 0.30 4.39 1.04 -1.25 -5.01 113.70 114.10 3g3x s SER 136 Ca 0.49 -0.13 0.00 0.00 0.48 0.00 0.00 55.95 56.80 3g3x s SER 136 Cb 0.14 0.34 0.52 0.00 0.10 0.00 0.00 66.02 67.12 3g3x s SER 136 CO -0.05 -0.57 1.91 -0.09 0.98 0.00 0.00 173.24 175.43 3g3x h ARG 137 N 3.40 1.01 -0.24 4.02 2.43 -1.92 -2.11 114.38 120.97 3g3x h ARG 137 Ca -0.31 -0.06 0.06 0.00 -0.81 0.00 0.00 59.98 58.86 3g3x h ARG 137 Cb 1.19 -0.23 -0.07 0.00 -0.42 0.00 0.00 29.97 30.44 3g3x h ARG 137 CO 0.44 0.67 -0.25 2.35 -1.51 0.00 0.00 179.97 181.68 3g3x h TRP 138 N 1.04 -0.66 -0.41 2.20 7.01 -1.95 0.71 115.95 123.89 3g3x h TRP 138 Ca 0.39 0.04 -0.04 0.00 2.11 0.00 0.00 58.89 61.39 3g3x h TRP 138 Cb 0.19 0.33 -0.02 0.00 -2.10 0.00 0.00 29.16 27.56 3g3x h TRP 138 CO -0.00 -0.33 0.09 -0.92 -2.79 0.00 0.00 178.44 174.49 3g3x h TYR 139 N -0.26 0.71 -0.70 2.65 5.03 -1.75 -1.60 116.97 121.04 3g3x h TYR 139 Ca 0.14 -0.09 -0.06 0.00 2.58 0.00 0.00 58.73 61.30 3g3x h TYR 139 Cb 0.47 -0.20 -0.03 0.00 1.55 0.00 0.00 36.73 38.52 3g3x h TYR 139 CO -0.40 0.68 0.22 -0.91 -1.32 0.00 0.00 178.16 176.43 3g3x h ASN 140 N 0.53 1.02 0.50 -2.11 4.21 -0.88 -1.65 115.58 117.20 3g3x h ASN 140 Ca 0.13 -0.21 -0.27 0.00 1.21 0.00 0.00 56.30 57.16 3g3x h ASN 140 Cb 0.33 -0.27 0.01 0.00 -1.12 0.00 0.00 38.32 37.27 3g3x h ASN 140 CO 0.00 0.96 -1.21 1.56 -1.29 0.00 0.00 177.43 177.45 3g3x h GLN 141 N 1.03 0.35 -2.30 0.81 1.08 -0.82 -3.38 115.11 111.89 3g3x h GLN 141 Ca 0.23 -0.53 -0.59 0.00 -1.45 0.00 0.00 58.65 56.30 3g3x h GLN 141 Cb 0.30 0.19 -0.41 0.00 -0.05 0.00 0.00 27.48 27.51 3g3x h GLN 141 CO -0.01 1.23 -0.79 0.25 -0.95 0.00 0.00 178.83 178.56 3g3x n THR 142 N -3.61 0.90 -0.14 -0.54 -2.24 -0.61 -4.99 114.28 103.05 3g3x n THR 142 Ca -0.09 -4.59 -0.11 0.00 -2.27 0.00 0.00 64.05 56.99 3g3x n THR 142 Cb 0.99 -2.02 0.01 0.00 -2.10 0.00 0.00 70.33 67.21 3g3x n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3g3x h PRO 143 N 4.48 0.95 -0.33 -0.78 0.13 -1.49 -0.27 132.00 134.70 3g3x h PRO 143 Ca 0.16 -0.42 -0.06 0.00 -0.87 0.00 0.00 66.00 64.80 3g3x h PRO 143 Cb 0.77 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.87 3g3x h PRO 143 CO 0.65 1.09 -0.04 -0.91 -0.23 0.00 0.00 178.00 178.55 3g3x h ASN 144 N 0.81 0.60 -0.31 1.44 4.21 -1.94 0.17 115.58 120.56 3g3x h ASN 144 Ca 0.10 -0.34 -0.05 0.00 1.21 0.00 0.00 56.30 57.22 3g3x h ASN 144 Cb 0.83 -0.16 -0.01 0.00 -1.12 0.00 0.00 38.32 37.86 3g3x h ASN 144 CO 0.07 0.80 -0.01 -0.09 -1.29 0.00 0.00 177.43 176.91 3g3x h ARG 145 N 0.39 0.55 -0.86 0.81 1.12 -1.95 -2.27 114.38 112.17 3g3x h ARG 145 Ca 0.09 -0.18 -0.02 0.00 -1.11 0.00 0.00 59.98 58.76 3g3x h ARG 145 Cb 0.52 -0.05 -0.04 0.00 -0.01 0.00 0.00 29.97 30.39 3g3x h ARG 145 CO 0.03 0.69 0.46 0.00 -3.11 0.00 0.00 179.97 178.04 3g3x h ALA 146 N 0.83 1.10 -0.80 2.80 0.00 -0.96 -1.75 119.26 120.48 3g3x h ALA 146 Ca 0.09 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.91 3g3x h ALA 146 Cb 0.45 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 3g3x h ALA 146 CO 0.02 0.62 0.50 0.87 0.00 0.00 0.00 179.25 181.26 3g3x h LYS 147 N 1.20 0.91 -0.28 0.00 1.57 -0.53 0.27 116.57 119.72 3g3x h LYS 147 Ca 0.30 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 59.01 3g3x h LYS 147 Cb 0.04 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 3g3x h LYS 147 CO -0.05 0.60 0.09 0.00 -0.57 0.00 0.00 179.45 179.53 3g3x h ARG 148 N 0.94 0.43 -0.34 3.15 3.08 -0.81 -3.15 114.38 117.68 3g3x h ARG 148 Ca 0.34 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 60.27 3g3x h ARG 148 Cb 0.10 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 3g3x h ARG 148 CO -0.15 0.48 0.09 0.28 -1.07 0.00 0.00 179.97 179.61 3g3x h VAL 149 N 0.29 1.22 0.00 2.04 2.07 -0.95 -1.76 116.25 119.16 3g3x h VAL 149 Ca 0.09 -0.72 0.00 0.00 0.82 0.00 0.00 66.70 66.89 3g3x h VAL 149 Cb 0.23 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 3g3x h VAL 149 CO -0.00 0.24 0.00 -0.38 0.02 0.00 0.00 177.57 177.45 3g3x n ILE 150 N -4.64 0.17 0.00 4.57 5.41 0.93 -1.77 119.36 124.03 3g3x n ILE 150 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.74 3g3x n ILE 150 Cb 0.18 -0.57 0.00 0.00 -0.71 0.00 0.00 39.64 38.55 3g3x n ILE 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 3g3x n THR 152 N 0.89 0.00 -0.21 1.39 -1.04 -0.66 -0.42 114.28 114.23 3g3x n THR 152 Ca 0.00 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.95 3g3x n THR 152 Cb 0.09 0.00 0.08 0.00 -1.82 0.00 0.00 70.33 68.68 3g3x n THR 152 CO 0.00 0.00 0.00 -0.26 -0.64 0.00 0.00 175.07 174.17 3g3x h PHE 153 N 0.00 1.09 -0.23 -1.42 0.04 -1.63 1.00 116.94 115.79 3g3x h PHE 153 Ca 0.00 -0.14 -0.04 0.00 2.80 0.00 0.00 57.97 60.59 3g3x h PHE 153 Cb 0.00 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 37.84 3g3x h PHE 153 CO 0.00 0.92 -0.01 -0.09 -0.60 0.00 0.00 178.31 178.53 3g3x h ARG 154 N 0.97 0.41 0.00 1.51 2.43 -1.00 -3.36 114.38 115.34 3g3x h ARG 154 Ca 0.20 -0.14 -0.15 0.00 -0.81 0.00 0.00 59.98 59.08 3g3x h ARG 154 Cb 0.41 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.90 3g3x h ARG 154 CO 0.01 0.60 -2.11 0.25 -1.51 0.00 0.00 179.97 177.21 3g3x n THR 155 N -4.64 0.57 -1.55 0.20 -2.24 -1.22 -4.77 114.28 100.63 3g3x n THR 155 Ca -0.04 -0.62 -0.14 0.00 -2.27 0.00 0.00 64.05 60.98 3g3x n THR 155 Cb 0.25 -0.20 -0.05 0.00 -2.10 0.00 0.00 70.33 68.23 3g3x n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3g3x n GLY 156 N 1.54 1.20 3.64 3.38 0.00 0.34 -5.00 105.19 110.29 3g3x n GLY 156 Ca -0.16 -0.35 -0.29 0.00 0.00 0.00 0.00 46.02 45.22 3g3x n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3g3x s THR 157 N -2.55 1.61 -0.59 2.61 -4.23 -1.26 -4.83 115.64 106.40 3g3x s THR 157 Ca 0.00 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.64 3g3x s THR 157 Cb 0.00 -2.70 0.67 0.00 1.34 0.00 0.00 72.50 71.81 3g3x s THR 157 CO 0.00 0.00 1.54 0.79 -0.54 0.00 0.00 174.62 176.41 3g3x n TRP 158 N -1.03 1.63 -0.11 3.99 7.02 -1.26 -4.59 117.44 123.10 3g3x n TRP 158 Ca -0.09 -0.58 0.18 0.00 -1.02 0.00 0.00 57.50 55.99 3g3x n TRP 158 Cb 0.67 -0.39 0.59 0.00 -2.42 0.00 0.00 31.31 29.76 3g3x n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 3g3x h ASP 159 N 3.40 0.22 1.02 -0.99 3.32 -1.98 0.49 116.42 121.89 3g3x h ASP 159 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3g3x h ASP 159 Cb 1.63 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 41.15 3g3x h ASP 159 CO 0.36 0.11 0.00 0.00 -1.72 0.00 0.00 179.24 177.99 3g3x n ALA 160 N -2.58 1.89 0.42 3.45 0.00 -1.26 -3.24 120.51 119.19 3g3x n ALA 160 Ca 0.13 0.05 0.05 0.00 0.00 0.00 0.00 53.44 53.67 3g3x n ALA 160 Cb 0.59 -1.42 0.04 0.00 0.00 0.00 0.00 19.45 18.66 3g3x n ALA 160 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3g3x n TYR 161 N -2.27 0.00 1.41 0.00 4.02 0.14 -4.96 117.16 115.51 3g3x n TYR 161 Ca 0.03 0.00 0.14 0.00 -0.01 0.00 0.00 57.90 58.06 3g3x n TYR 161 Cb 0.31 0.00 0.44 0.00 -0.02 0.00 0.00 39.34 40.07 3g3x n TYR 161 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48