#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j1t s THR 7 N 0.00 4.09 0.22 6.66 -4.23 -1.26 -4.40 115.64 116.72 1j1t s THR 7 Ca 0.00 1.35 -0.32 0.00 -1.18 0.00 0.00 61.69 61.55 1j1t s THR 7 Cb 0.00 -3.58 -0.12 0.00 1.34 0.00 0.00 72.50 70.14 1j1t s THR 7 CO 0.00 -0.23 1.68 -0.38 -0.54 0.00 0.00 174.62 175.15 1j1t n ILE 8 N -0.63 0.18 -1.64 2.99 2.08 0.13 -4.84 119.36 117.62 1j1t n ILE 8 Ca 0.07 -0.05 -0.38 0.00 0.56 0.00 0.00 62.75 62.96 1j1t n ILE 8 Cb 0.53 -1.91 0.05 0.00 -0.75 0.00 0.00 39.64 37.56 1j1t n ILE 8 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 1j1t n PRO 9 N 3.57 1.02 0.22 0.38 -0.04 -1.26 -4.79 135.00 134.11 1j1t n PRO 9 Ca 0.15 0.39 0.06 0.00 -0.04 0.00 0.00 63.50 64.07 1j1t n PRO 9 Cb 0.34 -2.25 0.53 0.00 -0.04 0.00 0.00 33.50 32.08 1j1t n PRO 9 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1j1t h SER 10 N 0.63 0.00 -0.39 3.54 4.64 -1.98 -2.46 113.55 117.53 1j1t h SER 10 Ca -0.49 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 60.93 1j1t h SER 10 Cb 1.35 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.43 1j1t h SER 10 CO 0.52 0.21 0.28 0.77 -0.87 0.00 0.00 176.83 177.74 1j1t h SER 11 N 0.00 0.07 0.00 4.97 4.64 -1.97 0.21 113.55 121.47 1j1t h SER 11 Ca -0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1j1t h SER 11 Cb 0.40 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1j1t h SER 11 CO 0.03 0.04 -0.48 0.40 -0.87 0.00 0.00 176.83 175.95 1j1t h ILE 12 N 0.08 0.04 -0.80 0.95 2.04 -1.81 -2.58 117.51 115.42 1j1t h ILE 12 Ca 0.19 -1.04 0.06 0.00 1.00 0.00 0.00 64.86 65.06 1j1t h ILE 12 Cb 0.64 0.08 -0.05 0.00 -0.74 0.00 0.00 36.82 36.75 1j1t h ILE 12 CO -0.02 0.01 0.52 0.71 0.00 0.00 0.00 178.15 179.38 1j1t h THR 13 N -1.00 1.06 0.00 -0.27 1.35 -1.38 -2.86 112.91 109.81 1j1t h THR 13 Ca -0.01 -0.31 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 1j1t h THR 13 Cb 0.48 0.08 0.00 0.00 -1.73 0.00 0.00 68.15 66.99 1j1t h THR 13 CO -0.01 0.16 -0.77 0.77 -0.25 0.00 0.00 175.52 175.42 1j1t h SER 14 N 0.90 0.00 0.00 5.36 4.64 -0.80 -3.48 113.55 120.17 1j1t h SER 14 Ca 0.34 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 1j1t h SER 14 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1j1t h SER 14 CO -0.12 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.49 1j1t n GLY 15 N 1.22 0.65 0.24 -0.77 0.00 -1.08 -4.93 105.19 100.51 1j1t n GLY 15 Ca 0.01 -0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.09 1j1t n GLY 15 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1j1t h SER 16 N 0.00 0.03 0.00 1.61 4.64 -1.75 -3.36 113.55 114.72 1j1t h SER 16 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1j1t h SER 16 Cb 0.00 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1j1t h SER 16 CO 0.00 0.15 -0.92 -0.38 -0.87 0.00 0.00 176.83 174.80 1j1t n ILE 17 N -4.39 0.00 -3.99 0.95 5.41 -0.99 -4.99 119.36 111.36 1j1t n ILE 17 Ca -0.02 0.00 -0.36 0.00 1.00 0.00 0.00 62.75 63.36 1j1t n ILE 17 Cb 0.19 -0.76 -0.07 0.00 -0.71 0.00 0.00 39.64 38.30 1j1t n ILE 17 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 1j1t s PHE 18 N -1.95 3.50 -0.05 1.39 0.08 -1.13 -0.60 117.98 119.23 1j1t s PHE 18 Ca 0.00 0.44 -0.04 0.00 0.12 0.00 0.00 56.93 57.46 1j1t s PHE 18 Cb 0.00 -1.90 -0.04 0.00 -0.57 0.00 0.00 43.02 40.51 1j1t s PHE 18 CO 0.00 0.67 0.16 -0.51 -0.10 0.00 0.00 175.22 175.44 1j1t s ASP 19 N -1.05 6.31 0.00 1.36 -0.00 0.69 -4.27 116.67 119.72 1j1t s ASP 19 Ca 0.15 0.37 -0.17 0.00 -0.00 0.00 0.00 52.55 52.91 1j1t s ASP 19 Cb -0.12 -1.99 -0.06 0.00 -0.00 0.00 0.00 42.92 40.75 1j1t s ASP 19 CO 0.04 0.31 0.46 -0.22 -0.00 0.00 0.00 175.17 175.77 1j1t s LEU 20 N -1.62 4.46 -0.31 1.23 2.96 -1.26 -1.65 118.68 122.49 1j1t s LEU 20 Ca 0.23 1.03 0.02 0.00 -0.22 0.00 0.00 54.13 55.18 1j1t s LEU 20 Cb -0.12 -2.69 0.08 0.00 0.50 0.00 0.00 46.19 43.95 1j1t s LEU 20 CO 0.13 0.26 0.00 -1.61 -1.32 0.00 0.00 176.35 173.82 1j1t s GLU 21 N -0.84 1.97 0.00 1.98 2.02 0.19 -4.80 118.70 119.23 1j1t s GLU 21 Ca 0.26 -1.58 0.00 0.00 0.02 0.00 0.00 54.97 53.66 1j1t s GLU 21 Cb -0.17 -3.14 0.00 0.00 0.10 0.00 0.00 34.13 30.92 1j1t s GLU 21 CO 0.15 -0.77 0.00 0.41 0.02 0.00 0.00 175.26 175.06 1j1t n GLY 22 N 4.42 0.57 0.18 -1.39 0.00 -1.26 -2.09 105.19 105.63 1j1t n GLY 22 Ca -0.06 -0.66 -0.01 0.00 0.00 0.00 0.00 46.02 45.29 1j1t n GLY 22 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1j1t h ASP 23 N 0.00 0.14 -3.24 1.61 3.32 -1.89 -3.44 116.42 112.93 1j1t h ASP 23 Ca 0.00 -0.06 -0.55 0.00 0.02 0.00 0.00 57.03 56.44 1j1t h ASP 23 Cb 0.00 -0.04 -0.36 0.00 0.22 0.00 0.00 39.33 39.15 1j1t h ASP 23 CO 0.00 0.57 -0.82 0.20 -1.72 0.00 0.00 179.24 177.47 1j1t s ASN 24 N -6.89 2.21 0.71 6.45 0.01 -1.26 -2.71 114.94 113.46 1j1t s ASN 24 Ca -0.04 -0.35 -0.11 0.00 -0.71 0.00 0.00 52.86 51.66 1j1t s ASN 24 Cb 0.13 -0.93 0.03 0.00 0.41 0.00 0.00 41.25 40.89 1j1t s ASN 24 CO 0.76 -0.05 1.08 -2.16 -1.51 0.00 0.00 177.10 175.22 1j1t s PRO 25 N 1.30 2.69 0.24 -0.60 0.04 -1.26 -3.30 135.00 134.11 1j1t s PRO 25 Ca -0.02 0.32 -0.30 0.00 0.04 0.00 0.00 61.00 61.04 1j1t s PRO 25 Cb -0.14 -2.04 -0.09 0.00 0.04 0.00 0.00 34.50 32.27 1j1t s PRO 25 CO -0.05 -1.10 1.10 1.21 0.04 0.00 0.00 177.00 178.21 1j1t s ASN 26 N -4.40 7.27 0.56 6.66 3.84 -1.10 -4.92 114.94 122.85 1j1t s ASN 26 Ca 0.58 2.20 0.28 0.00 0.21 0.00 0.00 52.86 56.13 1j1t s ASN 26 Cb -0.11 -2.62 1.64 0.00 -0.55 0.00 0.00 41.25 39.61 1j1t s ASN 26 CO 0.50 -0.18 2.17 1.55 -2.79 0.00 0.00 177.10 178.36 1j1t h PRO 27 N 4.35 0.00 -6.15 0.43 0.13 -1.87 -3.39 132.00 125.50 1j1t h PRO 27 Ca -0.46 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.12 1j1t h PRO 27 Cb 1.21 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.25 1j1t h PRO 27 CO 0.69 0.05 1.30 -1.17 -0.23 0.00 0.00 178.00 178.65 1j1t s LEU 28 N -7.58 3.36 0.07 1.56 2.96 -1.26 0.02 118.68 117.81 1j1t s LEU 28 Ca -0.04 -1.02 0.26 0.00 -0.22 0.00 0.00 54.13 53.11 1j1t s LEU 28 Cb 0.14 -2.56 0.80 0.00 0.50 0.00 0.00 46.19 45.07 1j1t s LEU 28 CO 0.57 -1.74 1.66 1.33 -1.32 0.00 0.00 176.35 176.85 1j1t n VAL 29 N 6.82 0.20 -3.59 1.68 0.24 -0.98 -4.90 118.33 117.80 1j1t n VAL 29 Ca 0.24 -0.12 -0.05 0.00 -2.04 0.00 0.00 64.34 62.38 1j1t n VAL 29 Cb 0.50 -0.27 -0.02 0.00 -1.47 0.00 0.00 33.84 32.59 1j1t n VAL 29 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 1j1t s ASP 30 N -3.57 -0.21 0.64 -1.34 1.47 -1.25 -4.99 116.67 107.42 1j1t s ASP 30 Ca 0.11 -0.08 0.26 0.00 1.18 0.00 0.00 52.55 54.03 1j1t s ASP 30 Cb 0.16 0.28 1.40 0.00 -0.34 0.00 0.00 42.92 44.42 1j1t s ASP 30 CO 0.62 -0.47 1.80 -2.24 0.68 0.00 0.00 175.17 175.56 1j1t h ASP 31 N 2.00 0.00 -0.02 2.11 -0.00 -2.00 -2.08 116.42 116.44 1j1t h ASP 31 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.84 1j1t h ASP 31 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.54 1j1t h ASP 31 CO 0.27 0.00 0.00 -1.20 -0.00 0.00 0.00 179.24 178.31 1j1t n SER 32 N -3.06 2.24 -3.82 4.15 7.64 -1.26 -0.70 113.62 118.81 1j1t n SER 32 Ca 0.01 -2.50 -0.13 0.00 1.01 0.00 0.00 58.87 57.26 1j1t n SER 32 Cb 0.55 -0.21 -0.14 0.00 -1.01 0.00 0.00 64.21 63.40 1j1t n SER 32 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1j1t s THR 33 N -1.87 -0.02 -0.12 0.44 2.01 -0.78 -4.47 115.64 110.83 1j1t s THR 33 Ca 0.16 0.08 0.02 0.00 0.31 0.00 0.00 61.69 62.25 1j1t s THR 33 Cb 0.14 -0.10 -0.01 0.00 0.01 0.00 0.00 72.50 72.54 1j1t s THR 33 CO 0.02 0.03 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.04 1j1t s LEU 34 N 0.43 2.38 -0.16 4.42 1.43 -0.67 -2.32 118.68 124.19 1j1t s LEU 34 Ca -0.03 -0.46 0.00 0.00 -1.03 0.00 0.00 54.13 52.61 1j1t s LEU 34 Cb -0.05 -1.51 0.02 0.00 0.03 0.00 0.00 46.19 44.69 1j1t s LEU 34 CO -0.02 0.15 -0.14 -0.69 0.23 0.00 0.00 176.35 175.88 1j1t s VAL 35 N 0.44 1.64 -0.30 -1.59 1.01 0.10 -0.47 120.40 121.24 1j1t s VAL 35 Ca -0.13 -0.71 -0.08 0.00 0.00 0.00 0.00 61.98 61.05 1j1t s VAL 35 Cb -0.17 -1.55 0.00 0.00 0.00 0.00 0.00 36.38 34.66 1j1t s VAL 35 CO 0.06 0.44 0.11 -0.36 0.00 0.00 0.00 175.10 175.35 1j1t s PHE 36 N 1.45 3.16 -0.50 5.22 0.40 0.12 -4.27 117.98 123.56 1j1t s PHE 36 Ca 0.04 -0.78 0.03 0.00 -0.60 0.00 0.00 56.93 55.63 1j1t s PHE 36 Cb -0.13 -2.30 0.15 0.00 0.51 0.00 0.00 43.02 41.25 1j1t s PHE 36 CO -0.11 -0.51 0.32 0.14 0.70 0.00 0.00 175.22 175.76 1j1t s VAL 37 N 1.55 1.59 0.58 -0.44 -7.23 -1.26 -1.76 120.40 113.44 1j1t s VAL 37 Ca 0.04 -3.03 0.28 0.00 -1.81 0.00 0.00 61.98 57.46 1j1t s VAL 37 Cb -0.17 -2.09 0.35 0.00 0.56 0.00 0.00 36.38 35.03 1j1t s VAL 37 CO 0.04 -0.99 2.25 1.55 -0.31 0.00 0.00 175.10 177.64 1j1t h PRO 38 N 6.17 0.00 0.00 4.82 0.13 -1.80 -0.05 132.00 141.27 1j1t h PRO 38 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1j1t h PRO 38 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 1j1t h PRO 38 CO 0.52 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.57 1j1t n LEU 39 N -3.92 0.35 -0.07 1.56 4.77 -1.26 -0.18 117.00 118.24 1j1t n LEU 39 Ca -0.03 0.57 -0.14 0.00 -0.03 0.00 0.00 56.01 56.38 1j1t n LEU 39 Cb 0.08 -0.52 -0.05 0.00 -2.33 0.00 0.00 43.42 40.61 1j1t n LEU 39 CO 0.28 -0.35 -0.98 -0.62 -1.33 0.00 0.00 177.39 174.39 1j1t n GLU 40 N -1.87 0.30 -0.21 3.23 1.02 -0.36 -4.64 120.64 118.12 1j1t n GLU 40 Ca 0.03 0.12 -0.09 0.00 -0.02 0.00 0.00 57.16 57.21 1j1t n GLU 40 Cb 0.23 -1.05 0.02 0.00 -0.02 0.00 0.00 31.44 30.63 1j1t n GLU 40 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1j1t h ALA 41 N -0.42 0.77 -6.57 0.62 0.00 -1.06 -3.44 119.26 109.17 1j1t h ALA 41 Ca -0.35 -0.25 -0.52 0.00 0.00 0.00 0.00 54.91 53.79 1j1t h ALA 41 Cb 1.34 -0.22 -0.15 0.00 0.00 0.00 0.00 17.79 18.76 1j1t h ALA 41 CO -0.19 0.51 -0.80 1.04 0.00 0.00 0.00 179.25 179.82 1j1t n GLN 42 N -4.33 -3.91 -2.62 0.00 6.02 0.75 -4.84 117.38 108.45 1j1t n GLN 42 Ca 0.03 0.44 -0.41 0.00 -0.01 0.00 0.00 57.00 57.05 1j1t n GLN 42 Cb 0.27 -5.23 -0.04 0.00 1.02 0.00 0.00 30.24 26.25 1j1t n GLN 42 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1j1t s HIS 43 N -3.27 3.68 0.25 1.08 2.46 -1.07 -4.83 115.29 113.60 1j1t s HIS 43 Ca 0.72 1.67 0.09 0.00 0.47 0.00 0.00 55.06 58.01 1j1t s HIS 43 Cb -0.38 -3.17 -0.05 0.00 -0.13 0.00 0.00 32.58 28.84 1j1t s HIS 43 CO 0.88 -0.24 -0.15 0.96 -2.47 0.00 0.00 174.74 173.72 1j1t s ILE 44 N 0.17 2.01 0.14 0.89 -5.25 -1.26 -1.63 121.20 116.27 1j1t s ILE 44 Ca 0.50 -2.27 0.04 0.00 -0.99 0.00 0.00 60.65 57.93 1j1t s ILE 44 Cb -0.26 -2.23 -0.04 0.00 2.95 0.00 0.00 42.46 42.88 1j1t s ILE 44 CO 0.31 -0.46 -0.10 0.42 -1.79 0.00 0.00 174.94 173.32 1j1t s THR 45 N -2.80 1.12 0.42 8.37 -4.23 -1.26 -5.03 115.64 112.22 1j1t s THR 45 Ca 0.27 -2.04 0.12 0.00 -1.18 0.00 0.00 61.69 58.86 1j1t s THR 45 Cb -0.01 -1.82 0.32 0.00 1.34 0.00 0.00 72.50 72.33 1j1t s THR 45 CO 0.11 -0.76 1.97 1.55 -0.54 0.00 0.00 174.62 176.95 1j1t h PRO 46 N 2.82 0.46 -0.06 3.99 0.13 -1.96 -2.63 132.00 134.74 1j1t h PRO 46 Ca -0.36 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1j1t h PRO 46 Cb 1.19 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1j1t h PRO 46 CO 0.63 0.31 0.00 0.09 -0.23 0.00 0.00 178.00 178.80 1j1t n ASN 47 N -4.48 2.46 -4.73 1.44 3.02 -1.26 -3.71 115.26 108.01 1j1t n ASN 47 Ca 0.10 -1.71 -0.34 0.00 -0.03 0.00 0.00 54.58 52.60 1j1t n ASN 47 Cb 0.35 -0.03 0.09 0.00 -0.61 0.00 0.00 39.78 39.58 1j1t n ASN 47 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1j1t s GLY 48 N -1.34 2.32 -0.51 7.41 0.00 -0.99 -4.97 107.32 109.24 1j1t s GLY 48 Ca 0.21 0.84 0.06 0.00 0.00 0.00 0.00 44.72 45.82 1j1t s GLY 48 CO 0.21 1.24 1.00 -2.01 0.00 0.00 0.00 173.10 173.53 1j1t n ASN 49 N -2.69 4.26 0.00 1.64 4.05 -1.26 -4.54 115.26 116.72 1j1t n ASN 49 Ca 0.13 -3.63 0.00 0.00 0.45 0.00 0.00 54.58 51.53 1j1t n ASN 49 Cb 0.50 -0.52 0.00 0.00 1.23 0.00 0.00 39.78 40.99 1j1t n ASN 49 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1j1t n GLY 50 N -0.30 -0.10 3.32 8.20 0.00 -1.26 -1.02 105.19 114.02 1j1t n GLY 50 Ca 0.33 -1.12 -0.28 0.00 0.00 0.00 0.00 46.02 44.95 1j1t n GLY 50 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1j1t s TRP 51 N -3.71 2.15 0.15 1.61 0.51 -0.95 -4.75 118.94 113.94 1j1t s TRP 51 Ca 0.00 -0.40 0.02 0.00 -2.12 0.00 0.00 56.10 53.60 1j1t s TRP 51 Cb 0.00 -1.27 -0.04 0.00 -0.81 0.00 0.00 33.47 31.35 1j1t s TRP 51 CO 0.00 0.15 -0.02 -0.98 -0.51 0.00 0.00 176.95 175.59 1j1t s ARG 52 N -1.35 1.01 -0.26 4.98 1.70 -0.65 -0.48 118.95 123.90 1j1t s ARG 52 Ca 0.11 -1.46 -0.01 0.00 -0.47 0.00 0.00 55.73 53.89 1j1t s ARG 52 Cb -0.10 -0.21 0.13 0.00 -0.57 0.00 0.00 34.95 34.20 1j1t s ARG 52 CO 0.03 -0.10 0.34 -1.58 -1.08 0.00 0.00 175.30 172.91 1j1t s HIS 53 N -3.67 -0.70 0.27 5.89 2.46 -0.43 -2.60 115.29 116.51 1j1t s HIS 53 Ca 0.20 0.41 -0.21 0.00 0.47 0.00 0.00 55.06 55.93 1j1t s HIS 53 Cb 0.06 -0.18 0.05 0.00 -0.13 0.00 0.00 32.58 32.37 1j1t s HIS 53 CO 0.01 -0.80 0.83 -1.83 -2.47 0.00 0.00 174.74 170.48 1j1t s GLU 54 N 2.47 1.72 0.10 2.88 -1.05 -0.89 -0.41 118.70 123.53 1j1t s GLU 54 Ca 0.10 -1.02 0.08 0.00 -0.15 0.00 0.00 54.97 53.99 1j1t s GLU 54 Cb -0.14 0.54 -0.04 0.00 -0.44 0.00 0.00 34.13 34.05 1j1t s GLU 54 CO -0.22 -0.80 -0.17 0.71 0.95 0.00 0.00 175.26 175.74 1j1t s TYR 55 N -3.13 2.58 0.00 4.83 1.51 -0.27 -0.64 117.35 122.24 1j1t s TYR 55 Ca 0.14 -0.24 0.00 0.00 -1.01 0.00 0.00 57.07 55.96 1j1t s TYR 55 Cb -0.04 -1.38 -0.00 0.00 -0.11 0.00 0.00 41.96 40.42 1j1t s TYR 55 CO 0.07 0.38 -0.01 -1.59 -1.11 0.00 0.00 175.55 173.28 1j1t s LYS 56 N -2.05 0.12 0.16 -0.62 -2.85 -0.66 -1.74 119.74 112.09 1j1t s LYS 56 Ca 0.18 -0.12 -0.31 0.00 -1.00 0.00 0.00 55.97 54.72 1j1t s LYS 56 Cb -0.11 -0.07 -0.11 0.00 -2.06 0.00 0.00 37.83 35.49 1j1t s LYS 56 CO 0.10 0.02 1.72 0.08 0.10 0.00 0.00 175.35 177.37 1j1t s VAL 57 N -0.21 2.39 0.55 1.79 1.01 -0.36 -0.22 120.40 125.34 1j1t s VAL 57 Ca -0.02 0.15 -0.21 0.00 0.00 0.00 0.00 61.98 61.90 1j1t s VAL 57 Cb -0.02 -3.10 -0.05 0.00 0.00 0.00 0.00 36.38 33.22 1j1t s VAL 57 CO -0.00 0.01 1.32 -1.59 0.00 0.00 0.00 175.10 174.83 1j1t s LYS 58 N 1.78 3.16 0.29 2.72 -2.85 0.24 -4.83 119.74 120.26 1j1t s LYS 58 Ca 0.76 2.14 0.02 0.00 -1.00 0.00 0.00 55.97 57.88 1j1t s LYS 58 Cb -0.46 -2.22 0.73 0.00 -2.06 0.00 0.00 37.83 33.81 1j1t s LYS 58 CO 0.33 -1.14 1.63 1.49 0.10 0.00 0.00 175.35 177.76 1j1t h GLU 59 N 1.43 0.15 0.00 1.78 4.81 -1.91 -1.93 114.58 118.91 1j1t h GLU 59 Ca -0.51 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 58.71 1j1t h GLU 59 Cb 1.30 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.64 1j1t h GLU 59 CO 0.57 0.10 -0.01 0.66 -0.73 0.00 0.00 179.01 179.60 1j1t h SER 60 N 0.15 0.00 0.12 1.04 4.64 -1.98 -2.65 113.55 114.88 1j1t h SER 60 Ca 0.56 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.88 1j1t h SER 60 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1j1t h SER 60 CO -0.71 0.01 -0.71 0.18 -0.87 0.00 0.00 176.83 174.73 1j1t n LEU 61 N -3.14 1.14 -4.71 5.97 4.77 -0.73 -4.97 117.00 115.33 1j1t n LEU 61 Ca -0.02 -0.43 -0.42 0.00 -0.03 0.00 0.00 56.01 55.11 1j1t n LEU 61 Cb 0.16 -0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.16 1j1t n LEU 61 CO 0.23 0.25 1.12 -0.13 -1.33 0.00 0.00 177.39 177.53 1j1t s ARG 62 N -2.83 4.29 0.16 3.23 0.52 -1.00 -5.01 118.95 118.31 1j1t s ARG 62 Ca 0.13 2.14 0.03 0.00 -0.52 0.00 0.00 55.73 57.50 1j1t s ARG 62 Cb 0.17 -3.29 -0.01 0.00 0.52 0.00 0.00 34.95 32.34 1j1t s ARG 62 CO 0.73 -0.51 0.10 1.33 0.02 0.00 0.00 175.30 176.98 1j1t n VAL 63 N 4.09 0.00 -1.65 3.52 0.24 -1.26 -4.80 118.33 118.48 1j1t n VAL 63 Ca 0.12 -1.10 -0.33 0.00 -2.04 0.00 0.00 64.34 60.99 1j1t n VAL 63 Cb 0.42 0.49 0.06 0.00 -1.47 0.00 0.00 33.84 33.34 1j1t n VAL 63 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1j1t s ALA 64 N -2.57 2.36 0.26 2.33 0.00 -0.58 -1.92 121.76 121.63 1j1t s ALA 64 Ca 0.15 0.64 -0.04 0.00 0.00 0.00 0.00 51.96 52.71 1j1t s ALA 64 Cb 0.01 -3.36 0.35 0.00 0.00 0.00 0.00 23.12 20.12 1j1t s ALA 64 CO 0.10 -1.46 1.91 0.52 0.00 0.00 0.00 175.76 176.84 1j1t h MET 65 N -0.09 1.22 0.00 0.00 2.86 -1.81 -1.06 114.93 116.05 1j1t h MET 65 Ca -0.47 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.10 1j1t h MET 65 Cb 1.26 -0.28 0.00 0.00 0.06 0.00 0.00 31.60 32.64 1j1t h MET 65 CO 0.53 0.81 0.00 0.25 1.06 0.00 0.00 176.91 179.55 1j1t n THR 66 N -4.44 0.32 -0.66 2.22 -2.24 -1.26 -2.37 114.28 105.85 1j1t n THR 66 Ca 0.13 0.08 0.08 0.00 -2.27 0.00 0.00 64.05 62.07 1j1t n THR 66 Cb 0.10 -0.74 0.27 0.00 -2.10 0.00 0.00 70.33 67.85 1j1t n THR 66 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1j1t n GLN 67 N -1.24 3.26 -3.84 -0.78 1.13 -0.40 -4.65 117.38 110.85 1j1t n GLN 67 Ca 0.11 -2.65 -0.12 0.00 -1.94 0.00 0.00 57.00 52.39 1j1t n GLN 67 Cb 0.15 -1.72 -0.10 0.00 0.11 0.00 0.00 30.24 28.68 1j1t n GLN 67 CO 0.00 0.00 0.00 -0.08 -1.44 0.00 0.00 177.06 175.54 1j1t s THR 68 N -2.05 0.06 -0.27 5.09 -1.32 -1.16 -2.81 115.64 113.19 1j1t s THR 68 Ca 0.40 -0.53 0.01 0.00 -1.21 0.00 0.00 61.69 60.36 1j1t s THR 68 Cb 0.28 -0.43 0.05 0.00 -1.51 0.00 0.00 72.50 70.89 1j1t s THR 68 CO 0.15 -0.29 -0.08 -0.47 -2.21 0.00 0.00 174.62 171.73 1j1t s TYR 69 N -1.09 3.22 0.04 9.09 6.14 0.02 -1.35 117.35 133.42 1j1t s TYR 69 Ca -0.12 -2.08 0.04 0.00 0.64 0.00 0.00 57.07 55.55 1j1t s TYR 69 Cb -0.06 -2.00 -0.02 0.00 0.42 0.00 0.00 41.96 40.30 1j1t s TYR 69 CO 0.02 -0.84 -0.11 -1.83 0.64 0.00 0.00 175.55 173.42 1j1t s GLU 70 N 1.18 0.75 -0.05 4.97 -1.05 -0.77 -0.29 118.70 123.44 1j1t s GLU 70 Ca -0.06 -0.70 -0.01 0.00 -0.15 0.00 0.00 54.97 54.04 1j1t s GLU 70 Cb -0.19 -0.70 0.03 0.00 -0.44 0.00 0.00 34.13 32.83 1j1t s GLU 70 CO -0.04 0.17 0.01 0.08 0.95 0.00 0.00 175.26 176.43 1j1t s VAL 71 N -0.93 0.20 -0.08 1.83 1.01 -0.26 -1.08 120.40 121.09 1j1t s VAL 71 Ca -0.02 0.18 0.05 0.00 0.00 0.00 0.00 61.98 62.19 1j1t s VAL 71 Cb -0.08 -0.36 -0.01 0.00 0.00 0.00 0.00 36.38 35.94 1j1t s VAL 71 CO 0.01 0.20 -0.24 0.12 0.00 0.00 0.00 175.10 175.19 1j1t s PHE 72 N 1.68 2.51 -0.00 5.22 5.36 -0.00 -0.72 117.98 132.02 1j1t s PHE 72 Ca -0.00 -0.83 -0.03 0.00 -0.96 0.00 0.00 56.93 55.10 1j1t s PHE 72 Cb -0.13 -1.66 -0.00 0.00 -0.34 0.00 0.00 43.02 40.89 1j1t s PHE 72 CO -0.03 -0.28 0.07 -2.00 -1.46 0.00 0.00 175.22 171.51 1j1t s GLU 73 N 0.04 0.29 -0.02 10.12 2.12 -0.44 -0.12 118.70 130.69 1j1t s GLU 73 Ca -0.10 -0.27 -0.29 0.00 0.36 0.00 0.00 54.97 54.67 1j1t s GLU 73 Cb -0.15 0.12 0.10 0.00 0.26 0.00 0.00 34.13 34.45 1j1t s GLU 73 CO 0.06 -0.06 0.87 0.00 -0.54 0.00 0.00 175.26 175.59 1j1t s ALA 74 N -0.88 -1.82 -0.29 6.30 0.00 -0.20 -1.23 121.76 123.64 1j1t s ALA 74 Ca -0.10 1.08 -0.15 0.00 0.00 0.00 0.00 51.96 52.80 1j1t s ALA 74 Cb -0.06 0.24 -0.03 0.00 0.00 0.00 0.00 23.12 23.27 1j1t s ALA 74 CO 0.00 -0.61 0.36 0.99 0.00 0.00 0.00 175.76 176.51 1j1t s THR 75 N -2.71 5.18 -0.18 0.00 2.01 0.03 -0.68 115.64 119.29 1j1t s THR 75 Ca 0.02 0.45 -0.01 0.00 0.31 0.00 0.00 61.69 62.46 1j1t s THR 75 Cb -0.01 -3.72 -0.00 0.00 0.01 0.00 0.00 72.50 68.78 1j1t s THR 75 CO -0.06 0.11 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.17 1j1t s VAL 76 N 2.06 2.96 -0.14 3.82 1.01 0.87 -1.38 120.40 129.60 1j1t s VAL 76 Ca 0.14 -0.66 -0.02 0.00 0.00 0.00 0.00 61.98 61.44 1j1t s VAL 76 Cb -0.16 -2.29 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 1j1t s VAL 76 CO 0.10 0.49 -0.06 -0.75 0.00 0.00 0.00 175.10 174.88 1j1t s LYS 77 N 1.00 3.47 -0.11 2.72 2.20 0.09 -0.51 119.74 128.59 1j1t s LYS 77 Ca -0.01 -0.55 0.03 0.00 -0.36 0.00 0.00 55.97 55.08 1j1t s LYS 77 Cb -0.15 -2.81 0.01 0.00 -1.51 0.00 0.00 37.83 33.36 1j1t s LYS 77 CO -0.02 0.32 -0.21 0.08 -0.36 0.00 0.00 175.35 175.16 1j1t s VAL 78 N 0.15 1.89 -0.16 4.02 1.01 -0.88 -1.00 120.40 125.42 1j1t s VAL 78 Ca -0.02 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.05 1j1t s VAL 78 Cb -0.14 -1.66 0.03 0.00 0.00 0.00 0.00 36.38 34.61 1j1t s VAL 78 CO 0.03 0.52 -0.11 -1.61 0.00 0.00 0.00 175.10 173.93 1j1t s GLU 79 N 0.58 1.98 -0.02 2.72 2.02 -0.66 0.51 118.70 125.84 1j1t s GLU 79 Ca -0.14 -0.59 -0.27 0.00 0.02 0.00 0.00 54.97 53.99 1j1t s GLU 79 Cb -0.17 -2.10 0.06 0.00 0.10 0.00 0.00 34.13 32.02 1j1t s GLU 79 CO 0.04 -0.33 0.61 1.41 0.02 0.00 0.00 175.26 177.01 1j1t s MET 80 N 1.52 1.03 0.68 1.61 1.75 -1.26 -0.20 119.30 124.42 1j1t s MET 80 Ca 0.03 0.09 -0.15 0.00 -1.25 0.00 0.00 55.69 54.40 1j1t s MET 80 Cb -0.14 0.48 0.01 0.00 2.84 0.00 0.00 34.83 38.02 1j1t s MET 80 CO -0.09 -0.34 1.17 -1.12 -0.65 0.00 0.00 175.02 173.99 1j1t s SER 81 N -1.43 4.68 0.41 1.11 0.01 -0.63 -4.72 113.70 113.13 1j1t s SER 81 Ca -0.10 2.21 -0.26 0.00 1.31 0.00 0.00 55.95 59.12 1j1t s SER 81 Cb -0.01 -2.57 -0.10 0.00 0.21 0.00 0.00 66.02 63.55 1j1t s SER 81 CO 0.06 -1.93 1.25 0.47 0.41 0.00 0.00 173.24 173.51 1j1t n ASP 82 N -2.46 2.48 0.00 2.44 10.43 -1.26 -2.11 116.55 126.06 1j1t n ASP 82 Ca 0.12 1.12 0.00 0.00 2.57 0.00 0.00 54.79 58.60 1j1t n ASP 82 Cb 0.51 -1.48 0.00 0.00 1.84 0.00 0.00 41.12 41.98 1j1t n ASP 82 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1j1t n GLY 83 N 0.84 1.74 3.78 0.44 0.00 -1.25 -4.80 105.19 105.93 1j1t n GLY 83 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 1j1t n GLY 83 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1j1t s GLY 84 N -1.93 2.37 -0.11 -0.02 0.00 -0.90 -4.52 107.32 102.21 1j1t s GLY 84 Ca 0.00 0.64 -0.05 0.00 0.00 0.00 0.00 44.72 45.31 1j1t s GLY 84 CO 0.00 0.99 0.25 1.25 0.00 0.00 0.00 173.10 175.59 1j1t s LYS 85 N -3.69 0.18 0.05 2.90 2.20 -1.26 -0.79 119.74 119.33 1j1t s LYS 85 Ca 0.69 0.61 -0.04 0.00 -0.36 0.00 0.00 55.97 56.87 1j1t s LYS 85 Cb -0.21 -0.09 -0.02 0.00 -1.51 0.00 0.00 37.83 36.00 1j1t s LYS 85 CO 0.33 -0.21 0.07 -0.08 -0.36 0.00 0.00 175.35 175.10 1j1t s THR 86 N 1.69 0.16 -0.23 3.43 -1.32 -0.74 -0.41 115.64 118.22 1j1t s THR 86 Ca -0.05 -1.34 -0.06 0.00 -1.21 0.00 0.00 61.69 59.03 1j1t s THR 86 Cb -0.11 -1.16 -0.02 0.00 -1.51 0.00 0.00 72.50 69.70 1j1t s THR 86 CO -0.09 -0.74 0.03 -0.63 -2.21 0.00 0.00 174.62 170.99 1j1t s ILE 87 N -3.24 4.01 -1.05 5.08 1.01 -0.64 -1.72 121.20 124.66 1j1t s ILE 87 Ca 0.00 -0.28 0.20 0.00 0.00 0.00 0.00 60.65 60.58 1j1t s ILE 87 Cb 0.03 -2.85 -0.20 0.00 0.01 0.00 0.00 42.46 39.44 1j1t s ILE 87 CO -0.08 0.38 0.88 2.30 0.00 0.00 0.00 174.94 178.42 1j1t n ILE 88 N 4.77 0.00 -3.59 2.92 -5.35 -0.39 -1.72 119.36 116.00 1j1t n ILE 88 Ca -0.17 -0.04 -0.14 0.00 -0.27 0.00 0.00 62.75 62.14 1j1t n ILE 88 Cb 0.51 1.02 -0.06 0.00 -1.74 0.00 0.00 39.64 39.37 1j1t n ILE 88 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1j1t s SER 89 N -2.88 -0.60 -0.07 7.28 1.04 -1.25 -0.88 113.70 116.34 1j1t s SER 89 Ca 0.09 0.95 -0.29 0.00 0.48 0.00 0.00 55.95 57.17 1j1t s SER 89 Cb 0.16 0.90 0.11 0.00 0.10 0.00 0.00 66.02 67.28 1j1t s SER 89 CO 0.81 -0.34 0.91 0.00 0.98 0.00 0.00 173.24 175.60 1j1t s GLN 90 N -0.33 0.75 -0.24 4.02 -2.07 0.71 -0.91 119.66 121.60 1j1t s GLN 90 Ca -0.03 -0.07 -0.06 0.00 -1.82 0.00 0.00 55.36 53.38 1j1t s GLN 90 Cb -0.03 0.35 -0.02 0.00 -1.09 0.00 0.00 33.01 32.22 1j1t s GLN 90 CO 0.02 -0.29 0.04 -1.01 -1.32 0.00 0.00 175.29 172.73 1j1t s HIS 91 N -2.15 3.06 0.06 9.60 3.76 -0.18 -0.11 115.29 129.33 1j1t s HIS 91 Ca 0.01 -0.53 0.02 0.00 -0.15 0.00 0.00 55.06 54.41 1j1t s HIS 91 Cb -0.01 -2.19 -0.04 0.00 1.11 0.00 0.00 32.58 31.45 1j1t s HIS 91 CO -0.03 -0.38 0.11 -1.58 -0.85 0.00 0.00 174.74 172.01 1j1t s HIS 92 N 1.49 3.29 0.66 1.40 2.46 0.11 -0.55 115.29 124.15 1j1t s HIS 92 Ca 0.06 0.15 0.00 0.00 0.47 0.00 0.00 55.06 55.73 1j1t s HIS 92 Cb -0.15 -1.68 0.09 0.00 -0.13 0.00 0.00 32.58 30.72 1j1t s HIS 92 CO 0.02 0.55 0.92 0.00 -2.47 0.00 0.00 174.74 173.75 1j1t s ALA 93 N -1.38 3.78 0.10 1.58 0.00 -0.12 -1.39 121.76 124.33 1j1t s ALA 93 Ca 0.29 -1.58 -0.32 0.00 0.00 0.00 0.00 51.96 50.35 1j1t s ALA 93 Cb -0.12 -2.03 -0.12 0.00 0.00 0.00 0.00 23.12 20.84 1j1t s ALA 93 CO 0.22 -1.20 1.59 0.77 0.00 0.00 0.00 175.76 177.14 1j1t h SER 94 N -0.31 -1.14 0.00 0.00 0.02 -1.85 -3.43 113.55 106.84 1j1t h SER 94 Ca -0.38 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 1j1t h SER 94 Cb 1.28 0.41 0.00 0.00 0.14 0.00 0.00 62.40 64.23 1j1t h SER 94 CO 0.45 -0.51 0.00 -0.90 -1.14 0.00 0.00 176.83 174.72 1j1t n ASP 95 N -5.48 0.00 -1.06 3.07 3.85 -1.26 -4.89 116.55 110.78 1j1t n ASP 95 Ca -0.09 0.00 0.12 0.00 -0.71 0.00 0.00 54.79 54.11 1j1t n ASP 95 Cb 0.38 0.00 0.22 0.00 -1.35 0.00 0.00 41.12 40.37 1j1t n ASP 95 CO 0.00 0.00 0.00 1.07 -1.01 0.00 0.00 177.20 177.26 1j1t n THR 96 N 0.00 0.39 -2.24 2.12 5.66 -1.26 -4.98 114.28 113.96 1j1t n THR 96 Ca 0.00 -0.66 -0.33 0.00 -3.05 0.00 0.00 64.05 60.01 1j1t n THR 96 Cb 0.00 1.00 -0.01 0.00 -1.55 0.00 0.00 70.33 69.77 1j1t n THR 96 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1j1t s GLY 97 N -1.59 2.23 0.09 1.09 0.00 -1.26 -4.95 107.32 102.94 1j1t s GLY 97 Ca 0.37 0.43 0.10 0.00 0.00 0.00 0.00 44.72 45.61 1j1t s GLY 97 CO 0.31 0.74 -0.26 -0.51 0.00 0.00 0.00 173.10 173.38 1j1t s THR 98 N -2.34 2.17 -0.10 0.90 -4.23 -1.26 -0.95 115.64 109.84 1j1t s THR 98 Ca 0.64 -1.57 0.00 0.00 -1.18 0.00 0.00 61.69 59.58 1j1t s THR 98 Cb -0.15 -1.89 -0.06 0.00 1.34 0.00 0.00 72.50 71.73 1j1t s THR 98 CO 0.31 0.21 -0.09 -0.38 -0.54 0.00 0.00 174.62 174.13 1j1t n ILE 99 N 1.33 0.58 -3.81 2.99 5.41 0.29 -4.74 119.36 121.40 1j1t n ILE 99 Ca -0.18 -0.22 -0.12 0.00 1.00 0.00 0.00 62.75 63.24 1j1t n ILE 99 Cb 0.53 -0.91 -0.11 0.00 -0.71 0.00 0.00 39.64 38.43 1j1t n ILE 99 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1j1t s SER 100 N -5.05 -0.16 -0.11 4.38 1.04 -1.11 -1.28 113.70 111.40 1j1t s SER 100 Ca -0.14 0.26 -0.07 0.00 0.48 0.00 0.00 55.95 56.48 1j1t s SER 100 Cb 0.04 0.38 0.04 0.00 0.10 0.00 0.00 66.02 66.57 1j1t s SER 100 CO 0.23 -0.18 0.28 -0.54 0.98 0.00 0.00 173.24 174.01 1j1t s LYS 101 N -0.36 0.27 -0.16 4.02 1.02 -0.49 -1.01 119.74 123.04 1j1t s LYS 101 Ca -0.05 0.50 -0.01 0.00 0.02 0.00 0.00 55.97 56.44 1j1t s LYS 101 Cb -0.03 -0.00 -0.01 0.00 -0.52 0.00 0.00 37.83 37.27 1j1t s LYS 101 CO 0.01 -0.11 -0.12 0.08 -0.92 0.00 0.00 175.35 174.28 1j1t s VAL 102 N 0.84 2.97 0.24 3.17 1.01 -0.09 -1.03 120.40 127.52 1j1t s VAL 102 Ca -0.06 -0.67 0.10 0.00 0.00 0.00 0.00 61.98 61.35 1j1t s VAL 102 Cb -0.07 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 1j1t s VAL 102 CO -0.06 0.50 -0.05 -0.31 0.00 0.00 0.00 175.10 175.18 1j1t s TYR 103 N 0.72 2.63 -0.29 5.22 2.02 0.06 -1.26 117.35 126.45 1j1t s TYR 103 Ca -0.06 -0.23 -0.03 0.00 -0.37 0.00 0.00 57.07 56.38 1j1t s TYR 103 Cb -0.15 -1.20 0.10 0.00 -0.40 0.00 0.00 41.96 40.31 1j1t s TYR 103 CO 0.02 0.60 0.12 0.08 -1.57 0.00 0.00 175.55 174.80 1j1t s VAL 104 N -2.17 0.16 0.02 0.71 1.01 -0.70 -2.27 120.40 117.16 1j1t s VAL 104 Ca 0.29 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.41 1j1t s VAL 104 Cb -0.07 -1.11 -0.02 0.00 0.00 0.00 0.00 36.38 35.18 1j1t s VAL 104 CO 0.18 -0.68 -0.03 -0.94 0.00 0.00 0.00 175.10 173.63 1j1t s SER 105 N 1.99 0.24 -0.66 3.32 1.04 -0.16 -1.79 113.70 117.68 1j1t s SER 105 Ca 0.09 -0.48 0.04 0.00 0.48 0.00 0.00 55.95 56.07 1j1t s SER 105 Cb -0.16 0.10 0.35 0.00 0.10 0.00 0.00 66.02 66.40 1j1t s SER 105 CO -0.32 -0.29 1.17 -0.67 0.98 0.00 0.00 173.24 174.11 1j1t n ASP 106 N 1.65 5.17 -4.03 7.02 2.03 0.03 0.06 116.55 128.49 1j1t n ASP 106 Ca -0.24 -3.70 -0.21 0.00 0.52 0.00 0.00 54.79 51.17 1j1t n ASP 106 Cb 0.55 -0.68 -0.02 0.00 -0.72 0.00 0.00 41.12 40.25 1j1t n ASP 106 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1j1t n THR 107 N -0.25 0.00 0.47 5.18 -2.24 -1.26 -1.20 114.28 114.98 1j1t n THR 107 Ca 0.36 -1.65 0.11 0.00 -2.27 0.00 0.00 64.05 60.60 1j1t n THR 107 Cb 0.39 0.02 0.27 0.00 -2.10 0.00 0.00 70.33 68.90 1j1t n THR 107 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1j1t n ASP 108 N -1.66 2.91 -4.70 3.42 2.03 0.02 -2.21 116.55 116.36 1j1t n ASP 108 Ca -0.06 -1.93 -0.42 0.00 0.52 0.00 0.00 54.79 52.89 1j1t n ASP 108 Cb 0.46 -0.26 -0.03 0.00 -0.72 0.00 0.00 41.12 40.57 1j1t n ASP 108 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1j1t n GLU 109 N 1.12 2.80 -1.84 -0.67 2.13 -1.26 -4.82 120.64 118.09 1j1t n GLU 109 Ca 0.19 1.01 -0.30 0.00 0.66 0.00 0.00 57.16 58.72 1j1t n GLU 109 Cb 0.50 -2.89 0.04 0.00 0.27 0.00 0.00 31.44 29.35 1j1t n GLU 109 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 1j1t s SER 110 N 2.15 5.67 0.00 4.31 1.04 -1.26 -4.49 113.70 121.11 1j1t s SER 110 Ca 0.79 1.27 0.00 0.00 0.48 0.00 0.00 55.95 58.49 1j1t s SER 110 Cb -0.49 -2.16 0.00 0.00 0.10 0.00 0.00 66.02 63.48 1j1t s SER 110 CO 0.35 -1.21 0.00 0.61 0.98 0.00 0.00 173.24 173.97 1j1t n GLY 111 N -2.81 0.79 3.76 7.32 0.00 -1.26 -5.07 105.19 107.91 1j1t n GLY 111 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 1j1t n GLY 111 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1j1t s PHE 112 N -2.00 1.97 0.35 1.61 2.99 -1.26 -4.62 117.98 117.02 1j1t s PHE 112 Ca 0.00 -0.88 0.03 0.00 0.00 0.00 0.00 56.93 56.08 1j1t s PHE 112 Cb 0.00 -1.69 0.65 0.00 0.00 0.00 0.00 43.02 41.98 1j1t s PHE 112 CO 0.00 0.18 2.00 -0.91 -0.00 0.00 0.00 175.22 176.49 1j1t h ASN 113 N 1.34 0.69 0.00 1.36 2.35 -1.95 -3.37 115.58 116.00 1j1t h ASN 113 Ca -0.43 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 1j1t h ASN 113 Cb 1.30 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.50 1j1t h ASN 113 CO 0.73 0.52 -0.45 -0.67 -1.65 0.00 0.00 177.43 175.91 1j1t n ASP 114 N -4.43 1.16 -2.50 5.81 2.03 -1.26 -5.01 116.55 112.35 1j1t n ASP 114 Ca 0.06 0.18 -0.17 0.00 0.52 0.00 0.00 54.79 55.38 1j1t n ASP 114 Cb 0.06 -0.51 -0.00 0.00 -0.72 0.00 0.00 41.12 39.94 1j1t n ASP 114 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1j1t n SER 115 N -3.64 -4.87 -4.20 1.67 7.64 -1.26 -4.96 113.62 103.99 1j1t n SER 115 Ca -0.06 0.05 -0.35 0.00 1.01 0.00 0.00 58.87 59.52 1j1t n SER 115 Cb 0.23 -4.08 -0.14 0.00 -1.01 0.00 0.00 64.21 59.21 1j1t n SER 115 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1j1t s VAL 116 N -2.84 3.04 0.45 0.44 1.01 -1.15 -4.45 120.40 116.90 1j1t s VAL 116 Ca 0.04 -1.15 -0.25 0.00 0.00 0.00 0.00 61.98 60.62 1j1t s VAL 116 Cb -0.02 -2.64 -0.09 0.00 0.00 0.00 0.00 36.38 33.63 1j1t s VAL 116 CO 0.04 0.05 1.26 0.00 0.00 0.00 0.00 175.10 176.45 1j1t n ALA 117 N 4.67 1.26 -4.12 5.51 0.00 -0.94 -3.77 120.51 123.11 1j1t n ALA 117 Ca -0.15 0.23 -0.33 0.00 0.00 0.00 0.00 53.44 53.20 1j1t n ALA 117 Cb 0.45 -2.27 -0.02 0.00 0.00 0.00 0.00 19.45 17.62 1j1t n ALA 117 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1j1t n ASN 118 N 0.02 -2.63 -0.25 0.00 5.15 -0.34 -4.87 115.26 112.33 1j1t n ASN 118 Ca 0.07 -0.99 0.02 0.00 -0.60 0.00 0.00 54.58 53.09 1j1t n ASN 118 Cb 0.41 -2.94 0.06 0.00 -0.53 0.00 0.00 39.78 36.78 1j1t n ASN 118 CO 0.00 0.00 0.00 -0.46 1.40 0.00 0.00 177.26 178.20 1j1t n ASN 119 N -2.76 2.30 0.00 1.20 6.94 -1.25 -4.69 115.26 116.99 1j1t n ASN 119 Ca -0.03 -1.94 0.00 0.00 -0.02 0.00 0.00 54.58 52.59 1j1t n ASN 119 Cb 0.55 -0.09 0.00 0.00 -2.36 0.00 0.00 39.78 37.88 1j1t n ASN 119 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1j1t n GLY 120 N -0.07 1.63 3.34 4.83 0.00 -1.26 -4.99 105.19 108.67 1j1t n GLY 120 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1j1t n GLY 120 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1j1t s ILE 121 N -3.53 4.44 -0.00 -0.61 1.01 -1.26 -4.08 121.20 117.17 1j1t s ILE 121 Ca 0.00 -1.04 -0.22 0.00 0.00 0.00 0.00 60.65 59.40 1j1t s ILE 121 Cb 0.00 -3.55 -0.05 0.00 0.01 0.00 0.00 42.46 38.87 1j1t s ILE 121 CO 0.00 -0.32 0.63 -0.36 0.00 0.00 0.00 174.94 174.90 1j1t s PHE 122 N 1.51 3.68 0.12 3.97 0.40 0.12 -4.65 117.98 123.12 1j1t s PHE 122 Ca 0.02 1.25 -0.25 0.00 -0.60 0.00 0.00 56.93 57.35 1j1t s PHE 122 Cb -0.20 -2.66 -0.07 0.00 0.51 0.00 0.00 43.02 40.59 1j1t s PHE 122 CO 0.05 0.31 0.78 -0.51 0.70 0.00 0.00 175.22 176.55 1j1t s ASP 123 N -0.08 7.32 -0.23 1.36 1.01 0.11 -1.23 116.67 124.94 1j1t s ASP 123 Ca 0.33 1.57 -0.01 0.00 0.71 0.00 0.00 52.55 55.15 1j1t s ASP 123 Cb -0.19 -2.49 0.02 0.00 1.01 0.00 0.00 42.92 41.28 1j1t s ASP 123 CO 0.18 0.13 -0.09 -0.69 0.21 0.00 0.00 175.17 174.91 1j1t s VAL 124 N -0.69 2.71 0.27 -1.27 1.01 0.28 -0.99 120.40 121.72 1j1t s VAL 124 Ca 0.37 -1.00 -0.02 0.00 0.00 0.00 0.00 61.98 61.33 1j1t s VAL 124 Cb -0.22 -2.33 -0.02 0.00 0.00 0.00 0.00 36.38 33.80 1j1t s VAL 124 CO 0.25 0.27 0.31 -0.72 0.00 0.00 0.00 175.10 175.21 1j1t s TYR 125 N 1.32 1.09 0.04 5.22 1.13 -0.96 -0.71 117.35 124.47 1j1t s TYR 125 Ca 0.01 -1.28 0.04 0.00 -1.41 0.00 0.00 57.07 54.43 1j1t s TYR 125 Cb -0.16 -0.32 -0.02 0.00 -1.10 0.00 0.00 41.96 40.36 1j1t s TYR 125 CO -0.06 -0.87 -0.12 0.54 -2.51 0.00 0.00 175.55 172.52 1j1t s VAL 126 N -3.73 0.95 -0.13 -3.49 0.11 -0.58 -0.76 120.40 112.77 1j1t s VAL 126 Ca 0.34 -0.94 0.02 0.00 -2.93 0.00 0.00 61.98 58.47 1j1t s VAL 126 Cb 0.03 -0.88 0.01 0.00 -1.53 0.00 0.00 36.38 34.01 1j1t s VAL 126 CO 0.16 -0.05 -0.21 -0.13 -3.33 0.00 0.00 175.10 171.54 1j1t s ARG 127 N -1.13 2.86 -0.07 1.54 0.52 -0.19 -0.94 118.95 121.54 1j1t s ARG 127 Ca -0.00 -0.80 0.04 0.00 -0.52 0.00 0.00 55.73 54.45 1j1t s ARG 127 Cb -0.08 -2.31 -0.00 0.00 0.52 0.00 0.00 34.95 33.08 1j1t s ARG 127 CO 0.01 -0.01 -0.20 -0.51 0.02 0.00 0.00 175.30 174.61 1j1t s LEU 128 N 0.81 1.97 -0.38 2.53 1.43 -0.01 -1.40 118.68 123.63 1j1t s LEU 128 Ca -0.08 -0.45 -0.21 0.00 -1.03 0.00 0.00 54.13 52.36 1j1t s LEU 128 Cb -0.16 -1.18 0.01 0.00 0.03 0.00 0.00 46.19 44.89 1j1t s LEU 128 CO -0.01 0.16 0.66 -0.60 0.23 0.00 0.00 176.35 176.79 1j1t s ARG 129 N 0.16 3.60 1.12 1.70 3.52 -0.40 0.28 118.95 128.93 1j1t s ARG 129 Ca -0.10 -0.00 -0.17 0.00 -0.13 0.00 0.00 55.73 55.33 1j1t s ARG 129 Cb -0.15 -3.84 0.25 0.00 -1.56 0.00 0.00 34.95 29.65 1j1t s ARG 129 CO 0.05 -0.82 1.13 0.54 -0.81 0.00 0.00 175.30 175.38 1j1t s ASN 130 N 1.86 1.63 0.19 -2.12 6.03 0.27 -1.37 114.94 121.43 1j1t s ASN 130 Ca 0.25 0.74 0.16 0.00 -1.03 0.00 0.00 52.86 52.98 1j1t s ASN 130 Cb -0.14 -1.08 0.78 0.00 -3.03 0.00 0.00 41.25 37.77 1j1t s ASN 130 CO 0.16 -3.70 1.48 0.35 -2.03 0.00 0.00 177.10 173.37 1j1t n THR 131 N -4.49 1.25 1.21 0.54 -2.24 -1.25 -0.93 114.28 108.36 1j1t n THR 131 Ca 0.11 0.53 0.13 0.00 -2.27 0.00 0.00 64.05 62.55 1j1t n THR 131 Cb 0.59 -1.49 0.36 0.00 -2.10 0.00 0.00 70.33 67.69 1j1t n THR 131 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1j1t n SER 132 N -1.98 2.09 0.00 3.42 7.64 -1.26 -4.81 113.62 118.72 1j1t n SER 132 Ca 0.00 -1.71 0.00 0.00 1.01 0.00 0.00 58.87 58.17 1j1t n SER 132 Cb 0.08 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 1j1t n SER 132 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1j1t n GLY 133 N 1.24 0.60 3.60 0.23 0.00 -0.10 -5.05 105.19 105.71 1j1t n GLY 133 Ca 0.17 -0.14 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 1j1t n GLY 133 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1j1t s ASN 134 N -2.13 4.88 0.21 1.61 0.02 -1.26 -4.85 114.94 113.43 1j1t s ASN 134 Ca 0.00 0.02 -0.29 0.00 -1.02 0.00 0.00 52.86 51.57 1j1t s ASN 134 Cb 0.00 -1.39 -0.08 0.00 0.02 0.00 0.00 41.25 39.79 1j1t s ASN 134 CO 0.00 0.33 0.90 -1.61 0.02 0.00 0.00 177.10 176.75 1j1t s GLU 135 N -0.60 4.78 -0.14 -0.60 2.02 -1.26 -0.56 118.70 122.33 1j1t s GLU 135 Ca 0.09 1.41 0.01 0.00 0.02 0.00 0.00 54.97 56.50 1j1t s GLU 135 Cb -0.12 -3.29 -0.00 0.00 0.10 0.00 0.00 34.13 30.82 1j1t s GLU 135 CO 0.02 0.49 -0.17 -1.21 0.02 0.00 0.00 175.26 174.42 1j1t s GLU 136 N -1.03 3.20 0.12 1.61 2.02 0.14 -4.92 118.70 119.85 1j1t s GLU 136 Ca 0.40 -0.77 0.05 0.00 0.02 0.00 0.00 54.97 54.68 1j1t s GLU 136 Cb -0.25 -2.56 -0.04 0.00 0.10 0.00 0.00 34.13 31.38 1j1t s GLU 136 CO 0.30 0.07 0.05 -1.59 0.02 0.00 0.00 175.26 174.11 1j1t s LYS 137 N 0.67 2.68 -0.15 1.61 -2.85 -1.26 -0.83 119.74 119.61 1j1t s LYS 137 Ca -0.08 -0.85 -0.07 0.00 -1.00 0.00 0.00 55.97 53.97 1j1t s LYS 137 Cb -0.16 -2.58 0.06 0.00 -2.06 0.00 0.00 37.83 33.09 1j1t s LYS 137 CO 0.02 0.52 0.34 0.12 0.10 0.00 0.00 175.35 176.45 1j1t s PHE 138 N -1.48 -0.51 0.08 1.78 2.19 -0.12 -4.99 117.98 114.92 1j1t s PHE 138 Ca 0.28 1.11 -0.30 0.00 0.33 0.00 0.00 56.93 58.35 1j1t s PHE 138 Cb -0.11 0.17 -0.05 0.00 -1.31 0.00 0.00 43.02 41.71 1j1t s PHE 138 CO 0.20 -0.32 1.08 0.00 1.83 0.00 0.00 175.22 178.01 1j1t s ALA 139 N 1.58 3.30 -0.19 11.12 0.00 -1.26 -1.53 121.76 134.78 1j1t s ALA 139 Ca -0.08 0.72 0.03 0.00 0.00 0.00 0.00 51.96 52.63 1j1t s ALA 139 Cb -0.10 -3.37 -0.14 0.00 0.00 0.00 0.00 23.12 19.52 1j1t s ALA 139 CO -0.11 -0.27 -0.14 1.28 0.00 0.00 0.00 175.76 176.52 1j1t n LEU 140 N 3.37 2.57 0.00 0.00 4.77 0.12 -4.98 117.00 122.85 1j1t n LEU 140 Ca 0.06 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1j1t n LEU 140 Cb 0.48 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1j1t n LEU 140 CO 0.53 0.77 0.00 0.61 -1.33 0.00 0.00 177.39 177.97 1j1t n GLY 141 N 2.49 -1.07 3.09 -0.72 0.00 -0.83 -4.68 105.19 103.47 1j1t n GLY 141 Ca -0.33 -0.80 -0.08 0.00 0.00 0.00 0.00 46.02 44.80 1j1t n GLY 141 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1j1t s THR 142 N -3.00 0.30 0.15 2.61 -4.23 -1.26 -0.55 115.64 109.65 1j1t s THR 142 Ca 0.00 -1.73 -0.21 0.00 -1.18 0.00 0.00 61.69 58.58 1j1t s THR 142 Cb 0.00 -1.40 0.06 0.00 1.34 0.00 0.00 72.50 72.49 1j1t s THR 142 CO 0.00 -0.92 0.53 0.00 -0.54 0.00 0.00 174.62 173.70 1j1t s MET 143 N -3.61 1.20 0.29 3.99 0.23 -0.36 -4.95 119.30 116.09 1j1t s MET 143 Ca 0.05 -0.54 0.09 0.00 -1.03 0.00 0.00 55.69 54.25 1j1t s MET 143 Cb 0.05 0.55 -0.04 0.00 -1.53 0.00 0.00 34.83 33.86 1j1t s MET 143 CO -0.08 -0.51 0.07 0.95 -2.03 0.00 0.00 175.02 173.42 1j1t s THR 144 N -3.74 3.43 0.10 3.16 -4.23 -1.26 0.13 115.64 113.23 1j1t s THR 144 Ca 0.02 -1.78 -0.35 0.00 -1.18 0.00 0.00 61.69 58.40 1j1t s THR 144 Cb -0.00 -2.96 -0.14 0.00 1.34 0.00 0.00 72.50 70.74 1j1t s THR 144 CO -0.12 -0.31 1.59 -0.24 -0.54 0.00 0.00 174.62 175.00 1j1t n SER 145 N -1.01 2.90 0.00 3.99 2.88 -1.26 -1.80 113.62 119.33 1j1t n SER 145 Ca -0.05 1.07 0.00 0.00 -1.33 0.00 0.00 58.87 58.56 1j1t n SER 145 Cb 0.60 -1.37 0.00 0.00 -0.75 0.00 0.00 64.21 62.68 1j1t n SER 145 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1j1t n GLY 146 N 3.45 2.47 3.86 0.46 0.00 0.18 -4.94 105.19 110.67 1j1t n GLY 146 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 1j1t n GLY 146 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j1t s GLU 147 N -0.78 2.25 0.03 1.61 2.02 -0.74 -4.77 118.70 118.31 1j1t s GLU 147 Ca 0.00 0.38 0.04 0.00 0.02 0.00 0.00 54.97 55.41 1j1t s GLU 147 Cb 0.00 -1.96 -0.02 0.00 0.10 0.00 0.00 34.13 32.25 1j1t s GLU 147 CO 0.00 -1.45 -0.12 0.99 0.02 0.00 0.00 175.26 174.71 1j1t s THR 148 N -3.37 0.90 0.17 3.63 2.01 -1.26 -2.08 115.64 115.63 1j1t s THR 148 Ca 0.60 -0.89 -0.04 0.00 0.31 0.00 0.00 61.69 61.68 1j1t s THR 148 Cb -0.12 -0.83 -0.03 0.00 0.01 0.00 0.00 72.50 71.53 1j1t s THR 148 CO 0.52 -0.04 0.17 0.72 -0.69 0.00 0.00 174.62 175.29 1j1t s PHE 149 N -0.83 0.77 -0.17 4.92 -0.12 0.33 -4.96 117.98 117.92 1j1t s PHE 149 Ca -0.00 -1.10 -0.10 0.00 -0.05 0.00 0.00 56.93 55.68 1j1t s PHE 149 Cb -0.07 -0.33 -0.05 0.00 -0.63 0.00 0.00 43.02 41.94 1j1t s PHE 149 CO 0.01 -0.64 0.16 1.21 -0.05 0.00 0.00 175.22 175.90 1j1t s ASN 150 N -3.05 6.30 -0.08 1.98 2.47 -1.26 -0.09 114.94 121.20 1j1t s ASN 150 Ca 0.26 0.35 0.04 0.00 0.42 0.00 0.00 52.86 53.93 1j1t s ASN 150 Cb 0.06 -2.10 -0.00 0.00 -1.45 0.00 0.00 41.25 37.75 1j1t s ASN 150 CO 0.04 0.24 -0.22 -0.22 -3.72 0.00 0.00 177.10 173.22 1j1t s LEU 151 N -0.04 2.02 -0.05 3.21 2.96 0.14 -3.97 118.68 122.96 1j1t s LEU 151 Ca 0.11 -0.51 -0.01 0.00 -0.22 0.00 0.00 54.13 53.50 1j1t s LEU 151 Cb -0.12 -1.30 0.03 0.00 0.50 0.00 0.00 46.19 45.30 1j1t s LEU 151 CO 0.01 0.16 0.02 -0.60 -1.32 0.00 0.00 176.35 174.62 1j1t s ARG 152 N 0.26 0.30 -0.14 1.98 3.52 -0.53 -1.03 118.95 123.30 1j1t s ARG 152 Ca -0.14 0.21 0.02 0.00 -0.13 0.00 0.00 55.73 55.69 1j1t s ARG 152 Cb -0.16 -0.72 0.01 0.00 -1.56 0.00 0.00 34.95 32.51 1j1t s ARG 152 CO 0.07 -0.29 -0.21 0.08 -0.81 0.00 0.00 175.30 174.14 1j1t s VAL 153 N 1.91 2.11 -0.09 7.11 1.01 0.83 -0.76 120.40 132.52 1j1t s VAL 153 Ca 0.03 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 61.07 1j1t s VAL 153 Cb -0.12 -1.84 0.01 0.00 0.00 0.00 0.00 36.38 34.42 1j1t s VAL 153 CO -0.04 0.55 -0.17 -0.69 0.00 0.00 0.00 175.10 174.75 1j1t s VAL 154 N 0.83 1.56 -0.39 2.92 1.01 0.53 -0.82 120.40 126.04 1j1t s VAL 154 Ca -0.07 -0.72 -0.03 0.00 0.00 0.00 0.00 61.98 61.17 1j1t s VAL 154 Cb -0.15 -1.39 0.10 0.00 0.00 0.00 0.00 36.38 34.93 1j1t s VAL 154 CO -0.02 0.45 0.16 0.21 0.00 0.00 0.00 175.10 175.90 1j1t s ASN 155 N 0.63 5.19 -1.13 3.32 2.47 -0.24 -0.25 114.94 124.92 1j1t s ASN 155 Ca -0.14 -1.85 -0.10 0.00 0.42 0.00 0.00 52.86 51.19 1j1t s ASN 155 Cb -0.16 -1.81 0.25 0.00 -1.45 0.00 0.00 41.25 38.08 1j1t s ASN 155 CO 0.04 -0.48 1.19 0.21 -3.72 0.00 0.00 177.10 174.34 1j1t s ASN 156 N 1.69 7.26 -1.43 -4.21 2.47 0.03 -1.84 114.94 118.92 1j1t s ASN 156 Ca 0.05 -3.45 -0.01 0.00 0.42 0.00 0.00 52.86 49.87 1j1t s ASN 156 Cb -0.22 -2.26 0.01 0.00 -1.45 0.00 0.00 41.25 37.33 1j1t s ASN 156 CO -0.03 -0.40 0.44 -1.22 -3.72 0.00 0.00 177.10 172.17 1j1t n TYR 157 N 3.42 -1.66 0.00 0.43 4.01 -0.45 -2.16 117.16 120.74 1j1t n TYR 157 Ca 0.27 0.75 0.00 0.00 -0.16 0.00 0.00 57.90 58.76 1j1t n TYR 157 Cb 0.40 -3.70 0.00 0.00 -0.31 0.00 0.00 39.34 35.73 1j1t n TYR 157 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1j1t n GLY 158 N -1.95 2.75 3.38 2.72 0.00 -1.00 -4.34 105.19 106.75 1j1t n GLY 158 Ca -0.29 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.29 1j1t n GLY 158 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1j1t s ASP 159 N -1.13 6.13 -0.12 1.61 1.01 -0.92 -0.99 116.67 122.26 1j1t s ASP 159 Ca 0.00 -1.34 -0.13 0.00 0.71 0.00 0.00 52.55 51.78 1j1t s ASP 159 Cb 0.00 -2.18 -0.05 0.00 1.01 0.00 0.00 42.92 41.71 1j1t s ASP 159 CO 0.00 -0.65 0.30 -0.69 0.21 0.00 0.00 175.17 174.34 1j1t s VAL 160 N 1.63 5.28 -0.01 -1.27 1.01 -0.78 -0.79 120.40 125.47 1j1t s VAL 160 Ca 0.04 0.57 0.03 0.00 0.00 0.00 0.00 61.98 62.62 1j1t s VAL 160 Cb -0.24 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.51 1j1t s VAL 160 CO 0.06 0.45 -0.10 -0.70 0.00 0.00 0.00 175.10 174.82 1j1t s GLU 161 N -0.02 0.80 -0.04 2.72 2.12 0.65 -1.44 118.70 123.48 1j1t s GLU 161 Ca 0.18 -0.36 0.04 0.00 0.36 0.00 0.00 54.97 55.18 1j1t s GLU 161 Cb -0.14 -0.77 0.00 0.00 0.26 0.00 0.00 34.13 33.48 1j1t s GLU 161 CO 0.06 0.21 -0.14 0.08 -0.54 0.00 0.00 175.26 174.93 1j1t s VAL 162 N -0.25 1.20 -0.06 3.70 1.01 -0.06 -0.35 120.40 125.60 1j1t s VAL 162 Ca 0.04 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.45 1j1t s VAL 162 Cb -0.04 -1.05 0.01 0.00 0.00 0.00 0.00 36.38 35.30 1j1t s VAL 162 CO -0.00 0.36 -0.11 -0.89 0.00 0.00 0.00 175.10 174.45 1j1t s THR 163 N 0.14 1.05 -0.17 3.92 2.01 0.06 -1.86 115.64 120.79 1j1t s THR 163 Ca -0.05 -0.44 -0.22 0.00 0.31 0.00 0.00 61.69 61.29 1j1t s THR 163 Cb -0.11 -0.96 0.06 0.00 0.01 0.00 0.00 72.50 71.50 1j1t s THR 163 CO 0.02 0.33 0.59 0.00 -0.69 0.00 0.00 174.62 174.87 1j1t s ALA 164 N 0.58 -1.47 -1.54 7.40 0.00 -0.60 -1.45 121.76 124.68 1j1t s ALA 164 Ca -0.12 1.50 0.00 0.00 0.00 0.00 0.00 51.96 53.34 1j1t s ALA 164 Cb -0.14 -0.71 0.00 0.00 0.00 0.00 0.00 23.12 22.27 1j1t s ALA 164 CO 0.03 -0.30 0.00 1.19 0.00 0.00 0.00 175.76 176.68 1j1t n PHE 165 N 2.29 -1.05 -0.91 0.00 3.01 -1.25 -0.76 117.46 118.79 1j1t n PHE 165 Ca -0.15 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.31 1j1t n PHE 165 Cb 0.56 -3.44 0.00 0.00 -0.01 0.00 0.00 39.48 36.59 1j1t n PHE 165 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1j1t n GLY 166 N -0.86 0.79 3.78 1.37 0.00 -1.26 -5.00 105.19 104.02 1j1t n GLY 166 Ca -0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.46 1j1t n GLY 166 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1j1t s ASN 167 N -2.78 6.25 0.06 1.61 0.02 0.06 -5.10 114.94 115.06 1j1t s ASN 167 Ca 0.00 0.31 0.08 0.00 -1.02 0.00 0.00 52.86 52.24 1j1t s ASN 167 Cb 0.00 -2.08 -0.03 0.00 0.02 0.00 0.00 41.25 39.17 1j1t s ASN 167 CO 0.00 0.26 -0.23 -0.44 0.02 0.00 0.00 177.10 176.72 1j1t s SER 168 N -0.15 2.75 -0.16 -1.22 0.01 -1.26 -1.55 113.70 112.12 1j1t s SER 168 Ca 0.10 -0.58 -0.13 0.00 1.31 0.00 0.00 55.95 56.66 1j1t s SER 168 Cb -0.11 -0.22 0.05 0.00 0.21 0.00 0.00 66.02 65.94 1j1t s SER 168 CO 0.00 0.18 0.41 0.12 0.41 0.00 0.00 173.24 174.36 1j1t s PHE 169 N -0.86 -0.49 -0.08 2.43 2.19 -0.78 -5.01 117.98 115.39 1j1t s PHE 169 Ca 0.09 1.14 -0.30 0.00 0.33 0.00 0.00 56.93 58.19 1j1t s PHE 169 Cb -0.09 0.18 0.09 0.00 -1.31 0.00 0.00 43.02 41.89 1j1t s PHE 169 CO 0.02 -0.25 0.80 0.20 1.83 0.00 0.00 175.22 177.83 1j1t s GLY 170 N 0.57 -0.46 0.17 13.12 0.00 -1.26 -0.88 107.32 118.58 1j1t s GLY 170 Ca -0.03 1.54 -0.17 0.00 0.00 0.00 0.00 44.72 46.06 1j1t s GLY 170 CO -0.03 0.93 0.48 -0.26 0.00 0.00 0.00 173.10 174.22 1j1t s ILE 171 N -1.33 0.04 0.34 0.90 -4.36 -0.52 -4.95 121.20 111.31 1j1t s ILE 171 Ca -0.06 -0.68 -0.27 0.00 -0.26 0.00 0.00 60.65 59.37 1j1t s ILE 171 Cb -0.00 -1.42 -0.09 0.00 1.25 0.00 0.00 42.46 42.20 1j1t s ILE 171 CO 0.05 -0.18 1.09 -2.16 0.24 0.00 0.00 174.94 173.98 1j1t s PRO 172 N -3.85 4.38 0.38 0.37 0.04 -1.26 -1.87 135.00 133.19 1j1t s PRO 172 Ca 0.07 1.69 0.08 0.00 0.04 0.00 0.00 61.00 62.88 1j1t s PRO 172 Cb 0.00 -2.87 -0.05 0.00 0.04 0.00 0.00 34.50 31.63 1j1t s PRO 172 CO -0.06 0.01 0.16 0.14 0.04 0.00 0.00 177.00 177.29 1j1t s VAL 173 N -1.39 2.65 0.15 -0.36 -7.23 -0.16 -3.90 120.40 110.15 1j1t s VAL 173 Ca 0.51 -1.70 -0.31 0.00 -1.81 0.00 0.00 61.98 58.67 1j1t s VAL 173 Cb -0.28 -2.97 -0.10 0.00 0.56 0.00 0.00 36.38 33.60 1j1t s VAL 173 CO 0.35 -0.09 1.56 -0.70 -0.31 0.00 0.00 175.10 175.91 1j1t s GLU 174 N -3.88 4.22 0.44 4.82 2.12 -0.47 -4.49 118.70 121.45 1j1t s GLU 174 Ca 0.40 2.33 -0.21 0.00 0.36 0.00 0.00 54.97 57.85 1j1t s GLU 174 Cb 0.00 -3.22 -0.10 0.00 0.26 0.00 0.00 34.13 31.07 1j1t s GLU 174 CO 0.23 -0.61 0.97 0.34 -0.54 0.00 0.00 175.26 175.65 1j1t s ASP 175 N 1.30 6.83 -0.06 -1.70 2.15 -1.26 -4.97 116.67 118.96 1j1t s ASP 175 Ca 0.70 1.76 -0.03 0.00 0.43 0.00 0.00 52.55 55.42 1j1t s ASP 175 Cb -0.43 -2.55 0.04 0.00 -0.30 0.00 0.00 42.92 39.68 1j1t s ASP 175 CO 0.31 -0.44 0.13 -0.62 -0.17 0.00 0.00 175.17 174.38 1j1t s ASP 176 N -2.09 -0.09 0.54 -0.34 -1.08 -1.26 -4.98 116.67 107.37 1j1t s ASP 176 Ca 0.62 0.26 0.26 0.00 -0.52 0.00 0.00 52.55 53.17 1j1t s ASP 176 Cb -0.12 0.16 1.51 0.00 -1.46 0.00 0.00 42.92 43.01 1j1t s ASP 176 CO 0.16 -0.14 2.13 0.77 0.52 0.00 0.00 175.17 178.61 1j1t h SER 177 N 7.15 0.00 -1.26 -0.34 4.64 -1.94 -2.76 113.55 119.04 1j1t h SER 177 Ca -0.42 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.39 1j1t h SER 177 Cb 1.14 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.82 1j1t h SER 177 CO 0.43 0.08 -0.88 0.00 -0.87 0.00 0.00 176.83 175.60 1j1t n GLN 178 N -3.84 2.78 -1.53 4.77 1.13 -1.25 -1.53 117.38 117.90 1j1t n GLN 178 Ca -0.02 -4.10 -0.31 0.00 -1.94 0.00 0.00 57.00 50.62 1j1t n GLN 178 Cb 0.18 -1.96 0.06 0.00 0.11 0.00 0.00 30.24 28.63 1j1t n GLN 178 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1j1t s SER 179 N -3.45 5.05 -0.25 1.08 1.04 -0.81 -4.03 113.70 112.33 1j1t s SER 179 Ca 0.42 1.78 -0.24 0.00 0.48 0.00 0.00 55.95 58.39 1j1t s SER 179 Cb 0.41 -2.52 0.07 0.00 0.10 0.00 0.00 66.02 64.08 1j1t s SER 179 CO -0.10 -1.67 0.68 -0.72 0.98 0.00 0.00 173.24 172.41 1j1t s TYR 180 N -2.82 -0.74 0.25 5.02 -0.85 -0.49 -4.00 117.35 113.73 1j1t s TYR 180 Ca 0.61 1.80 -0.18 0.00 -0.52 0.00 0.00 57.07 58.78 1j1t s TYR 180 Cb -0.16 0.26 -0.08 0.00 0.38 0.00 0.00 41.96 42.35 1j1t s TYR 180 CO 0.51 -0.37 0.72 0.12 -1.52 0.00 0.00 175.55 175.02 1j1t s PHE 181 N 0.30 3.57 0.00 -3.49 5.36 -1.26 0.04 117.98 122.50 1j1t s PHE 181 Ca -0.00 1.33 -0.05 0.00 -0.96 0.00 0.00 56.93 57.26 1j1t s PHE 181 Cb -0.05 -2.59 -0.00 0.00 -0.34 0.00 0.00 43.02 40.04 1j1t s PHE 181 CO 0.01 0.27 0.08 0.15 -1.46 0.00 0.00 175.22 174.27 1j1t s LYS 182 N -2.26 0.38 0.04 10.12 1.02 0.85 -1.22 119.74 128.67 1j1t s LYS 182 Ca 0.46 -0.39 -0.19 0.00 0.02 0.00 0.00 55.97 55.86 1j1t s LYS 182 Cb -0.15 0.15 0.04 0.00 -0.52 0.00 0.00 37.83 37.36 1j1t s LYS 182 CO 0.20 -0.08 0.44 -0.59 -0.92 0.00 0.00 175.35 174.40 1j1t s PHE 183 N -1.21 -0.31 0.00 3.18 -0.71 -0.71 -0.21 117.98 118.00 1j1t s PHE 183 Ca -0.13 0.32 0.00 0.00 -1.04 0.00 0.00 56.93 56.08 1j1t s PHE 183 Cb -0.07 0.25 0.00 0.00 -1.21 0.00 0.00 43.02 41.98 1j1t s PHE 183 CO 0.01 -0.58 0.00 0.41 -1.34 0.00 0.00 175.22 173.72 1j1t n GLY 184 N 0.55 0.18 2.59 1.99 0.00 -0.05 -1.12 105.19 109.34 1j1t n GLY 184 Ca -0.19 -0.55 -0.26 0.00 0.00 0.00 0.00 46.02 45.02 1j1t n GLY 184 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1j1t s ASN 185 N -4.00 3.04 -0.62 1.61 3.84 0.45 -4.20 114.94 115.07 1j1t s ASN 185 Ca 0.00 -1.11 -0.08 0.00 0.21 0.00 0.00 52.86 51.89 1j1t s ASN 185 Cb 0.00 -0.16 0.16 0.00 -0.55 0.00 0.00 41.25 40.70 1j1t s ASN 185 CO 0.00 -0.42 0.48 -0.47 -2.79 0.00 0.00 177.10 173.90 1j1t s TYR 186 N 2.16 3.51 -0.09 0.43 5.04 -0.70 -1.31 117.35 126.39 1j1t s TYR 186 Ca 0.08 -2.26 -0.30 0.00 -2.44 0.00 0.00 57.07 52.16 1j1t s TYR 186 Cb -0.16 -3.45 -0.03 0.00 0.35 0.00 0.00 41.96 38.67 1j1t s TYR 186 CO -0.33 -0.93 1.33 -1.17 -1.34 0.00 0.00 175.55 173.11 1j1t s LEU 187 N 0.50 4.25 -0.12 6.97 2.96 0.37 -1.61 118.68 132.00 1j1t s LEU 187 Ca 0.13 1.89 -0.23 0.00 -0.22 0.00 0.00 54.13 55.70 1j1t s LEU 187 Cb -0.20 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 42.92 1j1t s LEU 187 CO -0.04 -0.73 0.72 -1.10 -1.32 0.00 0.00 176.35 173.88 1j1t s GLN 188 N 3.04 4.36 -1.06 1.98 -1.52 0.45 -2.25 119.66 124.66 1j1t s GLN 188 Ca 0.60 0.87 -0.19 0.00 -1.95 0.00 0.00 55.36 54.68 1j1t s GLN 188 Cb -0.26 -3.50 0.10 0.00 -0.22 0.00 0.00 33.01 29.12 1j1t s GLN 188 CO 0.21 -0.09 1.39 0.45 -0.25 0.00 0.00 175.29 177.00 1j1t s SER 189 N 0.96 6.68 -0.07 5.90 0.15 -0.19 -4.61 113.70 122.52 1j1t s SER 189 Ca 0.36 -2.04 -0.09 0.00 0.70 0.00 0.00 55.95 54.88 1j1t s SER 189 Cb -0.17 -2.49 0.02 0.00 -1.71 0.00 0.00 66.02 61.67 1j1t s SER 189 CO 0.15 -1.19 0.24 -1.58 1.20 0.00 0.00 173.24 172.06 1j1t s GLN 190 N 3.58 0.36 -0.03 5.44 0.74 -1.26 -1.23 119.66 127.25 1j1t s GLN 190 Ca 0.42 0.18 -0.30 0.00 0.05 0.00 0.00 55.36 55.71 1j1t s GLN 190 Cb -0.01 0.17 -0.04 0.00 1.10 0.00 0.00 33.01 34.22 1j1t s GLN 190 CO -0.05 -0.06 1.33 0.34 -0.55 0.00 0.00 175.29 176.29 1j1t s ASP 191 N -0.24 6.92 0.50 6.67 -1.08 -0.45 -4.90 116.67 124.09 1j1t s ASP 191 Ca -0.04 1.98 0.24 0.00 -0.52 0.00 0.00 52.55 54.21 1j1t s ASP 191 Cb -0.03 -2.56 1.32 0.00 -1.46 0.00 0.00 42.92 40.19 1j1t s ASP 191 CO 0.01 -0.68 2.05 1.55 0.52 0.00 0.00 175.17 178.62 1j1t h PRO 192 N 7.78 0.00 0.00 4.34 0.13 -1.89 0.36 132.00 142.72 1j1t h PRO 192 Ca -0.36 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.75 1j1t h PRO 192 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 1j1t h PRO 192 CO 0.90 0.14 -0.19 1.88 -0.23 0.00 0.00 178.00 180.50 1j1t h TYR 193 N 0.00 0.00 0.00 1.56 0.05 -1.91 0.09 116.97 116.76 1j1t h TYR 193 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1j1t h TYR 193 Cb 0.33 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.07 1j1t h TYR 193 CO 0.00 0.71 -1.16 0.25 -1.05 0.00 0.00 178.16 176.91 1j1t n THR 194 N -4.64 0.42 -1.01 -2.88 -2.24 -1.23 -4.67 114.28 98.02 1j1t n THR 194 Ca -0.10 -0.47 -0.01 0.00 -2.27 0.00 0.00 64.05 61.21 1j1t n THR 194 Cb 0.35 -0.18 -0.00 0.00 -2.10 0.00 0.00 70.33 68.40 1j1t n THR 194 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1j1t n LEU 195 N -2.45 0.36 -4.75 3.22 4.77 0.13 -4.99 117.00 113.28 1j1t n LEU 195 Ca -0.00 0.01 -0.40 0.00 -0.03 0.00 0.00 56.01 55.59 1j1t n LEU 195 Cb 0.53 -1.35 -0.05 0.00 -2.33 0.00 0.00 43.42 40.22 1j1t n LEU 195 CO 0.41 -0.42 0.76 -1.81 -1.33 0.00 0.00 177.39 175.00 1j1t s ASP 196 N -2.05 7.35 0.24 -1.43 1.01 -1.25 -4.69 116.67 115.85 1j1t s ASP 196 Ca 0.00 2.18 -0.30 0.00 0.71 0.00 0.00 52.55 55.14 1j1t s ASP 196 Cb 0.00 -2.62 -0.09 0.00 1.01 0.00 0.00 42.92 41.22 1j1t s ASP 196 CO 0.00 -0.08 1.11 -0.54 0.21 0.00 0.00 175.17 175.86 1j1t s LYS 197 N -1.26 4.62 0.04 8.23 1.02 -1.26 -1.35 119.74 129.77 1j1t s LYS 197 Ca 0.44 1.78 0.05 0.00 0.02 0.00 0.00 55.97 58.27 1j1t s LYS 197 Cb -0.30 -3.22 -0.03 0.00 -0.52 0.00 0.00 37.83 33.75 1j1t s LYS 197 CO 0.38 0.15 -0.10 0.00 -0.92 0.00 0.00 175.35 174.86 1j1t n GLY 199 N 1.32 0.33 3.00 0.00 0.00 -1.26 -4.76 105.19 103.82 1j1t n GLY 199 Ca -0.15 -2.08 -0.25 0.00 0.00 0.00 0.00 46.02 43.55 1j1t n GLY 199 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1j1t s GLU 200 N -1.03 1.65 0.19 1.61 2.12 -1.26 -5.04 118.70 116.94 1j1t s GLU 200 Ca 0.00 -0.38 -0.32 0.00 0.36 0.00 0.00 54.97 54.63 1j1t s GLU 200 Cb 0.00 -1.43 -0.15 0.00 0.26 0.00 0.00 34.13 32.81 1j1t s GLU 200 CO 0.00 -0.03 1.17 0.00 -0.54 0.00 0.00 175.26 175.86 1j1t n ALA 201 N 4.03 -0.54 -0.75 6.30 0.00 -1.26 -1.07 120.51 127.22 1j1t n ALA 201 Ca -0.21 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1j1t n ALA 201 Cb 0.51 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.91 1j1t n ALA 201 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j1t n GLY 202 N 1.95 0.96 3.19 0.00 0.00 -1.24 -4.96 105.19 105.08 1j1t n GLY 202 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1j1t n GLY 202 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1j1t s ASN 203 N -2.85 5.76 0.23 1.61 3.04 -0.23 -4.95 114.94 117.54 1j1t s ASN 203 Ca 0.00 -2.56 -0.07 0.00 0.04 0.00 0.00 52.86 50.28 1j1t s ASN 203 Cb 0.00 -1.99 0.31 0.00 -1.54 0.00 0.00 41.25 38.03 1j1t s ASN 203 CO 0.00 -0.51 1.84 -1.28 -3.04 0.00 0.00 177.10 174.11 1j1t h SER 204 N 7.61 0.75 0.12 -4.21 0.87 -1.93 -1.80 113.55 114.96 1j1t h SER 204 Ca -0.03 0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.51 1j1t h SER 204 Cb 1.01 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.83 1j1t h SER 204 CO 0.76 0.48 -0.14 0.78 -0.53 0.00 0.00 176.83 178.18 1j1t h ASN 205 N 0.88 0.05 -0.50 6.23 -0.26 -1.95 -1.20 115.58 118.83 1j1t h ASN 205 Ca 0.35 -0.01 -0.10 0.00 -0.56 0.00 0.00 56.30 55.99 1j1t h ASN 205 Cb 0.18 -0.01 -0.02 0.00 -1.06 0.00 0.00 38.32 37.41 1j1t h ASN 205 CO -0.18 0.20 -0.06 0.77 -1.06 0.00 0.00 177.43 177.10 1j1t h SER 206 N 0.05 0.95 0.29 5.81 4.64 -1.67 -1.80 113.55 121.83 1j1t h SER 206 Ca 0.01 -0.28 -0.15 0.00 -0.47 0.00 0.00 61.79 60.90 1j1t h SER 206 Cb 0.28 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 1j1t h SER 206 CO 0.02 1.04 -0.60 -0.26 -0.87 0.00 0.00 176.83 176.15 1j1t h PHE 207 N 0.87 0.39 -0.28 4.77 0.04 -1.26 -1.45 116.94 120.02 1j1t h PHE 207 Ca 0.15 -0.15 0.02 0.00 2.80 0.00 0.00 57.97 60.78 1j1t h PHE 207 Cb 0.59 -0.07 -0.02 0.00 2.20 0.00 0.00 35.95 38.65 1j1t h PHE 207 CO 0.04 0.83 0.15 -0.22 -0.60 0.00 0.00 178.31 178.51 1j1t h LYS 208 N 0.23 0.30 -0.62 1.51 3.64 -0.92 -0.99 116.57 119.72 1j1t h LYS 208 Ca -0.01 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.28 1j1t h LYS 208 Cb 1.12 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.85 1j1t h LYS 208 CO 0.10 0.20 0.09 -0.91 -2.27 0.00 0.00 179.45 176.65 1j1t h ASN 209 N 0.31 0.99 0.09 4.20 2.35 -1.18 -2.31 115.58 120.02 1j1t h ASN 209 Ca 0.12 -0.27 0.01 0.00 -0.55 0.00 0.00 56.30 55.61 1j1t h ASN 209 Cb 0.03 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.12 1j1t h ASN 209 CO -0.08 1.01 -0.13 0.00 -1.65 0.00 0.00 177.43 176.59 1j1t h PHE 211 N -0.26 0.54 -0.04 0.00 0.04 -1.16 0.12 116.94 116.18 1j1t h PHE 211 Ca 0.02 -0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.75 1j1t h PHE 211 Cb 0.27 -0.17 -0.00 0.00 2.20 0.00 0.00 35.95 38.25 1j1t h PHE 211 CO -0.15 0.47 0.01 0.93 -0.60 0.00 0.00 178.31 178.98 1j1t h GLU 212 N 0.53 0.07 0.00 1.51 5.08 -0.97 0.86 114.58 121.65 1j1t h GLU 212 Ca 0.13 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.40 1j1t h GLU 212 Cb 0.20 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1j1t h GLU 212 CO -0.00 0.26 -0.31 -0.44 -1.00 0.00 0.00 179.01 177.51 1j1t h ASP 213 N -0.14 0.00 0.52 1.42 3.45 -0.59 -2.13 116.42 118.95 1j1t h ASP 213 Ca 0.01 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.47 1j1t h ASP 213 Cb 0.22 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.99 1j1t h ASP 213 CO -0.00 0.31 -0.09 0.18 -1.57 0.00 0.00 179.24 178.07 1j1t n LEU 214 N -3.90 0.27 -0.43 1.55 4.77 0.36 -4.91 117.00 114.71 1j1t n LEU 214 Ca -0.02 0.16 -0.05 0.00 -0.03 0.00 0.00 56.01 56.07 1j1t n LEU 214 Cb 0.39 -0.26 -0.02 0.00 -2.33 0.00 0.00 43.42 41.19 1j1t n LEU 214 CO 0.37 0.05 -0.05 0.61 -1.33 0.00 0.00 177.39 177.04 1j1t n GLY 215 N 1.33 0.75 3.44 -0.72 0.00 -0.79 -4.94 105.19 104.26 1j1t n GLY 215 Ca 0.13 -0.81 -0.44 0.00 0.00 0.00 0.00 46.02 44.90 1j1t n GLY 215 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1j1t s ILE 216 N -2.21 4.79 -1.61 -0.61 -1.09 0.23 -4.72 121.20 115.98 1j1t s ILE 216 Ca 0.00 -1.63 0.17 0.00 -2.23 0.00 0.00 60.65 56.95 1j1t s ILE 216 Cb 0.00 -4.76 0.02 0.00 -1.58 0.00 0.00 42.46 36.14 1j1t s ILE 216 CO 0.00 -1.47 0.90 0.35 -1.23 0.00 0.00 174.94 173.49 1j1t n THR 217 N 5.39 0.00 -3.81 2.92 -2.24 -1.26 -4.60 114.28 110.68 1j1t n THR 217 Ca 0.23 -0.36 -0.14 0.00 -2.27 0.00 0.00 64.05 61.52 1j1t n THR 217 Cb 0.49 1.22 -0.15 0.00 -2.10 0.00 0.00 70.33 69.79 1j1t n THR 217 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1j1t s GLU 218 N -1.85 0.00 -0.35 -0.78 2.12 -1.26 -5.01 118.70 111.56 1j1t s GLU 218 Ca 0.15 0.13 -0.02 0.00 0.36 0.00 0.00 54.97 55.60 1j1t s GLU 218 Cb 0.13 -0.13 0.19 0.00 0.26 0.00 0.00 34.13 34.58 1j1t s GLU 218 CO 0.38 -0.09 0.85 0.45 -0.54 0.00 0.00 175.26 176.31 1j1t s SER 219 N 0.61 -0.91 -0.12 -1.70 0.15 -1.23 -1.60 113.70 108.90 1j1t s SER 219 Ca -0.05 -0.37 0.00 0.00 0.70 0.00 0.00 55.95 56.23 1j1t s SER 219 Cb -0.07 1.22 0.02 0.00 -1.71 0.00 0.00 66.02 65.49 1j1t s SER 219 CO -0.02 -0.11 -0.10 -0.75 1.20 0.00 0.00 173.24 173.46 1j1t s LYS 220 N 2.07 1.80 -0.29 5.44 2.20 0.72 -4.25 119.74 127.43 1j1t s LYS 220 Ca 0.16 -0.37 -0.06 0.00 -0.36 0.00 0.00 55.97 55.34 1j1t s LYS 220 Cb -0.01 -1.75 0.01 0.00 -1.51 0.00 0.00 37.83 34.57 1j1t s LYS 220 CO -0.13 -0.23 0.07 0.08 -0.36 0.00 0.00 175.35 174.77 1j1t s VAL 221 N 1.56 3.89 -0.21 4.02 1.01 -0.72 -1.65 120.40 128.30 1j1t s VAL 221 Ca 0.03 -0.70 -0.07 0.00 0.00 0.00 0.00 61.98 61.25 1j1t s VAL 221 Cb -0.13 -2.99 -0.03 0.00 0.00 0.00 0.00 36.38 33.22 1j1t s VAL 221 CO -0.08 0.10 0.05 -0.89 0.00 0.00 0.00 175.10 174.28 1j1t s THR 222 N 1.49 4.46 -0.11 3.92 2.01 -0.17 -0.70 115.64 126.53 1j1t s THR 222 Ca 0.03 -0.14 0.03 0.00 0.31 0.00 0.00 61.69 61.91 1j1t s THR 222 Cb -0.17 -3.03 -0.00 0.00 0.01 0.00 0.00 72.50 69.30 1j1t s THR 222 CO 0.02 0.41 -0.21 -0.04 -0.69 0.00 0.00 174.62 174.11 1j1t s MET 223 N 0.90 3.13 0.26 4.92 -1.94 0.38 -0.73 119.30 126.22 1j1t s MET 223 Ca 0.03 -0.83 0.02 0.00 -1.71 0.00 0.00 55.69 53.20 1j1t s MET 223 Cb -0.14 -2.38 -0.05 0.00 2.01 0.00 0.00 34.83 34.26 1j1t s MET 223 CO 0.02 0.18 0.06 0.95 -0.01 0.00 0.00 175.02 176.22 1j1t s THR 224 N 0.37 0.82 -1.37 2.05 -4.23 -0.48 -1.67 115.64 111.13 1j1t s THR 224 Ca -0.16 -2.01 -0.03 0.00 -1.18 0.00 0.00 61.69 58.31 1j1t s THR 224 Cb -0.17 -2.57 0.00 0.00 1.34 0.00 0.00 72.50 71.09 1j1t s THR 224 CO 0.08 -0.11 0.46 0.59 -0.54 0.00 0.00 174.62 175.11 1j1t n ASN 225 N -0.49 -0.94 -4.82 3.99 5.03 -1.26 -0.79 115.26 115.98 1j1t n ASN 225 Ca -0.02 -1.01 -0.37 0.00 0.87 0.00 0.00 54.58 54.04 1j1t n ASN 225 Cb 0.66 -3.07 -0.06 0.00 -1.02 0.00 0.00 39.78 36.29 1j1t n ASN 225 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1j1t s VAL 226 N -3.90 4.76 -0.04 2.41 1.01 -1.26 -4.16 120.40 119.23 1j1t s VAL 226 Ca 0.06 1.10 -0.05 0.00 0.00 0.00 0.00 61.98 63.09 1j1t s VAL 226 Cb -0.03 -3.84 0.01 0.00 0.00 0.00 0.00 36.38 32.52 1j1t s VAL 226 CO 0.89 0.43 0.12 0.42 0.00 0.00 0.00 175.10 176.96 1j1t s THR 227 N -1.26 0.02 -0.07 3.92 -4.23 -0.37 -4.45 115.64 109.20 1j1t s THR 227 Ca 0.33 -0.17 -0.03 0.00 -1.18 0.00 0.00 61.69 60.64 1j1t s THR 227 Cb -0.18 -0.24 0.04 0.00 1.34 0.00 0.00 72.50 73.47 1j1t s THR 227 CO 0.19 -0.10 0.15 -0.47 -0.54 0.00 0.00 174.62 173.85 1j1t s TYR 228 N -0.27 -0.16 -0.03 3.99 5.04 -1.25 -1.33 117.35 123.33 1j1t s TYR 228 Ca -0.04 0.53 0.07 0.00 -2.44 0.00 0.00 57.07 55.20 1j1t s TYR 228 Cb -0.03 -0.19 -0.02 0.00 0.35 0.00 0.00 41.96 42.08 1j1t s TYR 228 CO 0.00 -0.22 -0.25 0.99 -1.34 0.00 0.00 175.55 174.73 1j1t s THR 229 N 1.77 2.11 -0.11 4.34 2.01 0.10 -4.96 115.64 120.91 1j1t s THR 229 Ca -0.03 -1.08 -0.04 0.00 0.31 0.00 0.00 61.69 60.86 1j1t s THR 229 Cb -0.12 -1.74 0.06 0.00 0.01 0.00 0.00 72.50 70.71 1j1t s THR 229 CO -0.06 0.58 0.18 -0.60 -0.69 0.00 0.00 174.62 174.03 1j1t s ARG 230 N -0.51 0.07 -0.22 4.92 3.52 -1.25 -1.11 118.95 124.36 1j1t s ARG 230 Ca 0.07 0.52 -0.00 0.00 -0.13 0.00 0.00 55.73 56.19 1j1t s ARG 230 Cb -0.11 -0.41 0.06 0.00 -1.56 0.00 0.00 34.95 32.93 1j1t s ARG 230 CO 0.00 -0.36 -0.03 -1.21 -0.81 0.00 0.00 175.30 172.89 1j1t s GLU 231 N 2.31 1.36 -0.17 5.12 2.02 0.60 -4.98 118.70 124.95 1j1t s GLU 231 Ca 0.03 -0.82 -0.05 0.00 0.02 0.00 0.00 54.97 54.15 1j1t s GLU 231 Cb -0.13 -2.44 -0.03 0.00 0.10 0.00 0.00 34.13 31.63 1j1t s GLU 231 CO -0.07 -0.60 -0.00 0.99 0.02 0.00 0.00 175.26 175.60 1j1t s THR 232 N 1.53 4.15 0.00 3.63 2.01 -1.26 -0.80 115.64 124.89 1j1t s THR 232 Ca -0.04 -0.26 0.00 0.00 0.31 0.00 0.00 61.69 61.70 1j1t s THR 232 Cb -0.18 -2.85 0.00 0.00 0.01 0.00 0.00 72.50 69.48 1j1t s THR 232 CO -0.07 0.47 0.25 -0.46 -0.69 0.00 0.00 174.62 174.12