#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a7k s VAL 2 N 0.00 0.16 0.14 2.03 -7.23 -1.26 0.02 120.40 114.25 2a7k s VAL 2 Ca 0.00 -1.31 0.09 0.00 -1.81 0.00 0.00 61.98 58.95 2a7k s VAL 2 Cb 0.00 -0.91 -0.04 0.00 0.56 0.00 0.00 36.38 35.99 2a7k s VAL 2 CO 0.00 -0.72 -0.14 0.72 -0.31 0.00 0.00 175.10 174.65 2a7k s PHE 3 N -2.71 2.59 -0.15 2.82 -0.12 0.11 -4.88 117.98 115.64 2a7k s PHE 3 Ca -0.04 -0.23 0.01 0.00 -0.05 0.00 0.00 56.93 56.61 2a7k s PHE 3 Cb -0.01 -1.33 0.02 0.00 -0.63 0.00 0.00 43.02 41.07 2a7k s PHE 3 CO -0.05 0.44 -0.17 -1.21 -0.05 0.00 0.00 175.22 174.17 2a7k s GLU 4 N -2.41 2.64 0.14 1.99 2.02 -1.26 -0.63 118.70 121.19 2a7k s GLU 4 Ca 0.21 -0.70 0.01 0.00 0.02 0.00 0.00 54.97 54.52 2a7k s GLU 4 Cb -0.10 -2.29 -0.04 0.00 0.10 0.00 0.00 34.13 31.80 2a7k s GLU 4 CO 0.12 -0.17 -0.02 -1.21 0.02 0.00 0.00 175.26 174.00 2a7k s GLU 5 N 1.25 0.97 -0.06 1.61 2.02 0.20 -4.98 118.70 119.72 2a7k s GLU 5 Ca 0.02 -1.44 0.04 0.00 0.02 0.00 0.00 54.97 53.61 2a7k s GLU 5 Cb -0.14 -0.17 -0.00 0.00 0.10 0.00 0.00 34.13 33.92 2a7k s GLU 5 CO -0.09 -0.10 -0.18 -0.80 0.02 0.00 0.00 175.26 174.11 2a7k s ASN 6 N -3.10 2.33 -0.75 -0.19 0.01 -1.26 0.68 114.94 112.66 2a7k s ASN 6 Ca 0.19 -0.39 -0.02 0.00 -0.71 0.00 0.00 52.86 51.93 2a7k s ASN 6 Cb 0.06 -0.78 0.19 0.00 0.41 0.00 0.00 41.25 41.13 2a7k s ASN 6 CO 0.00 0.14 0.59 -0.55 -1.51 0.00 0.00 177.10 175.77 2a7k s SER 7 N 0.17 5.52 0.97 -1.22 0.15 0.44 -4.97 113.70 114.74 2a7k s SER 7 Ca -0.08 -3.32 0.00 0.00 0.70 0.00 0.00 55.95 53.25 2a7k s SER 7 Cb -0.13 -1.86 0.00 0.00 -1.71 0.00 0.00 66.02 62.32 2a7k s SER 7 CO 0.04 -0.26 0.00 0.47 1.20 0.00 0.00 173.24 174.68 2a7k n ASP 8 N 2.85 0.00 -0.07 5.45 8.00 -1.26 -0.98 116.55 130.54 2a7k n ASP 8 Ca 0.15 0.00 0.15 0.00 0.71 0.00 0.00 54.79 55.80 2a7k n ASP 8 Cb 0.37 0.00 0.79 0.00 -0.02 0.00 0.00 41.12 42.27 2a7k n ASP 8 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 2a7k n GLU 9 N 4.25 0.85 -3.45 -1.24 0.00 -1.26 -4.71 120.64 115.08 2a7k n GLU 9 Ca 0.00 -0.13 -0.39 0.00 0.00 0.00 0.00 57.16 56.63 2a7k n GLU 9 Cb 0.00 -1.50 -0.10 0.00 0.00 0.00 0.00 31.44 29.85 2a7k n GLU 9 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2a7k s VAL 10 N -2.24 5.21 -0.21 3.84 1.01 -0.16 0.23 120.40 128.09 2a7k s VAL 10 Ca 0.38 0.33 -0.22 0.00 0.00 0.00 0.00 61.98 62.47 2a7k s VAL 10 Cb 0.21 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.89 2a7k s VAL 10 CO 0.41 0.12 0.67 -0.60 0.00 0.00 0.00 175.10 175.70 2a7k s ARG 11 N 1.97 4.20 -0.25 2.72 6.06 -0.33 -0.42 118.95 132.90 2a7k s ARG 11 Ca 0.12 0.68 -0.07 0.00 -2.50 0.00 0.00 55.73 53.96 2a7k s ARG 11 Cb -0.16 -3.59 -0.02 0.00 0.06 0.00 0.00 34.95 31.23 2a7k s ARG 11 CO 0.11 -0.30 0.07 0.08 -2.50 0.00 0.00 175.30 172.75 2a7k s VAL 12 N 2.10 4.23 -0.33 7.11 1.01 0.22 -0.85 120.40 133.88 2a7k s VAL 12 Ca 0.30 -0.24 -0.08 0.00 0.00 0.00 0.00 61.98 61.96 2a7k s VAL 12 Cb -0.16 -3.00 0.02 0.00 0.00 0.00 0.00 36.38 33.25 2a7k s VAL 12 CO 0.10 0.32 0.13 -0.63 0.00 0.00 0.00 175.10 175.02 2a7k s ILE 13 N 1.60 4.12 -0.25 2.22 1.01 0.50 -0.63 121.20 129.77 2a7k s ILE 13 Ca 0.06 -0.86 -0.08 0.00 0.00 0.00 0.00 60.65 59.77 2a7k s ILE 13 Cb -0.15 -3.24 -0.04 0.00 0.01 0.00 0.00 42.46 39.04 2a7k s ILE 13 CO 0.03 -0.09 0.10 -0.89 0.00 0.00 0.00 174.94 174.09 2a7k s THR 14 N 1.49 4.60 0.16 2.92 2.01 0.20 -1.43 115.64 125.59 2a7k s THR 14 Ca 0.01 -0.07 -0.31 0.00 0.31 0.00 0.00 61.69 61.63 2a7k s THR 14 Cb -0.18 -3.16 -0.09 0.00 0.01 0.00 0.00 72.50 69.08 2a7k s THR 14 CO 0.04 0.33 1.41 -0.76 -0.69 0.00 0.00 174.62 174.95 2a7k s LEU 15 N 1.51 4.38 -0.31 4.42 1.43 -0.03 -0.71 118.68 129.38 2a7k s LEU 15 Ca 0.06 2.43 0.18 0.00 -1.03 0.00 0.00 54.13 55.77 2a7k s LEU 15 Cb -0.15 -3.60 0.48 0.00 0.03 0.00 0.00 46.19 42.95 2a7k s LEU 15 CO 0.05 -0.66 1.05 -0.67 0.23 0.00 0.00 176.35 176.35 2a7k n ASP 16 N 3.46 2.14 -4.69 2.29 2.03 0.10 -4.46 116.55 117.42 2a7k n ASP 16 Ca 0.10 -2.64 -0.39 0.00 0.52 0.00 0.00 54.79 52.39 2a7k n ASP 16 Cb 0.42 -0.49 0.04 0.00 -0.72 0.00 0.00 41.12 40.37 2a7k n ASP 16 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 2a7k n HIS 17 N -0.37 1.71 -0.33 -0.67 -0.00 -1.23 -4.62 115.22 109.71 2a7k n HIS 17 Ca 0.14 0.45 0.17 0.00 -0.00 0.00 0.00 57.72 58.48 2a7k n HIS 17 Cb 0.81 -2.28 0.40 0.00 -0.00 0.00 0.00 29.99 28.92 2a7k n HIS 17 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 2a7k h PRO 18 N 1.15 0.59 -6.62 1.57 0.11 -1.98 -3.40 132.00 123.42 2a7k h PRO 18 Ca -0.49 -0.04 -0.51 0.00 0.11 0.00 0.00 66.00 65.07 2a7k h PRO 18 Cb 1.33 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 2a7k h PRO 18 CO 0.55 0.39 0.38 1.21 -0.21 0.00 0.00 178.00 180.32 2a7k s ASN 19 N -5.39 7.49 0.24 -2.05 3.84 -1.26 -4.96 114.94 112.85 2a7k s ASN 19 Ca -0.10 1.88 0.23 0.00 0.21 0.00 0.00 52.86 55.08 2a7k s ASN 19 Cb 0.25 -2.60 0.95 0.00 -0.55 0.00 0.00 41.25 39.31 2a7k s ASN 19 CO 0.80 -0.04 1.69 2.29 -2.79 0.00 0.00 177.10 179.05 2a7k n LYS 20 N 2.43 0.18 -0.06 0.43 0.00 -1.26 -1.88 118.16 118.00 2a7k n LYS 20 Ca 0.01 0.41 0.12 0.00 -0.00 0.00 0.00 58.31 58.85 2a7k n LYS 20 Cb 0.48 -1.84 0.35 0.00 -0.00 0.00 0.00 35.03 34.02 2a7k n LYS 20 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 2a7k n HIS 21 N -2.18 0.15 -3.63 5.58 8.25 -1.26 -0.86 115.22 121.26 2a7k n HIS 21 Ca 0.02 -0.07 -0.22 0.00 -0.26 0.00 0.00 57.72 57.18 2a7k n HIS 21 Cb 0.23 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.38 2a7k n HIS 21 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2a7k n ASN 22 N 0.63 -2.75 -4.77 0.41 3.02 -0.79 -0.20 115.26 110.82 2a7k n ASN 22 Ca 0.17 -0.84 -0.40 0.00 -0.03 0.00 0.00 54.58 53.48 2a7k n ASN 22 Cb 0.43 -4.09 0.01 0.00 -0.61 0.00 0.00 39.78 35.51 2a7k n ASN 22 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2a7k s PRO 23 N -5.75 3.79 -1.18 3.52 0.04 -1.26 -3.97 135.00 130.19 2a7k s PRO 23 Ca 0.16 2.30 -0.21 0.00 0.04 0.00 0.00 61.00 63.30 2a7k s PRO 23 Cb -0.04 -2.69 0.04 0.00 0.04 0.00 0.00 34.50 31.85 2a7k s PRO 23 CO 0.81 -0.69 1.70 -0.06 0.04 0.00 0.00 177.00 178.79 2a7k s PHE 24 N -1.23 2.53 0.86 0.56 0.08 0.40 -4.82 117.98 116.36 2a7k s PHE 24 Ca 0.60 -0.97 -0.12 0.00 0.12 0.00 0.00 56.93 56.56 2a7k s PHE 24 Cb -0.41 -4.59 0.11 0.00 -0.57 0.00 0.00 43.02 37.55 2a7k s PHE 24 CO 0.53 -1.76 1.13 -1.54 -0.10 0.00 0.00 175.22 173.48 2a7k s SER 25 N 5.01 3.95 0.24 1.36 1.04 -1.26 -4.57 113.70 119.47 2a7k s SER 25 Ca 0.55 1.03 -0.07 0.00 0.48 0.00 0.00 55.95 57.94 2a7k s SER 25 Cb 0.01 -1.64 0.24 0.00 0.10 0.00 0.00 66.02 64.74 2a7k s SER 25 CO 0.03 -2.28 1.92 -0.09 0.98 0.00 0.00 173.24 173.80 2a7k h ARG 26 N -1.31 1.27 -0.29 4.02 2.43 -1.99 -1.24 114.38 117.27 2a7k h ARG 26 Ca -0.49 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 58.58 2a7k h ARG 26 Cb 1.31 -0.29 -0.01 0.00 -0.42 0.00 0.00 29.97 30.57 2a7k h ARG 26 CO 0.62 0.85 0.10 1.15 -1.51 0.00 0.00 179.97 181.17 2a7k h THR 27 N 1.31 1.19 -0.59 0.20 2.02 -1.97 -1.40 112.91 113.68 2a7k h THR 27 Ca 0.35 -0.62 -0.03 0.00 0.77 0.00 0.00 66.41 66.89 2a7k h THR 27 Cb -0.15 1.06 -0.03 0.00 -1.74 0.00 0.00 68.15 67.30 2a7k h THR 27 CO -0.08 0.21 0.26 0.25 0.37 0.00 0.00 175.52 176.53 2a7k h LEU 28 N 0.31 0.79 -0.48 2.58 5.85 -1.81 -1.76 115.31 120.79 2a7k h LEU 28 Ca 0.09 -0.15 0.06 0.00 0.84 0.00 0.00 57.88 58.73 2a7k h LEU 28 Cb 0.23 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 2a7k h LEU 28 CO -0.00 0.72 0.17 -0.33 -0.34 0.00 0.00 178.44 178.66 2a7k h GLU 29 N 0.81 0.33 -0.54 1.25 5.08 -1.14 -1.14 114.58 119.23 2a7k h GLU 29 Ca 0.20 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.49 2a7k h GLU 29 Cb 0.16 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 2a7k h GLU 29 CO -0.02 0.22 0.14 1.15 -1.00 0.00 0.00 179.01 179.50 2a7k h THR 30 N 0.34 1.24 -0.67 1.13 2.02 -1.00 -0.67 112.91 115.31 2a7k h THR 30 Ca 0.23 -0.85 -0.06 0.00 0.77 0.00 0.00 66.41 66.49 2a7k h THR 30 Cb 0.24 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 2a7k h THR 30 CO -0.23 0.31 0.17 0.28 0.37 0.00 0.00 175.52 176.42 2a7k h SER 31 N 0.76 1.00 -0.29 4.18 0.02 -1.13 -0.86 113.55 117.23 2a7k h SER 31 Ca 0.17 -0.23 -0.10 0.00 -0.84 0.00 0.00 61.79 60.79 2a7k h SER 31 Cb 0.33 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 2a7k h SER 31 CO 0.00 0.97 -0.22 0.58 -1.14 0.00 0.00 176.83 177.02 2a7k h VAL 32 N 0.99 1.30 -0.45 2.27 2.07 -1.06 -0.42 116.25 120.96 2a7k h VAL 32 Ca 0.21 -1.37 -0.06 0.00 0.82 0.00 0.00 66.70 66.31 2a7k h VAL 32 Cb 0.35 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 2a7k h VAL 32 CO 0.00 0.44 0.06 0.11 0.02 0.00 0.00 177.57 178.19 2a7k h LYS 33 N 0.40 0.75 -0.67 1.57 1.57 -1.06 -1.71 116.57 117.42 2a7k h LYS 33 Ca 0.05 -0.21 -0.02 0.00 -1.87 0.00 0.00 60.65 58.60 2a7k h LYS 33 Cb 0.77 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.97 2a7k h LYS 33 CO 0.06 0.78 0.34 -0.44 -0.57 0.00 0.00 179.45 179.62 2a7k h ASP 34 N 0.61 0.86 -0.76 0.86 3.32 -1.10 -2.13 116.42 118.08 2a7k h ASP 34 Ca 0.13 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 2a7k h ASP 34 Cb 0.41 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 2a7k h ASP 34 CO 0.01 0.73 0.34 0.00 -1.72 0.00 0.00 179.24 178.60 2a7k h ALA 35 N 1.16 0.98 -0.66 3.45 0.00 -0.93 -1.22 119.26 122.05 2a7k h ALA 35 Ca 0.23 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 2a7k h ALA 35 Cb 0.08 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 2a7k h ALA 35 CO -0.03 0.57 0.09 -0.07 0.00 0.00 0.00 179.25 179.81 2a7k h LEU 36 N 1.08 1.06 -0.51 0.00 4.07 -1.20 -0.81 115.31 119.01 2a7k h LEU 36 Ca 0.26 -0.26 -0.16 0.00 0.08 0.00 0.00 57.88 57.80 2a7k h LEU 36 Cb 0.16 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.61 2a7k h LEU 36 CO -0.03 1.06 -0.48 0.00 -1.08 0.00 0.00 178.44 177.92 2a7k h ALA 37 N 1.05 0.69 -0.26 1.53 0.00 -1.17 -1.25 119.26 119.85 2a7k h ALA 37 Ca 0.20 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2a7k h ALA 37 Cb 0.46 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2a7k h ALA 37 CO 0.02 0.67 0.13 0.00 0.00 0.00 0.00 179.25 180.07 2a7k h ARG 38 N 0.53 0.37 -0.95 0.00 3.08 -1.05 -2.15 114.38 114.21 2a7k h ARG 38 Ca 0.03 -0.05 0.03 0.00 0.07 0.00 0.00 59.98 60.05 2a7k h ARG 38 Cb 1.03 -0.07 -0.05 0.00 0.08 0.00 0.00 29.97 30.96 2a7k h ARG 38 CO 0.10 0.35 0.63 0.00 -1.07 0.00 0.00 179.97 179.98 2a7k h ALA 39 N 1.00 1.36 -0.06 0.04 0.00 -1.03 -0.27 119.26 120.31 2a7k h ALA 39 Ca 0.09 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 2a7k h ALA 39 Cb 0.10 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2a7k h ALA 39 CO -0.01 0.57 -0.51 -0.97 0.00 0.00 0.00 179.25 178.32 2a7k h ASN 40 N 1.24 0.17 1.12 0.00 -1.24 -1.09 -3.19 115.58 112.59 2a7k h ASN 40 Ca 0.37 -0.08 -0.04 0.00 0.71 0.00 0.00 56.30 57.25 2a7k h ASN 40 Cb -0.06 -0.05 -0.01 0.00 0.73 0.00 0.00 38.32 38.94 2a7k h ASN 40 CO -0.10 0.66 -0.90 0.00 -1.29 0.00 0.00 177.43 175.79 2a7k h ALA 41 N 1.35 0.62 -1.89 1.57 0.00 -1.01 -3.46 119.26 116.43 2a7k h ALA 41 Ca 0.00 -0.21 -0.57 0.00 0.00 0.00 0.00 54.91 54.13 2a7k h ALA 41 Cb 0.95 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.72 2a7k h ALA 41 CO 0.08 0.23 0.82 0.34 0.00 0.00 0.00 179.25 180.72 2a7k s ASP 42 N -5.65 6.78 0.52 0.00 -1.08 -0.14 -4.92 116.67 112.19 2a7k s ASP 42 Ca 0.00 0.76 0.30 0.00 -0.52 0.00 0.00 52.55 53.10 2a7k s ASP 42 Cb 0.09 -2.53 1.39 0.00 -1.46 0.00 0.00 42.92 40.40 2a7k s ASP 42 CO 0.77 -1.00 2.01 0.44 0.52 0.00 0.00 175.17 177.92 2a7k h ASP 43 N 8.54 0.00 0.78 -0.34 5.19 -1.88 -1.86 116.42 126.86 2a7k h ASP 43 Ca -0.22 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.19 2a7k h ASP 43 Cb 1.06 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.57 2a7k h ASP 43 CO 1.05 0.10 0.00 -1.54 -3.12 0.00 0.00 179.24 175.73 2a7k n SER 44 N -3.34 0.00 -4.68 6.45 3.41 -1.26 -4.67 113.62 109.53 2a7k n SER 44 Ca -0.01 0.39 -0.37 0.00 -0.26 0.00 0.00 58.87 58.63 2a7k n SER 44 Cb 0.29 -0.46 -0.09 0.00 -0.26 0.00 0.00 64.21 63.70 2a7k n SER 44 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2a7k s VAL 45 N -2.92 5.33 -0.19 -3.33 1.01 -0.70 -4.45 120.40 115.14 2a7k s VAL 45 Ca 0.14 0.31 0.03 0.00 0.00 0.00 0.00 61.98 62.46 2a7k s VAL 45 Cb 0.16 -3.55 -0.02 0.00 0.00 0.00 0.00 36.38 32.97 2a7k s VAL 45 CO 0.44 0.34 0.22 0.54 0.00 0.00 0.00 175.10 176.64 2a7k n ARG 46 N 4.16 4.75 -3.44 2.72 5.12 0.14 -4.91 116.66 125.19 2a7k n ARG 46 Ca -0.14 -0.14 -0.13 0.00 -1.93 0.00 0.00 57.85 55.52 2a7k n ARG 46 Cb 0.52 -0.72 -0.03 0.00 -1.16 0.00 0.00 32.46 31.07 2a7k n ARG 46 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2a7k s ALA 47 N -1.08 -1.64 -0.04 7.54 0.00 -1.10 -4.07 121.76 121.36 2a7k s ALA 47 Ca 0.02 0.65 0.01 0.00 0.00 0.00 0.00 51.96 52.64 2a7k s ALA 47 Cb 0.02 0.72 0.02 0.00 0.00 0.00 0.00 23.12 23.88 2a7k s ALA 47 CO 0.11 -0.70 -0.05 0.08 0.00 0.00 0.00 175.76 175.19 2a7k s VAL 48 N -3.33 0.59 -0.10 0.00 1.01 0.13 -1.19 120.40 117.52 2a7k s VAL 48 Ca -0.00 -0.17 0.01 0.00 0.00 0.00 0.00 61.98 61.81 2a7k s VAL 48 Cb -0.01 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.76 2a7k s VAL 48 CO -0.09 0.23 -0.11 -0.69 0.00 0.00 0.00 175.10 174.43 2a7k s VAL 49 N 0.75 3.28 -0.12 2.92 1.01 -0.03 -0.01 120.40 128.19 2a7k s VAL 49 Ca -0.11 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 61.28 2a7k s VAL 49 Cb -0.13 -2.35 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 2a7k s VAL 49 CO 0.01 0.56 -0.17 -0.69 0.00 0.00 0.00 175.10 174.80 2a7k s VAL 50 N -0.20 2.72 0.00 2.92 1.01 0.13 -0.37 120.40 126.62 2a7k s VAL 50 Ca 0.01 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.22 2a7k s VAL 50 Cb -0.13 -2.11 -0.01 0.00 0.00 0.00 0.00 36.38 34.13 2a7k s VAL 50 CO 0.03 0.54 -0.03 -0.47 0.00 0.00 0.00 175.10 175.17 2a7k s TYR 51 N 0.35 0.24 -0.58 5.22 5.04 -0.52 -1.22 117.35 125.88 2a7k s TYR 51 Ca -0.14 -0.13 0.25 0.00 -2.44 0.00 0.00 57.07 54.62 2a7k s TYR 51 Cb -0.17 -0.16 0.86 0.00 0.35 0.00 0.00 41.96 42.85 2a7k s TYR 51 CO 0.07 -0.03 1.75 0.78 -1.34 0.00 0.00 175.55 176.78 2a7k h GLY 52 N 5.80 0.00 0.00 8.97 0.00 -1.80 -0.05 103.07 115.98 2a7k h GLY 52 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.06 2a7k h GLY 52 CO 0.49 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.64 2a7k n GLY 53 N 0.80 2.42 3.72 4.60 0.00 -1.26 -4.41 105.19 111.05 2a7k n GLY 53 Ca 0.04 -1.93 -0.42 0.00 0.00 0.00 0.00 46.02 43.71 2a7k n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a7k s ALA 54 N -2.89 3.72 -1.49 4.61 0.00 -1.26 -2.93 121.76 121.52 2a7k s ALA 54 Ca 0.00 1.29 -0.07 0.00 0.00 0.00 0.00 51.96 53.18 2a7k s ALA 54 Cb 0.00 -3.60 0.02 0.00 0.00 0.00 0.00 23.12 19.54 2a7k s ALA 54 CO 0.00 -0.75 0.74 0.39 0.00 0.00 0.00 175.76 176.14 2a7k n GLU 55 N 4.06 -5.39 -4.32 0.00 4.71 -1.26 -4.98 120.64 113.46 2a7k n GLU 55 Ca 0.13 0.82 -0.16 0.00 -0.01 0.00 0.00 57.16 57.94 2a7k n GLU 55 Cb 0.40 -5.71 -0.10 0.00 -1.01 0.00 0.00 31.44 25.02 2a7k n GLU 55 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 2a7k s ARG 56 N -5.93 1.35 0.17 3.49 0.52 -1.15 -5.03 118.95 112.37 2a7k s ARG 56 Ca 0.40 -1.71 -0.07 0.00 -0.52 0.00 0.00 55.73 53.83 2a7k s ARG 56 Cb -0.18 -0.42 -0.06 0.00 0.52 0.00 0.00 34.95 34.81 2a7k s ARG 56 CO 0.49 -0.20 0.45 -1.12 0.02 0.00 0.00 175.30 174.94 2a7k s SER 57 N -3.30 6.57 0.09 0.23 0.01 -0.04 -3.77 113.70 113.48 2a7k s SER 57 Ca 0.32 0.75 -0.36 0.00 1.31 0.00 0.00 55.95 57.97 2a7k s SER 57 Cb 0.07 -2.16 -0.17 0.00 0.21 0.00 0.00 66.02 63.98 2a7k s SER 57 CO 0.10 0.02 1.56 0.15 0.41 0.00 0.00 173.24 175.49 2a7k h PHE 58 N 2.86 -1.45 -1.17 2.43 3.57 -0.64 -3.39 116.94 119.14 2a7k h PHE 58 Ca -0.47 0.02 0.16 0.00 3.53 0.00 0.00 57.97 61.21 2a7k h PHE 58 Cb 1.17 0.58 -0.26 0.00 2.79 0.00 0.00 35.95 40.23 2a7k h PHE 58 CO 0.62 -0.66 0.34 0.45 -2.23 0.00 0.00 178.31 176.84 2a7k s SER 59 N -4.46 -0.48 0.00 0.41 0.15 -0.68 -4.59 113.70 104.05 2a7k s SER 59 Ca -0.18 0.71 0.13 0.00 0.70 0.00 0.00 55.95 57.32 2a7k s SER 59 Cb 0.05 1.40 0.73 0.00 -1.71 0.00 0.00 66.02 66.49 2a7k s SER 59 CO 0.61 -0.11 1.26 0.00 1.20 0.00 0.00 173.24 176.20 2a7k n ALA 60 N 4.31 1.90 0.00 5.45 0.00 0.72 -1.15 120.51 131.74 2a7k n ALA 60 Ca -0.13 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.23 2a7k n ALA 60 Cb 0.55 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.79 2a7k n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a7k n GLY 61 N -0.18 -1.51 3.80 0.00 0.00 -1.16 -4.49 105.19 101.64 2a7k n GLY 61 Ca 0.08 -1.69 -0.35 0.00 0.00 0.00 0.00 46.02 44.07 2a7k n GLY 61 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2a7k s GLY 62 N 0.00 2.63 -0.26 -0.02 0.00 -1.26 -0.45 107.32 107.96 2a7k s GLY 62 Ca 0.00 0.52 -0.37 0.00 0.00 0.00 0.00 44.72 44.87 2a7k s GLY 62 CO 0.00 0.90 1.93 1.34 0.00 0.00 0.00 173.10 177.27 2a7k n ASP 63 N -0.07 2.58 0.18 1.64 2.03 -1.26 -4.88 116.55 116.77 2a7k n ASP 63 Ca 0.05 0.83 0.04 0.00 0.52 0.00 0.00 54.79 56.22 2a7k n ASP 63 Cb 0.51 -1.24 0.33 0.00 -0.72 0.00 0.00 41.12 40.00 2a7k n ASP 63 CO 0.00 0.00 0.00 -0.26 -1.92 0.00 0.00 177.20 175.02 2a7k h PHE 64 N 9.48 0.00 0.00 -0.67 0.04 -1.96 -2.69 116.94 121.15 2a7k h PHE 64 Ca -0.40 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.23 2a7k h PHE 64 Cb 1.31 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.44 2a7k h PHE 64 CO 0.86 0.42 -0.63 -0.91 -0.60 0.00 0.00 178.31 177.45 2a7k h ASN 65 N 0.00 0.00 -0.37 2.17 2.35 -1.98 -2.22 115.58 115.54 2a7k h ASN 65 Ca -0.00 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.59 2a7k h ASN 65 Cb 0.86 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.23 2a7k h ASN 65 CO 0.05 0.63 -0.37 -0.33 -1.65 0.00 0.00 177.43 175.76 2a7k h GLU 66 N 0.00 0.90 -0.45 0.81 3.07 -1.93 -2.61 114.58 114.38 2a7k h GLU 66 Ca -0.01 -0.48 -0.10 0.00 -0.50 0.00 0.00 59.36 58.27 2a7k h GLU 66 Cb 1.42 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 29.33 2a7k h GLU 66 CO 0.08 1.13 -0.13 0.28 -1.40 0.00 0.00 179.01 178.97 2a7k h VAL 67 N 0.71 1.26 0.00 3.13 2.07 -1.52 -0.71 116.25 121.20 2a7k h VAL 67 Ca 0.06 -1.23 0.00 0.00 0.82 0.00 0.00 66.70 66.35 2a7k h VAL 67 Cb 0.97 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.79 2a7k h VAL 67 CO 0.09 0.42 0.00 0.11 0.02 0.00 0.00 177.57 178.22 2a7k h LYS 68 N 0.75 0.00 0.00 1.57 1.57 -1.43 -2.93 116.57 116.10 2a7k h LYS 68 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 2a7k h LYS 68 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 2a7k h LYS 68 CO 0.04 0.00 -1.00 0.00 -0.57 0.00 0.00 179.45 177.93 2a7k n GLN 69 N -2.35 0.03 -1.67 3.15 10.64 -0.98 -4.88 117.38 121.32 2a7k n GLN 69 Ca 0.04 -0.01 -0.35 0.00 -1.83 0.00 0.00 57.00 54.85 2a7k n GLN 69 Cb 0.38 -1.50 -0.03 0.00 -0.86 0.00 0.00 30.24 28.23 2a7k n GLN 69 CO 0.00 0.00 0.00 -1.17 -1.83 0.00 0.00 177.06 174.06 2a7k s LEU 70 N -3.08 3.35 -0.01 2.61 1.98 -0.29 -4.77 118.68 118.46 2a7k s LEU 70 Ca 0.08 0.84 0.02 0.00 -2.89 0.00 0.00 54.13 52.17 2a7k s LEU 70 Cb 0.16 -2.51 -0.03 0.00 0.66 0.00 0.00 46.19 44.47 2a7k s LEU 70 CO 0.85 -2.83 0.02 -1.54 -1.89 0.00 0.00 176.35 170.96 2a7k n SER 71 N 15.39 4.58 -4.77 3.68 3.41 -1.26 -4.90 113.62 129.75 2a7k n SER 71 Ca 0.34 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.56 2a7k n SER 71 Cb 0.54 0.83 -0.06 0.00 -0.26 0.00 0.00 64.21 65.26 2a7k n SER 71 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2a7k s ARG 72 N -2.09 4.25 0.14 4.33 3.00 -1.26 -5.01 118.95 122.30 2a7k s ARG 72 Ca -0.01 0.61 -0.14 0.00 0.00 0.00 0.00 55.73 56.20 2a7k s ARG 72 Cb 0.01 -3.34 0.00 0.00 0.00 0.00 0.00 34.95 31.62 2a7k s ARG 72 CO 0.07 0.39 1.61 0.66 0.00 0.00 0.00 175.30 178.03 2a7k h SER 73 N 5.66 0.73 -1.26 0.23 4.64 -1.98 -2.04 113.55 119.54 2a7k h SER 73 Ca -0.46 -0.28 0.36 0.00 -0.47 0.00 0.00 61.79 60.95 2a7k h SER 73 Cb 1.20 -0.19 -0.06 0.00 -0.31 0.00 0.00 62.40 63.03 2a7k h SER 73 CO 0.69 0.82 0.89 -0.33 -0.87 0.00 0.00 176.83 178.03 2a7k h GLU 74 N 0.61 0.06 0.15 4.77 3.07 -1.98 0.35 114.58 121.61 2a7k h GLU 74 Ca 0.13 -0.00 -0.29 0.00 -0.50 0.00 0.00 59.36 58.70 2a7k h GLU 74 Cb 0.42 -0.01 0.02 0.00 -0.84 0.00 0.00 28.75 28.34 2a7k h GLU 74 CO 0.01 0.04 -1.28 -0.44 -1.40 0.00 0.00 179.01 175.94 2a7k h ASP 75 N 0.06 0.65 0.25 1.42 3.32 -1.79 -1.84 116.42 118.48 2a7k h ASP 75 Ca 0.62 -0.66 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 2a7k h ASP 75 Cb 2.34 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 41.68 2a7k h ASP 75 CO -0.07 1.50 -0.12 0.40 -1.72 0.00 0.00 179.24 179.23 2a7k h ILE 76 N 0.15 0.81 -0.86 0.35 1.08 -0.15 0.13 117.51 119.02 2a7k h ILE 76 Ca -0.18 -0.42 0.22 0.00 -0.39 0.00 0.00 64.86 64.10 2a7k h ILE 76 Cb 1.98 1.05 -0.14 0.00 -3.07 0.00 0.00 36.82 36.64 2a7k h ILE 76 CO 0.23 0.09 0.23 -0.08 -0.69 0.00 0.00 178.15 177.93 2a7k h GLU 77 N -0.55 0.21 -0.09 2.37 4.57 -0.78 0.43 114.58 120.74 2a7k h GLU 77 Ca -0.03 -0.01 -0.15 0.00 -1.18 0.00 0.00 59.36 57.98 2a7k h GLU 77 Cb 0.40 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.94 2a7k h GLU 77 CO 0.06 0.14 -0.61 1.49 -1.18 0.00 0.00 179.01 178.91 2a7k h GLU 78 N 0.22 0.32 -0.11 1.92 4.81 -1.07 -2.21 114.58 118.46 2a7k h GLU 78 Ca 0.53 -0.22 -0.18 0.00 -0.13 0.00 0.00 59.36 59.36 2a7k h GLU 78 Cb 1.05 0.03 0.01 0.00 0.63 0.00 0.00 28.75 30.48 2a7k h GLU 78 CO -0.64 0.83 -0.64 2.35 -0.73 0.00 0.00 179.01 180.18 2a7k h TRP 79 N 0.24 0.85 -0.43 0.92 7.01 0.57 -1.68 115.95 123.43 2a7k h TRP 79 Ca -0.01 -0.39 0.07 0.00 2.11 0.00 0.00 58.89 60.67 2a7k h TRP 79 Cb 1.13 -0.13 -0.06 0.00 -2.10 0.00 0.00 29.16 28.00 2a7k h TRP 79 CO 0.03 1.19 0.10 0.82 -2.79 0.00 0.00 178.44 177.79 2a7k h ILE 80 N 0.27 0.79 -0.81 2.65 2.04 -1.03 -1.39 117.51 120.03 2a7k h ILE 80 Ca -0.05 -0.08 0.02 0.00 1.00 0.00 0.00 64.86 65.75 2a7k h ILE 80 Cb 1.29 0.53 -0.04 0.00 -0.74 0.00 0.00 36.82 37.86 2a7k h ILE 80 CO 0.13 0.04 0.53 0.44 0.00 0.00 0.00 178.15 179.29 2a7k h ASP 81 N 0.23 0.90 -0.63 1.72 3.32 -1.38 -2.05 116.42 118.53 2a7k h ASP 81 Ca 0.21 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.23 2a7k h ASP 81 Cb 0.25 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 2a7k h ASP 81 CO -0.26 0.64 0.33 0.03 -1.72 0.00 0.00 179.24 178.26 2a7k h ARG 82 N 1.06 0.88 0.25 3.56 3.08 -0.96 0.24 114.38 122.50 2a7k h ARG 82 Ca 0.31 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 60.23 2a7k h ARG 82 Cb -0.07 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 29.81 2a7k h ARG 82 CO -0.08 0.68 -0.12 0.28 -1.07 0.00 0.00 179.97 179.65 2a7k h VAL 83 N 0.85 0.79 -0.58 2.04 2.07 -1.02 -1.41 116.25 118.99 2a7k h VAL 83 Ca 0.22 -0.29 -0.10 0.00 0.82 0.00 0.00 66.70 67.35 2a7k h VAL 83 Cb 0.06 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 2a7k h VAL 83 CO -0.03 0.06 -0.04 0.40 0.02 0.00 0.00 177.57 177.98 2a7k h ILE 84 N -0.48 1.27 -0.88 4.57 1.08 -1.35 -2.76 117.51 118.95 2a7k h ILE 84 Ca -0.03 -1.20 0.02 0.00 -0.39 0.00 0.00 64.86 63.25 2a7k h ILE 84 Cb 0.36 0.86 -0.05 0.00 -3.07 0.00 0.00 36.82 34.93 2a7k h ILE 84 CO 0.06 0.43 0.58 0.44 -0.69 0.00 0.00 178.15 178.97 2a7k h ASP 85 N 0.95 0.99 -0.53 1.72 3.32 -0.92 -0.62 116.42 121.34 2a7k h ASP 85 Ca 0.16 -0.02 0.05 0.00 0.02 0.00 0.00 57.03 57.24 2a7k h ASP 85 Cb 0.61 -0.24 -0.05 0.00 0.22 0.00 0.00 39.33 39.87 2a7k h ASP 85 CO 0.04 0.71 0.26 0.25 -1.72 0.00 0.00 179.24 178.78 2a7k h LEU 86 N 1.17 0.36 -0.34 1.55 6.46 -0.99 -1.20 115.31 122.33 2a7k h LEU 86 Ca 0.33 0.03 -0.19 0.00 -0.12 0.00 0.00 57.88 57.93 2a7k h LEU 86 Cb -0.10 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 39.80 2a7k h LEU 86 CO -0.08 0.25 -0.69 1.88 -0.62 0.00 0.00 178.44 179.17 2a7k h TYR 87 N 0.50 0.80 -0.56 1.25 0.05 -1.20 -3.06 116.97 114.75 2a7k h TYR 87 Ca 0.24 -0.33 -0.03 0.00 0.05 0.00 0.00 58.73 58.66 2a7k h TYR 87 Cb 0.16 -0.13 -0.03 0.00 1.01 0.00 0.00 36.73 37.75 2a7k h TYR 87 CO -0.11 1.12 0.23 1.96 -1.05 0.00 0.00 178.16 180.30 2a7k h GLN 88 N 0.43 0.80 -0.92 4.88 1.08 -0.98 -1.67 115.11 118.74 2a7k h GLN 88 Ca -0.03 -0.12 0.06 0.00 -1.45 0.00 0.00 58.65 57.12 2a7k h GLN 88 Cb 1.28 -0.14 -0.06 0.00 -0.05 0.00 0.00 27.48 28.51 2a7k h GLN 88 CO 0.13 0.66 0.60 0.00 -0.95 0.00 0.00 178.83 179.27 2a7k h ALA 89 N 1.45 1.50 -0.03 3.87 0.00 -1.12 -0.28 119.26 124.65 2a7k h ALA 89 Ca 0.19 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2a7k h ALA 89 Cb 0.15 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2a7k h ALA 89 CO -0.02 0.36 -0.07 0.28 0.00 0.00 0.00 179.25 179.81 2a7k h VAL 90 N 1.05 1.44 0.00 0.00 2.07 -1.40 -3.27 116.25 116.14 2a7k h VAL 90 Ca 0.39 -1.40 -0.01 0.00 0.82 0.00 0.00 66.70 66.50 2a7k h VAL 90 Cb 0.20 2.30 -0.00 0.00 -1.52 0.00 0.00 31.29 32.26 2a7k h VAL 90 CO -0.15 0.38 -0.07 -0.07 0.02 0.00 0.00 177.57 177.68 2a7k h LEU 91 N -0.43 0.00 -0.86 2.57 3.38 -1.04 -2.41 115.31 116.51 2a7k h LEU 91 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2a7k h LEU 91 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2a7k h LEU 91 CO 0.01 0.07 0.00 0.59 0.09 0.00 0.00 178.44 179.20 2a7k n ASN 92 N -4.21 1.30 -4.65 -0.43 3.02 -0.14 -4.74 115.26 105.41 2a7k n ASN 92 Ca -0.03 -1.59 -0.43 0.00 -0.03 0.00 0.00 54.58 52.50 2a7k n ASN 92 Cb 0.15 -0.06 -0.02 0.00 -0.61 0.00 0.00 39.78 39.24 2a7k n ASN 92 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2a7k s VAL 93 N -1.87 4.62 -2.42 2.41 1.01 -0.91 -4.92 120.40 118.32 2a7k s VAL 93 Ca 0.33 1.92 0.22 0.00 0.00 0.00 0.00 61.98 64.46 2a7k s VAL 93 Cb 0.18 -4.34 0.43 0.00 0.00 0.00 0.00 36.38 32.64 2a7k s VAL 93 CO 0.27 -0.29 1.50 0.59 0.00 0.00 0.00 175.10 177.18 2a7k n ASN 94 N 6.51 2.29 -4.93 3.32 5.03 -1.26 -4.83 115.26 121.39 2a7k n ASN 94 Ca 0.12 -1.80 -0.25 0.00 0.87 0.00 0.00 54.58 53.52 2a7k n ASN 94 Cb 0.46 -0.13 -0.01 0.00 -1.02 0.00 0.00 39.78 39.09 2a7k n ASN 94 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2a7k s LYS 95 N -1.75 3.51 0.18 3.52 1.02 -1.26 -4.26 119.74 120.70 2a7k s LYS 95 Ca 0.34 -0.17 -0.33 0.00 0.02 0.00 0.00 55.97 55.84 2a7k s LYS 95 Cb 0.20 -2.59 -0.15 0.00 -0.52 0.00 0.00 37.83 34.76 2a7k s LYS 95 CO 0.29 0.07 1.23 -2.30 -0.92 0.00 0.00 175.35 173.72 2a7k n PRO 96 N -1.82 1.36 -5.05 -1.68 -0.02 -1.26 -4.83 135.00 121.71 2a7k n PRO 96 Ca -0.03 0.49 -0.29 0.00 -2.02 0.00 0.00 63.50 61.64 2a7k n PRO 96 Cb 0.56 -2.03 -0.16 0.00 -0.02 0.00 0.00 33.50 31.84 2a7k n PRO 96 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2a7k s THR 97 N -0.09 1.76 -0.09 3.45 -4.23 -1.26 -0.69 115.64 114.49 2a7k s THR 97 Ca 0.73 -0.88 0.02 0.00 -1.18 0.00 0.00 61.69 60.38 2a7k s THR 97 Cb -0.81 -1.51 0.01 0.00 1.34 0.00 0.00 72.50 71.53 2a7k s THR 97 CO 0.51 0.49 -0.13 -0.63 -0.54 0.00 0.00 174.62 174.32 2a7k s ILE 98 N 0.10 1.27 -0.24 2.99 -1.09 0.98 -1.63 121.20 123.58 2a7k s ILE 98 Ca -0.08 -0.52 -0.11 0.00 -2.23 0.00 0.00 60.65 57.71 2a7k s ILE 98 Cb -0.14 -1.17 -0.05 0.00 -1.58 0.00 0.00 42.46 39.51 2a7k s ILE 98 CO 0.04 0.39 0.16 0.00 -1.23 0.00 0.00 174.94 174.31 2a7k s ALA 99 N 0.92 3.61 -0.44 9.38 0.00 -0.59 -0.70 121.76 133.94 2a7k s ALA 99 Ca -0.09 -0.89 -0.08 0.00 0.00 0.00 0.00 51.96 50.90 2a7k s ALA 99 Cb -0.15 -2.34 0.10 0.00 0.00 0.00 0.00 23.12 20.73 2a7k s ALA 99 CO 0.00 -0.21 0.28 0.00 0.00 0.00 0.00 175.76 175.83 2a7k s ALA 100 N 1.09 3.29 -0.36 0.00 0.00 -0.36 -0.83 121.76 124.60 2a7k s ALA 100 Ca 0.08 -2.38 -0.13 0.00 0.00 0.00 0.00 51.96 49.53 2a7k s ALA 100 Cb -0.14 -2.66 -0.00 0.00 0.00 0.00 0.00 23.12 20.32 2a7k s ALA 100 CO 0.05 -1.78 0.25 0.08 0.00 0.00 0.00 175.76 174.36 2a7k s VAL 101 N 1.34 5.18 0.36 0.00 1.01 0.82 -4.06 120.40 125.04 2a7k s VAL 101 Ca 0.05 -0.42 0.08 0.00 0.00 0.00 0.00 61.98 61.69 2a7k s VAL 101 Cb -0.24 -3.74 -0.07 0.00 0.00 0.00 0.00 36.38 32.32 2a7k s VAL 101 CO -0.00 -0.11 -0.04 -0.62 0.00 0.00 0.00 175.10 174.32 2a7k s ASP 102 N 1.69 3.57 1.19 3.32 -1.08 -1.26 -1.29 116.67 122.81 2a7k s ASP 102 Ca 0.05 -1.28 0.00 0.00 -0.52 0.00 0.00 52.55 50.81 2a7k s ASP 102 Cb -0.18 -0.33 0.00 0.00 -1.46 0.00 0.00 42.92 40.95 2a7k s ASP 102 CO 0.10 -0.34 0.00 0.61 0.52 0.00 0.00 175.17 176.05 2a7k n GLY 103 N -0.83 3.02 3.86 2.66 0.00 -1.25 -0.80 105.19 111.85 2a7k n GLY 103 Ca -0.05 -0.20 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 2a7k n GLY 103 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2a7k s TYR 104 N 0.00 3.60 -0.40 1.61 2.02 -1.26 -1.25 117.35 121.67 2a7k s TYR 104 Ca 0.00 0.58 0.04 0.00 -0.37 0.00 0.00 57.07 57.32 2a7k s TYR 104 Cb 0.00 -2.02 0.11 0.00 -0.40 0.00 0.00 41.96 39.65 2a7k s TYR 104 CO 0.00 0.68 0.12 0.00 -1.57 0.00 0.00 175.55 174.78 2a7k s ALA 105 N -0.89 3.03 -0.10 3.71 0.00 -0.38 -1.69 121.76 125.43 2a7k s ALA 105 Ca 0.16 -2.76 0.03 0.00 0.00 0.00 0.00 51.96 49.39 2a7k s ALA 105 Cb -0.13 -2.05 -0.01 0.00 0.00 0.00 0.00 23.12 20.94 2a7k s ALA 105 CO 0.05 -1.79 -0.20 0.42 0.00 0.00 0.00 175.76 174.24 2a7k s ILE 106 N 0.56 2.45 0.00 0.00 1.01 -0.30 -1.27 121.20 123.65 2a7k s ILE 106 Ca 0.13 -0.89 0.00 0.00 0.00 0.00 0.00 60.65 59.89 2a7k s ILE 106 Cb -0.21 -1.97 0.00 0.00 0.01 0.00 0.00 42.46 40.29 2a7k s ILE 106 CO -0.06 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.04 2a7k n GLY 107 N 3.41 3.44 0.43 6.18 0.00 -0.08 -0.94 105.19 117.64 2a7k n GLY 107 Ca -0.18 0.24 0.24 0.00 0.00 0.00 0.00 46.02 46.32 2a7k n GLY 107 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2a7k h MET 108 N 0.00 0.14 -0.42 1.61 2.86 -1.91 0.47 114.93 117.69 2a7k h MET 108 Ca 0.00 -0.01 -0.12 0.00 -2.06 0.00 0.00 59.70 57.51 2a7k h MET 108 Cb 0.00 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 2a7k h MET 108 CO 0.00 0.09 -0.22 0.78 1.06 0.00 0.00 176.91 178.62 2a7k h GLY 109 N 0.15 0.90 0.67 8.32 0.00 -1.18 0.11 103.07 112.04 2a7k h GLY 109 Ca 0.43 -0.78 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 2a7k h GLY 109 CO -0.07 0.71 -0.01 -2.75 0.00 0.00 0.00 176.54 174.42 2a7k h PHE 110 N 0.73 0.11 -0.73 5.60 3.04 -1.27 -2.20 116.94 122.21 2a7k h PHE 110 Ca 0.10 -0.02 0.01 0.00 3.98 0.00 0.00 57.97 62.03 2a7k h PHE 110 Cb 0.75 -0.03 -0.04 0.00 2.56 0.00 0.00 35.95 39.20 2a7k h PHE 110 CO 0.04 0.45 0.48 1.96 -2.02 0.00 0.00 178.31 179.22 2a7k h GLN 111 N -0.26 0.97 -0.41 1.11 4.20 -0.91 -2.48 115.11 117.32 2a7k h GLN 111 Ca 0.01 -0.06 0.05 0.00 0.06 0.00 0.00 58.65 58.71 2a7k h GLN 111 Cb 0.41 -0.22 -0.04 0.00 0.30 0.00 0.00 27.48 27.93 2a7k h GLN 111 CO 0.01 0.65 0.15 0.35 -0.67 0.00 0.00 178.83 179.32 2a7k h PHE 112 N 1.00 0.27 -0.26 2.96 3.57 -0.78 -2.79 116.94 120.91 2a7k h PHE 112 Ca 0.27 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.79 2a7k h PHE 112 Cb -0.10 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.56 2a7k h PHE 112 CO -0.02 0.11 0.17 0.00 -2.23 0.00 0.00 178.31 176.34 2a7k h ALA 113 N 1.26 1.84 0.00 2.41 0.00 -1.07 -2.07 119.26 121.62 2a7k h ALA 113 Ca 0.19 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2a7k h ALA 113 Cb 0.17 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2a7k h ALA 113 CO -0.19 0.15 0.00 1.28 0.00 0.00 0.00 179.25 180.49 2a7k n LEU 114 N -4.50 0.16 0.14 0.00 4.77 -0.96 -2.49 117.00 114.12 2a7k n LEU 114 Ca 0.01 0.54 0.12 0.00 -0.03 0.00 0.00 56.01 56.65 2a7k n LEU 114 Cb 0.08 -0.52 0.22 0.00 -2.33 0.00 0.00 43.42 40.87 2a7k n LEU 114 CO 0.35 -0.33 0.66 0.24 -1.33 0.00 0.00 177.39 176.97 2a7k h MET 115 N 0.00 0.00 -7.08 3.23 2.86 -1.41 -3.47 114.93 109.05 2a7k h MET 115 Ca 0.00 0.00 -0.46 0.00 -2.06 0.00 0.00 59.70 57.18 2a7k h MET 115 Cb 0.27 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.93 2a7k h MET 115 CO 0.00 0.00 0.32 -0.06 1.06 0.00 0.00 176.91 178.23 2a7k s PHE 116 N -3.19 3.39 0.34 -0.22 0.40 -1.04 -4.48 117.98 113.18 2a7k s PHE 116 Ca 0.07 1.48 0.05 0.00 -0.60 0.00 0.00 56.93 57.93 2a7k s PHE 116 Cb 0.09 -2.77 0.62 0.00 0.51 0.00 0.00 43.02 41.47 2a7k s PHE 116 CO 0.67 -0.22 1.87 -0.44 0.70 0.00 0.00 175.22 177.81 2a7k h ASP 117 N 1.43 0.45 -5.02 1.36 3.32 -1.64 -3.44 116.42 112.88 2a7k h ASP 117 Ca -0.48 -0.09 -0.14 0.00 0.02 0.00 0.00 57.03 56.34 2a7k h ASP 117 Cb 1.18 -0.12 -0.20 0.00 0.22 0.00 0.00 39.33 40.42 2a7k h ASP 117 CO 0.62 0.55 -0.53 -1.10 -1.72 0.00 0.00 179.24 177.05 2a7k s GLN 118 N -4.91 0.50 -0.06 3.56 -0.21 -1.02 -5.03 119.66 112.49 2a7k s GLN 118 Ca -0.07 -0.55 0.03 0.00 0.02 0.00 0.00 55.36 54.79 2a7k s GLN 118 Cb 0.15 0.20 0.01 0.00 1.00 0.00 0.00 33.01 34.37 2a7k s GLN 118 CO 0.76 -0.12 -0.15 1.03 -2.12 0.00 0.00 175.29 174.70 2a7k s ARG 119 N -1.82 1.86 0.07 2.91 0.52 -1.26 -1.55 118.95 119.69 2a7k s ARG 119 Ca -0.12 -0.52 0.08 0.00 -0.52 0.00 0.00 55.73 54.65 2a7k s ARG 119 Cb -0.06 -1.54 -0.04 0.00 0.52 0.00 0.00 34.95 33.84 2a7k s ARG 119 CO -0.01 0.11 -0.16 -0.51 0.02 0.00 0.00 175.30 174.75 2a7k s LEU 120 N 0.43 2.73 0.14 2.53 1.43 -0.01 -0.32 118.68 125.61 2a7k s LEU 120 Ca -0.12 -0.45 0.05 0.00 -1.03 0.00 0.00 54.13 52.58 2a7k s LEU 120 Cb -0.15 -1.59 -0.04 0.00 0.03 0.00 0.00 46.19 44.45 2a7k s LEU 120 CO 0.04 0.22 -0.12 0.00 0.23 0.00 0.00 176.35 176.72 2a7k s MET 121 N -1.80 1.04 0.53 1.70 0.23 -0.63 -0.13 119.30 120.25 2a7k s MET 121 Ca 0.17 -1.34 -0.18 0.00 -1.03 0.00 0.00 55.69 53.30 2a7k s MET 121 Cb -0.11 -0.75 -0.07 0.00 -1.53 0.00 0.00 34.83 32.37 2a7k s MET 121 CO 0.08 0.12 1.05 0.00 -2.03 0.00 0.00 175.02 174.24 2a7k s ALA 122 N -2.74 2.83 -0.27 3.16 0.00 -0.41 -1.52 121.76 122.80 2a7k s ALA 122 Ca 0.13 0.51 0.25 0.00 0.00 0.00 0.00 51.96 52.85 2a7k s ALA 122 Cb -0.01 -3.24 1.16 0.00 0.00 0.00 0.00 23.12 21.03 2a7k s ALA 122 CO 0.02 -0.51 1.76 0.66 0.00 0.00 0.00 175.76 177.69 2a7k h SER 123 N 1.10 0.00 -0.34 0.00 4.64 -1.20 -2.02 113.55 115.72 2a7k h SER 123 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2a7k h SER 123 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2a7k h SER 123 CO 0.58 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.89 2a7k n THR 124 N -2.37 0.68 -2.54 2.95 -2.24 -1.26 -4.42 114.28 105.07 2a7k n THR 124 Ca 0.01 -0.84 -0.26 0.00 -2.27 0.00 0.00 64.05 60.69 2a7k n THR 124 Cb 0.17 0.77 0.03 0.00 -2.10 0.00 0.00 70.33 69.19 2a7k n THR 124 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2a7k s ALA 125 N -1.11 3.41 -0.01 6.98 0.00 -0.76 -4.68 121.76 125.59 2a7k s ALA 125 Ca 0.28 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.47 2a7k s ALA 125 Cb 0.16 -2.49 0.01 0.00 0.00 0.00 0.00 23.12 20.80 2a7k s ALA 125 CO 0.22 -0.69 0.01 -0.80 0.00 0.00 0.00 175.76 174.50 2a7k s ASN 126 N -4.28 0.10 -0.09 0.00 -0.87 -0.38 -3.74 114.94 105.68 2a7k s ASN 126 Ca 0.52 0.01 -0.09 0.00 -1.57 0.00 0.00 52.86 51.73 2a7k s ASN 126 Cb -0.10 -0.05 -0.04 0.00 -0.02 0.00 0.00 41.25 41.03 2a7k s ASN 126 CO 0.43 -0.05 0.20 -0.36 -2.57 0.00 0.00 177.10 174.75 2a7k s PHE 127 N 0.50 3.63 -0.06 2.20 0.40 -0.26 -1.25 117.98 123.14 2a7k s PHE 127 Ca -0.04 0.63 -0.04 0.00 -0.60 0.00 0.00 56.93 56.87 2a7k s PHE 127 Cb -0.06 -2.01 0.02 0.00 0.51 0.00 0.00 43.02 41.47 2a7k s PHE 127 CO -0.01 0.72 0.15 0.08 0.70 0.00 0.00 175.22 176.85 2a7k s VAL 128 N -1.05 -0.01 -0.59 -0.44 1.01 -0.39 0.25 120.40 119.17 2a7k s VAL 128 Ca 0.17 0.05 0.06 0.00 0.00 0.00 0.00 61.98 62.26 2a7k s VAL 128 Cb -0.13 -0.22 0.24 0.00 0.00 0.00 0.00 36.38 36.27 2a7k s VAL 128 CO 0.06 0.02 0.67 0.80 0.00 0.00 0.00 175.10 176.66 2a7k n MET 129 N 3.35 2.07 -0.37 2.72 1.56 -1.26 -0.90 117.12 124.30 2a7k n MET 129 Ca -0.16 -4.35 0.07 0.00 -0.27 0.00 0.00 57.70 52.99 2a7k n MET 129 Cb 0.57 -2.05 0.24 0.00 2.15 0.00 0.00 33.22 34.13 2a7k n MET 129 CO 0.00 0.00 0.00 -0.35 -0.73 0.00 0.00 175.97 174.89 2a7k n PRO 130 N 1.10 2.62 -0.32 2.12 -0.04 -1.26 -4.51 135.00 134.71 2a7k n PRO 130 Ca 0.27 -1.91 -0.06 0.00 -0.04 0.00 0.00 63.50 61.77 2a7k n PRO 130 Cb 0.43 -1.59 -0.01 0.00 -0.04 0.00 0.00 33.50 32.29 2a7k n PRO 130 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2a7k h GLU 131 N 2.86 -0.08 -0.52 0.54 3.07 -1.90 -1.95 114.58 116.60 2a7k h GLU 131 Ca 0.00 0.01 -0.06 0.00 -0.50 0.00 0.00 59.36 58.80 2a7k h GLU 131 Cb 0.93 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.84 2a7k h GLU 131 CO 0.10 -0.05 0.07 -0.07 -1.40 0.00 0.00 179.01 177.67 2a7k h LEU 132 N -0.08 0.78 -1.98 1.33 3.38 -1.81 0.56 115.31 117.49 2a7k h LEU 132 Ca 0.25 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 58.09 2a7k h LEU 132 Cb 0.54 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 2a7k h LEU 132 CO -0.86 0.80 0.08 0.50 0.09 0.00 0.00 178.44 179.04 2a7k h LYS 133 N 0.78 0.02 -0.34 1.13 3.64 -1.69 -2.32 116.57 117.80 2a7k h LYS 133 Ca 0.16 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2a7k h LYS 133 Cb 0.36 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 2a7k h LYS 133 CO 0.01 0.01 0.00 0.72 -2.27 0.00 0.00 179.45 177.92 2a7k n HIS 134 N -4.51 0.43 -1.95 1.91 8.25 0.02 -4.96 115.22 114.42 2a7k n HIS 134 Ca -0.00 -0.22 -0.04 0.00 -0.26 0.00 0.00 57.72 57.20 2a7k n HIS 134 Cb 0.18 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.29 2a7k n HIS 134 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2a7k n GLY 135 N 1.48 0.27 3.52 -1.41 0.00 -0.72 -5.04 105.19 103.28 2a7k n GLY 135 Ca 0.19 -0.74 -0.34 0.00 0.00 0.00 0.00 46.02 45.13 2a7k n GLY 135 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2a7k s ILE 136 N -2.20 3.82 0.42 -0.61 -1.09 -0.25 -5.00 121.20 116.29 2a7k s ILE 136 Ca 0.00 -0.40 -0.26 0.00 -2.23 0.00 0.00 60.65 57.76 2a7k s ILE 136 Cb 0.00 -2.64 -0.09 0.00 -1.58 0.00 0.00 42.46 38.15 2a7k s ILE 136 CO 0.00 0.52 1.43 -0.83 -1.23 0.00 0.00 174.94 174.83 2a7k s GLY 137 N 0.05 2.93 -0.18 6.18 0.00 -1.26 -3.25 107.32 111.79 2a7k s GLY 137 Ca -0.00 1.47 0.13 0.00 0.00 0.00 0.00 44.72 46.31 2a7k s GLY 137 CO 0.03 2.10 1.21 0.00 0.00 0.00 0.00 173.10 176.44 2a7k h SER 139 N 0.99 0.33 -0.03 0.00 4.64 -1.98 -0.80 113.55 116.69 2a7k h SER 139 Ca -0.03 -0.12 -0.02 0.00 -0.47 0.00 0.00 61.79 61.15 2a7k h SER 139 Cb 1.11 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 2a7k h SER 139 CO 0.01 0.63 -0.07 0.58 -0.87 0.00 0.00 176.83 177.12 2a7k h VAL 140 N 0.29 1.44 -0.58 0.95 2.07 -1.95 -1.13 116.25 117.34 2a7k h VAL 140 Ca 0.04 -1.41 0.02 0.00 0.82 0.00 0.00 66.70 66.17 2a7k h VAL 140 Cb 0.68 2.31 -0.03 0.00 -1.52 0.00 0.00 31.29 32.73 2a7k h VAL 140 CO 0.05 0.38 0.39 1.23 0.02 0.00 0.00 177.57 179.64 2a7k h GLY 141 N -0.43 0.81 0.96 2.17 0.00 -1.90 -1.93 103.07 102.74 2a7k h GLY 141 Ca 0.00 -0.29 -0.08 0.00 0.00 0.00 0.00 47.33 46.96 2a7k h GLY 141 CO 0.01 0.28 -0.05 0.00 0.00 0.00 0.00 176.54 176.78 2a7k h ALA 142 N 1.65 0.54 -0.64 3.60 0.00 -1.08 -1.22 119.26 122.10 2a7k h ALA 142 Ca 0.22 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.85 2a7k h ALA 142 Cb -0.03 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 2a7k h ALA 142 CO -0.05 0.36 0.42 0.00 0.00 0.00 0.00 179.25 179.98 2a7k h ALA 143 N 0.86 0.81 -0.02 0.00 0.00 -0.88 -0.90 119.26 119.12 2a7k h ALA 143 Ca 0.11 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2a7k h ALA 143 Cb 0.55 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2a7k h ALA 143 CO 0.03 0.23 -0.01 0.82 0.00 0.00 0.00 179.25 180.32 2a7k h ILE 144 N 0.86 1.31 -0.10 0.00 2.04 -1.28 -2.16 117.51 118.17 2a7k h ILE 144 Ca 0.23 -0.93 -0.18 0.00 1.00 0.00 0.00 64.86 64.98 2a7k h ILE 144 Cb -0.09 1.90 -0.00 0.00 -0.74 0.00 0.00 36.82 37.88 2a7k h ILE 144 CO -0.05 0.25 -0.70 0.25 0.00 0.00 0.00 178.15 177.90 2a7k h LEU 145 N -0.34 0.54 -1.27 1.44 5.85 -1.21 0.25 115.31 120.58 2a7k h LEU 145 Ca 0.00 -0.34 -0.03 0.00 0.84 0.00 0.00 57.88 58.36 2a7k h LEU 145 Cb 0.40 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 2a7k h LEU 145 CO 0.00 1.08 0.20 1.23 -0.34 0.00 0.00 178.44 180.61 2a7k h GLY 146 N 1.18 0.75 0.59 3.75 0.00 -1.20 0.37 103.07 108.51 2a7k h GLY 146 Ca -0.03 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 46.94 2a7k h GLY 146 CO 0.12 0.35 -0.00 -2.75 0.00 0.00 0.00 176.54 174.26 2a7k h PHE 147 N 0.70 0.01 -0.14 5.60 3.04 -0.93 -2.17 116.94 123.05 2a7k h PHE 147 Ca 0.17 -0.00 -0.21 0.00 3.98 0.00 0.00 57.97 61.90 2a7k h PHE 147 Cb 0.14 -0.00 0.01 0.00 2.56 0.00 0.00 35.95 38.65 2a7k h PHE 147 CO 0.01 0.42 -0.75 1.79 -2.02 0.00 0.00 178.31 177.76 2a7k h THR 148 N -0.40 1.29 0.00 4.41 1.35 -0.77 -3.38 112.91 115.40 2a7k h THR 148 Ca 0.00 -1.96 0.00 0.00 -0.55 0.00 0.00 66.41 63.90 2a7k h THR 148 Cb 0.42 2.02 0.00 0.00 -1.73 0.00 0.00 68.15 68.86 2a7k h THR 148 CO 0.00 0.62 0.00 1.41 -0.25 0.00 0.00 175.52 177.30 2a7k n HIS 149 N -3.98 0.00 0.00 4.73 8.25 0.13 -5.08 115.22 119.27 2a7k n HIS 149 Ca -0.08 -0.23 0.00 0.00 -0.26 0.00 0.00 57.72 57.15 2a7k n HIS 149 Cb 0.73 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.82 2a7k n HIS 149 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2a7k n GLY 150 N -0.23 -1.06 0.06 -1.41 0.00 -0.82 -4.42 105.19 97.32 2a7k n GLY 150 Ca 0.00 -1.63 -0.13 0.00 0.00 0.00 0.00 46.02 44.26 2a7k n GLY 150 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2a7k h PHE 151 N 0.00 0.05 -0.07 1.61 3.57 -1.87 -2.57 116.94 117.67 2a7k h PHE 151 Ca 0.00 -0.01 -0.17 0.00 3.53 0.00 0.00 57.97 61.32 2a7k h PHE 151 Cb 0.00 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 2a7k h PHE 151 CO 0.00 0.48 -0.69 0.66 -2.23 0.00 0.00 178.31 176.53 2a7k h SER 152 N -0.39 0.36 -0.33 0.41 4.64 -1.96 -0.18 113.55 116.11 2a7k h SER 152 Ca 0.00 -0.23 -0.02 0.00 -0.47 0.00 0.00 61.79 61.07 2a7k h SER 152 Cb 0.47 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.44 2a7k h SER 152 CO 0.00 0.94 0.12 0.74 -0.87 0.00 0.00 176.83 177.77 2a7k h THR 153 N 0.21 1.19 -0.25 2.95 2.02 -1.77 -2.21 112.91 115.06 2a7k h THR 153 Ca -0.02 -0.60 0.03 0.00 0.77 0.00 0.00 66.41 66.59 2a7k h THR 153 Cb 1.25 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 68.60 2a7k h THR 153 CO 0.11 0.21 0.06 -0.03 0.37 0.00 0.00 175.52 176.24 2a7k h MET 154 N 0.37 0.15 -0.54 6.66 -1.53 -1.11 -1.11 114.93 117.83 2a7k h MET 154 Ca 0.11 -0.01 0.08 0.00 -3.44 0.00 0.00 59.70 56.44 2a7k h MET 154 Cb 0.21 -0.03 -0.07 0.00 -0.55 0.00 0.00 31.60 31.16 2a7k h MET 154 CO -0.01 0.10 0.18 1.96 0.14 0.00 0.00 176.91 179.28 2a7k h GLN 155 N 0.16 0.33 -0.19 0.39 4.20 -0.97 -0.07 115.11 118.97 2a7k h GLN 155 Ca 0.11 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.80 2a7k h GLN 155 Cb 0.10 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 2a7k h GLN 155 CO -0.14 0.22 0.12 1.49 -0.67 0.00 0.00 178.83 179.85 2a7k h GLU 156 N 0.34 0.24 -0.07 1.46 4.81 -0.97 -1.70 114.58 118.69 2a7k h GLU 156 Ca 0.27 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.47 2a7k h GLU 156 Cb 0.32 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 2a7k h GLU 156 CO -0.29 0.16 -0.01 0.82 -0.73 0.00 0.00 179.01 178.96 2a7k h ILE 157 N 0.25 1.27 0.00 2.32 2.04 -0.55 -1.84 117.51 121.01 2a7k h ILE 157 Ca 0.07 -0.86 -0.05 0.00 1.00 0.00 0.00 64.86 65.01 2a7k h ILE 157 Cb -0.03 1.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 2a7k h ILE 157 CO -0.02 0.24 -0.24 0.16 0.00 0.00 0.00 178.15 178.29 2a7k h ILE 158 N -0.18 0.50 0.00 -0.67 3.07 -1.03 -2.39 117.51 116.81 2a7k h ILE 158 Ca 0.02 -1.33 -0.09 0.00 1.55 0.00 0.00 64.86 65.01 2a7k h ILE 158 Cb 0.38 1.95 -0.02 0.00 -0.27 0.00 0.00 36.82 38.86 2a7k h ILE 158 CO 0.01 0.24 -1.49 -1.22 -1.05 0.00 0.00 178.15 174.64 2a7k n TYR 159 N -3.28 0.68 0.02 0.16 4.01 -0.64 -4.19 117.16 113.92 2a7k n TYR 159 Ca 0.01 0.21 -0.03 0.00 -0.16 0.00 0.00 57.90 57.93 2a7k n TYR 159 Cb 0.51 -0.91 -0.10 0.00 -0.31 0.00 0.00 39.34 38.53 2a7k n TYR 159 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 2a7k h GLN 160 N 0.00 0.00 -6.39 -0.72 4.20 -1.35 -3.49 115.11 107.37 2a7k h GLN 160 Ca -0.11 0.00 -0.49 0.00 0.06 0.00 0.00 58.65 58.12 2a7k h GLN 160 Cb 1.32 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 29.03 2a7k h GLN 160 CO 0.02 0.42 -0.78 0.00 -0.67 0.00 0.00 178.83 177.81 2a7k s GLN 162 N -6.64 3.54 -0.11 0.00 -0.21 -1.26 -4.76 119.66 110.22 2a7k s GLN 162 Ca 0.61 -0.27 -0.29 0.00 0.02 0.00 0.00 55.36 55.42 2a7k s GLN 162 Cb -0.31 -2.84 -0.03 0.00 1.00 0.00 0.00 33.01 30.82 2a7k s GLN 162 CO 0.85 0.42 1.40 -1.12 -2.12 0.00 0.00 175.29 174.72 2a7k s SER 163 N -2.95 6.85 -0.48 5.90 0.01 -1.26 -4.48 113.70 117.28 2a7k s SER 163 Ca 0.39 1.91 -0.17 0.00 1.31 0.00 0.00 55.95 59.39 2a7k s SER 163 Cb -0.11 -2.54 0.06 0.00 0.21 0.00 0.00 66.02 63.64 2a7k s SER 163 CO 0.28 -0.81 0.49 -0.76 0.41 0.00 0.00 173.24 172.85 2a7k s LEU 164 N 3.55 5.33 0.93 2.44 1.43 0.14 -4.95 118.68 127.55 2a7k s LEU 164 Ca 0.62 -1.14 -0.15 0.00 -1.03 0.00 0.00 54.13 52.43 2a7k s LEU 164 Cb -0.26 -2.29 0.16 0.00 0.03 0.00 0.00 46.19 43.83 2a7k s LEU 164 CO 0.21 -0.74 1.25 1.51 0.23 0.00 0.00 176.35 178.81 2a7k s ASP 165 N 2.59 3.41 0.14 2.29 1.47 -1.26 -1.10 116.67 124.22 2a7k s ASP 165 Ca 0.09 0.52 -0.19 0.00 1.18 0.00 0.00 52.55 54.15 2a7k s ASP 165 Cb -0.22 -0.76 0.02 0.00 -0.34 0.00 0.00 42.92 41.62 2a7k s ASP 165 CO 0.09 -2.57 1.70 0.00 0.68 0.00 0.00 175.17 175.07 2a7k h ALA 166 N -1.52 0.21 -0.82 2.11 0.00 -1.77 0.80 119.26 118.26 2a7k h ALA 166 Ca -0.46 0.09 0.13 0.00 0.00 0.00 0.00 54.91 54.68 2a7k h ALA 166 Cb 1.28 0.17 -0.09 0.00 0.00 0.00 0.00 17.79 19.15 2a7k h ALA 166 CO 0.49 -0.44 0.42 -1.35 0.00 0.00 0.00 179.25 178.36 2a7k h PRO 167 N 0.04 0.61 -0.33 0.00 0.11 -1.93 0.10 132.00 130.60 2a7k h PRO 167 Ca 0.13 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 66.07 2a7k h PRO 167 Cb 0.19 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 2a7k h PRO 167 CO -0.25 0.40 -0.33 -0.09 -0.21 0.00 0.00 178.00 177.52 2a7k h ARG 168 N 0.63 0.72 -0.30 1.05 9.65 -1.51 -0.69 114.38 123.94 2a7k h ARG 168 Ca 0.44 -0.34 -0.10 0.00 -1.10 0.00 0.00 59.98 58.87 2a7k h ARG 168 Cb 0.58 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.14 2a7k h ARG 168 CO -0.34 0.95 -0.24 0.00 2.80 0.00 0.00 179.97 183.14 2a7k h VAL 170 N 0.51 1.18 -0.98 0.00 2.07 -0.50 0.12 116.25 118.65 2a7k h VAL 170 Ca 0.07 -0.55 0.08 0.00 0.82 0.00 0.00 66.70 67.13 2a7k h VAL 170 Cb 0.69 1.24 -0.07 0.00 -1.52 0.00 0.00 31.29 31.63 2a7k h VAL 170 CO 0.05 0.17 0.63 -0.78 0.02 0.00 0.00 177.57 177.66 2a7k h ASP 171 N 0.09 0.97 0.98 0.57 3.58 -0.99 0.00 116.42 121.63 2a7k h ASP 171 Ca 0.05 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.52 2a7k h ASP 171 Cb 0.21 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 41.08 2a7k h ASP 171 CO -0.00 0.59 0.00 -1.22 -2.88 0.00 0.00 179.24 175.73 2a7k n TYR 172 N -4.53 0.18 -3.57 0.28 4.01 -0.56 -4.91 117.16 108.06 2a7k n TYR 172 Ca 0.16 0.06 -0.23 0.00 -0.16 0.00 0.00 57.90 57.72 2a7k n TYR 172 Cb 0.24 -0.59 0.08 0.00 -0.31 0.00 0.00 39.34 38.76 2a7k n TYR 172 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2a7k n ARG 173 N -1.65 -7.82 0.20 -0.72 0.63 -0.01 -4.90 116.66 102.38 2a7k n ARG 173 Ca 0.06 0.81 0.09 0.00 -0.92 0.00 0.00 57.85 57.89 2a7k n ARG 173 Cb 0.32 -5.81 0.14 0.00 0.45 0.00 0.00 32.46 27.56 2a7k n ARG 173 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 2a7k h LEU 174 N -2.66 0.00 -8.49 6.15 3.38 -1.03 -3.46 115.31 109.20 2a7k h LEU 174 Ca -0.56 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.17 2a7k h LEU 174 Cb 1.36 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.96 2a7k h LEU 174 CO 0.55 0.17 -0.70 0.68 0.09 0.00 0.00 178.44 179.22 2a7k s VAL 175 N -3.15 0.80 -0.11 1.22 -7.23 -1.24 -4.80 120.40 105.89 2a7k s VAL 175 Ca 0.06 -1.97 0.20 0.00 -1.81 0.00 0.00 61.98 58.46 2a7k s VAL 175 Cb 0.06 -1.72 -0.29 0.00 0.56 0.00 0.00 36.38 34.98 2a7k s VAL 175 CO 0.69 -0.84 0.31 0.59 -0.31 0.00 0.00 175.10 175.54 2a7k n ASN 176 N -0.08 0.04 -3.73 4.85 4.13 0.57 -4.79 115.26 116.24 2a7k n ASN 176 Ca -0.12 0.02 -0.14 0.00 1.68 0.00 0.00 54.58 56.02 2a7k n ASN 176 Cb 0.61 1.48 -0.09 0.00 -1.54 0.00 0.00 39.78 40.24 2a7k n ASN 176 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2a7k s GLN 177 N -3.04 0.68 -0.10 3.52 -0.21 -1.20 -5.04 119.66 114.26 2a7k s GLN 177 Ca -0.09 -0.05 0.03 0.00 0.02 0.00 0.00 55.36 55.28 2a7k s GLN 177 Cb 0.10 0.31 0.00 0.00 1.00 0.00 0.00 33.01 34.43 2a7k s GLN 177 CO 0.87 -0.18 -0.22 0.08 -2.12 0.00 0.00 175.29 173.72 2a7k s VAL 178 N -1.12 1.95 0.22 1.09 1.01 -1.26 -1.60 120.40 120.70 2a7k s VAL 178 Ca -0.12 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 60.92 2a7k s VAL 178 Cb -0.04 -1.70 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 2a7k s VAL 178 CO 0.04 0.53 0.16 0.68 0.00 0.00 0.00 175.10 176.51 2a7k s VAL 179 N 0.49 0.00 0.50 2.92 -7.23 -0.58 -4.91 120.40 111.59 2a7k s VAL 179 Ca -0.16 -2.00 -0.22 0.00 -1.81 0.00 0.00 61.98 57.80 2a7k s VAL 179 Cb -0.17 -2.50 -0.06 0.00 0.56 0.00 0.00 36.38 34.21 2a7k s VAL 179 CO 0.06 0.00 1.23 -1.61 -0.31 0.00 0.00 175.10 174.47 2a7k s GLU 180 N -4.05 3.49 0.27 4.82 8.01 -1.26 -0.64 118.70 129.35 2a7k s GLU 180 Ca 0.39 1.91 -0.03 0.00 0.01 0.00 0.00 54.97 57.26 2a7k s GLU 180 Cb 0.06 -2.31 0.58 0.00 -4.31 0.00 0.00 34.13 28.15 2a7k s GLU 180 CO 0.14 -0.81 1.62 0.77 0.01 0.00 0.00 175.26 176.99 2a7k h SER 181 N 1.75 -0.34 0.80 -0.19 0.02 -1.93 0.33 113.55 114.00 2a7k h SER 181 Ca -0.50 0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 2a7k h SER 181 Cb 1.27 0.38 0.00 0.00 0.14 0.00 0.00 62.40 64.19 2a7k h SER 181 CO 0.59 -0.23 0.00 0.77 -1.14 0.00 0.00 176.83 176.82 2a7k h SER 182 N 0.09 0.00 -0.01 3.07 4.64 -2.03 -2.43 113.55 116.88 2a7k h SER 182 Ca 0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 2a7k h SER 182 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 2a7k h SER 182 CO -0.75 0.00 -0.61 0.00 -0.87 0.00 0.00 176.83 174.60 2a7k n ALA 183 N -1.99 3.81 0.02 5.18 0.00 0.03 -4.76 120.51 122.79 2a7k n ALA 183 Ca 0.01 -0.52 -0.13 0.00 0.00 0.00 0.00 53.44 52.80 2a7k n ALA 183 Cb 0.25 -0.62 -0.08 0.00 0.00 0.00 0.00 19.45 19.00 2a7k n ALA 183 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2a7k h LEU 184 N 0.87 -0.01 -0.72 0.00 5.85 -0.83 -1.75 115.31 118.72 2a7k h LEU 184 Ca 0.00 -0.25 -0.06 0.00 0.84 0.00 0.00 57.88 58.41 2a7k h LEU 184 Cb 0.49 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.49 2a7k h LEU 184 CO 0.00 0.24 0.21 0.25 -0.34 0.00 0.00 178.44 178.80 2a7k h LEU 185 N -0.26 1.07 -0.71 2.25 5.85 -1.86 -0.89 115.31 120.75 2a7k h LEU 185 Ca -0.00 -0.22 -0.07 0.00 0.84 0.00 0.00 57.88 58.44 2a7k h LEU 185 Cb 0.26 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 2a7k h LEU 185 CO 0.00 1.00 0.19 0.44 -0.34 0.00 0.00 178.44 179.73 2a7k h ASP 186 N 1.08 1.07 -0.46 1.25 3.32 -1.88 -0.25 116.42 120.54 2a7k h ASP 186 Ca 0.23 -0.23 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 2a7k h ASP 186 Cb 0.33 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 2a7k h ASP 186 CO -0.00 1.02 0.12 0.00 -1.72 0.00 0.00 179.24 178.65 2a7k h ALA 187 N 1.09 1.22 -0.13 3.45 0.00 -0.90 -0.03 119.26 123.97 2a7k h ALA 187 Ca 0.23 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2a7k h ALA 187 Cb 0.36 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2a7k h ALA 187 CO -0.00 0.53 -0.10 0.00 0.00 0.00 0.00 179.25 179.68 2a7k h ALA 188 N 1.35 0.19 -0.67 0.00 0.00 -0.91 -2.01 119.26 117.21 2a7k h ALA 188 Ca 0.17 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 54.83 2a7k h ALA 188 Cb 0.30 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 2a7k h ALA 188 CO -0.00 0.02 0.39 0.82 0.00 0.00 0.00 179.25 180.49 2a7k h ILE 189 N -0.08 1.03 -0.21 0.00 2.04 -0.95 0.19 117.51 119.53 2a7k h ILE 189 Ca 0.02 -0.26 0.04 0.00 1.00 0.00 0.00 64.86 65.67 2a7k h ILE 189 Cb 0.60 0.21 -0.04 0.00 -0.74 0.00 0.00 36.82 36.85 2a7k h ILE 189 CO 0.03 0.14 -0.06 0.74 0.00 0.00 0.00 178.15 179.00 2a7k h THR 190 N 0.75 0.78 -0.74 -0.27 2.02 -0.92 0.28 112.91 114.82 2a7k h THR 190 Ca 0.29 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.44 2a7k h THR 190 Cb 0.11 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 67.26 2a7k h THR 190 CO -0.15 0.00 0.36 1.56 0.37 0.00 0.00 175.52 177.66 2a7k h GLN 191 N -0.01 1.05 -0.67 6.66 1.08 -1.01 -1.68 115.11 120.53 2a7k h GLN 191 Ca 0.10 -0.14 -0.02 0.00 -1.45 0.00 0.00 58.65 57.14 2a7k h GLN 191 Cb 0.16 -0.20 -0.03 0.00 -0.05 0.00 0.00 27.48 27.36 2a7k h GLN 191 CO -0.22 0.81 0.35 0.00 -0.95 0.00 0.00 178.83 178.82 2a7k h ALA 192 N 1.34 1.35 -0.55 3.87 0.00 -0.54 -1.65 119.26 123.09 2a7k h ALA 192 Ca 0.26 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 2a7k h ALA 192 Cb 0.10 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2a7k h ALA 192 CO -0.03 0.52 0.03 0.45 0.00 0.00 0.00 179.25 180.21 2a7k h HIS 193 N 0.93 1.04 -0.08 0.00 3.86 -0.28 -0.31 115.15 120.31 2a7k h HIS 193 Ca 0.23 -0.17 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 2a7k h HIS 193 Cb 0.05 -0.27 -0.00 0.00 1.06 0.00 0.00 27.41 28.25 2a7k h HIS 193 CO 0.01 0.93 0.05 0.28 0.86 0.00 0.00 177.93 180.06 2a7k h VAL 194 N 0.84 1.03 -0.01 2.45 2.07 -0.91 -2.31 116.25 119.41 2a7k h VAL 194 Ca 0.16 -0.08 -0.16 0.00 0.82 0.00 0.00 66.70 67.44 2a7k h VAL 194 Cb 0.50 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 2a7k h VAL 194 CO 0.02 0.03 -0.75 0.24 0.02 0.00 0.00 177.57 177.14 2a7k h MET 195 N 0.10 0.09 0.00 1.57 2.86 -1.32 -2.76 114.93 115.47 2a7k h MET 195 Ca 0.03 -0.08 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 2a7k h MET 195 Cb 0.01 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.68 2a7k h MET 195 CO -0.01 0.79 -0.09 0.00 1.06 0.00 0.00 176.91 178.66 2a7k h ALA 196 N 1.18 1.39 0.00 6.32 0.00 -0.92 -2.60 119.26 124.63 2a7k h ALA 196 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2a7k h ALA 196 Cb 1.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2a7k h ALA 196 CO 0.10 0.12 0.00 -1.13 0.00 0.00 0.00 179.25 178.34 2a7k n SER 197 N -3.77 0.81 -4.70 0.00 3.41 -0.88 -4.76 113.62 103.74 2a7k n SER 197 Ca -0.02 0.60 -0.42 0.00 -0.26 0.00 0.00 58.87 58.77 2a7k n SER 197 Cb 0.20 -0.81 -0.03 0.00 -0.26 0.00 0.00 64.21 63.31 2a7k n SER 197 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 2a7k s TYR 198 N -3.16 2.76 0.00 7.33 2.02 -0.98 -4.91 117.35 120.41 2a7k s TYR 198 Ca 0.09 0.59 -0.39 0.00 -0.37 0.00 0.00 57.07 56.99 2a7k s TYR 198 Cb 0.11 -3.84 -0.18 0.00 -0.40 0.00 0.00 41.96 37.65 2a7k s TYR 198 CO 0.55 -3.23 1.30 -2.30 -1.57 0.00 0.00 175.55 170.30 2a7k n PRO 199 N 5.01 0.72 -0.10 -1.71 -0.02 -1.26 -4.82 135.00 132.81 2a7k n PRO 199 Ca 0.14 0.26 -0.08 0.00 -2.02 0.00 0.00 63.50 61.80 2a7k n PRO 199 Cb 0.41 -1.85 0.08 0.00 -0.02 0.00 0.00 33.50 32.12 2a7k n PRO 199 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2a7k h ALA 200 N 4.28 0.86 0.14 3.55 0.00 -1.91 -2.35 119.26 123.84 2a7k h ALA 200 Ca -0.49 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.05 2a7k h ALA 200 Cb 1.37 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2a7k h ALA 200 CO 0.76 0.63 -0.07 1.03 0.00 0.00 0.00 179.25 181.61 2a7k h SER 201 N 0.70 -0.16 -0.56 0.00 0.87 -1.99 0.20 113.55 112.60 2a7k h SER 201 Ca 0.10 -0.04 -0.06 0.00 -1.23 0.00 0.00 61.79 60.56 2a7k h SER 201 Cb 0.73 0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.70 2a7k h SER 201 CO 0.06 -0.06 0.15 0.00 -0.53 0.00 0.00 176.83 176.45 2a7k h ALA 202 N 0.61 1.13 0.02 6.23 0.00 -1.93 -2.21 119.26 123.11 2a7k h ALA 202 Ca -0.02 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 2a7k h ALA 202 Cb 0.19 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2a7k h ALA 202 CO 0.03 0.59 -0.01 0.35 0.00 0.00 0.00 179.25 180.21 2a7k h PHE 203 N 0.90 -0.02 -0.25 0.00 3.04 -1.06 -1.97 116.94 117.57 2a7k h PHE 203 Ca 0.19 -0.00 0.02 0.00 3.98 0.00 0.00 57.97 62.16 2a7k h PHE 203 Cb 0.32 0.01 -0.02 0.00 2.56 0.00 0.00 35.95 38.81 2a7k h PHE 203 CO 0.02 0.24 0.11 0.82 -2.02 0.00 0.00 178.31 177.48 2a7k h ILE 204 N -0.29 0.96 -0.52 1.41 2.04 -0.56 0.10 117.51 120.66 2a7k h ILE 204 Ca -0.00 -0.08 -0.10 0.00 1.00 0.00 0.00 64.86 65.68 2a7k h ILE 204 Cb 0.28 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 2a7k h ILE 204 CO 0.00 0.04 -0.07 0.78 0.00 0.00 0.00 178.15 178.91 2a7k h ASN 205 N 0.23 0.91 -0.07 1.72 2.35 -1.45 -0.78 115.58 118.49 2a7k h ASN 205 Ca 0.11 -0.27 -0.01 0.00 -0.55 0.00 0.00 56.30 55.57 2a7k h ASN 205 Cb 0.05 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.17 2a7k h ASN 205 CO -0.09 1.01 -0.00 0.74 -1.65 0.00 0.00 177.43 177.44 2a7k h THR 206 N 0.84 1.26 -0.78 2.81 2.02 -1.09 -2.81 112.91 115.16 2a7k h THR 206 Ca 0.14 -0.80 0.00 0.00 0.77 0.00 0.00 66.41 66.52 2a7k h THR 206 Cb 0.59 1.66 -0.04 0.00 -1.74 0.00 0.00 68.15 68.62 2a7k h THR 206 CO 0.04 0.22 0.50 0.50 0.37 0.00 0.00 175.52 177.15 2a7k h LYS 207 N -0.17 1.04 -0.45 6.66 3.64 -0.62 0.15 116.57 126.81 2a7k h LYS 207 Ca 0.02 -0.07 0.07 0.00 -1.27 0.00 0.00 60.65 59.39 2a7k h LYS 207 Cb 0.35 -0.23 -0.06 0.00 -0.41 0.00 0.00 32.23 31.89 2a7k h LYS 207 CO 0.00 0.70 0.11 0.00 -2.27 0.00 0.00 179.45 178.00 2a7k h ARG 208 N 1.06 0.25 -0.52 1.90 3.08 -1.15 0.26 114.38 119.26 2a7k h ARG 208 Ca 0.28 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 60.24 2a7k h ARG 208 Cb -0.09 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.88 2a7k h ARG 208 CO -0.06 0.17 0.00 0.00 -1.07 0.00 0.00 179.97 179.01 2a7k h ALA 209 N 1.33 1.02 -0.36 0.04 0.00 -1.11 -1.37 119.26 118.80 2a7k h ALA 209 Ca 0.22 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2a7k h ALA 209 Cb 0.26 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2a7k h ALA 209 CO -0.27 0.61 0.05 0.28 0.00 0.00 0.00 179.25 179.92 2a7k h VAL 210 N 0.82 1.24 0.00 0.00 2.07 -0.03 -3.28 116.25 117.06 2a7k h VAL 210 Ca 0.15 -0.86 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 2a7k h VAL 210 Cb 0.49 1.10 -0.00 0.00 -1.52 0.00 0.00 31.29 31.36 2a7k h VAL 210 CO 0.02 0.29 -0.42 0.78 0.02 0.00 0.00 177.57 178.27 2a7k h ASN 211 N 0.44 0.00 -0.48 0.57 4.21 -0.43 -3.38 115.58 116.51 2a7k h ASN 211 Ca 0.11 0.00 0.09 0.00 1.21 0.00 0.00 56.30 57.71 2a7k h ASN 211 Cb 0.37 0.00 -0.10 0.00 -1.12 0.00 0.00 38.32 37.47 2a7k h ASN 211 CO 0.01 0.01 -0.28 0.50 -1.29 0.00 0.00 177.43 176.38 2a7k h LYS 212 N 0.00 -0.17 0.00 0.81 3.64 -1.31 0.12 116.57 119.66 2a7k h LYS 212 Ca -0.00 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 2a7k h LYS 212 Cb 1.01 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.87 2a7k h LYS 212 CO 0.00 -0.11 -0.10 -1.00 -2.27 0.00 0.00 179.45 175.97 2a7k h PRO 213 N -0.17 0.00 -0.07 1.90 0.13 -1.78 -0.91 132.00 131.09 2a7k h PRO 213 Ca 0.21 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.26 2a7k h PRO 213 Cb 0.52 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.65 2a7k h PRO 213 CO -0.58 0.10 -0.28 0.35 -0.23 0.00 0.00 178.00 177.36 2a7k h PHE 214 N 0.00 0.42 -0.64 1.56 3.04 -1.16 -0.40 116.94 119.77 2a7k h PHE 214 Ca -0.00 -0.18 0.06 0.00 3.98 0.00 0.00 57.97 61.83 2a7k h PHE 214 Cb 0.42 -0.07 -0.06 0.00 2.56 0.00 0.00 35.95 38.80 2a7k h PHE 214 CO 0.00 0.90 0.34 0.82 -2.02 0.00 0.00 178.31 178.34 2a7k h ILE 215 N -0.18 0.94 -0.34 1.41 2.04 -0.60 0.65 117.51 121.42 2a7k h ILE 215 Ca -0.01 -0.21 -0.14 0.00 1.00 0.00 0.00 64.86 65.49 2a7k h ILE 215 Cb 0.92 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 2a7k h ILE 215 CO 0.06 0.11 -0.33 -0.74 0.00 0.00 0.00 178.15 177.26 2a7k h HIS 216 N 0.62 0.99 -0.86 1.37 2.76 -1.14 -1.70 115.15 117.19 2a7k h HIS 216 Ca 0.29 -0.29 0.01 0.00 -2.20 0.00 0.00 60.37 58.18 2a7k h HIS 216 Cb 0.21 -0.21 -0.04 0.00 1.55 0.00 0.00 27.41 28.92 2a7k h HIS 216 CO -0.09 1.08 0.57 1.25 -1.30 0.00 0.00 177.93 179.44 2a7k h LEU 217 N 0.61 0.98 -1.12 0.26 5.85 -0.55 -1.24 115.31 120.10 2a7k h LEU 217 Ca 0.06 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 2a7k h LEU 217 Cb 0.91 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.67 2a7k h LEU 217 CO 0.08 0.70 0.23 -0.07 -0.34 0.00 0.00 178.44 179.04 2a7k h LEU 218 N 1.15 0.77 -0.46 2.25 3.38 -0.63 -0.72 115.31 121.05 2a7k h LEU 218 Ca 0.32 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 58.09 2a7k h LEU 218 Cb -0.11 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 2a7k h LEU 218 CO -0.08 0.70 -0.09 -0.33 0.09 0.00 0.00 178.44 178.73 2a7k h GLU 219 N 0.83 0.88 -0.78 1.13 4.39 -0.79 -0.22 114.58 120.03 2a7k h GLU 219 Ca 0.20 -0.33 -0.00 0.00 0.34 0.00 0.00 59.36 59.57 2a7k h GLU 219 Cb 0.17 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 28.73 2a7k h GLU 219 CO -0.02 0.97 0.48 1.96 -1.16 0.00 0.00 179.01 181.24 2a7k h GLN 220 N 0.72 1.05 -0.48 2.33 4.20 -1.07 -1.94 115.11 119.92 2a7k h GLN 220 Ca 0.12 -0.09 -0.13 0.00 0.06 0.00 0.00 58.65 58.62 2a7k h GLN 220 Cb 0.63 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 2a7k h GLN 220 CO 0.04 0.73 -0.20 1.15 -0.67 0.00 0.00 178.83 179.88 2a7k h THR 221 N 1.07 1.27 -0.09 -0.54 2.02 -0.83 -0.30 112.91 115.51 2a7k h THR 221 Ca 0.28 -1.36 0.03 0.00 0.77 0.00 0.00 66.41 66.13 2a7k h THR 221 Cb -0.06 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.44 2a7k h THR 221 CO -0.05 0.47 -0.10 -0.09 0.37 0.00 0.00 175.52 176.12 2a7k h ARG 222 N 0.84 -0.13 -0.54 6.66 2.43 -0.72 -0.99 114.38 121.93 2a7k h ARG 222 Ca 0.11 0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.20 2a7k h ARG 222 Cb 0.77 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.33 2a7k h ARG 222 CO 0.06 -0.08 -0.02 -0.44 -1.51 0.00 0.00 179.97 177.98 2a7k h ASP 223 N -0.13 0.96 0.02 -3.80 3.32 -1.23 -2.54 116.42 113.03 2a7k h ASP 223 Ca 0.07 -0.32 -0.00 0.00 0.02 0.00 0.00 57.03 56.80 2a7k h ASP 223 Cb 0.23 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.52 2a7k h ASP 223 CO -0.16 1.05 -0.01 0.00 -1.72 0.00 0.00 179.24 178.39 2a7k h ALA 224 N 0.95 -0.03 -0.89 3.45 0.00 -0.94 -1.75 119.26 120.05 2a7k h ALA 224 Ca 0.15 -0.19 0.12 0.00 0.00 0.00 0.00 54.91 54.99 2a7k h ALA 224 Cb 0.57 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.29 2a7k h ALA 224 CO 0.03 -0.33 0.52 0.77 0.00 0.00 0.00 179.25 180.24 2a7k h SER 225 N -0.40 0.73 0.39 0.00 0.02 -1.19 -2.32 113.55 110.79 2a7k h SER 225 Ca -0.00 0.06 -0.20 0.00 -0.84 0.00 0.00 61.79 60.81 2a7k h SER 225 Cb 0.38 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 2a7k h SER 225 CO 0.00 0.38 -0.83 0.11 -1.14 0.00 0.00 176.83 175.36 2a7k h LYS 226 N 0.82 0.32 -0.41 3.45 1.57 -1.41 -2.84 116.57 118.08 2a7k h LYS 226 Ca 0.45 -0.31 -0.14 0.00 -1.87 0.00 0.00 60.65 58.78 2a7k h LYS 226 Cb 0.48 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 2a7k h LYS 226 CO -0.28 0.98 -0.29 0.00 -0.57 0.00 0.00 179.45 179.30 2a7k h ALA 227 N 0.91 0.72 -0.68 3.86 0.00 -1.14 0.32 119.26 123.24 2a7k h ALA 227 Ca -0.05 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 2a7k h ALA 227 Cb 1.43 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 2a7k h ALA 227 CO 0.14 0.66 0.33 0.28 0.00 0.00 0.00 179.25 180.66 2a7k h VAL 228 N 0.75 1.23 0.21 0.00 2.07 -1.44 -1.66 116.25 117.40 2a7k h VAL 228 Ca 0.09 -0.64 -0.32 0.00 0.82 0.00 0.00 66.70 66.65 2a7k h VAL 228 Cb 0.85 0.38 0.02 0.00 -1.52 0.00 0.00 31.29 31.03 2a7k h VAL 228 CO 0.07 0.27 -1.45 0.45 0.02 0.00 0.00 177.57 176.93 2a7k h HIS 229 N 0.95 0.80 -0.92 1.57 -0.00 -1.45 -2.36 115.15 113.74 2a7k h HIS 229 Ca 0.24 -0.59 -0.01 0.00 -0.00 0.00 0.00 60.37 60.01 2a7k h HIS 229 Cb 0.11 -0.03 -0.04 0.00 -0.00 0.00 0.00 27.41 27.45 2a7k h HIS 229 CO 0.00 1.49 0.54 0.87 -0.00 0.00 0.00 177.93 180.83 2a7k h LYS 230 N 0.12 1.26 -0.42 2.45 1.57 -0.36 0.25 116.57 121.44 2a7k h LYS 230 Ca -0.23 -0.12 -0.07 0.00 -1.87 0.00 0.00 60.65 58.35 2a7k h LYS 230 Cb 2.11 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 34.14 2a7k h LYS 230 CO 0.24 0.89 0.00 0.00 -0.57 0.00 0.00 179.45 180.01 2a7k h ALA 231 N 1.29 0.57 -0.68 3.86 0.00 -1.34 0.16 119.26 123.12 2a7k h ALA 231 Ca 0.33 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2a7k h ALA 231 Cb -0.03 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2a7k h ALA 231 CO -0.06 0.36 0.28 0.00 0.00 0.00 0.00 179.25 179.83 2a7k h ALA 232 N 0.90 0.89 -0.16 0.00 0.00 -1.08 -2.67 119.26 117.13 2a7k h ALA 232 Ca 0.12 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2a7k h ALA 232 Cb 0.48 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2a7k h ALA 232 CO 0.02 0.50 0.01 0.35 0.00 0.00 0.00 179.25 180.13 2a7k h PHE 233 N 0.97 0.30 0.00 0.00 3.04 -0.47 -3.24 116.94 117.53 2a7k h PHE 233 Ca 0.23 -0.05 -0.00 0.00 3.98 0.00 0.00 57.97 62.13 2a7k h PHE 233 Cb 0.19 -0.08 -0.00 0.00 2.56 0.00 0.00 35.95 38.62 2a7k h PHE 233 CO 0.01 0.48 -0.01 1.96 -2.02 0.00 0.00 178.31 178.73 2a7k h GLN 234 N 0.03 0.00 -0.07 1.11 4.20 -0.61 0.36 115.11 120.14 2a7k h GLN 234 Ca 0.05 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.62 2a7k h GLN 234 Cb 0.36 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 2a7k h GLN 234 CO 0.01 0.01 -0.57 0.00 -0.67 0.00 0.00 178.83 177.61 2a7k h ALA 235 N 1.99 0.91 -0.02 3.87 0.00 -1.50 -3.51 119.26 120.99 2a7k h ALA 235 Ca -0.00 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2a7k h ALA 235 Cb 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2a7k h ALA 235 CO 0.00 0.71 0.00 2.89 0.00 0.00 0.00 179.25 182.85