#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lhr s ARG 6 N -0.70 3.12 -0.12 0.00 3.52 -1.26 -1.15 118.95 122.36 1lhr s ARG 6 Ca 0.11 -0.82 -0.00 0.00 -0.13 0.00 0.00 55.73 54.89 1lhr s ARG 6 Cb -0.11 -2.46 -0.02 0.00 -1.56 0.00 0.00 34.95 30.80 1lhr s ARG 6 CO 0.00 0.08 -0.11 0.08 -0.81 0.00 0.00 175.30 174.55 1lhr s VAL 7 N 0.61 3.28 -0.41 7.11 1.01 0.20 -1.89 120.40 130.32 1lhr s VAL 7 Ca -0.11 -0.59 -0.13 0.00 0.00 0.00 0.00 61.98 61.15 1lhr s VAL 7 Cb -0.16 -2.38 0.04 0.00 0.00 0.00 0.00 36.38 33.88 1lhr s VAL 7 CO 0.03 0.53 0.27 -0.22 0.00 0.00 0.00 175.10 175.71 1lhr s LEU 8 N 0.10 5.05 -0.24 3.92 2.96 -0.65 0.42 118.68 130.25 1lhr s LEU 8 Ca -0.05 -1.12 -0.05 0.00 -0.22 0.00 0.00 54.13 52.70 1lhr s LEU 8 Cb -0.14 -2.08 -0.01 0.00 0.50 0.00 0.00 46.19 44.45 1lhr s LEU 8 CO 0.04 -0.47 0.01 -0.55 -1.32 0.00 0.00 176.35 174.06 1lhr s SER 9 N 1.86 4.70 -0.41 3.68 0.15 0.12 -0.42 113.70 123.38 1lhr s SER 9 Ca 0.03 -0.35 -0.03 0.00 0.70 0.00 0.00 55.95 56.30 1lhr s SER 9 Cb -0.21 -1.82 0.11 0.00 -1.71 0.00 0.00 66.02 62.39 1lhr s SER 9 CO 0.07 -0.04 0.20 -0.63 1.20 0.00 0.00 173.24 174.04 1lhr s ILE 10 N 1.53 3.33 0.37 6.45 1.01 -0.39 -1.09 121.20 132.42 1lhr s ILE 10 Ca 0.06 -2.01 -0.08 0.00 0.00 0.00 0.00 60.65 58.62 1lhr s ILE 10 Cb -0.15 -3.26 0.03 0.00 0.01 0.00 0.00 42.46 39.09 1lhr s ILE 10 CO -0.00 -0.67 0.63 -1.10 0.00 0.00 0.00 174.94 173.80 1lhr s GLN 11 N 1.16 2.11 0.59 2.79 -0.21 -0.88 -4.14 119.66 121.07 1lhr s GLN 11 Ca 0.08 -1.65 -0.17 0.00 0.02 0.00 0.00 55.36 53.64 1lhr s GLN 11 Cb -0.23 0.53 -0.04 0.00 1.00 0.00 0.00 33.01 34.28 1lhr s GLN 11 CO -0.04 -0.93 1.08 -1.54 -2.12 0.00 0.00 175.29 171.74 1lhr s SER 12 N -3.18 5.66 -0.03 5.90 1.04 -1.26 -0.90 113.70 120.93 1lhr s SER 12 Ca 0.24 1.93 0.06 0.00 0.48 0.00 0.00 55.95 58.66 1lhr s SER 12 Cb -0.03 -2.55 -0.01 0.00 0.10 0.00 0.00 66.02 63.53 1lhr s SER 12 CO 0.17 -1.25 -0.22 -2.28 0.98 0.00 0.00 173.24 170.64 1lhr s HIS 13 N -2.27 2.02 -0.04 5.02 2.46 -0.67 -0.38 115.29 121.44 1lhr s HIS 13 Ca 0.66 -0.47 0.03 0.00 0.47 0.00 0.00 55.06 55.75 1lhr s HIS 13 Cb -0.18 -1.32 0.00 0.00 -0.13 0.00 0.00 32.58 30.95 1lhr s HIS 13 CO 0.35 -0.10 -0.11 0.14 -2.47 0.00 0.00 174.74 172.55 1lhr s VAL 14 N -0.34 0.99 0.13 0.89 -7.23 -1.26 -0.95 120.40 112.64 1lhr s VAL 14 Ca 0.04 -0.46 -0.27 0.00 -1.81 0.00 0.00 61.98 59.48 1lhr s VAL 14 Cb -0.10 -0.88 -0.03 0.00 0.56 0.00 0.00 36.38 35.92 1lhr s VAL 14 CO 0.01 0.30 1.61 0.58 -0.31 0.00 0.00 175.10 177.29 1lhr h VAL 15 N 5.49 0.26 -3.47 1.32 2.07 -0.91 -3.42 116.25 117.59 1lhr h VAL 15 Ca -0.33 0.00 -0.66 0.00 0.82 0.00 0.00 66.70 66.53 1lhr h VAL 15 Cb 1.17 0.26 -0.15 0.00 -1.52 0.00 0.00 31.29 31.06 1lhr h VAL 15 CO 0.48 0.00 -0.69 -0.60 0.02 0.00 0.00 177.57 176.79 1lhr s ARG 16 N -5.98 2.52 0.06 1.57 3.52 -0.90 -5.05 118.95 114.69 1lhr s ARG 16 Ca -0.15 -0.79 0.00 0.00 -0.13 0.00 0.00 55.73 54.65 1lhr s ARG 16 Cb 0.10 -2.51 0.00 0.00 -1.56 0.00 0.00 34.95 30.98 1lhr s ARG 16 CO 0.65 0.57 0.00 0.41 -0.81 0.00 0.00 175.30 176.12 1lhr n GLY 17 N 1.06 -3.14 2.79 8.12 0.00 -1.26 -4.49 105.19 108.26 1lhr n GLY 17 Ca -0.13 -1.81 -0.29 0.00 0.00 0.00 0.00 46.02 43.79 1lhr n GLY 17 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1lhr s TYR 18 N -0.89 1.49 0.15 1.61 1.51 -1.26 -4.86 117.35 115.11 1lhr s TYR 18 Ca 0.00 -1.23 -0.18 0.00 -1.01 0.00 0.00 57.07 54.65 1lhr s TYR 18 Cb 0.00 -1.28 0.04 0.00 -0.11 0.00 0.00 41.96 40.61 1lhr s TYR 18 CO 0.00 -0.69 0.48 0.54 -1.11 0.00 0.00 175.55 174.77 1lhr s VAL 19 N 1.70 0.04 0.00 0.71 0.11 -1.26 -4.21 120.40 117.49 1lhr s VAL 19 Ca -0.01 -0.48 0.00 0.00 -2.93 0.00 0.00 61.98 58.56 1lhr s VAL 19 Cb -0.18 -1.23 0.00 0.00 -1.53 0.00 0.00 36.38 33.44 1lhr s VAL 19 CO -0.10 -0.19 0.00 0.61 -3.33 0.00 0.00 175.10 172.09 1lhr n GLY 20 N -0.29 3.16 0.29 6.54 0.00 -1.26 -1.72 105.19 111.90 1lhr n GLY 20 Ca -0.15 -0.10 0.16 0.00 0.00 0.00 0.00 46.02 45.94 1lhr n GLY 20 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1lhr h ASN 21 N 0.85 0.00 0.72 1.61 -0.26 -0.94 -2.18 115.58 115.38 1lhr h ASN 21 Ca 0.00 0.00 -0.14 0.00 -0.56 0.00 0.00 56.30 55.60 1lhr h ASN 21 Cb 0.00 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.24 1lhr h ASN 21 CO 0.00 0.06 -0.69 0.03 -1.06 0.00 0.00 177.43 175.77 1lhr h ARG 22 N 0.00 0.00 0.00 0.81 2.47 -1.48 -1.07 114.38 115.11 1lhr h ARG 22 Ca -0.00 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.69 1lhr h ARG 22 Cb 0.24 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.56 1lhr h ARG 22 CO 0.01 0.69 -0.57 0.00 0.56 0.00 0.00 179.97 180.66 1lhr h ALA 23 N 1.31 0.74 0.01 0.04 0.00 -1.38 -3.39 119.26 116.60 1lhr h ALA 23 Ca -0.01 -0.15 -0.38 0.00 0.00 0.00 0.00 54.91 54.37 1lhr h ALA 23 Cb 1.23 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.97 1lhr h ALA 23 CO 0.09 0.19 -2.38 0.00 0.00 0.00 0.00 179.25 177.15 1lhr n ALA 24 N -2.18 1.43 0.32 0.00 0.00 -1.00 -4.40 120.51 114.68 1lhr n ALA 24 Ca 0.01 -1.15 -0.15 0.00 0.00 0.00 0.00 53.44 52.15 1lhr n ALA 24 Cb 0.60 -0.20 -0.08 0.00 0.00 0.00 0.00 19.45 19.77 1lhr n ALA 24 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1lhr h THR 25 N 0.00 0.23 -0.56 0.00 2.02 -1.38 -2.60 112.91 110.62 1lhr h THR 25 Ca -0.54 -0.32 0.11 0.00 0.77 0.00 0.00 66.41 66.43 1lhr h THR 25 Cb 2.05 0.31 -0.09 0.00 -1.74 0.00 0.00 68.15 68.67 1lhr h THR 25 CO -0.02 0.03 -0.01 0.15 0.37 0.00 0.00 175.52 176.04 1lhr h PHE 26 N -1.08 -0.05 -0.14 3.16 3.57 -1.82 0.12 116.94 120.71 1lhr h PHE 26 Ca -0.08 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.49 1lhr h PHE 26 Cb 0.68 0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.50 1lhr h PHE 26 CO 0.00 -0.15 -0.08 -1.35 -2.23 0.00 0.00 178.31 174.50 1lhr h PRO 27 N 0.11 -0.07 -0.80 6.41 0.11 -1.79 -1.10 132.00 134.87 1lhr h PRO 27 Ca 0.29 0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.36 1lhr h PRO 27 Cb 0.45 0.02 -0.04 0.00 0.11 0.00 0.00 31.00 31.54 1lhr h PRO 27 CO -0.48 -0.05 0.31 -0.07 -0.21 0.00 0.00 178.00 177.50 1lhr h LEU 28 N -0.08 1.10 -0.43 2.35 3.38 -0.98 -2.08 115.31 118.58 1lhr h LEU 28 Ca 0.08 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1lhr h LEU 28 Cb 0.20 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1lhr h LEU 28 CO -0.19 0.98 0.18 1.56 0.09 0.00 0.00 178.44 181.06 1lhr h GLN 29 N 1.16 0.64 0.00 1.13 4.20 -0.41 0.07 115.11 121.90 1lhr h GLN 29 Ca 0.27 -0.11 -0.07 0.00 0.06 0.00 0.00 58.65 58.79 1lhr h GLN 29 Cb 0.22 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1lhr h GLN 29 CO -0.02 0.58 -0.35 -0.39 -0.67 0.00 0.00 178.83 177.98 1lhr h VAL 30 N 0.55 1.01 0.00 -0.54 -1.51 -1.07 -1.78 116.25 112.90 1lhr h VAL 30 Ca 0.14 -1.32 0.00 0.00 -1.23 0.00 0.00 66.70 64.29 1lhr h VAL 30 Cb 0.17 1.77 0.00 0.00 -2.13 0.00 0.00 31.29 31.10 1lhr h VAL 30 CO -0.01 0.34 0.00 0.18 -1.23 0.00 0.00 177.57 176.85 1lhr n LEU 31 N -3.76 0.00 0.00 4.19 4.77 -0.80 -4.88 117.00 116.52 1lhr n LEU 31 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1lhr n LEU 31 Cb 0.44 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1lhr n LEU 31 CO 0.37 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 1lhr n GLY 32 N 0.81 0.80 3.89 -0.72 0.00 -0.67 -5.06 105.19 104.23 1lhr n GLY 32 Ca 0.16 -0.16 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1lhr n GLY 32 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1lhr s PHE 33 N -2.00 3.58 -0.28 1.61 0.40 -0.03 -4.66 117.98 116.60 1lhr s PHE 33 Ca 0.00 0.52 -0.25 0.00 -0.60 0.00 0.00 56.93 56.60 1lhr s PHE 33 Cb 0.00 -1.94 0.00 0.00 0.51 0.00 0.00 43.02 41.59 1lhr s PHE 33 CO 0.00 0.65 0.84 -2.00 0.70 0.00 0.00 175.22 175.41 1lhr s GLU 34 N -1.63 4.07 -0.24 0.44 2.56 -0.30 -4.02 118.70 119.57 1lhr s GLU 34 Ca 0.25 0.80 -0.03 0.00 0.00 0.00 0.00 54.97 55.99 1lhr s GLU 34 Cb -0.13 -3.69 0.01 0.00 2.00 0.00 0.00 34.13 32.32 1lhr s GLU 34 CO 0.14 -0.64 -0.05 0.08 -0.56 0.00 0.00 175.26 174.24 1lhr s VAL 35 N 2.99 3.10 -0.25 3.70 1.01 -1.26 0.61 120.40 130.30 1lhr s VAL 35 Ca 0.35 -0.82 -0.13 0.00 0.00 0.00 0.00 61.98 61.38 1lhr s VAL 35 Cb -0.14 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.68 1lhr s VAL 35 CO 0.10 0.27 0.29 -1.81 0.00 0.00 0.00 175.10 173.96 1lhr s ASP 36 N 1.39 6.21 -0.20 3.32 1.11 0.17 -4.97 116.67 123.70 1lhr s ASP 36 Ca 0.02 0.23 -0.02 0.00 0.18 0.00 0.00 52.55 52.96 1lhr s ASP 36 Cb -0.16 -2.17 -0.00 0.00 1.07 0.00 0.00 42.92 41.66 1lhr s ASP 36 CO -0.04 -0.08 -0.09 0.00 1.18 0.00 0.00 175.17 176.14 1lhr s ALA 37 N 1.63 2.67 -0.24 5.23 0.00 -1.26 -0.71 121.76 129.09 1lhr s ALA 37 Ca 0.12 -1.14 -0.09 0.00 0.00 0.00 0.00 51.96 50.84 1lhr s ALA 37 Cb -0.15 -1.51 -0.04 0.00 0.00 0.00 0.00 23.12 21.41 1lhr s ALA 37 CO 0.09 -0.32 0.13 0.08 0.00 0.00 0.00 175.76 175.73 1lhr s VAL 38 N 1.29 5.07 -0.48 0.00 1.01 -0.25 -5.00 120.40 122.04 1lhr s VAL 38 Ca 0.03 0.08 -0.19 0.00 0.00 0.00 0.00 61.98 61.91 1lhr s VAL 38 Cb -0.14 -3.36 0.05 0.00 0.00 0.00 0.00 36.38 32.93 1lhr s VAL 38 CO -0.05 0.35 0.57 0.20 0.00 0.00 0.00 175.10 176.18 1lhr s ASN 39 N 1.12 6.22 0.62 3.32 0.01 -1.26 -2.08 114.94 122.89 1lhr s ASN 39 Ca 0.06 -0.84 0.35 0.00 -0.71 0.00 0.00 52.86 51.73 1lhr s ASN 39 Cb -0.14 -2.27 2.05 0.00 0.41 0.00 0.00 41.25 41.30 1lhr s ASN 39 CO 0.05 -0.80 2.30 0.77 -1.51 0.00 0.00 177.10 177.91 1lhr h SER 40 N 8.91 0.00 -5.08 -1.22 4.64 -1.35 -3.44 113.55 116.00 1lhr h SER 40 Ca -0.27 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.07 1lhr h SER 40 Cb 1.10 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.12 1lhr h SER 40 CO 0.92 0.00 0.11 0.68 -0.87 0.00 0.00 176.83 177.67 1lhr s VAL 41 N -4.44 0.00 -0.22 0.95 -7.23 -1.26 -1.43 120.40 106.77 1lhr s VAL 41 Ca -0.05 -1.13 -0.04 0.00 -1.81 0.00 0.00 61.98 58.96 1lhr s VAL 41 Cb 0.14 -2.05 0.09 0.00 0.56 0.00 0.00 36.38 35.12 1lhr s VAL 41 CO 0.50 -0.00 0.17 -1.58 -0.31 0.00 0.00 175.10 173.87 1lhr s GLN 42 N -3.95 0.16 0.35 4.82 0.74 -0.69 -1.67 119.66 119.41 1lhr s GLN 42 Ca 0.15 -0.09 0.09 0.00 0.05 0.00 0.00 55.36 55.56 1lhr s GLN 42 Cb -0.04 -1.35 -0.06 0.00 1.10 0.00 0.00 33.01 32.66 1lhr s GLN 42 CO 0.07 -0.78 -0.05 -0.06 -0.55 0.00 0.00 175.29 173.92 1lhr s PHE 43 N 2.22 2.46 0.26 1.67 0.40 -0.13 -1.65 117.98 123.21 1lhr s PHE 43 Ca 0.06 -0.49 0.06 0.00 -0.60 0.00 0.00 56.93 55.96 1lhr s PHE 43 Cb -0.16 -1.45 0.34 0.00 0.51 0.00 0.00 43.02 42.26 1lhr s PHE 43 CO -0.19 0.54 1.61 0.66 0.70 0.00 0.00 175.22 178.54 1lhr h SER 44 N 1.93 0.20 -5.37 1.36 4.64 -1.17 0.62 113.55 115.77 1lhr h SER 44 Ca -0.42 -0.11 0.15 0.00 -0.47 0.00 0.00 61.79 60.94 1lhr h SER 44 Cb 1.25 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 63.25 1lhr h SER 44 CO 0.70 0.71 0.55 0.54 -0.87 0.00 0.00 176.83 178.46 1lhr s ASN 45 N -6.88 -0.01 0.69 4.97 2.20 -1.26 -2.11 114.94 112.53 1lhr s ASN 45 Ca -0.03 -0.70 -0.07 0.00 -0.94 0.00 0.00 52.86 51.11 1lhr s ASN 45 Cb 0.12 0.53 0.05 0.00 -2.00 0.00 0.00 41.25 39.96 1lhr s ASN 45 CO 0.78 -1.06 1.00 -1.38 -2.94 0.00 0.00 177.10 173.51 1lhr s HIS 46 N -2.26 3.00 -2.00 1.54 -3.43 -1.26 -4.86 115.29 106.02 1lhr s HIS 46 Ca 0.21 0.52 0.11 0.00 -0.80 0.00 0.00 55.06 55.10 1lhr s HIS 46 Cb -0.03 -3.11 0.64 0.00 -1.43 0.00 0.00 32.58 28.65 1lhr s HIS 46 CO 0.06 -1.30 1.07 0.25 -2.00 0.00 0.00 174.74 172.81 1lhr n THR 47 N -2.88 0.00 0.43 -5.38 -2.24 0.59 -2.57 114.28 102.23 1lhr n THR 47 Ca 0.07 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.98 1lhr n THR 47 Cb 0.60 -0.66 0.34 0.00 -2.10 0.00 0.00 70.33 68.51 1lhr n THR 47 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1lhr h GLY 48 N 2.30 0.00 -1.20 3.38 0.00 -1.93 -3.45 103.07 102.17 1lhr h GLY 48 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.85 1lhr h GLY 48 CO 0.00 0.00 0.32 -0.19 0.00 0.00 0.00 176.54 176.67 1lhr s TYR 49 N -3.20 3.26 0.30 5.60 2.02 -1.06 -4.82 117.35 119.45 1lhr s TYR 49 Ca 0.08 0.86 0.08 0.00 -0.37 0.00 0.00 57.07 57.72 1lhr s TYR 49 Cb 0.09 -2.98 0.48 0.00 -0.40 0.00 0.00 41.96 39.15 1lhr s TYR 49 CO 0.60 -1.10 1.71 0.77 -1.57 0.00 0.00 175.55 175.97 1lhr h SER 50 N -0.50 0.19 -3.73 2.29 0.02 -1.89 -3.45 113.55 106.47 1lhr h SER 50 Ca -0.45 -0.08 -0.39 0.00 -0.84 0.00 0.00 61.79 60.03 1lhr h SER 50 Cb 1.26 -0.05 -0.14 0.00 0.14 0.00 0.00 62.40 63.61 1lhr h SER 50 CO 0.63 0.60 -0.67 -1.00 -1.14 0.00 0.00 176.83 175.25 1lhr s HIS 51 N -4.09 1.59 -0.29 3.45 3.76 -1.26 -5.16 115.29 113.29 1lhr s HIS 51 Ca -0.04 -0.87 -0.23 0.00 -0.15 0.00 0.00 55.06 53.77 1lhr s HIS 51 Cb 0.13 -0.91 0.16 0.00 1.11 0.00 0.00 32.58 33.07 1lhr s HIS 51 CO 0.76 0.02 1.18 1.67 -0.85 0.00 0.00 174.74 177.53 1lhr s TRP 52 N -3.34 -0.31 0.03 1.40 -2.14 -1.26 -4.87 118.94 108.44 1lhr s TRP 52 Ca 0.27 0.72 0.01 0.00 2.66 0.00 0.00 56.10 59.77 1lhr s TRP 52 Cb 0.05 0.37 -0.02 0.00 -3.10 0.00 0.00 33.47 30.77 1lhr s TRP 52 CO 0.08 -0.15 -0.05 0.15 -2.66 0.00 0.00 176.95 174.32 1lhr s LYS 53 N 0.40 0.41 0.00 3.25 1.02 -1.26 -5.00 119.74 118.56 1lhr s LYS 53 Ca 0.02 -0.57 0.00 0.00 0.02 0.00 0.00 55.97 55.44 1lhr s LYS 53 Cb -0.05 -0.18 0.00 0.00 -0.52 0.00 0.00 37.83 37.09 1lhr s LYS 53 CO -0.11 0.03 0.00 0.41 -0.92 0.00 0.00 175.35 174.76 1lhr n GLY 54 N 1.85 -1.39 3.17 -3.33 0.00 -1.26 -0.59 105.19 103.63 1lhr n GLY 54 Ca -0.21 -1.03 -0.17 0.00 0.00 0.00 0.00 46.02 44.61 1lhr n GLY 54 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1lhr s GLN 55 N -1.11 0.82 0.02 1.61 -1.52 -0.66 -4.97 119.66 113.85 1lhr s GLN 55 Ca 0.00 -1.00 0.01 0.00 -1.95 0.00 0.00 55.36 52.42 1lhr s GLN 55 Cb 0.00 -0.73 -0.04 0.00 -0.22 0.00 0.00 33.01 32.03 1lhr s GLN 55 CO 0.00 0.15 0.06 0.08 -0.25 0.00 0.00 175.29 175.33 1lhr s VAL 56 N -1.59 4.50 -0.21 1.09 1.01 -1.26 -1.71 120.40 122.22 1lhr s VAL 56 Ca -0.00 -0.58 -0.13 0.00 0.00 0.00 0.00 61.98 61.27 1lhr s VAL 56 Cb -0.08 -3.08 -0.05 0.00 0.00 0.00 0.00 36.38 33.17 1lhr s VAL 56 CO 0.02 0.28 0.27 -0.22 0.00 0.00 0.00 175.10 175.45 1lhr s LEU 57 N -1.90 4.15 0.57 3.92 2.96 -0.51 -4.99 118.68 122.88 1lhr s LEU 57 Ca 0.24 0.33 -0.06 0.00 -0.22 0.00 0.00 54.13 54.42 1lhr s LEU 57 Cb -0.12 -2.30 -0.00 0.00 0.50 0.00 0.00 46.19 44.27 1lhr s LEU 57 CO 0.15 0.02 0.88 0.54 -1.32 0.00 0.00 176.35 176.62 1lhr s ASN 58 N 0.93 5.76 0.52 3.68 2.20 -1.26 -4.89 114.94 121.88 1lhr s ASN 58 Ca 0.13 0.78 0.25 0.00 -0.94 0.00 0.00 52.86 53.08 1lhr s ASN 58 Cb -0.14 -1.84 1.38 0.00 -2.00 0.00 0.00 41.25 38.65 1lhr s ASN 58 CO 0.05 -0.95 1.98 0.77 -2.94 0.00 0.00 177.10 176.01 1lhr h SER 59 N -0.09 0.03 0.09 3.54 4.64 -1.94 0.32 113.55 120.15 1lhr h SER 59 Ca -0.46 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.71 1lhr h SER 59 Cb 1.24 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.32 1lhr h SER 59 CO 0.61 0.02 -0.57 0.44 -0.87 0.00 0.00 176.83 176.45 1lhr h ASP 60 N 0.03 0.56 0.09 4.97 5.19 -1.95 -1.93 116.42 123.37 1lhr h ASP 60 Ca 0.28 -0.30 -0.15 0.00 -0.62 0.00 0.00 57.03 56.24 1lhr h ASP 60 Cb 1.08 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 40.42 1lhr h ASP 60 CO -0.01 1.01 -0.51 -0.33 -3.12 0.00 0.00 179.24 176.27 1lhr h GLU 61 N 0.38 0.47 -0.52 3.56 5.08 -1.35 -1.74 114.58 120.47 1lhr h GLU 61 Ca 0.00 -0.28 -0.08 0.00 -1.00 0.00 0.00 59.36 58.00 1lhr h GLU 61 Cb 1.11 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.36 1lhr h GLU 61 CO 0.10 0.87 -0.00 1.25 -1.00 0.00 0.00 179.01 180.24 1lhr h LEU 62 N 0.37 0.85 -0.59 1.33 5.85 -1.09 -2.48 115.31 119.54 1lhr h LEU 62 Ca 0.01 -0.22 -0.15 0.00 0.84 0.00 0.00 57.88 58.37 1lhr h LEU 62 Cb 1.03 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 1lhr h LEU 62 CO 0.09 0.91 -0.46 -0.61 -0.34 0.00 0.00 178.44 178.03 1lhr h GLN 63 N 0.81 0.58 -0.36 1.25 4.15 -1.13 -2.48 115.11 117.93 1lhr h GLN 63 Ca 0.15 -0.32 -0.04 0.00 0.77 0.00 0.00 58.65 59.21 1lhr h GLN 63 Cb 0.49 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.18 1lhr h GLN 63 CO 0.02 0.92 0.04 1.49 -1.93 0.00 0.00 178.83 179.37 1lhr h GLU 64 N 0.47 0.54 0.09 1.69 4.81 -1.00 0.09 114.58 121.26 1lhr h GLU 64 Ca 0.03 -0.10 -0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1lhr h GLU 64 Cb 0.99 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.28 1lhr h GLU 64 CO 0.09 0.54 -0.04 -0.07 -0.73 0.00 0.00 179.01 178.79 1lhr h LEU 65 N 0.52 -0.10 -1.43 1.64 3.38 -1.30 -2.82 115.31 115.20 1lhr h LEU 65 Ca 0.12 -0.48 0.08 0.00 0.09 0.00 0.00 57.88 57.69 1lhr h LEU 65 Cb 0.28 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 1lhr h LEU 65 CO 0.00 0.49 0.47 0.22 0.09 0.00 0.00 178.44 179.71 1lhr h TYR 66 N -0.76 0.69 -0.81 1.13 3.20 -1.33 -0.30 116.97 118.79 1lhr h TYR 66 Ca -0.01 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 1lhr h TYR 66 Cb 0.58 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.58 1lhr h TYR 66 CO 0.11 0.35 0.38 -0.44 -1.64 0.00 0.00 178.16 176.91 1lhr h ASP 67 N 0.66 1.06 -0.84 -2.11 5.19 -0.97 -0.64 116.42 118.77 1lhr h ASP 67 Ca 0.32 -0.13 0.05 0.00 -0.62 0.00 0.00 57.03 56.64 1lhr h ASP 67 Cb 0.37 -0.27 -0.06 0.00 0.18 0.00 0.00 39.33 39.55 1lhr h ASP 67 CO -0.11 0.91 0.53 1.23 -3.12 0.00 0.00 179.24 178.68 1lhr h GLY 68 N 1.18 1.25 1.66 2.75 0.00 -0.79 0.21 103.07 109.33 1lhr h GLY 68 Ca 0.28 -0.39 -0.10 0.00 0.00 0.00 0.00 47.33 47.11 1lhr h GLY 68 CO -0.03 0.30 -0.31 1.41 0.00 0.00 0.00 176.54 177.90 1lhr h LEU 69 N 1.00 0.40 0.05 3.11 3.38 -1.04 -2.81 115.31 119.39 1lhr h LEU 69 Ca 0.35 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 1lhr h LEU 69 Cb 0.10 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1lhr h LEU 69 CO -0.15 0.70 -0.02 0.50 0.09 0.00 0.00 178.44 179.56 1lhr h LYS 70 N 0.34 -0.06 -0.99 1.13 3.64 0.21 -1.26 116.57 119.58 1lhr h LYS 70 Ca 0.04 0.00 0.18 0.00 -1.27 0.00 0.00 60.65 59.61 1lhr h LYS 70 Cb 0.73 0.01 -0.10 0.00 -0.41 0.00 0.00 32.23 32.45 1lhr h LYS 70 CO 0.06 0.42 0.60 -0.07 -2.27 0.00 0.00 179.45 178.19 1lhr h LEU 71 N -0.57 0.78 -0.62 5.20 3.38 -0.62 0.16 115.31 123.01 1lhr h LEU 71 Ca -0.01 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1lhr h LEU 71 Cb 0.51 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1lhr h LEU 71 CO 0.01 0.29 0.00 0.59 0.09 0.00 0.00 178.44 179.42 1lhr n ASN 72 N -4.77 0.92 -2.55 -0.43 3.02 -1.07 -4.90 115.26 105.49 1lhr n ASN 72 Ca 0.23 -1.80 -0.18 0.00 -0.03 0.00 0.00 54.58 52.80 1lhr n ASN 72 Cb 0.55 -0.09 -0.00 0.00 -0.61 0.00 0.00 39.78 39.62 1lhr n ASN 72 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1lhr n HIS 73 N -0.09 -1.33 -0.67 3.10 8.25 0.56 -4.84 115.22 120.19 1lhr n HIS 73 Ca 0.10 0.09 0.07 0.00 -0.26 0.00 0.00 57.72 57.72 1lhr n HIS 73 Cb 0.17 -3.46 0.21 0.00 1.12 0.00 0.00 29.99 28.03 1lhr n HIS 73 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 1lhr n VAL 74 N -3.80 1.77 -1.05 1.59 0.24 -0.50 -4.74 118.33 111.85 1lhr n VAL 74 Ca -0.18 -1.55 -0.16 0.00 -2.04 0.00 0.00 64.34 60.42 1lhr n VAL 74 Cb 0.64 0.04 -0.06 0.00 -1.47 0.00 0.00 33.84 32.99 1lhr n VAL 74 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1lhr n ASN 75 N -0.17 5.93 -4.24 -1.34 6.94 -1.15 -4.83 115.26 116.41 1lhr n ASN 75 Ca 0.17 -2.83 -0.38 0.00 -0.02 0.00 0.00 54.58 51.51 1lhr n ASN 75 Cb 0.70 -1.23 -0.11 0.00 -2.36 0.00 0.00 39.78 36.77 1lhr n ASN 75 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 1lhr s GLN 76 N -0.67 2.49 0.29 -3.83 -0.21 -1.26 -4.96 119.66 111.50 1lhr s GLN 76 Ca 0.45 -1.42 0.12 0.00 0.02 0.00 0.00 55.36 54.53 1lhr s GLN 76 Cb 0.27 -3.59 -0.05 0.00 1.00 0.00 0.00 33.01 30.64 1lhr s GLN 76 CO -0.07 -0.85 -0.19 0.71 -2.12 0.00 0.00 175.29 172.77 1lhr s TYR 77 N 1.35 2.30 -0.17 0.91 1.51 -1.26 -4.94 117.35 117.05 1lhr s TYR 77 Ca 0.02 -0.35 0.15 0.00 -1.01 0.00 0.00 57.07 55.88 1lhr s TYR 77 Cb -0.22 -1.03 -0.22 0.00 -0.11 0.00 0.00 41.96 40.39 1lhr s TYR 77 CO 0.01 0.71 0.06 -0.25 -1.11 0.00 0.00 175.55 174.96 1lhr n ASP 78 N -0.64 0.69 -4.07 2.29 8.00 -0.79 -4.74 116.55 117.29 1lhr n ASP 78 Ca -0.05 -0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.36 1lhr n ASP 78 Cb 0.60 0.91 -0.10 0.00 -0.02 0.00 0.00 41.12 42.51 1lhr n ASP 78 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1lhr s TYR 79 N -2.43 0.51 -0.01 1.24 1.51 -1.06 -1.09 117.35 116.02 1lhr s TYR 79 Ca -0.09 -0.86 0.02 0.00 -1.01 0.00 0.00 57.07 55.13 1lhr s TYR 79 Cb 0.05 -0.36 -0.00 0.00 -0.11 0.00 0.00 41.96 41.54 1lhr s TYR 79 CO 0.72 -0.28 -0.08 0.08 -1.11 0.00 0.00 175.55 174.88 1lhr s VAL 80 N -3.04 0.68 -0.06 0.71 1.01 -0.90 -1.63 120.40 117.17 1lhr s VAL 80 Ca 0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 61.98 61.63 1lhr s VAL 80 Cb 0.02 -0.58 0.03 0.00 0.00 0.00 0.00 36.38 35.84 1lhr s VAL 80 CO -0.06 0.20 0.01 -0.22 0.00 0.00 0.00 175.10 175.03 1lhr s LEU 81 N -0.06 0.63 0.18 3.92 2.96 0.44 -1.33 118.68 125.43 1lhr s LEU 81 Ca 0.01 -0.06 0.04 0.00 -0.22 0.00 0.00 54.13 53.90 1lhr s LEU 81 Cb -0.05 -0.38 -0.05 0.00 0.50 0.00 0.00 46.19 46.22 1lhr s LEU 81 CO -0.00 -0.18 -0.05 0.42 -1.32 0.00 0.00 176.35 175.21 1lhr s THR 82 N 1.83 1.06 0.00 3.68 -4.23 -1.07 -1.26 115.64 115.65 1lhr s THR 82 Ca 0.02 -2.04 0.00 0.00 -1.18 0.00 0.00 61.69 58.49 1lhr s THR 82 Cb -0.12 -2.06 0.00 0.00 1.34 0.00 0.00 72.50 71.66 1lhr s THR 82 CO -0.04 -0.56 0.00 0.61 -0.54 0.00 0.00 174.62 174.09 1lhr n GLY 83 N -0.28 4.33 3.67 3.99 0.00 -1.26 -2.72 105.19 112.92 1lhr n GLY 83 Ca -0.08 -0.47 -0.47 0.00 0.00 0.00 0.00 46.02 45.00 1lhr n GLY 83 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1lhr n TYR 84 N 0.00 2.22 -3.80 1.61 9.36 -1.26 -4.53 117.16 120.75 1lhr n TYR 84 Ca 0.00 0.25 -0.12 0.00 3.32 0.00 0.00 57.90 61.35 1lhr n TYR 84 Cb 0.00 -2.55 -0.12 0.00 -0.63 0.00 0.00 39.34 36.05 1lhr n TYR 84 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 1lhr s THR 85 N 1.47 0.01 0.00 2.97 2.01 -1.26 -4.75 115.64 116.08 1lhr s THR 85 Ca 0.82 -0.06 0.00 0.00 0.31 0.00 0.00 61.69 62.76 1lhr s THR 85 Cb -0.71 -0.31 0.00 0.00 0.01 0.00 0.00 72.50 71.49 1lhr s THR 85 CO 0.41 -0.03 0.77 -2.11 -0.69 0.00 0.00 174.62 172.97 1lhr n ARG 86 N 2.83 1.27 -4.01 4.92 0.00 -1.26 -4.91 116.66 115.51 1lhr n ARG 86 Ca -0.13 -1.04 -0.34 0.00 -0.00 0.00 0.00 57.85 56.33 1lhr n ARG 86 Cb 0.58 -0.98 -0.15 0.00 -0.00 0.00 0.00 32.46 31.92 1lhr n ARG 86 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1lhr s ASP 87 N -0.55 4.09 0.45 2.89 3.68 -1.26 -4.57 116.67 121.39 1lhr s ASP 87 Ca 0.00 -0.88 0.19 0.00 2.13 0.00 0.00 52.55 53.99 1lhr s ASP 87 Cb 0.00 -1.61 1.06 0.00 -1.45 0.00 0.00 42.92 40.92 1lhr s ASP 87 CO 0.00 -0.11 1.95 0.07 0.13 0.00 0.00 175.17 177.21 1lhr h LYS 88 N 7.97 0.00 -0.28 4.34 2.10 -1.92 -0.74 116.57 128.03 1lhr h LYS 88 Ca -0.34 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.15 1lhr h LYS 88 Cb 1.11 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.43 1lhr h LYS 88 CO 0.57 0.23 -0.47 1.03 -2.00 0.00 0.00 179.45 178.81 1lhr h SER 89 N 0.00 0.82 -0.20 7.07 0.87 -1.99 -1.68 113.55 118.44 1lhr h SER 89 Ca -0.00 -0.40 -0.12 0.00 -1.23 0.00 0.00 61.79 60.03 1lhr h SER 89 Cb 0.48 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.21 1lhr h SER 89 CO 0.03 1.16 -0.36 0.15 -0.53 0.00 0.00 176.83 177.28 1lhr h PHE 90 N 0.60 0.74 -0.65 2.24 3.57 -1.82 -2.83 116.94 118.78 1lhr h PHE 90 Ca 0.03 -0.26 0.00 0.00 3.53 0.00 0.00 57.97 61.27 1lhr h PHE 90 Cb 1.04 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.60 1lhr h PHE 90 CO 0.06 1.00 0.42 1.25 -2.23 0.00 0.00 178.31 178.81 1lhr h LEU 91 N 0.26 0.76 -0.69 0.59 5.85 -1.06 -2.02 115.31 119.00 1lhr h LEU 91 Ca 0.01 -0.03 -0.13 0.00 0.84 0.00 0.00 57.88 58.57 1lhr h LEU 91 Cb 0.95 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 1lhr h LEU 91 CO 0.08 0.56 -0.38 0.00 -0.34 0.00 0.00 178.44 178.36 1lhr h ALA 92 N 1.57 0.86 -0.25 1.25 0.00 -1.25 -2.67 119.26 118.78 1lhr h ALA 92 Ca 0.24 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 1lhr h ALA 92 Cb -0.08 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1lhr h ALA 92 CO -0.05 0.64 -0.13 1.98 0.00 0.00 0.00 179.25 181.69 1lhr h MET 93 N 0.48 0.41 -0.57 0.00 1.85 -1.14 -2.37 114.93 113.59 1lhr h MET 93 Ca 0.05 -0.11 -0.07 0.00 -0.61 0.00 0.00 59.70 58.95 1lhr h MET 93 Cb 0.88 -0.05 -0.02 0.00 0.43 0.00 0.00 31.60 32.84 1lhr h MET 93 CO 0.08 0.54 0.08 0.28 -0.40 0.00 0.00 176.91 177.48 1lhr h VAL 94 N 0.38 1.26 -0.43 -5.77 2.07 -1.08 -1.62 116.25 111.06 1lhr h VAL 94 Ca 0.07 -1.01 -0.03 0.00 0.82 0.00 0.00 66.70 66.55 1lhr h VAL 94 Cb 0.46 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1lhr h VAL 94 CO 0.03 0.37 0.14 0.58 0.02 0.00 0.00 177.57 178.71 1lhr h VAL 95 N 0.85 1.21 -0.21 2.57 2.07 -1.19 -0.61 116.25 120.95 1lhr h VAL 95 Ca 0.17 -0.70 0.03 0.00 0.82 0.00 0.00 66.70 67.02 1lhr h VAL 95 Cb 0.44 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 1lhr h VAL 95 CO 0.01 0.25 0.03 0.44 0.02 0.00 0.00 177.57 178.33 1lhr h ASP 96 N 0.55 -0.00 -0.96 0.57 3.32 -1.27 -1.13 116.42 117.49 1lhr h ASP 96 Ca 0.14 0.03 0.06 0.00 0.02 0.00 0.00 57.03 57.28 1lhr h ASP 96 Cb 0.24 0.05 -0.06 0.00 0.22 0.00 0.00 39.33 39.78 1lhr h ASP 96 CO -0.01 0.03 0.61 0.40 -1.72 0.00 0.00 179.24 178.55 1lhr h ILE 97 N 0.12 1.09 -0.23 0.35 2.04 -1.01 -2.13 117.51 117.73 1lhr h ILE 97 Ca 0.10 -0.39 -0.05 0.00 1.00 0.00 0.00 64.86 65.52 1lhr h ILE 97 Cb 0.10 -0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.03 1lhr h ILE 97 CO -0.13 0.21 -0.04 0.58 0.00 0.00 0.00 178.15 178.76 1lhr h VAL 98 N 1.13 1.28 -0.36 1.67 2.07 -0.48 -1.92 116.25 119.62 1lhr h VAL 98 Ca 0.41 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.90 1lhr h VAL 98 Cb 0.14 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 1lhr h VAL 98 CO -0.17 0.32 0.17 0.06 0.02 0.00 0.00 177.57 177.97 1lhr h GLN 99 N 0.18 0.50 -0.46 1.57 3.07 -0.96 0.23 115.11 119.24 1lhr h GLN 99 Ca 0.06 -0.05 -0.10 0.00 0.09 0.00 0.00 58.65 58.65 1lhr h GLN 99 Cb 0.49 -0.10 -0.01 0.00 0.08 0.00 0.00 27.48 27.94 1lhr h GLN 99 CO 0.02 0.39 -0.11 1.49 0.09 0.00 0.00 178.83 180.71 1lhr h GLU 100 N 0.51 0.89 -0.23 0.06 4.81 -1.26 -2.27 114.58 117.07 1lhr h GLU 100 Ca 0.13 -0.34 -0.14 0.00 -0.13 0.00 0.00 59.36 58.88 1lhr h GLU 100 Cb 0.06 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 1lhr h GLU 100 CO -0.02 0.99 -0.43 -0.07 -0.73 0.00 0.00 179.01 178.75 1lhr h LEU 101 N 0.72 0.62 -1.27 1.64 3.38 -0.49 -2.91 115.31 117.00 1lhr h LEU 101 Ca 0.12 -0.28 -0.08 0.00 0.09 0.00 0.00 57.88 57.73 1lhr h LEU 101 Cb 0.66 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1lhr h LEU 101 CO 0.05 0.97 -0.36 0.11 0.09 0.00 0.00 178.44 179.29 1lhr h LYS 102 N 0.47 0.00 -0.12 1.13 1.57 -0.43 0.24 116.57 119.43 1lhr h LYS 102 Ca 0.03 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.66 1lhr h LYS 102 Cb 0.94 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.24 1lhr h LYS 102 CO 0.08 0.36 -0.58 0.37 -0.57 0.00 0.00 179.45 179.11 1lhr h GLN 103 N 0.00 0.38 0.00 3.15 -0.00 -1.27 -1.54 115.11 115.83 1lhr h GLN 103 Ca -0.00 -0.25 -0.08 0.00 -0.00 0.00 0.00 58.65 58.31 1lhr h GLN 103 Cb 0.67 0.03 -0.01 0.00 0.00 0.00 0.00 27.48 28.17 1lhr h GLN 103 CO 0.05 0.85 -0.38 0.37 0.00 0.00 0.00 178.83 179.72 1lhr h GLN 104 N 0.29 0.00 -1.65 1.69 4.15 -1.23 -3.40 115.11 114.96 1lhr h GLN 104 Ca -0.00 0.00 -0.23 0.00 0.77 0.00 0.00 58.65 59.19 1lhr h GLN 104 Cb 1.09 0.00 -0.28 0.00 0.21 0.00 0.00 27.48 28.51 1lhr h GLN 104 CO 0.10 0.38 -0.58 1.21 -1.93 0.00 0.00 178.83 178.01 1lhr s ASN 105 N -6.38 0.29 0.63 -0.69 2.47 0.02 -5.01 114.94 106.28 1lhr s ASN 105 Ca 0.04 -0.95 0.37 0.00 0.42 0.00 0.00 52.86 52.75 1lhr s ASN 105 Cb 0.08 1.07 2.14 0.00 -1.45 0.00 0.00 41.25 43.09 1lhr s ASN 105 CO 0.71 -0.28 2.32 -0.65 -3.72 0.00 0.00 177.10 175.48 1lhr h PRO 106 N 7.48 0.00 -0.00 0.43 0.11 -1.51 -1.13 132.00 137.38 1lhr h PRO 106 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1lhr h PRO 106 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1lhr h PRO 106 CO 0.20 0.00 -0.02 -2.13 -0.21 0.00 0.00 178.00 175.85 1lhr n ARG 107 N -3.46 0.09 -1.72 1.05 3.00 -1.26 -4.90 116.66 109.45 1lhr n ARG 107 Ca -0.03 -0.00 -0.42 0.00 -0.00 0.00 0.00 57.85 57.39 1lhr n ARG 107 Cb 0.08 -1.50 -0.01 0.00 0.00 0.00 0.00 32.46 31.03 1lhr n ARG 107 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 1lhr n LEU 108 N -1.45 3.96 -4.37 6.15 0.00 -0.43 -4.99 117.00 115.87 1lhr n LEU 108 Ca 0.08 1.20 -0.35 0.00 0.00 0.00 0.00 56.01 56.95 1lhr n LEU 108 Cb 0.32 -1.53 -0.13 0.00 0.00 0.00 0.00 43.42 42.07 1lhr n LEU 108 CO 0.27 -0.22 -0.37 -0.69 0.00 0.00 0.00 177.39 176.37 1lhr s VAL 109 N -0.86 3.54 -0.33 1.96 1.01 -0.25 -5.00 120.40 120.47 1lhr s VAL 109 Ca 0.57 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 61.99 1lhr s VAL 109 Cb -0.54 -2.59 -0.01 0.00 0.00 0.00 0.00 36.38 33.24 1lhr s VAL 109 CO 0.60 0.44 0.21 -0.47 0.00 0.00 0.00 175.10 175.88 1lhr s TYR 110 N 1.12 3.21 -0.31 5.22 6.04 -1.26 -2.11 117.35 129.26 1lhr s TYR 110 Ca 0.02 -0.42 -0.11 0.00 0.04 0.00 0.00 57.07 56.59 1lhr s TYR 110 Cb -0.15 -2.43 -0.03 0.00 -1.04 0.00 0.00 41.96 38.32 1lhr s TYR 110 CO -0.00 -0.43 0.19 0.08 -1.54 0.00 0.00 175.55 173.85 1lhr s VAL 111 N 1.67 5.06 -0.10 3.14 1.01 -0.44 -0.45 120.40 130.28 1lhr s VAL 111 Ca 0.05 -0.13 0.02 0.00 0.00 0.00 0.00 61.98 61.92 1lhr s VAL 111 Cb -0.17 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.70 1lhr s VAL 111 CO 0.09 0.12 -0.16 0.00 0.00 0.00 0.00 175.10 175.14 1lhr s ASP 113 N 0.83 5.61 -1.09 0.00 2.15 -1.10 -1.57 116.67 121.50 1lhr s ASP 113 Ca -0.10 -2.08 -0.23 0.00 0.43 0.00 0.00 52.55 50.58 1lhr s ASP 113 Cb -0.15 -1.96 -0.03 0.00 -0.30 0.00 0.00 42.92 40.47 1lhr s ASP 113 CO 0.01 -0.62 1.84 -2.16 -0.17 0.00 0.00 175.17 174.06 1lhr s PRO 114 N 1.10 2.91 0.02 4.34 0.04 -1.26 -4.32 135.00 137.84 1lhr s PRO 114 Ca 0.08 -1.01 -0.30 0.00 0.04 0.00 0.00 61.00 59.80 1lhr s PRO 114 Cb -0.24 -5.25 -0.05 0.00 0.04 0.00 0.00 34.50 29.00 1lhr s PRO 114 CO -0.02 -3.25 1.15 0.08 0.04 0.00 0.00 177.00 175.00 1lhr s VAL 115 N 8.75 4.25 -0.11 -0.36 1.01 -1.26 -4.89 120.40 127.79 1lhr s VAL 115 Ca 0.63 1.61 -0.08 0.00 0.00 0.00 0.00 61.98 64.14 1lhr s VAL 115 Cb -0.02 -4.03 0.04 0.00 0.00 0.00 0.00 36.38 32.37 1lhr s VAL 115 CO 0.04 0.10 0.29 -0.04 0.00 0.00 0.00 175.10 175.49 1lhr s MET 116 N 1.28 0.30 0.00 2.72 -1.94 -1.26 -4.71 119.30 115.69 1lhr s MET 116 Ca 0.57 0.48 0.00 0.00 -1.71 0.00 0.00 55.69 55.03 1lhr s MET 116 Cb -0.27 0.06 0.00 0.00 2.01 0.00 0.00 34.83 36.63 1lhr s MET 116 CO 0.27 -0.09 0.00 0.41 -0.01 0.00 0.00 175.02 175.60 1lhr n GLY 117 N 3.46 0.61 1.97 -0.03 0.00 -1.26 -4.81 105.19 105.14 1lhr n GLY 117 Ca -0.18 -2.12 -0.18 0.00 0.00 0.00 0.00 46.02 43.55 1lhr n GLY 117 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1lhr n ASP 118 N 1.17 6.46 -4.79 1.61 3.85 -1.26 -2.30 116.55 121.29 1lhr n ASP 118 Ca 0.00 -3.08 -0.35 0.00 -0.71 0.00 0.00 54.79 50.65 1lhr n ASP 118 Cb 0.00 -1.09 -0.03 0.00 -1.35 0.00 0.00 41.12 38.66 1lhr n ASP 118 CO 0.00 0.00 0.00 -1.10 -1.01 0.00 0.00 177.20 175.09 1lhr s GLN 119 N -1.77 3.79 0.20 0.11 -0.21 -1.26 -4.95 119.66 115.56 1lhr s GLN 119 Ca 0.35 1.49 -0.30 0.00 0.02 0.00 0.00 55.36 56.93 1lhr s GLN 119 Cb 0.26 -2.21 -0.08 0.00 1.00 0.00 0.00 33.01 31.98 1lhr s GLN 119 CO -0.03 -0.47 1.05 1.03 -2.12 0.00 0.00 175.29 174.75 1lhr s ARG 120 N -3.02 4.67 0.04 2.91 0.52 -1.26 -4.79 118.95 118.02 1lhr s ARG 120 Ca 0.66 1.65 -0.00 0.00 -0.52 0.00 0.00 55.73 57.52 1lhr s ARG 120 Cb -0.21 -3.28 0.00 0.00 0.52 0.00 0.00 34.95 31.99 1lhr s ARG 120 CO 0.25 0.20 0.06 0.27 0.02 0.00 0.00 175.30 176.10 1lhr n ASN 121 N 2.05 -0.16 -0.51 0.23 0.23 -1.26 -4.78 115.26 111.05 1lhr n ASN 121 Ca 0.01 -1.23 0.07 0.00 -0.53 0.00 0.00 54.58 52.89 1lhr n ASN 121 Cb 0.46 0.30 0.16 0.00 -2.08 0.00 0.00 39.78 38.63 1lhr n ASN 121 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1lhr n GLY 122 N -0.07 3.65 1.48 4.83 0.00 -1.26 -0.30 105.19 113.52 1lhr n GLY 122 Ca 0.00 -0.69 -0.09 0.00 0.00 0.00 0.00 46.02 45.25 1lhr n GLY 122 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1lhr n GLU 123 N -0.39 2.11 -0.92 1.61 1.02 -1.26 -4.48 120.64 118.33 1lhr n GLU 123 Ca 0.14 -3.12 -0.04 0.00 -0.02 0.00 0.00 57.16 54.12 1lhr n GLU 123 Cb 0.60 -1.94 -0.02 0.00 -0.02 0.00 0.00 31.44 30.07 1lhr n GLU 123 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1lhr n GLY 124 N -1.04 0.37 3.90 0.62 0.00 -1.26 -4.95 105.19 102.83 1lhr n GLY 124 Ca 0.40 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.11 1lhr n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lhr s ALA 125 N -1.14 3.76 -0.75 4.61 0.00 -1.26 -5.01 121.76 121.98 1lhr s ALA 125 Ca 0.00 -0.58 0.22 0.00 0.00 0.00 0.00 51.96 51.60 1lhr s ALA 125 Cb 0.00 -2.15 -0.09 0.00 0.00 0.00 0.00 23.12 20.88 1lhr s ALA 125 CO 0.00 0.59 0.93 -1.33 0.00 0.00 0.00 175.76 175.94 1lhr n MET 126 N -0.14 0.17 -3.59 0.00 2.81 -1.26 -4.71 117.12 110.41 1lhr n MET 126 Ca -0.02 -0.03 -0.06 0.00 -1.81 0.00 0.00 57.70 55.77 1lhr n MET 126 Cb 0.52 -1.53 -0.02 0.00 -0.71 0.00 0.00 33.22 31.49 1lhr n MET 126 CO 0.00 0.00 0.00 1.52 1.51 0.00 0.00 175.97 179.00 1lhr s TYR 127 N -3.13 -0.26 -0.25 2.03 -0.85 -1.26 -4.66 117.35 108.97 1lhr s TYR 127 Ca 0.05 0.07 -0.09 0.00 -0.52 0.00 0.00 57.07 56.57 1lhr s TYR 127 Cb 0.15 0.57 -0.04 0.00 0.38 0.00 0.00 41.96 43.02 1lhr s TYR 127 CO 0.84 -0.63 0.14 0.08 -1.52 0.00 0.00 175.55 174.45 1lhr s VAL 128 N -3.16 4.98 0.11 -3.49 1.01 -0.98 -4.99 120.40 113.89 1lhr s VAL 128 Ca 0.08 0.05 -0.36 0.00 0.00 0.00 0.00 61.98 61.75 1lhr s VAL 128 Cb -0.01 -3.34 -0.17 0.00 0.00 0.00 0.00 36.38 32.87 1lhr s VAL 128 CO -0.05 0.32 1.26 -2.65 0.00 0.00 0.00 175.10 173.97 1lhr n PRO 129 N 4.70 1.07 0.25 2.72 -0.02 -1.26 -4.55 135.00 137.90 1lhr n PRO 129 Ca -0.15 0.38 0.10 0.00 -2.02 0.00 0.00 63.50 61.82 1lhr n PRO 129 Cb 0.52 -1.96 0.69 0.00 -0.02 0.00 0.00 33.50 32.73 1lhr n PRO 129 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1lhr h ASP 130 N 4.03 0.00 0.00 2.55 5.19 -1.98 -1.99 116.42 124.21 1lhr h ASP 130 Ca -0.46 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.95 1lhr h ASP 130 Cb 1.35 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.86 1lhr h ASP 130 CO 0.74 0.00 0.00 -0.90 -3.12 0.00 0.00 179.24 175.96 1lhr n ASP 131 N -4.40 0.00 -0.02 6.45 5.68 -1.26 -2.56 116.55 120.44 1lhr n ASP 131 Ca -0.02 -0.89 -0.09 0.00 -0.50 0.00 0.00 54.79 53.30 1lhr n ASP 131 Cb 0.13 0.00 -0.14 0.00 -1.14 0.00 0.00 41.12 39.97 1lhr n ASP 131 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 1lhr h LEU 132 N 0.00 0.00 -0.47 -2.12 4.07 -1.72 -3.40 115.31 111.68 1lhr h LEU 132 Ca 0.00 -0.00 0.09 0.00 0.08 0.00 0.00 57.88 58.04 1lhr h LEU 132 Cb 0.00 -0.00 -0.10 0.00 1.08 0.00 0.00 40.66 41.64 1lhr h LEU 132 CO 0.00 1.00 -0.35 0.25 -1.08 0.00 0.00 178.44 178.27 1lhr h LEU 133 N 0.00 -1.17 -2.07 1.67 5.85 -1.70 0.12 115.31 118.01 1lhr h LEU 133 Ca -0.28 0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1lhr h LEU 133 Cb 2.01 0.55 0.00 0.00 0.37 0.00 0.00 40.66 43.59 1lhr h LEU 133 CO 0.08 -0.32 0.00 1.55 -0.34 0.00 0.00 178.44 179.41 1lhr h PRO 134 N -0.23 0.00 0.09 5.25 0.13 -1.81 -0.86 132.00 134.58 1lhr h PRO 134 Ca 0.19 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.15 1lhr h PRO 134 Cb 0.55 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.70 1lhr h PRO 134 CO -0.59 0.00 -0.70 0.28 -0.23 0.00 0.00 178.00 176.75 1lhr h VAL 135 N 0.00 1.51 -0.01 1.56 2.07 -1.02 -2.75 116.25 117.61 1lhr h VAL 135 Ca 0.00 -2.39 -0.00 0.00 0.82 0.00 0.00 66.70 65.13 1lhr h VAL 135 Cb 0.09 3.04 -0.00 0.00 -1.52 0.00 0.00 31.29 32.90 1lhr h VAL 135 CO 0.00 0.68 0.00 1.88 0.02 0.00 0.00 177.57 180.15 1lhr h TYR 136 N -0.33 0.01 -0.13 1.57 0.99 -0.65 0.89 116.97 119.32 1lhr h TYR 136 Ca -0.11 -0.00 0.04 0.00 2.00 0.00 0.00 58.73 60.65 1lhr h TYR 136 Cb 1.51 -0.00 -0.05 0.00 1.00 0.00 0.00 36.73 39.19 1lhr h TYR 136 CO 0.19 0.16 -0.15 0.00 -0.00 0.00 0.00 178.16 178.36 1lhr h ARG 137 N -0.13 -0.18 0.01 4.88 3.08 -1.30 0.19 114.38 120.94 1lhr h ARG 137 Ca 0.00 0.01 -0.31 0.00 0.07 0.00 0.00 59.98 59.75 1lhr h ARG 137 Cb 0.15 0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.19 1lhr h ARG 137 CO -0.00 -0.12 -1.88 0.39 -1.07 0.00 0.00 179.97 177.29 1lhr n GLU 138 N -5.29 0.65 -0.09 0.04 1.02 -1.04 -4.49 120.64 111.44 1lhr n GLU 138 Ca -0.03 0.23 -0.15 0.00 -0.02 0.00 0.00 57.16 57.19 1lhr n GLU 138 Cb 0.21 -1.73 -0.08 0.00 -0.02 0.00 0.00 31.44 29.83 1lhr n GLU 138 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1lhr n LYS 139 N -3.03 0.43 0.09 3.49 4.76 0.26 -4.68 118.16 119.48 1lhr n LYS 139 Ca -0.22 0.13 -0.08 0.00 -2.87 0.00 0.00 58.31 55.28 1lhr n LYS 139 Cb 1.07 -1.29 -0.05 0.00 -1.84 0.00 0.00 35.03 32.93 1lhr n LYS 139 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1lhr h VAL 140 N -0.26 0.33 -0.99 -0.18 2.07 -1.26 -3.36 116.25 112.60 1lhr h VAL 140 Ca -0.43 -0.91 0.07 0.00 0.82 0.00 0.00 66.70 66.25 1lhr h VAL 140 Cb 1.54 0.57 -0.07 0.00 -1.52 0.00 0.00 31.29 31.81 1lhr h VAL 140 CO -0.15 0.09 0.64 0.58 0.02 0.00 0.00 177.57 178.75 1lhr h VAL 141 N -1.02 1.07 0.00 2.57 2.07 -1.18 -1.52 116.25 118.23 1lhr h VAL 141 Ca -0.03 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.09 1lhr h VAL 141 Cb 0.39 -0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 29.98 1lhr h VAL 141 CO 0.05 0.21 -0.03 -0.65 0.02 0.00 0.00 177.57 177.17 1lhr h PRO 142 N 1.14 0.00 0.00 1.57 0.11 -1.74 -2.46 132.00 130.62 1lhr h PRO 142 Ca 0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.55 1lhr h PRO 142 Cb 0.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.31 1lhr h PRO 142 CO -0.18 0.03 -1.58 0.28 -0.21 0.00 0.00 178.00 176.34 1lhr n VAL 143 N -3.72 0.09 -2.50 3.15 0.31 -0.72 -4.73 118.33 110.21 1lhr n VAL 143 Ca -0.03 -0.38 -0.38 0.00 -0.01 0.00 0.00 64.34 63.54 1lhr n VAL 143 Cb 0.12 0.16 -0.04 0.00 -0.91 0.00 0.00 33.84 33.18 1lhr n VAL 143 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1lhr s ALA 144 N -3.37 3.23 -0.19 3.52 0.00 -0.65 -4.73 121.76 119.57 1lhr s ALA 144 Ca -0.03 0.80 0.16 0.00 0.00 0.00 0.00 51.96 52.89 1lhr s ALA 144 Cb 0.14 -3.30 -0.22 0.00 0.00 0.00 0.00 23.12 19.73 1lhr s ALA 144 CO 0.87 -0.21 0.05 -0.25 0.00 0.00 0.00 175.76 176.22 1lhr n ASP 145 N 0.49 0.54 -3.75 0.00 8.00 0.40 -2.74 116.55 119.49 1lhr n ASP 145 Ca 0.02 -0.01 -0.18 0.00 0.71 0.00 0.00 54.79 55.34 1lhr n ASP 145 Cb 0.47 0.87 -0.17 0.00 -0.02 0.00 0.00 41.12 42.28 1lhr n ASP 145 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1lhr s ILE 146 N -2.45 0.04 0.03 0.53 1.01 -0.84 -2.45 121.20 117.06 1lhr s ILE 146 Ca -0.11 0.24 0.08 0.00 0.00 0.00 0.00 60.65 60.86 1lhr s ILE 146 Cb 0.06 -0.20 -0.02 0.00 0.01 0.00 0.00 42.46 42.30 1lhr s ILE 146 CO 0.74 0.15 -0.22 0.27 0.00 0.00 0.00 174.94 175.88 1lhr s ILE 147 N 1.50 1.81 -0.51 2.92 -4.36 -0.78 -0.18 121.20 121.60 1lhr s ILE 147 Ca -0.03 -1.18 0.06 0.00 -0.26 0.00 0.00 60.65 59.23 1lhr s ILE 147 Cb -0.13 -1.55 0.37 0.00 1.25 0.00 0.00 42.46 42.41 1lhr s ILE 147 CO -0.03 0.32 0.99 0.35 0.24 0.00 0.00 174.94 176.81 1lhr n THR 148 N 2.00 2.59 -1.68 8.37 -2.24 -0.61 -1.79 114.28 120.94 1lhr n THR 148 Ca -0.17 -5.23 -0.32 0.00 -2.27 0.00 0.00 64.05 56.07 1lhr n THR 148 Cb 0.53 -1.22 0.05 0.00 -2.10 0.00 0.00 70.33 67.58 1lhr n THR 148 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1lhr s PRO 149 N -3.43 2.89 0.67 -0.78 0.04 -1.18 -4.64 135.00 128.56 1lhr s PRO 149 Ca 0.47 1.15 0.04 0.00 0.04 0.00 0.00 61.00 62.70 1lhr s PRO 149 Cb 0.33 -1.98 0.12 0.00 0.04 0.00 0.00 34.50 33.01 1lhr s PRO 149 CO -0.15 -1.15 0.92 0.54 0.04 0.00 0.00 177.00 177.20 1lhr s ASN 150 N -3.21 4.62 0.15 6.66 2.20 -1.26 -1.85 114.94 122.25 1lhr s ASN 150 Ca 0.62 -0.60 -0.17 0.00 -0.94 0.00 0.00 52.86 51.77 1lhr s ASN 150 Cb -0.16 0.18 0.03 0.00 -2.00 0.00 0.00 41.25 39.30 1lhr s ASN 150 CO 0.47 -1.68 1.76 -0.61 -2.94 0.00 0.00 177.10 174.10 1lhr h GLN 151 N -0.26 0.28 -0.85 3.55 4.15 -1.42 -1.64 115.11 118.93 1lhr h GLN 151 Ca -0.33 -0.02 0.06 0.00 0.77 0.00 0.00 58.65 59.14 1lhr h GLN 151 Cb 1.27 -0.06 -0.06 0.00 0.21 0.00 0.00 27.48 28.84 1lhr h GLN 151 CO 0.40 0.19 0.52 0.35 -1.93 0.00 0.00 178.83 178.35 1lhr h PHE 152 N 0.29 0.96 -0.50 3.99 3.57 -1.95 -2.09 116.94 121.21 1lhr h PHE 152 Ca 0.14 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.56 1lhr h PHE 152 Cb 0.09 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.51 1lhr h PHE 152 CO -0.12 0.48 -0.14 0.93 -2.23 0.00 0.00 178.31 177.23 1lhr h GLU 153 N 0.95 0.97 -0.86 1.11 5.08 -1.82 -2.83 114.58 117.18 1lhr h GLU 153 Ca 0.37 -0.38 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1lhr h GLU 153 Cb 0.18 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 1lhr h GLU 153 CO -0.18 1.05 0.46 0.00 -1.00 0.00 0.00 179.01 179.34 1lhr h ALA 154 N 0.89 1.10 -0.71 3.43 0.00 -0.96 -1.86 119.26 121.16 1lhr h ALA 154 Ca 0.12 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1lhr h ALA 154 Cb 0.70 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1lhr h ALA 154 CO 0.05 0.63 0.34 0.93 0.00 0.00 0.00 179.25 181.20 1lhr h GLU 155 N 1.21 1.00 -0.21 0.00 5.08 -1.27 -2.70 114.58 117.68 1lhr h GLU 155 Ca 0.30 -0.14 -0.10 0.00 -1.00 0.00 0.00 59.36 58.43 1lhr h GLU 155 Cb 0.05 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 1lhr h GLU 155 CO -0.05 0.77 -0.24 -0.07 -1.00 0.00 0.00 179.01 178.43 1lhr h LEU 156 N 1.00 0.58 -1.46 1.33 3.38 -1.19 -0.07 115.31 118.88 1lhr h LEU 156 Ca 0.24 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1lhr h LEU 156 Cb 0.10 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1lhr h LEU 156 CO -0.03 0.95 0.00 -0.07 0.09 0.00 0.00 178.44 179.38 1lhr h LEU 157 N 0.22 0.00 -0.27 1.67 3.38 -1.18 -3.13 115.31 116.00 1lhr h LEU 157 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1lhr h LEU 157 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 1lhr h LEU 157 CO 0.06 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.94 1lhr n THR 158 N -2.51 0.00 0.00 0.22 -2.24 -1.03 -4.94 114.28 103.78 1lhr n THR 158 Ca -0.00 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 1lhr n THR 158 Cb 0.14 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.41 1lhr n THR 158 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lhr n GLY 159 N 0.61 2.23 3.92 3.38 0.00 -0.05 -4.98 105.19 110.31 1lhr n GLY 159 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1lhr n GLY 159 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1lhr s ARG 160 N 0.00 3.02 -0.04 1.61 3.52 -1.20 -4.99 118.95 120.87 1lhr s ARG 160 Ca 0.00 -0.07 0.05 0.00 -0.13 0.00 0.00 55.73 55.58 1lhr s ARG 160 Cb 0.00 -2.33 -0.01 0.00 -1.56 0.00 0.00 34.95 31.05 1lhr s ARG 160 CO 0.00 -0.57 -0.20 0.21 -0.81 0.00 0.00 175.30 173.93 1lhr s LYS 161 N -4.89 1.97 -0.31 5.12 2.20 -1.26 -4.46 119.74 118.11 1lhr s LYS 161 Ca 0.52 -0.71 -0.16 0.00 -0.36 0.00 0.00 55.97 55.26 1lhr s LYS 161 Cb -0.10 -1.73 -0.02 0.00 -1.51 0.00 0.00 37.83 34.47 1lhr s LYS 161 CO 0.44 0.32 0.40 0.42 -0.36 0.00 0.00 175.35 176.56 1lhr s ILE 162 N -0.11 5.14 -0.10 5.43 1.01 -1.26 -4.92 121.20 126.39 1lhr s ILE 162 Ca -0.02 0.32 0.09 0.00 0.00 0.00 0.00 60.65 61.04 1lhr s ILE 162 Cb -0.11 -3.80 -0.13 0.00 0.01 0.00 0.00 42.46 38.43 1lhr s ILE 162 CO 0.02 -0.01 0.23 1.41 0.00 0.00 0.00 174.94 176.59 1lhr n HIS 163 N 5.43 0.00 -4.02 3.97 8.25 -1.26 -4.99 115.22 122.60 1lhr n HIS 163 Ca -0.08 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.26 1lhr n HIS 163 Cb 0.50 -0.16 -0.03 0.00 1.12 0.00 0.00 29.99 31.41 1lhr n HIS 163 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1lhr n SER 164 N -1.69 -0.91 0.08 0.41 3.41 -1.26 -5.02 113.62 108.65 1lhr n SER 164 Ca -0.01 -2.53 -0.05 0.00 -0.26 0.00 0.00 58.87 56.02 1lhr n SER 164 Cb 0.21 1.78 0.11 0.00 -0.26 0.00 0.00 64.21 66.05 1lhr n SER 164 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 1lhr h GLN 165 N 0.00 0.25 -0.20 4.33 4.15 -1.99 -2.59 115.11 119.06 1lhr h GLN 165 Ca -0.20 -0.17 -0.17 0.00 0.77 0.00 0.00 58.65 58.88 1lhr h GLN 165 Cb 0.92 0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.63 1lhr h GLN 165 CO 0.28 0.78 -0.56 1.49 -1.93 0.00 0.00 178.83 178.90 1lhr h GLU 166 N 0.18 0.61 -0.89 1.69 4.81 -2.00 -2.85 114.58 116.14 1lhr h GLU 166 Ca -0.01 -0.39 -0.01 0.00 -0.13 0.00 0.00 59.36 58.82 1lhr h GLU 166 Cb 1.12 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.51 1lhr h GLU 166 CO 0.10 1.01 0.52 0.93 -0.73 0.00 0.00 179.01 180.83 1lhr h GLU 167 N 0.47 1.22 0.41 1.92 5.08 -1.92 -1.97 114.58 119.79 1lhr h GLU 167 Ca 0.01 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.22 1lhr h GLU 167 Cb 1.11 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.12 1lhr h GLU 167 CO 0.11 0.87 -0.20 0.00 -1.00 0.00 0.00 179.01 178.79 1lhr h ALA 168 N 1.28 -0.55 -0.28 3.43 0.00 -1.31 -1.09 119.26 120.75 1lhr h ALA 168 Ca 0.32 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 55.18 1lhr h ALA 168 Cb -0.02 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1lhr h ALA 168 CO -0.06 -0.78 0.25 -0.07 0.00 0.00 0.00 179.25 178.59 1lhr h LEU 169 N -0.59 0.00 -0.27 0.00 3.38 -1.35 0.23 115.31 116.70 1lhr h LEU 169 Ca -0.06 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.73 1lhr h LEU 169 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1lhr h LEU 169 CO 0.09 0.00 -0.53 -0.08 0.09 0.00 0.00 178.44 178.01 1lhr h GLU 170 N 0.00 0.84 -0.12 1.13 4.81 -0.56 -2.12 114.58 118.57 1lhr h GLU 170 Ca 0.13 -0.54 -0.21 0.00 -0.13 0.00 0.00 59.36 58.61 1lhr h GLU 170 Cb 0.64 0.07 0.01 0.00 0.63 0.00 0.00 28.75 30.09 1lhr h GLU 170 CO -0.00 1.17 -0.76 0.28 -0.73 0.00 0.00 179.01 178.97 1lhr h VAL 171 N 0.61 1.30 -0.96 0.32 2.07 0.32 -3.00 116.25 116.91 1lhr h VAL 171 Ca 0.01 -1.99 0.05 0.00 0.82 0.00 0.00 66.70 65.59 1lhr h VAL 171 Cb 1.14 2.09 -0.06 0.00 -1.52 0.00 0.00 31.29 32.95 1lhr h VAL 171 CO 0.12 0.62 0.63 0.24 0.02 0.00 0.00 177.57 179.20 1lhr h MET 172 N 0.43 1.13 -0.70 1.57 2.86 -0.65 -1.24 114.93 118.32 1lhr h MET 172 Ca -0.06 -0.07 -0.06 0.00 -2.06 0.00 0.00 59.70 57.45 1lhr h MET 172 Cb 1.40 -0.25 -0.03 0.00 0.06 0.00 0.00 31.60 32.78 1lhr h MET 172 CO 0.16 0.74 0.21 -0.44 1.06 0.00 0.00 176.91 178.64 1lhr h ASP 173 N 1.16 1.01 -0.88 1.22 3.45 -1.37 -1.34 116.42 119.66 1lhr h ASP 173 Ca 0.40 -0.19 -0.02 0.00 0.43 0.00 0.00 57.03 57.65 1lhr h ASP 173 Cb 0.10 -0.26 -0.04 0.00 -0.56 0.00 0.00 39.33 38.56 1lhr h ASP 173 CO -0.14 0.94 0.46 0.24 -1.57 0.00 0.00 179.24 179.17 1lhr h MET 174 N 1.04 1.24 -0.60 3.56 2.86 -1.13 -1.81 114.93 120.09 1lhr h MET 174 Ca 0.23 -0.16 -0.06 0.00 -2.06 0.00 0.00 59.70 57.65 1lhr h MET 174 Cb 0.30 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.70 1lhr h MET 174 CO -0.01 0.92 0.15 -0.07 1.06 0.00 0.00 176.91 178.97 1lhr h LEU 175 N 1.23 0.90 0.22 1.22 3.38 -0.71 -2.20 115.31 119.35 1lhr h LEU 175 Ca 0.31 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1lhr h LEU 175 Cb 0.06 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1lhr h LEU 175 CO -0.05 0.89 -0.20 0.45 0.09 0.00 0.00 178.44 179.62 1lhr h HIS 176 N 0.86 -0.54 -0.52 1.13 3.86 -0.76 -1.16 115.15 118.04 1lhr h HIS 176 Ca 0.19 0.00 0.15 0.00 -1.16 0.00 0.00 60.37 59.55 1lhr h HIS 176 Cb 0.34 0.21 -0.02 0.00 1.06 0.00 0.00 27.41 29.00 1lhr h HIS 176 CO 0.02 -0.31 0.48 0.66 0.86 0.00 0.00 177.93 179.65 1lhr h SER 177 N -0.45 0.00 1.41 2.45 4.64 -1.11 0.51 113.55 121.01 1lhr h SER 177 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1lhr h SER 177 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1lhr h SER 177 CO -0.04 0.00 0.00 0.24 -0.87 0.00 0.00 176.83 176.16 1lhr h MET 178 N 0.00 0.00 0.00 4.77 2.07 -0.58 -3.48 114.93 117.71 1lhr h MET 178 Ca 0.24 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.87 1lhr h MET 178 Cb 1.20 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.93 1lhr h MET 178 CO -0.00 0.00 0.00 0.41 1.07 0.00 0.00 176.91 178.39 1lhr n GLY 179 N 0.89 1.00 3.69 8.32 0.00 0.18 -3.76 105.19 115.50 1lhr n GLY 179 Ca 0.04 -0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1lhr n GLY 179 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1lhr n PRO 180 N 0.00 2.69 0.13 1.61 -0.04 -1.11 -4.90 135.00 133.38 1lhr n PRO 180 Ca 0.00 0.98 0.13 0.00 -0.04 0.00 0.00 63.50 64.56 1lhr n PRO 180 Cb 0.00 -2.86 0.46 0.00 -0.04 0.00 0.00 33.50 31.05 1lhr n PRO 180 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1lhr h ASP 181 N 8.56 0.00 -3.39 3.54 3.32 -1.75 -3.36 116.42 123.33 1lhr h ASP 181 Ca -0.47 0.00 -0.43 0.00 0.02 0.00 0.00 57.03 56.15 1lhr h ASP 181 Cb 1.23 0.00 -0.35 0.00 0.22 0.00 0.00 39.33 40.43 1lhr h ASP 181 CO 0.94 0.00 -0.78 -0.89 -1.72 0.00 0.00 179.24 176.80 1lhr s THR 182 N -3.24 0.59 0.04 0.35 2.01 -1.03 -0.28 115.64 114.09 1lhr s THR 182 Ca 0.07 -0.12 0.05 0.00 0.31 0.00 0.00 61.69 62.00 1lhr s THR 182 Cb 0.10 -0.64 -0.02 0.00 0.01 0.00 0.00 72.50 71.96 1lhr s THR 182 CO 0.49 0.25 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.84 1lhr s VAL 183 N 1.17 1.10 -0.16 3.82 1.01 -0.46 -1.86 120.40 125.03 1lhr s VAL 183 Ca -0.07 -0.97 -0.04 0.00 0.00 0.00 0.00 61.98 60.90 1lhr s VAL 183 Cb -0.14 -1.00 0.08 0.00 0.00 0.00 0.00 36.38 35.32 1lhr s VAL 183 CO -0.01 0.02 0.25 -0.69 0.00 0.00 0.00 175.10 174.67 1lhr s VAL 184 N -0.81 -0.38 -0.55 2.92 1.01 -0.74 -0.70 120.40 121.15 1lhr s VAL 184 Ca 0.02 0.14 -0.24 0.00 0.00 0.00 0.00 61.98 61.90 1lhr s VAL 184 Cb -0.08 -0.53 0.04 0.00 0.00 0.00 0.00 36.38 35.82 1lhr s VAL 184 CO 0.01 0.00 0.91 -0.63 0.00 0.00 0.00 175.10 175.40 1lhr s ILE 185 N 2.39 4.43 0.46 2.22 1.01 0.61 -3.12 121.20 129.20 1lhr s ILE 185 Ca 0.04 0.21 0.16 0.00 0.00 0.00 0.00 60.65 61.06 1lhr s ILE 185 Cb -0.13 -4.52 0.21 0.00 0.01 0.00 0.00 42.46 38.03 1lhr s ILE 185 CO -0.10 -1.09 2.03 0.71 0.00 0.00 0.00 174.94 176.49 1lhr h THR 186 N 6.01 1.05 -1.97 2.92 1.35 -1.62 -1.55 112.91 119.09 1lhr h THR 186 Ca -0.26 -0.49 -0.02 0.00 -0.55 0.00 0.00 66.41 65.08 1lhr h THR 186 Cb 1.08 1.27 -0.21 0.00 -1.73 0.00 0.00 68.15 68.55 1lhr h THR 186 CO 1.08 0.14 0.13 -0.94 -0.25 0.00 0.00 175.52 175.68 1lhr s SER 187 N -6.93 -0.77 0.15 5.36 1.04 -1.26 -4.58 113.70 106.72 1lhr s SER 187 Ca -0.04 1.42 0.01 0.00 0.48 0.00 0.00 55.95 57.83 1lhr s SER 187 Cb 0.16 1.42 -0.04 0.00 0.10 0.00 0.00 66.02 67.65 1lhr s SER 187 CO 0.68 -0.24 -0.01 -0.94 0.98 0.00 0.00 173.24 173.71 1lhr s SER 188 N 0.60 1.09 0.23 7.02 1.04 -1.03 -0.99 113.70 121.67 1lhr s SER 188 Ca -0.02 -1.13 0.25 0.00 0.48 0.00 0.00 55.95 55.53 1lhr s SER 188 Cb -0.05 0.13 0.87 0.00 0.10 0.00 0.00 66.02 67.07 1lhr s SER 188 CO -0.03 -0.56 1.76 0.59 0.98 0.00 0.00 173.24 175.97 1lhr n ASN 189 N -0.18 0.78 -4.56 7.02 3.02 -1.26 -4.46 115.26 115.62 1lhr n ASN 189 Ca -0.08 0.61 -0.48 0.00 -0.03 0.00 0.00 54.58 54.60 1lhr n ASN 189 Cb 0.63 -0.80 -0.03 0.00 -0.61 0.00 0.00 39.78 38.96 1lhr n ASN 189 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1lhr n LEU 190 N -2.27 1.31 -4.57 3.41 4.32 -1.26 -4.90 117.00 113.04 1lhr n LEU 190 Ca 0.04 1.15 -0.43 0.00 -0.02 0.00 0.00 56.01 56.76 1lhr n LEU 190 Cb 0.37 -1.20 -0.04 0.00 -1.62 0.00 0.00 43.42 40.93 1lhr n LEU 190 CO 0.27 -1.50 0.80 -0.76 -1.22 0.00 0.00 177.39 174.98 1lhr s LEU 191 N 0.80 3.94 0.27 2.23 1.43 -1.26 -4.57 118.68 121.52 1lhr s LEU 191 Ca 0.69 0.21 -0.30 0.00 -1.03 0.00 0.00 54.13 53.70 1lhr s LEU 191 Cb -0.83 -3.26 -0.11 0.00 0.03 0.00 0.00 46.19 42.02 1lhr s LEU 191 CO 0.55 -1.07 1.51 -0.44 0.23 0.00 0.00 176.35 177.13 1lhr s SER 192 N 2.27 6.52 0.59 2.29 0.01 -1.25 -4.84 113.70 119.29 1lhr s SER 192 Ca 0.39 2.80 0.29 0.00 1.31 0.00 0.00 55.95 60.74 1lhr s SER 192 Cb -0.10 -2.63 1.81 0.00 0.21 0.00 0.00 66.02 65.31 1lhr s SER 192 CO 0.27 -0.80 2.25 -0.65 0.41 0.00 0.00 173.24 174.71 1lhr h PRO 193 N 4.96 0.00 0.00 12.44 0.11 -1.97 -1.00 132.00 146.53 1lhr h PRO 193 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1lhr h PRO 193 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1lhr h PRO 193 CO 0.79 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.58 1lhr h ARG 194 N 0.00 0.00 0.00 1.05 -0.00 -1.98 -3.48 114.38 109.97 1lhr h ARG 194 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 1lhr h ARG 194 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.00 1lhr h ARG 194 CO -0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.97 180.38 1lhr n GLY 195 N -0.30 3.43 0.05 0.04 0.00 -0.38 -4.93 105.19 103.10 1lhr n GLY 195 Ca -0.00 -1.55 0.14 0.00 0.00 0.00 0.00 46.02 44.61 1lhr n GLY 195 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1lhr n SER 196 N 0.00 0.24 -1.37 1.61 3.41 -1.26 -3.50 113.62 112.75 1lhr n SER 196 Ca 0.00 -0.24 0.10 0.00 -0.26 0.00 0.00 58.87 58.47 1lhr n SER 196 Cb 0.00 -0.18 0.31 0.00 -0.26 0.00 0.00 64.21 64.08 1lhr n SER 196 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1lhr n ASP 197 N -1.19 4.01 -4.51 4.04 10.43 -1.26 -4.88 116.55 123.18 1lhr n ASP 197 Ca 0.13 -2.20 -0.33 0.00 2.57 0.00 0.00 54.79 54.96 1lhr n ASP 197 Cb 0.28 -0.50 -0.12 0.00 1.84 0.00 0.00 41.12 42.61 1lhr n ASP 197 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 1lhr s TYR 198 N -1.45 2.79 -0.04 1.24 1.51 -1.23 -0.84 117.35 119.34 1lhr s TYR 198 Ca 0.46 -0.11 -0.15 0.00 -1.01 0.00 0.00 57.07 56.26 1lhr s TYR 198 Cb 0.27 -1.67 -0.05 0.00 -0.11 0.00 0.00 41.96 40.40 1lhr s TYR 198 CO 0.27 0.22 0.40 -0.51 -1.11 0.00 0.00 175.55 174.82 1lhr s LEU 199 N -0.71 4.42 -0.12 -1.29 1.43 0.39 -4.52 118.68 118.28 1lhr s LEU 199 Ca 0.11 0.88 -0.05 0.00 -1.03 0.00 0.00 54.13 54.04 1lhr s LEU 199 Cb -0.11 -2.57 -0.04 0.00 0.03 0.00 0.00 46.19 43.50 1lhr s LEU 199 CO 0.01 0.25 0.07 -0.32 0.23 0.00 0.00 176.35 176.59 1lhr s MET 200 N -0.65 3.40 -0.02 1.70 -2.45 -1.26 -0.67 119.30 119.36 1lhr s MET 200 Ca 0.23 -0.29 0.06 0.00 -1.25 0.00 0.00 55.69 54.44 1lhr s MET 200 Cb -0.16 -3.04 -0.01 0.00 1.25 0.00 0.00 34.83 32.86 1lhr s MET 200 CO 0.12 0.63 -0.19 0.00 1.05 0.00 0.00 175.02 176.62 1lhr s ALA 201 N -0.63 1.61 0.06 4.11 0.00 -0.20 -2.46 121.76 124.24 1lhr s ALA 201 Ca 0.11 -0.83 0.09 0.00 0.00 0.00 0.00 51.96 51.33 1lhr s ALA 201 Cb -0.12 -0.41 -0.03 0.00 0.00 0.00 0.00 23.12 22.56 1lhr s ALA 201 CO 0.02 0.39 -0.24 -0.51 0.00 0.00 0.00 175.76 175.42 1lhr s LEU 202 N -0.44 2.19 0.03 0.00 1.02 -0.58 -1.21 118.68 119.69 1lhr s LEU 202 Ca 0.07 -0.59 0.01 0.00 0.02 0.00 0.00 54.13 53.65 1lhr s LEU 202 Cb -0.08 -1.15 -0.02 0.00 0.02 0.00 0.00 46.19 44.96 1lhr s LEU 202 CO -0.01 0.21 -0.06 -0.83 0.02 0.00 0.00 176.35 175.68 1lhr s GLY 203 N -1.34 0.38 -0.05 -3.19 0.00 -0.70 -0.28 107.32 102.13 1lhr s GLY 203 Ca 0.10 -0.63 -0.07 0.00 0.00 0.00 0.00 44.72 44.12 1lhr s GLY 203 CO 0.02 -0.68 0.19 -0.45 0.00 0.00 0.00 173.10 172.18 1lhr s SER 204 N -1.35 -0.15 -0.10 1.64 0.15 0.12 -0.82 113.70 113.20 1lhr s SER 204 Ca -0.11 0.23 -0.05 0.00 0.70 0.00 0.00 55.95 56.72 1lhr s SER 204 Cb -0.09 0.35 0.04 0.00 -1.71 0.00 0.00 66.02 64.61 1lhr s SER 204 CO -0.00 -0.16 0.23 -1.58 1.20 0.00 0.00 173.24 172.92 1lhr s GLN 205 N -0.35 0.18 -0.05 5.44 0.74 0.15 -1.35 119.66 124.42 1lhr s GLN 205 Ca -0.04 0.50 -0.03 0.00 0.05 0.00 0.00 55.36 55.83 1lhr s GLN 205 Cb -0.03 -0.13 -0.04 0.00 1.10 0.00 0.00 33.01 33.91 1lhr s GLN 205 CO 0.01 -0.16 0.10 1.03 -0.55 0.00 0.00 175.29 175.71 1lhr s ARG 206 N 1.24 3.21 -0.04 1.67 0.52 0.62 -0.74 118.95 125.43 1lhr s ARG 206 Ca -0.09 -0.35 -0.01 0.00 -0.52 0.00 0.00 55.73 54.76 1lhr s ARG 206 Cb -0.11 -2.97 0.03 0.00 0.52 0.00 0.00 34.95 32.42 1lhr s ARG 206 CO -0.08 0.70 0.03 0.99 0.02 0.00 0.00 175.30 176.96 1lhr s THR 207 N -1.10 0.05 -1.31 0.02 2.01 -0.89 -4.85 115.64 109.56 1lhr s THR 207 Ca 0.19 0.23 -0.17 0.00 0.31 0.00 0.00 61.69 62.25 1lhr s THR 207 Cb -0.12 -0.22 0.03 0.00 0.01 0.00 0.00 72.50 72.21 1lhr s THR 207 CO 0.09 0.16 1.92 -1.14 -0.69 0.00 0.00 174.62 174.96 1lhr n ARG 208 N 4.64 2.85 -0.08 4.92 0.63 -1.26 0.18 116.66 128.54 1lhr n ARG 208 Ca -0.17 -2.92 -0.13 0.00 -0.92 0.00 0.00 57.85 53.71 1lhr n ARG 208 Cb 0.50 -3.43 -0.05 0.00 0.45 0.00 0.00 32.46 29.93 1lhr n ARG 208 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1lhr h ALA 209 N 7.31 0.36 -3.16 5.13 0.00 -2.05 -3.48 119.26 123.37 1lhr h ALA 209 Ca 0.46 -0.39 -0.65 0.00 0.00 0.00 0.00 54.91 54.33 1lhr h ALA 209 Cb 0.80 -0.07 -0.25 0.00 0.00 0.00 0.00 17.79 18.26 1lhr h ALA 209 CO 1.60 0.36 -0.71 0.08 0.00 0.00 0.00 179.25 180.58 1lhr s VAL 214 N -4.29 3.52 0.75 0.00 1.01 -1.26 -5.23 120.40 114.89 1lhr s VAL 214 Ca -0.13 -0.47 -0.10 0.00 0.00 0.00 0.00 61.98 61.28 1lhr s VAL 214 Cb 0.08 -2.56 0.06 0.00 0.00 0.00 0.00 36.38 33.95 1lhr s VAL 214 CO 0.81 0.46 1.10 -0.69 0.00 0.00 0.00 175.10 176.79 1lhr s VAL 215 N 0.90 2.53 -0.18 2.92 1.01 0.13 -4.89 120.40 122.82 1lhr s VAL 215 Ca -0.01 0.05 -0.11 0.00 0.00 0.00 0.00 61.98 61.92 1lhr s VAL 215 Cb -0.15 -3.15 0.06 0.00 0.00 0.00 0.00 36.38 33.15 1lhr s VAL 215 CO 0.01 -0.18 0.44 -0.89 0.00 0.00 0.00 175.10 174.48 1lhr s THR 216 N -3.41 -0.02 -0.14 3.92 2.01 -1.26 -2.10 115.64 114.64 1lhr s THR 216 Ca 0.60 0.07 0.01 0.00 0.31 0.00 0.00 61.69 62.68 1lhr s THR 216 Cb -0.11 -0.65 -0.00 0.00 0.01 0.00 0.00 72.50 71.75 1lhr s THR 216 CO 0.48 0.03 -0.17 -1.10 -0.69 0.00 0.00 174.62 173.17 1lhr s GLN 217 N 1.26 3.21 0.04 4.92 -0.21 0.08 -4.96 119.66 124.01 1lhr s GLN 217 Ca -0.08 -0.77 0.09 0.00 0.02 0.00 0.00 55.36 54.62 1lhr s GLN 217 Cb -0.07 -2.55 -0.03 0.00 1.00 0.00 0.00 33.01 31.36 1lhr s GLN 217 CO -0.12 0.10 -0.26 1.03 -2.12 0.00 0.00 175.29 173.93 1lhr s ARG 218 N 0.59 1.85 0.13 2.91 0.52 -1.26 -0.67 118.95 123.01 1lhr s ARG 218 Ca -0.10 -1.09 -0.02 0.00 -0.52 0.00 0.00 55.73 54.00 1lhr s ARG 218 Cb -0.16 -2.00 -0.03 0.00 0.52 0.00 0.00 34.95 33.28 1lhr s ARG 218 CO 0.03 0.52 0.09 0.96 0.02 0.00 0.00 175.30 176.92 1lhr s ILE 219 N -0.79 0.10 -0.01 1.52 -4.36 0.00 -1.62 121.20 116.05 1lhr s ILE 219 Ca 0.12 -1.82 -0.03 0.00 -0.26 0.00 0.00 60.65 58.66 1lhr s ILE 219 Cb -0.10 -1.98 -0.00 0.00 1.25 0.00 0.00 42.46 41.63 1lhr s ILE 219 CO 0.02 -0.47 0.05 -0.60 0.24 0.00 0.00 174.94 174.18 1lhr s ARG 220 N -4.03 0.21 -0.00 0.37 3.52 -0.65 -1.73 118.95 116.64 1lhr s ARG 220 Ca 0.22 -0.17 0.00 0.00 -0.13 0.00 0.00 55.73 55.65 1lhr s ARG 220 Cb 0.07 0.08 -0.00 0.00 -1.56 0.00 0.00 34.95 33.54 1lhr s ARG 220 CO 0.01 -0.04 -0.00 -1.64 -0.81 0.00 0.00 175.30 172.82 1lhr s MET 221 N -0.60 0.04 -0.13 5.12 -1.94 -0.35 -1.52 119.30 119.92 1lhr s MET 221 Ca -0.07 -0.01 -0.03 0.00 -1.71 0.00 0.00 55.69 53.87 1lhr s MET 221 Cb -0.04 -0.04 -0.03 0.00 2.01 0.00 0.00 34.83 36.73 1lhr s MET 221 CO 0.00 0.01 -0.04 -1.21 -0.01 0.00 0.00 175.02 173.77 1lhr s GLU 222 N -0.00 3.41 -0.05 2.03 0.41 -1.26 -1.03 118.70 122.20 1lhr s GLU 222 Ca 0.00 -0.51 0.02 0.00 -0.41 0.00 0.00 54.97 54.07 1lhr s GLU 222 Cb -0.00 -2.84 0.01 0.00 -1.78 0.00 0.00 34.13 29.52 1lhr s GLU 222 CO -0.00 0.39 -0.08 -1.64 -0.49 0.00 0.00 175.26 173.44 1lhr s MET 223 N -0.04 1.16 0.15 1.61 -1.94 0.16 -4.92 119.30 115.48 1lhr s MET 223 Ca 0.01 -0.26 -0.30 0.00 -1.71 0.00 0.00 55.69 53.43 1lhr s MET 223 Cb -0.13 -1.04 -0.08 0.00 2.01 0.00 0.00 34.83 35.59 1lhr s MET 223 CO 0.03 0.01 1.22 -1.58 -0.01 0.00 0.00 175.02 174.68 1lhr s HIS 224 N 0.64 3.40 0.67 -0.03 2.46 -1.26 0.15 115.29 121.33 1lhr s HIS 224 Ca -0.11 1.34 -0.17 0.00 0.47 0.00 0.00 55.06 56.60 1lhr s HIS 224 Cb -0.14 -3.46 0.01 0.00 -0.13 0.00 0.00 32.58 28.86 1lhr s HIS 224 CO 0.02 -1.36 1.24 0.15 -2.47 0.00 0.00 174.74 172.31 1lhr s LYS 225 N 0.18 2.45 -0.13 2.88 1.02 -0.02 -4.83 119.74 121.28 1lhr s LYS 225 Ca 0.55 1.87 -0.01 0.00 0.02 0.00 0.00 55.97 58.41 1lhr s LYS 225 Cb -0.32 -1.86 -0.02 0.00 -0.52 0.00 0.00 37.83 35.11 1lhr s LYS 225 CO 0.34 -1.63 -0.10 0.08 -0.92 0.00 0.00 175.35 173.12 1lhr s VAL 226 N -1.71 3.30 -0.95 3.17 1.01 -1.26 -5.01 120.40 118.95 1lhr s VAL 226 Ca 0.78 -0.58 -0.07 0.00 0.00 0.00 0.00 61.98 62.11 1lhr s VAL 226 Cb -0.32 -2.40 -0.06 0.00 0.00 0.00 0.00 36.38 33.61 1lhr s VAL 226 CO 0.41 0.52 2.14 -0.67 0.00 0.00 0.00 175.10 177.51 1lhr n ASP 227 N 3.38 5.01 -3.64 3.32 2.03 -1.26 -4.77 116.55 120.61 1lhr n ASP 227 Ca -0.18 -2.35 -0.07 0.00 0.52 0.00 0.00 54.79 52.70 1lhr n ASP 227 Cb 0.53 -1.12 -0.02 0.00 -0.72 0.00 0.00 41.12 39.79 1lhr n ASP 227 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1lhr s ALA 228 N 3.42 -1.58 -0.24 -1.67 0.00 -1.26 -5.10 121.76 115.34 1lhr s ALA 228 Ca 0.42 0.31 -0.04 0.00 0.00 0.00 0.00 51.96 52.64 1lhr s ALA 228 Cb 0.11 0.70 -0.01 0.00 0.00 0.00 0.00 23.12 23.92 1lhr s ALA 228 CO -0.03 -0.90 -0.01 0.08 0.00 0.00 0.00 175.76 174.90 1lhr s VAL 229 N -3.51 3.52 0.23 0.00 1.01 -1.26 -5.10 120.40 115.30 1lhr s VAL 229 Ca 0.08 -0.52 0.08 0.00 0.00 0.00 0.00 61.98 61.62 1lhr s VAL 229 Cb -0.02 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 1lhr s VAL 229 CO -0.03 0.35 0.09 -0.36 0.00 0.00 0.00 175.10 175.16 1lhr s PHE 230 N 1.49 2.94 -0.04 5.22 0.40 -1.26 -5.00 117.98 121.73 1lhr s PHE 230 Ca 0.05 -0.14 0.05 0.00 -0.60 0.00 0.00 56.93 56.30 1lhr s PHE 230 Cb -0.15 -1.35 -0.01 0.00 0.51 0.00 0.00 43.02 42.02 1lhr s PHE 230 CO -0.02 0.55 -0.20 0.08 0.70 0.00 0.00 175.22 176.33 1lhr s VAL 231 N -2.07 1.63 0.00 -0.44 1.01 -1.26 -4.69 120.40 114.58 1lhr s VAL 231 Ca 0.31 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.45 1lhr s VAL 231 Cb -0.08 -1.38 0.00 0.00 0.00 0.00 0.00 36.38 34.92 1lhr s VAL 231 CO 0.22 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.39 1lhr n GLY 232 N 2.92 0.76 0.34 4.51 0.00 -1.26 -4.74 105.19 107.71 1lhr n GLY 232 Ca -0.17 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.83 1lhr n GLY 232 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1lhr h THR 233 N 0.00 1.23 -0.42 2.61 1.35 -1.87 -1.37 112.91 114.44 1lhr h THR 233 Ca 0.00 -0.63 -0.04 0.00 -0.55 0.00 0.00 66.41 65.19 1lhr h THR 233 Cb 0.00 0.28 -0.02 0.00 -1.73 0.00 0.00 68.15 66.68 1lhr h THR 233 CO 0.00 0.27 0.08 1.23 -0.25 0.00 0.00 175.52 176.85 1lhr h GLY 234 N 1.08 0.67 1.14 5.82 0.00 -1.95 -1.04 103.07 108.81 1lhr h GLY 234 Ca 0.25 -0.37 -0.19 0.00 0.00 0.00 0.00 47.33 47.02 1lhr h GLY 234 CO -0.03 0.35 -0.57 -0.55 0.00 0.00 0.00 176.54 175.74 1lhr h ASP 235 N 0.61 0.97 -0.54 0.19 3.32 -1.72 -2.79 116.42 116.46 1lhr h ASP 235 Ca 0.14 -0.54 -0.07 0.00 0.02 0.00 0.00 57.03 56.58 1lhr h ASP 235 Cb 0.27 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.51 1lhr h ASP 235 CO 0.00 1.34 0.10 0.25 -1.72 0.00 0.00 179.24 179.21 1lhr h LEU 236 N 0.65 0.89 0.55 1.55 5.85 -0.92 -2.60 115.31 121.28 1lhr h LEU 236 Ca 0.01 -0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.51 1lhr h LEU 236 Cb 1.18 -0.23 0.01 0.00 0.37 0.00 0.00 40.66 41.98 1lhr h LEU 236 CO 0.13 0.89 -0.27 0.15 -0.34 0.00 0.00 178.44 179.00 1lhr h PHE 237 N 0.89 -0.69 -0.97 1.25 3.57 -1.16 -1.99 116.94 117.84 1lhr h PHE 237 Ca 0.18 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.73 1lhr h PHE 237 Cb 0.38 0.23 -0.06 0.00 2.79 0.00 0.00 35.95 39.29 1lhr h PHE 237 CO 0.02 -0.41 0.63 0.00 -2.23 0.00 0.00 178.31 176.32 1lhr h ALA 238 N -0.34 1.33 -0.37 2.41 0.00 -1.46 0.16 119.26 121.00 1lhr h ALA 238 Ca -0.08 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1lhr h ALA 238 Cb 0.58 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1lhr h ALA 238 CO 0.12 0.43 0.03 0.00 0.00 0.00 0.00 179.25 179.84 1lhr h ALA 239 N 1.43 0.49 -0.01 0.00 0.00 -1.40 -1.50 119.26 118.27 1lhr h ALA 239 Ca 0.41 -0.23 -0.19 0.00 0.00 0.00 0.00 54.91 54.91 1lhr h ALA 239 Cb 0.13 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1lhr h ALA 239 CO -0.16 0.22 -0.82 0.52 0.00 0.00 0.00 179.25 179.01 1lhr h MET 240 N 0.45 0.18 -0.82 0.00 2.86 -0.98 -2.70 114.93 113.93 1lhr h MET 240 Ca 0.11 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 1lhr h MET 240 Cb 0.41 0.05 -0.04 0.00 0.06 0.00 0.00 31.60 32.08 1lhr h MET 240 CO 0.01 0.90 0.47 1.25 1.06 0.00 0.00 176.91 180.61 1lhr h LEU 241 N 0.11 1.00 -0.22 1.22 5.85 -0.61 -0.55 115.31 122.11 1lhr h LEU 241 Ca -0.03 -0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.65 1lhr h LEU 241 Cb 1.43 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 42.17 1lhr h LEU 241 CO 0.12 0.79 -0.02 0.25 -0.34 0.00 0.00 178.44 179.24 1lhr h LEU 242 N 1.13 -0.13 -0.11 2.25 6.46 -1.09 0.73 115.31 124.55 1lhr h LEU 242 Ca 0.29 0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 58.10 1lhr h LEU 242 Cb -0.01 0.11 -0.00 0.00 -0.73 0.00 0.00 40.66 40.02 1lhr h LEU 242 CO -0.05 -0.04 0.04 0.00 -0.62 0.00 0.00 178.44 177.77 1lhr h ALA 243 N 1.20 0.14 -0.01 1.25 0.00 -1.09 -2.81 119.26 117.94 1lhr h ALA 243 Ca 0.11 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1lhr h ALA 243 Cb 0.14 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1lhr h ALA 243 CO -0.20 -0.26 -0.41 -1.49 0.00 0.00 0.00 179.25 176.89 1lhr h TRP 244 N 0.01 0.03 -0.04 0.00 -0.00 -0.93 -2.41 115.95 112.60 1lhr h TRP 244 Ca 0.04 -0.01 -0.11 0.00 -0.00 0.00 0.00 58.89 58.81 1lhr h TRP 244 Cb 0.19 -0.01 -0.01 0.00 -0.00 0.00 0.00 29.16 29.33 1lhr h TRP 244 CO -0.01 0.43 -0.48 1.79 -0.00 0.00 0.00 178.44 180.18 1lhr h THR 245 N 0.02 1.34 -0.19 1.49 1.35 -0.81 -1.39 112.91 114.72 1lhr h THR 245 Ca -0.00 -1.66 -0.03 0.00 -0.55 0.00 0.00 66.41 64.17 1lhr h THR 245 Cb 0.74 1.84 -0.01 0.00 -1.73 0.00 0.00 68.15 69.00 1lhr h THR 245 CO 0.05 0.48 0.02 -0.74 -0.25 0.00 0.00 175.52 175.09 1lhr h HIS 246 N 0.09 0.35 0.00 4.73 -0.00 -1.17 -1.18 115.15 117.96 1lhr h HIS 246 Ca 0.00 -0.05 -0.05 0.00 -0.00 0.00 0.00 60.37 60.27 1lhr h HIS 246 Cb 0.88 -0.09 -0.01 0.00 -0.00 0.00 0.00 27.41 28.19 1lhr h HIS 246 CO 0.01 0.50 -0.23 -0.22 -0.00 0.00 0.00 177.93 177.98 1lhr h LYS 247 N 0.10 0.00 -2.20 5.26 3.11 -1.31 -3.32 116.57 118.22 1lhr h LYS 247 Ca 0.06 0.00 -0.58 0.00 -2.81 0.00 0.00 60.65 57.32 1lhr h LYS 247 Cb 0.35 0.00 -0.40 0.00 -1.00 0.00 0.00 32.23 31.18 1lhr h LYS 247 CO 0.01 0.23 -0.94 0.72 -2.81 0.00 0.00 179.45 176.66 1lhr n HIS 248 N -3.48 0.56 -0.21 1.91 8.25 -0.54 -5.00 115.22 116.71 1lhr n HIS 248 Ca -0.00 -3.68 0.11 0.00 -0.26 0.00 0.00 57.72 53.89 1lhr n HIS 248 Cb 0.41 -0.28 0.40 0.00 1.12 0.00 0.00 29.99 31.64 1lhr n HIS 248 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1lhr h PRO 249 N 4.49 0.62 -0.27 -0.41 0.13 -1.32 -2.97 132.00 132.27 1lhr h PRO 249 Ca 0.14 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1lhr h PRO 249 Cb 0.83 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.83 1lhr h PRO 249 CO 0.53 0.41 0.00 0.09 -0.23 0.00 0.00 178.00 178.80 1lhr n ASN 250 N -4.51 3.04 -3.82 1.44 3.02 -1.26 -4.81 115.26 108.36 1lhr n ASN 250 Ca 0.14 -2.31 -0.28 0.00 -0.03 0.00 0.00 54.58 52.09 1lhr n ASN 250 Cb 0.40 -0.29 -0.12 0.00 -0.61 0.00 0.00 39.78 39.15 1lhr n ASN 250 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1lhr s ASN 251 N -1.32 4.17 0.54 6.41 3.84 -1.12 -4.93 114.94 122.53 1lhr s ASN 251 Ca 0.26 -3.49 0.32 0.00 0.21 0.00 0.00 52.86 50.15 1lhr s ASN 251 Cb 0.17 -1.41 1.46 0.00 -0.55 0.00 0.00 41.25 40.91 1lhr s ASN 251 CO 0.11 -0.14 2.03 0.25 -2.79 0.00 0.00 177.10 176.57 1lhr h LEU 252 N 5.74 0.00 0.24 3.21 5.85 -1.87 -2.32 115.31 126.16 1lhr h LEU 252 Ca 0.11 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 1lhr h LEU 252 Cb 0.81 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.85 1lhr h LEU 252 CO 0.64 0.08 -0.11 0.50 -0.34 0.00 0.00 178.44 179.21 1lhr h LYS 253 N 0.00 -0.31 -0.64 1.25 3.64 -1.95 -1.58 116.57 116.99 1lhr h LYS 253 Ca -0.00 0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.32 1lhr h LYS 253 Cb 0.44 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.30 1lhr h LYS 253 CO 0.01 0.00 0.08 0.28 -2.27 0.00 0.00 179.45 177.55 1lhr h VAL 254 N -0.63 1.26 -0.46 2.00 2.07 -1.94 -1.11 116.25 117.45 1lhr h VAL 254 Ca -0.03 -1.06 0.03 0.00 0.82 0.00 0.00 66.70 66.45 1lhr h VAL 254 Cb 0.45 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 1lhr h VAL 254 CO 0.05 0.39 0.25 0.00 0.02 0.00 0.00 177.57 178.29 1lhr h ALA 255 N 1.02 0.58 -0.16 1.67 0.00 -1.42 -1.80 119.26 119.15 1lhr h ALA 255 Ca 0.19 0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.91 1lhr h ALA 255 Cb 0.47 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1lhr h ALA 255 CO 0.02 -0.09 -0.68 0.00 0.00 0.00 0.00 179.25 178.50 1lhr h GLU 257 N 0.46 1.05 -0.17 0.00 5.08 -0.86 0.20 114.58 120.35 1lhr h GLU 257 Ca -0.02 -0.06 -0.17 0.00 -1.00 0.00 0.00 59.36 58.10 1lhr h GLU 257 Cb 1.27 -0.24 0.01 0.00 0.50 0.00 0.00 28.75 30.29 1lhr h GLU 257 CO 0.13 0.69 -0.56 0.87 -1.00 0.00 0.00 179.01 179.15 1lhr h LYS 258 N 1.08 0.67 -0.25 2.33 1.57 -1.35 -1.77 116.57 118.85 1lhr h LYS 258 Ca 0.34 -0.50 -0.00 0.00 -1.87 0.00 0.00 60.65 58.62 1lhr h LYS 258 Cb -0.01 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1lhr h LYS 258 CO -0.11 1.12 0.16 1.15 -0.57 0.00 0.00 179.45 181.20 1lhr h THR 259 N 0.35 1.09 -0.27 -0.16 2.02 -0.96 -0.81 112.91 114.18 1lhr h THR 259 Ca -0.02 -0.20 -0.12 0.00 0.77 0.00 0.00 66.41 66.84 1lhr h THR 259 Cb 1.18 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 68.34 1lhr h THR 259 CO 0.12 0.08 -0.35 0.58 0.37 0.00 0.00 175.52 176.33 1lhr h VAL 260 N 0.33 1.29 0.29 3.16 2.07 -0.68 -2.06 116.25 120.66 1lhr h VAL 260 Ca 0.09 -1.48 -0.01 0.00 0.82 0.00 0.00 66.70 66.12 1lhr h VAL 260 Cb 0.00 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1lhr h VAL 260 CO -0.02 0.47 -0.14 0.28 0.02 0.00 0.00 177.57 178.18 1lhr h SER 261 N 0.49 -0.34 -0.72 0.57 0.02 -1.04 -1.56 113.55 110.99 1lhr h SER 261 Ca 0.05 -0.11 0.16 0.00 -0.84 0.00 0.00 61.79 61.05 1lhr h SER 261 Cb 0.83 0.09 -0.11 0.00 0.14 0.00 0.00 62.40 63.35 1lhr h SER 261 CO 0.07 -0.08 0.12 0.00 -1.14 0.00 0.00 176.83 175.80 1lhr h ALA 262 N 0.05 0.87 -0.15 3.77 0.00 -1.11 0.52 119.26 123.21 1lhr h ALA 262 Ca -0.04 0.18 0.04 0.00 0.00 0.00 0.00 54.91 55.10 1lhr h ALA 262 Cb 0.43 0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 1lhr h ALA 262 CO 0.07 -0.36 -0.16 1.98 0.00 0.00 0.00 179.25 180.77 1lhr h MET 263 N 0.22 -0.19 -0.84 0.00 4.05 -1.13 -1.18 114.93 115.86 1lhr h MET 263 Ca 0.40 0.01 0.10 0.00 -0.28 0.00 0.00 59.70 59.93 1lhr h MET 263 Cb 0.69 0.04 -0.07 0.00 -0.80 0.00 0.00 31.60 31.46 1lhr h MET 263 CO -0.54 -0.13 0.48 1.25 0.23 0.00 0.00 176.91 178.21 1lhr h HIS 264 N -0.20 0.88 -0.42 1.39 6.17 0.09 -1.07 115.15 122.00 1lhr h HIS 264 Ca 0.10 0.03 -0.04 0.00 0.71 0.00 0.00 60.37 61.17 1lhr h HIS 264 Cb 0.34 -0.27 -0.02 0.00 2.52 0.00 0.00 27.41 29.99 1lhr h HIS 264 CO -0.29 0.36 0.09 0.45 0.71 0.00 0.00 177.93 179.25 1lhr h HIS 265 N 0.81 0.71 -0.32 5.26 -0.00 -0.46 -0.67 115.15 120.48 1lhr h HIS 265 Ca 0.41 -0.09 -0.02 0.00 -0.00 0.00 0.00 60.37 60.67 1lhr h HIS 265 Cb 0.37 -0.20 -0.01 0.00 -0.00 0.00 0.00 27.41 27.57 1lhr h HIS 265 CO -0.06 0.68 0.14 0.28 -0.00 0.00 0.00 177.93 178.98 1lhr h VAL 266 N 0.54 1.17 -0.66 2.45 2.07 -0.51 -1.32 116.25 119.99 1lhr h VAL 266 Ca 0.13 -0.50 -0.08 0.00 0.82 0.00 0.00 66.70 67.06 1lhr h VAL 266 Cb 0.33 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 1lhr h VAL 266 CO 0.00 0.18 0.09 -0.07 0.02 0.00 0.00 177.57 177.79 1lhr h LEU 267 N 0.38 1.05 -0.22 2.57 3.38 -1.13 -0.17 115.31 121.18 1lhr h LEU 267 Ca 0.11 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 1lhr h LEU 267 Cb 0.15 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1lhr h LEU 267 CO -0.01 1.05 0.08 1.56 0.09 0.00 0.00 178.44 181.21 1lhr h GLN 268 N 1.02 0.33 -0.08 1.13 1.08 -0.97 0.53 115.11 118.14 1lhr h GLN 268 Ca 0.20 -0.06 -0.03 0.00 -1.45 0.00 0.00 58.65 57.31 1lhr h GLN 268 Cb 0.46 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.83 1lhr h GLN 268 CO 0.02 0.39 -0.08 -0.09 -0.95 0.00 0.00 178.83 178.11 1lhr h ARG 269 N 0.19 0.12 -0.02 1.46 2.43 -1.04 -1.90 114.38 115.62 1lhr h ARG 269 Ca 0.07 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1lhr h ARG 269 Cb 0.19 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1lhr h ARG 269 CO -0.01 0.21 -0.08 1.15 -1.51 0.00 0.00 179.97 179.73 1lhr h THR 270 N 0.12 1.49 -0.29 0.20 2.02 -0.42 -2.88 112.91 113.14 1lhr h THR 270 Ca 0.03 -1.57 -0.09 0.00 0.77 0.00 0.00 66.41 65.54 1lhr h THR 270 Cb 0.22 2.49 -0.02 0.00 -1.74 0.00 0.00 68.15 69.11 1lhr h THR 270 CO 0.01 0.42 -0.19 -0.29 0.37 0.00 0.00 175.52 175.85 1lhr h ILE 271 N -0.51 1.25 -0.11 3.11 6.09 -0.78 -1.31 117.51 125.25 1lhr h ILE 271 Ca -0.00 -1.17 -0.01 0.00 -1.37 0.00 0.00 64.86 62.31 1lhr h ILE 271 Cb 0.73 1.23 -0.00 0.00 0.47 0.00 0.00 36.82 39.25 1lhr h ILE 271 CO 0.02 0.38 0.03 0.11 -3.07 0.00 0.00 178.15 175.61 1lhr h LYS 272 N 0.48 0.18 -0.36 2.19 1.57 -1.43 -2.30 116.57 116.90 1lhr h LYS 272 Ca 0.08 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.73 1lhr h LYS 272 Cb 0.60 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.87 1lhr h LYS 272 CO 0.04 0.35 -0.13 0.00 -0.57 0.00 0.00 179.45 179.14 1lhr h ALA 274 N 1.28 0.33 -0.05 0.00 0.00 -1.14 -0.51 119.26 119.17 1lhr h ALA 274 Ca 0.10 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1lhr h ALA 274 Cb 0.56 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1lhr h ALA 274 CO 0.04 -0.10 -0.33 0.87 0.00 0.00 0.00 179.25 179.73 1lhr h LYS 275 N 0.28 0.09 -0.51 0.00 1.57 -1.35 -1.90 116.57 114.74 1lhr h LYS 275 Ca 0.09 -0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 58.71 1lhr h LYS 275 Cb 0.13 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 1lhr h LYS 275 CO -0.01 0.42 -0.16 0.00 -0.57 0.00 0.00 179.45 179.13 1lhr h ALA 276 N 1.59 0.75 0.00 3.86 0.00 -0.83 -3.17 119.26 121.46 1lhr h ALA 276 Ca 0.01 -0.37 -0.12 0.00 0.00 0.00 0.00 54.91 54.43 1lhr h ALA 276 Cb 0.63 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1lhr h ALA 276 CO 0.05 0.67 -0.58 0.87 0.00 0.00 0.00 179.25 180.26 1lhr h LYS 277 N 0.88 0.00 -6.71 0.00 1.79 -0.84 -3.45 116.57 108.23 1lhr h LYS 277 Ca 0.13 0.00 -0.49 0.00 -2.18 0.00 0.00 60.65 58.10 1lhr h LYS 277 Cb 0.73 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.39 1lhr h LYS 277 CO 0.06 0.58 -0.03 -1.54 -1.08 0.00 0.00 179.45 177.44 1lhr s SER 278 N -6.52 6.34 1.33 0.86 1.04 -0.74 -5.07 113.70 110.95 1lhr s SER 278 Ca 0.02 0.77 -0.18 0.00 0.48 0.00 0.00 55.95 57.04 1lhr s SER 278 Cb 0.09 -2.17 0.34 0.00 0.10 0.00 0.00 66.02 64.37 1lhr s SER 278 CO 0.75 -0.40 0.92 0.61 0.98 0.00 0.00 173.24 176.10 1lhr n GLY 279 N -1.73 -2.98 3.75 7.32 0.00 -1.26 -4.89 105.19 105.40 1lhr n GLY 279 Ca -0.01 -1.43 -0.40 0.00 0.00 0.00 0.00 46.02 44.18 1lhr n GLY 279 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1lhr s GLU 280 N -4.66 4.75 -0.28 1.61 2.02 -1.26 -2.70 118.70 118.18 1lhr s GLU 280 Ca 0.68 1.59 0.00 0.00 0.02 0.00 0.00 54.97 57.26 1lhr s GLU 280 Cb -0.19 -3.27 0.00 0.00 0.10 0.00 0.00 34.13 30.77 1lhr s GLU 280 CO 0.62 0.35 0.00 0.41 0.02 0.00 0.00 175.26 176.65 1lhr n GLY 281 N 1.58 0.42 3.61 -1.39 0.00 -1.26 -4.96 105.19 103.19 1lhr n GLY 281 Ca -0.01 -0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 1lhr n GLY 281 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lhr s VAL 282 N -1.58 4.84 0.20 1.61 1.01 -1.10 -5.07 120.40 120.31 1lhr s VAL 282 Ca 0.00 -0.01 -0.30 0.00 0.00 0.00 0.00 61.98 61.67 1lhr s VAL 282 Cb 0.00 -3.22 -0.08 0.00 0.00 0.00 0.00 36.38 33.08 1lhr s VAL 282 CO 0.00 0.41 1.21 -0.54 0.00 0.00 0.00 175.10 176.18 1lhr s LYS 283 N 0.77 4.48 0.33 2.72 1.02 -1.26 -4.66 119.74 123.14 1lhr s LYS 283 Ca 0.05 1.91 -0.29 0.00 0.02 0.00 0.00 55.97 57.66 1lhr s LYS 283 Cb -0.13 -3.22 -0.10 0.00 -0.52 0.00 0.00 37.83 33.85 1lhr s LYS 283 CO 0.02 -0.09 1.38 -2.14 -0.92 0.00 0.00 175.35 173.60 1lhr s PRO 284 N -0.41 4.28 0.38 -1.68 0.02 -1.26 -5.00 135.00 131.33 1lhr s PRO 284 Ca 0.52 2.32 -0.05 0.00 0.02 0.00 0.00 61.00 63.82 1lhr s PRO 284 Cb -0.33 -3.05 -0.05 0.00 0.02 0.00 0.00 34.50 31.09 1lhr s PRO 284 CO 0.38 -0.32 0.66 -1.54 -0.33 0.00 0.00 177.00 175.86 1lhr s SER 285 N -0.26 6.37 0.33 2.53 1.04 -1.26 -4.90 113.70 117.55 1lhr s SER 285 Ca 0.52 0.80 0.12 0.00 0.48 0.00 0.00 55.95 57.86 1lhr s SER 285 Cb -0.42 -2.18 0.98 0.00 0.10 0.00 0.00 66.02 64.50 1lhr s SER 285 CO 0.54 -0.37 1.69 -0.65 0.98 0.00 0.00 173.24 175.43 1lhr h PRO 286 N 0.98 0.41 -0.44 4.02 0.11 -1.94 0.32 132.00 135.47 1lhr h PRO 286 Ca -0.48 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 1lhr h PRO 286 Cb 1.20 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1lhr h PRO 286 CO 0.63 0.27 0.11 0.00 -0.21 0.00 0.00 178.00 178.81 1lhr h ALA 287 N 1.80 1.38 0.00 -0.75 0.00 -1.94 -1.53 119.26 118.23 1lhr h ALA 287 Ca 0.69 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.43 1lhr h ALA 287 Cb 1.45 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1lhr h ALA 287 CO -0.55 0.45 -0.10 1.96 0.00 0.00 0.00 179.25 181.00 1lhr h GLN 288 N 0.63 0.00 -0.10 0.00 4.20 -0.80 -3.25 115.11 115.79 1lhr h GLN 288 Ca 0.15 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.86 1lhr h GLN 288 Cb 0.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1lhr h GLN 288 CO -0.00 0.00 0.00 1.28 -0.67 0.00 0.00 178.83 179.44 1lhr n LEU 289 N -2.96 1.64 -4.71 1.46 4.77 -0.36 -4.40 117.00 112.45 1lhr n LEU 289 Ca 0.04 -0.63 -0.43 0.00 -0.03 0.00 0.00 56.01 54.96 1lhr n LEU 289 Cb 0.52 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.53 1lhr n LEU 289 CO 0.34 0.31 1.11 -0.62 -1.33 0.00 0.00 177.39 177.20 1lhr n GLU 290 N 0.29 2.37 -1.65 3.23 -0.58 -1.04 -4.83 120.64 118.44 1lhr n GLU 290 Ca 0.17 0.84 -0.47 0.00 -0.42 0.00 0.00 57.16 57.29 1lhr n GLU 290 Cb 0.35 -2.55 -0.04 0.00 -0.57 0.00 0.00 31.44 28.63 1lhr n GLU 290 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1lhr n LEU 291 N 1.94 2.73 -4.01 -4.62 4.77 -1.26 -4.86 117.00 111.69 1lhr n LEU 291 Ca 0.09 1.11 -0.42 0.00 -0.03 0.00 0.00 56.01 56.76 1lhr n LEU 291 Cb 0.35 -1.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.07 1lhr n LEU 291 CO 0.63 -0.55 2.30 0.54 -1.33 0.00 0.00 177.39 178.98 1lhr n ARG 292 N 2.76 3.11 0.31 3.23 5.12 -1.26 -4.74 116.66 125.19 1lhr n ARG 292 Ca 0.16 -3.02 -0.13 0.00 -1.93 0.00 0.00 57.85 52.93 1lhr n ARG 292 Cb 0.27 -3.26 -0.06 0.00 -1.16 0.00 0.00 32.46 28.26 1lhr n ARG 292 CO 0.00 0.00 0.00 1.98 -1.93 0.00 0.00 177.63 177.68 1lhr h MET 293 N 6.41 -0.81 -0.84 5.56 1.85 -1.94 -3.06 114.93 122.10 1lhr h MET 293 Ca 0.49 0.06 0.12 0.00 -0.61 0.00 0.00 59.70 59.75 1lhr h MET 293 Cb 0.71 0.18 -0.06 0.00 0.43 0.00 0.00 31.60 32.86 1lhr h MET 293 CO 1.69 -0.54 0.54 0.28 -0.40 0.00 0.00 176.91 178.49 1lhr h VAL 294 N -1.20 0.90 0.00 -5.77 2.07 -2.01 -1.08 116.25 109.16 1lhr h VAL 294 Ca -0.09 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.19 1lhr h VAL 294 Cb 0.64 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 1lhr h VAL 294 CO 0.14 0.13 0.00 0.00 0.02 0.00 0.00 177.57 177.86 1lhr n GLN 295 N -4.53 0.03 -0.67 1.57 3.00 -1.25 -3.18 117.38 112.35 1lhr n GLN 295 Ca 0.15 0.01 0.08 0.00 -0.01 0.00 0.00 57.00 57.24 1lhr n GLN 295 Cb 0.39 -1.50 0.35 0.00 0.00 0.00 0.00 30.24 29.48 1lhr n GLN 295 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 1lhr n SER 296 N -1.49 4.90 -0.16 1.08 7.64 -0.41 -4.67 113.62 120.50 1lhr n SER 296 Ca 0.07 -2.67 -0.04 0.00 1.01 0.00 0.00 58.87 57.24 1lhr n SER 296 Cb 0.32 -0.59 0.03 0.00 -1.01 0.00 0.00 64.21 62.96 1lhr n SER 296 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 1lhr h LYS 297 N 3.64 -0.07 0.00 1.43 3.64 -1.55 -0.38 116.57 123.28 1lhr h LYS 297 Ca 0.00 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 1lhr h LYS 297 Cb 1.60 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.43 1lhr h LYS 297 CO 0.31 -0.05 -0.35 0.87 -2.27 0.00 0.00 179.45 177.96 1lhr h LYS 298 N -0.08 0.00 0.00 1.90 1.79 -1.89 -1.63 116.57 116.66 1lhr h LYS 298 Ca 0.24 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.66 1lhr h LYS 298 Cb 0.45 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.09 1lhr h LYS 298 CO -0.57 0.35 -0.26 -0.44 -1.08 0.00 0.00 179.45 177.45 1lhr h ASP 299 N 0.00 0.00 0.19 0.86 3.45 -1.45 -2.21 116.42 117.26 1lhr h ASP 299 Ca -0.00 0.00 -0.32 0.00 0.43 0.00 0.00 57.03 57.13 1lhr h ASP 299 Cb 0.65 0.00 0.02 0.00 -0.56 0.00 0.00 39.33 39.43 1lhr h ASP 299 CO 0.05 0.26 -1.54 0.40 -1.57 0.00 0.00 179.24 176.84 1lhr h ILE 300 N 0.00 1.10 -0.45 0.35 2.04 -0.69 -2.94 117.51 116.92 1lhr h ILE 300 Ca -0.00 -2.55 -0.05 0.00 1.00 0.00 0.00 64.86 63.26 1lhr h ILE 300 Cb 1.04 2.87 -0.02 0.00 -0.74 0.00 0.00 36.82 39.98 1lhr h ILE 300 CO 0.03 0.81 0.08 -0.33 0.00 0.00 0.00 178.15 178.74 1lhr h GLU 301 N 0.01 0.75 -2.07 2.37 5.08 -1.31 -3.39 114.58 116.01 1lhr h GLU 301 Ca -0.30 -0.20 -0.48 0.00 -1.00 0.00 0.00 59.36 57.39 1lhr h GLU 301 Cb 2.03 -0.09 -0.33 0.00 0.50 0.00 0.00 28.75 30.86 1lhr h GLU 301 CO 0.18 0.76 -0.84 0.45 -1.00 0.00 0.00 179.01 178.57 1lhr s SER 302 N -6.14 0.96 0.18 1.42 0.15 -0.83 -5.05 113.70 104.39 1lhr s SER 302 Ca -0.13 -2.55 -0.30 0.00 0.70 0.00 0.00 55.95 53.68 1lhr s SER 302 Cb 0.11 0.14 -0.08 0.00 -1.71 0.00 0.00 66.02 64.49 1lhr s SER 302 CO 0.79 -0.17 1.10 -2.16 1.20 0.00 0.00 173.24 174.00 1lhr s PRO 303 N 0.48 4.60 -0.06 5.44 0.04 -1.11 -4.65 135.00 139.74 1lhr s PRO 303 Ca 0.29 1.71 -0.30 0.00 0.04 0.00 0.00 61.00 62.75 1lhr s PRO 303 Cb -0.02 -3.28 -0.03 0.00 0.04 0.00 0.00 34.50 31.21 1lhr s PRO 303 CO -0.13 0.08 1.19 -1.21 0.04 0.00 0.00 177.00 176.97 1lhr s GLU 304 N -0.38 4.36 0.18 4.56 0.41 -1.26 -4.93 118.70 121.64 1lhr s GLU 304 Ca 0.49 1.65 -0.32 0.00 -0.41 0.00 0.00 54.97 56.39 1lhr s GLU 304 Cb -0.29 -3.55 -0.11 0.00 -1.78 0.00 0.00 34.13 28.40 1lhr s GLU 304 CO 0.35 -0.44 1.63 0.42 -0.49 0.00 0.00 175.26 176.73 1lhr s ILE 305 N 2.19 2.38 0.00 -1.63 -1.09 -1.26 -4.78 121.20 117.01 1lhr s ILE 305 Ca 0.55 0.27 0.00 0.00 -2.23 0.00 0.00 60.65 59.24 1lhr s ILE 305 Cb -0.24 -3.17 0.00 0.00 -1.58 0.00 0.00 42.46 37.46 1lhr s ILE 305 CO 0.22 0.02 0.65 1.33 -1.23 0.00 0.00 174.94 175.93 1lhr n VAL 306 N 3.99 0.40 -3.91 2.92 0.24 -1.26 -5.05 118.33 115.65 1lhr n VAL 306 Ca 0.15 -0.44 -0.11 0.00 -2.04 0.00 0.00 64.34 61.90 1lhr n VAL 306 Cb 0.37 0.90 -0.13 0.00 -1.47 0.00 0.00 33.84 33.51 1lhr n VAL 306 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1lhr s VAL 307 N -0.40 0.04 -0.19 3.34 1.01 -1.26 -5.07 120.40 117.87 1lhr s VAL 307 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 61.64 1lhr s VAL 307 Cb 0.00 -0.12 0.02 0.00 0.00 0.00 0.00 36.38 36.28 1lhr s VAL 307 CO 0.00 -0.19 -0.16 -1.58 0.00 0.00 0.00 175.10 173.17 1lhr s GLN 308 N -0.56 3.02 -0.12 2.72 0.74 -1.26 -4.90 119.66 119.30 1lhr s GLN 308 Ca -0.06 -0.82 -0.27 0.00 0.05 0.00 0.00 55.36 54.26 1lhr s GLN 308 Cb -0.04 -2.67 -0.02 0.00 1.10 0.00 0.00 33.01 31.38 1lhr s GLN 308 CO -0.00 -0.23 0.88 0.00 -0.55 0.00 0.00 175.29 175.38 1lhr s ALA 309 N 1.31 3.43 -0.05 1.58 0.00 -1.26 -4.79 121.76 121.99 1lhr s ALA 309 Ca 0.04 0.18 -0.24 0.00 0.00 0.00 0.00 51.96 51.94 1lhr s ALA 309 Cb -0.14 -3.26 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 1lhr s ALA 309 CO -0.11 -0.53 0.74 -0.08 0.00 0.00 0.00 175.76 175.78 1lhr s THR 310 N 1.84 5.00 0.00 0.00 -1.32 -0.57 -4.87 115.64 115.73 1lhr s THR 310 Ca 0.42 1.54 -0.30 0.00 -1.21 0.00 0.00 61.69 62.14 1lhr s THR 310 Cb -0.18 -4.08 -0.04 0.00 -1.51 0.00 0.00 72.50 66.70 1lhr s THR 310 CO 0.16 0.25 1.07 -0.69 -2.21 0.00 0.00 174.62 173.19 1lhr s VAL 311 N 0.77 4.56 -2.89 5.08 1.01 -1.26 -1.64 120.40 126.03 1lhr s VAL 311 Ca 0.40 1.84 0.25 0.00 0.00 0.00 0.00 61.98 64.46 1lhr s VAL 311 Cb -0.18 -4.18 0.27 0.00 0.00 0.00 0.00 36.38 32.29 1lhr s VAL 311 CO 0.20 0.12 1.37 0.18 0.00 0.00 0.00 175.10 176.96