#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 0.15 0.13 2.03 -7.23 -1.26 -0.13 120.40 114.09 2a7k s VAL 2 Ca 0.00 -1.24 0.09 0.00 -1.81 0.00 0.00 61.98 59.03 2a7k s VAL 2 Cb 0.00 -0.75 -0.04 0.00 0.56 0.00 0.00 36.38 36.15 2a7k s VAL 2 CO 0.00 -0.68 -0.18 0.72 -0.31 0.00 0.00 175.10 174.65 2a7k s PHE 3 N -2.40 2.53 -0.13 2.82 -0.71 0.12 -4.88 117.98 115.32 2a7k s PHE 3 Ca -0.07 -0.27 0.02 0.00 -1.04 0.00 0.00 56.93 55.57 2a7k s PHE 3 Cb -0.03 -1.33 -0.00 0.00 -1.21 0.00 0.00 43.02 40.45 2a7k s PHE 3 CO -0.04 0.40 -0.19 -1.21 -1.34 0.00 0.00 175.22 172.84 2a7k s GLU 4 N -2.24 3.17 0.15 1.99 2.02 -1.26 -0.95 118.70 121.59 2a7k s GLU 4 Ca 0.19 -0.79 0.02 0.00 0.02 0.00 0.00 54.97 54.40 2a7k s GLU 4 Cb -0.10 -2.49 -0.04 0.00 0.10 0.00 0.00 34.13 31.59 2a7k s GLU 4 CO 0.11 0.10 -0.02 -1.21 0.02 0.00 0.00 175.26 174.26 2a7k s GLU 5 N 0.57 1.04 -0.05 1.61 2.02 0.21 -4.98 118.70 119.11 2a7k s GLU 5 Ca -0.11 -1.48 0.03 0.00 0.02 0.00 0.00 54.97 53.43 2a7k s GLU 5 Cb -0.16 -0.25 0.00 0.00 0.10 0.00 0.00 34.13 33.82 2a7k s GLU 5 CO 0.04 -0.10 -0.15 -0.80 0.02 0.00 0.00 175.26 174.26 2a7k s ASN 6 N -3.14 2.01 -0.75 -0.19 0.01 -1.26 0.58 114.94 112.20 2a7k s ASN 6 Ca 0.21 -0.34 -0.04 0.00 -0.71 0.00 0.00 52.86 51.98 2a7k s ASN 6 Cb 0.06 -0.73 0.19 0.00 0.41 0.00 0.00 41.25 41.18 2a7k s ASN 6 CO 0.02 0.10 0.60 -0.44 -1.51 0.00 0.00 177.10 175.87 2a7k s SER 7 N 0.32 5.70 0.99 -1.22 0.01 0.26 -4.98 113.70 114.77 2a7k s SER 7 Ca -0.09 -3.14 0.00 0.00 1.31 0.00 0.00 55.95 54.03 2a7k s SER 7 Cb -0.13 -1.92 0.00 0.00 0.21 0.00 0.00 66.02 64.17 2a7k s SER 7 CO 0.03 -0.33 0.00 0.47 0.41 0.00 0.00 173.24 173.82 2a7k n ASP 8 N 3.15 0.00 -0.07 2.44 8.00 -1.26 -1.41 116.55 127.39 2a7k n ASP 8 Ca 0.13 0.00 0.15 0.00 0.71 0.00 0.00 54.79 55.79 2a7k n ASP 8 Cb 0.39 0.00 0.81 0.00 -0.02 0.00 0.00 41.12 42.30 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 6.44 0.92 -3.54 -1.24 0.00 -1.26 -4.71 120.64 117.24 2a7k n GLU 9 Ca 0.00 -0.15 -0.40 0.00 0.00 0.00 0.00 57.16 56.61 2a7k n GLU 9 Cb 0.00 -1.50 -0.11 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 -2.19 5.28 -0.15 3.84 1.01 -0.50 0.38 120.40 128.07 2a7k s VAL 10 Ca 0.40 -0.15 -0.24 0.00 0.00 0.00 0.00 61.98 61.99 2a7k s VAL 10 Cb 0.21 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.89 2a7k s VAL 10 CO 0.40 0.04 0.75 -0.60 0.00 0.00 0.00 175.10 175.68 2a7k s ARG 11 N 1.73 4.31 -0.24 2.72 6.06 -0.24 -0.57 118.95 132.72 2a7k s ARG 11 Ca 0.06 0.88 -0.06 0.00 -2.50 0.00 0.00 55.73 54.11 2a7k s ARG 11 Cb -0.17 -3.54 -0.02 0.00 0.06 0.00 0.00 34.95 31.27 2a7k s ARG 11 CO 0.11 -0.20 0.04 0.08 -2.50 0.00 0.00 175.30 172.82 2a7k s VAL 12 N 1.73 4.07 -0.26 7.11 1.01 0.20 -0.25 120.40 134.01 2a7k s VAL 12 Ca 0.36 -0.25 -0.06 0.00 0.00 0.00 0.00 61.98 62.03 2a7k s VAL 12 Cb -0.17 -2.89 -0.00 0.00 0.00 0.00 0.00 36.38 33.32 2a7k s VAL 12 CO 0.13 0.37 0.03 -0.63 0.00 0.00 0.00 175.10 175.00 2a7k s ILE 13 N 1.52 3.76 -0.20 2.22 1.01 0.92 -0.62 121.20 129.80 2a7k s ILE 13 Ca 0.06 -0.55 -0.05 0.00 0.00 0.00 0.00 60.65 60.11 2a7k s ILE 13 Cb -0.15 -2.83 -0.02 0.00 0.01 0.00 0.00 42.46 39.47 2a7k s ILE 13 CO 0.02 0.25 -0.01 -0.89 0.00 0.00 0.00 174.94 174.30 2a7k s THR 14 N 1.50 3.79 0.14 2.92 2.01 -0.12 -1.30 115.64 124.59 2a7k s THR 14 Ca 0.04 -0.37 -0.30 0.00 0.31 0.00 0.00 61.69 61.37 2a7k s THR 14 Cb -0.16 -2.71 -0.08 0.00 0.01 0.00 0.00 72.50 69.56 2a7k s THR 14 CO 0.00 0.43 1.28 -0.76 -0.69 0.00 0.00 174.62 174.88 2a7k s LEU 15 N 1.09 4.40 -0.30 4.42 1.43 0.04 -0.70 118.68 129.06 2a7k s LEU 15 Ca 0.02 2.26 0.18 0.00 -1.03 0.00 0.00 54.13 55.56 2a7k s LEU 15 Cb -0.14 -3.60 0.48 0.00 0.03 0.00 0.00 46.19 42.96 2a7k s LEU 15 CO 0.01 -0.51 1.05 -0.67 0.23 0.00 0.00 176.35 176.46 2a7k n ASP 16 N 3.23 2.06 -4.73 2.29 2.03 0.81 -4.45 116.55 117.79 2a7k n ASP 16 Ca 0.08 -2.58 -0.38 0.00 0.52 0.00 0.00 54.79 52.43 2a7k n ASP 16 Cb 0.44 -0.49 0.06 0.00 -0.72 0.00 0.00 41.12 40.41 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 -0.39 2.08 -0.35 -0.67 -0.00 -1.23 -4.62 115.22 110.04 2a7k n HIS 17 Ca 0.14 0.43 0.13 0.00 -0.00 0.00 0.00 57.72 58.41 2a7k n HIS 17 Cb 0.81 -2.31 0.33 0.00 -0.00 0.00 0.00 29.99 28.81 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 0.99 0.73 -6.69 1.57 0.11 -1.98 -3.41 132.00 123.32 2a7k h PRO 18 Ca -0.51 -0.04 -0.51 0.00 0.11 0.00 0.00 66.00 65.05 2a7k h PRO 18 Cb 1.32 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 2a7k h PRO 18 CO 0.55 0.49 0.43 1.21 -0.21 0.00 0.00 178.00 180.46 2a7k s ASN 19 N -5.40 7.39 0.45 -2.05 3.84 -1.26 -4.95 114.94 112.96 2a7k s ASN 19 Ca -0.11 2.04 0.31 0.00 0.21 0.00 0.00 52.86 55.31 2a7k s ASN 19 Cb 0.25 -2.61 1.43 0.00 -0.55 0.00 0.00 41.25 39.78 2a7k s ASN 19 CO 0.80 -0.09 1.93 0.07 -2.79 0.00 0.00 177.10 177.02 2a7k h LYS 20 N 4.71 0.00 -0.19 0.43 5.09 -1.96 -2.11 116.57 122.54 2a7k h LYS 20 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.29 2a7k h LYS 20 Cb 1.21 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.54 2a7k h LYS 20 CO 0.70 0.00 0.00 0.72 -2.09 0.00 0.00 179.45 178.78 2a7k n HIS 21 N -2.71 0.23 -3.73 0.07 8.25 -1.26 -1.36 115.22 114.71 2a7k n HIS 21 Ca 0.00 -0.12 -0.26 0.00 -0.26 0.00 0.00 57.72 57.09 2a7k n HIS 21 Cb 0.20 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.33 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 0.82 -2.72 -4.77 0.41 3.02 -0.79 -0.36 115.26 110.87 2a7k n ASN 22 Ca 0.17 -0.93 -0.40 0.00 -0.03 0.00 0.00 54.58 53.39 2a7k n ASN 22 Cb 0.46 -3.61 -0.00 0.00 -0.61 0.00 0.00 39.78 36.01 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 -6.04 3.98 -1.16 3.52 0.04 -1.26 -3.93 135.00 130.15 2a7k s PRO 23 Ca 0.20 2.19 -0.21 0.00 0.04 0.00 0.00 61.00 63.22 2a7k s PRO 23 Cb -0.06 -2.78 0.04 0.00 0.04 0.00 0.00 34.50 31.74 2a7k s PRO 23 CO 0.85 -0.49 1.68 -0.06 0.04 0.00 0.00 177.00 179.01 2a7k s PHE 24 N -1.25 2.53 0.81 0.56 0.08 -0.01 -4.83 117.98 115.88 2a7k s PHE 24 Ca 0.56 -0.97 -0.12 0.00 0.12 0.00 0.00 56.93 56.53 2a7k s PHE 24 Cb -0.39 -4.60 0.09 0.00 -0.57 0.00 0.00 43.02 37.55 2a7k s PHE 24 CO 0.50 -1.78 1.17 -1.54 -0.10 0.00 0.00 175.22 173.47 2a7k s SER 25 N 5.01 4.36 0.26 1.36 1.04 -1.26 -4.56 113.70 119.91 2a7k s SER 25 Ca 0.54 0.66 -0.01 0.00 0.48 0.00 0.00 55.95 57.61 2a7k s SER 25 Cb 0.01 -1.11 0.34 0.00 0.10 0.00 0.00 66.02 65.36 2a7k s SER 25 CO 0.02 -1.98 1.75 -0.09 0.98 0.00 0.00 173.24 173.92 2a7k h ARG 26 N -1.07 0.75 -0.28 4.02 2.43 -2.00 -1.20 114.38 117.03 2a7k h ARG 26 Ca -0.45 -0.21 -0.08 0.00 -0.81 0.00 0.00 59.98 58.42 2a7k h ARG 26 Cb 1.31 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.78 2a7k h ARG 26 CO 0.61 0.79 -0.15 1.15 -1.51 0.00 0.00 179.97 180.86 2a7k h THR 27 N 0.69 1.30 -0.38 0.20 2.02 -1.97 -2.28 112.91 112.49 2a7k h THR 27 Ca 0.13 -1.25 -0.04 0.00 0.77 0.00 0.00 66.41 66.02 2a7k h THR 27 Cb 0.49 1.50 -0.02 0.00 -1.74 0.00 0.00 68.15 68.39 2a7k h THR 27 CO 0.03 0.40 0.08 0.25 0.37 0.00 0.00 175.52 176.65 2a7k h LEU 28 N 0.35 0.58 -0.54 2.58 5.85 -1.73 -1.63 115.31 120.76 2a7k h LEU 28 Ca 0.06 -0.24 0.07 0.00 0.84 0.00 0.00 57.88 58.61 2a7k h LEU 28 Cb 0.67 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.49 2a7k h LEU 28 CO 0.04 0.67 0.21 -0.33 -0.34 0.00 0.00 178.44 178.69 2a7k h GLU 29 N 0.46 0.39 -0.38 1.25 5.08 -1.27 -1.08 114.58 119.03 2a7k h GLU 29 Ca 0.12 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 2a7k h GLU 29 Cb 0.32 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2a7k h GLU 29 CO 0.00 0.26 0.12 1.15 -1.00 0.00 0.00 179.01 179.55 2a7k h THR 30 N 0.40 1.21 -0.77 1.13 2.02 -1.19 -0.05 112.91 115.66 2a7k h THR 30 Ca 0.26 -0.68 -0.01 0.00 0.77 0.00 0.00 66.41 66.75 2a7k h THR 30 Cb 0.27 0.94 -0.04 0.00 -1.74 0.00 0.00 68.15 67.59 2a7k h THR 30 CO -0.25 0.24 0.44 0.28 0.37 0.00 0.00 175.52 176.60 2a7k h SER 31 N 0.47 0.95 -0.14 4.18 0.02 -1.00 0.79 113.55 118.82 2a7k h SER 31 Ca 0.12 -0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 60.96 2a7k h SER 31 Cb 0.25 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 2a7k h SER 31 CO -0.00 0.76 -0.03 0.58 -1.14 0.00 0.00 176.83 176.99 2a7k h VAL 32 N 1.07 1.29 -0.49 2.27 2.07 -1.03 -1.17 116.25 120.25 2a7k h VAL 32 Ca 0.28 -0.97 0.01 0.00 0.82 0.00 0.00 66.70 66.84 2a7k h VAL 32 Cb 0.00 1.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.39 2a7k h VAL 32 CO -0.05 0.28 0.32 0.11 0.02 0.00 0.00 177.57 178.25 2a7k h LYS 33 N -0.04 0.63 -0.71 1.57 1.57 -0.75 -1.38 116.57 117.46 2a7k h LYS 33 Ca 0.04 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 2a7k h LYS 33 Cb 0.45 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 2a7k h LYS 33 CO 0.01 0.42 0.35 -0.44 -0.57 0.00 0.00 179.45 179.22 2a7k h ASP 34 N 0.65 0.92 -0.60 0.86 3.32 -0.81 -1.77 116.42 118.98 2a7k h ASP 34 Ca 0.18 -0.13 -0.09 0.00 0.02 0.00 0.00 57.03 57.01 2a7k h ASP 34 Cb -0.06 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.23 2a7k h ASP 34 CO -0.04 0.78 0.02 0.00 -1.72 0.00 0.00 179.24 178.28 2a7k h ALA 35 N 1.17 0.88 -0.58 3.45 0.00 -0.89 -1.51 119.26 121.79 2a7k h ALA 35 Ca 0.24 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 2a7k h ALA 35 Cb 0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2a7k h ALA 35 CO -0.03 0.66 -0.01 -0.07 0.00 0.00 0.00 179.25 179.80 2a7k h LEU 36 N 0.97 1.01 -0.62 0.00 4.07 -1.08 -0.63 115.31 119.04 2a7k h LEU 36 Ca 0.18 -0.31 -0.12 0.00 0.08 0.00 0.00 57.88 57.71 2a7k h LEU 36 Cb 0.53 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 41.98 2a7k h LEU 36 CO 0.03 1.07 -0.23 0.00 -1.08 0.00 0.00 178.44 178.23 2a7k h ALA 37 N 0.97 0.81 -0.33 1.53 0.00 -1.16 -1.20 119.26 119.88 2a7k h ALA 37 Ca 0.16 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2a7k h ALA 37 Cb 0.56 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2a7k h ALA 37 CO 0.03 0.65 0.15 0.00 0.00 0.00 0.00 179.25 180.08 2a7k h ARG 38 N 0.73 0.48 -0.99 0.00 3.08 -1.11 -2.31 114.38 114.27 2a7k h ARG 38 Ca 0.10 -0.08 0.04 0.00 0.07 0.00 0.00 59.98 60.11 2a7k h ARG 38 Cb 0.77 -0.08 -0.06 0.00 0.08 0.00 0.00 29.97 30.68 2a7k h ARG 38 CO 0.06 0.46 0.65 0.00 -1.07 0.00 0.00 179.97 180.07 2a7k h ALA 39 N 1.00 1.36 -0.01 0.04 0.00 -0.88 -1.00 119.26 119.78 2a7k h ALA 39 Ca 0.11 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 2a7k h ALA 39 Cb 0.14 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2a7k h ALA 39 CO -0.01 0.54 -0.68 -0.97 0.00 0.00 0.00 179.25 178.12 2a7k h ASN 40 N 1.24 0.04 0.78 0.00 -1.24 -1.11 -3.14 115.58 112.15 2a7k h ASN 40 Ca 0.39 -0.03 0.00 0.00 0.71 0.00 0.00 56.30 57.38 2a7k h ASN 40 Cb 0.01 -0.01 0.00 0.00 0.73 0.00 0.00 38.32 39.05 2a7k h ASN 40 CO -0.12 0.71 -0.86 0.00 -1.29 0.00 0.00 177.43 175.87 2a7k n ALA 41 N -2.42 2.93 -2.61 1.57 0.00 -0.88 -4.82 120.51 114.28 2a7k n ALA 41 Ca -0.01 -0.29 -0.42 0.00 0.00 0.00 0.00 53.44 52.72 2a7k n ALA 41 Cb 0.67 -1.10 -0.04 0.00 0.00 0.00 0.00 19.45 18.99 2a7k n ALA 41 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2a7k s ASP 42 N -4.47 6.70 0.56 0.00 -1.08 -0.40 -4.92 116.67 113.06 2a7k s ASP 42 Ca 0.03 0.64 0.34 0.00 -0.52 0.00 0.00 52.55 53.04 2a7k s ASP 42 Cb 0.13 -2.46 1.53 0.00 -1.46 0.00 0.00 42.92 40.65 2a7k s ASP 42 CO 0.76 -0.82 2.05 0.44 0.52 0.00 0.00 175.17 178.13 2a7k h ASP 43 N 8.38 0.00 0.84 -0.34 3.32 -1.88 -2.15 116.42 124.60 2a7k h ASP 43 Ca -0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.82 2a7k h ASP 43 Cb 1.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.63 2a7k h ASP 43 CO 0.97 0.04 0.00 -1.54 -1.72 0.00 0.00 179.24 176.99 2a7k n SER 44 N -3.20 0.00 -4.67 6.45 3.41 -1.26 -4.66 113.62 109.69 2a7k n SER 44 Ca -0.00 0.32 -0.36 0.00 -0.26 0.00 0.00 58.87 58.56 2a7k n SER 44 Cb 0.27 -0.44 -0.09 0.00 -0.26 0.00 0.00 64.21 63.69 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 -2.87 5.36 -0.38 -3.33 1.01 -0.81 -4.49 120.40 114.89 2a7k s VAL 45 Ca 0.18 0.19 0.05 0.00 0.00 0.00 0.00 61.98 62.40 2a7k s VAL 45 Cb 0.19 -3.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.04 2a7k s VAL 45 CO 0.49 0.35 0.36 0.54 0.00 0.00 0.00 175.10 176.84 2a7k n ARG 46 N 4.22 3.56 -3.44 2.72 1.74 0.16 -4.90 116.66 120.71 2a7k n ARG 46 Ca -0.15 -0.27 -0.12 0.00 -0.77 0.00 0.00 57.85 56.54 2a7k n ARG 46 Cb 0.52 -0.85 -0.02 0.00 -1.02 0.00 0.00 32.46 31.09 2a7k n ARG 46 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2a7k s ALA 47 N -1.13 -1.64 -0.04 7.54 0.00 -1.12 -4.09 121.76 121.29 2a7k s ALA 47 Ca 0.03 0.60 0.01 0.00 0.00 0.00 0.00 51.96 52.60 2a7k s ALA 47 Cb 0.04 0.78 0.02 0.00 0.00 0.00 0.00 23.12 23.96 2a7k s ALA 47 CO 0.16 -0.74 -0.05 0.08 0.00 0.00 0.00 175.76 175.20 2a7k s VAL 48 N -3.56 0.56 -0.11 0.00 1.01 0.24 -1.07 120.40 117.46 2a7k s VAL 48 Ca 0.01 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 61.84 2a7k s VAL 48 Cb -0.01 -0.56 -0.02 0.00 0.00 0.00 0.00 36.38 35.79 2a7k s VAL 48 CO -0.12 0.22 -0.13 -0.69 0.00 0.00 0.00 175.10 174.38 2a7k s VAL 49 N 0.73 3.06 -0.12 2.92 1.01 0.66 -0.37 120.40 128.29 2a7k s VAL 49 Ca -0.10 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.21 2a7k s VAL 49 Cb -0.13 -2.27 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 2a7k s VAL 49 CO 0.00 0.54 -0.14 -0.69 0.00 0.00 0.00 175.10 174.81 2a7k s VAL 50 N 0.11 2.97 -0.01 2.92 1.01 0.10 -0.06 120.40 127.45 2a7k s VAL 50 Ca -0.06 -0.69 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 2a7k s VAL 50 Cb -0.15 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 34.00 2a7k s VAL 50 CO 0.05 0.53 0.03 -0.47 0.00 0.00 0.00 175.10 175.24 2a7k s TYR 51 N 0.29 -0.01 -0.54 5.22 5.04 -0.42 -0.89 117.35 126.03 2a7k s TYR 51 Ca -0.10 0.04 0.25 0.00 -2.44 0.00 0.00 57.07 54.82 2a7k s TYR 51 Cb -0.16 -0.00 0.92 0.00 0.35 0.00 0.00 41.96 43.07 2a7k s TYR 51 CO 0.06 -0.04 1.75 0.78 -1.34 0.00 0.00 175.55 176.76 2a7k h GLY 52 N 5.95 0.00 0.00 8.97 0.00 -1.80 0.13 103.07 116.32 2a7k h GLY 52 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2a7k h GLY 52 CO 0.48 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.63 2a7k n GLY 53 N 0.51 2.37 3.74 4.60 0.00 -1.26 -4.35 105.19 110.80 2a7k n GLY 53 Ca 0.03 -1.91 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 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 -2.98 3.62 -1.31 4.61 0.00 -1.26 -2.82 121.76 121.62 2a7k s ALA 54 Ca 0.00 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.21 2a7k s ALA 54 Cb 0.00 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.57 2a7k s ALA 54 CO 0.00 -0.68 0.00 -0.85 0.00 0.00 0.00 175.76 174.23 2a7k n GLU 55 N 2.84 -1.04 -4.34 0.00 0.00 -1.26 -4.99 120.64 111.84 2a7k n GLU 55 Ca 0.08 0.81 -0.18 0.00 0.00 0.00 0.00 57.16 57.88 2a7k n GLU 55 Cb 0.41 -5.00 -0.10 0.00 0.00 0.00 0.00 31.44 26.74 2a7k n GLU 55 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 2a7k s ARG 56 N -4.01 1.40 0.15 3.44 0.52 -1.13 -5.00 118.95 114.33 2a7k s ARG 56 Ca 0.00 -1.74 -0.08 0.00 -0.52 0.00 0.00 55.73 53.39 2a7k s ARG 56 Cb 0.00 -0.54 -0.06 0.00 0.52 0.00 0.00 34.95 34.87 2a7k s ARG 56 CO 0.00 -0.17 0.44 -1.12 0.02 0.00 0.00 175.30 174.47 2a7k s SER 57 N -3.33 6.58 0.08 0.23 0.01 -0.47 -3.79 113.70 113.01 2a7k s SER 57 Ca 0.32 0.75 -0.36 0.00 1.31 0.00 0.00 55.95 57.98 2a7k s SER 57 Cb 0.07 -2.16 -0.17 0.00 0.21 0.00 0.00 66.02 63.97 2a7k s SER 57 CO 0.11 0.04 1.55 0.15 0.41 0.00 0.00 173.24 175.51 2a7k h PHE 58 N 2.97 -1.39 -1.52 2.43 3.57 -0.65 -3.39 116.94 118.97 2a7k h PHE 58 Ca -0.47 0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.15 2a7k h PHE 58 Cb 1.17 0.53 -0.24 0.00 2.79 0.00 0.00 35.95 40.21 2a7k h PHE 58 CO 0.63 -0.68 0.17 0.45 -2.23 0.00 0.00 178.31 176.65 2a7k s SER 59 N -4.30 -0.72 0.00 0.41 0.15 -0.79 -4.61 113.70 103.84 2a7k s SER 59 Ca -0.18 1.06 0.06 0.00 0.70 0.00 0.00 55.95 57.60 2a7k s SER 59 Cb 0.04 1.60 0.28 0.00 -1.71 0.00 0.00 66.02 66.24 2a7k s SER 59 CO 0.59 -0.16 1.15 0.00 1.20 0.00 0.00 173.24 176.02 2a7k n ALA 60 N 4.57 1.35 0.00 5.45 0.00 0.51 -1.05 120.51 131.34 2a7k n ALA 60 Ca -0.14 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2a7k n ALA 60 Cb 0.54 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.89 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 -0.83 -1.76 3.85 0.00 0.00 -1.17 -4.45 105.19 100.84 2a7k n GLY 61 Ca 0.02 -1.72 -0.32 0.00 0.00 0.00 0.00 46.02 44.00 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 -0.06 1.93 0.00 -0.02 0.00 -1.26 -0.83 107.32 107.08 2a7k s GLY 62 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 44.72 44.84 2a7k s GLY 62 CO 0.00 0.39 0.00 1.34 0.00 0.00 0.00 173.10 174.83 2a7k n ASP 63 N -2.03 0.00 0.00 1.64 -0.08 -1.26 -4.92 116.55 109.90 2a7k n ASP 63 Ca 0.07 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.35 2a7k n ASP 63 Cb 0.54 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.00 2a7k n ASP 63 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2a7k n GLU 66 N 0.00 0.00 0.26 -0.67 4.71 -1.26 -4.75 120.64 118.92 2a7k n GLU 66 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 57.16 56.99 2a7k n GLU 66 Cb 0.00 0.00 -0.08 0.00 -1.01 0.00 0.00 31.44 30.35 2a7k n GLU 66 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 2a7k h VAL 67 N 0.00 0.25 0.00 2.62 2.07 -1.97 -2.47 116.25 116.74 2a7k h VAL 67 Ca 0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 2a7k h VAL 67 Cb 0.00 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 30.01 2a7k h VAL 67 CO 0.00 0.00 -0.08 0.11 0.02 0.00 0.00 177.57 177.62 2a7k h LYS 68 N -0.80 0.00 -0.00 1.57 1.57 -1.96 -2.24 116.57 114.71 2a7k h LYS 68 Ca -0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2a7k h LYS 68 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.01 2a7k h LYS 68 CO -0.03 0.08 -0.04 1.04 -0.57 0.00 0.00 179.45 179.93 2a7k n GLN 69 N -3.84 0.88 -2.60 3.15 6.02 -0.96 -4.80 117.38 115.22 2a7k n GLN 69 Ca -0.02 -0.21 -0.43 0.00 -0.01 0.00 0.00 57.00 56.32 2a7k n GLN 69 Cb 0.18 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 29.92 2a7k n GLN 69 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2a7k s LEU 70 N -2.27 4.06 -0.37 1.08 1.43 -0.84 -4.95 118.68 116.82 2a7k s LEU 70 Ca 0.36 1.35 0.12 0.00 -1.03 0.00 0.00 54.13 54.94 2a7k s LEU 70 Cb 0.21 -3.54 0.36 0.00 0.03 0.00 0.00 46.19 43.25 2a7k s LEU 70 CO 0.42 -0.76 0.75 -1.54 0.23 0.00 0.00 176.35 175.45 2a7k n SER 71 N 6.57 0.81 -3.61 2.29 3.41 -1.26 -4.96 113.62 116.87 2a7k n SER 71 Ca 0.12 -3.00 -0.15 0.00 -0.26 0.00 0.00 58.87 55.58 2a7k n SER 71 Cb 0.46 -0.56 -0.07 0.00 -0.26 0.00 0.00 64.21 63.78 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 -2.42 0.86 0.10 4.33 3.00 -1.26 -5.08 118.95 118.48 2a7k s ARG 72 Ca 0.39 0.56 -0.32 0.00 0.00 0.00 0.00 55.73 56.36 2a7k s ARG 72 Cb 0.36 0.41 -0.12 0.00 0.00 0.00 0.00 34.95 35.60 2a7k s ARG 72 CO -0.07 -0.19 1.59 0.66 0.00 0.00 0.00 175.30 177.29 2a7k h SER 73 N 4.20 -1.21 0.44 0.23 4.64 -1.98 -2.00 113.55 117.88 2a7k h SER 73 Ca -0.28 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 2a7k h SER 73 Cb 1.16 0.44 0.00 0.00 -0.31 0.00 0.00 62.40 63.68 2a7k h SER 73 CO 0.23 -0.52 0.00 -0.62 -0.87 0.00 0.00 176.83 175.05 2a7k n GLU 74 N -5.48 0.03 -0.08 4.77 4.71 -1.26 -3.27 120.64 120.06 2a7k n GLU 74 Ca -0.09 0.33 -0.08 0.00 -0.01 0.00 0.00 57.16 57.31 2a7k n GLU 74 Cb 0.39 -1.57 -0.16 0.00 -1.01 0.00 0.00 31.44 29.09 2a7k n GLU 74 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 2a7k n ASP 75 N -1.64 0.10 0.07 1.62 3.85 -0.80 -2.44 116.55 117.31 2a7k n ASP 75 Ca 0.03 0.05 -0.20 0.00 -0.71 0.00 0.00 54.79 53.95 2a7k n ASP 75 Cb 0.15 0.95 -0.11 0.00 -1.35 0.00 0.00 41.12 40.76 2a7k n ASP 75 CO 0.00 0.00 0.00 0.40 -1.01 0.00 0.00 177.20 176.59 2a7k h ILE 76 N 0.00 1.29 -0.88 2.12 1.08 -1.45 -2.96 117.51 116.72 2a7k h ILE 76 Ca -0.48 -2.37 0.00 0.00 -0.39 0.00 0.00 64.86 61.63 2a7k h ILE 76 Cb 2.13 2.52 -0.04 0.00 -3.07 0.00 0.00 36.82 38.35 2a7k h ILE 76 CO 0.03 0.72 0.56 -0.33 -0.69 0.00 0.00 178.15 178.45 2a7k h GLU 77 N 0.33 1.17 -0.64 2.37 5.08 -1.70 -0.02 114.58 121.18 2a7k h GLU 77 Ca -0.15 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.09 2a7k h GLU 77 Cb 1.78 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 30.75 2a7k h GLU 77 CO 0.22 0.80 0.27 1.49 -1.00 0.00 0.00 179.01 180.78 2a7k h GLU 78 N 1.20 0.94 -0.31 2.33 4.57 -1.53 -0.48 114.58 121.30 2a7k h GLU 78 Ca 0.32 -0.16 -0.14 0.00 -1.18 0.00 0.00 59.36 58.20 2a7k h GLU 78 Cb -0.10 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 28.33 2a7k h GLU 78 CO -0.07 0.78 -0.34 2.35 -1.18 0.00 0.00 179.01 180.55 2a7k h TRP 79 N 0.89 0.95 -0.27 0.92 7.01 -1.24 -0.53 115.95 123.68 2a7k h TRP 79 Ca 0.21 -0.29 -0.00 0.00 2.11 0.00 0.00 58.89 60.92 2a7k h TRP 79 Cb 0.18 -0.20 -0.01 0.00 -2.10 0.00 0.00 29.16 27.03 2a7k h TRP 79 CO 0.01 1.07 0.16 0.82 -2.79 0.00 0.00 178.44 177.71 2a7k h ILE 80 N 0.55 1.11 -0.84 2.65 2.04 -0.95 -1.93 117.51 120.14 2a7k h ILE 80 Ca 0.05 -0.28 0.05 0.00 1.00 0.00 0.00 64.86 65.68 2a7k h ILE 80 Cb 0.93 0.80 -0.06 0.00 -0.74 0.00 0.00 36.82 37.75 2a7k h ILE 80 CO 0.08 0.11 0.53 0.44 0.00 0.00 0.00 178.15 179.31 2a7k h ASP 81 N 0.34 0.86 -0.33 1.72 3.32 -0.99 -1.26 116.42 120.08 2a7k h ASP 81 Ca 0.10 0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.20 2a7k h ASP 81 Cb 0.04 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.37 2a7k h ASP 81 CO -0.02 0.57 0.09 0.03 -1.72 0.00 0.00 179.24 178.19 2a7k h ARG 82 N 1.00 0.21 -0.09 3.56 3.08 -0.84 0.13 114.38 121.43 2a7k h ARG 82 Ca 0.35 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.38 2a7k h ARG 82 Cb 0.09 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 2a7k h ARG 82 CO -0.14 0.14 0.02 0.28 -1.07 0.00 0.00 179.97 179.19 2a7k h VAL 83 N 0.21 1.20 -0.45 2.04 2.07 -0.87 -0.94 116.25 119.52 2a7k h VAL 83 Ca 0.15 -0.63 -0.13 0.00 0.82 0.00 0.00 66.70 66.91 2a7k h VAL 83 Cb 0.15 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 2a7k h VAL 83 CO -0.18 0.18 -0.22 0.40 0.02 0.00 0.00 177.57 177.77 2a7k h ILE 84 N -0.08 1.27 -0.88 4.57 1.08 -1.17 -2.77 117.51 119.54 2a7k h ILE 84 Ca 0.03 -1.37 0.03 0.00 -0.39 0.00 0.00 64.86 63.16 2a7k h ILE 84 Cb 0.27 1.15 -0.05 0.00 -3.07 0.00 0.00 36.82 35.12 2a7k h ILE 84 CO 0.00 0.47 0.57 0.44 -0.69 0.00 0.00 178.15 178.94 2a7k h ASP 85 N 0.80 0.95 -0.26 1.72 3.32 -0.62 0.64 116.42 122.98 2a7k h ASP 85 Ca 0.11 -0.01 0.05 0.00 0.02 0.00 0.00 57.03 57.20 2a7k h ASP 85 Cb 0.78 -0.22 -0.05 0.00 0.22 0.00 0.00 39.33 40.06 2a7k h ASP 85 CO 0.06 0.66 -0.08 0.25 -1.72 0.00 0.00 179.24 178.41 2a7k h LEU 86 N 1.11 -0.27 -0.31 1.55 6.46 -0.93 -1.91 115.31 121.01 2a7k h LEU 86 Ca 0.35 0.08 -0.14 0.00 -0.12 0.00 0.00 57.88 58.05 2a7k h LEU 86 Cb -0.01 0.17 -0.00 0.00 -0.73 0.00 0.00 40.66 40.09 2a7k h LEU 86 CO -0.11 -0.10 -0.34 1.88 -0.62 0.00 0.00 178.44 179.15 2a7k h TYR 87 N -0.02 0.94 -0.98 1.25 0.05 -1.11 -2.87 116.97 114.23 2a7k h TYR 87 Ca 0.13 -0.29 0.03 0.00 0.05 0.00 0.00 58.73 58.65 2a7k h TYR 87 Cb 0.21 -0.19 -0.06 0.00 1.01 0.00 0.00 36.73 37.70 2a7k h TYR 87 CO -0.27 1.07 0.64 1.96 -1.05 0.00 0.00 178.16 180.51 2a7k h GLN 88 N 0.54 1.22 -0.94 4.88 1.08 -0.85 -1.83 115.11 119.20 2a7k h GLN 88 Ca 0.04 -0.07 0.14 0.00 -1.45 0.00 0.00 58.65 57.31 2a7k h GLN 88 Cb 0.92 -0.28 -0.09 0.00 -0.05 0.00 0.00 27.48 27.99 2a7k h GLN 88 CO 0.08 0.81 0.56 0.00 -0.95 0.00 0.00 178.83 179.33 2a7k h ALA 89 N 1.42 1.45 -0.11 3.87 0.00 -1.12 0.93 119.26 125.71 2a7k h ALA 89 Ca 0.38 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.30 2a7k h ALA 89 Cb -0.03 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 2a7k h ALA 89 CO -0.11 0.06 -0.14 0.28 0.00 0.00 0.00 179.25 179.34 2a7k h VAL 90 N 0.81 1.37 0.00 0.00 2.07 -1.34 -3.25 116.25 115.91 2a7k h VAL 90 Ca 0.50 -1.34 -0.03 0.00 0.82 0.00 0.00 66.70 66.64 2a7k h VAL 90 Cb 0.62 2.00 -0.00 0.00 -1.52 0.00 0.00 31.29 32.39 2a7k h VAL 90 CO -0.32 0.39 -0.16 -0.07 0.02 0.00 0.00 177.57 177.43 2a7k h LEU 91 N -0.13 0.00 -0.94 2.57 3.38 -0.51 -2.39 115.31 117.31 2a7k h LEU 91 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2a7k h LEU 91 Cb 0.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.43 2a7k h LEU 91 CO 0.03 0.16 0.00 0.59 0.09 0.00 0.00 178.44 179.31 2a7k n ASN 92 N -3.79 1.45 -4.64 -0.43 5.03 0.23 -4.76 115.26 108.35 2a7k n ASN 92 Ca -0.02 -1.51 -0.43 0.00 0.87 0.00 0.00 54.58 53.49 2a7k n ASN 92 Cb 0.26 -0.02 -0.02 0.00 -1.02 0.00 0.00 39.78 38.98 2a7k n ASN 92 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2a7k s VAL 93 N -1.97 4.37 -1.41 2.41 1.01 -0.90 -4.90 120.40 119.00 2a7k s VAL 93 Ca 0.38 1.59 0.15 0.00 0.00 0.00 0.00 61.98 64.10 2a7k s VAL 93 Cb 0.20 -4.24 0.56 0.00 0.00 0.00 0.00 36.38 32.90 2a7k s VAL 93 CO 0.32 -0.38 1.45 0.59 0.00 0.00 0.00 175.10 177.08 2a7k n ASN 94 N 7.00 3.71 -4.93 3.32 3.02 -1.26 -4.81 115.26 121.31 2a7k n ASN 94 Ca 0.13 -2.27 -0.23 0.00 -0.03 0.00 0.00 54.58 52.18 2a7k n ASN 94 Cb 0.46 -0.48 -0.03 0.00 -0.61 0.00 0.00 39.78 39.12 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 -1.65 3.34 0.19 3.52 1.02 -1.26 -4.26 119.74 120.65 2a7k s LYS 95 Ca 0.40 -0.76 -0.32 0.00 0.02 0.00 0.00 55.97 55.31 2a7k s LYS 95 Cb 0.25 -2.85 -0.15 0.00 -0.52 0.00 0.00 37.83 34.55 2a7k s LYS 95 CO 0.21 0.45 1.25 -2.30 -0.92 0.00 0.00 175.35 174.05 2a7k n PRO 96 N -1.08 1.45 -4.95 -1.68 -0.02 -1.26 -4.82 135.00 122.65 2a7k n PRO 96 Ca -0.08 0.52 -0.28 0.00 -2.02 0.00 0.00 63.50 61.63 2a7k n PRO 96 Cb 0.56 -2.07 -0.17 0.00 -0.02 0.00 0.00 33.50 31.81 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 -0.12 1.63 -0.08 3.45 -4.23 -1.26 -0.59 115.64 114.44 2a7k s THR 97 Ca 0.72 -0.79 0.02 0.00 -1.18 0.00 0.00 61.69 60.46 2a7k s THR 97 Cb -0.79 -1.41 0.01 0.00 1.34 0.00 0.00 72.50 71.65 2a7k s THR 97 CO 0.51 0.46 -0.14 -0.63 -0.54 0.00 0.00 174.62 174.28 2a7k s ILE 98 N 0.25 1.32 -0.21 2.99 -1.09 0.50 -1.59 121.20 123.37 2a7k s ILE 98 Ca -0.11 -0.57 -0.10 0.00 -2.23 0.00 0.00 60.65 57.65 2a7k s ILE 98 Cb -0.15 -1.21 -0.05 0.00 -1.58 0.00 0.00 42.46 39.48 2a7k s ILE 98 CO 0.05 0.40 0.13 0.00 -1.23 0.00 0.00 174.94 174.29 2a7k s ALA 99 N 0.80 3.62 -0.47 9.38 0.00 -0.68 -0.72 121.76 133.69 2a7k s ALA 99 Ca -0.11 -0.78 -0.08 0.00 0.00 0.00 0.00 51.96 50.99 2a7k s ALA 99 Cb -0.16 -2.19 0.12 0.00 0.00 0.00 0.00 23.12 20.89 2a7k s ALA 99 CO 0.02 0.02 0.33 0.00 0.00 0.00 0.00 175.76 176.13 2a7k s ALA 100 N 0.63 3.36 -0.33 0.00 0.00 -0.07 -1.20 121.76 124.16 2a7k s ALA 100 Ca 0.07 -2.56 -0.16 0.00 0.00 0.00 0.00 51.96 49.32 2a7k s ALA 100 Cb -0.12 -2.76 -0.02 0.00 0.00 0.00 0.00 23.12 20.22 2a7k s ALA 100 CO 0.01 -1.90 0.41 0.08 0.00 0.00 0.00 175.76 174.36 2a7k s VAL 101 N 1.29 5.13 0.32 0.00 1.01 0.41 -4.01 120.40 124.55 2a7k s VAL 101 Ca 0.06 0.26 0.08 0.00 0.00 0.00 0.00 61.98 62.39 2a7k s VAL 101 Cb -0.25 -3.83 -0.06 0.00 0.00 0.00 0.00 36.38 32.23 2a7k s VAL 101 CO -0.01 -0.07 -0.07 -0.62 0.00 0.00 0.00 175.10 174.33 2a7k s ASP 102 N 1.72 3.24 1.15 3.32 -1.08 -1.26 -1.02 116.67 122.74 2a7k s ASP 102 Ca 0.15 -1.21 0.00 0.00 -0.52 0.00 0.00 52.55 50.97 2a7k s ASP 102 Cb -0.16 -0.26 0.00 0.00 -1.46 0.00 0.00 42.92 41.04 2a7k s ASP 102 CO 0.12 -0.29 0.00 0.61 0.52 0.00 0.00 175.17 176.12 2a7k n GLY 103 N -0.70 3.00 3.88 2.66 0.00 -1.25 -1.04 105.19 111.73 2a7k n GLY 103 Ca -0.05 -0.24 -0.36 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 3.60 -0.36 1.61 2.02 -1.26 -1.34 117.35 121.62 2a7k s TYR 104 Ca 0.00 0.58 0.03 0.00 -0.37 0.00 0.00 57.07 57.31 2a7k s TYR 104 Cb 0.00 -1.99 0.11 0.00 -0.40 0.00 0.00 41.96 39.68 2a7k s TYR 104 CO 0.00 0.68 0.10 0.00 -1.57 0.00 0.00 175.55 174.76 2a7k s ALA 105 N -1.16 2.60 -0.12 3.71 0.00 -0.27 -1.89 121.76 124.63 2a7k s ALA 105 Ca 0.22 -2.45 0.02 0.00 0.00 0.00 0.00 51.96 49.75 2a7k s ALA 105 Cb -0.13 -1.91 -0.00 0.00 0.00 0.00 0.00 23.12 21.07 2a7k s ALA 105 CO 0.11 -1.75 -0.20 0.42 0.00 0.00 0.00 175.76 174.34 2a7k s ILE 106 N 0.86 2.40 0.00 0.00 1.01 -0.22 -1.04 121.20 124.22 2a7k s ILE 106 Ca 0.12 -0.89 0.00 0.00 0.00 0.00 0.00 60.65 59.88 2a7k s ILE 106 Cb -0.20 -1.96 0.00 0.00 0.01 0.00 0.00 42.46 40.31 2a7k s ILE 106 CO -0.10 0.54 0.00 0.61 0.00 0.00 0.00 174.94 175.99 2a7k n GLY 107 N 3.71 3.16 0.40 6.18 0.00 -0.06 -1.42 105.19 117.16 2a7k n GLY 107 Ca -0.19 0.13 0.19 0.00 0.00 0.00 0.00 46.02 46.15 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 0.39 -0.50 1.61 2.86 -1.91 0.56 114.93 117.94 2a7k h MET 108 Ca 0.00 -0.02 -0.11 0.00 -2.06 0.00 0.00 59.70 57.50 2a7k h MET 108 Cb 0.00 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 2a7k h MET 108 CO 0.00 0.26 -0.14 0.78 1.06 0.00 0.00 176.91 178.87 2a7k h GLY 109 N 0.40 1.03 0.73 8.32 0.00 -1.40 0.43 103.07 112.58 2a7k h GLY 109 Ca 0.45 -0.84 -0.00 0.00 0.00 0.00 0.00 47.33 46.94 2a7k h GLY 109 CO -0.17 0.77 -0.04 -2.75 0.00 0.00 0.00 176.54 174.35 2a7k h PHE 110 N 0.84 -0.11 -0.71 5.60 3.04 -1.31 -1.92 116.94 122.37 2a7k h PHE 110 Ca 0.13 -0.00 0.04 0.00 3.98 0.00 0.00 57.97 62.12 2a7k h PHE 110 Cb 0.69 0.04 -0.05 0.00 2.56 0.00 0.00 35.95 39.19 2a7k h PHE 110 CO 0.04 0.17 0.43 1.96 -2.02 0.00 0.00 178.31 178.90 2a7k h GLN 111 N -0.40 0.80 -0.48 1.11 4.20 -0.81 -2.38 115.11 117.15 2a7k h GLN 111 Ca -0.01 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.65 2a7k h GLN 111 Cb 0.33 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 2a7k h GLN 111 CO 0.02 0.53 0.32 0.35 -0.67 0.00 0.00 178.83 179.37 2a7k h PHE 112 N 0.82 0.61 -0.45 2.96 3.57 -0.16 -2.81 116.94 121.48 2a7k h PHE 112 Ca 0.30 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.86 2a7k h PHE 112 Cb 0.09 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.60 2a7k h PHE 112 CO -0.05 0.39 0.30 0.00 -2.23 0.00 0.00 178.31 176.72 2a7k h ALA 113 N 1.17 1.87 0.00 2.41 0.00 -0.89 -2.28 119.26 121.54 2a7k h ALA 113 Ca 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2a7k h ALA 113 Cb -0.07 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2a7k h ALA 113 CO -0.04 0.07 0.00 1.28 0.00 0.00 0.00 179.25 180.56 2a7k n LEU 114 N -4.48 0.27 0.17 0.00 4.77 -0.94 -2.65 117.00 114.15 2a7k n LEU 114 Ca 0.05 0.57 0.12 0.00 -0.03 0.00 0.00 56.01 56.73 2a7k n LEU 114 Cb 0.19 -0.54 0.22 0.00 -2.33 0.00 0.00 43.42 40.96 2a7k n LEU 114 CO 0.35 -0.41 0.74 0.24 -1.33 0.00 0.00 177.39 176.97 2a7k h MET 115 N 0.00 0.00 -6.93 3.23 2.86 -1.46 -3.47 114.93 109.16 2a7k h MET 115 Ca 0.00 0.00 -0.47 0.00 -2.06 0.00 0.00 59.70 57.17 2a7k h MET 115 Cb 0.26 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 2a7k h MET 115 CO 0.00 0.00 0.23 -0.06 1.06 0.00 0.00 176.91 178.14 2a7k s PHE 116 N -3.19 3.38 0.27 -0.22 0.40 -1.08 -4.50 117.98 113.03 2a7k s PHE 116 Ca 0.07 1.36 -0.03 0.00 -0.60 0.00 0.00 56.93 57.73 2a7k s PHE 116 Cb 0.08 -2.66 0.34 0.00 0.51 0.00 0.00 43.02 41.29 2a7k s PHE 116 CO 0.66 -0.08 1.86 -0.44 0.70 0.00 0.00 175.22 177.92 2a7k h ASP 117 N 1.75 0.93 -5.03 1.36 3.32 -1.63 -3.44 116.42 113.68 2a7k h ASP 117 Ca -0.48 -0.11 -0.16 0.00 0.02 0.00 0.00 57.03 56.30 2a7k h ASP 117 Cb 1.18 -0.24 -0.20 0.00 0.22 0.00 0.00 39.33 40.29 2a7k h ASP 117 CO 0.63 0.80 -0.67 -1.10 -1.72 0.00 0.00 179.24 177.19 2a7k s GLN 118 N -5.54 0.39 -0.06 3.56 -1.52 -1.01 -5.03 119.66 110.45 2a7k s GLN 118 Ca -0.11 -0.70 0.02 0.00 -1.95 0.00 0.00 55.36 52.62 2a7k s GLN 118 Cb 0.16 0.14 0.02 0.00 -0.22 0.00 0.00 33.01 33.11 2a7k s GLN 118 CO 0.81 -0.07 -0.09 1.03 -0.25 0.00 0.00 175.29 176.72 2a7k s ARG 119 N -1.92 1.30 0.07 2.91 0.52 -1.26 -1.69 118.95 118.88 2a7k s ARG 119 Ca -0.12 -0.27 0.07 0.00 -0.52 0.00 0.00 55.73 54.90 2a7k s ARG 119 Cb -0.06 -1.16 -0.04 0.00 0.52 0.00 0.00 34.95 34.21 2a7k s ARG 119 CO -0.02 -0.03 -0.15 -0.51 0.02 0.00 0.00 175.30 174.60 2a7k s LEU 120 N 0.82 2.79 0.12 2.53 1.43 -0.34 0.10 118.68 126.13 2a7k s LEU 120 Ca -0.12 -0.43 0.04 0.00 -1.03 0.00 0.00 54.13 52.59 2a7k s LEU 120 Cb -0.15 -1.63 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 2a7k s LEU 120 CO 0.02 0.22 -0.10 0.00 0.23 0.00 0.00 176.35 176.72 2a7k s MET 121 N -1.81 0.95 0.54 1.70 0.23 -0.58 -0.44 119.30 119.88 2a7k s MET 121 Ca 0.17 -1.32 -0.17 0.00 -1.03 0.00 0.00 55.69 53.34 2a7k s MET 121 Cb -0.11 -0.55 -0.06 0.00 -1.53 0.00 0.00 34.83 32.59 2a7k s MET 121 CO 0.09 0.07 1.03 0.00 -2.03 0.00 0.00 175.02 174.18 2a7k s ALA 122 N -2.99 2.86 -0.20 3.16 0.00 -0.19 -1.58 121.76 122.82 2a7k s ALA 122 Ca 0.12 0.41 0.26 0.00 0.00 0.00 0.00 51.96 52.75 2a7k s ALA 122 Cb 0.01 -3.21 1.23 0.00 0.00 0.00 0.00 23.12 21.15 2a7k s ALA 122 CO -0.00 -0.50 1.79 0.66 0.00 0.00 0.00 175.76 177.71 2a7k h SER 123 N 0.92 0.00 -0.37 0.00 4.64 -1.29 -1.64 113.55 115.81 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 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 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 -2.44 0.68 -2.31 2.95 -2.24 -1.26 -4.39 114.28 105.28 2a7k n THR 124 Ca 0.00 -0.84 -0.27 0.00 -2.27 0.00 0.00 64.05 60.67 2a7k n THR 124 Cb 0.16 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 -1.14 3.23 -0.00 6.98 0.00 -0.62 -4.68 121.76 125.54 2a7k s ALA 125 Ca 0.31 -0.59 0.00 0.00 0.00 0.00 0.00 51.96 51.68 2a7k s ALA 125 Cb 0.17 -2.69 0.01 0.00 0.00 0.00 0.00 23.12 20.61 2a7k s ALA 125 CO 0.23 -0.81 0.00 -0.80 0.00 0.00 0.00 175.76 174.39 2a7k s ASN 126 N -4.29 0.07 -0.15 0.00 -0.87 -0.45 -3.69 114.94 105.57 2a7k s ASN 126 Ca 0.54 -0.00 -0.08 0.00 -1.57 0.00 0.00 52.86 51.75 2a7k s ASN 126 Cb -0.11 -0.03 -0.04 0.00 -0.02 0.00 0.00 41.25 41.06 2a7k s ASN 126 CO 0.47 -0.02 0.13 -0.36 -2.57 0.00 0.00 177.10 174.74 2a7k s PHE 127 N 0.21 3.49 -0.02 2.20 0.40 -0.10 -1.12 117.98 123.04 2a7k s PHE 127 Ca -0.02 0.41 -0.01 0.00 -0.60 0.00 0.00 56.93 56.71 2a7k s PHE 127 Cb -0.03 -2.03 0.01 0.00 0.51 0.00 0.00 43.02 41.49 2a7k s PHE 127 CO -0.01 0.52 0.04 0.08 0.70 0.00 0.00 175.22 176.56 2a7k s VAL 128 N -0.41 -0.01 -0.55 -0.44 1.01 -0.20 0.03 120.40 119.82 2a7k s VAL 128 Ca 0.12 0.05 0.07 0.00 0.00 0.00 0.00 61.98 62.21 2a7k s VAL 128 Cb -0.12 -0.07 0.25 0.00 0.00 0.00 0.00 36.38 36.44 2a7k s VAL 128 CO 0.01 0.02 0.67 0.80 0.00 0.00 0.00 175.10 176.60 2a7k n MET 129 N 3.32 1.88 -0.38 2.72 1.56 -1.26 -0.88 117.12 124.09 2a7k n MET 129 Ca -0.16 -4.15 0.07 0.00 -0.27 0.00 0.00 57.70 53.19 2a7k n MET 129 Cb 0.58 -1.88 0.24 0.00 2.15 0.00 0.00 33.22 34.30 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 1.03 2.69 -0.21 2.12 -0.04 -1.26 -4.50 135.00 134.83 2a7k n PRO 130 Ca 0.27 -1.89 -0.03 0.00 -0.04 0.00 0.00 63.50 61.81 2a7k n PRO 130 Cb 0.45 -1.62 0.04 0.00 -0.04 0.00 0.00 33.50 32.33 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 2.79 -0.09 -0.54 0.54 3.07 -1.90 -2.02 114.58 116.43 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 0.97 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.88 2a7k h GLU 131 CO 0.13 -0.06 0.07 -0.07 -1.40 0.00 0.00 179.01 177.68 2a7k h LEU 132 N -0.10 0.81 -1.72 1.33 3.38 -1.81 0.78 115.31 117.98 2a7k h LEU 132 Ca 0.27 -0.17 0.04 0.00 0.09 0.00 0.00 57.88 58.11 2a7k h LEU 132 Cb 0.53 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 2a7k h LEU 132 CO -0.68 0.83 0.26 0.50 0.09 0.00 0.00 178.44 179.44 2a7k h LYS 133 N 0.81 0.35 -0.29 1.13 3.64 -1.70 -2.51 116.57 117.99 2a7k h LYS 133 Ca 0.17 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2a7k h LYS 133 Cb 0.38 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 2a7k h LYS 133 CO 0.01 0.23 0.00 0.72 -2.27 0.00 0.00 179.45 178.14 2a7k n HIS 134 N -4.48 0.37 -1.34 1.91 8.25 -0.29 -4.93 115.22 114.72 2a7k n HIS 134 Ca 0.04 -0.19 -0.01 0.00 -0.26 0.00 0.00 57.72 57.31 2a7k n HIS 134 Cb 0.19 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.30 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 1.40 0.41 3.70 -1.41 0.00 -0.81 -5.04 105.19 103.43 2a7k n GLY 135 Ca 0.18 -1.00 -0.35 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.03 4.75 0.51 -0.61 -1.09 0.11 -4.99 121.20 117.84 2a7k s ILE 136 Ca 0.00 -0.06 -0.23 0.00 -2.23 0.00 0.00 60.65 58.13 2a7k s ILE 136 Cb 0.00 -3.08 -0.06 0.00 -1.58 0.00 0.00 42.46 37.74 2a7k s ILE 136 CO 0.00 0.54 1.36 0.61 -1.23 0.00 0.00 174.94 176.22 2a7k n GLY 137 N 2.77 0.78 0.60 6.18 0.00 -1.26 -3.29 105.19 110.96 2a7k n GLY 137 Ca -0.18 0.08 0.06 0.00 0.00 0.00 0.00 46.02 45.98 2a7k n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a7k h SER 139 N 0.75 1.05 -0.02 0.00 0.02 -1.99 0.37 113.55 113.74 2a7k h SER 139 Ca -0.03 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.88 2a7k h SER 139 Cb 1.13 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.41 2a7k h SER 139 CO 0.01 0.77 -0.04 0.58 -1.14 0.00 0.00 176.83 177.01 2a7k h VAL 140 N 1.24 1.45 -0.97 2.27 2.07 -1.95 -1.97 116.25 118.38 2a7k h VAL 140 Ca 0.33 -1.38 0.09 0.00 0.82 0.00 0.00 66.70 66.56 2a7k h VAL 140 Cb -0.14 2.34 -0.07 0.00 -1.52 0.00 0.00 31.29 31.90 2a7k h VAL 140 CO -0.07 0.37 0.62 1.23 0.02 0.00 0.00 177.57 179.74 2a7k h GLY 141 N -0.50 1.49 0.94 2.17 0.00 -1.89 -1.94 103.07 103.35 2a7k h GLY 141 Ca 0.00 -0.43 -0.08 0.00 0.00 0.00 0.00 47.33 46.81 2a7k h GLY 141 CO 0.01 0.26 -0.12 0.00 0.00 0.00 0.00 176.54 176.69 2a7k h ALA 142 N 1.50 0.48 -0.51 3.60 0.00 -0.92 -1.08 119.26 122.33 2a7k h ALA 142 Ca 0.44 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 55.04 2a7k h ALA 142 Cb 0.31 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2a7k h ALA 142 CO -0.20 0.35 0.33 0.00 0.00 0.00 0.00 179.25 179.74 2a7k h ALA 143 N 0.80 0.64 -0.12 0.00 0.00 -1.03 -0.07 119.26 119.48 2a7k h ALA 143 Ca 0.08 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2a7k h ALA 143 Cb 0.64 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 2a7k h ALA 143 CO 0.04 0.07 -0.10 0.82 0.00 0.00 0.00 179.25 180.08 2a7k h ILE 144 N 0.67 1.34 -0.09 0.00 2.04 -1.32 -2.21 117.51 117.94 2a7k h ILE 144 Ca 0.19 -1.22 -0.17 0.00 1.00 0.00 0.00 64.86 64.67 2a7k h ILE 144 Cb -0.06 1.88 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 2a7k h ILE 144 CO -0.05 0.35 -0.66 0.25 0.00 0.00 0.00 178.15 178.04 2a7k h LEU 145 N -0.10 0.42 -1.05 1.44 5.85 -1.15 -0.75 115.31 119.97 2a7k h LEU 145 Ca 0.02 -0.26 -0.05 0.00 0.84 0.00 0.00 57.88 58.43 2a7k h LEU 145 Cb 0.60 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 2a7k h LEU 145 CO 0.03 0.97 0.12 1.23 -0.34 0.00 0.00 178.44 180.44 2a7k h GLY 146 N 1.33 0.85 0.80 3.75 0.00 -1.00 0.39 103.07 109.20 2a7k h GLY 146 Ca -0.02 -0.49 -0.05 0.00 0.00 0.00 0.00 47.33 46.78 2a7k h GLY 146 CO 0.11 0.46 -0.06 -2.75 0.00 0.00 0.00 176.54 174.30 2a7k h PHE 147 N 0.77 0.44 0.19 5.60 3.04 -1.04 -0.95 116.94 124.99 2a7k h PHE 147 Ca 0.17 -0.10 -0.31 0.00 3.98 0.00 0.00 57.97 61.71 2a7k h PHE 147 Cb 0.30 -0.11 0.02 0.00 2.56 0.00 0.00 35.95 38.72 2a7k h PHE 147 CO 0.02 0.65 -1.40 1.79 -2.02 0.00 0.00 178.31 177.35 2a7k h THR 148 N 0.11 1.34 0.00 4.41 1.35 -0.96 -3.39 112.91 115.77 2a7k h THR 148 Ca 0.05 -2.85 0.00 0.00 -0.55 0.00 0.00 66.41 63.06 2a7k h THR 148 Cb 0.52 2.97 0.00 0.00 -1.73 0.00 0.00 68.15 69.90 2a7k h THR 148 CO 0.02 0.85 0.00 1.41 -0.25 0.00 0.00 175.52 177.55 2a7k n HIS 149 N -3.61 0.00 0.00 4.73 8.25 0.14 -5.08 115.22 119.64 2a7k n HIS 149 Ca -0.14 -0.21 0.00 0.00 -0.26 0.00 0.00 57.72 57.11 2a7k n HIS 149 Cb 1.07 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 32.16 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 -0.21 -1.64 0.07 -1.41 0.00 -0.36 -4.47 105.19 97.17 2a7k n GLY 150 Ca 0.00 -1.55 -0.13 0.00 0.00 0.00 0.00 46.02 44.34 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 -0.07 -0.20 1.61 3.57 -1.88 -2.02 116.94 117.96 2a7k h PHE 151 Ca 0.00 -0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.35 2a7k h PHE 151 Cb 0.00 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.75 2a7k h PHE 151 CO 0.00 0.19 -0.49 0.66 -2.23 0.00 0.00 178.31 176.43 2a7k h SER 152 N -0.32 0.59 -0.36 0.41 4.64 -1.95 -0.31 113.55 116.25 2a7k h SER 152 Ca -0.01 -0.30 -0.02 0.00 -0.47 0.00 0.00 61.79 60.99 2a7k h SER 152 Cb 0.28 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.19 2a7k h SER 152 CO 0.01 0.99 0.13 0.74 -0.87 0.00 0.00 176.83 177.83 2a7k h THR 153 N 0.43 1.20 -0.31 2.95 2.02 -1.78 -2.10 112.91 115.33 2a7k h THR 153 Ca 0.02 -0.63 0.04 0.00 0.77 0.00 0.00 66.41 66.61 2a7k h THR 153 Cb 1.02 0.94 -0.04 0.00 -1.74 0.00 0.00 68.15 68.33 2a7k h THR 153 CO 0.09 0.22 0.08 -0.03 0.37 0.00 0.00 175.52 176.25 2a7k h MET 154 N 0.43 0.19 -0.39 6.66 -1.53 -1.08 -1.70 114.93 117.52 2a7k h MET 154 Ca 0.12 -0.01 0.04 0.00 -3.44 0.00 0.00 59.70 56.41 2a7k h MET 154 Cb 0.22 -0.04 -0.04 0.00 -0.55 0.00 0.00 31.60 31.18 2a7k h MET 154 CO -0.01 0.13 0.15 1.96 0.14 0.00 0.00 176.91 179.28 2a7k h GLN 155 N 0.20 0.31 -0.51 0.39 4.20 -0.95 -0.36 115.11 118.39 2a7k h GLN 155 Ca 0.14 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.86 2a7k h GLN 155 Cb 0.14 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.81 2a7k h GLN 155 CO -0.17 0.21 0.30 1.49 -0.67 0.00 0.00 178.83 179.98 2a7k h GLU 156 N 0.32 0.57 -0.03 1.46 4.81 -1.17 -1.22 114.58 119.31 2a7k h GLU 156 Ca 0.18 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 2a7k h GLU 156 Cb 0.14 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.39 2a7k h GLU 156 CO -0.17 0.38 -0.01 0.82 -0.73 0.00 0.00 179.01 179.30 2a7k h ILE 157 N 0.59 1.33 0.00 2.32 2.04 -0.81 -2.09 117.51 120.88 2a7k h ILE 157 Ca 0.21 -1.01 -0.08 0.00 1.00 0.00 0.00 64.86 64.98 2a7k h ILE 157 Cb 0.04 1.96 -0.01 0.00 -0.74 0.00 0.00 36.82 38.07 2a7k h ILE 157 CO -0.10 0.27 -0.39 0.16 0.00 0.00 0.00 178.15 178.08 2a7k h ILE 158 N -0.35 0.88 0.00 -0.67 3.07 -1.03 -2.41 117.51 117.00 2a7k h ILE 158 Ca 0.01 -1.60 -0.09 0.00 1.55 0.00 0.00 64.86 64.73 2a7k h ILE 158 Cb 0.44 1.98 -0.02 0.00 -0.27 0.00 0.00 36.82 38.96 2a7k h ILE 158 CO 0.00 0.38 -1.38 -1.22 -1.05 0.00 0.00 178.15 174.88 2a7k n TYR 159 N -3.50 0.79 0.00 0.16 4.01 -0.47 -4.14 117.16 114.02 2a7k n TYR 159 Ca 0.00 0.24 -0.05 0.00 -0.16 0.00 0.00 57.90 57.94 2a7k n TYR 159 Cb 0.53 -0.95 -0.11 0.00 -0.31 0.00 0.00 39.34 38.50 2a7k n TYR 159 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2a7k n GLN 160 N -2.70 0.63 -3.94 -0.72 6.02 -0.79 -4.99 117.38 110.89 2a7k n GLN 160 Ca -0.06 0.27 -0.30 0.00 -0.01 0.00 0.00 57.00 56.90 2a7k n GLN 160 Cb 0.70 -1.81 0.01 0.00 1.02 0.00 0.00 30.24 30.17 2a7k n GLN 160 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2a7k s GLN 162 N -6.57 3.58 -0.16 0.00 -0.21 -1.26 -4.77 119.66 110.27 2a7k s GLN 162 Ca 0.53 -0.15 -0.29 0.00 0.02 0.00 0.00 55.36 55.46 2a7k s GLN 162 Cb -0.27 -2.72 -0.02 0.00 1.00 0.00 0.00 33.01 31.01 2a7k s GLN 162 CO 0.85 0.27 1.31 0.45 -2.12 0.00 0.00 175.29 176.06 2a7k s SER 163 N -3.25 6.90 -0.47 5.90 0.15 -1.26 -4.44 113.70 117.23 2a7k s SER 163 Ca 0.42 1.75 -0.16 0.00 0.70 0.00 0.00 55.95 58.65 2a7k s SER 163 Cb -0.11 -2.54 0.06 0.00 -1.71 0.00 0.00 66.02 61.73 2a7k s SER 163 CO 0.30 -0.79 0.42 -0.76 1.20 0.00 0.00 173.24 173.60 2a7k s LEU 164 N 3.60 5.44 1.00 3.45 1.43 0.10 -4.95 118.68 128.76 2a7k s LEU 164 Ca 0.57 -1.19 -0.17 0.00 -1.03 0.00 0.00 54.13 52.31 2a7k s LEU 164 Cb -0.23 -2.22 0.22 0.00 0.03 0.00 0.00 46.19 43.99 2a7k s LEU 164 CO 0.17 -0.65 1.32 1.51 0.23 0.00 0.00 176.35 178.93 2a7k s ASP 165 N 2.46 2.76 0.11 2.29 1.47 -1.26 -0.92 116.67 123.59 2a7k s ASP 165 Ca 0.06 0.24 -0.23 0.00 1.18 0.00 0.00 52.55 53.80 2a7k s ASP 165 Cb -0.23 -0.25 -0.07 0.00 -0.34 0.00 0.00 42.92 42.03 2a7k s ASP 165 CO 0.08 -2.95 1.69 0.00 0.68 0.00 0.00 175.17 174.67 2a7k h ALA 166 N -1.79 -0.10 -1.00 2.11 0.00 -1.76 -0.01 119.26 116.71 2a7k h ALA 166 Ca -0.44 0.02 0.11 0.00 0.00 0.00 0.00 54.91 54.60 2a7k h ALA 166 Cb 1.23 0.20 -0.08 0.00 0.00 0.00 0.00 17.79 19.14 2a7k h ALA 166 CO 0.35 -0.59 0.63 -1.35 0.00 0.00 0.00 179.25 178.29 2a7k h PRO 167 N -0.17 0.99 -0.47 0.00 0.11 -1.94 -0.42 132.00 130.10 2a7k h PRO 167 Ca 0.05 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 66.01 2a7k h PRO 167 Cb 0.24 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 31.11 2a7k h PRO 167 CO -0.13 0.66 -0.09 -0.09 -0.21 0.00 0.00 178.00 178.14 2a7k h ARG 168 N 1.02 0.85 -0.58 1.05 9.65 -1.71 -0.84 114.38 123.83 2a7k h ARG 168 Ca 0.48 -0.28 -0.11 0.00 -1.10 0.00 0.00 59.98 58.97 2a7k h ARG 168 Cb 0.43 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.92 2a7k h ARG 168 CO -0.24 0.91 -0.06 0.00 2.80 0.00 0.00 179.97 183.38 2a7k h VAL 170 N 0.96 1.02 -0.66 0.00 2.07 -0.81 0.13 116.25 118.96 2a7k h VAL 170 Ca 0.16 -0.06 0.11 0.00 0.82 0.00 0.00 66.70 67.72 2a7k h VAL 170 Cb 0.63 0.82 -0.08 0.00 -1.52 0.00 0.00 31.29 31.14 2a7k h VAL 170 CO 0.04 0.03 0.26 -0.78 0.02 0.00 0.00 177.57 177.14 2a7k h ASP 171 N 0.18 0.25 0.66 0.57 3.58 -1.00 0.12 116.42 120.78 2a7k h ASP 171 Ca 0.06 0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.60 2a7k h ASP 171 Cb -0.00 0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.11 2a7k h ASP 171 CO -0.03 0.13 0.00 -1.22 -2.88 0.00 0.00 179.24 175.24 2a7k n TYR 172 N -4.99 0.00 -3.33 0.28 4.01 -0.61 -4.91 117.16 107.61 2a7k n TYR 172 Ca 0.11 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.61 2a7k n TYR 172 Cb 0.32 -0.38 0.06 0.00 -0.31 0.00 0.00 39.34 39.02 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 -1.38 -6.60 0.21 -0.72 0.63 0.03 -4.90 116.66 103.92 2a7k n ARG 173 Ca 0.09 0.87 0.11 0.00 -0.92 0.00 0.00 57.85 58.00 2a7k n ARG 173 Cb 0.25 -5.84 0.14 0.00 0.45 0.00 0.00 32.46 27.46 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 -2.12 0.00 -8.51 6.15 3.38 -1.01 -3.46 115.31 109.74 2a7k h LEU 174 Ca -0.55 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.17 2a7k h LEU 174 Cb 1.37 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.97 2a7k h LEU 174 CO 0.57 0.07 -0.69 0.68 0.09 0.00 0.00 178.44 179.16 2a7k s VAL 175 N -3.18 0.73 -0.12 1.22 -7.23 -1.25 -4.83 120.40 105.74 2a7k s VAL 175 Ca 0.06 -1.96 0.20 0.00 -1.81 0.00 0.00 61.98 58.47 2a7k s VAL 175 Cb 0.05 -1.80 -0.26 0.00 0.56 0.00 0.00 36.38 34.94 2a7k s VAL 175 CO 0.68 -0.77 0.40 0.59 -0.31 0.00 0.00 175.10 175.70 2a7k n ASN 176 N -0.10 0.17 -3.76 4.85 4.13 0.11 -4.80 115.26 115.86 2a7k n ASN 176 Ca -0.11 0.07 -0.13 0.00 1.68 0.00 0.00 54.58 56.10 2a7k n ASN 176 Cb 0.61 1.27 -0.09 0.00 -1.54 0.00 0.00 39.78 40.03 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 -3.03 0.55 -0.11 3.52 -0.21 -1.20 -5.03 119.66 114.14 2a7k s GLN 177 Ca -0.08 0.07 0.03 0.00 0.02 0.00 0.00 55.36 55.41 2a7k s GLN 177 Cb 0.10 0.25 0.00 0.00 1.00 0.00 0.00 33.01 34.36 2a7k s GLN 177 CO 0.86 -0.13 -0.23 0.08 -2.12 0.00 0.00 175.29 173.75 2a7k s VAL 178 N -0.73 2.09 0.19 1.09 1.01 -1.26 -1.53 120.40 121.26 2a7k s VAL 178 Ca -0.08 -1.00 -0.02 0.00 0.00 0.00 0.00 61.98 60.88 2a7k s VAL 178 Cb -0.04 -1.80 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 2a7k s VAL 178 CO 0.03 0.56 0.15 0.68 0.00 0.00 0.00 175.10 176.51 2a7k s VAL 179 N 0.47 0.02 0.50 2.92 -7.23 -0.61 -4.92 120.40 111.55 2a7k s VAL 179 Ca -0.16 -1.92 -0.22 0.00 -1.81 0.00 0.00 61.98 57.87 2a7k s VAL 179 Cb -0.17 -2.39 -0.06 0.00 0.56 0.00 0.00 36.38 34.32 2a7k s VAL 179 CO 0.06 -0.08 1.24 -1.61 -0.31 0.00 0.00 175.10 174.40 2a7k s GLU 180 N -4.13 3.47 0.27 4.82 8.01 -1.26 -0.79 118.70 129.09 2a7k s GLU 180 Ca 0.35 1.95 -0.01 0.00 0.01 0.00 0.00 54.97 57.27 2a7k s GLU 180 Cb 0.06 -2.32 0.62 0.00 -4.31 0.00 0.00 34.13 28.19 2a7k s GLU 180 CO 0.10 -0.84 1.65 0.77 0.01 0.00 0.00 175.26 176.95 2a7k h SER 181 N 1.75 -0.06 0.77 -0.19 0.02 -1.93 0.12 113.55 114.02 2a7k h SER 181 Ca -0.50 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 2a7k h SER 181 Cb 1.27 0.27 0.00 0.00 0.14 0.00 0.00 62.40 64.08 2a7k h SER 181 CO 0.59 -0.14 0.00 0.77 -1.14 0.00 0.00 176.83 176.91 2a7k h SER 182 N 0.20 0.00 0.00 3.07 4.64 -2.03 -2.53 113.55 116.90 2a7k h SER 182 Ca 0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 2a7k h SER 182 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 2a7k h SER 182 CO -0.64 0.00 -0.89 0.00 -0.87 0.00 0.00 176.83 174.43 2a7k n ALA 183 N -1.94 4.34 0.13 5.18 0.00 0.31 -4.75 120.51 123.78 2a7k n ALA 183 Ca 0.01 -0.51 -0.14 0.00 0.00 0.00 0.00 53.44 52.80 2a7k n ALA 183 Cb 0.24 -0.66 -0.08 0.00 0.00 0.00 0.00 19.45 18.95 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 0.00 -0.24 -0.42 0.00 5.85 -0.83 -1.25 115.31 118.43 2a7k h LEU 184 Ca 0.00 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 2a7k h LEU 184 Cb 0.44 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.51 2a7k h LEU 184 CO 0.00 -0.09 0.22 0.25 -0.34 0.00 0.00 178.44 178.47 2a7k h LEU 185 N -0.36 0.53 -0.88 2.25 5.85 -1.86 -0.91 115.31 119.93 2a7k h LEU 185 Ca -0.03 -0.10 -0.06 0.00 0.84 0.00 0.00 57.88 58.53 2a7k h LEU 185 Cb 0.28 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 2a7k h LEU 185 CO 0.05 0.48 0.18 0.44 -0.34 0.00 0.00 178.44 179.25 2a7k h ASP 186 N 0.54 0.94 -0.58 1.25 3.32 -1.87 -0.28 116.42 119.75 2a7k h ASP 186 Ca 0.15 -0.18 -0.05 0.00 0.02 0.00 0.00 57.03 56.97 2a7k h ASP 186 Cb 0.08 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.36 2a7k h ASP 186 CO -0.02 0.90 0.18 0.00 -1.72 0.00 0.00 179.24 178.57 2a7k h ALA 187 N 1.22 1.15 -0.18 3.45 0.00 -0.75 -0.42 119.26 123.73 2a7k h ALA 187 Ca 0.21 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2a7k h ALA 187 Cb 0.31 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2a7k h ALA 187 CO -0.00 0.58 -0.08 0.00 0.00 0.00 0.00 179.25 179.75 2a7k h ALA 188 N 1.28 0.25 -0.64 0.00 0.00 -0.80 -2.01 119.26 117.34 2a7k h ALA 188 Ca 0.20 -0.28 0.04 0.00 0.00 0.00 0.00 54.91 54.87 2a7k h ALA 188 Cb 0.29 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 2a7k h ALA 188 CO -0.01 0.06 0.38 0.82 0.00 0.00 0.00 179.25 180.50 2a7k h ILE 189 N 0.05 1.03 -0.11 0.00 2.04 -0.97 -0.61 117.51 118.95 2a7k h ILE 189 Ca 0.04 -0.25 0.04 0.00 1.00 0.00 0.00 64.86 65.69 2a7k h ILE 189 Cb 0.56 0.24 -0.04 0.00 -0.74 0.00 0.00 36.82 36.85 2a7k h ILE 189 CO 0.03 0.13 -0.13 0.74 0.00 0.00 0.00 178.15 178.92 2a7k h THR 190 N 0.72 0.65 -0.72 -0.27 2.02 -0.98 0.80 112.91 115.13 2a7k h THR 190 Ca 0.27 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.45 2a7k h THR 190 Cb 0.09 0.65 -0.04 0.00 -1.74 0.00 0.00 68.15 67.11 2a7k h THR 190 CO -0.14 0.00 0.44 1.56 0.37 0.00 0.00 175.52 177.76 2a7k h GLN 191 N -0.16 0.96 -0.64 6.66 1.08 -1.09 -1.38 115.11 120.54 2a7k h GLN 191 Ca 0.08 -0.08 -0.04 0.00 -1.45 0.00 0.00 58.65 57.17 2a7k h GLN 191 Cb 0.28 -0.21 -0.03 0.00 -0.05 0.00 0.00 27.48 27.48 2a7k h GLN 191 CO -0.21 0.66 0.23 0.00 -0.95 0.00 0.00 178.83 178.57 2a7k h ALA 192 N 1.51 1.21 -0.56 3.87 0.00 -0.49 -1.28 119.26 123.52 2a7k h ALA 192 Ca 0.26 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2a7k h ALA 192 Cb -0.06 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 2a7k h ALA 192 CO -0.05 0.57 0.16 0.45 0.00 0.00 0.00 179.25 180.37 2a7k h HIS 193 N 0.92 0.93 -0.32 0.00 3.86 0.17 -0.39 115.15 120.32 2a7k h HIS 193 Ca 0.21 -0.10 0.00 0.00 -1.16 0.00 0.00 60.37 59.32 2a7k h HIS 193 Cb 0.21 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.40 2a7k h HIS 193 CO 0.02 0.79 0.21 0.28 0.86 0.00 0.00 177.93 180.08 2a7k h VAL 194 N 0.80 1.10 -0.12 2.45 2.07 -0.96 -2.18 116.25 119.40 2a7k h VAL 194 Ca 0.18 -0.20 -0.14 0.00 0.82 0.00 0.00 66.70 67.35 2a7k h VAL 194 Cb 0.31 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 2a7k h VAL 194 CO -0.00 0.09 -0.54 0.24 0.02 0.00 0.00 177.57 177.38 2a7k h MET 195 N 0.43 0.35 0.00 1.57 2.86 -1.19 -2.86 114.93 116.09 2a7k h MET 195 Ca 0.12 -0.22 -0.02 0.00 -2.06 0.00 0.00 59.70 57.52 2a7k h MET 195 Cb -0.02 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.66 2a7k h MET 195 CO -0.02 0.81 -0.11 0.00 1.06 0.00 0.00 176.91 178.64 2a7k h ALA 196 N 1.15 1.47 0.00 6.32 0.00 -0.88 -2.16 119.26 125.16 2a7k h ALA 196 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2a7k h ALA 196 Cb 1.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2a7k h ALA 196 CO 0.09 0.14 0.00 0.66 0.00 0.00 0.00 179.25 180.14 2a7k h SER 197 N 0.00 0.00 -2.90 0.00 4.64 -1.15 -3.44 113.55 110.70 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 0.25 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.38 2a7k h SER 197 CO 0.01 0.00 0.82 -0.31 -0.87 0.00 0.00 176.83 176.48 2a7k s TYR 198 N -3.18 3.13 0.10 4.77 2.02 -0.81 -4.91 117.35 118.47 2a7k s TYR 198 Ca 0.08 0.76 -0.36 0.00 -0.37 0.00 0.00 57.07 57.19 2a7k s TYR 198 Cb 0.11 -3.82 -0.17 0.00 -0.40 0.00 0.00 41.96 37.68 2a7k s TYR 198 CO 0.54 -2.98 1.24 -2.30 -1.57 0.00 0.00 175.55 170.48 2a7k n PRO 199 N 4.01 0.99 -0.14 -1.71 -0.02 -1.26 -4.84 135.00 132.02 2a7k n PRO 199 Ca 0.13 0.36 -0.10 0.00 -2.02 0.00 0.00 63.50 61.86 2a7k n PRO 199 Cb 0.40 -1.93 -0.01 0.00 -0.02 0.00 0.00 33.50 31.94 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 3.96 0.55 0.04 3.55 0.00 -1.90 -2.57 119.26 122.88 2a7k h ALA 200 Ca -0.46 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 54.22 2a7k h ALA 200 Cb 1.35 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 2a7k h ALA 200 CO 0.74 0.31 -0.17 1.03 0.00 0.00 0.00 179.25 181.16 2a7k h SER 201 N 0.55 -0.48 -0.66 0.00 0.87 -1.99 0.15 113.55 111.99 2a7k h SER 201 Ca 0.12 0.07 -0.03 0.00 -1.23 0.00 0.00 61.79 60.72 2a7k h SER 201 Cb 0.45 0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.57 2a7k h SER 201 CO 0.02 -0.24 0.30 0.00 -0.53 0.00 0.00 176.83 176.39 2a7k h ALA 202 N 0.60 0.86 0.04 6.23 0.00 -1.94 -1.92 119.26 123.13 2a7k h ALA 202 Ca 0.04 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2a7k h ALA 202 Cb 0.35 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2a7k h ALA 202 CO -0.13 0.44 -0.02 0.35 0.00 0.00 0.00 179.25 179.89 2a7k h PHE 203 N 0.93 -0.05 -0.23 0.00 3.04 -1.01 -1.66 116.94 117.96 2a7k h PHE 203 Ca 0.23 -0.00 0.02 0.00 3.98 0.00 0.00 57.97 62.20 2a7k h PHE 203 Cb 0.14 0.02 -0.02 0.00 2.56 0.00 0.00 35.95 38.65 2a7k h PHE 203 CO 0.01 0.13 0.09 0.82 -2.02 0.00 0.00 178.31 177.34 2a7k h ILE 204 N -0.22 0.96 -0.80 1.41 2.04 -0.64 0.15 117.51 120.40 2a7k h ILE 204 Ca -0.01 -0.07 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 2a7k h ILE 204 Cb 0.20 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 36.98 2a7k h ILE 204 CO 0.01 0.04 0.36 0.78 0.00 0.00 0.00 178.15 179.33 2a7k h ASN 205 N 0.20 1.07 -0.12 1.72 2.35 -1.34 -1.42 115.58 118.04 2a7k h ASN 205 Ca 0.10 -0.14 -0.03 0.00 -0.55 0.00 0.00 56.30 55.68 2a7k h ASN 205 Cb 0.06 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.15 2a7k h ASN 205 CO -0.09 0.92 -0.05 0.74 -1.65 0.00 0.00 177.43 177.30 2a7k h THR 206 N 1.15 1.31 -0.86 2.81 2.02 -0.97 -2.59 112.91 115.78 2a7k h THR 206 Ca 0.27 -1.05 -0.03 0.00 0.77 0.00 0.00 66.41 66.38 2a7k h THR 206 Cb 0.16 1.76 -0.04 0.00 -1.74 0.00 0.00 68.15 68.28 2a7k h THR 206 CO -0.03 0.30 0.43 0.50 0.37 0.00 0.00 175.52 177.09 2a7k h LYS 207 N -0.10 1.23 -0.32 6.66 3.64 -0.58 0.13 116.57 127.24 2a7k h LYS 207 Ca 0.03 -0.17 0.05 0.00 -1.27 0.00 0.00 60.65 59.29 2a7k h LYS 207 Cb 0.50 -0.23 -0.05 0.00 -0.41 0.00 0.00 32.23 32.04 2a7k h LYS 207 CO 0.02 0.93 0.04 0.00 -2.27 0.00 0.00 179.45 178.16 2a7k h ARG 208 N 1.22 0.13 -0.60 1.90 3.08 -1.24 0.16 114.38 119.04 2a7k h ARG 208 Ca 0.30 -0.01 -0.09 0.00 0.07 0.00 0.00 59.98 60.25 2a7k h ARG 208 Cb 0.09 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 2a7k h ARG 208 CO -0.04 0.09 0.03 0.00 -1.07 0.00 0.00 179.97 178.98 2a7k h ALA 209 N 1.26 0.92 -0.28 0.04 0.00 -1.00 -1.67 119.26 118.52 2a7k h ALA 209 Ca 0.15 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2a7k h ALA 209 Cb 0.19 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2a7k h ALA 209 CO -0.23 0.65 0.12 0.28 0.00 0.00 0.00 179.25 180.08 2a7k h VAL 210 N 0.94 1.16 0.00 0.00 2.07 -0.41 -3.28 116.25 116.73 2a7k h VAL 210 Ca 0.18 -0.47 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 2a7k h VAL 210 Cb 0.51 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 31.23 2a7k h VAL 210 CO 0.02 0.16 -0.10 0.78 0.02 0.00 0.00 177.57 178.46 2a7k h ASN 211 N 0.30 0.00 -0.43 0.57 4.21 -0.63 -3.38 115.58 116.23 2a7k h ASN 211 Ca 0.09 0.00 0.09 0.00 1.21 0.00 0.00 56.30 57.69 2a7k h ASN 211 Cb 0.14 0.00 -0.09 0.00 -1.12 0.00 0.00 38.32 37.25 2a7k h ASN 211 CO -0.01 0.09 -0.27 0.50 -1.29 0.00 0.00 177.43 176.45 2a7k h LYS 212 N 0.00 -0.18 0.00 0.81 3.64 -1.36 0.37 116.57 119.84 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 1.07 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.93 2a7k h LYS 212 CO 0.01 -0.12 -0.10 -1.00 -2.27 0.00 0.00 179.45 175.97 2a7k h PRO 213 N -0.19 0.00 -0.17 1.90 0.13 -1.78 -0.60 132.00 131.28 2a7k h PRO 213 Ca 0.19 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.26 2a7k h PRO 213 Cb 0.50 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.63 2a7k h PRO 213 CO -0.54 0.10 -0.16 0.35 -0.23 0.00 0.00 178.00 177.52 2a7k h PHE 214 N 0.00 0.50 -0.71 1.56 3.04 -1.24 0.64 116.94 120.73 2a7k h PHE 214 Ca -0.00 -0.15 0.04 0.00 3.98 0.00 0.00 57.97 61.84 2a7k h PHE 214 Cb 0.18 -0.11 -0.05 0.00 2.56 0.00 0.00 35.95 38.54 2a7k h PHE 214 CO 0.00 0.78 0.44 0.82 -2.02 0.00 0.00 178.31 178.33 2a7k h ILE 215 N 0.07 1.07 -0.41 1.41 2.04 -0.78 -0.25 117.51 120.67 2a7k h ILE 215 Ca 0.03 -0.29 -0.09 0.00 1.00 0.00 0.00 64.86 65.51 2a7k h ILE 215 Cb 0.69 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 2a7k h ILE 215 CO 0.04 0.15 -0.10 0.45 0.00 0.00 0.00 178.15 178.69 2a7k h HIS 216 N 0.85 0.88 -0.56 1.37 3.86 -0.99 -1.92 115.15 118.64 2a7k h HIS 216 Ca 0.29 -0.19 0.04 0.00 -1.16 0.00 0.00 60.37 59.35 2a7k h HIS 216 Cb 0.06 -0.21 -0.04 0.00 1.06 0.00 0.00 27.41 28.27 2a7k h HIS 216 CO -0.05 0.91 0.32 1.25 0.86 0.00 0.00 177.93 181.23 2a7k h LEU 217 N 0.60 0.50 -0.79 2.43 5.85 -0.51 -1.43 115.31 121.96 2a7k h LEU 217 Ca 0.10 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 2a7k h LEU 217 Cb 0.63 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 2a7k h LEU 217 CO 0.04 0.35 0.44 -0.07 -0.34 0.00 0.00 178.44 178.86 2a7k h LEU 218 N 0.62 0.98 -0.74 2.25 3.38 -0.87 -0.72 115.31 120.22 2a7k h LEU 218 Ca 0.23 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 2a7k h LEU 218 Cb 0.07 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 2a7k h LEU 218 CO -0.12 0.79 0.22 -0.33 0.09 0.00 0.00 178.44 179.09 2a7k h GLU 219 N 1.10 1.16 -0.59 1.13 4.39 -0.98 0.29 114.58 121.08 2a7k h GLU 219 Ca 0.28 -0.25 -0.06 0.00 0.34 0.00 0.00 59.36 59.67 2a7k h GLU 219 Cb 0.02 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.48 2a7k h GLU 219 CO -0.05 0.99 0.14 1.96 -1.16 0.00 0.00 179.01 180.90 2a7k h GLN 220 N 1.11 0.92 -0.43 2.33 4.20 -1.05 -2.22 115.11 119.97 2a7k h GLN 220 Ca 0.24 -0.20 -0.09 0.00 0.06 0.00 0.00 58.65 58.66 2a7k h GLN 220 Cb 0.32 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 2a7k h GLN 220 CO -0.01 0.82 -0.10 1.15 -0.67 0.00 0.00 178.83 180.03 2a7k h THR 221 N 0.88 1.27 -0.36 -0.54 2.02 -0.42 -0.04 112.91 115.73 2a7k h THR 221 Ca 0.19 -1.20 0.08 0.00 0.77 0.00 0.00 66.41 66.24 2a7k h THR 221 Cb 0.32 1.18 -0.08 0.00 -1.74 0.00 0.00 68.15 67.83 2a7k h THR 221 CO -0.00 0.41 -0.15 -0.09 0.37 0.00 0.00 175.52 176.05 2a7k h ARG 222 N 0.64 -0.08 -0.40 6.66 2.43 -0.32 -0.00 114.38 123.31 2a7k h ARG 222 Ca 0.11 0.01 -0.15 0.00 -0.81 0.00 0.00 59.98 59.13 2a7k h ARG 222 Cb 0.63 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.19 2a7k h ARG 222 CO 0.04 -0.06 -0.35 -0.44 -1.51 0.00 0.00 179.97 177.65 2a7k h ASP 223 N -0.09 0.99 -0.16 -3.80 3.32 -1.20 -2.64 116.42 112.85 2a7k h ASP 223 Ca 0.18 -0.44 -0.10 0.00 0.02 0.00 0.00 57.03 56.70 2a7k h ASP 223 Cb 0.36 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.63 2a7k h ASP 223 CO -0.42 1.23 -0.28 0.00 -1.72 0.00 0.00 179.24 178.06 2a7k h ALA 224 N 0.81 0.24 -0.69 3.45 0.00 -0.70 -1.38 119.26 120.99 2a7k h ALA 224 Ca 0.07 -0.40 0.10 0.00 0.00 0.00 0.00 54.91 54.68 2a7k h ALA 224 Cb 0.94 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.61 2a7k h ALA 224 CO 0.09 0.25 0.31 0.77 0.00 0.00 0.00 179.25 180.67 2a7k h SER 225 N 0.09 0.37 -0.40 0.00 0.02 -1.01 -2.30 113.55 110.33 2a7k h SER 225 Ca 0.01 0.07 -0.14 0.00 -0.84 0.00 0.00 61.79 60.90 2a7k h SER 225 Cb 0.86 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.41 2a7k h SER 225 CO 0.06 0.20 -0.29 0.11 -1.14 0.00 0.00 176.83 175.78 2a7k h LYS 226 N 0.52 0.89 0.00 3.45 1.57 -1.44 -2.76 116.57 118.80 2a7k h LYS 226 Ca 0.35 -0.43 -0.06 0.00 -1.87 0.00 0.00 60.65 58.64 2a7k h LYS 226 Cb 0.41 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 2a7k h LYS 226 CO -0.30 1.08 -0.29 0.00 -0.57 0.00 0.00 179.45 179.38 2a7k h ALA 227 N 0.79 1.40 0.04 3.86 0.00 -1.05 -2.85 119.26 121.44 2a7k h ALA 227 Ca 0.08 -0.26 -0.22 0.00 0.00 0.00 0.00 54.91 54.51 2a7k h ALA 227 Cb 0.87 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.63 2a7k h ALA 227 CO 0.08 0.36 -0.87 0.28 0.00 0.00 0.00 179.25 179.10 2a7k h VAL 228 N 0.00 1.37 0.00 0.00 2.07 -1.43 -3.30 116.25 114.97 2a7k h VAL 228 Ca -0.00 -2.24 -0.66 0.00 0.82 0.00 0.00 66.70 64.62 2a7k h VAL 228 Cb 0.55 2.62 0.03 0.00 -1.52 0.00 0.00 31.29 32.96 2a7k h VAL 228 CO 0.04 0.67 2.49 1.41 0.02 0.00 0.00 177.57 182.20 2a7k n HIS 229 N -4.03 2.21 0.00 1.57 -0.00 -1.04 -5.12 115.22 108.81 2a7k n HIS 229 Ca -0.12 -2.06 0.00 0.00 -0.00 0.00 0.00 57.72 55.54 2a7k n HIS 229 Cb 0.80 -1.89 0.00 0.00 -0.00 0.00 0.00 29.99 28.91 2a7k n HIS 229 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97