#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3keu s GLU 4 N 0.00 0.24 -0.44 3.49 8.01 -1.26 -5.09 118.70 123.66 3keu s GLU 4 Ca 0.00 0.45 -0.08 0.00 0.01 0.00 0.00 54.97 55.34 3keu s GLU 4 Cb 0.00 -0.00 0.10 0.00 -4.31 0.00 0.00 34.13 29.92 3keu s GLU 4 CO 0.00 -0.10 0.28 0.00 0.01 0.00 0.00 175.26 175.45 3keu s ARG 6 N 1.37 3.92 -0.07 0.00 0.52 -1.26 -1.72 118.95 121.72 3keu s ARG 6 Ca 0.04 0.40 0.03 0.00 -0.52 0.00 0.00 55.73 55.68 3keu s ARG 6 Cb -0.24 -3.23 0.00 0.00 0.52 0.00 0.00 34.95 32.00 3keu s ARG 6 CO 0.00 0.67 -0.17 0.08 0.02 0.00 0.00 175.30 175.91 3keu s VAL 7 N -1.01 1.48 -0.36 3.52 1.01 -0.50 -1.58 120.40 122.95 3keu s VAL 7 Ca 0.23 -0.70 -0.10 0.00 0.00 0.00 0.00 61.98 61.41 3keu s VAL 7 Cb -0.16 -1.30 0.03 0.00 0.00 0.00 0.00 36.38 34.94 3keu s VAL 7 CO 0.13 0.43 0.19 -0.22 0.00 0.00 0.00 175.10 175.63 3keu s LEU 8 N 0.38 4.62 -0.27 3.92 2.96 -0.64 -0.19 118.68 129.46 3keu s LEU 8 Ca -0.12 -0.96 -0.04 0.00 -0.22 0.00 0.00 54.13 52.79 3keu s LEU 8 Cb -0.15 -2.01 0.02 0.00 0.50 0.00 0.00 46.19 44.55 3keu s LEU 8 CO 0.05 -0.36 0.00 -0.55 -1.32 0.00 0.00 176.35 174.16 3keu s SER 9 N 1.54 4.69 -0.47 3.68 0.15 -0.26 -0.51 113.70 122.51 3keu s SER 9 Ca 0.02 -0.83 -0.07 0.00 0.70 0.00 0.00 55.95 55.77 3keu s SER 9 Cb -0.19 -1.76 0.12 0.00 -1.71 0.00 0.00 66.02 62.49 3keu s SER 9 CO 0.06 -0.16 0.32 -0.63 1.20 0.00 0.00 173.24 174.03 3keu s ILE 10 N 1.39 3.90 0.28 6.45 1.01 -0.26 -0.86 121.20 133.11 3keu s ILE 10 Ca 0.01 -2.00 -0.10 0.00 0.00 0.00 0.00 60.65 58.56 3keu s ILE 10 Cb -0.17 -3.59 0.00 0.00 0.01 0.00 0.00 42.46 38.71 3keu s ILE 10 CO -0.01 -0.77 0.49 -1.10 0.00 0.00 0.00 174.94 173.55 3keu s GLN 11 N 1.13 1.68 0.83 2.79 -0.21 -0.91 -3.69 119.66 121.28 3keu s GLN 11 Ca 0.08 -1.42 -0.12 0.00 0.02 0.00 0.00 55.36 53.92 3keu s GLN 11 Cb -0.24 0.47 0.09 0.00 1.00 0.00 0.00 33.01 34.33 3keu s GLN 11 CO -0.02 -0.70 1.17 -1.12 -2.12 0.00 0.00 175.29 172.49 3keu s SER 12 N -3.09 3.57 -0.03 5.90 0.01 -1.26 -1.21 113.70 117.59 3keu s SER 12 Ca 0.25 2.23 0.03 0.00 1.31 0.00 0.00 55.95 59.77 3keu s SER 12 Cb -0.01 -2.57 -0.00 0.00 0.21 0.00 0.00 66.02 63.65 3keu s SER 12 CO 0.12 -2.68 -0.13 -2.28 0.41 0.00 0.00 173.24 168.69 3keu s HIS 13 N -2.39 1.24 0.15 2.43 2.46 -0.61 -0.27 115.29 118.30 3keu s HIS 13 Ca 0.69 -0.31 0.08 0.00 0.47 0.00 0.00 55.06 56.00 3keu s HIS 13 Cb -0.25 -0.85 -0.04 0.00 -0.13 0.00 0.00 32.58 31.31 3keu s HIS 13 CO 0.53 -0.10 -0.19 0.14 -2.47 0.00 0.00 174.74 172.65 3keu s VAL 14 N 0.02 1.80 -0.13 0.89 -7.23 -1.26 -1.03 120.40 113.46 3keu s VAL 14 Ca -0.01 -1.86 -0.21 0.00 -1.81 0.00 0.00 61.98 58.09 3keu s VAL 14 Cb -0.09 -1.80 -0.19 0.00 0.56 0.00 0.00 36.38 34.87 3keu s VAL 14 CO 0.01 -0.28 0.55 0.40 -0.31 0.00 0.00 175.10 175.47 3keu h ILE 15 N 3.38 1.30 -3.42 -0.62 2.04 -0.83 -3.44 117.51 115.92 3keu h ILE 15 Ca -0.43 -1.98 -0.62 0.00 1.00 0.00 0.00 64.86 62.83 3keu h ILE 15 Cb 1.20 2.46 -0.16 0.00 -0.74 0.00 0.00 36.82 39.59 3keu h ILE 15 CO 0.49 0.44 -0.54 -0.60 0.00 0.00 0.00 178.15 177.94 3keu s ARG 16 N -2.04 4.01 0.00 2.37 6.06 -0.22 -5.01 118.95 124.11 3keu s ARG 16 Ca -0.14 -0.31 0.00 0.00 -2.50 0.00 0.00 55.73 52.78 3keu s ARG 16 Cb -0.02 -3.37 0.00 0.00 0.06 0.00 0.00 34.95 31.62 3keu s ARG 16 CO 0.50 0.16 0.00 0.41 -2.50 0.00 0.00 175.30 173.87 3keu n GLY 17 N 3.93 -1.57 2.66 8.12 0.00 -1.26 -4.37 105.19 112.69 3keu n GLY 17 Ca -0.16 -2.22 -0.29 0.00 0.00 0.00 0.00 46.02 43.35 3keu n GLY 17 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3keu s TYR 18 N -0.80 1.72 0.07 1.61 1.51 -1.26 -4.85 117.35 115.35 3keu s TYR 18 Ca 0.00 -2.26 0.00 0.00 -1.01 0.00 0.00 57.07 53.80 3keu s TYR 18 Cb 0.00 -1.68 -0.04 0.00 -0.11 0.00 0.00 41.96 40.13 3keu s TYR 18 CO 0.00 -0.79 -0.05 0.14 -1.11 0.00 0.00 175.55 173.74 3keu s VAL 19 N 0.50 0.44 0.00 0.71 -7.23 -1.26 -4.19 120.40 109.37 3keu s VAL 19 Ca 0.18 -1.79 0.00 0.00 -1.81 0.00 0.00 61.98 58.56 3keu s VAL 19 Cb -0.24 -1.49 0.00 0.00 0.56 0.00 0.00 36.38 35.21 3keu s VAL 19 CO 0.00 -0.89 0.00 0.61 -0.31 0.00 0.00 175.10 174.51 3keu n GLY 20 N 0.18 3.15 0.28 2.32 0.00 -1.26 -1.00 105.19 108.85 3keu n GLY 20 Ca -0.14 0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.05 3keu n GLY 20 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3keu h ASN 21 N 0.00 0.00 0.11 1.61 -0.26 -0.85 -0.26 115.58 115.93 3keu h ASN 21 Ca 0.00 0.00 -0.14 0.00 -0.56 0.00 0.00 56.30 55.60 3keu h ASN 21 Cb 0.00 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.25 3keu h ASN 21 CO 0.00 0.00 -0.48 0.03 -1.06 0.00 0.00 177.43 175.92 3keu h ARG 22 N 0.00 0.43 0.00 0.81 2.47 -1.20 -0.35 114.38 116.54 3keu h ARG 22 Ca 0.00 -0.24 -0.16 0.00 -1.26 0.00 0.00 59.98 58.32 3keu h ARG 22 Cb 0.02 0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 28.33 3keu h ARG 22 CO -0.00 0.82 -0.83 0.00 0.56 0.00 0.00 179.97 180.52 3keu h ALA 23 N 1.14 0.56 0.03 0.04 0.00 -1.13 -3.38 119.26 116.52 3keu h ALA 23 Ca 0.02 -0.71 -0.30 0.00 0.00 0.00 0.00 54.91 53.92 3keu h ALA 23 Cb 0.98 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 3keu h ALA 23 CO 0.08 0.93 -1.71 0.00 0.00 0.00 0.00 179.25 178.56 3keu h ALA 24 N 1.29 0.65 0.40 0.00 0.00 -1.01 -3.41 119.26 117.17 3keu h ALA 24 Ca -0.04 -1.39 -0.02 0.00 0.00 0.00 0.00 54.91 53.46 3keu h ALA 24 Cb 1.58 0.48 0.00 0.00 0.00 0.00 0.00 17.79 19.85 3keu h ALA 24 CO 0.09 1.48 -0.19 1.15 0.00 0.00 0.00 179.25 181.78 3keu h THR 25 N 0.02 0.00 -0.63 0.00 2.02 -1.23 -2.88 112.91 110.21 3keu h THR 25 Ca -0.29 -0.36 0.13 0.00 0.77 0.00 0.00 66.41 66.66 3keu h THR 25 Cb 2.00 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 68.30 3keu h THR 25 CO 0.09 0.00 -0.07 0.15 0.37 0.00 0.00 175.52 176.06 3keu h PHE 26 N -0.89 -0.17 -0.23 3.16 3.57 -1.81 0.91 116.94 121.47 3keu h PHE 26 Ca -0.05 0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.53 3keu h PHE 26 Cb 0.41 0.17 -0.04 0.00 2.79 0.00 0.00 35.95 39.29 3keu h PHE 26 CO 0.03 -0.22 -0.00 -1.35 -2.23 0.00 0.00 178.31 174.54 3keu h PRO 27 N 0.06 0.07 -0.66 6.41 0.11 -1.79 0.93 132.00 137.13 3keu h PRO 27 Ca 0.32 -0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.34 3keu h PRO 27 Cb 0.51 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.58 3keu h PRO 27 CO -0.59 0.04 0.09 -0.07 -0.21 0.00 0.00 178.00 177.26 3keu h LEU 28 N 0.07 1.07 -0.63 2.35 3.38 -1.13 -2.17 115.31 118.25 3keu h LEU 28 Ca 0.11 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.78 3keu h LEU 28 Cb 0.14 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 3keu h LEU 28 CO -0.19 1.07 0.26 1.56 0.09 0.00 0.00 178.44 181.23 3keu h GLN 29 N 1.04 0.94 -0.49 1.13 4.20 -0.40 -1.62 115.11 119.91 3keu h GLN 29 Ca 0.20 -0.17 0.03 0.00 0.06 0.00 0.00 58.65 58.78 3keu h GLN 29 Cb 0.47 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.07 3keu h GLN 29 CO 0.02 0.79 0.33 0.28 -0.67 0.00 0.00 178.83 179.57 3keu h VAL 30 N 0.88 1.04 -0.23 -0.54 2.07 -0.62 -0.58 116.25 118.28 3keu h VAL 30 Ca 0.21 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.54 3keu h VAL 30 Cb 0.20 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 3keu h VAL 30 CO -0.02 0.10 0.00 0.18 0.02 0.00 0.00 177.57 177.85 3keu n LEU 31 N -4.47 1.27 0.00 2.57 4.77 -0.69 -4.90 117.00 115.54 3keu n LEU 31 Ca 0.06 -0.62 0.00 0.00 -0.03 0.00 0.00 56.01 55.41 3keu n LEU 31 Cb 0.15 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3keu n LEU 31 CO 0.35 0.31 0.00 0.61 -1.33 0.00 0.00 177.39 177.33 3keu n GLY 32 N 0.90 0.63 3.82 -0.72 0.00 -0.23 -5.06 105.19 104.53 3keu n GLY 32 Ca 0.09 -0.25 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 3keu n GLY 32 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3keu s PHE 33 N -2.00 3.78 -1.26 1.61 0.40 -0.70 -4.75 117.98 115.07 3keu s PHE 33 Ca 0.00 1.22 -0.16 0.00 -0.60 0.00 0.00 56.93 57.39 3keu s PHE 33 Cb 0.00 -2.46 0.11 0.00 0.51 0.00 0.00 43.02 41.18 3keu s PHE 33 CO 0.00 0.59 1.62 -1.21 0.70 0.00 0.00 175.22 176.92 3keu s GLU 34 N -1.16 4.02 -0.09 0.44 0.41 -0.70 -4.25 118.70 117.37 3keu s GLU 34 Ca 0.29 -2.21 -0.18 0.00 -0.41 0.00 0.00 54.97 52.46 3keu s GLU 34 Cb -0.19 -5.36 -0.05 0.00 -1.78 0.00 0.00 34.13 26.75 3keu s GLU 34 CO 0.18 -2.08 0.47 -1.50 -0.49 0.00 0.00 175.26 171.84 3keu s ILE 35 N 3.26 5.15 -0.17 -1.63 2.07 -1.26 -1.42 121.20 127.20 3keu s ILE 35 Ca 0.50 0.94 -0.05 0.00 -1.41 0.00 0.00 60.65 60.63 3keu s ILE 35 Cb 0.01 -3.80 -0.03 0.00 0.13 0.00 0.00 42.46 38.77 3keu s ILE 35 CO 0.05 0.37 0.01 -1.81 -1.91 0.00 0.00 174.94 171.65 3keu s ASP 36 N 0.32 5.14 -0.31 4.50 1.01 0.74 -4.93 116.67 123.15 3keu s ASP 36 Ca 0.26 -0.05 -0.09 0.00 0.71 0.00 0.00 52.55 53.37 3keu s ASP 36 Cb -0.15 -1.86 -0.01 0.00 1.01 0.00 0.00 42.92 41.91 3keu s ASP 36 CO 0.11 0.16 0.15 0.00 0.21 0.00 0.00 175.17 175.80 3keu s ALA 37 N 0.43 3.26 -0.30 5.23 0.00 -1.26 -1.10 121.76 128.01 3keu s ALA 37 Ca -0.01 -1.38 -0.11 0.00 0.00 0.00 0.00 51.96 50.46 3keu s ALA 37 Cb -0.13 -2.36 -0.03 0.00 0.00 0.00 0.00 23.12 20.59 3keu s ALA 37 CO 0.02 -0.89 0.20 0.08 0.00 0.00 0.00 175.76 175.16 3keu s VAL 38 N 1.61 5.17 -0.52 0.00 1.01 -0.04 -5.00 120.40 122.64 3keu s VAL 38 Ca 0.04 -0.05 -0.21 0.00 0.00 0.00 0.00 61.98 61.76 3keu s VAL 38 Cb -0.17 -3.55 0.05 0.00 0.00 0.00 0.00 36.38 32.71 3keu s VAL 38 CO 0.06 0.14 0.76 0.20 0.00 0.00 0.00 175.10 176.26 3keu s ASN 39 N 1.72 6.28 0.61 3.32 0.01 -1.26 -2.15 114.94 123.47 3keu s ASN 39 Ca 0.06 -0.62 0.36 0.00 -0.71 0.00 0.00 52.86 51.96 3keu s ASN 39 Cb -0.17 -2.35 1.95 0.00 0.41 0.00 0.00 41.25 41.09 3keu s ASN 39 CO 0.10 -1.02 2.23 0.77 -1.51 0.00 0.00 177.10 177.67 3keu h SER 40 N 9.11 0.00 -5.07 -1.22 4.64 -1.48 -3.44 113.55 116.09 3keu h SER 40 Ca -0.27 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.04 3keu h SER 40 Cb 1.09 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.08 3keu h SER 40 CO 1.01 0.03 0.07 0.68 -0.87 0.00 0.00 176.83 177.74 3keu s VAL 41 N -4.19 0.02 -0.27 0.95 -7.23 -1.26 -1.55 120.40 106.87 3keu s VAL 41 Ca -0.04 -0.73 -0.03 0.00 -1.81 0.00 0.00 61.98 59.37 3keu s VAL 41 Cb 0.13 -1.57 0.09 0.00 0.56 0.00 0.00 36.38 35.59 3keu s VAL 41 CO 0.49 -0.09 0.10 -1.58 -0.31 0.00 0.00 175.10 173.71 3keu s GLN 42 N -3.87 0.44 0.20 4.82 0.74 -0.39 -1.57 119.66 120.04 3keu s GLN 42 Ca 0.09 -0.68 0.08 0.00 0.05 0.00 0.00 55.36 54.90 3keu s GLN 42 Cb -0.01 -1.65 -0.04 0.00 1.10 0.00 0.00 33.01 32.40 3keu s GLN 42 CO -0.03 -0.93 -0.03 -0.06 -0.55 0.00 0.00 175.29 173.70 3keu s PHE 43 N 1.89 2.74 0.37 1.67 0.40 -0.20 -2.52 117.98 122.33 3keu s PHE 43 Ca 0.07 -0.18 0.04 0.00 -0.60 0.00 0.00 56.93 56.26 3keu s PHE 43 Cb -0.17 -1.30 0.71 0.00 0.51 0.00 0.00 43.02 42.77 3keu s PHE 43 CO -0.26 0.54 2.02 0.66 0.70 0.00 0.00 175.22 178.88 3keu h SER 44 N 2.55 0.65 -5.48 1.36 4.64 -0.89 0.20 113.55 116.58 3keu h SER 44 Ca -0.46 -0.02 0.22 0.00 -0.47 0.00 0.00 61.79 61.06 3keu h SER 44 Cb 1.22 -0.16 -0.08 0.00 -0.31 0.00 0.00 62.40 63.06 3keu h SER 44 CO 0.57 0.47 0.61 0.54 -0.87 0.00 0.00 176.83 178.15 3keu s ASN 45 N -6.53 -0.10 0.75 4.97 2.20 -1.26 -1.06 114.94 113.91 3keu s ASN 45 Ca -0.09 -0.38 -0.12 0.00 -0.94 0.00 0.00 52.86 51.32 3keu s ASN 45 Cb 0.18 0.40 0.04 0.00 -2.00 0.00 0.00 41.25 39.87 3keu s ASN 45 CO 0.75 -0.75 1.11 -1.38 -2.94 0.00 0.00 177.10 173.89 3keu s HIS 46 N -2.80 2.50 -2.00 1.54 -3.43 -1.26 -4.78 115.29 105.05 3keu s HIS 46 Ca 0.15 1.57 0.09 0.00 -0.80 0.00 0.00 55.06 56.07 3keu s HIS 46 Cb 0.00 -3.12 0.51 0.00 -1.43 0.00 0.00 32.58 28.53 3keu s HIS 46 CO 0.01 -1.87 0.98 0.25 -2.00 0.00 0.00 174.74 172.11 3keu n THR 47 N -3.19 0.00 1.09 -5.38 -2.24 -1.26 -2.75 114.28 100.55 3keu n THR 47 Ca 0.10 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 62.02 3keu n THR 47 Cb 0.52 -0.49 0.59 0.00 -2.10 0.00 0.00 70.33 68.86 3keu n THR 47 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3keu n GLY 48 N 0.05 -1.40 3.91 3.38 0.00 -1.26 -4.85 105.19 105.02 3keu n GLY 48 Ca 0.06 -0.15 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 3keu n GLY 48 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3keu s TYR 49 N -2.90 3.36 0.34 1.61 1.51 -1.11 -4.92 117.35 115.23 3keu s TYR 49 Ca 0.17 0.73 0.03 0.00 -1.01 0.00 0.00 57.07 56.99 3keu s TYR 49 Cb 0.19 -2.63 0.64 0.00 -0.11 0.00 0.00 41.96 40.06 3keu s TYR 49 CO 0.54 -0.68 1.95 0.00 -1.11 0.00 0.00 175.55 176.25 3keu h ALA 50 N -0.09 1.61 -2.19 3.71 0.00 -1.91 -3.43 119.26 116.95 3keu h ALA 50 Ca -0.46 -0.03 -0.38 0.00 0.00 0.00 0.00 54.91 54.04 3keu h ALA 50 Cb 1.24 -0.23 -0.14 0.00 0.00 0.00 0.00 17.79 18.65 3keu h ALA 50 CO 0.61 0.28 -0.68 -1.01 0.00 0.00 0.00 179.25 178.45 3keu s HIS 51 N -5.77 1.54 -0.25 0.00 3.76 -1.26 -5.15 115.29 108.16 3keu s HIS 51 Ca -0.10 -0.84 -0.27 0.00 -0.15 0.00 0.00 55.06 53.69 3keu s HIS 51 Cb 0.19 -0.86 0.15 0.00 1.11 0.00 0.00 32.58 33.17 3keu s HIS 51 CO 0.78 0.04 1.17 1.67 -0.85 0.00 0.00 174.74 177.55 3keu s TRP 52 N -3.33 -0.27 0.08 1.40 -2.14 -1.26 -4.88 118.94 108.54 3keu s TRP 52 Ca 0.26 0.58 0.02 0.00 2.66 0.00 0.00 56.10 59.61 3keu s TRP 52 Cb 0.04 0.44 -0.04 0.00 -3.10 0.00 0.00 33.47 30.82 3keu s TRP 52 CO 0.07 -0.18 -0.07 0.15 -2.66 0.00 0.00 176.95 174.26 3keu s LYS 53 N -0.44 0.75 0.00 3.25 -0.14 -1.26 -4.98 119.74 116.91 3keu s LYS 53 Ca 0.04 -1.15 0.00 0.00 -1.36 0.00 0.00 55.97 53.50 3keu s LYS 53 Cb -0.03 -0.27 0.00 0.00 -1.68 0.00 0.00 37.83 35.86 3keu s LYS 53 CO -0.06 0.01 0.00 0.41 -0.76 0.00 0.00 175.35 174.95 3keu n GLY 54 N 0.46 -2.31 3.23 -3.33 0.00 -1.26 -0.18 105.19 101.79 3keu n GLY 54 Ca -0.16 -1.23 -0.17 0.00 0.00 0.00 0.00 46.02 44.47 3keu n GLY 54 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3keu s GLN 55 N -1.92 0.98 0.50 1.61 1.11 -1.05 -5.00 119.66 115.89 3keu s GLN 55 Ca 0.00 -1.24 0.07 0.00 0.01 0.00 0.00 55.36 54.20 3keu s GLN 55 Cb 0.00 -0.78 0.01 0.00 -1.01 0.00 0.00 33.01 31.24 3keu s GLN 55 CO 0.00 0.14 0.39 0.14 0.01 0.00 0.00 175.29 175.97 3keu s VAL 56 N -2.34 2.04 -0.20 1.09 -7.23 -1.26 -1.26 120.40 111.23 3keu s VAL 56 Ca 0.09 -1.45 -0.02 0.00 -1.81 0.00 0.00 61.98 58.79 3keu s VAL 56 Cb -0.04 -2.48 -0.00 0.00 0.56 0.00 0.00 36.38 34.42 3keu s VAL 56 CO 0.02 0.00 -0.09 -0.22 -0.31 0.00 0.00 175.10 174.50 3keu s LEU 57 N -4.22 2.67 0.66 1.32 2.96 -0.60 -4.91 118.68 116.56 3keu s LEU 57 Ca 0.40 -0.46 -0.08 0.00 -0.22 0.00 0.00 54.13 53.77 3keu s LEU 57 Cb -0.02 -1.65 0.02 0.00 0.50 0.00 0.00 46.19 45.04 3keu s LEU 57 CO 0.24 0.00 1.00 0.54 -1.32 0.00 0.00 176.35 176.82 3keu s ASN 58 N 1.31 5.40 0.51 3.68 2.20 -1.26 -4.89 114.94 121.89 3keu s ASN 58 Ca 0.04 0.84 0.20 0.00 -0.94 0.00 0.00 52.86 53.01 3keu s ASN 58 Cb -0.14 -1.70 1.28 0.00 -2.00 0.00 0.00 41.25 38.69 3keu s ASN 58 CO -0.05 -1.27 2.03 0.77 -2.94 0.00 0.00 177.10 175.64 3keu h SER 59 N -0.45 0.08 -0.31 3.54 4.64 -1.93 -1.40 113.55 117.72 3keu h SER 59 Ca -0.45 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 60.70 3keu h SER 59 Cb 1.27 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3keu h SER 59 CO 0.62 0.05 -0.49 0.44 -0.87 0.00 0.00 176.83 176.58 3keu h ASP 60 N 0.09 0.97 -0.29 4.97 3.32 -1.97 -1.83 116.42 121.68 3keu h ASP 60 Ca 0.19 -0.51 -0.09 0.00 0.02 0.00 0.00 57.03 56.64 3keu h ASP 60 Cb 0.65 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 3keu h ASP 60 CO -0.02 1.29 -0.11 -0.33 -1.72 0.00 0.00 179.24 178.36 3keu h GLU 61 N 0.67 0.71 -0.33 3.56 5.08 -1.66 0.22 114.58 122.83 3keu h GLU 61 Ca 0.03 -0.23 -0.03 0.00 -1.00 0.00 0.00 59.36 58.13 3keu h GLU 61 Cb 1.09 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 3keu h GLU 61 CO 0.11 0.80 0.08 1.25 -1.00 0.00 0.00 179.01 180.25 3keu h LEU 62 N 0.65 0.50 -0.74 1.33 5.85 -1.27 -0.61 115.31 121.02 3keu h LEU 62 Ca 0.11 -0.23 -0.06 0.00 0.84 0.00 0.00 57.88 58.54 3keu h LEU 62 Cb 0.56 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 3keu h LEU 62 CO 0.03 0.60 0.22 -0.61 -0.34 0.00 0.00 178.44 178.35 3keu h GLN 63 N 0.37 1.15 -0.18 1.25 4.15 -1.02 -0.74 115.11 120.09 3keu h GLN 63 Ca 0.10 -0.25 0.05 0.00 0.77 0.00 0.00 58.65 59.31 3keu h GLN 63 Cb 0.30 -0.16 -0.05 0.00 0.21 0.00 0.00 27.48 27.78 3keu h GLN 63 CO 0.00 0.99 -0.12 1.49 -1.93 0.00 0.00 178.83 179.26 3keu h GLU 64 N 1.10 -0.11 -0.72 1.69 4.81 -0.22 0.16 114.58 121.29 3keu h GLU 64 Ca 0.24 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.47 3keu h GLU 64 Cb 0.32 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 3keu h GLU 64 CO -0.01 -0.07 0.44 -0.07 -0.73 0.00 0.00 179.01 178.58 3keu h LEU 65 N -0.11 0.85 -1.05 1.64 3.38 -0.68 -1.74 115.31 117.59 3keu h LEU 65 Ca 0.11 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3keu h LEU 65 Cb 0.27 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 3keu h LEU 65 CO -0.25 0.65 0.38 0.22 0.09 0.00 0.00 178.44 179.53 3keu h TYR 66 N 0.98 1.03 -0.88 1.13 3.20 -0.65 -2.56 116.97 119.22 3keu h TYR 66 Ca 0.26 -0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.07 3keu h TYR 66 Cb -0.06 -0.33 -0.04 0.00 1.54 0.00 0.00 36.73 37.85 3keu h TYR 66 CO -0.01 0.74 0.46 0.93 -1.64 0.00 0.00 178.16 178.63 3keu h GLU 67 N 1.05 1.24 -0.76 1.82 4.39 0.04 0.68 114.58 123.05 3keu h GLU 67 Ca 0.26 -0.16 -0.05 0.00 0.34 0.00 0.00 59.36 59.75 3keu h GLU 67 Cb 0.07 -0.23 -0.03 0.00 -0.10 0.00 0.00 28.75 28.45 3keu h GLU 67 CO -0.04 0.93 0.28 0.78 -1.16 0.00 0.00 179.01 179.80 3keu h GLY 68 N 1.24 1.24 0.97 -3.84 0.00 -0.96 0.20 103.07 101.92 3keu h GLY 68 Ca 0.31 -0.69 -0.10 0.00 0.00 0.00 0.00 47.33 46.85 3keu h GLY 68 CO -0.04 0.65 -0.15 1.41 0.00 0.00 0.00 176.54 178.40 3keu h LEU 69 N 1.12 0.75 -0.14 3.11 3.38 -1.05 -2.91 115.31 119.57 3keu h LEU 69 Ca 0.25 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 3keu h LEU 69 Cb 0.25 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 3keu h LEU 69 CO -0.02 0.98 0.06 -0.09 0.09 0.00 0.00 178.44 179.47 3keu h ARG 70 N 0.52 0.21 -0.80 1.13 2.43 -0.55 0.30 114.38 117.61 3keu h ARG 70 Ca 0.08 -0.03 0.21 0.00 -0.81 0.00 0.00 59.98 59.42 3keu h ARG 70 Cb 0.68 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.15 3keu h ARG 70 CO 0.05 0.28 0.56 -0.07 -1.51 0.00 0.00 179.97 179.27 3keu h LEU 71 N 0.08 0.18 -1.77 3.80 3.38 -0.95 0.28 115.31 120.31 3keu h LEU 71 Ca 0.05 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3keu h LEU 71 Cb 0.15 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3keu h LEU 71 CO -0.00 0.08 0.00 0.59 0.09 0.00 0.00 178.44 179.19 3keu n ASN 72 N -4.40 2.67 -3.04 -0.43 3.02 -0.94 -4.94 115.26 107.20 3keu n ASN 72 Ca 0.16 -1.87 -0.20 0.00 -0.03 0.00 0.00 54.58 52.64 3keu n ASN 72 Cb 0.75 -0.15 0.06 0.00 -0.61 0.00 0.00 39.78 39.82 3keu n ASN 72 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3keu n ASN 73 N 0.99 -5.74 -0.98 6.41 4.13 0.97 -4.89 115.26 116.15 3keu n ASN 73 Ca 0.18 -0.41 0.08 0.00 1.68 0.00 0.00 54.58 56.11 3keu n ASN 73 Cb 0.50 -4.41 0.27 0.00 -1.54 0.00 0.00 39.78 34.60 3keu n ASN 73 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 3keu n MET 74 N -4.20 3.12 -1.54 3.52 2.81 0.97 -4.68 117.12 117.12 3keu n MET 74 Ca -0.02 -2.85 -0.31 0.00 -1.81 0.00 0.00 57.70 52.71 3keu n MET 74 Cb 0.57 -1.87 0.00 0.00 -0.71 0.00 0.00 33.22 31.21 3keu n MET 74 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 3keu n ASN 75 N -0.36 6.97 -3.83 7.83 6.94 -1.24 -4.81 115.26 126.76 3keu n ASN 75 Ca 0.22 -3.47 -0.29 0.00 -0.02 0.00 0.00 54.58 51.02 3keu n ASN 75 Cb 0.91 -1.13 -0.16 0.00 -2.36 0.00 0.00 39.78 37.04 3keu n ASN 75 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 3keu s LYS 76 N -2.75 1.12 0.09 -3.83 1.02 -1.26 -4.85 119.74 109.27 3keu s LYS 76 Ca 0.54 -0.76 0.07 0.00 0.02 0.00 0.00 55.97 55.85 3keu s LYS 76 Cb 0.40 -2.34 -0.03 0.00 -0.52 0.00 0.00 37.83 35.34 3keu s LYS 76 CO -0.24 -0.65 -0.19 0.71 -0.92 0.00 0.00 175.35 174.06 3keu s TYR 77 N 1.61 1.65 -0.08 3.18 1.51 -1.26 -4.93 117.35 119.03 3keu s TYR 77 Ca -0.02 -0.42 0.14 0.00 -1.01 0.00 0.00 57.07 55.75 3keu s TYR 77 Cb -0.18 -0.91 -0.11 0.00 -0.11 0.00 0.00 41.96 40.64 3keu s TYR 77 CO -0.08 0.16 1.03 -0.44 -1.11 0.00 0.00 175.55 175.11 3keu h ASP 78 N 4.18 0.00 -5.13 2.29 3.32 -1.66 -3.43 116.42 115.99 3keu h ASP 78 Ca -0.45 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.49 3keu h ASP 78 Cb 1.18 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 40.57 3keu h ASP 78 CO 0.40 0.71 -0.52 -0.31 -1.72 0.00 0.00 179.24 177.80 3keu s TYR 79 N -2.84 0.24 -0.01 4.55 1.51 -0.70 -1.20 117.35 118.90 3keu s TYR 79 Ca -0.01 -0.61 0.03 0.00 -1.01 0.00 0.00 57.07 55.47 3keu s TYR 79 Cb 0.08 -0.17 -0.01 0.00 -0.11 0.00 0.00 41.96 41.76 3keu s TYR 79 CO 0.80 -0.40 -0.10 0.08 -1.11 0.00 0.00 175.55 174.81 3keu s VAL 80 N -3.08 0.84 -0.08 0.71 1.01 -0.82 -1.63 120.40 117.35 3keu s VAL 80 Ca -0.01 -0.44 -0.00 0.00 0.00 0.00 0.00 61.98 61.53 3keu s VAL 80 Cb 0.02 -0.71 0.02 0.00 0.00 0.00 0.00 36.38 35.71 3keu s VAL 80 CO -0.07 0.24 -0.06 -0.22 0.00 0.00 0.00 175.10 175.00 3keu s LEU 81 N -0.15 1.11 0.10 3.92 2.96 0.33 -0.16 118.68 126.80 3keu s LEU 81 Ca 0.02 -0.21 0.04 0.00 -0.22 0.00 0.00 54.13 53.76 3keu s LEU 81 Cb -0.05 -0.66 -0.04 0.00 0.50 0.00 0.00 46.19 45.94 3keu s LEU 81 CO -0.00 -0.11 -0.11 0.42 -1.32 0.00 0.00 176.35 175.23 3keu s THR 82 N 1.49 1.01 0.00 3.68 -4.23 -0.85 -1.11 115.64 115.64 3keu s THR 82 Ca -0.01 -1.67 0.00 0.00 -1.18 0.00 0.00 61.69 58.84 3keu s THR 82 Cb -0.13 -1.41 0.00 0.00 1.34 0.00 0.00 72.50 72.30 3keu s THR 82 CO -0.04 -0.54 0.00 0.61 -0.54 0.00 0.00 174.62 174.10 3keu n GLY 83 N 0.52 4.95 3.71 3.99 0.00 -1.24 -1.65 105.19 115.47 3keu n GLY 83 Ca -0.16 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 3keu n GLY 83 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3keu s TYR 84 N 3.98 2.81 -0.02 1.61 6.14 -1.26 -4.59 117.35 126.01 3keu s TYR 84 Ca 0.00 0.37 -0.02 0.00 0.64 0.00 0.00 57.07 58.06 3keu s TYR 84 Cb 0.00 -4.07 0.01 0.00 0.42 0.00 0.00 41.96 38.32 3keu s TYR 84 CO 0.00 -4.10 0.05 0.99 0.64 0.00 0.00 175.55 173.13 3keu s THR 85 N 1.50 -0.00 -0.02 4.34 2.01 -1.26 -4.62 115.64 117.59 3keu s THR 85 Ca 0.74 0.01 0.16 0.00 0.31 0.00 0.00 61.69 62.91 3keu s THR 85 Cb -0.47 -0.08 -0.24 0.00 0.01 0.00 0.00 72.50 71.72 3keu s THR 85 CO 0.32 0.00 0.34 -1.14 -0.69 0.00 0.00 174.62 173.46 3keu n ARG 86 N 3.10 0.49 -3.50 4.92 0.63 -1.26 -4.94 116.66 116.11 3keu n ARG 86 Ca -0.13 -0.14 -0.38 0.00 -0.92 0.00 0.00 57.85 56.29 3keu n ARG 86 Cb 0.59 -1.37 -0.09 0.00 0.45 0.00 0.00 32.46 32.05 3keu n ARG 86 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 3keu s ASP 87 N -3.82 6.28 0.18 6.15 2.15 -1.26 -4.52 116.67 121.84 3keu s ASP 87 Ca -0.06 0.32 -0.11 0.00 0.43 0.00 0.00 52.55 53.14 3keu s ASP 87 Cb 0.10 -2.18 0.10 0.00 -0.30 0.00 0.00 42.92 40.64 3keu s ASP 87 CO 0.65 -0.04 1.74 0.50 -0.17 0.00 0.00 175.17 177.85 3keu h LYS 88 N 7.55 0.98 -0.34 4.34 3.64 -1.96 -2.13 116.57 128.66 3keu h LYS 88 Ca -0.36 -0.18 0.01 0.00 -1.27 0.00 0.00 60.65 58.85 3keu h LYS 88 Cb 1.17 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.81 3keu h LYS 88 CO 0.68 0.83 0.21 1.03 -2.27 0.00 0.00 179.45 179.92 3keu h SER 89 N 0.92 0.35 -0.06 4.20 0.87 -1.99 -1.30 113.55 116.54 3keu h SER 89 Ca 0.22 -0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.80 3keu h SER 89 Cb 0.21 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.07 3keu h SER 89 CO -0.02 0.25 -0.07 0.15 -0.53 0.00 0.00 176.83 176.61 3keu h PHE 90 N 0.42 -0.18 -0.88 2.24 3.57 -1.89 -0.63 116.94 119.60 3keu h PHE 90 Ca 0.13 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.67 3keu h PHE 90 Cb -0.02 0.09 -0.05 0.00 2.79 0.00 0.00 35.95 38.76 3keu h PHE 90 CO -0.07 -0.11 0.57 1.25 -2.23 0.00 0.00 178.31 177.72 3keu h LEU 91 N -0.10 0.94 -0.46 0.59 5.85 -1.14 0.20 115.31 121.19 3keu h LEU 91 Ca 0.05 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 3keu h LEU 91 Cb 0.17 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 3keu h LEU 91 CO -0.12 0.65 0.18 0.00 -0.34 0.00 0.00 178.44 178.80 3keu h ALA 92 N 1.36 0.60 -0.90 1.25 0.00 -0.89 -0.35 119.26 120.33 3keu h ALA 92 Ca 0.35 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3keu h ALA 92 Cb -0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 3keu h ALA 92 CO -0.11 0.21 0.52 1.98 0.00 0.00 0.00 179.25 181.85 3keu h MET 93 N 0.60 1.24 -0.64 0.00 1.85 -0.38 -1.47 114.93 116.12 3keu h MET 93 Ca 0.15 -0.13 0.03 0.00 -0.61 0.00 0.00 59.70 59.15 3keu h MET 93 Cb 0.21 -0.25 -0.04 0.00 0.43 0.00 0.00 31.60 31.94 3keu h MET 93 CO -0.01 0.88 0.39 0.28 -0.40 0.00 0.00 176.91 178.05 3keu h VAL 94 N 1.25 1.07 -0.54 -5.77 2.07 -0.03 -1.96 116.25 112.35 3keu h VAL 94 Ca 0.32 -0.26 0.03 0.00 0.82 0.00 0.00 66.70 67.61 3keu h VAL 94 Cb -0.02 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 29.95 3keu h VAL 94 CO -0.06 0.14 0.31 0.58 0.02 0.00 0.00 177.57 178.56 3keu h VAL 95 N 0.77 1.03 -0.91 2.57 2.07 -0.23 -0.80 116.25 120.75 3keu h VAL 95 Ca 0.26 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 3keu h VAL 95 Cb 0.04 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 30.13 3keu h VAL 95 CO -0.11 0.11 0.54 0.44 0.02 0.00 0.00 177.57 178.56 3keu h ASP 96 N 0.61 1.11 -0.23 0.57 3.32 -0.87 -1.10 116.42 119.83 3keu h ASP 96 Ca 0.22 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 3keu h ASP 96 Cb 0.06 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 3keu h ASP 96 CO -0.11 0.86 0.10 0.40 -1.72 0.00 0.00 179.24 178.77 3keu h ILE 97 N 1.26 1.15 -0.40 0.35 2.04 -0.73 -0.95 117.51 120.22 3keu h ILE 97 Ca 0.33 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 3keu h ILE 97 Cb -0.03 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 3keu h ILE 97 CO -0.06 0.15 0.20 0.58 0.00 0.00 0.00 178.15 179.02 3keu h VAL 98 N 0.23 1.17 -0.43 1.67 2.07 -0.90 0.36 116.25 120.42 3keu h VAL 98 Ca 0.08 -0.47 0.08 0.00 0.82 0.00 0.00 66.70 67.21 3keu h VAL 98 Cb 0.15 0.74 -0.07 0.00 -1.52 0.00 0.00 31.29 30.58 3keu h VAL 98 CO -0.01 0.18 -0.02 1.56 0.02 0.00 0.00 177.57 179.30 3keu h GLN 99 N 0.51 0.08 0.07 1.57 4.20 -1.06 0.54 115.11 121.03 3keu h GLN 99 Ca 0.14 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 3keu h GLN 99 Cb 0.10 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.86 3keu h GLN 99 CO -0.02 0.06 -0.03 1.49 -0.67 0.00 0.00 178.83 179.66 3keu h GLU 100 N 0.09 -0.09 -0.22 1.46 4.57 -0.65 -1.16 114.58 118.59 3keu h GLU 100 Ca 0.21 0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.39 3keu h GLU 100 Cb 0.31 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.91 3keu h GLU 100 CO -0.37 0.01 0.11 -0.07 -1.18 0.00 0.00 179.01 177.50 3keu h LEU 101 N -0.16 0.26 -0.60 1.64 3.38 0.47 0.41 115.31 120.70 3keu h LEU 101 Ca -0.01 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 3keu h LEU 101 Cb 0.13 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3keu h LEU 101 CO 0.01 0.22 -0.42 0.11 0.09 0.00 0.00 178.44 178.46 3keu h LYS 102 N 0.30 0.63 -0.01 1.13 1.57 0.48 0.14 116.57 120.81 3keu h LYS 102 Ca 0.08 -0.33 -0.12 0.00 -1.87 0.00 0.00 60.65 58.41 3keu h LYS 102 Cb 0.03 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 3keu h LYS 102 CO -0.01 0.94 -0.53 1.96 -0.57 0.00 0.00 179.45 181.23 3keu h GLN 103 N 0.51 0.04 -0.09 3.15 4.20 -0.22 -1.04 115.11 121.66 3keu h GLN 103 Ca 0.04 -0.02 -0.15 0.00 0.06 0.00 0.00 58.65 58.57 3keu h GLN 103 Cb 0.95 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.72 3keu h GLN 103 CO 0.09 0.56 -0.62 0.37 -0.67 0.00 0.00 178.83 178.56 3keu h GLN 104 N 0.03 0.31 -1.90 1.46 5.75 -0.55 -3.40 115.11 116.81 3keu h GLN 104 Ca -0.00 -0.22 -0.37 0.00 -0.15 0.00 0.00 58.65 57.91 3keu h GLN 104 Cb 0.95 0.03 -0.30 0.00 1.07 0.00 0.00 27.48 29.23 3keu h GLN 104 CO 0.07 0.83 -0.69 1.21 -2.65 0.00 0.00 178.83 177.60 3keu s ASN 105 N -6.91 0.97 0.52 -0.69 2.47 0.45 -5.02 114.94 106.72 3keu s ASN 105 Ca -0.05 -1.69 0.41 0.00 0.42 0.00 0.00 52.86 51.95 3keu s ASN 105 Cb 0.12 0.60 1.59 0.00 -1.45 0.00 0.00 41.25 42.11 3keu s ASN 105 CO 0.81 -0.24 1.67 -0.65 -3.72 0.00 0.00 177.10 174.97 3keu h PRO 106 N 6.84 0.04 -0.06 0.43 0.11 -1.44 0.26 132.00 138.17 3keu h PRO 106 Ca 0.07 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 3keu h PRO 106 Cb 1.05 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3keu h PRO 106 CO 0.20 0.02 0.00 0.54 -0.21 0.00 0.00 178.00 178.55 3keu n ARG 107 N -4.20 1.25 -1.84 1.05 1.74 -1.26 -4.90 116.66 108.49 3keu n ARG 107 Ca 0.36 -0.37 -0.42 0.00 -0.77 0.00 0.00 57.85 56.65 3keu n ARG 107 Cb 1.60 -1.30 -0.02 0.00 -1.02 0.00 0.00 32.46 31.72 3keu n ARG 107 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3keu s LEU 108 N -1.52 4.36 -0.29 0.55 0.20 0.90 -4.96 118.68 117.92 3keu s LEU 108 Ca 0.27 2.84 -0.10 0.00 0.69 0.00 0.00 54.13 57.84 3keu s LEU 108 Cb 0.13 -3.62 -0.02 0.00 -0.43 0.00 0.00 46.19 42.25 3keu s LEU 108 CO 0.21 -0.87 0.15 -0.69 -0.29 0.00 0.00 176.35 174.86 3keu s VAL 109 N 0.29 4.72 -0.34 1.68 1.01 -0.34 -4.97 120.40 122.43 3keu s VAL 109 Ca 0.65 -0.24 -0.16 0.00 0.00 0.00 0.00 61.98 62.22 3keu s VAL 109 Cb -0.46 -3.33 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 3keu s VAL 109 CO 0.43 0.15 0.43 -0.47 0.00 0.00 0.00 175.10 175.64 3keu s TYR 110 N 1.65 3.20 -0.47 5.22 5.04 -1.26 -1.94 117.35 128.78 3keu s TYR 110 Ca 0.06 0.07 -0.16 0.00 -2.44 0.00 0.00 57.07 54.59 3keu s TYR 110 Cb -0.16 -2.77 0.06 0.00 0.35 0.00 0.00 41.96 39.44 3keu s TYR 110 CO 0.07 -0.47 0.42 0.08 -1.34 0.00 0.00 175.55 174.31 3keu s VAL 111 N 2.17 5.17 -0.22 3.14 1.01 0.77 -0.93 120.40 131.51 3keu s VAL 111 Ca 0.15 -0.90 -0.07 0.00 0.00 0.00 0.00 61.98 61.17 3keu s VAL 111 Cb -0.16 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.06 3keu s VAL 111 CO 0.12 -0.58 0.05 0.00 0.00 0.00 0.00 175.10 174.69 3keu s ASP 113 N 1.25 5.94 -1.03 0.00 2.15 -0.66 -2.35 116.67 121.97 3keu s ASP 113 Ca 0.04 -1.64 -0.17 0.00 0.43 0.00 0.00 52.55 51.21 3keu s ASP 113 Cb -0.15 -2.11 -0.08 0.00 -0.30 0.00 0.00 42.92 40.28 3keu s ASP 113 CO 0.03 -0.70 2.09 -0.81 -0.17 0.00 0.00 175.17 175.60 3keu n PRO 114 N 5.08 2.07 -2.11 4.34 -0.04 -1.26 -4.30 135.00 138.78 3keu n PRO 114 Ca -0.11 -2.05 -0.43 0.00 -0.04 0.00 0.00 63.50 60.87 3keu n PRO 114 Cb 0.42 -2.98 -0.03 0.00 -0.04 0.00 0.00 33.50 30.88 3keu n PRO 114 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3keu s VAL 115 N 4.16 3.70 0.00 0.52 1.01 -1.26 -4.79 120.40 123.74 3keu s VAL 115 Ca 0.53 0.79 0.00 0.00 0.00 0.00 0.00 61.98 63.30 3keu s VAL 115 Cb 0.14 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.82 3keu s VAL 115 CO 0.03 -0.28 0.00 0.18 0.00 0.00 0.00 175.10 175.03 3keu n LEU 116 N 8.35 0.00 0.00 3.92 4.77 -1.26 -4.71 117.00 128.07 3keu n LEU 116 Ca 0.19 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 3keu n LEU 116 Cb 0.45 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 3keu n LEU 116 CO 0.64 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 3keu n GLY 117 N 1.79 -0.84 3.80 -0.72 0.00 -1.26 -0.95 105.19 107.00 3keu n GLY 117 Ca 0.00 -0.98 -0.08 0.00 0.00 0.00 0.00 46.02 44.96 3keu n GLY 117 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3keu s ASP 118 N -4.00 -0.21 -0.12 1.61 -1.08 -0.61 -4.65 116.67 107.62 3keu s ASP 118 Ca 0.00 -0.70 -0.05 0.00 -0.52 0.00 0.00 52.55 51.27 3keu s ASP 118 Cb 0.00 0.70 -0.04 0.00 -1.46 0.00 0.00 42.92 42.12 3keu s ASP 118 CO 0.00 -1.31 0.08 -0.54 0.52 0.00 0.00 175.17 173.92 3keu s LYS 119 N -3.89 3.38 0.00 4.34 1.02 -1.26 -0.30 119.74 123.03 3keu s LYS 119 Ca 0.14 -0.25 0.00 0.00 0.02 0.00 0.00 55.97 55.88 3keu s LYS 119 Cb -0.05 -3.07 0.00 0.00 -0.52 0.00 0.00 37.83 34.20 3keu s LYS 119 CO 0.08 0.68 0.00 1.87 -0.92 0.00 0.00 175.35 177.05 3keu n TRP 120 N 2.27 0.00 -0.02 3.18 -0.00 -1.23 -4.82 117.44 116.83 3keu n TRP 120 Ca -0.19 0.00 -0.16 0.00 -0.00 0.00 0.00 57.50 57.15 3keu n TRP 120 Cb 0.54 0.00 -0.12 0.00 -0.00 0.00 0.00 31.31 31.73 3keu n TRP 120 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 177.69 177.91 3keu h ASP 121 N 0.00 0.25 0.00 5.87 1.82 -2.02 -3.47 116.42 118.87 3keu h ASP 121 Ca 0.00 -0.82 0.00 0.00 -0.39 0.00 0.00 57.03 55.82 3keu h ASP 121 Cb 0.00 -0.08 0.00 0.00 0.68 0.00 0.00 39.33 39.93 3keu h ASP 121 CO 0.00 1.04 0.00 0.61 -1.61 0.00 0.00 179.24 179.28 3keu n GLY 122 N 1.19 -0.04 3.91 -0.78 0.00 -1.26 -5.10 105.19 103.11 3keu n GLY 122 Ca -0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 3keu n GLY 122 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3keu s GLU 123 N -0.46 3.54 0.36 1.61 0.41 -1.26 -4.89 118.70 118.01 3keu s GLU 123 Ca 0.00 -0.25 0.03 0.00 -0.41 0.00 0.00 54.97 54.34 3keu s GLU 123 Cb 0.00 -2.92 0.03 0.00 -1.78 0.00 0.00 34.13 29.46 3keu s GLU 123 CO 0.00 0.52 0.25 0.41 -0.49 0.00 0.00 175.26 175.95 3keu n GLY 124 N 0.12 2.91 3.16 -1.39 0.00 -1.26 -3.49 105.19 105.24 3keu n GLY 124 Ca -0.04 -2.26 -0.13 0.00 0.00 0.00 0.00 46.02 43.60 3keu n GLY 124 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3keu s SER 125 N -3.10 1.24 0.47 1.61 1.04 0.59 -4.88 113.70 110.67 3keu s SER 125 Ca 0.19 -0.86 -0.15 0.00 0.48 0.00 0.00 55.95 55.61 3keu s SER 125 Cb -0.02 0.05 -0.08 0.00 0.10 0.00 0.00 66.02 66.08 3keu s SER 125 CO 0.12 -0.34 0.91 -0.04 0.98 0.00 0.00 173.24 174.86 3keu s MET 126 N -3.08 3.91 -0.23 4.02 -1.94 -1.26 -1.58 119.30 119.14 3keu s MET 126 Ca 0.06 0.80 0.21 0.00 -1.71 0.00 0.00 55.69 55.05 3keu s MET 126 Cb -0.00 -2.23 0.49 0.00 2.01 0.00 0.00 34.83 35.10 3keu s MET 126 CO -0.02 -0.17 1.13 2.48 -0.01 0.00 0.00 175.02 178.44 3keu n TYR 127 N -1.40 1.27 -3.86 -0.03 0.18 -0.13 -4.92 117.16 108.28 3keu n TYR 127 Ca 0.05 -1.92 -0.11 0.00 1.88 0.00 0.00 57.90 57.80 3keu n TYR 127 Cb 0.54 -0.24 -0.11 0.00 -0.38 0.00 0.00 39.34 39.15 3keu n TYR 127 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 3keu s VAL 128 N -3.41 0.05 0.39 -3.48 1.01 -1.23 -4.95 120.40 108.79 3keu s VAL 128 Ca 0.32 -0.42 -0.26 0.00 0.00 0.00 0.00 61.98 61.61 3keu s VAL 128 Cb 0.34 -0.32 -0.11 0.00 0.00 0.00 0.00 36.38 36.30 3keu s VAL 128 CO -0.05 -0.23 1.24 -2.65 0.00 0.00 0.00 175.10 173.41 3keu n PRO 129 N 2.12 1.90 -0.05 2.72 -0.02 -1.26 -4.88 135.00 135.53 3keu n PRO 129 Ca -0.19 0.67 0.03 0.00 -2.02 0.00 0.00 63.50 61.99 3keu n PRO 129 Cb 0.57 -2.31 0.37 0.00 -0.02 0.00 0.00 33.50 32.11 3keu n PRO 129 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3keu h GLU 130 N 2.15 0.64 0.00 -0.52 5.08 -1.99 -2.66 114.58 117.28 3keu h GLU 130 Ca -0.47 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 3keu h GLU 130 Cb 1.30 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.41 3keu h GLU 130 CO 0.60 0.45 0.09 -0.40 -1.00 0.00 0.00 179.01 178.76 3keu n ASP 131 N -4.44 0.00 0.10 1.42 5.75 -1.26 -1.49 116.55 116.63 3keu n ASP 131 Ca 0.04 0.38 -0.18 0.00 -0.01 0.00 0.00 54.79 55.02 3keu n ASP 131 Cb 0.08 -0.38 -0.11 0.00 -1.03 0.00 0.00 41.12 39.67 3keu n ASP 131 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 3keu h LEU 132 N 0.00 0.64 -0.58 -2.12 5.85 -1.84 -3.35 115.31 113.91 3keu h LEU 132 Ca 0.00 -0.61 0.11 0.00 0.84 0.00 0.00 57.88 58.22 3keu h LEU 132 Cb 0.19 -0.20 -0.09 0.00 0.37 0.00 0.00 40.66 40.93 3keu h LEU 132 CO 0.00 1.44 0.06 0.25 -0.34 0.00 0.00 178.44 179.86 3keu h LEU 133 N 0.18 -0.12 -1.11 2.25 5.85 -1.47 -0.98 115.31 119.91 3keu h LEU 133 Ca -0.15 0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.72 3keu h LEU 133 Cb 1.88 0.20 -0.05 0.00 0.37 0.00 0.00 40.66 43.06 3keu h LEU 133 CO 0.21 -0.05 0.61 -0.65 -0.34 0.00 0.00 178.44 178.22 3keu h PRO 134 N 0.18 1.15 -0.56 5.25 0.11 -1.75 0.04 132.00 136.42 3keu h PRO 134 Ca 0.30 -0.07 -0.11 0.00 0.11 0.00 0.00 66.00 66.24 3keu h PRO 134 Cb 0.47 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 31.30 3keu h PRO 134 CO -0.44 0.76 -0.06 0.28 -0.21 0.00 0.00 178.00 178.32 3keu h VAL 135 N 1.18 1.27 -0.33 3.15 2.07 -1.38 0.35 116.25 122.55 3keu h VAL 135 Ca 0.36 -1.22 -0.02 0.00 0.82 0.00 0.00 66.70 66.64 3keu h VAL 135 Cb -0.02 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 3keu h VAL 135 CO -0.10 0.43 0.14 1.88 0.02 0.00 0.00 177.57 179.95 3keu h TYR 136 N 0.92 0.50 -0.29 1.57 0.05 -0.64 0.92 116.97 120.00 3keu h TYR 136 Ca 0.15 -0.03 -0.07 0.00 0.05 0.00 0.00 58.73 58.83 3keu h TYR 136 Cb 0.63 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 38.21 3keu h TYR 136 CO 0.04 0.46 -0.09 0.87 -1.05 0.00 0.00 178.16 178.39 3keu h LYS 137 N 0.40 0.57 0.15 4.88 1.57 -0.80 0.18 116.57 123.51 3keu h LYS 137 Ca 0.11 -0.23 -0.34 0.00 -1.87 0.00 0.00 60.65 58.32 3keu h LYS 137 Cb 0.16 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.44 3keu h LYS 137 CO -0.01 0.78 -1.73 0.93 -0.57 0.00 0.00 179.45 178.85 3keu h GLU 138 N 0.33 0.32 0.00 3.15 5.08 -0.26 -3.40 114.58 119.80 3keu h GLU 138 Ca 0.07 -0.55 -0.22 0.00 -1.00 0.00 0.00 59.36 57.66 3keu h GLU 138 Cb 0.59 0.20 -0.03 0.00 0.50 0.00 0.00 28.75 30.01 3keu h GLU 138 CO 0.03 1.21 -1.65 1.63 -1.00 0.00 0.00 179.01 179.23 3keu n LYS 139 N -3.51 0.39 0.23 2.33 4.76 0.30 -4.67 118.16 117.98 3keu n LYS 139 Ca -0.23 0.17 -0.09 0.00 -2.87 0.00 0.00 58.31 55.28 3keu n LYS 139 Cb 1.06 -1.16 -0.04 0.00 -1.84 0.00 0.00 35.03 33.05 3keu n LYS 139 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 3keu h VAL 140 N -0.68 0.00 -0.98 -0.18 2.07 -0.90 -3.28 116.25 112.32 3keu h VAL 140 Ca -0.34 -0.21 0.09 0.00 0.82 0.00 0.00 66.70 67.06 3keu h VAL 140 Cb 1.20 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.90 3keu h VAL 140 CO -0.21 0.00 0.62 0.58 0.02 0.00 0.00 177.57 178.58 3keu h VAL 141 N -0.82 0.99 0.00 2.57 2.07 -0.90 -0.51 116.25 119.65 3keu h VAL 141 Ca -0.06 -0.36 -0.01 0.00 0.82 0.00 0.00 66.70 67.09 3keu h VAL 141 Cb 0.47 -0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.09 3keu h VAL 141 CO 0.10 0.19 -0.06 -0.65 0.02 0.00 0.00 177.57 177.18 3keu h PRO 142 N 1.04 0.00 0.00 1.57 0.11 -1.69 -1.98 132.00 131.05 3keu h PRO 142 Ca 0.46 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 66.38 3keu h PRO 142 Cb 0.33 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.42 3keu h PRO 142 CO -0.22 0.06 -1.03 -0.07 -0.21 0.00 0.00 178.00 176.53 3keu h LEU 143 N 0.00 0.00 -9.94 2.35 3.38 -1.17 -3.44 115.31 106.49 3keu h LEU 143 Ca -0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 3keu h LEU 143 Cb 0.14 0.00 0.08 0.00 0.09 0.00 0.00 40.66 40.97 3keu h LEU 143 CO 0.01 0.82 0.63 0.00 0.09 0.00 0.00 178.44 179.99 3keu s ALA 144 N -2.78 3.30 -0.15 1.53 0.00 -0.74 -4.78 121.76 118.13 3keu s ALA 144 Ca 0.00 1.27 0.19 0.00 0.00 0.00 0.00 51.96 53.42 3keu s ALA 144 Cb 0.09 -3.50 -0.27 0.00 0.00 0.00 0.00 23.12 19.44 3keu s ALA 144 CO 0.80 -0.84 0.18 -0.25 0.00 0.00 0.00 175.76 175.65 3keu n ASP 145 N 0.20 0.07 -3.79 0.00 9.92 -0.11 -3.04 116.55 119.80 3keu n ASP 145 Ca 0.03 0.00 -0.17 0.00 -0.53 0.00 0.00 54.79 54.12 3keu n ASP 145 Cb 0.43 1.27 -0.16 0.00 -0.64 0.00 0.00 41.12 42.01 3keu n ASP 145 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3keu s ILE 146 N -2.77 0.12 0.08 0.53 1.01 -0.85 -1.96 121.20 117.36 3keu s ILE 146 Ca -0.09 0.15 0.07 0.00 0.00 0.00 0.00 60.65 60.78 3keu s ILE 146 Cb 0.08 -0.24 -0.03 0.00 0.01 0.00 0.00 42.46 42.28 3keu s ILE 146 CO 0.84 0.15 -0.19 0.27 0.00 0.00 0.00 174.94 176.00 3keu s ILE 147 N 1.22 1.58 -0.48 2.92 -4.36 -0.29 -0.73 121.20 121.06 3keu s ILE 147 Ca -0.07 -1.40 0.08 0.00 -0.26 0.00 0.00 60.65 59.00 3keu s ILE 147 Cb -0.13 -1.43 0.37 0.00 1.25 0.00 0.00 42.46 42.52 3keu s ILE 147 CO -0.02 -0.02 0.95 0.35 0.24 0.00 0.00 174.94 176.43 3keu n THR 148 N 1.34 2.07 -1.88 8.37 -2.24 -0.99 -2.00 114.28 118.94 3keu n THR 148 Ca -0.19 -4.98 -0.31 0.00 -2.27 0.00 0.00 64.05 56.30 3keu n THR 148 Cb 0.54 -0.94 0.01 0.00 -2.10 0.00 0.00 70.33 67.84 3keu n THR 148 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3keu s PRO 149 N -3.25 3.56 0.72 -0.78 0.04 -1.18 -4.59 135.00 129.51 3keu s PRO 149 Ca 0.45 0.79 -0.02 0.00 0.04 0.00 0.00 61.00 62.25 3keu s PRO 149 Cb 0.34 -2.07 0.12 0.00 0.04 0.00 0.00 34.50 32.93 3keu s PRO 149 CO -0.12 -0.60 1.00 0.54 0.04 0.00 0.00 177.00 177.85 3keu s ASN 150 N -4.07 4.37 0.15 6.66 2.20 -1.26 -1.28 114.94 121.71 3keu s ASN 150 Ca 0.56 -0.23 -0.23 0.00 -0.94 0.00 0.00 52.86 52.01 3keu s ASN 150 Cb -0.11 -0.19 0.03 0.00 -2.00 0.00 0.00 41.25 38.98 3keu s ASN 150 CO 0.53 -1.85 1.61 -0.61 -2.94 0.00 0.00 177.10 173.84 3keu h GLN 151 N -0.56 -0.28 -0.35 3.55 4.15 -1.00 -0.90 115.11 119.72 3keu h GLN 151 Ca -0.38 0.02 0.08 0.00 0.77 0.00 0.00 58.65 59.13 3keu h GLN 151 Cb 1.27 0.06 -0.08 0.00 0.21 0.00 0.00 27.48 28.95 3keu h GLN 151 CO 0.42 -0.18 -0.16 0.35 -1.93 0.00 0.00 178.83 177.33 3keu h PHE 152 N -0.29 -0.39 -0.70 3.99 3.57 -1.91 -1.25 116.94 119.96 3keu h PHE 152 Ca 0.14 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.64 3keu h PHE 152 Cb 0.52 0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.46 3keu h PHE 152 CO -0.47 -0.24 0.28 0.93 -2.23 0.00 0.00 178.31 176.59 3keu h GLU 153 N -0.10 1.03 -0.04 1.11 5.08 -1.70 -0.98 114.58 118.98 3keu h GLU 153 Ca 0.18 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 3keu h GLU 153 Cb 0.37 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 3keu h GLU 153 CO -0.42 0.83 -0.16 0.00 -1.00 0.00 0.00 179.01 178.27 3keu h ALA 154 N 1.30 1.67 -0.02 3.43 0.00 -0.37 -0.61 119.26 124.65 3keu h ALA 154 Ca 0.24 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 3keu h ALA 154 Cb 0.19 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.94 3keu h ALA 154 CO -0.02 0.25 -0.44 0.93 0.00 0.00 0.00 179.25 179.96 3keu h GLU 155 N 0.06 0.33 -0.59 0.00 5.08 -0.63 -2.67 114.58 116.16 3keu h GLU 155 Ca 0.01 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.03 3keu h GLU 155 Cb 0.32 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.63 3keu h GLU 155 CO 0.02 1.01 0.32 -0.07 -1.00 0.00 0.00 179.01 179.30 3keu h LEU 156 N -0.22 0.73 -0.51 1.33 3.38 -0.92 0.68 115.31 119.78 3keu h LEU 156 Ca -0.05 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.83 3keu h LEU 156 Cb 1.15 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.72 3keu h LEU 156 CO 0.09 0.61 0.00 0.18 0.09 0.00 0.00 178.44 179.41 3keu n LEU 157 N -4.59 0.75 -0.01 1.67 4.77 -0.26 -3.50 117.00 115.82 3keu n LEU 157 Ca 0.04 0.65 0.02 0.00 -0.03 0.00 0.00 56.01 56.68 3keu n LEU 157 Cb 0.08 -0.50 -0.06 0.00 -2.33 0.00 0.00 43.42 40.61 3keu n LEU 157 CO 0.37 -0.46 -0.64 -1.54 -1.33 0.00 0.00 177.39 173.79 3keu n SER 158 N -2.28 3.06 0.00 -1.43 3.41 -0.94 -4.97 113.62 110.47 3keu n SER 158 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 3keu n SER 158 Cb 0.30 1.20 0.00 0.00 -0.26 0.00 0.00 64.21 65.45 3keu n SER 158 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3keu n GLY 159 N 2.15 0.84 3.49 5.00 0.00 0.23 -5.02 105.19 111.89 3keu n GLY 159 Ca -0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 3keu n GLY 159 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3keu s ARG 160 N -0.12 2.46 0.37 1.61 0.52 -1.15 -5.02 118.95 117.62 3keu s ARG 160 Ca 0.00 -0.73 -0.21 0.00 -0.52 0.00 0.00 55.73 54.27 3keu s ARG 160 Cb 0.00 -2.38 -0.10 0.00 0.52 0.00 0.00 34.95 32.99 3keu s ARG 160 CO 0.00 0.61 0.89 0.21 0.02 0.00 0.00 175.30 177.03 3keu s LYS 161 N -0.91 4.27 -0.26 3.54 2.20 -1.26 -4.34 119.74 122.99 3keu s LYS 161 Ca 0.13 1.06 -0.00 0.00 -0.36 0.00 0.00 55.97 56.80 3keu s LYS 161 Cb -0.11 -2.42 0.04 0.00 -1.51 0.00 0.00 37.83 33.83 3keu s LYS 161 CO 0.02 0.11 -0.07 0.42 -0.36 0.00 0.00 175.35 175.47 3keu s ILE 162 N -1.97 2.68 -0.20 5.43 1.01 -1.26 -4.94 121.20 121.95 3keu s ILE 162 Ca 0.56 -1.22 0.09 0.00 0.00 0.00 0.00 60.65 60.09 3keu s ILE 162 Cb -0.12 -2.43 -0.13 0.00 0.01 0.00 0.00 42.46 39.80 3keu s ILE 162 CO 0.17 0.12 0.29 1.41 0.00 0.00 0.00 174.94 176.93 3keu n HIS 163 N 4.61 0.00 -4.23 3.97 8.25 -1.26 -5.00 115.22 121.56 3keu n HIS 163 Ca -0.16 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.15 3keu n HIS 163 Cb 0.45 -0.12 -0.09 0.00 1.12 0.00 0.00 29.99 31.36 3keu n HIS 163 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3keu s SER 164 N -2.56 0.92 0.14 0.41 1.04 -1.26 -4.95 113.70 107.44 3keu s SER 164 Ca -0.00 -1.56 -0.14 0.00 0.48 0.00 0.00 55.95 54.72 3keu s SER 164 Cb 0.07 0.49 0.02 0.00 0.10 0.00 0.00 66.02 66.69 3keu s SER 164 CO 0.39 -0.98 1.68 -0.61 0.98 0.00 0.00 173.24 174.70 3keu h GLN 165 N 2.35 0.71 -0.74 4.02 4.15 -1.97 -2.19 115.11 121.44 3keu h GLN 165 Ca -0.30 -0.14 -0.00 0.00 0.77 0.00 0.00 58.65 58.98 3keu h GLN 165 Cb 1.24 -0.11 -0.04 0.00 0.21 0.00 0.00 27.48 28.79 3keu h GLN 165 CO 0.44 0.66 0.45 0.93 -1.93 0.00 0.00 178.83 179.38 3keu h GLU 166 N 0.61 1.00 -0.27 1.69 3.07 -1.99 -1.32 114.58 117.36 3keu h GLU 166 Ca 0.15 -0.08 -0.09 0.00 -0.50 0.00 0.00 59.36 58.84 3keu h GLU 166 Cb 0.23 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 27.92 3keu h GLU 166 CO -0.01 0.70 -0.19 0.93 -1.40 0.00 0.00 179.01 179.03 3keu h GLU 167 N 1.01 0.49 -0.48 2.33 5.08 -1.94 -1.76 114.58 119.31 3keu h GLU 167 Ca 0.27 -0.17 -0.06 0.00 -1.00 0.00 0.00 59.36 58.40 3keu h GLU 167 Cb -0.05 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 3keu h GLU 167 CO -0.05 0.67 0.08 0.00 -1.00 0.00 0.00 179.01 178.71 3keu h ALA 168 N 1.35 0.63 0.00 3.43 0.00 -0.70 -0.30 119.26 123.67 3keu h ALA 168 Ca 0.07 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 3keu h ALA 168 Cb 0.59 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3keu h ALA 168 CO 0.04 0.36 -0.35 -0.07 0.00 0.00 0.00 179.25 179.23 3keu h LEU 169 N 0.66 0.00 -0.07 0.00 3.38 -1.07 -0.01 115.31 118.20 3keu h LEU 169 Ca 0.15 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.95 3keu h LEU 169 Cb 0.38 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.14 3keu h LEU 169 CO 0.01 0.35 -0.61 0.03 0.09 0.00 0.00 178.44 178.30 3keu h ARG 170 N 0.00 0.55 -0.35 1.13 3.08 -0.87 -2.18 114.38 115.74 3keu h ARG 170 Ca -0.00 -0.49 -0.02 0.00 0.07 0.00 0.00 59.98 59.54 3keu h ARG 170 Cb 0.72 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.87 3keu h ARG 170 CO 0.04 1.12 0.11 0.28 -1.07 0.00 0.00 179.97 180.46 3keu h VAL 171 N 0.14 1.15 -0.01 2.04 2.07 -0.75 -0.94 116.25 119.95 3keu h VAL 171 Ca -0.06 -0.50 -0.11 0.00 0.82 0.00 0.00 66.70 66.86 3keu h VAL 171 Cb 1.27 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 3keu h VAL 171 CO 0.12 0.18 -0.50 0.24 0.02 0.00 0.00 177.57 177.63 3keu h MET 172 N 0.50 0.03 -0.39 1.57 2.86 -0.89 -1.55 114.93 117.06 3keu h MET 172 Ca 0.12 -0.02 -0.12 0.00 -2.06 0.00 0.00 59.70 57.62 3keu h MET 172 Cb 0.14 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 3keu h MET 172 CO -0.01 0.53 -0.24 -0.44 1.06 0.00 0.00 176.91 177.81 3keu h ASP 173 N 0.02 0.81 -0.02 1.22 3.32 -0.54 -0.45 116.42 120.79 3keu h ASP 173 Ca -0.00 -0.30 -0.00 0.00 0.02 0.00 0.00 57.03 56.74 3keu h ASP 173 Cb 0.90 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 40.23 3keu h ASP 173 CO 0.07 1.02 0.01 0.24 -1.72 0.00 0.00 179.24 178.85 3keu h MET 174 N 0.69 0.03 -0.67 3.56 2.86 -0.94 -1.48 114.93 118.97 3keu h MET 174 Ca 0.09 -0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.74 3keu h MET 174 Cb 0.77 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.39 3keu h MET 174 CO 0.06 0.20 0.45 -0.07 1.06 0.00 0.00 176.91 178.61 3keu h LEU 175 N -0.16 0.76 -0.37 1.22 3.38 -1.17 -1.60 115.31 117.37 3keu h LEU 175 Ca 0.01 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3keu h LEU 175 Cb 0.19 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 3keu h LEU 175 CO -0.00 0.55 0.23 0.45 0.09 0.00 0.00 178.44 179.76 3keu h HIS 176 N 0.90 0.48 0.00 1.13 3.86 -0.73 -1.45 115.15 119.34 3keu h HIS 176 Ca 0.25 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.46 3keu h HIS 176 Cb -0.08 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 28.23 3keu h HIS 176 CO -0.00 0.33 0.00 0.66 0.86 0.00 0.00 177.93 179.78 3keu h SER 177 N 0.50 0.00 0.94 2.45 4.64 -0.37 0.12 113.55 121.83 3keu h SER 177 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 3keu h SER 177 Cb -0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 3keu h SER 177 CO -0.03 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.16 3keu n MET 178 N -3.07 0.05 0.00 4.77 2.00 -0.56 -4.95 117.12 115.36 3keu n MET 178 Ca -0.02 0.11 0.00 0.00 0.00 0.00 0.00 57.70 57.80 3keu n MET 178 Cb 0.17 -1.57 0.00 0.00 0.00 0.00 0.00 33.22 31.82 3keu n MET 178 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3keu n GLY 179 N 1.04 3.33 3.71 3.03 0.00 0.42 -3.66 105.19 113.05 3keu n GLY 179 Ca 0.06 -0.53 -0.43 0.00 0.00 0.00 0.00 46.02 45.11 3keu n GLY 179 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3keu n PRO 180 N 0.00 2.52 0.14 1.61 -0.02 -1.17 -4.89 135.00 133.19 3keu n PRO 180 Ca 0.00 0.90 0.05 0.00 -2.02 0.00 0.00 63.50 62.44 3keu n PRO 180 Cb 0.00 -2.69 0.04 0.00 -0.02 0.00 0.00 33.50 30.83 3keu n PRO 180 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3keu h ASP 181 N 5.70 0.00 -3.12 2.55 3.45 -1.68 -3.37 116.42 119.96 3keu h ASP 181 Ca -0.45 0.00 -0.63 0.00 0.43 0.00 0.00 57.03 56.39 3keu h ASP 181 Cb 1.23 0.00 -0.35 0.00 -0.56 0.00 0.00 39.33 39.65 3keu h ASP 181 CO 0.87 0.35 -0.84 -0.89 -1.57 0.00 0.00 179.24 177.15 3keu s THR 182 N -3.05 1.75 -0.09 0.35 2.01 -0.83 -0.52 115.64 115.26 3keu s THR 182 Ca 0.03 -0.75 0.02 0.00 0.31 0.00 0.00 61.69 61.31 3keu s THR 182 Cb 0.07 -1.61 0.01 0.00 0.01 0.00 0.00 72.50 70.99 3keu s THR 182 CO 0.74 0.49 -0.16 -0.69 -0.69 0.00 0.00 174.62 174.31 3keu s VAL 183 N 1.33 1.49 -0.13 3.82 1.01 0.27 -1.14 120.40 127.05 3keu s VAL 183 Ca 0.03 -0.67 -0.01 0.00 0.00 0.00 0.00 61.98 61.33 3keu s VAL 183 Cb -0.13 -1.34 0.04 0.00 0.00 0.00 0.00 36.38 34.95 3keu s VAL 183 CO -0.10 0.44 -0.02 -0.69 0.00 0.00 0.00 175.10 174.73 3keu s VAL 184 N 0.70 0.73 -0.41 2.92 1.01 -0.85 0.32 120.40 124.82 3keu s VAL 184 Ca -0.13 -0.31 -0.25 0.00 0.00 0.00 0.00 61.98 61.30 3keu s VAL 184 Cb -0.16 -0.94 0.02 0.00 0.00 0.00 0.00 36.38 35.30 3keu s VAL 184 CO 0.03 0.14 0.86 -0.63 0.00 0.00 0.00 175.10 175.51 3keu s ILE 185 N 1.81 4.60 -1.18 2.22 1.01 0.78 -3.13 121.20 127.31 3keu s ILE 185 Ca 0.02 0.83 0.26 0.00 0.00 0.00 0.00 60.65 61.77 3keu s ILE 185 Cb -0.14 -4.33 0.31 0.00 0.01 0.00 0.00 42.46 38.31 3keu s ILE 185 CO -0.07 -0.64 1.85 0.35 0.00 0.00 0.00 174.94 176.43 3keu n THR 186 N 6.10 0.20 -3.60 2.92 -2.24 -0.40 -2.12 114.28 115.14 3keu n THR 186 Ca 0.05 0.05 -0.08 0.00 -2.27 0.00 0.00 64.05 61.80 3keu n THR 186 Cb 0.48 -0.61 -0.05 0.00 -2.10 0.00 0.00 70.33 68.05 3keu n THR 186 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3keu s SER 187 N -2.82 -0.26 0.17 3.42 1.04 -1.26 -4.79 113.70 109.20 3keu s SER 187 Ca 0.18 0.29 -0.24 0.00 0.48 0.00 0.00 55.95 56.65 3keu s SER 187 Cb 0.17 0.22 0.06 0.00 0.10 0.00 0.00 66.02 66.56 3keu s SER 187 CO 0.44 -0.24 0.80 -0.94 0.98 0.00 0.00 173.24 174.29 3keu s SER 188 N -1.06 -0.31 0.00 7.02 1.04 -1.12 -0.27 113.70 119.01 3keu s SER 188 Ca 0.02 -0.33 0.23 0.00 0.48 0.00 0.00 55.95 56.35 3keu s SER 188 Cb -0.01 0.57 0.97 0.00 0.10 0.00 0.00 66.02 67.65 3keu s SER 188 CO -0.02 -1.01 1.67 0.47 0.98 0.00 0.00 173.24 175.33 3keu n ASP 189 N -0.41 1.25 -4.54 7.02 8.00 -1.26 -3.64 116.55 122.96 3keu n ASP 189 Ca -0.08 -1.56 -0.42 0.00 0.71 0.00 0.00 54.79 53.45 3keu n ASP 189 Cb 0.61 -0.06 0.01 0.00 -0.02 0.00 0.00 41.12 41.67 3keu n ASP 189 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3keu n LEU 190 N 0.02 1.52 -4.81 0.64 4.77 -1.26 -4.93 117.00 112.95 3keu n LEU 190 Ca 0.17 0.98 -0.34 0.00 -0.03 0.00 0.00 56.01 56.79 3keu n LEU 190 Cb 0.28 -1.25 -0.06 0.00 -2.33 0.00 0.00 43.42 40.06 3keu n LEU 190 CO 0.14 -2.09 0.67 -2.16 -1.33 0.00 0.00 177.39 172.62 3keu s PRO 191 N -1.85 4.15 0.06 3.23 0.04 -1.26 -4.49 135.00 134.88 3keu s PRO 191 Ca 0.64 1.23 0.10 0.00 0.04 0.00 0.00 61.00 63.00 3keu s PRO 191 Cb -0.58 -2.24 -0.03 0.00 0.04 0.00 0.00 34.50 31.69 3keu s PRO 191 CO 0.57 -0.11 -0.26 0.45 0.04 0.00 0.00 177.00 177.68 3keu s SER 192 N -2.04 3.17 0.52 6.66 0.15 -1.26 -5.00 113.70 115.90 3keu s SER 192 Ca 0.62 -0.62 0.31 0.00 0.70 0.00 0.00 55.95 56.96 3keu s SER 192 Cb -0.13 -0.27 1.18 0.00 -1.71 0.00 0.00 66.02 65.09 3keu s SER 192 CO 0.17 0.24 1.92 -0.65 1.20 0.00 0.00 173.24 176.12 3keu h PRO 193 N 4.65 0.00 0.00 5.44 0.11 -2.01 -2.95 132.00 137.23 3keu h PRO 193 Ca -0.47 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 3keu h PRO 193 Cb 1.15 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 3keu h PRO 193 CO 0.43 0.04 -0.10 1.96 -0.21 0.00 0.00 178.00 180.11 3keu h GLN 194 N 0.00 0.00 0.00 1.05 1.08 -2.01 -3.48 115.11 111.75 3keu h GLN 194 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3keu h GLN 194 Cb 0.60 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.03 3keu h GLN 194 CO 0.00 0.10 0.00 0.41 -0.95 0.00 0.00 178.83 178.40 3keu n GLY 195 N -0.37 2.43 0.19 3.46 0.00 -1.11 -4.90 105.19 104.89 3keu n GLY 195 Ca -0.01 -1.75 0.06 0.00 0.00 0.00 0.00 46.02 44.32 3keu n GLY 195 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3keu h SER 196 N 0.00 0.00 -0.06 1.61 4.64 -1.94 -3.32 113.55 114.48 3keu h SER 196 Ca 0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 3keu h SER 196 Cb 0.00 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.03 3keu h SER 196 CO 0.00 0.37 -0.27 -0.46 -0.87 0.00 0.00 176.83 175.60 3keu n ASN 197 N -3.55 5.34 -4.00 4.97 6.94 -1.26 -4.84 115.26 118.85 3keu n ASN 197 Ca -0.00 -2.51 -0.09 0.00 -0.02 0.00 0.00 54.58 51.96 3keu n ASN 197 Cb 0.50 -1.35 -0.11 0.00 -2.36 0.00 0.00 39.78 36.46 3keu n ASN 197 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 3keu s TYR 198 N 0.64 0.31 0.05 -2.53 1.51 -1.25 -1.31 117.35 114.77 3keu s TYR 198 Ca 0.53 -0.65 0.07 0.00 -1.01 0.00 0.00 57.07 56.01 3keu s TYR 198 Cb 0.26 -0.23 -0.03 0.00 -0.11 0.00 0.00 41.96 41.85 3keu s TYR 198 CO -0.01 -0.25 -0.21 -0.48 -1.11 0.00 0.00 175.55 173.49 3keu s LEU 199 N -1.87 2.18 -0.10 -1.29 0.05 0.38 -4.83 118.68 113.20 3keu s LEU 199 Ca -0.09 -0.54 -0.02 0.00 0.05 0.00 0.00 54.13 53.53 3keu s LEU 199 Cb -0.05 -0.98 -0.03 0.00 -2.05 0.00 0.00 46.19 43.08 3keu s LEU 199 CO -0.03 0.16 -0.01 -0.63 -0.55 0.00 0.00 176.35 175.28 3keu s ILE 200 N -0.82 4.21 -0.09 1.48 1.09 -1.24 -0.93 121.20 124.90 3keu s ILE 200 Ca 0.08 -0.28 0.02 0.00 -1.10 0.00 0.00 60.65 59.37 3keu s ILE 200 Cb -0.09 -2.78 -0.02 0.00 -1.06 0.00 0.00 42.46 38.51 3keu s ILE 200 CO 0.02 0.58 -0.15 -0.69 -0.10 0.00 0.00 174.94 174.60 3keu s VAL 201 N -0.63 2.90 0.01 2.92 1.01 -0.51 -2.78 120.40 123.33 3keu s VAL 201 Ca 0.10 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.40 3keu s VAL 201 Cb -0.12 -2.16 -0.02 0.00 0.00 0.00 0.00 36.38 34.08 3keu s VAL 201 CO 0.02 0.56 -0.19 -0.76 0.00 0.00 0.00 175.10 174.73 3keu s LEU 202 N -0.15 2.10 -0.01 3.92 1.43 -0.90 -1.16 118.68 123.91 3keu s LEU 202 Ca -0.01 -0.42 0.01 0.00 -1.03 0.00 0.00 54.13 52.68 3keu s LEU 202 Cb -0.14 -0.93 0.00 0.00 0.03 0.00 0.00 46.19 45.16 3keu s LEU 202 CO 0.03 0.18 -0.05 -0.83 0.23 0.00 0.00 176.35 175.92 3keu s GLY 203 N -0.80 0.30 -0.04 -3.19 0.00 -0.32 -0.16 107.32 103.12 3keu s GLY 203 Ca 0.07 -0.16 0.02 0.00 0.00 0.00 0.00 44.72 44.64 3keu s GLY 203 CO 0.00 -0.00 -0.07 -0.45 0.00 0.00 0.00 173.10 172.59 3keu s SER 204 N 0.18 1.08 -0.05 1.64 0.15 0.15 -0.88 113.70 115.97 3keu s SER 204 Ca -0.02 -0.16 -0.01 0.00 0.70 0.00 0.00 55.95 56.46 3keu s SER 204 Cb -0.06 -0.44 0.03 0.00 -1.71 0.00 0.00 66.02 63.85 3keu s SER 204 CO -0.00 -0.00 0.01 -1.58 1.20 0.00 0.00 173.24 172.87 3keu s GLN 205 N 0.61 0.36 -0.08 5.44 0.74 -0.33 -0.56 119.66 125.84 3keu s GLN 205 Ca -0.09 0.16 -0.12 0.00 0.05 0.00 0.00 55.36 55.36 3keu s GLN 205 Cb -0.12 -0.71 -0.05 0.00 1.10 0.00 0.00 33.01 33.23 3keu s GLN 205 CO 0.01 -0.25 0.30 0.50 -0.55 0.00 0.00 175.29 175.29 3keu s ARG 206 N 1.71 3.89 -0.30 1.67 3.52 0.32 -1.53 118.95 128.23 3keu s ARG 206 Ca 0.00 0.17 -0.11 0.00 -0.13 0.00 0.00 55.73 55.66 3keu s ARG 206 Cb -0.13 -3.27 0.17 0.00 -1.56 0.00 0.00 34.95 30.16 3keu s ARG 206 CO -0.03 0.58 0.89 -0.98 -0.81 0.00 0.00 175.30 174.94 3keu s ARG 207 N -0.59 0.35 0.00 5.12 1.70 -0.33 -4.81 118.95 120.39 3keu s ARG 207 Ca 0.19 0.74 0.00 0.00 -0.47 0.00 0.00 55.73 56.19 3keu s ARG 207 Cb -0.14 0.43 0.00 0.00 -0.57 0.00 0.00 34.95 34.67 3keu s ARG 207 CO 0.08 -0.26 0.00 -1.13 -1.08 0.00 0.00 175.30 172.91 3keu n SER 213 N 5.29 0.00 -4.51 -2.89 3.41 -1.26 -4.34 113.62 109.32 3keu n SER 213 Ca -0.07 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.12 3keu n SER 213 Cb 0.52 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.44 3keu n SER 213 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3keu s VAL 214 N 0.00 4.19 0.11 -3.33 0.11 -1.26 -5.01 120.40 115.21 3keu s VAL 214 Ca 0.00 0.18 0.09 0.00 -2.93 0.00 0.00 61.98 59.32 3keu s VAL 214 Cb 0.00 -4.68 -0.04 0.00 -1.53 0.00 0.00 36.38 30.13 3keu s VAL 214 CO 0.00 -1.40 -0.17 0.68 -3.33 0.00 0.00 175.10 170.88 3keu s VAL 215 N 4.46 2.88 0.04 2.04 -7.23 -1.26 -5.13 120.40 116.19 3keu s VAL 215 Ca 0.30 -1.46 0.03 0.00 -1.81 0.00 0.00 61.98 59.04 3keu s VAL 215 Cb -0.12 -2.31 -0.04 0.00 0.56 0.00 0.00 36.38 34.47 3keu s VAL 215 CO 0.16 0.12 -0.01 -0.04 -0.31 0.00 0.00 175.10 175.02 3keu s MET 216 N -2.09 2.64 -0.07 4.82 1.00 -1.26 -1.19 119.30 123.14 3keu s MET 216 Ca 0.18 -0.72 -0.00 0.00 0.00 0.00 0.00 55.69 55.14 3keu s MET 216 Cb -0.11 -2.58 0.02 0.00 0.00 0.00 0.00 34.83 32.16 3keu s MET 216 CO 0.10 0.59 -0.04 -2.00 0.00 0.00 0.00 175.02 173.67 3keu s GLU 217 N -1.82 0.94 -0.04 2.03 2.12 -0.58 -4.99 118.70 116.36 3keu s GLU 217 Ca 0.21 -0.07 0.04 0.00 0.36 0.00 0.00 54.97 55.51 3keu s GLU 217 Cb -0.11 -1.09 0.00 0.00 0.26 0.00 0.00 34.13 33.18 3keu s GLU 217 CO 0.13 -0.21 -0.14 1.03 -0.54 0.00 0.00 175.26 175.53 3keu s ARG 218 N 1.51 1.49 0.16 4.30 0.52 -1.26 -1.18 118.95 124.49 3keu s ARG 218 Ca -0.01 -0.49 0.04 0.00 -0.52 0.00 0.00 55.73 54.74 3keu s ARG 218 Cb -0.13 -1.32 -0.05 0.00 0.52 0.00 0.00 34.95 33.98 3keu s ARG 218 CO -0.04 0.19 -0.07 0.96 0.02 0.00 0.00 175.30 176.36 3keu s ILE 219 N 0.13 1.02 0.02 1.52 -5.25 -0.06 0.06 121.20 118.64 3keu s ILE 219 Ca -0.04 -2.03 0.01 0.00 -0.99 0.00 0.00 60.65 57.60 3keu s ILE 219 Cb -0.11 -1.93 -0.02 0.00 2.95 0.00 0.00 42.46 43.35 3keu s ILE 219 CO 0.02 -0.67 -0.04 -0.60 -1.79 0.00 0.00 174.94 171.85 3keu s ARG 220 N -3.80 0.35 -0.02 0.37 3.52 0.83 -1.17 118.95 119.02 3keu s ARG 220 Ca 0.19 -0.48 -0.01 0.00 -0.13 0.00 0.00 55.73 55.29 3keu s ARG 220 Cb 0.04 -0.13 0.01 0.00 -1.56 0.00 0.00 34.95 33.31 3keu s ARG 220 CO 0.01 0.02 0.05 -1.64 -0.81 0.00 0.00 175.30 172.93 3keu s MET 221 N -1.03 0.05 -0.29 5.12 -1.94 -0.31 0.29 119.30 121.19 3keu s MET 221 Ca -0.08 0.09 -0.04 0.00 -1.71 0.00 0.00 55.69 53.94 3keu s MET 221 Cb -0.07 -0.01 0.03 0.00 2.01 0.00 0.00 34.83 36.79 3keu s MET 221 CO -0.00 -0.03 0.04 -0.51 -0.01 0.00 0.00 175.02 174.51 3keu s ASP 222 N 0.18 4.93 -0.13 3.03 1.11 -1.26 -1.42 116.67 123.10 3keu s ASP 222 Ca -0.01 -0.96 -0.03 0.00 0.18 0.00 0.00 52.55 51.73 3keu s ASP 222 Cb -0.02 -1.79 -0.03 0.00 1.07 0.00 0.00 42.92 42.15 3keu s ASP 222 CO -0.01 -0.22 -0.04 -0.63 1.18 0.00 0.00 175.17 175.45 3keu s ILE 223 N 1.39 3.89 -0.02 0.77 1.01 -0.11 -4.93 121.20 123.19 3keu s ILE 223 Ca -0.01 -0.37 -0.30 0.00 0.00 0.00 0.00 60.65 59.97 3keu s ILE 223 Cb -0.18 -2.67 -0.05 0.00 0.01 0.00 0.00 42.46 39.57 3keu s ILE 223 CO 0.00 0.53 1.36 -0.60 0.00 0.00 0.00 174.94 176.23 3keu s ARG 224 N 0.01 4.29 0.18 2.79 3.52 -1.26 -0.47 118.95 128.01 3keu s ARG 224 Ca 0.01 1.89 -0.30 0.00 -0.13 0.00 0.00 55.73 57.20 3keu s ARG 224 Cb -0.13 -3.60 -0.08 0.00 -1.56 0.00 0.00 34.95 29.58 3keu s ARG 224 CO 0.03 -0.57 1.23 0.15 -0.81 0.00 0.00 175.30 175.33 3keu s LYS 225 N 2.49 4.46 -0.05 5.12 1.02 -0.43 -4.91 119.74 127.44 3keu s LYS 225 Ca 0.62 1.92 -0.12 0.00 0.02 0.00 0.00 55.97 58.41 3keu s LYS 225 Cb -0.29 -3.23 -0.05 0.00 -0.52 0.00 0.00 37.83 33.73 3keu s LYS 225 CO 0.25 -0.15 0.30 0.08 -0.92 0.00 0.00 175.35 174.91 3keu s VAL 226 N 0.06 5.23 -1.16 3.17 1.01 -1.26 -4.95 120.40 122.50 3keu s VAL 226 Ca 0.54 0.58 -0.18 0.00 0.00 0.00 0.00 61.98 62.93 3keu s VAL 226 Cb -0.34 -3.58 -0.05 0.00 0.00 0.00 0.00 36.38 32.41 3keu s VAL 226 CO 0.37 0.60 2.06 -0.67 0.00 0.00 0.00 175.10 177.46 3keu n ASP 227 N 1.88 3.34 0.00 3.32 4.64 -1.26 -4.81 116.55 123.67 3keu n ASP 227 Ca -0.16 -2.77 0.00 0.00 -1.38 0.00 0.00 54.79 50.47 3keu n ASP 227 Cb 0.53 -1.44 0.00 0.00 -1.04 0.00 0.00 41.12 39.17 3keu n ASP 227 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3keu n ALA 228 N 7.16 0.00 -2.61 -1.67 0.00 -1.26 -5.03 120.51 117.10 3keu n ALA 228 Ca 0.51 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.56 3keu n ALA 228 Cb 0.40 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.76 3keu n ALA 228 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3keu s VAL 229 N -2.00 5.26 0.18 0.00 1.01 -1.26 -5.08 120.40 118.50 3keu s VAL 229 Ca 0.00 0.36 0.05 0.00 0.00 0.00 0.00 61.98 62.39 3keu s VAL 229 Cb 0.00 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 3keu s VAL 229 CO 0.00 0.23 0.17 -0.36 0.00 0.00 0.00 175.10 175.14 3keu s PHE 230 N 1.74 3.19 -0.07 5.22 0.08 -1.26 -5.01 117.98 121.87 3keu s PHE 230 Ca 0.11 -0.01 0.03 0.00 0.12 0.00 0.00 56.93 57.18 3keu s PHE 230 Cb -0.15 -1.52 0.01 0.00 -0.57 0.00 0.00 43.02 40.78 3keu s PHE 230 CO 0.09 0.52 -0.16 0.08 -0.10 0.00 0.00 175.22 175.65 3keu s VAL 231 N -1.80 1.45 0.00 -0.44 1.01 -1.26 -4.68 120.40 114.68 3keu s VAL 231 Ca 0.32 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.62 3keu s VAL 231 Cb -0.10 -1.29 0.00 0.00 0.00 0.00 0.00 36.38 35.00 3keu s VAL 231 CO 0.24 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.38 3keu n GLY 232 N 3.62 2.72 0.37 4.51 0.00 -1.26 -4.71 105.19 110.45 3keu n GLY 232 Ca -0.21 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.80 3keu n GLY 232 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3keu h THR 233 N 0.00 1.23 -0.51 2.61 1.35 -1.86 0.92 112.91 116.65 3keu h THR 233 Ca 0.00 -0.44 -0.03 0.00 -0.55 0.00 0.00 66.41 65.39 3keu h THR 233 Cb 0.00 -0.15 -0.02 0.00 -1.73 0.00 0.00 68.15 66.25 3keu h THR 233 CO 0.00 0.23 0.18 1.23 -0.25 0.00 0.00 175.52 176.92 3keu h GLY 234 N 1.27 0.83 1.00 5.82 0.00 -1.93 0.24 103.07 110.31 3keu h GLY 234 Ca 0.35 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 47.21 3keu h GLY 234 CO -0.08 0.44 0.27 -0.55 0.00 0.00 0.00 176.54 176.63 3keu h ASP 235 N 0.69 0.49 -0.64 0.19 3.32 -1.81 -1.23 116.42 117.42 3keu h ASP 235 Ca 0.17 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 3keu h ASP 235 Cb 0.23 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 3keu h ASP 235 CO -0.01 0.36 0.35 0.25 -1.72 0.00 0.00 179.24 178.47 3keu h LEU 236 N 0.57 0.80 0.22 1.55 5.85 -0.49 -1.50 115.31 122.31 3keu h LEU 236 Ca 0.15 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.78 3keu h LEU 236 Cb -0.06 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.75 3keu h LEU 236 CO -0.03 0.66 -0.23 0.15 -0.34 0.00 0.00 178.44 178.65 3keu h PHE 237 N 0.87 -0.62 -0.53 1.25 3.57 -0.15 -0.19 116.94 121.14 3keu h PHE 237 Ca 0.23 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.79 3keu h PHE 237 Cb 0.04 0.24 -0.05 0.00 2.79 0.00 0.00 35.95 38.97 3keu h PHE 237 CO -0.01 -0.34 0.23 0.00 -2.23 0.00 0.00 178.31 175.96 3keu h ALA 238 N 0.20 0.67 -0.45 2.41 0.00 -0.94 0.22 119.26 121.36 3keu h ALA 238 Ca -0.00 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3keu h ALA 238 Cb 0.47 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3keu h ALA 238 CO -0.06 -0.14 0.20 0.00 0.00 0.00 0.00 179.25 179.25 3keu h ALA 239 N 1.32 0.59 -0.36 0.00 0.00 -1.04 -0.40 119.26 119.37 3keu h ALA 239 Ca 0.25 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 3keu h ALA 239 Cb 0.22 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3keu h ALA 239 CO -0.21 0.17 -0.24 0.52 0.00 0.00 0.00 179.25 179.49 3keu h MET 240 N 0.59 0.72 -0.73 0.00 2.07 -0.79 -0.90 114.93 115.87 3keu h MET 240 Ca 0.15 -0.29 -0.04 0.00 -2.07 0.00 0.00 59.70 57.45 3keu h MET 240 Cb 0.15 -0.03 -0.03 0.00 -1.87 0.00 0.00 31.60 29.82 3keu h MET 240 CO -0.02 0.89 0.30 1.25 1.07 0.00 0.00 176.91 180.40 3keu h LEU 241 N 0.62 1.00 -0.03 1.22 5.85 -0.75 0.17 115.31 123.39 3keu h LEU 241 Ca 0.09 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.66 3keu h LEU 241 Cb 0.73 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.50 3keu h LEU 241 CO 0.06 0.88 0.01 0.25 -0.34 0.00 0.00 178.44 179.30 3keu h LEU 242 N 1.06 0.00 -0.48 2.25 6.46 -0.54 0.38 115.31 124.44 3keu h LEU 242 Ca 0.25 0.01 -0.05 0.00 -0.12 0.00 0.00 57.88 57.96 3keu h LEU 242 Cb 0.20 0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 40.11 3keu h LEU 242 CO -0.02 0.01 0.10 0.00 -0.62 0.00 0.00 178.44 177.91 3keu h ALA 243 N 1.02 0.63 0.01 1.25 0.00 -0.50 -2.42 119.26 119.26 3keu h ALA 243 Ca 0.01 -0.21 -0.19 0.00 0.00 0.00 0.00 54.91 54.52 3keu h ALA 243 Cb 0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3keu h ALA 243 CO -0.02 0.33 -0.89 -1.49 0.00 0.00 0.00 179.25 177.18 3keu h TRP 244 N 0.65 0.11 0.00 0.00 4.06 -0.61 -2.37 115.95 117.79 3keu h TRP 244 Ca 0.15 -0.07 -0.07 0.00 2.06 0.00 0.00 58.89 60.96 3keu h TRP 244 Cb 0.35 -0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 28.49 3keu h TRP 244 CO 0.02 0.92 -0.36 1.79 -3.56 0.00 0.00 178.44 177.26 3keu h THR 245 N 0.03 0.96 -0.22 1.49 1.35 -0.94 -0.07 112.91 115.51 3keu h THR 245 Ca -0.03 -1.38 -0.02 0.00 -0.55 0.00 0.00 66.41 64.43 3keu h THR 245 Cb 1.55 1.81 -0.01 0.00 -1.73 0.00 0.00 68.15 69.77 3keu h THR 245 CO 0.12 0.35 0.04 -0.74 -0.25 0.00 0.00 175.52 175.05 3keu h HIS 246 N 0.00 0.39 0.00 4.73 -0.00 -1.13 -2.44 115.15 116.70 3keu h HIS 246 Ca -0.00 -0.05 0.00 0.00 -0.00 0.00 0.00 60.37 60.32 3keu h HIS 246 Cb 0.78 -0.11 0.00 0.00 -0.00 0.00 0.00 27.41 28.09 3keu h HIS 246 CO 0.00 0.48 0.00 0.87 -0.00 0.00 0.00 177.93 179.28 3keu h LYS 247 N 0.18 0.00 -2.15 5.26 1.57 -1.20 -3.37 116.57 116.86 3keu h LYS 247 Ca 0.07 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.27 3keu h LYS 247 Cb 0.30 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.21 3keu h LYS 247 CO 0.00 0.00 -0.89 0.72 -0.57 0.00 0.00 179.45 178.72 3keu n HIS 248 N -3.09 1.22 -2.44 -1.35 8.25 -0.06 -5.10 115.22 112.64 3keu n HIS 248 Ca 0.03 -3.79 -0.34 0.00 -0.26 0.00 0.00 57.72 53.36 3keu n HIS 248 Cb 0.48 -0.39 -0.02 0.00 1.12 0.00 0.00 29.99 31.17 3keu n HIS 248 CO 0.00 0.00 0.00 -2.14 0.64 0.00 0.00 176.34 174.84 3keu s PRO 249 N -1.58 3.67 -1.68 -0.41 0.02 -0.93 -2.93 135.00 131.17 3keu s PRO 249 Ca 0.36 1.40 0.00 0.00 0.02 0.00 0.00 61.00 62.79 3keu s PRO 249 Cb 0.14 -2.07 0.00 0.00 0.02 0.00 0.00 34.50 32.59 3keu s PRO 249 CO -0.08 -0.55 0.00 0.09 -0.33 0.00 0.00 177.00 176.13 3keu n ASN 250 N -1.12 -5.18 -2.92 2.53 3.02 -1.26 -4.89 115.26 105.44 3keu n ASN 250 Ca 0.10 0.17 -0.14 0.00 -0.03 0.00 0.00 54.58 54.68 3keu n ASN 250 Cb 0.52 -4.26 0.01 0.00 -0.61 0.00 0.00 39.78 35.44 3keu n ASN 250 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3keu n ASN 251 N -1.20 -1.56 -0.14 6.41 2.85 -1.15 -4.98 115.26 115.50 3keu n ASN 251 Ca -0.20 -3.14 0.11 0.00 -0.11 0.00 0.00 54.58 51.24 3keu n ASN 251 Cb 0.63 0.87 0.45 0.00 1.24 0.00 0.00 39.78 42.97 3keu n ASN 251 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 3keu h LEU 252 N 3.79 0.48 0.45 1.20 5.85 -1.90 -2.19 115.31 122.99 3keu h LEU 252 Ca -0.05 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 3keu h LEU 252 Cb 0.99 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.91 3keu h LEU 252 CO 0.36 0.29 -0.41 0.50 -0.34 0.00 0.00 178.44 178.84 3keu h LYS 253 N 0.54 -0.81 -0.54 1.25 3.64 -1.94 -0.38 116.57 118.32 3keu h LYS 253 Ca 0.31 0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.74 3keu h LYS 253 Cb 0.50 0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 32.48 3keu h LYS 253 CO -0.10 -0.54 0.30 0.28 -2.27 0.00 0.00 179.45 177.11 3keu h VAL 254 N -0.84 1.18 -0.77 2.00 2.07 -1.90 -1.24 116.25 116.74 3keu h VAL 254 Ca -0.06 -0.46 0.10 0.00 0.82 0.00 0.00 66.70 67.10 3keu h VAL 254 Cb 0.72 0.50 -0.07 0.00 -1.52 0.00 0.00 31.29 30.92 3keu h VAL 254 CO -0.03 0.19 0.42 0.00 0.02 0.00 0.00 177.57 178.17 3keu h ALA 255 N 1.13 1.10 -0.00 1.67 0.00 -1.32 -0.04 119.26 121.79 3keu h ALA 255 Ca 0.19 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 55.01 3keu h ALA 255 Cb 0.05 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3keu h ALA 255 CO -0.03 0.02 -0.64 0.00 0.00 0.00 0.00 179.25 178.60 3keu h GLU 257 N 0.01 0.73 -0.27 0.00 5.08 0.06 -1.53 114.58 118.66 3keu h GLU 257 Ca -0.01 -0.48 -0.15 0.00 -1.00 0.00 0.00 59.36 57.72 3keu h GLU 257 Cb 1.13 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 3keu h GLU 257 CO 0.08 1.10 -0.46 0.87 -1.00 0.00 0.00 179.01 179.61 3keu h LYS 258 N 0.55 0.69 0.27 2.33 1.57 -1.03 -0.17 116.57 120.79 3keu h LYS 258 Ca 0.00 -0.39 -0.01 0.00 -1.87 0.00 0.00 60.65 58.38 3keu h LYS 258 Cb 1.17 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.50 3keu h LYS 258 CO 0.12 1.01 -0.13 1.15 -0.57 0.00 0.00 179.45 181.03 3keu h THR 259 N 0.55 0.78 -0.66 -0.16 2.02 -1.35 0.41 112.91 114.50 3keu h THR 259 Ca 0.03 -0.44 -0.06 0.00 0.77 0.00 0.00 66.41 66.71 3keu h THR 259 Cb 1.01 1.02 -0.03 0.00 -1.74 0.00 0.00 68.15 68.42 3keu h THR 259 CO 0.10 0.09 0.18 0.58 0.37 0.00 0.00 175.52 176.84 3keu h VAL 260 N -0.60 1.25 -0.78 3.16 2.07 -1.32 -1.77 116.25 118.26 3keu h VAL 260 Ca -0.04 -0.91 -0.04 0.00 0.82 0.00 0.00 66.70 66.53 3keu h VAL 260 Cb 0.43 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.76 3keu h VAL 260 CO 0.06 0.35 0.32 0.28 0.02 0.00 0.00 177.57 178.59 3keu h SER 261 N 0.96 1.07 -0.62 0.57 0.02 -0.96 0.15 113.55 114.75 3keu h SER 261 Ca 0.21 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.99 3keu h SER 261 Cb 0.34 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.57 3keu h SER 261 CO -0.00 0.95 0.37 0.74 -1.14 0.00 0.00 176.83 177.75 3keu h THR 262 N 1.14 1.18 -0.47 -2.27 2.02 -0.62 -1.41 112.91 112.48 3keu h THR 262 Ca 0.26 -0.40 0.00 0.00 0.77 0.00 0.00 66.41 67.05 3keu h THR 262 Cb 0.21 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 3keu h THR 262 CO -0.02 0.19 0.29 -0.07 0.37 0.00 0.00 175.52 176.28 3keu h LEU 263 N 0.84 0.55 -0.02 2.58 -0.00 -0.64 -2.04 115.31 116.58 3keu h LEU 263 Ca 0.22 -0.04 0.03 0.00 -0.00 0.00 0.00 57.88 58.09 3keu h LEU 263 Cb -0.03 -0.14 -0.06 0.00 -0.00 0.00 0.00 40.66 40.44 3keu h LEU 263 CO -0.04 0.42 -0.46 -0.74 -0.00 0.00 0.00 178.44 177.61 3keu h HIS 264 N 0.62 -1.34 -0.53 1.13 2.76 0.13 0.65 115.15 118.57 3keu h HIS 264 Ca 0.17 0.04 0.06 0.00 -2.20 0.00 0.00 60.37 58.44 3keu h HIS 264 Cb -0.04 0.59 -0.05 0.00 1.55 0.00 0.00 27.41 29.46 3keu h HIS 264 CO -0.04 -0.53 0.25 0.45 -1.30 0.00 0.00 177.93 176.76 3keu h HIS 265 N -0.61 0.44 0.03 5.26 3.86 -1.15 0.51 115.15 123.50 3keu h HIS 265 Ca 0.04 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 3keu h HIS 265 Cb 0.68 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 29.02 3keu h HIS 265 CO -0.47 0.19 -0.04 0.28 0.86 0.00 0.00 177.93 178.76 3keu h VAL 266 N 0.47 0.91 -0.39 2.45 2.07 -1.00 -0.24 116.25 120.51 3keu h VAL 266 Ca 0.24 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.65 3keu h VAL 266 Cb 0.20 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 3keu h VAL 266 CO -0.20 0.00 -0.20 -0.07 0.02 0.00 0.00 177.57 177.12 3keu h LEU 267 N -0.09 0.77 -0.26 2.57 3.38 -0.49 0.14 115.31 121.34 3keu h LEU 267 Ca 0.01 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 57.71 3keu h LEU 267 Cb 0.09 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 3keu h LEU 267 CO -0.02 0.96 0.16 -0.61 0.09 0.00 0.00 178.44 179.03 3keu h GLN 268 N 0.67 0.33 -0.42 1.13 5.75 0.21 0.21 115.11 122.98 3keu h GLN 268 Ca 0.10 -0.02 -0.07 0.00 -0.15 0.00 0.00 58.65 58.51 3keu h GLN 268 Cb 0.71 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 29.16 3keu h GLN 268 CO 0.05 0.22 -0.04 -0.09 -2.65 0.00 0.00 178.83 176.32 3keu h ARG 269 N 0.33 0.70 -0.26 1.69 2.43 -0.79 -2.74 114.38 115.75 3keu h ARG 269 Ca 0.10 -0.19 -0.13 0.00 -0.81 0.00 0.00 59.98 58.95 3keu h ARG 269 Cb -0.02 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.45 3keu h ARG 269 CO -0.03 0.74 -0.35 1.15 -1.51 0.00 0.00 179.97 179.97 3keu h THR 270 N 0.65 1.31 -0.17 0.20 2.02 0.05 -2.90 112.91 114.06 3keu h THR 270 Ca 0.13 -1.54 -0.13 0.00 0.77 0.00 0.00 66.41 65.63 3keu h THR 270 Cb 0.46 1.68 -0.01 0.00 -1.74 0.00 0.00 68.15 68.54 3keu h THR 270 CO 0.02 0.49 -0.44 -0.29 0.37 0.00 0.00 175.52 175.67 3keu h ILE 271 N 0.42 1.32 0.76 3.11 6.09 -0.57 -1.00 117.51 127.64 3keu h ILE 271 Ca 0.03 -1.62 -0.04 0.00 -1.37 0.00 0.00 64.86 61.86 3keu h ILE 271 Cb 0.94 1.67 0.01 0.00 0.47 0.00 0.00 36.82 39.90 3keu h ILE 271 CO 0.08 0.50 -0.36 1.56 -3.07 0.00 0.00 178.15 176.86 3keu h GLN 272 N 0.34 -0.98 -0.71 2.19 4.20 -1.50 -1.72 115.11 116.94 3keu h GLN 272 Ca 0.02 0.07 0.07 0.00 0.06 0.00 0.00 58.65 58.87 3keu h GLN 272 Cb 0.92 0.22 -0.06 0.00 0.30 0.00 0.00 27.48 28.86 3keu h GLN 272 CO 0.08 -0.65 0.39 0.00 -0.67 0.00 0.00 178.83 177.98 3keu h ALA 274 N 1.38 0.84 0.69 0.00 0.00 -0.94 -1.70 119.26 119.53 3keu h ALA 274 Ca 0.32 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.31 3keu h ALA 274 Cb 0.23 0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.15 3keu h ALA 274 CO -0.20 -0.25 -0.33 0.87 0.00 0.00 0.00 179.25 179.34 3keu h LYS 275 N 0.35 -0.89 -0.96 0.00 1.57 -0.45 0.52 116.57 116.72 3keu h LYS 275 Ca 0.35 0.06 0.30 0.00 -1.87 0.00 0.00 60.65 59.48 3keu h LYS 275 Cb 0.50 0.20 -0.16 0.00 0.08 0.00 0.00 32.23 32.85 3keu h LYS 275 CO -0.38 -0.57 0.27 0.00 -0.57 0.00 0.00 179.45 178.20 3keu h ALA 276 N -1.00 1.51 -0.09 3.86 0.00 -1.10 1.21 119.26 123.65 3keu h ALA 276 Ca -0.09 0.27 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 3keu h ALA 276 Cb 0.74 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3keu h ALA 276 CO 0.16 -0.62 -0.17 1.96 0.00 0.00 0.00 179.25 180.57 3keu h GLN 277 N 0.11 0.28 -0.51 0.00 4.20 -1.18 -3.28 115.11 114.72 3keu h GLN 277 Ca 0.65 -0.18 -0.12 0.00 0.06 0.00 0.00 58.65 59.07 3keu h GLN 277 Cb 1.47 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 29.25 3keu h GLN 277 CO -0.77 0.76 -0.16 0.00 -0.67 0.00 0.00 178.83 178.00 3keu h ALA 278 N 0.51 0.75 0.00 3.87 0.00 0.15 -3.50 119.26 121.04 3keu h ALA 278 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3keu h ALA 278 Cb 0.75 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3keu h ALA 278 CO 0.04 0.67 0.00 0.41 0.00 0.00 0.00 179.25 180.37 3keu n GLY 279 N -0.21 2.08 3.58 0.00 0.00 0.39 -4.71 105.19 106.32 3keu n GLY 279 Ca 0.01 -1.78 -0.49 0.00 0.00 0.00 0.00 46.02 43.76 3keu n GLY 279 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3keu n GLU 280 N 1.91 1.18 -0.71 1.61 2.13 -1.26 -1.80 120.64 123.69 3keu n GLU 280 Ca 0.00 0.42 0.00 0.00 0.66 0.00 0.00 57.16 58.24 3keu n GLU 280 Cb 0.00 -1.94 0.00 0.00 0.27 0.00 0.00 31.44 29.77 3keu n GLU 280 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3keu n GLY 281 N 2.10 0.80 3.62 8.31 0.00 -1.26 -4.99 105.19 113.77 3keu n GLY 281 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 3keu n GLY 281 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3keu s VAL 282 N -2.82 4.67 -0.02 1.61 1.01 -0.75 -5.06 120.40 119.04 3keu s VAL 282 Ca 0.00 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.60 3keu s VAL 282 Cb 0.00 -3.10 -0.05 0.00 0.00 0.00 0.00 36.38 33.23 3keu s VAL 282 CO 0.00 0.47 1.36 -0.13 0.00 0.00 0.00 175.10 176.80 3keu s ARG 283 N 0.37 4.29 0.43 2.72 0.52 -1.26 -4.62 118.95 121.40 3keu s ARG 283 Ca 0.02 1.91 -0.25 0.00 -0.52 0.00 0.00 55.73 56.88 3keu s ARG 283 Cb -0.13 -3.58 -0.09 0.00 0.52 0.00 0.00 34.95 31.67 3keu s ARG 283 CO 0.00 -0.56 1.32 -2.30 0.02 0.00 0.00 175.30 173.79 3keu n PRO 284 N 5.40 2.03 -1.89 3.54 -0.02 -1.26 -5.01 135.00 137.79 3keu n PRO 284 Ca 0.13 0.72 -0.29 0.00 -2.02 0.00 0.00 63.50 62.04 3keu n PRO 284 Cb 0.44 -2.46 0.12 0.00 -0.02 0.00 0.00 33.50 31.57 3keu n PRO 284 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3keu s SER 285 N -0.51 4.10 0.30 2.55 1.04 -1.26 -4.85 113.70 115.07 3keu s SER 285 Ca 0.61 0.66 -0.01 0.00 0.48 0.00 0.00 55.95 57.69 3keu s SER 285 Cb -0.49 -1.03 0.49 0.00 0.10 0.00 0.00 66.02 65.09 3keu s SER 285 CO 0.58 -2.15 1.94 -0.65 0.98 0.00 0.00 173.24 173.94 3keu h PRO 286 N -1.23 1.04 -0.42 4.02 0.11 -1.95 -1.31 132.00 132.26 3keu h PRO 286 Ca -0.46 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3keu h PRO 286 Cb 1.31 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 3keu h PRO 286 CO 0.59 0.69 0.27 1.98 -0.21 0.00 0.00 178.00 181.32 3keu h MET 287 N 1.07 0.56 0.00 1.05 4.05 -1.97 -1.63 114.93 118.06 3keu h MET 287 Ca 0.35 -0.04 -0.00 0.00 -0.28 0.00 0.00 59.70 59.73 3keu h MET 287 Cb 0.06 -0.12 -0.00 0.00 -0.80 0.00 0.00 31.60 30.73 3keu h MET 287 CO -0.11 0.38 -0.02 1.96 0.23 0.00 0.00 176.91 179.35 3keu h GLN 288 N 0.57 0.00 -0.23 0.39 4.20 -1.75 -2.95 115.11 115.33 3keu h GLN 288 Ca 0.15 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.86 3keu h GLN 288 Cb -0.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.73 3keu h GLN 288 CO -0.03 0.02 0.00 1.28 -0.67 0.00 0.00 178.83 179.42 3keu n LEU 289 N -3.12 2.09 -4.76 1.46 4.77 -0.56 -3.99 117.00 112.89 3keu n LEU 289 Ca 0.00 -0.90 -0.41 0.00 -0.03 0.00 0.00 56.01 54.68 3keu n LEU 289 Cb 0.31 -0.15 -0.01 0.00 -2.33 0.00 0.00 43.42 41.23 3keu n LEU 289 CO 0.27 0.45 1.12 -1.61 -1.33 0.00 0.00 177.39 176.29 3keu s GLU 290 N -1.70 4.20 0.24 3.23 0.41 -1.05 -4.73 118.70 119.31 3keu s GLU 290 Ca 0.33 2.44 -0.31 0.00 -0.41 0.00 0.00 54.97 57.02 3keu s GLU 290 Cb 0.18 -3.03 -0.14 0.00 -1.78 0.00 0.00 34.13 29.36 3keu s GLU 290 CO 0.26 -0.45 1.32 1.28 -0.49 0.00 0.00 175.26 177.18 3keu n LEU 291 N 1.25 2.77 -3.94 1.80 4.77 -1.26 -4.83 117.00 117.56 3keu n LEU 291 Ca 0.03 1.15 -0.43 0.00 -0.03 0.00 0.00 56.01 56.74 3keu n LEU 291 Cb 0.40 -1.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.10 3keu n LEU 291 CO 0.62 -0.70 2.10 0.54 -1.33 0.00 0.00 177.39 178.61 3keu n ARG 292 N 1.70 3.35 0.21 3.23 5.12 -1.26 -4.77 116.66 124.25 3keu n ARG 292 Ca 0.11 -3.29 -0.13 0.00 -1.93 0.00 0.00 57.85 52.61 3keu n ARG 292 Cb 0.31 -3.08 -0.07 0.00 -1.16 0.00 0.00 32.46 28.46 3keu n ARG 292 CO 0.00 0.00 0.00 1.98 -1.93 0.00 0.00 177.63 177.68 3keu h MET 293 N 6.09 -0.55 -0.31 5.56 4.05 -1.94 -2.99 114.93 124.84 3keu h MET 293 Ca 0.44 0.04 -0.05 0.00 -0.28 0.00 0.00 59.70 59.84 3keu h MET 293 Cb 0.67 0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 31.58 3keu h MET 293 CO 1.65 -0.24 -0.03 -0.39 0.23 0.00 0.00 176.91 178.12 3keu h VAL 294 N -0.94 1.20 0.00 -5.77 -1.51 -2.01 -1.63 116.25 105.59 3keu h VAL 294 Ca -0.06 -0.82 0.00 0.00 -1.23 0.00 0.00 66.70 64.60 3keu h VAL 294 Cb 0.56 1.00 0.00 0.00 -2.13 0.00 0.00 31.29 30.72 3keu h VAL 294 CO 0.10 0.28 0.00 0.00 -1.23 0.00 0.00 177.57 176.71 3keu n GLN 295 N -4.27 0.08 -0.52 5.19 3.00 -1.24 -2.79 117.38 116.83 3keu n GLN 295 Ca 0.01 0.32 0.10 0.00 -0.01 0.00 0.00 57.00 57.42 3keu n GLN 295 Cb 0.26 -1.64 0.34 0.00 0.00 0.00 0.00 30.24 29.19 3keu n GLN 295 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 3keu n SER 296 N -1.79 4.43 -0.22 1.08 7.64 -0.62 -4.67 113.62 119.48 3keu n SER 296 Ca 0.03 -2.29 -0.00 0.00 1.01 0.00 0.00 58.87 57.61 3keu n SER 296 Cb 0.19 -0.54 0.07 0.00 -1.01 0.00 0.00 64.21 62.92 3keu n SER 296 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 3keu h LYS 297 N 4.04 -0.00 -0.13 1.43 3.64 -1.58 -0.17 116.57 123.81 3keu h LYS 297 Ca 0.00 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.32 3keu h LYS 297 Cb 1.28 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.09 3keu h LYS 297 CO 0.15 -0.00 -0.18 0.00 -2.27 0.00 0.00 179.45 177.15 3keu h ARG 298 N -0.01 0.21 -0.09 1.90 2.47 -1.88 -1.71 114.38 115.26 3keu h ARG 298 Ca 0.31 -0.05 -0.14 0.00 -1.26 0.00 0.00 59.98 58.84 3keu h ARG 298 Cb 0.48 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.76 3keu h ARG 298 CO -0.67 0.39 -0.56 -0.44 0.56 0.00 0.00 179.97 179.25 3keu h ASP 299 N 0.20 0.32 -0.16 7.04 3.32 -1.35 -2.55 116.42 123.24 3keu h ASP 299 Ca 0.04 -0.17 -0.20 0.00 0.02 0.00 0.00 57.03 56.71 3keu h ASP 299 Cb 0.44 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.90 3keu h ASP 299 CO 0.03 0.81 -0.66 0.40 -1.72 0.00 0.00 179.24 178.11 3keu h ILE 300 N 0.22 1.29 -0.44 0.35 2.04 -0.65 -2.29 117.51 118.03 3keu h ILE 300 Ca 0.00 -1.86 -0.03 0.00 1.00 0.00 0.00 64.86 63.97 3keu h ILE 300 Cb 1.05 1.82 -0.02 0.00 -0.74 0.00 0.00 36.82 38.93 3keu h ILE 300 CO 0.09 0.60 0.17 -0.33 0.00 0.00 0.00 178.15 178.67 3keu h GLU 301 N 0.57 0.66 -1.76 2.37 5.08 -1.26 -3.40 114.58 116.84 3keu h GLU 301 Ca -0.02 -0.12 -0.32 0.00 -1.00 0.00 0.00 59.36 57.90 3keu h GLU 301 Cb 1.27 -0.10 -0.29 0.00 0.50 0.00 0.00 28.75 30.13 3keu h GLU 301 CO 0.14 0.61 -0.66 0.34 -1.00 0.00 0.00 179.01 178.44 3keu s ASP 302 N -5.92 0.57 0.23 1.42 2.15 -0.97 -5.06 116.67 109.10 3keu s ASP 302 Ca -0.13 -1.61 -0.30 0.00 0.43 0.00 0.00 52.55 50.94 3keu s ASP 302 Cb 0.11 0.80 -0.09 0.00 -0.30 0.00 0.00 42.92 43.44 3keu s ASP 302 CO 0.76 -0.22 1.09 -2.16 -0.17 0.00 0.00 175.17 174.47 3keu s PRO 303 N 1.32 4.64 -0.15 4.34 0.04 -0.86 -4.64 135.00 139.69 3keu s PRO 303 Ca 0.19 1.74 -0.29 0.00 0.04 0.00 0.00 61.00 62.68 3keu s PRO 303 Cb -0.11 -3.24 -0.02 0.00 0.04 0.00 0.00 34.50 31.18 3keu s PRO 303 CO -0.04 0.18 1.22 -2.00 0.04 0.00 0.00 177.00 176.40 3keu s GLU 304 N -0.94 4.26 -0.18 4.56 2.12 -1.26 -4.94 118.70 122.32 3keu s GLU 304 Ca 0.46 1.63 -0.29 0.00 0.36 0.00 0.00 54.97 57.14 3keu s GLU 304 Cb -0.30 -3.71 -0.04 0.00 0.26 0.00 0.00 34.13 30.34 3keu s GLU 304 CO 0.38 -0.64 1.77 0.42 -0.54 0.00 0.00 175.26 176.65 3keu s ILE 305 N 3.17 3.48 -0.29 -3.70 -1.09 -1.26 -4.83 121.20 116.68 3keu s ILE 305 Ca 0.54 0.54 0.10 0.00 -2.23 0.00 0.00 60.65 59.60 3keu s ILE 305 Cb -0.22 -3.49 0.25 0.00 -1.58 0.00 0.00 42.46 37.42 3keu s ILE 305 CO 0.15 -0.21 1.18 1.33 -1.23 0.00 0.00 174.94 176.17 3keu n VAL 306 N 6.51 1.47 -3.67 2.92 0.24 -1.26 -4.94 118.33 119.60 3keu n VAL 306 Ca 0.21 -1.48 -0.12 0.00 -2.04 0.00 0.00 64.34 60.91 3keu n VAL 306 Cb 0.45 0.17 -0.12 0.00 -1.47 0.00 0.00 33.84 32.87 3keu n VAL 306 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3keu s VAL 307 N -1.81 -0.40 0.05 3.34 1.01 -1.26 -5.07 120.40 116.26 3keu s VAL 307 Ca 0.22 0.23 -0.14 0.00 0.00 0.00 0.00 61.98 62.29 3keu s VAL 307 Cb 0.16 -0.49 -0.06 0.00 0.00 0.00 0.00 36.38 35.99 3keu s VAL 307 CO 0.06 0.10 0.44 -1.10 0.00 0.00 0.00 175.10 174.61 3keu s GLN 308 N 2.27 3.92 -0.08 2.72 -1.52 -1.26 -4.80 119.66 120.91 3keu s GLN 308 Ca -0.01 0.41 -0.07 0.00 -1.95 0.00 0.00 55.36 53.73 3keu s GLN 308 Cb -0.12 -3.13 -0.04 0.00 -0.22 0.00 0.00 33.01 29.50 3keu s GLN 308 CO -0.10 0.63 0.19 0.00 -0.25 0.00 0.00 175.29 175.76 3keu s ALA 309 N -1.21 3.86 0.00 6.09 0.00 -1.26 -4.77 121.76 124.48 3keu s ALA 309 Ca 0.28 -0.60 -0.18 0.00 0.00 0.00 0.00 51.96 51.47 3keu s ALA 309 Cb -0.16 -2.02 -0.06 0.00 0.00 0.00 0.00 23.12 20.88 3keu s ALA 309 CO 0.16 0.62 0.50 0.95 0.00 0.00 0.00 175.76 177.98 3keu s THR 310 N -1.09 4.94 -0.50 0.00 -4.23 0.15 -4.86 115.64 110.05 3keu s THR 310 Ca 0.18 1.04 -0.25 0.00 -1.18 0.00 0.00 61.69 61.48 3keu s THR 310 Cb -0.13 -3.82 0.03 0.00 1.34 0.00 0.00 72.50 69.93 3keu s THR 310 CO 0.08 0.51 0.91 -0.69 -0.54 0.00 0.00 174.62 174.89 3keu s VAL 311 N -0.70 4.46 -2.05 2.29 1.01 -1.26 -0.12 120.40 124.03 3keu s VAL 311 Ca 0.27 0.50 0.32 0.00 0.00 0.00 0.00 61.98 63.06 3keu s VAL 311 Cb -0.18 -4.47 0.88 0.00 0.00 0.00 0.00 36.38 32.61 3keu s VAL 311 CO 0.15 -0.94 2.18 0.18 0.00 0.00 0.00 175.10 176.67