#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b3l n ASP 2 N 0.00 1.25 -4.72 0.00 8.00 -1.26 -4.83 116.55 114.98 1b3l n ASP 2 Ca 0.00 -2.80 -0.42 0.00 0.71 0.00 0.00 54.79 52.28 1b3l n ASP 2 Cb 0.00 -0.65 -0.03 0.00 -0.02 0.00 0.00 41.12 40.42 1b3l n ASP 2 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1b3l s VAL 3 N -0.79 3.05 -0.31 2.53 1.01 -1.26 -4.94 120.40 119.69 1b3l s VAL 3 Ca 0.30 0.79 -0.29 0.00 0.00 0.00 0.00 61.98 62.78 1b3l s VAL 3 Cb 0.02 -3.50 -0.01 0.00 0.00 0.00 0.00 36.38 32.89 1b3l s VAL 3 CO -0.17 0.08 1.53 -2.84 0.00 0.00 0.00 175.10 173.70 1b3l s PRO 4 N 0.74 3.66 -0.39 2.72 0.02 -1.26 -4.91 135.00 135.59 1b3l s PRO 4 Ca 0.64 1.33 -0.40 0.00 0.02 0.00 0.00 61.00 62.59 1b3l s PRO 4 Cb -0.39 -4.04 -0.15 0.00 0.02 0.00 0.00 34.50 29.94 1b3l s PRO 4 CO 0.33 -1.45 2.03 0.00 -0.33 0.00 0.00 177.00 177.58 1b3l n ALA 5 N 8.77 0.36 0.00 -1.55 0.00 -1.26 -2.29 120.51 124.54 1b3l n ALA 5 Ca 0.18 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.78 1b3l n ALA 5 Cb 0.47 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.63 1b3l n ALA 5 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b3l n GLY 6 N 6.11 1.59 2.96 0.00 0.00 -1.26 -5.14 105.19 109.45 1b3l n GLY 6 Ca 0.41 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.23 1b3l n GLY 6 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1b3l s VAL 7 N -2.00 0.72 -0.28 1.61 1.01 -0.97 -5.13 120.40 115.36 1b3l s VAL 7 Ca 0.00 -0.27 -0.20 0.00 0.00 0.00 0.00 61.98 61.51 1b3l s VAL 7 Cb 0.00 -0.68 -0.02 0.00 0.00 0.00 0.00 36.38 35.68 1b3l s VAL 7 CO 0.00 0.25 0.59 -1.10 0.00 0.00 0.00 175.10 174.84 1b3l s GLN 8 N 0.55 4.00 -0.01 2.72 -0.21 -1.26 -5.01 119.66 120.44 1b3l s GLN 8 Ca -0.08 0.37 -0.25 0.00 0.02 0.00 0.00 55.36 55.41 1b3l s GLN 8 Cb -0.12 -3.68 -0.04 0.00 1.00 0.00 0.00 33.01 30.16 1b3l s GLN 8 CO 0.01 -0.46 0.78 -0.51 -2.12 0.00 0.00 175.29 172.99 1b3l s LEU 9 N 2.49 4.38 1.27 2.90 1.43 -1.26 -0.23 118.68 129.65 1b3l s LEU 9 Ca 0.24 1.38 -0.16 0.00 -1.03 0.00 0.00 54.13 54.57 1b3l s LEU 9 Cb -0.15 -3.24 0.32 0.00 0.03 0.00 0.00 46.19 43.15 1b3l s LEU 9 CO 0.10 -0.09 0.96 0.00 0.23 0.00 0.00 176.35 177.54 1b3l n ALA 10 N 3.42 -3.64 -0.00 4.21 0.00 -0.52 -4.41 120.51 119.57 1b3l n ALA 10 Ca -0.00 -1.42 -0.10 0.00 0.00 0.00 0.00 53.44 51.92 1b3l n ALA 10 Cb 0.51 -1.88 -0.14 0.00 0.00 0.00 0.00 19.45 17.94 1b3l n ALA 10 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1b3l h ASP 11 N -2.98 0.06 -3.58 0.00 1.82 -1.93 -3.43 116.42 106.38 1b3l h ASP 11 Ca -0.58 -0.11 -0.70 0.00 -0.39 0.00 0.00 57.03 55.25 1b3l h ASP 11 Cb 1.34 -0.02 -0.20 0.00 0.68 0.00 0.00 39.33 41.13 1b3l h ASP 11 CO 0.44 1.09 -0.43 -0.75 -1.61 0.00 0.00 179.24 177.98 1b3l s LYS 12 N -2.61 3.16 -1.14 0.28 2.20 -1.26 -5.00 119.74 115.38 1b3l s LYS 12 Ca -0.05 -0.87 -0.07 0.00 -0.36 0.00 0.00 55.97 54.61 1b3l s LYS 12 Cb 0.08 -3.92 0.26 0.00 -1.51 0.00 0.00 37.83 32.75 1b3l s LYS 12 CO 0.82 -0.65 1.42 1.04 -0.36 0.00 0.00 175.35 177.62 1b3l n GLN 13 N 5.17 3.94 -4.36 4.03 1.13 -1.26 -4.94 117.38 121.09 1b3l n GLN 13 Ca -0.11 -4.30 -0.23 0.00 -1.94 0.00 0.00 57.00 50.41 1b3l n GLN 13 Cb 0.48 -2.64 -0.11 0.00 0.11 0.00 0.00 30.24 28.08 1b3l n GLN 13 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1b3l s THR 14 N -1.39 1.97 -0.16 5.09 -4.23 -1.26 -1.01 115.64 114.66 1b3l s THR 14 Ca 0.34 -1.98 -0.09 0.00 -1.18 0.00 0.00 61.69 58.78 1b3l s THR 14 Cb -0.00 -1.94 0.05 0.00 1.34 0.00 0.00 72.50 71.96 1b3l s THR 14 CO 0.02 -0.28 0.38 -0.22 -0.54 0.00 0.00 174.62 173.98 1b3l s LEU 15 N -2.72 0.09 -0.17 4.79 2.96 -0.70 -4.93 118.68 118.00 1b3l s LEU 15 Ca 0.18 0.82 -0.03 0.00 -0.22 0.00 0.00 54.13 54.87 1b3l s LEU 15 Cb -0.06 1.25 -0.02 0.00 0.50 0.00 0.00 46.19 47.86 1b3l s LEU 15 CO 0.08 -0.18 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.18 1b3l s VAL 16 N 1.17 3.55 -0.06 1.68 1.01 -1.26 -1.00 120.40 125.49 1b3l s VAL 16 Ca -0.08 -0.46 0.04 0.00 0.00 0.00 0.00 61.98 61.48 1b3l s VAL 16 Cb -0.08 -2.56 -0.00 0.00 0.00 0.00 0.00 36.38 33.74 1b3l s VAL 16 CO -0.10 0.48 -0.18 -0.13 0.00 0.00 0.00 175.10 175.17 1b3l s ARG 17 N 0.72 1.99 0.18 2.72 0.52 -0.25 -1.64 118.95 123.20 1b3l s ARG 17 Ca -0.03 -0.63 -0.25 0.00 -0.52 0.00 0.00 55.73 54.31 1b3l s ARG 17 Cb -0.15 -1.67 -0.08 0.00 0.52 0.00 0.00 34.95 33.57 1b3l s ARG 17 CO 0.02 0.20 0.77 1.21 0.02 0.00 0.00 175.30 177.53 1b3l s ASN 18 N 0.18 7.35 0.00 0.23 2.47 -0.65 -0.93 114.94 123.58 1b3l s ASN 18 Ca -0.08 1.62 0.06 0.00 0.42 0.00 0.00 52.86 54.88 1b3l s ASN 18 Cb -0.13 -2.49 0.14 0.00 -1.45 0.00 0.00 41.25 37.32 1b3l s ASN 18 CO 0.03 0.18 1.04 -3.20 -3.72 0.00 0.00 177.10 171.43 1b3l n ASN 19 N 1.46 2.28 0.00 -4.21 5.15 0.82 -3.31 115.26 117.45 1b3l n ASN 19 Ca -0.05 -1.82 0.00 0.00 -0.60 0.00 0.00 54.58 52.11 1b3l n ASN 19 Cb 0.49 -0.10 0.00 0.00 -0.53 0.00 0.00 39.78 39.64 1b3l n ASN 19 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1b3l n GLY 20 N 0.14 2.59 3.74 8.20 0.00 -1.24 -4.58 105.19 114.04 1b3l n GLY 20 Ca 0.06 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.06 1b3l n GLY 20 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1b3l s SER 21 N -0.16 -0.14 -0.18 1.61 0.15 -1.26 -3.18 113.70 110.54 1b3l s SER 21 Ca 0.00 -0.37 -0.29 0.00 0.70 0.00 0.00 55.95 55.99 1b3l s SER 21 Cb 0.00 0.42 0.00 0.00 -1.71 0.00 0.00 66.02 64.73 1b3l s SER 21 CO 0.00 -0.78 1.02 -0.70 1.20 0.00 0.00 173.24 173.98 1b3l s GLU 22 N -3.05 4.32 0.81 5.44 2.56 -1.26 -4.44 118.70 123.08 1b3l s GLU 22 Ca 0.13 1.36 -0.14 0.00 0.00 0.00 0.00 54.97 56.33 1b3l s GLU 22 Cb -0.00 -3.60 0.06 0.00 2.00 0.00 0.00 34.13 32.59 1b3l s GLU 22 CO 0.01 -0.50 1.03 1.33 -0.56 0.00 0.00 175.26 176.57 1b3l n VAL 23 N 5.01 1.83 0.13 3.70 0.24 -1.26 -4.70 118.33 123.28 1b3l n VAL 23 Ca 0.11 -0.23 0.01 0.00 -2.04 0.00 0.00 64.34 62.18 1b3l n VAL 23 Cb 0.47 -1.08 0.32 0.00 -1.47 0.00 0.00 33.84 32.08 1b3l n VAL 23 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 1b3l h GLN 24 N -0.88 0.16 -1.16 7.34 4.20 -1.95 -3.48 115.11 119.34 1b3l h GLN 24 Ca -0.46 -0.06 0.35 0.00 0.06 0.00 0.00 58.65 58.54 1b3l h GLN 24 Cb 1.30 -0.01 -0.16 0.00 0.30 0.00 0.00 27.48 28.92 1b3l h GLN 24 CO 0.44 0.47 0.94 0.45 -0.67 0.00 0.00 178.83 180.46 1b3l s SER 25 N -6.90 -0.03 0.00 1.46 0.15 -1.26 -5.00 113.70 102.13 1b3l s SER 25 Ca -0.04 -0.03 0.14 0.00 0.70 0.00 0.00 55.95 56.71 1b3l s SER 25 Cb 0.14 0.06 -0.03 0.00 -1.71 0.00 0.00 66.02 64.48 1b3l s SER 25 CO 0.75 -0.10 0.74 0.18 1.20 0.00 0.00 173.24 176.01 1b3l n LEU 26 N -0.34 1.33 -4.65 3.45 4.77 -1.26 -4.90 117.00 115.40 1b3l n LEU 26 Ca -0.05 -0.72 -0.43 0.00 -0.03 0.00 0.00 56.01 54.78 1b3l n LEU 26 Cb 0.61 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.68 1b3l n LEU 26 CO 0.10 0.26 1.01 -0.62 -1.33 0.00 0.00 177.39 176.81 1b3l s ASP 27 N -1.81 6.93 0.57 -1.43 -1.08 -1.26 -4.91 116.67 113.68 1b3l s ASP 27 Ca 0.10 1.29 0.37 0.00 -0.52 0.00 0.00 52.55 53.80 1b3l s ASP 27 Cb 0.11 -2.54 2.04 0.00 -1.46 0.00 0.00 42.92 41.07 1b3l s ASP 27 CO 0.39 -0.84 2.14 1.55 0.52 0.00 0.00 175.17 178.93 1b3l h PRO 28 N 8.16 0.00 -0.01 4.34 0.14 -1.92 -0.33 132.00 142.39 1b3l h PRO 28 Ca -0.22 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.92 1b3l h PRO 28 Cb 1.08 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.22 1b3l h PRO 28 CO 1.01 0.00 -0.06 0.72 0.14 0.00 0.00 178.00 179.81 1b3l n HIS 29 N -2.83 0.00 0.01 1.56 8.25 -1.26 -3.96 115.22 116.98 1b3l n HIS 29 Ca -0.02 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.45 1b3l n HIS 29 Cb 0.08 -0.04 0.04 0.00 1.12 0.00 0.00 29.99 31.20 1b3l n HIS 29 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1b3l n LYS 30 N -0.20 1.89 -4.17 -0.41 4.76 -0.14 -4.22 118.16 115.67 1b3l n LYS 30 Ca 0.18 -1.39 -0.25 0.00 -2.87 0.00 0.00 58.31 53.97 1b3l n LYS 30 Cb 0.32 -1.09 -0.06 0.00 -1.84 0.00 0.00 35.03 32.36 1b3l n LYS 30 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 1b3l s ILE 31 N -0.79 4.01 0.00 -0.18 -4.36 -1.23 -4.78 121.20 113.87 1b3l s ILE 31 Ca 0.07 -1.39 0.00 0.00 -0.26 0.00 0.00 60.65 59.07 1b3l s ILE 31 Cb 0.04 -3.06 0.00 0.00 1.25 0.00 0.00 42.46 40.68 1b3l s ILE 31 CO 0.05 -0.18 0.00 -1.84 0.24 0.00 0.00 174.94 173.21 1b3l n GLU 32 N -0.45 0.00 -3.12 0.37 0.28 -1.26 -4.69 120.64 111.78 1b3l n GLU 32 Ca -0.09 0.00 -0.20 0.00 -0.16 0.00 0.00 57.16 56.71 1b3l n GLU 32 Cb 0.56 -0.13 0.06 0.00 1.43 0.00 0.00 31.44 33.36 1b3l n GLU 32 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1b3l n GLY 33 N 0.00 2.08 0.22 -1.84 0.00 -1.26 -5.00 105.19 99.39 1b3l n GLY 33 Ca 0.00 -2.24 -0.12 0.00 0.00 0.00 0.00 46.02 43.66 1b3l n GLY 33 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1b3l h VAL 34 N 0.19 1.29 0.21 1.61 2.07 -1.98 -0.96 116.25 118.67 1b3l h VAL 34 Ca -0.28 -1.32 -0.01 0.00 0.82 0.00 0.00 66.70 65.90 1b3l h VAL 34 Cb 1.26 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 32.43 1b3l h VAL 34 CO 0.41 0.43 -0.10 -0.65 0.02 0.00 0.00 177.57 177.68 1b3l h PRO 35 N 0.52 -0.27 -0.55 1.57 0.11 -1.95 -1.31 132.00 130.11 1b3l h PRO 35 Ca 0.07 0.02 0.10 0.00 0.11 0.00 0.00 66.00 66.30 1b3l h PRO 35 Cb 0.74 0.06 -0.08 0.00 0.11 0.00 0.00 31.00 31.83 1b3l h PRO 35 CO 0.06 -0.15 0.09 0.93 -0.21 0.00 0.00 178.00 178.71 1b3l h GLU 36 N -0.33 0.21 -0.46 1.05 3.07 -1.90 -2.81 114.58 113.41 1b3l h GLU 36 Ca -0.03 -0.01 -0.10 0.00 -0.50 0.00 0.00 59.36 58.71 1b3l h GLU 36 Cb 0.25 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.10 1b3l h GLU 36 CO 0.05 0.14 -0.13 0.77 -1.40 0.00 0.00 179.01 178.44 1b3l h SER 37 N 0.22 0.86 -0.05 1.42 0.02 -0.87 -2.08 113.55 113.06 1b3l h SER 37 Ca 0.28 -0.28 0.04 0.00 -0.84 0.00 0.00 61.79 61.00 1b3l h SER 37 Cb 0.42 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.67 1b3l h SER 37 CO -0.39 1.00 -0.32 0.78 -1.14 0.00 0.00 176.83 176.76 1b3l h ASN 38 N 0.77 -0.96 -0.32 3.07 2.35 -0.97 -2.59 115.58 116.93 1b3l h ASN 38 Ca 0.12 0.13 -0.05 0.00 -0.55 0.00 0.00 56.30 55.95 1b3l h ASN 38 Cb 0.65 0.39 -0.01 0.00 0.05 0.00 0.00 38.32 39.40 1b3l h ASN 38 CO 0.05 -0.37 -0.01 0.58 -1.65 0.00 0.00 177.43 176.02 1b3l h VAL 39 N -0.44 1.26 -0.76 2.81 2.07 -1.56 -3.30 116.25 116.34 1b3l h VAL 39 Ca 0.07 -0.99 0.17 0.00 0.82 0.00 0.00 66.70 66.78 1b3l h VAL 39 Cb 0.55 1.28 -0.12 0.00 -1.52 0.00 0.00 31.29 31.48 1b3l h VAL 39 CO -0.30 0.32 0.16 -1.28 0.02 0.00 0.00 177.57 176.50 1b3l h SER 40 N 0.36 -0.03 0.06 0.57 0.87 -1.24 -1.10 113.55 113.04 1b3l h SER 40 Ca 0.09 0.16 -0.01 0.00 -1.23 0.00 0.00 61.79 60.80 1b3l h SER 40 Cb 0.47 0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 62.65 1b3l h SER 40 CO 0.02 -0.07 -0.04 0.03 -0.53 0.00 0.00 176.83 176.24 1b3l h ARG 41 N 0.24 0.00 0.00 2.24 3.08 -1.54 0.27 114.38 118.68 1b3l h ARG 41 Ca 0.43 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 60.26 1b3l h ARG 41 Cb 0.76 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.78 1b3l h ARG 41 CO -0.55 0.04 -1.13 -0.44 -1.07 0.00 0.00 179.97 176.82 1b3l h ASP 42 N 0.00 0.00 0.06 7.04 3.32 -1.34 -3.39 116.42 122.10 1b3l h ASP 42 Ca -0.00 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.71 1b3l h ASP 42 Cb 0.08 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.60 1b3l h ASP 42 CO 0.01 0.96 -1.90 0.18 -1.72 0.00 0.00 179.24 176.76 1b3l n LEU 43 N -3.26 2.39 -4.29 1.55 4.77 -0.92 -1.36 117.00 115.86 1b3l n LEU 43 Ca -0.04 0.24 -0.31 0.00 -0.03 0.00 0.00 56.01 55.87 1b3l n LEU 43 Cb 0.95 -1.02 -0.16 0.00 -2.33 0.00 0.00 43.42 40.86 1b3l n LEU 43 CO 0.46 0.67 -0.56 -0.36 -1.33 0.00 0.00 177.39 176.26 1b3l s PHE 44 N -2.49 2.29 -0.11 -1.77 0.08 0.92 -0.41 117.98 116.49 1b3l s PHE 44 Ca -0.28 -0.48 0.03 0.00 0.12 0.00 0.00 56.93 56.32 1b3l s PHE 44 Cb 0.08 -1.48 0.01 0.00 -0.57 0.00 0.00 43.02 41.05 1b3l s PHE 44 CO 0.66 -0.07 -0.20 -2.00 -0.10 0.00 0.00 175.22 173.51 1b3l s GLU 45 N -0.51 2.65 0.00 0.44 2.12 -1.26 -4.46 118.70 117.68 1b3l s GLU 45 Ca 0.07 -0.73 0.00 0.00 0.36 0.00 0.00 54.97 54.67 1b3l s GLU 45 Cb -0.11 -2.11 0.00 0.00 0.26 0.00 0.00 34.13 32.18 1b3l s GLU 45 CO -0.00 0.05 0.00 0.41 -0.54 0.00 0.00 175.26 175.18 1b3l n GLY 46 N 3.86 1.42 0.50 -1.50 0.00 -1.26 -4.34 105.19 103.86 1b3l n GLY 46 Ca -0.20 -1.97 -0.17 0.00 0.00 0.00 0.00 46.02 43.68 1b3l n GLY 46 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1b3l h LEU 47 N 0.00 -1.52 -9.48 0.99 3.38 -1.82 -1.83 115.31 105.03 1b3l h LEU 47 Ca 0.00 0.14 -0.57 0.00 0.09 0.00 0.00 57.88 57.54 1b3l h LEU 47 Cb 0.00 0.54 -0.11 0.00 0.09 0.00 0.00 40.66 41.18 1b3l h LEU 47 CO 0.00 -0.61 -0.67 -0.76 0.09 0.00 0.00 178.44 176.49 1b3l s LEU 48 N -10.16 3.08 0.21 1.67 1.02 -1.26 -0.60 118.68 112.65 1b3l s LEU 48 Ca -0.17 -0.70 0.02 0.00 0.02 0.00 0.00 54.13 53.29 1b3l s LEU 48 Cb 0.05 -1.61 -0.05 0.00 0.02 0.00 0.00 46.19 44.60 1b3l s LEU 48 CO 0.61 0.02 0.05 0.27 0.02 0.00 0.00 176.35 177.31 1b3l s ILE 49 N -2.31 0.62 -0.02 -0.59 -4.36 0.91 -4.06 121.20 111.39 1b3l s ILE 49 Ca 0.31 -1.99 -0.14 0.00 -0.26 0.00 0.00 60.65 58.56 1b3l s ILE 49 Cb -0.06 -2.38 -0.05 0.00 1.25 0.00 0.00 42.46 41.22 1b3l s ILE 49 CO 0.19 -0.24 0.38 -0.44 0.24 0.00 0.00 174.94 175.07 1b3l s SER 50 N -3.24 6.75 0.00 4.36 0.01 -1.26 0.26 113.70 120.58 1b3l s SER 50 Ca 0.31 0.89 0.00 0.00 1.31 0.00 0.00 55.95 58.46 1b3l s SER 50 Cb 0.07 -2.23 0.00 0.00 0.21 0.00 0.00 66.02 64.07 1b3l s SER 50 CO 0.09 0.31 0.00 -0.90 0.41 0.00 0.00 173.24 173.15 1b3l n ASP 51 N 1.99 0.00 0.05 2.44 5.68 -0.00 -4.84 116.55 121.87 1b3l n ASP 51 Ca -0.14 0.00 0.12 0.00 -0.50 0.00 0.00 54.79 54.27 1b3l n ASP 51 Cb 0.53 0.00 0.22 0.00 -1.14 0.00 0.00 41.12 40.73 1b3l n ASP 51 CO 0.00 0.00 0.00 0.52 -1.33 0.00 0.00 177.20 176.39 1b3l n VAL 52 N -0.20 0.30 -0.47 2.12 0.31 -1.26 -3.36 118.33 115.76 1b3l n VAL 52 Ca 0.00 -0.22 0.09 0.00 -0.01 0.00 0.00 64.34 64.20 1b3l n VAL 52 Cb 0.00 -0.12 0.27 0.00 -0.91 0.00 0.00 33.84 33.08 1b3l n VAL 52 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1b3l n GLU 53 N -2.00 3.14 -0.91 5.55 2.13 -1.26 -4.52 120.64 122.78 1b3l n GLU 53 Ca 0.04 -2.57 0.00 0.00 0.66 0.00 0.00 57.16 55.29 1b3l n GLU 53 Cb 0.42 -1.62 0.00 0.00 0.27 0.00 0.00 31.44 30.51 1b3l n GLU 53 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1b3l n GLY 54 N 0.83 0.70 3.83 8.31 0.00 -1.21 -4.57 105.19 113.08 1b3l n GLY 54 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 1b3l n GLY 54 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1b3l s HIS 55 N -3.03 3.52 0.29 1.61 3.76 -1.26 -4.66 115.29 115.52 1b3l s HIS 55 Ca 0.00 1.30 -0.30 0.00 -0.15 0.00 0.00 55.06 55.91 1b3l s HIS 55 Cb 0.00 -2.58 -0.12 0.00 1.11 0.00 0.00 32.58 31.00 1b3l s HIS 55 CO 0.00 0.23 1.58 -2.30 -0.85 0.00 0.00 174.74 173.40 1b3l n PRO 56 N 0.23 2.65 -3.68 8.40 -0.02 -1.26 -0.82 135.00 140.49 1b3l n PRO 56 Ca 0.00 0.94 -0.13 0.00 -2.02 0.00 0.00 63.50 62.30 1b3l n PRO 56 Cb 0.52 -2.72 -0.07 0.00 -0.02 0.00 0.00 33.50 31.21 1b3l n PRO 56 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1b3l s SER 57 N 0.49 -0.27 -0.11 2.55 1.04 0.14 -4.83 113.70 112.71 1b3l s SER 57 Ca 0.64 0.05 -0.35 0.00 0.48 0.00 0.00 55.95 56.78 1b3l s SER 57 Cb -0.51 0.40 -0.17 0.00 0.10 0.00 0.00 66.02 65.85 1b3l s SER 57 CO 0.48 -0.61 1.00 -2.65 0.98 0.00 0.00 173.24 172.44 1b3l n PRO 58 N 0.70 0.00 0.00 4.02 -0.01 -1.26 -0.06 135.00 138.39 1b3l n PRO 58 Ca -0.19 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.30 1b3l n PRO 58 Cb 0.59 -1.24 0.00 0.00 -0.01 0.00 0.00 33.50 32.84 1b3l n PRO 58 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1b3l n GLY 59 N 1.78 1.15 0.13 -1.23 0.00 0.24 -4.48 105.19 102.77 1b3l n GLY 59 Ca 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.20 1b3l n GLY 59 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1b3l h VAL 60 N 0.00 1.34 -3.38 1.61 2.07 -0.43 -3.42 116.25 114.05 1b3l h VAL 60 Ca 0.00 -2.31 -0.58 0.00 0.82 0.00 0.00 66.70 64.63 1b3l h VAL 60 Cb 0.00 2.29 -0.08 0.00 -1.52 0.00 0.00 31.29 31.98 1b3l h VAL 60 CO 0.00 0.63 0.03 0.00 0.02 0.00 0.00 177.57 178.25 1b3l s ALA 61 N -3.34 3.46 -0.07 1.67 0.00 -0.84 -1.52 121.76 121.11 1b3l s ALA 61 Ca 0.00 -0.13 0.14 0.00 0.00 0.00 0.00 51.96 51.97 1b3l s ALA 61 Cb 0.11 -2.86 -0.10 0.00 0.00 0.00 0.00 23.12 20.27 1b3l s ALA 61 CO 0.76 -0.25 1.09 1.05 0.00 0.00 0.00 175.76 178.41 1b3l h GLU 62 N 7.04 0.00 -3.06 0.00 4.11 -0.47 -3.39 114.58 118.80 1b3l h GLU 62 Ca -0.37 0.00 0.01 0.00 0.07 0.00 0.00 59.36 59.06 1b3l h GLU 62 Cb 1.17 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.32 1b3l h GLU 62 CO 0.76 0.52 0.18 -1.59 0.07 0.00 0.00 179.01 178.95 1b3l s LYS 63 N -2.85 1.44 0.19 1.06 0.00 -1.19 -4.81 119.74 113.58 1b3l s LYS 63 Ca -0.00 -0.70 -0.13 0.00 0.00 0.00 0.00 55.97 55.14 1b3l s LYS 63 Cb 0.08 0.58 0.01 0.00 0.00 0.00 0.00 37.83 38.50 1b3l s LYS 63 CO 0.79 -0.64 0.41 1.67 0.00 0.00 0.00 175.35 177.59 1b3l s TRP 64 N -3.82 0.20 0.25 1.78 -2.14 -1.26 -0.87 118.94 113.07 1b3l s TRP 64 Ca 0.05 -0.55 -0.17 0.00 2.66 0.00 0.00 56.10 58.09 1b3l s TRP 64 Cb -0.02 0.16 0.01 0.00 -3.10 0.00 0.00 33.47 30.52 1b3l s TRP 64 CO -0.05 -0.84 0.59 -1.83 -2.66 0.00 0.00 176.95 172.15 1b3l s GLU 65 N -3.94 1.61 0.05 3.25 1.03 -0.26 -4.96 118.70 115.48 1b3l s GLU 65 Ca 0.15 -1.05 -0.02 0.00 0.03 0.00 0.00 54.97 54.08 1b3l s GLU 65 Cb 0.01 0.54 -0.04 0.00 -0.80 0.00 0.00 34.13 33.84 1b3l s GLU 65 CO 0.01 -0.70 -0.01 0.54 -1.33 0.00 0.00 175.26 173.77 1b3l s ASN 66 N -2.94 0.44 -0.22 0.83 2.20 -1.26 0.09 114.94 114.08 1b3l s ASN 66 Ca 0.15 -0.94 0.01 0.00 -0.94 0.00 0.00 52.86 51.14 1b3l s ASN 66 Cb -0.03 0.21 0.05 0.00 -2.00 0.00 0.00 41.25 39.48 1b3l s ASN 66 CO 0.05 -0.60 -0.09 -0.75 -2.94 0.00 0.00 177.10 172.78 1b3l s LYS 67 N -3.80 1.94 -1.05 3.55 2.36 -0.82 -4.72 119.74 117.20 1b3l s LYS 67 Ca 0.06 -0.97 0.00 0.00 -2.55 0.00 0.00 55.97 52.51 1b3l s LYS 67 Cb 0.07 -2.55 0.00 0.00 -1.05 0.00 0.00 37.83 34.30 1b3l s LYS 67 CO -0.10 -0.50 0.00 -0.25 1.55 0.00 0.00 175.35 176.05 1b3l n ASP 68 N 4.64 -4.25 -1.55 1.43 8.00 -1.26 -2.24 116.55 121.33 1b3l n ASP 68 Ca -0.14 0.25 -0.19 0.00 0.71 0.00 0.00 54.79 55.42 1b3l n ASP 68 Cb 0.45 -2.62 -0.08 0.00 -0.02 0.00 0.00 41.12 38.85 1b3l n ASP 68 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1b3l n PHE 69 N -2.69 -0.10 -0.00 1.24 3.72 -1.26 -4.72 117.46 113.65 1b3l n PHE 69 Ca -0.10 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.30 1b3l n PHE 69 Cb 0.33 -3.25 -0.00 0.00 -0.94 0.00 0.00 39.48 35.62 1b3l n PHE 69 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1b3l n LYS 70 N -2.25 2.42 -4.09 -1.08 5.02 -0.95 -1.93 118.16 115.30 1b3l n LYS 70 Ca -0.19 -0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.78 1b3l n LYS 70 Cb 0.62 -1.01 -0.16 0.00 -0.02 0.00 0.00 35.03 34.46 1b3l n LYS 70 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1b3l s VAL 71 N -2.02 2.00 -0.14 -0.18 1.01 -1.09 -0.93 120.40 119.04 1b3l s VAL 71 Ca -0.00 -1.03 -0.00 0.00 0.00 0.00 0.00 61.98 60.94 1b3l s VAL 71 Cb 0.00 -1.88 -0.01 0.00 0.00 0.00 0.00 36.38 34.49 1b3l s VAL 71 CO 0.02 0.41 -0.13 0.26 0.00 0.00 0.00 175.10 175.66 1b3l s TRP 72 N 1.29 2.81 -0.18 5.22 0.52 -0.05 -1.94 118.94 126.60 1b3l s TRP 72 Ca 0.02 -0.73 0.00 0.00 0.02 0.00 0.00 56.10 55.41 1b3l s TRP 72 Cb -0.14 -1.86 0.01 0.00 -1.15 0.00 0.00 33.47 30.33 1b3l s TRP 72 CO -0.11 -0.27 -0.17 0.99 0.02 0.00 0.00 176.95 177.40 1b3l s THR 73 N 0.48 2.33 -0.21 2.01 2.01 0.11 0.05 115.64 122.43 1b3l s THR 73 Ca -0.09 -0.85 -0.07 0.00 0.31 0.00 0.00 61.69 60.98 1b3l s THR 73 Cb -0.16 -1.99 -0.04 0.00 0.01 0.00 0.00 72.50 70.32 1b3l s THR 73 CO 0.04 0.52 0.07 -0.36 -0.69 0.00 0.00 174.62 174.20 1b3l s PHE 74 N 1.24 3.18 -0.41 4.92 0.40 0.21 -1.10 117.98 126.43 1b3l s PHE 74 Ca 0.03 -0.10 -0.17 0.00 -0.60 0.00 0.00 56.93 56.09 1b3l s PHE 74 Cb -0.14 -2.14 0.02 0.00 0.51 0.00 0.00 43.02 41.27 1b3l s PHE 74 CO -0.09 -0.03 0.45 -1.01 0.70 0.00 0.00 175.22 175.23 1b3l s HIS 75 N 0.84 3.17 0.49 0.36 3.76 -0.05 -2.16 115.29 121.70 1b3l s HIS 75 Ca 0.04 -0.28 -0.16 0.00 -0.15 0.00 0.00 55.06 54.51 1b3l s HIS 75 Cb -0.14 -2.90 -0.08 0.00 1.11 0.00 0.00 32.58 30.58 1b3l s HIS 75 CO 0.02 -0.67 0.95 -0.51 -0.85 0.00 0.00 174.74 173.68 1b3l s LEU 76 N 2.18 3.67 0.09 0.89 1.43 -0.28 0.23 118.68 126.89 1b3l s LEU 76 Ca 0.13 1.51 -0.24 0.00 -1.03 0.00 0.00 54.13 54.50 1b3l s LEU 76 Cb -0.17 -4.43 -0.07 0.00 0.03 0.00 0.00 46.19 41.56 1b3l s LEU 76 CO 0.14 -0.55 0.74 0.00 0.23 0.00 0.00 176.35 176.91 1b3l s ARG 77 N -3.99 4.48 0.46 1.70 1.70 -0.58 -4.74 118.95 117.98 1b3l s ARG 77 Ca 0.58 1.05 0.12 0.00 -0.47 0.00 0.00 55.73 57.00 1b3l s ARG 77 Cb -0.10 -3.31 1.05 0.00 -0.57 0.00 0.00 34.95 32.02 1b3l s ARG 77 CO 0.30 0.44 2.08 0.93 -1.08 0.00 0.00 175.30 177.97 1b3l h GLU 78 N 5.02 0.31 -0.25 3.89 5.08 -1.94 -2.27 114.58 124.42 1b3l h GLU 78 Ca -0.46 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1b3l h GLU 78 Cb 1.21 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1b3l h GLU 78 CO 0.68 0.21 0.00 0.27 -1.00 0.00 0.00 179.01 179.17 1b3l n ASN 79 N -4.49 1.12 -4.69 1.42 6.94 -1.26 -4.90 115.26 109.40 1b3l n ASN 79 Ca 0.02 -2.02 -0.42 0.00 -0.02 0.00 0.00 54.58 52.14 1b3l n ASN 79 Cb 0.13 -0.16 -0.03 0.00 -2.36 0.00 0.00 39.78 37.36 1b3l n ASN 79 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1b3l s ALA 80 N -1.72 3.55 0.16 -2.53 0.00 -0.86 -4.53 121.76 115.84 1b3l s ALA 80 Ca 0.13 0.75 -0.00 0.00 0.00 0.00 0.00 51.96 52.83 1b3l s ALA 80 Cb 0.07 -3.57 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 1b3l s ALA 80 CO 0.08 -0.88 0.07 0.15 0.00 0.00 0.00 175.76 175.18 1b3l s LYS 81 N 2.43 1.05 0.62 0.00 1.02 -1.26 -0.40 119.74 123.20 1b3l s LYS 81 Ca 0.60 -1.52 -0.06 0.00 0.02 0.00 0.00 55.97 55.02 1b3l s LYS 81 Cb -0.28 0.14 0.02 0.00 -0.52 0.00 0.00 37.83 37.20 1b3l s LYS 81 CO 0.24 -0.27 0.92 -1.58 -0.92 0.00 0.00 175.35 173.74 1b3l s TRP 82 N -4.00 3.13 -0.68 3.18 0.52 0.34 -4.61 118.94 116.82 1b3l s TRP 82 Ca 0.28 0.54 0.18 0.00 0.02 0.00 0.00 56.10 57.12 1b3l s TRP 82 Cb 0.07 -2.86 0.78 0.00 -1.15 0.00 0.00 33.47 30.31 1b3l s TRP 82 CO 0.05 -0.99 1.55 -1.13 0.02 0.00 0.00 176.95 176.45 1b3l n SER 83 N -2.66 0.35 -1.15 2.95 3.41 0.12 -1.82 113.62 114.82 1b3l n SER 83 Ca 0.06 0.60 0.12 0.00 -0.26 0.00 0.00 58.87 59.39 1b3l n SER 83 Cb 0.59 -0.67 0.21 0.00 -0.26 0.00 0.00 64.21 64.07 1b3l n SER 83 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1b3l n ASP 84 N -1.91 3.46 0.00 4.04 5.68 -1.26 -4.89 116.55 121.68 1b3l n ASP 84 Ca 0.02 -1.99 0.00 0.00 -0.50 0.00 0.00 54.79 52.31 1b3l n ASP 84 Cb 0.16 -0.24 0.00 0.00 -1.14 0.00 0.00 41.12 39.90 1b3l n ASP 84 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1b3l n GLY 85 N 1.50 3.45 3.75 6.12 0.00 -0.76 -5.06 105.19 114.19 1b3l n GLY 85 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 1b3l n GLY 85 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1b3l s THR 86 N -2.99 3.04 0.43 2.61 -4.23 -1.26 -4.73 115.64 108.50 1b3l s THR 86 Ca 0.00 0.34 -0.12 0.00 -1.18 0.00 0.00 61.69 60.72 1b3l s THR 86 Cb 0.00 -2.72 -0.07 0.00 1.34 0.00 0.00 72.50 71.05 1b3l s THR 86 CO 0.00 -0.44 0.83 -2.16 -0.54 0.00 0.00 174.62 172.31 1b3l s PRO 87 N -4.85 3.84 -0.24 3.99 0.04 -1.26 -0.50 135.00 136.01 1b3l s PRO 87 Ca 0.62 0.61 -0.15 0.00 0.04 0.00 0.00 61.00 62.12 1b3l s PRO 87 Cb -0.18 -2.32 -0.04 0.00 0.04 0.00 0.00 34.50 31.99 1b3l s PRO 87 CO 0.56 -0.09 0.38 0.08 0.04 0.00 0.00 177.00 177.97 1b3l s VAL 88 N -2.42 5.19 0.27 -0.36 1.01 0.47 -4.68 120.40 119.87 1b3l s VAL 88 Ca 0.53 0.61 0.05 0.00 0.00 0.00 0.00 61.98 63.18 1b3l s VAL 88 Cb -0.10 -3.70 -0.06 0.00 0.00 0.00 0.00 36.38 32.52 1b3l s VAL 88 CO 0.31 0.20 -0.03 0.42 0.00 0.00 0.00 175.10 176.00 1b3l s THR 89 N 1.72 1.40 0.65 3.92 -4.23 -1.26 -4.73 115.64 113.11 1b3l s THR 89 Ca 0.16 -2.08 0.38 0.00 -1.18 0.00 0.00 61.69 58.98 1b3l s THR 89 Cb -0.15 -2.44 0.40 0.00 1.34 0.00 0.00 72.50 71.65 1b3l s THR 89 CO 0.09 -0.29 2.23 0.00 -0.54 0.00 0.00 174.62 176.11 1b3l h ALA 90 N 2.33 1.21 -0.06 3.99 0.00 -1.11 -0.83 119.26 124.79 1b3l h ALA 90 Ca -0.39 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.41 1b3l h ALA 90 Cb 1.23 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1b3l h ALA 90 CO 0.67 -0.11 -0.45 0.45 0.00 0.00 0.00 179.25 179.80 1b3l h HIS 91 N 0.00 0.16 -0.67 0.00 -0.00 -1.85 -2.04 115.15 110.75 1b3l h HIS 91 Ca 0.01 -0.05 -0.04 0.00 -0.00 0.00 0.00 60.37 60.29 1b3l h HIS 91 Cb 0.22 -0.04 -0.03 0.00 -0.00 0.00 0.00 27.41 27.56 1b3l h HIS 91 CO 0.00 0.57 0.26 -0.44 -0.00 0.00 0.00 177.93 178.32 1b3l h ASP 92 N 0.11 0.94 -0.32 2.45 3.32 -1.52 -2.27 116.42 119.12 1b3l h ASP 92 Ca 0.01 -0.18 -0.16 0.00 0.02 0.00 0.00 57.03 56.72 1b3l h ASP 92 Cb 0.85 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.15 1b3l h ASP 92 CO 0.07 0.86 -0.44 -0.26 -1.72 0.00 0.00 179.24 177.75 1b3l h PHE 93 N 0.96 1.05 0.09 4.55 -1.00 -1.53 0.32 116.94 121.37 1b3l h PHE 93 Ca 0.22 -0.35 0.02 0.00 2.81 0.00 0.00 57.97 60.68 1b3l h PHE 93 Cb 0.22 -0.21 -0.03 0.00 3.61 0.00 0.00 35.95 39.54 1b3l h PHE 93 CO 0.02 1.16 -0.20 0.28 -1.61 0.00 0.00 178.31 177.95 1b3l h VAL 94 N 0.64 0.54 -0.79 -0.55 2.07 -1.33 -1.62 116.25 115.20 1b3l h VAL 94 Ca 0.04 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.56 1b3l h VAL 94 Cb 1.04 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.30 1b3l h VAL 94 CO 0.10 0.00 0.53 0.22 0.02 0.00 0.00 177.57 178.44 1b3l h TYR 95 N -0.37 1.00 -0.37 1.57 3.20 -1.44 -2.53 116.97 118.03 1b3l h TYR 95 Ca 0.03 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.80 1b3l h TYR 95 Cb 0.41 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 1b3l h TYR 95 CO -0.21 0.62 -0.27 0.77 -1.64 0.00 0.00 178.16 177.43 1b3l h SER 96 N 1.07 0.88 0.11 -2.11 0.02 -0.62 -1.95 113.55 110.94 1b3l h SER 96 Ca 0.29 -0.44 -0.09 0.00 -0.84 0.00 0.00 61.79 60.72 1b3l h SER 96 Cb -0.12 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.17 1b3l h SER 96 CO -0.07 1.13 -0.29 -0.50 -1.14 0.00 0.00 176.83 175.97 1b3l h TRP 97 N 0.63 0.31 -0.30 3.45 4.06 -1.30 0.06 115.95 122.86 1b3l h TRP 97 Ca 0.07 -0.06 -0.04 0.00 2.06 0.00 0.00 58.89 60.92 1b3l h TRP 97 Cb 0.85 -0.08 -0.01 0.00 -1.00 0.00 0.00 29.16 28.92 1b3l h TRP 97 CO 0.06 0.55 0.05 1.96 -3.56 0.00 0.00 178.44 177.50 1b3l h GLN 98 N 0.25 0.49 -0.67 0.49 4.20 -1.40 -1.83 115.11 116.64 1b3l h GLN 98 Ca 0.04 -0.13 -0.06 0.00 0.06 0.00 0.00 58.65 58.55 1b3l h GLN 98 Cb 0.64 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 1b3l h GLN 98 CO 0.05 0.60 0.18 -0.09 -0.67 0.00 0.00 178.83 178.89 1b3l h ARG 99 N 0.32 1.04 -0.65 1.46 2.43 -0.80 -1.87 114.38 116.30 1b3l h ARG 99 Ca 0.09 -0.23 0.04 0.00 -0.81 0.00 0.00 59.98 59.07 1b3l h ARG 99 Cb 0.34 -0.15 -0.05 0.00 -0.42 0.00 0.00 29.97 29.70 1b3l h ARG 99 CO 0.01 0.91 0.39 1.25 -1.51 0.00 0.00 179.97 181.01 1b3l h LEU 100 N 1.00 0.62 -1.00 3.80 5.85 -0.79 -2.82 115.31 121.97 1b3l h LEU 100 Ca 0.22 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.88 1b3l h LEU 100 Cb 0.32 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 1b3l h LEU 100 CO -0.00 0.42 -0.32 0.00 -0.34 0.00 0.00 178.44 178.20 1b3l h ALA 101 N 1.30 1.01 -2.47 1.25 0.00 -1.15 -3.42 119.26 115.78 1b3l h ALA 101 Ca 0.27 -0.29 -0.53 0.00 0.00 0.00 0.00 54.91 54.36 1b3l h ALA 101 Cb 0.08 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 17.84 1b3l h ALA 101 CO -0.13 0.39 0.97 0.34 0.00 0.00 0.00 179.25 180.82 1b3l s ASP 102 N -6.35 6.62 0.59 0.00 -1.08 -0.72 -4.43 116.67 111.30 1b3l s ASP 102 Ca 0.00 2.48 0.29 0.00 -0.52 0.00 0.00 52.55 54.81 1b3l s ASP 102 Cb 0.11 -2.57 1.73 0.00 -1.46 0.00 0.00 42.92 40.73 1b3l s ASP 102 CO 0.67 -0.86 2.17 1.55 0.52 0.00 0.00 175.17 179.21 1b3l h PRO 103 N 8.04 0.00 0.00 4.34 0.13 -1.87 -0.62 132.00 142.02 1b3l h PRO 103 Ca -0.42 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.70 1b3l h PRO 103 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1b3l h PRO 103 CO 0.92 0.00 -0.03 -0.91 -0.23 0.00 0.00 178.00 177.76 1b3l h ASN 104 N 0.00 0.00 0.84 1.44 4.21 -1.92 -1.86 115.58 118.29 1b3l h ASN 104 Ca 0.05 0.00 -0.08 0.00 1.21 0.00 0.00 56.30 57.48 1b3l h ASN 104 Cb 0.28 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.47 1b3l h ASN 104 CO -0.00 0.03 -0.39 0.74 -1.29 0.00 0.00 177.43 176.52 1b3l h THR 105 N 0.00 0.91 -6.62 2.81 2.02 -1.35 -3.47 112.91 107.21 1b3l h THR 105 Ca -0.00 -1.55 -0.52 0.00 0.77 0.00 0.00 66.41 65.10 1b3l h THR 105 Cb 0.60 1.94 -0.10 0.00 -1.74 0.00 0.00 68.15 68.86 1b3l h THR 105 CO 0.00 0.38 -0.89 0.00 0.37 0.00 0.00 175.52 175.38 1b3l n ALA 106 N -2.30 -1.91 -1.82 6.16 0.00 -0.70 -4.94 120.51 115.00 1b3l n ALA 106 Ca -0.00 -0.26 -0.41 0.00 0.00 0.00 0.00 53.44 52.77 1b3l n ALA 106 Cb 0.52 -1.65 -0.02 0.00 0.00 0.00 0.00 19.45 18.29 1b3l n ALA 106 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1b3l s SER 107 N -4.23 6.83 0.21 0.00 0.15 -1.26 -4.91 113.70 110.49 1b3l s SER 107 Ca 0.10 2.59 0.21 0.00 0.70 0.00 0.00 55.95 59.56 1b3l s SER 107 Cb -0.06 -2.64 0.90 0.00 -1.71 0.00 0.00 66.02 62.52 1b3l s SER 107 CO 0.91 -0.51 1.64 -0.81 1.20 0.00 0.00 173.24 175.67 1b3l n PRO 108 N 1.33 0.15 -0.62 5.44 -0.04 -1.26 -1.92 135.00 138.09 1b3l n PRO 108 Ca 0.02 0.41 0.02 0.00 -0.04 0.00 0.00 63.50 63.90 1b3l n PRO 108 Cb 0.42 -1.80 0.23 0.00 -0.04 0.00 0.00 33.50 32.31 1b3l n PRO 108 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1b3l n TYR 109 N -2.08 1.09 -0.17 0.54 4.01 -1.26 -3.80 117.16 115.48 1b3l n TYR 109 Ca 0.02 -1.20 0.05 0.00 -0.16 0.00 0.00 57.90 56.61 1b3l n TYR 109 Cb 0.20 -0.41 0.34 0.00 -0.31 0.00 0.00 39.34 39.16 1b3l n TYR 109 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1b3l h ALA 110 N 1.44 1.67 0.00 -0.72 0.00 -1.63 -1.29 119.26 118.73 1b3l h ALA 110 Ca 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1b3l h ALA 110 Cb 1.59 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1b3l h ALA 110 CO 0.33 0.23 0.00 0.43 0.00 0.00 0.00 179.25 180.24 1b3l n SER 111 N -4.47 0.04 -0.24 0.00 7.64 -1.26 -3.04 113.62 112.29 1b3l n SER 111 Ca 0.10 0.51 0.07 0.00 1.01 0.00 0.00 58.87 60.56 1b3l n SER 111 Cb 0.19 -0.52 0.32 0.00 -1.01 0.00 0.00 64.21 63.19 1b3l n SER 111 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 1b3l h TYR 112 N 0.00 0.87 0.00 1.43 3.20 -1.59 0.13 116.97 121.02 1b3l h TYR 112 Ca 0.00 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.82 1b3l h TYR 112 Cb 0.13 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 1b3l h TYR 112 CO 0.00 0.43 -0.33 -0.07 -1.64 0.00 0.00 178.16 176.55 1b3l h LEU 113 N 0.83 0.00 -0.40 2.82 3.38 -1.74 -2.04 115.31 118.16 1b3l h LEU 113 Ca 0.36 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.15 1b3l h LEU 113 Cb 0.32 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 1b3l h LEU 113 CO -0.14 0.33 -0.61 1.56 0.09 0.00 0.00 178.44 179.67 1b3l h GLN 114 N 0.00 0.64 -0.16 1.13 4.20 -0.97 -2.30 115.11 117.64 1b3l h GLN 114 Ca -0.00 -0.43 -0.05 0.00 0.06 0.00 0.00 58.65 58.22 1b3l h GLN 114 Cb 0.82 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.65 1b3l h GLN 114 CO 0.04 1.05 -0.12 1.88 -0.67 0.00 0.00 178.83 181.01 1b3l h TYR 115 N 0.47 0.27 -0.00 2.96 0.05 -0.83 -0.55 116.97 119.33 1b3l h TYR 115 Ca -0.01 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.74 1b3l h TYR 115 Cb 1.18 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 38.85 1b3l h TYR 115 CO 0.06 0.38 -0.11 0.41 -1.05 0.00 0.00 178.16 177.85 1b3l n GLY 116 N -0.87 -0.86 3.66 3.88 0.00 -0.79 -4.98 105.19 105.23 1b3l n GLY 116 Ca -0.01 -0.29 -0.23 0.00 0.00 0.00 0.00 46.02 45.50 1b3l n GLY 116 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1b3l n HIS 117 N -0.86 -2.34 -2.23 1.61 8.25 -0.22 -4.90 115.22 114.54 1b3l n HIS 117 Ca 0.15 0.93 -0.41 0.00 -0.26 0.00 0.00 57.72 58.13 1b3l n HIS 117 Cb 0.28 -4.64 -0.03 0.00 1.12 0.00 0.00 29.99 26.72 1b3l n HIS 117 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1b3l s ILE 118 N -3.42 3.17 0.17 1.59 1.01 -1.04 -1.18 121.20 121.50 1b3l s ILE 118 Ca 0.32 1.02 -0.33 0.00 0.00 0.00 0.00 60.65 61.65 1b3l s ILE 118 Cb -0.15 -3.65 -0.16 0.00 0.01 0.00 0.00 42.46 38.52 1b3l s ILE 118 CO 0.78 0.18 1.22 0.00 0.00 0.00 0.00 174.94 177.11 1b3l n ALA 119 N 2.16 -0.59 -0.99 9.38 0.00 -0.13 -2.09 120.51 128.24 1b3l n ALA 119 Ca 0.04 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.95 1b3l n ALA 119 Cb 0.43 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.82 1b3l n ALA 119 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1b3l n ASN 120 N 2.12 -4.10 -0.03 0.00 3.02 -1.26 -1.63 115.26 113.37 1b3l n ASN 120 Ca 0.15 0.00 -0.03 0.00 -0.03 0.00 0.00 54.58 54.68 1b3l n ASN 120 Cb 0.25 -1.74 0.22 0.00 -0.61 0.00 0.00 39.78 37.89 1b3l n ASN 120 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1b3l h ILE 121 N 0.00 1.23 -0.69 2.41 6.09 -1.79 -2.11 117.51 122.65 1b3l h ILE 121 Ca 0.00 -1.01 -0.08 0.00 -1.37 0.00 0.00 64.86 62.40 1b3l h ILE 121 Cb 0.41 1.05 -0.03 0.00 0.47 0.00 0.00 36.82 38.72 1b3l h ILE 121 CO 0.00 0.34 0.14 0.44 -3.07 0.00 0.00 178.15 176.00 1b3l h ASP 122 N 0.56 1.08 0.47 2.19 3.32 -1.92 -0.56 116.42 121.56 1b3l h ASP 122 Ca 0.11 -0.24 -0.14 0.00 0.02 0.00 0.00 57.03 56.77 1b3l h ASP 122 Cb 0.48 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 1b3l h ASP 122 CO 0.03 1.05 -0.63 0.44 -1.72 0.00 0.00 179.24 178.41 1b3l h ASP 123 N 1.06 0.17 -0.10 6.45 3.32 -1.89 -2.09 116.42 123.35 1b3l h ASP 123 Ca 0.21 -0.10 -0.04 0.00 0.02 0.00 0.00 57.03 57.12 1b3l h ASP 123 Cb 0.41 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.91 1b3l h ASP 123 CO 0.01 0.76 -0.10 0.40 -1.72 0.00 0.00 179.24 178.58 1b3l h ILE 124 N 0.11 1.36 -0.78 0.35 2.04 -0.79 -0.31 117.51 119.50 1b3l h ILE 124 Ca -0.01 -1.27 0.03 0.00 1.00 0.00 0.00 64.86 64.61 1b3l h ILE 124 Cb 1.13 1.97 -0.05 0.00 -0.74 0.00 0.00 36.82 39.14 1b3l h ILE 124 CO 0.09 0.36 0.50 0.40 0.00 0.00 0.00 178.15 179.50 1b3l h ILE 125 N -0.16 1.12 0.00 -0.67 2.04 -1.13 -1.01 117.51 117.70 1b3l h ILE 125 Ca 0.02 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.54 1b3l h ILE 125 Cb 0.62 0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 1b3l h ILE 125 CO 0.03 0.18 0.00 0.00 0.00 0.00 0.00 178.15 178.35 1b3l n ALA 126 N -2.33 2.36 -1.15 1.87 0.00 -0.79 -4.83 120.51 115.64 1b3l n ALA 126 Ca 0.09 -0.10 -0.05 0.00 0.00 0.00 0.00 53.44 53.38 1b3l n ALA 126 Cb 0.08 -1.27 -0.02 0.00 0.00 0.00 0.00 19.45 18.24 1b3l n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b3l n GLY 127 N 0.43 0.77 0.11 0.00 0.00 -0.39 -4.91 105.19 101.21 1b3l n GLY 127 Ca 0.12 -0.75 0.07 0.00 0.00 0.00 0.00 46.02 45.47 1b3l n GLY 127 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b3l h LYS 128 N 0.06 0.00 -3.88 1.61 1.57 -1.29 -3.47 116.57 111.17 1b3l h LYS 128 Ca -0.10 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.52 1b3l h LYS 128 Cb 0.35 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 32.46 1b3l h LYS 128 CO 0.15 0.12 -0.63 0.15 -0.57 0.00 0.00 179.45 178.67 1b3l s LYS 129 N -3.18 0.41 0.58 3.15 1.02 -1.15 -4.99 119.74 115.57 1b3l s LYS 129 Ca -0.01 -0.64 -0.10 0.00 0.02 0.00 0.00 55.97 55.25 1b3l s LYS 129 Cb 0.09 0.15 -0.04 0.00 -0.52 0.00 0.00 37.83 37.51 1b3l s LYS 129 CO 0.79 -0.08 0.96 -1.25 -0.92 0.00 0.00 175.35 174.85 1b3l s PRO 130 N -1.79 3.61 0.56 -1.68 0.04 -1.26 -4.15 135.00 130.32 1b3l s PRO 130 Ca -0.12 0.62 0.33 0.00 0.04 0.00 0.00 61.00 61.86 1b3l s PRO 130 Cb -0.07 -2.16 1.62 0.00 0.04 0.00 0.00 34.50 33.93 1b3l s PRO 130 CO -0.02 -0.45 2.10 0.00 0.04 0.00 0.00 177.00 178.67 1b3l h ALA 131 N -0.09 1.11 0.00 8.56 0.00 -1.92 -0.78 119.26 126.15 1b3l h ALA 131 Ca -0.45 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1b3l h ALA 131 Cb 1.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1b3l h ALA 131 CO 0.62 0.08 0.00 1.79 0.00 0.00 0.00 179.25 181.74 1b3l h THR 132 N 0.00 0.00 -0.00 0.00 1.35 -1.93 -0.47 112.91 111.86 1b3l h THR 132 Ca -0.00 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.68 1b3l h THR 132 Cb 0.34 0.93 0.00 0.00 -1.73 0.00 0.00 68.15 67.69 1b3l h THR 132 CO 0.01 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 175.75 1b3l n ASP 133 N -2.53 0.32 -4.65 5.36 8.00 -0.30 -4.92 116.55 117.83 1b3l n ASP 133 Ca 0.00 -1.11 -0.41 0.00 0.71 0.00 0.00 54.79 53.98 1b3l n ASP 133 Cb 0.16 -0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.28 1b3l n ASP 133 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1b3l n LEU 134 N -0.75 3.32 -2.05 0.64 7.94 -0.19 -4.75 117.00 121.17 1b3l n LEU 134 Ca 0.23 1.05 -0.03 0.00 -1.11 0.00 0.00 56.01 56.16 1b3l n LEU 134 Cb 0.16 -1.42 -0.04 0.00 0.53 0.00 0.00 43.42 42.65 1b3l n LEU 134 CO 0.18 -1.13 0.71 0.61 -1.11 0.00 0.00 177.39 176.65 1b3l n GLY 135 N 1.02 1.61 3.31 -3.96 0.00 -0.65 -4.81 105.19 101.71 1b3l n GLY 135 Ca 0.09 -0.27 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 1b3l n GLY 135 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b3l s VAL 136 N 1.67 1.86 -0.07 1.61 -7.23 -1.26 -0.79 120.40 116.19 1b3l s VAL 136 Ca 0.15 -1.49 -0.25 0.00 -1.81 0.00 0.00 61.98 58.58 1b3l s VAL 136 Cb 0.07 -1.65 0.06 0.00 0.56 0.00 0.00 36.38 35.41 1b3l s VAL 136 CO 0.00 0.07 0.57 -1.59 -0.31 0.00 0.00 175.10 173.84 1b3l s LYS 137 N -1.71 0.89 -0.47 4.82 -2.85 0.16 -5.00 119.74 115.57 1b3l s LYS 137 Ca 0.09 0.25 -0.20 0.00 -1.00 0.00 0.00 55.97 55.10 1b3l s LYS 137 Cb -0.10 0.42 0.04 0.00 -2.06 0.00 0.00 37.83 36.13 1b3l s LYS 137 CO 0.04 -0.24 0.66 0.00 0.10 0.00 0.00 175.35 175.90 1b3l s ALA 138 N -0.94 3.34 0.09 0.59 0.00 -1.26 -0.10 121.76 123.48 1b3l s ALA 138 Ca -0.10 -1.39 -0.14 0.00 0.00 0.00 0.00 51.96 50.34 1b3l s ALA 138 Cb -0.02 -3.35 -0.20 0.00 0.00 0.00 0.00 23.12 19.55 1b3l s ALA 138 CO 0.07 -1.91 1.24 -0.07 0.00 0.00 0.00 175.76 175.09 1b3l h LEU 139 N 9.80 0.93 0.00 0.00 3.38 -1.34 -3.48 115.31 124.59 1b3l h LEU 139 Ca -0.26 -0.69 -0.06 0.00 0.09 0.00 0.00 57.88 56.96 1b3l h LEU 139 Cb 1.09 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1b3l h LEU 139 CO 0.93 1.48 -0.03 -0.90 0.09 0.00 0.00 178.44 180.01 1b3l n ASP 140 N -3.90 -0.26 -0.11 -0.43 5.68 -1.20 -4.98 116.55 111.35 1b3l n ASP 140 Ca -0.09 -1.37 0.04 0.00 -0.50 0.00 0.00 54.79 52.86 1b3l n ASP 140 Cb 0.82 0.49 0.36 0.00 -1.14 0.00 0.00 41.12 41.65 1b3l n ASP 140 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1b3l h ASP 141 N 0.39 0.62 -0.26 -1.12 5.19 -1.99 -2.68 116.42 116.57 1b3l h ASP 141 Ca -0.05 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 1b3l h ASP 141 Cb 0.23 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 39.59 1b3l h ASP 141 CO 0.07 0.44 0.00 1.41 -3.12 0.00 0.00 179.24 178.04 1b3l n HIS 142 N -4.46 0.67 -3.85 4.55 8.25 -1.26 -0.65 115.22 118.47 1b3l n HIS 142 Ca 0.06 -0.74 -0.26 0.00 -0.26 0.00 0.00 57.72 56.52 1b3l n HIS 142 Cb 0.10 -0.19 -0.17 0.00 1.12 0.00 0.00 29.99 30.84 1b3l n HIS 142 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1b3l s THR 143 N -2.12 0.86 -0.21 1.59 2.01 -1.01 -1.13 115.64 115.63 1b3l s THR 143 Ca 0.33 -0.33 -0.02 0.00 0.31 0.00 0.00 61.69 61.97 1b3l s THR 143 Cb 0.25 -1.01 0.00 0.00 0.01 0.00 0.00 72.50 71.75 1b3l s THR 143 CO 0.10 0.21 -0.09 0.12 -0.69 0.00 0.00 174.62 174.28 1b3l s PHE 144 N 1.76 2.92 -0.12 4.92 5.36 -0.92 -0.80 117.98 131.09 1b3l s PHE 144 Ca 0.03 -1.17 -0.01 0.00 -0.96 0.00 0.00 56.93 54.82 1b3l s PHE 144 Cb -0.14 -2.05 -0.02 0.00 -0.34 0.00 0.00 43.02 40.47 1b3l s PHE 144 CO -0.07 -0.63 -0.08 -2.00 -1.46 0.00 0.00 175.22 170.98 1b3l s GLU 145 N 1.42 3.35 -0.15 10.12 2.12 0.86 -0.62 118.70 135.80 1b3l s GLU 145 Ca 0.05 -0.58 0.02 0.00 0.36 0.00 0.00 54.97 54.82 1b3l s GLU 145 Cb -0.14 -2.74 0.01 0.00 0.26 0.00 0.00 34.13 31.52 1b3l s GLU 145 CO -0.06 0.34 -0.21 0.08 -0.54 0.00 0.00 175.26 174.87 1b3l s VAL 146 N 0.07 2.14 -0.29 3.70 1.01 0.11 -0.67 120.40 126.47 1b3l s VAL 146 Ca -0.02 -0.95 -0.11 0.00 0.00 0.00 0.00 61.98 60.90 1b3l s VAL 146 Cb -0.14 -1.87 -0.03 0.00 0.00 0.00 0.00 36.38 34.34 1b3l s VAL 146 CO 0.03 0.54 0.18 -0.89 0.00 0.00 0.00 175.10 174.97 1b3l s THR 147 N 0.87 5.08 0.12 3.92 2.01 0.03 -0.87 115.64 126.80 1b3l s THR 147 Ca -0.05 -0.04 -0.06 0.00 0.31 0.00 0.00 61.69 61.85 1b3l s THR 147 Cb -0.15 -3.48 -0.06 0.00 0.01 0.00 0.00 72.50 68.83 1b3l s THR 147 CO -0.03 0.18 0.38 -0.76 -0.69 0.00 0.00 174.62 173.70 1b3l s LEU 148 N 1.71 4.28 0.00 4.42 1.43 -0.11 -0.95 118.68 129.47 1b3l s LEU 148 Ca 0.06 0.63 0.29 0.00 -1.03 0.00 0.00 54.13 54.09 1b3l s LEU 148 Cb -0.16 -3.22 1.28 0.00 0.03 0.00 0.00 46.19 44.12 1b3l s LEU 148 CO 0.09 0.08 1.93 -1.54 0.23 0.00 0.00 176.35 177.15 1b3l n SER 149 N 0.29 0.07 -3.81 2.29 3.41 -0.33 -4.71 113.62 110.83 1b3l n SER 149 Ca -0.04 0.17 -0.11 0.00 -0.26 0.00 0.00 58.87 58.63 1b3l n SER 149 Cb 0.52 -0.35 -0.08 0.00 -0.26 0.00 0.00 64.21 64.04 1b3l n SER 149 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1b3l s GLU 150 N -2.83 0.75 0.03 4.33 0.41 -1.26 -5.08 118.70 115.05 1b3l s GLU 150 Ca 0.20 -0.60 -0.30 0.00 -0.41 0.00 0.00 54.97 53.85 1b3l s GLU 150 Cb 0.19 0.31 -0.07 0.00 -1.78 0.00 0.00 34.13 32.79 1b3l s GLU 150 CO 0.52 -0.23 1.48 -1.25 -0.49 0.00 0.00 175.26 175.29 1b3l s PRO 151 N -2.62 4.26 -0.40 0.39 0.05 -1.26 -4.74 135.00 130.67 1b3l s PRO 151 Ca -0.05 2.10 0.01 0.00 0.05 0.00 0.00 61.00 63.12 1b3l s PRO 151 Cb -0.01 -3.55 0.13 0.00 0.05 0.00 0.00 34.50 31.12 1b3l s PRO 151 CO -0.04 -0.62 0.19 0.08 0.05 0.00 0.00 177.00 176.67 1b3l s VAL 152 N 2.35 1.28 0.44 -0.36 1.01 -0.81 -4.91 120.40 119.39 1b3l s VAL 152 Ca 0.67 -2.24 0.12 0.00 0.00 0.00 0.00 61.98 60.53 1b3l s VAL 152 Cb -0.35 -1.91 0.21 0.00 0.00 0.00 0.00 36.38 34.33 1b3l s VAL 152 CO 0.29 -0.83 2.01 1.55 0.00 0.00 0.00 175.10 178.11 1b3l h PRO 153 N 7.10 0.18 -0.53 2.72 0.13 -1.95 -1.00 132.00 138.65 1b3l h PRO 153 Ca -0.04 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 1b3l h PRO 153 Cb 0.95 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1b3l h PRO 153 CO 0.47 0.24 0.00 2.48 -0.23 0.00 0.00 178.00 180.97 1b3l n TYR 154 N -4.38 0.71 -0.34 1.56 0.18 -1.26 -4.58 117.16 109.05 1b3l n TYR 154 Ca -0.01 -0.35 0.05 0.00 1.88 0.00 0.00 57.90 59.46 1b3l n TYR 154 Cb 0.19 0.00 0.12 0.00 -0.38 0.00 0.00 39.34 39.27 1b3l n TYR 154 CO 0.00 0.00 0.00 0.35 -2.08 0.00 0.00 176.86 175.13 1b3l h PHE 155 N 3.12 -0.55 0.00 -3.48 3.57 -1.57 0.93 116.94 118.97 1b3l h PHE 155 Ca 0.00 0.09 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 1b3l h PHE 155 Cb 0.71 0.39 -0.00 0.00 2.79 0.00 0.00 35.95 39.84 1b3l h PHE 155 CO 0.35 -0.41 -0.07 0.10 -2.23 0.00 0.00 178.31 176.06 1b3l h TYR 156 N -0.00 0.00 0.00 0.41 -0.00 -1.83 -2.23 116.97 113.32 1b3l h TYR 156 Ca 0.45 0.00 -0.03 0.00 -0.00 0.00 0.00 58.73 59.15 1b3l h TYR 156 Cb 0.69 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.41 1b3l h TYR 156 CO -0.74 0.07 -0.12 0.87 -0.00 0.00 0.00 178.16 178.24 1b3l h LYS 157 N 0.00 0.00 0.00 0.10 1.57 -1.16 -2.97 116.57 114.12 1b3l h LYS 157 Ca -0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1b3l h LYS 157 Cb 0.14 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.45 1b3l h LYS 157 CO 0.01 0.12 -0.15 -0.07 -0.57 0.00 0.00 179.45 178.79 1b3l h LEU 158 N 0.00 0.00 0.00 2.94 4.07 -1.50 -3.33 115.31 117.49 1b3l h LEU 158 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1b3l h LEU 158 Cb 0.40 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.14 1b3l h LEU 158 CO 0.02 0.15 0.00 0.18 -1.08 0.00 0.00 178.44 177.70 1b3l n LEU 159 N -3.37 0.00 -0.02 1.67 4.77 -1.12 -2.18 117.00 116.75 1b3l n LEU 159 Ca -0.00 0.48 0.15 0.00 -0.03 0.00 0.00 56.01 56.60 1b3l n LEU 159 Cb 0.35 -0.48 0.77 0.00 -2.33 0.00 0.00 43.42 41.73 1b3l n LEU 159 CO 0.31 -0.24 1.02 1.33 -1.33 0.00 0.00 177.39 178.47 1b3l n VAL 160 N -1.48 0.00 -2.56 4.08 0.24 -1.25 -4.08 118.33 113.28 1b3l n VAL 160 Ca 0.04 -0.01 -0.39 0.00 -2.04 0.00 0.00 64.34 61.94 1b3l n VAL 160 Cb 0.16 -0.44 -0.05 0.00 -1.47 0.00 0.00 33.84 32.04 1b3l n VAL 160 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1b3l s HIS 161 N -2.45 3.54 0.56 6.34 5.04 -0.92 -4.93 115.29 122.46 1b3l s HIS 161 Ca 0.32 1.72 0.29 0.00 -1.54 0.00 0.00 55.06 55.85 1b3l s HIS 161 Cb 0.21 -3.16 1.74 0.00 0.04 0.00 0.00 32.58 31.40 1b3l s HIS 161 CO 0.45 -0.37 2.22 -1.00 -2.34 0.00 0.00 174.74 173.70 1b3l h PRO 162 N 3.36 0.00 0.00 2.88 0.13 -1.91 -2.09 132.00 134.37 1b3l h PRO 162 Ca -0.47 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1b3l h PRO 162 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 1b3l h PRO 162 CO 0.65 0.02 -0.02 0.66 -0.23 0.00 0.00 178.00 179.08 1b3l h SER 163 N 0.00 0.00 -0.49 1.44 4.64 -1.93 -0.89 113.55 116.32 1b3l h SER 163 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1b3l h SER 163 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1b3l h SER 163 CO 0.00 0.02 0.00 1.33 -0.87 0.00 0.00 176.83 177.31 1b3l n VAL 164 N -3.15 2.58 -2.18 0.95 0.24 -0.79 -4.78 118.33 111.20 1b3l n VAL 164 Ca -0.01 -1.53 -0.32 0.00 -2.04 0.00 0.00 64.34 60.44 1b3l n VAL 164 Cb 0.24 -0.24 -0.01 0.00 -1.47 0.00 0.00 33.84 32.36 1b3l n VAL 164 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1b3l s SER 165 N -1.12 6.15 0.50 -1.34 0.01 -0.34 -4.64 113.70 112.92 1b3l s SER 165 Ca 0.51 1.70 -0.18 0.00 1.31 0.00 0.00 55.95 59.28 1b3l s SER 165 Cb 0.39 -2.52 -0.08 0.00 0.21 0.00 0.00 66.02 64.02 1b3l s SER 165 CO 0.14 -0.92 0.99 -2.16 0.41 0.00 0.00 173.24 171.71 1b3l s PRO 166 N -4.12 3.93 0.24 12.44 0.04 -1.26 -4.91 135.00 141.36 1b3l s PRO 166 Ca 0.61 1.08 0.11 0.00 0.04 0.00 0.00 61.00 62.84 1b3l s PRO 166 Cb -0.13 -2.13 -0.05 0.00 0.04 0.00 0.00 34.50 32.23 1b3l s PRO 166 CO 0.35 -0.29 -0.20 0.14 0.04 0.00 0.00 177.00 177.04 1b3l s VAL 167 N -2.40 2.27 -0.59 -0.36 -7.23 -1.26 -4.84 120.40 105.99 1b3l s VAL 167 Ca 0.61 -2.25 -0.27 0.00 -1.81 0.00 0.00 61.98 58.27 1b3l s VAL 167 Cb -0.11 -2.18 0.03 0.00 0.56 0.00 0.00 36.38 34.69 1b3l s VAL 167 CO 0.25 -0.36 1.12 -2.16 -0.31 0.00 0.00 175.10 173.64 1b3l s PRO 168 N -3.28 3.41 0.46 4.82 0.04 -1.26 -4.79 135.00 134.40 1b3l s PRO 168 Ca 0.25 0.00 0.19 0.00 0.04 0.00 0.00 61.00 61.48 1b3l s PRO 168 Cb -0.05 -4.05 1.16 0.00 0.04 0.00 0.00 34.50 31.60 1b3l s PRO 168 CO 0.12 -1.68 1.93 -0.22 0.04 0.00 0.00 177.00 177.20 1b3l h LYS 169 N 9.52 0.29 -0.48 4.56 3.64 -1.99 -2.17 116.57 129.94 1b3l h LYS 169 Ca -0.26 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.05 1b3l h LYS 169 Cb 1.06 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.80 1b3l h LYS 169 CO 1.17 0.19 0.10 0.66 -2.27 0.00 0.00 179.45 179.30 1b3l h SER 170 N 0.30 0.75 -0.01 4.20 4.64 -2.00 -2.11 113.55 119.31 1b3l h SER 170 Ca 0.35 -0.24 -0.01 0.00 -0.47 0.00 0.00 61.79 61.41 1b3l h SER 170 Cb 0.94 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 1b3l h SER 170 CO -0.09 0.80 -0.03 0.00 -0.87 0.00 0.00 176.83 176.64 1b3l h ALA 171 N 0.98 0.02 -0.41 5.18 0.00 -1.74 -2.31 119.26 120.98 1b3l h ALA 171 Ca 0.15 -0.31 0.08 0.00 0.00 0.00 0.00 54.91 54.83 1b3l h ALA 171 Cb 0.35 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.07 1b3l h ALA 171 CO 0.00 -0.16 -0.06 0.28 0.00 0.00 0.00 179.25 179.31 1b3l h VAL 172 N -0.52 0.63 -0.01 0.00 2.07 -1.49 0.90 116.25 117.83 1b3l h VAL 172 Ca -0.00 -0.01 -0.07 0.00 0.82 0.00 0.00 66.70 67.43 1b3l h VAL 172 Cb 0.62 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1b3l h VAL 172 CO 0.01 0.01 -0.34 -0.33 0.02 0.00 0.00 177.57 176.94 1b3l h GLU 173 N 0.04 0.02 0.18 1.57 5.08 -1.42 0.42 114.58 120.46 1b3l h GLU 173 Ca 0.20 -0.01 -0.33 0.00 -1.00 0.00 0.00 59.36 58.22 1b3l h GLU 173 Cb 0.30 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.56 1b3l h GLU 173 CO -0.39 0.35 -1.59 -0.22 -1.00 0.00 0.00 179.01 176.17 1b3l h LYS 174 N 0.02 0.38 -0.01 2.33 3.64 -0.71 -3.38 116.57 118.85 1b3l h LYS 174 Ca -0.00 -0.65 0.00 0.00 -1.27 0.00 0.00 60.65 58.73 1b3l h LYS 174 Cb 0.61 0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.67 1b3l h LYS 174 CO 0.04 1.28 -0.13 1.19 -2.27 0.00 0.00 179.45 179.56 1b3l n PHE 175 N -3.58 0.00 0.00 1.91 3.72 0.22 -5.05 117.46 114.68 1b3l n PHE 175 Ca -0.19 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.21 1b3l n PHE 175 Cb 1.07 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.61 1b3l n PHE 175 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1b3l n GLY 176 N 0.74 3.12 0.32 1.37 0.00 0.14 -1.01 105.19 109.87 1b3l n GLY 176 Ca 0.03 0.03 0.21 0.00 0.00 0.00 0.00 46.02 46.29 1b3l n GLY 176 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1b3l h ASP 177 N 0.00 0.00 -0.22 1.61 3.32 -1.95 0.04 116.42 119.21 1b3l h ASP 177 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1b3l h ASP 177 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1b3l h ASP 177 CO 0.00 0.00 0.00 0.29 -1.72 0.00 0.00 179.24 177.81 1b3l n LYS 178 N -2.99 1.84 0.25 3.56 4.76 -0.18 -4.23 118.16 121.18 1b3l n LYS 178 Ca -0.03 -1.28 0.08 0.00 -2.87 0.00 0.00 58.31 54.22 1b3l n LYS 178 Cb 0.10 -1.39 0.63 0.00 -1.84 0.00 0.00 35.03 32.52 1b3l n LYS 178 CO 0.00 0.00 0.00 0.11 -1.37 0.00 0.00 177.40 176.14 1b3l h TRP 179 N 2.48 0.02 -0.00 2.13 5.08 -1.04 -2.00 115.95 122.62 1b3l h TRP 179 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1b3l h TRP 179 Cb 0.55 -0.01 0.00 0.00 -3.00 0.00 0.00 29.16 26.70 1b3l h TRP 179 CO 0.14 0.01 -0.15 0.25 -1.28 0.00 0.00 178.44 177.42 1b3l n THR 180 N -4.54 0.00 -1.72 0.12 -2.24 -1.26 -2.84 114.28 101.81 1b3l n THR 180 Ca -0.03 -0.01 -0.38 0.00 -2.27 0.00 0.00 64.05 61.36 1b3l n THR 180 Cb 0.09 -0.23 0.05 0.00 -2.10 0.00 0.00 70.33 68.14 1b3l n THR 180 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b3l n GLN 181 N -1.38 1.41 0.31 -0.78 1.13 -0.75 -4.70 117.38 112.61 1b3l n GLN 181 Ca 0.09 0.53 0.19 0.00 -1.94 0.00 0.00 57.00 55.87 1b3l n GLN 181 Cb 0.32 -2.51 1.03 0.00 0.11 0.00 0.00 30.24 29.20 1b3l n GLN 181 CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 1b3l h PRO 182 N 1.03 0.00 -0.20 -1.09 0.11 -1.89 -1.44 132.00 128.52 1b3l h PRO 182 Ca -0.50 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.45 1b3l h PRO 182 Cb 1.32 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.43 1b3l h PRO 182 CO 0.55 0.00 -0.53 0.00 -0.21 0.00 0.00 178.00 177.81 1b3l h ALA 183 N 1.84 0.70 -0.01 -0.75 0.00 -1.92 -3.36 119.26 115.78 1b3l h ALA 183 Ca 0.02 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1b3l h ALA 183 Cb 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1b3l h ALA 183 CO -0.00 0.68 -0.37 0.09 0.00 0.00 0.00 179.25 179.66 1b3l n ASN 184 N -3.97 1.36 -4.75 0.00 3.02 -0.61 -5.05 115.26 105.26 1b3l n ASN 184 Ca -0.03 -1.18 -0.40 0.00 -0.03 0.00 0.00 54.58 52.94 1b3l n ASN 184 Cb 0.59 0.57 -0.06 0.00 -0.61 0.00 0.00 39.78 40.27 1b3l n ASN 184 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1b3l s ILE 185 N -1.86 4.19 -0.12 2.41 2.07 -0.80 -4.88 121.20 122.22 1b3l s ILE 185 Ca 0.11 2.00 0.02 0.00 -1.41 0.00 0.00 60.65 61.37 1b3l s ILE 185 Cb 0.11 -4.29 0.01 0.00 0.13 0.00 0.00 42.46 38.43 1b3l s ILE 185 CO 0.40 0.48 -0.18 -0.69 -1.91 0.00 0.00 174.94 173.04 1b3l s VAL 186 N -1.03 1.73 0.28 4.00 1.01 -1.26 -4.94 120.40 120.20 1b3l s VAL 186 Ca 0.40 -0.79 0.06 0.00 0.00 0.00 0.00 61.98 61.66 1b3l s VAL 186 Cb -0.25 -1.55 -0.06 0.00 0.00 0.00 0.00 36.38 34.52 1b3l s VAL 186 CO 0.30 0.49 -0.04 0.42 0.00 0.00 0.00 175.10 176.27 1b3l s THR 187 N 0.86 1.57 0.00 3.92 -4.23 -1.26 -4.66 115.64 111.84 1b3l s THR 187 Ca -0.08 -2.10 0.00 0.00 -1.18 0.00 0.00 61.69 58.33 1b3l s THR 187 Cb -0.15 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.19 1b3l s THR 187 CO -0.01 -0.26 0.55 -0.46 -0.54 0.00 0.00 174.62 173.90 1b3l n ASN 188 N -0.59 0.83 -3.99 3.99 6.94 -0.99 0.10 115.26 121.54 1b3l n ASN 188 Ca -0.05 -1.30 -0.20 0.00 -0.02 0.00 0.00 54.58 53.01 1b3l n ASN 188 Cb 0.64 0.00 0.11 0.00 -2.36 0.00 0.00 39.78 38.17 1b3l n ASN 188 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1b3l n GLY 189 N -0.15 0.34 0.11 4.83 0.00 0.45 -4.50 105.19 106.27 1b3l n GLY 189 Ca 0.00 -1.97 0.08 0.00 0.00 0.00 0.00 46.02 44.13 1b3l n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b3l n ALA 190 N -3.04 1.11 -2.29 4.61 0.00 -1.17 -4.65 120.51 115.08 1b3l n ALA 190 Ca -0.14 0.12 -0.15 0.00 0.00 0.00 0.00 53.44 53.27 1b3l n ALA 190 Cb 0.48 -1.23 -0.10 0.00 0.00 0.00 0.00 19.45 18.60 1b3l n ALA 190 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1b3l s TYR 191 N -3.35 1.40 0.23 0.00 1.51 -0.47 -1.59 117.35 115.09 1b3l s TYR 191 Ca -0.01 -0.90 0.02 0.00 -1.01 0.00 0.00 57.07 55.17 1b3l s TYR 191 Cb 0.05 -0.79 -0.05 0.00 -0.11 0.00 0.00 41.96 41.06 1b3l s TYR 191 CO 0.16 -0.05 0.04 -1.59 -1.11 0.00 0.00 175.55 173.01 1b3l s LYS 192 N -3.84 1.32 -0.29 -0.62 -2.85 -0.44 -4.45 119.74 108.57 1b3l s LYS 192 Ca 0.24 -1.69 -0.24 0.00 -1.00 0.00 0.00 55.97 53.29 1b3l s LYS 192 Cb 0.05 -0.39 -0.00 0.00 -2.06 0.00 0.00 37.83 35.43 1b3l s LYS 192 CO 0.05 -0.19 0.79 -1.17 0.10 0.00 0.00 175.35 174.94 1b3l s LEU 193 N -3.28 4.08 -0.18 2.77 2.96 -1.26 -1.73 118.68 122.03 1b3l s LEU 193 Ca 0.31 0.78 -0.15 0.00 -0.22 0.00 0.00 54.13 54.85 1b3l s LEU 193 Cb 0.07 -3.10 -0.10 0.00 0.50 0.00 0.00 46.19 43.55 1b3l s LEU 193 CO 0.10 -0.58 -0.05 1.17 -1.32 0.00 0.00 176.35 175.67 1b3l n LYS 194 N 6.13 0.51 -3.95 1.98 4.81 -0.24 -4.85 118.16 122.56 1b3l n LYS 194 Ca 0.04 0.50 -0.10 0.00 -0.87 0.00 0.00 58.31 57.88 1b3l n LYS 194 Cb 0.48 -1.68 -0.10 0.00 0.02 0.00 0.00 35.03 33.75 1b3l n LYS 194 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 1b3l s ASN 195 N -6.35 0.18 -0.22 3.14 0.01 -0.98 -4.94 114.94 105.79 1b3l s ASN 195 Ca -0.24 -0.44 -0.04 0.00 -0.71 0.00 0.00 52.86 51.43 1b3l s ASN 195 Cb 0.05 0.15 0.08 0.00 0.41 0.00 0.00 41.25 41.93 1b3l s ASN 195 CO 0.41 -0.36 0.09 0.86 -1.51 0.00 0.00 177.10 176.59 1b3l s TRP 196 N -1.67 0.51 -0.36 2.20 -0.00 -1.26 0.80 118.94 119.16 1b3l s TRP 196 Ca -0.13 -0.71 -0.11 0.00 -0.00 0.00 0.00 56.10 55.15 1b3l s TRP 196 Cb -0.08 -0.90 0.01 0.00 -0.00 0.00 0.00 33.47 32.51 1b3l s TRP 196 CO -0.01 -0.66 0.20 0.08 -0.00 0.00 0.00 176.95 176.56 1b3l s VAL 197 N 2.03 4.69 -0.11 5.86 1.01 0.12 -4.99 120.40 129.01 1b3l s VAL 197 Ca 0.04 -0.67 -0.36 0.00 0.00 0.00 0.00 61.98 60.99 1b3l s VAL 197 Cb -0.16 -3.54 -0.13 0.00 0.00 0.00 0.00 36.38 32.54 1b3l s VAL 197 CO -0.19 -0.14 1.78 0.52 0.00 0.00 0.00 175.10 177.07 1b3l n VAL 198 N 5.01 0.41 -0.95 2.92 0.31 -1.26 -0.67 118.33 124.10 1b3l n VAL 198 Ca -0.12 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 1b3l n VAL 198 Cb 0.47 -1.58 0.00 0.00 -0.91 0.00 0.00 33.84 31.82 1b3l n VAL 198 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1b3l n ASN 199 N 5.69 -2.28 0.06 4.52 5.03 -1.26 -4.79 115.26 122.23 1b3l n ASN 199 Ca 0.23 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.68 1b3l n ASN 199 Cb 0.24 -1.02 0.00 0.00 -1.02 0.00 0.00 39.78 37.98 1b3l n ASN 199 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1b3l n GLU 200 N -1.99 0.00 -3.48 3.52 1.02 0.16 -4.89 120.64 114.98 1b3l n GLU 200 Ca 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.04 1b3l n GLU 200 Cb 0.08 -0.45 -0.02 0.00 -0.02 0.00 0.00 31.44 31.03 1b3l n GLU 200 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1b3l s ARG 201 N -2.00 1.09 -0.12 3.49 1.70 -0.63 -4.47 118.95 118.02 1b3l s ARG 201 Ca 0.00 -0.42 -0.01 0.00 -0.47 0.00 0.00 55.73 54.83 1b3l s ARG 201 Cb 0.00 0.49 0.03 0.00 -0.57 0.00 0.00 34.95 34.90 1b3l s ARG 201 CO 0.00 -0.48 -0.06 0.42 -1.08 0.00 0.00 175.30 174.10 1b3l s ILE 202 N -3.46 0.95 -0.10 4.99 1.01 -0.82 0.13 121.20 123.90 1b3l s ILE 202 Ca 0.03 -0.28 0.01 0.00 0.00 0.00 0.00 60.65 60.41 1b3l s ILE 202 Cb -0.01 -1.01 -0.02 0.00 0.01 0.00 0.00 42.46 41.43 1b3l s ILE 202 CO -0.10 0.32 -0.10 -0.69 0.00 0.00 0.00 174.94 174.36 1b3l s VAL 203 N 1.74 3.35 0.04 2.92 1.01 0.24 -0.05 120.40 129.64 1b3l s VAL 203 Ca 0.04 -0.59 0.08 0.00 0.00 0.00 0.00 61.98 61.52 1b3l s VAL 203 Cb -0.13 -2.38 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 1b3l s VAL 203 CO -0.08 0.56 -0.24 -0.76 0.00 0.00 0.00 175.10 174.58 1b3l s LEU 204 N -0.24 2.15 0.08 3.92 1.43 0.60 -1.08 118.68 125.54 1b3l s LEU 204 Ca 0.02 -0.55 0.08 0.00 -1.03 0.00 0.00 54.13 52.66 1b3l s LEU 204 Cb -0.13 -1.16 -0.03 0.00 0.03 0.00 0.00 46.19 44.90 1b3l s LEU 204 CO 0.03 0.23 -0.22 -1.83 0.23 0.00 0.00 176.35 174.78 1b3l s GLU 205 N -1.13 1.31 0.14 1.70 -1.05 -0.71 -1.32 118.70 117.64 1b3l s GLU 205 Ca 0.10 -1.12 -0.29 0.00 -0.15 0.00 0.00 54.97 53.52 1b3l s GLU 205 Cb -0.09 -1.56 -0.16 0.00 -0.44 0.00 0.00 34.13 31.87 1b3l s GLU 205 CO 0.02 0.38 0.61 -2.13 0.95 0.00 0.00 175.26 175.08 1b3l n ARG 206 N 1.36 0.00 -3.54 -4.83 0.63 -0.68 -1.33 116.66 108.28 1b3l n ARG 206 Ca -0.18 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.33 1b3l n ARG 206 Cb 0.53 -1.04 -0.10 0.00 0.45 0.00 0.00 32.46 32.31 1b3l n ARG 206 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1b3l s ASN 207 N -0.69 5.84 0.45 6.15 2.47 -0.62 -4.64 114.94 123.89 1b3l s ASN 207 Ca 0.65 -1.22 0.15 0.00 0.42 0.00 0.00 52.86 52.87 1b3l s ASN 207 Cb -0.94 -2.06 1.08 0.00 -1.45 0.00 0.00 41.25 37.88 1b3l s ASN 207 CO 0.52 -0.50 1.98 -0.65 -3.72 0.00 0.00 177.10 174.73 1b3l h PRO 208 N 8.52 0.34 -0.00 0.43 0.11 -1.91 -1.98 132.00 137.50 1b3l h PRO 208 Ca -0.25 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1b3l h PRO 208 Cb 1.10 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1b3l h PRO 208 CO 0.75 0.23 -0.07 1.04 -0.21 0.00 0.00 178.00 179.73 1b3l n GLN 209 N -4.46 0.57 -1.99 1.05 1.13 -1.26 -4.86 117.38 107.55 1b3l n GLN 209 Ca 0.10 -0.13 -0.41 0.00 -1.94 0.00 0.00 57.00 54.62 1b3l n GLN 209 Cb 0.40 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 29.24 1b3l n GLN 209 CO 0.00 0.00 0.00 -0.47 -1.44 0.00 0.00 177.06 175.15 1b3l s TYR 210 N -2.52 2.94 0.62 1.08 5.04 -0.75 -4.34 117.35 119.42 1b3l s TYR 210 Ca 0.29 1.14 0.37 0.00 -2.44 0.00 0.00 57.07 56.43 1b3l s TYR 210 Cb 0.20 -3.83 2.10 0.00 0.35 0.00 0.00 41.96 40.78 1b3l s TYR 210 CO 0.47 -2.56 2.31 0.11 -1.34 0.00 0.00 175.55 174.54 1b3l h TRP 211 N 4.21 0.00 -0.10 4.97 5.08 -1.88 -0.50 115.95 127.72 1b3l h TRP 211 Ca -0.48 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 59.47 1b3l h TRP 211 Cb 1.22 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 27.37 1b3l h TRP 211 CO 0.58 0.00 -0.11 -3.47 -1.28 0.00 0.00 178.44 174.16 1b3l n ASP 212 N -3.48 2.56 -0.25 0.11 2.03 -1.26 -4.76 116.55 111.50 1b3l n ASP 212 Ca -0.03 -3.34 0.26 0.00 0.52 0.00 0.00 54.79 52.20 1b3l n ASP 212 Cb 0.08 -0.50 0.62 0.00 -0.72 0.00 0.00 41.12 40.60 1b3l n ASP 212 CO 0.00 0.00 0.00 -1.13 -1.92 0.00 0.00 177.20 174.15 1b3l h ASN 213 N 0.72 0.21 -0.91 1.67 -1.24 -1.38 -2.06 115.58 112.60 1b3l h ASN 213 Ca 0.03 0.03 0.13 0.00 0.71 0.00 0.00 56.30 57.20 1b3l h ASN 213 Cb 1.19 -0.01 -0.09 0.00 0.73 0.00 0.00 38.32 40.15 1b3l h ASN 213 CO 0.10 0.06 0.53 0.00 -1.29 0.00 0.00 177.43 176.84 1b3l h ALA 214 N 1.56 1.37 -0.00 1.57 0.00 -1.85 -2.08 119.26 119.82 1b3l h ALA 214 Ca 0.50 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.46 1b3l h ALA 214 Cb 1.61 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.28 1b3l h ALA 214 CO -0.12 0.07 -0.15 1.63 0.00 0.00 0.00 179.25 180.68 1b3l n LYS 215 N -4.74 0.60 -2.28 0.00 5.02 -0.77 -4.85 118.16 111.14 1b3l n LYS 215 Ca 0.17 -0.24 -0.41 0.00 -2.02 0.00 0.00 58.31 55.82 1b3l n LYS 215 Cb 0.38 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.86 1b3l n LYS 215 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1b3l s THR 216 N -2.56 3.34 -0.20 -0.18 2.01 -0.78 -0.11 115.64 117.15 1b3l s THR 216 Ca 0.26 1.13 -0.12 0.00 0.31 0.00 0.00 61.69 63.27 1b3l s THR 216 Cb 0.20 -3.72 -0.08 0.00 0.01 0.00 0.00 72.50 68.90 1b3l s THR 216 CO 0.50 0.18 -0.28 0.52 -0.69 0.00 0.00 174.62 174.86 1b3l n VAL 217 N 2.44 1.25 -2.14 3.82 0.31 -1.26 -4.88 118.33 117.87 1b3l n VAL 217 Ca 0.05 -0.19 -0.41 0.00 -0.01 0.00 0.00 64.34 63.78 1b3l n VAL 217 Cb 0.44 -1.88 -0.02 0.00 -0.91 0.00 0.00 33.84 31.46 1b3l n VAL 217 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1b3l s ILE 218 N -2.47 2.81 -0.10 2.52 1.09 -1.26 -4.87 121.20 118.91 1b3l s ILE 218 Ca -0.29 0.79 0.14 0.00 -1.10 0.00 0.00 60.65 60.19 1b3l s ILE 218 Cb 0.10 -3.50 -0.20 0.00 -1.06 0.00 0.00 42.46 37.80 1b3l s ILE 218 CO 0.37 0.18 0.14 0.59 -0.10 0.00 0.00 174.94 176.12 1b3l n ASN 219 N 1.13 1.47 -3.76 3.58 3.02 -0.18 -4.64 115.26 115.88 1b3l n ASN 219 Ca 0.01 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.41 1b3l n ASN 219 Cb 0.42 1.13 -0.16 0.00 -0.61 0.00 0.00 39.78 40.56 1b3l n ASN 219 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1b3l s GLN 220 N -2.58 -0.02 -0.05 3.52 0.74 -1.11 -1.68 119.66 118.47 1b3l s GLN 220 Ca -0.07 0.23 0.03 0.00 0.05 0.00 0.00 55.36 55.61 1b3l s GLN 220 Cb 0.06 -0.26 0.00 0.00 1.10 0.00 0.00 33.01 33.92 1b3l s GLN 220 CO 0.60 -0.18 -0.15 0.54 -0.55 0.00 0.00 175.29 175.55 1b3l s VAL 221 N 1.17 1.30 -0.15 1.34 0.11 -0.43 -1.72 120.40 122.02 1b3l s VAL 221 Ca -0.08 -0.61 -0.02 0.00 -2.93 0.00 0.00 61.98 58.33 1b3l s VAL 221 Cb -0.13 -1.14 -0.02 0.00 -1.53 0.00 0.00 36.38 33.56 1b3l s VAL 221 CO -0.03 0.38 -0.07 -0.89 -3.33 0.00 0.00 175.10 171.16 1b3l s THR 222 N 0.29 3.63 -0.24 5.04 2.01 -0.17 -0.29 115.64 125.90 1b3l s THR 222 Ca -0.08 -0.46 -0.05 0.00 0.31 0.00 0.00 61.69 61.41 1b3l s THR 222 Cb -0.13 -2.57 -0.01 0.00 0.01 0.00 0.00 72.50 69.80 1b3l s THR 222 CO 0.03 0.51 0.01 -0.31 -0.69 0.00 0.00 174.62 174.16 1b3l s TYR 223 N 0.33 3.03 0.13 4.92 2.02 0.92 -1.09 117.35 127.61 1b3l s TYR 223 Ca -0.06 -0.83 -0.01 0.00 -0.37 0.00 0.00 57.07 55.80 1b3l s TYR 223 Cb -0.15 -2.16 -0.04 0.00 -0.40 0.00 0.00 41.96 39.21 1b3l s TYR 223 CO 0.04 -0.51 0.30 -0.51 -1.57 0.00 0.00 175.55 173.30 1b3l s LEU 224 N 1.51 4.30 -0.67 -1.29 1.43 -0.11 -1.94 118.68 121.92 1b3l s LEU 224 Ca 0.05 0.37 0.02 0.00 -1.03 0.00 0.00 54.13 53.54 1b3l s LEU 224 Cb -0.15 -3.09 0.37 0.00 0.03 0.00 0.00 46.19 43.35 1b3l s LEU 224 CO -0.01 0.07 1.47 -0.81 0.23 0.00 0.00 176.35 177.31 1b3l n PRO 225 N -0.10 3.44 -3.31 1.29 -0.04 -1.26 0.28 135.00 135.32 1b3l n PRO 225 Ca -0.04 -4.27 -0.41 0.00 -0.04 0.00 0.00 63.50 58.73 1b3l n PRO 225 Cb 0.52 -2.28 -0.08 0.00 -0.04 0.00 0.00 33.50 31.61 1b3l n PRO 225 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1b3l s ILE 226 N -5.07 5.07 -0.18 0.52 1.01 -1.26 -4.21 121.20 117.07 1b3l s ILE 226 Ca 0.48 0.11 0.17 0.00 0.00 0.00 0.00 60.65 61.42 1b3l s ILE 226 Cb 0.37 -3.94 0.03 0.00 0.01 0.00 0.00 42.46 38.93 1b3l s ILE 226 CO -0.25 -0.22 1.25 0.77 0.00 0.00 0.00 174.94 176.49 1b3l h SER 227 N 8.52 0.00 -2.84 3.58 4.64 -1.88 -3.33 113.55 122.24 1b3l h SER 227 Ca -0.28 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.47 1b3l h SER 227 Cb 1.13 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.19 1b3l h SER 227 CO 0.75 0.42 1.09 -0.55 -0.87 0.00 0.00 176.83 177.68 1b3l s SER 228 N -6.14 6.45 0.49 4.97 0.15 -1.26 -4.15 113.70 114.21 1b3l s SER 228 Ca 0.02 1.55 0.27 0.00 0.70 0.00 0.00 55.95 58.49 1b3l s SER 228 Cb 0.08 -2.53 1.20 0.00 -1.71 0.00 0.00 66.02 63.05 1b3l s SER 228 CO 0.76 -1.21 1.94 -0.33 1.20 0.00 0.00 173.24 175.61 1b3l h GLU 229 N 10.37 0.00 0.05 5.44 3.07 -1.86 -2.14 114.58 129.51 1b3l h GLU 229 Ca -0.32 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.54 1b3l h GLU 229 Cb 1.14 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.05 1b3l h GLU 229 CO 1.01 0.16 -0.03 0.28 -1.40 0.00 0.00 179.01 179.03 1b3l h VAL 230 N 0.00 0.97 -1.03 3.13 2.07 -1.93 -2.82 116.25 116.64 1b3l h VAL 230 Ca -0.00 -1.56 0.26 0.00 0.82 0.00 0.00 66.70 66.22 1b3l h VAL 230 Cb 0.56 1.78 -0.09 0.00 -1.52 0.00 0.00 31.29 32.01 1b3l h VAL 230 CO 0.02 0.31 0.66 0.74 0.02 0.00 0.00 177.57 179.32 1b3l h THR 231 N -0.95 0.54 0.01 2.57 2.02 -1.95 -1.20 112.91 113.94 1b3l h THR 231 Ca -0.01 -0.14 -0.00 0.00 0.77 0.00 0.00 66.41 67.03 1b3l h THR 231 Cb 0.56 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 1b3l h THR 231 CO 0.01 0.07 -0.00 -0.78 0.37 0.00 0.00 175.52 175.19 1b3l h ASP 232 N 0.41 -0.01 0.17 4.18 3.58 -1.45 -2.59 116.42 120.70 1b3l h ASP 232 Ca 0.59 -0.44 -0.03 0.00 0.42 0.00 0.00 57.03 57.58 1b3l h ASP 232 Cb 1.47 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.52 1b3l h ASP 232 CO -0.30 0.43 -0.12 0.58 -2.88 0.00 0.00 179.24 176.96 1b3l h VAL 233 N -0.45 0.92 -0.01 2.25 2.07 -0.98 -1.68 116.25 118.37 1b3l h VAL 233 Ca -0.00 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.08 1b3l h VAL 233 Cb 0.44 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.46 1b3l h VAL 233 CO 0.00 0.12 -0.14 0.59 0.02 0.00 0.00 177.57 178.16 1b3l n ASN 234 N -4.15 1.00 -0.00 0.57 3.02 -0.65 -0.65 115.26 114.39 1b3l n ASN 234 Ca -0.02 -1.00 0.06 0.00 -0.03 0.00 0.00 54.58 53.59 1b3l n ASN 234 Cb 0.20 0.05 -0.09 0.00 -0.61 0.00 0.00 39.78 39.33 1b3l n ASN 234 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1b3l n ARG 235 N -0.49 1.83 -0.06 3.52 1.74 -0.89 -3.85 116.66 118.45 1b3l n ARG 235 Ca 0.15 -0.05 -0.04 0.00 -0.77 0.00 0.00 57.85 57.14 1b3l n ARG 235 Cb 0.32 -1.19 -0.01 0.00 -1.02 0.00 0.00 32.46 30.56 1b3l n ARG 235 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 1b3l n TYR 236 N -1.56 0.77 -0.28 -1.55 4.19 -0.69 -1.31 117.16 116.73 1b3l n TYR 236 Ca 0.01 0.33 0.06 0.00 3.31 0.00 0.00 57.90 61.61 1b3l n TYR 236 Cb 0.26 -0.69 0.16 0.00 0.49 0.00 0.00 39.34 39.56 1b3l n TYR 236 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1b3l h ARG 237 N -0.86 0.05 -1.05 2.98 3.08 -1.11 0.97 114.38 118.43 1b3l h ARG 237 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1b3l h ARG 237 Cb 0.46 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.50 1b3l h ARG 237 CO 0.00 0.03 0.00 -1.13 -1.07 0.00 0.00 179.97 177.80 1b3l n SER 238 N -5.44 2.81 0.00 7.04 3.41 -1.25 -4.90 113.62 115.29 1b3l n SER 238 Ca 0.15 -1.90 0.00 0.00 -0.26 0.00 0.00 58.87 56.86 1b3l n SER 238 Cb 0.50 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 1b3l n SER 238 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1b3l n GLY 239 N 0.52 1.79 0.00 5.00 0.00 0.33 -4.91 105.19 107.93 1b3l n GLY 239 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 1b3l n GLY 239 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1b3l n GLU 240 N 0.00 0.13 -4.22 1.61 1.02 -0.43 -4.74 120.64 114.01 1b3l n GLU 240 Ca 0.00 0.18 -0.17 0.00 -0.02 0.00 0.00 57.16 57.16 1b3l n GLU 240 Cb 0.00 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 29.79 1b3l n GLU 240 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1b3l s ILE 241 N -2.50 0.69 -0.21 -3.67 1.01 -0.73 -4.92 121.20 110.86 1b3l s ILE 241 Ca 0.08 -0.71 0.10 0.00 0.00 0.00 0.00 60.65 60.13 1b3l s ILE 241 Cb 0.05 -0.64 -0.20 0.00 0.01 0.00 0.00 42.46 41.67 1b3l s ILE 241 CO 0.11 -0.04 -0.06 0.47 0.00 0.00 0.00 174.94 175.42 1b3l n ASP 242 N 2.22 1.06 -3.86 3.58 8.00 -0.65 -4.56 116.55 122.34 1b3l n ASP 242 Ca -0.17 -0.06 -0.27 0.00 0.71 0.00 0.00 54.79 55.00 1b3l n ASP 242 Cb 0.56 0.38 -0.17 0.00 -0.02 0.00 0.00 41.12 41.87 1b3l n ASP 242 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1b3l s MET 243 N -2.48 1.25 0.96 -1.24 -1.94 -1.05 -1.96 119.30 112.83 1b3l s MET 243 Ca -0.20 -0.29 -0.12 0.00 -1.71 0.00 0.00 55.69 53.37 1b3l s MET 243 Cb 0.07 -1.66 0.16 0.00 2.01 0.00 0.00 34.83 35.42 1b3l s MET 243 CO 0.69 -0.36 1.11 0.95 -0.01 0.00 0.00 175.02 177.40 1b3l s THR 244 N 1.75 2.07 0.79 2.05 -4.23 -0.40 -1.64 115.64 116.03 1b3l s THR 244 Ca 0.03 0.02 -0.11 0.00 -1.18 0.00 0.00 61.69 60.46 1b3l s THR 244 Cb -0.14 -2.63 0.07 0.00 1.34 0.00 0.00 72.50 71.14 1b3l s THR 244 CO -0.07 -0.03 1.10 -0.47 -0.54 0.00 0.00 174.62 174.60 1b3l s TYR 245 N -3.10 2.49 -1.09 3.99 5.04 -1.21 -4.63 117.35 118.83 1b3l s TYR 245 Ca 0.65 1.55 -0.03 0.00 -2.44 0.00 0.00 57.07 56.80 1b3l s TYR 245 Cb -0.17 -3.08 0.28 0.00 0.35 0.00 0.00 41.96 39.35 1b3l s TYR 245 CO 0.56 -1.92 1.84 0.27 -1.34 0.00 0.00 175.55 174.96 1b3l n ASN 246 N -3.61 7.20 -3.53 4.32 6.94 -1.26 -4.66 115.26 120.65 1b3l n ASN 246 Ca 0.09 -3.54 -0.25 0.00 -0.02 0.00 0.00 54.58 50.86 1b3l n ASN 246 Cb 0.53 -1.23 -0.15 0.00 -2.36 0.00 0.00 39.78 36.58 1b3l n ASN 246 CO 0.00 0.00 0.00 0.20 -1.03 0.00 0.00 177.26 176.43 1b3l s ASN 247 N -1.10 2.69 -0.08 0.53 0.01 -1.23 -4.55 114.94 111.21 1b3l s ASN 247 Ca 0.40 -0.90 -0.16 0.00 -0.71 0.00 0.00 52.86 51.49 1b3l s ASN 247 Cb 0.16 -0.11 -0.05 0.00 0.41 0.00 0.00 41.25 41.66 1b3l s ASN 247 CO -0.07 -0.39 0.40 -0.04 -1.51 0.00 0.00 177.10 175.49 1b3l s MET 248 N 2.17 4.14 0.64 -0.60 -1.94 -1.26 -4.79 119.30 117.66 1b3l s MET 248 Ca 0.07 0.35 -0.17 0.00 -1.71 0.00 0.00 55.69 54.23 1b3l s MET 248 Cb -0.16 -3.34 -0.01 0.00 2.01 0.00 0.00 34.83 33.33 1b3l s MET 248 CO -0.26 0.40 1.19 -1.25 -0.01 0.00 0.00 175.02 175.09 1b3l s PRO 249 N -0.13 2.70 0.08 2.03 0.04 -1.26 -4.90 135.00 133.57 1b3l s PRO 249 Ca 0.23 1.73 -0.06 0.00 0.04 0.00 0.00 61.00 62.94 1b3l s PRO 249 Cb -0.15 -1.91 -0.24 0.00 0.04 0.00 0.00 34.50 32.24 1b3l s PRO 249 CO 0.10 -1.39 1.17 0.82 0.04 0.00 0.00 177.00 177.74 1b3l h ILE 250 N 0.40 1.44 -0.64 0.56 2.04 -1.92 -3.21 117.51 116.18 1b3l h ILE 250 Ca -0.49 -2.82 0.13 0.00 1.00 0.00 0.00 64.86 62.68 1b3l h ILE 250 Cb 1.29 2.80 -0.12 0.00 -0.74 0.00 0.00 36.82 40.04 1b3l h ILE 250 CO 0.53 0.83 -0.17 -0.33 0.00 0.00 0.00 178.15 179.02 1b3l h GLU 251 N 0.14 -0.01 -0.12 2.37 3.07 -1.96 -3.19 114.58 114.88 1b3l h GLU 251 Ca -0.14 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.72 1b3l h GLU 251 Cb 1.88 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.79 1b3l h GLU 251 CO 0.20 -0.00 0.00 1.47 -1.40 0.00 0.00 179.01 179.28 1b3l n LEU 252 N -5.44 2.36 0.48 1.33 -0.00 -1.26 -4.75 117.00 109.73 1b3l n LEU 252 Ca 0.08 -2.08 -0.20 0.00 -0.00 0.00 0.00 56.01 53.81 1b3l n LEU 252 Cb 0.33 -0.11 -0.10 0.00 -0.00 0.00 0.00 43.42 43.55 1b3l n LEU 252 CO 0.04 0.59 0.55 0.15 -0.00 0.00 0.00 177.39 178.72 1b3l h PHE 253 N 0.69 -1.24 -0.22 1.47 3.57 -1.55 -2.89 116.94 116.77 1b3l h PHE 253 Ca 0.00 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.50 1b3l h PHE 253 Cb 0.62 0.42 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 1b3l h PHE 253 CO 0.09 -0.74 -0.13 1.04 -2.23 0.00 0.00 178.31 176.33 1b3l n GLN 254 N -5.64 -0.10 -0.03 1.11 6.02 -1.26 -2.06 117.38 115.43 1b3l n GLN 254 Ca -0.16 0.66 -0.10 0.00 -0.01 0.00 0.00 57.00 57.40 1b3l n GLN 254 Cb 0.51 -0.99 -0.04 0.00 1.02 0.00 0.00 30.24 30.75 1b3l n GLN 254 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.06 177.62 1b3l h LYS 255 N 0.00 0.14 0.00 -1.09 2.10 -1.86 -3.06 116.57 112.81 1b3l h LYS 255 Ca 0.04 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.68 1b3l h LYS 255 Cb 0.09 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 31.39 1b3l h LYS 255 CO -0.21 0.09 0.00 1.28 -2.00 0.00 0.00 179.45 178.62 1b3l n LEU 256 N -5.04 0.50 -0.76 7.07 4.77 -0.87 -1.97 117.00 120.69 1b3l n LEU 256 Ca -0.04 0.70 0.03 0.00 -0.03 0.00 0.00 56.01 56.67 1b3l n LEU 256 Cb 0.06 -0.72 0.13 0.00 -2.33 0.00 0.00 43.42 40.56 1b3l n LEU 256 CO 0.31 -0.77 0.52 1.17 -1.33 0.00 0.00 177.39 177.29 1b3l n LYS 257 N -2.13 2.02 0.00 3.23 4.81 -1.15 -1.53 118.16 123.40 1b3l n LYS 257 Ca -0.00 -1.00 0.00 0.00 -0.87 0.00 0.00 58.31 56.43 1b3l n LYS 257 Cb 0.08 -1.52 0.00 0.00 0.02 0.00 0.00 35.03 33.61 1b3l n LYS 257 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1b3l n LYS 258 N 0.23 0.00 -0.03 1.64 3.00 -1.18 -4.22 118.16 117.60 1b3l n LYS 258 Ca 0.09 0.00 -0.20 0.00 -0.00 0.00 0.00 58.31 58.20 1b3l n LYS 258 Cb 0.42 -0.00 -0.13 0.00 0.00 0.00 0.00 35.03 35.31 1b3l n LYS 258 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 1b3l h GLU 259 N 0.00 0.15 -2.01 1.64 4.81 -1.43 -3.41 114.58 114.32 1b3l h GLU 259 Ca 0.00 -0.25 -0.53 0.00 -0.13 0.00 0.00 59.36 58.45 1b3l h GLU 259 Cb 0.14 0.09 -0.40 0.00 0.63 0.00 0.00 28.75 29.21 1b3l h GLU 259 CO 0.00 1.12 -1.13 0.44 -0.73 0.00 0.00 179.01 178.71 1b3l n ILE 260 N -4.21 -0.37 0.10 2.32 -5.35 -0.58 -5.00 119.36 106.27 1b3l n ILE 260 Ca -0.22 -4.29 0.19 0.00 -0.27 0.00 0.00 62.75 58.17 1b3l n ILE 260 Cb 0.75 -1.27 0.76 0.00 -1.74 0.00 0.00 39.64 38.14 1b3l n ILE 260 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 1b3l h PRO 261 N 3.59 0.00 0.00 6.28 0.13 -1.73 -1.96 132.00 138.30 1b3l h PRO 261 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1b3l h PRO 261 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 1b3l h PRO 261 CO 0.49 0.00 -0.44 0.09 -0.23 0.00 0.00 178.00 177.91 1b3l n ASN 262 N -3.92 0.48 -0.31 1.44 3.02 -1.26 -3.59 115.26 111.12 1b3l n ASN 262 Ca 0.06 -0.01 0.12 0.00 -0.03 0.00 0.00 54.58 54.72 1b3l n ASN 262 Cb 0.52 0.08 0.14 0.00 -0.61 0.00 0.00 39.78 39.91 1b3l n ASN 262 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1b3l n GLU 263 N -1.68 0.84 -3.32 3.52 1.02 -0.74 -4.82 120.64 115.47 1b3l n GLU 263 Ca 0.05 -0.62 -0.46 0.00 -0.02 0.00 0.00 57.16 56.11 1b3l n GLU 263 Cb 0.37 -1.49 -0.05 0.00 -0.02 0.00 0.00 31.44 30.25 1b3l n GLU 263 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1b3l s VAL 264 N -2.59 5.19 -0.21 2.62 1.01 -1.22 -0.80 120.40 124.39 1b3l s VAL 264 Ca 0.19 -1.49 -0.18 0.00 0.00 0.00 0.00 61.98 60.50 1b3l s VAL 264 Cb 0.18 -4.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 1b3l s VAL 264 CO 0.60 -0.86 0.49 -0.13 0.00 0.00 0.00 175.10 175.20 1b3l s ARG 265 N 1.60 4.16 -0.28 2.72 1.81 -0.27 -4.98 118.95 123.70 1b3l s ARG 265 Ca 0.03 0.34 0.00 0.00 -1.72 0.00 0.00 55.73 54.38 1b3l s ARG 265 Cb -0.30 -3.57 0.08 0.00 -0.45 0.00 0.00 34.95 30.71 1b3l s ARG 265 CO 0.03 -0.16 0.05 0.08 -0.68 0.00 0.00 175.30 174.61 1b3l s VAL 266 N 1.69 1.21 0.24 3.52 1.01 -1.26 -2.03 120.40 124.79 1b3l s VAL 266 Ca 0.22 -1.40 0.04 0.00 0.00 0.00 0.00 61.98 60.84 1b3l s VAL 266 Cb -0.15 -1.78 -0.05 0.00 0.00 0.00 0.00 36.38 34.39 1b3l s VAL 266 CO 0.09 -0.46 -0.01 -1.81 0.00 0.00 0.00 175.10 172.91 1b3l s ASP 267 N 1.48 1.97 0.49 3.32 1.01 -0.25 -4.93 116.67 119.76 1b3l s ASP 267 Ca 0.05 -1.23 -0.23 0.00 0.71 0.00 0.00 52.55 51.85 1b3l s ASP 267 Cb -0.18 -0.02 -0.06 0.00 1.01 0.00 0.00 42.92 43.67 1b3l s ASP 267 CO -0.16 -0.50 1.32 -2.84 0.21 0.00 0.00 175.17 173.20 1b3l s PRO 268 N -3.85 3.47 -0.10 8.23 0.02 -1.26 0.17 135.00 141.67 1b3l s PRO 268 Ca 0.29 2.15 -0.06 0.00 0.02 0.00 0.00 61.00 63.41 1b3l s PRO 268 Cb 0.06 -2.42 0.04 0.00 0.02 0.00 0.00 34.50 32.20 1b3l s PRO 268 CO 0.10 -0.90 0.25 -0.47 -0.33 0.00 0.00 177.00 175.64 1b3l s TYR 269 N -1.33 -0.33 -1.46 6.54 5.04 -1.25 -4.48 117.35 120.08 1b3l s TYR 269 Ca 0.66 0.78 -0.10 0.00 -2.44 0.00 0.00 57.07 55.97 1b3l s TYR 269 Cb -0.38 0.06 0.03 0.00 0.35 0.00 0.00 41.96 42.02 1b3l s TYR 269 CO 0.46 -0.22 2.50 1.28 -1.34 0.00 0.00 175.55 178.23 1b3l n LEU 270 N 4.04 7.87 -4.13 6.97 4.77 -0.34 -4.46 117.00 131.72 1b3l n LEU 270 Ca -0.23 -4.50 -0.14 0.00 -0.03 0.00 0.00 56.01 51.11 1b3l n LEU 270 Cb 0.54 -1.52 -0.11 0.00 -2.33 0.00 0.00 43.42 40.00 1b3l n LEU 270 CO 0.15 1.76 -0.42 0.00 -1.33 0.00 0.00 177.39 177.55 1b3l s THR 272 N -1.94 1.40 -0.17 0.00 2.01 -0.52 -1.77 115.64 114.66 1b3l s THR 272 Ca -0.01 -0.69 -0.12 0.00 0.31 0.00 0.00 61.69 61.19 1b3l s THR 272 Cb -0.06 -1.21 -0.05 0.00 0.01 0.00 0.00 72.50 71.19 1b3l s THR 272 CO 0.00 0.41 0.21 -0.47 -0.69 0.00 0.00 174.62 174.08 1b3l s TYR 273 N 0.15 3.46 0.20 4.92 6.14 0.86 -2.27 117.35 130.80 1b3l s TYR 273 Ca -0.06 0.48 -0.13 0.00 0.64 0.00 0.00 57.07 58.00 1b3l s TYR 273 Cb -0.12 -2.22 0.01 0.00 0.42 0.00 0.00 41.96 40.04 1b3l s TYR 273 CO 0.03 0.32 0.43 1.52 0.64 0.00 0.00 175.55 178.48 1b3l s TYR 274 N 0.25 0.18 -0.32 4.97 1.13 -0.47 -1.38 117.35 121.71 1b3l s TYR 274 Ca 0.13 -0.54 -0.10 0.00 -1.41 0.00 0.00 57.07 55.15 1b3l s TYR 274 Cb -0.12 0.18 -0.01 0.00 -1.10 0.00 0.00 41.96 40.92 1b3l s TYR 274 CO 0.01 -0.86 0.16 0.71 -2.51 0.00 0.00 175.55 173.06 1b3l s TYR 275 N -3.94 3.19 0.06 -3.49 2.02 -0.24 -0.54 117.35 114.41 1b3l s TYR 275 Ca 0.15 -0.56 -0.29 0.00 -0.37 0.00 0.00 57.07 56.00 1b3l s TYR 275 Cb 0.01 -2.37 -0.05 0.00 -0.40 0.00 0.00 41.96 39.15 1b3l s TYR 275 CO 0.01 -0.46 0.93 -2.00 -1.57 0.00 0.00 175.55 172.46 1b3l s GLU 276 N 1.62 4.62 -0.16 -0.62 2.12 0.27 -1.29 118.70 125.26 1b3l s GLU 276 Ca 0.05 1.37 -0.06 0.00 0.36 0.00 0.00 54.97 56.68 1b3l s GLU 276 Cb -0.17 -3.40 -0.04 0.00 0.26 0.00 0.00 34.13 30.78 1b3l s GLU 276 CO 0.07 0.14 0.05 0.42 -0.54 0.00 0.00 175.26 175.39 1b3l s ILE 277 N 0.32 4.66 -0.65 -3.70 1.01 -1.26 -0.63 121.20 120.95 1b3l s ILE 277 Ca 0.47 -0.09 -0.27 0.00 0.00 0.00 0.00 60.65 60.76 1b3l s ILE 277 Cb -0.22 -3.07 0.00 0.00 0.01 0.00 0.00 42.46 39.18 1b3l s ILE 277 CO 0.28 0.49 1.60 0.21 0.00 0.00 0.00 174.94 177.52 1b3l s ASN 278 N 0.12 5.69 0.05 3.58 3.84 -0.58 -4.69 114.94 122.96 1b3l s ASN 278 Ca 0.04 0.05 0.16 0.00 0.21 0.00 0.00 52.86 53.32 1b3l s ASN 278 Cb -0.12 -2.54 0.70 0.00 -0.55 0.00 0.00 41.25 38.73 1b3l s ASN 278 CO 0.01 -2.11 1.52 0.59 -2.79 0.00 0.00 177.10 174.32 1b3l n ASN 279 N 11.17 0.14 -0.00 -4.21 3.02 -0.44 -3.14 115.26 121.80 1b3l n ASN 279 Ca 0.13 0.53 0.10 0.00 -0.03 0.00 0.00 54.58 55.32 1b3l n ASN 279 Cb 0.51 -0.56 -0.12 0.00 -0.61 0.00 0.00 39.78 38.99 1b3l n ASN 279 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1b3l n GLN 280 N -1.65 0.18 -3.21 3.52 1.13 -1.26 -3.82 117.38 112.27 1b3l n GLN 280 Ca 0.03 -0.05 -0.40 0.00 -1.94 0.00 0.00 57.00 54.65 1b3l n GLN 280 Cb 0.18 -1.51 -0.07 0.00 0.11 0.00 0.00 30.24 28.96 1b3l n GLN 280 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 1b3l s LYS 281 N -3.14 4.17 0.49 -1.09 2.20 -1.19 -4.79 119.74 116.39 1b3l s LYS 281 Ca 0.04 0.45 -0.24 0.00 -0.36 0.00 0.00 55.97 55.87 1b3l s LYS 281 Cb 0.15 -3.59 -0.07 0.00 -1.51 0.00 0.00 37.83 32.82 1b3l s LYS 281 CO 0.87 -0.22 1.38 0.00 -0.36 0.00 0.00 175.35 177.02 1b3l s ALA 282 N 1.87 3.03 -2.10 3.13 0.00 -1.26 -1.22 121.76 125.20 1b3l s ALA 282 Ca 0.25 1.37 0.16 0.00 0.00 0.00 0.00 51.96 53.74 1b3l s ALA 282 Cb -0.16 -3.57 0.48 0.00 0.00 0.00 0.00 23.12 19.87 1b3l s ALA 282 CO 0.10 -1.24 1.38 -0.35 0.00 0.00 0.00 175.76 175.65 1b3l n PRO 283 N -0.58 1.98 0.00 0.00 -0.04 -1.26 -4.86 135.00 130.23 1b3l n PRO 283 Ca 0.08 -1.50 0.08 0.00 -0.04 0.00 0.00 63.50 62.12 1b3l n PRO 283 Cb 0.44 -1.36 0.47 0.00 -0.04 0.00 0.00 33.50 33.00 1b3l n PRO 283 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1b3l n PHE 284 N 0.72 0.00 1.47 0.54 3.72 -0.36 -2.01 117.46 121.53 1b3l n PHE 284 Ca 0.15 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.65 1b3l n PHE 284 Cb 0.37 -0.14 0.42 0.00 -0.94 0.00 0.00 39.48 39.19 1b3l n PHE 284 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1b3l n ASN 285 N -1.14 1.14 -4.64 4.37 6.94 -1.17 -4.68 115.26 116.09 1b3l n ASN 285 Ca 0.10 -1.63 -0.37 0.00 -0.02 0.00 0.00 54.58 52.67 1b3l n ASN 285 Cb 0.10 -0.07 -0.10 0.00 -2.36 0.00 0.00 39.78 37.34 1b3l n ASN 285 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1b3l s ASP 286 N -1.56 6.00 0.55 0.53 -1.08 -0.85 -4.98 116.67 115.28 1b3l s ASP 286 Ca 0.30 0.07 0.22 0.00 -0.52 0.00 0.00 52.55 52.62 1b3l s ASP 286 Cb 0.16 -2.08 1.48 0.00 -1.46 0.00 0.00 42.92 41.01 1b3l s ASP 286 CO 0.24 0.05 2.16 1.62 0.52 0.00 0.00 175.17 179.77 1b3l h VAL 287 N 5.09 0.79 -0.50 1.11 3.04 -1.89 -2.43 116.25 121.45 1b3l h VAL 287 Ca -0.38 0.00 -0.12 0.00 -1.01 0.00 0.00 66.70 65.19 1b3l h VAL 287 Cb 1.17 0.96 -0.01 0.00 -2.01 0.00 0.00 31.29 31.40 1b3l h VAL 287 CO 0.64 0.00 -0.16 0.03 -1.01 0.00 0.00 177.57 177.08 1b3l h ARG 288 N 0.00 0.99 -0.21 4.17 3.08 -1.93 -0.02 114.38 120.45 1b3l h ARG 288 Ca 0.03 -0.40 -0.04 0.00 0.07 0.00 0.00 59.98 59.64 1b3l h ARG 288 Cb 0.14 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 1b3l h ARG 288 CO -0.00 1.07 -0.03 0.28 -1.07 0.00 0.00 179.97 180.23 1b3l h VAL 289 N 0.85 1.27 -0.72 2.04 2.07 -1.73 -1.73 116.25 118.30 1b3l h VAL 289 Ca 0.12 -0.97 -0.00 0.00 0.82 0.00 0.00 66.70 66.67 1b3l h VAL 289 Cb 0.73 1.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.94 1b3l h VAL 289 CO 0.06 0.30 0.44 0.03 0.02 0.00 0.00 177.57 178.41 1b3l h ARG 290 N 0.14 0.97 -0.66 1.57 3.08 -1.32 -2.64 114.38 115.51 1b3l h ARG 290 Ca 0.06 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1b3l h ARG 290 Cb 0.46 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 1b3l h ARG 290 CO 0.02 0.69 0.33 1.15 -1.07 0.00 0.00 179.97 181.08 1b3l h THR 291 N 0.98 1.22 -0.47 2.04 2.02 -0.97 -2.19 112.91 115.53 1b3l h THR 291 Ca 0.26 -0.61 -0.00 0.00 0.77 0.00 0.00 66.41 66.83 1b3l h THR 291 Cb -0.04 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 66.74 1b3l h THR 291 CO -0.05 0.25 0.29 0.00 0.37 0.00 0.00 175.52 176.38 1b3l h ALA 292 N 1.15 0.60 -0.99 6.16 0.00 -1.07 -1.42 119.26 123.69 1b3l h ALA 292 Ca 0.23 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.11 1b3l h ALA 292 Cb 0.10 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 1b3l h ALA 292 CO -0.03 0.08 0.65 -0.07 0.00 0.00 0.00 179.25 179.89 1b3l h LEU 293 N 0.63 1.10 -0.26 0.00 3.38 -1.21 -1.43 115.31 117.52 1b3l h LEU 293 Ca 0.17 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 1b3l h LEU 293 Cb -0.01 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1b3l h LEU 293 CO -0.03 0.77 -0.08 0.50 0.09 0.00 0.00 178.44 179.69 1b3l h LYS 294 N 1.28 0.51 -0.19 1.13 3.64 -1.06 -3.03 116.57 118.86 1b3l h LYS 294 Ca 0.39 -0.20 -0.14 0.00 -1.27 0.00 0.00 60.65 59.43 1b3l h LYS 294 Cb -0.04 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 1b3l h LYS 294 CO -0.11 0.73 -0.47 -0.07 -2.27 0.00 0.00 179.45 177.26 1b3l h LEU 295 N 0.25 0.53 -0.01 5.20 3.38 -1.15 -3.28 115.31 120.23 1b3l h LEU 295 Ca 0.06 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1b3l h LEU 295 Cb 0.56 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1b3l h LEU 295 CO 0.03 0.92 0.00 0.00 0.09 0.00 0.00 178.44 179.48 1b3l n ALA 296 N -2.50 2.28 -2.27 1.53 0.00 -0.55 -4.53 120.51 114.47 1b3l n ALA 296 Ca -0.02 -0.03 -0.42 0.00 0.00 0.00 0.00 53.44 52.97 1b3l n ALA 296 Cb 0.55 -1.47 -0.03 0.00 0.00 0.00 0.00 19.45 18.50 1b3l n ALA 296 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1b3l s LEU 297 N -4.46 4.37 -0.60 0.00 0.20 -1.15 -4.73 118.68 112.31 1b3l s LEU 297 Ca 0.11 2.19 -0.16 0.00 0.69 0.00 0.00 54.13 56.96 1b3l s LEU 297 Cb 0.13 -3.58 0.14 0.00 -0.43 0.00 0.00 46.19 42.44 1b3l s LEU 297 CO 0.59 -0.59 0.59 -0.62 -0.29 0.00 0.00 176.35 176.03 1b3l s ASP 298 N 1.15 6.27 0.29 3.68 -1.08 -1.26 -4.90 116.67 120.82 1b3l s ASP 298 Ca 0.62 -1.84 0.04 0.00 -0.52 0.00 0.00 52.55 50.85 1b3l s ASP 298 Cb -0.34 -2.23 0.45 0.00 -1.46 0.00 0.00 42.92 39.34 1b3l s ASP 298 CO 0.29 -0.88 1.74 0.03 0.52 0.00 0.00 175.17 176.87 1b3l h ARG 299 N 8.81 0.43 -0.76 4.34 3.08 -1.93 -2.51 114.38 125.84 1b3l h ARG 299 Ca -0.24 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 59.65 1b3l h ARG 299 Cb 1.09 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 31.07 1b3l h ARG 299 CO 1.02 0.65 0.45 0.22 -1.07 0.00 0.00 179.97 181.24 1b3l h ASP 300 N 0.38 0.91 -0.23 7.04 3.58 -1.96 -0.96 116.42 125.18 1b3l h ASP 300 Ca 0.06 -0.07 -0.05 0.00 0.42 0.00 0.00 57.03 57.39 1b3l h ASP 300 Cb 0.65 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.46 1b3l h ASP 300 CO 0.05 0.72 -0.04 0.40 -2.88 0.00 0.00 179.24 177.49 1b3l h ILE 301 N 1.04 1.27 0.41 2.25 2.04 -1.90 -0.76 117.51 121.86 1b3l h ILE 301 Ca 0.27 -1.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.11 1b3l h ILE 301 Cb -0.02 1.46 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 1b3l h ILE 301 CO -0.05 0.31 -0.20 0.40 0.00 0.00 0.00 178.15 178.61 1b3l h ILE 302 N 0.19 0.60 0.06 -0.67 1.08 -1.28 0.28 117.51 117.77 1b3l h ILE 302 Ca 0.06 -0.08 -0.00 0.00 -0.39 0.00 0.00 64.86 64.45 1b3l h ILE 302 Cb 0.48 0.64 0.00 0.00 -3.07 0.00 0.00 36.82 34.87 1b3l h ILE 302 CO 0.02 0.02 -0.03 0.58 -0.69 0.00 0.00 178.15 178.05 1b3l h VAL 303 N -0.60 1.16 0.00 1.67 2.07 -1.25 0.11 116.25 119.42 1b3l h VAL 303 Ca -0.06 -1.58 0.00 0.00 0.82 0.00 0.00 66.70 65.88 1b3l h VAL 303 Cb 0.45 2.07 0.00 0.00 -1.52 0.00 0.00 31.29 32.29 1b3l h VAL 303 CO 0.09 0.35 -0.38 0.59 0.02 0.00 0.00 177.57 178.24 1b3l n ASN 304 N -4.77 0.49 0.00 0.57 3.02 -0.29 -1.45 115.26 112.82 1b3l n ASN 304 Ca -0.08 0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.58 1b3l n ASN 304 Cb 0.31 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.44 1b3l n ASN 304 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1b3l n LYS 305 N -1.76 1.09 -0.07 3.52 5.02 -0.97 -4.61 118.16 120.38 1b3l n LYS 305 Ca 0.05 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.12 1b3l n LYS 305 Cb 0.38 -0.84 -0.12 0.00 -0.02 0.00 0.00 35.03 34.43 1b3l n LYS 305 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1b3l n VAL 306 N -1.91 1.62 -0.05 -0.18 0.31 0.96 -4.73 118.33 114.36 1b3l n VAL 306 Ca 0.00 -0.47 -0.02 0.00 -0.01 0.00 0.00 64.34 63.84 1b3l n VAL 306 Cb 0.34 -1.73 -0.01 0.00 -0.91 0.00 0.00 33.84 31.53 1b3l n VAL 306 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1b3l h LYS 307 N -0.30 0.00 -6.09 5.55 3.64 -0.93 -3.49 116.57 114.95 1b3l h LYS 307 Ca -0.49 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 58.63 1b3l h LYS 307 Cb 1.80 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.62 1b3l h LYS 307 CO -0.09 0.00 -0.70 -1.71 -2.27 0.00 0.00 179.45 174.68 1b3l n ASN 308 N -4.19 -6.30 0.00 4.20 5.15 -0.53 -4.94 115.26 108.66 1b3l n ASN 308 Ca -0.03 -0.34 0.00 0.00 -0.60 0.00 0.00 54.58 53.61 1b3l n ASN 308 Cb 0.11 -3.30 0.00 0.00 -0.53 0.00 0.00 39.78 36.05 1b3l n ASN 308 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1b3l n GLN 309 N -1.61 0.30 0.00 1.20 6.02 -1.26 -4.93 117.38 117.10 1b3l n GLN 309 Ca -0.12 -0.05 0.00 0.00 -0.01 0.00 0.00 57.00 56.82 1b3l n GLN 309 Cb 0.60 -0.38 0.00 0.00 1.02 0.00 0.00 30.24 31.48 1b3l n GLN 309 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1b3l n GLY 310 N 0.06 1.05 3.80 1.08 0.00 -1.26 -4.99 105.19 104.93 1b3l n GLY 310 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1b3l n GLY 310 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1b3l s ASP 311 N -2.00 5.57 -0.11 1.61 1.01 -1.26 -4.81 116.67 116.68 1b3l s ASP 311 Ca 0.00 1.81 -0.03 0.00 0.71 0.00 0.00 52.55 55.04 1b3l s ASP 311 Cb 0.00 -2.53 -0.03 0.00 1.01 0.00 0.00 42.92 41.37 1b3l s ASP 311 CO 0.00 -1.31 0.00 -0.76 0.21 0.00 0.00 175.17 173.31 1b3l s LEU 312 N -4.78 3.56 0.23 1.23 2.01 -0.98 -4.90 118.68 115.05 1b3l s LEU 312 Ca 0.63 0.09 -0.32 0.00 0.01 0.00 0.00 54.13 54.54 1b3l s LEU 312 Cb -0.16 -1.84 -0.13 0.00 0.01 0.00 0.00 46.19 44.07 1b3l s LEU 312 CO 0.41 0.31 1.44 -2.65 1.01 0.00 0.00 176.35 176.87 1b3l n PRO 313 N 2.60 2.07 -4.32 1.29 -0.02 -1.26 -0.75 135.00 134.60 1b3l n PRO 313 Ca -0.18 0.74 -0.32 0.00 -2.02 0.00 0.00 63.50 61.72 1b3l n PRO 313 Cb 0.53 -2.42 -0.09 0.00 -0.02 0.00 0.00 33.50 31.50 1b3l n PRO 313 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1b3l s ALA 314 N 0.10 3.13 0.00 3.55 0.00 -0.34 -4.74 121.76 123.47 1b3l s ALA 314 Ca 0.70 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 51.61 1b3l s ALA 314 Cb -0.65 -1.17 0.00 0.00 0.00 0.00 0.00 23.12 21.30 1b3l s ALA 314 CO 0.48 0.64 0.71 2.48 0.00 0.00 0.00 175.76 180.07 1b3l n TYR 315 N 1.23 0.00 -4.03 0.00 0.18 -1.26 -4.46 117.16 108.83 1b3l n TYR 315 Ca -0.14 -0.24 -0.14 0.00 1.88 0.00 0.00 57.90 59.26 1b3l n TYR 315 Cb 0.52 -0.02 -0.02 0.00 -0.38 0.00 0.00 39.34 39.44 1b3l n TYR 315 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 1b3l s SER 316 N -0.48 0.86 -0.15 9.48 1.04 -1.26 -4.83 113.70 118.37 1b3l s SER 316 Ca 0.00 -1.48 -0.11 0.00 0.48 0.00 0.00 55.95 54.84 1b3l s SER 316 Cb 0.00 0.73 -0.05 0.00 0.10 0.00 0.00 66.02 66.80 1b3l s SER 316 CO 0.00 -1.43 -0.12 0.22 0.98 0.00 0.00 173.24 172.89 1b3l h TYR 317 N 2.05 0.00 -2.80 5.02 3.20 -1.99 -3.45 116.97 119.00 1b3l h TYR 317 Ca -0.29 0.00 -0.53 0.00 3.14 0.00 0.00 58.73 61.05 1b3l h TYR 317 Cb 1.24 0.00 0.03 0.00 1.54 0.00 0.00 36.73 39.54 1b3l h TYR 317 CO 1.64 0.21 0.90 0.99 -1.64 0.00 0.00 178.16 180.26 1b3l s THR 318 N -2.24 2.89 0.31 1.81 2.01 -1.26 -4.72 115.64 114.44 1b3l s THR 318 Ca -0.16 0.54 -0.30 0.00 0.31 0.00 0.00 61.69 62.08 1b3l s THR 318 Cb 0.03 -3.35 -0.11 0.00 0.01 0.00 0.00 72.50 69.08 1b3l s THR 318 CO 0.27 0.02 1.58 -2.84 -0.69 0.00 0.00 174.62 172.96 1b3l s PRO 319 N 1.73 4.12 0.60 4.92 0.02 -1.26 -4.90 135.00 140.23 1b3l s PRO 319 Ca 0.71 2.58 0.38 0.00 0.02 0.00 0.00 61.00 64.68 1b3l s PRO 319 Cb -0.41 -3.01 1.85 0.00 0.02 0.00 0.00 34.50 32.94 1b3l s PRO 319 CO 0.31 -0.62 2.17 -1.00 -0.33 0.00 0.00 177.00 177.53 1b3l h PRO 320 N 4.54 0.00 -0.59 5.54 0.13 -1.94 -1.84 132.00 137.85 1b3l h PRO 320 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1b3l h PRO 320 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1b3l h PRO 320 CO 0.77 0.01 0.00 2.48 -0.23 0.00 0.00 178.00 181.03 1b3l n TYR 321 N -3.14 0.93 -2.20 1.56 4.11 -1.26 -4.70 117.16 112.46 1b3l n TYR 321 Ca -0.01 -0.41 -0.38 0.00 -0.00 0.00 0.00 57.90 57.10 1b3l n TYR 321 Cb 0.20 -0.09 -0.01 0.00 -0.00 0.00 0.00 39.34 39.44 1b3l n TYR 321 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.86 177.85 1b3l s THR 322 N -1.50 2.97 -0.14 -3.48 2.01 -0.69 -4.94 115.64 109.86 1b3l s THR 322 Ca 0.38 0.77 -0.36 0.00 0.31 0.00 0.00 61.69 62.79 1b3l s THR 322 Cb 0.22 -3.41 -0.13 0.00 0.01 0.00 0.00 72.50 69.20 1b3l s THR 322 CO 0.22 0.02 1.85 -0.67 -0.69 0.00 0.00 174.62 175.36 1b3l n ASP 323 N -0.33 3.17 0.00 3.53 2.03 -1.26 -1.67 116.55 122.03 1b3l n ASP 323 Ca 0.06 1.00 0.00 0.00 0.52 0.00 0.00 54.79 56.37 1b3l n ASP 323 Cb 0.47 -1.31 0.00 0.00 -0.72 0.00 0.00 41.12 39.56 1b3l n ASP 323 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1b3l n GLY 324 N 4.37 0.82 3.72 0.27 0.00 -1.26 -4.06 105.19 109.06 1b3l n GLY 324 Ca 0.24 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.87 1b3l n GLY 324 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b3l s ALA 325 N -2.88 3.38 -0.53 4.61 0.00 -0.67 -4.69 121.76 120.98 1b3l s ALA 325 Ca 0.00 0.05 0.04 0.00 0.00 0.00 0.00 51.96 52.05 1b3l s ALA 325 Cb 0.00 -2.86 0.16 0.00 0.00 0.00 0.00 23.12 20.42 1b3l s ALA 325 CO 0.00 -0.05 0.36 0.21 0.00 0.00 0.00 175.76 176.28 1b3l s LYS 326 N 0.64 1.65 0.17 0.00 2.20 -1.26 -4.85 119.74 118.28 1b3l s LYS 326 Ca 0.34 -2.55 -0.06 0.00 -0.36 0.00 0.00 55.97 53.34 1b3l s LYS 326 Cb -0.17 -2.54 -0.06 0.00 -1.51 0.00 0.00 37.83 33.55 1b3l s LYS 326 CO 0.16 -1.26 0.43 -0.51 -0.36 0.00 0.00 175.35 173.81 1b3l s LEU 327 N -0.41 4.23 -0.17 5.43 1.43 -1.26 -4.63 118.68 123.30 1b3l s LEU 327 Ca 0.24 0.67 -0.15 0.00 -1.03 0.00 0.00 54.13 53.87 1b3l s LEU 327 Cb -0.10 -3.41 -0.04 0.00 0.03 0.00 0.00 46.19 42.67 1b3l s LEU 327 CO -0.11 0.01 0.33 -0.69 0.23 0.00 0.00 176.35 176.11 1b3l s VAL 328 N -1.73 5.28 0.08 -1.59 1.01 -1.26 -5.06 120.40 117.13 1b3l s VAL 328 Ca 0.43 0.61 -0.31 0.00 0.00 0.00 0.00 61.98 62.70 1b3l s VAL 328 Cb -0.12 -3.66 -0.07 0.00 0.00 0.00 0.00 36.38 32.53 1b3l s VAL 328 CO 0.24 0.35 1.34 -0.70 0.00 0.00 0.00 175.10 176.34 1b3l s GLU 329 N 0.67 4.34 0.62 2.72 2.12 -1.26 -4.99 118.70 122.92 1b3l s GLU 329 Ca 0.18 1.98 -0.15 0.00 0.36 0.00 0.00 54.97 57.34 1b3l s GLU 329 Cb -0.14 -3.32 -0.02 0.00 0.26 0.00 0.00 34.13 30.91 1b3l s GLU 329 CO 0.05 -0.41 1.07 -1.25 -0.54 0.00 0.00 175.26 174.18 1b3l s PRO 330 N 1.30 3.16 0.30 4.30 0.04 -1.26 -4.96 135.00 137.87 1b3l s PRO 330 Ca 0.63 1.22 0.06 0.00 0.04 0.00 0.00 61.00 62.95 1b3l s PRO 330 Cb -0.34 -2.01 0.74 0.00 0.04 0.00 0.00 34.50 32.93 1b3l s PRO 330 CO 0.29 -0.94 1.76 0.93 0.04 0.00 0.00 177.00 179.09 1b3l h GLU 331 N 0.23 0.69 0.00 4.56 4.39 -2.01 -2.38 114.58 120.06 1b3l h GLU 331 Ca -0.47 -0.04 -0.06 0.00 0.34 0.00 0.00 59.36 59.13 1b3l h GLU 331 Cb 1.22 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.71 1b3l h GLU 331 CO 0.57 0.46 -0.28 0.11 -1.16 0.00 0.00 179.01 178.70 1b3l h TRP 332 N 0.71 0.00 0.00 4.33 5.08 -1.98 -1.98 115.95 122.12 1b3l h TRP 332 Ca 0.58 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 60.54 1b3l h TRP 332 Cb 0.92 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.08 1b3l h TRP 332 CO -0.02 0.28 -0.05 0.35 -1.28 0.00 0.00 178.44 177.72 1b3l h PHE 333 N 0.00 0.00 0.00 0.12 3.57 -1.81 -3.06 116.94 115.76 1b3l h PHE 333 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1b3l h PHE 333 Cb 0.66 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.40 1b3l h PHE 333 CO 0.00 0.05 -0.80 0.87 -2.23 0.00 0.00 178.31 176.20 1b3l h LYS 334 N 0.00 0.00 -7.33 1.11 1.57 -1.42 -3.47 116.57 107.02 1b3l h LYS 334 Ca -0.00 0.00 -0.43 0.00 -1.87 0.00 0.00 60.65 58.35 1b3l h LYS 334 Cb 0.76 0.00 0.18 0.00 0.08 0.00 0.00 32.23 33.25 1b3l h LYS 334 CO 0.01 0.00 0.13 -1.58 -0.57 0.00 0.00 179.45 177.44 1b3l s TRP 335 N -3.31 1.28 0.61 -1.35 0.51 -1.16 -5.03 118.94 110.49 1b3l s TRP 335 Ca 0.02 0.79 -0.12 0.00 -2.12 0.00 0.00 56.10 54.67 1b3l s TRP 335 Cb 0.09 -3.30 -0.04 0.00 -0.81 0.00 0.00 33.47 29.41 1b3l s TRP 335 CO 0.76 -3.50 1.03 -1.54 -0.51 0.00 0.00 176.95 173.18 1b3l s SER 336 N -3.50 6.24 0.26 2.95 1.04 -1.26 -4.92 113.70 114.50 1b3l s SER 336 Ca 0.68 1.46 -0.03 0.00 0.48 0.00 0.00 55.95 58.54 1b3l s SER 336 Cb -0.16 -2.48 0.34 0.00 0.10 0.00 0.00 66.02 63.82 1b3l s SER 336 CO 0.58 -0.86 1.81 -0.61 0.98 0.00 0.00 173.24 175.14 1b3l h GLN 337 N -0.15 0.92 -0.92 4.02 5.75 -1.96 -2.40 115.11 120.37 1b3l h GLN 337 Ca -0.44 -0.18 0.01 0.00 -0.15 0.00 0.00 58.65 57.88 1b3l h GLN 337 Cb 1.19 -0.14 -0.05 0.00 1.07 0.00 0.00 27.48 29.56 1b3l h GLN 337 CO 0.62 0.80 0.61 0.37 -2.65 0.00 0.00 178.83 178.57 1b3l h GLN 338 N 0.88 1.20 -0.46 1.69 -0.00 -1.99 -0.46 115.11 115.98 1b3l h GLN 338 Ca 0.20 -0.07 -0.11 0.00 -0.00 0.00 0.00 58.65 58.66 1b3l h GLN 338 Cb 0.28 -0.27 -0.01 0.00 0.00 0.00 0.00 27.48 27.48 1b3l h GLN 338 CO -0.00 0.79 -0.16 -0.22 0.00 0.00 0.00 178.83 179.24 1b3l h LYS 339 N 1.23 0.91 -0.53 1.69 1.63 -1.87 -2.17 116.57 117.46 1b3l h LYS 339 Ca 0.34 -0.37 0.03 0.00 -0.85 0.00 0.00 60.65 59.80 1b3l h LYS 339 Cb -0.13 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 31.42 1b3l h LYS 339 CO -0.08 1.03 0.31 0.00 -3.45 0.00 0.00 179.45 177.26 1b3l h ARG 340 N 0.75 0.59 -0.61 1.90 3.08 -1.06 -1.08 114.38 117.95 1b3l h ARG 340 Ca 0.11 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1b3l h ARG 340 Cb 0.72 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.60 1b3l h ARG 340 CO 0.05 0.39 0.36 -0.91 -1.07 0.00 0.00 179.97 178.79 1b3l h ASN 341 N 0.61 0.74 -0.42 7.04 2.35 -0.91 0.46 115.58 125.45 1b3l h ASN 341 Ca 0.22 -0.07 -0.14 0.00 -0.55 0.00 0.00 56.30 55.76 1b3l h ASN 341 Cb 0.05 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 1b3l h ASN 341 CO -0.11 0.60 -0.28 1.05 -1.65 0.00 0.00 177.43 177.04 1b3l h GLU 342 N 0.83 0.95 -0.58 0.81 4.11 -1.04 -0.45 114.58 119.19 1b3l h GLU 342 Ca 0.22 -0.44 -0.02 0.00 0.07 0.00 0.00 59.36 59.19 1b3l h GLU 342 Cb 0.00 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 1b3l h GLU 342 CO -0.04 1.10 0.30 1.49 0.07 0.00 0.00 179.01 181.93 1b3l h GLU 343 N 0.80 0.83 -0.77 1.06 4.57 -0.91 -2.29 114.58 117.88 1b3l h GLU 343 Ca 0.09 -0.11 -0.05 0.00 -1.18 0.00 0.00 59.36 58.10 1b3l h GLU 343 Cb 0.86 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 29.26 1b3l h GLU 343 CO 0.08 0.66 0.27 0.00 -1.18 0.00 0.00 179.01 178.84 1b3l h ALA 344 N 1.13 1.01 -0.64 2.92 0.00 0.20 -2.54 119.26 121.34 1b3l h ALA 344 Ca 0.20 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1b3l h ALA 344 Cb 0.09 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1b3l h ALA 344 CO -0.03 0.67 0.21 0.87 0.00 0.00 0.00 179.25 180.98 1b3l h LYS 345 N 1.14 0.98 -0.66 0.00 1.57 -0.85 -2.16 116.57 116.60 1b3l h LYS 345 Ca 0.25 -0.20 0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1b3l h LYS 345 Cb 0.27 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.40 1b3l h LYS 345 CO -0.01 0.85 0.43 -0.22 -0.57 0.00 0.00 179.45 179.93 1b3l h LYS 346 N 0.91 0.84 -0.32 3.15 3.64 -1.23 -1.82 116.57 121.74 1b3l h LYS 346 Ca 0.21 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 1b3l h LYS 346 Cb 0.27 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1b3l h LYS 346 CO -0.01 0.55 0.13 -0.07 -2.27 0.00 0.00 179.45 177.78 1b3l h LEU 347 N 0.86 0.44 -0.21 5.20 3.38 -1.20 -1.77 115.31 122.01 1b3l h LEU 347 Ca 0.25 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1b3l h LEU 347 Cb -0.06 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1b3l h LEU 347 CO -0.07 0.48 0.11 -0.07 0.09 0.00 0.00 178.44 178.98 1b3l h LEU 348 N 0.36 0.27 -0.72 1.67 3.38 -1.23 -2.50 115.31 116.55 1b3l h LEU 348 Ca 0.11 -0.10 0.06 0.00 0.09 0.00 0.00 57.88 58.03 1b3l h LEU 348 Cb 0.18 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.80 1b3l h LEU 348 CO -0.01 0.29 0.42 0.00 0.09 0.00 0.00 178.44 179.23 1b3l h ALA 349 N 0.99 0.97 0.00 1.53 0.00 -1.22 -0.80 119.26 120.72 1b3l h ALA 349 Ca 0.07 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1b3l h ALA 349 Cb 0.09 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1b3l h ALA 349 CO -0.01 0.12 -0.17 1.49 0.00 0.00 0.00 179.25 180.68 1b3l h GLU 350 N 0.77 0.00 -0.21 0.00 4.81 -1.17 -0.92 114.58 117.86 1b3l h GLU 350 Ca 0.32 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.55 1b3l h GLU 350 Cb 0.17 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.55 1b3l h GLU 350 CO -0.17 0.17 0.00 0.00 -0.73 0.00 0.00 179.01 178.27 1b3l n ALA 351 N -2.30 2.49 -0.53 2.92 0.00 -0.52 -4.90 120.51 117.66 1b3l n ALA 351 Ca -0.01 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 52.99 1b3l n ALA 351 Cb 0.29 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.71 1b3l n ALA 351 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b3l n GLY 352 N 0.94 0.73 3.42 0.00 0.00 -0.35 -5.06 105.19 104.89 1b3l n GLY 352 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1b3l n GLY 352 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1b3l s PHE 353 N -2.02 2.92 0.14 1.61 0.08 -0.42 -4.97 117.98 115.32 1b3l s PHE 353 Ca 0.00 -0.51 0.02 0.00 0.12 0.00 0.00 56.93 56.56 1b3l s PHE 353 Cb 0.00 -1.92 -0.01 0.00 -0.57 0.00 0.00 43.02 40.52 1b3l s PHE 353 CO 0.00 -0.16 0.09 0.25 -0.10 0.00 0.00 175.22 175.30 1b3l n THR 354 N 3.63 0.00 -1.18 0.64 -2.24 -1.07 -2.97 114.28 111.09 1b3l n THR 354 Ca -0.18 -0.95 -0.30 0.00 -2.27 0.00 0.00 64.05 60.35 1b3l n THR 354 Cb 0.52 0.42 0.13 0.00 -2.10 0.00 0.00 70.33 69.30 1b3l n THR 354 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b3l s ALA 355 N -2.49 1.71 0.00 6.98 0.00 -1.26 -2.09 121.76 124.61 1b3l s ALA 355 Ca 0.13 0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.15 1b3l s ALA 355 Cb 0.01 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.90 1b3l s ALA 355 CO 0.09 -2.23 0.00 -3.47 0.00 0.00 0.00 175.76 170.15 1b3l n ASP 356 N -3.81 0.00 -2.70 0.00 2.03 -1.26 -4.57 116.55 106.23 1b3l n ASP 356 Ca 0.08 0.00 -0.06 0.00 0.52 0.00 0.00 54.79 55.32 1b3l n ASP 356 Cb 0.54 -0.26 0.09 0.00 -0.72 0.00 0.00 41.12 40.78 1b3l n ASP 356 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1b3l n LYS 357 N -1.87 0.61 -3.15 -0.67 2.85 -1.13 -5.16 118.16 109.62 1b3l n LYS 357 Ca 0.00 -1.37 -0.28 0.00 -1.05 0.00 0.00 58.31 55.61 1b3l n LYS 357 Cb 0.00 -0.70 -0.02 0.00 -0.65 0.00 0.00 35.03 33.66 1b3l n LYS 357 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 1b3l s PRO 358 N 0.22 3.63 0.18 -1.58 0.04 -0.89 -2.59 135.00 134.02 1b3l s PRO 358 Ca 0.23 0.08 -0.32 0.00 0.04 0.00 0.00 61.00 61.03 1b3l s PRO 358 Cb 0.28 -2.56 -0.11 0.00 0.04 0.00 0.00 34.50 32.14 1b3l s PRO 358 CO -0.13 0.10 1.74 -1.17 0.04 0.00 0.00 177.00 177.58 1b3l s LEU 359 N -3.88 4.38 -0.03 -3.56 2.96 -1.26 -4.88 118.68 112.42 1b3l s LEU 359 Ca 0.45 2.82 0.04 0.00 -0.22 0.00 0.00 54.13 57.23 1b3l s LEU 359 Cb -0.10 -3.59 -0.01 0.00 0.50 0.00 0.00 46.19 42.99 1b3l s LEU 359 CO 0.33 -0.97 -0.16 -0.89 -1.32 0.00 0.00 176.35 173.34 1b3l s THR 360 N 1.62 1.28 0.25 3.68 2.01 -1.26 -1.82 115.64 121.41 1b3l s THR 360 Ca 0.76 -0.66 -0.17 0.00 0.31 0.00 0.00 61.69 61.93 1b3l s THR 360 Cb -0.48 -1.09 0.01 0.00 0.01 0.00 0.00 72.50 70.95 1b3l s THR 360 CO 0.33 0.37 0.58 0.72 -0.69 0.00 0.00 174.62 175.93 1b3l s PHE 361 N -0.15 0.09 -0.08 4.92 -0.71 -0.65 -4.99 117.98 116.40 1b3l s PHE 361 Ca 0.01 -0.49 -0.13 0.00 -1.04 0.00 0.00 56.93 55.29 1b3l s PHE 361 Cb -0.09 0.42 -0.05 0.00 -1.21 0.00 0.00 43.02 42.10 1b3l s PHE 361 CO 0.01 -1.08 0.31 -0.51 -1.34 0.00 0.00 175.22 172.60 1b3l s ASP 362 N -2.96 6.59 -0.28 1.98 1.01 -1.26 -1.23 116.67 120.53 1b3l s ASP 362 Ca 0.16 0.70 -0.04 0.00 0.71 0.00 0.00 52.55 54.09 1b3l s ASP 362 Cb -0.03 -2.19 0.02 0.00 1.01 0.00 0.00 42.92 41.74 1b3l s ASP 362 CO 0.07 0.27 0.00 -0.22 0.21 0.00 0.00 175.17 175.51 1b3l s LEU 363 N -0.58 3.58 -0.12 1.23 2.96 -0.14 -2.75 118.68 122.86 1b3l s LEU 363 Ca 0.19 -0.90 -0.14 0.00 -0.22 0.00 0.00 54.13 53.06 1b3l s LEU 363 Cb -0.14 -1.75 -0.05 0.00 0.50 0.00 0.00 46.19 44.75 1b3l s LEU 363 CO 0.08 -0.18 0.33 -0.22 -1.32 0.00 0.00 176.35 175.04 1b3l s LEU 364 N 1.37 4.30 0.06 -0.68 2.96 0.41 -0.52 118.68 126.58 1b3l s LEU 364 Ca -0.00 0.64 -0.00 0.00 -0.22 0.00 0.00 54.13 54.55 1b3l s LEU 364 Cb -0.17 -2.44 -0.04 0.00 0.50 0.00 0.00 46.19 44.03 1b3l s LEU 364 CO -0.01 0.15 -0.04 -0.72 -1.32 0.00 0.00 176.35 174.41 1b3l s TYR 365 N 0.09 0.56 -0.10 5.38 1.13 -0.34 -0.44 117.35 123.63 1b3l s TYR 365 Ca 0.19 -1.00 -0.18 0.00 -1.41 0.00 0.00 57.07 54.68 1b3l s TYR 365 Cb -0.14 -0.40 -0.04 0.00 -1.10 0.00 0.00 41.96 40.28 1b3l s TYR 365 CO 0.07 -0.32 0.47 0.54 -2.51 0.00 0.00 175.55 173.79 1b3l s ASN 366 N -2.81 6.71 -0.03 -0.18 4.22 -1.26 -1.69 114.94 119.90 1b3l s ASN 366 Ca 0.06 0.84 -0.40 0.00 -2.14 0.00 0.00 52.86 51.22 1b3l s ASN 366 Cb 0.06 -2.28 -0.20 0.00 1.28 0.00 0.00 41.25 40.11 1b3l s ASN 366 CO -0.08 0.04 1.09 0.41 -2.04 0.00 0.00 177.10 176.52 1b3l n THR 367 N 3.41 0.00 -3.64 0.54 -1.04 -0.34 -4.81 114.28 108.39 1b3l n THR 367 Ca -0.08 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.91 1b3l n THR 367 Cb 0.52 -0.03 -0.03 0.00 -1.82 0.00 0.00 70.33 68.96 1b3l n THR 367 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1b3l s SER 368 N 0.19 -0.02 0.07 8.00 0.15 -1.26 -4.80 113.70 116.03 1b3l s SER 368 Ca 0.91 0.02 -0.08 0.00 0.70 0.00 0.00 55.95 57.49 1b3l s SER 368 Cb -1.27 0.02 -0.28 0.00 -1.71 0.00 0.00 66.02 62.78 1b3l s SER 368 CO 0.58 -0.02 1.12 0.44 1.20 0.00 0.00 173.24 176.55 1b3l h ASP 369 N 2.02 0.58 -0.09 5.45 3.32 -1.92 -3.21 116.42 122.58 1b3l h ASP 369 Ca -0.06 -0.60 -0.02 0.00 0.02 0.00 0.00 57.03 56.37 1b3l h ASP 369 Cb 1.17 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 40.53 1b3l h ASP 369 CO 0.21 1.45 -0.02 0.25 -1.72 0.00 0.00 179.24 179.41 1b3l h LEU 370 N 0.12 0.17 -0.60 1.55 5.85 -1.90 -2.92 115.31 117.58 1b3l h LEU 370 Ca -0.16 -0.37 -0.10 0.00 0.84 0.00 0.00 57.88 58.08 1b3l h LEU 370 Cb 1.98 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.94 1b3l h LEU 370 CO 0.22 0.50 -0.04 0.45 -0.34 0.00 0.00 178.44 179.23 1b3l h HIS 371 N -0.16 1.17 0.20 1.25 3.86 -1.88 -1.78 115.15 117.81 1b3l h HIS 371 Ca 0.02 -0.22 0.01 0.00 -1.16 0.00 0.00 60.37 59.03 1b3l h HIS 371 Cb 0.42 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.57 1b3l h HIS 371 CO 0.05 1.04 -0.28 -0.22 0.86 0.00 0.00 177.93 179.38 1b3l h LYS 372 N 0.96 -0.53 -0.52 2.45 1.63 -1.64 -0.29 116.57 118.63 1b3l h LYS 372 Ca 0.16 0.04 0.09 0.00 -0.85 0.00 0.00 60.65 60.09 1b3l h LYS 372 Cb 0.60 0.12 -0.08 0.00 -0.60 0.00 0.00 32.23 32.28 1b3l h LYS 372 CO 0.04 -0.35 0.09 -0.22 -3.45 0.00 0.00 179.45 175.56 1b3l h LYS 373 N -0.55 0.22 -0.41 1.90 3.11 -1.38 0.10 116.57 119.56 1b3l h LYS 373 Ca 0.01 -0.01 -0.11 0.00 -2.81 0.00 0.00 60.65 57.73 1b3l h LYS 373 Cb 0.54 -0.05 -0.02 0.00 -1.00 0.00 0.00 32.23 31.71 1b3l h LYS 373 CO -0.11 0.14 -0.18 -0.07 -2.81 0.00 0.00 179.45 176.42 1b3l h LEU 374 N 0.22 0.78 -0.71 5.20 3.38 -1.20 -2.37 115.31 120.60 1b3l h LEU 374 Ca 0.27 -0.26 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1b3l h LEU 374 Cb 0.37 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1b3l h LEU 374 CO -0.36 0.96 0.18 0.00 0.09 0.00 0.00 178.44 179.30 1b3l h ALA 375 N 1.11 0.94 -0.35 1.53 0.00 -0.48 0.12 119.26 122.14 1b3l h ALA 375 Ca 0.10 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.63 1b3l h ALA 375 Cb 0.67 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1b3l h ALA 375 CO 0.05 0.67 -0.32 0.82 0.00 0.00 0.00 179.25 180.46 1b3l h ILE 376 N 1.08 1.28 -0.51 0.00 2.04 -0.66 -2.38 117.51 118.36 1b3l h ILE 376 Ca 0.22 -1.49 -0.07 0.00 1.00 0.00 0.00 64.86 64.52 1b3l h ILE 376 Cb 0.37 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 1b3l h ILE 376 CO 0.00 0.49 0.04 0.00 0.00 0.00 0.00 178.15 178.68 1b3l h ALA 377 N 0.75 0.68 -0.68 1.87 0.00 -1.14 -2.74 119.26 118.01 1b3l h ALA 377 Ca 0.06 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 1b3l h ALA 377 Cb 0.91 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1b3l h ALA 377 CO 0.08 0.46 0.24 0.28 0.00 0.00 0.00 179.25 180.31 1b3l h VAL 378 N 0.75 1.25 -1.00 0.00 2.07 -0.72 -2.49 116.25 116.11 1b3l h VAL 378 Ca 0.15 -0.81 0.03 0.00 0.82 0.00 0.00 66.70 66.89 1b3l h VAL 378 Cb 0.46 0.51 -0.06 0.00 -1.52 0.00 0.00 31.29 30.69 1b3l h VAL 378 CO 0.02 0.32 0.65 0.00 0.02 0.00 0.00 177.57 178.58 1b3l h ALA 379 N 1.10 1.34 0.00 1.67 0.00 -1.31 -1.67 119.26 120.40 1b3l h ALA 379 Ca 0.22 -0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.90 1b3l h ALA 379 Cb 0.25 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1b3l h ALA 379 CO -0.01 0.58 -0.84 0.66 0.00 0.00 0.00 179.25 179.64 1b3l h SER 380 N 1.28 0.06 -0.09 0.00 4.64 -1.42 -1.48 113.55 116.54 1b3l h SER 380 Ca 0.39 -0.05 -0.16 0.00 -0.47 0.00 0.00 61.79 61.50 1b3l h SER 380 Cb -0.04 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.03 1b3l h SER 380 CO -0.11 0.87 -0.50 0.40 -0.87 0.00 0.00 176.83 176.61 1b3l h ILE 381 N 0.02 1.30 -0.17 0.95 2.04 -1.03 -1.18 117.51 119.46 1b3l h ILE 381 Ca -0.02 -1.72 -0.07 0.00 1.00 0.00 0.00 64.86 64.06 1b3l h ILE 381 Cb 1.47 1.66 -0.00 0.00 -0.74 0.00 0.00 36.82 39.21 1b3l h ILE 381 CO 0.11 0.54 -0.16 -0.50 0.00 0.00 0.00 178.15 178.15 1b3l h TRP 382 N 0.51 0.48 -0.34 1.37 6.55 -1.32 0.35 115.95 123.56 1b3l h TRP 382 Ca 0.02 -0.14 0.06 0.00 0.95 0.00 0.00 58.89 59.78 1b3l h TRP 382 Cb 1.06 -0.10 -0.06 0.00 -0.86 0.00 0.00 29.16 29.20 1b3l h TRP 382 CO 0.05 0.78 -0.03 -0.22 -1.05 0.00 0.00 178.44 177.96 1b3l h LYS 383 N 0.05 0.06 -0.15 0.49 1.63 -1.26 0.00 116.57 117.39 1b3l h LYS 383 Ca 0.03 -0.00 -0.18 0.00 -0.85 0.00 0.00 60.65 59.64 1b3l h LYS 383 Cb 0.69 -0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 32.31 1b3l h LYS 383 CO 0.04 0.04 -0.65 -0.22 -3.45 0.00 0.00 179.45 175.20 1b3l h LYS 384 N 0.06 0.56 0.00 1.90 3.11 -1.09 0.36 116.57 121.48 1b3l h LYS 384 Ca 0.16 -0.41 0.00 0.00 -2.81 0.00 0.00 60.65 57.60 1b3l h LYS 384 Cb 0.24 0.07 0.00 0.00 -1.00 0.00 0.00 32.23 31.53 1b3l h LYS 384 CO -0.30 1.03 -0.95 0.09 -2.81 0.00 0.00 179.45 176.50 1b3l n ASN 385 N -3.91 0.64 0.00 4.20 3.02 0.10 -4.56 115.26 114.74 1b3l n ASN 385 Ca -0.04 -0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.44 1b3l n ASN 385 Cb 0.67 0.64 0.00 0.00 -0.61 0.00 0.00 39.78 40.48 1b3l n ASN 385 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1b3l n LEU 386 N -2.07 0.00 0.00 3.41 4.77 -0.04 -4.79 117.00 118.27 1b3l n LEU 386 Ca 0.02 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1b3l n LEU 386 Cb 0.45 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 1b3l n LEU 386 CO 0.39 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 1b3l n GLY 387 N 0.28 0.43 3.87 -0.72 0.00 0.12 -4.89 105.19 104.28 1b3l n GLY 387 Ca 0.00 -0.62 -0.31 0.00 0.00 0.00 0.00 46.02 45.09 1b3l n GLY 387 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b3l s VAL 388 N -2.00 4.73 -0.23 1.61 -7.23 -1.22 -4.71 120.40 111.35 1b3l s VAL 388 Ca 0.00 0.76 -0.05 0.00 -1.81 0.00 0.00 61.98 60.88 1b3l s VAL 388 Cb 0.00 -3.71 -0.02 0.00 0.56 0.00 0.00 36.38 33.22 1b3l s VAL 388 CO 0.00 -0.48 -0.01 0.20 -0.31 0.00 0.00 175.10 174.50 1b3l s ASN 389 N -2.98 4.59 -0.10 4.85 0.01 -0.76 -3.60 114.94 116.95 1b3l s ASN 389 Ca 0.53 -0.32 0.03 0.00 -0.71 0.00 0.00 52.86 52.39 1b3l s ASN 389 Cb -0.10 -1.80 -0.01 0.00 0.41 0.00 0.00 41.25 39.75 1b3l s ASN 389 CO 0.29 -0.01 -0.19 0.54 -1.51 0.00 0.00 177.10 176.21 1b3l s VAL 390 N 1.46 2.50 -0.33 1.60 0.11 -1.26 -1.64 120.40 122.84 1b3l s VAL 390 Ca 0.05 -0.87 -0.18 0.00 -2.93 0.00 0.00 61.98 58.05 1b3l s VAL 390 Cb -0.15 -1.99 -0.01 0.00 -1.53 0.00 0.00 36.38 32.71 1b3l s VAL 390 CO -0.01 0.55 0.52 0.20 -3.33 0.00 0.00 175.10 173.03 1b3l s ASN 391 N 0.14 6.34 0.34 3.54 0.02 -0.36 -4.94 114.94 120.03 1b3l s ASN 391 Ca -0.10 0.11 -0.27 0.00 -1.02 0.00 0.00 52.86 51.58 1b3l s ASN 391 Cb -0.16 -2.27 -0.09 0.00 0.02 0.00 0.00 41.25 38.75 1b3l s ASN 391 CO 0.06 -0.44 1.10 -0.76 0.02 0.00 0.00 177.10 177.09 1b3l s LEU 392 N 2.39 4.37 -0.08 0.60 1.02 -1.26 -0.97 118.68 124.75 1b3l s LEU 392 Ca 0.19 2.23 -0.04 0.00 0.02 0.00 0.00 54.13 56.53 1b3l s LEU 392 Cb -0.15 -3.86 0.04 0.00 0.02 0.00 0.00 46.19 42.24 1b3l s LEU 392 CO 0.12 -0.35 0.19 -0.70 0.02 0.00 0.00 176.35 175.63 1b3l s GLU 393 N -1.90 0.16 0.06 1.70 2.12 0.32 -4.88 118.70 116.27 1b3l s GLU 393 Ca 0.51 0.40 0.09 0.00 0.36 0.00 0.00 54.97 56.33 1b3l s GLU 393 Cb -0.29 -0.10 -0.03 0.00 0.26 0.00 0.00 34.13 33.97 1b3l s GLU 393 CO 0.37 -0.13 -0.25 0.54 -0.54 0.00 0.00 175.26 175.25 1b3l s ASN 394 N 0.96 2.99 0.02 -1.70 4.22 -1.26 -1.20 114.94 118.97 1b3l s ASN 394 Ca -0.07 -0.60 -0.00 0.00 -2.14 0.00 0.00 52.86 50.04 1b3l s ASN 394 Cb -0.09 -0.25 -0.02 0.00 1.28 0.00 0.00 41.25 42.18 1b3l s ASN 394 CO -0.05 0.21 -0.02 -1.10 -2.04 0.00 0.00 177.10 174.10 1b3l s GLN 395 N -1.38 0.26 0.58 3.55 -0.21 -0.68 -4.92 119.66 116.86 1b3l s GLN 395 Ca 0.11 -0.49 -0.19 0.00 0.02 0.00 0.00 55.36 54.81 1b3l s GLN 395 Cb -0.10 0.09 -0.04 0.00 1.00 0.00 0.00 33.01 33.97 1b3l s GLN 395 CO 0.03 -0.04 1.22 -1.21 -2.12 0.00 0.00 175.29 173.16 1b3l s GLU 396 N -1.19 3.01 0.15 2.91 2.02 -1.26 -1.20 118.70 123.14 1b3l s GLU 396 Ca -0.13 1.86 -0.21 0.00 0.02 0.00 0.00 54.97 56.51 1b3l s GLU 396 Cb -0.08 -1.97 0.05 0.00 0.10 0.00 0.00 34.13 32.22 1b3l s GLU 396 CO -0.01 -1.18 1.25 1.87 0.02 0.00 0.00 175.26 177.21 1b3l n TRP 397 N -1.50 -0.20 0.16 1.61 -0.00 -1.26 -1.20 117.44 115.04 1b3l n TRP 397 Ca 0.13 1.01 0.00 0.00 -0.00 0.00 0.00 57.50 58.64 1b3l n TRP 397 Cb 0.49 -0.66 0.24 0.00 -0.00 0.00 0.00 31.31 31.38 1b3l n TRP 397 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 177.69 179.26 1b3l h LYS 398 N 0.00 0.00 -0.12 5.87 2.10 -1.92 -1.97 116.57 120.53 1b3l h LYS 398 Ca 0.19 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.67 1b3l h LYS 398 Cb 0.39 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.73 1b3l h LYS 398 CO -0.78 0.52 -0.60 1.15 -2.00 0.00 0.00 179.45 177.74 1b3l h THR 399 N 0.00 1.33 -0.22 0.07 2.02 -1.75 -2.72 112.91 111.64 1b3l h THR 399 Ca -0.01 -1.88 0.05 0.00 0.77 0.00 0.00 66.41 65.35 1b3l h THR 399 Cb 0.94 2.11 -0.06 0.00 -1.74 0.00 0.00 68.15 69.41 1b3l h THR 399 CO 0.07 0.58 -0.14 0.15 0.37 0.00 0.00 175.52 176.54 1b3l h PHE 400 N 0.28 -0.36 -0.77 3.16 3.57 -0.98 -0.84 116.94 121.00 1b3l h PHE 400 Ca -0.04 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.44 1b3l h PHE 400 Cb 1.24 0.19 -0.03 0.00 2.79 0.00 0.00 35.95 40.14 1b3l h PHE 400 CO 0.10 -0.21 0.29 -0.07 -2.23 0.00 0.00 178.31 176.19 1b3l h LEU 401 N -0.14 1.07 -0.89 0.59 3.38 -1.41 -2.36 115.31 115.56 1b3l h LEU 401 Ca 0.12 -0.17 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 1b3l h LEU 401 Cb 0.32 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1b3l h LEU 401 CO -0.30 0.96 -0.20 -0.78 0.09 0.00 0.00 178.44 178.21 1b3l h ASP 402 N 1.12 0.59 -0.52 -0.43 3.58 -1.06 -2.59 116.42 117.11 1b3l h ASP 402 Ca 0.25 -0.19 -0.01 0.00 0.42 0.00 0.00 57.03 57.51 1b3l h ASP 402 Cb 0.24 -0.16 -0.03 0.00 1.72 0.00 0.00 39.33 41.10 1b3l h ASP 402 CO -0.02 0.80 0.31 0.74 -2.88 0.00 0.00 179.24 178.19 1b3l h THR 403 N 0.53 1.17 -0.56 2.25 2.02 -1.08 -0.63 112.91 116.60 1b3l h THR 403 Ca 0.08 -0.39 -0.07 0.00 0.77 0.00 0.00 66.41 66.81 1b3l h THR 403 Cb 0.64 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.50 1b3l h THR 403 CO 0.05 0.17 0.08 0.03 0.37 0.00 0.00 175.52 176.22 1b3l h ARG 404 N 0.70 0.89 -0.55 6.66 3.08 -1.08 -0.78 114.38 123.30 1b3l h ARG 404 Ca 0.19 -0.21 -0.10 0.00 0.07 0.00 0.00 59.98 59.92 1b3l h ARG 404 Cb 0.01 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 1b3l h ARG 404 CO -0.03 0.83 -0.05 0.45 -1.07 0.00 0.00 179.97 180.10 1b3l h HIS 405 N 0.84 1.09 0.00 3.04 3.86 -1.20 -2.45 115.15 120.34 1b3l h HIS 405 Ca 0.17 -0.20 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1b3l h HIS 405 Cb 0.38 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 28.57 1b3l h HIS 405 CO 0.02 0.99 0.00 1.04 0.86 0.00 0.00 177.93 180.84 1b3l n GLN 406 N -4.17 0.12 -1.29 2.45 6.02 -0.27 -4.93 117.38 115.31 1b3l n GLN 406 Ca 0.02 0.17 -0.04 0.00 -0.01 0.00 0.00 57.00 57.14 1b3l n GLN 406 Cb 0.36 -1.66 -0.02 0.00 1.02 0.00 0.00 30.24 29.95 1b3l n GLN 406 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1b3l n GLY 407 N 1.03 0.62 2.74 1.08 0.00 -0.34 -4.95 105.19 105.37 1b3l n GLY 407 Ca 0.05 -0.85 -0.35 0.00 0.00 0.00 0.00 46.02 44.88 1b3l n GLY 407 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1b3l n THR 408 N -3.07 3.50 -4.00 2.61 -2.24 -1.15 -4.87 114.28 105.06 1b3l n THR 408 Ca -0.04 -3.77 -0.10 0.00 -2.27 0.00 0.00 64.05 57.87 1b3l n THR 408 Cb 0.21 -1.39 -0.07 0.00 -2.10 0.00 0.00 70.33 66.98 1b3l n THR 408 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1b3l s PHE 409 N -3.10 0.49 -0.04 4.78 -0.71 -1.26 -4.99 117.98 113.15 1b3l s PHE 409 Ca 0.55 -0.83 -0.04 0.00 -1.04 0.00 0.00 56.93 55.57 1b3l s PHE 409 Cb 0.42 -0.03 -0.01 0.00 -1.21 0.00 0.00 43.02 42.18 1b3l s PHE 409 CO -0.34 -0.81 -0.09 -0.25 -1.34 0.00 0.00 175.22 172.40 1b3l n ASP 410 N -0.29 0.52 -3.99 1.98 8.00 -1.26 -4.74 116.55 116.78 1b3l n ASP 410 Ca -0.04 0.09 -0.20 0.00 0.71 0.00 0.00 54.79 55.35 1b3l n ASP 410 Cb 0.63 -0.50 -0.15 0.00 -0.02 0.00 0.00 41.12 41.07 1b3l n ASP 410 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1b3l s VAL 411 N -1.51 0.75 0.06 2.53 1.01 -1.11 -1.53 120.40 120.59 1b3l s VAL 411 Ca -0.07 -0.33 0.06 0.00 0.00 0.00 0.00 61.98 61.63 1b3l s VAL 411 Cb 0.01 -0.67 -0.03 0.00 0.00 0.00 0.00 36.38 35.69 1b3l s VAL 411 CO 0.11 0.24 -0.16 0.00 0.00 0.00 0.00 175.10 175.29 1b3l s ALA 412 N 0.25 1.31 0.41 5.51 0.00 0.20 -0.44 121.76 128.99 1b3l s ALA 412 Ca -0.04 -0.95 -0.25 0.00 0.00 0.00 0.00 51.96 50.72 1b3l s ALA 412 Cb -0.09 -0.18 -0.08 0.00 0.00 0.00 0.00 23.12 22.77 1b3l s ALA 412 CO 0.00 0.24 1.20 0.50 0.00 0.00 0.00 175.76 177.71 1b3l s ARG 413 N -1.40 3.97 0.18 0.00 3.00 0.41 0.96 118.95 126.08 1b3l s ARG 413 Ca 0.02 1.91 -0.13 0.00 -1.00 0.00 0.00 55.73 56.53 1b3l s ARG 413 Cb -0.09 -2.65 0.01 0.00 0.00 0.00 0.00 34.95 32.22 1b3l s ARG 413 CO 0.02 -0.41 0.41 0.00 0.00 0.00 0.00 175.30 175.32 1b3l s ALA 414 N -1.39 -0.46 -0.13 6.12 0.00 0.30 -4.77 121.76 121.42 1b3l s ALA 414 Ca 0.58 -0.57 -0.11 0.00 0.00 0.00 0.00 51.96 51.86 1b3l s ALA 414 Cb -0.32 0.86 0.04 0.00 0.00 0.00 0.00 23.12 23.70 1b3l s ALA 414 CO 0.41 -0.73 0.35 0.20 0.00 0.00 0.00 175.76 175.98 1b3l s GLY 415 N -2.93 -0.26 -0.06 0.00 0.00 -1.26 -1.36 107.32 101.46 1b3l s GLY 415 Ca 0.14 1.07 0.01 0.00 0.00 0.00 0.00 44.72 45.94 1b3l s GLY 415 CO -0.01 1.02 -0.05 0.86 0.00 0.00 0.00 173.10 174.92 1b3l s TRP 416 N 0.50 0.91 -0.02 1.90 -0.11 -0.96 -4.98 118.94 116.18 1b3l s TRP 416 Ca -0.03 -0.30 0.03 0.00 1.22 0.00 0.00 56.10 57.03 1b3l s TRP 416 Cb -0.04 -0.79 -0.03 0.00 -1.50 0.00 0.00 33.47 31.10 1b3l s TRP 416 CO -0.03 -0.25 -0.09 0.00 -4.62 0.00 0.00 176.95 171.96 1b3l n ALA 418 N 1.85 0.68 -0.06 0.00 0.00 -0.27 -4.92 120.51 117.79 1b3l n ALA 418 Ca -0.16 0.05 -0.05 0.00 0.00 0.00 0.00 53.44 53.28 1b3l n ALA 418 Cb 0.53 -2.20 -0.15 0.00 0.00 0.00 0.00 19.45 17.62 1b3l n ALA 418 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1b3l n ASP 419 N -0.95 0.17 -3.80 0.00 8.00 -1.26 -4.96 116.55 113.75 1b3l n ASP 419 Ca 0.13 0.08 -0.12 0.00 0.71 0.00 0.00 54.79 55.58 1b3l n ASP 419 Cb 0.46 1.02 -0.09 0.00 -0.02 0.00 0.00 41.12 42.49 1b3l n ASP 419 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1b3l s TYR 420 N -2.75 -0.09 -1.04 1.24 1.13 -1.26 -4.69 117.35 109.90 1b3l s TYR 420 Ca -0.08 0.10 -0.20 0.00 -1.41 0.00 0.00 57.07 55.48 1b3l s TYR 420 Cb 0.08 0.04 0.10 0.00 -1.10 0.00 0.00 41.96 41.08 1b3l s TYR 420 CO 0.84 -0.36 1.35 1.21 -2.51 0.00 0.00 175.55 176.08 1b3l s ASN 421 N -1.39 6.66 -0.25 -0.18 3.84 -1.26 -4.65 114.94 117.71 1b3l s ASN 421 Ca -0.14 -1.99 -0.26 0.00 0.21 0.00 0.00 52.86 50.68 1b3l s ASN 421 Cb -0.06 -2.48 0.13 0.00 -0.55 0.00 0.00 41.25 38.29 1b3l s ASN 421 CO 0.03 -1.20 1.04 -0.70 -2.79 0.00 0.00 177.10 173.48 1b3l s GLU 422 N 3.54 0.51 0.61 0.43 -6.30 -1.26 -4.41 118.70 111.82 1b3l s GLU 422 Ca 0.41 0.44 0.31 0.00 -2.50 0.00 0.00 54.97 53.63 1b3l s GLU 422 Cb -0.02 0.24 1.76 0.00 0.00 0.00 0.00 34.13 36.12 1b3l s GLU 422 CO -0.07 -0.09 2.13 -1.35 0.02 0.00 0.00 175.26 175.90 1b3l h PRO 423 N 3.68 0.00 0.00 4.30 0.11 -1.90 -2.49 132.00 135.70 1b3l h PRO 423 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1b3l h PRO 423 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1b3l h PRO 423 CO 0.17 0.00 0.00 1.79 -0.21 0.00 0.00 178.00 179.75 1b3l h THR 424 N 0.00 0.00 -0.27 -1.15 1.35 -1.96 -1.82 112.91 109.06 1b3l h THR 424 Ca 0.06 -0.49 0.01 0.00 -0.55 0.00 0.00 66.41 65.44 1b3l h THR 424 Cb 0.42 1.42 -0.01 0.00 -1.73 0.00 0.00 68.15 68.25 1b3l h THR 424 CO -0.00 0.00 0.18 -1.28 -0.25 0.00 0.00 175.52 174.17 1b3l h SER 425 N 0.00 0.30 0.00 5.36 0.87 -1.71 -0.07 113.55 118.30 1b3l h SER 425 Ca 0.00 -0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.51 1b3l h SER 425 Cb 0.53 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 1b3l h SER 425 CO 0.00 0.22 -0.55 -0.26 -0.53 0.00 0.00 176.83 175.71 1b3l h PHE 426 N 0.36 0.00 -0.29 2.24 -1.00 -1.68 -3.42 116.94 113.15 1b3l h PHE 426 Ca 0.10 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.86 1b3l h PHE 426 Cb -0.02 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.52 1b3l h PHE 426 CO -0.00 0.35 0.10 -0.07 -1.61 0.00 0.00 178.31 177.08 1b3l h LEU 427 N -1.00 0.37 -2.27 1.54 3.38 -1.24 -1.89 115.31 114.21 1b3l h LEU 427 Ca -0.07 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 1b3l h LEU 427 Cb 0.61 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 1b3l h LEU 427 CO -0.04 0.36 -0.02 0.78 0.09 0.00 0.00 178.44 179.61 1b3l h ASN 428 N 0.41 0.00 0.72 -0.43 2.35 -1.27 -2.29 115.58 115.07 1b3l h ASN 428 Ca 0.10 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 1b3l h ASN 428 Cb 0.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.49 1b3l h ASN 428 CO -0.01 0.02 0.00 0.35 -1.65 0.00 0.00 177.43 176.14 1b3l n THR 429 N -3.21 0.79 0.60 2.81 -2.24 -0.71 -3.02 114.28 109.30 1b3l n THR 429 Ca -0.02 0.17 0.12 0.00 -2.27 0.00 0.00 64.05 62.05 1b3l n THR 429 Cb 0.18 -0.96 0.16 0.00 -2.10 0.00 0.00 70.33 67.61 1b3l n THR 429 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1b3l n MET 430 N -1.81 2.38 -2.04 -0.78 2.81 -0.86 -3.31 117.12 113.50 1b3l n MET 430 Ca 0.04 -2.10 -0.39 0.00 -1.81 0.00 0.00 57.70 53.44 1b3l n MET 430 Cb 0.23 -1.48 0.00 0.00 -0.71 0.00 0.00 33.22 31.27 1b3l n MET 430 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1b3l s LEU 431 N -1.69 4.08 0.42 4.03 1.02 -1.17 -4.75 118.68 120.62 1b3l s LEU 431 Ca 0.33 2.59 0.13 0.00 0.02 0.00 0.00 54.13 57.20 1b3l s LEU 431 Cb 0.21 -4.08 0.98 0.00 0.02 0.00 0.00 46.19 43.33 1b3l s LEU 431 CO 0.30 -1.03 1.95 0.77 0.02 0.00 0.00 176.35 178.36 1b3l h SER 432 N 2.23 0.43 -0.46 2.29 4.64 -1.88 -1.40 113.55 119.42 1b3l h SER 432 Ca -0.50 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1b3l h SER 432 Cb 1.26 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1b3l h SER 432 CO 0.61 0.25 0.00 -0.90 -0.87 0.00 0.00 176.83 175.92 1b3l n ASP 433 N -4.48 4.30 -4.77 4.97 5.75 -1.26 -4.90 116.55 116.17 1b3l n ASP 433 Ca 0.12 -2.63 -0.38 0.00 -0.01 0.00 0.00 54.79 51.88 1b3l n ASP 433 Cb 0.41 -0.52 -0.03 0.00 -1.03 0.00 0.00 41.12 39.94 1b3l n ASP 433 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1b3l s SER 434 N -1.25 6.84 0.44 -1.12 0.15 -0.53 -4.91 113.70 113.32 1b3l s SER 434 Ca 0.44 2.22 0.29 0.00 0.70 0.00 0.00 55.95 59.61 1b3l s SER 434 Cb 0.31 -2.61 1.12 0.00 -1.71 0.00 0.00 66.02 63.13 1b3l s SER 434 CO 0.16 -0.44 1.86 0.77 1.20 0.00 0.00 173.24 176.79 1b3l h SER 435 N 2.97 0.00 -0.13 5.45 4.64 -1.90 -1.71 113.55 122.87 1b3l h SER 435 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1b3l h SER 435 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1b3l h SER 435 CO 0.64 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 177.19 1b3l n ASN 436 N -2.81 1.92 -4.57 4.97 4.13 -1.25 -4.77 115.26 112.88 1b3l n ASN 436 Ca 0.02 -1.70 -0.42 0.00 1.68 0.00 0.00 54.58 54.15 1b3l n ASN 436 Cb 0.32 -0.08 -0.01 0.00 -1.54 0.00 0.00 39.78 38.47 1b3l n ASN 436 CO 0.00 0.00 0.00 0.21 0.28 0.00 0.00 177.26 177.75 1b3l s ASN 437 N -1.73 6.71 0.00 6.41 3.84 -0.64 -4.69 114.94 124.84 1b3l s ASN 437 Ca 0.34 -2.07 0.28 0.00 0.21 0.00 0.00 52.86 51.62 1b3l s ASN 437 Cb 0.19 -2.57 0.99 0.00 -0.55 0.00 0.00 41.25 39.31 1b3l s ASN 437 CO 0.29 -1.30 1.73 0.35 -2.79 0.00 0.00 177.10 175.39 1b3l n THR 438 N 6.57 0.00 0.39 -5.21 -2.24 -1.26 -3.09 114.28 109.44 1b3l n THR 438 Ca 0.43 -0.03 0.13 0.00 -2.27 0.00 0.00 64.05 62.31 1b3l n THR 438 Cb 0.48 -0.07 0.37 0.00 -2.10 0.00 0.00 70.33 69.00 1b3l n THR 438 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b3l h ALA 439 N 3.27 1.00 -5.53 6.98 0.00 -1.83 -3.46 119.26 119.69 1b3l h ALA 439 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.52 1b3l h ALA 439 Cb 0.45 0.00 0.13 0.00 0.00 0.00 0.00 17.79 18.36 1b3l h ALA 439 CO 0.00 0.00 -0.65 0.72 0.00 0.00 0.00 179.25 179.32 1b3l n HIS 440 N -2.70 -2.70 -3.23 0.00 8.25 -1.18 -1.32 115.22 112.34 1b3l n HIS 440 Ca 0.04 0.93 -0.39 0.00 -0.26 0.00 0.00 57.72 58.04 1b3l n HIS 440 Cb 0.42 -4.85 -0.06 0.00 1.12 0.00 0.00 29.99 26.63 1b3l n HIS 440 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1b3l s TYR 441 N -3.29 3.60 -0.20 4.41 5.04 -1.26 -4.15 117.35 121.49 1b3l s TYR 441 Ca 0.54 1.08 -0.03 0.00 -2.44 0.00 0.00 57.07 56.22 1b3l s TYR 441 Cb -0.24 -2.61 0.06 0.00 0.35 0.00 0.00 41.96 39.53 1b3l s TYR 441 CO 0.67 0.24 0.05 0.15 -1.34 0.00 0.00 175.55 175.32 1b3l s LYS 442 N 0.28 0.54 -0.08 4.97 1.02 -1.26 -4.34 119.74 120.87 1b3l s LYS 442 Ca 0.30 -0.42 -0.01 0.00 0.02 0.00 0.00 55.97 55.86 1b3l s LYS 442 Cb -0.17 -2.01 0.03 0.00 -0.52 0.00 0.00 37.83 35.16 1b3l s LYS 442 CO 0.14 -0.69 0.01 0.45 -0.92 0.00 0.00 175.35 174.34 1b3l s SER 443 N 1.90 1.68 0.37 2.83 0.15 -1.26 -5.01 113.70 114.36 1b3l s SER 443 Ca 0.01 -0.14 0.10 0.00 0.70 0.00 0.00 55.95 56.62 1b3l s SER 443 Cb -0.17 -0.44 0.73 0.00 -1.71 0.00 0.00 66.02 64.43 1b3l s SER 443 CO -0.11 -0.20 1.86 -0.65 1.20 0.00 0.00 173.24 175.34 1b3l h PRO 444 N 8.33 0.14 -0.33 5.44 0.11 -1.99 -0.87 132.00 142.83 1b3l h PRO 444 Ca -0.19 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.81 1b3l h PRO 444 Cb 1.12 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1b3l h PRO 444 CO 0.26 0.39 -0.05 0.00 -0.21 0.00 0.00 178.00 178.40 1b3l h ALA 445 N 1.61 0.45 -0.28 -0.75 0.00 -2.00 -2.10 119.26 116.18 1b3l h ALA 445 Ca 0.02 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1b3l h ALA 445 Cb 0.53 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1b3l h ALA 445 CO 0.04 0.25 0.14 0.35 0.00 0.00 0.00 179.25 180.03 1b3l h PHE 446 N 0.40 0.40 -0.63 0.00 3.57 -1.82 -2.39 116.94 116.47 1b3l h PHE 446 Ca 0.09 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.63 1b3l h PHE 446 Cb 0.53 -0.13 -0.06 0.00 2.79 0.00 0.00 35.95 39.09 1b3l h PHE 446 CO 0.05 0.36 0.33 -0.44 -2.23 0.00 0.00 178.31 176.37 1b3l h ASP 447 N 0.33 0.46 -0.64 0.41 3.32 -1.04 -2.44 116.42 116.82 1b3l h ASP 447 Ca 0.10 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 1b3l h ASP 447 Cb 0.10 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.57 1b3l h ASP 447 CO -0.01 0.30 0.31 0.50 -1.72 0.00 0.00 179.24 178.62 1b3l h LYS 448 N 0.60 0.92 -0.39 3.56 3.11 -1.27 0.11 116.57 123.21 1b3l h LYS 448 Ca 0.29 -0.13 0.05 0.00 -2.81 0.00 0.00 60.65 58.04 1b3l h LYS 448 Cb 0.22 -0.17 -0.04 0.00 -1.00 0.00 0.00 32.23 31.24 1b3l h LYS 448 CO -0.20 0.73 0.13 -0.07 -2.81 0.00 0.00 179.45 177.24 1b3l h LEU 449 N 0.89 0.14 -0.35 5.20 3.38 -1.07 0.56 115.31 124.06 1b3l h LEU 449 Ca 0.22 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.18 1b3l h LEU 449 Cb 0.11 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1b3l h LEU 449 CO -0.03 0.12 0.01 0.40 0.09 0.00 0.00 178.44 179.03 1b3l h ILE 450 N 0.29 1.25 -0.64 1.22 1.08 -1.20 -2.99 117.51 116.53 1b3l h ILE 450 Ca 0.18 -0.94 0.10 0.00 -0.39 0.00 0.00 64.86 63.81 1b3l h ILE 450 Cb 0.16 1.18 -0.07 0.00 -3.07 0.00 0.00 36.82 35.02 1b3l h ILE 450 CO -0.19 0.31 0.25 0.00 -0.69 0.00 0.00 178.15 177.84 1b3l h ALA 451 N 0.87 0.84 0.00 1.87 0.00 -0.25 -1.84 119.26 120.76 1b3l h ALA 451 Ca 0.10 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1b3l h ALA 451 Cb 0.43 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 1b3l h ALA 451 CO 0.02 -0.17 -0.01 -0.44 0.00 0.00 0.00 179.25 178.65 1b3l h ASP 452 N 0.44 0.00 0.70 0.00 3.32 -0.83 -2.79 116.42 117.26 1b3l h ASP 452 Ca 0.32 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.37 1b3l h ASP 452 Cb 0.40 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.95 1b3l h ASP 452 CO -0.31 0.01 0.00 0.71 -1.72 0.00 0.00 179.24 177.93 1b3l h THR 453 N 0.00 0.00 -0.01 0.35 1.35 -1.18 -1.09 112.91 112.33 1b3l h THR 453 Ca -0.00 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.53 1b3l h THR 453 Cb 0.02 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 67.71 1b3l h THR 453 CO 0.00 0.00 -0.29 0.18 -0.25 0.00 0.00 175.52 175.16 1b3l n LEU 454 N -2.93 0.98 -0.00 3.87 4.77 -1.05 -4.13 117.00 118.52 1b3l n LEU 454 Ca -0.00 -0.24 0.09 0.00 -0.03 0.00 0.00 56.01 55.83 1b3l n LEU 454 Cb 0.23 -0.13 -0.11 0.00 -2.33 0.00 0.00 43.42 41.07 1b3l n LEU 454 CO 0.24 0.19 -0.09 0.29 -1.33 0.00 0.00 177.39 176.69 1b3l n LYS 455 N -0.74 0.47 -2.02 3.23 5.02 -0.43 -4.63 118.16 119.06 1b3l n LYS 455 Ca 0.11 -0.01 -0.32 0.00 -2.02 0.00 0.00 58.31 56.08 1b3l n LYS 455 Cb 0.35 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 1b3l n LYS 455 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1b3l s VAL 456 N -2.90 4.48 0.05 -0.18 -7.23 -1.14 -5.01 120.40 108.46 1b3l s VAL 456 Ca 0.07 0.96 -0.16 0.00 -1.81 0.00 0.00 61.98 61.04 1b3l s VAL 456 Cb 0.15 -3.71 -0.23 0.00 0.56 0.00 0.00 36.38 33.14 1b3l s VAL 456 CO 0.82 -0.90 1.15 0.00 -0.31 0.00 0.00 175.10 175.86 1b3l h ALA 457 N 0.11 0.10 -1.12 1.32 0.00 -1.94 -3.49 119.26 114.25 1b3l h ALA 457 Ca -0.45 -0.65 -0.62 0.00 0.00 0.00 0.00 54.91 53.19 1b3l h ALA 457 Cb 1.19 0.05 -0.13 0.00 0.00 0.00 0.00 17.79 18.90 1b3l h ALA 457 CO 0.61 0.55 -0.50 0.16 0.00 0.00 0.00 179.25 180.07 1b3l s ASP 458 N -7.08 3.33 0.26 0.00 1.47 -1.26 -5.05 116.67 108.34 1b3l s ASP 458 Ca -0.11 -1.73 0.03 0.00 1.18 0.00 0.00 52.55 51.92 1b3l s ASP 458 Cb 0.05 0.63 0.35 0.00 -0.34 0.00 0.00 42.92 43.62 1b3l s ASP 458 CO 0.88 -0.97 1.66 0.44 0.68 0.00 0.00 175.17 177.86 1b3l h ASP 459 N 1.57 0.42 -0.18 2.11 5.19 -1.99 -2.93 116.42 120.62 1b3l h ASP 459 Ca -0.37 -0.17 -0.09 0.00 -0.62 0.00 0.00 57.03 55.77 1b3l h ASP 459 Cb 1.29 -0.12 -0.02 0.00 0.18 0.00 0.00 39.33 40.67 1b3l h ASP 459 CO 0.60 0.77 -0.18 0.00 -3.12 0.00 0.00 179.24 177.30 1b3l h THR 460 N 0.33 1.26 -0.07 0.35 1.03 -2.00 -1.04 112.91 112.77 1b3l h THR 460 Ca 0.03 -1.20 -0.18 0.00 -0.01 0.00 0.00 66.41 65.05 1b3l h THR 460 Cb 0.84 1.21 -0.01 0.00 -1.07 0.00 0.00 68.15 69.12 1b3l h THR 460 CO 0.07 0.39 -0.74 -0.61 -0.01 0.00 0.00 175.52 174.62 1b3l h GLN 461 N 0.54 0.38 -0.16 0.00 4.15 -1.97 -2.94 115.11 115.10 1b3l h GLN 461 Ca 0.09 -0.32 0.03 0.00 0.77 0.00 0.00 58.65 59.22 1b3l h GLN 461 Cb 0.62 0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.35 1b3l h GLN 461 CO 0.04 0.97 -0.05 -0.09 -1.93 0.00 0.00 178.83 177.77 1b3l h ARG 462 N 0.26 -0.02 -0.52 1.69 2.43 -1.30 -2.07 114.38 114.84 1b3l h ARG 462 Ca -0.03 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.11 1b3l h ARG 462 Cb 1.32 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.85 1b3l h ARG 462 CO 0.13 -0.01 0.20 0.77 -1.51 0.00 0.00 179.97 179.54 1b3l h SER 463 N -0.02 0.69 -0.72 -3.80 0.02 -1.13 -0.71 113.55 107.87 1b3l h SER 463 Ca 0.08 -0.09 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 1b3l h SER 463 Cb 0.14 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.47 1b3l h SER 463 CO -0.18 0.63 0.27 -0.33 -1.14 0.00 0.00 176.83 176.09 1b3l h GLU 464 N 0.75 1.09 -0.50 3.45 5.08 -1.32 -2.05 114.58 121.07 1b3l h GLU 464 Ca 0.18 -0.21 -0.08 0.00 -1.00 0.00 0.00 59.36 58.25 1b3l h GLU 464 Cb 0.17 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1b3l h GLU 464 CO -0.02 0.91 -0.01 -0.07 -1.00 0.00 0.00 179.01 178.82 1b3l h LEU 465 N 1.04 0.88 -0.87 1.33 3.38 -0.47 -2.14 115.31 118.46 1b3l h LEU 465 Ca 0.24 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.91 1b3l h LEU 465 Cb 0.24 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1b3l h LEU 465 CO -0.02 0.98 0.58 1.88 0.09 0.00 0.00 178.44 181.95 1b3l h TYR 466 N 0.76 1.09 -0.88 1.13 0.05 -1.09 -0.20 116.97 117.83 1b3l h TYR 466 Ca 0.14 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.93 1b3l h TYR 466 Cb 0.53 -0.37 -0.04 0.00 1.01 0.00 0.00 36.73 37.86 1b3l h TYR 466 CO 0.04 0.69 0.47 0.00 -1.05 0.00 0.00 178.16 178.31 1b3l h ALA 467 N 1.32 1.13 0.00 3.88 0.00 -1.19 -0.85 119.26 123.56 1b3l h ALA 467 Ca 0.32 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.98 1b3l h ALA 467 Cb -0.13 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.29 1b3l h ALA 467 CO -0.07 0.65 -0.54 0.87 0.00 0.00 0.00 179.25 180.17 1b3l h LYS 468 N 1.24 0.00 -0.20 0.00 1.57 -0.87 -2.35 116.57 115.96 1b3l h LYS 468 Ca 0.31 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 59.00 1b3l h LYS 468 Cb 0.05 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.35 1b3l h LYS 468 CO -0.05 0.54 -0.22 0.00 -0.57 0.00 0.00 179.45 179.15 1b3l h ALA 469 N 1.46 0.30 -0.74 3.86 0.00 -0.51 -1.04 119.26 122.59 1b3l h ALA 469 Ca -0.01 -0.36 0.03 0.00 0.00 0.00 0.00 54.91 54.57 1b3l h ALA 469 Cb 1.19 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.88 1b3l h ALA 469 CO 0.07 0.25 0.49 0.93 0.00 0.00 0.00 179.25 180.98 1b3l h GLU 470 N 0.17 0.88 -0.35 0.00 4.39 -1.07 -1.71 114.58 116.89 1b3l h GLU 470 Ca 0.03 -0.05 -0.07 0.00 0.34 0.00 0.00 59.36 59.60 1b3l h GLU 470 Cb 0.77 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 29.21 1b3l h GLU 470 CO 0.05 0.58 -0.08 1.96 -1.16 0.00 0.00 179.01 180.36 1b3l h GLN 471 N 0.91 0.59 -0.23 2.33 4.20 -1.28 -0.74 115.11 120.89 1b3l h GLN 471 Ca 0.29 -0.17 -0.02 0.00 0.06 0.00 0.00 58.65 58.82 1b3l h GLN 471 Cb 0.03 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.74 1b3l h GLN 471 CO -0.08 0.68 0.08 0.37 -0.67 0.00 0.00 178.83 179.20 1b3l h GLN 472 N 0.55 0.36 -0.86 1.46 5.75 -0.58 -0.13 115.11 121.66 1b3l h GLN 472 Ca 0.10 -0.08 0.02 0.00 -0.15 0.00 0.00 58.65 58.54 1b3l h GLN 472 Cb 0.48 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.93 1b3l h GLN 472 CO 0.03 0.44 0.57 1.25 -2.65 0.00 0.00 178.83 178.46 1b3l h LEU 473 N 0.21 0.97 -0.19 -2.39 5.85 -1.16 -2.19 115.31 116.42 1b3l h LEU 473 Ca 0.08 -0.02 -0.14 0.00 0.84 0.00 0.00 57.88 58.64 1b3l h LEU 473 Cb 0.22 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.02 1b3l h LEU 473 CO -0.00 0.70 -0.42 -0.78 -0.34 0.00 0.00 178.44 177.59 1b3l h ASP 474 N 1.14 0.70 -0.72 1.25 3.58 -0.95 -1.14 116.42 120.28 1b3l h ASP 474 Ca 0.32 -0.56 -0.01 0.00 0.42 0.00 0.00 57.03 57.20 1b3l h ASP 474 Cb -0.09 -0.20 -0.04 0.00 1.72 0.00 0.00 39.33 40.72 1b3l h ASP 474 CO -0.08 1.13 0.41 0.50 -2.88 0.00 0.00 179.24 178.32 1b3l h LYS 475 N 0.30 1.01 -0.00 0.28 3.64 -0.88 -1.56 116.57 119.37 1b3l h LYS 475 Ca 0.00 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1b3l h LYS 475 Cb 1.02 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.64 1b3l h LYS 475 CO 0.09 0.74 -0.03 -0.25 -2.27 0.00 0.00 179.45 177.73 1b3l n ASP 476 N -4.37 0.05 -3.95 4.20 8.00 -0.83 -4.95 116.55 114.70 1b3l n ASP 476 Ca 0.07 0.13 -0.30 0.00 0.71 0.00 0.00 54.79 55.40 1b3l n ASP 476 Cb 0.09 -0.35 -0.01 0.00 -0.02 0.00 0.00 41.12 40.83 1b3l n ASP 476 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1b3l n SER 477 N -1.37 -1.74 0.08 -2.24 7.64 -0.45 -4.86 113.62 110.67 1b3l n SER 477 Ca 0.11 -1.08 -0.01 0.00 1.01 0.00 0.00 58.87 58.90 1b3l n SER 477 Cb 0.29 -2.80 0.26 0.00 -1.01 0.00 0.00 64.21 60.95 1b3l n SER 477 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1b3l h ALA 478 N 0.92 1.20 -2.82 -0.43 0.00 -1.80 -3.44 119.26 112.90 1b3l h ALA 478 Ca -0.65 -0.34 -0.46 0.00 0.00 0.00 0.00 54.91 53.45 1b3l h ALA 478 Cb 1.38 -0.10 -0.13 0.00 0.00 0.00 0.00 17.79 18.94 1b3l h ALA 478 CO 0.59 0.52 -0.50 0.96 0.00 0.00 0.00 179.25 180.82 1b3l s ILE 479 N -4.38 0.03 -0.43 0.00 -4.36 -1.26 -4.06 121.20 106.73 1b3l s ILE 479 Ca -0.05 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.35 1b3l s ILE 479 Cb 0.14 -2.49 0.12 0.00 1.25 0.00 0.00 42.46 41.48 1b3l s ILE 479 CO 0.77 0.00 0.18 -0.69 0.24 0.00 0.00 174.94 175.44 1b3l s VAL 480 N -3.48 2.75 0.31 8.37 1.01 -0.41 -4.93 120.40 124.02 1b3l s VAL 480 Ca 0.40 -2.59 -0.29 0.00 0.00 0.00 0.00 61.98 59.49 1b3l s VAL 480 Cb 0.03 -2.93 -0.11 0.00 0.00 0.00 0.00 36.38 33.37 1b3l s VAL 480 CO 0.26 -0.70 1.53 -2.84 0.00 0.00 0.00 175.10 173.35 1b3l s PRO 481 N 0.55 4.15 0.04 2.72 0.02 -1.26 -1.07 135.00 140.15 1b3l s PRO 481 Ca 0.13 2.51 -0.03 0.00 0.02 0.00 0.00 61.00 63.63 1b3l s PRO 481 Cb -0.22 -3.02 -0.01 0.00 0.02 0.00 0.00 34.50 31.27 1b3l s PRO 481 CO -0.05 -0.55 -0.06 0.28 -0.33 0.00 0.00 177.00 176.30 1b3l n VAL 482 N 1.68 1.11 -3.65 3.83 0.31 -0.48 -4.70 118.33 116.43 1b3l n VAL 482 Ca 0.06 0.30 -0.12 0.00 -0.01 0.00 0.00 64.34 64.56 1b3l n VAL 482 Cb 0.39 -1.69 -0.06 0.00 -0.91 0.00 0.00 33.84 31.57 1b3l n VAL 482 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 1b3l s TYR 483 N -2.13 -0.26 -0.16 3.52 -0.85 -1.06 -1.20 117.35 115.20 1b3l s TYR 483 Ca -0.05 0.16 -0.24 0.00 -0.52 0.00 0.00 57.07 56.43 1b3l s TYR 483 Cb 0.01 0.24 -0.02 0.00 0.38 0.00 0.00 41.96 42.57 1b3l s TYR 483 CO 0.07 -0.61 0.75 0.71 -1.52 0.00 0.00 175.55 174.95 1b3l s TYR 484 N -2.80 3.43 0.65 -3.49 2.02 0.07 -0.10 117.35 117.12 1b3l s TYR 484 Ca -0.03 1.15 -0.16 0.00 -0.37 0.00 0.00 57.07 57.66 1b3l s TYR 484 Cb -0.00 -2.92 -0.01 0.00 -0.40 0.00 0.00 41.96 38.63 1b3l s TYR 484 CO -0.05 -0.18 1.16 0.71 -1.57 0.00 0.00 175.55 175.62 1b3l s TYR 485 N 1.89 2.43 0.09 2.71 1.51 -0.73 -2.31 117.35 122.95 1b3l s TYR 485 Ca 0.35 1.56 0.07 0.00 -1.01 0.00 0.00 57.07 58.04 1b3l s TYR 485 Cb -0.16 -3.33 -0.04 0.00 -0.11 0.00 0.00 41.96 38.32 1b3l s TYR 485 CO 0.13 -2.02 -0.13 0.14 -1.11 0.00 0.00 175.55 172.56 1b3l s VAL 486 N -2.01 3.17 -0.53 0.71 -7.23 -1.26 -3.80 120.40 109.45 1b3l s VAL 486 Ca 0.72 -1.30 -0.25 0.00 -1.81 0.00 0.00 61.98 59.34 1b3l s VAL 486 Cb -0.25 -2.45 0.04 0.00 0.56 0.00 0.00 36.38 34.27 1b3l s VAL 486 CO 0.39 0.15 0.97 0.21 -0.31 0.00 0.00 175.10 176.51 1b3l s ASN 487 N -2.05 6.40 -0.10 4.85 2.47 0.45 -4.87 114.94 122.08 1b3l s ASN 487 Ca 0.19 -0.16 0.01 0.00 0.42 0.00 0.00 52.86 53.33 1b3l s ASN 487 Cb -0.11 -2.46 0.02 0.00 -1.45 0.00 0.00 41.25 37.25 1b3l s ASN 487 CO 0.11 -1.21 -0.12 0.00 -3.72 0.00 0.00 177.10 172.16 1b3l s ALA 488 N 4.03 1.50 0.28 1.71 0.00 -1.26 -1.09 121.76 126.93 1b3l s ALA 488 Ca 0.34 -0.62 -0.19 0.00 0.00 0.00 0.00 51.96 51.49 1b3l s ALA 488 Cb -0.11 -0.80 0.02 0.00 0.00 0.00 0.00 23.12 22.22 1b3l s ALA 488 CO 0.22 -0.14 0.68 -0.98 0.00 0.00 0.00 175.76 175.53 1b3l s ARG 489 N 1.13 1.77 -0.24 0.00 1.70 -0.86 -3.58 118.95 118.88 1b3l s ARG 489 Ca -0.05 -1.08 -0.12 0.00 -0.47 0.00 0.00 55.73 54.02 1b3l s ARG 489 Cb -0.14 0.58 -0.05 0.00 -0.57 0.00 0.00 34.95 34.77 1b3l s ARG 489 CO -0.03 -0.80 0.22 -0.51 -1.08 0.00 0.00 175.30 173.10 1b3l s LEU 490 N -2.95 4.10 -0.27 -1.89 1.43 -1.26 -1.12 118.68 116.72 1b3l s LEU 490 Ca 0.14 0.17 0.02 0.00 -1.03 0.00 0.00 54.13 53.43 1b3l s LEU 490 Cb -0.05 -2.20 0.07 0.00 0.03 0.00 0.00 46.19 44.04 1b3l s LEU 490 CO 0.08 0.00 -0.06 -0.69 0.23 0.00 0.00 176.35 175.91 1b3l s VAL 491 N 1.31 1.98 0.45 -1.59 1.01 0.02 -1.27 120.40 122.31 1b3l s VAL 491 Ca 0.10 -1.66 -0.23 0.00 0.00 0.00 0.00 61.98 60.19 1b3l s VAL 491 Cb -0.14 -2.21 -0.10 0.00 0.00 0.00 0.00 36.38 33.93 1b3l s VAL 491 CO 0.07 -0.18 0.95 0.29 0.00 0.00 0.00 175.10 176.24 1b3l n LYS 492 N 4.47 1.21 -0.35 2.72 5.02 -0.83 -4.59 118.16 125.82 1b3l n LYS 492 Ca -0.10 0.44 0.16 0.00 -2.02 0.00 0.00 58.31 56.79 1b3l n LYS 492 Cb 0.43 -2.01 0.37 0.00 -0.02 0.00 0.00 35.03 33.80 1b3l n LYS 492 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1b3l h PRO 493 N 1.31 0.62 0.00 1.97 0.11 -1.92 -1.73 132.00 132.35 1b3l h PRO 493 Ca -0.45 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.54 1b3l h PRO 493 Cb 1.35 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1b3l h PRO 493 CO 0.55 0.41 -0.42 0.11 -0.21 0.00 0.00 178.00 178.44 1b3l h TRP 494 N 0.64 0.00 -2.60 0.65 0.09 -1.90 -3.44 115.95 109.39 1b3l h TRP 494 Ca 0.62 0.00 -0.53 0.00 0.09 0.00 0.00 58.89 59.07 1b3l h TRP 494 Cb 1.13 0.00 0.06 0.00 0.08 0.00 0.00 29.16 30.42 1b3l h TRP 494 CO -0.01 0.42 1.00 0.28 0.09 0.00 0.00 178.44 180.23 1b3l n VAL 495 N -3.47 0.04 -4.35 0.12 0.31 -0.65 -1.55 118.33 108.77 1b3l n VAL 495 Ca 0.00 -0.01 -0.27 0.00 -0.01 0.00 0.00 64.34 64.06 1b3l n VAL 495 Cb 0.57 -1.96 -0.10 0.00 -0.91 0.00 0.00 33.84 31.43 1b3l n VAL 495 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1b3l s GLY 496 N 1.32 1.72 0.00 2.92 0.00 0.72 -4.80 107.32 109.21 1b3l s GLY 496 Ca 0.76 -1.56 0.00 0.00 0.00 0.00 0.00 44.72 43.93 1b3l s GLY 496 CO 0.33 -1.58 0.00 0.61 0.00 0.00 0.00 173.10 172.46 1b3l n GLY 497 N 0.12 0.85 3.52 0.20 0.00 -1.26 -2.33 105.19 106.28 1b3l n GLY 497 Ca -0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 1b3l n GLY 497 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1b3l s TYR 498 N -2.22 2.41 -0.06 1.61 5.04 -1.26 -4.85 117.35 118.03 1b3l s TYR 498 Ca 0.00 -0.17 -0.22 0.00 -2.44 0.00 0.00 57.07 54.24 1b3l s TYR 498 Cb 0.00 -4.52 -0.31 0.00 0.35 0.00 0.00 41.96 37.48 1b3l s TYR 498 CO 0.00 -1.93 0.88 1.79 -1.34 0.00 0.00 175.55 174.95 1b3l h THR 499 N 6.02 1.52 0.00 4.34 1.35 -1.96 -3.48 112.91 120.70 1b3l h THR 499 Ca -0.28 -2.52 0.00 0.00 -0.55 0.00 0.00 66.41 63.06 1b3l h THR 499 Cb 1.06 3.21 0.00 0.00 -1.73 0.00 0.00 68.15 70.69 1b3l h THR 499 CO 1.25 0.71 0.00 0.61 -0.25 0.00 0.00 175.52 177.84 1b3l n GLY 500 N 1.67 0.58 0.75 5.82 0.00 -1.26 -4.93 105.19 107.82 1b3l n GLY 500 Ca -0.14 -0.40 0.11 0.00 0.00 0.00 0.00 46.02 45.60 1b3l n GLY 500 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1b3l n LYS 501 N -2.75 2.00 -3.08 1.61 5.02 -1.26 -4.70 118.16 114.99 1b3l n LYS 501 Ca 0.00 -1.50 -0.43 0.00 -2.02 0.00 0.00 58.31 54.36 1b3l n LYS 501 Cb 0.00 -1.44 -0.06 0.00 -0.02 0.00 0.00 35.03 33.51 1b3l n LYS 501 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1b3l s ASP 502 N -1.61 6.28 0.14 4.39 2.15 -1.26 -4.74 116.67 122.03 1b3l s ASP 502 Ca 0.34 -0.58 0.13 0.00 0.43 0.00 0.00 52.55 52.87 1b3l s ASP 502 Cb 0.19 -2.33 0.63 0.00 -0.30 0.00 0.00 42.92 41.11 1b3l s ASP 502 CO 0.29 -0.90 1.40 -0.81 -0.17 0.00 0.00 175.17 174.97 1b3l n PRO 503 N 6.43 0.07 0.02 4.34 -0.04 -1.26 -0.62 135.00 143.94 1b3l n PRO 503 Ca -0.03 0.49 0.11 0.00 -0.04 0.00 0.00 63.50 64.03 1b3l n PRO 503 Cb 0.47 -1.70 -0.00 0.00 -0.04 0.00 0.00 33.50 32.22 1b3l n PRO 503 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1b3l n LEU 504 N -1.85 0.59 -3.73 1.53 4.77 -1.26 -1.20 117.00 115.85 1b3l n LEU 504 Ca 0.01 -0.04 -0.26 0.00 -0.03 0.00 0.00 56.01 55.69 1b3l n LEU 504 Cb 0.08 -0.08 0.05 0.00 -2.33 0.00 0.00 43.42 41.14 1b3l n LEU 504 CO 0.08 0.05 0.15 -0.67 -1.33 0.00 0.00 177.39 175.67 1b3l n ASP 505 N -1.98 -4.96 -4.53 -1.43 2.03 0.21 -4.89 116.55 101.01 1b3l n ASP 505 Ca 0.01 -0.67 -0.43 0.00 0.52 0.00 0.00 54.79 54.22 1b3l n ASP 505 Cb 0.44 -4.46 -0.01 0.00 -0.72 0.00 0.00 41.12 36.36 1b3l n ASP 505 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 1b3l s ASN 506 N -3.48 6.74 -0.03 1.67 0.01 -1.26 -4.98 114.94 113.61 1b3l s ASN 506 Ca 0.53 -2.17 -0.20 0.00 -0.71 0.00 0.00 52.86 50.31 1b3l s ASN 506 Cb -0.25 -2.51 -0.05 0.00 0.41 0.00 0.00 41.25 38.85 1b3l s ASN 506 CO 0.78 -1.17 0.59 -0.63 -1.51 0.00 0.00 177.10 175.15 1b3l s ILE 507 N 3.66 4.97 -0.10 0.60 -1.09 -1.26 -4.89 121.20 123.09 1b3l s ILE 507 Ca 0.45 1.22 0.02 0.00 -2.23 0.00 0.00 60.65 60.11 1b3l s ILE 507 Cb -0.00 -3.92 -0.02 0.00 -1.58 0.00 0.00 42.46 36.94 1b3l s ILE 507 CO -0.02 0.38 -0.15 -0.31 -1.23 0.00 0.00 174.94 173.61 1b3l s TYR 508 N 0.05 2.73 -0.34 3.97 1.51 -1.26 -4.86 117.35 119.14 1b3l s TYR 508 Ca 0.31 -0.56 0.25 0.00 -1.01 0.00 0.00 57.07 56.06 1b3l s TYR 508 Cb -0.18 -1.75 1.09 0.00 -0.11 0.00 0.00 41.96 41.01 1b3l s TYR 508 CO 0.16 -0.12 1.75 0.28 -1.11 0.00 0.00 175.55 176.51 1b3l h VAL 509 N 5.12 0.00 0.00 0.71 2.07 -1.94 -1.19 116.25 121.03 1b3l h VAL 509 Ca -0.31 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 66.99 1b3l h VAL 509 Cb 1.20 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 31.92 1b3l h VAL 509 CO 0.53 0.00 0.00 2.29 0.02 0.00 0.00 177.57 180.41 1b3l n LYS 510 N -2.36 0.27 0.00 1.57 2.85 -1.26 -3.19 118.16 116.04 1b3l n LYS 510 Ca 0.01 0.04 0.10 0.00 -1.05 0.00 0.00 58.31 57.41 1b3l n LYS 510 Cb 0.20 -1.50 -0.05 0.00 -0.65 0.00 0.00 35.03 33.03 1b3l n LYS 510 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1b3l n ASN 511 N -1.35 1.48 -4.95 -5.58 3.02 -0.45 0.21 115.26 107.65 1b3l n ASN 511 Ca 0.11 -1.24 -0.20 0.00 -0.03 0.00 0.00 54.58 53.22 1b3l n ASN 511 Cb 0.24 0.71 0.04 0.00 -0.61 0.00 0.00 39.78 40.17 1b3l n ASN 511 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1b3l s LEU 512 N -2.61 3.31 -0.26 3.41 1.02 -1.19 -4.34 118.68 118.02 1b3l s LEU 512 Ca 0.13 -0.27 -0.26 0.00 0.02 0.00 0.00 54.13 53.74 1b3l s LEU 512 Cb 0.16 -2.54 0.14 0.00 0.02 0.00 0.00 46.19 43.97 1b3l s LEU 512 CO 0.65 -1.17 1.11 -0.72 0.02 0.00 0.00 176.35 176.24 1b3l s TYR 513 N -2.70 -0.35 -0.12 0.29 -0.85 -0.99 -4.34 117.35 108.29 1b3l s TYR 513 Ca 0.59 0.80 -0.18 0.00 -0.52 0.00 0.00 57.07 57.75 1b3l s TYR 513 Cb -0.09 0.41 -0.04 0.00 0.38 0.00 0.00 41.96 42.62 1b3l s TYR 513 CO 0.38 -0.21 0.48 0.42 -1.52 0.00 0.00 175.55 175.10 1b3l s ILE 514 N -0.18 5.18 0.20 -3.49 -1.09 -1.26 -0.20 121.20 120.36 1b3l s ILE 514 Ca 0.03 0.96 -0.08 0.00 -2.23 0.00 0.00 60.65 59.34 1b3l s ILE 514 Cb -0.04 -3.82 -0.07 0.00 -1.58 0.00 0.00 42.46 36.96 1b3l s ILE 514 CO -0.06 0.31 0.48 -0.63 -1.23 0.00 0.00 174.94 173.81 1b3l s ILE 515 N 0.71 5.03 0.19 2.92 1.01 -0.59 -1.44 121.20 129.03 1b3l s ILE 515 Ca 0.26 0.29 -0.31 0.00 0.00 0.00 0.00 60.65 60.88 1b3l s ILE 515 Cb -0.15 -3.62 -0.10 0.00 0.01 0.00 0.00 42.46 38.59 1b3l s ILE 515 CO 0.10 -0.03 1.56 -0.75 0.00 0.00 0.00 174.94 175.81 1b3l s LYS 516 N -2.77 4.21 0.00 2.79 2.20 0.67 -4.12 119.74 122.72 1b3l s LYS 516 Ca 0.45 2.38 0.00 0.00 -0.36 0.00 0.00 55.97 58.44 1b3l s LYS 516 Cb -0.12 -3.13 0.00 0.00 -1.51 0.00 0.00 37.83 33.08 1b3l s LYS 516 CO 0.23 -0.58 0.00 -2.39 -0.36 0.00 0.00 175.35 172.25