#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b62 h HIS -1 N 0.00 -0.19 -3.67 -1.40 -0.00 -2.12 -3.41 115.15 104.36 1b62 h HIS -1 Ca 0.00 -0.00 -0.50 0.00 -0.00 0.00 0.00 60.37 59.86 1b62 h HIS -1 Cb 0.00 0.06 -0.02 0.00 -0.00 0.00 0.00 27.41 27.45 1b62 h HIS -1 CO 0.00 -0.05 0.26 -1.64 -0.00 0.00 0.00 177.93 176.50 1b62 s MET 1 N -5.83 4.64 0.74 5.26 1.00 -1.26 -5.04 119.30 118.82 1b62 s MET 1 Ca -0.14 1.28 -0.11 0.00 0.00 0.00 0.00 55.69 56.72 1b62 s MET 1 Cb 0.05 -3.14 0.04 0.00 0.00 0.00 0.00 34.83 31.77 1b62 s MET 1 CO 0.64 0.48 1.08 -1.25 0.00 0.00 0.00 175.02 175.97 1b62 s PRO 2 N -1.41 2.54 -0.05 2.03 0.04 -1.26 -4.96 135.00 131.93 1b62 s PRO 2 Ca 0.41 1.04 -0.30 0.00 0.04 0.00 0.00 61.00 62.19 1b62 s PRO 2 Cb -0.23 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 1b62 s PRO 2 CO 0.27 -1.41 1.16 0.42 0.04 0.00 0.00 177.00 177.49 1b62 s ILE 3 N -2.98 4.34 -0.01 0.56 1.01 -1.26 -5.00 121.20 117.86 1b62 s ILE 3 Ca 0.60 1.66 -0.02 0.00 0.00 0.00 0.00 60.65 62.88 1b62 s ILE 3 Cb -0.16 -4.06 -0.00 0.00 0.01 0.00 0.00 42.46 38.25 1b62 s ILE 3 CO 0.56 0.02 0.05 -1.58 0.00 0.00 0.00 174.94 173.99 1b62 s GLN 4 N 2.02 0.18 0.26 2.79 0.74 -1.26 -5.13 119.66 119.25 1b62 s GLN 4 Ca 0.55 -0.13 -0.30 0.00 0.05 0.00 0.00 55.36 55.53 1b62 s GLN 4 Cb -0.24 0.07 -0.11 0.00 1.10 0.00 0.00 33.01 33.84 1b62 s GLN 4 CO 0.22 -0.03 1.53 0.08 -0.55 0.00 0.00 175.29 176.54 1b62 s VAL 5 N -0.48 2.38 0.04 1.34 1.01 -1.26 -4.97 120.40 118.46 1b62 s VAL 5 Ca -0.05 0.32 -0.30 0.00 0.00 0.00 0.00 61.98 61.94 1b62 s VAL 5 Cb -0.03 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 1b62 s VAL 5 CO 0.00 0.05 1.04 -0.76 0.00 0.00 0.00 175.10 175.43 1b62 s LEU 6 N -0.20 4.39 0.92 3.92 1.43 -1.26 -5.01 118.68 122.87 1b62 s LEU 6 Ca 0.63 1.79 -0.11 0.00 -1.03 0.00 0.00 54.13 55.41 1b62 s LEU 6 Cb -0.45 -3.58 0.10 0.00 0.03 0.00 0.00 46.19 42.30 1b62 s LEU 6 CO 0.43 -0.29 0.88 -2.65 0.23 0.00 0.00 176.35 174.95 1b62 n PRO 7 N 3.71 -0.36 -0.09 1.29 -0.02 -1.26 -4.53 135.00 133.74 1b62 n PRO 7 Ca 0.06 -0.05 -0.09 0.00 -2.02 0.00 0.00 63.50 61.40 1b62 n PRO 7 Cb 0.49 -2.19 -0.03 0.00 -0.02 0.00 0.00 33.50 31.75 1b62 n PRO 7 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1b62 h PRO 8 N -1.71 -0.32 0.22 0.52 0.11 -1.85 0.92 132.00 129.90 1b62 h PRO 8 Ca -0.43 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.69 1b62 h PRO 8 Cb 1.28 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.46 1b62 h PRO 8 CO 0.39 -0.21 -0.10 0.37 -0.21 0.00 0.00 178.00 178.23 1b62 h GLN 9 N -0.33 -0.28 -0.45 1.05 4.15 -1.40 -0.94 115.11 116.92 1b62 h GLN 9 Ca 0.14 0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.62 1b62 h GLN 9 Cb 0.57 0.06 -0.04 0.00 0.21 0.00 0.00 27.48 28.28 1b62 h GLN 9 CO -0.51 -0.18 0.21 1.25 -1.93 0.00 0.00 178.83 177.67 1b62 h LEU 10 N -0.30 0.29 -0.81 -2.39 5.85 -1.75 -0.25 115.31 115.95 1b62 h LEU 10 Ca -0.03 0.03 0.06 0.00 0.84 0.00 0.00 57.88 58.78 1b62 h LEU 10 Cb 0.23 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.18 1b62 h LEU 10 CO 0.05 0.21 0.49 0.00 -0.34 0.00 0.00 178.44 178.85 1b62 h ALA 11 N 1.25 1.11 -0.24 1.25 0.00 -0.61 -1.04 119.26 120.99 1b62 h ALA 11 Ca 0.20 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 1b62 h ALA 11 Cb 0.13 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1b62 h ALA 11 CO -0.15 0.22 -0.36 -0.91 0.00 0.00 0.00 179.25 178.04 1b62 h ASN 12 N 0.90 0.54 -0.43 0.00 2.35 -0.41 -2.09 115.58 116.44 1b62 h ASN 12 Ca 0.36 -0.23 -0.11 0.00 -0.55 0.00 0.00 56.30 55.78 1b62 h ASN 12 Cb 0.18 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 1b62 h ASN 12 CO -0.18 0.86 -0.12 1.56 -1.65 0.00 0.00 177.43 177.90 1b62 h GLN 13 N 0.44 0.90 -0.60 0.81 4.20 -0.32 0.36 115.11 120.90 1b62 h GLN 13 Ca 0.05 -0.32 -0.04 0.00 0.06 0.00 0.00 58.65 58.39 1b62 h GLN 13 Cb 0.83 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.53 1b62 h GLN 13 CO 0.07 0.97 0.20 0.82 -0.67 0.00 0.00 178.83 180.23 1b62 h ILE 14 N 0.81 1.24 -0.50 2.54 2.04 -1.09 -2.34 117.51 120.21 1b62 h ILE 14 Ca 0.13 -0.79 -0.02 0.00 1.00 0.00 0.00 64.86 65.18 1b62 h ILE 14 Cb 0.65 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 1b62 h ILE 14 CO 0.05 0.30 0.25 0.00 0.00 0.00 0.00 178.15 178.75 1b62 h ALA 15 N 1.07 0.64 -0.25 1.87 0.00 -0.80 -2.11 119.26 119.69 1b62 h ALA 15 Ca 0.20 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.06 1b62 h ALA 15 Cb 0.26 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1b62 h ALA 15 CO -0.01 0.20 0.32 0.00 0.00 0.00 0.00 179.25 179.76 1b62 h ALA 16 N 1.09 1.84 0.00 0.00 0.00 0.18 0.11 119.26 122.47 1b62 h ALA 16 Ca 0.17 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1b62 h ALA 16 Cb 0.10 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1b62 h ALA 16 CO -0.02 -0.45 -0.05 0.78 0.00 0.00 0.00 179.25 179.50 1b62 h GLY 17 N 0.00 0.00 0.08 0.00 0.00 -0.87 0.27 103.07 102.55 1b62 h GLY 17 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 47.33 47.06 1b62 h GLY 17 CO -0.00 0.00 -2.42 1.18 0.00 0.00 0.00 176.54 175.30 1b62 n GLU 18 N -4.30 0.66 0.08 4.80 1.02 -0.01 -4.54 120.64 118.34 1b62 n GLU 18 Ca -0.03 0.17 -0.15 0.00 -0.02 0.00 0.00 57.16 57.13 1b62 n GLU 18 Cb 0.14 -1.54 -0.07 0.00 -0.02 0.00 0.00 31.44 29.94 1b62 n GLU 18 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 1b62 h VAL 19 N -0.03 1.41 -3.49 2.62 3.04 -1.42 -3.39 116.25 114.99 1b62 h VAL 19 Ca -0.56 -2.57 -0.75 0.00 -1.01 0.00 0.00 66.70 61.81 1b62 h VAL 19 Cb 1.90 2.55 -0.32 0.00 -2.01 0.00 0.00 31.29 33.42 1b62 h VAL 19 CO -0.08 0.77 0.10 -0.69 -1.01 0.00 0.00 177.57 176.66 1b62 s VAL 20 N -3.12 5.03 0.07 1.51 1.01 0.94 -4.78 120.40 121.07 1b62 s VAL 20 Ca -0.06 -3.48 -0.17 0.00 0.00 0.00 0.00 61.98 58.28 1b62 s VAL 20 Cb 0.08 -4.09 -0.12 0.00 0.00 0.00 0.00 36.38 32.26 1b62 s VAL 20 CO 0.88 -1.10 1.37 -0.08 0.00 0.00 0.00 175.10 176.17 1b62 h GLU 21 N 6.53 0.58 -2.69 2.72 4.81 -1.78 -3.43 114.58 121.32 1b62 h GLU 21 Ca 0.14 -0.33 0.10 0.00 -0.13 0.00 0.00 59.36 59.14 1b62 h GLU 21 Cb 0.87 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.26 1b62 h GLU 21 CO 0.89 0.94 0.49 -0.98 -0.73 0.00 0.00 179.01 179.61 1b62 s ARG 22 N -4.22 1.62 0.34 1.92 1.70 -1.26 -5.00 118.95 114.06 1b62 s ARG 22 Ca -0.13 -1.05 0.12 0.00 -0.47 0.00 0.00 55.73 54.21 1b62 s ARG 22 Cb 0.07 0.45 0.95 0.00 -0.57 0.00 0.00 34.95 35.85 1b62 s ARG 22 CO 0.81 -0.76 1.75 -1.35 -1.08 0.00 0.00 175.30 174.67 1b62 h PRO 23 N 2.00 0.52 -0.44 3.89 0.11 -1.90 0.26 132.00 136.44 1b62 h PRO 23 Ca -0.29 -0.03 0.06 0.00 0.11 0.00 0.00 66.00 65.85 1b62 h PRO 23 Cb 1.23 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1b62 h PRO 23 CO 0.38 0.34 0.30 0.00 -0.21 0.00 0.00 178.00 178.81 1b62 h ALA 24 N 1.68 1.97 -0.53 -0.75 0.00 -1.88 -1.78 119.26 117.97 1b62 h ALA 24 Ca 0.62 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.47 1b62 h ALA 24 Cb 1.29 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1b62 h ALA 24 CO -0.40 -0.05 0.16 0.77 0.00 0.00 0.00 179.25 179.73 1b62 h SER 25 N 0.35 0.79 -0.52 0.00 0.02 -0.82 -1.46 113.55 111.91 1b62 h SER 25 Ca 0.19 -0.21 -0.02 0.00 -0.84 0.00 0.00 61.79 60.91 1b62 h SER 25 Cb 0.32 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.63 1b62 h SER 25 CO -0.04 0.79 0.24 0.58 -1.14 0.00 0.00 176.83 177.26 1b62 h VAL 26 N 0.74 1.20 -0.48 2.27 2.07 -1.31 -1.37 116.25 119.37 1b62 h VAL 26 Ca 0.17 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 67.11 1b62 h VAL 26 Cb 0.30 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 1b62 h VAL 26 CO -0.00 0.23 0.29 0.58 0.02 0.00 0.00 177.57 178.68 1b62 h VAL 27 N 0.69 1.15 0.12 2.57 2.07 -1.20 -1.79 116.25 119.86 1b62 h VAL 27 Ca 0.18 -0.34 0.01 0.00 0.82 0.00 0.00 66.70 67.37 1b62 h VAL 27 Cb 0.14 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1b62 h VAL 27 CO -0.02 0.15 -0.16 0.50 0.02 0.00 0.00 177.57 178.06 1b62 h LYS 28 N 0.64 -0.32 -0.25 1.57 3.64 -0.96 -0.02 116.57 120.88 1b62 h LYS 28 Ca 0.17 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.60 1b62 h LYS 28 Cb -0.01 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 1b62 h LYS 28 CO -0.03 -0.21 0.10 0.93 -2.27 0.00 0.00 179.45 177.96 1b62 h GLU 29 N -0.33 0.21 -0.35 1.90 4.39 -1.11 -1.07 114.58 118.22 1b62 h GLU 29 Ca 0.01 -0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 1b62 h GLU 29 Cb 0.33 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.92 1b62 h GLU 29 CO -0.07 0.14 0.04 -0.07 -1.16 0.00 0.00 179.01 177.90 1b62 h LEU 30 N 0.22 0.57 -0.88 1.33 3.38 -1.21 -1.84 115.31 116.89 1b62 h LEU 30 Ca 0.11 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.74 1b62 h LEU 30 Cb 0.06 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1b62 h LEU 30 CO -0.10 0.70 0.14 0.58 0.09 0.00 0.00 178.44 179.85 1b62 h VAL 31 N 0.42 1.25 -0.18 1.22 2.07 -0.93 -1.77 116.25 118.33 1b62 h VAL 31 Ca 0.11 -0.91 -0.08 0.00 0.82 0.00 0.00 66.70 66.64 1b62 h VAL 31 Cb 0.38 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1b62 h VAL 31 CO 0.01 0.34 -0.22 -0.33 0.02 0.00 0.00 177.57 177.39 1b62 h GLU 32 N 0.92 0.32 -0.52 1.57 5.08 -1.07 -1.63 114.58 119.25 1b62 h GLU 32 Ca 0.19 -0.10 -0.10 0.00 -1.00 0.00 0.00 59.36 58.35 1b62 h GLU 32 Cb 0.35 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1b62 h GLU 32 CO 0.00 0.53 -0.07 -0.91 -1.00 0.00 0.00 179.01 177.57 1b62 h ASN 33 N 0.29 0.93 -0.64 1.42 2.35 -0.67 -1.31 115.58 117.96 1b62 h ASN 33 Ca 0.05 -0.28 -0.05 0.00 -0.55 0.00 0.00 56.30 55.47 1b62 h ASN 33 Cb 0.56 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.64 1b62 h ASN 33 CO 0.04 1.03 0.22 0.28 -1.65 0.00 0.00 177.43 177.35 1b62 h SER 34 N 0.85 0.93 -0.30 5.81 0.02 -0.84 -0.60 113.55 119.43 1b62 h SER 34 Ca 0.14 -0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 60.91 1b62 h SER 34 Cb 0.60 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 1b62 h SER 34 CO 0.04 0.86 0.06 -0.07 -1.14 0.00 0.00 176.83 176.58 1b62 h LEU 35 N 0.97 0.46 -1.42 5.07 3.38 -1.02 -1.74 115.31 121.01 1b62 h LEU 35 Ca 0.22 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1b62 h LEU 35 Cb 0.25 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1b62 h LEU 35 CO -0.01 0.58 0.01 0.44 0.09 0.00 0.00 178.44 179.55 1b62 h ASP 36 N 0.32 0.36 0.00 -0.43 3.32 -0.92 -1.08 116.42 117.98 1b62 h ASP 36 Ca 0.09 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1b62 h ASP 36 Cb 0.31 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.76 1b62 h ASP 36 CO 0.00 0.41 0.00 0.00 -1.72 0.00 0.00 179.24 177.93 1b62 n ALA 37 N -2.49 2.40 -1.86 3.45 0.00 -0.26 -4.86 120.51 116.89 1b62 n ALA 37 Ca 0.01 -0.04 -0.07 0.00 0.00 0.00 0.00 53.44 53.34 1b62 n ALA 37 Cb 0.20 -1.10 -0.01 0.00 0.00 0.00 0.00 19.45 18.54 1b62 n ALA 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b62 n GLY 38 N 0.44 0.33 3.77 0.00 0.00 -0.41 -1.67 105.19 107.65 1b62 n GLY 38 Ca 0.04 -0.64 -0.35 0.00 0.00 0.00 0.00 46.02 45.07 1b62 n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b62 s ALA 39 N -2.32 2.66 -0.04 4.61 0.00 -0.69 -4.68 121.76 121.30 1b62 s ALA 39 Ca 0.00 0.86 0.12 0.00 0.00 0.00 0.00 51.96 52.94 1b62 s ALA 39 Cb 0.00 -3.38 -0.18 0.00 0.00 0.00 0.00 23.12 19.57 1b62 s ALA 39 CO 0.00 -0.86 0.26 2.41 0.00 0.00 0.00 175.76 177.58 1b62 n THR 40 N -1.37 0.00 -3.76 0.00 -1.04 -1.26 -4.84 114.28 102.01 1b62 n THR 40 Ca 0.12 -0.26 -0.14 0.00 -2.04 0.00 0.00 64.05 61.73 1b62 n THR 40 Cb 0.51 0.28 -0.14 0.00 -1.82 0.00 0.00 70.33 69.15 1b62 n THR 40 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 1b62 s ARG 41 N -2.76 0.09 -0.08 -2.82 3.52 -1.26 -0.36 118.95 115.29 1b62 s ARG 41 Ca -0.04 0.34 0.01 0.00 -0.13 0.00 0.00 55.73 55.92 1b62 s ARG 41 Cb 0.07 -0.16 0.02 0.00 -1.56 0.00 0.00 34.95 33.32 1b62 s ARG 41 CO 0.48 -0.15 -0.11 0.42 -0.81 0.00 0.00 175.30 175.12 1b62 s ILE 42 N 1.05 1.15 -0.18 4.11 1.01 0.51 -2.89 121.20 125.96 1b62 s ILE 42 Ca -0.08 -0.45 -0.02 0.00 0.00 0.00 0.00 60.65 60.10 1b62 s ILE 42 Cb -0.11 -1.08 -0.01 0.00 0.01 0.00 0.00 42.46 41.28 1b62 s ILE 42 CO -0.05 0.37 -0.08 -1.81 0.00 0.00 0.00 174.94 173.36 1b62 s ASP 43 N 0.97 4.18 -0.20 3.58 1.01 0.07 -1.11 116.67 125.17 1b62 s ASP 43 Ca -0.09 -0.35 -0.01 0.00 0.71 0.00 0.00 52.55 52.82 1b62 s ASP 43 Cb -0.15 -1.68 0.01 0.00 1.01 0.00 0.00 42.92 42.11 1b62 s ASP 43 CO -0.00 0.07 -0.14 -0.63 0.21 0.00 0.00 175.17 174.68 1b62 s ILE 44 N 0.92 2.53 -0.17 0.77 1.01 0.90 -1.11 121.20 126.05 1b62 s ILE 44 Ca -0.02 -0.83 -0.02 0.00 0.00 0.00 0.00 60.65 59.78 1b62 s ILE 44 Cb -0.15 -2.13 -0.01 0.00 0.01 0.00 0.00 42.46 40.18 1b62 s ILE 44 CO 0.00 0.46 -0.08 -1.81 0.00 0.00 0.00 174.94 173.51 1b62 s ASP 45 N 1.34 4.25 0.05 3.58 1.01 0.11 -0.38 116.67 126.63 1b62 s ASP 45 Ca 0.04 -0.33 0.08 0.00 0.71 0.00 0.00 52.55 53.06 1b62 s ASP 45 Cb -0.14 -1.69 -0.03 0.00 1.01 0.00 0.00 42.92 42.07 1b62 s ASP 45 CO -0.09 0.09 -0.22 -0.63 0.21 0.00 0.00 175.17 174.52 1b62 s ILE 46 N 0.84 2.48 -0.07 0.77 -1.09 0.36 -0.72 121.20 123.76 1b62 s ILE 46 Ca -0.02 -1.32 0.00 0.00 -2.23 0.00 0.00 60.65 57.08 1b62 s ILE 46 Cb -0.15 -2.02 0.02 0.00 -1.58 0.00 0.00 42.46 38.74 1b62 s ILE 46 CO 0.01 0.33 -0.06 -1.61 -1.23 0.00 0.00 174.94 172.38 1b62 s GLU 47 N -1.41 1.13 -1.25 2.79 2.02 -0.38 -0.20 118.70 121.39 1b62 s GLU 47 Ca 0.13 -0.15 -0.01 0.00 0.02 0.00 0.00 54.97 54.96 1b62 s GLU 47 Cb -0.10 -1.19 -0.01 0.00 0.10 0.00 0.00 34.13 32.94 1b62 s GLU 47 CO 0.04 -0.17 0.81 0.54 0.02 0.00 0.00 175.26 176.50 1b62 n ARG 48 N 4.54 -5.05 -0.94 1.61 1.74 -1.26 -1.58 116.66 115.72 1b62 n ARG 48 Ca -0.17 0.70 0.00 0.00 -0.77 0.00 0.00 57.85 57.61 1b62 n ARG 48 Cb 0.51 -5.38 0.00 0.00 -1.02 0.00 0.00 32.46 26.56 1b62 n ARG 48 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1b62 n GLY 49 N -1.42 0.25 0.84 -0.13 0.00 -1.26 -2.37 105.19 101.10 1b62 n GLY 49 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1b62 n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b62 n GLY 50 N -0.91 0.77 0.23 -0.02 0.00 -0.61 -4.17 105.19 100.48 1b62 n GLY 50 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1b62 n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b62 h ALA 51 N 0.00 0.98 0.00 4.61 0.00 -1.53 -3.32 119.26 120.01 1b62 h ALA 51 Ca 0.00 -0.12 -0.39 0.00 0.00 0.00 0.00 54.91 54.40 1b62 h ALA 51 Cb 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.71 1b62 h ALA 51 CO 0.00 0.17 -2.33 1.17 0.00 0.00 0.00 179.25 178.26 1b62 n LYS 52 N -3.23 0.52 -3.65 0.00 0.00 -1.09 -3.26 118.16 107.45 1b62 n LYS 52 Ca 0.01 0.20 -0.15 0.00 0.00 0.00 0.00 58.31 58.37 1b62 n LYS 52 Cb 0.43 -1.38 -0.08 0.00 0.00 0.00 0.00 35.03 34.00 1b62 n LYS 52 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 1b62 s LEU 53 N -7.05 -0.09 -0.08 3.14 0.20 -1.11 -2.23 118.68 111.46 1b62 s LEU 53 Ca -0.33 0.77 -0.03 0.00 0.69 0.00 0.00 54.13 55.23 1b62 s LEU 53 Cb 0.12 1.97 0.04 0.00 -0.43 0.00 0.00 46.19 47.89 1b62 s LEU 53 CO 0.45 -0.38 0.10 -0.63 -0.29 0.00 0.00 176.35 175.60 1b62 s ILE 54 N -0.53 -0.16 -0.09 6.68 1.01 -0.28 -1.25 121.20 126.57 1b62 s ILE 54 Ca -0.06 0.29 0.01 0.00 0.00 0.00 0.00 60.65 60.89 1b62 s ILE 54 Cb -0.03 -0.28 0.02 0.00 0.01 0.00 0.00 42.46 42.18 1b62 s ILE 54 CO 0.04 0.08 -0.12 -0.60 0.00 0.00 0.00 174.94 174.35 1b62 s ARG 55 N 2.21 1.82 -0.11 2.79 3.52 0.11 -0.33 118.95 128.95 1b62 s ARG 55 Ca 0.04 -0.41 0.00 0.00 -0.13 0.00 0.00 55.73 55.23 1b62 s ARG 55 Cb -0.13 -1.61 0.02 0.00 -1.56 0.00 0.00 34.95 31.67 1b62 s ARG 55 CO -0.05 -0.09 -0.09 0.42 -0.81 0.00 0.00 175.30 174.68 1b62 s ILE 56 N 1.08 1.08 -0.04 4.11 1.01 -0.63 0.04 121.20 127.84 1b62 s ILE 56 Ca -0.06 -0.34 0.06 0.00 0.00 0.00 0.00 60.65 60.31 1b62 s ILE 56 Cb -0.15 -1.08 -0.02 0.00 0.01 0.00 0.00 42.46 41.23 1b62 s ILE 56 CO -0.02 0.37 -0.23 -0.60 0.00 0.00 0.00 174.94 174.47 1b62 s ARG 57 N 1.54 2.40 0.22 2.79 3.52 -0.27 -0.69 118.95 128.47 1b62 s ARG 57 Ca 0.02 -0.86 0.03 0.00 -0.13 0.00 0.00 55.73 54.79 1b62 s ARG 57 Cb -0.13 -2.18 -0.05 0.00 -1.56 0.00 0.00 34.95 31.03 1b62 s ARG 57 CO -0.07 0.50 0.02 0.16 -0.81 0.00 0.00 175.30 175.10 1b62 s ASP 58 N -0.44 1.56 -0.36 -2.12 1.47 0.64 -0.75 116.67 116.66 1b62 s ASP 58 Ca 0.05 -1.24 0.07 0.00 1.18 0.00 0.00 52.55 52.60 1b62 s ASP 58 Cb -0.12 0.07 0.51 0.00 -0.34 0.00 0.00 42.92 43.04 1b62 s ASP 58 CO 0.01 -0.57 1.54 -0.46 0.68 0.00 0.00 175.17 176.37 1b62 n ASN 59 N -0.39 3.62 -2.77 2.11 6.94 -1.14 -2.59 115.26 121.05 1b62 n ASN 59 Ca -0.04 -3.77 -0.08 0.00 -0.02 0.00 0.00 54.58 50.67 1b62 n ASN 59 Cb 0.64 -0.65 0.06 0.00 -2.36 0.00 0.00 39.78 37.47 1b62 n ASN 59 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1b62 n GLY 60 N -1.04 -2.50 0.00 4.83 0.00 -1.26 -4.59 105.19 100.63 1b62 n GLY 60 Ca 0.41 -1.46 0.11 0.00 0.00 0.00 0.00 46.02 45.08 1b62 n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b62 n GLY 62 N 0.55 -1.49 3.09 0.00 0.00 -1.26 -4.38 105.19 101.69 1b62 n GLY 62 Ca 0.11 -1.43 -0.30 0.00 0.00 0.00 0.00 46.02 44.40 1b62 n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1b62 s ILE 63 N -1.41 1.70 0.38 -0.61 1.01 -1.26 -4.86 121.20 116.15 1b62 s ILE 63 Ca 0.00 -0.75 -0.27 0.00 0.00 0.00 0.00 60.65 59.63 1b62 s ILE 63 Cb 0.00 -1.55 -0.11 0.00 0.01 0.00 0.00 42.46 40.81 1b62 s ILE 63 CO 0.00 0.48 1.31 1.17 0.00 0.00 0.00 174.94 177.90 1b62 n LYS 64 N 4.30 2.13 -0.24 2.79 4.81 -1.26 -4.41 118.16 126.28 1b62 n LYS 64 Ca -0.19 0.75 0.01 0.00 -0.87 0.00 0.00 58.31 58.01 1b62 n LYS 64 Cb 0.51 -2.40 0.08 0.00 0.02 0.00 0.00 35.03 33.25 1b62 n LYS 64 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 1b62 h LYS 65 N 2.44 0.01 0.00 1.64 3.64 -1.95 0.43 116.57 122.77 1b62 h LYS 65 Ca -0.47 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1b62 h LYS 65 Cb 1.28 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 1b62 h LYS 65 CO 0.62 0.00 0.00 -0.40 -2.27 0.00 0.00 179.45 177.40 1b62 n ASP 66 N -5.46 0.00 0.00 4.20 5.75 -1.26 -2.58 116.55 117.20 1b62 n ASP 66 Ca 0.09 -1.10 0.00 0.00 -0.01 0.00 0.00 54.79 53.78 1b62 n ASP 66 Cb 0.37 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.46 1b62 n ASP 66 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1b62 n GLU 67 N -0.71 -0.29 -0.05 0.11 1.02 0.12 -4.76 120.64 116.08 1b62 n GLU 67 Ca 0.07 -0.60 -0.10 0.00 -0.02 0.00 0.00 57.16 56.52 1b62 n GLU 67 Cb 0.03 -0.94 -0.03 0.00 -0.02 0.00 0.00 31.44 30.49 1b62 n GLU 67 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1b62 h LEU 68 N 0.00 0.23 -0.93 -4.62 3.38 -1.27 -0.58 115.31 111.53 1b62 h LEU 68 Ca 0.00 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1b62 h LEU 68 Cb 0.14 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 1b62 h LEU 68 CO 0.00 0.17 0.19 0.00 0.09 0.00 0.00 178.44 178.89 1b62 h ALA 69 N 1.09 1.13 -0.19 1.53 0.00 -1.86 -2.01 119.26 118.96 1b62 h ALA 69 Ca 0.09 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1b62 h ALA 69 Cb -0.01 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1b62 h ALA 69 CO -0.03 0.60 -0.09 -0.07 0.00 0.00 0.00 179.25 179.65 1b62 h LEU 70 N 0.94 0.27 -1.28 0.00 3.38 -1.73 -1.63 115.31 115.26 1b62 h LEU 70 Ca 0.21 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 1b62 h LEU 70 Cb 0.28 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1b62 h LEU 70 CO -0.01 0.40 -0.31 0.00 0.09 0.00 0.00 178.44 178.62 1b62 h ALA 71 N 1.63 1.18 -0.01 1.53 0.00 -0.37 -1.78 119.26 121.43 1b62 h ALA 71 Ca 0.06 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1b62 h ALA 71 Cb 0.34 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1b62 h ALA 71 CO 0.02 0.39 -0.14 1.28 0.00 0.00 0.00 179.25 180.80 1b62 n LEU 72 N -3.72 1.55 -4.89 0.00 4.77 -0.69 -4.40 117.00 109.61 1b62 n LEU 72 Ca -0.01 -0.50 -0.29 0.00 -0.03 0.00 0.00 56.01 55.19 1b62 n LEU 72 Cb 0.41 -0.04 0.01 0.00 -2.33 0.00 0.00 43.42 41.46 1b62 n LEU 72 CO 0.36 0.27 0.57 0.00 -1.33 0.00 0.00 177.39 177.25 1b62 s ALA 73 N -2.23 3.26 0.35 -1.18 0.00 -0.67 -4.03 121.76 117.26 1b62 s ALA 73 Ca 0.30 -0.37 -0.16 0.00 0.00 0.00 0.00 51.96 51.73 1b62 s ALA 73 Cb 0.20 -2.79 -0.09 0.00 0.00 0.00 0.00 23.12 20.44 1b62 s ALA 73 CO 0.42 -0.57 0.79 0.50 0.00 0.00 0.00 175.76 176.90 1b62 s ARG 74 N -4.96 4.04 -1.52 0.00 3.52 -1.26 -4.13 118.95 114.64 1b62 s ARG 74 Ca 0.51 0.77 -0.14 0.00 -0.13 0.00 0.00 55.73 56.74 1b62 s ARG 74 Cb -0.11 -2.37 0.10 0.00 -1.56 0.00 0.00 34.95 31.02 1b62 s ARG 74 CO 0.49 0.10 0.77 0.72 -0.81 0.00 0.00 175.30 176.57 1b62 n HIS 75 N -0.49 -1.97 -3.95 5.12 8.25 -0.98 -4.95 115.22 116.25 1b62 n HIS 75 Ca 0.04 0.73 -0.25 0.00 -0.26 0.00 0.00 57.72 57.99 1b62 n HIS 75 Cb 0.53 -3.36 -0.17 0.00 1.12 0.00 0.00 29.99 28.12 1b62 n HIS 75 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1b62 s ALA 76 N -3.18 1.06 0.11 -1.41 0.00 -1.14 -4.96 121.76 112.24 1b62 s ALA 76 Ca 0.61 -0.36 -0.04 0.00 0.00 0.00 0.00 51.96 52.17 1b62 s ALA 76 Cb -0.32 -0.78 -0.03 0.00 0.00 0.00 0.00 23.12 22.00 1b62 s ALA 76 CO 0.75 -0.34 0.11 -0.08 0.00 0.00 0.00 175.76 176.19 1b62 s THR 77 N 1.61 0.14 -1.08 0.00 -1.32 -1.26 -4.43 115.64 109.30 1b62 s THR 77 Ca 0.02 -1.62 0.09 0.00 -1.21 0.00 0.00 61.69 58.97 1b62 s THR 77 Cb -0.13 -1.70 0.12 0.00 -1.51 0.00 0.00 72.50 69.28 1b62 s THR 77 CO -0.05 -0.62 0.91 -1.54 -2.21 0.00 0.00 174.62 171.10 1b62 n SER 78 N -0.05 2.04 0.03 8.08 3.41 -1.26 -4.67 113.62 121.20 1b62 n SER 78 Ca -0.10 -1.55 0.02 0.00 -0.26 0.00 0.00 58.87 56.98 1b62 n SER 78 Cb 0.62 -0.05 -0.08 0.00 -0.26 0.00 0.00 64.21 64.44 1b62 n SER 78 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1b62 n LYS 79 N 0.49 0.63 -3.83 4.33 5.02 -1.26 -4.94 118.16 118.60 1b62 n LYS 79 Ca 0.07 0.14 -0.12 0.00 -2.02 0.00 0.00 58.31 56.37 1b62 n LYS 79 Cb 0.28 -1.75 -0.10 0.00 -0.02 0.00 0.00 35.03 33.44 1b62 n LYS 79 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1b62 s ILE 80 N -3.03 0.07 0.00 -0.18 -4.36 -1.26 -4.90 121.20 107.53 1b62 s ILE 80 Ca -0.04 -0.55 0.00 0.00 -0.26 0.00 0.00 60.65 59.80 1b62 s ILE 80 Cb 0.09 -0.48 0.00 0.00 1.25 0.00 0.00 42.46 43.32 1b62 s ILE 80 CO 0.82 -0.30 0.17 0.00 0.24 0.00 0.00 174.94 175.87 1b62 n ALA 81 N 1.55 1.27 -3.72 2.27 0.00 -1.26 -4.84 120.51 115.77 1b62 n ALA 81 Ca -0.21 -0.17 -0.09 0.00 0.00 0.00 0.00 53.44 52.96 1b62 n ALA 81 Cb 0.56 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.03 1b62 n ALA 81 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1b62 s SER 82 N -0.21 0.11 0.23 0.00 1.04 -1.26 -5.05 113.70 108.56 1b62 s SER 82 Ca 0.00 -1.21 -0.03 0.00 0.48 0.00 0.00 55.95 55.19 1b62 s SER 82 Cb 0.00 0.84 0.24 0.00 0.10 0.00 0.00 66.02 67.21 1b62 s SER 82 CO 0.00 -1.68 1.68 0.25 0.98 0.00 0.00 173.24 174.47 1b62 h LEU 83 N 2.01 0.77 -0.20 2.42 5.85 -2.00 -3.06 115.31 121.08 1b62 h LEU 83 Ca -0.33 -0.24 0.03 0.00 0.84 0.00 0.00 57.88 58.18 1b62 h LEU 83 Cb 1.25 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 42.04 1b62 h LEU 83 CO 0.41 0.92 0.01 0.44 -0.34 0.00 0.00 178.44 179.89 1b62 h ASP 84 N 0.69 -0.05 -0.98 1.25 5.19 -1.99 -1.78 116.42 118.74 1b62 h ASP 84 Ca 0.11 0.04 0.14 0.00 -0.62 0.00 0.00 57.03 56.70 1b62 h ASP 84 Cb 0.63 0.07 -0.09 0.00 0.18 0.00 0.00 39.33 40.12 1b62 h ASP 84 CO 0.04 0.00 0.60 0.44 -3.12 0.00 0.00 179.24 177.21 1b62 h ASP 85 N 0.08 0.85 -0.05 6.45 3.32 -1.91 -2.43 116.42 122.73 1b62 h ASP 85 Ca 0.09 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1b62 h ASP 85 Cb 0.11 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.56 1b62 h ASP 85 CO -0.15 0.42 -0.01 0.25 -1.72 0.00 0.00 179.24 178.03 1b62 h LEU 86 N 0.91 0.09 -2.76 1.55 7.12 -1.31 -1.19 115.31 119.72 1b62 h LEU 86 Ca 0.51 -0.36 0.00 0.00 0.13 0.00 0.00 57.88 58.16 1b62 h LEU 86 Cb 0.58 -0.03 -0.00 0.00 -0.53 0.00 0.00 40.66 40.69 1b62 h LEU 86 CO -0.30 0.43 0.06 -0.33 -0.13 0.00 0.00 178.44 178.17 1b62 h GLU 87 N -0.24 0.00 -0.62 1.25 5.08 -0.87 -2.59 114.58 116.59 1b62 h GLU 87 Ca 0.01 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.05 1b62 h GLU 87 Cb 0.39 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 29.23 1b62 h GLU 87 CO 0.00 0.00 -1.07 0.00 -1.00 0.00 0.00 179.01 176.94 1b62 n ALA 88 N -2.09 3.20 -1.64 3.43 0.00 -1.05 -4.19 120.51 118.17 1b62 n ALA 88 Ca -0.03 -3.04 -0.40 0.00 0.00 0.00 0.00 53.44 49.98 1b62 n ALA 88 Cb 0.13 -0.79 0.03 0.00 0.00 0.00 0.00 19.45 18.82 1b62 n ALA 88 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 1b62 n ILE 89 N -0.52 3.07 -0.08 0.00 3.06 -0.46 -4.96 119.36 119.47 1b62 n ILE 89 Ca 0.14 -0.50 -0.08 0.00 -2.50 0.00 0.00 62.75 59.81 1b62 n ILE 89 Cb 0.82 -1.28 -0.12 0.00 0.54 0.00 0.00 39.64 39.61 1b62 n ILE 89 CO 0.00 0.00 0.00 -0.38 -2.50 0.00 0.00 176.55 173.67 1b62 n ILE 90 N -0.97 1.03 -2.88 9.51 5.41 -1.26 -5.03 119.36 125.17 1b62 n ILE 90 Ca 0.11 -0.62 -0.20 0.00 1.00 0.00 0.00 62.75 63.04 1b62 n ILE 90 Cb 0.43 -0.65 0.06 0.00 -0.71 0.00 0.00 39.64 38.77 1b62 n ILE 90 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1b62 s SER 91 N -4.92 5.10 0.01 4.38 1.04 -1.26 -5.04 113.70 113.01 1b62 s SER 91 Ca -0.09 -0.52 -0.16 0.00 0.48 0.00 0.00 55.95 55.66 1b62 s SER 91 Cb 0.05 -0.17 -0.35 0.00 0.10 0.00 0.00 66.02 65.65 1b62 s SER 91 CO 0.60 -1.28 0.92 -0.07 0.98 0.00 0.00 173.24 174.39 1b62 h LEU 92 N 0.13 0.78-10.58 2.42 3.38 -1.96 -3.47 115.31 106.01 1b62 h LEU 92 Ca -0.35 -0.93 -0.45 0.00 0.09 0.00 0.00 57.88 56.24 1b62 h LEU 92 Cb 1.28 -0.25 0.06 0.00 0.09 0.00 0.00 40.66 41.84 1b62 h LEU 92 CO 0.43 1.71 0.05 -0.83 0.09 0.00 0.00 178.44 179.89 1b62 s GLY 93 N -4.69 1.79 0.00 0.83 0.00 -1.26 -4.95 107.32 99.03 1b62 s GLY 93 Ca -0.11 -1.41 0.00 0.00 0.00 0.00 0.00 44.72 43.20 1b62 s GLY 93 CO 0.92 -1.01 0.00 1.97 0.00 0.00 0.00 173.10 174.98 1b62 n PHE 94 N -2.60 0.00 0.14 1.90 1.16 -1.26 -4.87 117.46 111.93 1b62 n PHE 94 Ca 0.10 0.00 0.03 0.00 -1.87 0.00 0.00 57.45 55.71 1b62 n PHE 94 Cb 0.60 0.00 0.03 0.00 -1.61 0.00 0.00 39.48 38.50 1b62 n PHE 94 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1b62 h ARG 95 N 0.00 0.00 -1.81 3.97 3.08 -1.95 -3.44 114.38 114.22 1b62 h ARG 95 Ca 0.00 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.71 1b62 h ARG 95 Cb 0.00 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 29.99 1b62 h ARG 95 CO 0.00 0.49 -0.39 0.41 -1.07 0.00 0.00 179.97 179.41 1b62 n GLY 96 N 1.23 0.41 0.04 0.04 0.00 -1.26 -4.31 105.19 101.34 1b62 n GLY 96 Ca 0.02 -0.20 -0.04 0.00 0.00 0.00 0.00 46.02 45.81 1b62 n GLY 96 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1b62 n GLU 97 N -2.58 2.13 -0.04 1.61 -0.58 -1.26 -2.31 120.64 117.61 1b62 n GLU 97 Ca -0.19 -0.02 -0.13 0.00 -0.42 0.00 0.00 57.16 56.40 1b62 n GLU 97 Cb 0.61 -1.26 -0.08 0.00 -0.57 0.00 0.00 31.44 30.15 1b62 n GLU 97 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1b62 h ALA 98 N 0.55 -0.73 -0.65 0.62 0.00 -1.93 -1.10 119.26 116.01 1b62 h ALA 98 Ca -0.24 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1b62 h ALA 98 Cb 1.48 0.95 -0.03 0.00 0.00 0.00 0.00 17.79 20.19 1b62 h ALA 98 CO 0.01 -1.01 0.35 -0.07 0.00 0.00 0.00 179.25 178.53 1b62 h LEU 99 N -0.50 0.82 -0.33 0.00 3.38 -1.89 -1.05 115.31 115.75 1b62 h LEU 99 Ca 0.07 -0.10 0.05 0.00 0.09 0.00 0.00 57.88 57.98 1b62 h LEU 99 Cb 0.65 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.14 1b62 h LEU 99 CO -0.47 0.69 0.07 0.00 0.09 0.00 0.00 178.44 178.82 1b62 h ALA 100 N 1.16 0.35 0.20 1.53 0.00 -1.63 0.59 119.26 121.47 1b62 h ALA 100 Ca 0.23 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1b62 h ALA 100 Cb 0.06 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1b62 h ALA 100 CO -0.03 -0.33 -0.12 0.77 0.00 0.00 0.00 179.25 179.54 1b62 h SER 101 N 0.19 -0.28 -0.62 0.00 0.02 -0.95 -2.71 113.55 109.20 1b62 h SER 101 Ca 0.16 0.02 0.01 0.00 -0.84 0.00 0.00 61.79 61.13 1b62 h SER 101 Cb 0.17 0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.76 1b62 h SER 101 CO -0.20 -0.19 0.41 0.40 -1.14 0.00 0.00 176.83 176.11 1b62 h ILE 102 N -0.30 1.14 -0.01 3.27 2.04 -0.91 -2.19 117.51 120.55 1b62 h ILE 102 Ca -0.02 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.56 1b62 h ILE 102 Cb 0.25 0.25 -0.00 0.00 -0.74 0.00 0.00 36.82 36.57 1b62 h ILE 102 CO 0.02 0.15 0.01 0.77 0.00 0.00 0.00 178.15 179.10 1b62 h SER 103 N 0.82 0.00 1.06 1.72 4.64 -0.77 -1.86 113.55 119.17 1b62 h SER 103 Ca 0.23 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1b62 h SER 103 Cb -0.07 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 1b62 h SER 103 CO -0.06 0.00 0.00 0.77 -0.87 0.00 0.00 176.83 176.67 1b62 h SER 104 N 0.01 0.00 -0.02 4.97 4.64 -1.07 -3.25 113.55 118.83 1b62 h SER 104 Ca 0.01 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 1b62 h SER 104 Cb 0.02 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 61.99 1b62 h SER 104 CO -0.00 0.00 -0.66 1.33 -0.87 0.00 0.00 176.83 176.63 1b62 n VAL 105 N -2.33 1.63 -3.92 0.95 0.24 -0.71 -4.79 118.33 109.39 1b62 n VAL 105 Ca 0.03 -2.68 -0.01 0.00 -2.04 0.00 0.00 64.34 59.65 1b62 n VAL 105 Cb 0.32 0.08 0.02 0.00 -1.47 0.00 0.00 33.84 32.78 1b62 n VAL 105 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1b62 n SER 106 N -0.68 -1.45 -4.25 -1.34 3.41 -1.14 0.08 113.62 108.26 1b62 n SER 106 Ca 0.16 -1.62 -0.43 0.00 -0.26 0.00 0.00 58.87 56.72 1b62 n SER 106 Cb 0.82 2.32 -0.06 0.00 -0.26 0.00 0.00 64.21 67.03 1b62 n SER 106 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1b62 s ARG 107 N -2.03 2.93 -0.20 4.33 1.81 -0.20 -4.79 118.95 120.79 1b62 s ARG 107 Ca 0.24 -2.07 -0.08 0.00 -1.72 0.00 0.00 55.73 52.10 1b62 s ARG 107 Cb -0.02 -4.12 -0.04 0.00 -0.45 0.00 0.00 34.95 30.32 1b62 s ARG 107 CO 0.03 -1.25 0.08 -1.17 -0.68 0.00 0.00 175.30 172.32 1b62 s LEU 108 N 0.85 3.84 -0.13 2.53 0.20 -1.26 -0.96 118.68 123.76 1b62 s LEU 108 Ca 0.10 0.05 0.02 0.00 0.69 0.00 0.00 54.13 54.99 1b62 s LEU 108 Cb -0.21 -1.99 -0.00 0.00 -0.43 0.00 0.00 46.19 43.55 1b62 s LEU 108 CO -0.03 0.13 -0.18 -0.89 -0.29 0.00 0.00 176.35 175.09 1b62 s THR 109 N 0.66 2.53 -0.26 3.68 2.01 0.51 -4.53 115.64 120.25 1b62 s THR 109 Ca 0.04 -0.84 -0.05 0.00 0.31 0.00 0.00 61.69 61.16 1b62 s THR 109 Cb -0.13 -2.03 0.00 0.00 0.01 0.00 0.00 72.50 70.36 1b62 s THR 109 CO 0.01 0.54 0.01 -0.22 -0.69 0.00 0.00 174.62 174.27 1b62 s LEU 110 N 0.49 3.35 -0.08 4.42 2.96 0.10 -1.27 118.68 128.65 1b62 s LEU 110 Ca -0.12 -0.60 0.04 0.00 -0.22 0.00 0.00 54.13 53.23 1b62 s LEU 110 Cb -0.17 -1.79 -0.01 0.00 0.50 0.00 0.00 46.19 44.73 1b62 s LEU 110 CO 0.05 -0.11 -0.22 -0.89 -1.32 0.00 0.00 176.35 173.86 1b62 s THR 111 N 1.46 2.30 0.06 3.68 2.01 -0.66 0.70 115.64 125.20 1b62 s THR 111 Ca 0.03 -0.96 -0.26 0.00 0.31 0.00 0.00 61.69 60.81 1b62 s THR 111 Cb -0.16 -1.87 0.08 0.00 0.01 0.00 0.00 72.50 70.56 1b62 s THR 111 CO -0.01 0.56 0.71 -0.55 -0.69 0.00 0.00 174.62 174.65 1b62 s SER 112 N -0.02 -0.52 -0.13 3.53 0.15 -0.05 -1.17 113.70 115.49 1b62 s SER 112 Ca -0.07 0.14 -0.09 0.00 0.70 0.00 0.00 55.95 56.63 1b62 s SER 112 Cb -0.15 0.52 0.04 0.00 -1.71 0.00 0.00 66.02 64.72 1b62 s SER 112 CO 0.05 -0.78 0.32 -0.60 1.20 0.00 0.00 173.24 173.42 1b62 s ARG 113 N -3.03 0.32 0.43 5.44 3.52 -0.89 -2.01 118.95 122.73 1b62 s ARG 113 Ca 0.00 0.57 0.02 0.00 -0.13 0.00 0.00 55.73 56.20 1b62 s ARG 113 Cb -0.01 0.02 -0.00 0.00 -1.56 0.00 0.00 34.95 33.40 1b62 s ARG 113 CO -0.07 -0.12 0.62 0.95 -0.81 0.00 0.00 175.30 175.87 1b62 s THR 114 N 0.90 3.88 0.45 4.11 -4.23 -1.26 -1.50 115.64 117.98 1b62 s THR 114 Ca -0.06 -0.67 0.11 0.00 -1.18 0.00 0.00 61.69 59.89 1b62 s THR 114 Cb -0.07 -3.41 0.27 0.00 1.34 0.00 0.00 72.50 70.64 1b62 s THR 114 CO -0.06 -0.25 2.08 0.00 -0.54 0.00 0.00 174.62 175.86 1b62 h ALA 115 N 0.52 1.84 0.00 3.99 0.00 -1.96 -1.78 119.26 121.86 1b62 h ALA 115 Ca -0.46 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1b62 h ALA 115 Cb 1.26 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1b62 h ALA 115 CO 0.55 0.14 0.00 0.39 0.00 0.00 0.00 179.25 180.33 1b62 n GLU 116 N -4.49 0.08 -3.76 0.00 4.71 -1.26 -4.80 120.64 111.11 1b62 n GLU 116 Ca 0.02 0.12 -0.37 0.00 -0.01 0.00 0.00 57.16 56.92 1b62 n GLU 116 Cb 0.10 -1.60 -0.07 0.00 -1.01 0.00 0.00 31.44 28.86 1b62 n GLU 116 CO 0.00 0.00 0.00 -0.65 0.09 0.00 0.00 177.13 176.57 1b62 s GLN 117 N -3.05 3.79 0.05 3.49 -0.21 -0.67 -4.96 119.66 118.10 1b62 s GLN 117 Ca 0.12 -0.07 0.05 0.00 0.02 0.00 0.00 55.36 55.48 1b62 s GLN 117 Cb 0.15 -3.28 -0.24 0.00 1.00 0.00 0.00 33.01 30.64 1b62 s GLN 117 CO 0.50 0.58 1.01 1.96 -2.12 0.00 0.00 175.29 177.22 1b62 h GLN 118 N 5.61 0.09 -5.95 2.91 4.20 -1.87 -3.44 115.11 116.66 1b62 h GLN 118 Ca -0.49 -0.15 -0.62 0.00 0.06 0.00 0.00 58.65 57.45 1b62 h GLN 118 Cb 1.20 0.05 -0.05 0.00 0.30 0.00 0.00 27.48 28.99 1b62 h GLN 118 CO 0.65 0.93 -0.39 -1.21 -0.67 0.00 0.00 178.83 178.14 1b62 s GLU 119 N -2.65 3.57 0.19 1.46 0.41 -1.26 -5.05 118.70 115.36 1b62 s GLU 119 Ca -0.03 -0.13 0.05 0.00 -0.41 0.00 0.00 54.97 54.45 1b62 s GLU 119 Cb 0.08 -3.03 -0.04 0.00 -1.78 0.00 0.00 34.13 29.36 1b62 s GLU 119 CO 0.83 0.61 0.22 0.00 -0.49 0.00 0.00 175.26 176.44 1b62 s ALA 120 N -1.39 3.73 0.06 5.21 0.00 -1.24 -4.77 121.76 123.36 1b62 s ALA 120 Ca 0.31 -1.20 0.00 0.00 0.00 0.00 0.00 51.96 51.07 1b62 s ALA 120 Cb -0.13 -1.52 -0.04 0.00 0.00 0.00 0.00 23.12 21.43 1b62 s ALA 120 CO 0.19 0.43 -0.04 -1.58 0.00 0.00 0.00 175.76 174.76 1b62 s TRP 121 N -1.85 0.60 0.01 0.00 0.52 -0.85 -2.05 118.94 115.32 1b62 s TRP 121 Ca 0.33 -0.89 0.06 0.00 0.02 0.00 0.00 56.10 55.62 1b62 s TRP 121 Cb -0.10 -0.39 -0.02 0.00 -1.15 0.00 0.00 33.47 31.81 1b62 s TRP 121 CO 0.26 -0.26 -0.18 -1.14 0.02 0.00 0.00 176.95 175.65 1b62 s GLN 122 N -3.29 1.32 0.04 4.98 0.74 0.01 -0.87 119.66 122.59 1b62 s GLN 122 Ca 0.03 -0.71 -0.03 0.00 0.05 0.00 0.00 55.36 54.69 1b62 s GLN 122 Cb 0.03 -1.32 -0.02 0.00 1.10 0.00 0.00 33.01 32.79 1b62 s GLN 122 CO -0.06 0.35 0.05 0.00 -0.55 0.00 0.00 175.29 175.08 1b62 s ALA 123 N -0.56 0.09 -0.13 1.58 0.00 0.22 -1.12 121.76 121.84 1b62 s ALA 123 Ca 0.06 -0.71 -0.30 0.00 0.00 0.00 0.00 51.96 51.01 1b62 s ALA 123 Cb -0.07 0.24 0.11 0.00 0.00 0.00 0.00 23.12 23.40 1b62 s ALA 123 CO 0.00 -0.30 0.91 1.52 0.00 0.00 0.00 175.76 177.88 1b62 s TYR 124 N -2.70 -0.46 0.19 0.00 -0.85 -0.99 0.01 117.35 112.55 1b62 s TYR 124 Ca -0.04 0.81 0.04 0.00 -0.52 0.00 0.00 57.07 57.35 1b62 s TYR 124 Cb -0.01 0.43 -0.03 0.00 0.38 0.00 0.00 41.96 42.73 1b62 s TYR 124 CO -0.05 -0.41 0.29 0.00 -1.52 0.00 0.00 175.55 173.85 1b62 s ALA 125 N -1.07 3.90 0.10 9.51 0.00 -1.26 -0.90 121.76 132.04 1b62 s ALA 125 Ca -0.04 -1.14 -0.15 0.00 0.00 0.00 0.00 51.96 50.63 1b62 s ALA 125 Cb -0.01 -1.70 0.03 0.00 0.00 0.00 0.00 23.12 21.44 1b62 s ALA 125 CO 0.04 0.42 0.36 -1.21 0.00 0.00 0.00 175.76 175.36 1b62 s GLU 126 N -3.51 0.98 0.20 0.00 2.02 0.23 -4.89 118.70 113.73 1b62 s GLU 126 Ca 0.34 -0.68 0.00 0.00 0.02 0.00 0.00 54.97 54.65 1b62 s GLU 126 Cb -0.10 0.43 0.00 0.00 0.10 0.00 0.00 34.13 34.56 1b62 s GLU 126 CO 0.28 -0.36 0.00 0.41 0.02 0.00 0.00 175.26 175.61 1b62 n GLY 127 N -0.01 -2.63 0.36 -1.39 0.00 -1.26 -0.69 105.19 99.58 1b62 n GLY 127 Ca -0.16 -1.33 0.16 0.00 0.00 0.00 0.00 46.02 44.68 1b62 n GLY 127 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1b62 h ARG 128 N -0.49 0.00 -0.02 1.61 3.08 -2.00 0.41 114.38 116.98 1b62 h ARG 128 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1b62 h ARG 128 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.52 1b62 h ARG 128 CO 0.02 0.00 -0.43 -0.25 -1.07 0.00 0.00 179.97 178.24 1b62 n ASP 129 N -3.09 2.04 -3.52 7.04 9.92 -1.26 -1.18 116.55 126.50 1b62 n ASP 129 Ca 0.03 -1.51 -0.21 0.00 -0.53 0.00 0.00 54.79 52.56 1b62 n ASP 129 Cb 0.62 0.42 0.08 0.00 -0.64 0.00 0.00 41.12 41.61 1b62 n ASP 129 CO 0.00 0.00 0.00 0.23 0.13 0.00 0.00 177.20 177.56 1b62 n MET 130 N 0.04 -7.39 -2.11 -1.24 2.81 0.14 -4.78 117.12 104.59 1b62 n MET 130 Ca 0.10 0.84 -0.41 0.00 -1.81 0.00 0.00 57.70 56.42 1b62 n MET 130 Cb 0.47 -5.87 -0.02 0.00 -0.71 0.00 0.00 33.22 27.09 1b62 n MET 130 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 1b62 s ASN 131 N -3.77 6.77 -0.16 7.83 0.01 0.14 -4.41 114.94 121.34 1b62 s ASN 131 Ca 0.33 2.64 -0.08 0.00 -0.71 0.00 0.00 52.86 55.04 1b62 s ASN 131 Cb -0.15 -2.64 -0.04 0.00 0.41 0.00 0.00 41.25 38.83 1b62 s ASN 131 CO 0.73 -0.56 0.12 -0.69 -1.51 0.00 0.00 177.10 175.19 1b62 s VAL 132 N -0.75 5.33 -0.16 1.60 1.01 -1.26 -0.61 120.40 125.56 1b62 s VAL 132 Ca 0.52 0.15 -0.05 0.00 0.00 0.00 0.00 61.98 62.60 1b62 s VAL 132 Cb -0.40 -3.38 -0.03 0.00 0.00 0.00 0.00 36.38 32.57 1b62 s VAL 132 CO 0.49 0.52 -0.00 -0.89 0.00 0.00 0.00 175.10 175.21 1b62 s THR 133 N -0.21 4.20 -0.13 3.92 2.01 -0.08 -4.95 115.64 120.40 1b62 s THR 133 Ca 0.10 -0.25 0.02 0.00 0.31 0.00 0.00 61.69 61.88 1b62 s THR 133 Cb -0.12 -2.86 0.00 0.00 0.01 0.00 0.00 72.50 69.54 1b62 s THR 133 CO 0.01 0.48 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.53 1b62 s VAL 134 N 0.34 2.30 0.11 3.82 1.01 -1.26 -2.34 120.40 124.39 1b62 s VAL 134 Ca -0.02 -0.91 -0.05 0.00 0.00 0.00 0.00 61.98 61.00 1b62 s VAL 134 Cb -0.14 -1.92 -0.02 0.00 0.00 0.00 0.00 36.38 34.30 1b62 s VAL 134 CO 0.02 0.54 0.14 -1.59 0.00 0.00 0.00 175.10 174.22 1b62 s LYS 135 N 0.64 0.92 0.75 2.72 -2.85 -0.27 -4.98 119.74 116.66 1b62 s LYS 135 Ca -0.10 -1.19 -0.15 0.00 -1.00 0.00 0.00 55.97 53.52 1b62 s LYS 135 Cb -0.16 0.30 0.02 0.00 -2.06 0.00 0.00 37.83 35.93 1b62 s LYS 135 CO 0.02 -0.28 0.97 -2.30 0.10 0.00 0.00 175.35 173.86 1b62 n PRO 136 N -0.08 0.42 -3.82 1.78 -0.02 -1.26 -0.81 135.00 131.20 1b62 n PRO 136 Ca -0.10 0.20 -0.08 0.00 -2.02 0.00 0.00 63.50 61.50 1b62 n PRO 136 Cb 0.63 -2.23 0.01 0.00 -0.02 0.00 0.00 33.50 31.89 1b62 n PRO 136 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1b62 s ALA 137 N -1.89 -0.96 -0.06 3.55 0.00 -0.87 -4.51 121.76 117.02 1b62 s ALA 137 Ca 0.72 -0.58 0.06 0.00 0.00 0.00 0.00 51.96 52.16 1b62 s ALA 137 Cb -0.33 0.72 -0.01 0.00 0.00 0.00 0.00 23.12 23.51 1b62 s ALA 137 CO 0.51 -1.01 -0.24 0.00 0.00 0.00 0.00 175.76 175.03 1b62 s ALA 138 N -2.75 2.07 -0.29 0.00 0.00 -1.26 -3.66 121.76 115.86 1b62 s ALA 138 Ca 0.15 -0.98 -0.26 0.00 0.00 0.00 0.00 51.96 50.87 1b62 s ALA 138 Cb -0.05 -0.67 0.18 0.00 0.00 0.00 0.00 23.12 22.59 1b62 s ALA 138 CO 0.10 0.38 1.40 -1.58 0.00 0.00 0.00 175.76 176.05 1b62 s HIS 139 N -0.06 -0.09 1.02 0.00 5.04 -1.26 -4.98 115.29 114.96 1b62 s HIS 139 Ca -0.06 0.21 -0.16 0.00 -1.54 0.00 0.00 55.06 53.52 1b62 s HIS 139 Cb -0.14 0.48 0.21 0.00 0.04 0.00 0.00 32.58 33.16 1b62 s HIS 139 CO 0.04 -0.05 1.21 -1.25 -2.34 0.00 0.00 174.74 172.35 1b62 s PRO 140 N -0.09 0.20 0.07 2.88 0.04 -1.26 -4.75 135.00 132.10 1b62 s PRO 140 Ca 0.07 -0.13 -0.32 0.00 0.04 0.00 0.00 61.00 60.67 1b62 s PRO 140 Cb -0.04 -1.77 -0.11 0.00 0.04 0.00 0.00 34.50 32.62 1b62 s PRO 140 CO -0.14 -2.75 1.86 0.28 0.04 0.00 0.00 177.00 176.29 1b62 n VAL 141 N -4.07 0.46 0.00 -0.36 0.31 -1.26 -4.24 118.33 109.18 1b62 n VAL 141 Ca 0.12 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 1b62 n VAL 141 Cb 0.59 -2.09 0.00 0.00 -0.91 0.00 0.00 33.84 31.44 1b62 n VAL 141 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1b62 n GLY 142 N 4.27 0.93 3.13 2.92 0.00 -0.56 -4.56 105.19 111.32 1b62 n GLY 142 Ca 0.19 -1.93 -0.10 0.00 0.00 0.00 0.00 46.02 44.17 1b62 n GLY 142 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1b62 s THR 143 N -2.41 0.10 -0.05 2.61 2.01 -1.07 -2.09 115.64 114.75 1b62 s THR 143 Ca 0.00 -0.85 0.00 0.00 0.31 0.00 0.00 61.69 61.15 1b62 s THR 143 Cb 0.00 -0.68 0.02 0.00 0.01 0.00 0.00 72.50 71.85 1b62 s THR 143 CO 0.00 -0.47 -0.03 -0.89 -0.69 0.00 0.00 174.62 172.54 1b62 s THR 144 N -2.01 0.48 -0.10 -0.82 2.01 -0.31 -0.26 115.64 114.62 1b62 s THR 144 Ca -0.10 -0.04 -0.02 0.00 0.31 0.00 0.00 61.69 61.84 1b62 s THR 144 Cb -0.04 -0.55 -0.03 0.00 0.01 0.00 0.00 72.50 71.89 1b62 s THR 144 CO -0.01 0.23 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.37 1b62 s LEU 145 N 1.25 3.43 -0.17 4.42 2.01 0.13 -1.65 118.68 128.11 1b62 s LEU 145 Ca -0.06 0.04 0.00 0.00 0.01 0.00 0.00 54.13 54.13 1b62 s LEU 145 Cb -0.14 -1.79 0.04 0.00 0.01 0.00 0.00 46.19 44.31 1b62 s LEU 145 CO -0.02 0.32 -0.08 -0.70 1.01 0.00 0.00 176.35 176.87 1b62 s GLU 146 N -0.51 1.78 -0.30 1.70 2.12 -0.40 -1.61 118.70 121.48 1b62 s GLU 146 Ca 0.08 -0.63 -0.01 0.00 0.36 0.00 0.00 54.97 54.78 1b62 s GLU 146 Cb -0.12 -2.15 0.05 0.00 0.26 0.00 0.00 34.13 32.18 1b62 s GLU 146 CO 0.02 -0.39 -0.01 0.08 -0.54 0.00 0.00 175.26 174.42 1b62 s VAL 147 N 1.53 2.87 0.13 3.70 1.01 0.55 -0.36 120.40 129.83 1b62 s VAL 147 Ca 0.01 -1.46 0.07 0.00 0.00 0.00 0.00 61.98 60.60 1b62 s VAL 147 Cb -0.15 -2.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1b62 s VAL 147 CO -0.08 -0.12 -0.06 -0.76 0.00 0.00 0.00 175.10 174.07 1b62 s LEU 148 N 1.22 3.17 -1.19 3.92 1.02 -0.13 -1.13 118.68 125.56 1b62 s LEU 148 Ca -0.05 -0.38 -0.29 0.00 0.02 0.00 0.00 54.13 53.43 1b62 s LEU 148 Cb -0.20 -1.90 0.02 0.00 0.02 0.00 0.00 46.19 44.13 1b62 s LEU 148 CO -0.02 0.15 0.72 0.47 0.02 0.00 0.00 176.35 177.69 1b62 n ASP 149 N 0.39 -4.53 -4.72 2.29 8.00 -0.95 -1.03 116.55 116.01 1b62 n ASP 149 Ca -0.12 -1.19 -0.42 0.00 0.71 0.00 0.00 54.79 53.78 1b62 n ASP 149 Cb 0.53 -2.36 -0.03 0.00 -0.02 0.00 0.00 41.12 39.24 1b62 n ASP 149 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1b62 s LEU 150 N -7.07 4.37 -0.32 0.64 1.98 -1.20 -1.89 118.68 115.19 1b62 s LEU 150 Ca 0.48 2.86 0.00 0.00 -2.89 0.00 0.00 54.13 54.58 1b62 s LEU 150 Cb -0.23 -3.60 0.00 0.00 0.66 0.00 0.00 46.19 43.03 1b62 s LEU 150 CO 0.93 -0.98 0.00 0.49 -1.89 0.00 0.00 176.35 174.90 1b62 n PHE 151 N 4.12 0.00 0.17 5.38 3.72 0.11 -4.91 117.46 126.05 1b62 n PHE 151 Ca 0.16 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.62 1b62 n PHE 151 Cb 0.35 -0.99 0.52 0.00 -0.94 0.00 0.00 39.48 38.42 1b62 n PHE 151 CO 0.00 0.00 0.00 0.10 -0.05 0.00 0.00 176.76 176.81 1b62 h TYR 152 N 0.00 0.16 -0.47 1.38 -0.00 -1.55 -2.17 116.97 114.33 1b62 h TYR 152 Ca -0.06 -0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.66 1b62 h TYR 152 Cb 0.36 -0.05 0.00 0.00 -0.00 0.00 0.00 36.73 37.04 1b62 h TYR 152 CO 0.19 0.18 0.00 0.27 -0.00 0.00 0.00 178.16 178.80 1b62 n ASN 153 N -4.43 4.31 -3.29 0.10 6.94 -1.26 -4.61 115.26 113.02 1b62 n ASN 153 Ca -0.01 -2.61 -0.24 0.00 -0.02 0.00 0.00 54.58 51.70 1b62 n ASN 153 Cb 0.15 -0.52 -0.08 0.00 -2.36 0.00 0.00 39.78 36.97 1b62 n ASN 153 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1b62 n THR 154 N 0.45 -1.01 -0.36 5.53 -2.24 -0.81 -5.02 114.28 110.81 1b62 n THR 154 Ca 0.22 -3.27 0.03 0.00 -2.27 0.00 0.00 64.05 58.77 1b62 n THR 154 Cb 0.85 -1.41 0.18 0.00 -2.10 0.00 0.00 70.33 67.86 1b62 n THR 154 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1b62 h PRO 155 N 5.27 1.07 -0.51 -0.78 0.13 -1.82 -2.38 132.00 132.99 1b62 h PRO 155 Ca 0.21 -0.06 0.09 0.00 -0.87 0.00 0.00 66.00 65.37 1b62 h PRO 155 Cb 0.92 -0.24 -0.03 0.00 0.13 0.00 0.00 31.00 31.78 1b62 h PRO 155 CO 0.35 0.71 0.35 0.00 -0.23 0.00 0.00 178.00 179.18 1b62 h ALA 156 N 1.47 2.07 0.13 -0.56 0.00 -1.95 -2.36 119.26 118.05 1b62 h ALA 156 Ca 0.44 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 55.02 1b62 h ALA 156 Cb 0.24 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1b62 h ALA 156 CO -0.19 -0.19 -1.57 0.00 0.00 0.00 0.00 179.25 177.30 1b62 h ARG 157 N 0.31 0.27 -0.11 0.00 3.08 -1.79 -3.34 114.38 112.80 1b62 h ARG 157 Ca 0.24 -0.46 0.03 0.00 0.07 0.00 0.00 59.98 59.86 1b62 h ARG 157 Cb 0.52 0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.74 1b62 h ARG 157 CO -0.05 1.14 0.08 -0.09 -1.07 0.00 0.00 179.97 179.98 1b62 h ARG 158 N 0.07 0.00 0.00 0.04 2.43 -1.07 -0.66 114.38 115.19 1b62 h ARG 158 Ca -0.26 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 58.89 1b62 h ARG 158 Cb 2.03 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 31.58 1b62 h ARG 158 CO 0.16 0.00 -0.08 0.87 -1.51 0.00 0.00 179.97 179.42 1b62 h LYS 159 N 0.00 0.00 -0.00 0.20 1.79 -1.62 -2.52 116.57 114.42 1b62 h LYS 159 Ca 0.05 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.52 1b62 h LYS 159 Cb 0.22 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.87 1b62 h LYS 159 CO -0.00 0.08 -0.18 1.19 -1.08 0.00 0.00 179.45 179.45 1b62 n PHE 160 N -3.42 0.00 -1.98 -1.35 3.01 -0.26 -4.88 117.46 108.58 1b62 n PHE 160 Ca -0.01 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.02 1b62 n PHE 160 Cb 0.22 -0.29 -0.03 0.00 -0.01 0.00 0.00 39.48 39.38 1b62 n PHE 160 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1b62 s LEU 161 N -2.76 4.37 0.00 4.37 1.43 -0.95 -5.01 118.68 120.13 1b62 s LEU 161 Ca 0.20 2.52 0.00 0.00 -1.03 0.00 0.00 54.13 55.82 1b62 s LEU 161 Cb 0.19 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.83 1b62 s LEU 161 CO 0.55 -0.80 0.00 0.54 0.23 0.00 0.00 176.35 176.87 1b62 n ARG 162 N 4.34 0.31 -1.71 1.70 5.12 -1.26 -5.02 116.66 120.14 1b62 n ARG 162 Ca 0.14 0.00 -0.34 0.00 -1.93 0.00 0.00 57.85 55.71 1b62 n ARG 162 Cb 0.40 0.00 0.06 0.00 -1.16 0.00 0.00 32.46 31.76 1b62 n ARG 162 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 1b62 s THR 163 N -0.61 2.70 0.26 0.55 -4.23 -1.26 -4.74 115.64 108.31 1b62 s THR 163 Ca 0.00 0.36 -0.02 0.00 -1.18 0.00 0.00 61.69 60.85 1b62 s THR 163 Cb 0.00 -2.97 0.24 0.00 1.34 0.00 0.00 72.50 71.12 1b62 s THR 163 CO 0.00 -0.16 1.71 -0.08 -0.54 0.00 0.00 174.62 175.55 1b62 h GLU 164 N 0.16 0.38 -0.09 3.99 4.81 -1.96 0.33 114.58 122.21 1b62 h GLU 164 Ca -0.48 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 58.74 1b62 h GLU 164 Cb 1.28 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.56 1b62 h GLU 164 CO 0.53 0.25 -0.01 -0.22 -0.73 0.00 0.00 179.01 178.83 1b62 h LYS 165 N 0.39 0.02 -0.37 1.92 3.64 -1.93 -0.09 116.57 120.15 1b62 h LYS 165 Ca 0.45 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.81 1b62 h LYS 165 Cb 0.76 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.56 1b62 h LYS 165 CO -0.47 0.01 0.13 1.15 -2.27 0.00 0.00 179.45 178.00 1b62 h THR 166 N 0.02 1.20 -0.59 1.00 2.02 -1.52 -1.98 112.91 113.06 1b62 h THR 166 Ca 0.04 -0.65 -0.10 0.00 0.77 0.00 0.00 66.41 66.46 1b62 h THR 166 Cb 0.06 0.94 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 1b62 h THR 166 CO -0.08 0.23 -0.03 -0.33 0.37 0.00 0.00 175.52 175.68 1b62 h GLU 167 N 0.45 1.06 -0.59 6.66 4.39 -0.86 -2.45 114.58 123.24 1b62 h GLU 167 Ca 0.12 -0.35 -0.08 0.00 0.34 0.00 0.00 59.36 59.39 1b62 h GLU 167 Cb 0.23 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 1b62 h GLU 167 CO -0.01 1.05 0.05 0.35 -1.16 0.00 0.00 179.01 179.29 1b62 h PHE 168 N 0.96 1.06 -0.86 4.33 3.57 -0.95 -2.33 116.94 122.73 1b62 h PHE 168 Ca 0.16 -0.16 0.05 0.00 3.53 0.00 0.00 57.97 61.56 1b62 h PHE 168 Cb 0.59 -0.29 -0.06 0.00 2.79 0.00 0.00 35.95 38.99 1b62 h PHE 168 CO 0.04 0.93 0.54 -0.91 -2.23 0.00 0.00 178.31 176.68 1b62 h ASN 169 N 0.93 0.87 -0.36 0.41 4.21 -1.10 0.36 115.58 120.89 1b62 h ASN 169 Ca 0.18 0.01 -0.06 0.00 1.21 0.00 0.00 56.30 57.64 1b62 h ASN 169 Cb 0.47 -0.18 -0.02 0.00 -1.12 0.00 0.00 38.32 37.47 1b62 h ASN 169 CO 0.02 0.58 0.03 0.45 -1.29 0.00 0.00 177.43 177.22 1b62 h HIS 170 N 1.01 0.74 -0.41 1.19 3.86 -1.08 -0.08 115.15 120.38 1b62 h HIS 170 Ca 0.36 -0.08 -0.04 0.00 -1.16 0.00 0.00 60.37 59.44 1b62 h HIS 170 Cb 0.10 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.34 1b62 h HIS 170 CO -0.03 0.68 0.08 0.82 0.86 0.00 0.00 177.93 180.34 1b62 h ILE 171 N 0.67 1.24 -0.65 2.45 2.04 -0.57 -0.82 117.51 121.88 1b62 h ILE 171 Ca 0.14 -0.84 0.01 0.00 1.00 0.00 0.00 64.86 65.17 1b62 h ILE 171 Cb 0.37 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 1b62 h ILE 171 CO 0.01 0.29 0.43 -0.78 0.00 0.00 0.00 178.15 178.10 1b62 h ASP 172 N 0.53 0.73 -0.65 1.72 3.58 0.17 -1.39 116.42 121.10 1b62 h ASP 172 Ca 0.13 -0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.55 1b62 h ASP 172 Cb 0.35 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 41.19 1b62 h ASP 172 CO 0.01 0.53 0.35 -0.08 -2.88 0.00 0.00 179.24 177.16 1b62 h GLU 173 N 0.86 0.91 -0.21 0.28 4.57 -0.79 -0.90 114.58 119.30 1b62 h GLU 173 Ca 0.24 -0.11 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 1b62 h GLU 173 Cb -0.09 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.32 1b62 h GLU 173 CO -0.06 0.70 0.14 0.82 -1.18 0.00 0.00 179.01 179.43 1b62 h ILE 174 N 0.89 1.06 -0.89 2.32 1.08 -0.59 -1.62 117.51 119.76 1b62 h ILE 174 Ca 0.23 -0.10 -0.01 0.00 -0.39 0.00 0.00 64.86 64.59 1b62 h ILE 174 Cb 0.05 0.75 -0.04 0.00 -3.07 0.00 0.00 36.82 34.51 1b62 h ILE 174 CO -0.04 0.05 0.52 0.40 -0.69 0.00 0.00 178.15 178.40 1b62 h ILE 175 N 0.28 1.25 -0.26 -0.67 1.08 -1.10 -1.94 117.51 116.15 1b62 h ILE 175 Ca 0.08 -0.57 0.06 0.00 -0.39 0.00 0.00 64.86 64.03 1b62 h ILE 175 Cb -0.03 0.01 -0.05 0.00 -3.07 0.00 0.00 36.82 33.68 1b62 h ILE 175 CO -0.02 0.27 -0.09 -0.09 -0.69 0.00 0.00 178.15 177.53 1b62 h ARG 176 N 1.23 -0.04 -0.39 2.37 9.65 -0.60 0.28 114.38 126.88 1b62 h ARG 176 Ca 0.32 0.00 -0.07 0.00 -1.10 0.00 0.00 59.98 59.13 1b62 h ARG 176 Cb -0.03 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.54 1b62 h ARG 176 CO -0.06 -0.03 -0.03 0.00 2.80 0.00 0.00 179.97 182.65 1b62 h ARG 177 N -0.04 0.64 -0.01 0.20 3.08 -0.86 -2.62 114.38 114.76 1b62 h ARG 177 Ca 0.13 -0.16 -0.26 0.00 0.07 0.00 0.00 59.98 59.76 1b62 h ARG 177 Cb 0.24 -0.08 0.02 0.00 0.08 0.00 0.00 29.97 30.23 1b62 h ARG 177 CO -0.29 0.68 -1.01 0.82 -1.07 0.00 0.00 179.97 179.09 1b62 h ILE 178 N 0.60 1.29 -0.53 2.04 2.04 -0.79 -3.02 117.51 119.14 1b62 h ILE 178 Ca 0.12 -2.24 -0.01 0.00 1.00 0.00 0.00 64.86 63.73 1b62 h ILE 178 Cb 0.43 2.34 -0.03 0.00 -0.74 0.00 0.00 36.82 38.82 1b62 h ILE 178 CO 0.02 0.69 0.27 0.00 0.00 0.00 0.00 178.15 179.13 1b62 h ALA 179 N 0.45 1.49 0.00 1.87 0.00 -0.35 -1.62 119.26 121.09 1b62 h ALA 179 Ca -0.12 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 1b62 h ALA 179 Cb 1.66 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 1b62 h ALA 179 CO 0.20 0.42 -0.42 -0.07 0.00 0.00 0.00 179.25 179.38 1b62 h LEU 180 N 0.73 0.00 -0.48 0.00 3.38 -1.49 -3.06 115.31 114.40 1b62 h LEU 180 Ca 0.19 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.99 1b62 h LEU 180 Cb 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1b62 h LEU 180 CO -0.03 0.42 -0.74 0.00 0.09 0.00 0.00 178.44 178.18 1b62 h ALA 181 N 1.58 0.70 -2.91 1.53 0.00 -1.18 -3.40 119.26 115.58 1b62 h ALA 181 Ca -0.00 -0.64 -0.61 0.00 0.00 0.00 0.00 54.91 53.66 1b62 h ALA 181 Cb 0.93 -0.08 -0.40 0.00 0.00 0.00 0.00 17.79 18.24 1b62 h ALA 181 CO 0.05 0.83 -0.75 1.03 0.00 0.00 0.00 179.25 180.42 1b62 s ARG 182 N -3.46 1.34 0.53 0.00 1.81 -0.94 -4.93 118.95 113.31 1b62 s ARG 182 Ca -0.03 -2.14 0.29 0.00 -1.72 0.00 0.00 55.73 52.14 1b62 s ARG 182 Cb 0.11 -2.31 1.51 0.00 -0.45 0.00 0.00 34.95 33.81 1b62 s ARG 182 CO 0.81 -1.20 2.08 0.74 -0.68 0.00 0.00 175.30 177.05 1b62 h PHE 183 N 6.47 0.00 -0.00 -0.53 -1.00 -1.78 -2.74 116.94 117.35 1b62 h PHE 183 Ca 0.04 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.82 1b62 h PHE 183 Cb 0.91 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.47 1b62 h PHE 183 CO 0.48 0.10 0.00 -0.40 -1.61 0.00 0.00 178.31 176.88 1b62 n ASP 184 N -3.55 0.08 -4.28 2.17 5.75 -1.26 -0.26 116.55 115.20 1b62 n ASP 184 Ca -0.02 -1.12 -0.33 0.00 -0.01 0.00 0.00 54.79 53.31 1b62 n ASP 184 Cb 0.23 -0.00 -0.15 0.00 -1.03 0.00 0.00 41.12 40.17 1b62 n ASP 184 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1b62 s VAL 185 N -2.00 2.79 0.02 2.12 1.01 -1.04 -4.64 120.40 118.67 1b62 s VAL 185 Ca 0.43 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 61.38 1b62 s VAL 185 Cb 0.20 -2.19 -0.05 0.00 0.00 0.00 0.00 36.38 34.34 1b62 s VAL 185 CO 0.33 0.51 1.14 -0.89 0.00 0.00 0.00 175.10 176.19 1b62 s THR 186 N 0.86 4.28 -0.11 3.92 2.01 0.52 -4.34 115.64 122.78 1b62 s THR 186 Ca -0.04 1.63 -0.00 0.00 0.31 0.00 0.00 61.69 63.59 1b62 s THR 186 Cb -0.15 -4.05 0.02 0.00 0.01 0.00 0.00 72.50 68.34 1b62 s THR 186 CO -0.00 0.10 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.32 1b62 s ILE 187 N 1.27 1.00 -0.11 1.82 1.01 -0.78 -0.36 121.20 125.05 1b62 s ILE 187 Ca 0.56 -0.27 -0.00 0.00 0.00 0.00 0.00 60.65 60.94 1b62 s ILE 187 Cb -0.26 -1.02 -0.02 0.00 0.01 0.00 0.00 42.46 41.16 1b62 s ILE 187 CO 0.27 0.36 -0.10 0.20 0.00 0.00 0.00 174.94 175.67 1b62 s ASN 188 N 1.70 4.27 -0.10 3.58 0.01 -0.27 -0.64 114.94 123.49 1b62 s ASN 188 Ca 0.05 -0.22 0.02 0.00 -0.71 0.00 0.00 52.86 51.99 1b62 s ASN 188 Cb -0.13 -1.47 0.01 0.00 0.41 0.00 0.00 41.25 40.08 1b62 s ASN 188 CO -0.08 0.22 -0.14 -0.22 -1.51 0.00 0.00 177.10 175.37 1b62 s LEU 189 N 0.03 1.69 0.09 0.60 2.96 0.54 -0.07 118.68 124.51 1b62 s LEU 189 Ca -0.03 -0.39 0.07 0.00 -0.22 0.00 0.00 54.13 53.56 1b62 s LEU 189 Cb -0.14 -1.02 -0.03 0.00 0.50 0.00 0.00 46.19 45.49 1b62 s LEU 189 CO 0.04 0.02 -0.19 -0.44 -1.32 0.00 0.00 176.35 174.46 1b62 s SER 190 N 0.92 2.30 -0.05 3.68 0.01 0.49 -1.01 113.70 120.04 1b62 s SER 190 Ca -0.09 -0.64 0.02 0.00 1.31 0.00 0.00 55.95 56.55 1b62 s SER 190 Cb -0.15 -0.12 0.01 0.00 0.21 0.00 0.00 66.02 65.97 1b62 s SER 190 CO -0.00 0.04 -0.09 -2.28 0.41 0.00 0.00 173.24 171.32 1b62 s HIS 191 N -1.13 1.11 -1.43 2.43 2.46 0.63 -0.49 115.29 118.87 1b62 s HIS 191 Ca 0.04 -0.36 -0.01 0.00 0.47 0.00 0.00 55.06 55.20 1b62 s HIS 191 Cb -0.10 -0.85 0.00 0.00 -0.13 0.00 0.00 32.58 31.50 1b62 s HIS 191 CO 0.03 -0.21 0.33 0.09 -2.47 0.00 0.00 174.74 172.52 1b62 n ASN 192 N 3.79 -0.21 0.00 9.88 3.02 0.71 -0.85 115.26 131.60 1b62 n ASN 192 Ca -0.23 -1.08 0.00 0.00 -0.03 0.00 0.00 54.58 53.24 1b62 n ASN 192 Cb 0.52 -2.70 0.00 0.00 -0.61 0.00 0.00 39.78 36.99 1b62 n ASN 192 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1b62 n GLY 193 N -2.12 0.84 3.38 7.41 0.00 -1.26 -4.99 105.19 108.45 1b62 n GLY 193 Ca -0.31 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.39 1b62 n GLY 193 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1b62 s LYS 194 N -0.28 2.53 0.08 1.61 2.20 -0.03 -5.09 119.74 120.76 1b62 s LYS 194 Ca 0.00 -0.80 -0.31 0.00 -0.36 0.00 0.00 55.97 54.51 1b62 s LYS 194 Cb 0.00 -2.28 -0.07 0.00 -1.51 0.00 0.00 37.83 33.97 1b62 s LYS 194 CO 0.00 0.50 1.36 0.42 -0.36 0.00 0.00 175.35 177.27 1b62 s ILE 195 N -0.44 3.51 -0.21 5.43 1.01 -1.26 -0.27 121.20 128.96 1b62 s ILE 195 Ca 0.05 1.06 0.07 0.00 0.00 0.00 0.00 60.65 61.83 1b62 s ILE 195 Cb -0.12 -3.68 -0.18 0.00 0.01 0.00 0.00 42.46 38.50 1b62 s ILE 195 CO 0.02 0.07 -0.10 0.52 0.00 0.00 0.00 174.94 175.44 1b62 n VAL 196 N 4.07 1.28 -3.57 2.92 0.31 -0.18 -4.89 118.33 118.28 1b62 n VAL 196 Ca 0.11 -0.60 -0.06 0.00 -0.01 0.00 0.00 64.34 63.78 1b62 n VAL 196 Cb 0.43 -1.02 -0.02 0.00 -0.91 0.00 0.00 33.84 32.33 1b62 n VAL 196 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1b62 s ARG 197 N -2.45 0.84 -0.29 5.55 1.70 -0.63 -5.01 118.95 118.65 1b62 s ARG 197 Ca -0.23 -0.36 -0.02 0.00 -0.47 0.00 0.00 55.73 54.66 1b62 s ARG 197 Cb 0.07 0.35 0.17 0.00 -0.57 0.00 0.00 34.95 34.97 1b62 s ARG 197 CO 0.61 -0.37 0.56 1.14 -1.08 0.00 0.00 175.30 176.15 1b62 s GLN 198 N -3.06 0.52 -0.42 3.89 -2.07 -1.26 -0.34 119.66 116.92 1b62 s GLN 198 Ca 0.07 0.94 -0.17 0.00 -1.82 0.00 0.00 55.36 54.38 1b62 s GLN 198 Cb -0.01 0.36 0.02 0.00 -1.09 0.00 0.00 33.01 32.30 1b62 s GLN 198 CO -0.06 -0.60 0.43 0.71 -1.32 0.00 0.00 175.29 174.45 1b62 s TYR 199 N 2.80 3.18 0.30 9.60 2.02 0.19 -4.97 117.35 130.47 1b62 s TYR 199 Ca 0.18 -0.43 -0.29 0.00 -0.37 0.00 0.00 57.07 56.16 1b62 s TYR 199 Cb -0.15 -2.89 -0.10 0.00 -0.40 0.00 0.00 41.96 38.42 1b62 s TYR 199 CO -0.20 -0.70 1.27 1.03 -1.57 0.00 0.00 175.55 175.38 1b62 s ARG 200 N 2.08 4.41 0.42 -0.62 0.52 -1.26 -1.87 118.95 122.63 1b62 s ARG 200 Ca 0.11 2.12 -0.25 0.00 -0.52 0.00 0.00 55.73 57.19 1b62 s ARG 200 Cb -0.18 -3.11 -0.08 0.00 0.52 0.00 0.00 34.95 32.10 1b62 s ARG 200 CO 0.13 -0.13 1.20 0.00 0.02 0.00 0.00 175.30 176.52 1b62 s ALA 201 N -0.95 3.12 -0.24 2.13 0.00 -1.26 -4.83 121.76 119.73 1b62 s ALA 201 Ca 0.49 1.02 -0.16 0.00 0.00 0.00 0.00 51.96 53.32 1b62 s ALA 201 Cb -0.38 -3.41 -0.04 0.00 0.00 0.00 0.00 23.12 19.30 1b62 s ALA 201 CO 0.48 -0.64 0.42 0.08 0.00 0.00 0.00 175.76 176.10 1b62 s VAL 202 N -1.41 5.16 1.20 0.00 1.01 0.64 -4.95 120.40 122.04 1b62 s VAL 202 Ca 0.59 0.70 -0.15 0.00 0.00 0.00 0.00 61.98 63.12 1b62 s VAL 202 Cb -0.32 -3.74 0.26 0.00 0.00 0.00 0.00 36.38 32.59 1b62 s VAL 202 CO 0.40 0.18 0.77 -0.81 0.00 0.00 0.00 175.10 175.64 1b62 n PRO 203 N 5.00 -2.53 -1.60 2.72 -0.04 -1.26 -4.45 135.00 132.84 1b62 n PRO 203 Ca -0.07 -0.72 -0.50 0.00 -0.04 0.00 0.00 63.50 62.17 1b62 n PRO 203 Cb 0.51 -2.04 -0.06 0.00 -0.04 0.00 0.00 33.50 31.87 1b62 n PRO 203 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1b62 n GLU 204 N -4.40 1.62 -0.86 0.54 1.02 -1.26 -0.48 120.64 116.83 1b62 n GLU 204 Ca 0.02 0.55 0.00 0.00 -0.02 0.00 0.00 57.16 57.71 1b62 n GLU 204 Cb 0.56 -2.54 0.00 0.00 -0.02 0.00 0.00 31.44 29.44 1b62 n GLU 204 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1b62 n GLY 205 N 5.18 0.47 3.43 0.62 0.00 -1.26 -4.99 105.19 108.64 1b62 n GLY 205 Ca 0.30 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.03 1b62 n GLY 205 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1b62 s GLY 206 N -2.00 1.51 -0.01 -0.02 0.00 0.37 -4.90 107.32 102.26 1b62 s GLY 206 Ca 0.00 -0.28 -0.30 0.00 0.00 0.00 0.00 44.72 44.14 1b62 s GLY 206 CO 0.00 0.52 1.33 1.62 0.00 0.00 0.00 173.10 176.57 1b62 s GLN 207 N -4.53 4.31 -0.02 2.90 2.00 -1.26 -4.90 119.66 118.16 1b62 s GLN 207 Ca 0.69 1.87 0.08 0.00 -2.00 0.00 0.00 55.36 55.99 1b62 s GLN 207 Cb -0.23 -3.55 -0.24 0.00 0.80 0.00 0.00 33.01 29.79 1b62 s GLN 207 CO 0.64 -0.52 0.75 0.87 -0.50 0.00 0.00 175.29 176.53 1b62 h LYS 208 N 7.66 0.06 -1.42 1.67 1.57 -1.98 -3.36 116.57 120.78 1b62 h LYS 208 Ca -0.37 -0.11 0.46 0.00 -1.87 0.00 0.00 60.65 58.76 1b62 h LYS 208 Cb 1.17 0.04 -0.12 0.00 0.08 0.00 0.00 32.23 33.41 1b62 h LYS 208 CO 0.89 0.73 0.94 0.93 -0.57 0.00 0.00 179.45 182.37 1b62 h GLU 209 N 0.02 0.06 0.54 3.15 3.07 -1.99 0.13 114.58 119.56 1b62 h GLU 209 Ca -0.25 -0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.58 1b62 h GLU 209 Cb 1.98 -0.01 0.01 0.00 -0.84 0.00 0.00 28.75 29.88 1b62 h GLU 209 CO 0.10 0.04 -0.26 0.00 -1.40 0.00 0.00 179.01 177.49 1b62 h ARG 210 N 0.06 -0.70 -0.40 2.33 3.08 -2.00 -1.05 114.38 115.70 1b62 h ARG 210 Ca 0.83 0.05 -0.07 0.00 0.07 0.00 0.00 59.98 60.86 1b62 h ARG 210 Cb 2.76 0.16 -0.01 0.00 0.08 0.00 0.00 29.97 32.96 1b62 h ARG 210 CO -0.34 -0.47 -0.03 -0.09 -1.07 0.00 0.00 179.97 177.97 1b62 h ARG 211 N -0.73 0.73 -0.30 0.04 2.43 -1.03 -1.91 114.38 113.60 1b62 h ARG 211 Ca -0.07 -0.25 0.07 0.00 -0.81 0.00 0.00 59.98 58.92 1b62 h ARG 211 Cb 0.56 -0.06 -0.07 0.00 -0.42 0.00 0.00 29.97 29.99 1b62 h ARG 211 CO 0.12 0.83 -0.16 1.25 -1.51 0.00 0.00 179.97 180.51 1b62 h LEU 212 N 0.55 -0.53 -1.17 3.80 5.85 -1.26 0.14 115.31 122.69 1b62 h LEU 212 Ca 0.11 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 1b62 h LEU 212 Cb 0.52 0.29 -0.03 0.00 0.37 0.00 0.00 40.66 41.81 1b62 h LEU 212 CO 0.03 -0.20 0.37 1.23 -0.34 0.00 0.00 178.44 179.53 1b62 h GLY 213 N -0.12 1.01 1.91 3.75 0.00 -1.12 0.29 103.07 108.79 1b62 h GLY 213 Ca 0.16 -0.45 -0.10 0.00 0.00 0.00 0.00 47.33 46.94 1b62 h GLY 213 CO -0.38 0.43 -0.44 0.00 0.00 0.00 0.00 176.54 176.16 1b62 h ALA 214 N 1.45 1.18 0.00 3.60 0.00 -0.33 0.51 119.26 125.67 1b62 h ALA 214 Ca 0.24 -0.41 -0.19 0.00 0.00 0.00 0.00 54.91 54.54 1b62 h ALA 214 Cb 0.03 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1b62 h ALA 214 CO -0.04 0.58 -1.06 0.82 0.00 0.00 0.00 179.25 179.55 1b62 h ILE 215 N 0.09 1.06 0.00 0.00 2.04 -0.31 -3.40 117.51 116.99 1b62 h ILE 215 Ca 0.01 -2.21 0.00 0.00 1.00 0.00 0.00 64.86 63.66 1b62 h ILE 215 Cb 0.81 2.41 0.00 0.00 -0.74 0.00 0.00 36.82 39.30 1b62 h ILE 215 CO 0.06 0.36 -0.94 0.00 0.00 0.00 0.00 178.15 177.63 1b62 n GLY 217 N 1.35 2.35 0.21 0.00 0.00 0.18 -4.47 105.19 104.81 1b62 n GLY 217 Ca 0.02 -1.88 -0.03 0.00 0.00 0.00 0.00 46.02 44.13 1b62 n GLY 217 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1b62 h THR 218 N 0.00 1.29 -0.41 2.61 1.35 -1.92 -2.60 112.91 113.23 1b62 h THR 218 Ca 0.00 -1.43 0.08 0.00 -0.55 0.00 0.00 66.41 64.51 1b62 h THR 218 Cb 0.00 1.55 -0.07 0.00 -1.73 0.00 0.00 68.15 67.90 1b62 h THR 218 CO 0.00 0.44 -0.02 0.00 -0.25 0.00 0.00 175.52 175.69 1b62 h ALA 219 N 1.32 0.36 -0.21 6.62 0.00 -1.93 -0.96 119.26 124.47 1b62 h ALA 219 Ca 0.03 0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1b62 h ALA 219 Cb 0.77 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1b62 h ALA 219 CO 0.06 -0.40 -0.11 0.35 0.00 0.00 0.00 179.25 179.15 1b62 h PHE 220 N 0.09 0.51 -0.95 0.00 3.57 -1.76 -3.17 116.94 115.23 1b62 h PHE 220 Ca 0.20 -0.13 0.20 0.00 3.53 0.00 0.00 57.97 61.78 1b62 h PHE 220 Cb 0.29 -0.12 -0.08 0.00 2.79 0.00 0.00 35.95 38.84 1b62 h PHE 220 CO -0.29 0.74 0.61 1.25 -2.23 0.00 0.00 178.31 178.39 1b62 h LEU 221 N 0.14 0.54 -0.32 0.59 5.85 -0.99 0.11 115.31 121.23 1b62 h LEU 221 Ca 0.04 0.06 -0.13 0.00 0.84 0.00 0.00 57.88 58.70 1b62 h LEU 221 Cb 0.61 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 1b62 h LEU 221 CO 0.03 0.20 -0.31 -0.33 -0.34 0.00 0.00 178.44 177.69 1b62 h GLU 222 N 0.53 0.77 -0.01 1.25 5.08 -1.17 -3.08 114.58 117.95 1b62 h GLU 222 Ca 0.52 -0.41 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1b62 h GLU 222 Cb 1.11 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.38 1b62 h GLU 222 CO -0.25 1.03 -0.04 1.04 -1.00 0.00 0.00 179.01 179.79 1b62 n GLN 223 N -4.21 1.33 -1.88 2.33 1.13 -0.64 -4.91 117.38 110.53 1b62 n GLN 223 Ca -0.03 -0.64 -0.42 0.00 -1.94 0.00 0.00 57.00 53.97 1b62 n GLN 223 Cb 0.49 -1.49 -0.03 0.00 0.11 0.00 0.00 30.24 29.33 1b62 n GLN 223 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1b62 s ALA 224 N -2.11 3.49 -0.36 -1.58 0.00 0.31 -2.60 121.76 118.91 1b62 s ALA 224 Ca 0.37 0.99 -0.08 0.00 0.00 0.00 0.00 51.96 53.24 1b62 s ALA 224 Cb 0.21 -3.82 0.04 0.00 0.00 0.00 0.00 23.12 19.55 1b62 s ALA 224 CO 0.38 -1.64 0.16 -0.51 0.00 0.00 0.00 175.76 174.16 1b62 s LEU 225 N 4.66 4.59 0.64 0.00 1.43 0.11 -4.87 118.68 125.24 1b62 s LEU 225 Ca 0.80 -1.16 -0.18 0.00 -1.03 0.00 0.00 54.13 52.56 1b62 s LEU 225 Cb -0.35 -1.94 -0.02 0.00 0.03 0.00 0.00 46.19 43.91 1b62 s LEU 225 CO 0.34 -0.38 1.29 0.00 0.23 0.00 0.00 176.35 177.82 1b62 s ALA 226 N 1.45 2.42 -0.02 4.21 0.00 -1.26 -0.83 121.76 127.73 1b62 s ALA 226 Ca 0.00 1.20 0.03 0.00 0.00 0.00 0.00 51.96 53.19 1b62 s ALA 226 Cb -0.20 -3.54 -0.00 0.00 0.00 0.00 0.00 23.12 19.38 1b62 s ALA 226 CO 0.04 -1.54 -0.10 0.42 0.00 0.00 0.00 175.76 174.58 1b62 s ILE 227 N -1.41 0.84 -0.24 0.00 1.01 0.71 -4.88 121.20 117.23 1b62 s ILE 227 Ca 0.82 -0.41 -0.04 0.00 0.00 0.00 0.00 60.65 61.01 1b62 s ILE 227 Cb -0.37 -0.74 0.08 0.00 0.01 0.00 0.00 42.46 41.45 1b62 s ILE 227 CO 0.39 0.25 0.11 -1.61 0.00 0.00 0.00 174.94 174.09 1b62 s GLU 228 N 0.05 0.15 -0.11 2.79 2.02 -1.25 -3.26 118.70 119.07 1b62 s GLU 228 Ca -0.01 -0.35 -0.04 0.00 0.02 0.00 0.00 54.97 54.59 1b62 s GLU 228 Cb -0.07 -1.45 0.06 0.00 0.10 0.00 0.00 34.13 32.77 1b62 s GLU 228 CO 0.00 -0.87 0.18 -0.46 0.02 0.00 0.00 175.26 174.13 1b62 s TRP 229 N 2.11 -0.20 0.18 1.61 -0.11 -0.52 -4.99 118.94 117.02 1b62 s TRP 229 Ca 0.06 0.52 0.05 0.00 1.22 0.00 0.00 56.10 57.96 1b62 s TRP 229 Cb -0.16 -0.28 -0.05 0.00 -1.50 0.00 0.00 33.47 31.48 1b62 s TRP 229 CO -0.25 -0.35 -0.10 -1.14 -4.62 0.00 0.00 176.95 170.48 1b62 s GLN 230 N 2.30 1.20 -0.42 5.86 0.74 -1.26 0.15 119.66 128.23 1b62 s GLN 230 Ca 0.04 -1.54 -0.01 0.00 0.05 0.00 0.00 55.36 53.91 1b62 s GLN 230 Cb -0.13 -0.80 0.21 0.00 1.10 0.00 0.00 33.01 33.39 1b62 s GLN 230 CO -0.07 0.09 0.96 1.58 -0.55 0.00 0.00 175.29 177.29 1b62 n HIS 231 N -0.30 -2.05 -0.29 1.67 -0.00 0.10 -4.98 115.22 109.38 1b62 n HIS 231 Ca -0.09 -0.99 0.00 0.00 0.46 0.00 0.00 57.72 57.10 1b62 n HIS 231 Cb 0.61 1.27 0.00 0.00 -0.12 0.00 0.00 29.99 31.75 1b62 n HIS 231 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1b62 n GLY 232 N 2.60 0.62 0.27 1.57 0.00 -1.26 -3.07 105.19 105.92 1b62 n GLY 232 Ca 0.13 -0.66 0.15 0.00 0.00 0.00 0.00 46.02 45.65 1b62 n GLY 232 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1b62 h ASP 233 N 0.64 0.00 -3.33 1.61 3.32 -2.00 -3.42 116.42 113.24 1b62 h ASP 233 Ca 0.00 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.46 1b62 h ASP 233 Cb 0.00 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.46 1b62 h ASP 233 CO 0.00 0.08 0.37 -0.76 -1.72 0.00 0.00 179.24 177.21 1b62 s LEU 234 N -6.55 4.10 -0.02 1.55 1.43 -1.17 -3.65 118.68 114.36 1b62 s LEU 234 Ca -0.01 0.99 0.00 0.00 -1.03 0.00 0.00 54.13 54.08 1b62 s LEU 234 Cb 0.11 -3.11 0.03 0.00 0.03 0.00 0.00 46.19 43.24 1b62 s LEU 234 CO 0.56 -0.45 0.02 0.42 0.23 0.00 0.00 176.35 177.14 1b62 s THR 235 N 2.56 -0.00 -0.12 5.49 -4.23 -0.92 0.01 115.64 118.42 1b62 s THR 235 Ca 0.33 0.19 -0.00 0.00 -1.18 0.00 0.00 61.69 61.04 1b62 s THR 235 Cb -0.16 -0.13 -0.02 0.00 1.34 0.00 0.00 72.50 73.54 1b62 s THR 235 CO 0.09 0.11 -0.12 -0.22 -0.54 0.00 0.00 174.62 173.93 1b62 s LEU 236 N 1.10 2.80 0.22 4.79 2.96 0.40 -0.85 118.68 130.10 1b62 s LEU 236 Ca -0.09 -0.28 -0.00 0.00 -0.22 0.00 0.00 54.13 53.54 1b62 s LEU 236 Cb -0.13 -1.63 -0.04 0.00 0.50 0.00 0.00 46.19 44.89 1b62 s LEU 236 CO -0.03 0.19 0.12 -0.13 -1.32 0.00 0.00 176.35 175.19 1b62 s ARG 237 N 0.19 1.29 0.00 1.98 0.52 -0.20 -1.43 118.95 121.29 1b62 s ARG 237 Ca -0.07 -1.69 0.00 0.00 -0.52 0.00 0.00 55.73 53.45 1b62 s ARG 237 Cb -0.15 0.08 0.00 0.00 0.52 0.00 0.00 34.95 35.40 1b62 s ARG 237 CO 0.05 -0.36 0.00 0.41 0.02 0.00 0.00 175.30 175.41 1b62 n GLY 238 N -0.35 0.42 3.00 -3.53 0.00 -1.20 0.00 105.19 103.53 1b62 n GLY 238 Ca 0.01 -2.10 -0.15 0.00 0.00 0.00 0.00 46.02 43.79 1b62 n GLY 238 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1b62 s TRP 239 N -0.38 0.56 -0.08 1.61 0.51 -0.01 -0.21 118.94 120.94 1b62 s TRP 239 Ca 0.00 -0.26 0.01 0.00 -2.12 0.00 0.00 56.10 53.73 1b62 s TRP 239 Cb 0.00 -0.35 0.02 0.00 -0.81 0.00 0.00 33.47 32.33 1b62 s TRP 239 CO 0.00 -0.04 -0.10 0.08 -0.51 0.00 0.00 176.95 176.38 1b62 s VAL 240 N -0.65 1.02 0.31 4.03 1.01 -0.01 -1.05 120.40 125.07 1b62 s VAL 240 Ca -0.03 -0.38 -0.28 0.00 0.00 0.00 0.00 61.98 61.30 1b62 s VAL 240 Cb -0.05 -0.98 -0.09 0.00 0.00 0.00 0.00 36.38 35.26 1b62 s VAL 240 CO 0.00 0.34 1.05 0.00 0.00 0.00 0.00 175.10 176.49 1b62 s ALA 241 N 0.98 3.28 -0.08 5.51 0.00 -0.05 -0.71 121.76 130.70 1b62 s ALA 241 Ca -0.09 0.77 -0.33 0.00 0.00 0.00 0.00 51.96 52.31 1b62 s ALA 241 Cb -0.15 -3.28 -0.11 0.00 0.00 0.00 0.00 23.12 19.58 1b62 s ALA 241 CO -0.00 -0.10 1.93 -3.47 0.00 0.00 0.00 175.76 174.12 1b62 n ASP 242 N 0.79 3.56 -0.25 0.00 -0.08 -1.07 -4.65 116.55 114.85 1b62 n ASP 242 Ca 0.01 0.91 0.11 0.00 -1.51 0.00 0.00 54.79 54.31 1b62 n ASP 242 Cb 0.47 -1.41 0.38 0.00 2.34 0.00 0.00 41.12 42.90 1b62 n ASP 242 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1b62 h PRO 243 N 9.89 0.66 0.00 -0.67 0.11 -1.94 -0.23 132.00 139.82 1b62 h PRO 243 Ca -0.48 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.55 1b62 h PRO 243 Cb 1.27 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1b62 h PRO 243 CO 0.95 0.44 -0.18 -0.97 -0.21 0.00 0.00 178.00 178.03 1b62 h ASN 244 N 0.68 0.00 -0.20 -2.05 -1.24 -1.98 -2.88 115.58 107.91 1b62 h ASN 244 Ca 0.43 0.00 -0.11 0.00 0.71 0.00 0.00 56.30 57.33 1b62 h ASN 244 Cb 0.67 0.00 -0.07 0.00 0.73 0.00 0.00 38.32 39.65 1b62 h ASN 244 CO -0.19 0.18 -0.27 1.41 -1.29 0.00 0.00 177.43 177.27 1b62 n HIS 245 N -3.56 0.64 -3.61 0.67 8.25 -0.16 -4.99 115.22 112.46 1b62 n HIS 245 Ca -0.01 -1.58 -0.37 0.00 -0.26 0.00 0.00 57.72 55.50 1b62 n HIS 245 Cb 0.33 -0.39 -0.10 0.00 1.12 0.00 0.00 29.99 30.95 1b62 n HIS 245 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1b62 s THR 246 N -3.27 5.33 0.29 1.59 2.01 -0.85 -4.84 115.64 115.90 1b62 s THR 246 Ca 0.42 0.25 0.06 0.00 0.31 0.00 0.00 61.69 62.73 1b62 s THR 246 Cb 0.39 -3.54 -0.02 0.00 0.01 0.00 0.00 72.50 69.34 1b62 s THR 246 CO -0.03 0.31 0.34 0.42 -0.69 0.00 0.00 174.62 174.97 1b62 s THR 247 N 1.25 4.37 0.48 -0.82 -4.23 -1.26 -4.97 115.64 110.45 1b62 s THR 247 Ca 0.09 -1.16 0.15 0.00 -1.18 0.00 0.00 61.69 59.58 1b62 s THR 247 Cb -0.14 -3.48 0.30 0.00 1.34 0.00 0.00 72.50 70.51 1b62 s THR 247 CO 0.06 -0.25 2.08 -0.65 -0.54 0.00 0.00 174.62 175.32 1b62 h PRO 248 N 1.18 0.21 -0.76 3.99 0.11 -1.98 0.78 132.00 135.53 1b62 h PRO 248 Ca -0.48 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.56 1b62 h PRO 248 Cb 1.24 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 1b62 h PRO 248 CO 0.58 0.14 0.25 0.00 -0.21 0.00 0.00 178.00 178.76 1b62 h ALA 249 N 1.84 1.02 0.00 -0.75 0.00 -1.99 -1.89 119.26 117.49 1b62 h ALA 249 Ca 0.12 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 1b62 h ALA 249 Cb 0.22 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1b62 h ALA 249 CO -0.02 0.67 -0.52 -0.07 0.00 0.00 0.00 179.25 179.31 1b62 h LEU 250 N 1.12 0.00 -0.98 0.00 3.38 -1.49 -2.90 115.31 114.44 1b62 h LEU 250 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1b62 h LEU 250 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1b62 h LEU 250 CO -0.01 0.52 0.00 0.00 0.09 0.00 0.00 178.44 179.04 1b62 n ALA 251 N -2.31 1.20 0.33 1.53 0.00 0.10 -0.99 120.51 120.37 1b62 n ALA 251 Ca 0.00 0.13 0.15 0.00 0.00 0.00 0.00 53.44 53.72 1b62 n ALA 251 Cb 0.62 -1.28 0.61 0.00 0.00 0.00 0.00 19.45 19.40 1b62 n ALA 251 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1b62 h GLU 252 N 0.00 0.00 -4.22 0.00 5.08 -1.41 -3.38 114.58 110.66 1b62 h GLU 252 Ca 0.00 0.00 -0.76 0.00 -1.00 0.00 0.00 59.36 57.60 1b62 h GLU 252 Cb 0.09 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 29.11 1b62 h GLU 252 CO 0.00 0.00 0.49 0.42 -1.00 0.00 0.00 179.01 178.92 1b62 s ILE 253 N -3.52 5.37 -0.54 3.13 1.01 -0.16 -4.89 121.20 121.59 1b62 s ILE 253 Ca 0.02 -2.39 0.05 0.00 0.00 0.00 0.00 60.65 58.33 1b62 s ILE 253 Cb 0.09 -4.62 0.17 0.00 0.01 0.00 0.00 42.46 38.11 1b62 s ILE 253 CO 0.48 -1.25 0.42 0.00 0.00 0.00 0.00 174.94 174.60 1b62 n GLN 254 N 4.66 0.96 -4.21 2.79 6.02 -1.24 0.10 117.38 126.47 1b62 n GLN 254 Ca 0.21 -3.77 -0.34 0.00 -0.01 0.00 0.00 57.00 53.08 1b62 n GLN 254 Cb 0.46 -1.94 -0.14 0.00 1.02 0.00 0.00 30.24 29.65 1b62 n GLN 254 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1b62 s TYR 255 N -0.70 2.93 0.07 1.08 2.02 -0.45 -4.98 117.35 117.33 1b62 s TYR 255 Ca 0.30 -0.77 0.09 0.00 -0.37 0.00 0.00 57.07 56.32 1b62 s TYR 255 Cb 0.01 -2.01 -0.03 0.00 -0.40 0.00 0.00 41.96 39.53 1b62 s TYR 255 CO -0.18 -0.38 -0.24 0.00 -1.57 0.00 0.00 175.55 173.18 1b62 s TYR 257 N -0.92 0.37 -0.31 0.00 1.51 -0.26 -1.83 117.35 115.90 1b62 s TYR 257 Ca 0.10 -0.07 -0.03 0.00 -1.01 0.00 0.00 57.07 56.06 1b62 s TYR 257 Cb -0.10 -0.24 0.05 0.00 -0.11 0.00 0.00 41.96 41.56 1b62 s TYR 257 CO 0.03 -0.01 0.03 0.08 -1.11 0.00 0.00 175.55 174.57 1b62 s VAL 258 N -0.05 3.18 -1.34 0.71 1.01 -0.82 0.07 120.40 123.16 1b62 s VAL 258 Ca 0.01 -1.35 -0.01 0.00 0.00 0.00 0.00 61.98 60.63 1b62 s VAL 258 Cb -0.02 -2.83 -0.00 0.00 0.00 0.00 0.00 36.38 33.52 1b62 s VAL 258 CO -0.00 -0.14 0.57 0.59 0.00 0.00 0.00 175.10 176.12 1b62 n ASN 259 N 4.67 -0.97 0.00 3.32 3.02 0.03 -1.46 115.26 123.87 1b62 n ASN 259 Ca -0.13 -0.92 0.00 0.00 -0.03 0.00 0.00 54.58 53.51 1b62 n ASN 259 Cb 0.44 -3.56 0.00 0.00 -0.61 0.00 0.00 39.78 36.05 1b62 n ASN 259 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1b62 n GLY 260 N -1.77 2.60 3.58 7.41 0.00 -1.26 -4.98 105.19 110.76 1b62 n GLY 260 Ca -0.30 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 1b62 n GLY 260 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1b62 s ARG 261 N 0.00 3.72 0.68 1.61 3.52 -0.54 -4.88 118.95 123.05 1b62 s ARG 261 Ca 0.00 0.23 -0.17 0.00 -0.13 0.00 0.00 55.73 55.67 1b62 s ARG 261 Cb 0.00 -3.82 -0.03 0.00 -1.56 0.00 0.00 34.95 29.54 1b62 s ARG 261 CO 0.00 -0.84 0.78 0.00 -0.81 0.00 0.00 175.30 174.43 1b62 n MET 262 N 6.36 0.53 -3.73 5.12 0.00 -1.26 -1.94 117.12 122.20 1b62 n MET 262 Ca 0.02 0.22 -0.04 0.00 0.00 0.00 0.00 57.70 57.91 1b62 n MET 262 Cb 0.48 -2.02 -0.01 0.00 0.00 0.00 0.00 33.22 31.66 1b62 n MET 262 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 175.97 177.38 1b62 s MET 263 N -2.87 1.14 -0.45 3.17 0.00 -0.76 -4.60 119.30 114.93 1b62 s MET 263 Ca 0.71 -0.61 0.05 0.00 0.00 0.00 0.00 55.69 55.84 1b62 s MET 263 Cb -0.37 0.40 0.18 0.00 0.00 0.00 0.00 34.83 35.03 1b62 s MET 263 CO 0.52 -0.52 0.48 0.54 0.00 0.00 0.00 175.02 176.04 1b62 n ARG 264 N -0.45 0.31 -4.00 4.11 1.74 -0.90 -3.92 116.66 113.55 1b62 n ARG 264 Ca -0.06 -2.78 -0.35 0.00 -0.77 0.00 0.00 57.85 53.89 1b62 n ARG 264 Cb 0.61 -1.60 -0.09 0.00 -1.02 0.00 0.00 32.46 30.36 1b62 n ARG 264 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1b62 s ASP 265 N 0.32 5.79 0.32 0.55 -1.08 -1.26 -4.79 116.67 116.53 1b62 s ASP 265 Ca 0.32 0.19 0.02 0.00 -0.52 0.00 0.00 52.55 52.56 1b62 s ASP 265 Cb 0.03 -1.93 0.55 0.00 -1.46 0.00 0.00 42.92 40.12 1b62 s ASP 265 CO -0.15 0.25 1.88 0.03 0.52 0.00 0.00 175.17 177.71 1b62 h ARG 266 N 6.11 0.66 -0.44 4.34 3.08 -1.98 -2.52 114.38 123.63 1b62 h ARG 266 Ca -0.43 -0.12 0.09 0.00 0.07 0.00 0.00 59.98 59.59 1b62 h ARG 266 Cb 1.18 -0.11 -0.08 0.00 0.08 0.00 0.00 29.97 31.04 1b62 h ARG 266 CO 0.66 0.61 -0.12 1.25 -1.07 0.00 0.00 179.97 181.30 1b62 h LEU 267 N 0.64 -0.43 -0.07 3.04 5.85 -1.99 0.75 115.31 123.10 1b62 h LEU 267 Ca 0.15 0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.96 1b62 h LEU 267 Cb 0.25 0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.56 1b62 h LEU 267 CO -0.00 -0.15 -0.09 0.40 -0.34 0.00 0.00 178.44 178.25 1b62 h ILE 268 N -0.01 1.39 -0.45 4.05 2.04 -1.92 -2.13 117.51 120.48 1b62 h ILE 268 Ca 0.21 -1.31 0.05 0.00 1.00 0.00 0.00 64.86 64.82 1b62 h ILE 268 Cb 0.33 2.09 -0.02 0.00 -0.74 0.00 0.00 36.82 38.47 1b62 h ILE 268 CO -0.46 0.36 0.30 0.78 0.00 0.00 0.00 178.15 179.14 1b62 h ASN 269 N -0.26 0.33 0.15 1.72 4.21 -1.20 -1.58 115.58 118.96 1b62 h ASN 269 Ca 0.01 -0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.51 1b62 h ASN 269 Cb 0.63 -0.07 0.00 0.00 -1.12 0.00 0.00 38.32 37.76 1b62 h ASN 269 CO 0.02 0.22 -0.07 -0.74 -1.29 0.00 0.00 177.43 175.57 1b62 h HIS 270 N 0.38 -0.19 -1.00 1.19 2.76 -0.80 -2.16 115.15 115.33 1b62 h HIS 270 Ca 0.19 -0.00 0.14 0.00 -2.20 0.00 0.00 60.37 58.50 1b62 h HIS 270 Cb 0.28 0.06 -0.09 0.00 1.55 0.00 0.00 27.41 29.21 1b62 h HIS 270 CO -0.00 0.23 0.63 0.00 -1.30 0.00 0.00 177.93 177.49 1b62 h ALA 271 N -0.01 1.58 0.35 5.26 0.00 -0.97 0.17 119.26 125.64 1b62 h ALA 271 Ca -0.02 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1b62 h ALA 271 Cb 0.51 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1b62 h ALA 271 CO 0.03 0.14 -0.17 0.82 0.00 0.00 0.00 179.25 180.07 1b62 h ILE 272 N 0.92 0.60 -0.01 0.00 2.04 -1.32 -0.36 117.51 119.38 1b62 h ILE 272 Ca 0.52 -0.56 0.00 0.00 1.00 0.00 0.00 64.86 65.82 1b62 h ILE 272 Cb 0.61 0.86 -0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1b62 h ILE 272 CO -0.30 0.10 0.01 -0.09 0.00 0.00 0.00 178.15 177.88 1b62 h ARG 273 N -0.82 0.00 0.03 2.37 2.43 -0.96 -0.06 114.38 117.37 1b62 h ARG 273 Ca -0.05 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 58.98 1b62 h ARG 273 Cb 0.53 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.09 1b62 h ARG 273 CO 0.08 0.00 -0.58 0.37 -1.51 0.00 0.00 179.97 178.33 1b62 h GLN 274 N 0.00 0.35 -0.44 0.20 4.15 -0.47 0.13 115.11 119.03 1b62 h GLN 274 Ca 0.00 -0.41 -0.01 0.00 0.77 0.00 0.00 58.65 59.01 1b62 h GLN 274 Cb 0.03 0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.83 1b62 h GLN 274 CO -0.00 1.10 0.23 0.00 -1.93 0.00 0.00 178.83 178.23 1b62 h ALA 275 N 0.26 1.57 0.01 3.38 0.00 0.62 0.15 119.26 125.26 1b62 h ALA 275 Ca -0.08 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1b62 h ALA 275 Cb 1.32 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1b62 h ALA 275 CO 0.11 0.35 -0.09 0.00 0.00 0.00 0.00 179.25 179.63 1b62 h GLU 277 N -0.82 0.89 0.00 0.00 4.81 -0.77 1.55 114.58 120.25 1b62 h GLU 277 Ca -0.01 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.09 1b62 h GLU 277 Cb 0.97 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 1b62 h GLU 277 CO 0.02 0.59 -0.34 -0.44 -0.73 0.00 0.00 179.01 178.11 1b62 h ASP 278 N 0.92 0.00 0.00 1.04 5.19 -0.79 -3.28 116.42 119.50 1b62 h ASP 278 Ca 0.35 0.00 -0.23 0.00 -0.62 0.00 0.00 57.03 56.53 1b62 h ASP 278 Cb 0.16 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.63 1b62 h ASP 278 CO -0.17 0.34 -1.45 1.17 -3.12 0.00 0.00 179.24 176.01 1b62 n LYS 279 N -4.07 0.55 -1.09 3.56 0.00 -0.81 -4.94 118.16 111.36 1b62 n LYS 279 Ca -0.02 0.45 -0.30 0.00 0.00 0.00 0.00 58.31 58.44 1b62 n LYS 279 Cb 0.39 -1.64 0.24 0.00 0.00 0.00 0.00 35.03 34.02 1b62 n LYS 279 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 1b62 s LEU 280 N -7.84 0.68 -0.01 3.14 2.96 0.52 -5.03 118.68 113.11 1b62 s LEU 280 Ca -0.29 0.60 -0.00 0.00 -0.22 0.00 0.00 54.13 54.21 1b62 s LEU 280 Cb 0.07 -2.31 -0.00 0.00 0.50 0.00 0.00 46.19 44.45 1b62 s LEU 280 CO 0.48 -4.16 -0.00 1.23 -1.32 0.00 0.00 176.35 172.58 1b62 h GLY 281 N -2.61 0.00 -1.99 7.98 0.00 -1.80 -3.43 103.07 101.22 1b62 h GLY 281 Ca -0.44 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.40 1b62 h GLY 281 CO 0.33 0.00 0.25 0.00 0.00 0.00 0.00 176.54 177.12 1b62 s ALA 282 N -2.98 3.22 0.13 3.60 0.00 -1.26 -4.84 121.76 119.63 1b62 s ALA 282 Ca -0.00 -0.10 -0.22 0.00 0.00 0.00 0.00 51.96 51.63 1b62 s ALA 282 Cb 0.00 -2.88 -0.07 0.00 0.00 0.00 0.00 23.12 20.16 1b62 s ALA 282 CO 0.01 -0.24 0.69 0.34 0.00 0.00 0.00 175.76 176.55 1b62 s ASP 283 N -3.43 7.23 0.13 0.00 2.15 -1.26 -4.50 116.67 116.98 1b62 s ASP 283 Ca 0.54 1.47 -0.05 0.00 0.43 0.00 0.00 52.55 54.94 1b62 s ASP 283 Cb -0.10 -2.43 0.02 0.00 -0.30 0.00 0.00 42.92 40.10 1b62 s ASP 283 CO 0.37 0.22 0.27 0.00 -0.17 0.00 0.00 175.17 175.85 1b62 n GLN 284 N 1.55 0.38 -3.00 4.34 10.64 -1.26 -5.07 117.38 124.96 1b62 n GLN 284 Ca -0.07 -0.77 -0.43 0.00 -1.83 0.00 0.00 57.00 53.89 1b62 n GLN 284 Cb 0.50 0.95 -0.05 0.00 -0.86 0.00 0.00 30.24 30.78 1b62 n GLN 284 CO 0.00 0.00 0.00 -0.65 -1.83 0.00 0.00 177.06 174.58 1b62 s GLN 285 N -2.04 3.17 0.83 2.61 -1.52 -1.26 -4.88 119.66 116.57 1b62 s GLN 285 Ca 0.06 -0.76 -0.11 0.00 -1.95 0.00 0.00 55.36 52.60 1b62 s GLN 285 Cb -0.02 -4.13 0.09 0.00 -0.22 0.00 0.00 33.01 28.73 1b62 s GLN 285 CO 0.04 -1.46 1.09 -1.25 -0.25 0.00 0.00 175.29 173.46 1b62 s PRO 286 N 3.31 1.81 -0.12 2.91 0.04 -1.26 -4.60 135.00 137.09 1b62 s PRO 286 Ca 0.20 0.86 0.01 0.00 0.04 0.00 0.00 61.00 62.11 1b62 s PRO 286 Cb -0.17 -1.87 -0.01 0.00 0.04 0.00 0.00 34.50 32.49 1b62 s PRO 286 CO 0.13 -1.86 -0.17 0.00 0.04 0.00 0.00 177.00 175.14 1b62 s ALA 287 N -2.99 2.47 0.15 8.56 0.00 -1.26 -4.65 121.76 124.04 1b62 s ALA 287 Ca 0.62 -0.94 -0.24 0.00 0.00 0.00 0.00 51.96 51.40 1b62 s ALA 287 Cb -0.17 -1.09 0.06 0.00 0.00 0.00 0.00 23.12 21.92 1b62 s ALA 287 CO 0.56 0.22 0.79 -0.59 0.00 0.00 0.00 175.76 176.74 1b62 s PHE 288 N 0.41 -0.30 -0.35 0.00 -0.12 0.29 -0.87 117.98 117.04 1b62 s PHE 288 Ca -0.13 0.01 0.01 0.00 -0.05 0.00 0.00 56.93 56.78 1b62 s PHE 288 Cb -0.16 0.62 0.15 0.00 -0.63 0.00 0.00 43.02 42.99 1b62 s PHE 288 CO 0.06 -0.88 0.30 0.08 -0.05 0.00 0.00 175.22 174.73 1b62 s VAL 289 N -3.54 -0.18 0.06 -2.49 1.01 -0.21 -1.34 120.40 113.71 1b62 s VAL 289 Ca 0.07 -1.15 0.06 0.00 0.00 0.00 0.00 61.98 60.96 1b62 s VAL 289 Cb -0.02 -0.86 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 1b62 s VAL 289 CO -0.03 -0.71 -0.11 -0.76 0.00 0.00 0.00 175.10 173.50 1b62 s LEU 290 N 1.45 2.99 -0.19 3.92 1.43 -0.10 -0.83 118.68 127.35 1b62 s LEU 290 Ca 0.16 -0.31 0.00 0.00 -1.03 0.00 0.00 54.13 52.96 1b62 s LEU 290 Cb -0.18 -1.76 0.04 0.00 0.03 0.00 0.00 46.19 44.32 1b62 s LEU 290 CO -0.07 0.23 -0.09 -0.31 0.23 0.00 0.00 176.35 176.34 1b62 s TYR 291 N -1.08 2.23 -0.24 0.29 1.51 0.10 -1.10 117.35 119.06 1b62 s TYR 291 Ca 0.18 -1.45 -0.09 0.00 -1.01 0.00 0.00 57.07 54.71 1b62 s TYR 291 Cb -0.11 -1.56 -0.04 0.00 -0.11 0.00 0.00 41.96 40.14 1b62 s TYR 291 CO 0.10 -0.71 0.12 -1.17 -1.11 0.00 0.00 175.55 172.78 1b62 s LEU 292 N 1.46 3.87 -0.17 -1.29 2.96 0.11 -1.03 118.68 124.59 1b62 s LEU 292 Ca -0.00 0.00 -0.06 0.00 -0.22 0.00 0.00 54.13 53.85 1b62 s LEU 292 Cb -0.16 -2.03 -0.04 0.00 0.50 0.00 0.00 46.19 44.46 1b62 s LEU 292 CO -0.08 0.04 0.04 -1.61 -1.32 0.00 0.00 176.35 173.42 1b62 s GLU 293 N 1.20 3.81 0.07 1.98 0.41 -0.03 -0.79 118.70 125.35 1b62 s GLU 293 Ca 0.06 -0.37 -0.17 0.00 -0.41 0.00 0.00 54.97 54.08 1b62 s GLU 293 Cb -0.14 -3.12 0.04 0.00 -1.78 0.00 0.00 34.13 29.12 1b62 s GLU 293 CO 0.05 0.34 0.41 -1.50 -0.49 0.00 0.00 175.26 174.06 1b62 s ILE 294 N 0.18 0.06 -0.15 -1.63 2.07 -1.24 -2.16 121.20 118.32 1b62 s ILE 294 Ca 0.03 -0.50 -0.35 0.00 -1.41 0.00 0.00 60.65 58.42 1b62 s ILE 294 Cb -0.12 -1.02 -0.12 0.00 0.13 0.00 0.00 42.46 41.33 1b62 s ILE 294 CO 0.01 -0.28 1.91 -0.67 -1.91 0.00 0.00 174.94 174.00 1b62 n ASP 295 N 0.28 3.17 0.32 4.50 2.03 -1.26 -4.79 116.55 120.80 1b62 n ASP 295 Ca -0.18 0.89 0.16 0.00 0.52 0.00 0.00 54.79 56.19 1b62 n ASP 295 Cb 0.61 -1.34 0.83 0.00 -0.72 0.00 0.00 41.12 40.51 1b62 n ASP 295 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1b62 h PRO 296 N 9.56 0.00 -0.00 -0.67 0.13 -1.91 0.32 132.00 139.43 1b62 h PRO 296 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1b62 h PRO 296 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1b62 h PRO 296 CO 0.96 0.00 -0.12 0.72 -0.23 0.00 0.00 178.00 179.33 1b62 n HIS 297 N -2.95 0.00 0.22 1.56 8.25 -1.26 -3.35 115.22 117.69 1b62 n HIS 297 Ca -0.02 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.56 1b62 n HIS 297 Cb 0.38 -0.29 0.22 0.00 1.12 0.00 0.00 29.99 31.42 1b62 n HIS 297 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1b62 n GLN 298 N -1.24 2.53 -3.82 -0.41 1.13 0.11 -4.93 117.38 110.75 1b62 n GLN 298 Ca 0.11 -2.33 -0.12 0.00 -1.94 0.00 0.00 57.00 52.72 1b62 n GLN 298 Cb 0.30 -1.52 -0.12 0.00 0.11 0.00 0.00 30.24 29.01 1b62 n GLN 298 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1b62 s VAL 299 N -1.42 0.01 -0.33 5.09 0.11 -1.21 -0.04 120.40 122.61 1b62 s VAL 299 Ca 0.40 -0.08 -0.12 0.00 -2.93 0.00 0.00 61.98 59.24 1b62 s VAL 299 Cb 0.23 -0.26 -0.02 0.00 -1.53 0.00 0.00 36.38 34.80 1b62 s VAL 299 CO 0.32 -0.04 0.23 -0.62 -3.33 0.00 0.00 175.10 171.65 1b62 s ASP 300 N -0.08 6.03 0.00 3.54 -1.08 0.16 -4.91 116.67 120.34 1b62 s ASP 300 Ca -0.02 -0.37 0.24 0.00 -0.52 0.00 0.00 52.55 51.89 1b62 s ASP 300 Cb -0.02 -2.13 0.39 0.00 -1.46 0.00 0.00 42.92 39.71 1b62 s ASP 300 CO 0.00 -0.21 1.33 0.52 0.52 0.00 0.00 175.17 177.34 1b62 n VAL 301 N 5.09 0.00 -3.18 1.11 0.31 -1.26 -2.04 118.33 118.36 1b62 n VAL 301 Ca -0.13 -0.06 -0.43 0.00 -0.01 0.00 0.00 64.34 63.71 1b62 n VAL 301 Cb 0.50 0.51 0.00 0.00 -0.91 0.00 0.00 33.84 33.94 1b62 n VAL 301 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1b62 n ASN 302 N -1.14 5.91 -0.00 4.52 4.05 -1.26 -4.55 115.26 122.78 1b62 n ASN 302 Ca 0.07 -3.24 -0.01 0.00 0.45 0.00 0.00 54.58 51.85 1b62 n ASN 302 Cb 0.35 -1.30 -0.00 0.00 1.23 0.00 0.00 39.78 40.06 1b62 n ASN 302 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 177.26 174.73 1b62 n VAL 303 N 1.93 0.04 0.00 3.44 0.31 -1.26 -5.09 118.33 117.69 1b62 n VAL 303 Ca 0.25 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.57 1b62 n VAL 303 Cb 0.36 -0.69 0.00 0.00 -0.91 0.00 0.00 33.84 32.60 1b62 n VAL 303 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 1b62 n HIS 304 N -2.61 0.00 0.00 3.52 -0.00 -1.26 -5.05 115.22 109.83 1b62 n HIS 304 Ca -0.01 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.17 1b62 n HIS 304 Cb 0.51 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.38 1b62 n HIS 304 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1b62 n PRO 305 N 0.00 0.00 0.00 1.57 -0.05 -1.26 -2.88 135.00 132.38 1b62 n PRO 305 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.45 1b62 n PRO 305 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 33.50 33.45 1b62 n PRO 305 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 175.50 177.08 1b62 n LYS 307 N 0.00 0.00 0.00 0.54 5.02 -1.26 -5.66 118.16 116.80 1b62 n LYS 307 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1b62 n LYS 307 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1b62 n LYS 307 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1b62 n HIS 308 N -0.18 0.00 -2.92 2.13 8.25 -1.14 -4.79 115.22 116.57 1b62 n HIS 308 Ca 0.00 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.11 1b62 n HIS 308 Cb 0.00 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.05 1b62 n HIS 308 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1b62 s GLU 309 N 0.00 4.29 0.15 -0.41 2.02 -1.26 -2.11 118.70 121.39 1b62 s GLU 309 Ca 0.00 1.04 -0.12 0.00 0.02 0.00 0.00 54.97 55.92 1b62 s GLU 309 Cb 0.00 -2.53 0.01 0.00 0.10 0.00 0.00 34.13 31.71 1b62 s GLU 309 CO 0.00 0.17 0.34 0.14 0.02 0.00 0.00 175.26 175.93 1b62 s VAL 310 N -1.86 0.07 -0.07 2.63 -7.23 -1.26 -4.58 120.40 108.10 1b62 s VAL 310 Ca 0.54 -1.12 -0.01 0.00 -1.81 0.00 0.00 61.98 59.57 1b62 s VAL 310 Cb -0.13 -1.62 0.03 0.00 0.56 0.00 0.00 36.38 35.21 1b62 s VAL 310 CO 0.18 -0.32 -0.00 -0.13 -0.31 0.00 0.00 175.10 174.52 1b62 s ARG 311 N -3.91 0.64 -0.08 4.82 0.52 -0.87 -4.94 118.95 115.14 1b62 s ARG 311 Ca 0.12 0.08 -0.18 0.00 -0.52 0.00 0.00 55.73 55.23 1b62 s ARG 311 Cb 0.02 -0.96 -0.05 0.00 0.52 0.00 0.00 34.95 34.49 1b62 s ARG 311 CO -0.04 -0.28 0.48 -0.06 0.02 0.00 0.00 175.30 175.42 1b62 s PHE 312 N 1.85 3.58 0.28 -0.53 0.40 -1.26 0.41 117.98 122.71 1b62 s PHE 312 Ca 0.03 0.95 -0.01 0.00 -0.60 0.00 0.00 56.93 57.30 1b62 s PHE 312 Cb -0.12 -2.50 0.41 0.00 0.51 0.00 0.00 43.02 41.31 1b62 s PHE 312 CO -0.05 0.29 1.84 1.25 0.70 0.00 0.00 175.22 179.26 1b62 h HIS 313 N 6.16 0.87 -2.29 0.36 -0.00 -0.82 -3.18 115.15 116.26 1b62 h HIS 313 Ca -0.44 -0.07 -0.65 0.00 -0.00 0.00 0.00 60.37 59.22 1b62 h HIS 313 Cb 1.19 -0.26 -0.38 0.00 -0.00 0.00 0.00 27.41 27.96 1b62 h HIS 313 CO 0.64 0.71 -0.20 1.04 -0.00 0.00 0.00 177.93 180.11 1b62 n GLN 314 N -4.29 3.75 -0.28 5.26 6.02 -1.26 -4.94 117.38 121.63 1b62 n GLN 314 Ca 0.04 -4.80 -0.05 0.00 -0.01 0.00 0.00 57.00 52.19 1b62 n GLN 314 Cb 0.20 -2.30 -0.03 0.00 1.02 0.00 0.00 30.24 29.13 1b62 n GLN 314 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1b62 n SER 315 N -0.08 -0.61 0.01 1.08 2.88 -1.20 -1.45 113.62 114.24 1b62 n SER 315 Ca 0.35 1.20 -0.11 0.00 -1.33 0.00 0.00 58.87 58.98 1b62 n SER 315 Cb 0.36 -0.20 -0.05 0.00 -0.75 0.00 0.00 64.21 63.56 1b62 n SER 315 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1b62 h ARG 316 N 0.00 0.05 0.23 -1.46 3.08 -1.93 -2.18 114.38 112.16 1b62 h ARG 316 Ca 0.16 -0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.21 1b62 h ARG 316 Cb 0.33 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.33 1b62 h ARG 316 CO -0.65 0.03 -0.42 1.25 -1.07 0.00 0.00 179.97 179.11 1b62 h LEU 317 N 0.05 -1.19 -0.24 3.04 5.85 -1.68 -2.06 115.31 119.08 1b62 h LEU 317 Ca 0.04 0.12 0.06 0.00 0.84 0.00 0.00 57.88 58.94 1b62 h LEU 317 Cb 0.03 0.43 -0.07 0.00 0.37 0.00 0.00 40.66 41.42 1b62 h LEU 317 CO -0.05 -0.51 -0.22 0.58 -0.34 0.00 0.00 178.44 177.89 1b62 h VAL 318 N -0.72 0.42 -0.78 1.05 2.07 -1.42 -1.22 116.25 115.65 1b62 h VAL 318 Ca -0.00 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.67 1b62 h VAL 318 Cb 0.70 0.42 -0.10 0.00 -1.52 0.00 0.00 31.29 30.80 1b62 h VAL 318 CO -0.18 0.00 0.32 -0.74 0.02 0.00 0.00 177.57 176.99 1b62 h HIS 319 N -0.23 0.55 -0.02 1.57 -0.00 -1.17 -0.10 115.15 115.74 1b62 h HIS 319 Ca 0.14 0.04 -0.12 0.00 -0.00 0.00 0.00 60.37 60.42 1b62 h HIS 319 Cb 0.44 -0.12 -0.02 0.00 -0.00 0.00 0.00 27.41 27.71 1b62 h HIS 319 CO -0.38 0.07 -0.54 0.22 -0.00 0.00 0.00 177.93 177.29 1b62 h ASP 320 N 0.46 0.06 0.63 3.26 1.82 -0.76 -2.37 116.42 119.53 1b62 h ASP 320 Ca 0.43 -0.03 -0.03 0.00 -0.39 0.00 0.00 57.03 57.01 1b62 h ASP 320 Cb 0.67 -0.02 0.01 0.00 0.68 0.00 0.00 39.33 40.66 1b62 h ASP 320 CO -0.41 0.60 -0.30 0.15 -1.61 0.00 0.00 179.24 177.66 1b62 h PHE 321 N 0.04 -0.78 -0.66 0.28 3.57 0.15 -1.18 116.94 118.36 1b62 h PHE 321 Ca -0.00 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.49 1b62 h PHE 321 Cb 0.98 0.26 -0.04 0.00 2.79 0.00 0.00 35.95 39.94 1b62 h PHE 321 CO 0.00 -0.48 0.43 0.82 -2.23 0.00 0.00 178.31 176.85 1b62 h ILE 322 N -0.86 1.13 -0.28 1.41 2.04 -1.37 -1.21 117.51 118.37 1b62 h ILE 322 Ca -0.09 -0.29 0.05 0.00 1.00 0.00 0.00 64.86 65.53 1b62 h ILE 322 Cb 0.65 0.20 -0.05 0.00 -0.74 0.00 0.00 36.82 36.88 1b62 h ILE 322 CO 0.14 0.16 -0.02 0.22 0.00 0.00 0.00 178.15 178.65 1b62 h TYR 323 N 0.86 -0.06 0.04 1.37 3.20 -1.30 -1.22 116.97 119.86 1b62 h TYR 323 Ca 0.25 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.14 1b62 h TYR 323 Cb -0.05 0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.29 1b62 h TYR 323 CO -0.04 -0.07 -0.02 1.96 -1.64 0.00 0.00 178.16 178.35 1b62 h GLN 324 N 0.06 -0.05 -0.39 1.82 1.08 -0.87 0.13 115.11 116.88 1b62 h GLN 324 Ca 0.14 0.00 0.08 0.00 -1.45 0.00 0.00 58.65 57.42 1b62 h GLN 324 Cb 0.19 0.01 -0.09 0.00 -0.05 0.00 0.00 27.48 27.55 1b62 h GLN 324 CO -0.25 0.11 -0.20 0.78 -0.95 0.00 0.00 178.83 178.32 1b62 h GLY 325 N -0.21 0.08 0.64 3.46 0.00 -0.94 0.65 103.07 106.76 1b62 h GLY 325 Ca -0.01 0.25 -0.00 0.00 0.00 0.00 0.00 47.33 47.57 1b62 h GLY 325 CO 0.01 -0.20 -0.02 -2.08 0.00 0.00 0.00 176.54 174.25 1b62 h VAL 326 N -0.13 1.21 -0.36 4.60 2.07 -1.19 -2.62 116.25 119.83 1b62 h VAL 326 Ca 0.19 -0.82 0.08 0.00 0.82 0.00 0.00 66.70 66.97 1b62 h VAL 326 Cb 0.43 1.75 -0.09 0.00 -1.52 0.00 0.00 31.29 31.86 1b62 h VAL 326 CO -0.47 0.21 -0.28 0.25 0.02 0.00 0.00 177.57 177.30 1b62 h LEU 327 N -0.42 -0.92 -0.25 2.57 5.85 -0.30 0.10 115.31 121.95 1b62 h LEU 327 Ca -0.01 0.17 0.06 0.00 0.84 0.00 0.00 57.88 58.95 1b62 h LEU 327 Cb 0.38 0.44 -0.08 0.00 0.37 0.00 0.00 40.66 41.78 1b62 h LEU 327 CO 0.01 -0.29 -0.33 -1.28 -0.34 0.00 0.00 178.44 176.20 1b62 h SER 328 N -0.23 -1.07 -0.84 1.25 0.87 0.33 -2.07 113.55 111.80 1b62 h SER 328 Ca 0.17 0.17 -0.00 0.00 -1.23 0.00 0.00 61.79 60.90 1b62 h SER 328 Cb 0.50 0.47 -0.04 0.00 -0.44 0.00 0.00 62.40 62.89 1b62 h SER 328 CO -0.49 -0.35 0.52 0.58 -0.53 0.00 0.00 176.83 176.56 1b62 h VAL 329 N -0.34 1.23 0.00 2.23 2.07 -0.98 -0.71 116.25 119.75 1b62 h VAL 329 Ca 0.13 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 67.17 1b62 h VAL 329 Cb 0.55 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.35 1b62 h VAL 329 CO -0.44 0.23 0.00 0.18 0.02 0.00 0.00 177.57 177.57 1b62 n LEU 330 N -4.38 0.00 -3.12 2.57 4.77 -0.05 -3.03 117.00 113.76 1b62 n LEU 330 Ca 0.09 0.02 -0.19 0.00 -0.03 0.00 0.00 56.01 55.91 1b62 n LEU 330 Cb 0.05 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 1b62 n LEU 330 CO 0.37 -0.02 -0.17 0.00 -1.33 0.00 0.00 177.39 176.24 1b62 n GLN 331 N -1.02 0.86 0.00 3.23 6.02 -0.27 -5.04 117.38 121.15 1b62 n GLN 331 Ca 0.04 -3.07 0.00 0.00 -0.01 0.00 0.00 57.00 53.96 1b62 n GLN 331 Cb 0.02 -1.44 0.00 0.00 1.02 0.00 0.00 30.24 29.84 1b62 n GLN 331 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99