#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x7j s VAL 3 N 0.00 4.68 -0.20 2.28 1.01 -1.26 -5.05 120.40 121.86 2x7j s VAL 3 Ca 0.00 1.30 -0.25 0.00 0.00 0.00 0.00 61.98 63.03 2x7j s VAL 3 Cb 0.00 -3.94 -0.01 0.00 0.00 0.00 0.00 36.38 32.43 2x7j s VAL 3 CO 0.00 0.55 0.83 0.21 0.00 0.00 0.00 175.10 176.69 2x7j s ASN 4 N -1.12 6.90 0.49 3.32 3.84 -1.26 -4.95 114.94 122.17 2x7j s ASN 4 Ca 0.30 1.11 0.20 0.00 0.21 0.00 0.00 52.86 54.68 2x7j s ASN 4 Cb -0.20 -2.44 1.25 0.00 -0.55 0.00 0.00 41.25 39.30 2x7j s ASN 4 CO 0.20 -0.45 2.00 1.55 -2.79 0.00 0.00 177.10 177.61 2x7j h PRO 5 N 7.49 0.15 -0.27 0.43 0.13 -1.93 -2.61 132.00 135.39 2x7j h PRO 5 Ca -0.26 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2x7j h PRO 5 Cb 1.11 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 2x7j h PRO 5 CO 0.85 0.10 0.18 0.82 -0.23 0.00 0.00 178.00 179.72 2x7j h ILE 6 N 0.15 1.07 -0.14 -3.56 2.04 -1.92 -2.05 117.51 113.10 2x7j h ILE 6 Ca 0.24 -0.12 0.01 0.00 1.00 0.00 0.00 64.86 65.99 2x7j h ILE 6 Cb 0.74 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 2x7j h ILE 6 CO -0.03 0.07 0.05 0.74 0.00 0.00 0.00 178.15 178.97 2x7j h THR 7 N 0.36 0.96 0.00 -0.27 2.02 -1.82 -0.28 112.91 113.88 2x7j h THR 7 Ca 0.10 -0.04 -0.14 0.00 0.77 0.00 0.00 66.41 67.10 2x7j h THR 7 Cb -0.03 0.84 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 2x7j h THR 7 CO -0.02 0.02 -1.62 1.41 0.37 0.00 0.00 175.52 175.68 2x7j n HIS 8 N -5.06 0.64 0.25 3.16 8.25 -1.19 -2.46 115.22 118.81 2x7j n HIS 8 Ca -0.04 0.21 -0.13 0.00 -0.26 0.00 0.00 57.72 57.50 2x7j n HIS 8 Cb 0.06 -0.94 -0.07 0.00 1.12 0.00 0.00 29.99 30.16 2x7j n HIS 8 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 2x7j h TYR 9 N 0.00 -0.62 -0.02 4.41 3.20 -1.29 0.42 116.97 123.07 2x7j h TYR 9 Ca -0.17 -0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.55 2x7j h TYR 9 Cb 1.49 0.21 -0.02 0.00 1.54 0.00 0.00 36.73 39.95 2x7j h TYR 9 CO 0.00 -0.31 -0.60 0.82 -1.64 0.00 0.00 178.16 176.43 2x7j h ILE 10 N -1.05 1.42 -0.22 1.81 1.08 -1.25 -2.00 117.51 117.30 2x7j h ILE 10 Ca -0.07 -2.03 -0.00 0.00 -0.39 0.00 0.00 64.86 62.37 2x7j h ILE 10 Cb 0.59 2.07 -0.01 0.00 -3.07 0.00 0.00 36.82 36.41 2x7j h ILE 10 CO 0.11 0.59 0.13 1.23 -0.69 0.00 0.00 178.15 179.51 2x7j h GLY 11 N 1.70 0.33 1.42 5.37 0.00 -1.49 0.74 103.07 111.13 2x7j h GLY 11 Ca -0.01 -0.14 -0.04 0.00 0.00 0.00 0.00 47.33 47.14 2x7j h GLY 11 CO 0.08 0.14 0.12 1.76 0.00 0.00 0.00 176.54 178.64 2x7j h SER 12 N 0.26 0.68 0.37 0.19 0.02 -0.84 0.11 113.55 114.33 2x7j h SER 12 Ca 0.08 -0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 2x7j h SER 12 Cb 0.05 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.41 2x7j h SER 12 CO -0.01 0.67 -0.18 0.15 -1.14 0.00 0.00 176.83 176.32 2x7j h PHE 13 N 0.71 -0.45 -0.32 3.45 -0.00 -0.69 -1.46 116.94 118.17 2x7j h PHE 13 Ca 0.16 -0.01 -0.14 0.00 -0.00 0.00 0.00 57.97 57.98 2x7j h PHE 13 Cb 0.27 0.15 -0.01 0.00 -0.00 0.00 0.00 35.95 36.36 2x7j h PHE 13 CO 0.01 -0.25 -0.37 0.82 -0.00 0.00 0.00 178.31 178.52 2x7j h ILE 14 N -0.55 1.28 -0.61 1.41 1.08 -0.75 -2.60 117.51 116.77 2x7j h ILE 14 Ca -0.05 -1.54 -0.07 0.00 -0.39 0.00 0.00 64.86 62.81 2x7j h ILE 14 Cb 0.41 1.43 -0.03 0.00 -3.07 0.00 0.00 36.82 35.57 2x7j h ILE 14 CO 0.08 0.50 0.10 -0.78 -0.69 0.00 0.00 178.15 177.37 2x7j h ASP 15 N 0.62 0.93 0.43 1.72 3.58 -0.74 -2.34 116.42 120.63 2x7j h ASP 15 Ca 0.06 -0.21 -0.10 0.00 0.42 0.00 0.00 57.03 57.20 2x7j h ASP 15 Cb 0.92 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.71 2x7j h ASP 15 CO 0.08 0.93 -0.47 -0.08 -2.88 0.00 0.00 179.24 176.83 2x7j h GLU 16 N 0.93 0.04 -0.61 0.28 4.57 -1.12 -0.97 114.58 117.71 2x7j h GLU 16 Ca 0.19 -0.02 -0.04 0.00 -1.18 0.00 0.00 59.36 58.31 2x7j h GLU 16 Cb 0.40 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.96 2x7j h GLU 16 CO 0.01 0.50 0.23 0.74 -1.18 0.00 0.00 179.01 179.31 2x7j h PHE 17 N 0.03 0.94 -0.70 0.92 -1.00 -1.04 0.46 116.94 116.55 2x7j h PHE 17 Ca -0.00 -0.08 -0.03 0.00 2.81 0.00 0.00 57.97 60.67 2x7j h PHE 17 Cb 0.84 -0.28 -0.03 0.00 3.61 0.00 0.00 35.95 40.09 2x7j h PHE 17 CO 0.00 0.76 0.33 0.00 -1.61 0.00 0.00 178.31 177.79 2x7j h ALA 18 N 1.08 1.25 0.00 2.45 0.00 -1.00 -1.43 119.26 121.60 2x7j h ALA 18 Ca 0.20 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 2x7j h ALA 18 Cb 0.23 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2x7j h ALA 18 CO -0.01 0.57 -0.38 -0.07 0.00 0.00 0.00 179.25 179.36 2x7j h LEU 19 N 1.00 0.00 -0.79 0.00 3.38 -0.72 -1.99 115.31 116.19 2x7j h LEU 19 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2x7j h LEU 19 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2x7j h LEU 19 CO -0.03 0.38 0.00 0.28 0.09 0.00 0.00 178.44 179.16 2x7j h SER 20 N 0.00 0.00 0.00 -0.43 0.02 -0.05 -3.46 113.55 109.64 2x7j h SER 20 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2x7j h SER 20 Cb 0.70 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.24 2x7j h SER 20 CO 0.05 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.35 2x7j n GLY 21 N 0.27 0.97 3.71 -3.77 0.00 -0.75 -5.08 105.19 100.55 2x7j n GLY 21 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2x7j n GLY 21 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x7j s ILE 22 N -2.00 3.53 -0.01 -0.61 -1.09 -0.62 -4.86 121.20 115.54 2x7j s ILE 22 Ca 0.00 1.08 0.00 0.00 -2.23 0.00 0.00 60.65 59.50 2x7j s ILE 22 Cb 0.00 -3.69 -0.00 0.00 -1.58 0.00 0.00 42.46 37.19 2x7j s ILE 22 CO 0.00 0.07 0.01 0.35 -1.23 0.00 0.00 174.94 174.14 2x7j n THR 23 N 4.06 0.00 -4.31 2.92 -2.24 -1.26 -4.34 114.28 109.11 2x7j n THR 23 Ca 0.11 -0.36 -0.20 0.00 -2.27 0.00 0.00 64.05 61.33 2x7j n THR 23 Cb 0.43 0.87 -0.16 0.00 -2.10 0.00 0.00 70.33 69.37 2x7j n THR 23 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2x7j s ASP 24 N -1.29 1.09 -0.13 3.42 1.01 -1.26 0.31 116.67 119.82 2x7j s ASP 24 Ca 0.00 -0.17 0.01 0.00 0.71 0.00 0.00 52.55 53.10 2x7j s ASP 24 Cb 0.00 -0.37 0.02 0.00 1.01 0.00 0.00 42.92 43.58 2x7j s ASP 24 CO 0.01 0.02 -0.14 0.00 0.21 0.00 0.00 175.17 175.28 2x7j s ALA 25 N 0.43 1.73 -0.21 5.23 0.00 0.41 -1.52 121.76 127.82 2x7j s ALA 25 Ca -0.06 -0.80 -0.21 0.00 0.00 0.00 0.00 51.96 50.89 2x7j s ALA 25 Cb -0.10 -0.96 -0.02 0.00 0.00 0.00 0.00 23.12 22.03 2x7j s ALA 25 CO 0.01 -0.29 0.64 0.08 0.00 0.00 0.00 175.76 176.20 2x7j s VAL 26 N 1.35 5.00 -0.05 0.00 1.01 0.27 0.04 120.40 128.03 2x7j s VAL 26 Ca 0.01 1.19 0.04 0.00 0.00 0.00 0.00 61.98 63.22 2x7j s VAL 26 Cb -0.13 -3.95 -0.00 0.00 0.00 0.00 0.00 36.38 32.29 2x7j s VAL 26 CO -0.07 0.08 -0.16 -0.69 0.00 0.00 0.00 175.10 174.26 2x7j s VAL 27 N 2.10 1.35 -0.07 2.92 1.01 0.13 -1.31 120.40 126.54 2x7j s VAL 27 Ca 0.28 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.64 2x7j s VAL 27 Cb -0.16 -1.17 -0.02 0.00 0.00 0.00 0.00 36.38 35.03 2x7j s VAL 27 CO 0.10 0.39 -0.18 0.00 0.00 0.00 0.00 175.10 175.41 2x7j s PRO 29 N -0.34 2.43 0.00 0.00 0.04 -1.26 -4.32 135.00 131.55 2x7j s PRO 29 Ca 0.02 1.56 0.00 0.00 0.04 0.00 0.00 61.00 62.62 2x7j s PRO 29 Cb -0.13 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.53 2x7j s PRO 29 CO 0.02 -1.57 0.00 0.41 0.04 0.00 0.00 177.00 175.91 2x7j n GLY 30 N -0.09 1.81 0.10 0.56 0.00 -1.26 -4.52 105.19 101.80 2x7j n GLY 30 Ca 0.12 -0.80 -0.17 0.00 0.00 0.00 0.00 46.02 45.17 2x7j n GLY 30 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2x7j h SER 31 N 0.00 0.28 0.53 1.61 0.87 -1.99 -3.30 113.55 111.55 2x7j h SER 31 Ca 0.00 -0.87 -0.09 0.00 -1.23 0.00 0.00 61.79 59.60 2x7j h SER 31 Cb 0.00 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 2x7j h SER 31 CO 0.00 1.12 -0.43 -0.09 -0.53 0.00 0.00 176.83 176.90 2x7j h ARG 32 N -0.52 0.00 -0.10 2.24 9.65 -1.97 -2.18 114.38 121.51 2x7j h ARG 32 Ca -0.06 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 2x7j h ARG 32 Cb 1.22 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.80 2x7j h ARG 32 CO 0.08 0.43 0.00 -1.13 2.80 0.00 0.00 179.97 182.14 2x7j n SER 33 N -3.88 0.56 -0.39 -3.80 3.41 -1.25 -4.57 113.62 103.70 2x7j n SER 33 Ca -0.01 -1.92 -0.09 0.00 -0.26 0.00 0.00 58.87 56.59 2x7j n SER 33 Cb 0.47 -0.07 -0.08 0.00 -0.26 0.00 0.00 64.21 64.28 2x7j n SER 33 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2x7j n THR 34 N -0.23 -0.62 0.01 6.66 -1.04 -0.82 -1.60 114.28 116.64 2x7j n THR 34 Ca 0.05 2.24 -0.00 0.00 -2.04 0.00 0.00 64.05 64.31 2x7j n THR 34 Cb 0.10 -2.80 0.30 0.00 -1.82 0.00 0.00 70.33 66.11 2x7j n THR 34 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 2x7j h PRO 35 N 0.00 0.51 -0.09 -2.82 0.13 -1.81 0.27 132.00 128.19 2x7j h PRO 35 Ca 0.17 -0.11 -0.01 0.00 -0.87 0.00 0.00 66.00 65.18 2x7j h PRO 35 Cb 0.40 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 31.46 2x7j h PRO 35 CO -0.88 0.55 0.01 -0.07 -0.23 0.00 0.00 178.00 177.38 2x7j h LEU 36 N 0.49 0.15 -0.02 1.56 3.38 -1.72 -1.72 115.31 117.42 2x7j h LEU 36 Ca 0.10 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 2x7j h LEU 36 Cb 0.34 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2x7j h LEU 36 CO 0.01 0.38 -0.02 0.00 0.09 0.00 0.00 178.44 178.91 2x7j h ALA 37 N 0.77 0.03 -0.26 1.53 0.00 -0.91 -2.28 119.26 118.14 2x7j h ALA 37 Ca 0.03 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.71 2x7j h ALA 37 Cb 0.30 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2x7j h ALA 37 CO 0.00 -0.21 0.09 0.28 0.00 0.00 0.00 179.25 179.41 2x7j h VAL 38 N -0.43 0.93 -0.26 0.00 2.07 -1.03 -0.64 116.25 116.89 2x7j h VAL 38 Ca 0.00 -0.07 -0.11 0.00 0.82 0.00 0.00 66.70 67.34 2x7j h VAL 38 Cb 0.51 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 2x7j h VAL 38 CO 0.00 0.04 -0.31 -0.07 0.02 0.00 0.00 177.57 177.26 2x7j h LEU 39 N 0.20 0.55 -0.47 2.57 3.38 -1.37 0.18 115.31 120.36 2x7j h LEU 39 Ca 0.11 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2x7j h LEU 39 Cb 0.09 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 2x7j h LEU 39 CO -0.12 0.83 0.25 0.00 0.09 0.00 0.00 178.44 179.48 2x7j h ALA 41 N 1.09 0.36 0.00 0.00 0.00 -0.56 -2.91 119.26 117.23 2x7j h ALA 41 Ca 0.16 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 2x7j h ALA 41 Cb 0.07 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2x7j h ALA 41 CO -0.02 -0.22 -0.51 0.00 0.00 0.00 0.00 179.25 178.50 2x7j h ALA 42 N 1.14 1.07 -2.50 0.00 0.00 -0.53 -3.44 119.26 115.00 2x7j h ALA 42 Ca 0.12 -0.46 -0.53 0.00 0.00 0.00 0.00 54.91 54.03 2x7j h ALA 42 Cb 0.02 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 17.75 2x7j h ALA 42 CO -0.07 0.63 0.89 -1.58 0.00 0.00 0.00 179.25 179.12 2x7j s HIS 43 N -3.73 2.82 0.39 0.00 2.46 -0.29 -4.90 115.29 112.04 2x7j s HIS 43 Ca -0.01 0.60 0.29 0.00 0.47 0.00 0.00 55.06 56.42 2x7j s HIS 43 Cb 0.13 -3.85 1.50 0.00 -0.13 0.00 0.00 32.58 30.23 2x7j s HIS 43 CO 0.73 -3.23 2.08 -1.35 -2.47 0.00 0.00 174.74 170.50 2x7j h PRO 44 N 7.56 0.00 -0.02 2.88 0.11 -1.86 -2.96 132.00 137.70 2x7j h PRO 44 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2x7j h PRO 44 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2x7j h PRO 44 CO 0.91 0.10 -0.26 -0.25 -0.21 0.00 0.00 178.00 178.30 2x7j n ASP 45 N -3.52 1.95 -4.23 -2.05 8.00 -1.26 -4.88 116.55 110.57 2x7j n ASP 45 Ca -0.02 -1.48 -0.34 0.00 0.71 0.00 0.00 54.79 53.66 2x7j n ASP 45 Cb 0.24 0.23 -0.15 0.00 -0.02 0.00 0.00 41.12 41.42 2x7j n ASP 45 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2x7j s ILE 46 N -2.31 2.86 -0.03 0.53 1.01 -1.12 -4.35 121.20 117.79 2x7j s ILE 46 Ca 0.25 -0.71 -0.26 0.00 0.00 0.00 0.00 60.65 59.93 2x7j s ILE 46 Cb 0.19 -2.29 -0.03 0.00 0.01 0.00 0.00 42.46 40.33 2x7j s ILE 46 CO 0.47 0.44 0.81 -0.44 0.00 0.00 0.00 174.94 176.22 2x7j s SER 47 N 1.40 7.15 -0.18 3.58 0.01 0.15 -4.77 113.70 121.04 2x7j s SER 47 Ca 0.05 1.38 -0.13 0.00 1.31 0.00 0.00 55.95 58.57 2x7j s SER 47 Cb -0.14 -2.48 -0.05 0.00 0.21 0.00 0.00 66.02 63.57 2x7j s SER 47 CO -0.07 -0.16 0.24 -0.69 0.41 0.00 0.00 173.24 172.97 2x7j s VAL 48 N 0.84 5.34 -0.23 3.43 1.01 -1.26 -0.45 120.40 129.08 2x7j s VAL 48 Ca 0.43 0.43 -0.01 0.00 0.00 0.00 0.00 61.98 62.83 2x7j s VAL 48 Cb -0.19 -3.58 0.03 0.00 0.00 0.00 0.00 36.38 32.64 2x7j s VAL 48 CO 0.22 0.40 -0.10 -1.00 0.00 0.00 0.00 175.10 174.63 2x7j s HIS 49 N 0.46 3.01 -0.32 5.22 3.76 0.11 -4.96 115.29 122.57 2x7j s HIS 49 Ca 0.14 -1.60 -0.17 0.00 -0.15 0.00 0.00 55.06 53.27 2x7j s HIS 49 Cb -0.12 -2.02 -0.01 0.00 1.11 0.00 0.00 32.58 31.54 2x7j s HIS 49 CO 0.02 -0.75 0.47 0.08 -0.85 0.00 0.00 174.74 173.71 2x7j s VAL 50 N 1.31 5.07 -0.08 -0.90 1.01 -1.26 0.18 120.40 125.72 2x7j s VAL 50 Ca 0.01 0.40 0.03 0.00 0.00 0.00 0.00 61.98 62.42 2x7j s VAL 50 Cb -0.16 -3.89 -0.01 0.00 0.00 0.00 0.00 36.38 32.32 2x7j s VAL 50 CO -0.06 -0.10 -0.19 -1.10 0.00 0.00 0.00 175.10 173.65 2x7j s GLN 51 N 2.28 2.86 -0.05 2.72 -1.52 -0.24 -4.95 119.66 120.76 2x7j s GLN 51 Ca 0.17 -0.78 -0.23 0.00 -1.95 0.00 0.00 55.36 52.57 2x7j s GLN 51 Cb -0.16 -2.38 -0.27 0.00 -0.22 0.00 0.00 33.01 29.99 2x7j s GLN 51 CO 0.12 0.36 0.96 0.82 -0.25 0.00 0.00 175.29 177.31 2x7j h ILE 52 N 5.07 1.54 -3.52 1.08 1.08 -1.97 -3.37 117.51 117.42 2x7j h ILE 52 Ca -0.32 -2.25 -0.61 0.00 -0.39 0.00 0.00 64.86 61.29 2x7j h ILE 52 Cb 1.19 2.97 -0.11 0.00 -3.07 0.00 0.00 36.82 37.79 2x7j h ILE 52 CO 0.51 0.63 0.54 -0.62 -0.69 0.00 0.00 178.15 178.51 2x7j s ASP 53 N -6.65 6.43 0.38 1.72 -1.08 -1.26 -4.82 116.67 111.39 2x7j s ASP 53 Ca -0.15 -0.07 0.08 0.00 -0.52 0.00 0.00 52.55 51.90 2x7j s ASP 53 Cb 0.01 -2.43 0.82 0.00 -1.46 0.00 0.00 42.92 39.86 2x7j s ASP 53 CO 0.79 -1.08 1.97 -0.33 0.52 0.00 0.00 175.17 177.04 2x7j h GLU 54 N 9.13 0.63 -0.54 4.34 3.07 -1.89 0.74 114.58 130.07 2x7j h GLU 54 Ca -0.25 -0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 58.54 2x7j h GLU 54 Cb 1.08 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 28.82 2x7j h GLU 54 CO 1.03 0.42 0.21 -0.09 -1.40 0.00 0.00 179.01 179.18 2x7j h ARG 55 N 0.65 0.82 -0.21 2.33 2.43 -1.89 -0.18 114.38 118.33 2x7j h ARG 55 Ca 0.30 -0.15 -0.02 0.00 -0.81 0.00 0.00 59.98 59.29 2x7j h ARG 55 Cb 0.32 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 2x7j h ARG 55 CO -0.10 0.72 0.03 0.77 -1.51 0.00 0.00 179.97 179.89 2x7j h SER 56 N 0.74 0.33 -0.78 -3.80 0.02 -1.57 -2.62 113.55 105.87 2x7j h SER 56 Ca 0.18 -0.26 0.16 0.00 -0.84 0.00 0.00 61.79 61.03 2x7j h SER 56 Cb 0.21 -0.09 -0.15 0.00 0.14 0.00 0.00 62.40 62.52 2x7j h SER 56 CO -0.01 0.51 -0.20 0.00 -1.14 0.00 0.00 176.83 175.98 2x7j h ALA 57 N 0.84 0.49 -0.29 3.77 0.00 -0.67 0.48 119.26 123.87 2x7j h ALA 57 Ca 0.06 0.30 -0.00 0.00 0.00 0.00 0.00 54.91 55.27 2x7j h ALA 57 Cb 0.32 0.61 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2x7j h ALA 57 CO 0.00 -0.42 0.18 0.78 0.00 0.00 0.00 179.25 179.79 2x7j h GLY 58 N -0.01 0.43 2.00 0.00 0.00 -0.82 0.56 103.07 105.23 2x7j h GLY 58 Ca 0.37 -0.18 -0.12 0.00 0.00 0.00 0.00 47.33 47.40 2x7j h GLY 58 CO -0.81 0.17 -0.57 0.74 0.00 0.00 0.00 176.54 176.08 2x7j h PHE 59 N 0.37 0.00 0.16 5.60 -1.00 -0.90 -0.77 116.94 120.39 2x7j h PHE 59 Ca 0.10 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.88 2x7j h PHE 59 Cb 0.02 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.58 2x7j h PHE 59 CO -0.04 0.57 -0.08 0.35 -1.61 0.00 0.00 178.31 177.50 2x7j h PHE 60 N 0.00 -0.20 -0.95 -0.55 3.57 0.46 -0.44 116.94 118.84 2x7j h PHE 60 Ca -0.01 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.62 2x7j h PHE 60 Cb 1.02 0.07 -0.09 0.00 2.79 0.00 0.00 35.95 39.73 2x7j h PHE 60 CO 0.00 0.00 0.57 0.00 -2.23 0.00 0.00 178.31 176.65 2x7j h ALA 61 N 0.45 1.45 -0.22 2.41 0.00 -0.73 -0.74 119.26 121.88 2x7j h ALA 61 Ca -0.02 0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.97 2x7j h ALA 61 Cb 0.29 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 2x7j h ALA 61 CO 0.04 0.10 -0.03 1.25 0.00 0.00 0.00 179.25 180.60 2x7j h LEU 62 N 0.85 -0.15 -0.43 0.00 5.85 -0.71 -1.38 115.31 119.35 2x7j h LEU 62 Ca 0.49 0.06 -0.10 0.00 0.84 0.00 0.00 57.88 59.17 2x7j h LEU 62 Cb 0.58 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 2x7j h LEU 62 CO -0.30 -0.05 -0.14 1.23 -0.34 0.00 0.00 178.44 178.84 2x7j h GLY 63 N 0.03 0.91 0.67 3.75 0.00 -0.50 -0.35 103.07 107.59 2x7j h GLY 63 Ca 0.10 -0.78 0.05 0.00 0.00 0.00 0.00 47.33 46.71 2x7j h GLY 63 CO -0.20 0.71 0.20 -2.00 0.00 0.00 0.00 176.54 175.25 2x7j h LEU 64 N 0.67 0.26 -0.37 3.11 6.46 -0.98 -0.97 115.31 123.48 2x7j h LEU 64 Ca 0.10 0.04 -0.16 0.00 -0.12 0.00 0.00 57.88 57.75 2x7j h LEU 64 Cb 0.68 -0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.59 2x7j h LEU 64 CO 0.05 0.19 -0.75 0.00 -0.62 0.00 0.00 178.44 177.31 2x7j h ALA 65 N 1.28 0.68 -0.58 1.25 0.00 -1.15 -2.88 119.26 117.86 2x7j h ALA 65 Ca 0.21 -0.68 -0.09 0.00 0.00 0.00 0.00 54.91 54.35 2x7j h ALA 65 Cb 0.16 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2x7j h ALA 65 CO -0.18 0.94 0.01 -0.22 0.00 0.00 0.00 179.25 179.80 2x7j h LYS 66 N 0.00 1.02 -0.72 0.00 3.64 -0.73 0.16 116.57 119.94 2x7j h LYS 66 Ca -0.01 -0.32 -0.07 0.00 -1.27 0.00 0.00 60.65 58.99 2x7j h LYS 66 Cb 1.40 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 33.09 2x7j h LYS 66 CO 0.10 1.00 0.19 0.00 -2.27 0.00 0.00 179.45 178.47 2x7j h ALA 67 N 0.98 0.97 -0.00 5.00 0.00 -1.08 -3.26 119.26 121.87 2x7j h ALA 67 Ca 0.17 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2x7j h ALA 67 Cb 0.54 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2x7j h ALA 67 CO 0.03 0.67 -0.93 1.63 0.00 0.00 0.00 179.25 180.65 2x7j n LYS 68 N -4.23 0.43 -2.19 0.00 5.02 -1.10 -4.89 118.16 111.20 2x7j n LYS 68 Ca 0.05 -0.03 -0.16 0.00 -2.02 0.00 0.00 58.31 56.15 2x7j n LYS 68 Cb 0.25 -1.44 -0.02 0.00 -0.02 0.00 0.00 35.03 33.80 2x7j n LYS 68 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2x7j n GLN 69 N -1.43 -1.84 -3.95 1.97 1.13 0.55 -4.97 117.38 108.84 2x7j n GLN 69 Ca 0.04 0.82 -0.09 0.00 -1.94 0.00 0.00 57.00 55.83 2x7j n GLN 69 Cb 0.32 -5.37 -0.10 0.00 0.11 0.00 0.00 30.24 25.19 2x7j n GLN 69 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 2x7j s ARG 70 N -4.64 0.53 0.73 -1.09 1.70 -1.22 -4.95 118.95 110.02 2x7j s ARG 70 Ca 0.00 -0.76 -0.15 0.00 -0.47 0.00 0.00 55.73 54.35 2x7j s ARG 70 Cb 0.00 0.20 0.04 0.00 -0.57 0.00 0.00 34.95 34.62 2x7j s ARG 70 CO 0.00 -0.12 1.20 -1.25 -1.08 0.00 0.00 175.30 174.05 2x7j s PRO 71 N -2.46 2.14 0.15 3.89 0.04 -1.26 -4.57 135.00 132.93 2x7j s PRO 71 Ca -0.06 1.72 0.06 0.00 0.04 0.00 0.00 61.00 62.76 2x7j s PRO 71 Cb -0.02 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 2x7j s PRO 71 CO -0.04 -1.83 -0.13 0.14 0.04 0.00 0.00 177.00 175.18 2x7j s VAL 72 N -2.04 1.37 0.27 -0.36 -7.23 -1.24 -4.70 120.40 106.47 2x7j s VAL 72 Ca 0.73 -1.96 -0.26 0.00 -1.81 0.00 0.00 61.98 58.68 2x7j s VAL 72 Cb -0.28 -1.77 -0.09 0.00 0.56 0.00 0.00 36.38 34.79 2x7j s VAL 72 CO 0.46 -0.58 0.89 -0.76 -0.31 0.00 0.00 175.10 174.80 2x7j s LEU 73 N -2.93 4.43 -0.12 1.32 1.43 -0.58 -0.88 118.68 121.36 2x7j s LEU 73 Ca 0.15 1.77 -0.01 0.00 -1.03 0.00 0.00 54.13 55.01 2x7j s LEU 73 Cb -0.01 -3.79 0.03 0.00 0.03 0.00 0.00 46.19 42.45 2x7j s LEU 73 CO 0.03 0.02 -0.03 -0.22 0.23 0.00 0.00 176.35 176.39 2x7j s LEU 74 N -1.77 1.06 -0.05 1.79 2.96 0.15 -0.56 118.68 122.26 2x7j s LEU 74 Ca 0.46 -0.38 0.02 0.00 -0.22 0.00 0.00 54.13 54.00 2x7j s LEU 74 Cb -0.20 -0.68 0.02 0.00 0.50 0.00 0.00 46.19 45.83 2x7j s LEU 74 CO 0.25 -0.19 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.38 2x7j s ILE 75 N 1.81 0.84 0.26 6.68 1.01 -0.43 0.86 121.20 132.23 2x7j s ILE 75 Ca 0.03 -0.31 -0.04 0.00 0.00 0.00 0.00 60.65 60.32 2x7j s ILE 75 Cb -0.14 -0.79 -0.02 0.00 0.01 0.00 0.00 42.46 41.52 2x7j s ILE 75 CO -0.07 0.29 0.33 0.00 0.00 0.00 0.00 174.94 175.49 2x7j n THR 77 N -0.40 0.00 -2.39 0.00 5.66 -1.26 -1.96 114.28 113.92 2x7j n THR 77 Ca 0.01 -0.97 -0.34 0.00 -3.05 0.00 0.00 64.05 59.70 2x7j n THR 77 Cb 0.63 -1.36 -0.02 0.00 -1.55 0.00 0.00 70.33 68.03 2x7j n THR 77 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2x7j s SER 78 N -4.64 6.07 0.00 1.09 1.04 -1.11 -4.17 113.70 111.98 2x7j s SER 78 Ca 0.57 2.00 0.00 0.00 0.48 0.00 0.00 55.95 59.01 2x7j s SER 78 Cb -0.02 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.53 2x7j s SER 78 CO 0.39 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 174.25 2x7j n GLY 79 N -0.18 -0.08 0.23 7.32 0.00 -1.15 -4.52 105.19 106.81 2x7j n GLY 79 Ca 0.10 -2.02 0.16 0.00 0.00 0.00 0.00 46.02 44.26 2x7j n GLY 79 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2x7j h THR 80 N 0.00 0.00 -0.42 2.61 1.35 -1.91 -2.44 112.91 112.10 2x7j h THR 80 Ca 0.00 -0.04 0.09 0.00 -0.55 0.00 0.00 66.41 65.91 2x7j h THR 80 Cb 0.00 0.75 -0.09 0.00 -1.73 0.00 0.00 68.15 67.08 2x7j h THR 80 CO 0.00 0.00 -0.20 0.00 -0.25 0.00 0.00 175.52 175.07 2x7j h ALA 81 N 2.02 0.11 -0.20 6.62 0.00 -1.83 -0.32 119.26 125.67 2x7j h ALA 81 Ca 0.00 0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 2x7j h ALA 81 Cb 0.05 0.48 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2x7j h ALA 81 CO 0.00 -0.56 -0.25 0.00 0.00 0.00 0.00 179.25 178.44 2x7j h ALA 82 N 1.17 1.20 0.00 0.00 0.00 -1.60 -2.10 119.26 117.94 2x7j h ALA 82 Ca 0.20 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2x7j h ALA 82 Cb 0.43 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 2x7j h ALA 82 CO -0.49 0.52 -0.09 0.00 0.00 0.00 0.00 179.25 179.18 2x7j h ALA 83 N 1.41 1.32 0.00 0.00 0.00 -1.18 -1.27 119.26 119.55 2x7j h ALA 83 Ca 0.05 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2x7j h ALA 83 Cb 0.63 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2x7j h ALA 83 CO 0.04 0.12 0.00 0.09 0.00 0.00 0.00 179.25 179.50 2x7j n ASN 84 N -3.67 0.27 0.05 0.00 3.02 -0.56 -2.27 115.26 112.10 2x7j n ASN 84 Ca -0.02 0.55 0.14 0.00 -0.03 0.00 0.00 54.58 55.22 2x7j n ASN 84 Cb 0.21 -0.62 0.53 0.00 -0.61 0.00 0.00 39.78 39.29 2x7j n ASN 84 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2x7j n PHE 85 N -1.79 0.40 -0.14 3.10 3.72 -0.48 -3.74 117.46 118.54 2x7j n PHE 85 Ca 0.04 0.12 -0.04 0.00 -0.05 0.00 0.00 57.45 57.52 2x7j n PHE 85 Cb 0.24 -0.69 0.04 0.00 -0.94 0.00 0.00 39.48 38.14 2x7j n PHE 85 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 176.76 175.79 2x7j h TYR 86 N 0.00 0.20 -0.93 1.38 3.20 -1.59 -0.34 116.97 118.88 2x7j h TYR 86 Ca 0.00 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 2x7j h TYR 86 Cb 0.60 -0.02 -0.05 0.00 1.54 0.00 0.00 36.73 38.80 2x7j h TYR 86 CO 0.00 0.04 0.58 -1.35 -1.64 0.00 0.00 178.16 175.79 2x7j h PRO 87 N 0.26 1.26 -0.48 1.82 0.11 -1.83 -0.66 132.00 132.48 2x7j h PRO 87 Ca 0.21 -0.10 -0.13 0.00 0.11 0.00 0.00 66.00 66.09 2x7j h PRO 87 Cb 0.24 -0.27 -0.01 0.00 0.11 0.00 0.00 31.00 31.07 2x7j h PRO 87 CO -0.25 0.87 -0.20 0.00 -0.21 0.00 0.00 178.00 178.21 2x7j h ALA 88 N 1.32 0.67 -0.51 -0.75 0.00 -1.62 -1.62 119.26 116.75 2x7j h ALA 88 Ca 0.34 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2x7j h ALA 88 Cb -0.08 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2x7j h ALA 88 CO -0.07 0.65 0.26 0.28 0.00 0.00 0.00 179.25 180.37 2x7j h VAL 89 N 0.83 1.18 -0.42 0.00 2.07 -0.56 0.12 116.25 119.47 2x7j h VAL 89 Ca 0.11 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 67.14 2x7j h VAL 89 Cb 0.77 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 2x7j h VAL 89 CO 0.06 0.20 0.27 0.58 0.02 0.00 0.00 177.57 178.71 2x7j h VAL 90 N 0.67 1.12 -0.67 2.57 2.07 -1.01 0.04 116.25 121.05 2x7j h VAL 90 Ca 0.18 -0.23 -0.05 0.00 0.82 0.00 0.00 66.70 67.41 2x7j h VAL 90 Cb 0.09 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 2x7j h VAL 90 CO -0.03 0.11 0.22 -0.08 0.02 0.00 0.00 177.57 177.81 2x7j h GLU 91 N 0.57 1.03 -0.68 1.57 4.57 -0.92 -2.48 114.58 118.25 2x7j h GLU 91 Ca 0.15 -0.22 -0.02 0.00 -1.18 0.00 0.00 59.36 58.10 2x7j h GLU 91 Cb -0.05 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.36 2x7j h GLU 91 CO -0.03 0.89 0.35 0.00 -1.18 0.00 0.00 179.01 179.05 2x7j h ALA 92 N 1.09 1.35 -0.15 2.92 0.00 -0.44 0.03 119.26 124.06 2x7j h ALA 92 Ca 0.22 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2x7j h ALA 92 Cb 0.29 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2x7j h ALA 92 CO -0.01 0.52 0.06 1.25 0.00 0.00 0.00 179.25 181.07 2x7j h HIS 93 N 0.94 0.24 -0.00 0.00 -0.00 -0.62 0.14 115.15 115.85 2x7j h HIS 93 Ca 0.24 -0.02 -0.23 0.00 -0.00 0.00 0.00 60.37 60.36 2x7j h HIS 93 Cb 0.05 -0.07 0.00 0.00 -0.00 0.00 0.00 27.41 27.39 2x7j h HIS 93 CO 0.01 0.31 -0.94 1.88 -0.00 0.00 0.00 177.93 179.19 2x7j h TYR 94 N 0.09 0.64 0.00 5.26 0.05 -1.31 -3.11 116.97 118.58 2x7j h TYR 94 Ca 0.05 -0.35 0.00 0.00 0.05 0.00 0.00 58.73 58.48 2x7j h TYR 94 Cb 0.18 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 37.85 2x7j h TYR 94 CO -0.01 1.17 0.00 0.43 -1.05 0.00 0.00 178.16 178.69 2x7j n SER 95 N -3.76 0.67 -2.42 3.88 7.64 -0.02 -4.78 113.62 114.84 2x7j n SER 95 Ca -0.07 0.58 -0.09 0.00 1.01 0.00 0.00 58.87 60.30 2x7j n SER 95 Cb 0.83 -0.76 0.04 0.00 -1.01 0.00 0.00 64.21 63.32 2x7j n SER 95 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2x7j n ARG 96 N -2.15 -2.53 -4.63 1.43 1.74 0.38 -5.00 116.66 105.90 2x7j n ARG 96 Ca 0.05 0.48 -0.33 0.00 -0.77 0.00 0.00 57.85 57.28 2x7j n ARG 96 Cb 0.38 -4.16 -0.15 0.00 -1.02 0.00 0.00 32.46 27.50 2x7j n ARG 96 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2x7j s VAL 97 N -3.21 2.70 -0.16 1.55 1.01 -0.43 -4.57 120.40 117.29 2x7j s VAL 97 Ca 0.12 -0.77 -0.29 0.00 0.00 0.00 0.00 61.98 61.04 2x7j s VAL 97 Cb -0.02 -2.13 -0.01 0.00 0.00 0.00 0.00 36.38 34.22 2x7j s VAL 97 CO 0.41 0.52 1.16 -2.16 0.00 0.00 0.00 175.10 175.03 2x7j s PRO 98 N 0.69 4.28 -0.00 2.72 0.04 -1.26 -3.38 135.00 138.09 2x7j s PRO 98 Ca -0.07 1.54 0.01 0.00 0.04 0.00 0.00 61.00 62.52 2x7j s PRO 98 Cb -0.16 -3.67 0.00 0.00 0.04 0.00 0.00 34.50 30.71 2x7j s PRO 98 CO 0.02 -0.60 -0.01 0.42 0.04 0.00 0.00 177.00 176.86 2x7j s ILE 99 N 3.06 0.13 -0.36 0.56 1.01 -1.16 -3.68 121.20 120.76 2x7j s ILE 99 Ca 0.51 -0.05 -0.08 0.00 0.00 0.00 0.00 60.65 61.03 2x7j s ILE 99 Cb -0.20 -0.13 0.05 0.00 0.01 0.00 0.00 42.46 42.19 2x7j s ILE 99 CO 0.13 0.05 0.16 -0.63 0.00 0.00 0.00 174.94 174.65 2x7j s ILE 100 N 0.07 4.06 -0.24 2.92 1.01 -0.06 -1.23 121.20 127.73 2x7j s ILE 100 Ca -0.00 -1.14 -0.15 0.00 0.00 0.00 0.00 60.65 59.36 2x7j s ILE 100 Cb -0.02 -3.34 -0.04 0.00 0.01 0.00 0.00 42.46 39.07 2x7j s ILE 100 CO -0.00 -0.27 0.35 -0.69 0.00 0.00 0.00 174.94 174.33 2x7j s VAL 101 N 1.44 5.21 -0.14 2.92 1.01 -0.23 0.32 120.40 130.93 2x7j s VAL 101 Ca 0.00 0.55 0.01 0.00 0.00 0.00 0.00 61.98 62.55 2x7j s VAL 101 Cb -0.20 -3.68 -0.00 0.00 0.00 0.00 0.00 36.38 32.50 2x7j s VAL 101 CO 0.03 0.22 -0.16 -0.76 0.00 0.00 0.00 175.10 174.43 2x7j s LEU 102 N 1.65 2.45 -0.13 3.92 1.43 0.25 -1.13 118.68 127.12 2x7j s LEU 102 Ca 0.15 -0.46 0.02 0.00 -1.03 0.00 0.00 54.13 52.82 2x7j s LEU 102 Cb -0.15 -1.54 0.01 0.00 0.03 0.00 0.00 46.19 44.54 2x7j s LEU 102 CO 0.08 0.11 -0.21 0.42 0.23 0.00 0.00 176.35 176.99 2x7j s THR 103 N 0.65 1.96 0.43 5.49 -4.23 -0.88 -1.97 115.64 117.09 2x7j s THR 103 Ca -0.09 -0.92 -0.23 0.00 -1.18 0.00 0.00 61.69 59.27 2x7j s THR 103 Cb -0.16 -1.73 -0.08 0.00 1.34 0.00 0.00 72.50 71.87 2x7j s THR 103 CO 0.02 0.53 1.11 0.00 -0.54 0.00 0.00 174.62 175.75 2x7j s ALA 104 N 0.80 3.03 0.08 3.99 0.00 -0.83 0.68 121.76 129.51 2x7j s ALA 104 Ca -0.08 0.83 0.00 0.00 0.00 0.00 0.00 51.96 52.71 2x7j s ALA 104 Cb -0.16 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 2x7j s ALA 104 CO -0.01 -0.45 -0.04 0.34 0.00 0.00 0.00 175.76 175.59 2x7j s ASP 105 N -1.46 0.83 0.78 0.00 -1.08 -0.31 -2.73 116.67 112.70 2x7j s ASP 105 Ca 0.61 -1.01 -0.11 0.00 -0.52 0.00 0.00 52.55 51.52 2x7j s ASP 105 Cb -0.25 0.15 0.06 0.00 -1.46 0.00 0.00 42.92 41.41 2x7j s ASP 105 CO 0.31 -0.53 1.09 -0.13 0.52 0.00 0.00 175.17 176.43 2x7j s ARG 106 N -3.88 2.20 0.82 4.34 3.00 -1.26 -0.80 118.95 123.38 2x7j s ARG 106 Ca 0.10 1.20 -0.12 0.00 0.00 0.00 0.00 55.73 56.91 2x7j s ARG 106 Cb 0.07 -1.89 0.08 0.00 0.00 0.00 0.00 34.95 33.21 2x7j s ARG 106 CO -0.07 -1.69 1.10 -1.25 0.00 0.00 0.00 175.30 173.40 2x7j s PRO 107 N -4.87 1.89 0.27 3.54 0.04 -1.25 -4.36 135.00 130.26 2x7j s PRO 107 Ca 0.62 0.62 -0.02 0.00 0.04 0.00 0.00 61.00 62.25 2x7j s PRO 107 Cb -0.18 -1.90 0.59 0.00 0.04 0.00 0.00 34.50 33.06 2x7j s PRO 107 CO 0.56 -1.75 1.62 0.45 0.04 0.00 0.00 177.00 177.91 2x7j h HIS 108 N -1.19 0.04 0.00 0.56 3.86 -1.96 0.14 115.15 116.60 2x7j h HIS 108 Ca -0.48 0.06 0.00 0.00 -1.16 0.00 0.00 60.37 58.79 2x7j h HIS 108 Cb 1.28 0.12 0.00 0.00 1.06 0.00 0.00 27.41 29.87 2x7j h HIS 108 CO 0.44 -0.29 0.00 -0.85 0.86 0.00 0.00 177.93 178.09 2x7j n GLU 109 N -5.36 0.07 -0.04 2.45 0.00 -1.26 -1.57 120.64 114.92 2x7j n GLU 109 Ca 0.18 0.27 0.06 0.00 0.00 0.00 0.00 57.16 57.66 2x7j n GLU 109 Cb 0.60 -1.50 0.08 0.00 0.00 0.00 0.00 31.44 30.62 2x7j n GLU 109 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2x7j n LEU 110 N -1.38 2.15 -4.71 -1.84 4.77 0.46 -5.01 117.00 111.44 2x7j n LEU 110 Ca 0.03 -2.57 -0.31 0.00 -0.03 0.00 0.00 56.01 53.13 2x7j n LEU 110 Cb 0.09 -0.24 -0.08 0.00 -2.33 0.00 0.00 43.42 40.86 2x7j n LEU 110 CO 0.08 0.61 -0.31 -0.13 -1.33 0.00 0.00 177.39 176.30 2x7j s ARG 111 N -2.02 2.75 -1.94 3.23 0.52 -0.61 -4.48 118.95 116.40 2x7j s ARG 111 Ca 0.18 -0.69 0.00 0.00 -0.52 0.00 0.00 55.73 54.70 2x7j s ARG 111 Cb 0.15 -2.65 0.00 0.00 0.52 0.00 0.00 34.95 32.97 2x7j s ARG 111 CO 0.02 0.59 0.00 0.39 0.02 0.00 0.00 175.30 176.31 2x7j n GLU 112 N 0.93 -1.60 -0.74 3.54 -0.58 -1.26 -4.86 120.64 116.06 2x7j n GLU 112 Ca -0.12 1.09 0.04 0.00 -0.42 0.00 0.00 57.16 57.75 2x7j n GLU 112 Cb 0.52 -5.65 0.07 0.00 -0.57 0.00 0.00 31.44 25.81 2x7j n GLU 112 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 2x7j n VAL 113 N -3.36 0.72 -1.52 2.62 0.24 -1.26 -5.01 118.33 110.76 2x7j n VAL 113 Ca -0.23 -1.27 -0.08 0.00 -2.04 0.00 0.00 64.34 60.71 2x7j n VAL 113 Cb 0.68 0.39 -0.03 0.00 -1.47 0.00 0.00 33.84 33.42 2x7j n VAL 113 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2x7j n GLY 114 N -0.30 0.73 3.77 7.63 0.00 -1.26 -5.02 105.19 110.73 2x7j n GLY 114 Ca 0.08 -0.62 -0.35 0.00 0.00 0.00 0.00 46.02 45.13 2x7j n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x7j s ALA 115 N -2.35 2.64 0.06 4.61 0.00 -1.26 -4.93 121.76 120.53 2x7j s ALA 115 Ca 0.00 0.79 -0.31 0.00 0.00 0.00 0.00 51.96 52.44 2x7j s ALA 115 Cb 0.00 -3.36 -0.08 0.00 0.00 0.00 0.00 23.12 19.68 2x7j s ALA 115 CO 0.00 -0.89 1.58 -1.25 0.00 0.00 0.00 175.76 175.19 2x7j s PRO 116 N -3.43 4.22 0.00 0.00 0.04 -1.26 -2.81 135.00 131.76 2x7j s PRO 116 Ca 0.72 2.23 0.00 0.00 0.04 0.00 0.00 61.00 63.99 2x7j s PRO 116 Cb -0.24 -3.55 0.00 0.00 0.04 0.00 0.00 34.50 30.75 2x7j s PRO 116 CO 0.30 -0.68 0.00 0.94 0.04 0.00 0.00 177.00 177.60 2x7j n GLN 117 N 5.39 0.00 -3.80 4.56 7.27 -1.26 -5.02 117.38 124.52 2x7j n GLN 117 Ca 0.15 0.01 -0.36 0.00 0.07 0.00 0.00 57.00 56.87 2x7j n GLN 117 Cb 0.41 -3.00 -0.11 0.00 2.41 0.00 0.00 30.24 29.95 2x7j n GLN 117 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2x7j s ALA 118 N -2.00 3.32 0.40 1.69 0.00 -1.12 -2.93 121.76 121.11 2x7j s ALA 118 Ca 0.00 -1.00 0.06 0.00 0.00 0.00 0.00 51.96 51.01 2x7j s ALA 118 Cb 0.00 -2.12 -0.07 0.00 0.00 0.00 0.00 23.12 20.93 2x7j s ALA 118 CO 0.00 -0.30 0.02 0.96 0.00 0.00 0.00 175.76 176.45 2x7j s ILE 119 N 1.26 1.68 -0.38 0.00 -4.36 -1.26 -4.79 121.20 113.35 2x7j s ILE 119 Ca 0.05 -2.00 -0.29 0.00 -0.26 0.00 0.00 60.65 58.16 2x7j s ILE 119 Cb -0.14 -2.85 0.01 0.00 1.25 0.00 0.00 42.46 40.73 2x7j s ILE 119 CO 0.04 0.00 1.38 0.21 0.24 0.00 0.00 174.94 176.82 2x7j s ASN 120 N -3.67 6.42 0.00 4.36 2.47 -1.26 -4.84 114.94 118.42 2x7j s ASN 120 Ca 0.32 0.93 0.16 0.00 0.42 0.00 0.00 52.86 54.69 2x7j s ASN 120 Cb 0.09 -2.54 0.17 0.00 -1.45 0.00 0.00 41.25 37.52 2x7j s ASN 120 CO 0.16 -1.34 1.07 0.00 -3.72 0.00 0.00 177.10 173.26 2x7j n GLN 121 N 7.88 1.47 -1.95 0.43 6.02 -1.26 -4.77 117.38 125.20 2x7j n GLN 121 Ca 0.16 -1.58 -0.42 0.00 -0.01 0.00 0.00 57.00 55.14 2x7j n GLN 121 Cb 0.48 -1.33 -0.03 0.00 1.02 0.00 0.00 30.24 30.38 2x7j n GLN 121 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 2x7j s HIS 122 N -1.33 2.44 -1.04 1.08 3.76 -1.26 -2.26 115.29 116.68 2x7j s HIS 122 Ca 0.21 0.36 -0.02 0.00 -0.15 0.00 0.00 55.06 55.46 2x7j s HIS 122 Cb 0.14 -3.94 0.01 0.00 1.11 0.00 0.00 32.58 29.91 2x7j s HIS 122 CO 0.21 -3.75 0.09 1.19 -0.85 0.00 0.00 174.74 171.63 2x7j n PHE 123 N 5.63 -1.52 -0.33 1.40 3.01 -1.26 -4.82 117.46 119.57 2x7j n PHE 123 Ca 0.16 0.08 0.08 0.00 1.01 0.00 0.00 57.45 58.78 2x7j n PHE 123 Cb 0.41 -2.73 0.17 0.00 -0.01 0.00 0.00 39.48 37.31 2x7j n PHE 123 CO 0.00 0.00 0.00 -0.11 1.01 0.00 0.00 176.76 177.66 2x7j n LEU 124 N -2.96 -0.28 -1.10 4.37 7.94 -0.96 -1.02 117.00 123.00 2x7j n LEU 124 Ca -0.12 1.61 0.08 0.00 -1.11 0.00 0.00 56.01 56.47 2x7j n LEU 124 Cb 0.59 -0.51 0.25 0.00 0.53 0.00 0.00 43.42 44.28 2x7j n LEU 124 CO 0.22 -1.56 0.70 0.49 -1.11 0.00 0.00 177.39 176.12 2x7j n PHE 125 N -5.50 0.89 -2.19 1.96 3.72 -1.26 -5.02 117.46 110.06 2x7j n PHE 125 Ca 0.17 -0.39 0.00 0.00 -0.05 0.00 0.00 57.45 57.18 2x7j n PHE 125 Cb 0.53 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.98 2x7j n PHE 125 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2x7j n GLY 126 N 1.15 2.64 1.21 1.37 0.00 -0.19 -1.78 105.19 109.58 2x7j n GLY 126 Ca 0.18 -0.25 0.08 0.00 0.00 0.00 0.00 46.02 46.03 2x7j n GLY 126 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2x7j n ASN 127 N 1.06 3.52 0.00 1.61 3.02 -1.26 -3.71 115.26 119.49 2x7j n ASN 127 Ca 0.00 -2.23 0.09 0.00 -0.03 0.00 0.00 54.58 52.41 2x7j n ASN 127 Cb 0.00 -0.46 0.42 0.00 -0.61 0.00 0.00 39.78 39.13 2x7j n ASN 127 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2x7j n PHE 128 N 0.94 0.00 -5.24 3.10 3.01 -0.73 -4.61 117.46 113.91 2x7j n PHE 128 Ca 0.20 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.35 2x7j n PHE 128 Cb 0.63 -0.40 -0.16 0.00 -0.01 0.00 0.00 39.48 39.55 2x7j n PHE 128 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 2x7j s VAL 129 N -2.79 1.95 -0.93 -4.37 -7.23 -1.24 -4.50 120.40 101.29 2x7j s VAL 129 Ca 0.13 -1.06 0.25 0.00 -1.81 0.00 0.00 61.98 59.49 2x7j s VAL 129 Cb 0.12 -1.62 0.03 0.00 0.56 0.00 0.00 36.38 35.47 2x7j s VAL 129 CO 0.30 0.55 1.44 2.29 -0.31 0.00 0.00 175.10 179.38 2x7j n LYS 130 N 2.48 0.06 -3.72 4.82 2.85 -1.13 -4.80 118.16 118.70 2x7j n LYS 130 Ca -0.16 0.02 -0.17 0.00 -1.05 0.00 0.00 58.31 56.95 2x7j n LYS 130 Cb 0.51 -1.53 -0.16 0.00 -0.65 0.00 0.00 35.03 33.20 2x7j n LYS 130 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 177.40 177.47 2x7j s PHE 131 N -3.03 -0.01 -0.00 5.58 5.36 -1.26 -5.10 117.98 119.52 2x7j s PHE 131 Ca 0.10 0.27 0.02 0.00 -0.96 0.00 0.00 56.93 56.36 2x7j s PHE 131 Cb 0.17 -0.30 -0.01 0.00 -0.34 0.00 0.00 43.02 42.54 2x7j s PHE 131 CO 0.69 -0.15 -0.07 0.12 -1.46 0.00 0.00 175.22 174.34 2x7j s PHE 132 N 1.56 0.67 -0.00 10.12 5.36 -1.26 -1.13 117.98 133.30 2x7j s PHE 132 Ca -0.03 -0.14 -0.13 0.00 -0.96 0.00 0.00 56.93 55.67 2x7j s PHE 132 Cb -0.12 -0.43 0.02 0.00 -0.34 0.00 0.00 43.02 42.14 2x7j s PHE 132 CO -0.04 -0.01 0.26 -0.08 -1.46 0.00 0.00 175.22 173.89 2x7j s THR 133 N -0.21 0.07 -0.54 0.12 -1.32 -0.87 -5.02 115.64 107.88 2x7j s THR 133 Ca 0.03 -0.56 -0.20 0.00 -1.21 0.00 0.00 61.69 59.74 2x7j s THR 133 Cb -0.03 -0.61 0.07 0.00 -1.51 0.00 0.00 72.50 70.41 2x7j s THR 133 CO -0.00 -0.31 0.69 -0.62 -2.21 0.00 0.00 174.62 172.17 2x7j s ASP 134 N -1.44 6.22 0.69 8.08 2.15 -1.26 -0.39 116.67 130.72 2x7j s ASP 134 Ca -0.13 -0.97 -0.15 0.00 0.43 0.00 0.00 52.55 51.74 2x7j s ASP 134 Cb -0.05 -2.31 0.02 0.00 -0.30 0.00 0.00 42.92 40.27 2x7j s ASP 134 CO 0.03 -1.00 1.14 -0.94 -0.17 0.00 0.00 175.17 174.23 2x7j s SER 135 N 2.94 4.75 0.71 -0.34 1.04 0.01 -4.96 113.70 117.85 2x7j s SER 135 Ca 0.16 2.09 -0.16 0.00 0.48 0.00 0.00 55.95 58.53 2x7j s SER 135 Cb -0.19 -2.56 0.03 0.00 0.10 0.00 0.00 66.02 63.39 2x7j s SER 135 CO 0.11 -1.88 1.25 0.00 0.98 0.00 0.00 173.24 173.70 2x7j n ALA 136 N -2.62 0.64 -1.77 5.32 0.00 -1.26 -4.44 120.51 116.39 2x7j n ALA 136 Ca 0.11 -0.13 -0.40 0.00 0.00 0.00 0.00 53.44 53.01 2x7j n ALA 136 Cb 0.52 -2.29 0.01 0.00 0.00 0.00 0.00 19.45 17.69 2x7j n ALA 136 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2x7j n LEU 137 N -2.42 5.01 -4.61 0.00 4.77 -1.26 -4.79 117.00 113.70 2x7j n LEU 137 Ca 0.15 1.17 -0.45 0.00 -0.03 0.00 0.00 56.01 56.85 2x7j n LEU 137 Cb 0.49 -1.62 -0.02 0.00 -2.33 0.00 0.00 43.42 39.94 2x7j n LEU 137 CO 0.48 0.00 0.70 -2.65 -1.33 0.00 0.00 177.39 174.58 2x7j n PRO 138 N 0.08 1.51 -3.95 3.23 -0.02 -1.26 -5.01 135.00 129.58 2x7j n PRO 138 Ca 0.03 0.53 -0.08 0.00 -2.02 0.00 0.00 63.50 61.96 2x7j n PRO 138 Cb 0.40 -1.99 -0.08 0.00 -0.02 0.00 0.00 33.50 31.81 2x7j n PRO 138 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2x7j s GLU 139 N -1.24 0.74 0.00 -0.52 2.02 -1.26 -4.87 118.70 113.56 2x7j s GLU 139 Ca 0.62 -1.04 0.19 0.00 0.02 0.00 0.00 54.97 54.76 2x7j s GLU 139 Cb -0.70 0.29 0.13 0.00 0.10 0.00 0.00 34.13 33.94 2x7j s GLU 139 CO 0.58 -0.20 1.07 -0.85 0.02 0.00 0.00 175.26 175.88 2x7j n GLU 140 N 0.06 1.61 -2.14 1.61 0.28 -1.26 -4.58 120.64 116.22 2x7j n GLU 140 Ca -0.15 -1.53 -0.36 0.00 -0.16 0.00 0.00 57.16 54.96 2x7j n GLU 140 Cb 0.62 -1.36 0.01 0.00 1.43 0.00 0.00 31.44 32.14 2x7j n GLU 140 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 2x7j s SER 141 N -1.63 5.74 0.44 -1.84 1.04 -1.26 -4.80 113.70 111.38 2x7j s SER 141 Ca 0.21 2.35 0.11 0.00 0.48 0.00 0.00 55.95 59.10 2x7j s SER 141 Cb 0.16 -2.60 0.99 0.00 0.10 0.00 0.00 66.02 64.66 2x7j s SER 141 CO 0.26 -1.22 2.06 -0.65 0.98 0.00 0.00 173.24 174.67 2x7j h PRO 142 N 1.52 0.40 -0.33 4.02 0.11 -1.99 -0.24 132.00 135.49 2x7j h PRO 142 Ca -0.50 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.47 2x7j h PRO 142 Cb 1.27 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2x7j h PRO 142 CO 0.58 0.26 -0.26 0.37 -0.21 0.00 0.00 178.00 178.74 2x7j h GLN 143 N 0.41 0.66 0.00 1.05 5.75 -2.00 -1.90 115.11 119.09 2x7j h GLN 143 Ca 0.15 -0.28 -0.13 0.00 -0.15 0.00 0.00 58.65 58.25 2x7j h GLN 143 Cb 0.11 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.61 2x7j h GLN 143 CO -0.04 0.86 -0.60 0.52 -2.65 0.00 0.00 178.83 176.93 2x7j h MET 144 N 0.58 0.00 0.00 1.69 2.86 -1.45 -1.17 114.93 117.44 2x7j h MET 144 Ca 0.08 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.62 2x7j h MET 144 Cb 0.75 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.39 2x7j h MET 144 CO 0.06 0.60 -0.48 -0.07 1.06 0.00 0.00 176.91 178.08 2x7j h LEU 145 N 0.00 0.00 -0.30 1.22 3.38 -1.01 -1.31 115.31 117.29 2x7j h LEU 145 Ca -0.01 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.77 2x7j h LEU 145 Cb 1.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.08 2x7j h LEU 145 CO 0.08 0.48 -0.63 0.03 0.09 0.00 0.00 178.44 178.48 2x7j h ARG 146 N 0.00 0.76 -0.45 1.13 3.08 -1.20 -2.71 114.38 114.99 2x7j h ARG 146 Ca -0.00 -0.53 -0.01 0.00 0.07 0.00 0.00 59.98 59.50 2x7j h ARG 146 Cb 0.99 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 31.10 2x7j h ARG 146 CO 0.06 1.15 0.24 -0.92 -1.07 0.00 0.00 179.97 179.43 2x7j h TYR 147 N 0.56 0.63 0.02 3.04 3.20 -0.96 -1.02 116.97 122.44 2x7j h TYR 147 Ca -0.01 -0.02 -0.24 0.00 3.14 0.00 0.00 58.73 61.59 2x7j h TYR 147 Cb 1.23 -0.20 0.01 0.00 1.54 0.00 0.00 36.73 39.31 2x7j h TYR 147 CO 0.07 0.49 -1.01 0.97 -1.64 0.00 0.00 178.16 177.04 2x7j h ILE 148 N 0.59 1.38 -0.36 1.81 6.09 -1.31 -0.04 117.51 125.67 2x7j h ILE 148 Ca 0.16 -2.47 -0.01 0.00 -1.37 0.00 0.00 64.86 61.17 2x7j h ILE 148 Cb 0.08 2.48 -0.02 0.00 0.47 0.00 0.00 36.82 39.83 2x7j h ILE 148 CO -0.02 0.74 0.18 0.03 -3.07 0.00 0.00 178.15 176.01 2x7j h ARG 149 N 0.25 0.51 -0.85 2.19 3.08 -1.49 -1.86 114.38 116.22 2x7j h ARG 149 Ca -0.10 -0.07 0.09 0.00 0.07 0.00 0.00 59.98 59.96 2x7j h ARG 149 Cb 1.66 -0.09 -0.07 0.00 0.08 0.00 0.00 29.97 31.55 2x7j h ARG 149 CO 0.18 0.45 0.50 1.15 -1.07 0.00 0.00 179.97 181.19 2x7j h THR 150 N 0.45 0.95 -0.53 2.04 2.02 -1.05 -1.67 112.91 115.12 2x7j h THR 150 Ca 0.12 -0.30 -0.02 0.00 0.77 0.00 0.00 66.41 66.99 2x7j h THR 150 Cb 0.10 0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 66.50 2x7j h THR 150 CO -0.02 0.16 0.27 0.25 0.37 0.00 0.00 175.52 176.55 2x7j h LEU 151 N 0.86 0.68 -0.13 2.58 5.85 -0.71 0.98 115.31 125.42 2x7j h LEU 151 Ca 0.40 -0.11 0.01 0.00 0.84 0.00 0.00 57.88 59.02 2x7j h LEU 151 Cb 0.31 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 2x7j h LEU 151 CO -0.23 0.60 0.04 0.00 -0.34 0.00 0.00 178.44 178.51 2x7j h ALA 152 N 1.11 0.14 -0.74 1.25 0.00 -0.89 0.17 119.26 120.30 2x7j h ALA 152 Ca 0.18 0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.17 2x7j h ALA 152 Cb 0.09 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 2x7j h ALA 152 CO -0.03 -0.41 0.43 0.77 0.00 0.00 0.00 179.25 180.02 2x7j h SER 153 N 0.10 0.65 -0.26 0.00 0.02 -1.00 -1.22 113.55 111.84 2x7j h SER 153 Ca 0.06 0.03 -0.05 0.00 -0.84 0.00 0.00 61.79 60.99 2x7j h SER 153 Cb 0.04 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 2x7j h SER 153 CO -0.06 0.42 -0.02 -0.09 -1.14 0.00 0.00 176.83 175.94 2x7j h ARG 154 N 0.79 0.47 -0.52 3.45 2.43 -0.46 0.82 114.38 121.36 2x7j h ARG 154 Ca 0.33 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 2x7j h ARG 154 Cb 0.18 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.67 2x7j h ARG 154 CO -0.18 0.66 0.34 0.00 -1.51 0.00 0.00 179.97 179.27 2x7j h ALA 155 N 0.80 0.66 -0.74 2.80 0.00 -0.36 -0.42 119.26 122.00 2x7j h ALA 155 Ca 0.07 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2x7j h ALA 155 Cb 0.46 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2x7j h ALA 155 CO 0.02 0.12 0.32 0.00 0.00 0.00 0.00 179.25 179.70 2x7j h ALA 156 N 1.18 1.15 -0.12 0.00 0.00 -1.08 -2.09 119.26 118.30 2x7j h ALA 156 Ca 0.19 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 2x7j h ALA 156 Cb -0.06 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 2x7j h ALA 156 CO -0.04 0.62 -0.50 0.78 0.00 0.00 0.00 179.25 180.11 2x7j h GLY 157 N 1.12 0.35 1.32 0.00 0.00 -0.28 -2.67 103.07 102.92 2x7j h GLY 157 Ca 0.25 -0.38 -0.23 0.00 0.00 0.00 0.00 47.33 46.97 2x7j h GLY 157 CO -0.02 0.34 -0.90 0.83 0.00 0.00 0.00 176.54 176.78 2x7j h GLU 158 N 0.25 0.63 -0.44 4.80 4.39 -0.86 -0.55 114.58 122.79 2x7j h GLU 158 Ca 0.01 -0.60 -0.00 0.00 0.34 0.00 0.00 59.36 59.10 2x7j h GLU 158 Cb 0.97 0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.76 2x7j h GLU 158 CO 0.08 1.21 0.26 0.00 -1.16 0.00 0.00 179.01 179.40 2x7j h ALA 159 N 0.59 1.62 0.00 3.43 0.00 -1.18 -2.98 119.26 120.74 2x7j h ALA 159 Ca -0.08 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2x7j h ALA 159 Cb 1.54 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2x7j h ALA 159 CO 0.17 0.33 -0.99 1.04 0.00 0.00 0.00 179.25 179.80 2x7j n GLN 160 N -4.44 0.57 -2.09 0.00 6.02 -1.02 -1.92 117.38 114.51 2x7j n GLN 160 Ca 0.03 0.11 -0.41 0.00 -0.01 0.00 0.00 57.00 56.73 2x7j n GLN 160 Cb 0.08 -1.81 -0.02 0.00 1.02 0.00 0.00 30.24 29.51 2x7j n GLN 160 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 2x7j s LYS 161 N -3.35 4.32 0.95 -1.09 2.20 -0.22 -4.64 119.74 117.92 2x7j s LYS 161 Ca 0.00 2.22 -0.12 0.00 -0.36 0.00 0.00 55.97 57.72 2x7j s LYS 161 Cb 0.10 -3.11 0.10 0.00 -1.51 0.00 0.00 37.83 33.40 2x7j s LYS 161 CO 0.79 -0.30 0.72 0.54 -0.36 0.00 0.00 175.35 176.73 2x7j n ARG 162 N 1.84 -0.51 -0.28 4.03 1.74 -1.26 -2.79 116.66 119.43 2x7j n ARG 162 Ca 0.04 -0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.02 2x7j n ARG 162 Cb 0.41 -2.08 0.00 0.00 -1.02 0.00 0.00 32.46 29.77 2x7j n ARG 162 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2x7j n PRO 163 N -2.91 0.00 -1.20 5.56 -0.04 -1.26 -5.02 135.00 130.13 2x7j n PRO 163 Ca 0.08 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.20 2x7j n PRO 163 Cb 0.53 0.00 0.10 0.00 -0.04 0.00 0.00 33.50 34.10 2x7j n PRO 163 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2x7j n MET 164 N 0.54 0.29 -3.23 0.54 2.81 -1.12 -4.95 117.12 112.00 2x7j n MET 164 Ca 0.00 0.16 0.00 0.00 -1.81 0.00 0.00 57.70 56.05 2x7j n MET 164 Cb 0.00 -2.21 0.00 0.00 -0.71 0.00 0.00 33.22 30.30 2x7j n MET 164 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2x7j n GLY 165 N 1.01 -1.22 3.80 3.03 0.00 -0.81 -3.84 105.19 107.17 2x7j n GLY 165 Ca 0.12 -0.88 -0.34 0.00 0.00 0.00 0.00 46.02 44.92 2x7j n GLY 165 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2x7j s PRO 166 N -0.45 3.96 0.16 1.61 0.04 -1.22 -2.96 135.00 136.14 2x7j s PRO 166 Ca 0.00 1.30 0.03 0.00 0.04 0.00 0.00 61.00 62.37 2x7j s PRO 166 Cb 0.00 -2.16 -0.05 0.00 0.04 0.00 0.00 34.50 32.34 2x7j s PRO 166 CO 0.00 -0.28 -0.06 0.14 0.04 0.00 0.00 177.00 176.83 2x7j s VAL 167 N -2.02 1.00 -0.07 -0.36 -7.23 -0.36 -2.86 120.40 108.51 2x7j s VAL 167 Ca 0.65 -2.03 -0.00 0.00 -1.81 0.00 0.00 61.98 58.79 2x7j s VAL 167 Cb -0.14 -1.94 0.02 0.00 0.56 0.00 0.00 36.38 34.88 2x7j s VAL 167 CO 0.18 -0.66 -0.04 -2.28 -0.31 0.00 0.00 175.10 172.00 2x7j s HIS 168 N -3.44 0.89 -0.19 2.82 2.46 -0.29 -1.07 115.29 116.48 2x7j s HIS 168 Ca 0.19 -0.31 -0.01 0.00 0.47 0.00 0.00 55.06 55.40 2x7j s HIS 168 Cb 0.04 -0.85 0.01 0.00 -0.13 0.00 0.00 32.58 31.65 2x7j s HIS 168 CO 0.02 -0.31 -0.13 0.08 -2.47 0.00 0.00 174.74 171.92 2x7j s VAL 169 N 1.48 2.66 -0.20 0.89 1.01 -0.29 -2.05 120.40 123.90 2x7j s VAL 169 Ca -0.02 -0.74 -0.16 0.00 0.00 0.00 0.00 61.98 61.06 2x7j s VAL 169 Cb -0.13 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 2x7j s VAL 169 CO -0.03 0.49 0.40 0.21 0.00 0.00 0.00 175.10 176.17 2x7j s ASN 170 N 1.27 6.44 -0.56 3.32 2.47 0.47 -2.07 114.94 126.29 2x7j s ASN 170 Ca 0.03 0.51 -0.00 0.00 0.42 0.00 0.00 52.86 53.82 2x7j s ASN 170 Cb -0.14 -2.23 0.14 0.00 -1.45 0.00 0.00 41.25 37.57 2x7j s ASN 170 CO -0.07 -0.08 0.34 -0.69 -3.72 0.00 0.00 177.10 172.88 2x7j s VAL 171 N 1.33 3.26 0.23 -5.21 1.01 0.21 -0.81 120.40 120.43 2x7j s VAL 171 Ca 0.19 -2.96 -0.30 0.00 0.00 0.00 0.00 61.98 58.91 2x7j s VAL 171 Cb -0.15 -3.18 -0.09 0.00 0.00 0.00 0.00 36.38 32.96 2x7j s VAL 171 CO 0.08 -0.82 1.36 -2.16 0.00 0.00 0.00 175.10 173.56 2x7j s PRO 172 N 0.02 4.34 -0.02 2.72 0.04 -1.26 -1.16 135.00 139.68 2x7j s PRO 172 Ca 0.16 2.16 0.01 0.00 0.04 0.00 0.00 61.00 63.38 2x7j s PRO 172 Cb -0.22 -3.15 0.01 0.00 0.04 0.00 0.00 34.50 31.18 2x7j s PRO 172 CO -0.03 -0.31 -0.04 -0.51 0.04 0.00 0.00 177.00 176.15 2x7j s LEU 173 N -0.33 1.61 -0.11 -3.56 1.43 0.02 -4.43 118.68 113.31 2x7j s LEU 173 Ca 0.57 -0.09 -0.06 0.00 -1.03 0.00 0.00 54.13 53.52 2x7j s LEU 173 Cb -0.39 -0.32 -0.04 0.00 0.03 0.00 0.00 46.19 45.47 2x7j s LEU 173 CO 0.41 -0.01 0.11 -0.60 0.23 0.00 0.00 176.35 176.49 2x7j s ARG 174 N 0.45 3.36 -0.25 1.70 3.52 -1.26 -3.83 118.95 122.64 2x7j s ARG 174 Ca -0.05 -0.19 -0.29 0.00 -0.13 0.00 0.00 55.73 55.07 2x7j s ARG 174 Cb -0.09 -3.11 -0.03 0.00 -1.56 0.00 0.00 34.95 30.16 2x7j s ARG 174 CO -0.00 0.75 1.80 -1.21 -0.81 0.00 0.00 175.30 175.83 2x7j s GLU 175 N -0.97 3.52 -0.13 5.12 2.02 -1.26 -4.34 118.70 122.66 2x7j s GLU 175 Ca 0.14 1.67 -0.01 0.00 0.02 0.00 0.00 54.97 56.79 2x7j s GLU 175 Cb -0.12 -4.16 0.04 0.00 0.10 0.00 0.00 34.13 29.98 2x7j s GLU 175 CO 0.04 -1.64 -0.04 -2.14 0.02 0.00 0.00 175.26 171.50 2x7j s PRO 176 N 5.34 1.17 0.09 0.39 0.02 -1.26 -5.12 135.00 135.62 2x7j s PRO 176 Ca 0.80 -0.27 0.18 0.00 0.02 0.00 0.00 61.00 61.73 2x7j s PRO 176 Cb -0.26 -1.64 -0.11 0.00 0.02 0.00 0.00 34.50 32.50 2x7j s PRO 176 CO 0.33 -0.38 0.84 1.28 -0.33 0.00 0.00 177.00 178.75 2x7j n LEU 177 N 4.98 0.80 -4.67 -5.54 4.77 -1.26 -4.88 117.00 111.21 2x7j n LEU 177 Ca -0.11 0.34 -0.43 0.00 -0.03 0.00 0.00 56.01 55.79 2x7j n LEU 177 Cb 0.49 0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.61 2x7j n LEU 177 CO 0.15 0.07 1.04 -0.32 -1.33 0.00 0.00 177.39 176.99 2x7j s MET 178 N -3.04 4.26 0.56 3.23 1.75 -1.26 -4.00 119.30 120.80 2x7j s MET 178 Ca -0.03 1.63 -0.18 0.00 -1.25 0.00 0.00 55.69 55.86 2x7j s MET 178 Cb 0.09 -3.71 -0.05 0.00 2.84 0.00 0.00 34.83 34.00 2x7j s MET 178 CO 0.81 -0.64 1.08 -1.25 -0.65 0.00 0.00 175.02 174.37 2x7j s PRO 179 N 3.19 3.37 -0.63 4.11 0.04 -1.26 -4.93 135.00 138.88 2x7j s PRO 179 Ca 0.54 1.39 -0.24 0.00 0.04 0.00 0.00 61.00 62.73 2x7j s PRO 179 Cb -0.22 -2.03 0.05 0.00 0.04 0.00 0.00 34.50 32.35 2x7j s PRO 179 CO 0.15 -0.80 1.03 0.34 0.04 0.00 0.00 177.00 177.77 2x7j s ASP 180 N -2.25 6.24 0.19 6.66 -1.08 -1.26 -4.89 116.67 120.28 2x7j s ASP 180 Ca 0.68 -0.60 0.23 0.00 -0.52 0.00 0.00 52.55 52.33 2x7j s ASP 180 Cb -0.19 -2.46 0.90 0.00 -1.46 0.00 0.00 42.92 39.71 2x7j s ASP 180 CO 0.30 -1.45 1.69 0.18 0.52 0.00 0.00 175.17 176.42 2x7j n LEU 181 N 7.99 0.53 -0.96 -1.34 4.77 -1.26 -2.41 117.00 124.32 2x7j n LEU 181 Ca 0.00 0.61 0.07 0.00 -0.03 0.00 0.00 56.01 56.66 2x7j n LEU 181 Cb 0.47 -0.51 0.22 0.00 -2.33 0.00 0.00 43.42 41.27 2x7j n LEU 181 CO 0.66 -0.40 0.68 -1.54 -1.33 0.00 0.00 177.39 175.46 2x7j n SER 182 N -2.06 2.79 -2.25 -1.43 3.41 -1.26 -4.28 113.62 108.53 2x7j n SER 182 Ca 0.03 -2.08 -0.18 0.00 -0.26 0.00 0.00 58.87 56.38 2x7j n SER 182 Cb 0.26 -0.36 0.03 0.00 -0.26 0.00 0.00 64.21 63.88 2x7j n SER 182 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2x7j n ASP 183 N 0.84 4.07 -3.88 4.04 2.03 -1.01 -5.00 116.55 117.64 2x7j n ASP 183 Ca 0.16 -3.33 -0.35 0.00 0.52 0.00 0.00 54.79 51.80 2x7j n ASP 183 Cb 0.47 -0.38 0.02 0.00 -0.72 0.00 0.00 41.12 40.50 2x7j n ASP 183 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2x7j n GLU 184 N -0.65 -0.89 0.08 -0.67 1.02 -1.26 -4.83 120.64 113.44 2x7j n GLU 184 Ca 0.34 0.44 0.19 0.00 -0.02 0.00 0.00 57.16 58.12 2x7j n GLU 184 Cb 0.91 -2.76 0.74 0.00 -0.02 0.00 0.00 31.44 30.31 2x7j n GLU 184 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2x7j h PRO 185 N -1.53 0.00 -0.50 3.49 0.13 -1.80 -2.19 132.00 129.59 2x7j h PRO 185 Ca -0.65 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.48 2x7j h PRO 185 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 2x7j h PRO 185 CO 0.45 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.41 2x7j n PHE 186 N -4.00 0.66 -1.61 1.56 0.99 -1.26 -3.20 117.46 110.61 2x7j n PHE 186 Ca 0.07 -0.33 -0.49 0.00 -0.00 0.00 0.00 57.45 56.70 2x7j n PHE 186 Cb 0.54 0.00 -0.04 0.00 -1.00 0.00 0.00 39.48 38.98 2x7j n PHE 186 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2x7j n GLY 187 N 1.37 0.42 3.90 1.37 0.00 -0.83 -4.87 105.19 106.55 2x7j n GLY 187 Ca 0.18 0.59 -0.21 0.00 0.00 0.00 0.00 46.02 46.58 2x7j n GLY 187 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x7j s ARG 188 N 0.00 3.01 -0.01 1.61 0.52 -1.26 -4.84 118.95 117.98 2x7j s ARG 188 Ca 0.76 -1.06 0.16 0.00 -0.52 0.00 0.00 55.73 55.07 2x7j s ARG 188 Cb -0.82 -2.66 -0.22 0.00 0.52 0.00 0.00 34.95 31.76 2x7j s ARG 188 CO 0.49 0.23 0.47 -1.33 0.02 0.00 0.00 175.30 175.18 2x7j n MET 189 N -1.39 0.94 -4.52 3.54 2.81 -1.26 -5.01 117.12 112.23 2x7j n MET 189 Ca -0.04 -0.10 -0.24 0.00 -1.81 0.00 0.00 57.70 55.51 2x7j n MET 189 Cb 0.58 -1.34 -0.10 0.00 -0.71 0.00 0.00 33.22 31.65 2x7j n MET 189 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2x7j s ARG 190 N -2.91 1.78 -0.26 0.03 0.52 -1.26 -5.11 118.95 111.74 2x7j s ARG 190 Ca -0.02 -2.01 -0.18 0.00 -0.52 0.00 0.00 55.73 53.00 2x7j s ARG 190 Cb 0.11 -1.11 -0.03 0.00 0.52 0.00 0.00 34.95 34.45 2x7j s ARG 190 CO 0.67 -0.17 0.51 0.99 0.02 0.00 0.00 175.30 177.31 2x7j s THR 191 N -3.10 5.08 0.00 0.02 2.01 -1.26 -4.94 115.64 113.44 2x7j s THR 191 Ca 0.34 0.86 0.00 0.00 0.31 0.00 0.00 61.69 63.20 2x7j s THR 191 Cb 0.08 -3.82 0.00 0.00 0.01 0.00 0.00 72.50 68.77 2x7j s THR 191 CO 0.16 0.09 0.00 0.61 -0.69 0.00 0.00 174.62 174.79 2x7j n GLY 192 N 4.41 -1.56 3.65 4.40 0.00 -1.26 -4.91 105.19 109.92 2x7j n GLY 192 Ca -0.04 -1.37 -0.45 0.00 0.00 0.00 0.00 46.02 44.16 2x7j n GLY 192 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x7j n ARG 193 N 0.00 1.84 0.53 1.61 1.74 -1.26 -4.94 116.66 116.18 2x7j n ARG 193 Ca 0.00 0.65 -0.21 0.00 -0.77 0.00 0.00 57.85 57.52 2x7j n ARG 193 Cb 0.00 -2.23 -0.10 0.00 -1.02 0.00 0.00 32.46 29.11 2x7j n ARG 193 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2x7j h HIS 194 N 3.43 -1.26 -4.05 -1.55 -0.00 -1.94 -3.43 115.15 106.35 2x7j h HIS 194 Ca -0.44 -0.03 -0.57 0.00 -0.00 0.00 0.00 60.37 59.33 2x7j h HIS 194 Cb 1.30 0.42 -0.31 0.00 -0.00 0.00 0.00 27.41 28.81 2x7j h HIS 194 CO 0.54 -0.78 -0.84 0.08 -0.00 0.00 0.00 177.93 176.92 2x7j s VAL 195 N -5.96 1.47 -0.12 5.26 1.01 -1.26 -5.09 120.40 115.71 2x7j s VAL 195 Ca -0.20 -0.76 -0.04 0.00 0.00 0.00 0.00 61.98 60.98 2x7j s VAL 195 Cb 0.02 -1.25 -0.04 0.00 0.00 0.00 0.00 36.38 35.12 2x7j s VAL 195 CO 0.59 0.42 0.04 -0.94 0.00 0.00 0.00 175.10 175.21 2x7j s SER 196 N -0.12 5.48 -0.25 3.32 1.04 -1.26 -4.92 113.70 116.99 2x7j s SER 196 Ca -0.00 0.15 -0.07 0.00 0.48 0.00 0.00 55.95 56.51 2x7j s SER 196 Cb -0.10 -1.73 -0.02 0.00 0.10 0.00 0.00 66.02 64.27 2x7j s SER 196 CO 0.01 0.31 0.06 -0.69 0.98 0.00 0.00 173.24 173.91 2x7j s VAL 197 N -0.46 4.17 -0.44 5.02 1.01 -1.26 -5.06 120.40 123.39 2x7j s VAL 197 Ca 0.09 -0.23 -0.07 0.00 0.00 0.00 0.00 61.98 61.76 2x7j s VAL 197 Cb -0.12 -2.95 0.11 0.00 0.00 0.00 0.00 36.38 33.41 2x7j s VAL 197 CO 0.02 0.34 0.28 -0.54 0.00 0.00 0.00 175.10 175.20 2x7j s LYS 198 N 1.59 2.37 0.62 2.72 -0.14 -1.26 -5.07 119.74 120.58 2x7j s LYS 198 Ca 0.06 -1.70 -0.10 0.00 -1.36 0.00 0.00 55.97 52.87 2x7j s LYS 198 Cb -0.15 -3.78 -0.02 0.00 -1.68 0.00 0.00 37.83 32.20 2x7j s LYS 198 CO 0.03 -1.09 1.01 0.95 -0.76 0.00 0.00 175.35 175.48 2x7j s THR 199 N 1.31 4.31 0.00 2.17 -4.23 -1.26 -5.08 115.64 112.86 2x7j s THR 199 Ca 0.05 0.61 0.00 0.00 -1.18 0.00 0.00 61.69 61.17 2x7j s THR 199 Cb -0.24 -3.73 0.00 0.00 1.34 0.00 0.00 72.50 69.87 2x7j s THR 199 CO -0.01 -0.91 0.00 0.61 -0.54 0.00 0.00 174.62 173.77 2x7j n GLY 200 N -2.74 5.47 3.24 3.99 0.00 -1.26 -5.17 105.19 108.72 2x7j n GLY 200 Ca 0.05 -1.62 -0.17 0.00 0.00 0.00 0.00 46.02 44.28 2x7j n GLY 200 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2x7j s THR 201 N 1.44 1.28 -0.13 2.61 -1.32 -1.26 -4.98 115.64 113.28 2x7j s THR 201 Ca 0.00 -1.74 -0.07 0.00 -1.21 0.00 0.00 61.69 58.66 2x7j s THR 201 Cb 0.00 -1.54 -0.04 0.00 -1.51 0.00 0.00 72.50 69.40 2x7j s THR 201 CO 0.00 -0.46 0.14 -1.58 -2.21 0.00 0.00 174.62 170.51 2x7j s GLN 202 N -2.78 3.57 0.02 7.08 0.74 -1.26 -5.03 119.66 122.00 2x7j s GLN 202 Ca 0.09 -0.15 0.04 0.00 0.05 0.00 0.00 55.36 55.39 2x7j s GLN 202 Cb -0.04 -3.23 -0.02 0.00 1.10 0.00 0.00 33.01 30.83 2x7j s GLN 202 CO 0.03 0.69 -0.11 -1.12 -0.55 0.00 0.00 175.29 174.22 2x7j s SER 203 N -0.76 1.27 -0.12 6.67 0.01 -1.26 -1.25 113.70 118.25 2x7j s SER 203 Ca 0.14 -0.34 -0.03 0.00 1.31 0.00 0.00 55.95 57.02 2x7j s SER 203 Cb -0.12 -0.09 -0.03 0.00 0.21 0.00 0.00 66.02 65.99 2x7j s SER 203 CO 0.03 0.03 0.01 -0.69 0.41 0.00 0.00 173.24 173.02 2x7j s VAL 204 N -0.66 4.32 0.74 3.43 1.01 -1.26 -4.98 120.40 123.00 2x7j s VAL 204 Ca 0.01 -0.23 -0.11 0.00 0.00 0.00 0.00 61.98 61.65 2x7j s VAL 204 Cb -0.06 -2.86 0.03 0.00 0.00 0.00 0.00 36.38 33.49 2x7j s VAL 204 CO 0.00 0.56 1.08 1.51 0.00 0.00 0.00 175.10 178.25 2x7j s ASP 205 N -0.40 5.06 0.27 3.32 1.47 -1.26 -4.92 116.67 120.22 2x7j s ASP 205 Ca 0.08 1.38 -0.04 0.00 1.18 0.00 0.00 52.55 55.14 2x7j s ASP 205 Cb -0.12 -2.19 0.55 0.00 -0.34 0.00 0.00 42.92 40.82 2x7j s ASP 205 CO 0.02 -1.62 1.60 -0.09 0.68 0.00 0.00 175.17 175.77 2x7j h ARG 206 N -0.84 0.05 -0.43 2.11 2.43 -1.98 -2.86 114.38 112.86 2x7j h ARG 206 Ca -0.45 -0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 58.65 2x7j h ARG 206 Cb 1.24 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.76 2x7j h ARG 206 CO 0.60 0.04 0.02 1.49 -1.51 0.00 0.00 179.97 180.60 2x7j h GLU 207 N 0.05 0.75 0.00 0.20 4.81 -2.01 -2.16 114.58 116.22 2x7j h GLU 207 Ca 0.49 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 2x7j h GLU 207 Cb 0.90 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.21 2x7j h GLU 207 CO -0.81 0.81 0.00 -1.13 -0.73 0.00 0.00 179.01 177.15 2x7j n SER 208 N -4.42 0.00 -0.10 1.04 3.41 -1.09 -2.44 113.62 110.01 2x7j n SER 208 Ca -0.00 -0.60 0.12 0.00 -0.26 0.00 0.00 58.87 58.12 2x7j n SER 208 Cb 0.28 -0.12 0.17 0.00 -0.26 0.00 0.00 64.21 64.29 2x7j n SER 208 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2x7j n LEU 209 N -1.12 0.88 -0.31 1.04 4.32 -0.83 -4.61 117.00 116.38 2x7j n LEU 209 Ca 0.19 -0.24 -0.11 0.00 -0.02 0.00 0.00 56.01 55.83 2x7j n LEU 209 Cb 0.16 -0.14 -0.08 0.00 -1.62 0.00 0.00 43.42 41.73 2x7j n LEU 209 CO 0.19 0.19 0.50 0.28 -1.22 0.00 0.00 177.39 177.34 2x7j h SER 210 N 0.51 -1.95 -0.68 -1.43 0.02 -1.29 0.44 113.55 109.17 2x7j h SER 210 Ca 0.00 0.29 0.08 0.00 -0.84 0.00 0.00 61.79 61.32 2x7j h SER 210 Cb 0.53 0.85 -0.06 0.00 0.14 0.00 0.00 62.40 63.86 2x7j h SER 210 CO 0.00 -0.30 0.35 0.44 -1.14 0.00 0.00 176.83 176.18 2x7j h ASP 211 N -0.15 0.49 -0.23 3.07 5.19 -1.83 0.17 116.42 123.12 2x7j h ASP 211 Ca 0.15 0.05 -0.20 0.00 -0.62 0.00 0.00 57.03 56.41 2x7j h ASP 211 Cb 0.50 -0.04 0.00 0.00 0.18 0.00 0.00 39.33 39.97 2x7j h ASP 211 CO -0.81 0.30 -0.62 0.58 -3.12 0.00 0.00 179.24 175.56 2x7j h VAL 212 N 0.63 1.28 -0.46 -1.35 2.07 -1.71 -1.17 116.25 115.54 2x7j h VAL 212 Ca 0.32 -1.81 -0.00 0.00 0.82 0.00 0.00 66.70 66.03 2x7j h VAL 212 Cb 0.29 1.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.82 2x7j h VAL 212 CO -0.23 0.58 0.27 0.00 0.02 0.00 0.00 177.57 178.21 2x7j h ALA 213 N 0.62 0.58 -0.26 1.67 0.00 -0.51 -1.38 119.26 120.00 2x7j h ALA 213 Ca -0.01 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2x7j h ALA 213 Cb 1.24 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 2x7j h ALA 213 CO 0.13 0.08 0.15 0.93 0.00 0.00 0.00 179.25 180.55 2x7j h GLU 214 N 0.61 0.35 0.00 0.00 5.08 -0.52 -0.01 114.58 120.09 2x7j h GLU 214 Ca 0.16 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.42 2x7j h GLU 214 Cb 0.01 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 2x7j h GLU 214 CO -0.03 0.29 -0.33 0.00 -1.00 0.00 0.00 179.01 177.93 2x7j h MET 215 N 0.32 0.00 0.08 2.33 -0.00 -1.11 -2.21 114.93 114.35 2x7j h MET 215 Ca 0.09 0.00 -0.29 0.00 -0.00 0.00 0.00 59.70 59.50 2x7j h MET 215 Cb 0.03 0.00 0.03 0.00 -0.00 0.00 0.00 31.60 31.66 2x7j h MET 215 CO -0.02 0.33 -1.19 -0.07 -0.00 0.00 0.00 176.91 175.97 2x7j h LEU 216 N 0.00 0.89 -1.01 -0.10 3.38 -0.81 0.16 115.31 117.81 2x7j h LEU 216 Ca -0.00 -0.79 0.06 0.00 0.09 0.00 0.00 57.88 57.24 2x7j h LEU 216 Cb 0.60 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 41.01 2x7j h LEU 216 CO 0.04 1.59 0.65 0.00 0.09 0.00 0.00 178.44 180.81 2x7j h ALA 217 N 0.33 1.40 0.00 1.53 0.00 -0.91 -3.12 119.26 118.48 2x7j h ALA 217 Ca -0.17 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.55 2x7j h ALA 217 Cb 1.85 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 19.30 2x7j h ALA 217 CO 0.23 0.45 -1.01 0.93 0.00 0.00 0.00 179.25 179.85 2x7j h GLU 218 N 1.19 0.00 -6.40 0.00 4.39 -1.28 -3.44 114.58 109.04 2x7j h GLU 218 Ca 0.43 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 59.55 2x7j h GLU 218 Cb 0.15 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 28.71 2x7j h GLU 218 CO -0.17 0.50 0.75 0.00 -1.16 0.00 0.00 179.01 178.93 2x7j s ALA 219 N -2.88 3.18 0.03 3.43 0.00 0.54 -4.88 121.76 121.19 2x7j s ALA 219 Ca 0.00 -0.68 -0.26 0.00 0.00 0.00 0.00 51.96 51.02 2x7j s ALA 219 Cb 0.08 -3.77 -0.17 0.00 0.00 0.00 0.00 23.12 19.26 2x7j s ALA 219 CO 0.79 -2.19 1.43 1.49 0.00 0.00 0.00 175.76 177.28 2x7j h GLU 220 N 9.18 -0.24 -5.26 0.00 4.81 -1.85 -3.39 114.58 117.83 2x7j h GLU 220 Ca -0.24 0.02 -0.71 0.00 -0.13 0.00 0.00 59.36 58.30 2x7j h GLU 220 Cb 1.07 0.05 -0.14 0.00 0.63 0.00 0.00 28.75 30.37 2x7j h GLU 220 CO 1.08 0.02 1.68 0.15 -0.73 0.00 0.00 179.01 181.21 2x7j s LYS 221 N -5.17 4.01 0.26 1.92 1.02 -1.26 -4.93 119.74 115.59 2x7j s LYS 221 Ca -0.15 -2.26 0.11 0.00 0.02 0.00 0.00 55.97 53.70 2x7j s LYS 221 Cb 0.03 -5.26 -0.05 0.00 -0.52 0.00 0.00 37.83 32.04 2x7j s LYS 221 CO 0.62 -1.98 -0.17 0.20 -0.92 0.00 0.00 175.35 173.09 2x7j s GLY 222 N 3.51 1.82 0.01 -3.33 0.00 -1.26 -0.29 107.32 107.78 2x7j s GLY 222 Ca 0.47 -1.79 0.01 0.00 0.00 0.00 0.00 44.72 43.40 2x7j s GLY 222 CO 0.02 -1.87 -0.04 -3.16 0.00 0.00 0.00 173.10 168.06 2x7j s MET 223 N -3.37 0.30 -0.16 2.90 0.23 -0.66 -4.15 119.30 114.39 2x7j s MET 223 Ca 0.29 -0.30 -0.08 0.00 -1.03 0.00 0.00 55.69 54.57 2x7j s MET 223 Cb -0.06 -0.19 -0.04 0.00 -1.53 0.00 0.00 34.83 33.01 2x7j s MET 223 CO 0.15 0.04 0.10 0.42 -2.03 0.00 0.00 175.02 173.70 2x7j s ILE 224 N -0.52 5.14 -0.20 3.16 1.01 0.03 -0.98 121.20 128.85 2x7j s ILE 224 Ca -0.03 0.09 -0.01 0.00 0.00 0.00 0.00 60.65 60.69 2x7j s ILE 224 Cb -0.04 -3.30 0.01 0.00 0.01 0.00 0.00 42.46 39.14 2x7j s ILE 224 CO -0.00 0.51 -0.12 -0.69 0.00 0.00 0.00 174.94 174.63 2x7j s VAL 225 N -0.10 2.66 -0.23 2.92 1.01 0.92 0.51 120.40 128.09 2x7j s VAL 225 Ca 0.09 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.33 2x7j s VAL 225 Cb -0.12 -2.18 0.05 0.00 0.00 0.00 0.00 36.38 34.12 2x7j s VAL 225 CO 0.01 0.46 -0.14 0.00 0.00 0.00 0.00 175.10 175.43 2x7j n GLY 227 N 4.50 0.84 3.72 0.00 0.00 -0.38 -1.85 105.19 112.03 2x7j n GLY 227 Ca -0.16 -1.89 -0.65 0.00 0.00 0.00 0.00 46.02 43.31 2x7j n GLY 227 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2x7j n GLU 228 N -0.17 0.25 -4.42 1.61 2.13 -1.26 -3.82 120.64 114.95 2x7j n GLU 228 Ca 0.00 0.09 -0.26 0.00 0.66 0.00 0.00 57.16 57.65 2x7j n GLU 228 Cb 0.00 -1.63 -0.11 0.00 0.27 0.00 0.00 31.44 29.97 2x7j n GLU 228 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2x7j s LEU 229 N 2.83 2.54 0.00 4.31 1.43 -0.97 -4.46 118.68 124.37 2x7j s LEU 229 Ca 1.02 -0.89 0.00 0.00 -1.03 0.00 0.00 54.13 53.23 2x7j s LEU 229 Cb -1.39 -1.20 0.00 0.00 0.03 0.00 0.00 46.19 43.63 2x7j s LEU 229 CO 0.76 0.09 0.00 1.41 0.23 0.00 0.00 176.35 178.84 2x7j n HIS 230 N -0.06 0.00 -2.11 0.29 8.25 -1.26 -4.82 115.22 115.52 2x7j n HIS 230 Ca -0.10 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.94 2x7j n HIS 230 Cb 0.57 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.65 2x7j n HIS 230 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2x7j s SER 231 N -3.33 6.76 0.19 0.41 0.15 -1.26 -4.92 113.70 111.70 2x7j s SER 231 Ca 0.00 2.41 -0.04 0.00 0.70 0.00 0.00 55.95 59.02 2x7j s SER 231 Cb 0.00 -2.59 0.10 0.00 -1.71 0.00 0.00 66.02 61.83 2x7j s SER 231 CO 0.00 -0.70 1.50 0.44 1.20 0.00 0.00 173.24 175.69 2x7j h ASP 232 N 6.76 0.64 -0.80 5.45 3.32 -2.00 -2.35 116.42 127.45 2x7j h ASP 232 Ca -0.42 -0.34 -0.01 0.00 0.02 0.00 0.00 57.03 56.27 2x7j h ASP 232 Cb 1.21 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 40.54 2x7j h ASP 232 CO 0.88 1.06 0.44 0.00 -1.72 0.00 0.00 179.24 179.89 2x7j h ALA 233 N 0.96 1.03 -0.01 3.45 0.00 -1.99 -1.94 119.26 120.75 2x7j h ALA 233 Ca 0.01 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2x7j h ALA 233 Cb 1.08 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 2x7j h ALA 233 CO 0.10 0.53 0.00 -0.44 0.00 0.00 0.00 179.25 179.45 2x7j h ASP 234 N 1.11 0.01 -0.30 0.00 3.32 -1.91 -0.99 116.42 117.67 2x7j h ASP 234 Ca 0.28 -0.22 0.07 0.00 0.02 0.00 0.00 57.03 57.18 2x7j h ASP 234 Cb 0.03 -0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.49 2x7j h ASP 234 CO -0.05 0.23 -0.30 0.11 -1.72 0.00 0.00 179.24 177.52 2x7j h LYS 235 N -0.21 -0.27 -0.89 3.56 1.57 -1.35 0.29 116.57 119.27 2x7j h LYS 235 Ca 0.00 0.02 0.08 0.00 -1.87 0.00 0.00 60.65 58.88 2x7j h LYS 235 Cb 0.22 0.06 -0.07 0.00 0.08 0.00 0.00 32.23 32.52 2x7j h LYS 235 CO -0.00 -0.18 0.55 0.93 -0.57 0.00 0.00 179.45 180.18 2x7j h GLU 236 N -0.28 0.93 0.01 3.15 5.08 -1.19 -0.56 114.58 121.73 2x7j h GLU 236 Ca 0.15 -0.06 -0.24 0.00 -1.00 0.00 0.00 59.36 58.21 2x7j h GLU 236 Cb 0.52 -0.21 0.01 0.00 0.50 0.00 0.00 28.75 29.57 2x7j h GLU 236 CO -0.46 0.61 -1.00 -0.91 -1.00 0.00 0.00 179.01 176.26 2x7j h ASN 237 N 0.96 0.68 -0.44 1.42 2.35 -0.30 -0.99 115.58 119.26 2x7j h ASN 237 Ca 0.40 -0.55 -0.03 0.00 -0.55 0.00 0.00 56.30 55.57 2x7j h ASN 237 Cb 0.26 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 2x7j h ASN 237 CO -0.20 1.35 0.15 0.40 -1.65 0.00 0.00 177.43 177.48 2x7j h ILE 238 N 0.29 1.22 -0.34 2.81 2.04 -0.14 0.30 117.51 123.69 2x7j h ILE 238 Ca -0.10 -0.70 0.00 0.00 1.00 0.00 0.00 64.86 65.06 2x7j h ILE 238 Cb 1.64 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 38.55 2x7j h ILE 238 CO 0.18 0.25 0.23 0.40 0.00 0.00 0.00 178.15 179.21 2x7j h ILE 239 N 0.57 1.09 -0.98 -0.67 2.04 -1.11 -1.75 117.51 116.70 2x7j h ILE 239 Ca 0.14 -0.17 0.03 0.00 1.00 0.00 0.00 64.86 65.87 2x7j h ILE 239 Cb 0.24 0.59 -0.05 0.00 -0.74 0.00 0.00 36.82 36.86 2x7j h ILE 239 CO -0.01 0.09 0.64 0.00 0.00 0.00 0.00 178.15 178.87 2x7j h ALA 240 N 1.12 1.35 -0.43 1.87 0.00 -0.88 -2.58 119.26 119.72 2x7j h ALA 240 Ca 0.13 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 2x7j h ALA 240 Cb -0.05 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 2x7j h ALA 240 CO -0.03 0.56 -0.25 1.25 0.00 0.00 0.00 179.25 180.79 2x7j h LEU 241 N 1.25 0.92 -1.57 0.00 5.85 -0.55 -1.20 115.31 120.01 2x7j h LEU 241 Ca 0.38 -0.35 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 2x7j h LEU 241 Cb -0.03 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.74 2x7j h LEU 241 CO -0.11 1.12 -0.13 0.77 -0.34 0.00 0.00 178.44 179.75 2x7j h SER 242 N 0.77 0.10 0.11 1.25 4.64 -0.97 -0.77 113.55 118.68 2x7j h SER 242 Ca 0.10 -0.02 -0.24 0.00 -0.47 0.00 0.00 61.79 61.16 2x7j h SER 242 Cb 0.80 -0.03 0.02 0.00 -0.31 0.00 0.00 62.40 62.89 2x7j h SER 242 CO 0.07 0.25 -1.02 0.11 -0.87 0.00 0.00 176.83 175.37 2x7j h LYS 243 N 0.11 0.50 -0.83 4.77 1.57 -1.10 0.51 116.57 122.10 2x7j h LYS 243 Ca 0.02 -0.68 0.10 0.00 -1.87 0.00 0.00 60.65 58.22 2x7j h LYS 243 Cb 0.30 0.23 -0.08 0.00 0.08 0.00 0.00 32.23 32.76 2x7j h LYS 243 CO 0.02 1.29 0.47 0.00 -0.57 0.00 0.00 179.45 180.66 2x7j h ALA 244 N 0.23 1.20 0.00 3.86 0.00 -1.06 -2.79 119.26 120.70 2x7j h ALA 244 Ca -0.16 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2x7j h ALA 244 Cb 1.74 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.41 2x7j h ALA 244 CO 0.20 0.08 -0.94 1.28 0.00 0.00 0.00 179.25 179.87 2x7j n LEU 245 N -4.75 0.67 -3.57 0.00 4.77 -0.31 -4.78 117.00 109.03 2x7j n LEU 245 Ca 0.14 0.15 -0.21 0.00 -0.03 0.00 0.00 56.01 56.06 2x7j n LEU 245 Cb 0.30 -0.11 0.05 0.00 -2.33 0.00 0.00 43.42 41.33 2x7j n LEU 245 CO 0.26 -0.05 -0.02 0.00 -1.33 0.00 0.00 177.39 176.25 2x7j n GLN 246 N -2.20 -4.18 -4.56 3.23 1.13 0.16 -4.95 117.38 106.02 2x7j n GLN 246 Ca 0.02 0.68 -0.34 0.00 -1.94 0.00 0.00 57.00 55.42 2x7j n GLN 246 Cb 0.47 -5.26 -0.11 0.00 0.11 0.00 0.00 30.24 25.45 2x7j n GLN 246 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 2x7j s TYR 247 N -3.54 2.99 0.70 1.08 2.02 -0.24 -4.29 117.35 116.07 2x7j s TYR 247 Ca 0.15 0.04 -0.15 0.00 -0.37 0.00 0.00 57.07 56.74 2x7j s TYR 247 Cb -0.04 -1.74 0.02 0.00 -0.40 0.00 0.00 41.96 39.81 2x7j s TYR 247 CO 0.79 0.34 1.15 -1.25 -1.57 0.00 0.00 175.55 175.01 2x7j s PRO 248 N -0.75 2.42 -0.33 -1.71 0.04 -1.26 -4.71 135.00 128.70 2x7j s PRO 248 Ca 0.11 1.56 -0.04 0.00 0.04 0.00 0.00 61.00 62.67 2x7j s PRO 248 Cb -0.11 -1.89 0.05 0.00 0.04 0.00 0.00 34.50 32.59 2x7j s PRO 248 CO 0.02 -1.58 0.06 0.42 0.04 0.00 0.00 177.00 175.96 2x7j s ILE 249 N -2.21 3.32 -0.40 0.56 1.01 -0.74 -0.79 121.20 121.96 2x7j s ILE 249 Ca 0.70 -1.37 -0.28 0.00 0.00 0.00 0.00 60.65 59.70 2x7j s ILE 249 Cb -0.24 -2.94 -0.01 0.00 0.01 0.00 0.00 42.46 39.28 2x7j s ILE 249 CO 0.44 -0.20 1.65 -0.76 0.00 0.00 0.00 174.94 176.08 2x7j s LEU 250 N 1.30 3.51 -0.45 2.97 1.43 0.18 -1.16 118.68 126.45 2x7j s LEU 250 Ca -0.02 1.00 -0.15 0.00 -1.03 0.00 0.00 54.13 53.93 2x7j s LEU 250 Cb -0.20 -3.41 0.06 0.00 0.03 0.00 0.00 46.19 42.68 2x7j s LEU 250 CO 0.00 -1.68 0.36 0.00 0.23 0.00 0.00 176.35 175.26 2x7j s ALA 251 N 6.56 3.51 0.48 4.21 0.00 -0.91 -1.59 121.76 134.02 2x7j s ALA 251 Ca 0.71 -2.05 -0.24 0.00 0.00 0.00 0.00 51.96 50.39 2x7j s ALA 251 Cb -0.18 -2.99 -0.07 0.00 0.00 0.00 0.00 23.12 19.88 2x7j s ALA 251 CO 0.32 -1.67 1.32 0.34 0.00 0.00 0.00 175.76 176.06 2x7j s ASP 252 N 2.39 5.81 0.44 0.00 2.15 -0.77 -4.81 116.67 121.87 2x7j s ASP 252 Ca 0.04 2.67 0.22 0.00 0.43 0.00 0.00 52.55 55.92 2x7j s ASP 252 Cb -0.23 -2.63 1.21 0.00 -0.30 0.00 0.00 42.92 40.96 2x7j s ASP 252 CO 0.07 -1.19 1.80 -0.65 -0.17 0.00 0.00 175.17 175.02 2x7j h PRO 253 N 2.02 0.29 0.00 4.34 0.11 -1.92 0.20 132.00 137.04 2x7j h PRO 253 Ca -0.50 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2x7j h PRO 253 Cb 1.27 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2x7j h PRO 253 CO 0.60 0.19 0.00 1.28 -0.21 0.00 0.00 178.00 179.86 2x7j n LEU 254 N -4.51 0.00 0.20 2.35 4.32 -1.26 -1.85 117.00 116.26 2x7j n LEU 254 Ca 0.24 0.47 0.05 0.00 -0.02 0.00 0.00 56.01 56.75 2x7j n LEU 254 Cb 0.92 -0.47 0.44 0.00 -1.62 0.00 0.00 43.42 42.69 2x7j n LEU 254 CO 0.30 -0.00 0.78 0.77 -1.22 0.00 0.00 177.39 178.01 2x7j h SER 255 N 0.00 0.00 -0.24 -1.43 4.64 -0.69 -2.57 113.55 113.25 2x7j h SER 255 Ca 0.00 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.22 2x7j h SER 255 Cb 0.47 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.52 2x7j h SER 255 CO 0.00 0.31 -0.09 0.59 -0.87 0.00 0.00 176.83 176.77 2x7j n ASN 256 N -3.92 -5.22 0.02 4.97 3.02 -0.77 -4.41 115.26 108.96 2x7j n ASN 256 Ca -0.02 0.13 0.08 0.00 -0.03 0.00 0.00 54.58 54.74 2x7j n ASN 256 Cb 0.38 -3.16 0.35 0.00 -0.61 0.00 0.00 39.78 36.74 2x7j n ASN 256 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2x7j n LEU 257 N -0.58 0.12 -0.06 3.41 4.77 -1.26 -3.21 117.00 120.19 2x7j n LEU 257 Ca -0.05 0.53 0.12 0.00 -0.03 0.00 0.00 56.01 56.58 2x7j n LEU 257 Cb 0.43 -0.51 0.24 0.00 -2.33 0.00 0.00 43.42 41.26 2x7j n LEU 257 CO 0.08 -0.30 0.45 0.54 -1.33 0.00 0.00 177.39 176.84 2x7j n ARG 258 N -1.64 0.20 -3.14 3.23 1.74 -1.26 -4.65 116.66 111.14 2x7j n ARG 258 Ca 0.03 -0.12 -0.21 0.00 -0.77 0.00 0.00 57.85 56.79 2x7j n ARG 258 Cb 0.19 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.08 2x7j n ARG 258 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2x7j n ASN 259 N -1.30 -0.70 -1.38 0.55 6.94 -1.20 -0.77 115.26 117.40 2x7j n ASN 259 Ca 0.07 -2.73 -0.01 0.00 -0.02 0.00 0.00 54.58 51.88 2x7j n ASN 259 Cb 0.34 -0.07 0.01 0.00 -2.36 0.00 0.00 39.78 37.69 2x7j n ASN 259 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2x7j n GLY 260 N 1.86 1.64 0.03 4.83 0.00 -1.19 -2.78 105.19 109.57 2x7j n GLY 260 Ca 0.21 -1.04 0.12 0.00 0.00 0.00 0.00 46.02 45.31 2x7j n GLY 260 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2x7j n VAL 261 N -0.12 0.18 -0.62 1.61 0.24 -1.26 -4.31 118.33 114.05 2x7j n VAL 261 Ca -0.01 -0.19 -0.31 0.00 -2.04 0.00 0.00 64.34 61.79 2x7j n VAL 261 Cb 0.12 0.15 0.19 0.00 -1.47 0.00 0.00 33.84 32.83 2x7j n VAL 261 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2x7j n HIS 262 N -1.88 -1.22 -2.20 6.34 1.44 -1.26 -4.90 115.22 111.54 2x7j n HIS 262 Ca 0.03 0.07 -0.42 0.00 -2.01 0.00 0.00 57.72 55.39 2x7j n HIS 262 Cb 0.41 -1.67 -0.03 0.00 0.12 0.00 0.00 29.99 28.82 2x7j n HIS 262 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 2x7j s ASP 263 N -2.10 6.85 -0.03 4.39 -1.08 -1.26 -4.91 116.67 118.53 2x7j s ASP 263 Ca 0.61 2.20 0.11 0.00 -0.52 0.00 0.00 52.55 54.95 2x7j s ASP 263 Cb -0.18 -2.57 0.31 0.00 -1.46 0.00 0.00 42.92 39.01 2x7j s ASP 263 CO 0.65 -0.68 1.25 0.29 0.52 0.00 0.00 175.17 177.20 2x7j n LYS 264 N 4.73 2.87 0.10 4.34 5.02 -1.26 -4.65 118.16 129.31 2x7j n LYS 264 Ca 0.12 -2.11 0.06 0.00 -2.02 0.00 0.00 58.31 54.36 2x7j n LYS 264 Cb 0.43 -1.32 0.34 0.00 -0.02 0.00 0.00 35.03 34.46 2x7j n LYS 264 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2x7j n SER 265 N 0.24 0.33 -0.00 4.39 3.41 -1.26 -1.19 113.62 119.54 2x7j n SER 265 Ca 0.12 0.64 0.04 0.00 -0.26 0.00 0.00 58.87 59.41 2x7j n SER 265 Cb 0.48 -0.68 -0.06 0.00 -0.26 0.00 0.00 64.21 63.69 2x7j n SER 265 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2x7j n THR 266 N -1.94 0.00 -2.39 6.66 -1.04 -1.26 -5.00 114.28 109.31 2x7j n THR 266 Ca -0.01 -0.25 -0.42 0.00 -2.04 0.00 0.00 64.05 61.33 2x7j n THR 266 Cb 0.04 0.63 -0.03 0.00 -1.82 0.00 0.00 70.33 69.15 2x7j n THR 266 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2x7j s VAL 267 N -2.25 4.04 -0.19 12.58 1.01 -0.33 -1.79 120.40 133.47 2x7j s VAL 267 Ca -0.00 1.42 -0.06 0.00 0.00 0.00 0.00 61.98 63.33 2x7j s VAL 267 Cb 0.06 -3.91 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 2x7j s VAL 267 CO 0.37 0.04 0.04 -0.63 0.00 0.00 0.00 175.10 174.91 2x7j s ILE 268 N 1.85 4.48 -0.12 2.22 -1.09 -0.31 -4.91 121.20 123.32 2x7j s ILE 268 Ca 0.59 -0.14 0.02 0.00 -2.23 0.00 0.00 60.65 58.89 2x7j s ILE 268 Cb -0.28 -3.02 -0.01 0.00 -1.58 0.00 0.00 42.46 37.57 2x7j s ILE 268 CO 0.25 0.45 0.15 -0.90 -1.23 0.00 0.00 174.94 173.66 2x7j n ASP 269 N 3.78 0.25 -0.53 3.58 5.68 -1.26 -2.13 116.55 125.92 2x7j n ASP 269 Ca -0.17 -0.63 0.05 0.00 -0.50 0.00 0.00 54.79 53.55 2x7j n ASP 269 Cb 0.52 0.85 0.10 0.00 -1.14 0.00 0.00 41.12 41.46 2x7j n ASP 269 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2x7j n ALA 270 N -0.87 2.29 -0.33 2.12 0.00 -1.26 -4.68 120.51 117.78 2x7j n ALA 270 Ca 0.00 -0.92 0.21 0.00 0.00 0.00 0.00 53.44 52.74 2x7j n ALA 270 Cb 0.03 -0.39 0.47 0.00 0.00 0.00 0.00 19.45 19.56 2x7j n ALA 270 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 2x7j h TYR 271 N 1.98 0.77 -0.43 0.00 -0.00 -1.94 -0.38 116.97 116.97 2x7j h TYR 271 Ca 0.00 0.03 -0.04 0.00 -0.00 0.00 0.00 58.73 58.72 2x7j h TYR 271 Cb 0.61 -0.22 -0.02 0.00 -0.00 0.00 0.00 36.73 37.09 2x7j h TYR 271 CO 0.13 0.08 0.11 0.22 -0.00 0.00 0.00 178.16 178.70 2x7j h ASP 272 N 0.46 0.58 0.04 0.10 3.58 -1.90 0.19 116.42 119.47 2x7j h ASP 272 Ca 0.60 -0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.97 2x7j h ASP 272 Cb 1.39 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 42.29 2x7j h ASP 272 CO -0.34 0.57 -0.02 0.28 -2.88 0.00 0.00 179.24 176.85 2x7j h SER 273 N 0.62 -0.05 0.87 2.28 0.02 -1.46 -3.38 113.55 112.45 2x7j h SER 273 Ca 0.14 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 2x7j h SER 273 Cb 0.22 0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.77 2x7j h SER 273 CO -0.01 0.35 0.00 2.19 -1.14 0.00 0.00 176.83 178.22 2x7j h PHE 274 N -0.82 0.00 -0.00 3.45 -0.00 -1.31 -2.75 116.94 115.51 2x7j h PHE 274 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.96 2x7j h PHE 274 Cb 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 35.99 2x7j h PHE 274 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 178.31 179.59 2x7j n LEU 275 N -2.89 0.05 0.24 2.10 4.77 0.05 -2.74 117.00 118.58 2x7j n LEU 275 Ca 0.01 -0.02 0.15 0.00 -0.03 0.00 0.00 56.01 56.12 2x7j n LEU 275 Cb 0.27 -0.00 0.49 0.00 -2.33 0.00 0.00 43.42 41.85 2x7j n LEU 275 CO 0.25 0.01 0.92 0.11 -1.33 0.00 0.00 177.39 177.35 2x7j h LYS 276 N 0.08 0.00 -5.68 3.23 1.57 -1.66 -3.45 116.57 110.66 2x7j h LYS 276 Ca 0.00 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.20 2x7j h LYS 276 Cb 0.02 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.24 2x7j h LYS 276 CO 0.00 0.00 -0.04 0.34 -0.57 0.00 0.00 179.45 179.18 2x7j s ASP 277 N -5.64 6.67 0.39 0.86 2.15 -1.11 -4.97 116.67 115.02 2x7j s ASP 277 Ca 0.04 0.81 0.06 0.00 0.43 0.00 0.00 52.55 53.88 2x7j s ASP 277 Cb 0.08 -2.31 0.77 0.00 -0.30 0.00 0.00 42.92 41.16 2x7j s ASP 277 CO 0.57 -0.12 2.01 0.44 -0.17 0.00 0.00 175.17 177.90 2x7j h ASP 278 N 7.11 0.51 0.01 -0.34 5.19 -1.90 -1.61 116.42 125.38 2x7j h ASP 278 Ca -0.37 -0.03 -0.20 0.00 -0.62 0.00 0.00 57.03 55.81 2x7j h ASP 278 Cb 1.17 -0.13 0.02 0.00 0.18 0.00 0.00 39.33 40.56 2x7j h ASP 278 CO 0.75 0.42 -0.77 -0.08 -3.12 0.00 0.00 179.24 176.44 2x7j h GLU 279 N 0.58 0.51 -0.71 3.56 4.81 -1.95 -1.13 114.58 120.25 2x7j h GLU 279 Ca 0.15 -0.56 -0.02 0.00 -0.13 0.00 0.00 59.36 58.80 2x7j h GLU 279 Cb 0.02 0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 2x7j h GLU 279 CO -0.02 1.19 0.35 -0.07 -0.73 0.00 0.00 179.01 179.72 2x7j h LEU 280 N 0.06 0.90 -0.21 1.64 3.38 -1.83 -1.02 115.31 118.23 2x7j h LEU 280 Ca -0.10 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 2x7j h LEU 280 Cb 1.46 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 2x7j h LEU 280 CO 0.15 0.76 0.10 0.50 0.09 0.00 0.00 178.44 180.04 2x7j h LYS 281 N 1.00 0.30 -0.87 1.13 3.64 -1.24 0.50 116.57 121.02 2x7j h LYS 281 Ca 0.25 -0.04 0.08 0.00 -1.27 0.00 0.00 60.65 59.66 2x7j h LYS 281 Cb 0.09 -0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 31.79 2x7j h LYS 281 CO -0.03 0.31 0.53 -0.09 -2.27 0.00 0.00 179.45 177.90 2x7j h ARG 282 N 0.21 0.91 -0.07 1.90 2.43 -0.89 -0.55 114.38 118.32 2x7j h ARG 282 Ca 0.07 -0.05 -0.23 0.00 -0.81 0.00 0.00 59.98 58.96 2x7j h ARG 282 Cb 0.11 -0.20 0.01 0.00 -0.42 0.00 0.00 29.97 29.47 2x7j h ARG 282 CO -0.01 0.60 -0.88 0.87 -1.51 0.00 0.00 179.97 179.04 2x7j h LYS 283 N 0.93 0.64 -0.46 0.20 1.57 -0.91 -3.31 116.57 115.23 2x7j h LYS 283 Ca 0.40 -0.60 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 2x7j h LYS 283 Cb 0.26 0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.72 2x7j h LYS 283 CO -0.20 1.21 0.00 1.28 -0.57 0.00 0.00 179.45 181.16 2x7j n LEU 284 N -3.86 2.80 -4.67 2.94 4.77 0.14 -4.97 117.00 114.15 2x7j n LEU 284 Ca -0.08 -1.34 -0.42 0.00 -0.03 0.00 0.00 56.01 54.14 2x7j n LEU 284 Cb 0.80 -0.31 -0.03 0.00 -2.33 0.00 0.00 43.42 41.56 2x7j n LEU 284 CO 0.53 0.67 1.48 -0.60 -1.33 0.00 0.00 177.39 178.14 2x7j s ARG 285 N -1.39 4.16 0.31 3.23 3.52 -0.23 -4.99 118.95 123.56 2x7j s ARG 285 Ca 0.36 2.49 -0.07 0.00 -0.13 0.00 0.00 55.73 58.39 2x7j s ARG 285 Cb 0.19 -3.87 -0.06 0.00 -1.56 0.00 0.00 34.95 29.66 2x7j s ARG 285 CO 0.26 -0.87 0.61 -1.25 -0.81 0.00 0.00 175.30 173.24 2x7j s PRO 286 N 3.57 3.68 0.02 5.12 0.04 -1.26 -5.00 135.00 141.17 2x7j s PRO 286 Ca 0.81 0.14 -0.18 0.00 0.04 0.00 0.00 61.00 61.82 2x7j s PRO 286 Cb -0.42 -2.58 -0.27 0.00 0.04 0.00 0.00 34.50 31.27 2x7j s PRO 286 CO 0.37 0.16 1.07 -0.44 0.04 0.00 0.00 177.00 178.20 2x7j h ASP 287 N 1.66 0.69 -4.21 6.66 3.32 -1.03 -3.45 116.42 120.07 2x7j h ASP 287 Ca -0.47 -0.82 -0.61 0.00 0.02 0.00 0.00 57.03 55.14 2x7j h ASP 287 Cb 1.19 -0.22 -0.24 0.00 0.22 0.00 0.00 39.33 40.28 2x7j h ASP 287 CO 0.66 1.44 -0.85 0.68 -1.72 0.00 0.00 179.24 179.45 2x7j s VAL 288 N -2.98 1.84 -0.03 -1.35 -7.23 -1.17 -1.17 120.40 108.30 2x7j s VAL 288 Ca -0.12 -1.40 0.05 0.00 -1.81 0.00 0.00 61.98 58.70 2x7j s VAL 288 Cb 0.04 -1.62 -0.01 0.00 0.56 0.00 0.00 36.38 35.35 2x7j s VAL 288 CO 0.88 0.15 -0.17 -0.69 -0.31 0.00 0.00 175.10 174.95 2x7j s VAL 289 N -0.93 1.41 -0.19 1.32 1.01 0.11 -1.65 120.40 121.48 2x7j s VAL 289 Ca 0.09 -0.72 -0.02 0.00 0.00 0.00 0.00 61.98 61.33 2x7j s VAL 289 Cb -0.09 -1.20 -0.00 0.00 0.00 0.00 0.00 36.38 35.08 2x7j s VAL 289 CO 0.03 0.41 -0.10 -0.63 0.00 0.00 0.00 175.10 174.80 2x7j s ILE 290 N -0.09 2.94 -0.13 2.22 1.01 -0.15 0.20 121.20 127.20 2x7j s ILE 290 Ca -0.01 -0.65 -0.04 0.00 0.00 0.00 0.00 60.65 59.95 2x7j s ILE 290 Cb -0.10 -2.30 -0.03 0.00 0.01 0.00 0.00 42.46 40.04 2x7j s ILE 290 CO 0.01 0.47 0.01 -0.13 0.00 0.00 0.00 174.94 175.31 2x7j s ARG 291 N 1.20 3.42 0.07 2.79 0.52 0.95 -0.05 118.95 127.85 2x7j s ARG 291 Ca 0.02 -0.42 0.10 0.00 -0.52 0.00 0.00 55.73 54.91 2x7j s ARG 291 Cb -0.14 -2.94 -0.03 0.00 0.52 0.00 0.00 34.95 32.36 2x7j s ARG 291 CO -0.04 0.48 -0.26 -0.06 0.02 0.00 0.00 175.30 175.44 2x7j s PHE 292 N -0.25 2.26 0.09 -0.53 0.40 -0.24 -0.92 117.98 118.79 2x7j s PHE 292 Ca 0.06 -0.40 0.00 0.00 -0.60 0.00 0.00 56.93 55.99 2x7j s PHE 292 Cb -0.12 -1.32 0.00 0.00 0.51 0.00 0.00 43.02 42.09 2x7j s PHE 292 CO 0.02 0.18 0.00 0.41 0.70 0.00 0.00 175.22 176.53 2x7j n GLY 293 N 1.53 -2.12 3.46 4.36 0.00 -1.26 -1.25 105.19 109.91 2x7j n GLY 293 Ca -0.17 -1.41 -0.30 0.00 0.00 0.00 0.00 46.02 44.13 2x7j n GLY 293 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2x7j s PRO 294 N -1.22 -1.83 0.45 1.61 0.04 -1.26 -4.69 135.00 128.10 2x7j s PRO 294 Ca 0.00 0.18 -0.25 0.00 0.04 0.00 0.00 61.00 60.98 2x7j s PRO 294 Cb 0.00 -1.50 -0.08 0.00 0.04 0.00 0.00 34.50 32.95 2x7j s PRO 294 CO 0.00 -4.17 1.34 -1.33 0.04 0.00 0.00 177.00 172.89 2x7j n MET 295 N -5.13 2.01 -1.27 4.56 2.81 -1.26 -3.99 117.12 114.86 2x7j n MET 295 Ca 0.11 0.72 -0.29 0.00 -1.81 0.00 0.00 57.70 56.43 2x7j n MET 295 Cb 0.59 -2.51 0.16 0.00 -0.71 0.00 0.00 33.22 30.75 2x7j n MET 295 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 2x7j s PRO 296 N -2.41 0.80 0.34 0.03 0.04 -1.26 -4.78 135.00 127.76 2x7j s PRO 296 Ca 0.63 0.53 0.06 0.00 0.04 0.00 0.00 61.00 62.26 2x7j s PRO 296 Cb -0.47 -1.78 0.62 0.00 0.04 0.00 0.00 34.50 32.91 2x7j s PRO 296 CO 0.56 -2.49 1.86 0.28 0.04 0.00 0.00 177.00 177.26 2x7j h VAL 297 N -1.72 1.20 -1.62 -0.36 2.07 -1.97 -3.45 116.25 110.41 2x7j h VAL 297 Ca -0.52 -0.87 -0.61 0.00 0.82 0.00 0.00 66.70 65.52 2x7j h VAL 297 Cb 1.32 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.17 2x7j h VAL 297 CO 0.58 0.28 1.49 -0.24 0.02 0.00 0.00 177.57 179.70 2x7j n SER 298 N -4.25 2.76 -0.20 0.57 2.88 -1.26 -4.86 113.62 109.26 2x7j n SER 298 Ca 0.01 0.21 -0.06 0.00 -1.33 0.00 0.00 58.87 57.70 2x7j n SER 298 Cb 0.28 -1.45 0.04 0.00 -0.75 0.00 0.00 64.21 62.32 2x7j n SER 298 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2x7j h LYS 299 N 14.52 0.72 -0.57 -1.46 3.64 -1.95 -2.81 116.57 128.67 2x7j h LYS 299 Ca -0.34 -0.04 0.12 0.00 -1.27 0.00 0.00 60.65 59.11 2x7j h LYS 299 Cb 1.27 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.90 2x7j h LYS 299 CO 1.00 0.48 0.39 -1.35 -2.27 0.00 0.00 179.45 177.70 2x7j h PRO 300 N 0.75 0.24 -0.16 1.90 0.11 -1.89 -0.62 132.00 132.32 2x7j h PRO 300 Ca 0.22 -0.01 -0.17 0.00 0.11 0.00 0.00 66.00 66.14 2x7j h PRO 300 Cb -0.05 -0.05 0.01 0.00 0.11 0.00 0.00 31.00 31.01 2x7j h PRO 300 CO -0.06 0.16 -0.57 0.28 -0.21 0.00 0.00 178.00 177.59 2x7j h VAL 301 N 0.24 1.32 0.30 3.15 2.07 -1.87 -1.56 116.25 119.90 2x7j h VAL 301 Ca 0.27 -1.82 0.00 0.00 0.82 0.00 0.00 66.70 65.97 2x7j h VAL 301 Cb 0.73 2.01 -0.04 0.00 -1.52 0.00 0.00 31.29 32.47 2x7j h VAL 301 CO -0.05 0.56 -0.53 0.15 0.02 0.00 0.00 177.57 177.73 2x7j h PHE 302 N 0.34 -1.49 -0.99 1.57 3.57 -1.15 -1.37 116.94 117.42 2x7j h PHE 302 Ca -0.03 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.54 2x7j h PHE 302 Cb 1.20 0.61 -0.06 0.00 2.79 0.00 0.00 35.95 40.49 2x7j h PHE 302 CO 0.10 -0.64 0.65 -0.07 -2.23 0.00 0.00 178.31 176.12 2x7j h LEU 303 N -0.88 1.07 0.39 0.59 3.38 -1.18 0.83 115.31 119.51 2x7j h LEU 303 Ca -0.03 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 2x7j h LEU 303 Cb 0.82 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 2x7j h LEU 303 CO -0.19 0.73 -0.47 -0.25 0.09 0.00 0.00 178.44 178.35 2x7j h TRP 304 N 1.24 -1.31 -0.58 1.13 7.01 -1.09 0.33 115.95 122.68 2x7j h TRP 304 Ca 0.40 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.43 2x7j h TRP 304 Cb 0.03 0.52 -0.03 0.00 -2.10 0.00 0.00 29.16 27.58 2x7j h TRP 304 CO -0.00 -0.60 0.39 -0.07 -2.79 0.00 0.00 178.44 175.37 2x7j h LEU 305 N -0.87 0.65 -0.24 0.65 3.38 -0.61 -1.43 115.31 116.85 2x7j h LEU 305 Ca -0.05 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 2x7j h LEU 305 Cb 0.78 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.36 2x7j h LEU 305 CO -0.10 0.47 -0.21 0.50 0.09 0.00 0.00 178.44 179.19 2x7j h LYS 306 N 0.77 0.57 0.00 1.13 3.11 -0.60 -3.31 116.57 118.24 2x7j h LYS 306 Ca 0.22 -0.29 0.00 0.00 -2.81 0.00 0.00 60.65 57.77 2x7j h LYS 306 Cb -0.06 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.18 2x7j h LYS 306 CO -0.05 0.88 -0.44 -0.25 -2.81 0.00 0.00 179.45 176.78 2x7j n ASP 307 N -4.39 0.50 -3.70 4.20 8.00 0.11 -4.11 116.55 117.17 2x7j n ASP 307 Ca -0.04 0.03 -0.28 0.00 0.71 0.00 0.00 54.79 55.21 2x7j n ASP 307 Cb 0.41 0.05 -0.10 0.00 -0.02 0.00 0.00 41.12 41.46 2x7j n ASP 307 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2x7j n ASP 308 N -1.74 3.30 0.05 -2.24 -0.08 -0.57 -4.95 116.55 110.33 2x7j n ASP 308 Ca 0.05 -3.30 0.05 0.00 -1.51 0.00 0.00 54.79 50.08 2x7j n ASP 308 Cb 0.37 -0.72 0.25 0.00 2.34 0.00 0.00 41.12 43.36 2x7j n ASP 308 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2x7j n PRO 309 N 1.50 0.05 0.00 -0.67 -0.04 -1.26 -1.36 135.00 133.23 2x7j n PRO 309 Ca 0.24 0.46 0.13 0.00 -0.04 0.00 0.00 63.50 64.29 2x7j n PRO 309 Cb 0.38 -1.64 0.59 0.00 -0.04 0.00 0.00 33.50 32.79 2x7j n PRO 309 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2x7j n THR 310 N -1.74 0.16 -2.26 0.52 -2.24 -1.26 -4.61 114.28 102.84 2x7j n THR 310 Ca 0.01 0.04 -0.43 0.00 -2.27 0.00 0.00 64.05 61.40 2x7j n THR 310 Cb 0.07 -0.58 -0.02 0.00 -2.10 0.00 0.00 70.33 67.70 2x7j n THR 310 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2x7j s ILE 311 N -2.91 3.89 -0.33 2.28 1.01 -0.46 -4.97 121.20 119.70 2x7j s ILE 311 Ca 0.16 0.99 -0.28 0.00 0.00 0.00 0.00 60.65 61.51 2x7j s ILE 311 Cb 0.18 -3.93 0.02 0.00 0.01 0.00 0.00 42.46 38.73 2x7j s ILE 311 CO 0.47 -0.41 1.05 -1.10 0.00 0.00 0.00 174.94 174.95 2x7j s GLN 312 N 4.53 4.02 -0.11 2.79 -1.52 -0.32 -4.87 119.66 124.18 2x7j s GLN 312 Ca 0.65 0.97 -0.06 0.00 -1.95 0.00 0.00 55.36 54.97 2x7j s GLN 312 Cb -0.20 -3.75 -0.04 0.00 -0.22 0.00 0.00 33.01 28.79 2x7j s GLN 312 CO 0.27 -0.92 0.12 -0.65 -0.25 0.00 0.00 175.29 173.86 2x7j s GLN 313 N 3.65 3.36 -0.21 2.91 -0.21 -1.26 0.09 119.66 127.99 2x7j s GLN 313 Ca 0.44 -0.18 0.01 0.00 0.02 0.00 0.00 55.36 55.65 2x7j s GLN 313 Cb -0.12 -3.12 0.04 0.00 1.00 0.00 0.00 33.01 30.81 2x7j s GLN 313 CO 0.16 0.76 -0.13 0.42 -2.12 0.00 0.00 175.29 174.39 2x7j s ILE 314 N -1.02 1.84 -0.25 1.08 1.01 0.13 -1.52 121.20 122.47 2x7j s ILE 314 Ca 0.15 -1.11 -0.09 0.00 0.00 0.00 0.00 60.65 59.60 2x7j s ILE 314 Cb -0.12 -1.86 -0.04 0.00 0.01 0.00 0.00 42.46 40.45 2x7j s ILE 314 CO 0.04 0.22 0.11 -0.69 0.00 0.00 0.00 174.94 174.62 2x7j s VAL 315 N 1.31 4.71 -0.24 2.92 1.01 -0.09 -0.03 120.40 130.00 2x7j s VAL 315 Ca -0.01 -0.04 -0.10 0.00 0.00 0.00 0.00 61.98 61.83 2x7j s VAL 315 Cb -0.16 -3.21 -0.05 0.00 0.00 0.00 0.00 36.38 32.96 2x7j s VAL 315 CO -0.09 0.32 0.15 -0.63 0.00 0.00 0.00 175.10 174.86 2x7j s ILE 316 N 1.51 5.29 -0.29 2.22 1.09 -0.10 -0.96 121.20 129.96 2x7j s ILE 316 Ca 0.06 0.16 -0.02 0.00 -1.10 0.00 0.00 60.65 59.74 2x7j s ILE 316 Cb -0.15 -3.46 0.12 0.00 -1.06 0.00 0.00 42.46 37.90 2x7j s ILE 316 CO 0.06 0.36 0.21 -0.62 -0.10 0.00 0.00 174.94 174.84 2x7j s ASP 317 N 1.01 2.71 0.40 3.58 -1.08 -0.62 -4.05 116.67 118.62 2x7j s ASP 317 Ca 0.07 -1.11 0.09 0.00 -0.52 0.00 0.00 52.55 51.09 2x7j s ASP 317 Cb -0.13 0.02 0.87 0.00 -1.46 0.00 0.00 42.92 42.22 2x7j s ASP 317 CO 0.04 -0.41 1.97 -0.08 0.52 0.00 0.00 175.17 177.21 2x7j h GLU 318 N 8.28 0.57 0.00 4.34 4.81 -1.75 -2.72 114.58 128.11 2x7j h GLU 318 Ca -0.16 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.04 2x7j h GLU 318 Cb 1.04 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.29 2x7j h GLU 318 CO 0.39 0.38 0.00 -0.44 -0.73 0.00 0.00 179.01 178.61 2x7j h ASP 319 N 0.59 0.00 0.00 1.04 3.32 -1.93 -3.40 116.42 116.04 2x7j h ASP 319 Ca 0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.34 2x7j h ASP 319 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2x7j h ASP 319 CO -0.09 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.04 2x7j n GLY 320 N 0.35 0.68 0.00 2.75 0.00 -1.03 -4.07 105.19 103.88 2x7j n GLY 320 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2x7j n GLY 320 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x7j n GLY 321 N -2.64 -1.59 2.31 -0.02 0.00 -1.26 -5.05 105.19 96.94 2x7j n GLY 321 Ca 0.00 -1.54 -0.23 0.00 0.00 0.00 0.00 46.02 44.24 2x7j n GLY 321 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2x7j n TRP 322 N -1.30 -0.87 -3.20 1.61 -0.00 -1.26 -5.00 117.44 107.42 2x7j n TRP 322 Ca 0.00 -3.29 -0.46 0.00 -0.00 0.00 0.00 57.50 53.76 2x7j n TRP 322 Cb 0.00 0.04 -0.04 0.00 -0.00 0.00 0.00 31.31 31.31 2x7j n TRP 322 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 177.69 178.72 2x7j s ARG 323 N -0.57 3.22 -0.45 5.87 0.52 -1.26 -4.88 118.95 121.40 2x7j s ARG 323 Ca 0.34 -1.75 0.05 0.00 -0.52 0.00 0.00 55.73 53.86 2x7j s ARG 323 Cb 0.12 -4.38 0.19 0.00 0.52 0.00 0.00 34.95 31.40 2x7j s ARG 323 CO -0.15 -1.45 0.74 0.34 0.02 0.00 0.00 175.30 174.80 2x7j s ASP 324 N 3.27 -1.32 0.00 0.23 2.15 -1.26 -4.77 116.67 114.97 2x7j s ASP 324 Ca 0.13 -1.12 0.14 0.00 0.43 0.00 0.00 52.55 52.12 2x7j s ASP 324 Cb -0.21 1.71 0.84 0.00 -0.30 0.00 0.00 42.92 44.97 2x7j s ASP 324 CO 0.00 -0.10 1.29 -0.81 -0.17 0.00 0.00 175.17 175.39 2x7j n PRO 325 N 3.59 0.61 0.06 4.34 -0.04 -1.26 -2.94 135.00 139.36 2x7j n PRO 325 Ca 0.14 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.72 2x7j n PRO 325 Cb 0.58 -1.36 0.23 0.00 -0.04 0.00 0.00 33.50 32.90 2x7j n PRO 325 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2x7j n THR 326 N -0.86 0.36 -0.93 0.52 -2.24 -1.26 -4.91 114.28 104.95 2x7j n THR 326 Ca 0.11 -0.24 -0.04 0.00 -2.27 0.00 0.00 64.05 61.60 2x7j n THR 326 Cb 0.05 -0.19 -0.02 0.00 -2.10 0.00 0.00 70.33 68.07 2x7j n THR 326 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2x7j n GLN 327 N -2.07 -1.81 0.00 -0.78 1.13 -1.15 -4.79 117.38 107.91 2x7j n GLN 327 Ca 0.04 0.51 0.06 0.00 -1.94 0.00 0.00 57.00 55.67 2x7j n GLN 327 Cb 0.43 -4.56 0.03 0.00 0.11 0.00 0.00 30.24 26.25 2x7j n GLN 327 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2x7j n ALA 328 N 0.73 2.63 -1.33 -1.58 0.00 -1.26 -5.03 120.51 114.66 2x7j n ALA 328 Ca -0.04 -0.55 -0.34 0.00 0.00 0.00 0.00 53.44 52.51 2x7j n ALA 328 Cb 0.40 -0.40 0.09 0.00 0.00 0.00 0.00 19.45 19.54 2x7j n ALA 328 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2x7j s SER 329 N -1.17 4.17 -0.05 0.00 1.04 -1.26 -4.67 113.70 111.76 2x7j s SER 329 Ca 0.12 2.33 0.12 0.00 0.48 0.00 0.00 55.95 59.01 2x7j s SER 329 Cb 0.10 -2.59 -0.19 0.00 0.10 0.00 0.00 66.02 63.45 2x7j s SER 329 CO 0.20 -2.28 0.20 0.00 0.98 0.00 0.00 173.24 172.35 2x7j n ALA 330 N -2.79 2.22 -3.72 5.32 0.00 -0.58 -4.91 120.51 116.04 2x7j n ALA 330 Ca 0.13 -0.48 -0.14 0.00 0.00 0.00 0.00 53.44 52.95 2x7j n ALA 330 Cb 0.50 -0.30 -0.14 0.00 0.00 0.00 0.00 19.45 19.51 2x7j n ALA 330 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2x7j s HIS 331 N -2.70 -0.15 -0.34 0.00 3.76 -0.83 -5.01 115.29 110.02 2x7j s HIS 331 Ca -0.05 0.46 -0.06 0.00 -0.15 0.00 0.00 55.06 55.25 2x7j s HIS 331 Cb 0.07 -0.09 0.04 0.00 1.11 0.00 0.00 32.58 33.71 2x7j s HIS 331 CO 0.53 -0.16 0.11 -1.64 -0.85 0.00 0.00 174.74 172.73 2x7j s MET 332 N 1.14 2.61 -0.38 1.40 1.00 -1.26 -0.91 119.30 122.89 2x7j s MET 332 Ca -0.09 -1.20 -0.13 0.00 0.00 0.00 0.00 55.69 54.28 2x7j s MET 332 Cb -0.11 -3.46 0.02 0.00 0.00 0.00 0.00 34.83 31.27 2x7j s MET 332 CO -0.06 -0.68 0.24 0.42 0.00 0.00 0.00 175.02 174.95 2x7j s ILE 333 N 1.40 4.90 -1.29 2.53 -1.09 -0.13 -5.00 121.20 122.52 2x7j s ILE 333 Ca -0.01 -0.70 -0.16 0.00 -2.23 0.00 0.00 60.65 57.54 2x7j s ILE 333 Cb -0.20 -3.70 0.10 0.00 -1.58 0.00 0.00 42.46 37.08 2x7j s ILE 333 CO 0.03 -0.23 1.70 1.41 -1.23 0.00 0.00 174.94 176.62 2x7j n HIS 334 N 5.07 4.60 -3.80 3.97 8.25 -1.26 -1.58 115.22 130.46 2x7j n HIS 334 Ca -0.12 -3.00 -0.12 0.00 -0.26 0.00 0.00 57.72 54.22 2x7j n HIS 334 Cb 0.47 -2.48 -0.11 0.00 1.12 0.00 0.00 29.99 28.99 2x7j n HIS 334 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2x7j n ASN 336 N 2.38 2.24 -0.20 0.00 2.85 -0.38 -2.83 115.26 119.32 2x7j n ASN 336 Ca -0.16 1.13 -0.07 0.00 -0.11 0.00 0.00 54.58 55.36 2x7j n ASN 336 Cb 0.57 -1.33 0.02 0.00 1.24 0.00 0.00 39.78 40.29 2x7j n ASN 336 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2x7j h ALA 337 N 4.35 0.72 -0.42 5.20 0.00 -1.95 0.19 119.26 127.34 2x7j h ALA 337 Ca -0.45 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.31 2x7j h ALA 337 Cb 1.30 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 2x7j h ALA 337 CO 0.77 0.26 0.11 0.77 0.00 0.00 0.00 179.25 181.16 2x7j h SER 338 N 0.75 0.63 0.20 0.00 0.02 -1.89 -0.08 113.55 113.18 2x7j h SER 338 Ca 0.19 -0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 2x7j h SER 338 Cb 0.10 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.47 2x7j h SER 338 CO -0.03 0.69 -0.10 0.58 -1.14 0.00 0.00 176.83 176.84 2x7j h VAL 339 N 0.54 0.82 -0.54 2.27 2.07 -1.86 -0.40 116.25 119.15 2x7j h VAL 339 Ca 0.13 -0.09 0.11 0.00 0.82 0.00 0.00 66.70 67.68 2x7j h VAL 339 Cb 0.30 0.88 -0.10 0.00 -1.52 0.00 0.00 31.29 30.85 2x7j h VAL 339 CO -0.00 0.02 -0.09 0.15 0.02 0.00 0.00 177.57 177.67 2x7j h PHE 340 N -0.31 -0.20 -0.33 1.57 3.57 -0.53 -0.58 116.94 120.13 2x7j h PHE 340 Ca -0.03 0.05 0.01 0.00 3.53 0.00 0.00 57.97 61.52 2x7j h PHE 340 Cb 0.24 0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.13 2x7j h PHE 340 CO -0.05 -0.20 0.22 0.00 -2.23 0.00 0.00 178.31 176.04 2x7j h ALA 341 N 1.52 0.42 -0.65 2.41 0.00 -0.69 -1.77 119.26 120.52 2x7j h ALA 341 Ca 0.27 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 2x7j h ALA 341 Cb 0.42 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2x7j h ALA 341 CO -0.52 -0.12 0.31 0.93 0.00 0.00 0.00 179.25 179.84 2x7j h GLU 342 N 0.44 0.93 -0.35 0.00 5.08 -0.42 -1.47 114.58 118.79 2x7j h GLU 342 Ca 0.12 -0.14 0.01 0.00 -1.00 0.00 0.00 59.36 58.36 2x7j h GLU 342 Cb -0.04 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.02 2x7j h GLU 342 CO -0.03 0.74 0.21 0.93 -1.00 0.00 0.00 179.01 179.86 2x7j h GLU 343 N 0.89 0.42 -0.13 2.33 4.39 -0.83 0.08 114.58 121.72 2x7j h GLU 343 Ca 0.22 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.89 2x7j h GLU 343 Cb 0.12 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2x7j h GLU 343 CO -0.03 0.28 0.06 0.82 -1.16 0.00 0.00 179.01 178.98 2x7j h ILE 344 N 0.43 1.13 -1.00 3.13 1.08 -1.15 -2.69 117.51 118.44 2x7j h ILE 344 Ca 0.13 -0.38 0.04 0.00 -0.39 0.00 0.00 64.86 64.27 2x7j h ILE 344 Cb -0.01 1.14 -0.06 0.00 -3.07 0.00 0.00 36.82 34.81 2x7j h ILE 344 CO -0.05 0.12 0.65 0.24 -0.69 0.00 0.00 178.15 178.42 2x7j h MET 345 N 0.08 1.20 0.00 2.37 2.86 -1.09 -1.86 114.93 118.49 2x7j h MET 345 Ca 0.05 -0.07 -0.04 0.00 -2.06 0.00 0.00 59.70 57.58 2x7j h MET 345 Cb 0.13 -0.27 -0.01 0.00 0.06 0.00 0.00 31.60 31.52 2x7j h MET 345 CO -0.01 0.80 -0.18 0.00 1.06 0.00 0.00 176.91 178.58 2x7j h ALA 346 N 1.43 1.66 -0.01 6.32 0.00 -0.83 -2.58 119.26 125.25 2x7j h ALA 346 Ca 0.41 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2x7j h ALA 346 Cb 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2x7j h ALA 346 CO -0.14 0.22 -0.06 0.41 0.00 0.00 0.00 179.25 179.68 2x7j n GLY 347 N -0.99 -0.05 3.81 0.00 0.00 -0.73 -4.89 105.19 102.35 2x7j n GLY 347 Ca -0.02 -0.46 -0.36 0.00 0.00 0.00 0.00 46.02 45.17 2x7j n GLY 347 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x7j s LEU 348 N -2.11 4.34 0.87 0.99 1.43 -0.97 -5.06 118.68 118.16 2x7j s LEU 348 Ca 0.34 1.50 -0.12 0.00 -1.03 0.00 0.00 54.13 54.82 2x7j s LEU 348 Cb 0.20 -3.67 0.11 0.00 0.03 0.00 0.00 46.19 42.86 2x7j s LEU 348 CO 0.37 0.01 1.13 0.42 0.23 0.00 0.00 176.35 178.52 2x7j s THR 349 N -1.54 2.33 -0.89 5.49 -4.23 -1.26 -4.94 115.64 110.60 2x7j s THR 349 Ca 0.44 0.11 0.23 0.00 -1.18 0.00 0.00 61.69 61.29 2x7j s THR 349 Cb -0.17 -2.88 0.21 0.00 1.34 0.00 0.00 72.50 70.99 2x7j s THR 349 CO 0.22 -0.14 1.72 0.00 -0.54 0.00 0.00 174.62 175.87 2x7j n ALA 350 N -3.62 2.00 -1.64 3.99 0.00 -1.26 -4.89 120.51 115.09 2x7j n ALA 350 Ca 0.07 -0.05 -0.45 0.00 0.00 0.00 0.00 53.44 53.01 2x7j n ALA 350 Cb 0.59 -1.38 -0.02 0.00 0.00 0.00 0.00 19.45 18.64 2x7j n ALA 350 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2x7j n ALA 351 N -1.58 0.51 -1.63 0.00 0.00 -1.26 -4.88 120.51 111.68 2x7j n ALA 351 Ca 0.05 0.41 -0.54 0.00 0.00 0.00 0.00 53.44 53.36 2x7j n ALA 351 Cb 0.28 -2.17 -0.06 0.00 0.00 0.00 0.00 19.45 17.49 2x7j n ALA 351 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2x7j n THR 352 N 1.18 0.11 -2.90 0.00 -1.04 -1.26 -4.95 114.28 105.42 2x7j n THR 352 Ca 0.10 -0.02 -0.41 0.00 -2.04 0.00 0.00 64.05 61.69 2x7j n THR 352 Cb 0.31 -0.96 -0.04 0.00 -1.82 0.00 0.00 70.33 67.82 2x7j n THR 352 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2x7j s ARG 353 N 1.51 4.45 0.34 -2.82 1.81 -1.26 -5.04 118.95 117.94 2x7j s ARG 353 Ca 0.89 1.09 -0.29 0.00 -1.72 0.00 0.00 55.73 55.71 2x7j s ARG 353 Cb -0.99 -3.47 -0.10 0.00 -0.45 0.00 0.00 34.95 29.93 2x7j s ARG 353 CO 0.53 -0.05 1.37 0.45 -0.68 0.00 0.00 175.30 176.92 2x7j s SER 354 N 0.93 6.64 0.00 0.23 0.15 -1.26 -4.94 113.70 115.46 2x7j s SER 354 Ca 0.43 2.79 0.12 0.00 0.70 0.00 0.00 55.95 59.99 2x7j s SER 354 Cb -0.19 -2.65 0.32 0.00 -1.71 0.00 0.00 66.02 61.79 2x7j s SER 354 CO 0.20 -0.64 1.25 -1.54 1.20 0.00 0.00 173.24 173.71 2x7j n SER 355 N 0.84 2.95 -0.05 5.45 3.41 -1.26 -4.64 113.62 120.32 2x7j n SER 355 Ca 0.01 -1.95 -0.10 0.00 -0.26 0.00 0.00 58.87 56.56 2x7j n SER 355 Cb 0.41 -0.24 -0.04 0.00 -0.26 0.00 0.00 64.21 64.08 2x7j n SER 355 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2x7j h GLU 356 N 2.32 0.29 -0.38 4.33 5.08 -1.95 0.78 114.58 125.05 2x7j h GLU 356 Ca 0.00 -0.04 0.08 0.00 -1.00 0.00 0.00 59.36 58.40 2x7j h GLU 356 Cb 0.74 -0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.86 2x7j h GLU 356 CO 0.00 0.31 -0.12 2.35 -1.00 0.00 0.00 179.01 180.55 2x7j h TRP 357 N 0.20 -0.27 -0.67 4.33 2.91 -1.91 -1.16 115.95 119.38 2x7j h TRP 357 Ca 0.07 0.04 -0.02 0.00 1.13 0.00 0.00 58.89 60.11 2x7j h TRP 357 Cb 0.12 0.18 -0.03 0.00 -0.51 0.00 0.00 29.16 28.91 2x7j h TRP 357 CO -0.03 -0.19 0.34 1.25 -1.03 0.00 0.00 178.44 178.78 2x7j h LEU 358 N -0.03 0.84 -1.28 0.65 5.85 -1.64 -2.54 115.31 117.16 2x7j h LEU 358 Ca 0.18 -0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.76 2x7j h LEU 358 Cb 0.32 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 2x7j h LEU 358 CO -0.41 0.70 -0.27 -0.33 -0.34 0.00 0.00 178.44 177.79 2x7j h GLU 359 N 0.94 0.14 -0.39 1.25 5.08 0.29 -1.57 114.58 120.32 2x7j h GLU 359 Ca 0.23 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.58 2x7j h GLU 359 Cb 0.06 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 2x7j h GLU 359 CO -0.03 0.40 0.21 0.87 -1.00 0.00 0.00 179.01 179.46 2x7j h LYS 360 N 0.13 0.41 -0.25 2.33 1.57 -0.83 -0.60 116.57 119.32 2x7j h LYS 360 Ca 0.02 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2x7j h LYS 360 Cb 0.55 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 2x7j h LYS 360 CO 0.04 0.27 0.02 -1.49 -0.57 0.00 0.00 179.45 177.72 2x7j h TRP 361 N 0.42 0.47 -0.32 -1.35 4.06 -1.33 -1.61 115.95 116.29 2x7j h TRP 361 Ca 0.16 -0.08 -0.06 0.00 2.06 0.00 0.00 58.89 60.97 2x7j h TRP 361 Cb 0.05 -0.13 -0.02 0.00 -1.00 0.00 0.00 29.16 28.07 2x7j h TRP 361 CO -0.09 0.58 -0.08 1.96 -3.56 0.00 0.00 178.44 177.25 2x7j h GLN 362 N 0.23 0.53 0.52 0.49 1.08 -1.23 -0.97 115.11 115.75 2x7j h GLN 362 Ca 0.07 -0.14 -0.02 0.00 -1.45 0.00 0.00 58.65 57.11 2x7j h GLN 362 Cb 0.38 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.75 2x7j h GLN 362 CO 0.01 0.61 -0.28 0.35 -0.95 0.00 0.00 178.83 178.57 2x7j h PHE 363 N 0.50 -0.74 -0.06 2.96 3.57 -0.93 0.85 116.94 123.08 2x7j h PHE 363 Ca 0.10 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.62 2x7j h PHE 363 Cb 0.44 0.26 -0.04 0.00 2.79 0.00 0.00 35.95 39.39 2x7j h PHE 363 CO 0.02 -0.44 -0.19 0.28 -2.23 0.00 0.00 178.31 175.75 2x7j h VAL 364 N -0.74 0.54 -0.20 1.41 2.07 -1.14 -0.30 116.25 117.89 2x7j h VAL 364 Ca -0.06 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.48 2x7j h VAL 364 Cb 0.59 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 2x7j h VAL 364 CO 0.09 0.00 0.06 -1.13 0.02 0.00 0.00 177.57 176.60 2x7j h ASN 365 N -0.27 0.05 -0.26 0.57 -1.24 -1.14 -0.85 115.58 112.44 2x7j h ASN 365 Ca 0.08 0.02 -0.01 0.00 0.71 0.00 0.00 56.30 57.09 2x7j h ASN 365 Cb 0.38 0.02 -0.01 0.00 0.73 0.00 0.00 38.32 39.44 2x7j h ASN 365 CO -0.22 0.06 0.10 1.23 -1.29 0.00 0.00 177.43 177.31 2x7j h GLY 366 N 0.14 0.41 1.02 1.57 0.00 -0.61 -1.47 103.07 104.14 2x7j h GLY 366 Ca 0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 2x7j h GLY 366 CO -0.10 0.21 0.58 3.21 0.00 0.00 0.00 176.54 180.44 2x7j h ARG 367 N 0.26 1.30 0.09 4.80 2.47 -0.94 0.02 114.38 122.37 2x7j h ARG 367 Ca 0.09 -0.12 -0.00 0.00 -1.26 0.00 0.00 59.98 58.69 2x7j h ARG 367 Cb 0.18 -0.27 -0.00 0.00 -1.65 0.00 0.00 29.97 28.22 2x7j h ARG 367 CO -0.01 0.90 -0.06 0.35 0.56 0.00 0.00 179.97 181.72 2x7j h PHE 368 N 1.32 -0.14 -0.28 3.04 3.57 -0.89 -2.06 116.94 121.50 2x7j h PHE 368 Ca 0.34 -0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.74 2x7j h PHE 368 Cb -0.06 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 2x7j h PHE 368 CO 0.01 -0.09 -0.26 0.00 -2.23 0.00 0.00 178.31 175.73 2x7j h ARG 369 N -0.14 0.55 -0.10 1.11 2.47 -0.91 -2.33 114.38 115.03 2x7j h ARG 369 Ca -0.01 -0.22 -0.01 0.00 -1.26 0.00 0.00 59.98 58.48 2x7j h ARG 369 Cb 0.12 -0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 28.41 2x7j h ARG 369 CO 0.01 0.76 0.03 0.93 0.56 0.00 0.00 179.97 182.26 2x7j h GLU 370 N 0.48 0.17 -0.27 0.04 5.08 -0.93 -1.78 114.58 117.36 2x7j h GLU 370 Ca 0.07 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 2x7j h GLU 370 Cb 0.71 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 2x7j h GLU 370 CO 0.05 0.34 0.08 1.25 -1.00 0.00 0.00 179.01 179.73 2x7j h HIS 371 N -0.04 0.38 -0.00 4.33 2.76 -1.24 -1.62 115.15 119.72 2x7j h HIS 371 Ca 0.03 -0.01 -0.11 0.00 -2.20 0.00 0.00 60.37 58.08 2x7j h HIS 371 Cb 0.25 -0.12 -0.02 0.00 1.55 0.00 0.00 27.41 29.07 2x7j h HIS 371 CO 0.01 0.33 -0.51 -0.07 -1.30 0.00 0.00 177.93 176.39 2x7j h LEU 372 N 0.39 0.01 -0.73 0.26 3.38 -1.24 -2.86 115.31 114.51 2x7j h LEU 372 Ca 0.09 -0.01 0.14 0.00 0.09 0.00 0.00 57.88 58.20 2x7j h LEU 372 Cb 0.13 -0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.79 2x7j h LEU 372 CO -0.01 0.52 0.26 1.56 0.09 0.00 0.00 178.44 180.87 2x7j h GLN 373 N 0.01 0.39 0.00 1.13 1.08 -0.38 -1.88 115.11 115.45 2x7j h GLN 373 Ca -0.00 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 2x7j h GLN 373 Cb 0.91 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 28.25 2x7j h GLN 373 CO 0.07 0.26 0.00 1.79 -0.95 0.00 0.00 178.83 179.99 2x7j h THR 374 N 0.40 0.00 -3.36 -0.54 1.35 -1.43 -3.43 112.91 105.89 2x7j h THR 374 Ca 0.40 -0.32 -0.57 0.00 -0.55 0.00 0.00 66.41 65.37 2x7j h THR 374 Cb 0.61 1.13 -0.06 0.00 -1.73 0.00 0.00 68.15 68.09 2x7j h THR 374 CO -0.41 0.00 0.11 -0.63 -0.25 0.00 0.00 175.52 174.34 2x7j s ILE 375 N -3.30 5.04 0.55 6.82 1.01 -0.71 -5.02 121.20 125.58 2x7j s ILE 375 Ca 0.05 1.38 -0.21 0.00 0.00 0.00 0.00 60.65 61.88 2x7j s ILE 375 Cb 0.10 -4.02 -0.05 0.00 0.01 0.00 0.00 42.46 38.50 2x7j s ILE 375 CO 0.45 0.21 1.23 -0.55 0.00 0.00 0.00 174.94 176.28 2x7j s SER 376 N 0.89 5.46 -0.01 3.58 0.15 -1.26 -4.96 113.70 117.55 2x7j s SER 376 Ca 0.35 2.46 0.01 0.00 0.70 0.00 0.00 55.95 59.47 2x7j s SER 376 Cb -0.17 -2.61 0.02 0.00 -1.71 0.00 0.00 66.02 61.55 2x7j s SER 376 CO 0.15 -1.42 0.96 -1.54 1.20 0.00 0.00 173.24 172.60 2x7j n SER 377 N -1.17 1.81 0.09 5.45 3.41 -1.26 -4.78 113.62 117.16 2x7j n SER 377 Ca 0.11 -1.96 0.07 0.00 -0.26 0.00 0.00 58.87 56.83 2x7j n SER 377 Cb 0.48 -0.02 0.53 0.00 -0.26 0.00 0.00 64.21 64.94 2x7j n SER 377 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2x7j h GLU 378 N 0.00 0.28 -6.21 4.33 4.39 -1.98 -3.42 114.58 111.97 2x7j h GLU 378 Ca 0.00 -0.02 -0.54 0.00 0.34 0.00 0.00 59.36 59.14 2x7j h GLU 378 Cb 0.58 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 29.13 2x7j h GLU 378 CO 0.00 0.19 1.25 0.34 -1.16 0.00 0.00 179.01 179.63 2x7j s ASP 379 N -6.75 5.73 0.24 1.42 -1.08 -1.26 -4.69 116.67 110.28 2x7j s ASP 379 Ca -0.07 0.69 0.24 0.00 -0.52 0.00 0.00 52.55 52.89 2x7j s ASP 379 Cb 0.18 -2.53 0.94 0.00 -1.46 0.00 0.00 42.92 40.04 2x7j s ASP 379 CO 0.71 -1.95 1.72 0.52 0.52 0.00 0.00 175.17 176.69 2x7j n VAL 380 N 7.20 0.78 0.95 1.11 0.31 -1.26 -2.53 118.33 124.88 2x7j n VAL 380 Ca 0.19 0.13 0.13 0.00 -0.01 0.00 0.00 64.34 64.79 2x7j n VAL 380 Cb 0.49 -1.04 0.46 0.00 -0.91 0.00 0.00 33.84 32.85 2x7j n VAL 380 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2x7j n SER 381 N -2.20 0.26 -4.61 4.52 3.41 -1.26 -4.68 113.62 109.06 2x7j n SER 381 Ca 0.03 0.25 -0.39 0.00 -0.26 0.00 0.00 58.87 58.50 2x7j n SER 381 Cb 0.27 -0.25 -0.09 0.00 -0.26 0.00 0.00 64.21 63.87 2x7j n SER 381 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2x7j s PHE 382 N -3.02 3.25 0.28 7.33 5.36 -1.05 -2.11 117.98 128.02 2x7j s PHE 382 Ca 0.12 0.36 -0.00 0.00 -0.96 0.00 0.00 56.93 56.45 2x7j s PHE 382 Cb 0.18 -2.52 0.41 0.00 -0.34 0.00 0.00 43.02 40.75 2x7j s PHE 382 CO 0.60 -0.19 1.80 1.49 -1.46 0.00 0.00 175.22 177.46 2x7j h GLU 383 N 8.13 0.72 -0.95 10.12 4.81 -1.87 -1.75 114.58 133.78 2x7j h GLU 383 Ca -0.33 -0.18 0.19 0.00 -0.13 0.00 0.00 59.36 58.92 2x7j h GLU 383 Cb 1.17 -0.09 -0.08 0.00 0.63 0.00 0.00 28.75 30.37 2x7j h GLU 383 CO 0.63 0.73 0.61 0.78 -0.73 0.00 0.00 179.01 181.02 2x7j h GLY 384 N 0.94 1.30 0.98 1.92 0.00 -1.95 -2.96 103.07 103.31 2x7j h GLY 384 Ca 0.14 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 2x7j h GLY 384 CO 0.01 -0.01 0.26 3.43 0.00 0.00 0.00 176.54 180.23 2x7j h ASN 385 N 0.60 0.60 -0.98 0.19 2.35 -1.62 -2.19 115.58 114.53 2x7j h ASN 385 Ca 0.52 -0.10 0.27 0.00 -0.55 0.00 0.00 56.30 56.44 2x7j h ASN 385 Cb 1.01 -0.15 -0.18 0.00 0.05 0.00 0.00 38.32 39.05 2x7j h ASN 385 CO -0.27 0.53 0.04 0.25 -1.65 0.00 0.00 177.43 176.33 2x7j h LEU 386 N 0.63 -0.46 -0.24 1.61 7.12 -1.67 -0.31 115.31 121.98 2x7j h LEU 386 Ca 0.17 0.28 -0.20 0.00 0.13 0.00 0.00 57.88 58.25 2x7j h LEU 386 Cb 0.06 0.48 -0.01 0.00 -0.53 0.00 0.00 40.66 40.67 2x7j h LEU 386 CO -0.03 -0.35 -0.90 1.88 -0.13 0.00 0.00 178.44 178.91 2x7j h TYR 387 N 0.01 0.34 -0.30 1.25 -1.99 -1.55 0.45 116.97 115.17 2x7j h TYR 387 Ca 0.60 -0.19 -0.05 0.00 2.00 0.00 0.00 58.73 61.09 2x7j h TYR 387 Cb 1.24 -0.04 -0.02 0.00 2.00 0.00 0.00 36.73 39.91 2x7j h TYR 387 CO -0.49 1.01 -0.01 0.00 -0.00 0.00 0.00 178.16 178.67 2x7j h ARG 388 N 0.12 0.47 0.00 4.88 3.08 -0.93 -2.73 114.38 119.27 2x7j h ARG 388 Ca -0.05 -0.10 -0.02 0.00 0.07 0.00 0.00 59.98 59.88 2x7j h ARG 388 Cb 1.54 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 31.52 2x7j h ARG 388 CO 0.14 0.51 -0.14 0.82 -1.07 0.00 0.00 179.97 180.23 2x7j h ILE 389 N 0.45 1.09 -0.70 2.04 5.03 -1.14 -3.39 117.51 120.90 2x7j h ILE 389 Ca 0.10 -1.87 0.20 0.00 -0.12 0.00 0.00 64.86 63.17 2x7j h ILE 389 Cb 0.32 2.11 -0.03 0.00 -3.03 0.00 0.00 36.82 36.19 2x7j h ILE 389 CO 0.01 0.37 0.50 0.25 -0.68 0.00 0.00 178.15 178.60 2x7j h LEU 390 N -1.00 0.02 -1.62 1.44 5.85 -0.08 -2.69 115.31 117.23 2x7j h LEU 390 Ca -0.03 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.66 2x7j h LEU 390 Cb 0.70 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 2x7j h LEU 390 CO -0.02 0.01 -0.04 0.06 -0.34 0.00 0.00 178.44 178.11 2x7j h GLN 391 N 0.02 0.19 -0.00 1.25 3.07 -1.68 -1.39 115.11 116.56 2x7j h GLN 391 Ca 0.33 -0.03 0.00 0.00 0.09 0.00 0.00 58.65 59.05 2x7j h GLN 391 Cb 1.31 -0.03 0.00 0.00 0.08 0.00 0.00 27.48 28.84 2x7j h GLN 391 CO -0.01 0.25 -0.42 0.72 0.09 0.00 0.00 178.83 179.46 2x7j n HIS 392 N -4.38 0.00 0.01 0.06 8.25 -1.01 -4.18 115.22 113.97 2x7j n HIS 392 Ca -0.01 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.56 2x7j n HIS 392 Cb 0.18 -0.27 -0.17 0.00 1.12 0.00 0.00 29.99 30.85 2x7j n HIS 392 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2x7j n LEU 393 N -1.45 0.02 -4.63 2.41 4.77 -0.56 -4.92 117.00 112.63 2x7j n LEU 393 Ca 0.06 -0.01 -0.43 0.00 -0.03 0.00 0.00 56.01 55.61 2x7j n LEU 393 Cb 0.34 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.40 2x7j n LEU 393 CO 0.33 0.00 1.60 -0.69 -1.33 0.00 0.00 177.39 177.31 2x7j s VAL 394 N -3.48 3.25 0.30 4.08 1.01 -1.01 -4.88 120.40 119.67 2x7j s VAL 394 Ca -0.08 0.28 -0.29 0.00 0.00 0.00 0.00 61.98 61.90 2x7j s VAL 394 Cb 0.14 -3.25 -0.13 0.00 0.00 0.00 0.00 36.38 33.14 2x7j s VAL 394 CO 0.89 -0.10 1.32 -2.65 0.00 0.00 0.00 175.10 174.56 2x7j n PRO 395 N 7.95 2.06 -1.67 2.72 -0.02 -1.26 -4.91 135.00 139.87 2x7j n PRO 395 Ca 0.23 0.73 -0.39 0.00 -2.02 0.00 0.00 63.50 62.04 2x7j n PRO 395 Cb 0.44 -2.33 0.04 0.00 -0.02 0.00 0.00 33.50 31.63 2x7j n PRO 395 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2x7j n GLU 396 N 1.12 1.36 -1.91 -0.52 1.02 -1.26 -2.23 120.64 118.22 2x7j n GLU 396 Ca 0.07 0.50 -0.19 0.00 -0.02 0.00 0.00 57.16 57.53 2x7j n GLU 396 Cb 0.34 -2.33 -0.05 0.00 -0.02 0.00 0.00 31.44 29.39 2x7j n GLU 396 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2x7j n ASN 397 N -0.60 -5.15 -4.70 1.62 3.02 0.38 -4.98 115.26 104.85 2x7j n ASN 397 Ca 0.11 0.28 -0.25 0.00 -0.03 0.00 0.00 54.58 54.69 2x7j n ASN 397 Cb 0.44 -4.47 -0.00 0.00 -0.61 0.00 0.00 39.78 35.14 2x7j n ASN 397 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2x7j n SER 398 N -1.48 2.72 -4.45 6.41 3.41 -0.95 -4.62 113.62 114.66 2x7j n SER 398 Ca -0.20 -2.83 -0.32 0.00 -0.26 0.00 0.00 58.87 55.26 2x7j n SER 398 Cb 0.64 -0.02 -0.13 0.00 -0.26 0.00 0.00 64.21 64.44 2x7j n SER 398 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2x7j s SER 399 N -4.06 3.80 -0.29 4.04 0.01 0.81 -2.02 113.70 116.00 2x7j s SER 399 Ca 0.28 -0.34 -0.06 0.00 1.31 0.00 0.00 55.95 57.14 2x7j s SER 399 Cb -0.02 -0.67 0.01 0.00 0.21 0.00 0.00 66.02 65.55 2x7j s SER 399 CO 0.18 0.30 0.06 -0.22 0.41 0.00 0.00 173.24 173.96 2x7j s LEU 400 N -1.08 3.78 -0.21 2.44 2.96 0.36 0.14 118.68 127.07 2x7j s LEU 400 Ca 0.13 -0.77 -0.15 0.00 -0.22 0.00 0.00 54.13 53.12 2x7j s LEU 400 Cb -0.10 -1.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.70 2x7j s LEU 400 CO 0.03 -0.19 0.35 0.12 -1.32 0.00 0.00 176.35 175.34 2x7j s PHE 401 N 1.46 3.36 -0.21 5.38 5.36 0.25 -0.47 117.98 133.11 2x7j s PHE 401 Ca 0.02 0.53 -0.04 0.00 -0.96 0.00 0.00 56.93 56.48 2x7j s PHE 401 Cb -0.17 -2.48 -0.01 0.00 -0.34 0.00 0.00 43.02 40.02 2x7j s PHE 401 CO 0.01 -0.01 -0.04 0.08 -1.46 0.00 0.00 175.22 173.81 2x7j s VAL 402 N 1.30 3.43 0.92 3.12 1.01 0.68 -1.57 120.40 129.29 2x7j s VAL 402 Ca 0.17 -0.48 -0.11 0.00 0.00 0.00 0.00 61.98 61.56 2x7j s VAL 402 Cb -0.15 -2.55 0.15 0.00 0.00 0.00 0.00 36.38 33.83 2x7j s VAL 402 CO 0.07 0.43 1.10 -0.83 0.00 0.00 0.00 175.10 175.87 2x7j s GLY 403 N 1.34 1.64 0.56 4.51 0.00 0.69 -4.46 107.32 111.60 2x7j s GLY 403 Ca 0.04 0.23 -0.09 0.00 0.00 0.00 0.00 44.72 44.90 2x7j s GLY 403 CO -0.02 0.70 0.76 0.70 0.00 0.00 0.00 173.10 175.24 2x7j n ASN 404 N -4.10 0.12 0.00 1.64 3.02 -1.26 -2.52 115.26 112.15 2x7j n ASN 404 Ca 0.08 -1.31 0.00 0.00 -0.03 0.00 0.00 54.58 53.32 2x7j n ASN 404 Cb 0.53 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 39.13 2x7j n ASN 404 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2x7j n SER 405 N -3.46 0.00 0.08 6.41 2.88 -1.26 -4.12 113.62 114.15 2x7j n SER 405 Ca 0.10 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.53 2x7j n SER 405 Cb 0.34 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.77 2x7j n SER 405 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 2x7j h MET 406 N 0.00 0.25 -0.40 -1.46 2.86 -1.99 -3.30 114.93 110.89 2x7j h MET 406 Ca 0.00 -0.28 0.08 0.00 -2.06 0.00 0.00 59.70 57.44 2x7j h MET 406 Cb 0.00 0.08 -0.08 0.00 0.06 0.00 0.00 31.60 31.66 2x7j h MET 406 CO 0.00 1.01 -0.13 -1.35 1.06 0.00 0.00 176.91 177.50 2x7j h PRO 407 N 0.13 -0.04 -0.88 -0.22 0.11 -1.76 0.81 132.00 130.15 2x7j h PRO 407 Ca -0.06 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.05 2x7j h PRO 407 Cb 1.57 0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.64 2x7j h PRO 407 CO 0.15 -0.03 0.53 0.97 -0.21 0.00 0.00 178.00 179.41 2x7j h ILE 408 N -0.04 1.24 -0.54 4.15 6.09 -1.60 0.21 117.51 127.02 2x7j h ILE 408 Ca 0.19 -0.53 -0.10 0.00 -1.37 0.00 0.00 64.86 63.05 2x7j h ILE 408 Cb 0.33 -0.00 -0.02 0.00 0.47 0.00 0.00 36.82 37.60 2x7j h ILE 408 CO -0.43 0.26 -0.06 0.03 -3.07 0.00 0.00 178.15 174.88 2x7j h ARG 409 N 1.22 0.99 -0.42 2.19 3.08 -0.90 -1.58 114.38 118.96 2x7j h ARG 409 Ca 0.32 -0.34 -0.15 0.00 0.07 0.00 0.00 59.98 59.88 2x7j h ARG 409 Cb -0.05 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 2x7j h ARG 409 CO -0.06 1.02 -0.31 -0.44 -1.07 0.00 0.00 179.97 179.11 2x7j h ASP 410 N 0.86 0.98 -0.64 7.04 3.32 0.11 0.53 116.42 128.62 2x7j h ASP 410 Ca 0.15 -0.41 0.05 0.00 0.02 0.00 0.00 57.03 56.84 2x7j h ASP 410 Cb 0.61 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.84 2x7j h ASP 410 CO 0.04 1.20 0.36 0.58 -1.72 0.00 0.00 179.24 179.70 2x7j h VAL 411 N 0.79 0.98 -0.62 -1.35 2.07 -0.55 0.43 116.25 118.00 2x7j h VAL 411 Ca 0.08 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 2x7j h VAL 411 Cb 0.89 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 2x7j h VAL 411 CO 0.08 0.12 0.30 -0.78 0.02 0.00 0.00 177.57 177.31 2x7j h ASP 412 N 0.67 0.80 -0.12 0.57 1.82 -0.90 -0.98 116.42 118.28 2x7j h ASP 412 Ca 0.28 -0.13 -0.03 0.00 -0.39 0.00 0.00 57.03 56.77 2x7j h ASP 412 Cb 0.16 -0.21 -0.00 0.00 0.68 0.00 0.00 39.33 39.96 2x7j h ASP 412 CO -0.17 0.70 -0.04 0.74 -1.61 0.00 0.00 179.24 178.87 2x7j h THR 413 N 0.84 1.30 -0.01 2.25 2.02 0.15 -3.38 112.91 116.08 2x7j h THR 413 Ca 0.21 -1.01 0.00 0.00 0.77 0.00 0.00 66.41 66.39 2x7j h THR 413 Cb 0.11 1.73 0.00 0.00 -1.74 0.00 0.00 68.15 68.25 2x7j h THR 413 CO -0.03 0.29 -0.36 0.49 0.37 0.00 0.00 175.52 176.28 2x7j n PHE 414 N -4.73 0.00 -2.70 3.16 3.72 0.14 -4.89 117.46 112.16 2x7j n PHE 414 Ca -0.06 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.91 2x7j n PHE 414 Cb 0.26 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.77 2x7j n PHE 414 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2x7j s PHE 415 N -1.80 3.05 0.56 1.38 2.99 -0.38 -4.63 117.98 119.15 2x7j s PHE 415 Ca 0.09 0.92 -0.02 0.00 0.00 0.00 0.00 56.93 57.92 2x7j s PHE 415 Cb 0.10 -3.82 0.02 0.00 0.00 0.00 0.00 43.02 39.32 2x7j s PHE 415 CO 0.39 -0.89 0.82 -1.21 -0.00 0.00 0.00 175.22 174.32 2x7j s GLU 416 N 3.74 2.70 0.35 0.44 2.02 -1.26 -4.90 118.70 121.79 2x7j s GLU 416 Ca 0.43 -0.43 -0.28 0.00 0.02 0.00 0.00 54.97 54.71 2x7j s GLU 416 Cb -0.11 -2.40 -0.09 0.00 0.10 0.00 0.00 34.13 31.63 2x7j s GLU 416 CO 0.20 -0.69 1.24 -1.59 0.02 0.00 0.00 175.26 174.44 2x7j s LYS 417 N -4.85 4.27 0.04 1.61 -2.85 -1.26 -4.82 119.74 111.88 2x7j s LYS 417 Ca 0.55 2.06 -0.19 0.00 -1.00 0.00 0.00 55.97 57.38 2x7j s LYS 417 Cb -0.10 -2.95 0.04 0.00 -2.06 0.00 0.00 37.83 32.76 2x7j s LYS 417 CO 0.41 -0.21 0.44 1.14 0.10 0.00 0.00 175.35 177.23 2x7j s GLN 418 N -1.93 0.93 0.15 1.78 -2.07 0.05 -5.02 119.66 113.55 2x7j s GLN 418 Ca 0.51 -0.30 0.24 0.00 -1.82 0.00 0.00 55.36 54.00 2x7j s GLN 418 Cb -0.36 0.42 0.92 0.00 -1.09 0.00 0.00 33.01 32.90 2x7j s GLN 418 CO 0.47 -0.32 1.75 -0.25 -1.32 0.00 0.00 175.29 175.62 2x7j n ASP 419 N 0.56 0.48 -4.71 12.60 8.00 -1.26 -3.19 116.55 129.03 2x7j n ASP 419 Ca -0.19 0.57 -0.42 0.00 0.71 0.00 0.00 54.79 55.46 2x7j n ASP 419 Cb 0.59 -0.69 -0.03 0.00 -0.02 0.00 0.00 41.12 40.98 2x7j n ASP 419 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2x7j s ARG 420 N -3.12 4.39 0.02 -1.24 0.52 -1.26 -3.97 118.95 114.28 2x7j s ARG 420 Ca 0.09 1.80 -0.24 0.00 -0.52 0.00 0.00 55.73 56.87 2x7j s ARG 420 Cb 0.13 -3.40 -0.05 0.00 0.52 0.00 0.00 34.95 32.14 2x7j s ARG 420 CO 0.48 -0.35 0.71 -1.25 0.02 0.00 0.00 175.30 174.92 2x7j s PRO 421 N 1.43 4.44 0.06 3.54 0.04 -1.26 -3.31 135.00 139.94 2x7j s PRO 421 Ca 0.59 0.95 -0.27 0.00 0.04 0.00 0.00 61.00 62.32 2x7j s PRO 421 Cb -0.30 -3.37 0.09 0.00 0.04 0.00 0.00 34.50 30.96 2x7j s PRO 421 CO 0.28 0.28 0.82 -0.59 0.04 0.00 0.00 177.00 177.82 2x7j s PHE 422 N 0.03 -0.36 -0.10 0.56 -0.71 -1.12 -0.47 117.98 115.81 2x7j s PHE 422 Ca 0.36 0.18 -0.01 0.00 -1.04 0.00 0.00 56.93 56.43 2x7j s PHE 422 Cb -0.19 0.56 -0.03 0.00 -1.21 0.00 0.00 43.02 42.15 2x7j s PHE 422 CO 0.21 -0.67 -0.07 1.03 -1.34 0.00 0.00 175.22 174.37 2x7j s ARG 423 N -3.32 3.11 -0.20 1.99 0.52 -0.85 -4.82 118.95 115.38 2x7j s ARG 423 Ca 0.05 -0.57 -0.08 0.00 -0.52 0.00 0.00 55.73 54.62 2x7j s ARG 423 Cb -0.01 -2.68 -0.04 0.00 0.52 0.00 0.00 34.95 32.73 2x7j s ARG 423 CO -0.08 0.47 0.07 0.42 0.02 0.00 0.00 175.30 176.20 2x7j s ILE 424 N -0.29 4.77 0.10 1.52 1.01 -1.26 -0.49 121.20 126.56 2x7j s ILE 424 Ca 0.04 -0.04 0.10 0.00 0.00 0.00 0.00 60.65 60.75 2x7j s ILE 424 Cb -0.13 -3.17 -0.03 0.00 0.01 0.00 0.00 42.46 39.14 2x7j s ILE 424 CO 0.02 0.43 -0.25 -0.31 0.00 0.00 0.00 174.94 174.83 2x7j s TYR 425 N 0.65 2.17 -0.04 3.97 1.51 0.38 -4.75 117.35 121.24 2x7j s TYR 425 Ca 0.04 -0.39 -0.21 0.00 -1.01 0.00 0.00 57.07 55.50 2x7j s TYR 425 Cb -0.13 -1.22 0.04 0.00 -0.11 0.00 0.00 41.96 40.54 2x7j s TYR 425 CO 0.01 0.24 0.46 0.45 -1.11 0.00 0.00 175.55 175.60 2x7j s SER 426 N -1.74 -0.39 -1.31 2.29 0.15 -1.26 -0.23 113.70 111.21 2x7j s SER 426 Ca 0.11 0.40 -0.18 0.00 0.70 0.00 0.00 55.95 56.99 2x7j s SER 426 Cb -0.10 0.46 0.07 0.00 -1.71 0.00 0.00 66.02 64.74 2x7j s SER 426 CO 0.04 -0.47 1.77 0.59 1.20 0.00 0.00 173.24 176.37 2x7j n ASN 427 N 1.31 4.86 -1.11 5.45 3.02 -1.26 -4.72 115.26 122.82 2x7j n ASN 427 Ca -0.20 -2.92 0.11 0.00 -0.03 0.00 0.00 54.58 51.55 2x7j n ASN 427 Cb 0.56 -1.74 0.27 0.00 -0.61 0.00 0.00 39.78 38.27 2x7j n ASN 427 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2x7j n ARG 428 N 8.12 2.41 0.18 3.52 5.12 -1.26 -2.95 116.66 131.80 2x7j n ARG 428 Ca 0.49 -2.17 -0.15 0.00 -1.93 0.00 0.00 57.85 54.09 2x7j n ARG 428 Cb 0.45 -1.49 -0.08 0.00 -1.16 0.00 0.00 32.46 30.18 2x7j n ARG 428 CO 0.00 0.00 0.00 0.78 -1.93 0.00 0.00 177.63 176.48 2x7j h GLY 429 N 4.63 -0.44 0.00 -0.13 0.00 -1.84 -3.38 103.07 101.91 2x7j h GLY 429 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.49 2x7j h GLY 429 CO 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 176.54 176.38 2x7j n ALA 430 N -2.31 1.68 -2.49 3.60 0.00 -1.26 -4.70 120.51 115.02 2x7j n ALA 430 Ca -0.10 -0.30 -0.20 0.00 0.00 0.00 0.00 53.44 52.84 2x7j n ALA 430 Cb 0.21 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.66 2x7j n ALA 430 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2x7j n ASN 431 N -0.08 -5.61 -4.77 0.00 5.03 -1.15 -4.97 115.26 103.70 2x7j n ASN 431 Ca 0.00 -0.07 -0.39 0.00 0.87 0.00 0.00 54.58 54.99 2x7j n ASN 431 Cb 0.07 -4.60 -0.03 0.00 -1.02 0.00 0.00 39.78 34.20 2x7j n ASN 431 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 2x7j s GLY 432 N -2.26 2.92 0.00 7.41 0.00 -1.26 -4.77 107.32 109.36 2x7j s GLY 432 Ca 0.06 0.90 0.29 0.00 0.00 0.00 0.00 44.72 45.97 2x7j s GLY 432 CO 0.07 1.43 1.88 0.29 0.00 0.00 0.00 173.10 176.78 2x7j n ILE 433 N 0.50 0.00 -2.77 0.90 -5.35 -1.26 -4.65 119.36 106.73 2x7j n ILE 433 Ca 0.02 -0.13 -0.36 0.00 -0.27 0.00 0.00 62.75 62.01 2x7j n ILE 433 Cb 0.46 0.08 -0.06 0.00 -1.74 0.00 0.00 39.64 38.38 2x7j n ILE 433 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 2x7j s ASP 434 N -2.17 7.23 -0.10 7.28 -4.77 -1.26 -4.32 116.67 118.56 2x7j s ASP 434 Ca 0.37 1.83 0.00 0.00 -3.30 0.00 0.00 52.55 51.45 2x7j s ASP 434 Cb 0.21 -2.57 0.00 0.00 -1.09 0.00 0.00 42.92 39.47 2x7j s ASP 434 CO 0.40 -0.15 0.00 0.61 0.70 0.00 0.00 175.17 176.73 2x7j n GLY 435 N 0.34 0.26 0.31 2.12 0.00 -1.26 -4.87 105.19 102.09 2x7j n GLY 435 Ca 0.03 -0.03 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 2x7j n GLY 435 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2x7j h VAL 436 N 0.00 1.19 0.03 1.61 2.07 -1.88 0.04 116.25 119.31 2x7j h VAL 436 Ca -0.02 -0.57 -0.00 0.00 0.82 0.00 0.00 66.70 66.93 2x7j h VAL 436 Cb 0.68 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2x7j h VAL 436 CO 0.03 0.23 -0.02 0.58 0.02 0.00 0.00 177.57 178.41 2x7j h VAL 437 N 0.76 1.21 -0.27 2.57 2.07 -1.89 -1.34 116.25 119.36 2x7j h VAL 437 Ca 0.19 -0.77 -0.03 0.00 0.82 0.00 0.00 66.70 66.91 2x7j h VAL 437 Cb 0.13 1.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 2x7j h VAL 437 CO -0.02 0.20 0.05 0.28 0.02 0.00 0.00 177.57 178.10 2x7j h SER 438 N -0.38 0.35 -0.13 0.57 0.02 -1.76 0.11 113.55 112.33 2x7j h SER 438 Ca -0.00 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 2x7j h SER 438 Cb 0.35 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 2x7j h SER 438 CO 0.01 0.37 0.06 0.28 -1.14 0.00 0.00 176.83 176.41 2x7j h SER 439 N 0.39 0.18 -0.12 3.07 0.02 -0.77 -0.57 113.55 115.75 2x7j h SER 439 Ca 0.09 -0.15 0.04 0.00 -0.84 0.00 0.00 61.79 60.93 2x7j h SER 439 Cb 0.17 -0.05 -0.05 0.00 0.14 0.00 0.00 62.40 62.62 2x7j h SER 439 CO -0.00 0.29 -0.17 0.00 -1.14 0.00 0.00 176.83 175.81 2x7j h ALA 440 N 0.90 -0.10 -0.74 3.77 0.00 -0.32 0.10 119.26 122.87 2x7j h ALA 440 Ca 0.05 0.05 0.16 0.00 0.00 0.00 0.00 54.91 55.16 2x7j h ALA 440 Cb 0.16 0.33 -0.11 0.00 0.00 0.00 0.00 17.79 18.17 2x7j h ALA 440 CO -0.00 -0.62 0.17 0.52 0.00 0.00 0.00 179.25 179.31 2x7j h MET 441 N -0.21 0.25 -0.15 0.00 2.86 -0.62 -0.67 114.93 116.39 2x7j h MET 441 Ca 0.09 -0.02 -0.13 0.00 -2.06 0.00 0.00 59.70 57.59 2x7j h MET 441 Cb 0.35 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 2x7j h MET 441 CO -0.25 0.17 -0.46 0.78 1.06 0.00 0.00 176.91 178.21 2x7j h GLY 442 N 0.26 0.41 1.78 8.32 0.00 -0.16 -1.71 103.07 111.97 2x7j h GLY 442 Ca 0.42 -0.42 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 2x7j h GLY 442 CO -0.52 0.38 -0.06 -2.08 0.00 0.00 0.00 176.54 174.26 2x7j h VAL 443 N 0.30 1.16 0.14 4.60 2.07 0.59 -0.66 116.25 124.45 2x7j h VAL 443 Ca 0.02 -0.66 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 2x7j h VAL 443 Cb 0.92 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 2x7j h VAL 443 CO 0.08 0.21 -0.07 0.00 0.02 0.00 0.00 177.57 177.81 2x7j h GLU 445 N -0.69 0.43 -0.10 0.00 4.39 -1.24 -0.53 114.58 116.83 2x7j h GLU 445 Ca -0.02 -0.03 -0.12 0.00 0.34 0.00 0.00 59.36 59.54 2x7j h GLU 445 Cb 0.51 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 2x7j h GLU 445 CO 0.03 0.29 -0.40 0.78 -1.16 0.00 0.00 179.01 178.54 2x7j h GLY 446 N 0.44 0.50 0.82 -3.84 0.00 -0.82 -3.32 103.07 96.86 2x7j h GLY 446 Ca 0.67 -0.68 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2x7j h GLY 446 CO -0.47 0.60 -1.01 -1.30 0.00 0.00 0.00 176.54 174.37 2x7j n THR 447 N -4.32 0.36 -3.92 4.70 -2.24 -0.34 -4.79 114.28 103.74 2x7j n THR 447 Ca -0.08 -0.38 -0.30 0.00 -2.27 0.00 0.00 64.05 61.02 2x7j n THR 447 Cb 0.54 -0.09 0.03 0.00 -2.10 0.00 0.00 70.33 68.71 2x7j n THR 447 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2x7j n LYS 448 N -2.28 -5.49 -4.01 -0.78 4.76 -0.23 -4.96 118.16 105.17 2x7j n LYS 448 Ca 0.01 0.59 -0.09 0.00 -2.87 0.00 0.00 58.31 55.95 2x7j n LYS 448 Cb 0.49 -5.47 -0.06 0.00 -1.84 0.00 0.00 35.03 28.15 2x7j n LYS 448 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2x7j s ALA 449 N -3.31 -0.09 0.42 7.82 0.00 -1.26 -5.01 121.76 120.33 2x7j s ALA 449 Ca 0.65 -0.95 -0.25 0.00 0.00 0.00 0.00 51.96 51.40 2x7j s ALA 449 Cb -0.32 1.09 -0.08 0.00 0.00 0.00 0.00 23.12 23.80 2x7j s ALA 449 CO 0.83 -0.81 1.26 -2.14 0.00 0.00 0.00 175.76 174.91 2x7j s PRO 450 N -4.03 3.93 -0.06 0.00 0.02 -1.26 -4.80 135.00 128.80 2x7j s PRO 450 Ca 0.24 2.06 0.04 0.00 0.02 0.00 0.00 61.00 63.35 2x7j s PRO 450 Cb 0.00 -2.69 0.00 0.00 0.02 0.00 0.00 34.50 31.84 2x7j s PRO 450 CO 0.08 -0.49 -0.16 0.08 -0.33 0.00 0.00 177.00 176.18 2x7j s VAL 451 N -1.32 1.42 -0.11 3.83 1.01 -1.26 -0.13 120.40 123.85 2x7j s VAL 451 Ca 0.58 -0.68 -0.00 0.00 0.00 0.00 0.00 61.98 61.88 2x7j s VAL 451 Cb -0.36 -1.25 -0.02 0.00 0.00 0.00 0.00 36.38 34.75 2x7j s VAL 451 CO 0.45 0.41 -0.08 -0.89 0.00 0.00 0.00 175.10 174.99 2x7j s THR 452 N 0.30 3.52 -0.20 3.92 2.01 0.12 -2.20 115.64 123.10 2x7j s THR 452 Ca -0.10 -0.52 -0.01 0.00 0.31 0.00 0.00 61.69 61.37 2x7j s THR 452 Cb -0.14 -2.47 0.01 0.00 0.01 0.00 0.00 72.50 69.91 2x7j s THR 452 CO 0.04 0.55 -0.13 -0.22 -0.69 0.00 0.00 174.62 174.17 2x7j s LEU 453 N -0.18 2.55 -0.26 4.42 2.96 0.09 0.85 118.68 129.10 2x7j s LEU 453 Ca 0.02 -0.64 -0.11 0.00 -0.22 0.00 0.00 54.13 53.17 2x7j s LEU 453 Cb -0.13 -1.58 -0.05 0.00 0.50 0.00 0.00 46.19 44.93 2x7j s LEU 453 CO 0.03 -0.03 0.21 -0.69 -1.32 0.00 0.00 176.35 174.54 2x7j s VAL 454 N 1.34 5.31 -0.06 1.68 1.01 -0.61 0.12 120.40 129.20 2x7j s VAL 454 Ca 0.04 0.24 -0.13 0.00 0.00 0.00 0.00 61.98 62.13 2x7j s VAL 454 Cb -0.14 -3.54 0.03 0.00 0.00 0.00 0.00 36.38 32.72 2x7j s VAL 454 CO -0.09 0.28 0.31 -0.51 0.00 0.00 0.00 175.10 175.09 2x7j s ILE 455 N 1.46 0.04 0.72 2.22 2.07 -0.98 -0.22 121.20 126.50 2x7j s ILE 455 Ca 0.09 -0.30 -0.11 0.00 -1.41 0.00 0.00 60.65 58.92 2x7j s ILE 455 Cb -0.15 -0.54 0.03 0.00 0.13 0.00 0.00 42.46 41.93 2x7j s ILE 455 CO 0.08 -0.16 1.10 -0.83 -1.91 0.00 0.00 174.94 173.21 2x7j s GLY 456 N -0.74 1.62 0.22 1.50 0.00 -1.26 -1.34 107.32 107.32 2x7j s GLY 456 Ca -0.08 -0.48 -0.02 0.00 0.00 0.00 0.00 44.72 44.14 2x7j s GLY 456 CO 0.03 -0.08 1.60 1.29 0.00 0.00 0.00 173.10 175.93 2x7j h ASP 457 N -0.70 0.65 -0.33 1.64 2.03 -1.85 0.49 116.42 118.34 2x7j h ASP 457 Ca -0.45 -0.28 -0.13 0.00 -0.73 0.00 0.00 57.03 55.44 2x7j h ASP 457 Cb 1.27 -0.18 -0.01 0.00 -0.83 0.00 0.00 39.33 39.59 2x7j h ASP 457 CO 0.64 0.95 -0.32 -0.07 -1.03 0.00 0.00 179.24 179.41 2x7j h LEU 458 N 0.51 0.85 -0.17 0.15 3.38 -1.92 -0.45 115.31 117.67 2x7j h LEU 458 Ca 0.05 -0.47 -0.00 0.00 0.09 0.00 0.00 57.88 57.55 2x7j h LEU 458 Cb 0.87 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 2x7j h LEU 458 CO 0.08 1.14 0.09 -1.28 0.09 0.00 0.00 178.44 178.56 2x7j h SER 459 N 0.58 0.21 -0.54 -0.43 0.87 -1.78 -0.49 113.55 111.98 2x7j h SER 459 Ca 0.05 -0.10 0.04 0.00 -1.23 0.00 0.00 61.79 60.56 2x7j h SER 459 Cb 0.90 -0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 62.76 2x7j h SER 459 CO 0.08 0.25 0.30 0.15 -0.53 0.00 0.00 176.83 177.07 2x7j h PHE 460 N 0.16 0.55 -0.79 2.24 3.04 -0.85 -0.32 116.94 120.96 2x7j h PHE 460 Ca 0.06 0.02 0.05 0.00 3.98 0.00 0.00 57.97 62.08 2x7j h PHE 460 Cb 0.08 -0.17 -0.06 0.00 2.56 0.00 0.00 35.95 38.37 2x7j h PHE 460 CO -0.04 0.29 0.48 -0.92 -2.02 0.00 0.00 178.31 176.10 2x7j h TYR 461 N 0.58 0.90 -0.80 0.41 3.20 -0.88 -2.57 116.97 117.81 2x7j h TYR 461 Ca 0.23 0.03 0.07 0.00 3.14 0.00 0.00 58.73 62.19 2x7j h TYR 461 Cb 0.09 -0.29 -0.06 0.00 1.54 0.00 0.00 36.73 38.01 2x7j h TYR 461 CO -0.08 0.47 0.48 1.25 -1.64 0.00 0.00 178.16 178.63 2x7j h HIS 462 N 0.90 0.88 -1.22 -3.82 2.76 0.65 -2.82 115.15 112.48 2x7j h HIS 462 Ca 0.34 0.03 -0.59 0.00 -2.20 0.00 0.00 60.37 57.94 2x7j h HIS 462 Cb 0.14 -0.28 -0.40 0.00 1.55 0.00 0.00 27.41 28.41 2x7j h HIS 462 CO -0.04 0.43 -0.51 -3.47 -1.30 0.00 0.00 177.93 173.03 2x7j n ASP 463 N -4.69 5.23 -0.25 3.26 2.03 -1.02 -4.73 116.55 116.38 2x7j n ASP 463 Ca 0.11 -3.75 0.11 0.00 0.52 0.00 0.00 54.79 51.79 2x7j n ASP 463 Cb 0.19 -0.50 0.38 0.00 -0.72 0.00 0.00 41.12 40.48 2x7j n ASP 463 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 2x7j h LEU 464 N 2.41 0.64 -2.26 -2.67 4.07 -1.19 -1.66 115.31 114.66 2x7j h LEU 464 Ca 0.37 0.03 0.01 0.00 0.08 0.00 0.00 57.88 58.37 2x7j h LEU 464 Cb 1.09 -0.10 -0.00 0.00 1.08 0.00 0.00 40.66 42.73 2x7j h LEU 464 CO 0.91 0.34 0.03 0.78 -1.08 0.00 0.00 178.44 179.42 2x7j h ASN 465 N 0.69 0.00 0.42 -0.43 4.21 -1.86 -2.08 115.58 116.53 2x7j h ASN 465 Ca 0.42 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.93 2x7j h ASN 465 Cb 0.64 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.84 2x7j h ASN 465 CO -0.18 0.00 0.00 1.23 -1.29 0.00 0.00 177.43 177.19 2x7j h GLY 466 N 0.00 0.00 1.78 2.83 0.00 -1.68 -2.28 103.07 103.72 2x7j h GLY 466 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 2x7j h GLY 466 CO -0.00 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.58 2x7j n LEU 467 N -2.59 0.00 0.21 3.11 4.77 -0.78 -2.90 117.00 118.82 2x7j n LEU 467 Ca -0.00 0.39 0.08 0.00 -0.03 0.00 0.00 56.01 56.44 2x7j n LEU 467 Cb 0.15 -0.39 0.47 0.00 -2.33 0.00 0.00 43.42 41.32 2x7j n LEU 467 CO 0.18 -0.12 0.79 0.25 -1.33 0.00 0.00 177.39 177.16 2x7j h LEU 468 N 0.00 0.00 -1.81 2.23 5.85 -1.61 -2.60 115.31 117.37 2x7j h LEU 468 Ca 0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2x7j h LEU 468 Cb 0.28 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 2x7j h LEU 468 CO 0.00 0.28 -0.14 0.00 -0.34 0.00 0.00 178.44 178.24 2x7j h ALA 469 N 1.72 1.59 0.33 1.25 0.00 -1.76 -0.46 119.26 121.92 2x7j h ALA 469 Ca -0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2x7j h ALA 469 Cb 0.67 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2x7j h ALA 469 CO 0.04 0.17 -0.29 0.00 0.00 0.00 0.00 179.25 179.17 2x7j h ALA 470 N 1.86 -1.01 0.55 0.00 0.00 -1.64 -0.94 119.26 118.08 2x7j h ALA 470 Ca -0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 2x7j h ALA 470 Cb 0.28 0.50 0.01 0.00 0.00 0.00 0.00 17.79 18.57 2x7j h ALA 470 CO 0.02 -1.02 -0.26 0.87 0.00 0.00 0.00 179.25 178.85 2x7j h LYS 471 N -0.60 -0.71 -0.71 0.00 1.57 -1.68 -0.04 116.57 114.40 2x7j h LYS 471 Ca -0.04 0.05 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 2x7j h LYS 471 Cb 0.51 0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.95 2x7j h LYS 471 CO -0.01 -0.48 0.46 -0.22 -0.57 0.00 0.00 179.45 178.63 2x7j h LYS 472 N -0.81 0.90 -0.30 3.15 3.64 -1.19 -2.57 116.57 119.38 2x7j h LYS 472 Ca -0.08 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 2x7j h LYS 472 Cb 0.57 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 2x7j h LYS 472 CO 0.12 0.59 0.00 1.28 -2.27 0.00 0.00 179.45 179.18 2x7j n LEU 473 N -4.62 2.96 -3.81 5.20 4.77 -0.38 -4.99 117.00 116.13 2x7j n LEU 473 Ca 0.07 -1.55 -0.28 0.00 -0.03 0.00 0.00 56.01 54.22 2x7j n LEU 473 Cb 0.04 -0.19 0.04 0.00 -2.33 0.00 0.00 43.42 40.98 2x7j n LEU 473 CO 0.35 0.66 0.12 0.61 -1.33 0.00 0.00 177.39 177.80 2x7j n GLY 474 N 1.01 -0.48 3.69 -0.72 0.00 -0.07 -4.96 105.19 103.66 2x7j n GLY 474 Ca 0.14 0.20 -0.36 0.00 0.00 0.00 0.00 46.02 46.00 2x7j n GLY 474 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x7j s ILE 475 N -3.34 5.36 0.20 -0.61 1.01 -0.95 -4.39 121.20 118.47 2x7j s ILE 475 Ca 0.57 0.27 -0.30 0.00 0.00 0.00 0.00 60.65 61.18 2x7j s ILE 475 Cb -0.28 -3.52 -0.08 0.00 0.01 0.00 0.00 42.46 38.59 2x7j s ILE 475 CO 0.80 0.37 0.97 -2.16 0.00 0.00 0.00 174.94 174.93 2x7j s PRO 476 N 0.79 4.78 -0.16 2.79 0.04 -1.26 -4.28 135.00 137.70 2x7j s PRO 476 Ca 0.10 1.52 -0.13 0.00 0.04 0.00 0.00 61.00 62.53 2x7j s PRO 476 Cb -0.13 -3.30 0.05 0.00 0.04 0.00 0.00 34.50 31.16 2x7j s PRO 476 CO 0.02 0.38 0.41 -1.17 0.04 0.00 0.00 177.00 176.69 2x7j s LEU 477 N -0.82 0.24 -0.33 -3.56 2.96 -0.47 -4.64 118.68 112.06 2x7j s LEU 477 Ca 0.44 0.86 -0.11 0.00 -0.22 0.00 0.00 54.13 55.09 2x7j s LEU 477 Cb -0.26 1.40 -0.00 0.00 0.50 0.00 0.00 46.19 47.83 2x7j s LEU 477 CO 0.32 -0.16 0.19 -0.89 -1.32 0.00 0.00 176.35 174.50 2x7j s THR 478 N 0.61 4.83 -0.37 3.68 2.01 -0.94 -1.02 115.64 124.44 2x7j s THR 478 Ca -0.03 -0.44 -0.13 0.00 0.31 0.00 0.00 61.69 61.41 2x7j s THR 478 Cb -0.05 -3.51 0.01 0.00 0.01 0.00 0.00 72.50 68.96 2x7j s THR 478 CO -0.04 -0.02 0.24 -0.69 -0.69 0.00 0.00 174.62 173.42 2x7j s VAL 479 N 1.64 4.97 -0.64 3.82 1.01 0.22 -0.74 120.40 130.68 2x7j s VAL 479 Ca 0.05 -0.58 -0.21 0.00 0.00 0.00 0.00 61.98 61.23 2x7j s VAL 479 Cb -0.18 -3.69 0.08 0.00 0.00 0.00 0.00 36.38 32.60 2x7j s VAL 479 CO 0.08 -0.16 0.88 -0.63 0.00 0.00 0.00 175.10 175.26 2x7j s ILE 480 N 1.64 4.50 -0.47 2.22 1.01 0.12 0.04 121.20 130.26 2x7j s ILE 480 Ca 0.04 -0.61 -0.20 0.00 0.00 0.00 0.00 60.65 59.88 2x7j s ILE 480 Cb -0.18 -4.62 0.04 0.00 0.01 0.00 0.00 42.46 37.70 2x7j s ILE 480 CO 0.09 -1.35 0.66 -0.22 0.00 0.00 0.00 174.94 174.12 2x7j s LEU 481 N 3.56 4.64 -0.83 2.97 2.96 -0.14 -2.32 118.68 129.52 2x7j s LEU 481 Ca 0.19 -0.56 -0.23 0.00 -0.22 0.00 0.00 54.13 53.31 2x7j s LEU 481 Cb -0.19 -2.62 0.07 0.00 0.50 0.00 0.00 46.19 43.94 2x7j s LEU 481 CO 0.08 -0.86 1.20 -0.69 -1.32 0.00 0.00 176.35 174.76 2x7j s VAL 482 N 2.85 4.16 -0.47 1.68 1.01 -0.45 -0.99 120.40 128.19 2x7j s VAL 482 Ca 0.20 -0.54 -0.16 0.00 0.00 0.00 0.00 61.98 61.48 2x7j s VAL 482 Cb -0.16 -4.86 0.06 0.00 0.00 0.00 0.00 36.38 31.43 2x7j s VAL 482 CO 0.16 -1.69 0.43 0.21 0.00 0.00 0.00 175.10 174.21 2x7j s ASN 483 N 4.02 6.16 -0.12 3.32 3.84 0.02 -3.06 114.94 129.13 2x7j s ASN 483 Ca 0.34 -1.21 0.15 0.00 0.21 0.00 0.00 52.86 52.35 2x7j s ASN 483 Cb -0.08 -2.20 0.40 0.00 -0.55 0.00 0.00 41.25 38.82 2x7j s ASN 483 CO 0.02 -0.67 1.31 -0.46 -2.79 0.00 0.00 177.10 174.50 2x7j n ASN 484 N 5.37 3.26 -3.49 -4.21 0.23 -1.26 -1.74 115.26 113.42 2x7j n ASN 484 Ca -0.11 -2.74 -0.15 0.00 -0.53 0.00 0.00 54.58 51.04 2x7j n ASN 484 Cb 0.44 -0.42 0.00 0.00 -2.08 0.00 0.00 39.78 37.73 2x7j n ASN 484 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 2x7j n ASP 485 N -0.47 -6.07 0.00 0.53 4.64 -1.26 -4.50 116.55 109.42 2x7j n ASP 485 Ca 0.17 -0.61 0.00 0.00 -1.38 0.00 0.00 54.79 52.97 2x7j n ASP 485 Cb 0.70 -3.24 0.00 0.00 -1.04 0.00 0.00 41.12 37.54 2x7j n ASP 485 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2x7j n GLY 486 N -1.70 0.72 3.37 0.27 0.00 -1.26 -4.21 105.19 102.37 2x7j n GLY 486 Ca -0.18 -2.06 -0.43 0.00 0.00 0.00 0.00 46.02 43.35 2x7j n GLY 486 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x7j n GLY 487 N 0.00 3.28 0.38 -0.02 0.00 0.16 -4.65 105.19 104.34 2x7j n GLY 487 Ca 0.00 -1.73 0.29 0.00 0.00 0.00 0.00 46.02 44.58 2x7j n GLY 487 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2x7j h GLY 488 N 10.84 1.81 1.89 -0.02 0.00 -1.89 -2.28 103.07 113.43 2x7j h GLY 488 Ca 0.41 -0.18 -0.02 0.00 0.00 0.00 0.00 47.33 47.54 2x7j h GLY 488 CO 1.45 -0.49 -0.04 1.19 0.00 0.00 0.00 176.54 178.65 2x7j h ILE 489 N 0.20 1.10 0.00 2.60 2.10 -1.96 -2.87 117.51 118.67 2x7j h ILE 489 Ca 0.77 -0.40 0.00 0.00 1.08 0.00 0.00 64.86 66.31 2x7j h ILE 489 Cb 2.03 1.07 0.00 0.00 -1.09 0.00 0.00 36.82 38.83 2x7j h ILE 489 CO -0.55 0.13 0.00 0.49 -1.08 0.00 0.00 178.15 177.13 2x7j n PHE 490 N -4.40 0.00 0.30 2.19 3.01 -0.86 -2.17 117.46 115.53 2x7j n PHE 490 Ca -0.01 0.00 0.16 0.00 1.01 0.00 0.00 57.45 58.61 2x7j n PHE 490 Cb 0.17 -0.39 0.59 0.00 -0.01 0.00 0.00 39.48 39.84 2x7j n PHE 490 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 2x7j h SER 491 N 0.00 0.00 1.06 4.37 0.02 -1.70 -2.32 113.55 114.99 2x7j h SER 491 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2x7j h SER 491 Cb 0.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.77 2x7j h SER 491 CO 0.00 0.00 -0.09 0.49 -1.14 0.00 0.00 176.83 176.09 2x7j n PHE 492 N -2.96 0.27 -2.27 3.45 3.01 -0.92 -4.78 117.46 113.26 2x7j n PHE 492 Ca 0.01 0.08 -0.38 0.00 1.01 0.00 0.00 57.45 58.17 2x7j n PHE 492 Cb 0.33 -0.60 -0.02 0.00 -0.01 0.00 0.00 39.48 39.18 2x7j n PHE 492 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2x7j s LEU 493 N -3.46 4.14 0.63 4.37 1.43 -0.87 -4.90 118.68 120.02 2x7j s LEU 493 Ca 0.12 2.35 0.37 0.00 -1.03 0.00 0.00 54.13 55.95 2x7j s LEU 493 Cb 0.17 -4.08 2.13 0.00 0.03 0.00 0.00 46.19 44.43 2x7j s LEU 493 CO 0.58 -0.76 2.30 1.55 0.23 0.00 0.00 176.35 180.25 2x7j h PRO 494 N 2.45 0.00 -0.22 1.29 0.13 -1.88 -2.40 132.00 131.37 2x7j h PRO 494 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2x7j h PRO 494 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2x7j h PRO 494 CO 0.62 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.43 2x7j n GLN 495 N -3.43 1.65 0.08 0.86 6.02 -1.26 -3.79 117.38 117.51 2x7j n GLN 495 Ca -0.03 -1.00 0.10 0.00 -0.01 0.00 0.00 57.00 56.06 2x7j n GLN 495 Cb 0.10 -1.31 0.42 0.00 1.02 0.00 0.00 30.24 30.47 2x7j n GLN 495 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2x7j n ALA 496 N 0.26 1.66 0.00 -1.58 0.00 -0.90 -2.87 120.51 117.08 2x7j n ALA 496 Ca 0.13 0.03 -0.18 0.00 0.00 0.00 0.00 53.44 53.42 2x7j n ALA 496 Cb 0.27 -1.33 -0.10 0.00 0.00 0.00 0.00 19.45 18.29 2x7j n ALA 496 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2x7j h SER 497 N 0.00 0.62 0.00 0.00 0.02 -1.82 -3.37 113.55 108.99 2x7j h SER 497 Ca 0.00 -0.73 -0.34 0.00 -0.84 0.00 0.00 61.79 59.88 2x7j h SER 497 Cb 0.32 -0.19 0.09 0.00 0.14 0.00 0.00 62.40 62.76 2x7j h SER 497 CO 0.00 1.27 1.15 -0.62 -1.14 0.00 0.00 176.83 177.48 2x7j n GLU 498 N -4.16 0.00 0.33 3.45 -0.58 -1.14 -4.63 120.64 113.91 2x7j n GLU 498 Ca -0.10 -0.74 0.18 0.00 -0.42 0.00 0.00 57.16 56.08 2x7j n GLU 498 Cb 0.69 -2.19 0.94 0.00 -0.57 0.00 0.00 31.44 30.32 2x7j n GLU 498 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2x7j h LYS 499 N 8.99 0.00 0.00 3.49 6.56 -1.84 -2.93 116.57 130.84 2x7j h LYS 499 Ca 0.15 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.71 2x7j h LYS 499 Cb 0.43 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.09 2x7j h LYS 499 CO 1.54 0.00 -0.16 1.79 -2.06 0.00 0.00 179.45 180.56 2x7j h THR 500 N 0.00 0.71 0.00 -0.16 1.35 -1.95 -3.25 112.91 109.61 2x7j h THR 500 Ca 0.00 -0.66 0.00 0.00 -0.55 0.00 0.00 66.41 65.20 2x7j h THR 500 Cb 0.46 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 68.29 2x7j h THR 500 CO -0.00 0.16 -0.83 1.41 -0.25 0.00 0.00 175.52 176.01 2x7j n HIS 501 N -3.76 0.00 -0.08 4.73 8.25 -1.12 -4.90 115.22 118.34 2x7j n HIS 501 Ca -0.02 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.33 2x7j n HIS 501 Cb 0.27 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.31 2x7j n HIS 501 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 2x7j h PHE 502 N 0.00 -1.36 -0.71 4.41 3.57 -1.56 -1.09 116.94 120.21 2x7j h PHE 502 Ca 0.00 0.07 0.01 0.00 3.53 0.00 0.00 57.97 61.58 2x7j h PHE 502 Cb 0.00 0.64 -0.04 0.00 2.79 0.00 0.00 35.95 39.34 2x7j h PHE 502 CO 0.00 -0.47 0.47 1.49 -2.23 0.00 0.00 178.31 177.57 2x7j h GLU 503 N -0.41 0.91 -0.49 1.11 4.57 -1.89 0.45 114.58 118.82 2x7j h GLU 503 Ca 0.10 -0.05 -0.10 0.00 -1.18 0.00 0.00 59.36 58.13 2x7j h GLU 503 Cb 0.61 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.98 2x7j h GLU 503 CO -0.52 0.60 -0.08 -0.44 -1.18 0.00 0.00 179.01 177.39 2x7j h ASP 504 N 0.93 0.88 0.00 1.04 3.32 -1.58 -0.72 116.42 120.29 2x7j h ASP 504 Ca 0.26 -0.26 -0.13 0.00 0.02 0.00 0.00 57.03 56.93 2x7j h ASP 504 Cb -0.07 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.22 2x7j h ASP 504 CO -0.06 0.98 -1.71 0.18 -1.72 0.00 0.00 179.24 176.91 2x7j n LEU 505 N -4.16 0.00 -0.01 1.55 4.77 -0.64 -4.54 117.00 113.97 2x7j n LEU 505 Ca 0.02 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.96 2x7j n LEU 505 Cb 0.37 0.17 -0.01 0.00 -2.33 0.00 0.00 43.42 41.61 2x7j n LEU 505 CO 0.44 0.17 -0.54 0.49 -1.33 0.00 0.00 177.39 176.62 2x7j n PHE 506 N -2.23 0.00 -0.06 -1.77 3.01 0.15 -4.72 117.46 111.84 2x7j n PHE 506 Ca -0.12 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.25 2x7j n PHE 506 Cb 0.65 -0.12 -0.02 0.00 -0.01 0.00 0.00 39.48 39.98 2x7j n PHE 506 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2x7j h GLY 507 N -0.14 -0.26 -6.96 1.37 0.00 -1.33 -3.31 103.07 92.44 2x7j h GLY 507 Ca -0.08 0.36 -0.56 0.00 0.00 0.00 0.00 47.33 47.05 2x7j h GLY 507 CO -0.05 -0.21 -0.97 -1.30 0.00 0.00 0.00 176.54 174.01 2x7j n THR 508 N -5.40 -2.53 -0.90 4.70 -2.24 -0.28 0.39 114.28 108.02 2x7j n THR 508 Ca -0.01 -0.48 -0.31 0.00 -2.27 0.00 0.00 64.05 60.98 2x7j n THR 508 Cb 0.32 -2.17 0.14 0.00 -2.10 0.00 0.00 70.33 66.52 2x7j n THR 508 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2x7j s PRO 509 N -7.04 1.40 -0.06 -0.78 0.04 -1.26 -4.45 135.00 122.86 2x7j s PRO 509 Ca 0.41 1.51 0.05 0.00 0.04 0.00 0.00 61.00 63.01 2x7j s PRO 509 Cb -0.23 -1.77 -0.08 0.00 0.04 0.00 0.00 34.50 32.46 2x7j s PRO 509 CO 0.91 -2.34 0.03 0.25 0.04 0.00 0.00 177.00 175.89 2x7j n THR 510 N -3.90 0.38 -0.18 1.26 -2.24 -1.26 -4.93 114.28 103.40 2x7j n THR 510 Ca 0.12 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 2x7j n THR 510 Cb 0.52 -0.74 0.00 0.00 -2.10 0.00 0.00 70.33 68.01 2x7j n THR 510 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x7j n GLY 511 N 2.59 2.04 3.58 3.38 0.00 -1.26 -4.97 105.19 110.55 2x7j n GLY 511 Ca -0.09 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.41 2x7j n GLY 511 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2x7j n LEU 512 N 0.00 1.42 -4.34 0.99 4.32 -1.26 -4.94 117.00 113.18 2x7j n LEU 512 Ca 0.00 1.13 -0.46 0.00 -0.02 0.00 0.00 56.01 56.66 2x7j n LEU 512 Cb 0.00 -1.17 -0.04 0.00 -1.62 0.00 0.00 43.42 40.59 2x7j n LEU 512 CO 0.00 -1.23 0.34 -0.62 -1.22 0.00 0.00 177.39 174.66 2x7j s ASP 513 N 0.26 6.32 0.16 -1.43 -1.08 -1.26 -4.95 116.67 114.68 2x7j s ASP 513 Ca 0.81 -1.84 0.18 0.00 -0.52 0.00 0.00 52.55 51.17 2x7j s ASP 513 Cb -0.95 -2.25 0.78 0.00 -1.46 0.00 0.00 42.92 39.04 2x7j s ASP 513 CO 0.50 -0.91 1.54 0.49 0.52 0.00 0.00 175.17 177.30 2x7j n PHE 514 N 5.49 0.45 0.21 -5.34 3.01 -1.26 -1.85 117.46 118.16 2x7j n PHE 514 Ca -0.05 0.19 0.09 0.00 1.01 0.00 0.00 57.45 58.69 2x7j n PHE 514 Cb 0.43 -0.81 0.63 0.00 -0.01 0.00 0.00 39.48 39.72 2x7j n PHE 514 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 2x7j h LYS 515 N 0.00 0.04 -0.23 -1.08 2.10 -2.00 0.18 116.57 115.58 2x7j h LYS 515 Ca 0.00 -0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.61 2x7j h LYS 515 Cb 0.23 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.54 2x7j h LYS 515 CO 0.00 0.03 -0.01 0.45 -2.00 0.00 0.00 179.45 177.92 2x7j h HIS 516 N 0.04 0.35 -0.01 0.07 3.86 -1.80 -0.76 115.15 116.90 2x7j h HIS 516 Ca 0.04 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.23 2x7j h HIS 516 Cb 0.12 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.49 2x7j h HIS 516 CO -0.00 0.36 -0.01 0.00 0.86 0.00 0.00 177.93 179.14 2x7j h ALA 517 N 1.67 0.01 -0.76 2.45 0.00 -0.86 0.19 119.26 121.96 2x7j h ALA 517 Ca 0.08 -0.29 0.16 0.00 0.00 0.00 0.00 54.91 54.86 2x7j h ALA 517 Cb 0.24 -0.00 -0.11 0.00 0.00 0.00 0.00 17.79 17.92 2x7j h ALA 517 CO 0.01 -0.19 0.22 0.00 0.00 0.00 0.00 179.25 179.28 2x7j h ALA 518 N 0.43 1.02 -0.20 0.00 0.00 -1.17 -0.94 119.26 118.40 2x7j h ALA 518 Ca 0.00 0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2x7j h ALA 518 Cb 0.59 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2x7j h ALA 518 CO 0.00 -0.31 0.04 0.00 0.00 0.00 0.00 179.25 178.98 2x7j h ALA 519 N 1.61 0.26 -0.79 0.00 0.00 -0.92 0.36 119.26 119.78 2x7j h ALA 519 Ca 0.43 -0.16 0.16 0.00 0.00 0.00 0.00 54.91 55.34 2x7j h ALA 519 Cb 0.73 -0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.34 2x7j h ALA 519 CO -0.49 -0.09 0.32 1.25 0.00 0.00 0.00 179.25 180.24 2x7j h LEU 520 N 0.13 0.30 -2.92 0.00 5.85 0.23 -2.55 115.31 116.33 2x7j h LEU 520 Ca 0.06 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.90 2x7j h LEU 520 Cb 0.29 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.41 2x7j h LEU 520 CO 0.00 0.09 0.00 -1.22 -0.34 0.00 0.00 178.44 176.97 2x7j n TYR 521 N -5.01 1.27 -2.26 1.25 4.02 -0.44 -4.95 117.16 111.05 2x7j n TYR 521 Ca 0.16 -0.55 -0.11 0.00 -0.01 0.00 0.00 57.90 57.39 2x7j n TYR 521 Cb 0.46 -0.13 -0.00 0.00 -0.02 0.00 0.00 39.34 39.64 2x7j n TYR 521 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2x7j n GLY 522 N 1.39 -0.08 3.95 2.72 0.00 -0.37 -4.50 105.19 108.30 2x7j n GLY 522 Ca 0.25 -0.41 -0.24 0.00 0.00 0.00 0.00 46.02 45.63 2x7j n GLY 522 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2x7j s GLY 523 N -2.53 1.41 0.14 -0.02 0.00 0.11 -4.69 107.32 101.73 2x7j s GLY 523 Ca 0.02 -0.99 -0.11 0.00 0.00 0.00 0.00 44.72 43.63 2x7j s GLY 523 CO 0.02 -0.96 0.48 -0.51 0.00 0.00 0.00 173.10 172.13 2x7j s THR 524 N -2.09 4.98 -0.06 0.90 -4.23 -0.15 -4.40 115.64 110.58 2x7j s THR 524 Ca 0.38 0.55 0.04 0.00 -1.18 0.00 0.00 61.69 61.48 2x7j s THR 524 Cb -0.10 -3.67 -0.02 0.00 1.34 0.00 0.00 72.50 70.05 2x7j s THR 524 CO 0.32 0.18 -0.18 -0.47 -0.54 0.00 0.00 174.62 173.93 2x7j s TYR 525 N -1.52 2.61 0.08 3.99 5.04 -1.26 -0.15 117.35 126.14 2x7j s TYR 525 Ca 0.38 -0.43 0.07 0.00 -2.44 0.00 0.00 57.07 54.65 2x7j s TYR 525 Cb -0.14 -1.65 -0.03 0.00 0.35 0.00 0.00 41.96 40.49 2x7j s TYR 525 CO 0.20 -0.02 -0.17 -1.12 -1.34 0.00 0.00 175.55 173.09 2x7j s SER 526 N -0.36 2.10 -0.49 4.32 0.01 -0.03 -4.98 113.70 114.26 2x7j s SER 526 Ca 0.03 -0.64 0.04 0.00 1.31 0.00 0.00 55.95 56.69 2x7j s SER 526 Cb -0.12 -0.10 0.17 0.00 0.21 0.00 0.00 66.02 66.18 2x7j s SER 526 CO 0.02 -0.00 0.38 0.00 0.41 0.00 0.00 173.24 174.05 2x7j s PRO 528 N -0.35 4.29 0.00 0.00 0.04 -1.26 -4.94 135.00 132.78 2x7j s PRO 528 Ca 0.31 2.28 0.22 0.00 0.04 0.00 0.00 61.00 63.84 2x7j s PRO 528 Cb 0.01 -3.09 -0.01 0.00 0.04 0.00 0.00 34.50 31.45 2x7j s PRO 528 CO -0.19 -0.34 1.06 0.00 0.04 0.00 0.00 177.00 177.57 2x7j n ALA 529 N 1.74 3.51 -3.32 8.56 0.00 -1.26 -4.86 120.51 124.88 2x7j n ALA 529 Ca 0.04 -0.63 -0.09 0.00 0.00 0.00 0.00 53.44 52.76 2x7j n ALA 529 Cb 0.41 -0.77 -0.05 0.00 0.00 0.00 0.00 19.45 19.05 2x7j n ALA 529 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2x7j s SER 530 N -2.41 -0.13 0.44 0.00 1.04 -1.26 -4.81 113.70 106.57 2x7j s SER 530 Ca 0.18 -0.86 0.18 0.00 0.48 0.00 0.00 55.95 55.94 2x7j s SER 530 Cb 0.18 0.62 1.02 0.00 0.10 0.00 0.00 66.02 67.93 2x7j s SER 530 CO 0.55 -1.18 1.94 -0.50 0.98 0.00 0.00 173.24 175.03 2x7j h TRP 531 N 2.20 0.00 -0.34 5.02 -0.00 -1.94 -1.68 115.95 119.21 2x7j h TRP 531 Ca -0.25 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 58.64 2x7j h TRP 531 Cb 1.25 0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 30.39 2x7j h TRP 531 CO 0.40 0.24 0.18 -0.44 -0.00 0.00 0.00 178.44 178.83 2x7j h ASP 532 N 0.00 0.43 0.46 -3.49 3.32 -1.98 0.39 116.42 115.54 2x7j h ASP 532 Ca -0.00 -0.10 -0.06 0.00 0.02 0.00 0.00 57.03 56.89 2x7j h ASP 532 Cb 0.49 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 2x7j h ASP 532 CO 0.03 0.40 -0.30 -0.33 -1.72 0.00 0.00 179.24 177.33 2x7j h GLU 533 N 0.43 0.00 -0.03 3.56 5.08 -1.87 -2.46 114.58 119.29 2x7j h GLU 533 Ca 0.12 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 2x7j h GLU 533 Cb 0.07 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 2x7j h GLU 533 CO -0.02 0.30 -0.06 0.35 -1.00 0.00 0.00 179.01 178.59 2x7j h PHE 534 N 0.00 0.12 -0.10 4.33 3.57 -0.61 -1.53 116.94 122.71 2x7j h PHE 534 Ca -0.00 -0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.49 2x7j h PHE 534 Cb 0.61 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.32 2x7j h PHE 534 CO 0.00 0.62 0.12 0.87 -2.23 0.00 0.00 178.31 177.69 2x7j h LYS 535 N -0.41 0.00 0.06 1.11 1.57 -0.11 0.07 116.57 118.86 2x7j h LYS 535 Ca 0.00 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.48 2x7j h LYS 535 Cb 0.61 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.89 2x7j h LYS 535 CO 0.01 0.00 -1.61 1.15 -0.57 0.00 0.00 179.45 178.43 2x7j h THR 536 N 0.00 1.02 0.00 -0.16 2.02 -1.32 -3.35 112.91 111.11 2x7j h THR 536 Ca 0.05 -2.76 -0.17 0.00 0.77 0.00 0.00 66.41 64.29 2x7j h THR 536 Cb 0.28 2.60 -0.03 0.00 -1.74 0.00 0.00 68.15 69.26 2x7j h THR 536 CO -0.00 0.72 -0.93 0.00 0.37 0.00 0.00 175.52 175.68 2x7j h ALA 537 N 0.69 0.55 -1.81 6.16 0.00 -0.44 -3.45 119.26 120.96 2x7j h ALA 537 Ca -0.26 -0.78 -0.57 0.00 0.00 0.00 0.00 54.91 53.30 2x7j h ALA 537 Cb 1.99 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 19.69 2x7j h ALA 537 CO 0.11 1.01 0.85 -0.47 0.00 0.00 0.00 179.25 180.75 2x7j s TYR 538 N -2.82 2.90 -0.47 0.00 5.04 -0.07 -4.91 117.35 117.03 2x7j s TYR 538 Ca 0.01 0.76 0.07 0.00 -2.44 0.00 0.00 57.07 55.47 2x7j s TYR 538 Cb 0.09 -4.20 0.24 0.00 0.35 0.00 0.00 41.96 38.44 2x7j s TYR 538 CO 0.79 -1.14 0.80 0.00 -1.34 0.00 0.00 175.55 174.67 2x7j n ALA 539 N 7.53 -0.47 -1.70 3.97 0.00 -1.26 -4.93 120.51 123.65 2x7j n ALA 539 Ca 0.11 -1.89 -0.43 0.00 0.00 0.00 0.00 53.44 51.22 2x7j n ALA 539 Cb 0.49 -1.21 -0.02 0.00 0.00 0.00 0.00 19.45 18.71 2x7j n ALA 539 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2x7j n PRO 540 N 1.58 2.22 -3.96 0.00 -0.02 -1.26 -5.01 135.00 128.55 2x7j n PRO 540 Ca 0.12 0.79 -0.10 0.00 -2.02 0.00 0.00 63.50 62.29 2x7j n PRO 540 Cb 0.61 -2.45 -0.07 0.00 -0.02 0.00 0.00 33.50 31.57 2x7j n PRO 540 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 2x7j s GLN 541 N -0.92 1.22 -0.21 -0.52 1.03 -1.26 -4.94 119.66 114.06 2x7j s GLN 541 Ca 0.63 -1.17 0.22 0.00 0.04 0.00 0.00 55.36 55.07 2x7j s GLN 541 Cb -0.59 0.40 0.47 0.00 0.03 0.00 0.00 33.01 33.32 2x7j s GLN 541 CO 0.54 -0.46 1.16 0.00 -2.54 0.00 0.00 175.29 173.99 2x7j n ALA 542 N -0.25 2.60 -0.10 2.60 0.00 -1.26 -4.62 120.51 119.49 2x7j n ALA 542 Ca -0.07 -2.44 -0.15 0.00 0.00 0.00 0.00 53.44 50.78 2x7j n ALA 542 Cb 0.63 -0.83 -0.14 0.00 0.00 0.00 0.00 19.45 19.11 2x7j n ALA 542 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2x7j n ASP 543 N -0.47 1.30 -4.51 0.00 8.00 -1.26 -4.84 116.55 114.78 2x7j n ASP 543 Ca 0.03 -0.02 -0.24 0.00 0.71 0.00 0.00 54.79 55.27 2x7j n ASP 543 Cb 0.87 0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 41.87 2x7j n ASP 543 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2x7j s LYS 544 N -2.52 1.73 1.10 -1.24 1.02 -1.26 -5.13 119.74 113.44 2x7j s LYS 544 Ca -0.24 -1.91 -0.17 0.00 0.02 0.00 0.00 55.97 53.67 2x7j s LYS 544 Cb 0.08 -1.41 0.11 0.00 -0.52 0.00 0.00 37.83 36.09 2x7j s LYS 544 CO 0.71 0.04 0.14 -2.30 -0.92 0.00 0.00 175.35 173.01 2x7j n PRO 545 N -0.74 -1.48 0.00 -1.68 -0.02 -1.26 -4.35 135.00 125.47 2x7j n PRO 545 Ca -0.05 -0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.02 2x7j n PRO 545 Cb 0.64 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.37 2x7j n PRO 545 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2x7j n GLY 546 N 1.87 2.05 3.47 -1.23 0.00 -1.26 -4.85 105.19 105.24 2x7j n GLY 546 Ca 0.02 0.07 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 2x7j n GLY 546 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2x7j s LEU 547 N 0.00 3.90 -0.20 0.99 0.20 -1.26 -1.36 118.68 120.94 2x7j s LEU 547 Ca 0.00 -0.34 -0.00 0.00 0.69 0.00 0.00 54.13 54.48 2x7j s LEU 547 Cb 0.00 -2.00 0.01 0.00 -0.43 0.00 0.00 46.19 43.77 2x7j s LEU 547 CO 0.00 -0.12 -0.14 -2.28 -0.29 0.00 0.00 176.35 173.52 2x7j s HIS 548 N 1.64 2.87 -0.37 5.38 2.46 -0.19 -0.98 115.29 126.11 2x7j s HIS 548 Ca 0.06 -1.48 -0.13 0.00 0.47 0.00 0.00 55.06 53.97 2x7j s HIS 548 Cb -0.16 -1.98 0.01 0.00 -0.13 0.00 0.00 32.58 30.31 2x7j s HIS 548 CO 0.06 -0.74 0.25 -1.17 -2.47 0.00 0.00 174.74 170.68 2x7j s LEU 549 N 1.34 4.75 -0.36 8.88 2.96 0.79 0.73 118.68 137.76 2x7j s LEU 549 Ca 0.04 -0.72 -0.04 0.00 -0.22 0.00 0.00 54.13 53.19 2x7j s LEU 549 Cb -0.14 -2.12 0.07 0.00 0.50 0.00 0.00 46.19 44.51 2x7j s LEU 549 CO -0.09 -0.34 0.12 -0.63 -1.32 0.00 0.00 176.35 174.09 2x7j s ILE 550 N 1.67 3.42 -0.15 6.68 1.01 0.11 -0.85 121.20 133.08 2x7j s ILE 550 Ca 0.05 -1.55 -0.16 0.00 0.00 0.00 0.00 60.65 58.99 2x7j s ILE 550 Cb -0.18 -3.10 -0.04 0.00 0.01 0.00 0.00 42.46 39.15 2x7j s ILE 550 CO 0.09 -0.36 0.40 -0.70 0.00 0.00 0.00 174.94 174.36 2x7j s GLU 551 N 1.27 4.29 -0.21 2.79 2.12 -0.23 -0.96 118.70 127.76 2x7j s GLU 551 Ca 0.01 0.28 -0.02 0.00 0.36 0.00 0.00 54.97 55.59 2x7j s GLU 551 Cb -0.21 -3.45 -0.00 0.00 0.26 0.00 0.00 34.13 30.73 2x7j s GLU 551 CO -0.01 0.16 -0.09 0.42 -0.54 0.00 0.00 175.26 175.20 2x7j s ILE 552 N 0.68 3.01 -0.26 -3.70 -1.09 -0.16 -3.98 121.20 115.69 2x7j s ILE 552 Ca 0.21 -0.62 -0.18 0.00 -2.23 0.00 0.00 60.65 57.84 2x7j s ILE 552 Cb -0.14 -2.34 -0.03 0.00 -1.58 0.00 0.00 42.46 38.36 2x7j s ILE 552 CO 0.07 0.46 0.50 -0.54 -1.23 0.00 0.00 174.94 174.20 2x7j s LYS 553 N 1.41 4.07 0.33 2.79 1.02 -1.26 -0.80 119.74 127.30 2x7j s LYS 553 Ca 0.05 0.29 0.05 0.00 0.02 0.00 0.00 55.97 56.39 2x7j s LYS 553 Cb -0.14 -3.65 -0.06 0.00 -0.52 0.00 0.00 37.83 33.46 2x7j s LYS 553 CO -0.06 -0.33 0.01 0.95 -0.92 0.00 0.00 175.35 175.00 2x7j s THR 554 N 2.24 1.52 -0.34 2.17 -4.23 -0.71 -4.31 115.64 111.99 2x7j s THR 554 Ca 0.20 -2.05 -0.00 0.00 -1.18 0.00 0.00 61.69 58.67 2x7j s THR 554 Cb -0.16 -2.72 0.08 0.00 1.34 0.00 0.00 72.50 71.05 2x7j s THR 554 CO 0.09 -0.11 0.06 -0.62 -0.54 0.00 0.00 174.62 173.51 2x7j s ASP 555 N -3.52 4.93 0.37 3.99 3.68 -0.90 -4.31 116.67 120.90 2x7j s ASP 555 Ca 0.34 -1.69 0.25 0.00 2.13 0.00 0.00 52.55 53.58 2x7j s ASP 555 Cb 0.07 -1.71 0.65 0.00 -1.45 0.00 0.00 42.92 40.48 2x7j s ASP 555 CO 0.15 -0.36 1.71 0.08 0.13 0.00 0.00 175.17 176.88 2x7j h ARG 556 N 7.91 0.00 -0.30 4.34 0.11 -1.91 -2.48 114.38 122.06 2x7j h ARG 556 Ca -0.15 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 59.81 2x7j h ARG 556 Cb 1.05 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.11 2x7j h ARG 556 CO 0.57 0.00 -0.31 1.96 0.10 0.00 0.00 179.97 182.30 2x7j h GLN 557 N 0.00 0.64 -0.01 0.08 1.08 -1.93 -3.24 115.11 111.74 2x7j h GLN 557 Ca 0.00 -0.28 0.00 0.00 -1.45 0.00 0.00 58.65 56.92 2x7j h GLN 557 Cb 0.82 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.23 2x7j h GLN 557 CO 0.00 0.87 -0.51 -1.13 -0.95 0.00 0.00 178.83 177.11 2x7j n SER 558 N -4.08 1.40 -0.09 1.46 3.41 -1.19 -4.65 113.62 109.88 2x7j n SER 558 Ca -0.01 -1.20 -0.08 0.00 -0.26 0.00 0.00 58.87 57.32 2x7j n SER 558 Cb 0.46 0.65 -0.00 0.00 -0.26 0.00 0.00 64.21 65.06 2x7j n SER 558 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2x7j h ARG 559 N 1.28 0.36 -0.58 4.33 2.43 -1.47 -2.96 114.38 117.78 2x7j h ARG 559 Ca 0.00 -0.02 0.09 0.00 -0.81 0.00 0.00 59.98 59.24 2x7j h ARG 559 Cb 0.53 -0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 29.92 2x7j h ARG 559 CO 0.00 0.24 0.18 0.28 -1.51 0.00 0.00 179.97 179.16 2x7j h VAL 560 N 0.37 0.75 -0.24 0.20 2.07 -1.83 0.15 116.25 117.71 2x7j h VAL 560 Ca 0.13 -0.12 -0.10 0.00 0.82 0.00 0.00 66.70 67.43 2x7j h VAL 560 Cb 0.02 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.15 2x7j h VAL 560 CO -0.07 0.06 -0.24 -0.61 0.02 0.00 0.00 177.57 176.73 2x7j h GLN 561 N 0.35 0.60 -0.29 1.57 5.75 -1.88 0.61 115.11 121.82 2x7j h GLN 561 Ca 0.29 -0.32 0.02 0.00 -0.15 0.00 0.00 58.65 58.49 2x7j h GLN 561 Cb 0.37 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.91 2x7j h GLN 561 CO -0.32 0.91 0.15 -0.07 -2.65 0.00 0.00 178.83 176.85 2x7j h LEU 562 N 0.31 0.23 0.39 -2.39 3.38 -1.30 -0.59 115.31 115.33 2x7j h LEU 562 Ca 0.04 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 2x7j h LEU 562 Cb 0.80 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 2x7j h LEU 562 CO 0.06 0.17 -0.46 -0.74 0.09 0.00 0.00 178.44 177.56 2x7j h HIS 563 N 0.31 -1.28 -0.71 1.13 2.76 -0.50 -1.36 115.15 115.51 2x7j h HIS 563 Ca 0.12 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.29 2x7j h HIS 563 Cb 0.03 0.51 -0.03 0.00 1.55 0.00 0.00 27.41 29.46 2x7j h HIS 563 CO -0.09 -0.61 0.40 0.00 -1.30 0.00 0.00 177.93 176.33 2x7j h ARG 564 N -0.88 0.98 0.25 5.26 3.08 -0.78 -2.17 114.38 120.12 2x7j h ARG 564 Ca -0.04 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 59.90 2x7j h ARG 564 Cb 0.80 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.65 2x7j h ARG 564 CO -0.10 0.71 -0.12 -0.44 -1.07 0.00 0.00 179.97 178.94 2x7j h ASP 565 N 0.99 -0.29 -0.55 7.04 3.32 -0.99 -0.47 116.42 125.46 2x7j h ASP 565 Ca 0.25 -0.11 0.10 0.00 0.02 0.00 0.00 57.03 57.29 2x7j h ASP 565 Cb 0.01 0.07 -0.08 0.00 0.22 0.00 0.00 39.33 39.55 2x7j h ASP 565 CO -0.04 -0.06 0.11 -0.03 -1.72 0.00 0.00 179.24 177.50 2x7j h MET 566 N -0.52 0.23 0.04 3.56 4.05 -1.06 0.02 114.93 121.26 2x7j h MET 566 Ca -0.03 -0.01 -0.25 0.00 -0.28 0.00 0.00 59.70 59.12 2x7j h MET 566 Cb 0.38 -0.05 0.01 0.00 -0.80 0.00 0.00 31.60 31.14 2x7j h MET 566 CO 0.06 0.15 -1.05 -0.07 0.23 0.00 0.00 176.91 176.23 2x7j h LEU 567 N 0.24 0.58 -0.83 3.39 3.38 -1.35 -2.97 115.31 117.75 2x7j h LEU 567 Ca 0.28 -0.50 -0.10 0.00 0.09 0.00 0.00 57.88 57.65 2x7j h LEU 567 Cb 0.41 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2x7j h LEU 567 CO -0.37 1.32 -0.16 0.78 0.09 0.00 0.00 178.44 180.09 2x7j h ASN 568 N 0.22 0.69 -0.02 -0.43 2.35 -0.88 -0.82 115.58 116.69 2x7j h ASN 568 Ca -0.11 -0.22 0.03 0.00 -0.55 0.00 0.00 56.30 55.45 2x7j h ASN 568 Cb 1.71 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 39.85 2x7j h ASN 568 CO 0.18 0.87 -0.20 -0.08 -1.65 0.00 0.00 177.43 176.56 2x7j h GLU 569 N 0.62 -0.29 -0.59 0.81 4.81 -1.00 0.33 114.58 119.27 2x7j h GLU 569 Ca 0.10 0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.37 2x7j h GLU 569 Cb 0.63 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.04 2x7j h GLU 569 CO 0.04 -0.19 0.37 0.00 -0.73 0.00 0.00 179.01 178.50 2x7j h ALA 570 N 0.61 0.76 -0.44 2.92 0.00 -1.33 -1.68 119.26 120.10 2x7j h ALA 570 Ca 0.06 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.00 2x7j h ALA 570 Cb 0.39 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2x7j h ALA 570 CO -0.20 0.13 0.19 0.28 0.00 0.00 0.00 179.25 179.65 2x7j h VAL 571 N 0.75 0.91 -0.75 0.00 2.07 -0.78 -2.03 116.25 116.43 2x7j h VAL 571 Ca 0.23 -0.13 -0.06 0.00 0.82 0.00 0.00 66.70 67.56 2x7j h VAL 571 Cb -0.02 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 2x7j h VAL 571 CO -0.08 0.07 0.24 0.03 0.02 0.00 0.00 177.57 177.85 2x7j h ARG 572 N 0.38 1.17 -0.89 1.57 3.08 -0.44 -1.30 114.38 117.95 2x7j h ARG 572 Ca 0.20 -0.25 0.10 0.00 0.07 0.00 0.00 59.98 60.10 2x7j h ARG 572 Cb 0.15 -0.17 -0.08 0.00 0.08 0.00 0.00 29.97 29.96 2x7j h ARG 572 CO -0.17 0.99 0.53 1.49 -1.07 0.00 0.00 179.97 181.74 2x7j h GLU 573 N 1.12 0.85 -0.17 0.04 4.57 -1.01 -2.25 114.58 117.73 2x7j h GLU 573 Ca 0.24 -0.05 0.05 0.00 -1.18 0.00 0.00 59.36 58.42 2x7j h GLU 573 Cb 0.31 -0.19 -0.05 0.00 -0.16 0.00 0.00 28.75 28.65 2x7j h GLU 573 CO -0.01 0.56 -0.17 0.28 -1.18 0.00 0.00 179.01 178.50 2x7j h VAL 574 N 0.87 0.55 -0.80 0.32 2.07 -0.51 -0.46 116.25 118.30 2x7j h VAL 574 Ca 0.43 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.92 2x7j h VAL 574 Cb 0.40 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.68 2x7j h VAL 574 CO -0.25 0.00 0.37 0.11 0.02 0.00 0.00 177.57 177.82 2x7j h LYS 575 N -0.19 1.15 0.36 1.57 1.57 -1.15 -0.44 116.57 119.44 2x7j h LYS 575 Ca 0.11 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2x7j h LYS 575 Cb 0.35 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 2x7j h LYS 575 CO -0.28 0.90 -0.30 -0.22 -0.57 0.00 0.00 179.45 178.97 2x7j h LYS 576 N 1.13 -0.62 -0.95 3.15 3.64 -1.06 -2.75 116.57 119.11 2x7j h LYS 576 Ca 0.27 0.04 0.29 0.00 -1.27 0.00 0.00 60.65 59.98 2x7j h LYS 576 Cb 0.13 0.14 -0.15 0.00 -0.41 0.00 0.00 32.23 31.94 2x7j h LYS 576 CO -0.03 -0.41 0.40 1.96 -2.27 0.00 0.00 179.45 179.10 2x7j h GLN 577 N -0.64 0.24 -0.16 1.90 1.08 -0.88 0.34 115.11 117.00 2x7j h GLN 577 Ca -0.05 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.12 2x7j h GLN 577 Cb 0.54 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.91 2x7j h GLN 577 CO -0.01 0.16 -0.00 2.35 -0.95 0.00 0.00 178.83 180.38 2x7j h TRP 578 N 0.25 0.22 0.00 2.96 2.91 -0.84 -2.47 115.95 118.99 2x7j h TRP 578 Ca 0.66 -0.01 -0.11 0.00 1.13 0.00 0.00 58.89 60.56 2x7j h TRP 578 Cb 1.44 -0.07 -0.02 0.00 -0.51 0.00 0.00 29.16 30.00 2x7j h TRP 578 CO -0.14 0.24 -0.53 0.93 -1.03 0.00 0.00 178.44 177.91 2x7j h GLU 579 N 0.22 0.00 0.00 2.65 4.39 -0.64 -3.51 114.58 117.69 2x7j h GLU 579 Ca 0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.75 2x7j h GLU 579 Cb 0.16 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 2x7j h GLU 579 CO 0.00 0.53 0.00 1.28 -1.16 0.00 0.00 179.01 179.66