#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 0.17 0.14 2.03 -7.23 -1.26 0.12 120.40 114.37 2a7k s VAL 2 Ca 0.00 -1.38 0.10 0.00 -1.81 0.00 0.00 61.98 58.88 2a7k s VAL 2 Cb 0.00 -0.95 -0.04 0.00 0.56 0.00 0.00 36.38 35.95 2a7k s VAL 2 CO 0.00 -0.76 -0.20 0.72 -0.31 0.00 0.00 175.10 174.55 2a7k s PHE 3 N -2.80 2.47 -0.14 2.82 -0.12 -0.15 -4.88 117.98 115.17 2a7k s PHE 3 Ca -0.03 -0.30 0.02 0.00 -0.05 0.00 0.00 56.93 56.57 2a7k s PHE 3 Cb -0.00 -1.28 0.01 0.00 -0.63 0.00 0.00 43.02 41.12 2a7k s PHE 3 CO -0.06 0.41 -0.20 -1.21 -0.05 0.00 0.00 175.22 174.12 2a7k s GLU 4 N -2.31 2.81 0.15 1.99 2.02 -1.26 -0.68 118.70 121.43 2a7k s GLU 4 Ca 0.19 -0.77 0.02 0.00 0.02 0.00 0.00 54.97 54.42 2a7k s GLU 4 Cb -0.10 -2.33 -0.05 0.00 0.10 0.00 0.00 34.13 31.76 2a7k s GLU 4 CO 0.10 -0.07 -0.03 -1.21 0.02 0.00 0.00 175.26 174.07 2a7k s GLU 5 N 0.97 1.05 -0.06 1.61 2.02 0.24 -4.98 118.70 119.55 2a7k s GLU 5 Ca -0.04 -1.48 0.03 0.00 0.02 0.00 0.00 54.97 53.50 2a7k s GLU 5 Cb -0.15 -0.31 0.01 0.00 0.10 0.00 0.00 34.13 33.77 2a7k s GLU 5 CO -0.04 -0.08 -0.15 -0.80 0.02 0.00 0.00 175.26 174.21 2a7k s ASN 6 N -3.15 2.02 -0.72 -0.19 0.01 -1.26 0.51 114.94 112.17 2a7k s ASN 6 Ca 0.20 -0.34 -0.03 0.00 -0.71 0.00 0.00 52.86 51.98 2a7k s ASN 6 Cb 0.05 -0.80 0.18 0.00 0.41 0.00 0.00 41.25 41.10 2a7k s ASN 6 CO 0.02 0.09 0.56 -0.55 -1.51 0.00 0.00 177.10 175.70 2a7k s SER 7 N 0.40 5.54 0.91 -1.22 0.15 0.19 -4.98 113.70 114.69 2a7k s SER 7 Ca -0.11 -3.10 0.00 0.00 0.70 0.00 0.00 55.95 53.44 2a7k s SER 7 Cb -0.14 -1.89 0.00 0.00 -1.71 0.00 0.00 66.02 62.27 2a7k s SER 7 CO 0.04 -0.33 0.00 0.47 1.20 0.00 0.00 173.24 174.62 2a7k n ASP 8 N 3.18 0.00 0.00 5.45 8.00 -1.26 -1.41 116.55 130.51 2a7k n ASP 8 Ca 0.12 0.00 0.14 0.00 0.71 0.00 0.00 54.79 55.76 2a7k n ASP 8 Cb 0.38 0.00 0.73 0.00 -0.02 0.00 0.00 41.12 42.21 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 3.27 0.42 -3.52 -1.24 0.00 -1.26 -4.71 120.64 113.60 2a7k n GLU 9 Ca 0.00 0.01 -0.38 0.00 0.00 0.00 0.00 57.16 56.79 2a7k n GLU 9 Cb 0.00 -1.50 -0.10 0.00 0.00 0.00 0.00 31.44 29.84 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 -2.56 5.26 -0.20 3.84 1.01 -0.50 0.17 120.40 127.42 2a7k s VAL 10 Ca 0.28 0.31 -0.23 0.00 0.00 0.00 0.00 61.98 62.34 2a7k s VAL 10 Cb 0.19 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.97 2a7k s VAL 10 CO 0.44 0.22 0.74 -0.60 0.00 0.00 0.00 175.10 175.90 2a7k s ARG 11 N 1.86 4.23 -0.26 2.72 6.06 -0.26 -0.63 118.95 132.66 2a7k s ARG 11 Ca 0.10 0.81 -0.06 0.00 -2.50 0.00 0.00 55.73 54.08 2a7k s ARG 11 Cb -0.16 -3.60 -0.00 0.00 0.06 0.00 0.00 34.95 31.25 2a7k s ARG 11 CO 0.11 -0.34 0.04 0.08 -2.50 0.00 0.00 175.30 172.69 2a7k s VAL 12 N 2.22 3.86 -0.30 7.11 1.01 0.18 -0.48 120.40 134.01 2a7k s VAL 12 Ca 0.33 -0.54 -0.08 0.00 0.00 0.00 0.00 61.98 61.69 2a7k s VAL 12 Cb -0.16 -2.90 0.00 0.00 0.00 0.00 0.00 36.38 33.33 2a7k s VAL 12 CO 0.10 0.22 0.11 -0.63 0.00 0.00 0.00 175.10 174.90 2a7k s ILE 13 N 1.51 4.22 -0.22 2.22 1.01 0.78 -0.59 121.20 130.13 2a7k s ILE 13 Ca 0.04 -0.55 -0.06 0.00 0.00 0.00 0.00 60.65 60.08 2a7k s ILE 13 Cb -0.16 -3.15 -0.03 0.00 0.01 0.00 0.00 42.46 39.13 2a7k s ILE 13 CO 0.01 0.09 0.03 -0.89 0.00 0.00 0.00 174.94 174.19 2a7k s THR 14 N 1.55 4.18 0.18 2.92 2.01 0.15 -1.39 115.64 125.24 2a7k s THR 14 Ca 0.04 -0.23 -0.30 0.00 0.31 0.00 0.00 61.69 61.50 2a7k s THR 14 Cb -0.17 -2.91 -0.08 0.00 0.01 0.00 0.00 72.50 69.34 2a7k s THR 14 CO 0.04 0.40 1.32 -0.76 -0.69 0.00 0.00 174.62 174.93 2a7k s LEU 15 N 1.16 4.41 -0.30 4.42 1.43 0.20 -0.97 118.68 129.01 2a7k s LEU 15 Ca 0.04 2.38 0.18 0.00 -1.03 0.00 0.00 54.13 55.69 2a7k s LEU 15 Cb -0.14 -3.60 0.48 0.00 0.03 0.00 0.00 46.19 42.95 2a7k s LEU 15 CO 0.02 -0.55 1.04 -0.67 0.23 0.00 0.00 176.35 176.42 2a7k n ASP 16 N 2.90 1.98 -4.67 2.29 2.03 0.12 -4.49 116.55 116.72 2a7k n ASP 16 Ca 0.07 -2.59 -0.39 0.00 0.52 0.00 0.00 54.79 52.39 2a7k n ASP 16 Cb 0.43 -0.49 0.03 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 -0.34 1.56 -0.33 -0.67 -0.00 -1.22 -4.60 115.22 109.62 2a7k n HIS 17 Ca 0.13 0.48 0.18 0.00 -0.00 0.00 0.00 57.72 58.50 2a7k n HIS 17 Cb 0.81 -2.27 0.41 0.00 -0.00 0.00 0.00 29.99 28.94 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 1.33 0.56 -6.62 1.57 0.11 -1.98 -3.41 132.00 123.55 2a7k h PRO 18 Ca -0.48 -0.03 -0.51 0.00 0.11 0.00 0.00 66.00 65.09 2a7k h PRO 18 Cb 1.33 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 2a7k h PRO 18 CO 0.56 0.37 0.38 1.21 -0.21 0.00 0.00 178.00 180.30 2a7k s ASN 19 N -5.33 7.49 0.50 -2.05 3.84 -1.26 -4.95 114.94 113.19 2a7k s ASN 19 Ca -0.10 1.88 0.34 0.00 0.21 0.00 0.00 52.86 55.19 2a7k s ASN 19 Cb 0.26 -2.60 1.59 0.00 -0.55 0.00 0.00 41.25 39.95 2a7k s ASN 19 CO 0.80 -0.04 2.01 0.07 -2.79 0.00 0.00 177.10 177.15 2a7k h LYS 20 N 5.17 0.00 -0.13 0.43 2.10 -1.96 -2.15 116.57 120.02 2a7k h LYS 20 Ca -0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 2a7k h LYS 20 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 2a7k h LYS 20 CO 0.71 0.00 0.00 0.72 -2.00 0.00 0.00 179.45 178.88 2a7k n HIS 21 N -2.82 0.16 -3.72 0.07 8.25 -1.26 -1.70 115.22 114.20 2a7k n HIS 21 Ca -0.00 -0.08 -0.23 0.00 -0.26 0.00 0.00 57.72 57.14 2a7k n HIS 21 Cb 0.18 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.32 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 0.37 -2.03 -4.77 0.41 3.02 -0.81 -0.49 115.26 110.96 2a7k n ASN 22 Ca 0.17 -0.88 -0.40 0.00 -0.03 0.00 0.00 54.58 53.43 2a7k n ASN 22 Cb 0.36 -3.81 0.00 0.00 -0.61 0.00 0.00 39.78 35.72 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 -5.99 3.95 -1.21 3.52 0.04 -1.26 -4.07 135.00 129.97 2a7k s PRO 23 Ca 0.11 2.43 -0.20 0.00 0.04 0.00 0.00 61.00 63.39 2a7k s PRO 23 Cb -0.03 -2.83 0.05 0.00 0.04 0.00 0.00 34.50 31.73 2a7k s PRO 23 CO 0.83 -0.61 1.68 -0.06 0.04 0.00 0.00 177.00 178.88 2a7k s PHE 24 N -1.17 2.65 0.86 0.56 0.08 0.62 -4.82 117.98 116.76 2a7k s PHE 24 Ca 0.56 -1.28 -0.13 0.00 0.12 0.00 0.00 56.93 56.21 2a7k s PHE 24 Cb -0.44 -4.69 0.11 0.00 -0.57 0.00 0.00 43.02 37.43 2a7k s PHE 24 CO 0.58 -1.81 1.20 -1.54 -0.10 0.00 0.00 175.22 173.55 2a7k s SER 25 N 4.61 4.04 0.24 1.36 1.04 -1.26 -4.55 113.70 119.18 2a7k s SER 25 Ca 0.53 0.70 0.07 0.00 0.48 0.00 0.00 55.95 57.73 2a7k s SER 25 Cb 0.03 -1.11 0.26 0.00 0.10 0.00 0.00 66.02 65.30 2a7k s SER 25 CO 0.03 -2.19 1.56 0.08 0.98 0.00 0.00 173.24 173.70 2a7k h ARG 26 N -1.26 0.12 -0.00 4.02 0.11 -1.99 -1.13 114.38 114.24 2a7k h ARG 26 Ca -0.46 -0.09 -0.00 0.00 0.10 0.00 0.00 59.98 59.53 2a7k h ARG 26 Cb 1.31 0.02 -0.00 0.00 1.11 0.00 0.00 29.97 32.41 2a7k h ARG 26 CO 0.59 0.72 0.00 1.15 0.10 0.00 0.00 179.97 182.54 2a7k h THR 27 N 0.09 1.04 -0.69 0.08 2.02 -1.97 -1.47 112.91 112.00 2a7k h THR 27 Ca -0.01 -0.12 -0.05 0.00 0.77 0.00 0.00 66.41 67.00 2a7k h THR 27 Cb 1.15 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 68.65 2a7k h THR 27 CO 0.09 0.03 0.24 0.25 0.37 0.00 0.00 175.52 176.51 2a7k h LEU 28 N -0.05 0.99 -0.22 2.58 5.85 -1.75 -1.34 115.31 121.36 2a7k h LEU 28 Ca 0.00 -0.19 0.04 0.00 0.84 0.00 0.00 57.88 58.57 2a7k h LEU 28 Cb 0.05 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.78 2a7k h LEU 28 CO -0.00 0.91 -0.05 -0.33 -0.34 0.00 0.00 178.44 178.64 2a7k h GLU 29 N 1.00 0.01 -0.46 1.25 5.08 -1.17 -0.63 114.58 119.66 2a7k h GLU 29 Ca 0.23 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.57 2a7k h GLU 29 Cb 0.26 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 2a7k h GLU 29 CO -0.01 0.01 0.24 1.15 -1.00 0.00 0.00 179.01 179.39 2a7k h THR 30 N 0.01 1.18 -0.40 1.13 2.02 -0.95 -0.25 112.91 115.66 2a7k h THR 30 Ca 0.11 -0.48 0.01 0.00 0.77 0.00 0.00 66.41 66.82 2a7k h THR 30 Cb 0.16 0.64 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 2a7k h THR 30 CO -0.22 0.19 0.24 0.28 0.37 0.00 0.00 175.52 176.38 2a7k h SER 31 N 0.60 0.40 -0.06 4.18 0.02 -1.08 -0.06 113.55 117.56 2a7k h SER 31 Ca 0.16 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.11 2a7k h SER 31 Cb 0.09 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 2a7k h SER 31 CO -0.02 0.29 0.02 0.58 -1.14 0.00 0.00 176.83 176.55 2a7k h VAL 32 N 0.49 1.16 -0.37 2.27 2.07 -0.87 0.59 116.25 121.59 2a7k h VAL 32 Ca 0.15 -0.47 0.01 0.00 0.82 0.00 0.00 66.70 67.21 2a7k h VAL 32 Cb -0.01 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 2a7k h VAL 32 CO -0.06 0.13 0.24 0.11 0.02 0.00 0.00 177.57 178.01 2a7k h LYS 33 N -0.09 0.47 -0.87 1.57 1.57 -0.91 -0.99 116.57 117.32 2a7k h LYS 33 Ca 0.02 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 2a7k h LYS 33 Cb 0.19 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.36 2a7k h LYS 33 CO -0.00 0.31 0.45 -0.44 -0.57 0.00 0.00 179.45 179.20 2a7k h ASP 34 N 0.49 1.11 -0.51 0.86 3.32 -0.85 -1.16 116.42 119.67 2a7k h ASP 34 Ca 0.14 -0.12 -0.05 0.00 0.02 0.00 0.00 57.03 57.02 2a7k h ASP 34 Cb -0.05 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.20 2a7k h ASP 34 CO -0.04 0.91 0.14 0.00 -1.72 0.00 0.00 179.24 178.54 2a7k h ALA 35 N 1.26 0.67 -0.80 3.45 0.00 -0.44 -2.01 119.26 121.38 2a7k h ALA 35 Ca 0.30 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2a7k h ALA 35 Cb 0.07 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 2a7k h ALA 35 CO -0.04 0.35 0.38 -0.07 0.00 0.00 0.00 179.25 179.86 2a7k h LEU 36 N 0.70 1.06 -0.63 0.00 4.07 -0.92 -0.55 115.31 119.04 2a7k h LEU 36 Ca 0.16 -0.14 -0.12 0.00 0.08 0.00 0.00 57.88 57.86 2a7k h LEU 36 Cb 0.31 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 41.76 2a7k h LEU 36 CO -0.00 0.90 -0.23 0.00 -1.08 0.00 0.00 178.44 178.04 2a7k h ALA 37 N 1.20 0.82 -0.33 1.53 0.00 -1.08 -0.95 119.26 120.44 2a7k h ALA 37 Ca 0.27 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 2a7k h ALA 37 Cb 0.13 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2a7k h ALA 37 CO -0.03 0.65 0.09 0.00 0.00 0.00 0.00 179.25 179.95 2a7k h ARG 38 N 0.73 0.52 -1.00 0.00 3.08 -1.16 -2.06 114.38 114.49 2a7k h ARG 38 Ca 0.10 -0.12 0.05 0.00 0.07 0.00 0.00 59.98 60.08 2a7k h ARG 38 Cb 0.76 -0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.68 2a7k h ARG 38 CO 0.06 0.57 0.65 0.00 -1.07 0.00 0.00 179.97 180.18 2a7k h ALA 39 N 0.92 1.38 -0.04 0.04 0.00 -0.95 -0.23 119.26 120.38 2a7k h ALA 39 Ca 0.10 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 2a7k h ALA 39 Cb 0.28 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2a7k h ALA 39 CO -0.00 0.50 -0.57 -0.97 0.00 0.00 0.00 179.25 178.21 2a7k h ASN 40 N 1.22 0.15 1.05 0.00 -1.24 -1.02 -3.22 115.58 112.53 2a7k h ASN 40 Ca 0.42 -0.08 -0.07 0.00 0.71 0.00 0.00 56.30 57.28 2a7k h ASN 40 Cb 0.09 -0.04 -0.01 0.00 0.73 0.00 0.00 38.32 39.08 2a7k h ASN 40 CO -0.15 0.68 -0.99 0.00 -1.29 0.00 0.00 177.43 175.68 2a7k h ALA 41 N 1.32 0.62 -1.94 1.57 0.00 -1.03 -3.46 119.26 116.35 2a7k h ALA 41 Ca -0.00 -0.34 -0.57 0.00 0.00 0.00 0.00 54.91 53.99 2a7k h ALA 41 Cb 1.03 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.84 2a7k h ALA 41 CO 0.08 0.39 0.83 0.34 0.00 0.00 0.00 179.25 180.89 2a7k s ASP 42 N -5.71 6.88 0.26 0.00 -1.08 -0.13 -4.91 116.67 111.99 2a7k s ASP 42 Ca -0.00 0.96 0.25 0.00 -0.52 0.00 0.00 52.55 53.24 2a7k s ASP 42 Cb 0.09 -2.54 0.92 0.00 -1.46 0.00 0.00 42.92 39.93 2a7k s ASP 42 CO 0.78 -0.91 1.75 0.44 0.52 0.00 0.00 175.17 177.75 2a7k h ASP 43 N 8.22 0.00 1.00 -0.34 3.32 -1.88 -2.33 116.42 124.42 2a7k h ASP 43 Ca -0.21 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.84 2a7k h ASP 43 Cb 1.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.61 2a7k h ASP 43 CO 1.04 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 177.02 2a7k n SER 44 N -2.32 0.33 -4.70 6.45 3.41 -1.26 -4.70 113.62 110.83 2a7k n SER 44 Ca 0.03 0.55 -0.36 0.00 -0.26 0.00 0.00 58.87 58.83 2a7k n SER 44 Cb 0.32 -0.63 -0.08 0.00 -0.26 0.00 0.00 64.21 63.56 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 -3.07 5.36 -0.14 -3.33 1.01 -0.88 -4.47 120.40 114.89 2a7k s VAL 45 Ca 0.10 0.26 0.03 0.00 0.00 0.00 0.00 61.98 62.37 2a7k s VAL 45 Cb 0.14 -3.52 -0.04 0.00 0.00 0.00 0.00 36.38 32.97 2a7k s VAL 45 CO 0.48 0.38 0.13 0.54 0.00 0.00 0.00 175.10 176.64 2a7k n ARG 46 N 3.90 5.47 -3.55 2.72 5.12 0.13 -4.91 116.66 125.54 2a7k n ARG 46 Ca -0.15 -0.00 -0.11 0.00 -1.93 0.00 0.00 57.85 55.66 2a7k n ARG 46 Cb 0.52 -0.69 -0.02 0.00 -1.16 0.00 0.00 32.46 31.11 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 -1.38 -1.39 -0.03 7.54 0.00 -1.16 -3.99 121.76 121.36 2a7k s ALA 47 Ca 0.01 0.23 0.01 0.00 0.00 0.00 0.00 51.96 52.21 2a7k s ALA 47 Cb 0.02 0.86 0.01 0.00 0.00 0.00 0.00 23.12 24.02 2a7k s ALA 47 CO 0.13 -0.80 -0.04 0.08 0.00 0.00 0.00 175.76 175.14 2a7k s VAL 48 N -3.80 0.40 -0.10 0.00 1.01 0.38 -1.10 120.40 117.20 2a7k s VAL 48 Ca 0.04 -0.11 0.02 0.00 0.00 0.00 0.00 61.98 61.93 2a7k s VAL 48 Cb -0.01 -0.41 -0.02 0.00 0.00 0.00 0.00 36.38 35.94 2a7k s VAL 48 CO -0.09 0.17 -0.16 -0.69 0.00 0.00 0.00 175.10 174.33 2a7k s VAL 49 N 0.56 2.82 -0.13 2.92 1.01 0.37 -0.30 120.40 127.65 2a7k s VAL 49 Ca -0.07 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.15 2a7k s VAL 49 Cb -0.10 -2.14 -0.01 0.00 0.00 0.00 0.00 36.38 34.13 2a7k s VAL 49 CO -0.00 0.55 -0.15 -0.69 0.00 0.00 0.00 175.10 174.81 2a7k s VAL 50 N 0.02 2.84 -0.00 2.92 1.01 0.07 -0.16 120.40 127.10 2a7k s VAL 50 Ca -0.05 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.19 2a7k s VAL 50 Cb -0.15 -2.18 0.00 0.00 0.00 0.00 0.00 36.38 34.06 2a7k s VAL 50 CO 0.05 0.53 0.00 -0.47 0.00 0.00 0.00 175.10 175.21 2a7k s TYR 51 N 0.40 0.01 -0.50 5.22 5.04 -0.49 -0.97 117.35 126.06 2a7k s TYR 51 Ca -0.12 0.01 0.25 0.00 -2.44 0.00 0.00 57.07 54.77 2a7k s TYR 51 Cb -0.16 -0.03 0.96 0.00 0.35 0.00 0.00 41.96 43.08 2a7k s TYR 51 CO 0.06 -0.01 1.75 0.78 -1.34 0.00 0.00 175.55 176.78 2a7k h GLY 52 N 6.26 0.00 0.00 8.97 0.00 -1.79 0.58 103.07 117.09 2a7k h GLY 52 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.07 2a7k h GLY 52 CO 0.51 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.66 2a7k n GLY 53 N 0.34 2.24 3.73 4.60 0.00 -1.26 -4.35 105.19 110.48 2a7k n GLY 53 Ca 0.03 -1.92 -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 -2.87 3.59 -1.50 4.61 0.00 -1.26 -2.79 121.76 121.54 2a7k s ALA 54 Ca 0.00 1.17 -0.05 0.00 0.00 0.00 0.00 51.96 53.07 2a7k s ALA 54 Cb 0.00 -3.53 0.02 0.00 0.00 0.00 0.00 23.12 19.61 2a7k s ALA 54 CO 0.00 -0.62 0.57 0.39 0.00 0.00 0.00 175.76 176.10 2a7k n GLU 55 N 3.20 -4.54 -4.34 0.00 1.02 -1.26 -5.00 120.64 109.73 2a7k n GLU 55 Ca 0.09 0.82 -0.18 0.00 -0.02 0.00 0.00 57.16 57.88 2a7k n GLU 55 Cb 0.42 -5.65 -0.10 0.00 -0.02 0.00 0.00 31.44 26.08 2a7k n GLU 55 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2a7k s ARG 56 N -5.75 1.36 0.25 3.49 0.52 -1.12 -5.01 118.95 112.69 2a7k s ARG 56 Ca 0.31 -1.69 -0.09 0.00 -0.52 0.00 0.00 55.73 53.74 2a7k s ARG 56 Cb -0.15 -0.66 -0.07 0.00 0.52 0.00 0.00 34.95 34.60 2a7k s ARG 56 CO 0.39 -0.09 0.56 -1.12 0.02 0.00 0.00 175.30 175.06 2a7k s SER 57 N -3.32 6.59 0.08 0.23 0.01 -0.69 -3.76 113.70 112.84 2a7k s SER 57 Ca 0.29 0.89 -0.34 0.00 1.31 0.00 0.00 55.95 58.10 2a7k s SER 57 Cb 0.06 -2.22 -0.16 0.00 0.21 0.00 0.00 66.02 63.91 2a7k s SER 57 CO 0.09 -0.11 1.59 0.15 0.41 0.00 0.00 173.24 175.37 2a7k h PHE 58 N 2.34 -1.14 -1.09 2.43 3.57 -0.76 -3.39 116.94 118.88 2a7k h PHE 58 Ca -0.47 -0.00 0.16 0.00 3.53 0.00 0.00 57.97 61.19 2a7k h PHE 58 Cb 1.17 0.43 -0.25 0.00 2.79 0.00 0.00 35.95 40.09 2a7k h PHE 58 CO 0.61 -0.61 0.29 0.45 -2.23 0.00 0.00 178.31 176.82 2a7k s SER 59 N -4.40 -0.52 0.00 0.41 0.15 -0.69 -4.59 113.70 104.06 2a7k s SER 59 Ca -0.18 0.75 0.11 0.00 0.70 0.00 0.00 55.95 57.33 2a7k s SER 59 Cb 0.04 1.51 0.58 0.00 -1.71 0.00 0.00 66.02 66.44 2a7k s SER 59 CO 0.62 -0.11 1.19 0.00 1.20 0.00 0.00 173.24 176.13 2a7k n ALA 60 N 4.60 1.75 0.00 5.45 0.00 0.35 -1.04 120.51 131.63 2a7k n ALA 60 Ca -0.11 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2a7k n ALA 60 Cb 0.54 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.81 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 -0.36 -1.45 3.82 0.00 0.00 -1.18 -4.49 105.19 101.53 2a7k n GLY 61 Ca 0.06 -1.64 -0.33 0.00 0.00 0.00 0.00 46.02 44.11 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 2.22 -0.29 -0.02 0.00 -1.26 -0.28 107.32 107.70 2a7k s GLY 62 Ca 0.00 0.35 -0.29 0.00 0.00 0.00 0.00 44.72 44.79 2a7k s GLY 62 CO 0.00 0.65 1.72 -0.35 0.00 0.00 0.00 173.10 175.12 2a7k s ASP 63 N -2.63 6.09 0.23 1.64 2.15 -1.26 -4.90 116.67 117.99 2a7k s ASP 63 Ca 0.62 1.42 -0.04 0.00 0.43 0.00 0.00 52.55 54.98 2a7k s ASP 63 Cb -0.12 -2.53 0.24 0.00 -0.30 0.00 0.00 42.92 40.21 2a7k s ASP 63 CO 0.27 -1.53 1.70 -0.26 -0.17 0.00 0.00 175.17 175.17 2a7k h PHE 64 N 12.00 0.91 -0.80 -5.34 0.04 -1.96 -0.07 116.94 121.73 2a7k h PHE 64 Ca -0.34 -0.16 0.13 0.00 2.80 0.00 0.00 57.97 60.40 2a7k h PHE 64 Cb 1.16 -0.24 -0.09 0.00 2.20 0.00 0.00 35.95 38.99 2a7k h PHE 64 CO 0.94 0.87 0.39 -0.91 -0.60 0.00 0.00 178.31 179.01 2a7k h ASN 65 N 0.75 0.48 0.79 2.17 4.21 -1.99 -0.20 115.58 121.79 2a7k h ASN 65 Ca 0.13 0.08 -0.17 0.00 1.21 0.00 0.00 56.30 57.55 2a7k h ASN 65 Cb 0.57 0.01 -0.02 0.00 -1.12 0.00 0.00 38.32 37.75 2a7k h ASN 65 CO 0.03 0.23 -0.82 -0.33 -1.29 0.00 0.00 177.43 175.25 2a7k h GLU 66 N 0.60 0.02 -0.40 0.81 5.08 -1.65 -1.87 114.58 117.17 2a7k h GLU 66 Ca 0.42 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.74 2a7k h GLU 66 Cb 0.55 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 2a7k h GLU 66 CO -0.34 0.82 0.18 0.28 -1.00 0.00 0.00 179.01 178.96 2a7k h VAL 67 N 0.01 1.18 -0.58 3.13 2.07 -0.60 -2.91 116.25 118.54 2a7k h VAL 67 Ca -0.01 -0.54 0.01 0.00 0.82 0.00 0.00 66.70 66.98 2a7k h VAL 67 Cb 1.44 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 31.97 2a7k h VAL 67 CO 0.11 0.20 0.39 0.11 0.02 0.00 0.00 177.57 178.40 2a7k h LYS 68 N 0.51 0.75 0.00 1.57 1.57 -0.78 -1.97 116.57 118.22 2a7k h LYS 68 Ca 0.14 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2a7k h LYS 68 Cb 0.15 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.29 2a7k h LYS 68 CO -0.02 0.49 0.00 1.96 -0.57 0.00 0.00 179.45 181.32 2a7k h GLN 69 N 0.77 0.00 -6.25 3.15 4.20 -1.17 -3.43 115.11 112.37 2a7k h GLN 69 Ca 0.22 0.00 -0.55 0.00 0.06 0.00 0.00 58.65 58.38 2a7k h GLN 69 Cb -0.05 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.73 2a7k h GLN 69 CO -0.05 0.00 1.22 -0.51 -0.67 0.00 0.00 178.83 178.82 2a7k s LEU 70 N -5.30 4.10 -0.02 1.46 1.43 -0.74 -4.83 118.68 114.77 2a7k s LEU 70 Ca 0.03 2.17 0.25 0.00 -1.03 0.00 0.00 54.13 55.56 2a7k s LEU 70 Cb 0.09 -3.53 0.42 0.00 0.03 0.00 0.00 46.19 43.21 2a7k s LEU 70 CO 0.48 -1.23 1.16 -1.54 0.23 0.00 0.00 176.35 175.45 2a7k n SER 71 N 8.38 0.98 -3.66 2.29 3.41 -1.26 -4.98 113.62 118.78 2a7k n SER 71 Ca 0.21 -2.00 -0.05 0.00 -0.26 0.00 0.00 58.87 56.76 2a7k n SER 71 Cb 0.43 -0.29 -0.07 0.00 -0.26 0.00 0.00 64.21 64.02 2a7k n SER 71 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2a7k s ARG 72 N -0.31 0.50 0.41 4.33 3.52 -1.26 -5.05 118.95 121.09 2a7k s ARG 72 Ca 0.32 1.21 0.19 0.00 -0.13 0.00 0.00 55.73 57.33 2a7k s ARG 72 Cb 0.37 0.49 1.12 0.00 -1.56 0.00 0.00 34.95 35.37 2a7k s ARG 72 CO -0.15 -0.20 1.81 0.66 -0.81 0.00 0.00 175.30 176.60 2a7k h SER 73 N 7.80 0.41 -0.30 -2.12 4.64 -1.99 0.32 113.55 122.30 2a7k h SER 73 Ca -0.21 0.06 -0.10 0.00 -0.47 0.00 0.00 61.79 61.06 2a7k h SER 73 Cb 1.13 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 63.20 2a7k h SER 73 CO 0.14 0.12 -0.18 -0.33 -0.87 0.00 0.00 176.83 175.71 2a7k h GLU 74 N 0.38 0.76 0.11 4.77 3.07 -1.99 -1.23 114.58 120.45 2a7k h GLU 74 Ca 0.54 -0.28 -0.30 0.00 -0.50 0.00 0.00 59.36 58.82 2a7k h GLU 74 Cb 1.41 -0.05 0.03 0.00 -0.84 0.00 0.00 28.75 29.30 2a7k h GLU 74 CO -0.23 0.88 -1.23 -0.44 -1.40 0.00 0.00 179.01 176.59 2a7k h ASP 75 N 0.67 0.88 -0.27 1.42 3.32 -1.38 -2.68 116.42 118.38 2a7k h ASP 75 Ca 0.10 -0.80 0.06 0.00 0.02 0.00 0.00 57.03 56.42 2a7k h ASP 75 Cb 0.67 -0.28 -0.08 0.00 0.22 0.00 0.00 39.33 39.87 2a7k h ASP 75 CO 0.05 1.60 -0.31 0.40 -1.72 0.00 0.00 179.24 179.26 2a7k h ILE 76 N 0.29 0.28 -0.55 0.35 1.08 -1.38 -2.06 117.51 115.51 2a7k h ILE 76 Ca -0.18 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.29 2a7k h ILE 76 Cb 1.90 0.28 -0.03 0.00 -3.07 0.00 0.00 36.82 35.90 2a7k h ILE 76 CO 0.24 0.00 0.36 -0.33 -0.69 0.00 0.00 178.15 177.73 2a7k h GLU 77 N -0.30 0.73 -0.32 2.37 5.08 -1.25 0.13 114.58 121.02 2a7k h GLU 77 Ca 0.14 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.35 2a7k h GLU 77 Cb 0.53 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 2a7k h GLU 77 CO -0.44 0.49 -0.24 1.05 -1.00 0.00 0.00 179.01 178.86 2a7k h GLU 78 N 0.75 0.62 -0.28 2.33 -0.00 -1.40 -0.22 114.58 116.39 2a7k h GLU 78 Ca 0.20 -0.24 -0.05 0.00 -0.00 0.00 0.00 59.36 59.27 2a7k h GLU 78 Cb -0.08 -0.03 -0.01 0.00 -0.00 0.00 0.00 28.75 28.63 2a7k h GLU 78 CO -0.04 0.81 -0.00 2.35 -0.00 0.00 0.00 179.01 182.12 2a7k h TRP 79 N 0.54 0.54 -0.56 2.06 7.01 -0.99 -1.99 115.95 122.56 2a7k h TRP 79 Ca 0.08 -0.10 0.05 0.00 2.11 0.00 0.00 58.89 61.03 2a7k h TRP 79 Cb 0.71 -0.14 -0.05 0.00 -2.10 0.00 0.00 29.16 27.58 2a7k h TRP 79 CO 0.03 0.65 0.29 0.82 -2.79 0.00 0.00 178.44 177.44 2a7k h ILE 80 N 0.28 0.96 -0.89 2.65 1.08 -0.44 -1.07 117.51 120.09 2a7k h ILE 80 Ca 0.08 -0.19 0.04 0.00 -0.39 0.00 0.00 64.86 64.39 2a7k h ILE 80 Cb 0.43 0.35 -0.05 0.00 -3.07 0.00 0.00 36.82 34.49 2a7k h ILE 80 CO 0.02 0.10 0.57 0.44 -0.69 0.00 0.00 178.15 178.59 2a7k h ASP 81 N 0.56 0.95 -0.33 1.72 3.32 -0.94 -1.07 116.42 120.63 2a7k h ASP 81 Ca 0.25 -0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.30 2a7k h ASP 81 Cb 0.15 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 2a7k h ASP 81 CO -0.16 0.65 0.20 0.03 -1.72 0.00 0.00 179.24 178.23 2a7k h ARG 82 N 1.11 0.39 0.33 3.56 3.08 -0.68 0.61 114.38 122.78 2a7k h ARG 82 Ca 0.36 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.37 2a7k h ARG 82 Cb 0.02 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 29.98 2a7k h ARG 82 CO -0.12 0.26 -0.16 0.28 -1.07 0.00 0.00 179.97 179.16 2a7k h VAL 83 N 0.40 0.68 -0.63 2.04 2.07 -0.86 -0.42 116.25 119.53 2a7k h VAL 83 Ca 0.13 -0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.56 2a7k h VAL 83 Cb -0.01 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 2a7k h VAL 83 CO -0.06 0.00 0.04 0.40 0.02 0.00 0.00 177.57 177.97 2a7k h ILE 84 N -0.44 1.27 -0.87 4.57 1.08 -1.14 -2.83 117.51 119.15 2a7k h ILE 84 Ca -0.04 -1.12 -0.00 0.00 -0.39 0.00 0.00 64.86 63.31 2a7k h ILE 84 Cb 0.34 0.75 -0.04 0.00 -3.07 0.00 0.00 36.82 34.79 2a7k h ILE 84 CO 0.07 0.41 0.53 0.44 -0.69 0.00 0.00 178.15 178.91 2a7k h ASP 85 N 0.99 1.03 -0.39 1.72 3.32 -0.76 -0.10 116.42 122.23 2a7k h ASP 85 Ca 0.18 -0.06 0.07 0.00 0.02 0.00 0.00 57.03 57.24 2a7k h ASP 85 Cb 0.52 -0.26 -0.06 0.00 0.22 0.00 0.00 39.33 39.75 2a7k h ASP 85 CO 0.02 0.79 0.05 0.25 -1.72 0.00 0.00 179.24 178.63 2a7k h LEU 86 N 1.19 -0.06 -0.31 1.55 5.85 -0.84 -1.19 115.31 121.49 2a7k h LEU 86 Ca 0.31 0.08 -0.15 0.00 0.84 0.00 0.00 57.88 58.96 2a7k h LEU 86 Cb -0.06 0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.08 2a7k h LEU 86 CO -0.06 0.01 -0.39 1.88 -0.34 0.00 0.00 178.44 179.53 2a7k h TYR 87 N 0.16 1.00 -0.87 1.25 0.05 -1.21 -2.91 116.97 114.44 2a7k h TYR 87 Ca 0.19 -0.32 0.03 0.00 0.05 0.00 0.00 58.73 58.68 2a7k h TYR 87 Cb 0.25 -0.20 -0.05 0.00 1.01 0.00 0.00 36.73 37.73 2a7k h TYR 87 CO -0.22 1.12 0.57 1.96 -1.05 0.00 0.00 178.16 180.54 2a7k h GLN 88 N 0.59 1.05 -0.99 4.88 1.08 -0.90 -1.34 115.11 119.50 2a7k h GLN 88 Ca 0.04 -0.06 0.08 0.00 -1.45 0.00 0.00 58.65 57.26 2a7k h GLN 88 Cb 0.99 -0.24 -0.07 0.00 -0.05 0.00 0.00 27.48 28.11 2a7k h GLN 88 CO 0.09 0.70 0.63 0.00 -0.95 0.00 0.00 178.83 179.30 2a7k h ALA 89 N 1.49 1.41 -0.14 3.87 0.00 -1.02 -0.30 119.26 124.57 2a7k h ALA 89 Ca 0.34 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.19 2a7k h ALA 89 Cb 0.02 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 2a7k h ALA 89 CO -0.10 0.35 -0.12 0.28 0.00 0.00 0.00 179.25 179.66 2a7k h VAL 90 N 1.09 1.34 0.00 0.00 2.07 -1.25 -3.26 116.25 116.25 2a7k h VAL 90 Ca 0.45 -1.26 -0.02 0.00 0.82 0.00 0.00 66.70 66.68 2a7k h VAL 90 Cb 0.27 1.87 -0.00 0.00 -1.52 0.00 0.00 31.29 31.91 2a7k h VAL 90 CO -0.20 0.37 -0.11 -0.07 0.02 0.00 0.00 177.57 177.58 2a7k h LEU 91 N -0.04 0.00 -0.91 2.57 3.38 -0.74 -2.29 115.31 117.28 2a7k h LEU 91 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2a7k h LEU 91 Cb 0.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2a7k h LEU 91 CO 0.03 0.11 -0.03 0.59 0.09 0.00 0.00 178.44 179.23 2a7k n ASN 92 N -3.44 1.44 -4.66 -0.43 3.02 -0.17 -4.79 115.26 106.23 2a7k n ASN 92 Ca -0.01 -1.42 -0.43 0.00 -0.03 0.00 0.00 54.58 52.69 2a7k n ASN 92 Cb 0.27 0.02 -0.02 0.00 -0.61 0.00 0.00 39.78 39.43 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 -2.06 4.28 -2.12 2.41 1.01 -0.86 -4.92 120.40 118.14 2a7k s VAL 93 Ca 0.36 1.54 0.16 0.00 0.00 0.00 0.00 61.98 64.04 2a7k s VAL 93 Cb 0.21 -4.04 0.38 0.00 0.00 0.00 0.00 36.38 32.93 2a7k s VAL 93 CO 0.36 -0.19 1.39 0.59 0.00 0.00 0.00 175.10 177.25 2a7k n ASN 94 N 6.75 1.90 -4.85 3.32 3.02 -1.26 -4.81 115.26 119.34 2a7k n ASN 94 Ca 0.14 -1.88 -0.26 0.00 -0.03 0.00 0.00 54.58 52.54 2a7k n ASN 94 Cb 0.45 -0.19 -0.05 0.00 -0.61 0.00 0.00 39.78 39.38 2a7k n ASN 94 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2a7k s LYS 95 N -1.62 3.08 0.19 3.52 1.02 -1.26 -4.30 119.74 120.37 2a7k s LYS 95 Ca 0.28 -0.77 -0.32 0.00 0.02 0.00 0.00 55.97 55.18 2a7k s LYS 95 Cb 0.15 -2.76 -0.15 0.00 -0.52 0.00 0.00 37.83 34.55 2a7k s LYS 95 CO 0.21 0.50 1.16 -2.30 -0.92 0.00 0.00 175.35 174.00 2a7k n PRO 96 N -0.37 1.23 -4.97 -1.68 -0.02 -1.26 -4.79 135.00 123.14 2a7k n PRO 96 Ca -0.08 0.44 -0.27 0.00 -2.02 0.00 0.00 63.50 61.57 2a7k n PRO 96 Cb 0.54 -1.93 -0.16 0.00 -0.02 0.00 0.00 33.50 31.93 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 -0.26 1.61 -0.06 3.45 -4.23 -1.26 -0.47 115.64 114.42 2a7k s THR 97 Ca 0.71 -0.83 0.02 0.00 -1.18 0.00 0.00 61.69 60.41 2a7k s THR 97 Cb -0.82 -1.36 0.01 0.00 1.34 0.00 0.00 72.50 71.67 2a7k s THR 97 CO 0.53 0.46 -0.11 -0.63 -0.54 0.00 0.00 174.62 174.32 2a7k s ILE 98 N -0.17 1.04 -0.23 2.99 -1.09 0.59 -1.92 121.20 122.40 2a7k s ILE 98 Ca 0.00 -0.43 -0.11 0.00 -2.23 0.00 0.00 60.65 57.88 2a7k s ILE 98 Cb -0.11 -0.96 -0.05 0.00 -1.58 0.00 0.00 42.46 39.77 2a7k s ILE 98 CO 0.01 0.33 0.19 0.00 -1.23 0.00 0.00 174.94 174.25 2a7k s ALA 99 N 0.67 3.61 -0.45 9.38 0.00 -0.64 -0.75 121.76 133.58 2a7k s ALA 99 Ca -0.14 -0.81 -0.08 0.00 0.00 0.00 0.00 51.96 50.93 2a7k s ALA 99 Cb -0.15 -2.35 0.11 0.00 0.00 0.00 0.00 23.12 20.73 2a7k s ALA 99 CO 0.03 -0.16 0.30 0.00 0.00 0.00 0.00 175.76 175.93 2a7k s ALA 100 N 1.00 3.33 -0.35 0.00 0.00 -0.14 -0.92 121.76 124.68 2a7k s ALA 100 Ca 0.09 -2.46 -0.15 0.00 0.00 0.00 0.00 51.96 49.45 2a7k s ALA 100 Cb -0.13 -2.72 -0.01 0.00 0.00 0.00 0.00 23.12 20.26 2a7k s ALA 100 CO 0.04 -1.83 0.33 0.08 0.00 0.00 0.00 175.76 174.38 2a7k s VAL 101 N 1.34 5.20 0.33 0.00 1.01 0.10 -4.02 120.40 124.35 2a7k s VAL 101 Ca 0.05 -0.05 0.08 0.00 0.00 0.00 0.00 61.98 62.06 2a7k s VAL 101 Cb -0.25 -3.81 -0.06 0.00 0.00 0.00 0.00 36.38 32.26 2a7k s VAL 101 CO -0.01 -0.09 -0.06 -0.62 0.00 0.00 0.00 175.10 174.32 2a7k s ASP 102 N 1.73 3.36 1.02 3.32 -1.08 -1.26 -0.95 116.67 122.81 2a7k s ASP 102 Ca 0.10 -1.24 0.00 0.00 -0.52 0.00 0.00 52.55 50.90 2a7k s ASP 102 Cb -0.17 -0.28 0.00 0.00 -1.46 0.00 0.00 42.92 41.01 2a7k s ASP 102 CO 0.11 -0.31 0.00 0.61 0.52 0.00 0.00 175.17 176.10 2a7k n GLY 103 N -0.75 2.85 3.88 2.66 0.00 -1.25 -1.24 105.19 111.35 2a7k n GLY 103 Ca -0.05 -0.25 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 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 3.59 -0.35 1.61 2.02 -1.26 -1.45 117.35 121.51 2a7k s TYR 104 Ca 0.00 0.55 0.03 0.00 -0.37 0.00 0.00 57.07 57.28 2a7k s TYR 104 Cb 0.00 -1.97 0.11 0.00 -0.40 0.00 0.00 41.96 39.70 2a7k s TYR 104 CO 0.00 0.66 0.10 0.00 -1.57 0.00 0.00 175.55 174.73 2a7k s ALA 105 N -1.21 2.50 -0.10 3.71 0.00 -0.27 -1.70 121.76 124.69 2a7k s ALA 105 Ca 0.23 -2.36 0.03 0.00 0.00 0.00 0.00 51.96 49.86 2a7k s ALA 105 Cb -0.13 -1.88 -0.01 0.00 0.00 0.00 0.00 23.12 21.10 2a7k s ALA 105 CO 0.13 -1.74 -0.20 0.42 0.00 0.00 0.00 175.76 174.37 2a7k s ILE 106 N 0.96 2.42 0.00 0.00 1.01 -0.20 -1.06 121.20 124.33 2a7k s ILE 106 Ca 0.12 -0.90 0.00 0.00 0.00 0.00 0.00 60.65 59.87 2a7k s ILE 106 Cb -0.20 -1.95 0.00 0.00 0.01 0.00 0.00 42.46 40.32 2a7k s ILE 106 CO -0.12 0.55 0.00 0.61 0.00 0.00 0.00 174.94 175.99 2a7k n GLY 107 N 3.34 3.70 0.40 6.18 0.00 -0.07 -1.03 105.19 117.71 2a7k n GLY 107 Ca -0.18 0.20 0.21 0.00 0.00 0.00 0.00 46.02 46.25 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 0.10 -0.56 1.61 2.86 -1.91 0.22 114.93 117.25 2a7k h MET 108 Ca 0.00 -0.01 -0.10 0.00 -2.06 0.00 0.00 59.70 57.53 2a7k h MET 108 Cb 0.00 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 2a7k h MET 108 CO 0.00 0.07 -0.05 0.78 1.06 0.00 0.00 176.91 178.77 2a7k h GLY 109 N 0.11 1.11 0.68 8.32 0.00 -1.23 0.18 103.07 112.24 2a7k h GLY 109 Ca 0.32 -0.85 -0.00 0.00 0.00 0.00 0.00 47.33 46.80 2a7k h GLY 109 CO -0.04 0.78 -0.01 -2.75 0.00 0.00 0.00 176.54 174.53 2a7k h PHE 110 N 0.91 -0.02 -0.70 5.60 3.04 -1.33 -2.09 116.94 122.33 2a7k h PHE 110 Ca 0.15 -0.00 0.02 0.00 3.98 0.00 0.00 57.97 62.12 2a7k h PHE 110 Cb 0.61 0.01 -0.04 0.00 2.56 0.00 0.00 35.95 39.09 2a7k h PHE 110 CO 0.04 0.29 0.45 1.96 -2.02 0.00 0.00 178.31 179.04 2a7k h GLN 111 N -0.34 0.88 -0.60 1.11 4.20 -0.94 -2.27 115.11 117.15 2a7k h GLN 111 Ca -0.00 -0.05 0.03 0.00 0.06 0.00 0.00 58.65 58.69 2a7k h GLN 111 Cb 0.33 -0.20 -0.04 0.00 0.30 0.00 0.00 27.48 27.87 2a7k h GLN 111 CO 0.00 0.58 0.36 0.35 -0.67 0.00 0.00 178.83 179.45 2a7k h PHE 112 N 0.91 0.67 -0.24 2.96 3.57 -0.62 -2.60 116.94 121.59 2a7k h PHE 112 Ca 0.27 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.78 2a7k h PHE 112 Cb -0.04 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.47 2a7k h PHE 112 CO -0.03 0.37 0.12 0.00 -2.23 0.00 0.00 178.31 176.54 2a7k h ALA 113 N 1.27 1.75 0.00 2.41 0.00 -0.83 -2.19 119.26 121.67 2a7k h ALA 113 Ca 0.24 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2a7k h ALA 113 Cb 0.05 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2a7k h ALA 113 CO -0.11 0.21 0.00 1.28 0.00 0.00 0.00 179.25 180.62 2a7k n LEU 114 N -4.46 0.18 0.16 0.00 4.77 -0.92 -2.64 117.00 114.08 2a7k n LEU 114 Ca 0.01 0.55 0.12 0.00 -0.03 0.00 0.00 56.01 56.66 2a7k n LEU 114 Cb 0.11 -0.53 0.23 0.00 -2.33 0.00 0.00 43.42 40.90 2a7k n LEU 114 CO 0.35 -0.36 0.71 0.24 -1.33 0.00 0.00 177.39 177.01 2a7k h MET 115 N 0.00 0.00 -7.06 3.23 2.86 -1.44 -3.47 114.93 109.05 2a7k h MET 115 Ca 0.00 0.00 -0.45 0.00 -2.06 0.00 0.00 59.70 57.19 2a7k h MET 115 Cb 0.26 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 2a7k h MET 115 CO 0.00 0.00 0.33 -0.06 1.06 0.00 0.00 176.91 178.24 2a7k s PHE 116 N -3.19 3.35 0.25 -0.22 0.40 -1.08 -4.51 117.98 112.97 2a7k s PHE 116 Ca 0.07 1.55 -0.06 0.00 -0.60 0.00 0.00 56.93 57.89 2a7k s PHE 116 Cb 0.09 -2.81 0.28 0.00 0.51 0.00 0.00 43.02 41.08 2a7k s PHE 116 CO 0.66 -0.15 1.91 -0.44 0.70 0.00 0.00 175.22 177.90 2a7k h ASP 117 N 1.72 1.07 -5.07 1.36 3.32 -1.72 -3.44 116.42 113.67 2a7k h ASP 117 Ca -0.48 -0.02 -0.15 0.00 0.02 0.00 0.00 57.03 56.40 2a7k h ASP 117 Cb 1.18 -0.26 -0.19 0.00 0.22 0.00 0.00 39.33 40.29 2a7k h ASP 117 CO 0.61 0.76 -0.67 -1.10 -1.72 0.00 0.00 179.24 177.12 2a7k s GLN 118 N -6.10 0.43 -0.06 3.56 -1.52 -1.03 -5.03 119.66 109.90 2a7k s GLN 118 Ca -0.13 -0.80 0.03 0.00 -1.95 0.00 0.00 55.36 52.51 2a7k s GLN 118 Cb 0.18 0.15 0.01 0.00 -0.22 0.00 0.00 33.01 33.13 2a7k s GLN 118 CO 0.81 -0.08 -0.13 1.03 -0.25 0.00 0.00 175.29 176.67 2a7k s ARG 119 N -2.29 1.71 0.04 2.91 0.52 -1.26 -1.63 118.95 118.96 2a7k s ARG 119 Ca -0.08 -0.45 0.06 0.00 -0.52 0.00 0.00 55.73 54.75 2a7k s ARG 119 Cb -0.04 -1.42 -0.03 0.00 0.52 0.00 0.00 34.95 33.98 2a7k s ARG 119 CO -0.04 0.06 -0.14 -0.51 0.02 0.00 0.00 175.30 174.69 2a7k s LEU 120 N 0.55 2.79 0.13 2.53 1.43 -0.10 -0.29 118.68 125.72 2a7k s LEU 120 Ca -0.13 -0.36 0.05 0.00 -1.03 0.00 0.00 54.13 52.66 2a7k s LEU 120 Cb -0.15 -1.63 -0.04 0.00 0.03 0.00 0.00 46.19 44.41 2a7k s LEU 120 CO 0.04 0.25 -0.13 0.00 0.23 0.00 0.00 176.35 176.73 2a7k s MET 121 N -1.57 1.02 0.49 1.70 0.23 -0.56 0.00 119.30 120.61 2a7k s MET 121 Ca 0.16 -1.27 -0.20 0.00 -1.03 0.00 0.00 55.69 53.35 2a7k s MET 121 Cb -0.11 -0.83 -0.08 0.00 -1.53 0.00 0.00 34.83 32.28 2a7k s MET 121 CO 0.07 0.15 1.04 0.00 -2.03 0.00 0.00 175.02 174.25 2a7k s ALA 122 N -2.36 2.86 0.35 3.16 0.00 -0.12 -1.49 121.76 124.15 2a7k s ALA 122 Ca 0.10 0.60 0.38 0.00 0.00 0.00 0.00 51.96 53.04 2a7k s ALA 122 Cb -0.04 -3.26 1.94 0.00 0.00 0.00 0.00 23.12 21.77 2a7k s ALA 122 CO 0.02 -0.36 2.14 0.66 0.00 0.00 0.00 175.76 178.23 2a7k h SER 123 N 1.47 0.00 -0.30 0.00 4.64 -1.03 -1.07 113.55 117.27 2a7k h SER 123 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 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 0.59 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.90 2a7k n THR 124 N -2.89 0.49 -2.14 2.95 -2.24 -1.26 -4.33 114.28 104.86 2a7k n THR 124 Ca -0.02 -0.74 -0.28 0.00 -2.27 0.00 0.00 64.05 60.74 2a7k n THR 124 Cb 0.12 0.96 0.04 0.00 -2.10 0.00 0.00 70.33 69.34 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 -1.29 3.09 -0.04 6.98 0.00 -0.41 -4.68 121.76 125.42 2a7k s ALA 125 Ca 0.30 -0.52 -0.02 0.00 0.00 0.00 0.00 51.96 51.72 2a7k s ALA 125 Cb 0.18 -2.82 0.02 0.00 0.00 0.00 0.00 23.12 20.51 2a7k s ALA 125 CO 0.25 -0.98 0.08 -0.80 0.00 0.00 0.00 175.76 174.31 2a7k s ASN 126 N -4.34 -0.05 -0.12 0.00 -0.87 -0.53 -3.69 114.94 105.35 2a7k s ASN 126 Ca 0.56 0.16 -0.09 0.00 -1.57 0.00 0.00 52.86 51.93 2a7k s ASN 126 Cb -0.11 0.10 -0.04 0.00 -0.02 0.00 0.00 41.25 41.18 2a7k s ASN 126 CO 0.48 -0.09 0.18 -0.36 -2.57 0.00 0.00 177.10 174.75 2a7k s PHE 127 N 0.66 3.58 -0.03 2.20 0.40 -0.09 -1.12 117.98 123.58 2a7k s PHE 127 Ca -0.05 0.56 -0.02 0.00 -0.60 0.00 0.00 56.93 56.82 2a7k s PHE 127 Cb -0.07 -2.04 0.01 0.00 0.51 0.00 0.00 43.02 41.43 2a7k s PHE 127 CO -0.03 0.63 0.06 0.08 0.70 0.00 0.00 175.22 176.66 2a7k s VAL 128 N -0.73 -0.02 -0.59 -0.44 1.01 -0.22 0.17 120.40 119.58 2a7k s VAL 128 Ca 0.15 0.06 0.06 0.00 0.00 0.00 0.00 61.98 62.25 2a7k s VAL 128 Cb -0.12 -0.10 0.25 0.00 0.00 0.00 0.00 36.38 36.40 2a7k s VAL 128 CO 0.04 0.02 0.70 0.80 0.00 0.00 0.00 175.10 176.66 2a7k n MET 129 N 3.37 2.16 -0.27 2.72 1.56 -1.26 -0.89 117.12 124.51 2a7k n MET 129 Ca -0.16 -4.39 0.07 0.00 -0.27 0.00 0.00 57.70 52.94 2a7k n MET 129 Cb 0.57 -2.06 0.20 0.00 2.15 0.00 0.00 33.22 34.08 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 0.99 2.23 -0.21 2.12 -0.04 -1.26 -4.52 135.00 134.30 2a7k n PRO 130 Ca 0.28 -1.64 -0.05 0.00 -0.04 0.00 0.00 63.50 62.05 2a7k n PRO 130 Cb 0.43 -1.44 0.01 0.00 -0.04 0.00 0.00 33.50 32.46 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 2.56 -0.15 -0.72 0.54 3.07 -1.90 -2.02 114.58 115.96 2a7k h GLU 131 Ca 0.00 0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.86 2a7k h GLU 131 Cb 0.71 0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 28.62 2a7k h GLU 131 CO 0.05 -0.10 0.41 -0.07 -1.40 0.00 0.00 179.01 177.90 2a7k h LEU 132 N -0.15 0.88 -1.59 1.33 3.38 -1.80 0.40 115.31 117.76 2a7k h LEU 132 Ca 0.24 -0.08 0.12 0.00 0.09 0.00 0.00 57.88 58.24 2a7k h LEU 132 Cb 0.55 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 2a7k h LEU 132 CO -0.69 0.70 0.45 0.50 0.09 0.00 0.00 178.44 179.49 2a7k h LYS 133 N 0.98 0.43 -0.33 1.13 3.64 -1.70 -1.66 116.57 119.06 2a7k h LYS 133 Ca 0.25 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 2a7k h LYS 133 Cb 0.00 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 2a7k h LYS 133 CO -0.04 0.28 0.00 0.72 -2.27 0.00 0.00 179.45 178.14 2a7k n HIS 134 N -4.48 0.42 -1.64 1.91 8.25 -0.43 -4.93 115.22 114.33 2a7k n HIS 134 Ca 0.12 -0.21 -0.04 0.00 -0.26 0.00 0.00 57.72 57.33 2a7k n HIS 134 Cb 0.43 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.53 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 1.37 0.42 3.64 -1.41 0.00 -0.62 -5.04 105.19 103.55 2a7k n GLY 135 Ca 0.18 -0.81 -0.35 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.16 4.35 0.44 -0.61 -1.09 0.00 -4.99 121.20 117.13 2a7k s ILE 136 Ca 0.00 -0.22 -0.26 0.00 -2.23 0.00 0.00 60.65 57.95 2a7k s ILE 136 Cb 0.00 -2.87 -0.09 0.00 -1.58 0.00 0.00 42.46 37.92 2a7k s ILE 136 CO 0.00 0.56 1.43 -0.83 -1.23 0.00 0.00 174.94 174.86 2a7k s GLY 137 N -0.40 2.92 -0.17 6.18 0.00 -1.26 -3.22 107.32 111.37 2a7k s GLY 137 Ca 0.08 1.47 0.14 0.00 0.00 0.00 0.00 44.72 46.40 2a7k s GLY 137 CO 0.02 2.09 1.19 0.00 0.00 0.00 0.00 173.10 176.40 2a7k h SER 139 N 0.76 0.19 -0.01 0.00 4.64 -1.98 0.59 113.55 117.75 2a7k h SER 139 Ca -0.02 -0.05 -0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2a7k h SER 139 Cb 1.09 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 2a7k h SER 139 CO 0.01 0.43 -0.01 0.58 -0.87 0.00 0.00 176.83 176.97 2a7k h VAL 140 N 0.19 1.47 -0.71 0.95 2.07 -1.94 -1.54 116.25 116.73 2a7k h VAL 140 Ca 0.03 -1.39 -0.00 0.00 0.82 0.00 0.00 66.70 66.16 2a7k h VAL 140 Cb 0.50 2.40 -0.03 0.00 -1.52 0.00 0.00 31.29 32.63 2a7k h VAL 140 CO 0.03 0.36 0.43 1.23 0.02 0.00 0.00 177.57 179.64 2a7k h GLY 141 N -0.56 1.03 0.95 2.17 0.00 -1.89 -1.90 103.07 102.86 2a7k h GLY 141 Ca -0.00 -0.42 -0.09 0.00 0.00 0.00 0.00 47.33 46.82 2a7k h GLY 141 CO 0.00 0.41 -0.16 0.00 0.00 0.00 0.00 176.54 176.79 2a7k h ALA 142 N 1.49 0.46 -0.84 3.60 0.00 -0.85 -1.52 119.26 121.60 2a7k h ALA 142 Ca 0.26 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2a7k h ALA 142 Cb -0.04 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 2a7k h ALA 142 CO -0.05 0.37 0.44 0.00 0.00 0.00 0.00 179.25 180.01 2a7k h ALA 143 N 0.77 1.08 -0.05 0.00 0.00 -1.10 -0.74 119.26 119.22 2a7k h ALA 143 Ca 0.07 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2a7k h ALA 143 Cb 0.69 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2a7k h ALA 143 CO 0.05 0.61 -0.03 0.82 0.00 0.00 0.00 179.25 180.70 2a7k h ILE 144 N 1.18 1.34 -0.40 0.00 2.04 -1.25 -2.16 117.51 118.26 2a7k h ILE 144 Ca 0.29 -1.08 -0.12 0.00 1.00 0.00 0.00 64.86 64.96 2a7k h ILE 144 Cb 0.07 1.95 -0.01 0.00 -0.74 0.00 0.00 36.82 38.09 2a7k h ILE 144 CO -0.04 0.29 -0.23 0.25 0.00 0.00 0.00 178.15 178.42 2a7k h LEU 145 N -0.29 0.82 -1.17 1.44 5.85 -1.24 0.86 115.31 121.57 2a7k h LEU 145 Ca 0.01 -0.30 -0.00 0.00 0.84 0.00 0.00 57.88 58.43 2a7k h LEU 145 Cb 0.49 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.26 2a7k h LEU 145 CO 0.01 1.02 0.48 1.23 -0.34 0.00 0.00 178.44 180.83 2a7k h GLY 146 N 0.95 1.11 0.76 3.75 0.00 -1.17 0.32 103.07 108.79 2a7k h GLY 146 Ca 0.09 -0.45 -0.06 0.00 0.00 0.00 0.00 47.33 46.91 2a7k h GLY 146 CO 0.06 0.44 -0.15 -2.75 0.00 0.00 0.00 176.54 174.14 2a7k h PHE 147 N 1.07 0.46 0.15 5.60 3.57 -0.71 -2.09 116.94 124.98 2a7k h PHE 147 Ca 0.28 -0.13 -0.30 0.00 3.53 0.00 0.00 57.97 61.34 2a7k h PHE 147 Cb -0.06 -0.10 0.03 0.00 2.79 0.00 0.00 35.95 38.61 2a7k h PHE 147 CO 0.00 0.76 -1.29 1.79 -2.23 0.00 0.00 178.31 177.34 2a7k h THR 148 N 0.03 1.32 0.00 4.41 1.35 -0.64 -3.39 112.91 115.99 2a7k h THR 148 Ca 0.03 -2.61 0.00 0.00 -0.55 0.00 0.00 66.41 63.28 2a7k h THR 148 Cb 0.67 2.81 0.00 0.00 -1.73 0.00 0.00 68.15 69.90 2a7k h THR 148 CO 0.04 0.78 0.00 1.41 -0.25 0.00 0.00 175.52 177.50 2a7k n HIS 149 N -3.73 0.00 0.00 4.73 8.25 0.11 -5.08 115.22 119.50 2a7k n HIS 149 Ca -0.13 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.33 2a7k n HIS 149 Cb 1.02 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.13 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 0.07 -0.46 0.06 -1.41 0.00 -0.78 -4.54 105.19 98.13 2a7k n GLY 150 Ca 0.00 -1.70 -0.13 0.00 0.00 0.00 0.00 46.02 44.19 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 0.02 -0.11 1.61 3.57 -1.86 -2.26 116.94 117.90 2a7k h PHE 151 Ca 0.00 -0.00 -0.16 0.00 3.53 0.00 0.00 57.97 61.34 2a7k h PHE 151 Cb 0.00 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 2a7k h PHE 151 CO 0.00 0.40 -0.59 0.66 -2.23 0.00 0.00 178.31 176.54 2a7k h SER 152 N -0.36 0.43 -0.31 0.41 4.64 -1.96 -0.34 113.55 116.06 2a7k h SER 152 Ca 0.00 -0.24 -0.02 0.00 -0.47 0.00 0.00 61.79 61.06 2a7k h SER 152 Cb 0.39 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 2a7k h SER 152 CO 0.00 0.92 0.09 0.74 -0.87 0.00 0.00 176.83 177.72 2a7k h THR 153 N 0.28 1.20 -0.28 2.95 2.02 -1.79 -2.33 112.91 114.96 2a7k h THR 153 Ca -0.00 -0.66 0.04 0.00 0.77 0.00 0.00 66.41 66.56 2a7k h THR 153 Cb 1.12 1.06 -0.04 0.00 -1.74 0.00 0.00 68.15 68.55 2a7k h THR 153 CO 0.10 0.22 0.03 -0.03 0.37 0.00 0.00 175.52 176.21 2a7k h MET 154 N 0.34 0.12 -0.21 6.66 -1.53 -1.12 -1.35 114.93 117.85 2a7k h MET 154 Ca 0.10 -0.01 0.05 0.00 -3.44 0.00 0.00 59.70 56.40 2a7k h MET 154 Cb 0.25 -0.03 -0.05 0.00 -0.55 0.00 0.00 31.60 31.22 2a7k h MET 154 CO -0.00 0.08 -0.11 1.96 0.14 0.00 0.00 176.91 178.97 2a7k h GLN 155 N 0.12 -0.10 -0.36 0.39 4.20 -1.03 -0.87 115.11 117.48 2a7k h GLN 155 Ca 0.13 0.01 0.06 0.00 0.06 0.00 0.00 58.65 58.91 2a7k h GLN 155 Cb 0.16 0.02 -0.06 0.00 0.30 0.00 0.00 27.48 27.90 2a7k h GLN 155 CO -0.20 -0.06 0.01 1.49 -0.67 0.00 0.00 178.83 179.39 2a7k h GLU 156 N -0.10 0.10 0.08 1.46 4.81 -1.07 -1.53 114.58 118.34 2a7k h GLU 156 Ca 0.11 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 2a7k h GLU 156 Cb 0.27 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.63 2a7k h GLU 156 CO -0.27 0.07 -0.04 0.82 -0.73 0.00 0.00 179.01 178.86 2a7k h ILE 157 N 0.11 1.12 0.00 2.32 2.04 -0.79 -1.59 117.51 120.72 2a7k h ILE 157 Ca 0.17 -0.72 -0.05 0.00 1.00 0.00 0.00 64.86 65.27 2a7k h ILE 157 Cb 0.24 1.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 2a7k h ILE 157 CO -0.29 0.18 -0.23 0.16 0.00 0.00 0.00 178.15 177.97 2a7k h ILE 158 N -0.43 0.52 0.00 -0.67 3.07 -1.14 -2.20 117.51 116.67 2a7k h ILE 158 Ca -0.01 -1.19 -0.09 0.00 1.55 0.00 0.00 64.86 65.12 2a7k h ILE 158 Cb 0.37 1.83 -0.02 0.00 -0.27 0.00 0.00 36.82 38.73 2a7k h ILE 158 CO 0.02 0.22 -1.47 -1.22 -1.05 0.00 0.00 178.15 174.65 2a7k n TYR 159 N -3.34 0.70 -0.00 0.16 4.01 -0.58 -4.22 117.16 113.89 2a7k n TYR 159 Ca 0.01 0.22 -0.08 0.00 -0.16 0.00 0.00 57.90 57.89 2a7k n TYR 159 Cb 0.46 -0.92 -0.13 0.00 -0.31 0.00 0.00 39.34 38.44 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 -6.42 -0.72 4.20 -1.27 -3.49 115.11 107.41 2a7k h GLN 160 Ca -0.11 0.00 -0.49 0.00 0.06 0.00 0.00 58.65 58.11 2a7k h GLN 160 Cb 1.32 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 29.02 2a7k h GLN 160 CO 0.02 0.59 -0.80 0.00 -0.67 0.00 0.00 178.83 177.97 2a7k s GLN 162 N -6.63 3.61 -0.09 0.00 -0.21 -1.26 -4.76 119.66 110.32 2a7k s GLN 162 Ca 0.54 -0.10 -0.30 0.00 0.02 0.00 0.00 55.36 55.52 2a7k s GLN 162 Cb -0.28 -2.76 -0.04 0.00 1.00 0.00 0.00 33.01 30.94 2a7k s GLN 162 CO 0.86 0.34 1.37 0.45 -2.12 0.00 0.00 175.29 176.19 2a7k s SER 163 N -2.91 6.88 -0.45 5.90 0.15 -1.26 -4.46 113.70 117.54 2a7k s SER 163 Ca 0.42 1.93 -0.16 0.00 0.70 0.00 0.00 55.95 58.83 2a7k s SER 163 Cb -0.11 -2.55 0.05 0.00 -1.71 0.00 0.00 66.02 61.70 2a7k s SER 163 CO 0.28 -0.76 0.42 -0.76 1.20 0.00 0.00 173.24 173.61 2a7k s LEU 164 N 3.15 5.24 0.94 3.45 1.43 0.13 -4.95 118.68 128.07 2a7k s LEU 164 Ca 0.61 -1.03 -0.15 0.00 -1.03 0.00 0.00 54.13 52.53 2a7k s LEU 164 Cb -0.27 -2.26 0.18 0.00 0.03 0.00 0.00 46.19 43.87 2a7k s LEU 164 CO 0.22 -0.63 1.30 1.51 0.23 0.00 0.00 176.35 178.98 2a7k s ASP 165 N 2.23 3.29 0.16 2.29 1.47 -1.26 -0.91 116.67 123.94 2a7k s ASP 165 Ca 0.08 0.36 -0.18 0.00 1.18 0.00 0.00 52.55 53.98 2a7k s ASP 165 Cb -0.21 -0.47 0.07 0.00 -0.34 0.00 0.00 42.92 41.97 2a7k s ASP 165 CO 0.10 -2.63 1.66 0.00 0.68 0.00 0.00 175.17 174.98 2a7k h ALA 166 N -1.57 0.18 -0.92 2.11 0.00 -1.75 -0.48 119.26 116.82 2a7k h ALA 166 Ca -0.45 0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.66 2a7k h ALA 166 Cb 1.25 0.33 -0.06 0.00 0.00 0.00 0.00 17.79 19.31 2a7k h ALA 166 CO 0.42 -0.49 0.60 -1.35 0.00 0.00 0.00 179.25 178.43 2a7k h PRO 167 N -0.05 1.03 -0.41 0.00 0.11 -1.93 -0.68 132.00 130.07 2a7k h PRO 167 Ca 0.18 -0.06 -0.12 0.00 0.11 0.00 0.00 66.00 66.10 2a7k h PRO 167 Cb 0.32 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.18 2a7k h PRO 167 CO -0.39 0.68 -0.24 -0.09 -0.21 0.00 0.00 178.00 177.75 2a7k h ARG 168 N 1.06 0.84 -0.33 1.05 9.65 -1.62 -1.08 114.38 123.96 2a7k h ARG 168 Ca 0.39 -0.35 -0.11 0.00 -1.10 0.00 0.00 59.98 58.81 2a7k h ARG 168 Cb 0.18 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 28.71 2a7k h ARG 168 CO -0.15 0.99 -0.24 0.00 2.80 0.00 0.00 179.97 183.37 2a7k h VAL 170 N 0.57 1.17 -0.42 0.00 2.07 -0.89 0.37 116.25 119.11 2a7k h VAL 170 Ca 0.08 -0.51 -0.04 0.00 0.82 0.00 0.00 66.70 67.06 2a7k h VAL 170 Cb 0.71 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 2a7k h VAL 170 CO 0.05 0.17 0.10 -0.78 0.02 0.00 0.00 177.57 177.14 2a7k h ASP 171 N 0.30 0.57 0.87 0.57 3.58 -1.04 -1.40 116.42 119.87 2a7k h ASP 171 Ca 0.09 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.46 2a7k h ASP 171 Cb 0.16 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.07 2a7k h ASP 171 CO -0.01 0.57 0.00 -1.22 -2.88 0.00 0.00 179.24 175.70 2a7k n TYR 172 N -4.32 0.00 -3.27 0.28 4.01 -0.40 -4.93 117.16 108.54 2a7k n TYR 172 Ca 0.03 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.57 2a7k n TYR 172 Cb 0.20 -0.45 0.06 0.00 -0.31 0.00 0.00 39.34 38.84 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 -1.45 -5.98 0.19 -0.72 0.63 -0.53 -4.91 116.66 103.90 2a7k n ARG 173 Ca 0.09 0.73 0.10 0.00 -0.92 0.00 0.00 57.85 57.85 2a7k n ARG 173 Cb 0.31 -5.38 0.13 0.00 0.45 0.00 0.00 32.46 27.96 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 -1.95 0.00 -8.52 6.15 3.38 -0.56 -3.46 115.31 110.34 2a7k h LEU 174 Ca -0.48 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.24 2a7k h LEU 174 Cb 1.31 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.92 2a7k h LEU 174 CO 0.48 0.08 -0.69 0.68 0.09 0.00 0.00 178.44 179.08 2a7k s VAL 175 N -3.19 0.79 -0.11 1.22 -7.23 -1.24 -4.81 120.40 105.84 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 -1.79 -0.27 0.00 0.56 0.00 0.00 36.38 34.94 2a7k s VAL 175 CO 0.70 -0.78 0.42 0.59 -0.31 0.00 0.00 175.10 175.72 2a7k n ASN 176 N -0.11 0.14 -3.72 4.85 4.13 0.61 -4.80 115.26 116.36 2a7k n ASN 176 Ca -0.11 0.06 -0.14 0.00 1.68 0.00 0.00 54.58 56.07 2a7k n ASN 176 Cb 0.61 1.39 -0.08 0.00 -1.54 0.00 0.00 39.78 40.16 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 -3.12 0.73 -0.10 3.52 -0.21 -1.21 -5.04 119.66 114.24 2a7k s GLN 177 Ca -0.08 -0.12 0.03 0.00 0.02 0.00 0.00 55.36 55.21 2a7k s GLN 177 Cb 0.11 0.33 0.01 0.00 1.00 0.00 0.00 33.01 34.45 2a7k s GLN 177 CO 0.87 -0.21 -0.18 0.08 -2.12 0.00 0.00 175.29 173.73 2a7k s VAL 178 N -1.30 1.65 0.20 1.09 1.01 -1.26 -1.50 120.40 120.29 2a7k s VAL 178 Ca -0.13 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.08 2a7k s VAL 178 Cb -0.04 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.83 2a7k s VAL 178 CO 0.05 0.47 0.13 0.68 0.00 0.00 0.00 175.10 176.43 2a7k s VAL 179 N 0.65 0.02 0.52 2.92 -7.23 -0.56 -4.90 120.40 111.83 2a7k s VAL 179 Ca -0.13 -2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 57.83 2a7k s VAL 179 Cb -0.16 -2.48 -0.06 0.00 0.56 0.00 0.00 36.38 34.24 2a7k s VAL 179 CO 0.04 -0.02 1.19 -1.61 -0.31 0.00 0.00 175.10 174.38 2a7k s GLU 180 N -4.15 3.40 0.27 4.82 0.41 -1.26 -0.38 118.70 121.82 2a7k s GLU 180 Ca 0.38 1.81 -0.03 0.00 -0.41 0.00 0.00 54.97 56.73 2a7k s GLU 180 Cb 0.07 -2.19 0.58 0.00 -1.78 0.00 0.00 34.13 30.81 2a7k s GLU 180 CO 0.12 -0.85 1.63 0.77 -0.49 0.00 0.00 175.26 176.43 2a7k h SER 181 N 1.51 -0.28 0.67 -0.19 0.02 -1.93 0.35 113.55 113.70 2a7k h SER 181 Ca -0.50 0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 2a7k h SER 181 Cb 1.27 0.35 0.00 0.00 0.14 0.00 0.00 62.40 64.16 2a7k h SER 181 CO 0.58 -0.21 0.00 0.77 -1.14 0.00 0.00 176.83 176.83 2a7k h SER 182 N 0.12 0.00 -0.01 3.07 4.64 -2.03 -2.39 113.55 116.95 2a7k h SER 182 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 2a7k h SER 182 Cb 0.93 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 2a7k h SER 182 CO -0.72 0.00 -0.39 0.00 -0.87 0.00 0.00 176.83 174.85 2a7k n ALA 183 N -2.01 3.28 0.10 5.18 0.00 0.02 -4.76 120.51 122.33 2a7k n ALA 183 Ca -0.00 -0.50 -0.13 0.00 0.00 0.00 0.00 53.44 52.80 2a7k n ALA 183 Cb 0.22 -0.54 -0.08 0.00 0.00 0.00 0.00 19.45 19.05 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 1.37 -0.16 -0.54 0.00 5.85 -0.76 -1.41 115.31 119.66 2a7k h LEU 184 Ca 0.00 -0.08 -0.08 0.00 0.84 0.00 0.00 57.88 58.57 2a7k h LEU 184 Cb 0.49 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 2a7k h LEU 184 CO 0.00 -0.03 0.04 0.25 -0.34 0.00 0.00 178.44 178.36 2a7k h LEU 185 N -0.29 0.90 -0.84 2.25 5.85 -1.86 -0.95 115.31 120.37 2a7k h LEU 185 Ca -0.02 -0.29 -0.03 0.00 0.84 0.00 0.00 57.88 58.38 2a7k h LEU 185 Cb 0.23 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 2a7k h LEU 185 CO 0.03 0.96 0.39 -0.78 -0.34 0.00 0.00 178.44 178.71 2a7k h ASP 186 N 0.81 1.11 -0.55 1.25 1.82 -1.87 0.03 116.42 119.02 2a7k h ASP 186 Ca 0.16 -0.14 -0.07 0.00 -0.39 0.00 0.00 57.03 56.59 2a7k h ASP 186 Cb 0.48 -0.29 -0.03 0.00 0.68 0.00 0.00 39.33 40.18 2a7k h ASP 186 CO 0.02 0.95 0.10 0.00 -1.61 0.00 0.00 179.24 178.69 2a7k h ALA 187 N 1.21 1.06 -0.13 -0.78 0.00 -0.92 -0.22 119.26 119.48 2a7k h ALA 187 Ca 0.29 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2a7k h ALA 187 Cb 0.14 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 2a7k h ALA 187 CO -0.03 0.61 -0.04 0.00 0.00 0.00 0.00 179.25 179.79 2a7k h ALA 188 N 1.20 0.18 -0.86 0.00 0.00 -0.84 -2.09 119.26 116.86 2a7k h ALA 188 Ca 0.18 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.87 2a7k h ALA 188 Cb 0.39 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 2a7k h ALA 188 CO 0.01 -0.06 0.57 0.82 0.00 0.00 0.00 179.25 180.58 2a7k h ILE 189 N -0.06 1.20 -0.15 0.00 2.04 -0.93 -0.82 117.51 118.79 2a7k h ILE 189 Ca 0.03 -0.39 0.04 0.00 1.00 0.00 0.00 64.86 65.54 2a7k h ILE 189 Cb 0.47 -0.04 -0.04 0.00 -0.74 0.00 0.00 36.82 36.47 2a7k h ILE 189 CO 0.01 0.21 -0.10 0.74 0.00 0.00 0.00 178.15 179.01 2a7k h THR 190 N 1.14 0.70 -0.60 -0.27 2.02 -0.94 0.46 112.91 115.42 2a7k h THR 190 Ca 0.32 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.50 2a7k h THR 190 Cb -0.10 0.70 -0.03 0.00 -1.74 0.00 0.00 68.15 66.98 2a7k h THR 190 CO -0.08 0.00 0.36 1.56 0.37 0.00 0.00 175.52 177.73 2a7k h GLN 191 N -0.10 0.80 -0.28 6.66 1.08 -1.08 -1.85 115.11 120.34 2a7k h GLN 191 Ca 0.09 -0.06 -0.11 0.00 -1.45 0.00 0.00 58.65 57.11 2a7k h GLN 191 Cb 0.24 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.48 2a7k h GLN 191 CO -0.21 0.56 -0.30 0.00 -0.95 0.00 0.00 178.83 177.93 2a7k h ALA 192 N 1.58 0.96 -0.45 3.87 0.00 -0.38 -1.85 119.26 122.98 2a7k h ALA 192 Ca 0.22 -0.38 -0.10 0.00 0.00 0.00 0.00 54.91 54.64 2a7k h ALA 192 Cb -0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2a7k h ALA 192 CO -0.04 0.61 -0.11 0.45 0.00 0.00 0.00 179.25 180.15 2a7k h HIS 193 N 0.49 0.91 -0.12 0.00 3.86 -0.20 -0.11 115.15 119.98 2a7k h HIS 193 Ca 0.06 -0.17 -0.01 0.00 -1.16 0.00 0.00 60.37 59.09 2a7k h HIS 193 Cb 0.77 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 29.00 2a7k h HIS 193 CO 0.03 0.89 0.05 0.28 0.86 0.00 0.00 177.93 180.04 2a7k h VAL 194 N 0.74 1.14 -0.02 2.45 2.07 -1.13 -2.43 116.25 119.07 2a7k h VAL 194 Ca 0.12 -0.42 -0.14 0.00 0.82 0.00 0.00 66.70 67.09 2a7k h VAL 194 Cb 0.61 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 2a7k h VAL 194 CO 0.04 0.13 -0.61 0.24 0.02 0.00 0.00 177.57 177.38 2a7k h MET 195 N 0.05 0.09 0.00 1.57 2.86 -1.31 -2.72 114.93 115.47 2a7k h MET 195 Ca 0.04 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 2a7k h MET 195 Cb 0.15 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.82 2a7k h MET 195 CO -0.00 0.68 -0.10 0.00 1.06 0.00 0.00 176.91 178.54 2a7k h ALA 196 N 1.31 1.16 0.00 6.32 0.00 -0.91 -2.54 119.26 124.60 2a7k h ALA 196 Ca -0.01 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2a7k h ALA 196 Cb 1.10 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2a7k h ALA 196 CO 0.09 0.12 0.00 0.66 0.00 0.00 0.00 179.25 180.12 2a7k h SER 197 N 0.00 0.00 -2.51 0.00 4.64 -1.10 -3.45 113.55 111.14 2a7k h SER 197 Ca -0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 2a7k h SER 197 Cb 0.38 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.50 2a7k h SER 197 CO 0.01 0.00 1.13 -0.31 -0.87 0.00 0.00 176.83 176.80 2a7k s TYR 198 N -3.32 1.94 0.07 4.77 2.02 -0.96 -4.88 117.35 116.99 2a7k s TYR 198 Ca 0.06 -0.10 -0.37 0.00 -0.37 0.00 0.00 57.07 56.29 2a7k s TYR 198 Cb 0.07 -4.17 -0.18 0.00 -0.40 0.00 0.00 41.96 37.28 2a7k s TYR 198 CO 0.62 -4.93 1.19 -2.30 -1.57 0.00 0.00 175.55 168.55 2a7k n PRO 199 N 6.19 0.69 -0.15 -1.71 -0.02 -1.26 -4.82 135.00 133.92 2a7k n PRO 199 Ca 0.18 0.25 -0.10 0.00 -2.02 0.00 0.00 63.50 61.81 2a7k n PRO 199 Cb 0.39 -1.79 -0.01 0.00 -0.02 0.00 0.00 33.50 32.07 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 3.70 0.58 -0.01 3.55 0.00 -1.90 -2.40 119.26 122.78 2a7k h ALA 200 Ca -0.48 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.21 2a7k h ALA 200 Cb 1.38 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2a7k h ALA 200 CO 0.71 0.32 -0.06 1.03 0.00 0.00 0.00 179.25 181.26 2a7k h SER 201 N 0.58 -0.16 -0.55 0.00 0.87 -1.99 0.37 113.55 112.66 2a7k h SER 201 Ca 0.13 0.03 -0.07 0.00 -1.23 0.00 0.00 61.79 60.65 2a7k h SER 201 Cb 0.42 0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.43 2a7k h SER 201 CO 0.01 -0.08 0.10 0.00 -0.53 0.00 0.00 176.83 176.33 2a7k h ALA 202 N 0.90 1.06 0.07 6.23 0.00 -1.94 -1.95 119.26 123.62 2a7k h ALA 202 Ca 0.03 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2a7k h ALA 202 Cb 0.13 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2a7k h ALA 202 CO -0.06 0.61 -0.03 0.35 0.00 0.00 0.00 179.25 180.11 2a7k h PHE 203 N 0.90 -0.09 -0.09 0.00 3.57 -0.87 -1.87 116.94 118.49 2a7k h PHE 203 Ca 0.18 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.71 2a7k h PHE 203 Cb 0.39 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 2a7k h PHE 203 CO 0.03 0.08 -0.06 0.82 -2.23 0.00 0.00 178.31 176.95 2a7k h ILE 204 N -0.24 0.82 -0.92 1.41 2.04 -0.19 0.58 117.51 121.02 2a7k h ILE 204 Ca -0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 2a7k h ILE 204 Cb 0.20 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 37.06 2a7k h ILE 204 CO 0.02 0.00 0.52 0.78 0.00 0.00 0.00 178.15 179.46 2a7k h ASN 205 N -0.06 1.14 -0.08 1.72 4.21 -1.37 -0.77 115.58 120.38 2a7k h ASN 205 Ca 0.06 -0.09 -0.02 0.00 1.21 0.00 0.00 56.30 57.46 2a7k h ASN 205 Cb 0.14 -0.29 -0.00 0.00 -1.12 0.00 0.00 38.32 37.05 2a7k h ASN 205 CO -0.13 0.90 -0.03 0.74 -1.29 0.00 0.00 177.43 177.62 2a7k h THR 206 N 1.28 1.31 -0.82 2.81 2.02 -1.00 -2.72 112.91 115.78 2a7k h THR 206 Ca 0.33 -0.98 -0.03 0.00 0.77 0.00 0.00 66.41 66.49 2a7k h THR 206 Cb 0.00 1.81 -0.04 0.00 -1.74 0.00 0.00 68.15 68.19 2a7k h THR 206 CO -0.05 0.27 0.39 0.50 0.37 0.00 0.00 175.52 177.00 2a7k h LYS 207 N -0.20 1.19 -0.50 6.66 3.64 -0.69 0.97 116.57 127.64 2a7k h LYS 207 Ca 0.02 -0.18 0.05 0.00 -1.27 0.00 0.00 60.65 59.27 2a7k h LYS 207 Cb 0.45 -0.21 -0.05 0.00 -0.41 0.00 0.00 32.23 32.01 2a7k h LYS 207 CO 0.01 0.92 0.23 -0.09 -2.27 0.00 0.00 179.45 178.25 2a7k h ARG 208 N 1.18 0.44 -0.47 1.90 2.43 -1.18 0.21 114.38 118.89 2a7k h ARG 208 Ca 0.28 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.33 2a7k h ARG 208 Cb 0.13 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 2a7k h ARG 208 CO -0.03 0.29 -0.08 0.00 -1.51 0.00 0.00 179.97 178.64 2a7k h ALA 209 N 1.29 0.97 0.02 2.80 0.00 -1.06 -1.87 119.26 121.41 2a7k h ALA 209 Ca 0.23 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2a7k h ALA 209 Cb 0.16 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2a7k h ALA 209 CO -0.18 0.61 -0.01 0.28 0.00 0.00 0.00 179.25 179.96 2a7k h VAL 210 N 0.77 1.17 0.00 0.00 2.07 -0.46 -3.30 116.25 116.50 2a7k h VAL 210 Ca 0.13 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 67.08 2a7k h VAL 210 Cb 0.57 1.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.90 2a7k h VAL 210 CO 0.04 0.15 0.00 0.78 0.02 0.00 0.00 177.57 178.55 2a7k h ASN 211 N -0.27 0.00 -0.24 0.57 4.21 -0.58 -3.37 115.58 115.90 2a7k h ASN 211 Ca -0.00 0.00 0.06 0.00 1.21 0.00 0.00 56.30 57.57 2a7k h ASN 211 Cb 0.26 0.00 -0.07 0.00 -1.12 0.00 0.00 38.32 37.39 2a7k h ASN 211 CO 0.00 0.00 -0.24 0.50 -1.29 0.00 0.00 177.43 176.40 2a7k h LYS 212 N 0.00 -0.24 0.00 0.81 3.64 -1.41 0.16 116.57 119.53 2a7k h LYS 212 Ca 0.00 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 2a7k h LYS 212 Cb 0.86 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.74 2a7k h LYS 212 CO 0.00 -0.16 -0.03 -1.00 -2.27 0.00 0.00 179.45 175.99 2a7k h PRO 213 N -0.25 0.00 -0.11 1.90 0.13 -1.78 -0.65 132.00 131.24 2a7k h PRO 213 Ca 0.14 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.13 2a7k h PRO 213 Cb 0.46 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.60 2a7k h PRO 213 CO -0.39 0.03 -0.46 0.35 -0.23 0.00 0.00 178.00 177.31 2a7k h PHE 214 N 0.00 0.68 -0.56 1.56 3.04 -1.30 -0.34 116.94 120.02 2a7k h PHE 214 Ca -0.00 -0.29 -0.01 0.00 3.98 0.00 0.00 57.97 61.64 2a7k h PHE 214 Cb 0.32 -0.11 -0.03 0.00 2.56 0.00 0.00 35.95 38.70 2a7k h PHE 214 CO 0.00 1.06 0.29 0.82 -2.02 0.00 0.00 178.31 178.46 2a7k h ILE 215 N 0.11 1.19 -0.54 1.41 2.04 -0.52 -0.90 117.51 120.31 2a7k h ILE 215 Ca -0.03 -0.52 -0.06 0.00 1.00 0.00 0.00 64.86 65.26 2a7k h ILE 215 Cb 1.10 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.66 2a7k h ILE 215 CO 0.10 0.21 0.12 -0.74 0.00 0.00 0.00 178.15 177.84 2a7k h HIS 216 N 0.76 0.92 -0.68 1.37 2.76 -1.06 -2.00 115.15 117.22 2a7k h HIS 216 Ca 0.20 -0.12 0.01 0.00 -2.20 0.00 0.00 60.37 58.27 2a7k h HIS 216 Cb 0.08 -0.26 -0.04 0.00 1.55 0.00 0.00 27.41 28.74 2a7k h HIS 216 CO -0.01 0.81 0.44 1.25 -1.30 0.00 0.00 177.93 179.12 2a7k h LEU 217 N 0.76 0.75 -1.14 0.26 5.85 -0.73 -1.56 115.31 119.49 2a7k h LEU 217 Ca 0.17 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.83 2a7k h LEU 217 Cb 0.36 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 2a7k h LEU 217 CO 0.00 0.53 0.13 -0.07 -0.34 0.00 0.00 178.44 178.70 2a7k h LEU 218 N 0.89 0.67 -0.43 2.25 3.38 -0.84 -0.51 115.31 120.72 2a7k h LEU 218 Ca 0.26 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 2a7k h LEU 218 Cb -0.06 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 2a7k h LEU 218 CO -0.07 0.66 -0.09 -0.33 0.09 0.00 0.00 178.44 178.69 2a7k h GLU 219 N 0.71 0.82 -0.94 1.13 4.39 -1.03 0.11 114.58 119.77 2a7k h GLU 219 Ca 0.16 -0.31 0.01 0.00 0.34 0.00 0.00 59.36 59.56 2a7k h GLU 219 Cb 0.25 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.80 2a7k h GLU 219 CO -0.00 0.94 0.62 1.96 -1.16 0.00 0.00 179.01 181.37 2a7k h GLN 220 N 0.65 1.23 -0.26 2.33 4.20 -1.09 -2.43 115.11 119.73 2a7k h GLN 220 Ca 0.11 -0.07 -0.14 0.00 0.06 0.00 0.00 58.65 58.60 2a7k h GLN 220 Cb 0.63 -0.28 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 2a7k h GLN 220 CO 0.04 0.81 -0.43 1.15 -0.67 0.00 0.00 178.83 179.74 2a7k h THR 221 N 1.26 1.30 -0.09 -0.54 2.02 -0.71 0.67 112.91 116.81 2a7k h THR 221 Ca 0.35 -1.61 0.04 0.00 0.77 0.00 0.00 66.41 65.96 2a7k h THR 221 Cb -0.12 1.55 -0.04 0.00 -1.74 0.00 0.00 68.15 67.80 2a7k h THR 221 CO -0.08 0.51 -0.15 -0.09 0.37 0.00 0.00 175.52 176.09 2a7k h ARG 222 N 0.53 -0.19 -0.31 6.66 2.43 -0.62 -0.23 114.38 122.65 2a7k h ARG 222 Ca 0.04 0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.11 2a7k h ARG 222 Cb 0.96 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.55 2a7k h ARG 222 CO 0.09 -0.13 -0.23 -0.44 -1.51 0.00 0.00 179.97 177.75 2a7k h ASP 223 N -0.20 0.74 -0.39 -3.80 3.32 -1.22 -3.03 116.42 111.84 2a7k h ASP 223 Ca 0.08 -0.44 -0.09 0.00 0.02 0.00 0.00 57.03 56.60 2a7k h ASP 223 Cb 0.31 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 2a7k h ASP 223 CO -0.21 1.03 -0.10 0.00 -1.72 0.00 0.00 179.24 178.23 2a7k h ALA 224 N 0.74 0.54 -0.12 3.45 0.00 -0.74 -3.05 119.26 120.08 2a7k h ALA 224 Ca 0.06 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 2a7k h ALA 224 Cb 0.79 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2a7k h ALA 224 CO 0.06 0.41 0.06 0.77 0.00 0.00 0.00 179.25 180.56 2a7k h SER 225 N 0.57 0.14 0.00 0.00 0.02 -1.10 -3.51 113.55 109.68 2a7k h SER 225 Ca 0.10 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 2a7k h SER 225 Cb 0.63 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.13 2a7k h SER 225 CO 0.04 0.12 0.00 0.29 -1.14 0.00 0.00 176.83 176.14