#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a4o n ASP 2 N 0.00 -2.35 -0.20 7.83 -0.08 -1.26 -4.83 116.55 115.66 1a4o n ASP 2 Ca 0.00 -0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1a4o n ASP 2 Cb 0.00 -1.26 0.09 0.00 2.34 0.00 0.00 41.12 42.30 1a4o n ASP 2 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 1a4o h LYS 3 N 0.03 0.13 0.00 -0.67 3.64 -1.98 -0.25 116.57 117.47 1a4o h LYS 3 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1a4o h LYS 3 Cb 0.96 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.75 1a4o h LYS 3 CO 0.02 0.08 0.00 0.09 -2.27 0.00 0.00 179.45 177.37 1a4o n ASN 4 N -5.25 0.00 -0.10 4.20 4.13 -1.26 -1.30 115.26 115.67 1a4o n ASN 4 Ca 0.08 -0.46 -0.13 0.00 1.68 0.00 0.00 54.58 55.75 1a4o n ASN 4 Cb 0.34 -0.08 -0.14 0.00 -1.54 0.00 0.00 39.78 38.35 1a4o n ASN 4 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 1a4o n GLU 5 N -1.08 0.67 0.08 3.52 2.13 -0.19 -2.91 120.64 122.86 1a4o n GLU 5 Ca 0.14 0.07 -0.01 0.00 0.66 0.00 0.00 57.16 58.02 1a4o n GLU 5 Cb 0.09 -1.54 0.27 0.00 0.27 0.00 0.00 31.44 30.53 1a4o n GLU 5 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1a4o h LEU 6 N 0.00 0.31 0.03 4.31 -0.00 -0.55 -0.18 115.31 119.23 1a4o h LEU 6 Ca -0.54 -0.10 -0.00 0.00 -0.00 0.00 0.00 57.88 57.23 1a4o h LEU 6 Cb 2.10 -0.08 0.00 0.00 -0.00 0.00 0.00 40.66 42.68 1a4o h LEU 6 CO -0.01 0.59 -0.01 0.58 -0.00 0.00 0.00 178.44 179.58 1a4o h VAL 7 N 0.28 1.37 0.00 1.22 2.07 -1.34 -2.02 116.25 117.83 1a4o h VAL 7 Ca 0.04 -1.33 0.00 0.00 0.82 0.00 0.00 66.70 66.23 1a4o h VAL 7 Cb 0.63 2.25 0.00 0.00 -1.52 0.00 0.00 31.29 32.65 1a4o h VAL 7 CO 0.05 0.33 0.00 0.00 0.02 0.00 0.00 177.57 177.97 1a4o n GLN 8 N -4.83 0.39 -0.07 1.57 3.00 -1.15 -2.18 117.38 114.11 1a4o n GLN 8 Ca -0.09 0.07 -0.22 0.00 -0.01 0.00 0.00 57.00 56.75 1a4o n GLN 8 Cb 0.29 -1.50 -0.12 0.00 0.00 0.00 0.00 30.24 28.91 1a4o n GLN 8 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.06 178.23 1a4o n LYS 9 N -1.18 0.63 -0.16 -1.09 0.00 -0.09 -3.61 118.16 112.67 1a4o n LYS 9 Ca 0.11 0.45 -0.07 0.00 0.00 0.00 0.00 58.31 58.80 1a4o n LYS 9 Cb 0.11 -1.72 0.01 0.00 0.00 0.00 0.00 35.03 33.43 1a4o n LYS 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1a4o h ALA 10 N -0.32 0.61 -0.05 3.14 0.00 -1.10 -1.37 119.26 120.17 1a4o h ALA 10 Ca -0.39 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.51 1a4o h ALA 10 Cb 1.57 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 19.12 1a4o h ALA 10 CO -0.12 0.07 -0.32 0.87 0.00 0.00 0.00 179.25 179.75 1a4o h LYS 11 N 0.64 -0.43 -0.67 0.00 1.57 -1.62 0.12 116.57 116.18 1a4o h LYS 11 Ca 0.17 0.03 0.14 0.00 -1.87 0.00 0.00 60.65 59.12 1a4o h LYS 11 Cb -0.04 0.10 -0.10 0.00 0.08 0.00 0.00 32.23 32.27 1a4o h LYS 11 CO -0.03 -0.28 0.14 1.25 -0.57 0.00 0.00 179.45 179.95 1a4o h LEU 12 N -0.44 -0.02 -0.68 2.94 5.85 -1.55 -0.30 115.31 121.11 1a4o h LEU 12 Ca 0.07 0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.97 1a4o h LEU 12 Cb 0.56 0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.72 1a4o h LEU 12 CO -0.30 -0.02 0.40 0.00 -0.34 0.00 0.00 178.44 178.18 1a4o h ALA 13 N 1.55 0.89 -0.67 1.25 0.00 -0.06 0.01 119.26 122.24 1a4o h ALA 13 Ca 0.36 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.19 1a4o h ALA 13 Cb 0.58 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1a4o h ALA 13 CO -0.46 0.12 0.10 1.49 0.00 0.00 0.00 179.25 180.49 1a4o h GLU 14 N 0.76 1.11 0.00 0.00 4.81 0.74 0.27 114.58 122.27 1a4o h GLU 14 Ca 0.29 -0.30 -0.05 0.00 -0.13 0.00 0.00 59.36 59.17 1a4o h GLU 14 Cb 0.11 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1a4o h GLU 14 CO -0.14 1.02 -0.23 1.96 -0.73 0.00 0.00 179.01 180.89 1a4o h GLN 15 N 1.04 0.00 -0.03 1.92 4.20 -0.38 -1.17 115.11 120.69 1a4o h GLN 15 Ca 0.20 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.91 1a4o h GLN 15 Cb 0.45 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1a4o h GLN 15 CO 0.01 0.23 0.00 0.00 -0.67 0.00 0.00 178.83 178.40 1a4o n ALA 16 N -2.40 2.54 0.00 3.87 0.00 -0.08 -4.98 120.51 119.46 1a4o n ALA 16 Ca -0.02 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 52.89 1a4o n ALA 16 Cb 0.31 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.71 1a4o n ALA 16 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1a4o n GLU 17 N 0.56 0.00 -1.70 0.00 0.00 0.88 -4.95 120.64 115.43 1a4o n GLU 17 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 57.16 56.99 1a4o n GLU 17 Cb 0.43 -1.20 -0.03 0.00 0.00 0.00 0.00 31.44 30.64 1a4o n GLU 17 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 1a4o s ARG 18 N 0.00 2.20 0.12 5.31 0.52 -0.82 -4.81 118.95 121.46 1a4o s ARG 18 Ca 0.00 1.05 -0.01 0.00 -0.52 0.00 0.00 55.73 56.26 1a4o s ARG 18 Cb 0.00 -4.57 -0.16 0.00 0.52 0.00 0.00 34.95 30.74 1a4o s ARG 18 CO 0.00 -3.26 1.26 1.88 0.02 0.00 0.00 175.30 175.20 1a4o h TYR 19 N 17.49 0.38 0.00 -0.53 0.05 -1.93 -2.88 116.97 129.56 1a4o h TYR 19 Ca -0.21 -0.24 -0.01 0.00 0.05 0.00 0.00 58.73 58.32 1a4o h TYR 19 Cb 1.21 -0.03 -0.00 0.00 1.01 0.00 0.00 36.73 38.92 1a4o h TYR 19 CO 1.01 1.13 -0.03 -0.44 -1.05 0.00 0.00 178.16 178.77 1a4o h ASP 20 N 0.10 0.00 0.01 3.88 3.32 -1.89 0.12 116.42 121.96 1a4o h ASP 20 Ca -0.08 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.84 1a4o h ASP 20 Cb 1.74 0.00 0.01 0.00 0.22 0.00 0.00 39.33 41.30 1a4o h ASP 20 CO 0.17 0.03 -0.52 0.44 -1.72 0.00 0.00 179.24 177.63 1a4o h ASP 21 N 0.00 0.43 -0.11 6.45 5.19 -1.95 -3.02 116.42 123.42 1a4o h ASP 21 Ca -0.00 -0.79 -0.00 0.00 -0.62 0.00 0.00 57.03 55.62 1a4o h ASP 21 Cb 0.07 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.44 1a4o h ASP 21 CO 0.00 1.17 0.06 -0.03 -3.12 0.00 0.00 179.24 177.33 1a4o h MET 22 N -0.25 0.14 0.00 3.56 4.05 -1.05 -1.23 114.93 120.15 1a4o h MET 22 Ca -0.07 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.33 1a4o h MET 22 Cb 1.27 -0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 32.04 1a4o h MET 22 CO 0.10 0.15 -0.03 0.00 0.23 0.00 0.00 176.91 177.36 1a4o h ALA 23 N 0.98 1.29 0.01 0.39 0.00 -0.94 -0.95 119.26 120.04 1a4o h ALA 23 Ca 0.04 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1a4o h ALA 23 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1a4o h ALA 23 CO -0.01 0.04 -0.21 0.00 0.00 0.00 0.00 179.25 179.07 1a4o h ALA 24 N 1.97 0.01 -0.42 0.00 0.00 -1.22 -2.45 119.26 117.14 1a4o h ALA 24 Ca -0.00 -0.48 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 1a4o h ALA 24 Cb 0.13 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1a4o h ALA 24 CO 0.00 0.06 -0.08 0.00 0.00 0.00 0.00 179.25 179.24 1a4o h MET 26 N 0.66 0.00 0.19 0.00 2.86 -1.28 -1.83 114.93 115.54 1a4o h MET 26 Ca 0.12 0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 57.45 1a4o h MET 26 Cb 0.52 0.00 0.03 0.00 0.06 0.00 0.00 31.60 32.21 1a4o h MET 26 CO 0.03 0.16 -1.37 -0.22 1.06 0.00 0.00 176.91 176.57 1a4o h LYS 27 N 0.00 0.48 -0.09 1.72 3.64 -1.18 -2.33 116.57 118.81 1a4o h LYS 27 Ca -0.00 -0.78 -0.00 0.00 -1.27 0.00 0.00 60.65 58.60 1a4o h LYS 27 Cb 0.79 0.28 -0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1a4o h LYS 27 CO 0.02 1.37 0.05 1.03 -2.27 0.00 0.00 179.45 179.65 1a4o h SER 28 N 0.15 0.11 -0.41 4.20 0.87 -1.22 -2.46 113.55 114.79 1a4o h SER 28 Ca -0.21 -0.07 0.03 0.00 -1.23 0.00 0.00 61.79 60.31 1a4o h SER 28 Cb 2.06 -0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 63.96 1a4o h SER 28 CO 0.25 0.15 0.20 0.58 -0.53 0.00 0.00 176.83 177.48 1a4o h VAL 29 N 0.07 0.96 0.00 2.23 2.07 -1.41 -2.64 116.25 117.53 1a4o h VAL 29 Ca 0.03 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 1a4o h VAL 29 Cb 0.06 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 30.35 1a4o h VAL 29 CO -0.01 0.07 -0.10 0.00 0.02 0.00 0.00 177.57 177.56 1a4o h THR 30 N 0.41 1.00 -0.81 2.57 1.03 -1.21 -2.78 112.91 113.11 1a4o h THR 30 Ca 0.18 -0.33 -0.52 0.00 -0.01 0.00 0.00 66.41 65.72 1a4o h THR 30 Cb 0.09 1.18 -0.24 0.00 -1.07 0.00 0.00 68.15 68.12 1a4o h THR 30 CO -0.13 0.09 0.67 -1.84 -0.01 0.00 0.00 175.52 174.31 1a4o n GLU 31 N -4.32 2.29 0.00 0.00 0.28 -0.94 -4.42 120.64 113.53 1a4o n GLU 31 Ca -0.03 -2.62 0.00 0.00 -0.16 0.00 0.00 57.16 54.35 1a4o n GLU 31 Cb 0.17 -2.03 0.00 0.00 1.43 0.00 0.00 31.44 31.02 1a4o n GLU 31 CO 0.00 0.00 0.00 0.94 -0.16 0.00 0.00 177.13 177.91 1a4o n GLN 32 N -0.55 1.08 -3.28 3.44 -0.06 -1.05 -5.00 117.38 111.96 1a4o n GLN 32 Ca 0.51 0.00 -0.43 0.00 -2.00 0.00 0.00 57.00 55.07 1a4o n GLN 32 Cb 0.82 0.00 -0.08 0.00 -4.06 0.00 0.00 30.24 26.92 1a4o n GLN 32 CO 0.00 0.00 0.00 0.20 -0.20 0.00 0.00 177.06 177.06 1a4o s GLY 33 N 0.00 1.88 0.00 1.69 0.00 -1.26 -5.05 107.32 104.57 1a4o s GLY 33 Ca 0.00 -1.62 0.00 0.00 0.00 0.00 0.00 44.72 43.10 1a4o s GLY 33 CO 0.00 1.23 0.00 0.00 0.00 0.00 0.00 173.10 174.33 1a4o n ALA 34 N 5.70 0.00 -2.32 3.20 0.00 -1.26 -4.92 120.51 120.91 1a4o n ALA 34 Ca -0.07 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.33 1a4o n ALA 34 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.92 1a4o n ALA 34 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1a4o n GLU 35 N 0.00 -1.61 -2.67 0.00 4.07 -1.26 -4.90 120.64 114.26 1a4o n GLU 35 Ca 0.00 1.59 -0.42 0.00 -0.06 0.00 0.00 57.16 58.27 1a4o n GLU 35 Cb 0.00 -4.02 -0.03 0.00 -0.06 0.00 0.00 31.44 27.33 1a4o n GLU 35 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1a4o s LEU 36 N -1.80 3.66 0.07 4.31 1.02 -1.26 -4.98 118.68 119.70 1a4o s LEU 36 Ca 0.12 -0.66 -0.28 0.00 0.02 0.00 0.00 54.13 53.33 1a4o s LEU 36 Cb -0.03 -2.51 -0.15 0.00 0.02 0.00 0.00 46.19 43.51 1a4o s LEU 36 CO 0.48 -1.67 0.68 -0.24 0.02 0.00 0.00 176.35 175.61 1a4o n SER 37 N 8.69 -0.46 -0.25 2.29 2.88 -1.26 -3.73 113.62 121.78 1a4o n SER 37 Ca 0.00 0.94 0.25 0.00 -1.33 0.00 0.00 58.87 58.73 1a4o n SER 37 Cb 0.48 -0.77 0.45 0.00 -0.75 0.00 0.00 64.21 63.62 1a4o n SER 37 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1a4o n ASN 38 N 1.42 0.26 0.16 -3.46 4.13 -1.26 0.10 115.26 116.60 1a4o n ASN 38 Ca 0.16 1.24 -0.14 0.00 1.68 0.00 0.00 54.58 57.52 1a4o n ASN 38 Cb 0.13 -0.61 -0.08 0.00 -1.54 0.00 0.00 39.78 37.68 1a4o n ASN 38 CO 0.00 0.00 0.00 -0.08 0.28 0.00 0.00 177.26 177.46 1a4o h GLU 39 N 0.00 -0.38 -0.42 3.52 4.81 -2.01 -2.84 114.58 117.26 1a4o h GLU 39 Ca 0.64 0.03 0.09 0.00 -0.13 0.00 0.00 59.36 59.99 1a4o h GLU 39 Cb 1.73 0.09 -0.08 0.00 0.63 0.00 0.00 28.75 31.11 1a4o h GLU 39 CO -0.57 -0.10 -0.12 0.93 -0.73 0.00 0.00 179.01 178.43 1a4o h GLU 40 N -0.67 -0.02 -0.89 1.92 5.08 -0.61 0.16 114.58 119.55 1a4o h GLU 40 Ca -0.04 0.00 0.17 0.00 -1.00 0.00 0.00 59.36 58.49 1a4o h GLU 40 Cb 0.47 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.62 1a4o h GLU 40 CO 0.07 -0.01 0.46 -0.09 -1.00 0.00 0.00 179.01 178.44 1a4o h ARG 41 N -0.02 0.58 0.04 2.33 2.43 -1.25 0.83 114.38 119.32 1a4o h ARG 41 Ca 0.21 -0.03 -0.17 0.00 -0.81 0.00 0.00 59.98 59.17 1a4o h ARG 41 Cb 0.33 -0.13 0.02 0.00 -0.42 0.00 0.00 29.97 29.76 1a4o h ARG 41 CO -0.45 0.38 -0.69 -0.97 -1.51 0.00 0.00 179.97 176.74 1a4o h ASN 42 N 0.60 0.54 -1.00 -3.80 -0.73 -1.16 -3.12 115.58 106.90 1a4o h ASN 42 Ca 0.51 -0.80 0.23 0.00 1.87 0.00 0.00 56.30 58.10 1a4o h ASN 42 Cb 0.80 -0.17 -0.10 0.00 0.27 0.00 0.00 38.32 39.12 1a4o h ASN 42 CO -0.41 1.28 0.63 -0.07 -0.37 0.00 0.00 177.43 178.50 1a4o h LEU 43 N -0.13 0.60 0.74 0.34 4.07 -0.11 0.23 115.31 121.04 1a4o h LEU 43 Ca -0.10 0.09 -0.04 0.00 0.08 0.00 0.00 57.88 57.92 1a4o h LEU 43 Cb 1.42 -0.01 0.01 0.00 1.08 0.00 0.00 40.66 43.16 1a4o h LEU 43 CO 0.13 0.16 -0.35 0.25 -1.08 0.00 0.00 178.44 177.55 1a4o h LEU 44 N 0.56 -0.84 -1.50 1.67 5.85 -0.86 -1.70 115.31 118.49 1a4o h LEU 44 Ca 0.58 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 59.30 1a4o h LEU 44 Cb 1.20 0.22 -0.02 0.00 0.37 0.00 0.00 40.66 42.43 1a4o h LEU 44 CO -0.35 -0.55 0.16 0.28 -0.34 0.00 0.00 178.44 177.65 1a4o h SER 45 N -1.08 0.44 -0.13 1.25 0.02 -1.09 -1.81 113.55 111.15 1a4o h SER 45 Ca -0.10 -0.04 -0.17 0.00 -0.84 0.00 0.00 61.79 60.64 1a4o h SER 45 Cb 0.78 -0.11 0.01 0.00 0.14 0.00 0.00 62.40 63.21 1a4o h SER 45 CO 0.17 0.39 -0.58 1.62 -1.14 0.00 0.00 176.83 177.29 1a4o h VAL 46 N 0.50 1.33 0.27 2.27 3.04 -0.60 -2.44 116.25 120.62 1a4o h VAL 46 Ca 0.13 -1.85 -0.01 0.00 -1.01 0.00 0.00 66.70 63.95 1a4o h VAL 46 Cb 0.08 2.10 0.00 0.00 -2.01 0.00 0.00 31.29 31.46 1a4o h VAL 46 CO -0.02 0.57 -0.13 0.00 -1.01 0.00 0.00 177.57 176.98 1a4o h ALA 47 N 0.51 -0.37 -0.29 3.17 0.00 -1.19 -2.66 119.26 118.43 1a4o h ALA 47 Ca -0.04 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.69 1a4o h ALA 47 Cb 1.22 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 1a4o h ALA 47 CO 0.12 -0.47 0.19 1.88 0.00 0.00 0.00 179.25 180.97 1a4o h TYR 48 N -0.83 0.34 -0.04 0.00 0.05 -1.46 -2.44 116.97 112.60 1a4o h TYR 48 Ca -0.04 0.01 -0.22 0.00 0.05 0.00 0.00 58.73 58.53 1a4o h TYR 48 Cb 0.51 -0.12 0.00 0.00 1.01 0.00 0.00 36.73 38.14 1a4o h TYR 48 CO 0.04 0.21 -0.88 1.57 -1.05 0.00 0.00 178.16 178.06 1a4o h LYS 49 N 0.37 0.47 -0.30 4.88 2.10 -1.48 -0.10 116.57 122.50 1a4o h LYS 49 Ca 0.11 -0.46 -0.04 0.00 -2.00 0.00 0.00 60.65 58.26 1a4o h LYS 49 Cb 0.00 0.12 -0.02 0.00 -0.90 0.00 0.00 32.23 31.43 1a4o h LYS 49 CO -0.02 1.10 0.01 -0.91 -2.00 0.00 0.00 179.45 177.63 1a4o h ASN 50 N 0.29 0.42 0.11 7.07 2.35 -1.12 -1.12 115.58 123.57 1a4o h ASN 50 Ca -0.07 -0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.61 1a4o h ASN 50 Cb 1.50 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 39.76 1a4o h ASN 50 CO 0.16 0.48 -0.05 0.58 -1.65 0.00 0.00 177.43 176.95 1a4o h VAL 51 N 0.44 0.00 0.23 2.81 2.07 -1.34 -3.20 116.25 117.26 1a4o h VAL 51 Ca 0.10 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.35 1a4o h VAL 51 Cb 0.28 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.01 1a4o h VAL 51 CO 0.01 0.00 -0.36 1.62 0.02 0.00 0.00 177.57 178.86 1a4o h VAL 52 N -0.42 0.25 -1.08 2.57 3.04 -1.07 -2.55 116.25 116.99 1a4o h VAL 52 Ca -0.01 0.00 0.29 0.00 -1.01 0.00 0.00 66.70 65.97 1a4o h VAL 52 Cb 0.11 0.25 -0.10 0.00 -2.01 0.00 0.00 31.29 29.55 1a4o h VAL 52 CO 0.02 0.00 0.69 1.23 -1.01 0.00 0.00 177.57 178.51 1a4o h GLY 53 N -0.66 1.21 0.81 3.17 0.00 -1.39 0.39 103.07 106.60 1a4o h GLY 53 Ca 0.00 -0.19 0.02 0.00 0.00 0.00 0.00 47.33 47.17 1a4o h GLY 53 CO -0.14 -0.18 0.03 0.00 0.00 0.00 0.00 176.54 176.26 1a4o h ALA 54 N 1.62 0.17 -0.40 3.60 0.00 -1.45 0.67 119.26 123.47 1a4o h ALA 54 Ca 0.63 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 55.45 1a4o h ALA 54 Cb 1.67 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.48 1a4o h ALA 54 CO -0.31 -0.40 -0.21 0.00 0.00 0.00 0.00 179.25 178.33 1a4o h ARG 55 N 0.11 0.79 -0.34 0.00 -0.00 -0.97 -1.12 114.38 112.84 1a4o h ARG 55 Ca 0.08 -0.31 0.05 0.00 -0.50 0.00 0.00 59.98 59.29 1a4o h ARG 55 Cb 0.07 -0.04 -0.02 0.00 0.00 0.00 0.00 29.97 29.98 1a4o h ARG 55 CO -0.10 0.93 0.23 0.00 0.00 0.00 0.00 179.97 181.03 1a4o h ARG 56 N 0.69 0.25 0.09 0.04 3.08 -0.50 0.20 114.38 118.22 1a4o h ARG 56 Ca 0.10 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 1a4o h ARG 56 Cb 0.72 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.71 1a4o h ARG 56 CO 0.06 0.17 -0.04 1.03 -1.07 0.00 0.00 179.97 180.11 1a4o h SER 57 N 0.26 -0.10 -0.42 7.04 0.87 -0.33 -2.82 113.55 118.05 1a4o h SER 57 Ca 0.15 -0.42 0.09 0.00 -1.23 0.00 0.00 61.79 60.37 1a4o h SER 57 Cb 0.26 0.03 -0.08 0.00 -0.44 0.00 0.00 62.40 62.16 1a4o h SER 57 CO -0.03 0.56 -0.12 0.28 -0.53 0.00 0.00 176.83 176.99 1a4o h SER 58 N -0.94 -0.43 -0.92 6.23 0.02 -0.94 0.57 113.55 117.14 1a4o h SER 58 Ca -0.01 0.13 0.10 0.00 -0.84 0.00 0.00 61.79 61.17 1a4o h SER 58 Cb 0.51 0.28 -0.07 0.00 0.14 0.00 0.00 62.40 63.26 1a4o h SER 58 CO 0.02 -0.15 0.59 -0.25 -1.14 0.00 0.00 176.83 175.90 1a4o h TRP 59 N -0.01 1.00 0.89 3.45 7.01 -0.74 0.42 115.95 127.97 1a4o h TRP 59 Ca 0.20 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.19 1a4o h TRP 59 Cb 0.33 -0.32 0.01 0.00 -2.10 0.00 0.00 29.16 27.07 1a4o h TRP 59 CO -0.38 0.44 -0.43 0.00 -2.79 0.00 0.00 178.44 175.28 1a4o h ARG 60 N 0.91 -1.16 -0.18 2.65 3.08 -0.64 -2.47 114.38 116.58 1a4o h ARG 60 Ca 0.43 0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.56 1a4o h ARG 60 Cb 0.43 0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.74 1a4o h ARG 60 CO -0.20 -0.77 0.11 -0.24 -1.07 0.00 0.00 179.97 177.80 1a4o h VAL 61 N -1.22 1.09 0.00 2.04 3.04 -1.09 -1.33 116.25 118.78 1a4o h VAL 61 Ca -0.12 -0.22 -0.01 0.00 -1.01 0.00 0.00 66.70 65.33 1a4o h VAL 61 Cb 0.92 0.91 -0.00 0.00 -2.01 0.00 0.00 31.29 31.11 1a4o h VAL 61 CO 0.20 0.08 -0.04 1.62 -1.01 0.00 0.00 177.57 178.42 1a4o h VAL 62 N 0.21 0.33 0.13 1.51 3.04 -0.99 -0.83 116.25 119.64 1a4o h VAL 62 Ca 0.06 -0.23 -0.28 0.00 -1.01 0.00 0.00 66.70 65.24 1a4o h VAL 62 Cb 0.04 1.17 0.00 0.00 -2.01 0.00 0.00 31.29 30.49 1a4o h VAL 62 CO -0.01 0.04 -1.28 0.28 -1.01 0.00 0.00 177.57 175.59 1a4o h SER 63 N 0.00 0.42 -0.84 3.17 0.02 -0.98 -0.60 113.55 114.73 1a4o h SER 63 Ca -0.00 -0.46 -0.03 0.00 -0.84 0.00 0.00 61.79 60.46 1a4o h SER 63 Cb 0.17 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 62.53 1a4o h SER 63 CO 0.01 1.37 0.42 0.77 -1.14 0.00 0.00 176.83 178.25 1a4o h SER 64 N 0.07 1.08 1.42 3.07 4.64 -0.04 -1.33 113.55 122.47 1a4o h SER 64 Ca -0.15 -0.12 -0.06 0.00 -0.47 0.00 0.00 61.79 60.99 1a4o h SER 64 Cb 1.98 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 63.78 1a4o h SER 64 CO 0.20 0.90 -0.30 0.40 -0.87 0.00 0.00 176.83 177.16 1a4o h ILE 65 N 1.19 0.56 -0.07 0.95 2.04 -1.32 -2.67 117.51 118.20 1a4o h ILE 65 Ca 0.29 -1.58 -0.14 0.00 1.00 0.00 0.00 64.86 64.43 1a4o h ILE 65 Cb 0.09 2.11 -0.01 0.00 -0.74 0.00 0.00 36.82 38.26 1a4o h ILE 65 CO -0.04 0.29 -0.60 -0.08 0.00 0.00 0.00 178.15 177.72 1a4o h GLU 66 N 0.00 0.22 0.01 2.37 4.81 0.02 -3.28 114.58 118.73 1a4o h GLU 66 Ca -0.00 -0.15 -0.05 0.00 -0.13 0.00 0.00 59.36 59.03 1a4o h GLU 66 Cb 1.09 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.49 1a4o h GLU 66 CO 0.04 0.75 -0.19 0.37 -0.73 0.00 0.00 179.01 179.25 1a4o h GLN 67 N 0.16 0.11 -3.87 1.92 -0.00 -1.33 -3.44 115.11 108.67 1a4o h GLN 67 Ca -0.01 -0.13 -0.77 0.00 -0.00 0.00 0.00 58.65 57.74 1a4o h GLN 67 Cb 1.09 0.04 -0.20 0.00 0.00 0.00 0.00 27.48 28.41 1a4o h GLN 67 CO 0.09 0.92 1.31 1.63 0.00 0.00 0.00 178.83 182.79 1a4o n LYS 68 N -4.54 3.66 -0.09 1.69 5.02 -1.01 -5.12 118.16 117.76 1a4o n LYS 68 Ca -0.10 -3.98 -0.14 0.00 -2.02 0.00 0.00 58.31 52.08 1a4o n LYS 68 Cb 0.49 -2.83 -0.07 0.00 -0.02 0.00 0.00 35.03 32.60 1a4o n LYS 68 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1a4o n GLU 73 N 3.87 0.51 -0.08 1.97 0.00 -1.26 -4.58 120.64 121.08 1a4o n GLU 73 Ca 0.34 0.55 -0.05 0.00 0.00 0.00 0.00 57.16 58.00 1a4o n GLU 73 Cb 0.39 -1.72 0.15 0.00 0.00 0.00 0.00 31.44 30.26 1a4o n GLU 73 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 1a4o h LYS 74 N -1.00 0.72 0.00 5.31 3.64 -2.00 0.43 116.57 123.67 1a4o h LYS 74 Ca -0.19 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 1a4o h LYS 74 Cb 0.93 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 1a4o h LYS 74 CO -0.12 0.81 0.00 1.17 -2.27 0.00 0.00 179.45 179.04 1a4o n LYS 75 N -4.17 0.12 -0.08 1.90 4.81 -1.26 -0.93 118.16 118.54 1a4o n LYS 75 Ca 0.01 0.52 -0.07 0.00 -0.87 0.00 0.00 58.31 57.90 1a4o n LYS 75 Cb 0.35 -1.81 -0.16 0.00 0.02 0.00 0.00 35.03 33.44 1a4o n LYS 75 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1a4o n GLN 76 N -2.05 0.68 -0.10 1.64 7.27 0.75 -2.74 117.38 122.83 1a4o n GLN 76 Ca 0.00 -0.01 -0.12 0.00 0.07 0.00 0.00 57.00 56.94 1a4o n GLN 76 Cb 0.10 -1.54 -0.04 0.00 2.41 0.00 0.00 30.24 31.16 1a4o n GLN 76 CO 0.00 0.00 0.00 0.37 0.07 0.00 0.00 177.06 177.50 1a4o h GLN 77 N 0.00 0.62 0.00 3.69 -0.00 0.14 0.55 115.11 120.11 1a4o h GLN 77 Ca -0.45 -0.28 -0.09 0.00 -0.00 0.00 0.00 58.65 57.83 1a4o h GLN 77 Cb 2.06 -0.01 -0.01 0.00 0.00 0.00 0.00 27.48 29.51 1a4o h GLN 77 CO 0.03 0.86 -0.42 0.00 0.00 0.00 0.00 178.83 179.30 1a4o h MET 78 N 0.37 0.00 0.03 1.69 -0.00 -1.21 0.40 114.93 116.21 1a4o h MET 78 Ca 0.06 0.00 -0.26 0.00 -0.00 0.00 0.00 59.70 59.51 1a4o h MET 78 Cb 0.68 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 32.26 1a4o h MET 78 CO 0.05 0.42 -1.32 0.00 -0.00 0.00 0.00 176.91 176.06 1a4o h ALA 79 N 1.58 0.44 -0.29 -3.00 0.00 -1.30 -2.78 119.26 113.91 1a4o h ALA 79 Ca -0.00 -1.11 -0.15 0.00 0.00 0.00 0.00 54.91 53.65 1a4o h ALA 79 Cb 0.80 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 1a4o h ALA 79 CO 0.05 1.31 -0.39 -0.09 0.00 0.00 0.00 179.25 180.13 1a4o h ARG 80 N 0.02 0.77 -0.27 0.00 2.43 0.31 -1.89 114.38 115.75 1a4o h ARG 80 Ca -0.14 -0.45 0.05 0.00 -0.81 0.00 0.00 59.98 58.63 1a4o h ARG 80 Cb 1.90 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 31.44 1a4o h ARG 80 CO 0.13 1.07 -0.00 1.49 -1.51 0.00 0.00 179.97 181.14 1a4o h GLU 81 N 0.52 0.07 -0.12 0.20 4.81 -0.98 -0.67 114.58 118.42 1a4o h GLU 81 Ca 0.03 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.23 1a4o h GLU 81 Cb 0.98 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.34 1a4o h GLU 81 CO 0.09 0.05 -0.05 -0.92 -0.73 0.00 0.00 179.01 177.45 1a4o h TYR 82 N 0.08 0.28 -0.22 0.92 3.20 -1.50 -3.13 116.97 116.60 1a4o h TYR 82 Ca 0.13 -0.07 0.06 0.00 3.14 0.00 0.00 58.73 62.00 1a4o h TYR 82 Cb 0.17 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 1a4o h TYR 82 CO -0.21 0.58 0.17 -0.09 -1.64 0.00 0.00 178.16 176.96 1a4o h ARG 83 N -0.10 0.00 -0.09 1.82 1.12 -1.15 -0.11 114.38 115.88 1a4o h ARG 83 Ca 0.03 0.00 -0.14 0.00 -1.11 0.00 0.00 59.98 58.76 1a4o h ARG 83 Cb 0.50 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.45 1a4o h ARG 83 CO 0.02 0.00 -0.55 1.49 -3.11 0.00 0.00 179.97 177.82 1a4o h GLU 84 N 0.00 0.25 0.20 0.20 4.81 -1.10 -2.19 114.58 116.76 1a4o h GLU 84 Ca 0.10 -0.16 -0.32 0.00 -0.13 0.00 0.00 59.36 58.86 1a4o h GLU 84 Cb 0.43 0.02 0.03 0.00 0.63 0.00 0.00 28.75 29.86 1a4o h GLU 84 CO -0.00 0.73 -1.38 -0.22 -0.73 0.00 0.00 179.01 177.41 1a4o h LYS 85 N 0.19 0.53 0.00 1.92 3.64 -1.03 -2.95 116.57 118.88 1a4o h LYS 85 Ca 0.00 -0.84 0.00 0.00 -1.27 0.00 0.00 60.65 58.54 1a4o h LYS 85 Cb 1.03 0.30 0.00 0.00 -0.41 0.00 0.00 32.23 33.15 1a4o h LYS 85 CO 0.09 1.39 0.00 -0.89 -2.27 0.00 0.00 179.45 177.77 1a4o n ILE 86 N -3.71 0.43 -0.00 2.00 5.41 -0.41 -2.47 119.36 120.61 1a4o n ILE 86 Ca -0.15 -0.16 -0.08 0.00 1.00 0.00 0.00 62.75 63.37 1a4o n ILE 86 Cb 1.06 -0.59 -0.13 0.00 -0.71 0.00 0.00 39.64 39.26 1a4o n ILE 86 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 1a4o h GLU 87 N 0.00 0.00 -0.04 0.38 4.81 -1.44 -3.16 114.58 115.14 1a4o h GLU 87 Ca 0.00 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 1a4o h GLU 87 Cb 0.63 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.02 1a4o h GLU 87 CO 0.00 0.58 -0.13 1.15 -0.73 0.00 0.00 179.01 179.88 1a4o h THR 88 N 0.00 1.47 -0.76 0.32 2.02 -1.41 0.22 112.91 114.77 1a4o h THR 88 Ca -0.22 -1.58 0.07 0.00 0.77 0.00 0.00 66.41 65.45 1a4o h THR 88 Cb 1.94 2.41 -0.05 0.00 -1.74 0.00 0.00 68.15 70.71 1a4o h THR 88 CO 0.09 0.43 0.50 -0.33 0.37 0.00 0.00 175.52 176.57 1a4o h GLU 89 N -0.41 0.75 0.35 6.66 5.08 -1.62 0.23 114.58 125.63 1a4o h GLU 89 Ca -0.01 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1a4o h GLU 89 Cb 0.77 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1a4o h GLU 89 CO 0.03 0.50 -0.17 1.25 -1.00 0.00 0.00 179.01 179.62 1a4o h LEU 90 N 0.77 -0.40 -0.92 1.33 5.85 -1.50 -3.06 115.31 117.38 1a4o h LEU 90 Ca 0.33 -0.15 0.11 0.00 0.84 0.00 0.00 57.88 59.01 1a4o h LEU 90 Cb 0.29 0.10 -0.08 0.00 0.37 0.00 0.00 40.66 41.35 1a4o h LEU 90 CO -0.11 0.00 0.56 -0.09 -0.34 0.00 0.00 178.44 178.45 1a4o h ARG 91 N -0.89 0.87 0.00 1.25 9.65 -0.01 -0.53 114.38 124.72 1a4o h ARG 91 Ca -0.05 -0.05 -0.01 0.00 -1.10 0.00 0.00 59.98 58.77 1a4o h ARG 91 Cb 0.53 -0.20 -0.00 0.00 -1.39 0.00 0.00 29.97 28.92 1a4o h ARG 91 CO 0.08 0.57 -0.04 -0.44 2.80 0.00 0.00 179.97 182.94 1a4o h ASP 92 N 0.89 0.00 0.08 -3.80 3.32 -0.99 -1.49 116.42 114.44 1a4o h ASP 92 Ca 0.46 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.37 1a4o h ASP 92 Cb 0.45 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.00 1a4o h ASP 92 CO -0.26 0.04 -0.63 0.40 -1.72 0.00 0.00 179.24 177.07 1a4o h ILE 93 N 0.00 1.52 -0.76 0.35 1.08 -1.00 -2.27 117.51 116.44 1a4o h ILE 93 Ca -0.00 -2.44 0.03 0.00 -0.39 0.00 0.00 64.86 62.06 1a4o h ILE 93 Cb 0.11 3.16 -0.04 0.00 -3.07 0.00 0.00 36.82 36.98 1a4o h ILE 93 CO 0.01 0.66 0.50 0.00 -0.69 0.00 0.00 178.15 178.62 1a4o h ASN 95 N 0.94 0.25 -0.49 0.00 2.35 -1.39 0.17 115.58 117.41 1a4o h ASN 95 Ca 0.30 -0.58 0.10 0.00 -0.55 0.00 0.00 56.30 55.57 1a4o h ASN 95 Cb 0.02 -0.07 -0.10 0.00 0.05 0.00 0.00 38.32 38.22 1a4o h ASN 95 CO -0.08 0.78 -0.18 -0.78 -1.65 0.00 0.00 177.43 175.52 1a4o h ASP 96 N -0.27 -0.62 0.21 5.81 3.58 -1.02 -1.64 116.42 122.45 1a4o h ASP 96 Ca -0.00 0.17 -0.29 0.00 0.42 0.00 0.00 57.03 57.33 1a4o h ASP 96 Cb 0.75 0.37 0.03 0.00 1.72 0.00 0.00 39.33 42.19 1a4o h ASP 96 CO 0.03 -0.21 -1.28 1.62 -2.88 0.00 0.00 179.24 176.52 1a4o h VAL 97 N -0.06 1.32 -0.73 2.25 3.04 -0.98 -3.20 116.25 117.88 1a4o h VAL 97 Ca 0.24 -2.61 0.15 0.00 -1.01 0.00 0.00 66.70 63.46 1a4o h VAL 97 Cb 0.43 3.06 -0.10 0.00 -2.01 0.00 0.00 31.29 32.66 1a4o h VAL 97 CO -0.54 0.78 0.21 -0.07 -1.01 0.00 0.00 177.57 176.94 1a4o h LEU 98 N -0.06 0.09 0.13 3.16 4.07 -0.46 0.06 115.31 122.31 1a4o h LEU 98 Ca -0.23 0.13 -0.01 0.00 0.08 0.00 0.00 57.88 57.86 1a4o h LEU 98 Cb 1.97 0.16 0.00 0.00 1.08 0.00 0.00 40.66 43.87 1a4o h LEU 98 CO 0.22 0.01 -0.06 -1.28 -1.08 0.00 0.00 178.44 176.24 1a4o h SER 99 N 0.32 -0.15 -0.91 -0.43 0.87 -1.41 -2.29 113.55 109.55 1a4o h SER 99 Ca 0.41 -0.04 0.22 0.00 -1.23 0.00 0.00 61.79 61.14 1a4o h SER 99 Cb 0.67 0.04 -0.12 0.00 -0.44 0.00 0.00 62.40 62.54 1a4o h SER 99 CO -0.47 -0.05 0.43 -0.07 -0.53 0.00 0.00 176.83 176.14 1a4o h LEU 100 N -0.23 0.40 0.00 2.23 4.07 -1.05 0.35 115.31 121.08 1a4o h LEU 100 Ca -0.02 0.15 0.00 0.00 0.08 0.00 0.00 57.88 58.09 1a4o h LEU 100 Cb 0.18 0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.03 1a4o h LEU 100 CO 0.03 0.04 0.00 0.18 -1.08 0.00 0.00 178.44 177.61 1a4o n LEU 101 N -5.00 0.26 -0.33 1.67 4.32 -0.26 -1.33 117.00 116.33 1a4o n LEU 101 Ca 0.22 0.70 0.07 0.00 -0.02 0.00 0.00 56.01 56.98 1a4o n LEU 101 Cb 0.65 -0.31 0.23 0.00 -1.62 0.00 0.00 43.42 42.36 1a4o n LEU 101 CO 0.14 -0.31 1.17 -0.33 -1.22 0.00 0.00 177.39 176.84 1a4o h GLU 102 N 0.00 0.80 0.00 3.23 5.08 -1.35 0.99 114.58 123.33 1a4o h GLU 102 Ca 0.00 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1a4o h GLU 102 Cb 0.00 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.07 1a4o h GLU 102 CO 0.00 0.53 -0.08 0.87 -1.00 0.00 0.00 179.01 179.33 1a4o h LYS 103 N 0.82 0.00 0.00 2.33 6.56 -0.42 -3.41 116.57 122.45 1a4o h LYS 103 Ca 0.48 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.07 1a4o h LYS 103 Cb 0.55 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.21 1a4o h LYS 103 CO -0.30 0.04 0.00 1.19 -2.06 0.00 0.00 179.45 178.32 1a4o n PHE 104 N -3.09 -0.00 0.00 -1.35 3.01 -0.54 -5.00 117.46 110.49 1a4o n PHE 104 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.50 1a4o n PHE 104 Cb 0.55 0.01 0.00 0.00 -0.01 0.00 0.00 39.48 40.02 1a4o n PHE 104 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1a4o n LEU 105 N -1.51 0.66 -0.32 4.37 7.99 -0.22 -3.87 117.00 124.11 1a4o n LEU 105 Ca 0.00 0.43 0.27 0.00 -0.01 0.00 0.00 56.01 56.70 1a4o n LEU 105 Cb 0.00 -0.38 0.60 0.00 -0.11 0.00 0.00 43.42 43.53 1a4o n LEU 105 CO 0.00 -0.38 1.25 0.16 -1.51 0.00 0.00 177.39 176.92 1a4o h ILE 106 N 0.00 0.48 -0.13 -0.08 3.07 -1.16 0.15 117.51 119.85 1a4o h ILE 106 Ca 0.00 -0.08 0.00 0.00 1.55 0.00 0.00 64.86 66.33 1a4o h ILE 106 Cb 0.00 0.21 0.00 0.00 -0.27 0.00 0.00 36.82 36.76 1a4o h ILE 106 CO 0.00 0.04 0.00 -0.81 -1.05 0.00 0.00 178.15 176.33 1a4o n PRO 107 N -4.48 1.41 -3.54 0.16 -0.04 -1.26 -4.38 135.00 122.88 1a4o n PRO 107 Ca 0.25 -0.63 -0.27 0.00 -0.04 0.00 0.00 63.50 62.81 1a4o n PRO 107 Cb 1.00 -1.27 -0.10 0.00 -0.04 0.00 0.00 33.50 33.09 1a4o n PRO 107 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1a4o n ASN 108 N -0.09 1.78 0.00 3.54 2.85 0.54 -5.10 115.26 118.78 1a4o n ASN 108 Ca 0.12 -2.96 0.00 0.00 -0.11 0.00 0.00 54.58 51.63 1a4o n ASN 108 Cb 0.19 -0.66 0.00 0.00 1.24 0.00 0.00 39.78 40.55 1a4o n ASN 108 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1a4o n ALA 109 N 1.84 0.00 0.02 5.20 0.00 -1.26 -4.53 120.51 121.77 1a4o n ALA 109 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.69 1a4o n ALA 109 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 1a4o n ALA 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a4o n ALA 112 N -3.00 3.00 -0.07 0.00 0.00 -1.26 -5.03 120.51 114.15 1a4o n ALA 112 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1a4o n ALA 112 Cb 0.00 0.04 -0.06 0.00 0.00 0.00 0.00 19.45 19.43 1a4o n ALA 112 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1a4o h GLU 113 N 0.00 0.46 -0.20 0.00 4.11 -1.97 -2.94 114.58 114.05 1a4o h GLU 113 Ca 0.00 -0.22 0.06 0.00 0.07 0.00 0.00 59.36 59.27 1a4o h GLU 113 Cb 0.00 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1a4o h GLU 113 CO 0.00 0.76 0.55 0.66 0.07 0.00 0.00 179.01 181.05 1a4o h SER 114 N 0.15 0.00 -0.08 3.06 4.64 -1.98 0.14 113.55 119.49 1a4o h SER 114 Ca 0.04 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.35 1a4o h SER 114 Cb 0.64 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.73 1a4o h SER 114 CO 0.04 0.00 -0.00 0.11 -0.87 0.00 0.00 176.83 176.10 1a4o h LYS 115 N 0.00 0.13 0.00 4.77 1.57 -1.89 -1.47 116.57 119.68 1a4o h LYS 115 Ca 0.10 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.76 1a4o h LYS 115 Cb 1.19 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.48 1a4o h LYS 115 CO -0.00 0.41 -0.36 -0.24 -0.57 0.00 0.00 179.45 178.69 1a4o h VAL 116 N -0.16 0.76 0.21 0.50 3.04 -0.88 -0.59 116.25 119.13 1a4o h VAL 116 Ca 0.02 -1.60 -0.01 0.00 -1.01 0.00 0.00 66.70 64.10 1a4o h VAL 116 Cb 0.35 2.03 0.00 0.00 -2.01 0.00 0.00 31.29 31.66 1a4o h VAL 116 CO 0.00 0.35 -0.10 0.15 -1.01 0.00 0.00 177.57 176.97 1a4o h PHE 117 N 0.00 -0.26 0.21 3.17 3.04 -1.35 -2.34 116.94 119.41 1a4o h PHE 117 Ca -0.00 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.93 1a4o h PHE 117 Cb 1.00 0.09 0.00 0.00 2.56 0.00 0.00 35.95 39.60 1a4o h PHE 117 CO 0.00 -0.02 -0.10 1.88 -2.02 0.00 0.00 178.31 178.05 1a4o h TYR 118 N -0.48 -0.26 0.00 0.41 0.05 -1.22 -2.84 116.97 112.62 1a4o h TYR 118 Ca -0.03 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.74 1a4o h TYR 118 Cb 0.37 0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.19 1a4o h TYR 118 CO -0.01 0.10 0.00 -0.07 -1.05 0.00 0.00 178.16 177.13 1a4o h LEU 119 N -0.68 0.00 -0.01 3.88 4.07 -1.20 0.78 115.31 122.15 1a4o h LEU 119 Ca -0.03 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.89 1a4o h LEU 119 Cb 0.48 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.22 1a4o h LEU 119 CO 0.05 0.00 -0.16 0.50 -1.08 0.00 0.00 178.44 177.75 1a4o h LYS 120 N 0.00 0.12 -0.02 1.13 3.64 -1.38 -2.88 116.57 117.17 1a4o h LYS 120 Ca 0.00 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 1a4o h LYS 120 Cb 0.00 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 31.85 1a4o h LYS 120 CO 0.00 0.86 0.02 1.98 -2.27 0.00 0.00 179.45 180.03 1a4o h MET 121 N -0.58 0.02 -0.15 1.90 4.05 -0.78 0.26 114.93 119.65 1a4o h MET 121 Ca -0.02 -0.00 -0.07 0.00 -0.28 0.00 0.00 59.70 59.33 1a4o h MET 121 Cb 0.91 -0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.70 1a4o h MET 121 CO 0.03 0.01 -0.18 -0.22 0.23 0.00 0.00 176.91 176.79 1a4o h LYS 122 N 0.02 0.39 -0.53 0.39 3.64 -0.94 -1.98 116.57 117.55 1a4o h LYS 122 Ca 0.01 -0.21 -0.07 0.00 -1.27 0.00 0.00 60.65 59.11 1a4o h LYS 122 Cb 0.02 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 1a4o h LYS 122 CO -0.00 0.78 0.05 0.78 -2.27 0.00 0.00 179.45 178.79 1a4o h GLY 123 N 0.02 0.94 0.61 5.01 0.00 -1.08 -2.61 103.07 105.94 1a4o h GLY 123 Ca 0.02 -0.61 -0.03 0.00 0.00 0.00 0.00 47.33 46.72 1a4o h GLY 123 CO 0.04 0.56 -0.35 -0.55 0.00 0.00 0.00 176.54 176.25 1a4o h ASP 124 N 0.82 -0.87 -0.55 0.19 3.32 -0.38 -0.98 116.42 117.96 1a4o h ASP 124 Ca 0.16 0.04 0.03 0.00 0.02 0.00 0.00 57.03 57.28 1a4o h ASP 124 Cb 0.42 0.25 -0.03 0.00 0.22 0.00 0.00 39.33 40.18 1a4o h ASP 124 CO 0.01 -0.55 0.37 1.88 -1.72 0.00 0.00 179.24 179.23 1a4o h TYR 125 N -0.89 0.63 -0.34 4.55 -1.99 -1.41 -0.96 116.97 116.56 1a4o h TYR 125 Ca -0.08 0.02 -0.07 0.00 2.00 0.00 0.00 58.73 60.59 1a4o h TYR 125 Cb 0.70 -0.21 -0.02 0.00 2.00 0.00 0.00 36.73 39.20 1a4o h TYR 125 CO -0.01 0.37 -0.10 1.88 -0.00 0.00 0.00 178.16 180.30 1a4o h TYR 126 N 0.66 0.63 -0.38 4.88 0.05 -1.42 -1.87 116.97 119.51 1a4o h TYR 126 Ca 0.22 -0.10 -0.08 0.00 0.05 0.00 0.00 58.73 58.82 1a4o h TYR 126 Cb 0.06 -0.17 -0.02 0.00 1.01 0.00 0.00 36.73 37.61 1a4o h TYR 126 CO -0.00 0.67 -0.08 -0.09 -1.05 0.00 0.00 178.16 177.61 1a4o h ARG 127 N 0.54 0.65 -0.13 4.88 2.43 0.09 -0.20 114.38 122.65 1a4o h ARG 127 Ca 0.10 -0.19 -0.13 0.00 -0.81 0.00 0.00 59.98 58.95 1a4o h ARG 127 Cb 0.50 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.97 1a4o h ARG 127 CO 0.03 0.73 -0.48 1.88 -1.51 0.00 0.00 179.97 180.62 1a4o h TYR 128 N 0.60 0.42 0.00 2.20 0.05 -0.77 -2.12 116.97 117.35 1a4o h TYR 128 Ca 0.11 -0.13 -0.07 0.00 0.05 0.00 0.00 58.73 58.70 1a4o h TYR 128 Cb 0.50 -0.09 -0.01 0.00 1.01 0.00 0.00 36.73 38.15 1a4o h TYR 128 CO 0.02 0.76 -0.32 -0.07 -1.05 0.00 0.00 178.16 177.50 1a4o h LEU 129 N 0.28 0.00 0.01 3.88 4.07 -0.68 -2.90 115.31 119.96 1a4o h LEU 129 Ca 0.02 0.00 -0.09 0.00 0.08 0.00 0.00 57.88 57.89 1a4o h LEU 129 Cb 0.94 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.69 1a4o h LEU 129 CO 0.08 0.32 -0.34 0.00 -1.08 0.00 0.00 178.44 177.42 1a4o h ALA 130 N 1.68 0.03 -0.50 1.53 0.00 -0.59 0.20 119.26 121.61 1a4o h ALA 130 Ca -0.00 -0.50 0.09 0.00 0.00 0.00 0.00 54.91 54.50 1a4o h ALA 130 Cb 0.86 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.59 1a4o h ALA 130 CO 0.04 0.15 0.05 0.93 0.00 0.00 0.00 179.25 180.42 1a4o h GLU 131 N -0.44 0.17 0.00 0.00 5.08 -1.39 -2.07 114.58 115.94 1a4o h GLU 131 Ca -0.04 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1a4o h GLU 131 Cb 1.10 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.31 1a4o h GLU 131 CO 0.07 0.11 -0.12 0.28 -1.00 0.00 0.00 179.01 178.34 1a4o n VAL 132 N -5.18 0.25 -0.42 3.13 0.31 -1.10 -4.95 118.33 110.37 1a4o n VAL 132 Ca 0.06 -0.13 -0.28 0.00 -0.01 0.00 0.00 64.34 63.98 1a4o n VAL 132 Cb 0.26 -0.41 0.26 0.00 -0.91 0.00 0.00 33.84 33.05 1a4o n VAL 132 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1a4o n ALA 133 N -1.64 -4.40 -2.00 3.52 0.00 0.70 -5.05 120.51 111.64 1a4o n ALA 133 Ca 0.06 -1.44 0.00 0.00 0.00 0.00 0.00 53.44 52.06 1a4o n ALA 133 Cb 0.38 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.71 1a4o n ALA 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a4o n ALA 134 N -5.38 0.00 -1.00 0.00 0.00 -1.26 -4.86 120.51 108.01 1a4o n ALA 134 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1a4o n ALA 134 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 1a4o n ALA 134 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a4o n GLY 135 N 3.44 -0.44 0.27 0.00 0.00 -1.26 -4.09 105.19 103.11 1a4o n GLY 135 Ca 0.00 -0.44 0.18 0.00 0.00 0.00 0.00 46.02 45.76 1a4o n GLY 135 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1a4o h ASP 136 N 0.00 0.00 -0.51 1.61 1.82 -2.01 0.39 116.42 117.73 1a4o h ASP 136 Ca 0.00 0.00 0.10 0.00 -0.39 0.00 0.00 57.03 56.74 1a4o h ASP 136 Cb 0.00 0.00 -0.09 0.00 0.68 0.00 0.00 39.33 39.92 1a4o h ASP 136 CO 0.00 0.00 -0.10 0.44 -1.61 0.00 0.00 179.24 177.97 1a4o h ASP 137 N 0.00 -0.43 -0.71 2.28 5.19 -2.00 -1.07 116.42 119.68 1a4o h ASP 137 Ca 0.00 0.15 0.12 0.00 -0.62 0.00 0.00 57.03 56.68 1a4o h ASP 137 Cb 0.07 0.30 -0.13 0.00 0.18 0.00 0.00 39.33 39.74 1a4o h ASP 137 CO 0.00 -0.15 -0.34 0.50 -3.12 0.00 0.00 179.24 176.12 1a4o h LYS 138 N 0.02 -0.11 0.58 3.56 1.63 -0.35 -2.16 116.57 119.74 1a4o h LYS 138 Ca 0.25 0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 60.03 1a4o h LYS 138 Cb 0.38 0.02 0.01 0.00 -0.60 0.00 0.00 32.23 32.04 1a4o h LYS 138 CO -0.51 -0.07 -0.28 0.87 -3.45 0.00 0.00 179.45 176.01 1a4o h LYS 139 N -0.11 -0.75 -0.53 1.90 1.57 -1.31 -0.77 116.57 116.56 1a4o h LYS 139 Ca 0.27 0.05 0.15 0.00 -1.87 0.00 0.00 60.65 59.26 1a4o h LYS 139 Cb 0.57 0.17 -0.02 0.00 0.08 0.00 0.00 32.23 33.02 1a4o h LYS 139 CO -0.77 -0.50 0.49 0.78 -0.57 0.00 0.00 179.45 178.88 1a4o h GLY 140 N -0.79 0.00 0.00 3.86 0.00 -0.89 -2.04 103.07 103.20 1a4o h GLY 140 Ca -0.08 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.21 1a4o h GLY 140 CO 0.13 0.00 -0.44 -2.22 0.00 0.00 0.00 176.54 174.01 1a4o h ILE 141 N 0.00 0.31 -0.69 2.60 2.04 -1.20 -3.29 117.51 117.27 1a4o h ILE 141 Ca 0.25 -1.31 0.20 0.00 1.00 0.00 0.00 64.86 65.01 1a4o h ILE 141 Cb 1.23 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.94 1a4o h ILE 141 CO -0.00 0.10 0.54 1.62 0.00 0.00 0.00 178.15 180.41 1a4o h VAL 142 N -1.00 0.56 -0.19 1.67 3.04 -0.93 0.19 116.25 119.58 1a4o h VAL 142 Ca -0.06 0.00 -0.17 0.00 -1.01 0.00 0.00 66.70 65.47 1a4o h VAL 142 Cb 0.53 0.62 0.00 0.00 -2.01 0.00 0.00 31.29 30.44 1a4o h VAL 142 CO -0.03 0.00 -0.53 -0.78 -1.01 0.00 0.00 177.57 175.21 1a4o h ASP 143 N 0.00 0.79 0.22 3.17 3.58 -1.55 -2.91 116.42 119.73 1a4o h ASP 143 Ca 0.33 -0.58 -0.02 0.00 0.42 0.00 0.00 57.03 57.18 1a4o h ASP 143 Cb 1.40 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 42.21 1a4o h ASP 143 CO -0.00 1.24 -0.08 1.56 -2.88 0.00 0.00 179.24 179.07 1a4o h GLN 144 N 0.39 0.00 -0.14 0.28 1.08 -0.72 -0.85 115.11 115.14 1a4o h GLN 144 Ca -0.01 0.00 -0.21 0.00 -1.45 0.00 0.00 58.65 56.97 1a4o h GLN 144 Cb 1.15 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.59 1a4o h GLN 144 CO 0.11 0.08 -0.76 1.03 -0.95 0.00 0.00 178.83 178.35 1a4o h SER 145 N 0.00 0.84 0.20 1.46 0.87 -1.21 -3.25 113.55 112.46 1a4o h SER 145 Ca -0.00 -0.54 -0.01 0.00 -1.23 0.00 0.00 61.79 60.01 1a4o h SER 145 Cb 0.21 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 61.93 1a4o h SER 145 CO 0.01 1.33 -0.10 -0.61 -0.53 0.00 0.00 176.83 176.93 1a4o h GLN 146 N 0.49 -0.26 0.00 2.24 4.15 -1.02 -2.32 115.11 118.38 1a4o h GLN 146 Ca -0.04 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.39 1a4o h GLN 146 Cb 1.37 0.06 0.00 0.00 0.21 0.00 0.00 27.48 29.12 1a4o h GLN 146 CO 0.15 0.13 0.00 0.00 -1.93 0.00 0.00 178.83 177.18 1a4o n GLN 147 N -5.00 0.31 -0.05 1.69 10.64 -0.48 -0.07 117.38 124.42 1a4o n GLN 147 Ca -0.08 0.00 -0.11 0.00 -1.83 0.00 0.00 57.00 54.97 1a4o n GLN 147 Cb 0.26 -1.08 -0.04 0.00 -0.86 0.00 0.00 30.24 28.52 1a4o n GLN 147 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1a4o n ALA 148 N -0.58 2.26 0.05 2.61 0.00 -1.20 -4.06 120.51 119.58 1a4o n ALA 148 Ca 0.01 -0.44 -0.12 0.00 0.00 0.00 0.00 53.44 52.90 1a4o n ALA 148 Cb 0.01 0.35 -0.07 0.00 0.00 0.00 0.00 19.45 19.74 1a4o n ALA 148 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1a4o h TYR 149 N -0.37 -0.03 0.00 0.00 0.05 -0.92 -0.75 116.97 114.96 1a4o h TYR 149 Ca -0.28 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.50 1a4o h TYR 149 Cb 1.25 0.01 0.00 0.00 1.01 0.00 0.00 36.73 39.00 1a4o h TYR 149 CO -0.03 -0.02 0.00 0.37 -1.05 0.00 0.00 178.16 177.43 1a4o h GLN 150 N -0.02 0.00 0.18 4.88 4.15 -0.73 0.26 115.11 123.83 1a4o h GLN 150 Ca 0.00 0.00 -0.34 0.00 0.77 0.00 0.00 58.65 59.08 1a4o h GLN 150 Cb 0.02 0.00 0.01 0.00 0.21 0.00 0.00 27.48 27.72 1a4o h GLN 150 CO -0.00 0.00 -1.65 1.49 -1.93 0.00 0.00 178.83 176.73 1a4o h GLU 151 N 0.00 0.38 -0.27 1.69 4.81 -1.43 -2.43 114.58 117.34 1a4o h GLU 151 Ca 0.00 -0.65 -0.17 0.00 -0.13 0.00 0.00 59.36 58.41 1a4o h GLU 151 Cb 0.22 0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.84 1a4o h GLU 151 CO 0.00 1.29 -0.53 0.00 -0.73 0.00 0.00 179.01 179.04 1a4o h ALA 152 N 0.23 0.56 -0.54 2.92 0.00 -0.69 -2.48 119.26 119.26 1a4o h ALA 152 Ca -0.30 -0.51 0.08 0.00 0.00 0.00 0.00 54.91 54.18 1a4o h ALA 152 Cb 2.09 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 19.73 1a4o h ALA 152 CO 0.19 0.68 0.17 0.35 0.00 0.00 0.00 179.25 180.65 1a4o h PHE 153 N 0.60 0.30 0.00 0.00 3.57 -0.56 -0.36 116.94 120.49 1a4o h PHE 153 Ca 0.02 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.48 1a4o h PHE 153 Cb 1.11 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.79 1a4o h PHE 153 CO 0.06 0.07 -0.30 0.93 -2.23 0.00 0.00 178.31 176.84 1a4o h GLU 154 N 0.34 0.00 -0.94 1.11 5.08 -1.31 -2.07 114.58 116.79 1a4o h GLU 154 Ca 0.27 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.39 1a4o h GLU 154 Cb 0.33 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 29.44 1a4o h GLU 154 CO -0.29 0.30 0.30 -0.89 -1.00 0.00 0.00 179.01 177.43 1a4o n ILE 155 N -3.54 2.15 -0.09 3.13 5.41 -0.22 -4.01 119.36 122.19 1a4o n ILE 155 Ca -0.00 -1.06 -0.11 0.00 1.00 0.00 0.00 62.75 62.57 1a4o n ILE 155 Cb 0.45 -0.61 -0.04 0.00 -0.71 0.00 0.00 39.64 38.73 1a4o n ILE 155 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 1a4o n SER 156 N -0.28 1.90 -4.25 4.38 7.64 -0.75 -4.61 113.62 117.66 1a4o n SER 156 Ca 0.31 0.32 -0.32 0.00 1.01 0.00 0.00 58.87 60.20 1a4o n SER 156 Cb 1.11 -0.73 -0.07 0.00 -1.01 0.00 0.00 64.21 63.51 1a4o n SER 156 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1a4o n LYS 157 N -4.39 1.23 0.00 1.43 4.81 -1.25 -3.43 118.16 116.56 1a4o n LYS 157 Ca -0.18 -2.09 0.00 0.00 -0.87 0.00 0.00 58.31 55.17 1a4o n LYS 157 Cb 0.54 -3.45 0.00 0.00 0.02 0.00 0.00 35.03 32.14 1a4o n LYS 157 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1a4o n LYS 158 N 7.91 0.00 -0.85 1.64 4.81 -1.26 -4.95 118.16 125.46 1a4o n LYS 158 Ca 0.46 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.90 1a4o n LYS 158 Cb 0.45 0.00 0.31 0.00 0.02 0.00 0.00 35.03 35.81 1a4o n LYS 158 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1a4o n GLU 159 N 0.00 3.65 0.00 1.64 2.13 -1.25 -5.21 120.64 121.60 1a4o n GLU 159 Ca 0.00 -3.07 0.00 0.00 0.66 0.00 0.00 57.16 54.75 1a4o n GLU 159 Cb 0.00 -2.11 0.00 0.00 0.27 0.00 0.00 31.44 29.60 1a4o n GLU 159 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 1a4o n MET 160 N -0.15 0.00 0.00 5.31 2.81 -1.22 -5.05 117.12 118.81 1a4o n MET 160 Ca 0.33 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.22 1a4o n MET 160 Cb 1.21 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.72 1a4o n MET 160 CO 0.00 0.00 0.00 1.51 1.51 0.00 0.00 175.97 178.99 1a4o n ILE 166 N 0.00 0.00 0.07 2.02 3.06 -1.26 -4.98 119.36 118.27 1a4o n ILE 166 Ca 0.00 0.00 -0.06 0.00 -2.50 0.00 0.00 62.75 60.19 1a4o n ILE 166 Cb 0.00 0.00 -0.03 0.00 0.54 0.00 0.00 39.64 40.15 1a4o n ILE 166 CO 0.00 0.00 0.00 -0.09 -2.50 0.00 0.00 176.55 173.96 1a4o h ARG 167 N 0.00 -0.27 -0.71 9.51 2.43 -1.96 -1.31 114.38 122.07 1a4o h ARG 167 Ca 0.00 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.15 1a4o h ARG 167 Cb 0.00 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 1a4o h ARG 167 CO 0.00 -0.10 0.30 1.25 -1.51 0.00 0.00 179.97 179.91 1a4o h LEU 168 N -1.05 0.95 -1.37 3.80 5.85 -2.00 -1.78 115.31 119.72 1a4o h LEU 168 Ca -0.03 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.54 1a4o h LEU 168 Cb 0.29 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1a4o h LEU 168 CO 0.05 0.84 0.14 1.23 -0.34 0.00 0.00 178.44 180.35 1a4o h GLY 169 N 1.09 0.61 0.87 3.75 0.00 -1.93 -2.21 103.07 105.25 1a4o h GLY 169 Ca 0.24 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.27 1a4o h GLY 169 CO -0.02 0.28 -0.00 -2.00 0.00 0.00 0.00 176.54 174.80 1a4o h LEU 170 N 0.57 -0.00 -0.84 3.11 5.85 -0.35 -2.61 115.31 121.04 1a4o h LEU 170 Ca 0.14 -0.13 0.14 0.00 0.84 0.00 0.00 57.88 58.87 1a4o h LEU 170 Cb 0.15 0.00 -0.15 0.00 0.37 0.00 0.00 40.66 41.03 1a4o h LEU 170 CO -0.01 0.13 -0.33 0.00 -0.34 0.00 0.00 178.44 177.89 1a4o h ALA 171 N 0.86 0.20 0.17 1.25 0.00 -1.04 0.53 119.26 121.23 1a4o h ALA 171 Ca -0.00 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1a4o h ALA 171 Cb 0.13 0.86 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 1a4o h ALA 171 CO 0.00 -0.58 -0.42 1.25 0.00 0.00 0.00 179.25 179.49 1a4o h LEU 172 N -0.05 -1.25 0.44 0.00 5.85 -1.24 0.60 115.31 119.66 1a4o h LEU 172 Ca 0.33 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 59.16 1a4o h LEU 172 Cb 0.59 0.45 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 1a4o h LEU 172 CO -0.87 -0.47 -0.39 0.78 -0.34 0.00 0.00 178.44 177.15 1a4o h ASN 173 N -0.66 -1.04 -0.76 1.25 2.35 -0.82 -0.54 115.58 115.36 1a4o h ASN 173 Ca -0.02 0.08 0.14 0.00 -0.55 0.00 0.00 56.30 55.95 1a4o h ASN 173 Cb 0.64 0.33 -0.09 0.00 0.05 0.00 0.00 38.32 39.25 1a4o h ASN 173 CO -0.19 -0.53 0.31 0.15 -1.65 0.00 0.00 177.43 175.52 1a4o h PHE 174 N -0.81 0.54 0.68 1.19 3.57 0.01 0.52 116.94 122.64 1a4o h PHE 174 Ca -0.06 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.45 1a4o h PHE 174 Cb 0.69 -0.12 0.01 0.00 2.79 0.00 0.00 35.95 39.31 1a4o h PHE 174 CO -0.17 0.08 -0.33 1.03 -2.23 0.00 0.00 178.31 176.69 1a4o h SER 175 N 0.46 -0.78 0.05 0.41 0.87 0.34 -1.36 113.55 113.55 1a4o h SER 175 Ca 0.41 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.99 1a4o h SER 175 Cb 0.61 0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.77 1a4o h SER 175 CO -0.39 -0.53 0.00 0.55 -0.53 0.00 0.00 176.83 175.93 1a4o n VAL 176 N -5.47 0.15 0.08 2.23 3.14 -0.22 -0.22 118.33 118.03 1a4o n VAL 176 Ca -0.14 0.04 -0.09 0.00 -2.96 0.00 0.00 64.34 61.19 1a4o n VAL 176 Cb 0.38 -0.83 -0.02 0.00 -1.06 0.00 0.00 33.84 32.31 1a4o n VAL 176 CO 0.00 0.00 0.00 0.15 -6.46 0.00 0.00 176.83 170.52 1a4o h PHE 177 N 0.00 0.29 -1.19 1.45 3.57 0.12 -3.34 116.94 117.84 1a4o h PHE 177 Ca 0.00 -0.17 -0.63 0.00 3.53 0.00 0.00 57.97 60.70 1a4o h PHE 177 Cb 0.03 -0.03 -0.10 0.00 2.79 0.00 0.00 35.95 38.63 1a4o h PHE 177 CO 0.00 0.99 1.61 0.71 -2.23 0.00 0.00 178.31 179.39 1a4o s TYR 178 N -3.17 2.67 0.00 0.41 2.02 0.70 -5.07 117.35 114.91 1a4o s TYR 178 Ca -0.03 -1.12 0.00 0.00 -0.37 0.00 0.00 57.07 55.55 1a4o s TYR 178 Cb 0.10 -4.67 0.00 0.00 -0.40 0.00 0.00 41.96 36.99 1a4o s TYR 178 CO 0.83 -1.85 0.00 0.98 -1.57 0.00 0.00 175.55 173.94 1a4o n TYR 179 N 8.47 0.00 -2.64 2.71 9.36 -1.26 -4.90 117.16 128.90 1a4o n TYR 179 Ca 0.36 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.58 1a4o n TYR 179 Cb 0.49 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.20 1a4o n TYR 179 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1a4o n ALA 188 N 0.00 0.00 -0.10 2.98 0.00 -1.26 -5.14 120.51 116.99 1a4o n ALA 188 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.63 1a4o n ALA 188 Cb 0.00 0.00 0.61 0.00 0.00 0.00 0.00 19.45 20.06 1a4o n ALA 188 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a4o h SER 190 N 0.20 -1.23 -0.46 0.00 4.64 -1.99 -1.88 113.55 112.83 1a4o h SER 190 Ca 0.33 0.11 0.05 0.00 -0.47 0.00 0.00 61.79 61.81 1a4o h SER 190 Cb 1.03 0.42 -0.03 0.00 -0.31 0.00 0.00 62.40 63.51 1a4o h SER 190 CO -0.06 -0.59 0.31 0.25 -0.87 0.00 0.00 176.83 175.86 1a4o h LEU 191 N -0.87 0.37 -0.52 5.97 5.85 -1.69 -1.68 115.31 122.75 1a4o h LEU 191 Ca -0.04 -0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.54 1a4o h LEU 191 Cb 0.78 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 1a4o h LEU 191 CO -0.09 0.25 -0.34 0.00 -0.34 0.00 0.00 178.44 177.92 1a4o h ALA 192 N 1.75 0.70 0.55 1.25 0.00 -1.10 -2.23 119.26 120.18 1a4o h ALA 192 Ca 0.19 -0.43 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1a4o h ALA 192 Cb 0.22 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1a4o h ALA 192 CO -0.05 0.66 -0.26 -0.22 0.00 0.00 0.00 179.25 179.38 1a4o h LYS 193 N 0.70 -0.71 -0.84 0.00 3.64 -0.51 -1.14 116.57 117.71 1a4o h LYS 193 Ca 0.07 0.05 0.14 0.00 -1.27 0.00 0.00 60.65 59.64 1a4o h LYS 193 Cb 0.90 0.16 -0.15 0.00 -0.41 0.00 0.00 32.23 32.73 1a4o h LYS 193 CO 0.08 -0.41 -0.35 1.15 -2.27 0.00 0.00 179.45 177.65 1a4o h THR 194 N -0.94 0.07 -0.19 1.00 2.02 -1.38 1.99 112.91 115.48 1a4o h THR 194 Ca -0.08 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.12 1a4o h THR 194 Cb 0.63 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 1a4o h THR 194 CO 0.12 0.00 0.08 0.00 0.37 0.00 0.00 175.52 176.09 1a4o h ALA 195 N 1.33 0.22 0.00 6.16 0.00 -1.41 -1.59 119.26 123.97 1a4o h ALA 195 Ca 0.32 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1a4o h ALA 195 Cb 0.59 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1a4o h ALA 195 CO -0.87 -0.35 0.00 0.35 0.00 0.00 0.00 179.25 178.38 1a4o h PHE 196 N 0.17 0.00 0.12 0.00 3.57 0.56 -2.69 116.94 118.68 1a4o h PHE 196 Ca 0.08 0.00 -0.32 0.00 3.53 0.00 0.00 57.97 61.26 1a4o h PHE 196 Cb 0.04 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.77 1a4o h PHE 196 CO -0.11 0.00 -1.65 0.22 -2.23 0.00 0.00 178.31 174.55 1a4o h ASP 197 N 0.00 0.41 1.24 0.41 3.58 0.34 -3.11 116.42 119.29 1a4o h ASP 197 Ca 0.00 -0.63 0.00 0.00 0.42 0.00 0.00 57.03 56.82 1a4o h ASP 197 Cb 0.59 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.50 1a4o h ASP 197 CO 0.00 1.53 0.00 -0.62 -2.88 0.00 0.00 179.24 177.27 1a4o n GLU 198 N -3.45 0.15 0.07 0.28 1.02 -0.63 -2.94 120.64 115.14 1a4o n GLU 198 Ca -0.20 0.13 -0.01 0.00 -0.02 0.00 0.00 57.16 57.06 1a4o n GLU 198 Cb 1.05 -1.67 -0.05 0.00 -0.02 0.00 0.00 31.44 30.74 1a4o n GLU 198 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1a4o h ALA 199 N 2.71 0.61 -0.02 0.62 0.00 -1.47 -3.30 119.26 118.41 1a4o h ALA 199 Ca 0.00 -0.77 -0.20 0.00 0.00 0.00 0.00 54.91 53.94 1a4o h ALA 199 Cb 0.62 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1a4o h ALA 199 CO 0.00 0.94 -0.84 0.82 0.00 0.00 0.00 179.25 180.17 1a4o h ILE 200 N 0.00 1.44 -0.08 0.00 2.04 -1.46 -3.06 117.51 116.38 1a4o h ILE 200 Ca -0.08 -2.42 0.00 0.00 1.00 0.00 0.00 64.86 63.36 1a4o h ILE 200 Cb 1.59 2.34 0.00 0.00 -0.74 0.00 0.00 36.82 40.01 1a4o h ILE 200 CO 0.08 0.71 0.00 0.00 0.00 0.00 0.00 178.15 178.94 1a4o n ALA 201 N -2.49 2.65 0.39 1.87 0.00 -1.22 -2.40 120.51 119.31 1a4o n ALA 201 Ca -0.04 -0.24 0.04 0.00 0.00 0.00 0.00 53.44 53.19 1a4o n ALA 201 Cb 0.78 -1.01 -0.05 0.00 0.00 0.00 0.00 19.45 19.16 1a4o n ALA 201 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1a4o n GLU 202 N 0.03 3.86 -2.71 0.00 2.13 -1.16 -5.09 120.64 117.71 1a4o n GLU 202 Ca 0.04 -0.01 -0.34 0.00 0.66 0.00 0.00 57.16 57.51 1a4o n GLU 202 Cb 0.33 -0.93 -0.06 0.00 0.27 0.00 0.00 31.44 31.05 1a4o n GLU 202 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1a4o s LEU 203 N -2.49 3.94 0.30 4.31 1.43 -1.01 -5.13 118.68 120.03 1a4o s LEU 203 Ca 0.03 1.80 0.05 0.00 -1.03 0.00 0.00 54.13 54.98 1a4o s LEU 203 Cb 0.07 -4.50 0.77 0.00 0.03 0.00 0.00 46.19 42.55 1a4o s LEU 203 CO 0.36 -0.49 1.71 0.25 0.23 0.00 0.00 176.35 178.41 1a4o h LEU 216 N 1.90 0.46 -0.81 1.79 5.85 -2.06 -3.53 115.31 118.90 1a4o h LEU 216 Ca -0.49 0.14 0.25 0.00 0.84 0.00 0.00 57.88 58.63 1a4o h LEU 216 Cb 1.20 0.09 -0.15 0.00 0.37 0.00 0.00 40.66 42.17 1a4o h LEU 216 CO 0.61 0.05 0.13 -0.38 -0.34 0.00 0.00 178.44 178.50 1a4o n ILE 217 N -4.98 -0.34 -0.03 4.05 5.41 -1.26 -1.98 119.36 120.23 1a4o n ILE 217 Ca 0.23 1.75 -0.13 0.00 1.00 0.00 0.00 62.75 65.61 1a4o n ILE 217 Cb 0.67 -2.63 -0.09 0.00 -0.71 0.00 0.00 39.64 36.88 1a4o n ILE 217 CO 0.00 0.00 0.00 0.24 0.00 0.00 0.00 176.55 176.79 1a4o h MET 218 N 0.00 0.12 -0.26 0.38 2.86 -2.02 -3.26 114.93 112.76 1a4o h MET 218 Ca 0.54 -0.06 -0.10 0.00 -2.06 0.00 0.00 59.70 58.03 1a4o h MET 218 Cb 1.23 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.87 1a4o h MET 218 CO -0.73 0.55 -0.26 0.37 1.06 0.00 0.00 176.91 177.89 1a4o h GLN 219 N -0.31 0.50 -0.61 1.72 4.15 -1.90 -3.21 115.11 115.45 1a4o h GLN 219 Ca 0.01 -0.19 0.12 0.00 0.77 0.00 0.00 58.65 59.36 1a4o h GLN 219 Cb 0.52 -0.03 -0.12 0.00 0.21 0.00 0.00 27.48 28.06 1a4o h GLN 219 CO 0.01 0.72 -0.18 -0.07 -1.93 0.00 0.00 178.83 177.37 1a4o h LEU 220 N 0.44 -0.67 0.00 -2.39 4.07 -1.43 0.89 115.31 116.21 1a4o h LEU 220 Ca 0.06 0.19 0.00 0.00 0.08 0.00 0.00 57.88 58.22 1a4o h LEU 220 Cb 0.69 0.42 0.00 0.00 1.08 0.00 0.00 40.66 42.84 1a4o h LEU 220 CO 0.05 -0.23 -0.31 0.00 -1.08 0.00 0.00 178.44 176.88 1a4o n LEU 221 N -5.43 0.54 -0.04 1.67 -0.00 -1.25 -0.89 117.00 111.61 1a4o n LEU 221 Ca 0.07 0.33 -0.14 0.00 -0.00 0.00 0.00 56.01 56.27 1a4o n LEU 221 Cb 0.33 -0.30 -0.09 0.00 -0.00 0.00 0.00 43.42 43.36 1a4o n LEU 221 CO 0.04 -0.04 0.53 -0.09 -0.00 0.00 0.00 177.39 177.84 1a4o h ARG 222 N 0.00 0.22 -0.42 1.47 1.12 -1.00 -2.93 114.38 112.84 1a4o h ARG 222 Ca 0.00 -0.15 0.03 0.00 -1.11 0.00 0.00 59.98 58.74 1a4o h ARG 222 Cb 0.64 0.02 -0.03 0.00 -0.01 0.00 0.00 29.97 30.59 1a4o h ARG 222 CO 0.00 0.76 0.23 0.22 -3.11 0.00 0.00 179.97 178.07 1a4o h ASP 223 N -0.28 0.36 0.22 -3.80 1.82 0.73 -0.36 116.42 115.11 1a4o h ASP 223 Ca -0.00 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.65 1a4o h ASP 223 Cb 0.76 -0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.71 1a4o h ASP 223 CO 0.03 0.26 0.00 0.59 -1.61 0.00 0.00 179.24 178.51 1a4o n ASN 224 N -4.88 0.24 0.11 2.28 3.02 -0.07 -0.85 115.26 115.11 1a4o n ASN 224 Ca 0.02 0.59 0.07 0.00 -0.03 0.00 0.00 54.58 55.23 1a4o n ASN 224 Cb 0.08 -0.63 0.01 0.00 -0.61 0.00 0.00 39.78 38.64 1a4o n ASN 224 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1a4o h LEU 225 N 0.00 0.00 -1.00 3.41 4.07 -0.87 -2.09 115.31 118.82 1a4o h LEU 225 Ca 0.00 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.88 1a4o h LEU 225 Cb 0.11 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.83 1a4o h LEU 225 CO 0.00 0.21 -0.10 0.74 -1.08 0.00 0.00 178.44 178.22 1a4o h THR 226 N 0.00 1.24 0.27 0.22 2.02 -0.88 -3.23 112.91 112.55 1a4o h THR 226 Ca -0.04 -1.04 -0.01 0.00 0.77 0.00 0.00 66.41 66.08 1a4o h THR 226 Cb 1.20 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 68.69 1a4o h THR 226 CO 0.02 0.35 -0.13 -0.07 0.37 0.00 0.00 175.52 176.06 1a4o h LEU 227 N 0.56 -0.31 -0.93 2.58 3.38 -1.53 -3.52 115.31 115.54 1a4o h LEU 227 Ca 0.10 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1a4o h LEU 227 Cb 0.50 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1a4o h LEU 227 CO 0.03 0.09 0.00 -2.67 0.09 0.00 0.00 178.44 175.98