#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3j s LYS 5 N 0.00 3.38 0.00 -1.08 -2.85 -1.26 -5.07 119.74 112.86 3h3j s LYS 5 Ca 0.00 0.86 0.00 0.00 -1.00 0.00 0.00 55.97 55.83 3h3j s LYS 5 Cb 0.00 -2.05 0.00 0.00 -2.06 0.00 0.00 37.83 33.72 3h3j s LYS 5 CO 0.00 -0.75 0.00 0.41 0.10 0.00 0.00 175.35 175.11 3h3j n GLY 6 N -2.31 -0.26 3.57 0.59 0.00 -1.26 -5.05 105.19 100.47 3h3j n GLY 6 Ca 0.07 -1.74 -0.35 0.00 0.00 0.00 0.00 46.02 43.99 3h3j n GLY 6 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3h3j s ASN 7 N -1.00 5.46 -0.09 1.61 0.02 -1.26 -5.01 114.94 114.68 3h3j s ASN 7 Ca 0.00 -0.01 0.01 0.00 -1.02 0.00 0.00 52.86 51.84 3h3j s ASN 7 Cb 0.00 -1.95 0.02 0.00 0.02 0.00 0.00 41.25 39.34 3h3j s ASN 7 CO 0.00 0.11 -0.11 -0.75 0.02 0.00 0.00 177.10 176.37 3h3j s LYS 8 N 0.76 1.70 -0.11 -0.60 2.20 -1.26 -2.36 119.74 120.07 3h3j s LYS 8 Ca 0.03 -0.38 0.00 0.00 -0.36 0.00 0.00 55.97 55.27 3h3j s LYS 8 Cb -0.13 -1.52 -0.02 0.00 -1.51 0.00 0.00 37.83 34.65 3h3j s LYS 8 CO 0.02 -0.08 -0.12 0.08 -0.36 0.00 0.00 175.35 174.88 3h3j s VAL 9 N 1.05 3.15 -0.20 4.02 1.01 -0.26 -1.33 120.40 127.83 3h3j s VAL 9 Ca -0.07 -0.64 -0.03 0.00 0.00 0.00 0.00 61.98 61.23 3h3j s VAL 9 Cb -0.15 -2.31 -0.01 0.00 0.00 0.00 0.00 36.38 33.92 3h3j s VAL 9 CO -0.01 0.54 -0.05 -0.69 0.00 0.00 0.00 175.10 174.89 3h3j s VAL 10 N 0.06 3.39 -0.20 2.92 1.01 0.08 -0.55 120.40 127.11 3h3j s VAL 10 Ca -0.05 -0.50 -0.16 0.00 0.00 0.00 0.00 61.98 61.28 3h3j s VAL 10 Cb -0.14 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.68 3h3j s VAL 10 CO 0.04 0.44 0.40 -0.22 0.00 0.00 0.00 175.10 175.76 3h3j s LEU 11 N 1.23 4.15 -0.30 3.92 2.96 0.62 -0.68 118.68 130.58 3h3j s LEU 11 Ca 0.03 0.51 -0.05 0.00 -0.22 0.00 0.00 54.13 54.39 3h3j s LEU 11 Cb -0.14 -2.51 0.02 0.00 0.50 0.00 0.00 46.19 44.06 3h3j s LEU 11 CO -0.02 -0.08 0.05 -0.63 -1.32 0.00 0.00 176.35 174.36 3h3j s ILE 12 N 1.34 3.61 0.00 6.68 1.01 0.47 -0.41 121.20 133.91 3h3j s ILE 12 Ca 0.19 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 59.89 3h3j s ILE 12 Cb -0.15 -2.93 0.00 0.00 0.01 0.00 0.00 42.46 39.39 3h3j s ILE 12 CO 0.08 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.64 3h3j n GLY 13 N 4.79 1.30 2.29 6.18 0.00 0.09 -0.72 105.19 119.12 3h3j n GLY 13 Ca -0.14 -0.89 -0.27 0.00 0.00 0.00 0.00 46.02 44.72 3h3j n GLY 13 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3h3j n ASN 14 N 0.00 5.18 -1.29 1.61 5.15 -1.26 -3.99 115.26 120.66 3h3j n ASN 14 Ca 0.00 -3.75 0.00 0.00 -0.60 0.00 0.00 54.58 50.23 3h3j n ASN 14 Cb 0.00 -0.48 0.00 0.00 -0.53 0.00 0.00 39.78 38.77 3h3j n ASN 14 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3h3j n GLY 15 N -0.62 1.37 0.12 8.20 0.00 -1.26 -4.37 105.19 108.63 3h3j n GLY 15 Ca 0.44 -1.65 -0.08 0.00 0.00 0.00 0.00 46.02 44.73 3h3j n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3j h ALA 16 N -1.53 0.21 0.08 4.61 0.00 -1.95 0.06 119.26 120.73 3h3j h ALA 16 Ca 0.00 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3h3j h ALA 16 Cb 0.00 0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3h3j h ALA 16 CO 0.00 -0.43 -0.04 0.28 0.00 0.00 0.00 179.25 179.07 3h3j h VAL 17 N 0.07 1.17 -0.39 0.00 2.07 -1.88 -2.62 116.25 114.67 3h3j h VAL 17 Ca 0.12 -0.94 -0.00 0.00 0.82 0.00 0.00 66.70 66.69 3h3j h VAL 17 Cb 0.15 1.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 3h3j h VAL 17 CO -0.20 0.23 0.22 1.23 0.02 0.00 0.00 177.57 179.07 3h3j h GLY 18 N -0.54 0.57 1.80 2.17 0.00 -1.66 -0.35 103.07 105.06 3h3j h GLY 18 Ca -0.01 -0.25 -0.10 0.00 0.00 0.00 0.00 47.33 46.97 3h3j h GLY 18 CO 0.02 0.24 -0.39 1.48 0.00 0.00 0.00 176.54 177.88 3h3j h SER 19 N 0.50 0.23 -0.48 0.19 4.64 -1.08 0.10 113.55 117.66 3h3j h SER 19 Ca 0.14 -0.09 -0.13 0.00 -0.47 0.00 0.00 61.79 61.24 3h3j h SER 19 Cb 0.03 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.04 3h3j h SER 19 CO -0.02 0.61 -0.19 0.28 -0.87 0.00 0.00 176.83 176.63 3h3j h SER 20 N 0.19 1.01 -0.55 4.97 0.02 -1.03 -0.58 113.55 117.58 3h3j h SER 20 Ca 0.02 -0.37 -0.03 0.00 -0.84 0.00 0.00 61.79 60.57 3h3j h SER 20 Cb 0.78 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 63.02 3h3j h SER 20 CO 0.06 1.16 0.24 0.22 -1.14 0.00 0.00 176.83 177.37 3h3j h TYR 21 N 0.86 0.82 -0.64 3.45 3.20 -0.48 -0.85 116.97 123.33 3h3j h TYR 21 Ca 0.12 -0.05 0.02 0.00 3.14 0.00 0.00 58.73 61.96 3h3j h TYR 21 Cb 0.77 -0.25 -0.04 0.00 1.54 0.00 0.00 36.73 38.75 3h3j h TYR 21 CO 0.05 0.66 0.40 0.00 -1.64 0.00 0.00 178.16 177.62 3h3j h ALA 22 N 1.08 0.83 -0.43 1.82 0.00 -0.51 -0.74 119.26 121.31 3h3j h ALA 22 Ca 0.19 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 3h3j h ALA 22 Cb 0.17 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3h3j h ALA 22 CO -0.02 0.16 -0.05 0.35 0.00 0.00 0.00 179.25 179.69 3h3j h PHE 23 N 0.79 0.77 -0.61 0.00 3.57 -0.79 -1.54 116.94 119.13 3h3j h PHE 23 Ca 0.25 -0.12 0.02 0.00 3.53 0.00 0.00 57.97 61.66 3h3j h PHE 23 Cb 0.00 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 38.50 3h3j h PHE 23 CO -0.05 0.75 0.39 0.77 -2.23 0.00 0.00 178.31 177.94 3h3j h SER 24 N 0.67 0.65 -0.19 0.41 0.02 -0.28 -0.73 113.55 114.10 3h3j h SER 24 Ca 0.13 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.03 3h3j h SER 24 Cb 0.49 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.86 3h3j h SER 24 CO 0.02 0.46 -0.00 -0.07 -1.14 0.00 0.00 176.83 176.10 3h3j h LEU 25 N 0.77 0.43 -0.72 5.07 3.38 -0.58 0.38 115.31 124.04 3h3j h LEU 25 Ca 0.24 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 58.02 3h3j h LEU 25 Cb -0.02 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3h3j h LEU 25 CO -0.08 0.49 -0.30 0.58 0.09 0.00 0.00 178.44 179.22 3h3j h VAL 26 N 0.44 1.28 -0.24 1.22 2.07 -0.80 -0.11 116.25 120.11 3h3j h VAL 26 Ca 0.10 -1.42 -0.19 0.00 0.82 0.00 0.00 66.70 66.01 3h3j h VAL 26 Cb 0.29 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 3h3j h VAL 26 CO 0.01 0.46 -0.60 0.78 0.02 0.00 0.00 177.57 178.24 3h3j h ASN 27 N 0.56 0.90 0.43 0.57 2.35 -0.58 -3.38 115.58 116.43 3h3j h ASN 27 Ca 0.07 -0.50 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 3h3j h ASN 27 Cb 0.80 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.91 3h3j h ASN 27 CO 0.07 1.29 -1.45 0.00 -1.65 0.00 0.00 177.43 175.69 3h3j n GLN 28 N -3.98 0.55 -3.78 0.81 6.02 0.07 -4.48 117.38 112.59 3h3j n GLN 28 Ca -0.05 -0.05 -0.27 0.00 -0.01 0.00 0.00 57.00 56.63 3h3j n GLN 28 Cb 0.65 -1.64 0.05 0.00 1.02 0.00 0.00 30.24 30.31 3h3j n GLN 28 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 3h3j n SER 29 N -2.33 -4.83 -0.20 1.08 7.64 -0.06 -4.88 113.62 110.03 3h3j n SER 29 Ca -0.01 -0.71 -0.09 0.00 1.01 0.00 0.00 58.87 59.08 3h3j n SER 29 Cb 0.53 -4.29 0.02 0.00 -1.01 0.00 0.00 64.21 59.46 3h3j n SER 29 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 3h3j h ILE 30 N -2.25 1.25 -3.00 0.44 2.04 -1.91 -3.46 117.51 110.62 3h3j h ILE 30 Ca -0.58 -0.95 -0.42 0.00 1.00 0.00 0.00 64.86 63.91 3h3j h ILE 30 Cb 1.37 0.76 -0.14 0.00 -0.74 0.00 0.00 36.82 38.06 3h3j h ILE 30 CO 0.62 0.35 -0.72 0.68 0.00 0.00 0.00 178.15 179.09 3h3j s VAL 31 N -5.24 1.54 -0.85 1.67 -7.23 -1.26 -4.95 120.40 104.08 3h3j s VAL 31 Ca -0.12 -2.15 0.23 0.00 -1.81 0.00 0.00 61.98 58.12 3h3j s VAL 31 Cb 0.13 -2.07 -0.12 0.00 0.56 0.00 0.00 36.38 34.87 3h3j s VAL 31 CO 0.82 -0.57 1.09 -0.90 -0.31 0.00 0.00 175.10 175.22 3h3j n ASP 32 N -0.37 0.69 -3.74 4.85 5.75 -1.19 -4.68 116.55 117.87 3h3j n ASP 32 Ca -0.08 -0.49 -0.15 0.00 -0.01 0.00 0.00 54.79 54.06 3h3j n ASP 32 Cb 0.61 0.73 -0.16 0.00 -1.03 0.00 0.00 41.12 41.28 3h3j n ASP 32 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 3h3j s GLU 33 N -3.08 -0.00 -0.09 0.11 2.12 -0.99 -0.38 118.70 116.39 3h3j s GLU 33 Ca 0.07 0.30 0.01 0.00 0.36 0.00 0.00 54.97 55.71 3h3j s GLU 33 Cb 0.16 -0.27 0.02 0.00 0.26 0.00 0.00 34.13 34.30 3h3j s GLU 33 CO 0.80 -0.20 -0.11 -1.17 -0.54 0.00 0.00 175.26 174.03 3h3j s LEU 34 N 1.35 1.52 -0.07 2.70 2.96 0.28 -1.11 118.68 126.32 3h3j s LEU 34 Ca -0.06 -0.32 0.04 0.00 -0.22 0.00 0.00 54.13 53.57 3h3j s LEU 34 Cb -0.12 -0.87 -0.02 0.00 0.50 0.00 0.00 46.19 45.68 3h3j s LEU 34 CO -0.04 -0.02 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.08 3h3j s VAL 35 N 1.03 2.52 -0.12 1.68 1.01 0.29 -1.12 120.40 125.70 3h3j s VAL 35 Ca -0.07 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.03 3h3j s VAL 35 Cb -0.15 -1.97 -0.00 0.00 0.00 0.00 0.00 36.38 34.26 3h3j s VAL 35 CO -0.01 0.57 -0.19 -0.63 0.00 0.00 0.00 175.10 174.83 3h3j s ILE 36 N -0.21 2.45 -0.07 2.22 1.01 0.31 -0.28 121.20 126.63 3h3j s ILE 36 Ca -0.01 -0.87 0.05 0.00 0.00 0.00 0.00 60.65 59.81 3h3j s ILE 36 Cb -0.13 -1.98 -0.00 0.00 0.01 0.00 0.00 42.46 40.35 3h3j s ILE 36 CO 0.03 0.54 -0.21 -0.63 0.00 0.00 0.00 174.94 174.67 3h3j s ILE 37 N 0.41 1.79 0.00 2.92 1.01 0.46 -0.67 121.20 127.12 3h3j s ILE 37 Ca -0.14 -0.90 -0.26 0.00 0.00 0.00 0.00 60.65 59.35 3h3j s ILE 37 Cb -0.17 -1.54 0.06 0.00 0.01 0.00 0.00 42.46 40.82 3h3j s ILE 37 CO 0.07 0.50 0.58 -0.62 0.00 0.00 0.00 174.94 175.46 3h3j s ASP 38 N 0.11 -0.52 0.29 3.58 2.15 -1.26 -0.73 116.67 120.29 3h3j s ASP 38 Ca -0.09 0.41 -0.02 0.00 0.43 0.00 0.00 52.55 53.27 3h3j s ASP 38 Cb -0.14 0.50 0.42 0.00 -0.30 0.00 0.00 42.92 43.39 3h3j s ASP 38 CO 0.05 -0.66 1.96 -0.07 -0.17 0.00 0.00 175.17 176.28 3h3j h LEU 39 N 2.95 0.98 -7.97 -1.34 3.38 -2.01 -3.33 115.31 107.97 3h3j h LEU 39 Ca -0.29 -0.02 -0.65 0.00 0.09 0.00 0.00 57.88 57.01 3h3j h LEU 39 Cb 1.18 -0.24 -0.10 0.00 0.09 0.00 0.00 40.66 41.59 3h3j h LEU 39 CO 0.40 0.71 1.79 -0.62 0.09 0.00 0.00 178.44 180.80 3h3j s ASP 40 N -6.23 6.69 0.40 -0.43 -1.08 -1.26 -4.81 116.67 109.95 3h3j s ASP 40 Ca -0.12 -2.02 0.16 0.00 -0.52 0.00 0.00 52.55 50.05 3h3j s ASP 40 Cb 0.18 -2.56 0.83 0.00 -1.46 0.00 0.00 42.92 39.91 3h3j s ASP 40 CO 0.80 -1.29 1.85 0.71 0.52 0.00 0.00 175.17 177.75 3h3j h THR 41 N 6.07 1.08 -0.29 1.71 1.35 -2.00 -2.29 112.91 118.54 3h3j h THR 41 Ca 0.32 -1.21 -0.18 0.00 -0.55 0.00 0.00 66.41 64.79 3h3j h THR 41 Cb 0.94 1.68 0.00 0.00 -1.73 0.00 0.00 68.15 69.04 3h3j h THR 41 CO 1.42 0.33 -0.52 -0.33 -0.25 0.00 0.00 175.52 176.17 3h3j h GLU 42 N 0.00 0.86 -0.30 4.72 4.39 -1.93 -0.06 114.58 122.25 3h3j h GLU 42 Ca -0.00 -0.54 -0.12 0.00 0.34 0.00 0.00 59.36 59.04 3h3j h GLU 42 Cb 0.66 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.36 3h3j h GLU 42 CO 0.04 1.18 -0.29 -0.22 -1.16 0.00 0.00 179.01 178.56 3h3j h LYS 43 N 0.64 0.62 -0.32 2.33 3.64 -1.94 -0.99 116.57 120.56 3h3j h LYS 43 Ca 0.02 -0.27 0.02 0.00 -1.27 0.00 0.00 60.65 59.15 3h3j h LYS 43 Cb 1.13 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.90 3h3j h LYS 43 CO 0.12 0.84 0.16 0.28 -2.27 0.00 0.00 179.45 178.58 3h3j h VAL 44 N 0.53 0.99 -0.19 2.00 2.07 -1.22 0.31 116.25 120.76 3h3j h VAL 44 Ca 0.07 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.50 3h3j h VAL 44 Cb 0.77 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 3h3j h VAL 44 CO 0.06 0.06 -0.01 -0.09 0.02 0.00 0.00 177.57 177.61 3h3j h ARG 45 N 0.34 0.05 -0.51 1.57 2.43 -0.78 0.86 114.38 118.34 3h3j h ARG 45 Ca 0.13 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.27 3h3j h ARG 45 Cb 0.04 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 3h3j h ARG 45 CO -0.09 0.03 0.21 0.78 -1.51 0.00 0.00 179.97 179.39 3h3j h GLY 46 N 0.05 0.82 1.25 2.80 0.00 -0.93 -2.47 103.07 104.60 3h3j h GLY 46 Ca 0.09 -0.44 -0.17 0.00 0.00 0.00 0.00 47.33 46.81 3h3j h GLY 46 CO -0.16 0.42 -0.47 -0.55 0.00 0.00 0.00 176.54 175.77 3h3j h ASP 47 N 0.69 0.87 -0.62 0.19 3.32 -0.73 -2.16 116.42 117.98 3h3j h ASP 47 Ca 0.17 -0.43 -0.00 0.00 0.02 0.00 0.00 57.03 56.78 3h3j h ASP 47 Cb 0.19 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.46 3h3j h ASP 47 CO -0.01 1.20 0.38 0.58 -1.72 0.00 0.00 179.24 179.67 3h3j h VAL 48 N 0.63 1.18 -0.05 -1.35 2.07 -0.73 0.20 116.25 118.20 3h3j h VAL 48 Ca 0.03 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.16 3h3j h VAL 48 Cb 1.05 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 31.15 3h3j h VAL 48 CO 0.10 0.18 0.02 0.24 0.02 0.00 0.00 177.57 178.14 3h3j h MET 49 N 0.84 0.08 -0.68 1.57 2.86 -1.42 0.15 114.93 118.33 3h3j h MET 49 Ca 0.22 -0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.86 3h3j h MET 49 Cb -0.03 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.58 3h3j h MET 49 CO -0.04 0.22 0.45 0.22 1.06 0.00 0.00 176.91 178.82 3h3j h ASP 50 N -0.08 0.77 -0.24 1.22 3.58 -1.17 -1.96 116.42 118.54 3h3j h ASP 50 Ca 0.02 -0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.41 3h3j h ASP 50 Cb 0.17 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 41.02 3h3j h ASP 50 CO -0.00 0.56 0.02 -0.07 -2.88 0.00 0.00 179.24 176.86 3h3j h LEU 51 N 0.91 0.41 -1.47 2.28 3.38 -0.49 -2.89 115.31 117.43 3h3j h LEU 51 Ca 0.25 -0.29 0.14 0.00 0.09 0.00 0.00 57.88 58.07 3h3j h LEU 51 Cb -0.10 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 40.49 3h3j h LEU 51 CO -0.06 0.60 0.52 0.11 0.09 0.00 0.00 178.44 179.70 3h3j h LYS 52 N 0.21 0.51 0.00 1.13 1.57 -0.17 0.10 116.57 119.92 3h3j h LYS 52 Ca 0.07 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3h3j h LYS 52 Cb 0.38 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.57 3h3j h LYS 52 CO 0.01 0.34 0.00 0.72 -0.57 0.00 0.00 179.45 179.95 3h3j n HIS 53 N -4.50 0.23 0.03 -1.35 8.25 -0.79 -1.70 115.22 115.40 3h3j n HIS 53 Ca 0.15 0.08 0.01 0.00 -0.26 0.00 0.00 57.72 57.70 3h3j n HIS 53 Cb 0.48 -0.64 -0.08 0.00 1.12 0.00 0.00 29.99 30.88 3h3j n HIS 53 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3h3j n ALA 54 N -1.58 1.97 0.30 -1.41 0.00 0.00 -4.46 120.51 115.34 3h3j n ALA 54 Ca 0.04 -0.53 0.16 0.00 0.00 0.00 0.00 53.44 53.11 3h3j n ALA 54 Cb 0.24 -0.96 0.93 0.00 0.00 0.00 0.00 19.45 19.66 3h3j n ALA 54 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3h3j h THR 55 N 0.00 0.50 0.00 0.00 1.35 -1.13 -1.61 112.91 112.02 3h3j h THR 55 Ca -0.16 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 65.70 3h3j h THR 55 Cb 1.55 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.97 3h3j h THR 55 CO 0.04 0.00 0.00 -0.65 -0.25 0.00 0.00 175.52 174.66 3h3j h PRO 56 N 0.00 0.00 -0.29 4.72 0.11 -1.78 -1.39 132.00 133.37 3h3j h PRO 56 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3h3j h PRO 56 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3h3j h PRO 56 CO 0.00 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.45 3h3j n TYR 57 N -2.59 0.37 -1.96 0.65 4.01 -0.61 -4.98 117.16 112.06 3h3j n TYR 57 Ca -0.00 -0.23 -0.38 0.00 -0.16 0.00 0.00 57.90 57.13 3h3j n TYR 57 Cb 0.16 -0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.20 3h3j n TYR 57 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 3h3j s SER 58 N -1.33 5.69 0.22 7.72 0.01 -0.52 -4.92 113.70 120.57 3h3j s SER 58 Ca 0.31 2.63 -0.08 0.00 1.31 0.00 0.00 55.95 60.11 3h3j s SER 58 Cb 0.18 -2.63 0.31 0.00 0.21 0.00 0.00 66.02 64.10 3h3j s SER 58 CO 0.26 -1.27 1.76 -0.65 0.41 0.00 0.00 173.24 173.75 3h3j h PRO 59 N 1.83 0.50 -4.86 12.44 0.11 -1.82 -3.43 132.00 136.77 3h3j h PRO 59 Ca -0.50 -0.03 -0.32 0.00 0.11 0.00 0.00 66.00 65.26 3h3j h PRO 59 Cb 1.28 -0.11 -0.15 0.00 0.11 0.00 0.00 31.00 32.13 3h3j h PRO 59 CO 0.59 0.33 -0.65 0.95 -0.21 0.00 0.00 178.00 179.02 3h3j s THR 60 N -6.07 0.67 0.10 -1.15 -4.23 -1.26 -5.11 115.64 98.59 3h3j s THR 60 Ca -0.13 -1.99 -0.35 0.00 -1.18 0.00 0.00 61.69 58.04 3h3j s THR 60 Cb 0.18 -2.33 -0.15 0.00 1.34 0.00 0.00 72.50 71.54 3h3j s THR 60 CO 0.75 -0.29 1.49 0.41 -0.54 0.00 0.00 174.62 176.44 3h3j n THR 61 N -0.34 0.03 -4.59 3.99 -1.04 -1.26 -4.82 114.28 106.26 3h3j n THR 61 Ca -0.04 -0.01 -0.28 0.00 -2.04 0.00 0.00 64.05 61.68 3h3j n THR 61 Cb 0.64 -1.21 -0.17 0.00 -1.82 0.00 0.00 70.33 67.77 3h3j n THR 61 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3h3j s VAL 62 N 0.93 1.51 -0.24 12.58 1.01 -1.26 -4.37 120.40 130.55 3h3j s VAL 62 Ca 0.83 -0.66 -0.10 0.00 0.00 0.00 0.00 61.98 62.04 3h3j s VAL 62 Cb -0.82 -1.36 -0.05 0.00 0.00 0.00 0.00 36.38 34.15 3h3j s VAL 62 CO 0.43 0.44 0.14 -0.13 0.00 0.00 0.00 175.10 175.99 3h3j s ARG 63 N 0.84 3.96 -0.09 2.72 1.81 0.49 -4.88 118.95 123.80 3h3j s ARG 63 Ca -0.10 -0.33 0.00 0.00 -1.72 0.00 0.00 55.73 53.59 3h3j s ARG 63 Cb -0.15 -3.49 -0.03 0.00 -0.45 0.00 0.00 34.95 30.83 3h3j s ARG 63 CO 0.01 -0.01 -0.09 0.08 -0.68 0.00 0.00 175.30 174.61 3h3j s VAL 64 N 1.23 3.46 0.04 3.52 1.01 -1.26 -0.56 120.40 127.85 3h3j s VAL 64 Ca 0.07 -0.55 -0.12 0.00 0.00 0.00 0.00 61.98 61.37 3h3j s VAL 64 Cb -0.14 -2.43 0.01 0.00 0.00 0.00 0.00 36.38 33.82 3h3j s VAL 64 CO 0.05 0.56 0.27 -1.59 0.00 0.00 0.00 175.10 174.40 3h3j s LYS 65 N -0.37 0.78 0.25 2.72 -2.85 -0.28 -4.91 119.74 115.09 3h3j s LYS 65 Ca 0.05 -0.56 -0.30 0.00 -1.00 0.00 0.00 55.97 54.16 3h3j s LYS 65 Cb -0.12 0.33 -0.09 0.00 -2.06 0.00 0.00 37.83 35.89 3h3j s LYS 65 CO 0.02 -0.24 1.02 0.00 0.10 0.00 0.00 175.35 176.25 3h3j s ALA 66 N -2.61 3.37 0.32 0.59 0.00 -1.26 -0.53 121.76 121.63 3h3j s ALA 66 Ca -0.05 0.76 0.04 0.00 0.00 0.00 0.00 51.96 52.72 3h3j s ALA 66 Cb -0.01 -3.27 -0.02 0.00 0.00 0.00 0.00 23.12 19.82 3h3j s ALA 66 CO -0.04 0.01 0.16 0.41 0.00 0.00 0.00 175.76 176.30 3h3j n GLY 67 N 1.40 3.29 3.24 0.00 0.00 0.15 -4.76 105.19 108.50 3h3j n GLY 67 Ca -0.01 -2.00 -0.15 0.00 0.00 0.00 0.00 46.02 43.86 3h3j n GLY 67 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3h3j s GLU 68 N -3.23 1.40 0.40 1.61 -1.05 -1.26 -4.63 118.70 111.94 3h3j s GLU 68 Ca 0.22 -1.76 0.14 0.00 -0.15 0.00 0.00 54.97 53.43 3h3j s GLU 68 Cb 0.01 0.29 1.00 0.00 -0.44 0.00 0.00 34.13 34.99 3h3j s GLU 68 CO 0.16 -0.49 1.88 1.88 0.95 0.00 0.00 175.26 179.64 3h3j h TYR 69 N 2.44 0.61 -0.07 4.83 0.05 -1.99 0.12 116.97 122.96 3h3j h TYR 69 Ca -0.32 0.02 0.02 0.00 0.05 0.00 0.00 58.73 58.50 3h3j h TYR 69 Cb 1.24 -0.19 -0.00 0.00 1.01 0.00 0.00 36.73 38.79 3h3j h TYR 69 CO 0.83 0.20 0.11 0.66 -1.05 0.00 0.00 178.16 178.92 3h3j h SER 70 N 0.49 0.00 0.65 3.88 4.64 -1.95 -0.22 113.55 121.04 3h3j h SER 70 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 3h3j h SER 70 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 3h3j h SER 70 CO -0.17 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.26 3h3j n ASP 71 N -3.55 0.25 0.05 4.97 8.00 0.43 -2.66 116.55 124.03 3h3j n ASP 71 Ca -0.01 0.56 0.13 0.00 0.71 0.00 0.00 54.79 56.18 3h3j n ASP 71 Cb 0.20 -0.61 0.50 0.00 -0.02 0.00 0.00 41.12 41.20 3h3j n ASP 71 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h3j h HIS 73 N 0.00 0.69 -0.13 0.00 2.07 -1.66 -0.95 115.15 115.16 3h3j h HIS 73 Ca 0.00 0.04 -0.03 0.00 -2.85 0.00 0.00 60.37 57.53 3h3j h HIS 73 Cb 0.61 -0.17 -0.02 0.00 2.57 0.00 0.00 27.41 30.40 3h3j h HIS 73 CO 0.00 0.06 -0.09 -0.40 -3.07 0.00 0.00 177.93 174.43 3h3j n ASP 74 N -4.97 2.72 -4.77 3.10 5.75 -1.26 -4.15 116.55 112.97 3h3j n ASP 74 Ca 0.19 -3.30 -0.37 0.00 -0.01 0.00 0.00 54.79 51.30 3h3j n ASP 74 Cb 0.54 -0.51 -0.01 0.00 -1.03 0.00 0.00 41.12 40.11 3h3j n ASP 74 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3h3j s ALA 75 N -2.98 2.94 -0.12 2.12 0.00 -0.36 -4.85 121.76 118.51 3h3j s ALA 75 Ca 0.38 0.89 0.09 0.00 0.00 0.00 0.00 51.96 53.32 3h3j s ALA 75 Cb 0.33 -3.37 -0.23 0.00 0.00 0.00 0.00 23.12 19.85 3h3j s ALA 75 CO 0.03 -0.63 0.35 -0.25 0.00 0.00 0.00 175.76 175.26 3h3j n ASP 76 N -0.58 1.00 -3.76 0.00 8.00 -0.44 -4.22 116.55 116.55 3h3j n ASP 76 Ca 0.08 0.20 -0.15 0.00 0.71 0.00 0.00 54.79 55.63 3h3j n ASP 76 Cb 0.49 0.03 -0.16 0.00 -0.02 0.00 0.00 41.12 41.46 3h3j n ASP 76 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3h3j s LEU 77 N -6.15 1.00 -0.21 0.64 2.96 -1.05 -1.53 118.68 114.34 3h3j s LEU 77 Ca -0.13 0.05 -0.04 0.00 -0.22 0.00 0.00 54.13 53.80 3h3j s LEU 77 Cb 0.07 -0.06 -0.01 0.00 0.50 0.00 0.00 46.19 46.69 3h3j s LEU 77 CO 0.79 -0.14 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.95 3h3j s VAL 78 N 1.15 3.49 -0.24 1.68 1.01 0.09 -0.74 120.40 126.84 3h3j s VAL 78 Ca -0.08 -0.46 -0.06 0.00 0.00 0.00 0.00 61.98 61.38 3h3j s VAL 78 Cb -0.13 -2.58 -0.02 0.00 0.00 0.00 0.00 36.38 33.66 3h3j s VAL 78 CO -0.03 0.43 0.03 -0.69 0.00 0.00 0.00 175.10 174.85 3h3j s VAL 79 N 1.25 3.96 -0.29 2.92 1.01 0.15 -0.26 120.40 129.13 3h3j s VAL 79 Ca 0.03 -0.33 -0.06 0.00 0.00 0.00 0.00 61.98 61.62 3h3j s VAL 79 Cb -0.14 -2.86 0.01 0.00 0.00 0.00 0.00 36.38 33.39 3h3j s VAL 79 CO -0.01 0.34 0.06 -0.63 0.00 0.00 0.00 175.10 174.86 3h3j s ILE 80 N 1.56 3.78 -0.13 2.22 1.01 -0.26 -0.39 121.20 128.99 3h3j s ILE 80 Ca 0.06 -0.79 0.17 0.00 0.00 0.00 0.00 60.65 60.09 3h3j s ILE 80 Cb -0.15 -2.96 0.28 0.00 0.01 0.00 0.00 42.46 39.63 3h3j s ILE 80 CO 0.01 0.07 1.14 0.00 0.00 0.00 0.00 174.94 176.17 3h3j s ALA 82 N -2.67 3.41 0.00 0.00 0.00 -0.99 -4.70 121.76 116.82 3h3j s ALA 82 Ca 0.30 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.47 3h3j s ALA 82 Cb 0.27 -2.86 0.00 0.00 0.00 0.00 0.00 23.12 20.53 3h3j s ALA 82 CO 0.02 0.32 0.00 0.41 0.00 0.00 0.00 175.76 176.50 3h3j n GLY 83 N 0.85 0.79 3.78 0.00 0.00 -1.26 -4.73 105.19 104.62 3h3j n GLY 83 Ca -0.03 -2.12 -0.37 0.00 0.00 0.00 0.00 46.02 43.51 3h3j n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3j s ALA 84 N -1.23 3.16 0.35 4.61 0.00 -1.26 -5.06 121.76 122.32 3h3j s ALA 84 Ca 0.00 0.62 0.09 0.00 0.00 0.00 0.00 51.96 52.66 3h3j s ALA 84 Cb 0.00 -3.23 -0.05 0.00 0.00 0.00 0.00 23.12 19.84 3h3j s ALA 84 CO 0.00 -0.02 0.06 -0.98 0.00 0.00 0.00 175.76 174.82 3h3j s ARG 85 N -2.27 2.16 0.41 0.00 1.70 -1.26 -4.71 118.95 114.98 3h3j s ARG 85 Ca 0.54 -1.71 -0.20 0.00 -0.47 0.00 0.00 55.73 53.89 3h3j s ARG 85 Cb -0.20 -1.99 -0.11 0.00 -0.57 0.00 0.00 34.95 32.08 3h3j s ARG 85 CO 0.26 0.11 0.91 1.14 -1.08 0.00 0.00 175.30 176.64 3h3j s GLN 86 N -3.76 4.18 0.43 3.89 -2.07 -1.26 -5.08 119.66 115.99 3h3j s GLN 86 Ca 0.36 1.02 -0.00 0.00 -1.82 0.00 0.00 55.36 54.92 3h3j s GLN 86 Cb -0.00 -2.23 -0.01 0.00 -1.09 0.00 0.00 33.01 29.67 3h3j s GLN 86 CO 0.20 0.00 0.65 0.15 -1.32 0.00 0.00 175.29 174.98 3h3j s LYS 87 N -3.16 3.19 0.18 9.60 1.02 -1.26 -4.97 119.74 124.34 3h3j s LYS 87 Ca 0.60 -0.41 -0.33 0.00 0.02 0.00 0.00 55.97 55.86 3h3j s LYS 87 Cb -0.09 -2.57 -0.15 0.00 -0.52 0.00 0.00 37.83 34.50 3h3j s LYS 87 CO 0.14 -0.17 1.32 -2.30 -0.92 0.00 0.00 175.35 173.42 3h3j n PRO 88 N -2.03 1.56 -0.62 -1.68 -0.02 -1.26 -1.02 135.00 129.93 3h3j n PRO 88 Ca -0.00 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 3h3j n PRO 88 Cb 0.57 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 3h3j n PRO 88 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h3j n GLY 89 N 2.32 0.77 3.61 -1.23 0.00 -1.26 -5.06 105.19 104.33 3h3j n GLY 89 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 3h3j n GLY 89 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h3j s GLU 90 N -0.38 2.24 0.35 1.61 2.02 -0.19 -5.14 118.70 119.20 3h3j s GLU 90 Ca 0.00 -0.99 0.07 0.00 0.02 0.00 0.00 54.97 54.07 3h3j s GLU 90 Cb 0.00 -2.36 -0.01 0.00 0.10 0.00 0.00 34.13 31.86 3h3j s GLU 90 CO 0.00 0.51 0.48 0.95 0.02 0.00 0.00 175.26 177.22 3h3j s THR 91 N -1.28 3.90 0.28 3.63 -4.23 -1.26 -4.77 115.64 111.92 3h3j s THR 91 Ca 0.23 -1.00 -0.01 0.00 -1.18 0.00 0.00 61.69 59.73 3h3j s THR 91 Cb -0.11 -3.34 0.14 0.00 1.34 0.00 0.00 72.50 70.52 3h3j s THR 91 CO 0.15 -0.13 1.81 0.03 -0.54 0.00 0.00 174.62 175.93 3h3j h ARG 92 N 0.86 0.76 0.00 3.99 3.08 -1.98 -2.18 114.38 118.91 3h3j h ARG 92 Ca -0.45 -0.18 -0.00 0.00 0.07 0.00 0.00 59.98 59.42 3h3j h ARG 92 Cb 1.26 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 31.21 3h3j h ARG 92 CO 0.52 0.74 -0.02 -0.07 -1.07 0.00 0.00 179.97 180.07 3h3j h LEU 93 N 0.73 0.00 0.00 3.04 3.38 -1.95 -2.02 115.31 118.49 3h3j h LEU 93 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3h3j h LEU 93 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 3h3j h LEU 93 CO 0.01 0.02 0.00 0.47 0.09 0.00 0.00 178.44 179.02 3h3j n ASP 94 N -3.13 0.00 -0.09 -0.43 10.43 -0.82 -2.54 116.55 119.97 3h3j n ASP 94 Ca -0.00 -0.21 0.02 0.00 2.57 0.00 0.00 54.79 57.16 3h3j n ASP 94 Cb 0.25 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.21 3h3j n ASP 94 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 3h3j n LEU 95 N -0.93 0.85 -0.22 0.64 4.77 -0.76 -4.78 117.00 116.57 3h3j n LEU 95 Ca 0.04 -0.80 -0.02 0.00 -0.03 0.00 0.00 56.01 55.20 3h3j n LEU 95 Cb 0.02 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.19 3h3j n LEU 95 CO 0.03 0.19 1.08 -0.37 -1.33 0.00 0.00 177.39 176.99 3h3j h VAL 96 N 0.45 0.98 0.72 4.08 -1.51 -1.66 -1.99 116.25 117.32 3h3j h VAL 96 Ca 0.00 -0.23 -0.03 0.00 -1.23 0.00 0.00 66.70 65.21 3h3j h VAL 96 Cb 0.13 0.26 -0.00 0.00 -2.13 0.00 0.00 31.29 29.55 3h3j h VAL 96 CO 0.00 0.12 -0.43 0.28 -1.23 0.00 0.00 177.57 176.31 3h3j h SER 97 N 0.66 -1.09 -0.70 4.19 0.02 -1.86 0.58 113.55 115.34 3h3j h SER 97 Ca 0.28 0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 61.26 3h3j h SER 97 Cb 0.15 0.32 -0.03 0.00 0.14 0.00 0.00 62.40 62.98 3h3j h SER 97 CO -0.17 -0.68 0.32 0.07 -1.14 0.00 0.00 176.83 175.24 3h3j h LYS 98 N -1.08 1.03 -0.00 3.45 2.10 -1.86 -2.71 116.57 117.49 3h3j h LYS 98 Ca -0.09 -0.16 -0.16 0.00 -2.00 0.00 0.00 60.65 58.24 3h3j h LYS 98 Cb 0.87 -0.18 -0.02 0.00 -0.90 0.00 0.00 32.23 32.00 3h3j h LYS 98 CO 0.10 0.82 -0.75 -0.91 -2.00 0.00 0.00 179.45 176.71 3h3j h ASN 99 N 0.99 0.02 -0.48 7.07 -0.26 -1.23 -2.05 115.58 119.64 3h3j h ASN 99 Ca 0.24 -0.01 -0.04 0.00 -0.56 0.00 0.00 56.30 55.93 3h3j h ASN 99 Cb 0.15 -0.01 -0.03 0.00 -1.06 0.00 0.00 38.32 37.38 3h3j h ASN 99 CO -0.03 0.76 0.18 -0.07 -1.06 0.00 0.00 177.43 177.21 3h3j h LEU 100 N 0.01 0.72 0.08 1.61 3.38 -0.83 -0.02 115.31 120.25 3h3j h LEU 100 Ca -0.01 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 57.86 3h3j h LEU 100 Cb 1.32 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 3h3j h LEU 100 CO 0.10 0.68 -0.09 0.11 0.09 0.00 0.00 178.44 179.32 3h3j h LYS 101 N 0.77 -0.19 -0.49 1.13 1.57 -1.09 -2.01 116.57 116.26 3h3j h LYS 101 Ca 0.18 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.96 3h3j h LYS 101 Cb 0.21 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 3h3j h LYS 101 CO -0.01 -0.13 0.25 0.82 -0.57 0.00 0.00 179.45 179.81 3h3j h ILE 102 N -0.20 1.18 -0.13 1.86 2.04 -1.09 -2.82 117.51 118.35 3h3j h ILE 102 Ca 0.01 -0.50 -0.04 0.00 1.00 0.00 0.00 64.86 65.32 3h3j h ILE 102 Cb 0.20 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 3h3j h ILE 102 CO -0.04 0.20 -0.12 -0.26 0.00 0.00 0.00 178.15 177.93 3h3j h PHE 103 N 0.65 0.21 -0.52 1.37 -1.00 -0.93 -0.19 116.94 116.53 3h3j h PHE 103 Ca 0.17 -0.02 0.04 0.00 2.81 0.00 0.00 57.97 60.97 3h3j h PHE 103 Cb 0.10 -0.06 -0.04 0.00 3.61 0.00 0.00 35.95 39.55 3h3j h PHE 103 CO -0.01 0.33 0.27 -0.22 -1.61 0.00 0.00 178.31 177.07 3h3j h LYS 104 N 0.19 0.51 0.28 1.51 1.63 -1.10 0.26 116.57 119.86 3h3j h LYS 104 Ca 0.04 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.80 3h3j h LYS 104 Cb 0.34 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.86 3h3j h LYS 104 CO 0.02 0.34 -0.14 1.03 -3.45 0.00 0.00 179.45 177.25 3h3j h SER 105 N 0.53 -0.32 0.32 4.20 0.87 -1.35 -2.80 113.55 114.99 3h3j h SER 105 Ca 0.23 -0.21 -0.01 0.00 -1.23 0.00 0.00 61.79 60.57 3h3j h SER 105 Cb 0.12 0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 3h3j h SER 105 CO -0.15 0.09 -0.22 0.40 -0.53 0.00 0.00 176.83 176.43 3h3j h ILE 106 N -0.80 0.54 -0.08 2.23 2.04 -0.93 -1.04 117.51 119.48 3h3j h ILE 106 Ca -0.04 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.80 3h3j h ILE 106 Cb 0.51 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 3h3j h ILE 106 CO 0.06 0.00 -0.06 0.58 0.00 0.00 0.00 178.15 178.73 3h3j h VAL 107 N -0.52 1.10 -0.23 1.67 2.07 -1.07 -1.18 116.25 118.09 3h3j h VAL 107 Ca -0.03 -0.40 -0.03 0.00 0.82 0.00 0.00 66.70 67.05 3h3j h VAL 107 Cb 0.45 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 3h3j h VAL 107 CO 0.01 0.13 0.01 1.23 0.02 0.00 0.00 177.57 178.98 3h3j h GLY 108 N 0.41 0.42 1.15 2.17 0.00 -1.14 -1.09 103.07 104.98 3h3j h GLY 108 Ca 0.03 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 3h3j h GLY 108 CO 0.01 0.28 0.52 0.83 0.00 0.00 0.00 176.54 178.18 3h3j h GLU 109 N 0.17 1.13 -0.08 4.80 4.39 -0.51 -2.13 114.58 122.35 3h3j h GLU 109 Ca 0.07 -0.09 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 3h3j h GLU 109 Cb 0.37 -0.24 -0.00 0.00 -0.10 0.00 0.00 28.75 28.78 3h3j h GLU 109 CO 0.01 0.78 -0.00 0.28 -1.16 0.00 0.00 179.01 178.92 3h3j h VAL 110 N 1.16 1.26 0.00 3.13 2.07 -1.08 -3.08 116.25 119.70 3h3j h VAL 110 Ca 0.30 -0.81 -0.04 0.00 0.82 0.00 0.00 66.70 66.97 3h3j h VAL 110 Cb -0.07 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 3h3j h VAL 110 CO -0.06 0.23 -0.21 0.24 0.02 0.00 0.00 177.57 177.79 3h3j h MET 111 N -0.14 0.00 0.00 1.57 2.86 -1.05 -1.83 114.93 116.33 3h3j h MET 111 Ca 0.02 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.62 3h3j h MET 111 Cb 0.35 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 3h3j h MET 111 CO 0.00 0.21 -0.19 0.00 1.06 0.00 0.00 176.91 177.99 3h3j h ALA 112 N 1.79 1.18 0.00 6.32 0.00 -1.30 -1.02 119.26 126.23 3h3j h ALA 112 Ca -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3h3j h ALA 112 Cb 0.40 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3h3j h ALA 112 CO 0.03 0.24 0.00 -1.13 0.00 0.00 0.00 179.25 178.39 3h3j n SER 113 N -3.58 0.00 0.00 0.00 3.41 -0.69 -4.88 113.62 107.89 3h3j n SER 113 Ca -0.01 0.27 0.00 0.00 -0.26 0.00 0.00 58.87 58.86 3h3j n SER 113 Cb 0.33 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 63.87 3h3j n SER 113 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3h3j n LYS 114 N -1.42 0.00 -1.55 4.33 5.02 -0.39 -4.15 118.16 120.00 3h3j n LYS 114 Ca 0.09 0.28 -0.47 0.00 -2.02 0.00 0.00 58.31 56.19 3h3j n LYS 114 Cb 0.29 -2.81 -0.03 0.00 -0.02 0.00 0.00 35.03 32.46 3h3j n LYS 114 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3h3j n PHE 115 N -2.75 0.96 -2.68 2.13 7.35 -1.22 -4.84 117.46 116.41 3h3j n PHE 115 Ca 0.00 0.75 -0.08 0.00 -0.76 0.00 0.00 57.45 57.36 3h3j n PHE 115 Cb 0.00 -2.21 0.07 0.00 0.35 0.00 0.00 39.48 37.69 3h3j n PHE 115 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 3h3j n ASP 116 N 1.60 0.09 0.00 -2.13 2.03 -1.26 -4.87 116.55 112.00 3h3j n ASP 116 Ca 0.13 -2.58 0.00 0.00 0.52 0.00 0.00 54.79 52.86 3h3j n ASP 116 Cb 0.28 0.10 0.00 0.00 -0.72 0.00 0.00 41.12 40.78 3h3j n ASP 116 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3h3j n GLY 117 N -0.32 3.41 3.37 0.27 0.00 -1.26 -5.03 105.19 105.63 3h3j n GLY 117 Ca 0.04 -1.03 -0.31 0.00 0.00 0.00 0.00 46.02 44.71 3h3j n GLY 117 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h3j s ILE 118 N 4.15 2.36 -0.13 -0.61 1.01 -0.58 -4.91 121.20 122.48 3h3j s ILE 118 Ca 0.00 -1.12 -0.07 0.00 0.00 0.00 0.00 60.65 59.46 3h3j s ILE 118 Cb 0.00 -1.89 -0.04 0.00 0.01 0.00 0.00 42.46 40.54 3h3j s ILE 118 CO 0.00 0.49 0.11 -0.36 0.00 0.00 0.00 174.94 175.18 3h3j s PHE 119 N -0.72 3.46 -0.15 3.97 0.08 0.07 -0.73 117.98 123.95 3h3j s PHE 119 Ca 0.11 0.40 0.00 0.00 0.12 0.00 0.00 56.93 57.56 3h3j s PHE 119 Cb -0.10 -1.96 0.03 0.00 -0.57 0.00 0.00 43.02 40.42 3h3j s PHE 119 CO 0.01 0.57 -0.11 -1.17 -0.10 0.00 0.00 175.22 174.42 3h3j s LEU 120 N -0.68 1.70 -0.08 -0.37 2.96 0.64 -1.36 118.68 121.50 3h3j s LEU 120 Ca 0.13 -0.55 0.01 0.00 -0.22 0.00 0.00 54.13 53.50 3h3j s LEU 120 Cb -0.12 -1.11 -0.03 0.00 0.50 0.00 0.00 46.19 45.44 3h3j s LEU 120 CO 0.02 -0.10 -0.10 0.68 -1.32 0.00 0.00 176.35 175.54 3h3j s VAL 121 N 1.52 3.42 -0.01 1.68 -7.23 -0.11 -1.10 120.40 118.57 3h3j s VAL 121 Ca 0.03 -0.58 0.03 0.00 -1.81 0.00 0.00 61.98 59.66 3h3j s VAL 121 Cb -0.14 -2.39 -0.05 0.00 0.56 0.00 0.00 36.38 34.36 3h3j s VAL 121 CO -0.10 0.58 0.06 0.00 -0.31 0.00 0.00 175.10 175.34 3h3j n ALA 122 N 2.51 2.08 -1.66 1.32 0.00 -0.26 -1.42 120.51 123.08 3h3j n ALA 122 Ca -0.18 -0.12 -0.43 0.00 0.00 0.00 0.00 53.44 52.71 3h3j n ALA 122 Cb 0.53 -0.05 -0.01 0.00 0.00 0.00 0.00 19.45 19.92 3h3j n ALA 122 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3h3j n THR 123 N -1.76 2.08 -3.31 0.00 -1.04 -1.16 -4.66 114.28 104.43 3h3j n THR 123 Ca -0.02 -0.50 -0.31 0.00 -2.04 0.00 0.00 64.05 61.18 3h3j n THR 123 Cb 0.23 -1.36 -0.05 0.00 -1.82 0.00 0.00 70.33 67.33 3h3j n THR 123 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 3h3j s ASN 124 N -0.44 6.61 -0.14 8.00 0.01 -1.26 -2.71 114.94 125.01 3h3j s ASN 124 Ca 0.57 0.96 -0.29 0.00 -0.71 0.00 0.00 52.86 53.39 3h3j s ASN 124 Cb -0.60 -2.24 -0.01 0.00 0.41 0.00 0.00 41.25 38.80 3h3j s ASN 124 CO 0.61 -0.14 1.10 -2.16 -1.51 0.00 0.00 177.10 175.00 3h3j s PRO 125 N -3.04 4.33 0.30 -0.60 0.04 -1.24 -4.72 135.00 130.07 3h3j s PRO 125 Ca 0.48 1.49 0.02 0.00 0.04 0.00 0.00 61.00 63.03 3h3j s PRO 125 Cb -0.11 -3.61 0.49 0.00 0.04 0.00 0.00 34.50 31.31 3h3j s PRO 125 CO 0.23 -0.50 1.84 -0.24 0.04 0.00 0.00 177.00 178.36 3h3j h VAL 126 N 5.25 1.21 -0.51 -0.36 3.04 -1.78 -1.13 116.25 121.98 3h3j h VAL 126 Ca -0.27 -0.84 -0.06 0.00 -1.01 0.00 0.00 66.70 64.52 3h3j h VAL 126 Cb 1.12 0.86 -0.02 0.00 -2.01 0.00 0.00 31.29 31.24 3h3j h VAL 126 CO 0.92 0.30 0.09 0.44 -1.01 0.00 0.00 177.57 178.30 3h3j h ASP 127 N 0.63 0.80 -0.19 3.17 3.32 -1.87 0.28 116.42 122.56 3h3j h ASP 127 Ca 0.13 -0.26 -0.19 0.00 0.02 0.00 0.00 57.03 56.74 3h3j h ASP 127 Cb 0.35 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.69 3h3j h ASP 127 CO 0.01 0.85 -0.60 0.40 -1.72 0.00 0.00 179.24 178.18 3h3j h ILE 128 N 0.71 1.28 -0.29 0.35 2.04 -1.75 -1.34 117.51 118.52 3h3j h ILE 128 Ca 0.15 -1.80 -0.08 0.00 1.00 0.00 0.00 64.86 64.13 3h3j h ILE 128 Cb 0.39 1.73 -0.02 0.00 -0.74 0.00 0.00 36.82 38.18 3h3j h ILE 128 CO 0.01 0.58 -0.16 -0.07 0.00 0.00 0.00 178.15 178.51 3h3j h LEU 129 N 0.60 0.49 -0.40 1.44 3.38 -1.17 0.10 115.31 119.75 3h3j h LEU 129 Ca -0.00 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 3h3j h LEU 129 Cb 1.20 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 3h3j h LEU 129 CO 0.13 0.67 -0.12 0.00 0.09 0.00 0.00 178.44 179.20 3h3j h ALA 130 N 1.38 0.56 -0.46 1.53 0.00 -0.84 -0.27 119.26 121.16 3h3j h ALA 130 Ca 0.08 -0.33 0.03 0.00 0.00 0.00 0.00 54.91 54.69 3h3j h ALA 130 Cb 0.54 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 3h3j h ALA 130 CO 0.03 0.46 0.25 -0.92 0.00 0.00 0.00 179.25 179.07 3h3j h TYR 131 N 0.61 0.47 -0.80 0.00 3.20 -0.83 -0.78 116.97 118.84 3h3j h TYR 131 Ca 0.10 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 3h3j h TYR 131 Cb 0.66 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.75 3h3j h TYR 131 CO 0.05 0.25 0.46 0.00 -1.64 0.00 0.00 178.16 177.28 3h3j h ALA 132 N 1.23 1.31 -0.65 1.82 0.00 -0.58 -0.09 119.26 122.30 3h3j h ALA 132 Ca 0.19 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 3h3j h ALA 132 Cb 0.06 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3h3j h ALA 132 CO -0.11 0.58 0.06 1.15 0.00 0.00 0.00 179.25 180.93 3h3j h THR 133 N 1.11 1.27 0.21 0.00 2.02 -0.53 0.57 112.91 117.56 3h3j h THR 133 Ca 0.28 -1.09 -0.01 0.00 0.77 0.00 0.00 66.41 66.36 3h3j h THR 133 Cb -0.01 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.10 3h3j h THR 133 CO -0.05 0.40 -0.10 -0.25 0.37 0.00 0.00 175.52 175.89 3h3j h TRP 134 N 1.01 -0.27 0.24 3.16 7.01 -0.53 -0.67 115.95 125.91 3h3j h TRP 134 Ca 0.19 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.17 3h3j h TRP 134 Cb 0.49 0.09 0.00 0.00 -2.10 0.00 0.00 29.16 27.64 3h3j h TRP 134 CO 0.04 -0.12 -0.12 0.87 -2.79 0.00 0.00 178.44 176.32 3h3j h LYS 135 N -0.34 -0.31 -0.95 2.65 1.79 -0.76 -2.35 116.57 116.29 3h3j h LYS 135 Ca -0.03 0.02 0.07 0.00 -2.18 0.00 0.00 60.65 58.54 3h3j h LYS 135 Cb 0.26 0.07 -0.07 0.00 -1.58 0.00 0.00 32.23 30.92 3h3j h LYS 135 CO 0.05 -0.11 0.62 0.74 -1.08 0.00 0.00 179.45 179.66 3h3j h PHE 136 N -0.46 1.11 0.02 -1.35 0.04 0.11 -3.18 116.94 113.23 3h3j h PHE 136 Ca -0.03 0.03 -0.24 0.00 2.80 0.00 0.00 57.97 60.53 3h3j h PHE 136 Cb 0.34 -0.36 -0.03 0.00 2.20 0.00 0.00 35.95 38.10 3h3j h PHE 136 CO -0.02 0.56 -1.17 0.66 -0.60 0.00 0.00 178.31 177.73 3h3j h SER 137 N 1.07 0.07 0.00 2.17 4.64 -1.00 -3.48 113.55 117.02 3h3j h SER 137 Ca 0.42 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 3h3j h SER 137 Cb 0.24 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 3h3j h SER 137 CO -0.17 1.07 0.00 0.61 -0.87 0.00 0.00 176.83 177.47 3h3j n GLY 138 N 1.42 0.96 3.81 -0.77 0.00 -0.90 -5.03 105.19 104.68 3h3j n GLY 138 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 3h3j n GLY 138 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h3j s LEU 139 N 0.00 3.58 0.66 0.99 1.43 -1.26 -5.02 118.68 119.06 3h3j s LEU 139 Ca 0.00 1.79 -0.17 0.00 -1.03 0.00 0.00 54.13 54.71 3h3j s LEU 139 Cb 0.00 -4.53 -0.02 0.00 0.03 0.00 0.00 46.19 41.66 3h3j s LEU 139 CO 0.00 -0.99 0.99 -2.65 0.23 0.00 0.00 176.35 173.93 3h3j n PRO 140 N -1.76 0.75 0.18 1.29 -0.02 -1.26 -4.88 135.00 129.29 3h3j n PRO 140 Ca 0.08 0.30 0.05 0.00 -2.02 0.00 0.00 63.50 61.92 3h3j n PRO 140 Cb 0.53 -2.22 0.49 0.00 -0.02 0.00 0.00 33.50 32.29 3h3j n PRO 140 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 3h3j h LYS 141 N 0.17 0.13 -0.08 -0.52 2.10 -1.95 -1.69 116.57 114.73 3h3j h LYS 141 Ca -0.48 -0.02 0.02 0.00 -2.00 0.00 0.00 60.65 58.17 3h3j h LYS 141 Cb 1.35 -0.02 -0.00 0.00 -0.90 0.00 0.00 32.23 32.65 3h3j h LYS 141 CO 0.49 0.21 0.09 0.93 -2.00 0.00 0.00 179.45 179.18 3h3j h GLU 142 N 0.13 0.00 -0.51 0.07 3.07 -1.90 -2.64 114.58 112.79 3h3j h GLU 142 Ca 0.03 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.89 3h3j h GLU 142 Cb 0.21 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.12 3h3j h GLU 142 CO 0.01 0.00 0.00 0.54 -1.40 0.00 0.00 179.01 178.16 3h3j n ARG 143 N -3.88 3.08 -3.89 2.33 1.74 -0.64 -0.07 116.66 115.33 3h3j n ARG 143 Ca -0.01 -2.52 -0.28 0.00 -0.77 0.00 0.00 57.85 54.27 3h3j n ARG 143 Cb 0.19 -1.57 -0.17 0.00 -1.02 0.00 0.00 32.46 29.89 3h3j n ARG 143 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3h3j s VAL 144 N -1.43 1.08 -0.03 1.55 1.01 -1.00 -0.75 120.40 120.83 3h3j s VAL 144 Ca 0.39 -0.55 0.06 0.00 0.00 0.00 0.00 61.98 61.88 3h3j s VAL 144 Cb 0.23 -1.23 -0.01 0.00 0.00 0.00 0.00 36.38 35.37 3h3j s VAL 144 CO 0.22 0.18 -0.21 -0.63 0.00 0.00 0.00 175.10 174.66 3h3j s ILE 145 N 1.65 1.66 0.04 2.22 1.01 -0.46 -4.77 121.20 122.55 3h3j s ILE 145 Ca 0.02 -0.88 0.01 0.00 0.00 0.00 0.00 60.65 59.80 3h3j s ILE 145 Cb -0.15 -1.39 -0.04 0.00 0.01 0.00 0.00 42.46 40.90 3h3j s ILE 145 CO -0.08 0.47 0.11 -0.83 0.00 0.00 0.00 174.94 174.61 3h3j s GLY 146 N -0.34 2.06 0.30 6.18 0.00 -0.59 -0.94 107.32 113.99 3h3j s GLY 146 Ca 0.04 -0.92 -0.01 0.00 0.00 0.00 0.00 44.72 43.83 3h3j s GLY 146 CO 0.00 -0.85 1.93 1.48 0.00 0.00 0.00 173.10 175.66 3h3j h SER 147 N 3.61 0.88 0.00 1.64 4.64 -1.55 0.54 113.55 123.30 3h3j h SER 147 Ca -0.47 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.78 3h3j h SER 147 Cb 1.17 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 3h3j h SER 147 CO 0.66 0.70 0.00 0.61 -0.87 0.00 0.00 176.83 177.93 3h3j n GLY 148 N -1.25 3.23 0.95 -0.77 0.00 -1.26 -2.00 105.19 104.09 3h3j n GLY 148 Ca 0.07 -0.16 0.04 0.00 0.00 0.00 0.00 46.02 45.97 3h3j n GLY 148 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3h3j n THR 149 N 0.00 0.96 -0.32 2.61 -2.24 -1.26 -4.04 114.28 109.99 3h3j n THR 149 Ca 0.00 -0.55 0.13 0.00 -2.27 0.00 0.00 64.05 61.36 3h3j n THR 149 Cb 0.00 -0.22 0.35 0.00 -2.10 0.00 0.00 70.33 68.36 3h3j n THR 149 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 3h3j h ILE 150 N 1.76 0.77 0.19 2.28 6.09 -0.58 0.19 117.51 128.21 3h3j h ILE 150 Ca 0.00 -0.25 -0.30 0.00 -1.37 0.00 0.00 64.86 62.93 3h3j h ILE 150 Cb 0.93 -0.03 0.02 0.00 0.47 0.00 0.00 36.82 38.20 3h3j h ILE 150 CO 0.15 0.13 -1.43 0.25 -3.07 0.00 0.00 178.15 174.18 3h3j h LEU 151 N 0.74 0.63 -0.64 2.19 5.85 -1.81 -2.95 115.31 119.32 3h3j h LEU 151 Ca 0.52 -0.92 -0.00 0.00 0.84 0.00 0.00 57.88 58.32 3h3j h LEU 151 Cb 0.83 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 3h3j h LEU 151 CO -0.29 1.66 0.39 0.44 -0.34 0.00 0.00 178.44 180.30 3h3j h ASP 152 N -0.04 0.77 -0.67 1.25 3.32 -1.68 0.06 116.42 119.42 3h3j h ASP 152 Ca -0.27 -0.06 0.01 0.00 0.02 0.00 0.00 57.03 56.73 3h3j h ASP 152 Cb 1.98 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 41.30 3h3j h ASP 152 CO 0.18 0.61 0.44 0.28 -1.72 0.00 0.00 179.24 179.03 3h3j h SER 153 N 0.87 0.76 -0.78 6.45 0.02 -0.75 -0.71 113.55 119.41 3h3j h SER 153 Ca 0.23 -0.02 0.01 0.00 -0.84 0.00 0.00 61.79 61.17 3h3j h SER 153 Cb -0.02 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 62.29 3h3j h SER 153 CO -0.04 0.54 0.51 0.00 -1.14 0.00 0.00 176.83 176.70 3h3j h ALA 154 N 1.25 0.99 -0.53 3.77 0.00 -1.23 -0.41 119.26 123.10 3h3j h ALA 154 Ca 0.25 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 3h3j h ALA 154 Cb -0.08 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.37 3h3j h ALA 154 CO -0.06 0.41 0.10 0.00 0.00 0.00 0.00 179.25 179.70 3h3j h ARG 155 N 1.06 0.87 -0.19 0.00 3.08 -0.37 0.14 114.38 118.97 3h3j h ARG 155 Ca 0.28 -0.22 0.00 0.00 0.07 0.00 0.00 59.98 60.11 3h3j h ARG 155 Cb -0.11 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.82 3h3j h ARG 155 CO -0.06 0.84 0.12 0.35 -1.07 0.00 0.00 179.97 180.15 3h3j h PHE 156 N 0.75 0.24 -0.65 3.04 3.57 -1.00 0.17 116.94 123.06 3h3j h PHE 156 Ca 0.16 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.66 3h3j h PHE 156 Cb 0.38 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 3h3j h PHE 156 CO 0.03 0.16 0.38 0.00 -2.23 0.00 0.00 178.31 176.65 3h3j h ARG 157 N 0.25 0.89 0.12 1.11 3.08 -0.85 -1.16 114.38 117.83 3h3j h ARG 157 Ca 0.07 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 3h3j h ARG 157 Cb -0.02 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 29.85 3h3j h ARG 157 CO -0.01 0.65 -0.06 1.25 -1.07 0.00 0.00 179.97 180.73 3h3j h LEU 158 N 0.89 -0.14 -1.06 3.04 7.12 -0.27 0.78 115.31 125.66 3h3j h LEU 158 Ca 0.23 -0.03 -0.00 0.00 0.13 0.00 0.00 57.88 58.21 3h3j h LEU 158 Cb -0.00 0.04 -0.04 0.00 -0.53 0.00 0.00 40.66 40.12 3h3j h LEU 158 CO -0.04 -0.07 0.51 -0.07 -0.13 0.00 0.00 178.44 178.65 3h3j h LEU 159 N -0.20 1.02 -0.76 2.25 3.38 -0.49 -2.23 115.31 118.28 3h3j h LEU 159 Ca -0.02 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 3h3j h LEU 159 Cb 0.16 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3h3j h LEU 159 CO 0.03 0.79 0.06 -0.07 0.09 0.00 0.00 178.44 179.33 3h3j h LEU 160 N 1.18 0.96 -1.59 1.67 3.38 -1.06 -1.40 115.31 118.45 3h3j h LEU 160 Ca 0.31 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 3h3j h LEU 160 Cb -0.05 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 3h3j h LEU 160 CO -0.06 0.98 -0.10 0.77 0.09 0.00 0.00 178.44 180.12 3h3j h SER 161 N 0.93 0.12 0.05 -0.43 4.64 -0.31 0.79 113.55 119.34 3h3j h SER 161 Ca 0.18 -0.02 -0.24 0.00 -0.47 0.00 0.00 61.79 61.24 3h3j h SER 161 Cb 0.46 -0.03 0.02 0.00 -0.31 0.00 0.00 62.40 62.54 3h3j h SER 161 CO 0.02 0.25 -0.96 -0.33 -0.87 0.00 0.00 176.83 174.93 3h3j h GLU 162 N 0.13 0.56 -0.01 4.77 5.08 -1.13 0.14 114.58 124.11 3h3j h GLU 162 Ca 0.03 -0.67 -0.07 0.00 -1.00 0.00 0.00 59.36 57.65 3h3j h GLU 162 Cb 0.27 0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 3h3j h GLU 162 CO 0.02 1.27 -0.31 0.00 -1.00 0.00 0.00 179.01 178.99 3h3j h ALA 163 N 0.31 1.46 -0.01 3.43 0.00 -0.78 -3.15 119.26 120.52 3h3j h ALA 163 Ca -0.14 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.48 3h3j h ALA 163 Cb 1.65 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.39 3h3j h ALA 163 CO 0.19 0.40 -0.09 1.19 0.00 0.00 0.00 179.25 180.94 3h3j n PHE 164 N -4.16 0.00 -3.48 0.00 3.72 0.23 -5.03 117.46 108.73 3h3j n PHE 164 Ca -0.02 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.17 3h3j n PHE 164 Cb 0.36 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.96 3h3j n PHE 164 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3h3j n ASP 165 N 0.26 -4.35 -4.21 4.37 2.03 0.44 -5.03 116.55 110.07 3h3j n ASP 165 Ca 0.06 -0.79 -0.12 0.00 0.52 0.00 0.00 54.79 54.45 3h3j n ASP 165 Cb 0.25 -4.51 -0.10 0.00 -0.72 0.00 0.00 41.12 36.04 3h3j n ASP 165 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3h3j s VAL 166 N -3.47 0.15 0.34 5.18 -7.23 -0.86 -5.05 120.40 109.45 3h3j s VAL 166 Ca 0.29 -1.98 -0.28 0.00 -1.81 0.00 0.00 61.98 58.20 3h3j s VAL 166 Cb -0.06 -2.38 -0.12 0.00 0.56 0.00 0.00 36.38 34.37 3h3j s VAL 166 CO 0.78 -0.14 1.32 0.00 -0.31 0.00 0.00 175.10 176.75 3h3j n ALA 167 N -0.25 1.42 -0.30 1.32 0.00 -1.26 -4.66 120.51 116.78 3h3j n ALA 167 Ca -0.01 0.36 0.09 0.00 0.00 0.00 0.00 53.44 53.89 3h3j n ALA 167 Cb 0.65 -2.28 0.31 0.00 0.00 0.00 0.00 19.45 18.14 3h3j n ALA 167 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3h3j h PRO 168 N 2.72 0.82 0.00 0.00 0.11 -1.92 -0.63 132.00 133.10 3h3j h PRO 168 Ca -0.46 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3h3j h PRO 168 Cb 1.28 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3h3j h PRO 168 CO 0.64 0.54 0.00 0.54 -0.21 0.00 0.00 178.00 179.51 3h3j n ARG 169 N -4.57 0.09 -0.06 1.05 1.74 -1.26 -1.38 116.66 112.27 3h3j n ARG 169 Ca 0.17 0.52 0.12 0.00 -0.77 0.00 0.00 57.85 57.89 3h3j n ARG 169 Cb 0.39 -1.76 0.17 0.00 -1.02 0.00 0.00 32.46 30.24 3h3j n ARG 169 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3h3j n SER 170 N -1.94 3.00 -4.50 0.55 7.64 -0.25 -4.82 113.62 113.30 3h3j n SER 170 Ca 0.00 -1.96 -0.39 0.00 1.01 0.00 0.00 58.87 57.54 3h3j n SER 170 Cb 0.07 -0.08 -0.11 0.00 -1.01 0.00 0.00 64.21 63.08 3h3j n SER 170 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3h3j s VAL 171 N -1.84 4.95 -0.45 0.44 1.01 -0.48 -4.27 120.40 119.76 3h3j s VAL 171 Ca 0.32 -0.21 -0.16 0.00 0.00 0.00 0.00 61.98 61.94 3h3j s VAL 171 Cb 0.21 -3.48 0.05 0.00 0.00 0.00 0.00 36.38 33.16 3h3j s VAL 171 CO 0.31 0.10 0.38 -0.62 0.00 0.00 0.00 175.10 175.27 3h3j s ASP 172 N 1.68 6.14 -0.01 3.32 2.15 -0.57 -4.97 116.67 124.40 3h3j s ASP 172 Ca 0.06 -1.16 -0.18 0.00 0.43 0.00 0.00 52.55 51.70 3h3j s ASP 172 Cb -0.17 -2.18 0.03 0.00 -0.30 0.00 0.00 42.92 40.30 3h3j s ASP 172 CO 0.08 -0.60 0.39 0.00 -0.17 0.00 0.00 175.17 174.88 3h3j s ALA 173 N 1.71 -0.99 0.01 3.66 0.00 -1.26 -1.63 121.76 123.27 3h3j s ALA 173 Ca 0.05 0.49 0.01 0.00 0.00 0.00 0.00 51.96 52.51 3h3j s ALA 173 Cb -0.22 0.11 -0.01 0.00 0.00 0.00 0.00 23.12 23.00 3h3j s ALA 173 CO 0.08 -0.31 -0.04 -0.65 0.00 0.00 0.00 175.76 174.83 3h3j s GLN 174 N -1.52 0.34 -0.11 0.00 -0.21 -1.26 -4.72 119.66 112.18 3h3j s GLN 174 Ca -0.12 -0.36 -0.00 0.00 0.02 0.00 0.00 55.36 54.90 3h3j s GLN 174 Cb -0.03 -0.21 -0.02 0.00 1.00 0.00 0.00 33.01 33.75 3h3j s GLN 174 CO 0.04 0.05 -0.09 0.42 -2.12 0.00 0.00 175.29 173.59 3h3j s ILE 175 N -0.63 3.46 0.39 1.08 -1.09 -1.26 -1.77 121.20 121.38 3h3j s ILE 175 Ca -0.04 -0.54 0.04 0.00 -2.23 0.00 0.00 60.65 57.87 3h3j s ILE 175 Cb -0.05 -2.45 -0.04 0.00 -1.58 0.00 0.00 42.46 38.34 3h3j s ILE 175 CO -0.00 0.55 0.07 0.27 -1.23 0.00 0.00 174.94 174.60 3h3j s ILE 176 N -0.16 1.04 0.00 2.92 -4.36 -0.43 -4.63 121.20 115.58 3h3j s ILE 176 Ca 0.01 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.40 3h3j s ILE 176 Cb -0.13 -2.55 0.00 0.00 1.25 0.00 0.00 42.46 41.03 3h3j s ILE 176 CO 0.03 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.82 3h3j n GLY 177 N -0.89 -1.80 3.66 6.27 0.00 -0.08 -1.18 105.19 111.18 3h3j n GLY 177 Ca -0.07 -1.84 -0.44 0.00 0.00 0.00 0.00 46.02 43.67 3h3j n GLY 177 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3h3j n GLU 178 N 0.00 1.92 -2.32 1.61 2.13 -1.26 -1.08 120.64 121.64 3h3j n GLU 178 Ca 0.00 0.68 -0.35 0.00 0.66 0.00 0.00 57.16 58.15 3h3j n GLU 178 Cb 0.00 -2.26 -0.04 0.00 0.27 0.00 0.00 31.44 29.42 3h3j n GLU 178 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 3h3j s HIS 179 N -0.59 2.28 -5.00 4.31 5.65 -1.26 -3.40 115.29 117.28 3h3j s HIS 179 Ca 0.62 -0.36 0.00 0.00 0.25 0.00 0.00 55.06 55.57 3h3j s HIS 179 Cb -0.64 -4.39 0.00 0.00 -1.18 0.00 0.00 32.58 26.38 3h3j s HIS 179 CO 0.56 -1.68 0.00 0.41 -0.65 0.00 0.00 174.74 173.38 3h3j n GLY 180 N 6.25 -0.66 0.31 1.59 0.00 -1.26 -4.80 105.19 106.63 3h3j n GLY 180 Ca 0.42 -1.15 0.19 0.00 0.00 0.00 0.00 46.02 45.48 3h3j n GLY 180 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3h3j h ASP 181 N 0.00 0.00 -0.71 1.61 3.32 -1.88 -0.54 116.42 118.22 3h3j h ASP 181 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3h3j h ASP 181 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3h3j h ASP 181 CO 0.00 0.02 0.00 0.35 -1.72 0.00 0.00 179.24 177.89 3h3j n THR 182 N -3.35 1.23 -0.94 0.35 -2.24 -1.26 -4.97 114.28 103.10 3h3j n THR 182 Ca -0.03 -1.04 -0.33 0.00 -2.27 0.00 0.00 64.05 60.39 3h3j n THR 182 Cb 0.12 0.37 0.14 0.00 -2.10 0.00 0.00 70.33 68.86 3h3j n THR 182 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3h3j s GLU 183 N -1.28 1.37 0.01 -0.78 -1.05 -0.21 -4.56 118.70 112.19 3h3j s GLU 183 Ca 0.50 1.69 0.01 0.00 -0.15 0.00 0.00 54.97 57.02 3h3j s GLU 183 Cb 0.28 -1.75 -0.01 0.00 -0.44 0.00 0.00 34.13 32.21 3h3j s GLU 183 CO 0.31 -2.40 -0.03 -0.48 0.95 0.00 0.00 175.26 173.60 3h3j s LEU 184 N -6.06 2.06 0.38 1.83 2.34 -0.33 -5.00 118.68 113.91 3h3j s LEU 184 Ca 0.71 -0.16 -0.24 0.00 0.06 0.00 0.00 54.13 54.50 3h3j s LEU 184 Cb -0.27 -0.10 -0.10 0.00 -0.56 0.00 0.00 46.19 45.17 3h3j s LEU 184 CO 0.53 -0.04 0.99 -2.16 -1.06 0.00 0.00 176.35 174.62 3h3j s PRO 185 N -0.42 4.31 -1.13 1.48 0.04 -1.26 -1.32 135.00 136.71 3h3j s PRO 185 Ca -0.03 1.36 -0.08 0.00 0.04 0.00 0.00 61.00 62.30 3h3j s PRO 185 Cb -0.03 -2.54 0.27 0.00 0.04 0.00 0.00 34.50 32.24 3h3j s PRO 185 CO -0.00 0.02 1.33 0.28 0.04 0.00 0.00 177.00 178.66 3h3j n VAL 186 N 0.00 4.80 0.25 -0.36 0.31 -0.73 -4.84 118.33 117.77 3h3j n VAL 186 Ca 0.04 -5.45 0.12 0.00 -0.01 0.00 0.00 64.34 59.04 3h3j n VAL 186 Cb 0.51 -2.38 0.66 0.00 -0.91 0.00 0.00 33.84 31.71 3h3j n VAL 186 CO 0.00 0.00 0.00 -0.50 -1.32 0.00 0.00 176.83 175.01 3h3j h TRP 187 N 6.21 0.00 0.00 3.52 4.06 -1.94 -1.83 115.95 125.97 3h3j h TRP 187 Ca 0.21 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.16 3h3j h TRP 187 Cb 0.76 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.92 3h3j h TRP 187 CO 0.91 0.15 0.00 0.66 -3.56 0.00 0.00 178.44 176.60 3h3j h SER 188 N 0.00 0.00 0.00 -3.49 4.64 -1.97 -3.22 113.55 109.52 3h3j h SER 188 Ca -0.00 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.09 3h3j h SER 188 Cb 0.44 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.49 3h3j h SER 188 CO 0.02 0.00 -1.88 1.57 -0.87 0.00 0.00 176.83 175.67 3h3j n HIS 189 N -2.59 0.00 -1.69 4.77 -0.00 -0.83 -5.04 115.22 109.84 3h3j n HIS 189 Ca 0.00 0.00 -0.55 0.00 -0.00 0.00 0.00 57.72 57.17 3h3j n HIS 189 Cb 0.17 -0.59 -0.06 0.00 -0.00 0.00 0.00 29.99 29.51 3h3j n HIS 189 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3h3j n ALA 190 N -2.98 -0.06 -3.04 1.57 0.00 -0.75 -4.94 120.51 110.31 3h3j n ALA 190 Ca -0.27 0.39 -0.10 0.00 0.00 0.00 0.00 53.44 53.45 3h3j n ALA 190 Cb 0.79 -2.26 -0.04 0.00 0.00 0.00 0.00 19.45 17.94 3h3j n ALA 190 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3h3j s ASN 191 N 3.09 -0.25 -0.32 0.00 4.22 -0.64 -2.95 114.94 118.09 3h3j s ASN 191 Ca 0.95 -0.31 0.03 0.00 -2.14 0.00 0.00 52.86 51.39 3h3j s ASN 191 Cb -0.97 0.49 0.09 0.00 1.28 0.00 0.00 41.25 42.13 3h3j s ASN 191 CO 0.59 -0.87 0.01 -0.63 -2.04 0.00 0.00 177.10 174.16 3h3j s ILE 192 N -3.81 2.29 -1.66 0.54 1.01 -1.10 -1.52 121.20 116.95 3h3j s ILE 192 Ca 0.03 -2.12 0.00 0.00 0.00 0.00 0.00 60.65 58.56 3h3j s ILE 192 Cb 0.02 -2.59 0.00 0.00 0.01 0.00 0.00 42.46 39.90 3h3j s ILE 192 CO -0.11 -0.43 0.00 0.00 0.00 0.00 0.00 174.94 174.40 3h3j n ALA 193 N 4.32 -0.58 0.00 9.38 0.00 -1.26 -0.93 120.51 131.44 3h3j n ALA 193 Ca -0.02 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.61 3h3j n ALA 193 Cb 0.42 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 17.90 3h3j n ALA 193 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h3j n GLY 194 N -0.82 0.15 3.70 0.00 0.00 -1.26 -5.06 105.19 101.90 3h3j n GLY 194 Ca -0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 3h3j n GLY 194 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h3j s GLN 195 N -0.97 4.24 -0.66 1.61 -0.21 -0.10 -4.94 119.66 118.63 3h3j s GLN 195 Ca 0.00 2.18 -0.25 0.00 0.02 0.00 0.00 55.36 57.31 3h3j s GLN 195 Cb 0.00 -3.49 0.04 0.00 1.00 0.00 0.00 33.01 30.57 3h3j s GLN 195 CO 0.00 -0.63 1.11 -1.25 -2.12 0.00 0.00 175.29 172.40 3h3j s PRO 196 N 2.16 3.24 0.14 2.91 0.04 -1.26 -2.71 135.00 139.53 3h3j s PRO 196 Ca 0.69 -0.35 -0.16 0.00 0.04 0.00 0.00 61.00 61.22 3h3j s PRO 196 Cb -0.37 -4.15 0.01 0.00 0.04 0.00 0.00 34.50 30.03 3h3j s PRO 196 CO 0.30 -1.86 1.74 -0.07 0.04 0.00 0.00 177.00 177.15 3h3j h LEU 197 N 11.98 0.52 -0.61 -3.56 3.38 -1.87 -0.59 115.31 124.56 3h3j h LEU 197 Ca -0.27 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 3h3j h LEU 197 Cb 1.06 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.65 3h3j h LEU 197 CO 1.20 0.47 0.29 0.50 0.09 0.00 0.00 178.44 181.00 3h3j h LYS 198 N 0.53 0.88 -0.39 1.13 3.64 -1.84 0.12 116.57 120.63 3h3j h LYS 198 Ca 0.14 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 3h3j h LYS 198 Cb 0.08 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 3h3j h LYS 198 CO -0.02 0.71 0.21 1.15 -2.27 0.00 0.00 179.45 179.23 3h3j h THR 199 N 0.84 1.15 -0.55 1.00 2.02 -1.86 0.26 112.91 115.77 3h3j h THR 199 Ca 0.21 -0.38 0.01 0.00 0.77 0.00 0.00 66.41 67.01 3h3j h THR 199 Cb 0.12 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 3h3j h THR 199 CO -0.03 0.15 0.37 -0.07 0.37 0.00 0.00 175.52 176.31 3h3j h LEU 200 N 0.50 0.63 -0.78 2.58 3.38 -0.82 -2.57 115.31 118.25 3h3j h LEU 200 Ca 0.14 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 3h3j h LEU 200 Cb 0.05 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 3h3j h LEU 200 CO -0.02 0.46 0.44 -0.07 0.09 0.00 0.00 178.44 179.33 3h3j h LEU 201 N 0.75 0.96 -2.10 1.67 3.38 -0.40 -2.58 115.31 116.99 3h3j h LEU 201 Ca 0.20 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 3h3j h LEU 201 Cb -0.09 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.42 3h3j h LEU 201 CO -0.04 0.78 -0.02 -0.33 0.09 0.00 0.00 178.44 178.91 3h3j h GLU 202 N 1.07 0.00 0.00 1.13 5.08 -0.57 -0.29 114.58 121.00 3h3j h GLU 202 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 3h3j h GLU 202 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3h3j h GLU 202 CO -0.05 0.02 0.00 1.96 -1.00 0.00 0.00 179.01 179.95 3h3j h GLN 203 N 0.00 0.00 -7.37 2.33 4.20 -1.08 -3.41 115.11 109.77 3h3j h GLN 203 Ca -0.00 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 58.21 3h3j h GLN 203 Cb 0.05 0.00 0.06 0.00 0.30 0.00 0.00 27.48 27.89 3h3j h GLN 203 CO 0.00 0.00 0.40 1.03 -0.67 0.00 0.00 178.83 179.60 3h3j s ARG 204 N -3.46 3.37 0.32 1.46 0.52 -0.12 -4.96 118.95 116.08 3h3j s ARG 204 Ca 0.03 0.63 -0.29 0.00 -0.52 0.00 0.00 55.73 55.58 3h3j s ARG 204 Cb 0.09 -2.08 -0.12 0.00 0.52 0.00 0.00 34.95 33.36 3h3j s ARG 204 CO 0.46 -0.69 1.43 -2.30 0.02 0.00 0.00 175.30 174.22 3h3j n PRO 205 N -2.80 2.38 -4.37 3.54 -0.02 -1.26 -1.39 135.00 131.07 3h3j n PRO 205 Ca 0.06 0.84 -0.39 0.00 -2.02 0.00 0.00 63.50 61.98 3h3j n PRO 205 Cb 0.55 -2.51 -0.05 0.00 -0.02 0.00 0.00 33.50 31.46 3h3j n PRO 205 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3h3j n GLU 206 N 1.11 -1.88 -0.28 -0.52 -0.58 -1.26 -4.78 120.64 112.46 3h3j n GLU 206 Ca 0.06 0.25 -0.03 0.00 -0.42 0.00 0.00 57.16 57.01 3h3j n GLU 206 Cb 0.36 -4.90 0.12 0.00 -0.57 0.00 0.00 31.44 26.45 3h3j n GLU 206 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 3h3j h GLY 207 N -1.15 1.22 0.84 0.62 0.00 -1.40 -1.05 103.07 102.15 3h3j h GLY 207 Ca -0.59 -0.59 0.06 0.00 0.00 0.00 0.00 47.33 46.22 3h3j h GLY 207 CO 0.84 0.56 0.61 0.50 0.00 0.00 0.00 176.54 179.04 3h3j h LYS 208 N 1.13 1.05 -0.45 4.80 1.57 -1.83 0.27 116.57 123.12 3h3j h LYS 208 Ca 0.28 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.97 3h3j h LYS 208 Cb 0.09 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 3h3j h LYS 208 CO -0.04 0.70 0.20 0.00 -0.57 0.00 0.00 179.45 179.74 3h3j h ALA 209 N 1.49 0.58 -0.55 3.86 0.00 -1.57 -1.77 119.26 121.29 3h3j h ALA 209 Ca 0.40 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 55.08 3h3j h ALA 209 Cb 0.17 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3h3j h ALA 209 CO -0.15 0.16 -0.05 1.96 0.00 0.00 0.00 179.25 181.17 3h3j h GLN 210 N 0.58 1.01 -0.68 0.00 4.20 -0.56 0.87 115.11 120.52 3h3j h GLN 210 Ca 0.15 -0.35 0.05 0.00 0.06 0.00 0.00 58.65 58.56 3h3j h GLN 210 Cb 0.15 -0.08 -0.05 0.00 0.30 0.00 0.00 27.48 27.80 3h3j h GLN 210 CO -0.02 1.03 0.39 0.82 -0.67 0.00 0.00 178.83 180.39 3h3j h ILE 211 N 0.89 1.00 -0.35 2.54 2.04 -0.91 -0.64 117.51 122.08 3h3j h ILE 211 Ca 0.15 -0.25 -0.07 0.00 1.00 0.00 0.00 64.86 65.69 3h3j h ILE 211 Cb 0.61 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 3h3j h ILE 211 CO 0.04 0.13 -0.05 -0.08 0.00 0.00 0.00 178.15 178.19 3h3j h GLU 212 N 0.74 0.65 -0.73 2.37 4.81 -0.74 -2.80 114.58 118.89 3h3j h GLU 212 Ca 0.30 -0.24 -0.03 0.00 -0.13 0.00 0.00 59.36 59.26 3h3j h GLU 212 Cb 0.14 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 3h3j h GLU 212 CO -0.16 0.80 0.35 1.96 -0.73 0.00 0.00 179.01 181.23 3h3j h GLN 213 N 0.45 1.04 -0.69 1.92 1.08 -0.44 0.18 115.11 118.66 3h3j h GLN 213 Ca 0.09 -0.14 -0.03 0.00 -1.45 0.00 0.00 58.65 57.12 3h3j h GLN 213 Cb 0.54 -0.19 -0.03 0.00 -0.05 0.00 0.00 27.48 27.75 3h3j h GLN 213 CO 0.03 0.80 0.32 0.82 -0.95 0.00 0.00 178.83 179.85 3h3j h ILE 214 N 1.03 1.23 -0.23 2.54 2.04 -1.09 0.69 117.51 123.73 3h3j h ILE 214 Ca 0.25 -0.66 -0.15 0.00 1.00 0.00 0.00 64.86 65.30 3h3j h ILE 214 Cb 0.11 0.40 0.00 0.00 -0.74 0.00 0.00 36.82 36.59 3h3j h ILE 214 CO -0.03 0.27 -0.45 0.15 0.00 0.00 0.00 178.15 178.09 3h3j h PHE 215 N 0.96 0.90 -0.89 1.37 3.57 -1.13 -2.31 116.94 119.41 3h3j h PHE 215 Ca 0.23 -0.33 0.00 0.00 3.53 0.00 0.00 57.97 61.41 3h3j h PHE 215 Cb 0.13 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 38.66 3h3j h PHE 215 CO 0.01 1.11 0.56 0.28 -2.23 0.00 0.00 178.31 178.04 3h3j h VAL 216 N 0.43 1.24 0.00 1.41 2.07 -0.23 0.61 116.25 121.78 3h3j h VAL 216 Ca 0.01 -0.47 -0.12 0.00 0.82 0.00 0.00 66.70 66.94 3h3j h VAL 216 Cb 1.06 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 3h3j h VAL 216 CO 0.10 0.24 -0.58 1.56 0.02 0.00 0.00 177.57 178.91 3h3j h GLN 217 N 1.21 0.00 0.63 1.57 4.20 -0.86 -0.49 115.11 121.38 3h3j h GLN 217 Ca 0.32 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 59.00 3h3j h GLN 217 Cb -0.10 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.69 3h3j h GLN 217 CO -0.07 0.58 -0.30 1.15 -0.67 0.00 0.00 178.83 179.52 3h3j h THR 218 N 0.00 0.00 -0.84 -0.54 2.02 -0.72 -2.55 112.91 110.28 3h3j h THR 218 Ca -0.01 -0.22 0.14 0.00 0.77 0.00 0.00 66.41 67.09 3h3j h THR 218 Cb 1.05 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 67.37 3h3j h THR 218 CO 0.08 0.00 0.43 -0.09 0.37 0.00 0.00 175.52 176.31 3h3j h ARG 219 N -1.07 0.62 -0.66 6.66 2.43 -0.87 -2.71 114.38 118.79 3h3j h ARG 219 Ca -0.09 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 3h3j h ARG 219 Cb 0.64 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 3h3j h ARG 219 CO 0.14 0.41 0.00 -0.25 -1.51 0.00 0.00 179.97 178.76 3h3j n ASP 220 N -4.86 4.84 -0.15 -3.80 8.00 -0.20 -4.56 116.55 115.83 3h3j n ASP 220 Ca 0.16 -2.48 -0.08 0.00 0.71 0.00 0.00 54.79 53.11 3h3j n ASP 220 Cb 0.40 -0.59 0.01 0.00 -0.02 0.00 0.00 41.12 40.92 3h3j n ASP 220 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h3j h ALA 221 N 4.16 0.57 -0.94 2.24 0.00 -1.11 -1.22 119.26 122.96 3h3j h ALA 221 Ca 0.00 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.92 3h3j h ALA 221 Cb 1.49 -0.18 -0.07 0.00 0.00 0.00 0.00 17.79 19.04 3h3j h ALA 221 CO 0.25 0.05 0.60 0.00 0.00 0.00 0.00 179.25 180.15 3h3j h ALA 222 N 1.13 1.31 -0.48 0.00 0.00 -1.83 -0.57 119.26 118.82 3h3j h ALA 222 Ca 0.16 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 3h3j h ALA 222 Cb -0.01 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 3h3j h ALA 222 CO -0.03 0.36 0.02 1.88 0.00 0.00 0.00 179.25 181.48 3h3j h TYR 223 N 1.08 0.90 -0.54 0.00 0.05 -1.73 -0.03 116.97 116.69 3h3j h TYR 223 Ca 0.41 -0.15 -0.03 0.00 0.05 0.00 0.00 58.73 59.01 3h3j h TYR 223 Cb 0.19 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 37.67 3h3j h TYR 223 CO -0.02 0.85 0.21 -0.44 -1.05 0.00 0.00 178.16 177.72 3h3j h ASP 224 N 0.69 0.75 -0.42 3.88 3.32 -0.48 -0.76 116.42 123.40 3h3j h ASP 224 Ca 0.14 -0.17 -0.15 0.00 0.02 0.00 0.00 57.03 56.87 3h3j h ASP 224 Cb 0.48 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 3h3j h ASP 224 CO 0.02 0.72 -0.31 0.40 -1.72 0.00 0.00 179.24 178.35 3h3j h ILE 225 N 0.74 1.27 -0.61 0.35 2.04 -1.03 -2.44 117.51 117.83 3h3j h ILE 225 Ca 0.18 -1.47 -0.04 0.00 1.00 0.00 0.00 64.86 64.52 3h3j h ILE 225 Cb 0.20 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.54 3h3j h ILE 225 CO -0.01 0.50 0.21 0.40 0.00 0.00 0.00 178.15 179.24 3h3j h ILE 226 N 0.78 1.23 -0.77 -0.67 2.04 -0.82 0.68 117.51 119.98 3h3j h ILE 226 Ca 0.08 -0.75 -0.05 0.00 1.00 0.00 0.00 64.86 65.14 3h3j h ILE 226 Cb 0.89 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 37.48 3h3j h ILE 226 CO 0.08 0.29 0.30 -0.61 0.00 0.00 0.00 178.15 178.22 3h3j h GLN 227 N 0.88 1.16 0.06 2.37 4.15 -1.06 0.11 115.11 122.79 3h3j h GLN 227 Ca 0.20 -0.22 -0.26 0.00 0.77 0.00 0.00 58.65 59.15 3h3j h GLN 227 Cb 0.23 -0.19 0.02 0.00 0.21 0.00 0.00 27.48 27.75 3h3j h GLN 227 CO -0.01 0.95 -1.04 0.00 -1.93 0.00 0.00 178.83 176.80 3h3j h ALA 228 N 1.16 0.05 0.00 3.38 0.00 -0.94 -3.42 119.26 119.49 3h3j h ALA 228 Ca 0.26 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3h3j h ALA 228 Cb 0.23 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3h3j h ALA 228 CO -0.02 0.61 0.00 0.36 0.00 0.00 0.00 179.25 180.20 3h3j n LYS 229 N -3.91 0.11 0.00 0.00 2.85 0.19 -5.06 118.16 112.34 3h3j n LYS 229 Ca -0.12 -0.32 0.00 0.00 -1.05 0.00 0.00 58.31 56.82 3h3j n LYS 229 Cb 0.89 -0.57 0.00 0.00 -0.65 0.00 0.00 35.03 34.69 3h3j n LYS 229 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3h3j n GLY 230 N -0.03 3.16 3.54 2.58 0.00 0.39 -4.97 105.19 109.86 3h3j n GLY 230 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 3h3j n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3j s ALA 231 N -2.65 -1.91 0.06 4.61 0.00 -1.26 -4.84 121.76 115.78 3h3j s ALA 231 Ca 0.00 1.29 0.06 0.00 0.00 0.00 0.00 51.96 53.31 3h3j s ALA 231 Cb 0.00 0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 3h3j s ALA 231 CO 0.00 -0.57 -0.13 0.95 0.00 0.00 0.00 175.76 176.01 3h3j s THR 232 N -2.48 3.19 0.00 0.00 -4.23 -1.26 -4.60 115.64 106.26 3h3j s THR 232 Ca 0.04 -1.16 0.00 0.00 -1.18 0.00 0.00 61.69 59.39 3h3j s THR 232 Cb -0.01 -2.42 0.00 0.00 1.34 0.00 0.00 72.50 71.41 3h3j s THR 232 CO -0.06 0.24 0.00 0.00 -0.54 0.00 0.00 174.62 174.27 3h3j n TYR 233 N 1.16 0.00 -0.07 3.99 0.18 -1.26 -4.72 117.16 116.44 3h3j n TYR 233 Ca -0.15 0.00 -0.13 0.00 1.88 0.00 0.00 57.90 59.50 3h3j n TYR 233 Cb 0.52 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.43 3h3j n TYR 233 CO 0.00 0.00 0.00 1.88 -2.08 0.00 0.00 176.86 176.66 3h3j h TYR 234 N 0.00 0.66 -0.20 -3.48 0.05 -1.95 -1.60 116.97 110.46 3h3j h TYR 234 Ca 0.00 -0.21 0.01 0.00 0.05 0.00 0.00 58.73 58.58 3h3j h TYR 234 Cb 0.00 -0.13 -0.01 0.00 1.01 0.00 0.00 36.73 37.59 3h3j h TYR 234 CO 0.00 0.91 0.11 0.78 -1.05 0.00 0.00 178.16 178.90 3h3j h GLY 235 N 0.22 0.26 1.14 3.88 0.00 -2.00 -1.58 103.07 105.00 3h3j h GLY 235 Ca 0.03 -0.08 -0.14 0.00 0.00 0.00 0.00 47.33 47.14 3h3j h GLY 235 CO 0.06 0.07 -0.29 -0.24 0.00 0.00 0.00 176.54 176.14 3h3j h VAL 236 N 0.22 1.27 -0.56 4.60 3.04 -1.92 -1.51 116.25 121.40 3h3j h VAL 236 Ca 0.08 -1.46 0.07 0.00 -1.01 0.00 0.00 66.70 64.38 3h3j h VAL 236 Cb 0.01 1.24 -0.06 0.00 -2.01 0.00 0.00 31.29 30.47 3h3j h VAL 236 CO -0.05 0.50 0.24 0.00 -1.01 0.00 0.00 177.57 177.25 3h3j h ALA 237 N 0.84 0.72 -0.61 3.17 0.00 -1.12 0.23 119.26 122.50 3h3j h ALA 237 Ca 0.09 0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 3h3j h ALA 237 Cb 0.88 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 3h3j h ALA 237 CO 0.08 -0.15 0.02 1.98 0.00 0.00 0.00 179.25 181.18 3h3j h MET 238 N 0.44 1.05 -0.51 0.00 4.05 -1.11 -0.23 114.93 118.62 3h3j h MET 238 Ca 0.27 -0.31 -0.05 0.00 -0.28 0.00 0.00 59.70 59.33 3h3j h MET 238 Cb 0.27 -0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 30.94 3h3j h MET 238 CO -0.24 1.01 0.13 0.78 0.23 0.00 0.00 176.91 178.82 3h3j h GLY 239 N 1.01 0.87 1.02 1.39 0.00 -0.57 -0.62 103.07 106.16 3h3j h GLY 239 Ca 0.18 -0.54 -0.02 0.00 0.00 0.00 0.00 47.33 46.95 3h3j h GLY 239 CO 0.03 0.50 0.44 1.41 0.00 0.00 0.00 176.54 178.92 3h3j h LEU 240 N 0.70 1.01 -0.89 3.11 3.38 -0.26 -1.92 115.31 120.43 3h3j h LEU 240 Ca 0.16 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3h3j h LEU 240 Cb 0.32 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 3h3j h LEU 240 CO 0.00 0.82 0.55 0.00 0.09 0.00 0.00 178.44 179.89 3h3j h ALA 241 N 1.23 1.14 -0.49 1.53 0.00 -0.70 -0.89 119.26 121.09 3h3j h ALA 241 Ca 0.28 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3h3j h ALA 241 Cb 0.03 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 3h3j h ALA 241 CO -0.05 0.59 0.19 -0.09 0.00 0.00 0.00 179.25 179.90 3h3j h ARG 242 N 1.23 0.73 -0.58 0.00 9.65 -0.50 -0.15 114.38 124.75 3h3j h ARG 242 Ca 0.32 -0.13 -0.05 0.00 -1.10 0.00 0.00 59.98 59.01 3h3j h ARG 242 Cb -0.06 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.37 3h3j h ARG 242 CO -0.06 0.66 0.16 0.82 2.80 0.00 0.00 179.97 184.34 3h3j h ILE 243 N 0.65 1.25 -0.90 1.20 2.04 -1.13 -2.01 117.51 118.60 3h3j h ILE 243 Ca 0.16 -0.86 -0.01 0.00 1.00 0.00 0.00 64.86 65.15 3h3j h ILE 243 Cb 0.20 0.70 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 3h3j h ILE 243 CO -0.01 0.32 0.54 0.74 0.00 0.00 0.00 178.15 179.74 3h3j h THR 244 N 0.83 1.25 -0.35 -0.27 2.02 -0.64 -1.51 112.91 114.24 3h3j h THR 244 Ca 0.18 -0.55 -0.01 0.00 0.77 0.00 0.00 66.41 66.81 3h3j h THR 244 Cb 0.32 -0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.70 3h3j h THR 244 CO -0.00 0.26 0.17 -0.08 0.37 0.00 0.00 175.52 176.24 3h3j h GLU 245 N 1.24 0.50 -0.71 6.66 4.81 -0.81 -1.11 114.58 125.16 3h3j h GLU 245 Ca 0.32 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 59.50 3h3j h GLU 245 Cb -0.05 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.20 3h3j h GLU 245 CO -0.06 0.45 0.47 0.00 -0.73 0.00 0.00 179.01 179.14 3h3j h ALA 246 N 1.02 1.52 0.61 2.92 0.00 -0.61 0.47 119.26 125.20 3h3j h ALA 246 Ca 0.12 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 3h3j h ALA 246 Cb 0.11 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.63 3h3j h ALA 246 CO -0.02 0.43 -0.29 0.82 0.00 0.00 0.00 179.25 180.19 3h3j h ILE 247 N 0.94 0.06 0.00 0.00 2.04 -1.05 -1.78 117.51 117.72 3h3j h ILE 247 Ca 0.27 -0.39 0.00 0.00 1.00 0.00 0.00 64.86 65.74 3h3j h ILE 247 Cb -0.06 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.11 3h3j h ILE 247 CO -0.06 0.01 0.00 -0.26 0.00 0.00 0.00 178.15 177.84 3h3j h PHE 248 N -1.19 0.00 -0.70 1.37 0.04 -1.08 -1.33 116.94 114.06 3h3j h PHE 248 Ca -0.08 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.69 3h3j h PHE 248 Cb 0.65 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.80 3h3j h PHE 248 CO 0.00 0.00 0.00 0.54 -0.60 0.00 0.00 178.31 178.25 3h3j n ARG 249 N -2.94 2.68 -3.81 1.51 5.12 0.14 -4.99 116.66 114.37 3h3j n ARG 249 Ca 0.02 -2.54 -0.26 0.00 -1.93 0.00 0.00 57.85 53.14 3h3j n ARG 249 Cb 0.37 -1.56 0.01 0.00 -1.16 0.00 0.00 32.46 30.12 3h3j n ARG 249 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 3h3j n ASN 250 N 1.54 -2.09 0.05 0.55 5.15 -0.52 -4.88 115.26 115.06 3h3j n ASN 250 Ca 0.24 -0.97 -0.04 0.00 -0.60 0.00 0.00 54.58 53.21 3h3j n ASN 250 Cb 0.61 -3.40 -0.09 0.00 -0.53 0.00 0.00 39.78 36.37 3h3j n ASN 250 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 3h3j h GLU 251 N -1.86 0.00 -5.66 1.20 5.08 -1.45 -3.44 114.58 108.45 3h3j h GLU 251 Ca -0.64 0.00 -0.41 0.00 -1.00 0.00 0.00 59.36 57.31 3h3j h GLU 251 Cb 1.37 0.00 0.10 0.00 0.50 0.00 0.00 28.75 30.72 3h3j h GLU 251 CO 0.56 0.64 -0.68 -0.25 -1.00 0.00 0.00 179.01 178.29 3h3j n ASP 252 N -3.16 -6.16 -4.81 1.42 8.00 0.15 -4.99 116.55 107.00 3h3j n ASP 252 Ca -0.06 -0.52 -0.37 0.00 0.71 0.00 0.00 54.79 54.55 3h3j n ASP 252 Cb 0.91 -4.87 -0.06 0.00 -0.02 0.00 0.00 41.12 37.08 3h3j n ASP 252 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h3j s ALA 253 N -3.29 3.50 -0.25 2.24 0.00 -0.94 -4.67 121.76 118.35 3h3j s ALA 253 Ca 0.55 0.12 -0.23 0.00 0.00 0.00 0.00 51.96 52.40 3h3j s ALA 253 Cb -0.25 -2.75 -0.01 0.00 0.00 0.00 0.00 23.12 20.12 3h3j s ALA 253 CO 0.68 0.36 0.74 0.08 0.00 0.00 0.00 175.76 177.62 3h3j s VAL 254 N -1.32 4.89 0.05 0.00 1.01 -1.26 -0.49 120.40 123.28 3h3j s VAL 254 Ca 0.37 1.36 0.04 0.00 0.00 0.00 0.00 61.98 63.75 3h3j s VAL 254 Cb -0.18 -4.04 -0.02 0.00 0.00 0.00 0.00 36.38 32.13 3h3j s VAL 254 CO 0.21 -0.05 -0.12 -0.76 0.00 0.00 0.00 175.10 174.39 3h3j s LEU 255 N 2.71 2.21 -0.39 3.92 1.43 -0.27 -4.88 118.68 123.42 3h3j s LEU 255 Ca 0.31 -0.50 -0.27 0.00 -1.03 0.00 0.00 54.13 52.63 3h3j s LEU 255 Cb -0.15 -0.43 0.02 0.00 0.03 0.00 0.00 46.19 45.65 3h3j s LEU 255 CO 0.08 -0.06 1.01 0.42 0.23 0.00 0.00 176.35 178.03 3h3j s THR 256 N -1.07 4.47 0.27 5.49 -4.23 -1.26 -1.08 115.64 118.23 3h3j s THR 256 Ca -0.03 1.31 0.02 0.00 -1.18 0.00 0.00 61.69 61.81 3h3j s THR 256 Cb -0.09 -4.43 -0.04 0.00 1.34 0.00 0.00 72.50 69.29 3h3j s THR 256 CO 0.01 -0.66 0.14 0.68 -0.54 0.00 0.00 174.62 174.25 3h3j s VAL 257 N 3.77 0.33 -0.29 2.29 -7.23 -0.66 -1.35 120.40 117.26 3h3j s VAL 257 Ca 0.42 -2.00 -0.26 0.00 -1.81 0.00 0.00 61.98 58.33 3h3j s VAL 257 Cb -0.11 -2.55 0.01 0.00 0.56 0.00 0.00 36.38 34.29 3h3j s VAL 257 CO 0.21 0.00 0.92 -0.55 -0.31 0.00 0.00 175.10 175.37 3h3j s SER 258 N -3.31 6.83 0.08 4.85 0.15 0.18 -0.87 113.70 121.61 3h3j s SER 258 Ca 0.37 0.94 0.05 0.00 0.70 0.00 0.00 55.95 58.01 3h3j s SER 258 Cb 0.06 -2.47 -0.03 0.00 -1.71 0.00 0.00 66.02 61.87 3h3j s SER 258 CO 0.15 -0.69 -0.13 0.00 1.20 0.00 0.00 173.24 173.78 3h3j s ALA 259 N 3.18 1.17 0.11 5.45 0.00 -0.82 -1.54 121.76 129.31 3h3j s ALA 259 Ca 0.38 -1.07 -0.31 0.00 0.00 0.00 0.00 51.96 50.96 3h3j s ALA 259 Cb -0.14 -0.06 -0.07 0.00 0.00 0.00 0.00 23.12 22.85 3h3j s ALA 259 CO 0.12 0.10 1.33 -1.17 0.00 0.00 0.00 175.76 176.13 3h3j s LEU 260 N -2.00 4.38 -0.13 0.00 2.96 -1.26 -1.71 118.68 120.91 3h3j s LEU 260 Ca 0.01 2.25 -0.09 0.00 -0.22 0.00 0.00 54.13 56.08 3h3j s LEU 260 Cb -0.08 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.98 3h3j s LEU 260 CO 0.02 -0.59 0.18 -0.76 -1.32 0.00 0.00 176.35 173.88 3h3j s LEU 261 N 0.94 4.34 -0.39 -0.68 1.43 -0.50 -4.95 118.68 118.87 3h3j s LEU 261 Ca 0.62 0.46 0.12 0.00 -1.03 0.00 0.00 54.13 54.30 3h3j s LEU 261 Cb -0.35 -2.15 0.42 0.00 0.03 0.00 0.00 46.19 44.15 3h3j s LEU 261 CO 0.31 0.32 0.98 -0.62 0.23 0.00 0.00 176.35 177.57 3h3j n GLU 262 N 2.49 2.11 0.00 1.70 1.02 -1.25 -1.86 120.64 124.84 3h3j n GLU 262 Ca -0.18 -3.85 0.00 0.00 -0.02 0.00 0.00 57.16 53.12 3h3j n GLU 262 Cb 0.54 -1.73 0.00 0.00 -0.02 0.00 0.00 31.44 30.22 3h3j n GLU 262 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3h3j n GLY 263 N -0.19 1.61 3.76 0.62 0.00 0.61 -4.96 105.19 106.65 3h3j n GLY 263 Ca 0.23 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.87 3h3j n GLY 263 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h3j s GLU 264 N 0.00 3.52 -1.72 1.61 8.01 -1.24 -1.94 118.70 126.93 3h3j s GLU 264 Ca 0.00 2.09 0.00 0.00 0.01 0.00 0.00 54.97 57.07 3h3j s GLU 264 Cb 0.00 -2.42 0.00 0.00 -4.31 0.00 0.00 34.13 27.40 3h3j s GLU 264 CO 0.00 -0.84 0.00 0.66 0.01 0.00 0.00 175.26 175.09 3h3j n TYR 265 N -0.60 -0.19 -2.42 1.61 4.01 -1.26 -1.69 117.16 116.62 3h3j n TYR 265 Ca 0.08 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.63 3h3j n TYR 265 Cb 0.45 -2.95 -0.00 0.00 -0.31 0.00 0.00 39.34 36.53 3h3j n TYR 265 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 3h3j n GLU 266 N -2.00 -1.81 -4.30 -0.72 1.02 -0.82 -4.97 120.64 107.03 3h3j n GLU 266 Ca -0.16 0.91 -0.22 0.00 -0.02 0.00 0.00 57.16 57.67 3h3j n GLU 266 Cb 0.55 -5.48 -0.12 0.00 -0.02 0.00 0.00 31.44 26.37 3h3j n GLU 266 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3h3j s GLU 267 N -5.01 1.19 0.05 3.49 0.41 -0.68 -4.97 118.70 113.17 3h3j s GLU 267 Ca 0.03 -1.30 -0.03 0.00 -0.41 0.00 0.00 54.97 53.26 3h3j s GLU 267 Cb -0.01 -1.29 -0.03 0.00 -1.78 0.00 0.00 34.13 31.02 3h3j s GLU 267 CO 0.03 0.27 0.03 -1.83 -0.49 0.00 0.00 175.26 173.28 3h3j s GLU 268 N -2.46 0.63 -1.24 1.61 -1.05 -1.26 -0.28 118.70 114.65 3h3j s GLU 268 Ca 0.11 -1.06 -0.01 0.00 -0.15 0.00 0.00 54.97 53.86 3h3j s GLU 268 Cb -0.07 0.23 -0.01 0.00 -0.44 0.00 0.00 34.13 33.84 3h3j s GLU 268 CO 0.05 -0.14 0.83 -3.47 0.95 0.00 0.00 175.26 173.48 3h3j n ASP 269 N 0.29 -2.08 -3.64 0.83 2.03 -0.78 -4.97 116.55 108.24 3h3j n ASP 269 Ca -0.16 -0.75 -0.09 0.00 0.52 0.00 0.00 54.79 54.32 3h3j n ASP 269 Cb 0.60 -4.51 -0.07 0.00 -0.72 0.00 0.00 41.12 36.42 3h3j n ASP 269 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3h3j s VAL 270 N -3.53 0.00 -0.04 5.18 0.11 -1.26 -4.98 120.40 115.89 3h3j s VAL 270 Ca 0.06 0.00 -0.19 0.00 -2.93 0.00 0.00 61.98 58.91 3h3j s VAL 270 Cb -0.01 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.79 3h3j s VAL 270 CO 0.78 0.00 0.55 -0.31 -3.33 0.00 0.00 175.10 172.78 3h3j s TYR 271 N 0.89 3.64 0.09 1.54 1.51 -1.26 -1.41 117.35 122.36 3h3j s TYR 271 Ca -0.04 1.09 -0.24 0.00 -1.01 0.00 0.00 57.07 56.88 3h3j s TYR 271 Cb -0.05 -2.56 0.06 0.00 -0.11 0.00 0.00 41.96 39.30 3h3j s TYR 271 CO -0.09 0.33 0.58 -1.50 -1.11 0.00 0.00 175.55 173.75 3h3j s ILE 272 N -0.03 0.01 -0.17 2.71 2.07 -0.70 -4.71 121.20 120.39 3h3j s ILE 272 Ca 0.29 -0.10 -0.29 0.00 -1.41 0.00 0.00 60.65 59.14 3h3j s ILE 272 Cb -0.17 -1.01 -0.02 0.00 0.13 0.00 0.00 42.46 41.39 3h3j s ILE 272 CO 0.15 -0.06 1.39 -0.83 -1.91 0.00 0.00 174.94 173.68 3h3j s GLY 273 N -2.27 1.53 0.06 1.50 0.00 -0.24 -1.95 107.32 105.96 3h3j s GLY 273 Ca -0.03 0.50 -0.07 0.00 0.00 0.00 0.00 44.72 45.13 3h3j s GLY 273 CO -0.06 2.68 0.13 -1.34 0.00 0.00 0.00 173.10 174.51 3h3j s VAL 274 N 3.93 0.15 0.30 1.40 -7.23 -0.05 -0.90 120.40 118.00 3h3j s VAL 274 Ca 0.60 -1.22 -0.29 0.00 -1.81 0.00 0.00 61.98 59.26 3h3j s VAL 274 Cb -0.24 -1.20 -0.10 0.00 0.56 0.00 0.00 36.38 35.40 3h3j s VAL 274 CO 0.20 -0.67 1.41 -2.16 -0.31 0.00 0.00 175.10 173.57 3h3j s PRO 275 N -3.38 4.26 -0.06 4.82 0.04 -1.26 -1.65 135.00 137.77 3h3j s PRO 275 Ca 0.01 2.34 -0.12 0.00 0.04 0.00 0.00 61.00 63.28 3h3j s PRO 275 Cb 0.03 -3.06 0.02 0.00 0.04 0.00 0.00 34.50 31.53 3h3j s PRO 275 CO -0.08 -0.38 0.29 0.00 0.04 0.00 0.00 177.00 176.87 3h3j s ALA 276 N -0.61 -0.72 -0.21 8.56 0.00 -0.24 -0.92 121.76 127.61 3h3j s ALA 276 Ca 0.55 0.54 -0.29 0.00 0.00 0.00 0.00 51.96 52.76 3h3j s ALA 276 Cb -0.42 -0.20 0.00 0.00 0.00 0.00 0.00 23.12 22.49 3h3j s ALA 276 CO 0.51 -0.20 1.14 0.08 0.00 0.00 0.00 175.76 177.29 3h3j s VAL 277 N -0.61 4.50 -0.17 0.00 1.01 -0.47 -1.11 120.40 123.55 3h3j s VAL 277 Ca -0.07 1.80 -0.04 0.00 0.00 0.00 0.00 61.98 63.67 3h3j s VAL 277 Cb -0.04 -4.18 -0.03 0.00 0.00 0.00 0.00 36.38 32.13 3h3j s VAL 277 CO 0.02 -0.18 -0.02 -0.63 0.00 0.00 0.00 175.10 174.29 3h3j s ILE 278 N 3.37 3.98 0.00 2.22 -1.09 0.36 -0.07 121.20 129.96 3h3j s ILE 278 Ca 0.49 -0.32 0.00 0.00 -2.23 0.00 0.00 60.65 58.59 3h3j s ILE 278 Cb -0.18 -2.76 0.00 0.00 -1.58 0.00 0.00 42.46 37.94 3h3j s ILE 278 CO 0.10 0.47 0.00 -0.46 -1.23 0.00 0.00 174.94 173.83 3h3j n ASN 279 N 3.72 0.00 0.31 3.58 0.23 -0.20 -0.67 115.26 122.23 3h3j n ASN 279 Ca -0.17 -0.64 0.18 0.00 -0.53 0.00 0.00 54.58 53.41 3h3j n ASN 279 Cb 0.52 0.00 1.01 0.00 -2.08 0.00 0.00 39.78 39.24 3h3j n ASN 279 CO 0.00 0.00 0.00 -0.09 -0.93 0.00 0.00 177.26 176.24 3h3j h ARG 280 N 0.00 0.00 -0.01 -3.83 9.65 -1.71 0.71 114.38 119.19 3h3j h ARG 280 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3h3j h ARG 280 Cb 0.00 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 3h3j h ARG 280 CO 0.00 0.00 -0.13 0.09 2.80 0.00 0.00 179.97 182.73 3h3j n ASN 281 N -3.57 1.21 0.00 -3.80 4.13 -1.26 -4.94 115.26 107.03 3h3j n ASN 281 Ca -0.03 -1.16 0.00 0.00 1.68 0.00 0.00 54.58 55.08 3h3j n ASN 281 Cb 0.10 0.06 0.00 0.00 -1.54 0.00 0.00 39.78 38.40 3h3j n ASN 281 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3h3j n GLY 282 N 1.26 0.74 3.60 7.41 0.00 0.24 -4.39 105.19 114.05 3h3j n GLY 282 Ca 0.16 -1.45 -0.43 0.00 0.00 0.00 0.00 46.02 44.30 3h3j n GLY 282 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h3j s ILE 283 N 0.00 4.34 0.01 -0.61 1.01 0.90 -1.04 121.20 125.81 3h3j s ILE 283 Ca 0.00 1.16 -0.22 0.00 0.00 0.00 0.00 60.65 61.58 3h3j s ILE 283 Cb 0.00 -4.52 -0.17 0.00 0.01 0.00 0.00 42.46 37.78 3h3j s ILE 283 CO 0.00 -0.87 1.27 -0.09 0.00 0.00 0.00 174.94 175.25 3h3j h ARG 284 N 9.00 0.25 -2.15 2.79 2.43 -0.80 -3.41 114.38 122.50 3h3j h ARG 284 Ca -0.23 -0.16 0.03 0.00 -0.81 0.00 0.00 59.98 58.82 3h3j h ARG 284 Cb 1.07 0.02 -0.18 0.00 -0.42 0.00 0.00 29.97 30.45 3h3j h ARG 284 CO 1.08 0.73 0.37 0.54 -1.51 0.00 0.00 179.97 181.18 3h3j s ASN 285 N -6.09 -0.49 0.27 -3.80 4.22 -1.24 -5.01 114.94 102.80 3h3j s ASN 285 Ca -0.15 0.30 -0.30 0.00 -2.14 0.00 0.00 52.86 50.58 3h3j s ASN 285 Cb 0.04 0.45 -0.09 0.00 1.28 0.00 0.00 41.25 42.92 3h3j s ASN 285 CO 0.74 -0.61 1.05 -0.69 -2.04 0.00 0.00 177.10 175.55 3h3j s VAL 286 N -2.18 3.66 -0.23 3.54 1.01 -1.26 -1.37 120.40 123.57 3h3j s VAL 286 Ca -0.02 1.67 -0.13 0.00 0.00 0.00 0.00 61.98 63.50 3h3j s VAL 286 Cb -0.01 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.27 3h3j s VAL 286 CO -0.02 0.40 0.28 -0.69 0.00 0.00 0.00 175.10 175.07 3h3j s VAL 287 N -1.16 5.27 -0.43 2.92 1.01 -0.10 -4.90 120.40 123.01 3h3j s VAL 287 Ca 0.43 0.44 -0.12 0.00 0.00 0.00 0.00 61.98 62.73 3h3j s VAL 287 Cb -0.30 -3.62 0.06 0.00 0.00 0.00 0.00 36.38 32.52 3h3j s VAL 287 CO 0.38 0.29 0.30 -0.70 0.00 0.00 0.00 175.10 175.37 3h3j s GLU 288 N 1.27 2.83 0.16 2.72 2.12 -1.26 -4.48 118.70 122.05 3h3j s GLU 288 Ca 0.13 -1.28 0.03 0.00 0.36 0.00 0.00 54.97 54.22 3h3j s GLU 288 Cb -0.14 -3.91 -0.04 0.00 0.26 0.00 0.00 34.13 30.30 3h3j s GLU 288 CO 0.07 -0.89 0.24 0.96 -0.54 0.00 0.00 175.26 175.09 3h3j s ILE 289 N 1.56 5.06 0.18 -3.70 -4.36 -1.26 -5.06 121.20 113.63 3h3j s ILE 289 Ca 0.03 -0.82 -0.30 0.00 -0.26 0.00 0.00 60.65 59.29 3h3j s ILE 289 Cb -0.22 -3.61 -0.09 0.00 1.25 0.00 0.00 42.46 39.79 3h3j s ILE 289 CO 0.06 -0.11 1.37 -2.16 0.24 0.00 0.00 174.94 174.34 3h3j s PRO 290 N -3.23 4.34 -0.00 0.37 0.05 -1.26 -5.02 135.00 130.24 3h3j s PRO 290 Ca 0.33 2.12 0.04 0.00 0.05 0.00 0.00 61.00 63.55 3h3j s PRO 290 Cb -0.11 -3.19 -0.03 0.00 0.05 0.00 0.00 34.50 31.22 3h3j s PRO 290 CO 0.27 -0.36 -0.10 -0.51 0.05 0.00 0.00 177.00 176.35 3h3j s LEU 291 N 0.26 3.00 1.03 -3.56 1.43 -1.26 -4.98 118.68 114.59 3h3j s LEU 291 Ca 0.60 -0.20 -0.17 0.00 -1.03 0.00 0.00 54.13 53.33 3h3j s LEU 291 Cb -0.38 -1.71 0.23 0.00 0.03 0.00 0.00 46.19 44.36 3h3j s LEU 291 CO 0.36 0.29 1.30 0.54 0.23 0.00 0.00 176.35 179.07 3h3j s ASN 292 N -1.28 2.52 0.21 2.29 2.20 -1.26 -4.67 114.94 114.95 3h3j s ASN 292 Ca 0.15 0.28 -0.10 0.00 -0.94 0.00 0.00 52.86 52.25 3h3j s ASN 292 Cb -0.11 -0.31 0.16 0.00 -2.00 0.00 0.00 41.25 38.99 3h3j s ASN 292 CO 0.06 -3.10 1.88 0.44 -2.94 0.00 0.00 177.10 173.44 3h3j h ASP 293 N -1.89 0.87 -0.77 3.54 3.32 -2.00 0.17 116.42 119.64 3h3j h ASP 293 Ca -0.44 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 56.54 3h3j h ASP 293 Cb 1.24 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 40.53 3h3j h ASP 293 CO 0.34 0.63 0.33 -0.08 -1.72 0.00 0.00 179.24 178.74 3h3j h GLU 294 N 1.02 1.15 -0.28 3.56 4.81 -1.99 -1.08 114.58 121.77 3h3j h GLU 294 Ca 0.28 -0.20 -0.17 0.00 -0.13 0.00 0.00 59.36 59.14 3h3j h GLU 294 Cb -0.12 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.07 3h3j h GLU 294 CO -0.06 0.92 -0.48 0.93 -0.73 0.00 0.00 179.01 179.59 3h3j h GLU 295 N 1.13 0.82 -0.27 1.92 5.08 -1.73 -1.62 114.58 119.92 3h3j h GLU 295 Ca 0.26 -0.51 0.02 0.00 -1.00 0.00 0.00 59.36 58.13 3h3j h GLU 295 Cb 0.19 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 3h3j h GLU 295 CO -0.02 1.14 0.13 1.96 -1.00 0.00 0.00 179.01 181.22 3h3j h GLN 296 N 0.59 0.27 -0.39 2.33 4.20 -0.56 0.10 115.11 121.65 3h3j h GLN 296 Ca 0.02 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 3h3j h GLN 296 Cb 1.09 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.79 3h3j h GLN 296 CO 0.11 0.18 0.16 0.66 -0.67 0.00 0.00 178.83 179.27 3h3j h SER 297 N 0.28 0.53 -0.58 1.46 4.64 -1.06 -1.81 113.55 117.00 3h3j h SER 297 Ca 0.11 -0.16 -0.10 0.00 -0.47 0.00 0.00 61.79 61.17 3h3j h SER 297 Cb 0.04 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 61.97 3h3j h SER 297 CO -0.08 0.54 -0.05 0.11 -0.87 0.00 0.00 176.83 176.49 3h3j h LYS 298 N 0.48 1.06 -0.50 4.77 1.57 -1.13 -2.31 116.57 120.50 3h3j h LYS 298 Ca 0.13 -0.36 -0.04 0.00 -1.87 0.00 0.00 60.65 58.51 3h3j h LYS 298 Cb 0.17 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 3h3j h LYS 298 CO -0.01 1.06 0.15 0.35 -0.57 0.00 0.00 179.45 180.43 3h3j h PHE 299 N 0.95 0.81 -0.63 -1.35 3.57 -0.65 -0.86 116.94 118.77 3h3j h PHE 299 Ca 0.16 -0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.57 3h3j h PHE 299 Cb 0.61 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 3h3j h PHE 299 CO 0.04 0.71 0.38 0.00 -2.23 0.00 0.00 178.31 177.22 3h3j h ALA 300 N 1.01 0.81 -0.48 2.41 0.00 -1.29 -1.62 119.26 120.10 3h3j h ALA 300 Ca 0.16 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3h3j h ALA 300 Cb 0.28 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3h3j h ALA 300 CO -0.00 0.28 0.13 1.25 0.00 0.00 0.00 179.25 180.91 3h3j h HIS 301 N 0.86 0.72 -0.34 0.00 -0.00 -1.22 -1.24 115.15 113.92 3h3j h HIS 301 Ca 0.23 -0.05 -0.09 0.00 -0.00 0.00 0.00 60.37 60.46 3h3j h HIS 301 Cb -0.03 -0.22 -0.01 0.00 -0.00 0.00 0.00 27.41 27.16 3h3j h HIS 301 CO -0.02 0.60 -0.13 1.03 -0.00 0.00 0.00 177.93 179.41 3h3j h SER 302 N 0.69 0.71 -0.53 3.26 0.87 -0.73 -0.14 113.55 117.68 3h3j h SER 302 Ca 0.16 -0.39 -0.01 0.00 -1.23 0.00 0.00 61.79 60.32 3h3j h SER 302 Cb 0.23 -0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 61.97 3h3j h SER 302 CO -0.01 0.94 0.29 0.00 -0.53 0.00 0.00 176.83 177.52 3h3j h ALA 303 N 0.79 0.69 -0.61 6.23 0.00 -1.11 -1.70 119.26 123.55 3h3j h ALA 303 Ca 0.08 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 3h3j h ALA 303 Cb 0.65 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3h3j h ALA 303 CO 0.04 0.21 0.13 -0.22 0.00 0.00 0.00 179.25 179.41 3h3j h LYS 304 N 0.72 0.99 -0.42 0.00 3.64 -1.06 0.54 116.57 120.98 3h3j h LYS 304 Ca 0.19 -0.25 0.06 0.00 -1.27 0.00 0.00 60.65 59.37 3h3j h LYS 304 Cb 0.05 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 31.70 3h3j h LYS 304 CO -0.03 0.92 0.13 1.15 -2.27 0.00 0.00 179.45 179.34 3h3j h THR 305 N 0.90 0.85 -0.23 1.00 2.02 -0.69 0.11 112.91 116.87 3h3j h THR 305 Ca 0.19 -0.10 -0.05 0.00 0.77 0.00 0.00 66.41 67.22 3h3j h THR 305 Cb 0.38 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 3h3j h THR 305 CO 0.01 0.05 -0.04 -0.07 0.37 0.00 0.00 175.52 175.83 3h3j h LEU 306 N 0.28 0.44 -1.19 2.58 3.38 -1.01 -2.70 115.31 117.09 3h3j h LEU 306 Ca 0.20 -0.36 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 3h3j h LEU 306 Cb 0.20 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 3h3j h LEU 306 CO -0.22 0.69 -0.06 0.11 0.09 0.00 0.00 178.44 179.05 3h3j h LYS 307 N 0.17 0.49 -0.42 1.13 1.57 -0.57 -0.89 116.57 118.05 3h3j h LYS 307 Ca 0.06 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.67 3h3j h LYS 307 Cb 0.49 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 3h3j h LYS 307 CO 0.02 0.56 0.08 -0.44 -0.57 0.00 0.00 179.45 179.11 3h3j h ASP 308 N 0.46 0.65 -0.29 0.86 3.32 -0.74 -1.84 116.42 118.84 3h3j h ASP 308 Ca 0.09 -0.25 -0.11 0.00 0.02 0.00 0.00 57.03 56.78 3h3j h ASP 308 Cb 0.40 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 3h3j h ASP 308 CO 0.02 0.73 -0.21 0.40 -1.72 0.00 0.00 179.24 178.46 3h3j h ILE 309 N 0.55 1.27 -0.49 0.35 2.04 -1.13 -2.73 117.51 117.37 3h3j h ILE 309 Ca 0.13 -1.32 -0.05 0.00 1.00 0.00 0.00 64.86 64.62 3h3j h ILE 309 Cb 0.35 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 3h3j h ILE 309 CO 0.01 0.44 0.10 0.24 0.00 0.00 0.00 178.15 178.93 3h3j h MET 310 N 0.67 0.76 0.00 2.37 2.86 -1.06 -2.37 114.93 118.16 3h3j h MET 310 Ca 0.09 -0.16 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 3h3j h MET 310 Cb 0.72 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.27 3h3j h MET 310 CO 0.06 0.71 0.00 0.00 1.06 0.00 0.00 176.91 178.73 3h3j h ALA 311 N 1.37 1.00 -0.02 6.32 0.00 -1.03 -2.59 119.26 124.31 3h3j h ALA 311 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3h3j h ALA 311 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3h3j h ALA 311 CO 0.00 0.00 -0.37 0.39 0.00 0.00 0.00 179.25 179.27 3h3j n GLU 312 N -2.88 1.45 -2.72 0.00 1.02 -0.94 -4.85 120.64 111.73 3h3j n GLU 312 Ca 0.01 -1.19 -0.42 0.00 -0.02 0.00 0.00 57.16 55.54 3h3j n GLU 312 Cb 0.32 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 30.23 3h3j n GLU 312 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3h3j s ALA 313 N -2.36 3.02 0.47 0.62 0.00 -0.95 -4.90 121.76 117.66 3h3j s ALA 313 Ca 0.20 -1.30 0.14 0.00 0.00 0.00 0.00 51.96 51.00 3h3j s ALA 313 Cb 0.18 -3.95 1.12 0.00 0.00 0.00 0.00 23.12 20.47 3h3j s ALA 313 CO 0.51 -2.74 2.07 1.05 0.00 0.00 0.00 175.76 176.65 3h3j h GLU 314 N 9.58 0.24 0.00 0.00 4.11 -1.88 -0.83 114.58 125.80 3h3j h GLU 314 Ca -0.27 -0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.13 3h3j h GLU 314 Cb 1.06 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 3h3j h GLU 314 CO 1.17 0.16 -0.06 0.93 0.07 0.00 0.00 179.01 181.28 3h3j h GLU 315 N 0.25 0.00 0.00 1.06 3.07 -1.96 0.06 114.58 117.06 3h3j h GLU 315 Ca 0.14 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.00 3h3j h GLU 315 Cb 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 3h3j h GLU 315 CO -0.03 0.06 0.00 1.28 -1.40 0.00 0.00 179.01 178.93 3h3j n LEU 316 N -3.96 0.00 -0.63 1.33 4.77 -0.32 -5.07 117.00 113.12 3h3j n LEU 316 Ca -0.03 0.33 0.08 0.00 -0.03 0.00 0.00 56.01 56.36 3h3j n LEU 316 Cb 0.15 -0.33 0.07 0.00 -2.33 0.00 0.00 43.42 40.98 3h3j n LEU 316 CO 0.30 -0.02 0.50 0.29 -1.33 0.00 0.00 177.39 177.13