#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oha s MET 2 N 0.00 0.89 0.17 2.12 -1.94 -1.26 -4.96 119.30 114.32 1oha s MET 2 Ca 0.00 0.61 -0.31 0.00 -1.71 0.00 0.00 55.69 54.29 1oha s MET 2 Cb 0.00 -1.78 -0.09 0.00 2.01 0.00 0.00 34.83 34.97 1oha s MET 2 CO 0.00 -2.44 1.39 -0.80 -0.01 0.00 0.00 175.02 173.16 1oha s ASN 3 N -3.52 6.79 1.11 3.03 0.01 -1.26 -4.69 114.94 116.41 1oha s ASN 3 Ca 0.64 2.44 -0.13 0.00 -0.71 0.00 0.00 52.86 55.11 1oha s ASN 3 Cb -0.18 -2.60 0.25 0.00 0.41 0.00 0.00 41.25 39.13 1oha s ASN 3 CO 0.57 -0.64 1.05 -2.84 -1.51 0.00 0.00 177.10 173.73 1oha s PRO 4 N 0.43 -0.48 -0.16 -0.60 0.02 -1.26 -4.61 135.00 128.34 1oha s PRO 4 Ca 0.62 0.61 0.00 0.00 0.02 0.00 0.00 61.00 62.25 1oha s PRO 4 Cb -0.38 -1.62 0.03 0.00 0.02 0.00 0.00 34.50 32.54 1oha s PRO 4 CO 0.35 -3.37 -0.12 -1.17 -0.33 0.00 0.00 177.00 172.36 1oha s LEU 5 N -6.91 1.83 -0.21 -5.54 2.96 -0.52 -1.23 118.68 109.05 1oha s LEU 5 Ca 0.67 -0.60 -0.17 0.00 -0.22 0.00 0.00 54.13 53.81 1oha s LEU 5 Cb -0.21 -1.17 -0.03 0.00 0.50 0.00 0.00 46.19 45.28 1oha s LEU 5 CO 0.61 -0.09 0.46 -0.63 -1.32 0.00 0.00 176.35 175.38 1oha s ILE 6 N 1.48 5.15 -0.34 6.68 1.01 0.10 -1.94 121.20 133.34 1oha s ILE 6 Ca 0.03 0.81 -0.09 0.00 0.00 0.00 0.00 60.65 61.40 1oha s ILE 6 Cb -0.14 -3.78 0.02 0.00 0.01 0.00 0.00 42.46 38.57 1oha s ILE 6 CO -0.10 0.20 0.16 -0.63 0.00 0.00 0.00 174.94 174.57 1oha s ILE 7 N 1.60 4.37 -0.18 2.92 1.01 0.30 -2.02 121.20 129.20 1oha s ILE 7 Ca 0.21 -0.76 -0.19 0.00 0.00 0.00 0.00 60.65 59.91 1oha s ILE 7 Cb -0.15 -3.36 -0.03 0.00 0.01 0.00 0.00 42.46 38.93 1oha s ILE 7 CO 0.09 -0.10 0.52 -0.75 0.00 0.00 0.00 174.94 174.70 1oha s LYS 8 N 1.54 4.23 -0.18 2.79 2.36 -0.51 -1.77 119.74 128.19 1oha s LYS 8 Ca 0.02 0.45 -0.05 0.00 -2.55 0.00 0.00 55.97 53.84 1oha s LYS 8 Cb -0.18 -3.54 -0.03 0.00 -1.05 0.00 0.00 37.83 33.03 1oha s LYS 8 CO 0.05 -0.09 -0.01 -0.51 1.55 0.00 0.00 175.35 176.34 1oha s LEU 9 N 1.45 3.31 0.00 5.43 1.43 0.31 -1.13 118.68 129.48 1oha s LEU 9 Ca 0.25 -0.15 0.00 0.00 -1.03 0.00 0.00 54.13 53.20 1oha s LEU 9 Cb -0.15 -1.83 0.00 0.00 0.03 0.00 0.00 46.19 44.24 1oha s LEU 9 CO 0.10 0.11 0.00 0.61 0.23 0.00 0.00 176.35 177.40 1oha n GLY 10 N 3.94 3.28 0.00 -3.19 0.00 -0.66 -1.03 105.19 107.53 1oha n GLY 10 Ca -0.17 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.59 1oha n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oha n GLY 11 N 0.00 -0.60 0.05 -0.02 0.00 -1.26 -4.45 105.19 98.90 1oha n GLY 11 Ca 0.00 -1.74 0.11 0.00 0.00 0.00 0.00 46.02 44.39 1oha n GLY 11 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1oha n VAL 12 N -0.64 0.58 0.28 1.61 0.24 -1.26 -2.82 118.33 116.32 1oha n VAL 12 Ca 0.00 0.07 0.14 0.00 -2.04 0.00 0.00 64.34 62.51 1oha n VAL 12 Cb 0.00 -0.80 0.67 0.00 -1.47 0.00 0.00 33.84 32.24 1oha n VAL 12 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1oha h LEU 13 N 0.00 0.00 -1.43 1.34 3.38 -1.94 -0.88 115.31 115.78 1oha h LEU 13 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1oha h LEU 13 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1oha h LEU 13 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 178.44 178.46 1oha h LEU 14 N 0.00 0.00 -3.08 1.67 3.38 -1.74 -1.87 115.31 113.67 1oha h LEU 14 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1oha h LEU 14 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1oha h LEU 14 CO 0.00 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.00 1oha n ASP 15 N -2.63 4.70 -4.24 -0.43 8.00 -0.34 -4.90 116.55 116.72 1oha n ASP 15 Ca 0.00 -2.37 -0.34 0.00 0.71 0.00 0.00 54.79 52.78 1oha n ASP 15 Cb 0.19 -0.57 -0.14 0.00 -0.02 0.00 0.00 41.12 40.57 1oha n ASP 15 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1oha s SER 16 N -0.91 4.07 0.16 -2.24 0.15 -0.70 -4.99 113.70 109.23 1oha s SER 16 Ca 0.52 -0.60 -0.11 0.00 0.70 0.00 0.00 55.95 56.46 1oha s SER 16 Cb 0.32 -1.66 0.03 0.00 -1.71 0.00 0.00 66.02 63.00 1oha s SER 16 CO 0.27 -0.05 1.61 -0.33 1.20 0.00 0.00 173.24 175.94 1oha h GLU 17 N 8.05 0.92 -0.55 5.44 4.39 -1.90 -0.67 114.58 130.25 1oha h GLU 17 Ca -0.40 -0.30 -0.02 0.00 0.34 0.00 0.00 59.36 58.98 1oha h GLU 17 Cb 1.14 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.68 1oha h GLU 17 CO 0.60 0.95 0.25 1.49 -1.16 0.00 0.00 179.01 181.14 1oha h GLU 18 N 0.80 0.80 -0.52 2.33 4.22 -1.95 -0.10 114.58 120.15 1oha h GLU 18 Ca 0.15 -0.13 -0.07 0.00 0.08 0.00 0.00 59.36 59.39 1oha h GLU 18 Cb 0.53 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 1oha h GLU 18 CO 0.03 0.67 0.04 0.00 -2.18 0.00 0.00 179.01 177.57 1oha h ALA 19 N 1.09 0.70 -0.52 2.92 0.00 -1.83 -1.97 119.26 119.65 1oha h ALA 19 Ca 0.19 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1oha h ALA 19 Cb 0.14 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1oha h ALA 19 CO -0.02 0.48 -0.10 -0.07 0.00 0.00 0.00 179.25 179.53 1oha h LEU 20 N 0.77 0.97 -0.24 0.00 3.38 -0.88 -0.53 115.31 118.78 1oha h LEU 20 Ca 0.15 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 1oha h LEU 20 Cb 0.46 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1oha h LEU 20 CO 0.02 1.08 0.06 -0.08 0.09 0.00 0.00 178.44 179.61 1oha h GLU 21 N 0.87 0.39 -0.72 1.13 4.57 -0.91 -0.81 114.58 119.10 1oha h GLU 21 Ca 0.14 -0.10 -0.01 0.00 -1.18 0.00 0.00 59.36 58.21 1oha h GLU 21 Cb 0.65 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.16 1oha h GLU 21 CO 0.05 0.50 0.42 0.00 -1.18 0.00 0.00 179.01 178.79 1oha h ARG 22 N 0.21 0.99 0.12 1.92 2.47 -1.25 -1.93 114.38 116.91 1oha h ARG 22 Ca 0.08 -0.10 -0.01 0.00 -1.26 0.00 0.00 59.98 58.69 1oha h ARG 22 Cb 0.28 -0.20 0.00 0.00 -1.65 0.00 0.00 29.97 28.40 1oha h ARG 22 CO 0.00 0.72 -0.06 1.25 0.56 0.00 0.00 179.97 182.45 1oha h LEU 23 N 0.99 -0.13 -1.91 3.04 5.85 -0.92 -2.53 115.31 119.69 1oha h LEU 23 Ca 0.26 -0.17 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1oha h LEU 23 Cb -0.00 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.06 1oha h LEU 23 CO -0.05 0.09 -0.09 -0.26 -0.34 0.00 0.00 178.44 177.79 1oha h PHE 24 N -0.35 0.00 -0.27 1.25 -1.00 -1.08 0.24 116.94 115.73 1oha h PHE 24 Ca -0.02 0.00 -0.18 0.00 2.81 0.00 0.00 57.97 60.58 1oha h PHE 24 Cb 0.29 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.85 1oha h PHE 24 CO -0.01 0.09 -0.56 0.77 -1.61 0.00 0.00 178.31 176.99 1oha h SER 25 N 0.00 0.92 0.77 2.17 0.02 -1.20 -2.11 113.55 114.12 1oha h SER 25 Ca -0.00 -0.50 -0.13 0.00 -0.84 0.00 0.00 61.79 60.32 1oha h SER 25 Cb 0.35 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 1oha h SER 25 CO 0.01 1.29 -0.61 0.00 -1.14 0.00 0.00 176.83 176.38 1oha h ALA 26 N 0.72 0.87 -0.29 3.77 0.00 -0.88 -2.48 119.26 120.98 1oha h ALA 26 Ca 0.01 -0.56 -0.09 0.00 0.00 0.00 0.00 54.91 54.27 1oha h ALA 26 Cb 1.16 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1oha h ALA 26 CO 0.12 0.77 -0.16 -0.07 0.00 0.00 0.00 179.25 179.91 1oha h LEU 27 N 0.00 0.64 -0.06 0.00 3.38 -0.86 -1.12 115.31 117.30 1oha h LEU 27 Ca -0.01 -0.42 -0.00 0.00 0.09 0.00 0.00 57.88 57.55 1oha h LEU 27 Cb 1.17 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.73 1oha h LEU 27 CO 0.08 0.92 0.03 0.58 0.09 0.00 0.00 178.44 180.15 1oha h VAL 28 N 0.37 1.04 -0.78 1.22 2.07 -1.35 0.91 116.25 119.73 1oha h VAL 28 Ca 0.06 -0.10 0.06 0.00 0.82 0.00 0.00 66.70 67.54 1oha h VAL 28 Cb 0.69 1.01 -0.05 0.00 -1.52 0.00 0.00 31.29 31.42 1oha h VAL 28 CO 0.05 0.03 0.51 -1.13 0.02 0.00 0.00 177.57 177.05 1oha h ASN 29 N 0.05 0.75 -0.03 0.57 -0.73 -1.39 -0.23 115.58 114.58 1oha h ASN 29 Ca 0.02 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.18 1oha h ASN 29 Cb 0.02 -0.16 -0.00 0.00 0.27 0.00 0.00 38.32 38.45 1oha h ASN 29 CO -0.00 0.49 -0.04 0.22 -0.37 0.00 0.00 177.43 177.73 1oha h TYR 30 N 0.86 0.09 -0.65 0.67 3.20 -0.72 -3.03 116.97 117.39 1oha h TYR 30 Ca 0.33 -0.03 0.05 0.00 3.14 0.00 0.00 58.73 62.22 1oha h TYR 30 Cb 0.20 -0.02 -0.05 0.00 1.54 0.00 0.00 36.73 38.40 1oha h TYR 30 CO -0.00 0.58 0.36 0.00 -1.64 0.00 0.00 178.16 177.46 1oha h ARG 31 N -0.42 0.66 0.00 1.82 3.08 -0.38 0.08 114.38 119.22 1oha h ARG 31 Ca 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1oha h ARG 31 Cb 0.56 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1oha h ARG 31 CO 0.01 0.44 0.00 0.39 -1.07 0.00 0.00 179.97 179.73 1oha n GLU 32 N -4.79 0.85 0.00 0.04 -0.58 -0.14 -3.37 120.64 112.65 1oha n GLU 32 Ca 0.08 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.82 1oha n GLU 32 Cb 0.16 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.57 1oha n GLU 32 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1oha n SER 33 N -0.96 0.75 -3.90 1.62 3.41 -0.44 -5.05 113.62 109.04 1oha n SER 33 Ca 0.19 -1.25 -0.12 0.00 -0.26 0.00 0.00 58.87 57.43 1oha n SER 33 Cb 0.09 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 63.90 1oha n SER 33 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1oha s HIS 34 N -0.25 0.10 -0.78 7.33 3.76 -0.11 -5.04 115.29 120.30 1oha s HIS 34 Ca 0.00 -0.14 0.25 0.00 -0.15 0.00 0.00 55.06 55.02 1oha s HIS 34 Cb 0.00 -0.07 0.49 0.00 1.11 0.00 0.00 32.58 34.11 1oha s HIS 34 CO 0.00 -0.05 1.42 1.04 -0.85 0.00 0.00 174.74 176.31 1oha n GLN 35 N 2.70 0.18 -2.02 1.40 1.13 -1.26 -4.73 117.38 114.78 1oha n GLN 35 Ca -0.15 0.06 -0.42 0.00 -1.94 0.00 0.00 57.00 54.55 1oha n GLN 35 Cb 0.59 -1.62 -0.03 0.00 0.11 0.00 0.00 30.24 29.29 1oha n GLN 35 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1oha s ARG 36 N -3.10 4.19 0.28 -1.09 3.52 -1.26 -4.75 118.95 116.74 1oha s ARG 36 Ca 0.08 2.19 -0.29 0.00 -0.13 0.00 0.00 55.73 57.58 1oha s ARG 36 Cb 0.15 -3.90 -0.10 0.00 -1.56 0.00 0.00 34.95 29.54 1oha s ARG 36 CO 0.69 -0.81 1.34 -1.25 -0.81 0.00 0.00 175.30 174.46 1oha s PRO 37 N 3.71 4.34 0.06 5.12 0.04 -1.26 -4.85 135.00 142.16 1oha s PRO 37 Ca 0.73 2.20 0.01 0.00 0.04 0.00 0.00 61.00 63.98 1oha s PRO 37 Cb -0.34 -3.11 -0.04 0.00 0.04 0.00 0.00 34.50 31.05 1oha s PRO 37 CO 0.30 -0.25 0.13 -0.51 0.04 0.00 0.00 177.00 176.70 1oha s LEU 38 N -1.07 4.04 -0.02 -3.56 1.43 -1.26 -1.44 118.68 116.80 1oha s LEU 38 Ca 0.53 0.13 0.01 0.00 -1.03 0.00 0.00 54.13 53.76 1oha s LEU 38 Cb -0.40 -2.62 0.02 0.00 0.03 0.00 0.00 46.19 43.22 1oha s LEU 38 CO 0.47 0.19 -0.01 -0.69 0.23 0.00 0.00 176.35 176.54 1oha s VAL 39 N -1.40 0.19 -0.12 -1.59 1.01 -0.82 -4.29 120.40 113.39 1oha s VAL 39 Ca 0.30 0.00 -0.02 0.00 0.00 0.00 0.00 61.98 62.27 1oha s VAL 39 Cb -0.12 -0.24 -0.03 0.00 0.00 0.00 0.00 36.38 35.99 1oha s VAL 39 CO 0.23 0.11 -0.06 -0.63 0.00 0.00 0.00 175.10 174.75 1oha s ILE 40 N 0.57 3.75 -0.08 2.22 1.01 -0.26 -0.53 121.20 127.89 1oha s ILE 40 Ca -0.06 -0.43 0.04 0.00 0.00 0.00 0.00 60.65 60.21 1oha s ILE 40 Cb -0.09 -2.60 -0.00 0.00 0.01 0.00 0.00 42.46 39.79 1oha s ILE 40 CO -0.01 0.54 -0.22 -0.69 0.00 0.00 0.00 174.94 174.56 1oha s VAL 41 N -0.12 1.86 0.16 2.92 1.01 -0.73 -0.17 120.40 125.34 1oha s VAL 41 Ca 0.02 -0.93 0.08 0.00 0.00 0.00 0.00 61.98 61.15 1oha s VAL 41 Cb -0.13 -1.60 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 1oha s VAL 41 CO 0.03 0.52 -0.17 -1.38 0.00 0.00 0.00 175.10 174.09 1oha s HIS 42 N 0.19 1.74 0.00 5.22 -3.43 -0.50 -0.53 115.29 117.98 1oha s HIS 42 Ca -0.12 -0.50 0.00 0.00 -0.80 0.00 0.00 55.06 53.64 1oha s HIS 42 Cb -0.16 -0.86 0.00 0.00 -1.43 0.00 0.00 32.58 30.13 1oha s HIS 42 CO 0.06 0.30 0.00 0.41 -2.00 0.00 0.00 174.74 173.51 1oha n GLY 43 N 0.24 2.27 0.00 -1.38 0.00 -0.19 -3.81 105.19 102.31 1oha n GLY 43 Ca -0.13 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.87 1oha n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oha n GLY 44 N 5.00 0.00 0.45 -0.02 0.00 -1.26 -4.92 105.19 104.43 1oha n GLY 44 Ca 0.00 0.00 0.26 0.00 0.00 0.00 0.00 46.02 46.28 1oha n GLY 44 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1oha h GLY 45 N 0.00 0.00 0.80 -0.02 0.00 -1.98 0.84 103.07 102.71 1oha h GLY 45 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 1oha h GLY 45 CO 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 176.54 176.30 1oha h VAL 47 N 0.08 0.96 -0.02 0.00 2.07 -1.24 -1.50 116.25 116.61 1oha h VAL 47 Ca 0.02 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.29 1oha h VAL 47 Cb 0.80 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1oha h VAL 47 CO 0.05 0.12 -0.04 0.58 0.02 0.00 0.00 177.57 178.31 1oha h VAL 48 N 0.67 1.44 -0.49 2.57 2.07 -1.35 -2.49 116.25 118.68 1oha h VAL 48 Ca 0.33 -1.37 0.12 0.00 0.82 0.00 0.00 66.70 66.59 1oha h VAL 48 Cb 0.40 2.32 -0.02 0.00 -1.52 0.00 0.00 31.29 32.47 1oha h VAL 48 CO -0.11 0.36 0.34 0.44 0.02 0.00 0.00 177.57 178.62 1oha h ASP 49 N -0.49 0.11 -0.01 0.57 3.32 -0.59 -0.73 116.42 118.61 1oha h ASP 49 Ca 0.00 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.93 1oha h ASP 49 Cb 0.61 -0.02 0.01 0.00 0.22 0.00 0.00 39.33 40.15 1oha h ASP 49 CO 0.01 0.07 -0.46 -0.33 -1.72 0.00 0.00 179.24 176.80 1oha h GLU 50 N 0.13 0.33 0.00 3.56 5.08 -1.27 -3.12 114.58 119.29 1oha h GLU 50 Ca 0.23 -0.34 -0.03 0.00 -1.00 0.00 0.00 59.36 58.22 1oha h GLU 50 Cb 0.74 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.09 1oha h GLU 50 CO -0.03 1.03 -0.13 1.25 -1.00 0.00 0.00 179.01 180.13 1oha h LEU 51 N -0.23 0.00 0.00 1.33 5.85 -0.87 -0.96 115.31 120.43 1oha h LEU 51 Ca -0.06 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1oha h LEU 51 Cb 1.18 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1oha h LEU 51 CO 0.09 0.13 -0.05 0.24 -0.34 0.00 0.00 178.44 178.50 1oha h MET 52 N 0.00 0.00 0.00 1.25 2.86 -1.19 -2.44 114.93 115.41 1oha h MET 52 Ca -0.00 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.57 1oha h MET 52 Cb 0.33 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 1oha h MET 52 CO 0.02 0.00 -0.45 -0.22 1.06 0.00 0.00 176.91 177.32 1oha h LYS 53 N 0.00 0.00 -0.03 1.72 3.64 -1.14 1.77 116.57 122.52 1oha h LYS 53 Ca 0.00 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1oha h LYS 53 Cb 0.78 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.60 1oha h LYS 53 CO 0.00 0.66 0.13 0.78 -2.27 0.00 0.00 179.45 178.75 1oha h GLY 54 N -1.00 0.00 0.30 5.01 0.00 -1.37 0.60 103.07 106.61 1oha h GLY 54 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1oha h GLY 54 CO -0.06 0.00 -1.21 1.04 0.00 0.00 0.00 176.54 176.31 1oha n LEU 55 N -3.20 0.60 -2.32 3.11 4.77 -0.92 -4.99 117.00 114.04 1oha n LEU 55 Ca -0.02 -0.16 -0.13 0.00 -0.03 0.00 0.00 56.01 55.68 1oha n LEU 55 Cb 0.20 -0.05 0.05 0.00 -2.33 0.00 0.00 43.42 41.29 1oha n LEU 55 CO 0.20 0.10 0.12 -3.20 -1.33 0.00 0.00 177.39 173.28 1oha n ASN 56 N -1.88 -3.80 -4.67 -1.43 5.15 0.21 -5.04 115.26 103.80 1oha n ASN 56 Ca 0.01 -0.33 -0.26 0.00 -0.60 0.00 0.00 54.58 53.41 1oha n ASN 56 Cb 0.43 -3.13 -0.07 0.00 -0.53 0.00 0.00 39.78 36.47 1oha n ASN 56 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1oha s LEU 57 N -4.61 3.32 0.49 1.20 1.43 0.58 -4.99 118.68 116.11 1oha s LEU 57 Ca 0.24 -0.43 -0.09 0.00 -1.03 0.00 0.00 54.13 52.82 1oha s LEU 57 Cb -0.11 -1.94 -0.05 0.00 0.03 0.00 0.00 46.19 44.12 1oha s LEU 57 CO 0.42 0.07 0.85 -2.16 0.23 0.00 0.00 176.35 175.76 1oha s PRO 58 N -3.13 3.66 -0.18 1.29 0.04 -1.26 -4.54 135.00 130.88 1oha s PRO 58 Ca 0.28 0.46 0.00 0.00 0.04 0.00 0.00 61.00 61.79 1oha s PRO 58 Cb -0.09 -2.30 0.04 0.00 0.04 0.00 0.00 34.50 32.19 1oha s PRO 58 CO 0.19 -0.23 -0.11 0.14 0.04 0.00 0.00 177.00 177.03 1oha s VAL 59 N -2.71 1.53 -0.10 -0.36 -7.23 -1.26 -5.09 120.40 105.18 1oha s VAL 59 Ca 0.51 -0.84 0.03 0.00 -1.81 0.00 0.00 61.98 59.87 1oha s VAL 59 Cb -0.10 -1.58 0.01 0.00 0.56 0.00 0.00 36.38 35.27 1oha s VAL 59 CO 0.41 0.25 -0.19 -0.75 -0.31 0.00 0.00 175.10 174.51 1oha s LYS 60 N 1.46 2.60 -0.24 4.82 2.47 -1.26 -5.07 119.74 124.52 1oha s LYS 60 Ca 0.01 -0.71 0.02 0.00 -1.56 0.00 0.00 55.97 53.72 1oha s LYS 60 Cb -0.15 -2.07 0.05 0.00 -1.46 0.00 0.00 37.83 34.21 1oha s LYS 60 CO -0.09 0.05 -0.10 0.15 0.16 0.00 0.00 175.35 175.53 1oha s LYS 61 N 0.65 2.09 -1.00 4.03 1.02 -1.26 -0.38 119.74 124.89 1oha s LYS 61 Ca -0.13 -1.13 -0.21 0.00 0.02 0.00 0.00 55.97 54.52 1oha s LYS 61 Cb -0.16 -2.71 0.08 0.00 -0.52 0.00 0.00 37.83 34.52 1oha s LYS 61 CO 0.03 -0.53 1.35 0.15 -0.92 0.00 0.00 175.35 175.43 1oha s LYS 62 N 1.24 3.61 -0.85 1.68 1.02 -0.02 -4.21 119.74 122.21 1oha s LYS 62 Ca -0.06 -1.39 -0.03 0.00 0.02 0.00 0.00 55.97 54.51 1oha s LYS 62 Cb -0.19 -5.21 -0.03 0.00 -0.52 0.00 0.00 37.83 31.88 1oha s LYS 62 CO -0.06 -2.06 0.73 0.09 -0.92 0.00 0.00 175.35 173.13 1oha n ASN 63 N 8.02 -4.30 0.00 2.83 3.02 -1.26 -3.46 115.26 120.11 1oha n ASN 63 Ca 0.30 -0.52 0.00 0.00 -0.03 0.00 0.00 54.58 54.33 1oha n ASN 63 Cb 0.50 -4.12 0.00 0.00 -0.61 0.00 0.00 39.78 35.55 1oha n ASN 63 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1oha n GLY 64 N -1.22 3.00 3.70 7.41 0.00 -1.26 -4.78 105.19 112.03 1oha n GLY 64 Ca -0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 1oha n GLY 64 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1oha s LEU 65 N 0.00 4.18 -0.07 0.99 1.43 -1.22 -4.77 118.68 119.21 1oha s LEU 65 Ca 0.00 0.23 -0.30 0.00 -1.03 0.00 0.00 54.13 53.04 1oha s LEU 65 Cb 0.00 -2.15 -0.04 0.00 0.03 0.00 0.00 46.19 44.03 1oha s LEU 65 CO 0.00 0.11 1.38 -0.60 0.23 0.00 0.00 176.35 177.47 1oha s ARG 66 N 0.68 4.26 0.06 1.70 3.52 -1.26 -0.84 118.95 127.07 1oha s ARG 66 Ca 0.09 1.87 -0.31 0.00 -0.13 0.00 0.00 55.73 57.26 1oha s ARG 66 Cb -0.12 -3.71 -0.08 0.00 -1.56 0.00 0.00 34.95 29.48 1oha s ARG 66 CO 0.02 -0.65 1.67 0.08 -0.81 0.00 0.00 175.30 175.60 1oha s VAL 67 N 3.02 3.07 -0.48 7.11 1.01 0.49 -4.86 120.40 129.76 1oha s VAL 67 Ca 0.62 0.48 0.04 0.00 0.00 0.00 0.00 61.98 63.11 1oha s VAL 67 Cb -0.28 -3.31 0.13 0.00 0.00 0.00 0.00 36.38 32.92 1oha s VAL 67 CO 0.23 -0.01 0.23 -0.89 0.00 0.00 0.00 175.10 174.66 1oha s THR 68 N 2.80 2.40 0.75 3.92 2.01 0.60 -4.76 115.64 123.36 1oha s THR 68 Ca 0.74 -3.09 -0.13 0.00 0.31 0.00 0.00 61.69 59.52 1oha s THR 68 Cb -0.39 -2.68 0.05 0.00 0.01 0.00 0.00 72.50 69.48 1oha s THR 68 CO 0.32 -0.78 1.15 -2.84 -0.69 0.00 0.00 174.62 171.78 1oha s PRO 69 N -0.04 2.13 0.54 4.92 0.02 -1.26 0.65 135.00 141.96 1oha s PRO 69 Ca 0.16 1.52 0.24 0.00 0.02 0.00 0.00 61.00 62.94 1oha s PRO 69 Cb -0.25 -1.86 1.43 0.00 0.02 0.00 0.00 34.50 33.85 1oha s PRO 69 CO -0.01 -1.79 2.07 0.00 -0.33 0.00 0.00 177.00 176.93 1oha h ALA 70 N -0.64 2.17 -0.07 -1.55 0.00 -1.96 0.06 119.26 117.27 1oha h ALA 70 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1oha h ALA 70 Cb 1.27 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1oha h ALA 70 CO 0.50 -0.37 0.00 -0.40 0.00 0.00 0.00 179.25 178.98 1oha n ASP 71 N -4.27 0.59 0.00 0.00 5.75 -1.26 -3.65 116.55 113.71 1oha n ASP 71 Ca 0.04 -1.62 0.00 0.00 -0.01 0.00 0.00 54.79 53.20 1oha n ASP 71 Cb 0.38 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.43 1oha n ASP 71 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1oha n GLN 72 N -0.35 4.08 -0.05 0.11 6.02 -0.02 -4.79 117.38 122.38 1oha n GLN 72 Ca 0.12 -0.02 0.00 0.00 -0.01 0.00 0.00 57.00 57.09 1oha n GLN 72 Cb 0.14 -0.36 0.29 0.00 1.02 0.00 0.00 30.24 31.34 1oha n GLN 72 CO 0.00 0.00 0.00 0.97 -1.01 0.00 0.00 177.06 177.02 1oha h ILE 73 N 0.03 1.19 -0.45 5.09 6.09 -1.54 -1.19 117.51 126.72 1oha h ILE 73 Ca 0.00 -0.64 -0.13 0.00 -1.37 0.00 0.00 64.86 62.72 1oha h ILE 73 Cb 0.01 0.73 -0.01 0.00 0.47 0.00 0.00 36.82 38.02 1oha h ILE 73 CO 0.00 0.24 -0.22 0.44 -3.07 0.00 0.00 178.15 175.54 1oha h ASP 74 N 0.62 0.97 -0.45 2.19 3.32 -1.87 0.19 116.42 121.40 1oha h ASP 74 Ca 0.15 -0.40 -0.07 0.00 0.02 0.00 0.00 57.03 56.72 1oha h ASP 74 Cb 0.21 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 1oha h ASP 74 CO -0.01 1.16 -0.01 0.40 -1.72 0.00 0.00 179.24 179.07 1oha h ILE 75 N 0.78 1.26 -0.53 0.35 1.08 -1.81 -1.21 117.51 117.43 1oha h ILE 75 Ca 0.10 -1.05 -0.09 0.00 -0.39 0.00 0.00 64.86 63.43 1oha h ILE 75 Cb 0.79 1.06 -0.02 0.00 -3.07 0.00 0.00 36.82 35.58 1oha h ILE 75 CO 0.07 0.36 -0.02 0.40 -0.69 0.00 0.00 178.15 178.27 1oha h ILE 76 N 0.63 1.27 -0.91 -0.67 2.04 -1.15 -1.58 117.51 117.14 1oha h ILE 76 Ca 0.13 -1.13 -0.02 0.00 1.00 0.00 0.00 64.86 64.84 1oha h ILE 76 Cb 0.50 0.93 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 1oha h ILE 76 CO 0.02 0.40 0.50 0.74 0.00 0.00 0.00 178.15 179.81 1oha h THR 77 N 0.83 1.26 -0.28 -0.27 2.02 -0.83 -0.15 112.91 115.48 1oha h THR 77 Ca 0.15 -0.65 -0.01 0.00 0.77 0.00 0.00 66.41 66.68 1oha h THR 77 Cb 0.56 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 1oha h THR 77 CO 0.03 0.29 0.15 1.23 0.37 0.00 0.00 175.52 177.59 1oha h GLY 78 N 1.27 0.43 0.89 2.16 0.00 -0.86 0.16 103.07 107.12 1oha h GLY 78 Ca 0.32 -0.20 -0.05 0.00 0.00 0.00 0.00 47.33 47.40 1oha h GLY 78 CO -0.05 0.19 0.02 0.00 0.00 0.00 0.00 176.54 176.70 1oha h ALA 79 N 1.01 0.43 0.00 3.60 0.00 -0.77 -0.36 119.26 123.17 1oha h ALA 79 Ca 0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1oha h ALA 79 Cb 0.09 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1oha h ALA 79 CO -0.01 0.16 -0.28 -0.07 0.00 0.00 0.00 179.25 179.05 1oha h LEU 80 N 0.36 0.00 -0.95 0.00 3.38 -0.99 0.04 115.31 117.14 1oha h LEU 80 Ca 0.09 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 1oha h LEU 80 Cb 0.41 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1oha h LEU 80 CO 0.01 0.75 -0.16 0.00 0.09 0.00 0.00 178.44 179.13 1oha h ALA 81 N -0.80 0.98 -3.00 1.53 0.00 -0.87 -2.81 119.26 114.29 1oha h ALA 81 Ca -0.04 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1oha h ALA 81 Cb 0.43 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1oha h ALA 81 CO -0.02 0.20 0.00 0.41 0.00 0.00 0.00 179.25 179.84 1oha n GLY 82 N 0.35 -0.39 0.41 0.00 0.00 -0.80 -4.44 105.19 100.32 1oha n GLY 82 Ca 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 1oha n GLY 82 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1oha h THR 83 N 0.00 0.16 -0.24 2.61 2.02 -1.05 0.90 112.91 117.31 1oha h THR 83 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1oha h THR 83 Cb 0.00 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.56 1oha h THR 83 CO 0.00 0.00 0.15 0.00 0.37 0.00 0.00 175.52 176.04 1oha h ALA 84 N -0.19 0.30 -0.06 6.16 0.00 -1.08 -0.89 119.26 123.51 1oha h ALA 84 Ca 0.02 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1oha h ALA 84 Cb 0.68 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1oha h ALA 84 CO -0.23 -0.21 0.03 -0.97 0.00 0.00 0.00 179.25 177.87 1oha h ASN 85 N 0.31 0.07 0.85 0.00 -0.73 -1.35 -2.56 115.58 112.17 1oha h ASN 85 Ca 0.09 -0.07 -0.05 0.00 1.87 0.00 0.00 56.30 58.14 1oha h ASN 85 Cb -0.01 -0.02 -0.01 0.00 0.27 0.00 0.00 38.32 38.56 1oha h ASN 85 CO -0.02 0.11 -0.26 0.11 -0.37 0.00 0.00 177.43 177.01 1oha h LYS 86 N 0.01 0.00 -0.39 6.67 6.56 -0.76 -1.87 116.57 126.80 1oha h LYS 86 Ca 0.02 0.00 -0.08 0.00 -1.06 0.00 0.00 60.65 59.53 1oha h LYS 86 Cb 0.06 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.71 1oha h LYS 86 CO -0.00 0.26 -0.06 1.15 -2.06 0.00 0.00 179.45 178.73 1oha h THR 87 N 0.00 1.27 -0.30 -0.16 2.02 -0.97 -1.21 112.91 113.56 1oha h THR 87 Ca -0.00 -1.11 -0.10 0.00 0.77 0.00 0.00 66.41 65.96 1oha h THR 87 Cb 0.75 1.21 -0.01 0.00 -1.74 0.00 0.00 68.15 68.35 1oha h THR 87 CO 0.03 0.37 -0.25 -0.07 0.37 0.00 0.00 175.52 175.98 1oha h LEU 88 N 0.54 0.60 -1.27 2.58 3.38 -1.16 -2.14 115.31 117.83 1oha h LEU 88 Ca 0.10 -0.21 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 1oha h LEU 88 Cb 0.56 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1oha h LEU 88 CO 0.03 0.84 -0.22 -0.07 0.09 0.00 0.00 178.44 179.10 1oha h LEU 89 N 0.52 0.21 -0.35 1.67 3.38 -1.13 -1.28 115.31 118.34 1oha h LEU 89 Ca 0.07 -0.06 -0.16 0.00 0.09 0.00 0.00 57.88 57.83 1oha h LEU 89 Cb 0.70 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 1oha h LEU 89 CO 0.05 0.45 -0.41 0.00 0.09 0.00 0.00 178.44 178.62 1oha h ALA 90 N 1.57 0.52 -0.63 1.53 0.00 -0.73 -1.29 119.26 120.23 1oha h ALA 90 Ca 0.03 -0.46 -0.09 0.00 0.00 0.00 0.00 54.91 54.39 1oha h ALA 90 Cb 0.51 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1oha h ALA 90 CO 0.03 0.64 0.04 -1.49 0.00 0.00 0.00 179.25 178.47 1oha h TRP 91 N 0.70 1.18 -0.53 0.00 4.06 -1.12 -0.08 115.95 120.15 1oha h TRP 91 Ca 0.05 -0.19 -0.01 0.00 2.06 0.00 0.00 58.89 60.80 1oha h TRP 91 Cb 1.01 -0.31 -0.02 0.00 -1.00 0.00 0.00 29.16 28.83 1oha h TRP 91 CO 0.07 1.02 0.29 0.00 -3.56 0.00 0.00 178.44 176.25 1oha h ALA 92 N 1.02 0.67 -0.60 1.49 0.00 -1.10 -1.88 119.26 118.86 1oha h ALA 92 Ca 0.18 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1oha h ALA 92 Cb 0.52 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1oha h ALA 92 CO 0.02 0.19 0.32 -0.22 0.00 0.00 0.00 179.25 179.57 1oha h LYS 93 N 0.70 0.85 -0.68 0.00 1.63 -0.95 0.14 116.57 118.26 1oha h LYS 93 Ca 0.18 -0.10 0.11 0.00 -0.85 0.00 0.00 60.65 59.99 1oha h LYS 93 Cb 0.05 -0.16 -0.04 0.00 -0.60 0.00 0.00 32.23 31.47 1oha h LYS 93 CO -0.03 0.65 0.45 -0.22 -3.45 0.00 0.00 179.45 176.85 1oha h LYS 94 N 0.82 0.47 -0.67 1.90 3.64 -0.60 -1.28 116.57 120.86 1oha h LYS 94 Ca 0.21 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.51 1oha h LYS 94 Cb 0.06 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 1oha h LYS 94 CO -0.03 0.31 0.06 0.72 -2.27 0.00 0.00 179.45 178.25 1oha n HIS 95 N -4.48 1.96 -2.17 1.91 8.25 -0.62 -4.93 115.22 115.14 1oha n HIS 95 Ca 0.12 -0.76 -0.20 0.00 -0.26 0.00 0.00 57.72 56.61 1oha n HIS 95 Cb 0.39 -0.51 -0.03 0.00 1.12 0.00 0.00 29.99 30.96 1oha n HIS 95 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1oha n GLN 96 N 0.39 -1.57 -3.31 -0.41 3.00 -0.48 -4.97 117.38 110.03 1oha n GLN 96 Ca 0.28 1.05 -0.39 0.00 -0.01 0.00 0.00 57.00 57.93 1oha n GLN 96 Cb 1.15 -5.62 -0.07 0.00 0.00 0.00 0.00 30.24 25.70 1oha n GLN 96 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1oha s ILE 97 N -2.95 5.14 -0.67 5.09 -1.09 0.41 -5.00 121.20 122.12 1oha s ILE 97 Ca 0.00 0.82 -0.27 0.00 -2.23 0.00 0.00 60.65 58.97 1oha s ILE 97 Cb 0.00 -3.79 0.03 0.00 -1.58 0.00 0.00 42.46 37.13 1oha s ILE 97 CO 0.00 0.18 1.20 0.00 -1.23 0.00 0.00 174.94 175.09 1oha s ALA 98 N 1.72 2.89 0.33 9.38 0.00 -1.26 -4.03 121.76 130.79 1oha s ALA 98 Ca 0.21 -1.24 0.09 0.00 0.00 0.00 0.00 51.96 51.01 1oha s ALA 98 Cb -0.15 -4.12 -0.05 0.00 0.00 0.00 0.00 23.12 18.80 1oha s ALA 98 CO 0.09 -2.98 0.02 0.00 0.00 0.00 0.00 175.76 172.88 1oha s ALA 99 N 5.21 3.22 -0.04 0.00 0.00 -1.26 -1.22 121.76 127.66 1oha s ALA 99 Ca 0.36 -1.91 -0.02 0.00 0.00 0.00 0.00 51.96 50.40 1oha s ALA 99 Cb -0.09 -0.46 0.03 0.00 0.00 0.00 0.00 23.12 22.60 1oha s ALA 99 CO 0.18 0.10 0.04 0.08 0.00 0.00 0.00 175.76 176.16 1oha s VAL 100 N -2.48 0.01 0.17 0.00 1.01 -0.73 -4.84 120.40 113.55 1oha s VAL 100 Ca 0.35 0.33 -0.28 0.00 0.00 0.00 0.00 61.98 62.37 1oha s VAL 100 Cb -0.01 -0.23 -0.08 0.00 0.00 0.00 0.00 36.38 36.06 1oha s VAL 100 CO 0.20 0.19 0.89 -0.83 0.00 0.00 0.00 175.10 175.54 1oha s GLY 101 N 1.96 3.02 0.13 4.51 0.00 -1.26 -1.37 107.32 114.31 1oha s GLY 101 Ca 0.03 0.52 -0.04 0.00 0.00 0.00 0.00 44.72 45.22 1oha s GLY 101 CO -0.03 1.16 0.13 1.08 0.00 0.00 0.00 173.10 175.44 1oha s LEU 102 N -0.80 1.57 0.40 0.66 1.43 -0.20 -4.92 118.68 116.82 1oha s LEU 102 Ca 0.41 -1.03 0.04 0.00 -1.03 0.00 0.00 54.13 52.52 1oha s LEU 102 Cb -0.24 0.63 -0.05 0.00 0.03 0.00 0.00 46.19 46.55 1oha s LEU 102 CO 0.29 -0.77 0.04 0.72 0.23 0.00 0.00 176.35 176.87 1oha s PHE 103 N -3.99 2.11 0.52 0.29 -0.00 -1.26 -1.33 117.98 114.31 1oha s PHE 103 Ca 0.18 -0.91 0.21 0.00 -0.00 0.00 0.00 56.93 56.42 1oha s PHE 103 Cb 0.06 -1.50 1.33 0.00 -0.00 0.00 0.00 43.02 42.91 1oha s PHE 103 CO -0.01 0.16 2.05 -0.07 -0.00 0.00 0.00 175.22 177.34 1oha h LEU 104 N 1.79 0.02 -0.56 -1.99 3.38 -1.34 -2.36 115.31 114.26 1oha h LEU 104 Ca -0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1oha h LEU 104 Cb 1.26 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 1oha h LEU 104 CO 0.73 0.01 0.00 1.23 0.09 0.00 0.00 178.44 180.50 1oha h GLY 105 N 0.03 0.00 -5.24 0.83 0.00 -1.80 -2.26 103.07 94.63 1oha h GLY 105 Ca 0.17 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.97 1oha h GLY 105 CO -0.01 0.00 1.16 0.99 0.00 0.00 0.00 176.54 178.69 1oha s ASP 106 N -5.91 6.50 -1.25 0.19 1.01 -0.89 -1.11 116.67 115.21 1oha s ASP 106 Ca 0.05 2.59 0.00 0.00 0.71 0.00 0.00 52.55 55.89 1oha s ASP 106 Cb 0.07 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.46 1oha s ASP 106 CO 0.61 -1.01 0.00 0.61 0.21 0.00 0.00 175.17 175.60 1oha n GLY 107 N 4.36 1.22 3.88 0.21 0.00 -1.26 -2.22 105.19 111.38 1oha n GLY 107 Ca 0.19 -0.19 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 1oha n GLY 107 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1oha n ASP 108 N -0.64 -4.49 -0.12 1.61 8.00 -0.27 -4.46 116.55 116.19 1oha n ASP 108 Ca -0.12 -0.76 -0.05 0.00 0.71 0.00 0.00 54.79 54.58 1oha n ASP 108 Cb 0.49 -3.61 0.02 0.00 -0.02 0.00 0.00 41.12 38.00 1oha n ASP 108 CO 0.00 0.00 0.00 -1.28 -0.39 0.00 0.00 177.20 175.53 1oha h SER 109 N -1.82 -0.35 -3.31 -2.24 0.87 -1.24 -0.22 113.55 105.23 1oha h SER 109 Ca -0.56 0.12 -0.49 0.00 -1.23 0.00 0.00 61.79 59.62 1oha h SER 109 Cb 1.37 0.24 -0.35 0.00 -0.44 0.00 0.00 62.40 63.22 1oha h SER 109 CO 0.67 -0.13 -0.80 -0.69 -0.53 0.00 0.00 176.83 175.36 1oha s VAL 110 N -6.21 0.91 0.18 2.23 1.01 -0.87 -2.22 120.40 115.42 1oha s VAL 110 Ca -0.14 -0.28 -0.30 0.00 0.00 0.00 0.00 61.98 61.27 1oha s VAL 110 Cb 0.15 -0.91 -0.08 0.00 0.00 0.00 0.00 36.38 35.54 1oha s VAL 110 CO 0.71 0.33 1.13 -0.54 0.00 0.00 0.00 175.10 176.73 1oha s LYS 111 N 1.27 4.56 -0.02 2.72 -0.14 0.21 -4.55 119.74 123.79 1oha s LYS 111 Ca -0.04 1.77 0.02 0.00 -1.36 0.00 0.00 55.97 56.36 1oha s LYS 111 Cb -0.14 -3.26 0.00 0.00 -1.68 0.00 0.00 37.83 32.75 1oha s LYS 111 CO -0.03 0.02 -0.06 0.08 -0.76 0.00 0.00 175.35 174.60 1oha s VAL 112 N -0.18 0.50 0.14 3.17 1.01 -1.26 -0.87 120.40 122.92 1oha s VAL 112 Ca 0.51 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 62.28 1oha s VAL 112 Cb -0.30 -0.46 -0.04 0.00 0.00 0.00 0.00 36.38 35.57 1oha s VAL 112 CO 0.36 0.17 -0.01 0.42 0.00 0.00 0.00 175.10 176.03 1oha s THR 113 N 0.19 0.58 0.03 3.92 -4.23 -0.98 -4.09 115.64 111.05 1oha s THR 113 Ca -0.02 -1.95 -0.30 0.00 -1.18 0.00 0.00 61.69 58.24 1oha s THR 113 Cb -0.06 -1.95 -0.07 0.00 1.34 0.00 0.00 72.50 71.76 1oha s THR 113 CO -0.00 -0.62 1.55 -1.58 -0.54 0.00 0.00 174.62 173.43 1oha s GLN 114 N -3.91 4.23 -0.04 3.99 0.74 -1.26 0.01 119.66 123.42 1oha s GLN 114 Ca 0.19 2.17 -0.25 0.00 0.05 0.00 0.00 55.36 57.52 1oha s GLN 114 Cb 0.06 -3.63 -0.22 0.00 1.10 0.00 0.00 33.01 30.33 1oha s GLN 114 CO 0.00 -0.68 1.11 1.25 -0.55 0.00 0.00 175.29 176.43 1oha h LEU 115 N 8.64 0.14 -7.05 3.68 5.85 -1.61 -3.44 115.31 121.51 1oha h LEU 115 Ca -0.40 -0.67 -0.01 0.00 0.84 0.00 0.00 57.88 57.63 1oha h LEU 115 Cb 1.19 -0.04 -0.22 0.00 0.37 0.00 0.00 40.66 41.96 1oha h LEU 115 CO 0.92 0.79 -0.04 -0.62 -0.34 0.00 0.00 178.44 179.15 1oha s ASP 116 N -6.07 -0.84 0.60 1.25 2.15 -1.26 -5.01 116.67 107.50 1oha s ASP 116 Ca -0.16 1.38 0.31 0.00 0.43 0.00 0.00 52.55 54.50 1oha s ASP 116 Cb 0.01 1.26 1.83 0.00 -0.30 0.00 0.00 42.92 45.72 1oha s ASP 116 CO 0.71 -0.23 2.20 1.05 -0.17 0.00 0.00 175.17 178.74 1oha h GLU 117 N 6.85 0.00 0.00 4.34 4.11 -1.91 0.60 114.58 128.57 1oha h GLU 117 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.12 1oha h GLU 117 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1oha h GLU 117 CO 0.18 0.00 0.00 0.93 0.07 0.00 0.00 179.01 180.19 1oha h GLU 118 N 0.00 0.00 0.00 1.06 5.08 -2.02 -2.89 114.58 115.82 1oha h GLU 118 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1oha h GLU 118 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1oha h GLU 118 CO -0.00 0.00 -1.34 1.28 -1.00 0.00 0.00 179.01 177.95 1oha n LEU 119 N -3.08 0.49 0.00 1.33 4.77 0.19 -4.95 117.00 115.75 1oha n LEU 119 Ca 0.00 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1oha n LEU 119 Cb 0.28 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1oha n LEU 119 CO 0.26 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 1oha n GLY 120 N 1.32 0.48 2.23 -0.72 0.00 -1.09 -0.29 105.19 107.12 1oha n GLY 120 Ca -0.00 -1.01 -0.30 0.00 0.00 0.00 0.00 46.02 44.70 1oha n GLY 120 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1oha n HIS 121 N 9.42 1.63 -4.23 1.61 8.25 0.21 -4.73 115.22 127.38 1oha n HIS 121 Ca 0.00 -2.52 -0.34 0.00 -0.26 0.00 0.00 57.72 54.60 1oha n HIS 121 Cb 0.00 -2.11 -0.11 0.00 1.12 0.00 0.00 29.99 28.89 1oha n HIS 121 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1oha s VAL 122 N 1.32 4.29 0.13 1.59 1.01 -1.26 -0.47 120.40 127.01 1oha s VAL 122 Ca 0.67 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 62.46 1oha s VAL 122 Cb 0.23 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.68 1oha s VAL 122 CO -0.05 0.48 0.25 -0.83 0.00 0.00 0.00 175.10 174.95 1oha s GLY 123 N 0.33 1.84 -0.29 4.51 0.00 -0.27 -1.69 107.32 111.75 1oha s GLY 123 Ca -0.01 -1.00 -0.11 0.00 0.00 0.00 0.00 44.72 43.61 1oha s GLY 123 CO 0.02 -0.99 0.18 -2.27 0.00 0.00 0.00 173.10 170.04 1oha s LEU 124 N -3.02 4.05 -0.09 0.66 2.96 0.10 -4.66 118.68 118.68 1oha s LEU 124 Ca 0.34 -0.16 -0.13 0.00 -0.22 0.00 0.00 54.13 53.96 1oha s LEU 124 Cb -0.11 -2.09 -0.05 0.00 0.50 0.00 0.00 46.19 44.44 1oha s LEU 124 CO 0.28 -0.10 0.31 0.00 -1.32 0.00 0.00 176.35 175.52 1oha s ALA 125 N 1.72 3.70 0.05 5.97 0.00 -1.26 -2.32 121.76 129.63 1oha s ALA 125 Ca 0.07 -0.40 -0.03 0.00 0.00 0.00 0.00 51.96 51.60 1oha s ALA 125 Cb -0.16 -2.29 -0.03 0.00 0.00 0.00 0.00 23.12 20.64 1oha s ALA 125 CO 0.09 0.37 0.02 -0.65 0.00 0.00 0.00 175.76 175.60 1oha s GLN 126 N -0.51 0.63 0.27 0.00 -0.21 -0.05 -4.84 119.66 114.96 1oha s GLN 126 Ca 0.19 -1.07 -0.29 0.00 0.02 0.00 0.00 55.36 54.22 1oha s GLN 126 Cb -0.14 0.23 -0.14 0.00 1.00 0.00 0.00 33.01 33.95 1oha s GLN 126 CO 0.08 -0.14 1.04 -2.30 -2.12 0.00 0.00 175.29 171.85 1oha n PRO 127 N 0.27 1.35 0.00 2.91 -0.02 -1.26 -0.62 135.00 137.63 1oha n PRO 127 Ca -0.16 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 1oha n PRO 127 Cb 0.60 -1.87 0.00 0.00 -0.02 0.00 0.00 33.50 32.22 1oha n PRO 127 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1oha n GLY 128 N 1.35 4.97 3.71 -1.23 0.00 -0.94 -4.21 105.19 108.84 1oha n GLY 128 Ca 0.10 -1.40 -0.35 0.00 0.00 0.00 0.00 46.02 44.37 1oha n GLY 128 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1oha s SER 129 N 1.00 6.04 0.00 1.61 0.15 -0.10 -4.88 113.70 117.52 1oha s SER 129 Ca 0.00 0.20 0.27 0.00 0.70 0.00 0.00 55.95 57.13 1oha s SER 129 Cb 0.00 -2.04 1.11 0.00 -1.71 0.00 0.00 66.02 63.38 1oha s SER 129 CO 0.00 0.20 1.77 -0.81 1.20 0.00 0.00 173.24 175.60 1oha n PRO 130 N 3.40 1.59 0.10 5.44 -0.04 -1.26 -4.03 135.00 140.21 1oha n PRO 130 Ca -0.16 -0.86 -0.12 0.00 -0.04 0.00 0.00 63.50 62.31 1oha n PRO 130 Cb 0.52 -1.47 -0.05 0.00 -0.04 0.00 0.00 33.50 32.46 1oha n PRO 130 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1oha h LYS 131 N 2.06 -0.40 0.24 0.54 1.57 -1.94 0.59 116.57 119.23 1oha h LYS 131 Ca 0.00 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1oha h LYS 131 Cb 0.44 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 1oha h LYS 131 CO 0.00 -0.27 -0.15 1.25 -0.57 0.00 0.00 179.45 179.71 1oha h LEU 132 N -0.42 -0.37 -0.96 2.94 5.85 -1.84 -1.79 115.31 118.72 1oha h LEU 132 Ca 0.03 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 1oha h LEU 132 Cb 0.45 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.55 1oha h LEU 132 CO -0.14 -0.24 0.47 0.40 -0.34 0.00 0.00 178.44 178.58 1oha h ILE 133 N -0.38 1.25 -0.67 4.05 1.08 -1.85 -1.26 117.51 119.74 1oha h ILE 133 Ca -0.02 -0.63 -0.05 0.00 -0.39 0.00 0.00 64.86 63.77 1oha h ILE 133 Cb 0.31 0.09 -0.03 0.00 -3.07 0.00 0.00 36.82 34.12 1oha h ILE 133 CO 0.03 0.28 0.23 0.78 -0.69 0.00 0.00 178.15 178.78 1oha h ASN 134 N 1.20 0.94 -0.42 1.72 -0.26 -0.74 -0.16 115.58 117.87 1oha h ASN 134 Ca 0.30 -0.15 -0.10 0.00 -0.56 0.00 0.00 56.30 55.79 1oha h ASN 134 Cb 0.03 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 37.03 1oha h ASN 134 CO -0.05 0.86 -0.14 -1.28 -1.06 0.00 0.00 177.43 175.77 1oha h SER 135 N 0.98 0.85 -0.70 5.81 0.87 -0.83 -0.47 113.55 120.06 1oha h SER 135 Ca 0.22 -0.38 -0.03 0.00 -1.23 0.00 0.00 61.79 60.37 1oha h SER 135 Cb 0.25 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 61.95 1oha h SER 135 CO -0.01 1.03 0.31 -0.07 -0.53 0.00 0.00 176.83 177.56 1oha h LEU 136 N 0.65 0.94 -0.52 2.23 3.38 -0.85 -1.47 115.31 119.67 1oha h LEU 136 Ca 0.10 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1oha h LEU 136 Cb 0.68 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1oha h LEU 136 CO 0.05 0.83 0.02 -0.07 0.09 0.00 0.00 178.44 179.37 1oha h LEU 137 N 0.99 0.88 -1.86 1.67 3.38 -0.86 -1.05 115.31 118.44 1oha h LEU 137 Ca 0.24 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1oha h LEU 137 Cb 0.16 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1oha h LEU 137 CO -0.02 0.96 -0.13 -0.33 0.09 0.00 0.00 178.44 179.00 1oha h GLU 138 N 0.77 0.00 -0.32 1.13 4.39 -0.78 -2.03 114.58 117.75 1oha h GLU 138 Ca 0.15 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.85 1oha h GLU 138 Cb 0.49 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.14 1oha h GLU 138 CO 0.02 0.13 0.00 0.09 -1.16 0.00 0.00 179.01 178.10 1oha n ASN 139 N -3.80 2.40 0.00 1.42 5.03 -0.58 -4.95 115.26 114.78 1oha n ASN 139 Ca -0.02 -1.87 0.00 0.00 0.87 0.00 0.00 54.58 53.56 1oha n ASN 139 Cb 0.24 -0.21 0.00 0.00 -1.02 0.00 0.00 39.78 38.79 1oha n ASN 139 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1oha n GLY 140 N 1.27 0.59 3.93 7.41 0.00 -0.76 -5.06 105.19 112.57 1oha n GLY 140 Ca 0.17 -0.53 -0.28 0.00 0.00 0.00 0.00 46.02 45.38 1oha n GLY 140 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1oha s TYR 141 N -2.00 3.49 -0.46 1.61 1.51 -0.43 -4.80 117.35 116.27 1oha s TYR 141 Ca 0.00 0.22 -0.12 0.00 -1.01 0.00 0.00 57.07 56.16 1oha s TYR 141 Cb 0.00 -1.75 0.08 0.00 -0.11 0.00 0.00 41.96 40.19 1oha s TYR 141 CO 0.00 0.50 0.35 -1.17 -1.11 0.00 0.00 175.55 174.11 1oha s LEU 142 N -3.05 5.50 0.19 -1.29 2.96 -0.36 -4.28 118.68 118.35 1oha s LEU 142 Ca 0.36 -1.49 -0.30 0.00 -0.22 0.00 0.00 54.13 52.48 1oha s LEU 142 Cb -0.12 -2.09 -0.08 0.00 0.50 0.00 0.00 46.19 44.40 1oha s LEU 142 CO 0.28 -0.63 1.27 -2.84 -1.32 0.00 0.00 176.35 173.11 1oha s PRO 143 N 1.53 4.43 -0.27 0.98 0.02 -1.26 -1.77 135.00 138.66 1oha s PRO 143 Ca 0.04 1.99 0.02 0.00 0.02 0.00 0.00 61.00 63.06 1oha s PRO 143 Cb -0.24 -3.21 0.07 0.00 0.02 0.00 0.00 34.50 31.14 1oha s PRO 143 CO 0.04 -0.19 -0.03 0.08 -0.33 0.00 0.00 177.00 176.56 1oha s VAL 144 N 0.04 1.76 -0.17 3.83 1.01 -0.47 -1.10 120.40 125.30 1oha s VAL 144 Ca 0.55 -1.55 -0.04 0.00 0.00 0.00 0.00 61.98 60.94 1oha s VAL 144 Cb -0.35 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 33.94 1oha s VAL 144 CO 0.38 -0.23 -0.02 -0.69 0.00 0.00 0.00 175.10 174.53 1oha s VAL 145 N 1.25 3.93 0.73 2.92 1.01 0.76 -1.04 120.40 129.98 1oha s VAL 145 Ca -0.02 -0.34 -0.07 0.00 0.00 0.00 0.00 61.98 61.55 1oha s VAL 145 Cb -0.19 -2.74 0.08 0.00 0.00 0.00 0.00 36.38 33.53 1oha s VAL 145 CO -0.08 0.48 1.05 -0.94 0.00 0.00 0.00 175.10 175.60 1oha s SER 146 N 0.53 4.63 -0.18 3.32 1.04 -0.44 -1.41 113.70 121.19 1oha s SER 146 Ca -0.02 0.42 0.15 0.00 0.48 0.00 0.00 55.95 56.97 1oha s SER 146 Cb -0.14 -0.99 0.75 0.00 0.10 0.00 0.00 66.02 65.74 1oha s SER 146 CO 0.02 -1.72 1.66 -1.54 0.98 0.00 0.00 173.24 172.64 1oha n SER 147 N -3.01 5.17 -4.81 7.02 3.41 -1.25 -3.85 113.62 116.30 1oha n SER 147 Ca 0.09 -2.70 -0.38 0.00 -0.26 0.00 0.00 58.87 55.62 1oha n SER 147 Cb 0.60 -0.64 -0.06 0.00 -0.26 0.00 0.00 64.21 63.86 1oha n SER 147 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1oha s ILE 148 N -2.34 4.69 0.02 -1.33 -1.09 -1.26 -1.24 121.20 118.64 1oha s ILE 148 Ca 0.51 1.22 0.00 0.00 -2.23 0.00 0.00 60.65 60.15 1oha s ILE 148 Cb 0.37 -3.89 -0.00 0.00 -1.58 0.00 0.00 42.46 37.35 1oha s ILE 148 CO 0.19 0.44 0.01 0.61 -1.23 0.00 0.00 174.94 174.95 1oha n GLY 149 N 1.37 4.04 3.36 6.18 0.00 0.51 -1.40 105.19 119.24 1oha n GLY 149 Ca -0.08 -1.83 -0.13 0.00 0.00 0.00 0.00 46.02 43.98 1oha n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oha s VAL 150 N -1.78 0.00 0.71 1.61 0.11 -1.26 -0.77 120.40 119.02 1oha s VAL 150 Ca 0.01 -0.03 -0.11 0.00 -2.93 0.00 0.00 61.98 58.92 1oha s VAL 150 Cb 0.00 -0.66 0.03 0.00 -1.53 0.00 0.00 36.38 34.22 1oha s VAL 150 CO 0.01 -0.02 1.09 0.42 -3.33 0.00 0.00 175.10 173.27 1oha s THR 151 N 0.10 3.23 0.56 5.04 -4.23 -0.41 -4.43 115.64 115.50 1oha s THR 151 Ca -0.01 0.34 0.36 0.00 -1.18 0.00 0.00 61.69 61.19 1oha s THR 151 Cb -0.03 -3.39 0.39 0.00 1.34 0.00 0.00 72.50 70.81 1oha s THR 151 CO 0.01 -0.50 2.26 0.44 -0.54 0.00 0.00 174.62 176.30 1oha h ASP 152 N -0.67 0.00 0.29 3.99 3.32 -1.91 -0.12 116.42 121.32 1oha h ASP 152 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1oha h ASP 152 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.82 1oha h ASP 152 CO 0.64 0.02 -0.08 -0.62 -1.72 0.00 0.00 179.24 177.47 1oha n GLU 153 N -3.46 0.80 -0.39 3.56 4.71 -1.26 -4.93 120.64 119.68 1oha n GLU 153 Ca -0.03 -0.26 0.00 0.00 -0.01 0.00 0.00 57.16 56.86 1oha n GLU 153 Cb 0.12 -1.49 0.00 0.00 -1.01 0.00 0.00 31.44 29.05 1oha n GLU 153 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1oha n GLY 154 N 1.24 0.76 3.69 0.62 0.00 -0.06 -5.07 105.19 106.37 1oha n GLY 154 Ca 0.16 -0.39 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 1oha n GLY 154 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1oha s GLN 155 N -0.76 4.17 0.37 1.61 -1.52 -1.26 -4.85 119.66 117.41 1oha s GLN 155 Ca 0.00 -0.07 -0.27 0.00 -1.95 0.00 0.00 55.36 53.07 1oha s GLN 155 Cb 0.00 -3.48 -0.09 0.00 -0.22 0.00 0.00 33.01 29.21 1oha s GLN 155 CO 0.00 0.14 1.23 -0.51 -0.25 0.00 0.00 175.29 175.90 1oha s LEU 156 N 0.81 4.31 -0.00 2.90 1.43 -1.26 -1.29 118.68 125.58 1oha s LEU 156 Ca 0.12 2.51 0.03 0.00 -1.03 0.00 0.00 54.13 55.77 1oha s LEU 156 Cb -0.13 -3.83 -0.01 0.00 0.03 0.00 0.00 46.19 42.25 1oha s LEU 156 CO 0.04 -0.61 -0.10 -0.04 0.23 0.00 0.00 176.35 175.86 1oha s MET 157 N -2.03 0.81 -0.37 1.70 -1.94 0.05 -4.88 119.30 112.65 1oha s MET 157 Ca 0.53 -0.41 -0.17 0.00 -1.71 0.00 0.00 55.69 53.93 1oha s MET 157 Cb -0.35 -0.78 0.00 0.00 2.01 0.00 0.00 34.83 35.71 1oha s MET 157 CO 0.46 0.21 0.45 1.21 -0.01 0.00 0.00 175.02 177.34 1oha s ASN 158 N -0.37 6.24 -0.13 3.03 2.47 0.38 -0.36 114.94 126.21 1oha s ASN 158 Ca 0.03 -0.25 -0.04 0.00 0.42 0.00 0.00 52.86 53.02 1oha s ASN 158 Cb -0.04 -2.24 -0.03 0.00 -1.45 0.00 0.00 41.25 37.49 1oha s ASN 158 CO -0.00 -0.46 0.01 -0.69 -3.72 0.00 0.00 177.10 172.23 1oha s VAL 159 N 2.22 4.32 0.19 -5.21 1.01 -0.37 -1.12 120.40 121.44 1oha s VAL 159 Ca 0.15 -0.22 -0.32 0.00 0.00 0.00 0.00 61.98 61.59 1oha s VAL 159 Cb -0.16 -2.87 -0.11 0.00 0.00 0.00 0.00 36.38 33.24 1oha s VAL 159 CO 0.13 0.55 1.66 0.21 0.00 0.00 0.00 175.10 177.64 1oha s ASN 160 N -0.29 6.47 0.45 3.32 3.84 -1.26 -4.69 114.94 122.78 1oha s ASN 160 Ca 0.06 2.75 0.18 0.00 0.21 0.00 0.00 52.86 56.07 1oha s ASN 160 Cb -0.12 -2.60 1.13 0.00 -0.55 0.00 0.00 41.25 39.12 1oha s ASN 160 CO 0.02 -0.91 1.93 0.00 -2.79 0.00 0.00 177.10 175.35 1oha h ALA 161 N 6.86 2.22 -0.55 1.71 0.00 -1.89 -1.63 119.26 125.98 1oha h ALA 161 Ca -0.43 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.42 1oha h ALA 161 Cb 1.20 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1oha h ALA 161 CO 0.94 -0.43 0.11 -0.44 0.00 0.00 0.00 179.25 179.43 1oha h ASP 162 N 0.32 0.86 0.29 0.00 3.32 -1.94 -0.61 116.42 118.66 1oha h ASP 162 Ca 0.36 -0.25 -0.14 0.00 0.02 0.00 0.00 57.03 57.02 1oha h ASP 162 Cb 0.94 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.26 1oha h ASP 162 CO -0.10 0.89 -0.55 1.56 -1.72 0.00 0.00 179.24 179.32 1oha h GLN 163 N 0.80 0.28 -0.39 3.56 4.20 -1.66 -2.36 115.11 119.54 1oha h GLN 163 Ca 0.17 -0.17 -0.08 0.00 0.06 0.00 0.00 58.65 58.63 1oha h GLN 163 Cb 0.38 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 1oha h GLN 163 CO 0.01 0.76 -0.05 0.00 -0.67 0.00 0.00 178.83 178.87 1oha h ALA 164 N 1.21 0.54 -0.45 3.87 0.00 -1.13 -1.77 119.26 121.52 1oha h ALA 164 Ca 0.00 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.63 1oha h ALA 164 Cb 1.04 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1oha h ALA 164 CO 0.09 0.37 0.29 0.00 0.00 0.00 0.00 179.25 179.99 1oha h ALA 165 N 0.86 0.58 -0.55 0.00 0.00 -0.96 -0.69 119.26 118.49 1oha h ALA 165 Ca 0.10 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1oha h ALA 165 Cb 0.56 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1oha h ALA 165 CO 0.03 0.00 0.24 1.15 0.00 0.00 0.00 179.25 180.67 1oha h THR 166 N 0.59 1.21 -0.67 0.00 2.02 -1.32 0.41 112.91 115.16 1oha h THR 166 Ca 0.17 -0.65 -0.01 0.00 0.77 0.00 0.00 66.41 66.69 1oha h THR 166 Cb -0.04 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 66.95 1oha h THR 166 CO -0.05 0.25 0.36 0.00 0.37 0.00 0.00 175.52 176.45 1oha h ALA 167 N 1.08 0.86 -0.13 6.16 0.00 -1.00 -1.91 119.26 124.33 1oha h ALA 167 Ca 0.19 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1oha h ALA 167 Cb 0.17 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1oha h ALA 167 CO -0.02 0.38 -0.37 1.25 0.00 0.00 0.00 179.25 180.49 1oha h LEU 168 N 0.92 0.28 -0.46 0.00 5.85 -0.78 -1.83 115.31 119.29 1oha h LEU 168 Ca 0.24 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1oha h LEU 168 Cb 0.05 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 1oha h LEU 168 CO -0.04 0.64 0.22 0.00 -0.34 0.00 0.00 178.44 178.93 1oha h ALA 169 N 1.38 0.60 -0.62 1.25 0.00 -0.36 -0.31 119.26 121.19 1oha h ALA 169 Ca 0.03 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 1oha h ALA 169 Cb 0.77 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1oha h ALA 169 CO 0.06 0.16 0.08 0.00 0.00 0.00 0.00 179.25 179.55 1oha h ALA 170 N 1.07 0.83 -0.49 0.00 0.00 -1.16 0.31 119.26 119.81 1oha h ALA 170 Ca 0.16 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.82 1oha h ALA 170 Cb 0.12 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1oha h ALA 170 CO -0.02 0.61 0.29 1.15 0.00 0.00 0.00 179.25 181.28 1oha h THR 171 N 0.95 1.05 -0.00 0.00 2.02 -0.94 -3.00 112.91 112.98 1oha h THR 171 Ca 0.19 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1oha h THR 171 Cb 0.46 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 1oha h THR 171 CO 0.02 0.11 -0.47 0.18 0.37 0.00 0.00 175.52 175.73 1oha n LEU 172 N -4.81 0.93 -3.14 2.58 4.77 -0.16 -4.49 117.00 112.68 1oha n LEU 172 Ca 0.03 -0.25 -0.20 0.00 -0.03 0.00 0.00 56.01 55.57 1oha n LEU 172 Cb 0.07 -0.14 0.07 0.00 -2.33 0.00 0.00 43.42 41.09 1oha n LEU 172 CO 0.32 0.19 0.20 0.61 -1.33 0.00 0.00 177.39 177.39 1oha n GLY 173 N 1.43 -0.32 3.83 -0.72 0.00 0.94 -4.68 105.19 105.66 1oha n GLY 173 Ca 0.08 0.11 -0.22 0.00 0.00 0.00 0.00 46.02 46.00 1oha n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oha s ALA 174 N -3.28 3.61 0.64 4.61 0.00 -0.31 -4.53 121.76 122.50 1oha s ALA 174 Ca 0.46 -1.43 -0.11 0.00 0.00 0.00 0.00 51.96 50.88 1oha s ALA 174 Cb -0.20 -1.30 -0.02 0.00 0.00 0.00 0.00 23.12 21.59 1oha s ALA 174 CO 0.62 0.23 1.04 -0.51 0.00 0.00 0.00 175.76 177.15 1oha s ASP 175 N -3.86 5.98 -0.00 0.00 1.01 -0.36 -4.76 116.67 114.68 1oha s ASP 175 Ca 0.33 1.31 0.00 0.00 0.71 0.00 0.00 52.55 54.90 1oha s ASP 175 Cb -0.08 -2.28 0.00 0.00 1.01 0.00 0.00 42.92 41.57 1oha s ASP 175 CO 0.25 -1.01 0.00 -0.22 0.21 0.00 0.00 175.17 174.40 1oha s LEU 176 N -5.22 1.85 -0.05 1.23 2.96 -1.26 -0.72 118.68 117.47 1oha s LEU 176 Ca 0.56 -0.00 0.01 0.00 -0.22 0.00 0.00 54.13 54.47 1oha s LEU 176 Cb -0.11 -0.04 0.02 0.00 0.50 0.00 0.00 46.19 46.57 1oha s LEU 176 CO 0.53 -0.02 -0.04 -0.51 -1.32 0.00 0.00 176.35 175.00 1oha s ILE 177 N 0.17 0.50 -0.39 6.68 2.07 -0.86 -3.74 121.20 125.63 1oha s ILE 177 Ca -0.01 -0.09 -0.12 0.00 -1.41 0.00 0.00 60.65 59.01 1oha s ILE 177 Cb -0.02 -0.54 0.03 0.00 0.13 0.00 0.00 42.46 42.05 1oha s ILE 177 CO -0.00 0.22 0.25 -0.76 -1.91 0.00 0.00 174.94 172.74 1oha s LEU 178 N 1.02 4.91 -0.20 8.50 1.43 0.23 -1.42 118.68 133.15 1oha s LEU 178 Ca -0.09 -1.02 -0.12 0.00 -1.03 0.00 0.00 54.13 51.86 1oha s LEU 178 Cb -0.14 -2.07 -0.05 0.00 0.03 0.00 0.00 46.19 43.96 1oha s LEU 178 CO -0.01 -0.43 0.22 -0.76 0.23 0.00 0.00 176.35 175.61 1oha s LEU 179 N 1.59 4.18 0.00 1.79 1.43 -0.28 -1.21 118.68 126.17 1oha s LEU 179 Ca 0.03 0.30 0.00 0.00 -1.03 0.00 0.00 54.13 53.43 1oha s LEU 179 Cb -0.20 -2.23 0.00 0.00 0.03 0.00 0.00 46.19 43.79 1oha s LEU 179 CO 0.07 0.08 0.00 -0.24 0.23 0.00 0.00 176.35 176.50 1oha n SER 180 N 3.93 0.65 -1.18 2.29 2.88 0.95 -1.66 113.62 121.48 1oha n SER 180 Ca -0.13 -0.67 0.09 0.00 -1.33 0.00 0.00 58.87 56.82 1oha n SER 180 Cb 0.52 0.00 0.27 0.00 -0.75 0.00 0.00 64.21 64.25 1oha n SER 180 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1oha n ASP 181 N -1.58 3.43 -4.11 -3.46 5.68 -1.26 -3.07 116.55 112.19 1oha n ASP 181 Ca 0.00 -2.14 -0.17 0.00 -0.50 0.00 0.00 54.79 51.98 1oha n ASP 181 Cb 0.00 -0.44 -0.13 0.00 -1.14 0.00 0.00 41.12 39.41 1oha n ASP 181 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1oha s VAL 182 N -1.45 0.88 -0.97 2.12 1.01 -1.26 -5.00 120.40 115.73 1oha s VAL 182 Ca 0.40 -1.02 -0.09 0.00 0.00 0.00 0.00 61.98 61.26 1oha s VAL 182 Cb 0.23 -0.84 -0.07 0.00 0.00 0.00 0.00 36.38 35.69 1oha s VAL 182 CO 0.24 -0.15 2.15 -1.20 0.00 0.00 0.00 175.10 176.13 1oha n SER 183 N 1.72 4.76 0.00 3.32 7.64 -1.26 -3.21 113.62 126.59 1oha n SER 183 Ca -0.20 -2.42 0.00 0.00 1.01 0.00 0.00 58.87 57.26 1oha n SER 183 Cb 0.55 -1.16 0.00 0.00 -1.01 0.00 0.00 64.21 62.59 1oha n SER 183 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1oha n GLY 184 N 3.90 -1.84 3.70 0.23 0.00 -1.25 -4.62 105.19 105.32 1oha n GLY 184 Ca 0.48 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 44.61 1oha n GLY 184 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oha s ILE 185 N 0.00 4.86 0.12 -0.61 1.01 -1.26 -4.93 121.20 120.38 1oha s ILE 185 Ca 0.00 1.97 0.02 0.00 0.00 0.00 0.00 60.65 62.64 1oha s ILE 185 Cb 0.00 -4.28 -0.04 0.00 0.01 0.00 0.00 42.46 38.15 1oha s ILE 185 CO 0.00 0.10 0.24 -0.76 0.00 0.00 0.00 174.94 174.53 1oha s LEU 186 N 1.43 4.30 0.00 2.97 1.43 -1.26 -0.50 118.68 127.05 1oha s LEU 186 Ca 0.48 0.18 0.00 0.00 -1.03 0.00 0.00 54.13 53.77 1oha s LEU 186 Cb -0.19 -2.89 0.00 0.00 0.03 0.00 0.00 46.19 43.14 1oha s LEU 186 CO 0.22 0.10 0.00 -0.90 0.23 0.00 0.00 176.35 176.00 1oha n ASP 187 N -0.21 0.00 0.07 2.29 5.68 0.52 -4.82 116.55 120.08 1oha n ASP 187 Ca -0.06 -0.71 0.11 0.00 -0.50 0.00 0.00 54.79 53.63 1oha n ASP 187 Cb 0.53 0.00 0.58 0.00 -1.14 0.00 0.00 41.12 41.09 1oha n ASP 187 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1oha h GLY 188 N 0.00 0.25 -1.11 6.12 0.00 -1.92 -0.04 103.07 106.36 1oha h GLY 188 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.25 1oha h GLY 188 CO 0.00 0.06 0.00 0.28 0.00 0.00 0.00 176.54 176.88 1oha n LYS 189 N -4.48 1.89 -1.00 4.80 4.76 -1.26 -4.92 118.16 117.95 1oha n LYS 189 Ca 0.04 -1.34 -0.00 0.00 -2.87 0.00 0.00 58.31 54.14 1oha n LYS 189 Cb 0.26 -1.42 -0.00 0.00 -1.84 0.00 0.00 35.03 32.03 1oha n LYS 189 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1oha n GLY 190 N 1.21 0.39 3.91 0.72 0.00 -0.03 -5.04 105.19 106.34 1oha n GLY 190 Ca 0.17 -1.08 -0.33 0.00 0.00 0.00 0.00 46.02 44.77 1oha n GLY 190 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1oha s GLN 191 N -1.99 3.46 0.29 1.61 -0.21 -1.26 -4.72 119.66 116.84 1oha s GLN 191 Ca 0.00 -0.32 -0.30 0.00 0.02 0.00 0.00 55.36 54.76 1oha s GLN 191 Cb 0.00 -3.08 -0.12 0.00 1.00 0.00 0.00 33.01 30.82 1oha s GLN 191 CO 0.00 0.65 1.60 -2.13 -2.12 0.00 0.00 175.29 173.29 1oha n ARG 192 N 0.79 2.72 -3.54 2.91 0.63 -1.26 -0.35 116.66 118.56 1oha n ARG 192 Ca -0.09 0.97 -0.41 0.00 -0.92 0.00 0.00 57.85 57.40 1oha n ARG 192 Cb 0.52 -2.75 -0.11 0.00 0.45 0.00 0.00 32.46 30.57 1oha n ARG 192 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1oha s ILE 193 N -0.00 5.17 0.10 5.15 1.01 0.35 -4.85 121.20 128.13 1oha s ILE 193 Ca 0.64 -0.33 -0.22 0.00 0.00 0.00 0.00 60.65 60.74 1oha s ILE 193 Cb -0.49 -3.70 -0.12 0.00 0.01 0.00 0.00 42.46 38.16 1oha s ILE 193 CO 0.48 -0.06 1.74 0.00 0.00 0.00 0.00 174.94 177.11 1oha h ALA 194 N 8.49 0.11 -3.71 9.38 0.00 -1.88 -3.37 119.26 128.29 1oha h ALA 194 Ca -0.30 -0.02 -0.53 0.00 0.00 0.00 0.00 54.91 54.06 1oha h ALA 194 Cb 1.15 -0.04 -0.23 0.00 0.00 0.00 0.00 17.79 18.67 1oha h ALA 194 CO 0.65 -0.39 -0.82 -1.21 0.00 0.00 0.00 179.25 177.48 1oha s GLU 195 N -6.11 1.10 -0.01 0.00 2.02 -1.26 -1.11 118.70 113.33 1oha s GLU 195 Ca -0.13 -1.04 0.01 0.00 0.02 0.00 0.00 54.97 53.83 1oha s GLU 195 Cb 0.07 -1.27 0.01 0.00 0.10 0.00 0.00 34.13 33.04 1oha s GLU 195 CO 0.68 0.30 -0.01 1.41 0.02 0.00 0.00 175.26 177.65 1oha s MET 196 N -1.65 0.26 0.38 1.61 -2.45 -0.02 -4.89 119.30 112.54 1oha s MET 196 Ca 0.05 -0.02 0.06 0.00 -1.25 0.00 0.00 55.69 54.53 1oha s MET 196 Cb -0.10 -0.34 -0.07 0.00 1.25 0.00 0.00 34.83 35.57 1oha s MET 196 CO 0.03 -0.03 0.01 0.95 1.05 0.00 0.00 175.02 177.03 1oha s THR 197 N 0.43 1.80 0.24 10.11 -4.23 -1.26 -1.12 115.64 121.62 1oha s THR 197 Ca -0.04 -2.02 -0.06 0.00 -1.18 0.00 0.00 61.69 58.39 1oha s THR 197 Cb -0.07 -2.89 0.23 0.00 1.34 0.00 0.00 72.50 71.11 1oha s THR 197 CO -0.01 -0.03 1.89 0.00 -0.54 0.00 0.00 174.62 175.93 1oha h ALA 198 N 1.90 1.23 -0.25 3.99 0.00 -1.87 -0.80 119.26 123.45 1oha h ALA 198 Ca -0.43 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.36 1oha h ALA 198 Cb 1.24 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1oha h ALA 198 CO 0.77 0.66 0.09 0.00 0.00 0.00 0.00 179.25 180.77 1oha h ALA 199 N 1.33 0.33 -0.76 0.00 0.00 -1.99 -1.72 119.26 116.44 1oha h ALA 199 Ca 0.34 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 1oha h ALA 199 Cb -0.06 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1oha h ALA 199 CO -0.06 -0.06 0.27 -0.22 0.00 0.00 0.00 179.25 179.18 1oha h LYS 200 N 0.24 1.16 -0.36 0.00 3.64 -1.91 -2.44 116.57 116.91 1oha h LYS 200 Ca 0.08 -0.23 -0.00 0.00 -1.27 0.00 0.00 60.65 59.23 1oha h LYS 200 Cb 0.21 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 1oha h LYS 200 CO -0.00 0.97 0.21 0.00 -2.27 0.00 0.00 179.45 178.35 1oha h ALA 201 N 1.16 0.46 -0.10 5.00 0.00 -0.98 -1.86 119.26 122.94 1oha h ALA 201 Ca 0.25 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.13 1oha h ALA 201 Cb 0.26 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1oha h ALA 201 CO -0.01 -0.03 -0.10 1.49 0.00 0.00 0.00 179.25 180.59 1oha h GLU 202 N 0.46 -0.13 0.05 0.00 4.81 -1.06 -1.03 114.58 117.69 1oha h GLU 202 Ca 0.13 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.39 1oha h GLU 202 Cb 0.03 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.39 1oha h GLU 202 CO -0.02 -0.08 -0.42 0.37 -0.73 0.00 0.00 179.01 178.12 1oha h GLN 203 N -0.13 -0.59 -0.73 1.92 4.15 -1.18 -0.49 115.11 118.06 1oha h GLN 203 Ca 0.07 0.04 0.09 0.00 0.77 0.00 0.00 58.65 59.63 1oha h GLN 203 Cb 0.23 0.13 -0.05 0.00 0.21 0.00 0.00 27.48 28.01 1oha h GLN 203 CO -0.18 -0.39 0.48 -0.07 -1.93 0.00 0.00 178.83 176.74 1oha h LEU 204 N -0.61 0.57 -0.07 -2.39 3.38 -1.15 0.22 115.31 115.26 1oha h LEU 204 Ca 0.04 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1oha h LEU 204 Cb 0.66 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 1oha h LEU 204 CO -0.29 0.34 -0.01 0.40 0.09 0.00 0.00 178.44 178.97 1oha h ILE 205 N 0.63 1.29 -0.75 1.22 1.08 -0.54 0.12 117.51 120.56 1oha h ILE 205 Ca 0.33 -0.91 -0.02 0.00 -0.39 0.00 0.00 64.86 63.88 1oha h ILE 205 Cb 0.46 1.75 -0.04 0.00 -3.07 0.00 0.00 36.82 35.92 1oha h ILE 205 CO -0.12 0.25 0.40 -0.33 -0.69 0.00 0.00 178.15 177.67 1oha h GLU 206 N -0.19 1.04 0.00 2.37 5.08 -0.43 -1.57 114.58 120.88 1oha h GLU 206 Ca 0.02 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1oha h GLU 206 Cb 0.40 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1oha h GLU 206 CO 0.01 0.77 0.00 1.04 -1.00 0.00 0.00 179.01 179.83 1oha n GLN 207 N -4.35 0.10 -0.76 2.33 6.02 0.00 -4.89 117.38 115.83 1oha n GLN 207 Ca 0.08 0.22 0.00 0.00 -0.01 0.00 0.00 57.00 57.28 1oha n GLN 207 Cb 0.10 -1.65 0.00 0.00 1.02 0.00 0.00 30.24 29.71 1oha n GLN 207 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1oha n GLY 208 N 0.67 0.58 0.15 1.08 0.00 -0.59 -4.95 105.19 102.14 1oha n GLY 208 Ca 0.05 -0.32 -0.20 0.00 0.00 0.00 0.00 46.02 45.55 1oha n GLY 208 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1oha h ILE 209 N 0.00 1.38 -3.78 -0.61 2.04 -1.00 -3.42 117.51 112.12 1oha h ILE 209 Ca 0.00 -2.29 -0.63 0.00 1.00 0.00 0.00 64.86 62.94 1oha h ILE 209 Cb 0.00 2.69 -0.16 0.00 -0.74 0.00 0.00 36.82 38.61 1oha h ILE 209 CO 0.00 0.68 -0.34 -0.63 0.00 0.00 0.00 178.15 177.86 1oha s ILE 210 N -3.03 5.22 0.36 -0.67 1.01 -1.10 -4.95 121.20 118.04 1oha s ILE 210 Ca -0.12 0.39 0.04 0.00 0.00 0.00 0.00 60.65 60.96 1oha s ILE 210 Cb 0.04 -3.65 -0.03 0.00 0.01 0.00 0.00 42.46 38.83 1oha s ILE 210 CO 0.87 0.17 0.14 0.42 0.00 0.00 0.00 174.94 176.54 1oha s THR 211 N 1.96 0.55 0.00 2.92 -4.23 -1.26 -4.61 115.64 110.96 1oha s THR 211 Ca 0.12 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.63 1oha s THR 211 Cb -0.16 -2.46 0.00 0.00 1.34 0.00 0.00 72.50 71.22 1oha s THR 211 CO 0.10 0.00 0.00 -0.90 -0.54 0.00 0.00 174.62 173.28 1oha n ASP 212 N -1.12 0.00 0.26 3.99 5.75 -1.26 -0.92 116.55 123.25 1oha n ASP 212 Ca -0.03 0.00 0.17 0.00 -0.01 0.00 0.00 54.79 54.92 1oha n ASP 212 Cb 0.65 0.00 0.90 0.00 -1.03 0.00 0.00 41.12 41.64 1oha n ASP 212 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1oha h GLY 213 N 0.00 0.00 2.00 6.12 0.00 -1.94 -1.79 103.07 107.46 1oha h GLY 213 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1oha h GLY 213 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 176.54 178.52 1oha h MET 214 N 0.00 0.00 -0.05 4.80 4.05 -1.42 -2.10 114.93 120.22 1oha h MET 214 Ca 0.04 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.44 1oha h MET 214 Cb 0.24 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.04 1oha h MET 214 CO -0.00 0.00 -0.06 0.82 0.23 0.00 0.00 176.91 177.90 1oha h ILE 215 N 0.00 1.39 -0.77 1.77 2.04 -1.22 -1.21 117.51 119.52 1oha h ILE 215 Ca 0.00 -1.27 -0.01 0.00 1.00 0.00 0.00 64.86 64.58 1oha h ILE 215 Cb 0.93 2.13 -0.04 0.00 -0.74 0.00 0.00 36.82 39.10 1oha h ILE 215 CO 0.00 0.34 0.43 0.58 0.00 0.00 0.00 178.15 179.50 1oha h VAL 216 N -0.34 1.23 -0.22 1.67 2.07 -1.56 -2.45 116.25 116.64 1oha h VAL 216 Ca 0.01 -0.55 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 1oha h VAL 216 Cb 0.59 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1oha h VAL 216 CO 0.01 0.25 0.06 0.50 0.02 0.00 0.00 177.57 178.41 1oha h LYS 217 N 1.06 0.35 -0.21 1.57 3.64 -1.32 -1.67 116.57 119.98 1oha h LYS 217 Ca 0.27 -0.08 -0.09 0.00 -1.27 0.00 0.00 60.65 59.47 1oha h LYS 217 Cb 0.02 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 1oha h LYS 217 CO -0.05 0.46 -0.27 -0.24 -2.27 0.00 0.00 179.45 177.08 1oha h VAL 218 N 0.18 1.27 -0.43 2.00 3.04 -1.18 -0.99 116.25 120.14 1oha h VAL 218 Ca 0.07 -1.28 -0.14 0.00 -1.01 0.00 0.00 66.70 64.35 1oha h VAL 218 Cb 0.27 1.40 -0.01 0.00 -2.01 0.00 0.00 31.29 30.94 1oha h VAL 218 CO 0.00 0.40 -0.27 0.78 -1.01 0.00 0.00 177.57 177.47 1oha h ASN 219 N 0.36 0.95 -0.34 3.17 4.21 -1.33 -0.96 115.58 121.65 1oha h ASN 219 Ca 0.05 -0.38 -0.13 0.00 1.21 0.00 0.00 56.30 57.06 1oha h ASN 219 Cb 0.67 -0.26 -0.01 0.00 -1.12 0.00 0.00 38.32 37.60 1oha h ASN 219 CO 0.05 1.16 -0.25 0.00 -1.29 0.00 0.00 177.43 177.09 1oha h ALA 220 N 0.90 0.78 -0.31 -0.83 0.00 -1.10 -1.98 119.26 116.72 1oha h ALA 220 Ca 0.09 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 1oha h ALA 220 Cb 0.83 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1oha h ALA 220 CO 0.07 0.65 0.12 0.00 0.00 0.00 0.00 179.25 180.10 1oha h ALA 221 N 0.98 0.41 -0.74 0.00 0.00 -0.97 -1.60 119.26 117.33 1oha h ALA 221 Ca 0.09 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1oha h ALA 221 Cb 0.80 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1oha h ALA 221 CO 0.07 0.01 0.37 -0.07 0.00 0.00 0.00 179.25 179.63 1oha h LEU 222 N 0.36 0.96 -0.34 0.00 3.38 -1.08 -0.07 115.31 118.52 1oha h LEU 222 Ca 0.10 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1oha h LEU 222 Cb 0.19 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1oha h LEU 222 CO -0.01 0.81 0.17 -0.78 0.09 0.00 0.00 178.44 178.73 1oha h ASP 223 N 1.04 0.43 -0.44 -0.43 3.58 -1.20 -0.69 116.42 118.71 1oha h ASP 223 Ca 0.26 -0.11 -0.02 0.00 0.42 0.00 0.00 57.03 57.57 1oha h ASP 223 Cb 0.10 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.02 1oha h ASP 223 CO -0.03 0.42 0.19 0.00 -2.88 0.00 0.00 179.24 176.93 1oha h ALA 224 N 1.03 0.58 -0.47 -0.78 0.00 -1.04 -0.20 119.26 118.38 1oha h ALA 224 Ca 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1oha h ALA 224 Cb 0.10 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1oha h ALA 224 CO -0.02 0.17 0.30 0.00 0.00 0.00 0.00 179.25 179.71 1oha h ALA 225 N 1.03 0.59 -0.01 0.00 0.00 -0.71 0.22 119.26 120.38 1oha h ALA 225 Ca 0.15 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.85 1oha h ALA 225 Cb 0.17 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1oha h ALA 225 CO -0.01 0.05 -0.78 0.07 0.00 0.00 0.00 179.25 178.57 1oha h ARG 226 N 0.63 0.15 -0.19 0.00 0.11 -1.03 0.11 114.38 114.16 1oha h ARG 226 Ca 0.17 -0.14 -0.14 0.00 0.10 0.00 0.00 59.98 59.97 1oha h ARG 226 Cb -0.06 0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.06 1oha h ARG 226 CO -0.04 0.86 -0.42 1.15 0.10 0.00 0.00 179.97 181.62 1oha h THR 227 N 0.09 1.33 0.00 0.08 2.02 -0.70 -3.26 112.91 112.47 1oha h THR 227 Ca -0.03 -1.66 -0.02 0.00 0.77 0.00 0.00 66.41 65.47 1oha h THR 227 Cb 1.37 1.90 -0.00 0.00 -1.74 0.00 0.00 68.15 69.68 1oha h THR 227 CO 0.12 0.51 -0.79 -0.07 0.37 0.00 0.00 175.52 175.66 1oha h LEU 228 N 0.29 0.00 0.27 2.58 -0.00 -0.64 -3.48 115.31 114.32 1oha h LEU 228 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.88 57.77 1oha h LEU 228 Cb 1.03 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 41.64 1oha h LEU 228 CO 0.09 0.09 -0.10 0.61 -0.00 0.00 0.00 178.44 179.13 1oha n GLY 229 N 1.19 0.81 3.22 0.83 0.00 0.36 -5.02 105.19 106.58 1oha n GLY 229 Ca -0.00 -0.78 -0.16 0.00 0.00 0.00 0.00 46.02 45.08 1oha n GLY 229 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1oha s ARG 230 N -2.44 0.95 0.54 1.61 0.52 -1.11 -4.98 118.95 114.05 1oha s ARG 230 Ca 0.00 -1.21 -0.21 0.00 -0.52 0.00 0.00 55.73 53.79 1oha s ARG 230 Cb 0.00 -0.74 -0.05 0.00 0.52 0.00 0.00 34.95 34.68 1oha s ARG 230 CO 0.00 0.13 1.20 -2.14 0.02 0.00 0.00 175.30 174.51 1oha s PRO 231 N -2.76 3.30 -0.08 3.54 0.02 -1.26 -4.25 135.00 133.50 1oha s PRO 231 Ca 0.08 1.83 0.02 0.00 0.02 0.00 0.00 61.00 62.95 1oha s PRO 231 Cb -0.04 -2.13 0.01 0.00 0.02 0.00 0.00 34.50 32.37 1oha s PRO 231 CO 0.02 -0.95 -0.14 0.08 -0.33 0.00 0.00 177.00 175.68 1oha s VAL 232 N -1.57 1.30 0.08 3.83 1.01 -0.50 -4.76 120.40 119.79 1oha s VAL 232 Ca 0.72 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 62.15 1oha s VAL 232 Cb -0.30 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 1oha s VAL 232 CO 0.34 0.39 0.18 -1.81 0.00 0.00 0.00 175.10 174.21 1oha s ASP 233 N 0.71 6.11 -0.19 3.32 1.11 -1.25 0.55 116.67 127.04 1oha s ASP 233 Ca -0.13 0.17 0.01 0.00 0.18 0.00 0.00 52.55 52.78 1oha s ASP 233 Cb -0.16 -1.81 0.03 0.00 1.07 0.00 0.00 42.92 42.05 1oha s ASP 233 CO 0.03 0.16 -0.14 -0.63 1.18 0.00 0.00 175.17 175.77 1oha s ILE 234 N -1.50 1.78 0.29 0.77 1.01 -0.19 -0.60 121.20 122.76 1oha s ILE 234 Ca 0.33 -0.95 -0.04 0.00 0.00 0.00 0.00 60.65 59.99 1oha s ILE 234 Cb -0.13 -1.74 -0.01 0.00 0.01 0.00 0.00 42.46 40.59 1oha s ILE 234 CO 0.26 0.32 0.39 0.00 0.00 0.00 0.00 174.94 175.92 1oha s ALA 235 N 1.37 0.70 0.16 9.38 0.00 -0.35 -0.36 121.76 132.65 1oha s ALA 235 Ca 0.01 -1.45 0.04 0.00 0.00 0.00 0.00 51.96 50.57 1oha s ALA 235 Cb -0.15 1.21 -0.04 0.00 0.00 0.00 0.00 23.12 24.14 1oha s ALA 235 CO -0.10 -0.76 0.16 -1.54 0.00 0.00 0.00 175.76 173.52 1oha s SER 236 N -3.18 5.66 -0.21 0.00 1.04 -1.20 -0.04 113.70 115.79 1oha s SER 236 Ca 0.31 -0.07 0.12 0.00 0.48 0.00 0.00 55.95 56.79 1oha s SER 236 Cb 0.01 -1.53 0.41 0.00 0.10 0.00 0.00 66.02 65.02 1oha s SER 236 CO 0.17 0.07 1.24 -2.67 0.98 0.00 0.00 173.24 173.03 1oha n TRP 237 N -0.34 0.15 0.09 5.02 4.27 -1.17 -4.73 117.44 120.72 1oha n TRP 237 Ca -0.08 -1.42 -0.21 0.00 -3.89 0.00 0.00 57.50 51.91 1oha n TRP 237 Cb 0.54 -0.26 -0.12 0.00 -1.36 0.00 0.00 31.31 30.11 1oha n TRP 237 CO 0.00 0.00 0.00 -0.09 -2.29 0.00 0.00 177.69 175.31 1oha h ARG 238 N 0.85 0.58 -4.74 -2.67 2.43 -1.95 -3.44 114.38 105.43 1oha h ARG 238 Ca 0.03 -0.76 -0.68 0.00 -0.81 0.00 0.00 59.98 57.76 1oha h ARG 238 Cb 1.09 0.25 -0.20 0.00 -0.42 0.00 0.00 29.97 30.68 1oha h ARG 238 CO 0.05 1.34 -0.51 -1.01 -1.51 0.00 0.00 179.97 178.33 1oha s HIS 239 N -2.99 3.21 0.25 2.20 3.76 -1.26 -4.99 115.29 115.46 1oha s HIS 239 Ca -0.09 -0.37 -0.05 0.00 -0.15 0.00 0.00 55.06 54.40 1oha s HIS 239 Cb 0.06 -2.42 0.46 0.00 1.11 0.00 0.00 32.58 31.79 1oha s HIS 239 CO 0.92 -0.40 1.67 0.00 -0.85 0.00 0.00 174.74 176.08 1oha h ALA 240 N 8.43 0.90 0.00 -1.40 0.00 -1.97 -1.77 119.26 123.45 1oha h ALA 240 Ca -0.32 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1oha h ALA 240 Cb 1.15 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 19.24 1oha h ALA 240 CO 0.62 -0.38 -0.03 1.05 0.00 0.00 0.00 179.25 180.52 1oha h GLU 241 N 0.20 0.00 0.00 0.00 9.09 -2.00 -2.49 114.58 119.38 1oha h GLU 241 Ca 0.42 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.83 1oha h GLU 241 Cb 0.73 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.83 1oha h GLU 241 CO -0.57 0.03 -0.78 1.96 0.05 0.00 0.00 179.01 179.70 1oha h GLN 242 N 0.00 0.00 -0.54 1.06 4.20 -1.75 -3.39 115.11 114.70 1oha h GLN 242 Ca -0.00 0.00 0.10 0.00 0.06 0.00 0.00 58.65 58.80 1oha h GLN 242 Cb 0.12 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 27.83 1oha h GLN 242 CO 0.00 0.00 0.11 -0.07 -0.67 0.00 0.00 178.83 178.20 1oha h LEU 243 N 0.00 -0.01 0.34 1.46 3.38 -1.43 -1.61 115.31 117.44 1oha h LEU 243 Ca 0.00 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1oha h LEU 243 Cb 0.93 0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.80 1oha h LEU 243 CO 0.00 0.02 -0.44 -0.65 0.09 0.00 0.00 178.44 177.45 1oha h PRO 244 N 0.24 -0.78 -0.70 1.13 0.11 -1.76 -2.18 132.00 128.06 1oha h PRO 244 Ca 0.27 0.05 0.07 0.00 0.11 0.00 0.00 66.00 66.51 1oha h PRO 244 Cb 0.38 0.18 -0.04 0.00 0.11 0.00 0.00 31.00 31.63 1oha h PRO 244 CO -0.36 -0.52 0.46 0.00 -0.21 0.00 0.00 178.00 177.37 1oha h ALA 245 N -0.93 1.77 0.20 -0.75 0.00 -1.81 -2.03 119.26 115.72 1oha h ALA 245 Ca -0.04 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1oha h ALA 245 Cb 0.73 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 1oha h ALA 245 CO -0.11 0.11 -0.39 1.25 0.00 0.00 0.00 179.25 180.11 1oha h LEU 246 N 0.68 -1.12 -1.92 0.00 5.85 -0.89 -0.88 115.31 117.03 1oha h LEU 246 Ca 0.31 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 59.14 1oha h LEU 246 Cb 0.32 0.41 -0.00 0.00 0.37 0.00 0.00 40.66 41.76 1oha h LEU 246 CO -0.10 -0.49 -0.00 -0.26 -0.34 0.00 0.00 178.44 177.25 1oha h PHE 247 N -0.68 0.00 -0.00 1.25 0.05 -1.01 -1.83 116.94 114.72 1oha h PHE 247 Ca 0.01 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.80 1oha h PHE 247 Cb 0.67 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.62 1oha h PHE 247 CO -0.31 0.00 -0.01 -1.71 -0.18 0.00 0.00 178.31 176.10 1oha n ASN 248 N -3.09 0.19 0.00 2.17 5.15 -0.58 -4.89 115.26 114.21 1oha n ASN 248 Ca -0.00 -0.85 0.00 0.00 -0.60 0.00 0.00 54.58 53.13 1oha n ASN 248 Cb 0.24 -0.06 0.00 0.00 -0.53 0.00 0.00 39.78 39.43 1oha n ASN 248 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1oha n GLY 249 N 1.10 0.76 3.81 8.20 0.00 -0.69 -5.05 105.19 113.32 1oha n GLY 249 Ca 0.21 -0.53 -0.37 0.00 0.00 0.00 0.00 46.02 45.32 1oha n GLY 249 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1oha s MET 250 N -1.18 4.21 -0.53 1.61 -1.94 -0.44 -5.00 119.30 116.03 1oha s MET 250 Ca 0.00 0.76 -0.27 0.00 -1.71 0.00 0.00 55.69 54.48 1oha s MET 250 Cb 0.00 -3.10 -0.04 0.00 2.01 0.00 0.00 34.83 33.70 1oha s MET 250 CO 0.00 0.55 2.05 -2.14 -0.01 0.00 0.00 175.02 175.47 1oha s PRO 251 N -1.47 2.54 -0.01 2.03 0.02 -1.26 -4.57 135.00 132.27 1oha s PRO 251 Ca 0.35 1.01 0.10 0.00 0.02 0.00 0.00 61.00 62.48 1oha s PRO 251 Cb -0.18 -4.43 -0.14 0.00 0.02 0.00 0.00 34.50 29.76 1oha s PRO 251 CO 0.20 -2.81 0.31 -1.33 -0.33 0.00 0.00 177.00 173.05 1oha n MET 252 N 9.04 1.74 0.00 5.54 2.81 -1.26 -5.02 117.12 129.96 1oha n MET 252 Ca 0.26 -0.05 0.00 0.00 -1.81 0.00 0.00 57.70 56.10 1oha n MET 252 Cb 0.52 -1.13 0.00 0.00 -0.71 0.00 0.00 33.22 31.90 1oha n MET 252 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1oha n GLY 253 N 1.62 3.05 3.14 3.03 0.00 -1.26 -4.80 105.19 109.97 1oha n GLY 253 Ca -0.00 -0.37 -0.33 0.00 0.00 0.00 0.00 46.02 45.32 1oha n GLY 253 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1oha s THR 254 N 2.28 2.13 -0.25 2.61 2.01 0.51 -4.36 115.64 120.58 1oha s THR 254 Ca 0.00 -0.92 -0.18 0.00 0.31 0.00 0.00 61.69 60.91 1oha s THR 254 Cb 0.00 -1.89 -0.03 0.00 0.01 0.00 0.00 72.50 70.59 1oha s THR 254 CO 0.00 0.53 0.49 -0.60 -0.69 0.00 0.00 174.62 174.36 1oha s ARG 255 N 1.25 4.09 -0.24 4.92 3.52 -0.26 -1.02 118.95 131.21 1oha s ARG 255 Ca 0.04 0.30 -0.21 0.00 -0.13 0.00 0.00 55.73 55.73 1oha s ARG 255 Cb -0.13 -3.63 -0.02 0.00 -1.56 0.00 0.00 34.95 29.61 1oha s ARG 255 CO -0.11 -0.30 0.64 0.42 -0.81 0.00 0.00 175.30 175.14 1oha s ILE 256 N 2.13 4.98 -0.10 4.11 -1.09 0.19 -0.84 121.20 130.58 1oha s ILE 256 Ca 0.21 1.17 -0.12 0.00 -2.23 0.00 0.00 60.65 59.67 1oha s ILE 256 Cb -0.16 -3.95 -0.05 0.00 -1.58 0.00 0.00 42.46 36.73 1oha s ILE 256 CO 0.09 0.04 0.29 -0.76 -1.23 0.00 0.00 174.94 173.37 1oha s LEU 257 N 2.39 4.35 0.00 2.97 1.43 -0.27 -1.41 118.68 128.15 1oha s LEU 257 Ca 0.27 0.64 0.00 0.00 -1.03 0.00 0.00 54.13 54.02 1oha s LEU 257 Cb -0.16 -2.36 0.00 0.00 0.03 0.00 0.00 46.19 43.70 1oha s LEU 257 CO 0.09 0.25 0.21 0.00 0.23 0.00 0.00 176.35 177.12