#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1esj s ARG -10 N 0.00 2.83 0.49 3.17 0.52 -0.80 -4.21 118.95 120.95 1esj s ARG -10 Ca 0.00 -1.31 0.04 0.00 -0.52 0.00 0.00 55.73 53.94 1esj s ARG -10 Cb 0.00 -5.30 0.09 0.00 0.52 0.00 0.00 34.95 30.26 1esj s ARG -10 CO 0.00 -3.57 0.67 0.41 0.02 0.00 0.00 175.30 172.84 1esj n GLY -9 N 5.78 1.33 3.35 -3.53 0.00 -0.11 -4.24 105.19 107.77 1esj n GLY -9 Ca 0.45 -2.11 -0.33 0.00 0.00 0.00 0.00 46.02 44.04 1esj n GLY -9 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1esj s SER -8 N -3.87 3.76 0.00 1.61 0.15 -1.26 0.28 113.70 114.36 1esj s SER -8 Ca 0.48 -0.36 0.06 0.00 0.70 0.00 0.00 55.95 56.82 1esj s SER -8 Cb -0.03 -1.35 0.01 0.00 -1.71 0.00 0.00 66.02 62.94 1esj s SER -8 CO 0.31 0.21 0.54 1.41 1.20 0.00 0.00 173.24 176.91 1esj n HIS -7 N 3.24 0.00 -3.29 3.44 8.25 -1.26 -4.90 115.22 120.69 1esj n HIS -7 Ca -0.18 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.22 1esj n HIS -7 Cb 0.53 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.58 1esj n HIS -7 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1esj s HIS -6 N -0.85 -1.07 -0.26 4.41 5.65 -1.26 -4.99 115.29 116.93 1esj s HIS -6 Ca 0.05 0.82 -0.29 0.00 0.25 0.00 0.00 55.06 55.89 1esj s HIS -6 Cb 0.05 0.06 0.00 0.00 -1.18 0.00 0.00 32.58 31.52 1esj s HIS -6 CO 0.13 -0.85 1.18 -1.58 -0.65 0.00 0.00 174.74 172.96 1esj s HIS -5 N 2.61 2.97 -0.65 3.88 2.46 -1.26 -4.95 115.29 120.35 1esj s HIS -5 Ca 0.13 1.10 -0.26 0.00 0.47 0.00 0.00 55.06 56.50 1esj s HIS -5 Cb -0.14 -3.64 -0.02 0.00 -0.13 0.00 0.00 32.58 28.65 1esj s HIS -5 CO -0.22 -1.21 1.80 -1.58 -2.47 0.00 0.00 174.74 171.06 1esj s HIS -4 N 3.75 1.75 0.00 3.88 5.04 -1.26 -2.98 115.29 125.46 1esj s HIS -4 Ca 0.50 0.67 0.00 0.00 -1.54 0.00 0.00 55.06 54.69 1esj s HIS -4 Cb -0.16 -4.15 0.00 0.00 0.04 0.00 0.00 32.58 28.31 1esj s HIS -4 CO 0.16 -2.24 0.00 1.58 -2.34 0.00 0.00 174.74 171.90 1esj n HIS -3 N 12.45 0.00 0.78 3.88 -0.00 -1.26 -4.94 115.22 126.13 1esj n HIS -3 Ca 0.20 0.00 0.12 0.00 0.46 0.00 0.00 57.72 58.51 1esj n HIS -3 Cb 0.51 0.00 0.28 0.00 -0.12 0.00 0.00 29.99 30.66 1esj n HIS -3 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 1esj n HIS -2 N 0.00 0.33 0.00 1.57 8.25 -1.16 -5.02 115.22 119.19 1esj n HIS -2 Ca 0.00 0.10 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 1esj n HIS -2 Cb 0.00 -0.53 0.00 0.00 1.12 0.00 0.00 29.99 30.58 1esj n HIS -2 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1esj n GLY -1 N 1.41 1.47 3.84 -1.41 0.00 -1.26 -5.14 105.19 104.11 1esj n GLY -1 Ca 0.05 -1.59 -0.30 0.00 0.00 0.00 0.00 46.02 44.18 1esj n GLY -1 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1esj s SER 0 N 0.00 5.15 0.33 1.61 1.04 -1.26 -4.81 113.70 115.77 1esj s SER 0 Ca 0.00 1.29 -0.29 0.00 0.48 0.00 0.00 55.95 57.43 1esj s SER 0 Cb 0.00 -2.10 -0.11 0.00 0.10 0.00 0.00 66.02 63.90 1esj s SER 0 CO 0.00 -1.55 1.55 0.80 0.98 0.00 0.00 173.24 175.02 1esj n MET 1 N -3.16 2.71 -4.33 4.02 0.00 -1.26 -5.02 117.12 110.08 1esj n MET 1 Ca 0.07 0.96 -0.18 0.00 0.00 0.00 0.00 57.70 58.54 1esj n MET 1 Cb 0.56 -2.72 -0.09 0.00 0.00 0.00 0.00 33.22 30.97 1esj n MET 1 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 175.97 176.13 1esj s ASP 2 N 0.21 1.45 0.52 6.12 3.84 -1.26 -4.88 116.67 122.67 1esj s ASP 2 Ca 0.59 -1.51 0.18 0.00 -0.00 0.00 0.00 52.55 51.80 1esj s ASP 2 Cb -0.48 0.33 1.29 0.00 -1.38 0.00 0.00 42.92 42.68 1esj s ASP 2 CO 0.56 -0.85 2.13 0.00 -0.00 0.00 0.00 175.17 177.02 1esj h ALA 3 N 2.26 1.87 -0.16 2.11 0.00 -1.90 -0.40 119.26 123.04 1esj h ALA 3 Ca -0.35 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.45 1esj h ALA 3 Cb 1.25 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 1esj h ALA 3 CO 0.54 0.04 -0.19 0.37 0.00 0.00 0.00 179.25 180.02 1esj h GLN 4 N 0.00 0.40 -0.12 0.00 4.15 -1.89 -1.98 115.11 115.68 1esj h GLN 4 Ca -0.00 -0.23 -0.14 0.00 0.77 0.00 0.00 58.65 59.06 1esj h GLN 4 Cb 0.07 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.76 1esj h GLN 4 CO 0.00 0.80 -0.52 0.77 -1.93 0.00 0.00 178.83 177.96 1esj h SER 5 N 0.03 0.35 -0.62 -0.69 0.02 -1.84 -2.60 113.55 108.20 1esj h SER 5 Ca 0.02 -0.18 -0.08 0.00 -0.84 0.00 0.00 61.79 60.71 1esj h SER 5 Cb 0.75 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 1esj h SER 5 CO 0.05 0.81 0.07 0.00 -1.14 0.00 0.00 176.83 176.61 1esj h ALA 6 N 1.20 0.83 -0.82 3.77 0.00 -1.07 -2.55 119.26 120.62 1esj h ALA 6 Ca 0.01 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 1esj h ALA 6 Cb 1.00 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 1esj h ALA 6 CO 0.08 0.61 0.40 0.00 0.00 0.00 0.00 179.25 180.35 1esj h ALA 7 N 1.02 1.05 -0.08 0.00 0.00 -1.17 -2.16 119.26 117.91 1esj h ALA 7 Ca 0.18 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1esj h ALA 7 Cb 0.47 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1esj h ALA 7 CO 0.02 0.61 -0.22 0.87 0.00 0.00 0.00 179.25 180.53 1esj h LYS 8 N 1.15 0.14 -0.43 0.00 1.57 -1.24 -2.26 116.57 115.50 1esj h LYS 8 Ca 0.28 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.94 1esj h LYS 8 Cb 0.10 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 1esj h LYS 8 CO -0.04 0.35 -0.08 0.00 -0.57 0.00 0.00 179.45 179.12 1esj h LEU 10 N 0.68 0.34 -1.34 0.00 5.85 -1.13 -1.15 115.31 118.55 1esj h LEU 10 Ca 0.12 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 1esj h LEU 10 Cb 0.53 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 1esj h LEU 10 CO 0.03 0.27 0.29 0.74 -0.34 0.00 0.00 178.44 179.44 1esj h THR 11 N 0.37 1.17 -0.67 1.05 2.02 -1.25 -1.88 112.91 113.72 1esj h THR 11 Ca 0.10 -0.43 -0.07 0.00 0.77 0.00 0.00 66.41 66.78 1esj h THR 11 Cb -0.01 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 66.82 1esj h THR 11 CO -0.02 0.19 0.12 0.00 0.37 0.00 0.00 175.52 176.18 1esj h ALA 12 N 1.57 0.95 -0.44 6.16 0.00 -0.76 0.47 119.26 127.20 1esj h ALA 12 Ca 0.19 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1esj h ALA 12 Cb 0.03 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1esj h ALA 12 CO -0.03 0.66 0.19 0.28 0.00 0.00 0.00 179.25 180.35 1esj h VAL 13 N 1.03 1.19 -0.06 0.00 2.07 -0.47 -1.56 116.25 118.45 1esj h VAL 13 Ca 0.21 -0.57 -0.10 0.00 0.82 0.00 0.00 66.70 67.06 1esj h VAL 13 Cb 0.42 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1esj h VAL 13 CO 0.01 0.21 -0.44 0.03 0.02 0.00 0.00 177.57 177.40 1esj h ARG 14 N 0.57 0.13 -0.46 1.57 3.08 -1.08 0.73 114.38 118.91 1esj h ARG 14 Ca 0.15 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 60.04 1esj h ARG 14 Cb 0.15 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 1esj h ARG 14 CO -0.02 0.54 -0.10 -0.09 -1.07 0.00 0.00 179.97 179.24 1esj h ARG 15 N 0.11 0.89 0.00 0.04 2.43 -0.49 -3.31 114.38 114.04 1esj h ARG 15 Ca 0.01 -0.33 0.00 0.00 -0.81 0.00 0.00 59.98 58.84 1esj h ARG 15 Cb 0.82 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 1esj h ARG 15 CO 0.06 0.98 -1.31 0.72 -1.51 0.00 0.00 179.97 178.91 1esj n HIS 16 N -4.26 0.39 -3.86 2.20 8.25 -0.62 -5.00 115.22 112.32 1esj n HIS 16 Ca -0.00 0.11 -0.37 0.00 -0.26 0.00 0.00 57.72 57.20 1esj n HIS 16 Cb 0.38 -0.60 0.03 0.00 1.12 0.00 0.00 29.99 30.92 1esj n HIS 16 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1esj n SER 17 N -2.25 -4.44 -4.69 0.41 2.88 0.24 -4.81 113.62 100.95 1esj n SER 17 Ca -0.00 -1.13 -0.42 0.00 -1.33 0.00 0.00 58.87 55.99 1esj n SER 17 Cb 0.51 -2.71 -0.00 0.00 -0.75 0.00 0.00 64.21 61.26 1esj n SER 17 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1esj n PRO 18 N -4.53 2.04 -2.60 -1.46 -0.04 -1.26 -3.97 135.00 123.19 1esj n PRO 18 Ca -0.12 0.72 -0.43 0.00 -0.04 0.00 0.00 63.50 63.63 1esj n PRO 18 Cb 0.59 -2.32 -0.02 0.00 -0.04 0.00 0.00 33.50 31.71 1esj n PRO 18 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1esj s LEU 19 N -1.09 3.74 -0.35 1.53 2.96 -1.26 -0.88 118.68 123.33 1esj s LEU 19 Ca 0.57 0.71 -0.10 0.00 -0.22 0.00 0.00 54.13 55.09 1esj s LEU 19 Cb -0.56 -3.55 0.02 0.00 0.50 0.00 0.00 46.19 42.61 1esj s LEU 19 CO 0.61 -1.12 0.17 -0.69 -1.32 0.00 0.00 176.35 174.00 1esj s VAL 20 N 4.21 4.39 -0.34 1.68 1.01 0.10 0.32 120.40 131.76 1esj s VAL 20 Ca 0.48 -0.82 -0.22 0.00 0.00 0.00 0.00 61.98 61.41 1esj s VAL 20 Cb -0.09 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.88 1esj s VAL 20 CO 0.26 -0.15 0.75 -2.28 0.00 0.00 0.00 175.10 173.67 1esj s HIS 21 N 1.53 3.15 -0.14 5.22 2.46 -0.64 -1.58 115.29 125.29 1esj s HIS 21 Ca 0.02 0.58 -0.01 0.00 0.47 0.00 0.00 55.06 56.12 1esj s HIS 21 Cb -0.19 -3.28 -0.02 0.00 -0.13 0.00 0.00 32.58 28.97 1esj s HIS 21 CO 0.06 -0.65 -0.11 -1.12 -2.47 0.00 0.00 174.74 170.44 1esj s SER 22 N 1.76 4.18 -0.33 9.88 0.01 -0.38 -0.32 113.70 128.50 1esj s SER 22 Ca 0.30 -0.28 -0.04 0.00 1.31 0.00 0.00 55.95 57.23 1esj s SER 22 Cb -0.14 -1.65 0.05 0.00 0.21 0.00 0.00 66.02 64.50 1esj s SER 22 CO 0.15 0.17 0.08 -0.63 0.41 0.00 0.00 173.24 173.41 1esj s ILE 23 N 0.35 3.39 0.00 1.44 1.01 -0.48 -3.78 121.20 123.13 1esj s ILE 23 Ca -0.09 -1.36 0.00 0.00 0.00 0.00 0.00 60.65 59.19 1esj s ILE 23 Cb -0.16 -2.98 0.00 0.00 0.01 0.00 0.00 42.46 39.33 1esj s ILE 23 CO 0.05 -0.22 0.00 1.07 0.00 0.00 0.00 174.94 175.84 1esj n THR 24 N 4.71 0.00 -3.90 2.92 5.66 -1.26 -1.50 114.28 120.90 1esj n THR 24 Ca -0.11 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.68 1esj n THR 24 Cb 0.44 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.19 1esj n THR 24 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1esj s ASN 25 N -0.82 5.97 0.00 1.09 2.20 -1.26 -4.98 114.94 117.13 1esj s ASN 25 Ca 0.00 -0.11 0.13 0.00 -0.94 0.00 0.00 52.86 51.94 1esj s ASN 25 Cb 0.00 -1.55 0.58 0.00 -2.00 0.00 0.00 41.25 38.28 1esj s ASN 25 CO 0.00 -0.15 1.36 -0.46 -2.94 0.00 0.00 177.10 174.90 1esj n ASN 26 N -1.39 0.00 0.10 3.54 0.23 -1.26 -1.68 115.26 114.79 1esj n ASN 26 Ca -0.06 0.30 -0.03 0.00 -0.53 0.00 0.00 54.58 54.25 1esj n ASN 26 Cb 0.58 -0.39 -0.02 0.00 -2.08 0.00 0.00 39.78 37.86 1esj n ASN 26 CO 0.00 0.00 0.00 0.58 -0.93 0.00 0.00 177.26 176.91 1esj h VAL 27 N 0.00 1.37 0.00 3.53 2.07 -1.98 -3.37 116.25 117.88 1esj h VAL 27 Ca 0.00 -2.83 0.00 0.00 0.82 0.00 0.00 66.70 64.69 1esj h VAL 27 Cb 0.16 2.61 0.00 0.00 -1.52 0.00 0.00 31.29 32.54 1esj h VAL 27 CO 0.00 0.76 0.00 1.33 0.02 0.00 0.00 177.57 179.68 1esj n VAL 28 N -3.35 0.31 -0.02 2.57 0.24 -0.98 -4.79 118.33 112.31 1esj n VAL 28 Ca 0.01 -0.58 -0.10 0.00 -2.04 0.00 0.00 64.34 61.62 1esj n VAL 28 Cb 0.82 0.93 -0.04 0.00 -1.47 0.00 0.00 33.84 34.09 1esj n VAL 28 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 1esj h THR 29 N 0.24 0.93 -0.53 3.34 1.35 -1.49 -1.85 112.91 114.90 1esj h THR 29 Ca 0.00 -0.02 -0.01 0.00 -0.55 0.00 0.00 66.41 65.83 1esj h THR 29 Cb 0.25 0.85 -0.02 0.00 -1.73 0.00 0.00 68.15 67.50 1esj h THR 29 CO 0.00 0.01 0.29 -1.13 -0.25 0.00 0.00 175.52 174.44 1esj h ASN 30 N 0.07 0.65 -0.05 5.36 -0.73 -1.87 -0.71 115.58 118.29 1esj h ASN 30 Ca 0.06 -0.09 -0.12 0.00 1.87 0.00 0.00 56.30 58.02 1esj h ASN 30 Cb 0.06 -0.17 -0.01 0.00 0.27 0.00 0.00 38.32 38.47 1esj h ASN 30 CO -0.09 0.55 -0.36 0.15 -0.37 0.00 0.00 177.43 177.31 1esj h PHE 31 N 0.70 0.63 -0.38 0.67 3.57 -1.89 -0.77 116.94 119.48 1esj h PHE 31 Ca 0.19 -0.17 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 1esj h PHE 31 Cb 0.04 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.62 1esj h PHE 31 CO -0.02 0.83 0.08 1.15 -2.23 0.00 0.00 178.31 178.12 1esj h THR 32 N 0.46 1.23 -0.15 4.41 2.02 -1.04 0.60 112.91 120.44 1esj h THR 32 Ca 0.05 -0.80 -0.03 0.00 0.77 0.00 0.00 66.41 66.40 1esj h THR 32 Cb 0.83 1.02 -0.00 0.00 -1.74 0.00 0.00 68.15 68.26 1esj h THR 32 CO 0.07 0.27 -0.02 0.00 0.37 0.00 0.00 175.52 176.22 1esj h ALA 33 N 0.93 0.20 -0.44 6.16 0.00 -1.01 -1.93 119.26 123.18 1esj h ALA 33 Ca 0.12 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1esj h ALA 33 Cb 0.32 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1esj h ALA 33 CO 0.00 -0.07 0.11 -0.91 0.00 0.00 0.00 179.25 178.38 1esj h ASN 34 N -0.01 0.60 -0.41 0.00 2.35 -1.08 -0.39 115.58 116.64 1esj h ASN 34 Ca 0.04 -0.09 -0.08 0.00 -0.55 0.00 0.00 56.30 55.62 1esj h ASN 34 Cb 0.42 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 1esj h ASN 34 CO 0.01 0.60 -0.05 1.23 -1.65 0.00 0.00 177.43 177.57 1esj h GLY 35 N 0.85 0.82 1.04 2.83 0.00 -0.79 -0.68 103.07 107.14 1esj h GLY 35 Ca 0.15 -0.64 -0.08 0.00 0.00 0.00 0.00 47.33 46.75 1esj h GLY 35 CO -0.00 0.59 0.01 1.41 0.00 0.00 0.00 176.54 178.54 1esj h LEU 36 N 0.58 0.93 -0.65 3.11 3.38 -1.02 -1.11 115.31 120.53 1esj h LEU 36 Ca 0.11 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.74 1esj h LEU 36 Cb 0.55 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 1esj h LEU 36 CO 0.03 1.01 0.27 -0.07 0.09 0.00 0.00 178.44 179.77 1esj h LEU 37 N 0.83 0.90 -0.44 1.67 3.38 -0.95 0.52 115.31 121.22 1esj h LEU 37 Ca 0.15 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1esj h LEU 37 Cb 0.52 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1esj h LEU 37 CO 0.03 0.82 0.21 0.00 0.09 0.00 0.00 178.44 179.58 1esj h ALA 38 N 1.12 0.56 -0.89 1.53 0.00 -0.92 -2.80 119.26 117.86 1esj h ALA 38 Ca 0.22 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1esj h ALA 38 Cb 0.19 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1esj h ALA 38 CO -0.02 0.12 0.57 1.25 0.00 0.00 0.00 179.25 181.18 1esj h LEU 39 N 0.56 0.96 0.00 0.00 5.85 -0.94 -3.19 115.31 118.55 1esj h LEU 39 Ca 0.15 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1esj h LEU 39 Cb 0.12 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.93 1esj h LEU 39 CO -0.02 0.66 0.00 0.61 -0.34 0.00 0.00 178.44 179.35 1esj n GLY 40 N -1.34 1.07 3.98 3.75 0.00 -0.64 -4.69 105.19 107.31 1esj n GLY 40 Ca 0.11 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 1esj n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1esj s ALA 41 N -1.53 4.45 -0.30 4.61 0.00 0.08 -3.83 121.76 125.25 1esj s ALA 41 Ca 0.00 -1.80 -0.02 0.00 0.00 0.00 0.00 51.96 50.14 1esj s ALA 41 Cb 0.00 -1.39 0.05 0.00 0.00 0.00 0.00 23.12 21.78 1esj s ALA 41 CO 0.00 -0.40 0.00 -1.12 0.00 0.00 0.00 175.76 174.24 1esj s SER 42 N -4.36 4.90 0.16 0.00 0.01 -0.05 -3.85 113.70 110.50 1esj s SER 42 Ca 0.54 -1.28 -0.22 0.00 1.31 0.00 0.00 55.95 56.30 1esj s SER 42 Cb -0.07 -1.71 -0.08 0.00 0.21 0.00 0.00 66.02 64.37 1esj s SER 42 CO 0.32 -0.26 0.70 -2.16 0.41 0.00 0.00 173.24 172.25 1esj s PRO 43 N 1.25 4.35 -0.03 12.44 0.04 -1.26 0.02 135.00 151.81 1esj s PRO 43 Ca -0.05 0.93 -0.01 0.00 0.04 0.00 0.00 61.00 61.91 1esj s PRO 43 Cb -0.20 -3.12 0.03 0.00 0.04 0.00 0.00 34.50 31.25 1esj s PRO 43 CO -0.01 0.53 0.06 0.54 0.04 0.00 0.00 177.00 178.16 1esj s VAL 44 N -1.27 -0.07 -0.20 -0.36 0.11 -0.62 -4.90 120.40 113.09 1esj s VAL 44 Ca 0.36 0.25 -0.03 0.00 -2.93 0.00 0.00 61.98 59.64 1esj s VAL 44 Cb -0.20 -0.13 -0.01 0.00 -1.53 0.00 0.00 36.38 34.52 1esj s VAL 44 CO 0.22 0.10 -0.07 -0.04 -3.33 0.00 0.00 175.10 171.99 1esj s MET 45 N 1.32 3.35 -0.13 1.54 -1.94 -1.26 -1.26 119.30 120.92 1esj s MET 45 Ca -0.06 -0.65 -0.08 0.00 -1.71 0.00 0.00 55.69 53.19 1esj s MET 45 Cb -0.13 -2.90 0.05 0.00 2.01 0.00 0.00 34.83 33.86 1esj s MET 45 CO -0.04 -0.12 0.33 0.00 -0.01 0.00 0.00 175.02 175.18 1esj s ALA 46 N 1.24 -0.80 0.00 3.03 0.00 -1.25 -5.02 121.76 118.96 1esj s ALA 46 Ca 0.03 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.20 1esj s ALA 46 Cb -0.14 -0.75 0.00 0.00 0.00 0.00 0.00 23.12 22.23 1esj s ALA 46 CO -0.03 -0.22 0.00 0.66 0.00 0.00 0.00 175.76 176.17 1esj n TYR 47 N 4.07 0.00 -1.79 0.00 0.53 -1.26 -4.63 117.16 114.09 1esj n TYR 47 Ca -0.23 0.00 -0.42 0.00 -1.02 0.00 0.00 57.90 56.23 1esj n TYR 47 Cb 0.55 0.00 -0.02 0.00 -1.03 0.00 0.00 39.34 38.83 1esj n TYR 47 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1esj s ALA 48 N -1.20 3.80 0.30 -0.72 0.00 -1.26 -4.80 121.76 117.89 1esj s ALA 48 Ca 0.00 1.55 0.36 0.00 0.00 0.00 0.00 51.96 53.87 1esj s ALA 48 Cb 0.00 -3.66 1.89 0.00 0.00 0.00 0.00 23.12 21.35 1esj s ALA 48 CO 0.00 -0.94 2.11 1.57 0.00 0.00 0.00 175.76 178.50 1esj h LYS 49 N 5.63 0.00 0.00 0.00 2.10 -1.94 0.51 116.57 122.88 1esj h LYS 49 Ca -0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 1esj h LYS 49 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 1esj h LYS 49 CO 0.85 0.00 0.00 0.39 -2.00 0.00 0.00 179.45 178.69 1esj n GLU 50 N -2.84 0.17 0.00 0.07 4.71 -1.26 -4.28 120.64 117.21 1esj n GLU 50 Ca -0.02 0.24 0.00 0.00 -0.01 0.00 0.00 57.16 57.37 1esj n GLU 50 Cb 0.11 -1.74 0.00 0.00 -1.01 0.00 0.00 31.44 28.80 1esj n GLU 50 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 177.13 176.37 1esj n GLU 51 N -2.04 1.79 -0.22 3.49 0.28 -0.13 -4.89 120.64 118.93 1esj n GLU 51 Ca 0.05 0.00 0.07 0.00 -0.16 0.00 0.00 57.16 57.12 1esj n GLU 51 Cb 0.33 -0.17 0.35 0.00 1.43 0.00 0.00 31.44 33.38 1esj n GLU 51 CO 0.00 0.00 0.00 -0.39 -0.16 0.00 0.00 177.13 176.58 1esj h VAL 52 N 0.00 0.99 -0.48 3.84 -1.51 -1.17 -0.23 116.25 117.68 1esj h VAL 52 Ca 0.00 -0.27 -0.05 0.00 -1.23 0.00 0.00 66.70 65.15 1esj h VAL 52 Cb 0.00 0.14 -0.02 0.00 -2.13 0.00 0.00 31.29 29.28 1esj h VAL 52 CO 0.00 0.14 0.10 0.00 -1.23 0.00 0.00 177.57 176.58 1esj h ALA 53 N 1.59 0.64 -0.27 5.19 0.00 -1.84 -0.11 119.26 124.46 1esj h ALA 53 Ca 0.35 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.93 1esj h ALA 53 Cb 0.36 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1esj h ALA 53 CO -0.13 0.35 -0.31 -0.44 0.00 0.00 0.00 179.25 178.71 1esj h ASP 54 N 0.66 0.59 -0.03 0.00 3.45 -1.72 -2.63 116.42 116.74 1esj h ASP 54 Ca 0.15 -0.23 -0.17 0.00 0.43 0.00 0.00 57.03 57.21 1esj h ASP 54 Cb 0.36 -0.16 0.01 0.00 -0.56 0.00 0.00 39.33 38.98 1esj h ASP 54 CO 0.01 0.87 -0.63 -0.03 -1.57 0.00 0.00 179.24 177.88 1esj h MET 55 N 0.49 0.49 -0.93 3.56 4.05 -0.92 -3.30 114.93 118.37 1esj h MET 55 Ca 0.06 -0.48 -0.01 0.00 -0.28 0.00 0.00 59.70 58.99 1esj h MET 55 Cb 0.78 0.13 -0.04 0.00 -0.80 0.00 0.00 31.60 31.67 1esj h MET 55 CO 0.06 1.12 0.55 0.00 0.23 0.00 0.00 176.91 178.87 1esj h ALA 56 N 0.38 1.22 0.00 0.39 0.00 -1.00 -2.61 119.26 117.63 1esj h ALA 56 Ca -0.07 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1esj h ALA 56 Cb 1.32 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1esj h ALA 56 CO 0.13 0.66 0.00 1.57 0.00 0.00 0.00 179.25 181.61 1esj h LYS 57 N 1.29 0.00 -0.11 0.00 2.10 -1.55 -2.25 116.57 116.05 1esj h LYS 57 Ca 0.33 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.98 1esj h LYS 57 Cb -0.04 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.29 1esj h LYS 57 CO -0.06 0.00 0.00 0.44 -2.00 0.00 0.00 179.45 177.83 1esj n ILE 58 N -2.97 0.18 -2.22 0.07 -5.35 -1.01 -4.99 119.36 103.06 1esj n ILE 58 Ca -0.01 -0.59 -0.29 0.00 -0.27 0.00 0.00 62.75 61.59 1esj n ILE 58 Cb 0.19 1.19 0.02 0.00 -1.74 0.00 0.00 39.64 39.31 1esj n ILE 58 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1esj s ALA 59 N -1.31 3.19 -0.12 -1.28 0.00 -0.85 -4.93 121.76 116.46 1esj s ALA 59 Ca 0.22 -0.44 0.15 0.00 0.00 0.00 0.00 51.96 51.90 1esj s ALA 59 Cb 0.15 -2.80 -0.06 0.00 0.00 0.00 0.00 23.12 20.41 1esj s ALA 59 CO 0.21 -0.75 1.12 0.78 0.00 0.00 0.00 175.76 177.12 1esj h GLY 60 N -0.22 0.00 -4.09 0.00 0.00 -0.44 -3.47 103.07 94.84 1esj h GLY 60 Ca -0.45 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.84 1esj h GLY 60 CO 0.62 0.00 0.24 0.00 0.00 0.00 0.00 176.54 177.40 1esj s ALA 61 N -2.92 -1.80 -0.11 3.60 0.00 -1.17 -4.25 121.76 115.12 1esj s ALA 61 Ca 0.00 1.38 0.00 0.00 0.00 0.00 0.00 51.96 53.34 1esj s ALA 61 Cb 0.08 -0.14 -0.02 0.00 0.00 0.00 0.00 23.12 23.05 1esj s ALA 61 CO 0.78 -0.36 -0.12 -1.17 0.00 0.00 0.00 175.76 174.89 1esj s LEU 62 N -1.14 2.80 -0.14 0.00 2.96 0.67 -1.62 118.68 122.20 1esj s LEU 62 Ca -0.09 -0.26 0.02 0.00 -0.22 0.00 0.00 54.13 53.57 1esj s LEU 62 Cb -0.00 -1.62 0.02 0.00 0.50 0.00 0.00 46.19 45.08 1esj s LEU 62 CO 0.08 0.21 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.46 1esj s VAL 63 N 0.06 1.83 -0.20 1.68 1.01 0.57 -0.22 120.40 125.13 1esj s VAL 63 Ca -0.04 -0.82 -0.06 0.00 0.00 0.00 0.00 61.98 61.06 1esj s VAL 63 Cb -0.14 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.55 1esj s VAL 63 CO 0.04 0.50 0.02 -0.76 0.00 0.00 0.00 175.10 174.91 1esj s LEU 64 N 1.11 3.40 -0.16 3.92 1.43 0.98 -1.38 118.68 127.98 1esj s LEU 64 Ca -0.02 -0.14 0.00 0.00 -1.03 0.00 0.00 54.13 52.94 1esj s LEU 64 Cb -0.14 -1.87 0.03 0.00 0.03 0.00 0.00 46.19 44.24 1esj s LEU 64 CO -0.06 0.07 -0.10 0.21 0.23 0.00 0.00 176.35 176.70 1esj s ASN 65 N 0.96 2.80 -0.12 2.29 3.84 -0.56 -0.38 114.94 123.76 1esj s ASN 65 Ca 0.02 -0.59 0.08 0.00 0.21 0.00 0.00 52.86 52.58 1esj s ASN 65 Cb -0.14 -1.08 0.44 0.00 -0.55 0.00 0.00 41.25 39.91 1esj s ASN 65 CO 0.02 -0.11 1.18 2.30 -2.79 0.00 0.00 177.10 177.69 1esj n ILE 66 N 4.80 1.43 0.00 -5.21 -5.35 -1.11 -4.43 119.36 109.49 1esj n ILE 66 Ca -0.15 -0.74 0.00 0.00 -0.27 0.00 0.00 62.75 61.60 1esj n ILE 66 Cb 0.49 -0.35 0.00 0.00 -1.74 0.00 0.00 39.64 38.04 1esj n ILE 66 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1esj n GLY 67 N 0.38 -2.75 2.44 3.28 0.00 -1.26 -3.32 105.19 103.95 1esj n GLY 67 Ca 0.15 0.58 -0.27 0.00 0.00 0.00 0.00 46.02 46.48 1esj n GLY 67 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1esj n THR 68 N -1.26 1.82 -1.54 2.61 -2.24 -1.26 -4.94 114.28 107.47 1esj n THR 68 Ca 0.00 -5.00 -0.30 0.00 -2.27 0.00 0.00 64.05 56.49 1esj n THR 68 Cb 0.00 -2.08 0.19 0.00 -2.10 0.00 0.00 70.33 66.34 1esj n THR 68 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 1esj s LEU 69 N -2.16 1.82 0.07 3.22 2.34 -1.21 -4.83 118.68 117.93 1esj s LEU 69 Ca 0.38 0.54 -0.08 0.00 0.06 0.00 0.00 54.13 55.03 1esj s LEU 69 Cb 0.13 -2.53 -0.00 0.00 -0.56 0.00 0.00 46.19 43.23 1esj s LEU 69 CO -0.04 -3.21 0.17 -0.94 -1.06 0.00 0.00 176.35 171.27 1esj s SER 70 N -4.35 0.13 0.44 1.48 1.04 -1.26 -5.02 113.70 106.16 1esj s SER 70 Ca 0.71 -0.60 0.14 0.00 0.48 0.00 0.00 55.95 56.68 1esj s SER 70 Cb -0.08 0.31 1.04 0.00 0.10 0.00 0.00 66.02 67.39 1esj s SER 70 CO 0.54 -0.67 1.97 0.50 0.98 0.00 0.00 173.24 176.56 1esj h LYS 71 N 2.99 0.39 -0.26 4.02 3.64 -2.00 -2.15 116.57 123.19 1esj h LYS 71 Ca -0.33 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 58.98 1esj h LYS 71 Cb 1.19 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.92 1esj h LYS 71 CO 0.55 0.26 0.01 1.49 -2.27 0.00 0.00 179.45 179.48 1esj h GLU 72 N 0.40 0.46 -0.11 1.90 4.81 -2.00 -2.71 114.58 117.32 1esj h GLU 72 Ca 0.29 -0.14 -0.11 0.00 -0.13 0.00 0.00 59.36 59.26 1esj h GLU 72 Cb 0.60 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 1esj h GLU 72 CO -0.08 0.62 -0.43 0.66 -0.73 0.00 0.00 179.01 179.05 1esj h SER 73 N 0.25 0.28 -0.60 1.04 4.64 -1.77 -1.99 113.55 115.39 1esj h SER 73 Ca 0.08 -0.12 -0.06 0.00 -0.47 0.00 0.00 61.79 61.22 1esj h SER 73 Cb 0.40 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.39 1esj h SER 73 CO 0.01 0.68 0.16 0.58 -0.87 0.00 0.00 176.83 177.39 1esj h VAL 74 N 0.22 1.25 -0.64 0.95 2.07 -1.43 0.22 116.25 118.88 1esj h VAL 74 Ca 0.02 -0.88 0.04 0.00 0.82 0.00 0.00 66.70 66.70 1esj h VAL 74 Cb 0.85 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 1esj h VAL 74 CO 0.07 0.33 0.38 -0.08 0.02 0.00 0.00 177.57 178.29 1esj h GLU 75 N 0.87 0.70 -0.42 1.57 4.81 -1.22 -1.83 114.58 119.07 1esj h GLU 75 Ca 0.19 -0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 59.25 1esj h GLU 75 Cb 0.33 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 1esj h GLU 75 CO -0.00 0.46 -0.27 0.00 -0.73 0.00 0.00 179.01 178.48 1esj h ALA 76 N 1.31 0.73 -0.82 2.92 0.00 -0.77 -2.28 119.26 120.35 1esj h ALA 76 Ca 0.27 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1esj h ALA 76 Cb 0.10 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1esj h ALA 76 CO -0.14 0.66 0.48 0.52 0.00 0.00 0.00 179.25 180.77 1esj h MET 77 N 0.76 1.12 -0.30 0.00 2.86 -0.02 0.09 114.93 119.45 1esj h MET 77 Ca 0.09 -0.11 -0.18 0.00 -2.06 0.00 0.00 59.70 57.44 1esj h MET 77 Cb 0.82 -0.23 -0.00 0.00 0.06 0.00 0.00 31.60 32.25 1esj h MET 77 CO 0.07 0.80 -0.52 0.82 1.06 0.00 0.00 176.91 179.14 1esj h ILE 78 N 1.14 1.28 -0.38 -1.22 2.04 -1.23 0.37 117.51 119.50 1esj h ILE 78 Ca 0.29 -1.71 -0.01 0.00 1.00 0.00 0.00 64.86 64.44 1esj h ILE 78 Cb -0.02 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 1esj h ILE 78 CO -0.05 0.56 0.21 0.40 0.00 0.00 0.00 178.15 179.27 1esj h ILE 79 N 0.67 1.14 -0.67 -0.67 2.04 -0.98 -1.02 117.51 118.02 1esj h ILE 79 Ca 0.02 -0.36 -0.08 0.00 1.00 0.00 0.00 64.86 65.44 1esj h ILE 79 Cb 1.12 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 37.86 1esj h ILE 79 CO 0.12 0.15 0.10 0.00 0.00 0.00 0.00 178.15 178.51 1esj h ALA 80 N 1.07 0.89 -0.62 1.87 0.00 -0.88 -2.31 119.26 119.28 1esj h ALA 80 Ca 0.13 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1esj h ALA 80 Cb 0.04 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1esj h ALA 80 CO -0.02 0.67 0.29 0.78 0.00 0.00 0.00 179.25 180.97 1esj h GLY 81 N 1.04 0.97 1.34 0.00 0.00 -0.61 0.09 103.07 105.90 1esj h GLY 81 Ca 0.20 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 46.96 1esj h GLY 81 CO 0.02 0.46 -0.06 0.50 0.00 0.00 0.00 176.54 177.46 1esj h LYS 82 N 0.86 0.80 -0.20 4.80 1.57 -1.06 0.33 116.57 123.66 1esj h LYS 82 Ca 0.21 -0.24 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 1esj h LYS 82 Cb 0.13 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1esj h LYS 82 CO -0.03 0.84 0.03 1.03 -0.57 0.00 0.00 179.45 180.75 1esj h SER 83 N 0.73 0.33 -0.67 0.86 0.87 -1.05 -1.94 113.55 112.67 1esj h SER 83 Ca 0.13 -0.27 0.05 0.00 -1.23 0.00 0.00 61.79 60.48 1esj h SER 83 Cb 0.53 -0.09 -0.05 0.00 -0.44 0.00 0.00 62.40 62.35 1esj h SER 83 CO 0.03 0.51 0.38 0.00 -0.53 0.00 0.00 176.83 177.22 1esj h ALA 84 N 0.83 0.89 -0.66 6.23 0.00 -0.69 -2.32 119.26 123.54 1esj h ALA 84 Ca 0.06 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1esj h ALA 84 Cb 0.32 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1esj h ALA 84 CO 0.00 0.08 0.43 -0.91 0.00 0.00 0.00 179.25 178.86 1esj h ASN 85 N 0.72 0.73 0.58 0.00 2.35 -0.68 0.02 115.58 119.29 1esj h ASN 85 Ca 0.29 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.03 1esj h ASN 85 Cb 0.15 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.34 1esj h ASN 85 CO -0.16 0.52 0.00 -0.08 -1.65 0.00 0.00 177.43 176.06 1esj h GLU 86 N 0.86 0.00 -0.17 0.81 4.81 -0.81 -2.92 114.58 117.17 1esj h GLU 86 Ca 0.25 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 1esj h GLU 86 Cb -0.05 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.33 1esj h GLU 86 CO -0.07 0.00 0.00 0.72 -0.73 0.00 0.00 179.01 178.93 1esj n HIS 87 N -2.74 0.34 -1.95 0.92 8.25 -0.70 -4.98 115.22 114.36 1esj n HIS 87 Ca -0.00 -0.66 -0.14 0.00 -0.26 0.00 0.00 57.72 56.66 1esj n HIS 87 Cb 0.19 -0.11 -0.03 0.00 1.12 0.00 0.00 29.99 31.17 1esj n HIS 87 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1esj n GLY 88 N -0.32 0.41 3.62 -1.41 0.00 -0.68 -4.98 105.19 101.83 1esj n GLY 88 Ca 0.11 -0.32 -0.40 0.00 0.00 0.00 0.00 46.02 45.40 1esj n GLY 88 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1esj s VAL 89 N -2.63 5.02 0.31 1.61 1.01 -0.09 -5.03 120.40 120.60 1esj s VAL 89 Ca 0.00 1.01 -0.29 0.00 0.00 0.00 0.00 61.98 62.69 1esj s VAL 89 Cb 0.00 -3.89 -0.11 0.00 0.00 0.00 0.00 36.38 32.38 1esj s VAL 89 CO 0.00 0.05 1.55 -2.16 0.00 0.00 0.00 175.10 174.54 1esj s PRO 90 N 2.42 4.13 -0.13 2.72 0.04 -1.26 -4.36 135.00 138.56 1esj s PRO 90 Ca 0.24 2.56 0.00 0.00 0.04 0.00 0.00 61.00 63.84 1esj s PRO 90 Cb -0.16 -3.01 -0.01 0.00 0.04 0.00 0.00 34.50 31.36 1esj s PRO 90 CO 0.09 -0.59 -0.15 0.08 0.04 0.00 0.00 177.00 176.47 1esj s VAL 91 N -0.32 2.86 -0.08 -0.36 1.01 -1.26 -0.24 120.40 122.02 1esj s VAL 91 Ca 0.60 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.88 1esj s VAL 91 Cb -0.47 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 33.69 1esj s VAL 91 CO 0.52 0.53 -0.15 -0.63 0.00 0.00 0.00 175.10 175.36 1esj s ILE 92 N 0.45 2.95 -0.08 2.22 -1.09 0.69 -0.16 121.20 126.18 1esj s ILE 92 Ca -0.11 -0.74 0.03 0.00 -2.23 0.00 0.00 60.65 57.60 1esj s ILE 92 Cb -0.16 -2.17 -0.02 0.00 -1.58 0.00 0.00 42.46 38.53 1esj s ILE 92 CO 0.05 0.57 -0.18 -0.22 -1.23 0.00 0.00 174.94 173.93 1esj s LEU 93 N -0.33 2.48 -0.39 2.97 2.96 -0.73 -0.02 118.68 125.62 1esj s LEU 93 Ca 0.03 -0.36 -0.01 0.00 -0.22 0.00 0.00 54.13 53.57 1esj s LEU 93 Cb -0.13 -1.50 0.11 0.00 0.50 0.00 0.00 46.19 45.17 1esj s LEU 93 CO 0.02 0.25 0.17 -0.62 -1.32 0.00 0.00 176.35 174.85 1esj s ASP 94 N -0.16 5.12 0.00 3.68 -1.08 0.49 -0.98 116.67 123.74 1esj s ASP 94 Ca -0.02 -2.08 -0.01 0.00 -0.52 0.00 0.00 52.55 49.92 1esj s ASP 94 Cb -0.14 -1.77 -0.03 0.00 -1.46 0.00 0.00 42.92 39.52 1esj s ASP 94 CO 0.04 -0.50 2.15 -0.81 0.52 0.00 0.00 175.17 176.57 1esj n PRO 95 N 4.48 1.10 -1.68 4.34 -0.04 -1.25 -2.74 135.00 139.21 1esj n PRO 95 Ca -0.00 -0.12 -0.58 0.00 -0.04 0.00 0.00 63.50 62.76 1esj n PRO 95 Cb 0.41 -1.12 -0.07 0.00 -0.04 0.00 0.00 33.50 32.68 1esj n PRO 95 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1esj n VAL 96 N 1.63 0.18 -0.71 0.52 0.31 -1.26 -1.25 118.33 117.75 1esj n VAL 96 Ca 0.05 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 1esj n VAL 96 Cb 0.54 -0.97 0.00 0.00 -0.91 0.00 0.00 33.84 32.50 1esj n VAL 96 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1esj n GLY 97 N 3.68 1.09 3.70 2.92 0.00 -1.26 -4.47 105.19 110.84 1esj n GLY 97 Ca 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.85 1esj n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1esj s ALA 98 N -3.51 3.82 0.00 4.61 0.00 -0.38 -1.58 121.76 124.72 1esj s ALA 98 Ca 0.00 1.50 0.00 0.00 0.00 0.00 0.00 51.96 53.46 1esj s ALA 98 Cb 0.00 -3.74 0.00 0.00 0.00 0.00 0.00 23.12 19.38 1esj s ALA 98 CO 0.00 -1.14 0.00 0.41 0.00 0.00 0.00 175.76 175.03 1esj n GLY 99 N 4.16 3.01 0.23 0.00 0.00 -1.26 -4.15 105.19 107.17 1esj n GLY 99 Ca 0.17 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.34 1esj n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1esj h ALA 100 N 0.00 1.00 -2.22 4.61 0.00 -1.71 -3.45 119.26 117.49 1esj h ALA 100 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1esj h ALA 100 Cb 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 17.59 1esj h ALA 100 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 179.25 180.20 1esj s THR 101 N -3.43 0.02 0.09 0.00 -4.23 -1.25 -5.11 115.64 101.74 1esj s THR 101 Ca 0.04 -0.18 -0.31 0.00 -1.18 0.00 0.00 61.69 60.07 1esj s THR 101 Cb 0.08 -0.84 -0.14 0.00 1.34 0.00 0.00 72.50 72.94 1esj s THR 101 CO 0.57 -0.10 1.62 1.55 -0.54 0.00 0.00 174.62 177.73 1esj h PRO 102 N 3.49 -0.70 -0.85 3.99 0.13 -1.94 -2.59 132.00 133.53 1esj h PRO 102 Ca -0.28 0.05 0.09 0.00 -0.87 0.00 0.00 66.00 64.98 1esj h PRO 102 Cb 1.16 0.16 -0.06 0.00 0.13 0.00 0.00 31.00 32.39 1esj h PRO 102 CO 0.37 -0.47 0.55 0.35 -0.23 0.00 0.00 178.00 178.58 1esj h PHE 103 N -0.73 0.90 -0.38 1.56 3.57 -1.99 -0.81 116.94 119.07 1esj h PHE 103 Ca -0.03 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.41 1esj h PHE 103 Cb 0.64 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 1esj h PHE 103 CO -0.17 0.44 -0.08 -0.09 -2.23 0.00 0.00 178.31 176.17 1esj h ARG 104 N 0.86 0.73 -0.11 1.11 9.65 -1.88 -1.10 114.38 123.64 1esj h ARG 104 Ca 0.39 -0.28 -0.00 0.00 -1.10 0.00 0.00 59.98 58.99 1esj h ARG 104 Cb 0.36 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 28.89 1esj h ARG 104 CO -0.15 0.87 0.06 1.15 2.80 0.00 0.00 179.97 184.70 1esj h THR 105 N 0.54 1.08 -0.74 0.20 2.02 -0.97 -1.20 112.91 113.84 1esj h THR 105 Ca 0.10 -0.22 -0.06 0.00 0.77 0.00 0.00 66.41 67.00 1esj h THR 105 Cb 0.59 1.03 -0.03 0.00 -1.74 0.00 0.00 68.15 68.01 1esj h THR 105 CO 0.04 0.07 0.23 -0.33 0.37 0.00 0.00 175.52 175.89 1esj h GLU 106 N 0.09 1.15 -0.40 6.66 5.08 -1.13 -2.08 114.58 123.95 1esj h GLU 106 Ca 0.04 -0.25 -0.06 0.00 -1.00 0.00 0.00 59.36 58.09 1esj h GLU 106 Cb 0.06 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 1esj h GLU 106 CO -0.01 0.98 0.01 0.77 -1.00 0.00 0.00 179.01 179.77 1esj h SER 107 N 1.11 0.60 -0.58 1.42 0.02 -1.02 -0.70 113.55 114.40 1esj h SER 107 Ca 0.24 -0.12 -0.08 0.00 -0.84 0.00 0.00 61.79 60.98 1esj h SER 107 Cb 0.31 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 1esj h SER 107 CO -0.01 0.67 0.05 0.00 -1.14 0.00 0.00 176.83 176.40 1esj h ALA 108 N 1.41 0.94 -0.11 3.77 0.00 -0.72 -2.81 119.26 121.73 1esj h ALA 108 Ca 0.13 -0.28 -0.16 0.00 0.00 0.00 0.00 54.91 54.59 1esj h ALA 108 Cb 0.37 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1esj h ALA 108 CO 0.01 0.65 -0.61 0.00 0.00 0.00 0.00 179.25 179.29 1esj h ARG 109 N 0.94 0.40 -0.57 0.00 3.08 -0.72 -2.91 114.38 114.61 1esj h ARG 109 Ca 0.18 -0.28 -0.06 0.00 0.07 0.00 0.00 59.98 59.89 1esj h ARG 109 Cb 0.48 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.55 1esj h ARG 109 CO 0.02 0.89 0.12 -0.44 -1.07 0.00 0.00 179.97 179.49 1esj h ASP 110 N 0.29 0.88 -0.06 7.04 3.32 -1.04 -1.18 116.42 125.67 1esj h ASP 110 Ca -0.01 -0.24 -0.00 0.00 0.02 0.00 0.00 57.03 56.80 1esj h ASP 110 Cb 1.15 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 40.46 1esj h ASP 110 CO 0.10 0.89 0.04 0.40 -1.72 0.00 0.00 179.24 178.96 1esj h ILE 111 N 0.82 1.05 -0.13 0.35 2.04 -1.48 0.70 117.51 120.87 1esj h ILE 111 Ca 0.18 -0.15 -0.03 0.00 1.00 0.00 0.00 64.86 65.86 1esj h ILE 111 Cb 0.37 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1esj h ILE 111 CO 0.01 0.05 -0.06 0.40 0.00 0.00 0.00 178.15 178.54 1esj h ILE 112 N 0.04 1.13 -0.12 -0.67 2.04 -1.44 0.50 117.51 118.99 1esj h ILE 112 Ca 0.02 -0.54 -0.20 0.00 1.00 0.00 0.00 64.86 65.15 1esj h ILE 112 Cb 0.04 1.10 0.00 0.00 -0.74 0.00 0.00 36.82 37.23 1esj h ILE 112 CO -0.00 0.17 -0.74 -0.09 0.00 0.00 0.00 178.15 177.49 1esj h ARG 113 N 0.19 0.59 0.00 2.37 2.43 -0.59 -3.34 114.38 116.03 1esj h ARG 113 Ca 0.04 -0.48 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 1esj h ARG 113 Cb 0.24 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1esj h ARG 113 CO 0.01 1.10 -1.44 0.39 -1.51 0.00 0.00 179.97 178.52 1esj n GLU 114 N -3.89 0.42 -4.78 0.20 -0.58 0.18 -4.95 120.64 107.24 1esj n GLU 114 Ca -0.06 -0.08 -0.26 0.00 -0.42 0.00 0.00 57.16 56.35 1esj n GLU 114 Cb 0.72 -1.56 -0.16 0.00 -0.57 0.00 0.00 31.44 29.86 1esj n GLU 114 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1esj s VAL 115 N -3.31 1.38 -0.03 2.62 1.01 0.17 -4.74 120.40 117.51 1esj s VAL 115 Ca -0.01 -0.66 -0.30 0.00 0.00 0.00 0.00 61.98 61.02 1esj s VAL 115 Cb 0.14 -1.21 -0.03 0.00 0.00 0.00 0.00 36.38 35.28 1esj s VAL 115 CO 0.86 0.40 1.09 -0.13 0.00 0.00 0.00 175.10 177.32 1esj s ARG 116 N 0.31 4.45 -0.02 2.72 0.52 -1.26 -4.52 118.95 121.15 1esj s ARG 116 Ca -0.10 1.55 0.01 0.00 -0.52 0.00 0.00 55.73 56.68 1esj s ARG 116 Cb -0.14 -3.48 -0.03 0.00 0.52 0.00 0.00 34.95 31.82 1esj s ARG 116 CO 0.04 -0.25 -0.02 -0.51 0.02 0.00 0.00 175.30 174.57 1esj s LEU 117 N 1.55 3.40 0.08 2.53 1.43 -1.26 -4.61 118.68 121.80 1esj s LEU 117 Ca 0.53 -0.02 0.10 0.00 -1.03 0.00 0.00 54.13 53.71 1esj s LEU 117 Cb -0.23 -1.91 -0.19 0.00 0.03 0.00 0.00 46.19 43.90 1esj s LEU 117 CO 0.24 0.30 1.08 0.00 0.23 0.00 0.00 176.35 178.20 1esj h ALA 118 N 4.58 0.53 -2.20 4.21 0.00 -0.92 -3.44 119.26 122.02 1esj h ALA 118 Ca -0.49 -1.04 0.09 0.00 0.00 0.00 0.00 54.91 53.48 1esj h ALA 118 Cb 1.18 0.08 -0.16 0.00 0.00 0.00 0.00 17.79 18.88 1esj h ALA 118 CO 0.56 1.28 0.48 0.00 0.00 0.00 0.00 179.25 181.56 1esj s ALA 119 N -2.71 -1.83 -0.07 0.00 0.00 -1.21 -2.72 121.76 113.23 1esj s ALA 119 Ca -0.01 1.08 0.01 0.00 0.00 0.00 0.00 51.96 53.05 1esj s ALA 119 Cb 0.09 0.27 0.02 0.00 0.00 0.00 0.00 23.12 23.50 1esj s ALA 119 CO 0.81 -0.63 -0.09 0.42 0.00 0.00 0.00 175.76 176.28 1esj s ILE 120 N -2.80 0.90 -0.24 0.00 1.01 -0.24 -1.77 121.20 118.07 1esj s ILE 120 Ca 0.03 -0.32 0.02 0.00 0.00 0.00 0.00 60.65 60.39 1esj s ILE 120 Cb -0.01 -0.87 0.05 0.00 0.01 0.00 0.00 42.46 41.64 1esj s ILE 120 CO -0.07 0.31 -0.13 -0.60 0.00 0.00 0.00 174.94 174.45 1esj s ARG 121 N 0.94 2.44 0.32 2.79 3.00 -0.15 -0.92 118.95 127.37 1esj s ARG 121 Ca -0.10 -1.18 -0.18 0.00 -1.00 0.00 0.00 55.73 53.27 1esj s ARG 121 Cb -0.15 -2.78 0.05 0.00 0.00 0.00 0.00 34.95 32.08 1esj s ARG 121 CO 0.01 -0.46 0.83 0.20 0.00 0.00 0.00 175.30 175.88 1esj s GLY 122 N 1.17 0.22 0.70 8.12 0.00 -0.90 -3.96 107.32 112.67 1esj s GLY 122 Ca -0.05 -0.56 -0.07 0.00 0.00 0.00 0.00 44.72 44.04 1esj s GLY 122 CO -0.07 0.23 1.01 0.54 0.00 0.00 0.00 173.10 174.81 1esj s ASN 123 N -3.10 4.88 0.25 1.64 2.20 -1.26 -2.12 114.94 117.42 1esj s ASN 123 Ca 0.16 0.49 -0.06 0.00 -0.94 0.00 0.00 52.86 52.50 1esj s ASN 123 Cb -0.05 -1.16 0.46 0.00 -2.00 0.00 0.00 41.25 38.50 1esj s ASN 123 CO 0.09 -1.56 1.64 0.00 -2.94 0.00 0.00 177.10 174.34 1esj h ALA 124 N -0.57 0.84 0.46 3.54 0.00 -1.91 -1.05 119.26 120.56 1esj h ALA 124 Ca -0.44 0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1esj h ALA 124 Cb 1.31 0.38 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1esj h ALA 124 CO 0.60 -0.42 -0.22 0.00 0.00 0.00 0.00 179.25 179.21 1esj h ALA 125 N 1.70 -0.62 -0.88 0.00 0.00 -1.95 -0.70 119.26 116.80 1esj h ALA 125 Ca 0.42 -0.17 0.09 0.00 0.00 0.00 0.00 54.91 55.26 1esj h ALA 125 Cb 0.75 0.24 -0.07 0.00 0.00 0.00 0.00 17.79 18.71 1esj h ALA 125 CO -0.64 -0.78 0.53 0.93 0.00 0.00 0.00 179.25 179.28 1esj h GLU 126 N -0.76 0.86 -0.18 0.00 5.08 -1.62 0.39 114.58 118.35 1esj h GLU 126 Ca -0.06 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 1esj h GLU 126 Cb 0.54 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1esj h GLU 126 CO 0.10 0.57 0.06 0.82 -1.00 0.00 0.00 179.01 179.56 1esj h ILE 127 N 0.88 1.18 0.46 3.13 1.08 -1.13 -0.35 117.51 122.77 1esj h ILE 127 Ca 0.42 -0.57 -0.02 0.00 -0.39 0.00 0.00 64.86 64.29 1esj h ILE 127 Cb 0.36 1.22 0.00 0.00 -3.07 0.00 0.00 36.82 35.33 1esj h ILE 127 CO -0.24 0.18 -0.22 0.00 -0.69 0.00 0.00 178.15 177.18 1esj h ALA 128 N 0.88 -0.62 0.00 1.87 0.00 -0.09 -1.43 119.26 119.87 1esj h ALA 128 Ca 0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1esj h ALA 128 Cb 0.22 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 1esj h ALA 128 CO -0.00 -0.84 -0.04 0.45 0.00 0.00 0.00 179.25 178.82 1esj h HIS 129 N -0.64 0.00 0.16 0.00 3.86 -0.25 0.59 115.15 118.86 1esj h HIS 129 Ca -0.06 0.00 -0.31 0.00 -1.16 0.00 0.00 60.37 58.84 1esj h HIS 129 Cb 0.49 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.96 1esj h HIS 129 CO -0.04 0.04 -1.47 1.15 0.86 0.00 0.00 177.93 178.46 1esj h THR 130 N 0.00 1.24 0.00 2.45 2.02 -0.73 -3.36 112.91 114.53 1esj h THR 130 Ca -0.00 -2.81 -0.23 0.00 0.77 0.00 0.00 66.41 64.14 1esj h THR 130 Cb 0.11 2.87 -0.04 0.00 -1.74 0.00 0.00 68.15 69.35 1esj h THR 130 CO 0.00 0.84 -1.75 0.52 0.37 0.00 0.00 175.52 175.51 1esj n VAL 131 N -3.55 1.25 -1.90 3.16 0.31 -0.57 -4.69 118.33 112.34 1esj n VAL 131 Ca -0.15 -0.74 -0.39 0.00 -0.01 0.00 0.00 64.34 63.04 1esj n VAL 131 Cb 1.06 -0.70 -0.03 0.00 -0.91 0.00 0.00 33.84 33.26 1esj n VAL 131 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1esj n GLY 132 N 1.50 2.61 0.37 2.92 0.00 0.20 -4.73 105.19 108.06 1esj n GLY 132 Ca -0.16 -1.25 0.12 0.00 0.00 0.00 0.00 46.02 44.73 1esj n GLY 132 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1esj h VAL 133 N 5.09 0.87 -2.13 1.61 -1.51 -1.85 -3.41 116.25 114.90 1esj h VAL 133 Ca 0.41 -0.19 -0.60 0.00 -1.23 0.00 0.00 66.70 65.09 1esj h VAL 133 Cb 0.78 0.27 -0.13 0.00 -2.13 0.00 0.00 31.29 30.09 1esj h VAL 133 CO 1.62 0.10 -0.71 0.42 -1.23 0.00 0.00 177.57 177.77 1esj s THR 134 N -5.52 2.61 -1.58 7.19 -4.23 -1.26 -5.02 115.64 107.83 1esj s THR 134 Ca -0.09 -2.25 0.21 0.00 -1.18 0.00 0.00 61.69 58.38 1esj s THR 134 Cb 0.21 -2.49 0.44 0.00 1.34 0.00 0.00 72.50 71.99 1esj s THR 134 CO 0.77 -0.34 1.68 -0.90 -0.54 0.00 0.00 174.62 175.29 1esj n ASP 135 N -0.73 0.00 -0.00 3.99 5.68 -1.26 -2.78 116.55 121.46 1esj n ASP 135 Ca -0.05 -0.19 0.04 0.00 -0.50 0.00 0.00 54.79 54.08 1esj n ASP 135 Cb 0.61 -0.21 -0.05 0.00 -1.14 0.00 0.00 41.12 40.32 1esj n ASP 135 CO 0.00 0.00 0.00 -2.67 -1.33 0.00 0.00 177.20 173.20 1esj n TRP 136 N -1.21 0.00 -0.28 2.11 4.27 -1.26 -4.68 117.44 116.39 1esj n TRP 136 Ca 0.12 0.00 0.02 0.00 -3.89 0.00 0.00 57.50 53.75 1esj n TRP 136 Cb 0.14 -0.07 0.10 0.00 -1.36 0.00 0.00 31.31 30.12 1esj n TRP 136 CO 0.00 0.00 0.00 1.25 -2.29 0.00 0.00 177.69 176.65 1esj h LEU 137 N 0.00 -0.73 -9.01 5.67 7.12 -1.88 -3.33 115.31 113.14 1esj h LEU 137 Ca 0.00 0.24 -0.59 0.00 0.13 0.00 0.00 57.88 57.65 1esj h LEU 137 Cb 0.26 0.49 -0.09 0.00 -0.53 0.00 0.00 40.66 40.79 1esj h LEU 137 CO 0.00 -0.26 0.52 -0.63 -0.13 0.00 0.00 178.44 177.94 1esj s ILE 138 N -6.24 4.79 0.29 4.05 -1.09 -1.26 -5.04 121.20 116.70 1esj s ILE 138 Ca -0.15 1.56 0.08 0.00 -2.23 0.00 0.00 60.65 59.92 1esj s ILE 138 Cb 0.23 -4.16 -0.04 0.00 -1.58 0.00 0.00 42.46 36.91 1esj s ILE 138 CO 0.75 -0.14 0.14 -0.75 -1.23 0.00 0.00 174.94 173.72 1esj s LYS 139 N 2.95 2.59 0.00 2.79 2.20 -1.25 -5.02 119.74 124.00 1esj s LYS 139 Ca 0.36 -1.31 0.00 0.00 -0.36 0.00 0.00 55.97 54.66 1esj s LYS 139 Cb -0.15 -2.35 0.00 0.00 -1.51 0.00 0.00 37.83 33.83 1esj s LYS 139 CO 0.09 0.27 0.00 0.41 -0.36 0.00 0.00 175.35 175.76 1esj n GLY 140 N -1.13 0.59 3.02 5.54 0.00 -1.26 -4.92 105.19 107.03 1esj n GLY 140 Ca -0.05 -0.83 -0.12 0.00 0.00 0.00 0.00 46.02 45.01 1esj n GLY 140 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1esj s VAL 141 N 0.00 -0.00 -0.15 1.61 1.01 -1.26 -5.15 120.40 116.45 1esj s VAL 141 Ca 0.00 0.01 -0.06 0.00 0.00 0.00 0.00 61.98 61.93 1esj s VAL 141 Cb 0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 36.38 36.13 1esj s VAL 141 CO 0.00 0.00 0.05 -1.81 0.00 0.00 0.00 175.10 173.34 1esj s ASP 142 N 0.13 5.54 0.32 3.32 1.11 -1.26 -4.88 116.67 120.95 1esj s ASP 142 Ca -0.00 0.12 -0.16 0.00 0.18 0.00 0.00 52.55 52.68 1esj s ASP 142 Cb -0.01 -1.85 0.06 0.00 1.07 0.00 0.00 42.92 42.18 1esj s ASP 142 CO -0.00 0.24 0.83 0.00 1.18 0.00 0.00 175.17 177.42 1esj n ALA 143 N 3.07 -1.98 -1.51 5.23 0.00 -1.26 -5.16 120.51 118.90 1esj n ALA 143 Ca -0.17 -1.14 -0.33 0.00 0.00 0.00 0.00 53.44 51.79 1esj n ALA 143 Cb 0.53 0.84 0.05 0.00 0.00 0.00 0.00 19.45 20.87 1esj n ALA 143 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1esj s GLY 144 N -3.11 2.25 0.00 0.00 0.00 -1.26 -4.58 107.32 100.61 1esj s GLY 144 Ca 0.17 0.64 0.00 0.00 0.00 0.00 0.00 44.72 45.54 1esj s GLY 144 CO 0.10 1.01 0.00 1.18 0.00 0.00 0.00 173.10 175.38 1esj n GLU 145 N -2.36 0.00 0.00 2.90 1.02 -1.26 -4.89 120.64 116.05 1esj n GLU 145 Ca 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 1esj n GLU 145 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.93 1esj n GLU 145 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1esj n GLY 146 N 0.00 2.61 0.00 0.62 0.00 -1.26 -5.04 105.19 102.12 1esj n GLY 146 Ca 0.00 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 43.99 1esj n GLY 146 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1esj n GLY 147 N -0.21 -0.20 0.09 -0.02 0.00 -1.26 -4.86 105.19 98.74 1esj n GLY 147 Ca 0.00 0.11 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 1esj n GLY 147 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1esj h GLY 148 N 0.00 0.17 2.00 -0.02 0.00 -1.99 1.05 103.07 104.28 1esj h GLY 148 Ca 0.00 -0.24 -0.04 0.00 0.00 0.00 0.00 47.33 47.05 1esj h GLY 148 CO 0.00 0.21 -0.17 1.29 0.00 0.00 0.00 176.54 177.87 1esj h ASP 149 N -0.44 0.00 0.27 0.19 -0.00 -1.93 0.96 116.42 115.47 1esj h ASP 149 Ca -0.01 0.00 -0.15 0.00 -0.00 0.00 0.00 57.03 56.87 1esj h ASP 149 Cb 0.82 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.14 1esj h ASP 149 CO 0.03 0.17 -0.58 0.40 -0.00 0.00 0.00 179.24 179.26 1esj h ILE 150 N 0.00 1.36 -0.17 4.15 1.08 -1.72 0.18 117.51 122.40 1esj h ILE 150 Ca -0.00 -1.91 -0.03 0.00 -0.39 0.00 0.00 64.86 62.53 1esj h ILE 150 Cb 0.39 1.93 -0.01 0.00 -3.07 0.00 0.00 36.82 36.06 1esj h ILE 150 CO 0.02 0.57 0.00 0.40 -0.69 0.00 0.00 178.15 178.46 1esj h ILE 151 N 0.24 1.25 -0.08 -0.67 2.04 0.35 -0.41 117.51 120.24 1esj h ILE 151 Ca -0.00 -0.83 -0.09 0.00 1.00 0.00 0.00 64.86 64.94 1esj h ILE 151 Cb 1.09 1.47 -0.01 0.00 -0.74 0.00 0.00 36.82 38.63 1esj h ILE 151 CO 0.10 0.25 -0.35 0.03 0.00 0.00 0.00 178.15 178.17 1esj h ARG 152 N 0.04 0.15 -0.26 2.37 3.08 -1.10 -1.87 114.38 116.80 1esj h ARG 152 Ca 0.05 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 1esj h ARG 152 Cb 0.37 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 1esj h ARG 152 CO 0.01 0.49 0.10 1.25 -1.07 0.00 0.00 179.97 180.75 1esj h LEU 153 N 0.13 0.37 -0.76 3.04 5.85 -0.35 -1.23 115.31 122.36 1esj h LEU 153 Ca 0.02 -0.17 -0.07 0.00 0.84 0.00 0.00 57.88 58.50 1esj h LEU 153 Cb 0.69 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 1esj h LEU 153 CO 0.05 0.43 0.18 0.00 -0.34 0.00 0.00 178.44 178.77 1esj h ALA 154 N 0.95 0.99 -0.32 1.25 0.00 -0.73 -1.51 119.26 119.88 1esj h ALA 154 Ca 0.09 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 1esj h ALA 154 Cb 0.18 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1esj h ALA 154 CO -0.01 0.66 -0.23 1.96 0.00 0.00 0.00 179.25 181.63 1esj h GLN 155 N 1.06 0.72 -0.77 0.00 4.20 -1.25 0.05 115.11 119.12 1esj h GLN 155 Ca 0.22 -0.35 -0.01 0.00 0.06 0.00 0.00 58.65 58.58 1esj h GLN 155 Cb 0.35 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.09 1esj h GLN 155 CO -0.00 0.96 0.46 1.96 -0.67 0.00 0.00 178.83 181.54 1esj h GLN 156 N 0.48 1.05 -0.20 1.46 4.20 -1.10 -1.00 115.11 119.99 1esj h GLN 156 Ca 0.06 -0.10 -0.15 0.00 0.06 0.00 0.00 58.65 58.52 1esj h GLN 156 Cb 0.79 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 28.35 1esj h GLN 156 CO 0.06 0.75 -0.46 0.00 -0.67 0.00 0.00 178.83 178.51 1esj h ALA 157 N 1.24 0.33 -0.72 3.87 0.00 -1.19 -1.59 119.26 121.20 1esj h ALA 157 Ca 0.28 -0.48 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1esj h ALA 157 Cb -0.03 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1esj h ALA 157 CO -0.05 0.48 0.37 0.00 0.00 0.00 0.00 179.25 180.05 1esj h ALA 158 N 0.60 0.92 -0.07 0.00 0.00 -0.77 -0.29 119.26 119.64 1esj h ALA 158 Ca -0.00 -0.13 -0.23 0.00 0.00 0.00 0.00 54.91 54.55 1esj h ALA 158 Cb 1.07 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.59 1esj h ALA 158 CO 0.10 0.46 -0.87 1.96 0.00 0.00 0.00 179.25 180.90 1esj h GLN 159 N 0.99 0.63 -0.54 0.00 4.20 -1.23 0.34 115.11 119.51 1esj h GLN 159 Ca 0.25 -0.58 -0.11 0.00 0.06 0.00 0.00 58.65 58.27 1esj h GLN 159 Cb 0.07 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 1esj h GLN 159 CO -0.04 1.19 -0.09 -0.22 -0.67 0.00 0.00 178.83 179.01 1esj h LYS 160 N 0.39 1.01 -0.02 1.46 3.11 -1.12 -3.18 116.57 118.22 1esj h LYS 160 Ca -0.07 -0.37 0.00 0.00 -2.81 0.00 0.00 60.65 57.40 1esj h LYS 160 Cb 1.50 -0.07 0.00 0.00 -1.00 0.00 0.00 32.23 32.66 1esj h LYS 160 CO 0.17 1.05 -0.43 1.28 -2.81 0.00 0.00 179.45 178.71 1esj n LEU 161 N -4.18 2.09 -3.71 5.20 4.77 -0.13 -4.99 117.00 116.05 1esj n LEU 161 Ca 0.01 -0.76 -0.23 0.00 -0.03 0.00 0.00 56.01 55.00 1esj n LEU 161 Cb 0.39 -0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.51 1esj n LEU 161 CO 0.45 0.38 -0.09 -3.20 -1.33 0.00 0.00 177.39 173.61 1esj n ASN 162 N 0.08 -1.89 -2.02 -1.43 5.15 0.11 -4.90 115.26 110.37 1esj n ASN 162 Ca 0.10 -0.87 -0.07 0.00 -0.60 0.00 0.00 54.58 53.13 1esj n ASN 162 Cb 0.48 -3.88 -0.02 0.00 -0.53 0.00 0.00 39.78 35.84 1esj n ASN 162 CO 0.00 0.00 0.00 1.07 1.40 0.00 0.00 177.26 179.73 1esj n THR 163 N -4.22 0.00 -3.51 -0.44 5.66 -0.86 -4.93 114.28 105.97 1esj n THR 163 Ca -0.26 -0.90 -0.37 0.00 -3.05 0.00 0.00 64.05 59.47 1esj n THR 163 Cb 0.66 0.56 -0.07 0.00 -1.55 0.00 0.00 70.33 69.94 1esj n THR 163 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1esj s VAL 164 N -2.63 5.26 -0.20 1.08 1.01 -1.10 -4.38 120.40 119.45 1esj s VAL 164 Ca 0.15 0.63 -0.02 0.00 0.00 0.00 0.00 61.98 62.74 1esj s VAL 164 Cb -0.01 -3.66 -0.00 0.00 0.00 0.00 0.00 36.38 32.71 1esj s VAL 164 CO 0.11 0.41 -0.08 -0.63 0.00 0.00 0.00 175.10 174.90 1esj s ILE 165 N 0.25 3.12 -0.40 2.22 -1.09 0.41 -1.07 121.20 124.63 1esj s ILE 165 Ca 0.19 -0.59 -0.01 0.00 -2.23 0.00 0.00 60.65 58.01 1esj s ILE 165 Cb -0.14 -2.39 0.11 0.00 -1.58 0.00 0.00 42.46 38.47 1esj s ILE 165 CO 0.06 0.46 0.18 0.00 -1.23 0.00 0.00 174.94 174.40 1esj s ALA 166 N 1.26 3.11 -0.58 9.38 0.00 -0.09 -1.41 121.76 133.43 1esj s ALA 166 Ca 0.03 -2.59 -0.20 0.00 0.00 0.00 0.00 51.96 49.20 1esj s ALA 166 Cb -0.14 -2.31 0.08 0.00 0.00 0.00 0.00 23.12 20.75 1esj s ALA 166 CO -0.03 -1.79 0.74 0.42 0.00 0.00 0.00 175.76 175.09 1esj s ILE 167 N 0.99 4.73 0.46 0.00 1.01 0.66 -2.12 121.20 126.93 1esj s ILE 167 Ca 0.10 -0.68 -0.14 0.00 0.00 0.00 0.00 60.65 59.93 1esj s ILE 167 Cb -0.22 -4.47 -0.07 0.00 0.01 0.00 0.00 42.46 37.71 1esj s ILE 167 CO -0.05 -1.09 0.89 0.42 0.00 0.00 0.00 174.94 175.11 1esj s THR 168 N 2.96 4.65 -2.32 2.92 -4.23 -0.90 -1.19 115.64 117.53 1esj s THR 168 Ca 0.15 0.95 0.00 0.00 -1.18 0.00 0.00 61.69 61.62 1esj s THR 168 Cb -0.21 -3.72 0.00 0.00 1.34 0.00 0.00 72.50 69.91 1esj s THR 168 CO 0.09 -0.61 0.00 0.61 -0.54 0.00 0.00 174.62 174.18 1esj n GLY 169 N -1.43 -1.28 0.31 3.99 0.00 -1.26 -4.41 105.19 101.11 1esj n GLY 169 Ca 0.05 -0.99 0.15 0.00 0.00 0.00 0.00 46.02 45.22 1esj n GLY 169 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1esj h GLU 170 N 0.00 0.27 -5.20 1.61 4.11 -1.96 -3.32 114.58 110.08 1esj h GLU 170 Ca 0.00 -0.02 -0.66 0.00 0.07 0.00 0.00 59.36 58.75 1esj h GLU 170 Cb 0.00 -0.06 -0.33 0.00 0.50 0.00 0.00 28.75 28.86 1esj h GLU 170 CO 0.00 0.18 -0.87 0.08 0.07 0.00 0.00 179.01 178.47 1esj s VAL 171 N -5.88 1.97 0.07 -1.06 1.01 -1.26 -4.72 120.40 110.53 1esj s VAL 171 Ca -0.12 -0.95 -0.18 0.00 0.00 0.00 0.00 61.98 60.74 1esj s VAL 171 Cb 0.26 -1.72 -0.06 0.00 0.00 0.00 0.00 36.38 34.86 1esj s VAL 171 CO 0.78 0.54 0.53 -1.81 0.00 0.00 0.00 175.10 175.13 1esj s ASP 172 N 0.57 6.98 -0.16 3.32 1.01 -0.51 -4.82 116.67 123.05 1esj s ASP 172 Ca -0.14 1.18 0.01 0.00 0.71 0.00 0.00 52.55 54.31 1esj s ASP 172 Cb -0.17 -2.33 0.01 0.00 1.01 0.00 0.00 42.92 41.45 1esj s ASP 172 CO 0.04 0.26 -0.19 -0.69 0.21 0.00 0.00 175.17 174.81 1esj s VAL 173 N -1.15 2.24 -0.06 -1.27 1.01 -0.33 -0.40 120.40 120.44 1esj s VAL 173 Ca 0.29 -0.90 0.03 0.00 0.00 0.00 0.00 61.98 61.40 1esj s VAL 173 Cb -0.18 -1.93 0.01 0.00 0.00 0.00 0.00 36.38 34.27 1esj s VAL 173 CO 0.18 0.53 -0.14 -0.63 0.00 0.00 0.00 175.10 175.04 1esj s ILE 174 N 1.05 1.24 0.02 2.22 1.01 -0.46 -0.25 121.20 126.04 1esj s ILE 174 Ca -0.01 -0.57 -0.16 0.00 0.00 0.00 0.00 60.65 59.91 1esj s ILE 174 Cb -0.14 -1.10 0.03 0.00 0.01 0.00 0.00 42.46 41.25 1esj s ILE 174 CO -0.06 0.37 0.36 0.00 0.00 0.00 0.00 174.94 175.61 1esj s ALA 175 N 0.41 -0.87 0.00 9.38 0.00 -0.50 -0.50 121.76 129.67 1esj s ALA 175 Ca -0.10 0.25 0.00 0.00 0.00 0.00 0.00 51.96 52.11 1esj s ALA 175 Cb -0.14 0.25 0.00 0.00 0.00 0.00 0.00 23.12 23.23 1esj s ALA 175 CO 0.03 -0.39 0.00 -0.40 0.00 0.00 0.00 175.76 175.01 1esj n ASP 176 N 0.75 1.96 0.14 0.00 5.75 -0.78 -0.44 116.55 123.92 1esj n ASP 176 Ca -0.19 -0.17 0.11 0.00 -0.01 0.00 0.00 54.79 54.53 1esj n ASP 176 Cb 0.59 0.00 0.51 0.00 -1.03 0.00 0.00 41.12 41.19 1esj n ASP 176 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 1esj n THR 177 N 0.00 0.93 0.00 2.12 -1.04 -1.26 -4.00 114.28 111.03 1esj n THR 177 Ca 0.00 0.42 0.00 0.00 -2.04 0.00 0.00 64.05 62.43 1esj n THR 177 Cb 0.00 -1.37 0.00 0.00 -1.82 0.00 0.00 70.33 67.14 1esj n THR 177 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1esj n SER 178 N -2.21 2.70 -4.40 8.00 2.88 -1.26 -4.91 113.62 114.42 1esj n SER 178 Ca 0.01 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.34 1esj n SER 178 Cb 0.15 0.40 -0.10 0.00 -0.75 0.00 0.00 64.21 63.91 1esj n SER 178 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1esj s HIS 179 N -1.32 1.95 -0.04 0.66 3.76 -1.26 -5.04 115.29 114.01 1esj s HIS 179 Ca 0.00 -0.49 -0.02 0.00 -0.15 0.00 0.00 55.06 54.40 1esj s HIS 179 Cb 0.00 -0.89 0.02 0.00 1.11 0.00 0.00 32.58 32.82 1esj s HIS 179 CO 0.00 0.49 0.08 0.08 -0.85 0.00 0.00 174.74 174.55 1esj s VAL 180 N -2.79 -0.03 0.12 -0.90 1.01 -1.26 -1.87 120.40 114.68 1esj s VAL 180 Ca 0.26 0.10 0.04 0.00 0.00 0.00 0.00 61.98 62.37 1esj s VAL 180 Cb -0.02 -0.14 -0.04 0.00 0.00 0.00 0.00 36.38 36.18 1esj s VAL 180 CO 0.10 0.04 -0.10 -0.31 0.00 0.00 0.00 175.10 174.84 1esj s TYR 181 N 0.58 1.14 -0.05 5.22 1.51 0.34 -0.34 117.35 125.75 1esj s TYR 181 Ca -0.05 -0.76 0.05 0.00 -1.01 0.00 0.00 57.07 55.31 1esj s TYR 181 Cb -0.06 -0.60 -0.00 0.00 -0.11 0.00 0.00 41.96 41.18 1esj s TYR 181 CO -0.02 0.02 -0.19 0.95 -1.11 0.00 0.00 175.55 175.19 1esj s THR 182 N -3.13 1.62 -0.04 -0.71 -4.23 0.02 -1.35 115.64 107.82 1esj s THR 182 Ca 0.13 -0.82 0.06 0.00 -1.18 0.00 0.00 61.69 59.88 1esj s THR 182 Cb 0.01 -1.38 -0.02 0.00 1.34 0.00 0.00 72.50 72.45 1esj s THR 182 CO -0.01 0.46 -0.21 -0.76 -0.54 0.00 0.00 174.62 173.56 1esj s LEU 183 N -0.00 2.33 -0.47 4.79 2.01 0.46 -1.40 118.68 126.40 1esj s LEU 183 Ca -0.04 -0.37 0.07 0.00 0.01 0.00 0.00 54.13 53.81 1esj s LEU 183 Cb -0.12 -1.43 0.39 0.00 0.01 0.00 0.00 46.19 45.03 1esj s LEU 183 CO 0.03 0.32 0.99 1.41 1.01 0.00 0.00 176.35 180.10 1esj n HIS 184 N 2.48 3.00 -4.53 0.29 8.25 -0.65 -1.43 115.22 122.64 1esj n HIS 184 Ca -0.17 -3.48 -0.25 0.00 -0.26 0.00 0.00 57.72 53.56 1esj n HIS 184 Cb 0.52 -0.30 -0.09 0.00 1.12 0.00 0.00 29.99 31.23 1esj n HIS 184 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 1esj s ASN 185 N -3.34 2.87 0.00 0.41 -0.87 -1.26 -4.70 114.94 108.05 1esj s ASN 185 Ca 0.45 -1.56 0.00 0.00 -1.57 0.00 0.00 52.86 50.17 1esj s ASN 185 Cb 0.36 0.29 0.00 0.00 -0.02 0.00 0.00 41.25 41.88 1esj s ASN 185 CO -0.13 -0.80 0.00 0.61 -2.57 0.00 0.00 177.10 174.21 1esj n GLY 186 N -0.89 -0.81 3.48 0.66 0.00 -1.11 -4.86 105.19 101.66 1esj n GLY 186 Ca -0.07 -2.16 -0.17 0.00 0.00 0.00 0.00 46.02 43.62 1esj n GLY 186 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1esj s HIS 187 N 0.00 -0.58 0.54 1.61 2.46 -1.26 -4.52 115.29 113.54 1esj s HIS 187 Ca 0.00 0.98 0.42 0.00 0.47 0.00 0.00 55.06 56.94 1esj s HIS 187 Cb 0.00 0.36 2.21 0.00 -0.13 0.00 0.00 32.58 35.02 1esj s HIS 187 CO 0.00 -0.58 2.29 0.87 -2.47 0.00 0.00 174.74 174.85 1esj h LYS 188 N 3.12 0.00 0.00 2.88 6.56 -1.98 -2.47 116.57 124.69 1esj h LYS 188 Ca -0.28 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.31 1esj h LYS 188 Cb 1.15 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.81 1esj h LYS 188 CO 0.39 0.00 -0.03 -0.07 -2.06 0.00 0.00 179.45 177.68 1esj h LEU 189 N 0.00 0.00 -2.12 2.94 3.38 -1.97 -1.98 115.31 115.56 1esj h LEU 189 Ca 0.00 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.05 1esj h LEU 189 Cb 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1esj h LEU 189 CO 0.00 0.03 0.25 -0.07 0.09 0.00 0.00 178.44 178.74 1esj h LEU 190 N 0.00 0.00 0.00 1.67 3.38 -1.83 0.20 115.31 118.73 1esj h LEU 190 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1esj h LEU 190 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1esj h LEU 190 CO 0.00 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.88 1esj n THR 191 N -4.03 0.27 0.68 0.22 -2.24 -0.74 -2.87 114.28 105.56 1esj n THR 191 Ca 0.04 0.07 0.12 0.00 -2.27 0.00 0.00 64.05 62.00 1esj n THR 191 Cb 0.40 -0.65 0.17 0.00 -2.10 0.00 0.00 70.33 68.14 1esj n THR 191 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1esj n LYS 192 N -1.39 2.41 -4.09 -0.78 4.76 0.71 -4.86 118.16 114.91 1esj n LYS 192 Ca 0.09 -2.09 -0.32 0.00 -2.87 0.00 0.00 58.31 53.12 1esj n LYS 192 Cb 0.24 -1.49 -0.16 0.00 -1.84 0.00 0.00 35.03 31.78 1esj n LYS 192 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1esj s VAL 193 N -1.75 1.99 0.34 -0.18 1.01 -1.14 -4.95 120.40 115.72 1esj s VAL 193 Ca 0.34 -1.01 -0.28 0.00 0.00 0.00 0.00 61.98 61.03 1esj s VAL 193 Cb 0.21 -1.86 -0.10 0.00 0.00 0.00 0.00 36.38 34.63 1esj s VAL 193 CO 0.31 0.42 1.27 0.28 0.00 0.00 0.00 175.10 177.38 1esj s THR 194 N 1.29 2.84 0.00 3.92 -1.32 -1.26 -2.34 115.64 118.77 1esj s THR 194 Ca 0.03 0.83 0.00 0.00 -1.21 0.00 0.00 61.69 61.33 1esj s THR 194 Cb -0.14 -3.52 0.00 0.00 -1.51 0.00 0.00 72.50 67.33 1esj s THR 194 CO -0.11 0.18 0.00 0.61 -2.21 0.00 0.00 174.62 173.09 1esj n GLY 195 N 0.83 0.89 0.19 6.08 0.00 -1.26 -4.94 105.19 106.98 1esj n GLY 195 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 1esj n GLY 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1esj h ALA 196 N 0.00 0.55 -0.16 4.61 0.00 -1.74 0.16 119.26 122.68 1esj h ALA 196 Ca 0.00 -0.08 -0.19 0.00 0.00 0.00 0.00 54.91 54.64 1esj h ALA 196 Cb 0.00 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.62 1esj h ALA 196 CO 0.00 0.07 -0.65 0.78 0.00 0.00 0.00 179.25 179.44 1esj h GLY 197 N 0.57 0.81 1.00 0.00 0.00 -1.88 -2.37 103.07 101.20 1esj h GLY 197 Ca 0.15 -1.10 0.00 0.00 0.00 0.00 0.00 47.33 46.39 1esj h GLY 197 CO -0.03 0.98 0.42 1.76 0.00 0.00 0.00 176.54 179.67 1esj h SER 198 N 0.44 0.78 -0.36 0.19 0.02 -1.93 -1.44 113.55 111.25 1esj h SER 198 Ca -0.04 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.86 1esj h SER 198 Cb 1.28 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.61 1esj h SER 198 CO 0.14 0.59 0.17 0.25 -1.14 0.00 0.00 176.83 176.84 1esj h LEU 199 N 0.90 0.48 -0.77 5.07 5.85 -0.69 -2.22 115.31 123.94 1esj h LEU 199 Ca 0.24 -0.13 0.06 0.00 0.84 0.00 0.00 57.88 58.88 1esj h LEU 199 Cb -0.07 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 40.78 1esj h LEU 199 CO -0.05 0.48 0.46 0.25 -0.34 0.00 0.00 178.44 179.24 1esj h LEU 200 N 0.45 0.72 -0.59 2.25 5.85 -0.90 0.19 115.31 123.28 1esj h LEU 200 Ca 0.12 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 1esj h LEU 200 Cb 0.13 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 1esj h LEU 200 CO -0.01 0.47 0.30 0.74 -0.34 0.00 0.00 178.44 179.59 1esj h THR 201 N 0.85 1.20 0.00 1.05 2.02 -1.04 -0.22 112.91 116.77 1esj h THR 201 Ca 0.33 -0.55 -0.07 0.00 0.77 0.00 0.00 66.41 66.89 1esj h THR 201 Cb 0.15 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 1esj h THR 201 CO -0.17 0.23 -0.33 0.28 0.37 0.00 0.00 175.52 175.91 1esj h SER 202 N 0.80 0.00 -0.21 4.18 0.02 -0.73 -1.58 113.55 116.02 1esj h SER 202 Ca 0.20 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 61.02 1esj h SER 202 Cb 0.09 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 1esj h SER 202 CO -0.03 0.33 -0.32 0.58 -1.14 0.00 0.00 176.83 176.25 1esj h VAL 203 N 0.00 1.28 -0.86 2.27 2.07 0.25 -1.31 116.25 119.95 1esj h VAL 203 Ca -0.00 -1.46 -0.00 0.00 0.82 0.00 0.00 66.70 66.05 1esj h VAL 203 Cb 0.63 1.37 -0.04 0.00 -1.52 0.00 0.00 31.29 31.73 1esj h VAL 203 CO 0.04 0.48 0.52 0.58 0.02 0.00 0.00 177.57 179.21 1esj h VAL 204 N 0.61 1.24 -0.38 2.57 2.07 -0.32 -1.73 116.25 120.31 1esj h VAL 204 Ca 0.07 -0.52 0.02 0.00 0.82 0.00 0.00 66.70 67.09 1esj h VAL 204 Cb 0.84 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 1esj h VAL 204 CO 0.07 0.25 0.21 1.23 0.02 0.00 0.00 177.57 179.35 1esj h GLY 205 N 1.18 0.52 0.70 2.17 0.00 -0.72 -0.58 103.07 106.34 1esj h GLY 205 Ca 0.31 -0.15 0.07 0.00 0.00 0.00 0.00 47.33 47.55 1esj h GLY 205 CO -0.06 0.13 0.57 0.00 0.00 0.00 0.00 176.54 177.18 1esj h ALA 206 N 1.18 1.27 -0.12 3.60 0.00 -0.46 -1.86 119.26 122.86 1esj h ALA 206 Ca 0.15 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.89 1esj h ALA 206 Cb 0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1esj h ALA 206 CO -0.09 0.32 -0.60 0.74 0.00 0.00 0.00 179.25 179.62 1esj h PHE 207 N 1.03 0.53 0.00 0.00 -1.00 -0.93 -2.90 116.94 113.68 1esj h PHE 207 Ca 0.40 -0.20 -0.01 0.00 2.81 0.00 0.00 57.97 60.97 1esj h PHE 207 Cb 0.20 -0.09 -0.00 0.00 3.61 0.00 0.00 35.95 39.66 1esj h PHE 207 CO -0.02 0.91 -0.07 0.00 -1.61 0.00 0.00 178.31 177.52 1esj h ALA 209 N 1.93 0.92 0.00 0.00 0.00 -1.15 -3.35 119.26 117.61 1esj h ALA 209 Ca -0.00 -0.47 -0.14 0.00 0.00 0.00 0.00 54.91 54.29 1esj h ALA 209 Cb 0.37 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1esj h ALA 209 CO 0.01 0.65 -1.76 1.33 0.00 0.00 0.00 179.25 179.48 1esj n VAL 210 N -3.60 0.54 -3.72 0.00 0.24 -0.88 -1.91 118.33 109.00 1esj n VAL 210 Ca -0.00 -0.44 -0.37 0.00 -2.04 0.00 0.00 64.34 61.48 1esj n VAL 210 Cb 0.60 -0.35 -0.12 0.00 -1.47 0.00 0.00 33.84 32.49 1esj n VAL 210 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1esj s GLU 211 N -2.53 3.60 0.43 7.34 2.56 0.14 -0.93 118.70 129.31 1esj s GLU 211 Ca -0.06 -0.52 0.12 0.00 0.00 0.00 0.00 54.97 54.51 1esj s GLU 211 Cb 0.05 -3.40 0.95 0.00 2.00 0.00 0.00 34.13 33.74 1esj s GLU 211 CO 0.53 -0.24 1.99 1.05 -0.56 0.00 0.00 175.26 178.03 1esj h GLU 212 N 8.27 0.12 -5.47 4.30 4.11 0.38 -3.39 114.58 122.90 1esj h GLU 212 Ca -0.37 -0.02 -0.63 0.00 0.07 0.00 0.00 59.36 58.41 1esj h GLU 212 Cb 1.17 -0.02 -0.14 0.00 0.50 0.00 0.00 28.75 30.25 1esj h GLU 212 CO 0.58 0.24 0.46 1.21 0.07 0.00 0.00 179.01 181.57 1esj s ASN 213 N -6.95 6.23 0.48 3.06 3.84 -1.26 -4.91 114.94 115.43 1esj s ASN 213 Ca -0.05 -0.80 0.24 0.00 0.21 0.00 0.00 52.86 52.46 1esj s ASN 213 Cb 0.16 -2.40 1.27 0.00 -0.55 0.00 0.00 41.25 39.73 1esj s ASN 213 CO 0.71 -1.28 1.89 1.55 -2.79 0.00 0.00 177.10 177.18 1esj h PRO 214 N 9.39 0.20 -0.07 0.43 0.13 -1.91 0.18 132.00 140.35 1esj h PRO 214 Ca -0.28 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.83 1esj h PRO 214 Cb 1.08 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 32.16 1esj h PRO 214 CO 1.12 0.13 -0.00 1.25 -0.23 0.00 0.00 178.00 180.27 1esj h LEU 215 N 0.20 0.12 -0.67 1.56 5.85 -1.91 -0.61 115.31 119.86 1esj h LEU 215 Ca 0.42 -0.31 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 1esj h LEU 215 Cb 1.31 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.28 1esj h LEU 215 CO -0.09 0.40 0.25 -0.26 -0.34 0.00 0.00 178.44 178.40 1esj h PHE 216 N -0.16 1.04 -0.34 1.25 0.05 -1.54 -1.63 116.94 115.61 1esj h PHE 216 Ca 0.02 -0.09 0.02 0.00 3.82 0.00 0.00 57.97 61.74 1esj h PHE 216 Cb 0.34 -0.31 -0.03 0.00 2.00 0.00 0.00 35.95 37.95 1esj h PHE 216 CO 0.03 0.82 0.17 0.00 -0.18 0.00 0.00 178.31 179.16 1esj h ALA 217 N 1.11 0.41 -0.42 2.45 0.00 -0.59 0.16 119.26 122.38 1esj h ALA 217 Ca 0.22 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1esj h ALA 217 Cb 0.24 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1esj h ALA 217 CO -0.01 -0.20 0.20 0.00 0.00 0.00 0.00 179.25 179.24 1esj h ALA 218 N 1.17 0.54 -0.13 0.00 0.00 -0.90 0.17 119.26 120.11 1esj h ALA 218 Ca 0.14 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1esj h ALA 218 Cb 0.04 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1esj h ALA 218 CO -0.09 0.09 0.09 0.82 0.00 0.00 0.00 179.25 180.16 1esj h ILE 219 N 0.54 1.03 -0.78 0.00 2.04 -0.97 0.58 117.51 119.96 1esj h ILE 219 Ca 0.14 -0.06 -0.04 0.00 1.00 0.00 0.00 64.86 65.91 1esj h ILE 219 Cb 0.11 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 1esj h ILE 219 CO -0.02 0.03 0.35 0.00 0.00 0.00 0.00 178.15 178.51 1esj h ALA 220 N 1.05 1.01 0.02 1.87 0.00 -0.80 -0.71 119.26 121.69 1esj h ALA 220 Ca 0.05 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1esj h ALA 220 Cb -0.02 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.46 1esj h ALA 220 CO -0.01 0.60 -0.01 0.00 0.00 0.00 0.00 179.25 179.83 1esj h ALA 221 N 1.18 -0.03 -0.69 0.00 0.00 -0.62 -0.93 119.26 118.16 1esj h ALA 221 Ca 0.26 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1esj h ALA 221 Cb 0.16 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1esj h ALA 221 CO -0.03 -0.42 0.19 0.82 0.00 0.00 0.00 179.25 179.82 1esj h ILE 222 N -0.22 1.26 -0.36 0.00 2.04 -0.77 -1.29 117.51 118.15 1esj h ILE 222 Ca -0.00 -0.91 -0.09 0.00 1.00 0.00 0.00 64.86 64.86 1esj h ILE 222 Cb 0.21 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 1esj h ILE 222 CO 0.00 0.35 -0.13 0.28 0.00 0.00 0.00 178.15 178.66 1esj h SER 223 N 1.03 0.75 -0.37 1.72 0.02 -1.06 -0.13 113.55 115.51 1esj h SER 223 Ca 0.22 -0.39 -0.02 0.00 -0.84 0.00 0.00 61.79 60.76 1esj h SER 223 Cb 0.32 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.64 1esj h SER 223 CO -0.00 0.96 0.14 0.28 -1.14 0.00 0.00 176.83 177.07 1esj h SER 224 N 0.52 0.52 -0.37 3.07 0.02 -1.02 -0.80 113.55 115.49 1esj h SER 224 Ca 0.09 -0.18 -0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1esj h SER 224 Cb 0.66 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.05 1esj h SER 224 CO 0.04 0.56 0.22 0.22 -1.14 0.00 0.00 176.83 176.73 1esj h TYR 225 N 0.45 0.50 -0.63 3.45 3.20 -1.18 -1.32 116.97 121.45 1esj h TYR 225 Ca 0.12 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.97 1esj h TYR 225 Cb 0.21 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 1esj h TYR 225 CO 0.00 0.37 0.31 0.78 -1.64 0.00 0.00 178.16 177.98 1esj h GLY 226 N 0.48 0.96 1.00 1.82 0.00 -0.80 -0.04 103.07 106.50 1esj h GLY 226 Ca 0.13 -0.47 -0.05 0.00 0.00 0.00 0.00 47.33 46.94 1esj h GLY 226 CO -0.02 0.45 0.15 -2.08 0.00 0.00 0.00 176.54 175.03 1esj h VAL 227 N 0.86 1.24 -0.96 4.60 2.07 -0.98 -0.05 116.25 123.04 1esj h VAL 227 Ca 0.22 -0.86 -0.00 0.00 0.82 0.00 0.00 66.70 66.88 1esj h VAL 227 Cb 0.10 0.72 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 1esj h VAL 227 CO -0.03 0.32 0.58 0.00 0.02 0.00 0.00 177.57 178.46 1esj h ALA 228 N 1.03 1.22 -0.50 1.67 0.00 -0.91 -0.75 119.26 121.03 1esj h ALA 228 Ca 0.18 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1esj h ALA 228 Cb 0.32 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1esj h ALA 228 CO -0.00 0.67 0.03 0.00 0.00 0.00 0.00 179.25 179.94 1esj h ALA 229 N 1.32 1.11 -0.27 0.00 0.00 -0.35 0.03 119.26 121.11 1esj h ALA 229 Ca 0.34 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1esj h ALA 229 Cb -0.07 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1esj h ALA 229 CO -0.07 0.57 -0.03 1.96 0.00 0.00 0.00 179.25 181.69 1esj h GLN 230 N 0.76 0.49 -0.48 0.00 4.20 -0.14 -0.18 115.11 119.76 1esj h GLN 230 Ca 0.15 -0.17 -0.08 0.00 0.06 0.00 0.00 58.65 58.61 1esj h GLN 230 Cb 0.43 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.15 1esj h GLN 230 CO 0.02 0.67 -0.02 -0.07 -0.67 0.00 0.00 178.83 178.76 1esj h LEU 231 N 0.26 0.78 -0.38 1.46 3.38 -1.01 -2.06 115.31 117.75 1esj h LEU 231 Ca 0.07 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1esj h LEU 231 Cb 0.47 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1esj h LEU 231 CO 0.02 0.86 0.16 0.00 0.09 0.00 0.00 178.44 179.57 1esj h ALA 232 N 1.22 0.49 -0.57 1.53 0.00 -0.76 -0.91 119.26 120.26 1esj h ALA 232 Ca 0.14 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1esj h ALA 232 Cb 0.48 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1esj h ALA 232 CO 0.02 0.09 0.19 0.00 0.00 0.00 0.00 179.25 179.55 1esj h ALA 233 N 1.00 1.26 -0.04 0.00 0.00 -0.79 0.17 119.26 120.85 1esj h ALA 233 Ca 0.13 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1esj h ALA 233 Cb 0.17 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1esj h ALA 233 CO -0.01 0.53 0.01 1.96 0.00 0.00 0.00 179.25 181.74 1esj h GLN 234 N 0.83 0.07 -0.96 0.00 4.20 -1.08 -0.02 115.11 118.15 1esj h GLN 234 Ca 0.19 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.89 1esj h GLN 234 Cb 0.23 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.95 1esj h GLN 234 CO -0.01 0.25 0.62 0.37 -0.67 0.00 0.00 178.83 179.39 1esj h GLN 235 N -0.13 1.27 -0.53 1.46 5.75 -0.73 -2.40 115.11 119.81 1esj h GLN 235 Ca 0.01 -0.09 -0.12 0.00 -0.15 0.00 0.00 58.65 58.31 1esj h GLN 235 Cb 0.21 -0.28 -0.02 0.00 1.07 0.00 0.00 27.48 28.46 1esj h GLN 235 CO -0.00 0.86 -0.12 1.15 -2.65 0.00 0.00 178.83 178.06 1esj h THR 236 N 1.31 1.27 0.00 2.39 2.02 -0.49 -3.47 112.91 115.93 1esj h THR 236 Ca 0.35 -1.28 0.00 0.00 0.77 0.00 0.00 66.41 66.25 1esj h THR 236 Cb -0.12 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 1esj h THR 236 CO -0.07 0.45 0.00 0.00 0.37 0.00 0.00 175.52 176.27 1esj n ALA 237 N -2.50 0.00 -1.99 6.16 0.00 -0.04 -2.26 120.51 119.88 1esj n ALA 237 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.38 1esj n ALA 237 Cb 0.41 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.95 1esj n ALA 237 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1esj n ASP 238 N 10.00 2.99 -0.07 0.00 8.00 -1.26 -4.79 116.55 131.42 1esj n ASP 238 Ca 0.00 -3.46 -0.15 0.00 0.71 0.00 0.00 54.79 51.89 1esj n ASP 238 Cb 0.00 -0.42 -0.04 0.00 -0.02 0.00 0.00 41.12 40.64 1esj n ASP 238 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1esj h LYS 239 N 1.67 0.85 0.00 -1.24 1.57 -1.84 -3.50 116.57 114.08 1esj h LYS 239 Ca 0.12 -0.55 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1esj h LYS 239 Cb 1.34 0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.72 1esj h LYS 239 CO 0.35 1.19 0.00 0.41 -0.57 0.00 0.00 179.45 180.83 1esj n GLY 240 N 0.40 3.41 0.31 3.86 0.00 -1.26 -4.85 105.19 107.06 1esj n GLY 240 Ca -0.05 -1.75 0.19 0.00 0.00 0.00 0.00 46.02 44.42 1esj n GLY 240 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1esj h PRO 241 N 0.00 0.00 -0.03 1.61 0.13 -1.96 -1.84 132.00 129.91 1esj h PRO 241 Ca 0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 1esj h PRO 241 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 1esj h PRO 241 CO 0.00 0.02 -0.01 0.78 -0.23 0.00 0.00 178.00 178.55 1esj h GLY 242 N 0.82 0.07 1.55 1.56 0.00 -1.92 -0.63 103.07 104.51 1esj h GLY 242 Ca -0.00 -0.06 -0.07 0.00 0.00 0.00 0.00 47.33 47.19 1esj h GLY 242 CO 0.00 0.06 -0.12 1.76 0.00 0.00 0.00 176.54 178.24 1esj h SER 243 N -0.31 0.53 -0.56 0.19 0.02 -1.77 -2.87 113.55 108.78 1esj h SER 243 Ca 0.01 -0.14 -0.06 0.00 -0.84 0.00 0.00 61.79 60.76 1esj h SER 243 Cb 0.41 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 1esj h SER 243 CO 0.00 0.68 0.13 0.15 -1.14 0.00 0.00 176.83 176.65 1esj h PHE 244 N 0.51 0.96 -0.59 3.45 3.57 -1.19 0.46 116.94 124.11 1esj h PHE 244 Ca 0.09 -0.12 0.06 0.00 3.53 0.00 0.00 57.97 61.54 1esj h PHE 244 Cb 0.50 -0.27 -0.06 0.00 2.79 0.00 0.00 35.95 38.92 1esj h PHE 244 CO 0.02 0.83 0.28 0.37 -2.23 0.00 0.00 178.31 177.58 1esj h GLN 245 N 0.81 0.51 -0.37 1.11 4.15 -0.90 0.87 115.11 121.28 1esj h GLN 245 Ca 0.18 -0.03 -0.12 0.00 0.77 0.00 0.00 58.65 59.44 1esj h GLN 245 Cb 0.36 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.93 1esj h GLN 245 CO 0.00 0.34 -0.24 0.82 -1.93 0.00 0.00 178.83 177.82 1esj h ILE 246 N 0.53 1.28 0.00 2.39 1.08 -1.29 -3.00 117.51 118.50 1esj h ILE 246 Ca 0.27 -1.40 -0.08 0.00 -0.39 0.00 0.00 64.86 63.27 1esj h ILE 246 Cb 0.23 1.36 -0.01 0.00 -3.07 0.00 0.00 36.82 35.33 1esj h ILE 246 CO -0.21 0.46 -0.39 -0.08 -0.69 0.00 0.00 178.15 177.24 1esj h GLU 247 N 0.62 0.00 -0.58 2.37 4.57 -0.47 -1.22 114.58 119.87 1esj h GLU 247 Ca 0.08 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.16 1esj h GLU 247 Cb 0.81 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.38 1esj h GLU 247 CO 0.07 0.39 -0.01 1.25 -1.18 0.00 0.00 179.01 179.53 1esj h LEU 248 N 0.00 0.98 -0.33 1.64 5.85 -0.74 0.31 115.31 123.01 1esj h LEU 248 Ca -0.00 -0.28 -0.05 0.00 0.84 0.00 0.00 57.88 58.39 1esj h LEU 248 Cb 0.71 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 1esj h LEU 248 CO 0.05 1.04 0.02 -0.07 -0.34 0.00 0.00 178.44 179.14 1esj h LEU 249 N 0.92 0.57 -0.17 2.25 3.38 -1.32 -1.70 115.31 119.24 1esj h LEU 249 Ca 0.16 -0.29 0.02 0.00 0.09 0.00 0.00 57.88 57.86 1esj h LEU 249 Cb 0.55 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1esj h LEU 249 CO 0.03 0.72 0.02 0.78 0.09 0.00 0.00 178.44 180.08 1esj h ASN 250 N 0.39 -0.03 0.46 -0.43 2.35 -0.86 -2.91 115.58 114.56 1esj h ASN 250 Ca 0.10 0.03 -0.07 0.00 -0.55 0.00 0.00 56.30 55.81 1esj h ASN 250 Cb 0.42 0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 1esj h ASN 250 CO 0.01 0.01 -0.33 0.11 -1.65 0.00 0.00 177.43 175.58 1esj h LYS 251 N 0.08 0.00 0.00 0.81 1.79 -0.88 -0.84 116.57 117.52 1esj h LYS 251 Ca 0.08 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.54 1esj h LYS 251 Cb 0.08 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.73 1esj h LYS 251 CO -0.12 0.33 -0.06 -0.07 -1.08 0.00 0.00 179.45 178.45 1esj h LEU 252 N 0.00 0.00 0.09 2.94 3.38 -1.10 0.29 115.31 120.91 1esj h LEU 252 Ca -0.00 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.60 1esj h LEU 252 Cb 0.66 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.38 1esj h LEU 252 CO 0.04 0.06 -2.10 -0.24 0.09 0.00 0.00 178.44 176.30 1esj n SER 253 N -3.40 2.09 0.04 -0.43 2.88 -0.68 -3.79 113.62 110.33 1esj n SER 253 Ca -0.02 0.14 0.12 0.00 -1.33 0.00 0.00 58.87 57.78 1esj n SER 253 Cb 0.20 -0.76 0.13 0.00 -0.75 0.00 0.00 64.21 63.03 1esj n SER 253 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1esj n THR 254 N -3.47 0.25 -1.77 2.46 -2.24 -0.41 -4.89 114.28 104.22 1esj n THR 254 Ca -0.35 -0.23 -0.42 0.00 -2.27 0.00 0.00 64.05 60.78 1esj n THR 254 Cb 1.02 0.03 -0.02 0.00 -2.10 0.00 0.00 70.33 69.27 1esj n THR 254 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1esj s VAL 255 N -3.16 2.09 0.46 2.28 0.11 0.99 -4.97 120.40 118.20 1esj s VAL 255 Ca 0.06 0.07 0.08 0.00 -2.93 0.00 0.00 61.98 59.25 1esj s VAL 255 Cb 0.14 -3.04 0.01 0.00 -1.53 0.00 0.00 36.38 31.96 1esj s VAL 255 CO 0.75 0.01 0.46 0.42 -3.33 0.00 0.00 175.10 173.40 1esj s THR 256 N 0.49 2.42 0.27 5.04 -4.23 -1.26 -4.99 115.64 113.38 1esj s THR 256 Ca 0.68 -1.30 -0.04 0.00 -1.18 0.00 0.00 61.69 59.85 1esj s THR 256 Cb -0.48 -2.72 0.26 0.00 1.34 0.00 0.00 72.50 70.90 1esj s THR 256 CO 0.41 0.00 1.95 -0.08 -0.54 0.00 0.00 174.62 176.36 1esj h GLU 257 N 0.82 1.22 -0.49 3.99 4.81 -1.93 -2.08 114.58 120.91 1esj h GLU 257 Ca -0.39 -0.07 -0.07 0.00 -0.13 0.00 0.00 59.36 58.70 1esj h GLU 257 Cb 1.28 -0.27 -0.02 0.00 0.63 0.00 0.00 28.75 30.36 1esj h GLU 257 CO 0.54 0.81 0.01 1.96 -0.73 0.00 0.00 179.01 181.60 1esj h GLN 258 N 1.25 0.81 -0.81 1.92 7.50 -1.94 -2.58 115.11 121.25 1esj h GLN 258 Ca 0.34 -0.21 -0.03 0.00 0.50 0.00 0.00 58.65 59.24 1esj h GLN 258 Cb -0.14 -0.10 -0.04 0.00 0.05 0.00 0.00 27.48 27.25 1esj h GLN 258 CO -0.07 0.80 0.38 -0.44 -1.50 0.00 0.00 178.83 178.00 1esj h ASP 259 N 0.76 1.07 -0.41 1.46 3.32 -1.77 -1.73 116.42 119.12 1esj h ASP 259 Ca 0.15 -0.14 -0.09 0.00 0.02 0.00 0.00 57.03 56.97 1esj h ASP 259 Cb 0.44 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 1esj h ASP 259 CO 0.02 0.91 -0.09 0.58 -1.72 0.00 0.00 179.24 178.94 1esj h VAL 260 N 1.16 1.27 -0.98 -1.35 2.07 -1.30 -0.90 116.25 116.22 1esj h VAL 260 Ca 0.28 -1.18 0.02 0.00 0.82 0.00 0.00 66.70 66.64 1esj h VAL 260 Cb 0.13 1.19 -0.05 0.00 -1.52 0.00 0.00 31.29 31.04 1esj h VAL 260 CO -0.03 0.40 0.65 1.56 0.02 0.00 0.00 177.57 180.16 1esj h GLN 261 N 0.61 1.26 -0.02 1.57 4.20 -1.19 0.12 115.11 121.66 1esj h GLN 261 Ca 0.11 -0.08 -0.26 0.00 0.06 0.00 0.00 58.65 58.49 1esj h GLN 261 Cb 0.61 -0.29 0.02 0.00 0.30 0.00 0.00 27.48 28.12 1esj h GLN 261 CO 0.04 0.84 -0.99 1.49 -0.67 0.00 0.00 178.83 179.54 1esj h GLU 262 N 1.30 0.68 0.00 1.46 4.81 -1.14 -3.40 114.58 118.30 1esj h GLU 262 Ca 0.37 -0.70 -0.19 0.00 -0.13 0.00 0.00 59.36 58.71 1esj h GLU 262 Cb -0.10 0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.43 1esj h GLU 262 CO -0.09 1.29 -2.09 0.91 -0.73 0.00 0.00 179.01 178.30 1esj n TRP 263 N -3.85 0.00 -1.67 0.92 7.02 -0.36 -4.98 117.44 114.52 1esj n TRP 263 Ca -0.10 0.00 -0.48 0.00 -1.02 0.00 0.00 57.50 55.90 1esj n TRP 263 Cb 0.86 -0.70 -0.05 0.00 -2.42 0.00 0.00 31.31 29.00 1esj n TRP 263 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1esj n ALA 264 N -2.46 0.86 -3.82 6.99 0.00 0.02 -4.94 120.51 117.16 1esj n ALA 264 Ca -0.19 0.40 -0.34 0.00 0.00 0.00 0.00 53.44 53.31 1esj n ALA 264 Cb 0.84 -2.36 -0.12 0.00 0.00 0.00 0.00 19.45 17.81 1esj n ALA 264 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1esj s THR 265 N 2.03 3.16 -0.17 0.00 2.01 -1.26 -4.76 115.64 116.65 1esj s THR 265 Ca 0.85 -2.63 -0.01 0.00 0.31 0.00 0.00 61.69 60.21 1esj s THR 265 Cb -0.74 -3.15 -0.00 0.00 0.01 0.00 0.00 72.50 68.62 1esj s THR 265 CO 0.45 -0.76 -0.12 -0.63 -0.69 0.00 0.00 174.62 172.87 1esj s ILE 266 N 0.45 2.90 -0.13 1.82 1.01 -1.26 -1.63 121.20 124.35 1esj s ILE 266 Ca 0.13 -0.68 0.01 0.00 0.00 0.00 0.00 60.65 60.11 1esj s ILE 266 Cb -0.22 -2.25 0.02 0.00 0.01 0.00 0.00 42.46 40.02 1esj s ILE 266 CO -0.04 0.49 -0.14 -1.61 0.00 0.00 0.00 174.94 173.65 1esj s GLU 267 N 0.94 2.19 -0.09 2.79 2.02 -0.50 -4.92 118.70 121.14 1esj s GLU 267 Ca -0.02 -0.52 -0.30 0.00 0.02 0.00 0.00 54.97 54.15 1esj s GLU 267 Cb -0.15 -1.99 -0.03 0.00 0.10 0.00 0.00 34.13 32.06 1esj s GLU 267 CO -0.01 -0.20 1.19 0.50 0.02 0.00 0.00 175.26 176.76 1esj s ARG 268 N 1.39 4.33 -0.12 1.61 6.06 -1.26 -0.80 118.95 130.16 1esj s ARG 268 Ca 0.02 1.64 -0.26 0.00 -2.50 0.00 0.00 55.73 54.63 1esj s ARG 268 Cb -0.13 -3.60 -0.02 0.00 0.06 0.00 0.00 34.95 31.26 1esj s ARG 268 CO -0.08 -0.49 0.83 0.08 -2.50 0.00 0.00 175.30 173.13 1esj s VAL 269 N 2.47 4.92 -0.34 7.11 1.01 0.53 -4.96 120.40 131.14 1esj s VAL 269 Ca 0.55 1.66 -0.29 0.00 0.00 0.00 0.00 61.98 63.90 1esj s VAL 269 Cb -0.23 -4.14 -0.00 0.00 0.00 0.00 0.00 36.38 32.00 1esj s VAL 269 CO 0.20 0.10 1.48 -0.89 0.00 0.00 0.00 175.10 175.99 1esj s THR 270 N 1.67 3.85 -0.45 3.92 2.01 -1.26 -4.60 115.64 120.78 1esj s THR 270 Ca 0.40 0.91 -0.11 0.00 0.31 0.00 0.00 61.69 63.20 1esj s THR 270 Cb -0.17 -4.02 0.09 0.00 0.01 0.00 0.00 72.50 68.40 1esj s THR 270 CO 0.16 -0.56 0.32 -0.69 -0.69 0.00 0.00 174.62 173.16 1esj s VAL 271 N 5.38 4.56 -2.64 3.82 1.01 -1.26 -5.15 120.40 126.12 1esj s VAL 271 Ca 0.65 -1.37 0.27 0.00 0.00 0.00 0.00 61.98 61.53 1esj s VAL 271 Cb -0.18 -3.81 0.45 0.00 0.00 0.00 0.00 36.38 32.84 1esj s VAL 271 CO 0.30 -0.59 1.61 -1.54 0.00 0.00 0.00 175.10 174.88