#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sou n LEU 2 N 0.00 0.60 0.15 4.03 7.94 -1.26 -4.45 117.00 124.01 1sou n LEU 2 Ca 0.00 -0.07 -0.15 0.00 -1.11 0.00 0.00 56.01 54.68 1sou n LEU 2 Cb 0.00 -0.08 -0.08 0.00 0.53 0.00 0.00 43.42 43.79 1sou n LEU 2 CO 0.00 0.06 0.58 0.11 -1.11 0.00 0.00 177.39 177.03 1sou h LYS 3 N 0.00 -0.68 -0.89 1.96 1.79 -1.99 0.74 116.57 117.50 1sou h LYS 3 Ca 0.00 0.05 -0.00 0.00 -2.18 0.00 0.00 60.65 58.51 1sou h LYS 3 Cb 0.72 0.16 -0.04 0.00 -1.58 0.00 0.00 32.23 31.49 1sou h LYS 3 CO 0.00 -0.45 0.55 0.77 -1.08 0.00 0.00 179.45 179.23 1sou h SER 4 N -0.71 1.06 0.11 0.86 0.02 -1.90 -1.61 113.55 111.38 1sou h SER 4 Ca 0.01 -0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 1sou h SER 4 Cb 0.71 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.98 1sou h SER 4 CO -0.21 0.80 -0.05 -0.08 -1.14 0.00 0.00 176.83 176.15 1sou h GLU 5 N 1.22 -0.14 -0.47 3.45 4.81 -1.69 -2.56 114.58 119.20 1sou h GLU 5 Ca 0.32 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.54 1sou h GLU 5 Cb -0.07 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 1sou h GLU 5 CO -0.06 0.31 0.20 1.25 -0.73 0.00 0.00 179.01 179.98 1sou h LEU 6 N -0.68 0.59 0.58 1.64 5.85 -0.79 0.39 115.31 122.89 1sou h LEU 6 Ca -0.02 -0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.63 1sou h LEU 6 Cb 0.52 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 1sou h LEU 6 CO 0.03 0.53 -0.48 -0.09 -0.34 0.00 0.00 178.44 178.08 1sou h ARG 7 N 0.66 -1.00 -0.08 1.25 2.43 -1.31 -3.05 114.38 113.28 1sou h ARG 7 Ca 0.16 0.07 -0.22 0.00 -0.81 0.00 0.00 59.98 59.18 1sou h ARG 7 Cb 0.11 0.23 0.01 0.00 -0.42 0.00 0.00 29.97 29.89 1sou h ARG 7 CO -0.02 -0.67 -0.83 -0.22 -1.51 0.00 0.00 179.97 176.72 1sou h LYS 8 N -1.04 0.58 -0.89 0.20 3.64 -0.98 -1.86 116.57 116.22 1sou h LYS 8 Ca -0.07 -0.52 -0.02 0.00 -1.27 0.00 0.00 60.65 58.77 1sou h LYS 8 Cb 0.88 0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 32.78 1sou h LYS 8 CO -0.01 1.15 0.49 -0.22 -2.27 0.00 0.00 179.45 178.59 1sou h LYS 9 N 0.38 1.24 0.16 1.90 3.64 -0.30 0.27 116.57 123.86 1sou h LYS 9 Ca -0.06 -0.14 -0.33 0.00 -1.27 0.00 0.00 60.65 58.84 1sou h LYS 9 Cb 1.45 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1sou h LYS 9 CO 0.16 0.91 -1.69 0.28 -2.27 0.00 0.00 179.45 176.83 1sou h VAL 10 N 1.25 0.92 -0.75 2.00 2.07 -1.59 -3.36 116.25 116.79 1sou h VAL 10 Ca 0.31 -2.46 0.00 0.00 0.82 0.00 0.00 66.70 65.38 1sou h VAL 10 Cb 0.02 2.72 -0.04 0.00 -1.52 0.00 0.00 31.29 32.47 1sou h VAL 10 CO -0.05 0.82 0.48 0.25 0.02 0.00 0.00 177.57 179.09 1sou h LEU 11 N -0.01 0.88 -1.90 2.57 5.85 -1.11 -1.74 115.31 119.84 1sou h LEU 11 Ca -0.34 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.35 1sou h LEU 11 Cb 2.00 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 42.80 1sou h LEU 11 CO 0.13 0.65 0.09 -0.74 -0.34 0.00 0.00 178.44 178.24 1sou h HIS 12 N 1.02 0.13 0.16 1.25 2.76 -0.61 -2.65 115.15 117.22 1sou h HIS 12 Ca 0.27 0.00 -0.27 0.00 -2.20 0.00 0.00 60.37 58.18 1sou h HIS 12 Cb -0.08 -0.04 0.02 0.00 1.55 0.00 0.00 27.41 28.85 1sou h HIS 12 CO 0.00 0.08 -1.27 0.87 -1.30 0.00 0.00 177.93 176.31 1sou h LYS 13 N 0.14 0.35 -0.82 5.26 1.57 -1.49 -3.10 116.57 118.47 1sou h LYS 13 Ca 0.05 -0.59 -0.01 0.00 -1.87 0.00 0.00 60.65 58.23 1sou h LYS 13 Cb 0.04 0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 1sou h LYS 13 CO -0.01 1.28 0.47 -0.09 -0.57 0.00 0.00 179.45 180.53 1sou h ARG 14 N -0.18 1.12 -0.01 3.15 2.43 -1.12 -0.82 114.38 118.95 1sou h ARG 14 Ca -0.25 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 58.81 1sou h ARG 14 Cb 1.85 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 31.17 1sou h ARG 14 CO 0.15 0.81 -0.17 0.44 -1.51 0.00 0.00 179.97 179.69 1sou n ILE 15 N -4.36 0.00 0.63 1.20 -5.35 -1.05 -3.67 119.36 106.77 1sou n ILE 15 Ca 0.09 -0.12 0.11 0.00 -0.27 0.00 0.00 62.75 62.55 1sou n ILE 15 Cb 0.08 0.23 -0.09 0.00 -1.74 0.00 0.00 39.64 38.12 1sou n ILE 15 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1sou n ASN 16 N -0.65 0.63 -4.61 7.28 5.15 -0.38 -4.96 115.26 117.72 1sou n ASN 16 Ca 0.14 -0.54 -0.41 0.00 -0.60 0.00 0.00 54.58 53.17 1sou n ASN 16 Cb 0.32 1.20 0.01 0.00 -0.53 0.00 0.00 39.78 40.78 1sou n ASN 16 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1sou n LEU 17 N -1.81 2.63 -4.76 1.20 4.77 -0.83 -4.89 117.00 113.31 1sou n LEU 17 Ca 0.01 1.03 -0.39 0.00 -0.03 0.00 0.00 56.01 56.64 1sou n LEU 17 Cb 0.42 -1.35 0.02 0.00 -2.33 0.00 0.00 43.42 40.18 1sou n LEU 17 CO 0.43 -1.49 1.00 -0.44 -1.33 0.00 0.00 177.39 175.56 1sou s SER 18 N -0.75 5.69 0.11 -1.43 0.01 -1.26 -4.80 113.70 111.27 1sou s SER 18 Ca 0.63 2.77 -0.21 0.00 1.31 0.00 0.00 55.95 60.45 1sou s SER 18 Cb -0.55 -2.64 -0.10 0.00 0.21 0.00 0.00 66.02 62.94 1sou s SER 18 CO 0.57 -1.29 1.75 -0.33 0.41 0.00 0.00 173.24 174.35 1sou h GLU 19 N 1.98 0.09 -0.52 12.44 3.07 -1.98 0.17 114.58 129.83 1sou h GLU 19 Ca -0.51 -0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 58.32 1sou h GLU 19 Cb 1.28 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 29.14 1sou h GLU 19 CO 0.60 0.06 0.23 1.49 -1.40 0.00 0.00 179.01 179.98 1sou h GLU 20 N 0.09 0.76 -0.40 2.33 4.81 -1.99 -0.46 114.58 119.71 1sou h GLU 20 Ca 0.04 -0.12 -0.03 0.00 -0.13 0.00 0.00 59.36 59.11 1sou h GLU 20 Cb 0.02 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 1sou h GLU 20 CO -0.04 0.65 0.12 1.49 -0.73 0.00 0.00 179.01 180.50 1sou h GLU 21 N 0.69 0.63 -0.76 1.92 4.81 -1.89 -2.43 114.58 117.55 1sou h GLU 21 Ca 0.17 -0.14 0.02 0.00 -0.13 0.00 0.00 59.36 59.29 1sou h GLU 21 Cb 0.16 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.40 1sou h GLU 21 CO -0.02 0.63 0.49 -0.09 -0.73 0.00 0.00 179.01 179.29 1sou h ARG 22 N 0.51 0.94 0.00 1.92 2.43 -0.35 -1.04 114.38 118.79 1sou h ARG 22 Ca 0.13 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.20 1sou h ARG 22 Cb 0.27 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1sou h ARG 22 CO -0.00 0.63 -0.19 0.00 -1.51 0.00 0.00 179.97 178.89 1sou h ARG 23 N 0.97 0.00 0.00 0.20 2.47 -0.89 0.17 114.38 117.31 1sou h ARG 23 Ca 0.30 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.02 1sou h ARG 23 Cb -0.03 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.29 1sou h ARG 23 CO -0.09 0.19 -0.36 0.00 0.56 0.00 0.00 179.97 180.27 1sou h ARG 24 N 0.00 0.00 0.00 0.04 3.08 -0.75 -2.21 114.38 114.54 1sou h ARG 24 Ca -0.00 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.95 1sou h ARG 24 Cb 0.50 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 1sou h ARG 24 CO 0.03 0.00 -0.66 -0.07 -1.07 0.00 0.00 179.97 178.20 1sou h LEU 25 N 0.00 0.00 -1.55 3.04 3.38 -0.22 -3.30 115.31 116.65 1sou h LEU 25 Ca 0.00 -0.44 0.08 0.00 0.09 0.00 0.00 57.88 57.61 1sou h LEU 25 Cb 0.92 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.64 1sou h LEU 25 CO 0.00 1.09 0.40 0.28 0.09 0.00 0.00 178.44 180.31 1sou h SER 26 N -1.00 0.47 -0.57 -0.43 0.02 -0.84 -0.39 113.55 110.81 1sou h SER 26 Ca -0.15 0.00 0.11 0.00 -0.84 0.00 0.00 61.79 60.92 1sou h SER 26 Cb 0.90 -0.09 -0.11 0.00 0.14 0.00 0.00 62.40 63.23 1sou h SER 26 CO -0.09 0.30 -0.16 -0.08 -1.14 0.00 0.00 176.83 175.65 1sou h GLU 27 N 0.53 -0.02 0.00 3.45 4.81 -1.54 0.14 114.58 121.94 1sou h GLU 27 Ca 0.27 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.36 1sou h GLU 27 Cb 0.38 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 1sou h GLU 27 CO -0.08 -0.02 -0.71 0.87 -0.73 0.00 0.00 179.01 178.35 1sou h LYS 28 N -0.03 0.00 -0.03 1.92 1.57 -1.20 -0.90 116.57 117.91 1sou h LYS 28 Ca 0.27 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1sou h LYS 28 Cb 0.44 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.75 1sou h LYS 28 CO -0.60 0.64 0.01 0.28 -0.57 0.00 0.00 179.45 179.21 1sou h VAL 29 N 0.00 1.21 -0.30 0.50 2.07 -0.62 0.11 116.25 119.22 1sou h VAL 29 Ca -0.02 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 1sou h VAL 29 Cb 1.52 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 32.83 1sou h VAL 29 CO 0.08 0.17 0.13 0.40 0.02 0.00 0.00 177.57 178.37 1sou h ILE 30 N -0.19 1.17 -0.79 4.57 2.04 -0.72 0.46 117.51 124.04 1sou h ILE 30 Ca 0.01 -0.49 -0.02 0.00 1.00 0.00 0.00 64.86 65.35 1sou h ILE 30 Cb 0.26 0.94 -0.04 0.00 -0.74 0.00 0.00 36.82 37.25 1sou h ILE 30 CO 0.00 0.17 0.40 0.28 0.00 0.00 0.00 178.15 179.01 1sou h SER 31 N 0.34 1.02 0.08 1.72 0.02 -1.15 0.13 113.55 115.71 1sou h SER 31 Ca 0.10 -0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1sou h SER 31 Cb 0.15 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.43 1sou h SER 31 CO -0.01 0.85 -0.04 -1.13 -1.14 0.00 0.00 176.83 175.37 1sou h ASN 32 N 1.12 -0.09 -0.90 3.07 -0.73 -0.56 0.30 115.58 117.78 1sou h ASN 32 Ca 0.28 -0.29 0.06 0.00 1.87 0.00 0.00 56.30 58.22 1sou h ASN 32 Cb 0.09 0.02 -0.06 0.00 0.27 0.00 0.00 38.32 38.64 1sou h ASN 32 CO -0.04 0.24 0.59 0.25 -0.37 0.00 0.00 177.43 178.10 1sou h LEU 33 N -0.43 0.91 -0.54 0.34 5.85 -0.75 -1.42 115.31 119.27 1sou h LEU 33 Ca -0.01 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.55 1sou h LEU 33 Cb 0.37 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1sou h LEU 33 CO 0.02 0.59 -0.67 0.50 -0.34 0.00 0.00 178.44 178.54 1sou h LYS 34 N 1.04 0.28 0.00 1.25 3.64 -0.61 -2.97 116.57 119.20 1sou h LYS 34 Ca 0.38 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1sou h LYS 34 Cb 0.17 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1sou h LYS 34 CO -0.14 0.85 0.00 0.66 -2.27 0.00 0.00 179.45 178.55 1sou h SER 35 N 0.20 0.00 -2.27 4.20 4.64 0.08 -3.44 113.55 116.95 1sou h SER 35 Ca -0.02 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.73 1sou h SER 35 Cb 1.21 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 63.34 1sou h SER 35 CO 0.11 0.00 0.96 0.18 -0.87 0.00 0.00 176.83 177.20 1sou n LEU 36 N -2.60 3.44 0.08 5.97 4.77 -0.71 -4.87 117.00 123.08 1sou n LEU 36 Ca 0.03 1.03 0.06 0.00 -0.03 0.00 0.00 56.01 57.10 1sou n LEU 36 Cb 0.37 -1.45 0.50 0.00 -2.33 0.00 0.00 43.42 40.52 1sou n LEU 36 CO 0.28 -0.10 1.14 1.55 -1.33 0.00 0.00 177.39 178.92 1sou h PRO 37 N 7.43 0.36 -0.28 3.23 0.13 -1.89 -1.45 132.00 139.53 1sou h PRO 37 Ca -0.46 -0.02 -0.10 0.00 -0.87 0.00 0.00 66.00 64.55 1sou h PRO 37 Cb 1.25 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 1sou h PRO 37 CO 0.92 0.24 -0.24 0.93 -0.23 0.00 0.00 178.00 179.62 1sou h GLU 38 N 0.37 0.53 -0.03 0.86 5.08 -1.94 -2.71 114.58 116.75 1sou h GLU 38 Ca 0.11 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1sou h GLU 38 Cb -0.00 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 1sou h GLU 38 CO -0.02 0.73 -0.09 0.35 -1.00 0.00 0.00 179.01 178.97 1sou h PHE 39 N 0.47 0.04 -0.72 4.33 3.57 -1.52 0.33 116.94 123.45 1sou h PHE 39 Ca 0.07 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.50 1sou h PHE 39 Cb 0.67 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.37 1sou h PHE 39 CO 0.02 0.14 0.18 0.87 -2.23 0.00 0.00 178.31 177.29 1sou h LYS 40 N 0.04 1.14 0.08 1.11 1.79 -1.42 -3.11 116.57 116.21 1sou h LYS 40 Ca 0.01 -0.27 -0.26 0.00 -2.18 0.00 0.00 60.65 57.95 1sou h LYS 40 Cb 0.19 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 30.68 1sou h LYS 40 CO 0.01 1.00 -1.21 -0.22 -1.08 0.00 0.00 179.45 177.96 1sou h LYS 41 N 1.08 0.17 -5.77 3.15 3.64 -1.05 -3.44 116.57 114.36 1sou h LYS 41 Ca 0.23 -0.29 -0.56 0.00 -1.27 0.00 0.00 60.65 58.75 1sou h LYS 41 Cb 0.37 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.29 1sou h LYS 41 CO 0.00 1.11 1.55 0.43 -2.27 0.00 0.00 179.45 180.27 1sou n SER 42 N -3.45 2.35 -0.09 4.20 7.64 0.99 -4.78 113.62 120.49 1sou n SER 42 Ca -0.07 0.02 -0.10 0.00 1.01 0.00 0.00 58.87 59.73 1sou n SER 42 Cb 1.00 -1.42 -0.15 0.00 -1.01 0.00 0.00 64.21 62.62 1sou n SER 42 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1sou n LYS 43 N 8.66 0.68 -3.41 1.43 4.81 -1.26 -4.72 118.16 124.35 1sou n LYS 43 Ca 0.39 0.05 -0.44 0.00 -0.87 0.00 0.00 58.31 57.44 1sou n LYS 43 Cb 0.38 -1.56 -0.06 0.00 0.02 0.00 0.00 35.03 33.81 1sou n LYS 43 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1sou s LYS 44 N -2.51 2.88 -0.34 1.64 -0.14 -1.26 -0.95 119.74 119.05 1sou s LYS 44 Ca -0.11 -1.87 -0.06 0.00 -1.36 0.00 0.00 55.97 52.57 1sou s LYS 44 Cb 0.06 -4.16 0.05 0.00 -1.68 0.00 0.00 37.83 32.10 1sou s LYS 44 CO 0.82 -1.27 0.11 0.08 -0.76 0.00 0.00 175.35 174.32 1sou s VAL 45 N 1.25 3.69 -0.11 3.17 1.01 -0.37 -0.69 120.40 128.35 1sou s VAL 45 Ca 0.07 -1.23 -0.08 0.00 0.00 0.00 0.00 61.98 60.73 1sou s VAL 45 Cb -0.26 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 1sou s VAL 45 CO -0.00 -0.22 0.17 0.00 0.00 0.00 0.00 175.10 175.04 1sou s ALA 46 N 1.37 3.85 0.07 5.51 0.00 0.44 -0.40 121.76 132.59 1sou s ALA 46 Ca -0.01 -0.60 0.09 0.00 0.00 0.00 0.00 51.96 51.44 1sou s ALA 46 Cb -0.20 -2.02 -0.03 0.00 0.00 0.00 0.00 23.12 20.87 1sou s ALA 46 CO 0.02 0.59 -0.25 -0.51 0.00 0.00 0.00 175.76 175.61 1sou s LEU 47 N -0.98 2.29 0.00 0.00 1.02 -0.43 -0.41 118.68 120.17 1sou s LEU 47 Ca 0.16 -0.60 0.28 0.00 0.02 0.00 0.00 54.13 53.99 1sou s LEU 47 Cb -0.12 -1.32 1.13 0.00 0.02 0.00 0.00 46.19 45.89 1sou s LEU 47 CO 0.05 0.24 1.79 0.00 0.02 0.00 0.00 176.35 178.45 1sou n TYR 48 N 1.51 0.00 -2.34 0.29 9.36 -0.72 -4.38 117.16 120.87 1sou n TYR 48 Ca -0.17 0.00 -0.03 0.00 3.32 0.00 0.00 57.90 61.02 1sou n TYR 48 Cb 0.52 -0.14 -0.03 0.00 -0.63 0.00 0.00 39.34 39.07 1sou n TYR 48 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1sou s PRO 50 N -0.89 2.99 0.44 0.00 0.04 -1.26 -4.99 135.00 131.32 1sou s PRO 50 Ca -0.16 -0.19 -0.02 0.00 0.04 0.00 0.00 61.00 60.67 1sou s PRO 50 Cb 0.01 -4.66 -0.03 0.00 0.04 0.00 0.00 34.50 29.86 1sou s PRO 50 CO 0.60 -2.57 0.69 0.96 0.04 0.00 0.00 177.00 176.72 1sou s ILE 51 N 7.39 4.71 0.00 0.56 -4.36 -1.26 -4.43 121.20 123.81 1sou s ILE 51 Ca 0.53 -0.16 0.00 0.00 -0.26 0.00 0.00 60.65 60.76 1sou s ILE 51 Cb -0.07 -3.76 0.00 0.00 1.25 0.00 0.00 42.46 39.87 1sou s ILE 51 CO 0.08 -0.63 0.00 0.29 0.24 0.00 0.00 174.94 174.92 1sou n LYS 52 N -2.10 0.00 0.00 0.37 5.02 -1.26 -4.08 118.16 116.12 1sou n LYS 52 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 1sou n LYS 52 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.57 1sou n LYS 52 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1sou n GLY 53 N 0.00 -2.34 4.21 0.72 0.00 -1.26 -4.95 105.19 101.56 1sou n GLY 53 Ca 0.00 0.79 -0.36 0.00 0.00 0.00 0.00 46.02 46.45 1sou n GLY 53 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1sou n GLU 54 N -0.36 -2.72 -2.09 1.61 -0.58 -1.26 -3.37 120.64 111.87 1sou n GLU 54 Ca 0.00 0.33 -0.03 0.00 -0.42 0.00 0.00 57.16 57.04 1sou n GLU 54 Cb 0.00 -5.03 -0.02 0.00 -0.57 0.00 0.00 31.44 25.81 1sou n GLU 54 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1sou n VAL 55 N -4.26 -8.92 -2.16 2.62 0.31 -1.26 -4.83 118.33 99.82 1sou n VAL 55 Ca 0.08 1.71 -0.32 0.00 -0.01 0.00 0.00 64.34 65.80 1sou n VAL 55 Cb 0.48 -5.25 -0.04 0.00 -0.91 0.00 0.00 33.84 28.12 1sou n VAL 55 CO 0.00 0.00 0.00 1.51 -1.32 0.00 0.00 176.83 177.02 1sou s ASP 56 N -0.39 5.45 -0.05 4.52 -4.77 -1.22 -4.76 116.67 115.46 1sou s ASP 56 Ca -0.15 -0.58 0.08 0.00 -3.30 0.00 0.00 52.55 48.60 1sou s ASP 56 Cb 0.01 -2.56 0.32 0.00 -1.09 0.00 0.00 42.92 39.60 1sou s ASP 56 CO 0.40 -2.41 1.13 0.18 0.70 0.00 0.00 175.17 175.17 1sou n LEU 57 N 12.61 2.39 -0.23 2.11 4.77 -1.26 -4.41 117.00 132.97 1sou n LEU 57 Ca 0.33 -1.21 -0.03 0.00 -0.03 0.00 0.00 56.01 55.07 1sou n LEU 57 Cb 0.49 -0.40 0.15 0.00 -2.33 0.00 0.00 43.42 41.33 1sou n LEU 57 CO 0.64 0.42 1.09 0.71 -1.33 0.00 0.00 177.39 178.92 1sou h THR 58 N 1.78 1.24 0.00 -5.08 1.35 -1.95 -1.42 112.91 108.82 1sou h THR 58 Ca 0.00 -0.68 0.00 0.00 -0.55 0.00 0.00 66.41 65.18 1sou h THR 58 Cb 0.79 0.32 0.00 0.00 -1.73 0.00 0.00 68.15 67.53 1sou h THR 58 CO 0.11 0.29 0.00 -2.65 -0.25 0.00 0.00 175.52 173.02 1sou n PRO 59 N -4.32 0.05 0.07 4.72 -0.02 -1.26 -1.82 135.00 132.43 1sou n PRO 59 Ca 0.07 0.44 0.12 0.00 -2.02 0.00 0.00 63.50 62.11 1sou n PRO 59 Cb 0.15 -1.63 0.11 0.00 -0.02 0.00 0.00 33.50 32.11 1sou n PRO 59 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1sou h LEU 60 N 0.00 0.00 -0.12 2.45 5.85 -1.59 -3.37 115.31 118.53 1sou h LEU 60 Ca 0.00 -0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.58 1sou h LEU 60 Cb 0.13 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1sou h LEU 60 CO 0.00 0.09 -0.07 -0.26 -0.34 0.00 0.00 178.44 177.85 1sou h PHE 61 N 0.00 -0.18 -0.73 1.25 -1.00 -1.38 -0.76 116.94 114.14 1sou h PHE 61 Ca 0.00 0.01 0.11 0.00 2.81 0.00 0.00 57.97 60.90 1sou h PHE 61 Cb 0.81 0.10 -0.05 0.00 3.61 0.00 0.00 35.95 40.42 1sou h PHE 61 CO 0.00 -0.12 0.48 -1.35 -1.61 0.00 0.00 178.31 175.71 1sou h PRO 62 N -0.07 0.54 -0.30 1.51 0.11 -1.77 0.01 132.00 132.03 1sou h PRO 62 Ca 0.07 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 66.06 1sou h PRO 62 Cb 0.18 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.16 1sou h PRO 62 CO -0.17 0.36 -0.15 0.93 -0.21 0.00 0.00 178.00 178.76 1sou h GLU 63 N 0.56 0.63 -0.37 1.05 4.39 -1.57 -1.40 114.58 117.87 1sou h GLU 63 Ca 0.34 -0.28 -0.03 0.00 0.34 0.00 0.00 59.36 59.73 1sou h GLU 63 Cb 0.57 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.19 1sou h GLU 63 CO -0.12 0.86 0.09 0.28 -1.16 0.00 0.00 179.01 178.97 1sou h VAL 64 N 0.38 1.22 0.00 3.13 2.07 -0.43 -2.44 116.25 120.19 1sou h VAL 64 Ca 0.06 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.83 1sou h VAL 64 Cb 0.68 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.46 1sou h VAL 64 CO 0.05 0.26 0.00 -0.07 0.02 0.00 0.00 177.57 177.82 1sou h LEU 65 N 0.45 0.00 -0.14 2.57 3.38 -0.97 0.15 115.31 120.75 1sou h LEU 65 Ca 0.12 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.85 1sou h LEU 65 Cb 0.30 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.05 1sou h LEU 65 CO 0.00 0.00 -0.97 0.50 0.09 0.00 0.00 178.44 178.06 1sou h LYS 66 N 0.00 0.46 0.00 1.13 3.64 -0.75 -3.42 116.57 117.63 1sou h LYS 66 Ca 0.00 -0.50 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 1sou h LYS 66 Cb 0.35 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1sou h LYS 66 CO 0.00 1.15 -0.79 0.39 -2.27 0.00 0.00 179.45 177.92 1sou n GLU 67 N -3.76 0.00 -2.16 1.90 1.02 -1.10 -5.10 120.64 111.43 1sou n GLU 67 Ca -0.08 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 56.96 1sou n GLU 67 Cb 0.85 -0.59 0.03 0.00 -0.02 0.00 0.00 31.44 31.71 1sou n GLU 67 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1sou n LYS 68 N -2.67 0.85 -3.51 3.49 4.76 0.50 -5.08 118.16 116.50 1sou n LYS 68 Ca 0.00 -1.66 -0.38 0.00 -2.87 0.00 0.00 58.31 53.40 1sou n LYS 68 Cb 0.40 -0.06 -0.10 0.00 -1.84 0.00 0.00 35.03 33.42 1sou n LYS 68 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1sou s GLU 69 N -3.33 3.98 -0.63 1.97 0.41 -0.13 -4.41 118.70 116.56 1sou s GLU 69 Ca 0.29 -0.18 -0.24 0.00 -0.41 0.00 0.00 54.97 54.43 1sou s GLU 69 Cb -0.02 -3.66 0.05 0.00 -1.78 0.00 0.00 34.13 28.72 1sou s GLU 69 CO 0.18 -0.22 1.01 -1.17 -0.49 0.00 0.00 175.26 174.57 1sou s LEU 70 N 1.88 4.08 -0.32 1.80 2.96 -0.91 -1.24 118.68 126.94 1sou s LEU 70 Ca 0.10 -0.63 -0.19 0.00 -0.22 0.00 0.00 54.13 53.18 1sou s LEU 70 Cb -0.16 -2.62 -0.01 0.00 0.50 0.00 0.00 46.19 43.90 1sou s LEU 70 CO 0.11 -1.41 0.58 -0.63 -1.32 0.00 0.00 176.35 173.67 1sou s ILE 71 N 4.28 4.97 -0.06 6.68 1.01 0.46 -0.39 121.20 138.15 1sou s ILE 71 Ca 0.28 0.70 0.05 0.00 0.00 0.00 0.00 60.65 61.68 1sou s ILE 71 Cb -0.14 -3.97 -0.02 0.00 0.01 0.00 0.00 42.46 38.34 1sou s ILE 71 CO 0.15 -0.14 -0.20 -0.76 0.00 0.00 0.00 174.94 173.99 1sou s LEU 72 N 2.52 2.39 -0.20 2.97 1.43 0.41 -1.31 118.68 126.90 1sou s LEU 72 Ca 0.23 -0.37 -0.29 0.00 -1.03 0.00 0.00 54.13 52.67 1sou s LEU 72 Cb -0.15 -1.46 -0.01 0.00 0.03 0.00 0.00 46.19 44.60 1sou s LEU 72 CO 0.12 0.28 1.21 -2.16 0.23 0.00 0.00 176.35 176.03 1sou s PRO 73 N -0.38 4.20 -0.28 1.29 0.04 -1.26 -1.02 135.00 137.60 1sou s PRO 73 Ca 0.03 1.53 -0.08 0.00 0.04 0.00 0.00 61.00 62.52 1sou s PRO 73 Cb -0.12 -3.75 -0.01 0.00 0.04 0.00 0.00 34.50 30.66 1sou s PRO 73 CO 0.02 -0.74 0.10 0.21 0.04 0.00 0.00 177.00 176.64 1sou s LYS 74 N 3.50 3.44 -0.81 4.56 2.20 0.46 -4.88 119.74 128.21 1sou s LYS 74 Ca 0.52 -0.63 -0.22 0.00 -0.36 0.00 0.00 55.97 55.28 1sou s LYS 74 Cb -0.19 -3.43 0.08 0.00 -1.51 0.00 0.00 37.83 32.78 1sou s LYS 74 CO 0.13 -0.32 1.14 0.08 -0.36 0.00 0.00 175.35 176.02 1sou s VAL 75 N 1.60 4.30 -1.14 4.02 1.01 -1.26 -0.41 120.40 128.51 1sou s VAL 75 Ca 0.05 -0.69 -0.06 0.00 0.00 0.00 0.00 61.98 61.28 1sou s VAL 75 Cb -0.16 -4.81 0.26 0.00 0.00 0.00 0.00 36.38 31.67 1sou s VAL 75 CO 0.05 -1.61 1.56 -0.62 0.00 0.00 0.00 175.10 174.48 1sou n GLU 76 N 7.78 4.13 0.00 2.72 1.02 -0.62 -4.92 120.64 130.75 1sou n GLU 76 Ca 0.12 -4.24 0.00 0.00 -0.02 0.00 0.00 57.16 53.01 1sou n GLU 76 Cb 0.48 -2.65 0.00 0.00 -0.02 0.00 0.00 31.44 29.25 1sou n GLU 76 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1sou n GLY 77 N 1.93 1.60 0.04 0.62 0.00 -1.26 -2.72 105.19 105.40 1sou n GLY 77 Ca 0.30 -0.42 0.05 0.00 0.00 0.00 0.00 46.02 45.95 1sou n GLY 77 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1sou n ASN 78 N 8.22 0.14 -4.56 1.61 5.03 -1.26 -4.78 115.26 119.66 1sou n ASN 78 Ca 0.00 0.00 -0.38 0.00 0.87 0.00 0.00 54.58 55.07 1sou n ASN 78 Cb 0.00 1.68 -0.03 0.00 -1.02 0.00 0.00 39.78 40.41 1sou n ASN 78 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1sou s GLU 79 N -3.18 3.36 -0.25 3.52 0.41 -1.10 -4.96 118.70 116.50 1sou s GLU 79 Ca -0.08 -1.00 -0.29 0.00 -0.41 0.00 0.00 54.97 53.19 1sou s GLU 79 Cb 0.11 -5.30 0.01 0.00 -1.78 0.00 0.00 34.13 27.17 1sou s GLU 79 CO 0.86 -2.52 1.06 -1.50 -0.49 0.00 0.00 175.26 172.67 1sou s ILE 80 N 6.23 4.63 -0.12 -1.63 2.07 -1.26 -1.59 121.20 129.53 1sou s ILE 80 Ca 0.53 1.95 -0.01 0.00 -1.41 0.00 0.00 60.65 61.71 1sou s ILE 80 Cb -0.01 -4.32 -0.02 0.00 0.13 0.00 0.00 42.46 38.23 1sou s ILE 80 CO -0.06 -0.24 -0.09 -0.94 -1.91 0.00 0.00 174.94 171.69 1sou s SER 81 N 1.33 4.37 -0.62 4.50 1.04 0.45 -4.92 113.70 119.85 1sou s SER 81 Ca 0.45 -0.20 -0.27 0.00 0.48 0.00 0.00 55.95 56.41 1sou s SER 81 Cb -0.15 -1.54 0.04 0.00 0.10 0.00 0.00 66.02 64.47 1sou s SER 81 CO 0.08 0.21 1.15 -0.76 0.98 0.00 0.00 173.24 174.91 1sou s LEU 82 N 0.09 3.57 -0.27 2.42 1.43 -1.26 -0.41 118.68 124.25 1sou s LEU 82 Ca -0.03 -0.22 -0.15 0.00 -1.03 0.00 0.00 54.13 52.70 1sou s LEU 82 Cb -0.14 -2.88 -0.04 0.00 0.03 0.00 0.00 46.19 43.16 1sou s LEU 82 CO 0.04 -1.53 0.36 -0.31 0.23 0.00 0.00 176.35 175.14 1sou s TYR 83 N 4.91 3.25 -0.01 0.29 1.51 -0.18 -0.38 117.35 126.74 1sou s TYR 83 Ca 0.37 0.40 -0.27 0.00 -1.01 0.00 0.00 57.07 56.56 1sou s TYR 83 Cb -0.09 -2.56 -0.04 0.00 -0.11 0.00 0.00 41.96 39.16 1sou s TYR 83 CO 0.20 -0.22 0.83 -0.98 -1.11 0.00 0.00 175.55 174.28 1sou s ARG 84 N 2.02 4.51 -0.05 -0.62 1.70 -0.28 -0.44 118.95 125.79 1sou s ARG 84 Ca 0.14 1.15 0.03 0.00 -0.47 0.00 0.00 55.73 56.59 1sou s ARG 84 Cb -0.16 -3.43 0.00 0.00 -0.57 0.00 0.00 34.95 30.80 1sou s ARG 84 CO 0.10 0.08 -0.14 0.08 -1.08 0.00 0.00 175.30 174.34 1sou s VAL 85 N 0.63 1.25 -0.03 4.99 1.01 0.48 -2.82 120.40 125.91 1sou s VAL 85 Ca 0.43 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.86 1sou s VAL 85 Cb -0.20 -1.10 0.06 0.00 0.00 0.00 0.00 36.38 35.14 1sou s VAL 85 CO 0.23 0.37 0.92 1.57 0.00 0.00 0.00 175.10 178.19 1sou n HIS 86 N 3.43 0.00 -3.82 5.22 -0.00 -1.26 -2.13 115.22 116.65 1sou n HIS 86 Ca -0.20 -0.44 -0.36 0.00 -0.00 0.00 0.00 57.72 56.72 1sou n HIS 86 Cb 0.53 -0.06 -0.13 0.00 -0.00 0.00 0.00 29.99 30.33 1sou n HIS 86 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 1sou s SER 87 N -1.14 5.12 0.00 0.26 0.01 -1.26 -4.98 113.70 111.70 1sou s SER 87 Ca 0.06 -1.23 0.00 0.00 1.31 0.00 0.00 55.95 56.10 1sou s SER 87 Cb 0.05 -1.79 0.00 0.00 0.21 0.00 0.00 66.02 64.49 1sou s SER 87 CO 0.01 -0.30 0.86 -2.65 0.41 0.00 0.00 173.24 171.56 1sou n PRO 88 N 4.72 0.72 0.00 12.44 -0.02 -1.26 -3.02 135.00 148.57 1sou n PRO 88 Ca -0.12 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.36 1sou n PRO 88 Cb 0.44 -1.14 0.00 0.00 -0.02 0.00 0.00 33.50 32.78 1sou n PRO 88 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1sou n ALA 89 N 0.83 0.73 -0.52 3.55 0.00 -1.26 -4.92 120.51 118.92 1sou n ALA 89 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1sou n ALA 89 Cb 0.36 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.83 1sou n ALA 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sou s LEU 91 N -0.89 4.03 0.36 0.00 1.43 -1.26 -2.84 118.68 119.51 1sou s LEU 91 Ca 0.15 0.06 0.04 0.00 -1.03 0.00 0.00 54.13 53.35 1sou s LEU 91 Cb 0.12 -2.66 -0.03 0.00 0.03 0.00 0.00 46.19 43.65 1sou s LEU 91 CO 0.00 0.12 0.15 -0.83 0.23 0.00 0.00 176.35 176.02 1sou s GLY 92 N -2.76 2.35 -0.31 -3.19 0.00 -0.01 -4.82 107.32 98.57 1sou s GLY 92 Ca 0.32 -1.57 -0.02 0.00 0.00 0.00 0.00 44.72 43.46 1sou s GLY 92 CO 0.25 -1.71 0.13 0.14 0.00 0.00 0.00 173.10 171.91 1sou s VAL 93 N -3.38 0.44 0.00 1.40 1.01 -1.26 -1.17 120.40 117.44 1sou s VAL 93 Ca 0.31 -1.24 0.00 0.00 0.00 0.00 0.00 61.98 61.05 1sou s VAL 93 Cb 0.04 -1.34 0.00 0.00 0.00 0.00 0.00 36.38 35.07 1sou s VAL 93 CO 0.17 -0.75 0.00 0.61 0.00 0.00 0.00 175.10 175.13 1sou n GLY 94 N 4.85 0.04 3.56 4.51 0.00 -1.24 -4.97 105.19 111.94 1sou n GLY 94 Ca -0.02 -0.02 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 1sou n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sou s ALA 95 N -1.00 2.42 0.00 4.61 0.00 -1.26 -4.44 121.76 122.09 1sou s ALA 95 Ca 0.00 -1.55 0.00 0.00 0.00 0.00 0.00 51.96 50.41 1sou s ALA 95 Cb 0.00 -4.41 0.00 0.00 0.00 0.00 0.00 23.12 18.71 1sou s ALA 95 CO 0.00 -3.80 0.00 0.34 0.00 0.00 0.00 175.76 172.30 1sou n PHE 96 N 10.72 0.00 0.00 0.00 7.35 -1.26 -2.39 117.46 131.88 1sou n PHE 96 Ca 0.23 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.92 1sou n PHE 96 Cb 0.50 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.33 1sou n PHE 96 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1sou n GLY 97 N 0.00 0.00 3.60 7.13 0.00 -1.26 -5.17 105.19 109.49 1sou n GLY 97 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1sou n GLY 97 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1sou s ILE 98 N 0.00 1.48 -0.97 -0.61 -4.36 -1.01 -5.02 121.20 110.72 1sou s ILE 98 Ca 0.00 -2.00 -0.15 0.00 -0.26 0.00 0.00 60.65 58.24 1sou s ILE 98 Cb 0.00 -2.70 0.19 0.00 1.25 0.00 0.00 42.46 41.20 1sou s ILE 98 CO 0.00 0.00 1.07 -0.04 0.24 0.00 0.00 174.94 176.21 1sou s MET 99 N -3.79 3.77 0.25 0.37 -1.94 -1.25 -3.65 119.30 113.06 1sou s MET 99 Ca 0.27 -2.33 -0.14 0.00 -1.71 0.00 0.00 55.69 51.79 1sou s MET 99 Cb 0.07 -4.74 -0.08 0.00 2.01 0.00 0.00 34.83 32.09 1sou s MET 99 CO 0.14 -1.55 0.65 -1.83 -0.01 0.00 0.00 175.02 172.42 1sou s GLU 100 N 1.16 3.98 -0.48 2.03 1.03 -0.32 -4.73 118.70 121.37 1sou s GLU 100 Ca 0.30 0.56 -0.28 0.00 0.03 0.00 0.00 54.97 55.58 1sou s GLU 100 Cb -0.07 -2.64 -0.00 0.00 -0.80 0.00 0.00 34.13 30.62 1sou s GLU 100 CO -0.07 0.29 1.63 -2.14 -1.33 0.00 0.00 175.26 173.63 1sou s PRO 101 N -2.62 3.20 0.33 -4.83 0.02 -1.26 -0.83 135.00 129.00 1sou s PRO 101 Ca 0.48 0.85 0.18 0.00 0.02 0.00 0.00 61.00 62.53 1sou s PRO 101 Cb -0.12 -4.19 0.36 0.00 0.02 0.00 0.00 34.50 30.57 1sou s PRO 101 CO 0.19 -2.04 1.58 -0.39 -0.33 0.00 0.00 177.00 176.01 1sou h VAL 102 N 6.64 0.80 -3.34 3.83 -1.51 -1.86 -3.43 116.25 117.38 1sou h VAL 102 Ca -0.29 -1.85 -0.64 0.00 -1.23 0.00 0.00 66.70 62.69 1sou h VAL 102 Cb 1.13 2.19 -0.33 0.00 -2.13 0.00 0.00 31.29 32.15 1sou h VAL 102 CO 1.13 0.41 -0.86 -1.61 -1.23 0.00 0.00 177.57 175.41 1sou s GLU 103 N -3.23 2.69 0.00 5.19 0.41 -1.13 -5.08 118.70 117.55 1sou s GLU 103 Ca 0.03 -0.75 0.00 0.00 -0.41 0.00 0.00 54.97 53.83 1sou s GLU 103 Cb 0.09 -2.09 0.00 0.00 -1.78 0.00 0.00 34.13 30.35 1sou s GLU 103 CO 0.71 0.11 0.00 0.41 -0.49 0.00 0.00 175.26 176.00 1sou n GLY 104 N 3.69 -0.55 2.81 -1.39 0.00 -1.26 -4.86 105.19 103.62 1sou n GLY 104 Ca -0.20 -0.72 -0.16 0.00 0.00 0.00 0.00 46.02 44.94 1sou n GLY 104 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1sou s GLU 105 N -0.59 0.16 -0.39 1.61 2.12 -1.13 -4.95 118.70 115.53 1sou s GLU 105 Ca 0.00 0.10 -0.29 0.00 0.36 0.00 0.00 54.97 55.14 1sou s GLU 105 Cb 0.00 -0.35 0.02 0.00 0.26 0.00 0.00 34.13 34.06 1sou s GLU 105 CO 0.00 -0.13 1.12 0.50 -0.54 0.00 0.00 175.26 176.21 1sou s ARG 106 N 0.91 3.91 0.15 4.30 3.52 -1.26 -1.13 118.95 129.35 1sou s ARG 106 Ca -0.08 0.87 0.04 0.00 -0.13 0.00 0.00 55.73 56.43 1sou s ARG 106 Cb -0.12 -3.82 -0.04 0.00 -1.56 0.00 0.00 34.95 29.42 1sou s ARG 106 CO -0.02 -1.12 0.16 0.08 -0.81 0.00 0.00 175.30 173.59 1sou s VAL 107 N 4.05 4.67 0.24 7.11 1.01 0.49 -5.00 120.40 132.98 1sou s VAL 107 Ca 0.47 -0.95 -0.26 0.00 0.00 0.00 0.00 61.98 61.24 1sou s VAL 107 Cb -0.10 -3.37 -0.09 0.00 0.00 0.00 0.00 36.38 32.82 1sou s VAL 107 CO 0.23 -0.07 0.86 0.54 0.00 0.00 0.00 175.10 176.66 1sou s ASN 108 N -3.03 7.39 0.60 3.32 4.22 -1.26 -4.22 114.94 121.97 1sou s ASN 108 Ca 0.32 1.75 0.35 0.00 -2.14 0.00 0.00 52.86 53.13 1sou s ASN 108 Cb -0.11 -2.54 1.95 0.00 1.28 0.00 0.00 41.25 41.84 1sou s ASN 108 CO 0.24 0.08 2.26 1.55 -2.04 0.00 0.00 177.10 179.19 1sou h PRO 109 N 3.77 0.00 0.00 3.55 0.13 -1.99 -1.38 132.00 136.08 1sou h PRO 109 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1sou h PRO 109 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1sou h PRO 109 CO 0.66 0.02 0.00 1.49 -0.23 0.00 0.00 178.00 179.94 1sou h GLU 110 N 0.00 0.00 0.00 0.86 4.81 -1.96 -2.61 114.58 115.67 1sou h GLU 110 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1sou h GLU 110 Cb 0.08 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.46 1sou h GLU 110 CO 0.00 0.00 -0.28 -3.47 -0.73 0.00 0.00 179.01 174.53 1sou n ASP 111 N -3.04 0.51 -4.63 1.04 2.03 -0.52 -4.84 116.55 107.11 1sou n ASP 111 Ca 0.01 0.25 -0.43 0.00 0.52 0.00 0.00 54.79 55.14 1sou n ASP 111 Cb 0.29 -0.23 -0.03 0.00 -0.72 0.00 0.00 41.12 40.43 1sou n ASP 111 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1sou n VAL 112 N -1.86 0.53 -0.10 5.18 0.31 -0.99 -4.85 118.33 116.55 1sou n VAL 112 Ca 0.05 -0.33 -0.20 0.00 -0.01 0.00 0.00 64.34 63.86 1sou n VAL 112 Cb 0.39 -2.47 -0.10 0.00 -0.91 0.00 0.00 33.84 30.75 1sou n VAL 112 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1sou n ASP 113 N 9.99 1.86 -4.07 4.52 2.03 -1.23 -4.40 116.55 125.25 1sou n ASP 113 Ca 0.26 0.45 -0.21 0.00 0.52 0.00 0.00 54.79 55.81 1sou n ASP 113 Cb 0.43 -0.94 -0.15 0.00 -0.72 0.00 0.00 41.12 39.74 1sou n ASP 113 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 1sou s PHE 114 N -2.35 1.12 -0.09 -0.67 2.19 0.14 -1.48 117.98 116.84 1sou s PHE 114 Ca -0.27 -0.22 -0.08 0.00 0.33 0.00 0.00 56.93 56.69 1sou s PHE 114 Cb 0.06 -0.73 0.02 0.00 -1.31 0.00 0.00 43.02 41.06 1sou s PHE 114 CO 0.53 -0.03 0.23 -1.50 1.83 0.00 0.00 175.22 176.27 1sou s ILE 115 N -0.23 -0.00 -0.34 3.12 2.07 -0.48 -0.42 121.20 124.91 1sou s ILE 115 Ca 0.04 0.01 -0.07 0.00 -1.41 0.00 0.00 60.65 59.22 1sou s ILE 115 Cb -0.05 -0.32 0.04 0.00 0.13 0.00 0.00 42.46 42.25 1sou s ILE 115 CO -0.00 0.00 0.12 0.00 -1.91 0.00 0.00 174.94 173.15 1sou s ALA 116 N 0.18 3.07 -0.24 1.50 0.00 0.45 -0.43 121.76 126.29 1sou s ALA 116 Ca -0.00 -1.77 0.02 0.00 0.00 0.00 0.00 51.96 50.20 1sou s ALA 116 Cb -0.02 -2.31 0.06 0.00 0.00 0.00 0.00 23.12 20.85 1sou s ALA 116 CO -0.00 -1.36 -0.09 0.08 0.00 0.00 0.00 175.76 174.38 1sou s VAL 117 N 1.41 1.90 0.79 0.00 1.01 0.45 -1.76 120.40 124.18 1sou s VAL 117 Ca -0.01 -1.41 -0.12 0.00 0.00 0.00 0.00 61.98 60.45 1sou s VAL 117 Cb -0.20 -2.04 0.06 0.00 0.00 0.00 0.00 36.38 34.20 1sou s VAL 117 CO 0.03 -0.01 1.11 -2.84 0.00 0.00 0.00 175.10 173.39 1sou s PRO 118 N 1.24 2.18 0.17 2.72 0.02 -1.26 -2.23 135.00 137.84 1sou s PRO 118 Ca -0.07 0.49 -0.15 0.00 0.02 0.00 0.00 61.00 61.29 1sou s PRO 118 Cb -0.19 -1.94 0.02 0.00 0.02 0.00 0.00 34.50 32.41 1sou s PRO 118 CO -0.06 -1.52 0.42 0.20 -0.33 0.00 0.00 177.00 175.72 1sou s GLY 119 N -4.13 0.04 0.22 0.52 0.00 -1.25 -4.87 107.32 97.85 1sou s GLY 119 Ca 0.60 -0.39 -0.06 0.00 0.00 0.00 0.00 44.72 44.88 1sou s GLY 119 CO 0.53 -0.45 1.69 -2.08 0.00 0.00 0.00 173.10 172.79 1sou h VAL 120 N 2.34 1.26 -3.52 1.40 2.07 -1.59 -3.46 116.25 114.75 1sou h VAL 120 Ca -0.31 -1.12 -0.07 0.00 0.82 0.00 0.00 66.70 66.02 1sou h VAL 120 Cb 1.25 0.88 -0.14 0.00 -1.52 0.00 0.00 31.29 31.76 1sou h VAL 120 CO 0.43 0.40 -0.21 0.00 0.02 0.00 0.00 177.57 178.21 1sou s ALA 121 N -4.95 -0.64 0.16 1.67 0.00 -1.26 -4.78 121.76 111.96 1sou s ALA 121 Ca -0.10 -0.24 -0.00 0.00 0.00 0.00 0.00 51.96 51.62 1sou s ALA 121 Cb 0.14 0.55 -0.04 0.00 0.00 0.00 0.00 23.12 23.77 1sou s ALA 121 CO 0.84 -0.55 0.05 -0.06 0.00 0.00 0.00 175.76 176.03 1sou s PHE 122 N -3.59 1.03 0.10 0.00 0.40 -0.02 -0.61 117.98 115.29 1sou s PHE 122 Ca 0.02 -1.19 0.01 0.00 -0.60 0.00 0.00 56.93 55.17 1sou s PHE 122 Cb 0.02 -0.57 -0.00 0.00 0.51 0.00 0.00 43.02 42.98 1sou s PHE 122 CO -0.10 -0.44 0.02 -0.40 0.70 0.00 0.00 175.22 175.00 1sou n ASP 123 N -0.17 1.51 -0.32 1.36 5.68 -1.05 -0.43 116.55 123.13 1sou n ASP 123 Ca -0.05 -1.48 0.14 0.00 -0.50 0.00 0.00 54.79 52.90 1sou n ASP 123 Cb 0.64 0.17 0.52 0.00 -1.14 0.00 0.00 41.12 41.31 1sou n ASP 123 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1sou n LEU 124 N 0.00 1.11 -0.06 -2.12 4.77 -0.70 -3.85 117.00 116.15 1sou n LEU 124 Ca -0.03 -0.32 -0.05 0.00 -0.03 0.00 0.00 56.01 55.58 1sou n LEU 124 Cb 0.14 -0.06 -0.11 0.00 -2.33 0.00 0.00 43.42 41.05 1sou n LEU 124 CO 0.07 0.19 -0.93 -0.62 -1.33 0.00 0.00 177.39 174.77 1sou n GLU 125 N -0.31 1.49 0.00 3.23 1.02 -1.26 -5.02 120.64 119.79 1sou n GLU 125 Ca 0.17 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 1sou n GLU 125 Cb 0.33 -1.37 0.00 0.00 -0.02 0.00 0.00 31.44 30.38 1sou n GLU 125 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1sou n GLY 126 N 2.05 1.34 3.69 0.62 0.00 -1.25 -4.95 105.19 106.69 1sou n GLY 126 Ca -0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 1sou n GLY 126 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1sou s TYR 127 N -1.38 2.97 0.11 1.61 2.02 -1.26 -0.41 117.35 121.01 1sou s TYR 127 Ca 0.00 -0.06 0.09 0.00 -0.37 0.00 0.00 57.07 56.74 1sou s TYR 127 Cb 0.00 -1.49 -0.04 0.00 -0.40 0.00 0.00 41.96 40.03 1sou s TYR 127 CO 0.00 0.49 -0.23 -0.98 -1.57 0.00 0.00 175.55 173.26 1sou s ARG 128 N -2.57 1.27 -0.11 -0.62 1.70 -1.18 -2.52 118.95 114.91 1sou s ARG 128 Ca 0.27 -1.23 -0.22 0.00 -0.47 0.00 0.00 55.73 54.09 1sou s ARG 128 Cb -0.11 -1.62 -0.03 0.00 -0.57 0.00 0.00 34.95 32.62 1sou s ARG 128 CO 0.19 0.38 0.63 -1.17 -1.08 0.00 0.00 175.30 174.25 1sou s LEU 129 N -1.91 4.26 0.00 -1.89 2.96 0.22 -4.66 118.68 117.66 1sou s LEU 129 Ca 0.10 1.01 0.00 0.00 -0.22 0.00 0.00 54.13 55.02 1sou s LEU 129 Cb -0.10 -2.94 0.00 0.00 0.50 0.00 0.00 46.19 43.65 1sou s LEU 129 CO 0.05 -0.13 0.00 0.61 -1.32 0.00 0.00 176.35 175.55 1sou n GLY 130 N 3.32 1.22 0.10 7.98 0.00 -1.26 -1.69 105.19 114.86 1sou n GLY 130 Ca -0.03 -1.77 0.15 0.00 0.00 0.00 0.00 46.02 44.38 1sou n GLY 130 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1sou n PHE 131 N 0.00 0.00 -2.56 1.61 3.72 -1.26 -4.64 117.46 114.33 1sou n PHE 131 Ca 0.00 -0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.31 1sou n PHE 131 Cb 0.00 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.55 1sou n PHE 131 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1sou n GLY 132 N 1.02 0.19 0.00 1.37 0.00 -1.26 -4.85 105.19 101.66 1sou n GLY 132 Ca 0.22 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1sou n GLY 132 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1sou n LYS 133 N -2.07 0.00 0.00 1.61 2.85 -1.26 -4.87 118.16 114.42 1sou n LYS 133 Ca -0.05 -0.01 0.00 0.00 -1.05 0.00 0.00 58.31 57.20 1sou n LYS 133 Cb 0.55 -0.12 0.00 0.00 -0.65 0.00 0.00 35.03 34.81 1sou n LYS 133 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1sou n GLY 134 N 0.00 0.08 0.55 2.58 0.00 -1.26 -5.06 105.19 102.07 1sou n GLY 134 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1sou n GLY 134 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1sou n TYR 135 N 5.92 -0.67 -0.81 1.61 4.02 -1.26 -4.73 117.16 121.25 1sou n TYR 135 Ca 0.00 0.38 0.00 0.00 -0.01 0.00 0.00 57.90 58.27 1sou n TYR 135 Cb 0.00 -2.08 0.00 0.00 -0.02 0.00 0.00 39.34 37.24 1sou n TYR 135 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1sou n TYR 136 N 0.04 0.00 -0.25 -0.72 4.01 -1.26 -4.83 117.16 114.14 1sou n TYR 136 Ca 0.00 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.68 1sou n TYR 136 Cb 0.00 -0.70 0.05 0.00 -0.31 0.00 0.00 39.34 38.38 1sou n TYR 136 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 1sou h ASP 137 N 0.00 0.91 -0.01 7.72 2.03 -1.97 -2.32 116.42 122.77 1sou h ASP 137 Ca 0.00 -0.13 0.00 0.00 -0.73 0.00 0.00 57.03 56.17 1sou h ASP 137 Cb 0.07 -0.23 -0.00 0.00 -0.83 0.00 0.00 39.33 38.33 1sou h ASP 137 CO 0.00 0.79 0.01 -0.09 -1.03 0.00 0.00 179.24 178.92 1sou h ARG 138 N 0.97 0.00 0.06 4.15 9.65 -1.99 0.61 114.38 127.84 1sou h ARG 138 Ca 0.24 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 59.12 1sou h ARG 138 Cb 0.12 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.70 1sou h ARG 138 CO -0.03 0.00 -0.03 1.25 2.80 0.00 0.00 179.97 183.96 1sou h LEU 139 N 0.00 -0.07 -0.38 3.80 5.85 -1.83 -3.24 115.31 119.44 1sou h LEU 139 Ca 0.00 -0.31 0.00 0.00 0.84 0.00 0.00 57.88 58.42 1sou h LEU 139 Cb 0.03 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.08 1sou h LEU 139 CO -0.00 0.55 0.00 0.18 -0.34 0.00 0.00 178.44 178.83 1sou n LEU 140 N -4.79 0.42 0.09 2.25 4.77 -1.01 -0.42 117.00 118.30 1sou n LEU 140 Ca -0.04 0.59 -0.09 0.00 -0.03 0.00 0.00 56.01 56.45 1sou n LEU 140 Cb 0.18 -0.53 -0.02 0.00 -2.33 0.00 0.00 43.42 40.73 1sou n LEU 140 CO 0.14 -0.40 0.24 0.50 -1.33 0.00 0.00 177.39 176.54 1sou h LYS 141 N 0.00 0.17 0.07 3.23 1.63 -1.00 -3.36 116.57 117.31 1sou h LYS 141 Ca 0.00 -0.20 -0.37 0.00 -0.85 0.00 0.00 60.65 59.23 1sou h LYS 141 Cb 0.36 0.06 -0.04 0.00 -0.60 0.00 0.00 32.23 32.01 1sou h LYS 141 CO 0.00 0.96 -2.17 -2.13 -3.45 0.00 0.00 179.45 172.65 1sou n ARG 142 N -3.63 0.70 -2.15 1.90 0.63 -0.56 -4.74 116.66 108.82 1sou n ARG 142 Ca -0.03 0.23 -0.31 0.00 -0.92 0.00 0.00 57.85 56.82 1sou n ARG 142 Cb 0.82 -1.63 -0.04 0.00 0.45 0.00 0.00 32.46 32.06 1sou n ARG 142 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1sou s VAL 143 N -2.53 3.53 -0.99 5.15 1.01 0.44 -4.84 120.40 122.17 1sou s VAL 143 Ca -0.28 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 61.33 1sou s VAL 143 Cb 0.08 -4.21 0.30 0.00 0.00 0.00 0.00 36.38 32.56 1sou s VAL 143 CO 0.69 -1.14 1.40 1.17 0.00 0.00 0.00 175.10 177.22 1sou n LYS 144 N 8.91 4.28 0.00 2.72 0.00 -1.26 -4.81 118.16 128.01 1sou n LYS 144 Ca 0.36 -4.61 0.00 0.00 0.00 0.00 0.00 58.31 54.06 1sou n LYS 144 Cb 0.48 -2.45 0.00 0.00 0.00 0.00 0.00 35.03 33.06 1sou n LYS 144 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1sou n GLY 145 N 0.98 1.26 3.52 3.14 0.00 -1.26 -4.95 105.19 107.88 1sou n GLY 145 Ca 0.30 -1.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.25 1sou n GLY 145 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sou s LEU 146 N 0.00 4.06 -0.66 0.99 1.02 -0.55 -4.89 118.68 118.65 1sou s LEU 146 Ca 0.00 -1.75 -0.26 0.00 0.02 0.00 0.00 54.13 52.14 1sou s LEU 146 Cb 0.00 -2.51 0.04 0.00 0.02 0.00 0.00 46.19 43.74 1sou s LEU 146 CO 0.00 -1.32 1.17 -0.54 0.02 0.00 0.00 176.35 175.67 1sou s LYS 147 N 4.10 3.29 -0.35 1.70 1.02 -1.26 -1.38 119.74 126.86 1sou s LYS 147 Ca 0.42 -0.19 -0.14 0.00 0.02 0.00 0.00 55.97 56.08 1sou s LYS 147 Cb -0.01 -4.12 -0.01 0.00 -0.52 0.00 0.00 37.83 33.16 1sou s LYS 147 CO -0.08 -1.89 0.30 0.08 -0.92 0.00 0.00 175.35 172.84 1sou s VAL 148 N 5.05 5.23 -0.22 3.17 1.01 0.43 -0.40 120.40 134.67 1sou s VAL 148 Ca 0.35 -0.16 -0.29 0.00 0.00 0.00 0.00 61.98 61.88 1sou s VAL 148 Cb -0.10 -3.78 0.01 0.00 0.00 0.00 0.00 36.38 32.50 1sou s VAL 148 CO 0.18 -0.08 1.09 -0.83 0.00 0.00 0.00 175.10 175.45 1sou s GLY 149 N 1.73 1.69 -0.41 4.51 0.00 0.49 -0.41 107.32 114.91 1sou s GLY 149 Ca 0.08 0.23 -0.16 0.00 0.00 0.00 0.00 44.72 44.88 1sou s GLY 149 CO 0.11 2.25 0.37 0.14 0.00 0.00 0.00 173.10 175.98 1sou s VAL 150 N 3.27 5.16 0.34 1.40 1.01 -0.95 -1.39 120.40 129.24 1sou s VAL 150 Ca 0.46 -0.42 -0.11 0.00 0.00 0.00 0.00 61.98 61.92 1sou s VAL 150 Cb -0.16 -3.97 0.02 0.00 0.00 0.00 0.00 36.38 32.27 1sou s VAL 150 CO 0.08 -0.34 0.61 0.00 0.00 0.00 0.00 175.10 175.45 1sou s ALA 151 N 1.95 -0.12 0.16 5.51 0.00 -1.06 -3.93 121.76 124.26 1sou s ALA 151 Ca 0.09 -1.03 -0.02 0.00 0.00 0.00 0.00 51.96 51.00 1sou s ALA 151 Cb -0.18 0.94 -0.05 0.00 0.00 0.00 0.00 23.12 23.83 1sou s ALA 151 CO 0.12 -0.89 0.36 0.71 0.00 0.00 0.00 175.76 176.06 1sou s TYR 152 N -3.01 3.48 0.20 0.00 2.02 -1.26 -4.01 117.35 114.78 1sou s TYR 152 Ca 0.22 0.42 0.34 0.00 -0.37 0.00 0.00 57.07 57.68 1sou s TYR 152 Cb -0.03 -1.90 1.75 0.00 -0.40 0.00 0.00 41.96 41.38 1sou s TYR 152 CO 0.14 0.43 2.03 1.03 -1.57 0.00 0.00 175.55 177.61 1sou h SER 153 N 2.50 0.00 -0.20 2.29 0.87 -1.94 0.00 113.55 117.08 1sou h SER 153 Ca -0.47 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.06 1sou h SER 153 Cb 1.18 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.12 1sou h SER 153 CO 0.71 0.00 0.04 -0.26 -0.53 0.00 0.00 176.83 176.79 1sou h PHE 154 N 0.00 0.42 -0.01 2.24 0.04 -2.02 -2.59 116.94 115.03 1sou h PHE 154 Ca 0.00 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.74 1sou h PHE 154 Cb 0.10 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.12 1sou h PHE 154 CO 0.00 0.40 -0.10 1.04 -0.60 0.00 0.00 178.31 179.05 1sou n GLN 155 N -4.35 0.85 -3.08 1.51 6.02 -0.01 -4.74 117.38 113.57 1sou n GLN 155 Ca 0.01 -0.33 -0.43 0.00 -0.01 0.00 0.00 57.00 56.24 1sou n GLN 155 Cb 0.19 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 29.89 1sou n GLN 155 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1sou s VAL 156 N -2.38 4.80 0.53 5.09 1.01 -0.98 -0.84 120.40 127.64 1sou s VAL 156 Ca 0.31 0.19 0.07 0.00 0.00 0.00 0.00 61.98 62.55 1sou s VAL 156 Cb 0.20 -4.22 0.07 0.00 0.00 0.00 0.00 36.38 32.43 1sou s VAL 156 CO 0.45 -0.60 0.55 0.49 0.00 0.00 0.00 175.10 175.99 1sou n PHE 157 N 6.33 -1.36 0.28 5.22 3.72 0.42 -4.95 117.46 127.13 1sou n PHE 157 Ca -0.01 -2.12 -0.13 0.00 -0.05 0.00 0.00 57.45 55.14 1sou n PHE 157 Cb 0.48 -0.47 -0.07 0.00 -0.94 0.00 0.00 39.48 38.49 1sou n PHE 157 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1sou h GLU 158 N 0.00 -0.72 -3.29 -1.08 3.07 -1.93 -1.86 114.58 108.77 1sou h GLU 158 Ca -0.30 0.05 -0.19 0.00 -0.50 0.00 0.00 59.36 58.42 1sou h GLU 158 Cb 1.19 0.16 -0.27 0.00 -0.84 0.00 0.00 28.75 29.00 1sou h GLU 158 CO 0.45 -0.43 -0.52 1.03 -1.40 0.00 0.00 179.01 178.14 1sou s ARG 159 N -4.42 0.19 0.23 2.33 0.52 -1.26 -1.80 118.95 114.74 1sou s ARG 159 Ca -0.13 0.27 -0.05 0.00 -0.52 0.00 0.00 55.73 55.30 1sou s ARG 159 Cb 0.01 0.06 -0.06 0.00 0.52 0.00 0.00 34.95 35.49 1sou s ARG 159 CO 0.42 -0.04 0.49 -0.51 0.02 0.00 0.00 175.30 175.67 1sou s LEU 160 N 0.25 4.15 -0.51 2.53 1.43 -1.26 -4.99 118.68 120.28 1sou s LEU 160 Ca -0.01 0.68 -0.27 0.00 -1.03 0.00 0.00 54.13 53.50 1sou s LEU 160 Cb -0.03 -3.45 -0.04 0.00 0.03 0.00 0.00 46.19 42.70 1sou s LEU 160 CO -0.01 -0.09 2.07 -2.84 0.23 0.00 0.00 176.35 175.71 1sou s PRO 161 N -3.17 2.56 0.50 1.29 0.02 -1.26 -4.95 135.00 129.99 1sou s PRO 161 Ca 0.43 1.09 -0.20 0.00 0.02 0.00 0.00 61.00 62.34 1sou s PRO 161 Cb -0.11 -4.43 -0.08 0.00 0.02 0.00 0.00 34.50 29.90 1sou s PRO 161 CO 0.27 -2.78 1.06 1.03 -0.33 0.00 0.00 177.00 176.25 1sou s ARG 162 N 7.26 3.68 0.17 5.54 0.52 -1.26 -5.03 118.95 129.83 1sou s ARG 162 Ca 0.82 1.42 0.02 0.00 -0.52 0.00 0.00 55.73 57.47 1sou s ARG 162 Cb -0.17 -2.07 0.02 0.00 0.52 0.00 0.00 34.95 33.26 1sou s ARG 162 CO 0.25 -0.54 0.19 -3.47 0.02 0.00 0.00 175.30 171.75 1sou n ASP 163 N -1.07 0.98 0.10 0.23 -0.08 -1.26 -5.01 116.55 110.44 1sou n ASP 163 Ca 0.10 -1.50 -0.01 0.00 -1.51 0.00 0.00 54.79 51.87 1sou n ASP 163 Cb 0.52 -0.08 -0.03 0.00 2.34 0.00 0.00 41.12 43.87 1sou n ASP 163 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1sou h ALA 164 N 0.52 0.59 -1.28 -1.67 0.00 -2.03 -3.32 119.26 112.06 1sou h ALA 164 Ca -0.09 -0.65 -0.79 0.00 0.00 0.00 0.00 54.91 53.38 1sou h ALA 164 Cb 0.38 -0.05 -0.23 0.00 0.00 0.00 0.00 17.79 17.89 1sou h ALA 164 CO 0.13 0.85 1.35 0.91 0.00 0.00 0.00 179.25 182.50 1sou n TRP 165 N -3.22 2.59 -2.34 0.00 8.01 -1.26 -4.99 117.44 116.24 1sou n TRP 165 Ca -0.00 -2.64 -0.42 0.00 -1.31 0.00 0.00 57.50 53.12 1sou n TRP 165 Cb 0.81 -1.43 -0.02 0.00 -2.01 0.00 0.00 31.31 28.66 1sou n TRP 165 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.69 177.02 1sou s ASP 166 N -0.88 6.23 -0.37 -0.99 2.15 -1.25 -4.95 116.67 116.60 1sou s ASP 166 Ca 0.40 0.67 -0.03 0.00 0.43 0.00 0.00 52.55 54.02 1sou s ASP 166 Cb 0.14 -2.54 0.08 0.00 -0.30 0.00 0.00 42.92 40.30 1sou s ASP 166 CO -0.04 -1.55 0.13 -0.63 -0.17 0.00 0.00 175.17 172.92 1sou s ILE 167 N 5.77 3.25 0.51 4.11 -1.09 -1.26 -4.97 121.20 127.53 1sou s ILE 167 Ca 0.60 -1.76 -0.07 0.00 -2.23 0.00 0.00 60.65 57.19 1sou s ILE 167 Cb -0.13 -3.09 -0.04 0.00 -1.58 0.00 0.00 42.46 37.62 1sou s ILE 167 CO 0.30 -0.47 0.84 -2.16 -1.23 0.00 0.00 174.94 172.23 1sou s PRO 168 N 1.20 3.57 0.41 2.79 0.04 -1.26 -3.08 135.00 138.66 1sou s PRO 168 Ca 0.03 0.34 0.04 0.00 0.04 0.00 0.00 61.00 61.46 1sou s PRO 168 Cb -0.22 -2.31 -0.05 0.00 0.04 0.00 0.00 34.50 31.97 1sou s PRO 168 CO -0.03 -0.28 0.05 0.14 0.04 0.00 0.00 177.00 176.92 1sou s VAL 169 N -2.83 1.31 -0.24 -0.36 -7.23 0.46 -4.99 120.40 106.52 1sou s VAL 169 Ca 0.49 -2.00 -0.16 0.00 -1.81 0.00 0.00 61.98 58.50 1sou s VAL 169 Cb -0.10 -2.63 -0.12 0.00 0.56 0.00 0.00 36.38 34.08 1sou s VAL 169 CO 0.46 0.00 -0.22 0.47 -0.31 0.00 0.00 175.10 175.51 1sou n ASP 170 N -1.01 1.92 -4.02 4.85 9.92 0.46 -4.84 116.55 123.84 1sou n ASP 170 Ca -0.07 0.38 -0.24 0.00 -0.53 0.00 0.00 54.79 54.32 1sou n ASP 170 Cb 0.66 -0.84 -0.16 0.00 -0.64 0.00 0.00 41.12 40.14 1sou n ASP 170 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1sou s VAL 171 N -2.53 1.09 -0.39 2.53 1.01 -0.96 -1.03 120.40 120.12 1sou s VAL 171 Ca -0.33 -0.46 -0.11 0.00 0.00 0.00 0.00 61.98 61.08 1sou s VAL 171 Cb 0.10 -0.99 0.04 0.00 0.00 0.00 0.00 36.38 35.53 1sou s VAL 171 CO 0.48 0.34 0.22 -0.22 0.00 0.00 0.00 175.10 175.93 1sou s LEU 172 N 0.58 4.85 -0.18 3.92 2.96 0.13 -0.38 118.68 130.56 1sou s LEU 172 Ca -0.12 -1.14 -0.08 0.00 -0.22 0.00 0.00 54.13 52.56 1sou s LEU 172 Cb -0.15 -2.02 -0.04 0.00 0.50 0.00 0.00 46.19 44.48 1sou s LEU 172 CO 0.03 -0.43 0.09 -0.69 -1.32 0.00 0.00 176.35 174.03 1sou s VAL 173 N 1.52 5.08 0.18 1.68 1.01 -0.49 -0.56 120.40 128.82 1sou s VAL 173 Ca 0.02 0.07 0.01 0.00 0.00 0.00 0.00 61.98 62.08 1sou s VAL 173 Cb -0.20 -3.30 -0.00 0.00 0.00 0.00 0.00 36.38 32.88 1sou s VAL 173 CO 0.05 0.46 0.04 0.35 0.00 0.00 0.00 175.10 176.00 1sou n THR 174 N 3.42 0.00 1.06 3.92 -2.24 -0.94 -2.57 114.28 116.93 1sou n THR 174 Ca -0.17 -0.97 0.14 0.00 -2.27 0.00 0.00 64.05 60.78 1sou n THR 174 Cb 0.52 0.29 0.63 0.00 -2.10 0.00 0.00 70.33 69.67 1sou n THR 174 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1sou n GLU 175 N -0.43 0.10 0.04 -0.78 -0.00 -1.26 -4.34 120.64 113.97 1sou n GLU 175 Ca -0.05 0.01 0.00 0.00 -0.00 0.00 0.00 57.16 57.13 1sou n GLU 175 Cb 0.25 -1.50 0.00 0.00 -0.00 0.00 0.00 31.44 30.19 1sou n GLU 175 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1sou n LYS 176 N -1.45 0.00 -4.17 3.44 5.02 -1.26 -4.63 118.16 115.11 1sou n LYS 176 Ca 0.08 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.09 1sou n LYS 176 Cb 0.31 -0.39 -0.08 0.00 -0.02 0.00 0.00 35.03 34.84 1sou n LYS 176 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1sou s ASN 177 N -5.78 4.86 -0.52 4.39 -0.87 -1.26 -5.08 114.94 110.67 1sou s ASN 177 Ca 0.00 -0.28 -0.12 0.00 -1.57 0.00 0.00 52.86 50.89 1sou s ASN 177 Cb 0.00 -1.09 0.13 0.00 -0.02 0.00 0.00 41.25 40.27 1sou s ASN 177 CO 0.00 0.14 0.43 -0.69 -2.57 0.00 0.00 177.10 174.42 1sou s VAL 178 N -1.45 4.68 -1.02 1.60 1.01 -1.26 -2.22 120.40 121.74 1sou s VAL 178 Ca 0.26 -1.74 -0.14 0.00 0.00 0.00 0.00 61.98 60.36 1sou s VAL 178 Cb -0.11 -4.04 0.20 0.00 0.00 0.00 0.00 36.38 32.43 1sou s VAL 178 CO 0.18 -0.83 1.12 -0.13 0.00 0.00 0.00 175.10 175.43 1sou s ARG 179 N 1.36 3.87 -0.71 2.72 0.52 0.27 -4.97 118.95 122.01 1sou s ARG 179 Ca 0.06 -2.48 -0.27 0.00 -0.52 0.00 0.00 55.73 52.52 1sou s ARG 179 Cb -0.27 -4.75 0.01 0.00 0.52 0.00 0.00 34.95 30.46 1sou s ARG 179 CO 0.00 -1.53 1.50 0.50 0.02 0.00 0.00 175.30 175.79 1sou s ARG 180 N 0.88 3.00 -0.33 3.54 3.52 -1.26 0.20 118.95 128.49 1sou s ARG 180 Ca 0.31 0.02 0.09 0.00 -0.13 0.00 0.00 55.73 56.02 1sou s ARG 180 Cb -0.07 -4.31 0.69 0.00 -1.56 0.00 0.00 34.95 29.70 1sou s ARG 180 CO -0.07 -2.38 1.76 1.28 -0.81 0.00 0.00 175.30 175.09 1sou n LEU 181 N 10.62 5.82 -4.10 -0.88 4.77 -0.19 -4.79 117.00 128.25 1sou n LEU 181 Ca 0.11 -3.35 -0.42 0.00 -0.03 0.00 0.00 56.01 52.31 1sou n LEU 181 Cb 0.50 -0.74 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 1sou n LEU 181 CO 0.71 0.90 2.35 0.54 -1.33 0.00 0.00 177.39 180.56 1sou n ARG 182 N -0.50 3.03 -3.46 3.23 1.74 -1.02 -4.82 116.66 114.85 1sou n ARG 182 Ca 0.42 -2.93 -0.14 0.00 -0.77 0.00 0.00 57.85 54.43 1sou n ARG 182 Cb 1.37 -3.36 -0.03 0.00 -1.02 0.00 0.00 32.46 29.41 1sou n ARG 182 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1sou s ASP 183 N 3.56 -0.59 0.00 0.55 2.15 -1.26 -5.11 116.67 115.97 1sou s ASP 183 Ca 0.50 0.23 0.00 0.00 0.43 0.00 0.00 52.55 53.71 1sou s ASP 183 Cb 0.09 0.57 0.00 0.00 -0.30 0.00 0.00 42.92 43.29 1sou s ASP 183 CO -0.02 -0.84 0.22 0.61 -0.17 0.00 0.00 175.17 174.97 1sou n GLY 184 N 0.06 -0.24 0.69 2.66 0.00 -1.26 -4.92 105.19 102.19 1sou n GLY 184 Ca -0.18 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.81 1sou n GLY 184 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1sou n ARG 185 N -0.96 0.00 -2.47 1.61 3.00 -1.26 -5.14 116.66 111.44 1sou n ARG 185 Ca 0.00 -0.46 -0.41 0.00 -0.00 0.00 0.00 57.85 56.99 1sou n ARG 185 Cb 0.00 0.42 -0.04 0.00 0.00 0.00 0.00 32.46 32.84 1sou n ARG 185 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1sou s SER 186 N -0.46 7.23 0.00 6.15 1.04 -1.26 -4.91 113.70 121.50 1sou s SER 186 Ca 0.00 2.22 0.00 0.00 0.48 0.00 0.00 55.95 58.65 1sou s SER 186 Cb 0.00 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.50 1sou s SER 186 CO 0.00 -0.20 0.49 -0.11 0.98 0.00 0.00 173.24 174.40 1sou n LEU 187 N 1.71 0.00 -2.37 2.42 7.94 -1.26 -4.93 117.00 120.52 1sou n LEU 187 Ca 0.01 -0.29 -0.20 0.00 -1.11 0.00 0.00 56.01 54.41 1sou n LEU 187 Cb 0.45 0.00 -0.12 0.00 0.53 0.00 0.00 43.42 44.28 1sou n LEU 187 CO 0.54 0.17 2.00 -1.84 -1.11 0.00 0.00 177.39 177.15 1sou n GLU 188 N 0.00 2.48 -0.28 1.96 0.00 -1.26 -4.52 120.64 119.01 1sou n GLU 188 Ca 0.00 -1.48 0.04 0.00 0.00 0.00 0.00 57.16 55.72 1sou n GLU 188 Cb 0.53 -2.20 0.26 0.00 0.00 0.00 0.00 31.44 30.03 1sou n GLU 188 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 1sou h HIS 189 N 3.45 1.00 -0.37 -1.84 2.76 -2.03 -3.33 115.15 114.79 1sou h HIS 189 Ca 0.37 0.03 -0.28 0.00 -2.20 0.00 0.00 60.37 58.28 1sou h HIS 189 Cb 1.14 -0.33 -0.19 0.00 1.55 0.00 0.00 27.41 29.58 1sou h HIS 189 CO 1.76 0.52 -0.60 1.58 -1.30 0.00 0.00 177.93 179.90 1sou n HIS 190 N -4.49 -2.67 0.08 5.26 -0.00 -1.26 -5.00 115.22 107.14 1sou n HIS 190 Ca 0.13 -2.18 -0.08 0.00 0.46 0.00 0.00 57.72 56.05 1sou n HIS 190 Cb 0.21 1.23 -0.07 0.00 -0.12 0.00 0.00 29.99 31.23 1sou n HIS 190 CO 0.00 0.00 0.00 1.25 0.46 0.00 0.00 176.34 178.05 1sou h HIS 191 N 3.72 0.12 -3.51 1.57 6.17 -1.89 -3.42 115.15 117.92 1sou h HIS 191 Ca -0.10 -0.08 -0.59 0.00 0.71 0.00 0.00 60.37 60.31 1sou h HIS 191 Cb 1.02 -0.01 -0.09 0.00 2.52 0.00 0.00 27.41 30.86 1sou h HIS 191 CO 0.15 1.00 0.66 -1.58 0.71 0.00 0.00 177.93 178.87 1sou s HIS 192 N -2.88 3.05 0.62 5.26 2.46 -1.26 -5.03 115.29 117.51 1sou s HIS 192 Ca -0.01 0.78 -0.01 0.00 0.47 0.00 0.00 55.06 56.29 1sou s HIS 192 Cb 0.10 -3.76 0.12 0.00 -0.13 0.00 0.00 32.58 28.92 1sou s HIS 192 CO 0.83 -0.89 0.85 -2.39 -2.47 0.00 0.00 174.74 170.66 1sou n HIS 193 N 6.92 -3.11 -0.89 3.88 1.44 -1.26 -5.20 115.22 117.00 1sou n HIS 193 Ca 0.08 -1.40 0.00 0.00 -2.01 0.00 0.00 57.72 54.39 1sou n HIS 193 Cb 0.48 -0.62 0.00 0.00 0.12 0.00 0.00 29.99 29.97 1sou n HIS 193 CO 0.00 0.00 0.00 -2.39 -2.81 0.00 0.00 176.34 171.14