#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c8t h LEU 16 N 0.00 -0.49 -0.36 2.46 5.85 -2.05 0.43 115.31 121.15 2c8t h LEU 16 Ca 0.00 0.09 0.07 0.00 0.84 0.00 0.00 57.88 58.89 2c8t h LEU 16 Cb 0.00 0.24 -0.07 0.00 0.37 0.00 0.00 40.66 41.20 2c8t h LEU 16 CO 0.00 -0.20 -0.09 0.74 -0.34 0.00 0.00 178.44 178.55 2c8t h THR 17 N -0.18 0.63 -0.53 1.05 2.02 -2.06 -0.55 112.91 113.29 2c8t h THR 17 Ca 0.11 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.27 2c8t h THR 17 Cb 0.33 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 67.35 2c8t h THR 17 CO -0.27 0.00 0.26 0.44 0.37 0.00 0.00 175.52 176.33 2c8t h ASP 18 N -0.01 0.69 -0.78 4.18 3.32 -1.91 -1.97 116.42 119.93 2c8t h ASP 18 Ca 0.17 -0.12 0.08 0.00 0.02 0.00 0.00 57.03 57.18 2c8t h ASP 18 Cb 0.27 -0.18 -0.06 0.00 0.22 0.00 0.00 39.33 39.58 2c8t h ASP 18 CO -0.37 0.61 0.45 -1.28 -1.72 0.00 0.00 179.24 176.93 2c8t h SER 19 N 0.71 0.67 0.20 6.45 0.87 -0.43 0.52 113.55 122.55 2c8t h SER 19 Ca 0.18 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.77 2c8t h SER 19 Cb 0.10 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 2c8t h SER 19 CO -0.02 0.41 -0.10 0.58 -0.53 0.00 0.00 176.83 177.17 2c8t h VAL 20 N 0.80 0.86 -0.69 2.23 2.07 -0.82 -2.00 116.25 118.71 2c8t h VAL 20 Ca 0.36 -0.37 0.02 0.00 0.82 0.00 0.00 66.70 67.54 2c8t h VAL 20 Cb 0.26 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.08 2c8t h VAL 20 CO -0.21 0.08 0.45 1.88 0.02 0.00 0.00 177.57 179.80 2c8t h TYR 21 N -0.46 0.82 0.14 1.57 -1.99 -1.07 -0.30 116.97 115.68 2c8t h TYR 21 Ca -0.03 0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.71 2c8t h TYR 21 Cb 0.35 -0.28 0.00 0.00 2.00 0.00 0.00 36.73 38.80 2c8t h TYR 21 CO -0.01 0.49 -0.07 0.93 -0.00 0.00 0.00 178.16 179.50 2c8t h GLU 22 N 0.86 -0.18 -0.92 4.88 5.08 -0.88 -0.46 114.58 122.96 2c8t h GLU 22 Ca 0.27 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.68 2c8t h GLU 22 Cb 0.00 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.24 2c8t h GLU 22 CO -0.07 -0.03 0.59 0.00 -1.00 0.00 0.00 179.01 178.50 2c8t h ARG 23 N -0.30 1.09 0.00 2.33 3.08 -1.03 -0.68 114.38 118.88 2c8t h ARG 23 Ca -0.02 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 59.92 2c8t h ARG 23 Cb 0.24 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 2c8t h ARG 23 CO 0.03 0.72 -0.22 1.25 -1.07 0.00 0.00 179.97 180.68 2c8t h LEU 24 N 1.13 0.00 -0.64 3.04 5.85 -0.88 -2.05 115.31 121.76 2c8t h LEU 24 Ca 0.38 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.96 2c8t h LEU 24 Cb 0.06 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 2c8t h LEU 24 CO -0.14 0.22 -0.68 0.25 -0.34 0.00 0.00 178.44 177.76 2c8t h LEU 25 N 0.00 0.00 0.00 2.25 5.85 0.47 -0.88 115.31 123.00 2c8t h LEU 25 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2c8t h LEU 25 Cb 0.50 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.53 2c8t h LEU 25 CO 0.03 0.68 0.00 -1.20 -0.34 0.00 0.00 178.44 177.61 2c8t n SER 26 N -3.72 0.00 -1.46 1.25 7.64 -0.78 -1.93 113.62 114.61 2c8t n SER 26 Ca -0.01 0.25 0.08 0.00 1.01 0.00 0.00 58.87 60.20 2c8t n SER 26 Cb 0.67 -0.39 0.34 0.00 -1.01 0.00 0.00 64.21 63.82 2c8t n SER 26 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2c8t n GLU 27 N -1.39 3.93 -4.04 1.43 -0.58 -0.75 -4.93 120.64 114.32 2c8t n GLU 27 Ca 0.07 -2.94 -0.33 0.00 -0.42 0.00 0.00 57.16 53.54 2c8t n GLU 27 Cb 0.18 -1.99 0.00 0.00 -0.57 0.00 0.00 31.44 29.06 2c8t n GLU 27 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2c8t n ARG 28 N 0.46 -4.46 -5.21 3.49 5.12 -0.81 -4.89 116.66 110.35 2c8t n ARG 28 Ca 0.25 0.50 -0.32 0.00 -1.93 0.00 0.00 57.85 56.35 2c8t n ARG 28 Cb 0.98 -5.32 -0.16 0.00 -1.16 0.00 0.00 32.46 26.80 2c8t n ARG 28 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2c8t s ILE 29 N -3.28 2.17 0.01 0.55 1.01 -0.41 -0.45 121.20 120.80 2c8t s ILE 29 Ca 0.70 -1.02 0.00 0.00 0.00 0.00 0.00 60.65 60.33 2c8t s ILE 29 Cb -0.37 -1.80 -0.01 0.00 0.01 0.00 0.00 42.46 40.29 2c8t s ILE 29 CO 0.86 0.57 -0.02 -0.63 0.00 0.00 0.00 174.94 175.72 2c8t s ILE 30 N -0.12 0.08 -0.08 2.92 1.01 0.23 -3.48 121.20 121.76 2c8t s ILE 30 Ca -0.05 -0.43 0.04 0.00 0.00 0.00 0.00 60.65 60.22 2c8t s ILE 30 Cb -0.14 -0.15 -0.01 0.00 0.01 0.00 0.00 42.46 42.17 2c8t s ILE 30 CO 0.04 -0.22 -0.21 -0.36 0.00 0.00 0.00 174.94 174.19 2c8t s PHE 31 N -0.66 2.56 -0.53 3.97 0.40 -1.26 0.04 117.98 122.50 2c8t s PHE 31 Ca -0.07 -0.68 -0.05 0.00 -0.60 0.00 0.00 56.93 55.53 2c8t s PHE 31 Cb -0.05 -1.66 0.14 0.00 0.51 0.00 0.00 43.02 41.96 2c8t s PHE 31 CO -0.00 -0.19 0.36 -1.17 0.70 0.00 0.00 175.22 174.91 2c8t s LEU 32 N -0.07 5.46 -0.05 -0.37 2.96 0.13 -4.93 118.68 121.80 2c8t s LEU 32 Ca -0.05 -2.33 0.10 0.00 -0.22 0.00 0.00 54.13 51.62 2c8t s LEU 32 Cb -0.14 -1.91 0.24 0.00 0.50 0.00 0.00 46.19 44.88 2c8t s LEU 32 CO 0.04 -0.52 1.18 0.61 -1.32 0.00 0.00 176.35 176.34 2c8t n GLY 33 N 4.24 3.44 0.15 7.98 0.00 -1.26 -0.95 105.19 118.80 2c8t n GLY 33 Ca 0.01 -0.50 -0.00 0.00 0.00 0.00 0.00 46.02 45.53 2c8t n GLY 33 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2c8t n SER 34 N -0.36 -0.09 -4.68 1.61 3.41 -1.24 -4.75 113.62 107.52 2c8t n SER 34 Ca 0.10 -1.07 -0.62 0.00 -0.26 0.00 0.00 58.87 57.03 2c8t n SER 34 Cb 0.48 0.15 -0.08 0.00 -0.26 0.00 0.00 64.21 64.50 2c8t n SER 34 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2c8t n GLU 35 N -0.02 0.47 -2.19 4.33 4.07 -1.26 -4.34 120.64 121.70 2c8t n GLU 35 Ca -0.00 0.17 -0.31 0.00 -0.06 0.00 0.00 57.16 56.96 2c8t n GLU 35 Cb 0.02 -1.74 -0.04 0.00 -0.06 0.00 0.00 31.44 29.62 2c8t n GLU 35 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 2c8t s VAL 36 N 2.37 3.59 0.46 6.31 1.01 0.21 -4.84 120.40 129.51 2c8t s VAL 36 Ca 0.98 -0.57 0.06 0.00 0.00 0.00 0.00 61.98 62.46 2c8t s VAL 36 Cb -1.27 -4.35 -0.02 0.00 0.00 0.00 0.00 36.38 30.73 2c8t s VAL 36 CO 0.69 -1.23 0.25 0.54 0.00 0.00 0.00 175.10 175.35 2c8t s ASN 37 N 7.02 4.53 0.19 3.32 4.22 -1.26 -0.67 114.94 132.30 2c8t s ASN 37 Ca 0.64 -1.13 -0.12 0.00 -2.14 0.00 0.00 52.86 50.11 2c8t s ASN 37 Cb -0.04 -0.16 0.17 0.00 1.28 0.00 0.00 41.25 42.50 2c8t s ASN 37 CO -0.01 -0.74 1.80 0.44 -2.04 0.00 0.00 177.10 176.55 2c8t h ASP 38 N 1.18 0.48 0.36 3.54 3.32 -1.95 0.97 116.42 124.33 2c8t h ASP 38 Ca -0.41 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 56.66 2c8t h ASP 38 Cb 1.27 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.73 2c8t h ASP 38 CO 0.65 0.32 -0.38 -0.08 -1.72 0.00 0.00 179.24 178.04 2c8t h GLU 39 N 0.61 -0.74 -0.79 3.56 4.57 -1.97 0.19 114.58 120.01 2c8t h GLU 39 Ca 0.25 0.05 0.04 0.00 -1.18 0.00 0.00 59.36 58.52 2c8t h GLU 39 Cb 0.12 0.17 -0.05 0.00 -0.16 0.00 0.00 28.75 28.83 2c8t h GLU 39 CO -0.15 -0.49 0.50 0.82 -1.18 0.00 0.00 179.01 178.51 2c8t h ILE 40 N -0.77 1.10 0.03 2.32 2.04 -1.83 -1.67 117.51 118.73 2c8t h ILE 40 Ca -0.03 -0.33 0.02 0.00 1.00 0.00 0.00 64.86 65.52 2c8t h ILE 40 Cb 0.69 0.05 -0.03 0.00 -0.74 0.00 0.00 36.82 36.80 2c8t h ILE 40 CO -0.07 0.18 -0.15 0.00 0.00 0.00 0.00 178.15 178.11 2c8t h ALA 41 N 1.34 -0.20 -0.50 1.87 0.00 -0.23 0.87 119.26 122.41 2c8t h ALA 41 Ca 0.32 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.33 2c8t h ALA 41 Cb 0.04 0.25 -0.08 0.00 0.00 0.00 0.00 17.79 18.00 2c8t h ALA 41 CO -0.12 -0.65 -0.01 -0.91 0.00 0.00 0.00 179.25 177.55 2c8t h ASN 42 N -0.26 -0.23 -0.73 0.00 2.35 -0.46 0.31 115.58 116.55 2c8t h ASN 42 Ca 0.04 0.12 -0.05 0.00 -0.55 0.00 0.00 56.30 55.87 2c8t h ASN 42 Cb 0.31 0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.87 2c8t h ASN 42 CO -0.12 -0.08 0.28 -0.09 -1.65 0.00 0.00 177.43 175.77 2c8t h ARG 43 N 0.11 1.12 -0.17 0.81 2.43 -0.50 0.12 114.38 118.30 2c8t h ARG 43 Ca 0.25 -0.21 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 2c8t h ARG 43 Cb 0.38 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 2c8t h ARG 43 CO -0.43 0.92 0.03 -0.07 -1.51 0.00 0.00 179.97 178.91 2c8t h LEU 44 N 1.09 0.27 -0.47 3.80 3.38 -0.24 -1.51 115.31 121.62 2c8t h LEU 44 Ca 0.25 -0.25 0.07 0.00 0.09 0.00 0.00 57.88 58.04 2c8t h LEU 44 Cb 0.23 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.85 2c8t h LEU 44 CO -0.02 0.45 0.13 0.00 0.09 0.00 0.00 178.44 179.09 2c8t h ALA 46 N 1.34 0.22 -0.27 0.00 0.00 -0.65 -0.25 119.26 119.65 2c8t h ALA 46 Ca 0.23 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.29 2c8t h ALA 46 Cb 0.28 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2c8t h ALA 46 CO -0.27 -0.46 0.16 1.96 0.00 0.00 0.00 179.25 180.63 2c8t h GLN 47 N -0.00 0.32 -0.19 0.00 4.20 -0.20 0.02 115.11 119.24 2c8t h GLN 47 Ca 0.16 -0.02 0.04 0.00 0.06 0.00 0.00 58.65 58.90 2c8t h GLN 47 Cb 0.25 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.92 2c8t h GLN 47 CO -0.35 0.21 -0.07 0.82 -0.67 0.00 0.00 178.83 178.76 2c8t h ILE 48 N 0.33 0.74 -0.64 2.54 2.04 -0.27 -1.32 117.51 120.93 2c8t h ILE 48 Ca 0.11 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.01 2c8t h ILE 48 Cb -0.00 0.74 -0.05 0.00 -0.74 0.00 0.00 36.82 36.78 2c8t h ILE 48 CO -0.05 0.00 0.37 -0.07 0.00 0.00 0.00 178.15 178.40 2c8t h LEU 49 N -0.04 0.58 -0.02 1.44 3.38 -0.77 -1.11 115.31 118.77 2c8t h LEU 49 Ca 0.10 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2c8t h LEU 49 Cb 0.19 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 2c8t h LEU 49 CO -0.22 0.39 0.01 0.25 0.09 0.00 0.00 178.44 178.96 2c8t h LEU 50 N 0.71 0.02 -0.22 1.67 5.85 -0.63 0.42 115.31 123.14 2c8t h LEU 50 Ca 0.27 -0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.98 2c8t h LEU 50 Cb 0.11 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 2c8t h LEU 50 CO -0.14 0.04 0.13 -0.07 -0.34 0.00 0.00 178.44 178.06 2c8t h LEU 51 N 0.01 0.23 -1.12 2.25 3.38 -1.03 -0.34 115.31 118.69 2c8t h LEU 51 Ca 0.01 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.02 2c8t h LEU 51 Cb 0.02 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.66 2c8t h LEU 51 CO -0.00 0.16 0.60 0.00 0.09 0.00 0.00 178.44 179.29 2c8t h ALA 52 N 1.09 1.44 -0.21 1.53 0.00 -1.07 -1.53 119.26 120.50 2c8t h ALA 52 Ca 0.08 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 2c8t h ALA 52 Cb -0.02 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 2c8t h ALA 52 CO -0.03 0.47 -0.39 0.00 0.00 0.00 0.00 179.25 179.30 2c8t h ALA 53 N 1.47 0.94 -0.09 0.00 0.00 -0.47 -2.95 119.26 118.16 2c8t h ALA 53 Ca 0.37 -0.42 -0.14 0.00 0.00 0.00 0.00 54.91 54.71 2c8t h ALA 53 Cb 0.05 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2c8t h ALA 53 CO -0.12 0.62 -0.57 0.93 0.00 0.00 0.00 179.25 180.12 2c8t h GLU 54 N 0.40 0.27 -0.77 0.00 5.08 -0.13 -3.43 114.58 115.99 2c8t h GLU 54 Ca 0.04 -0.17 0.16 0.00 -1.00 0.00 0.00 59.36 58.39 2c8t h GLU 54 Cb 0.86 0.02 -0.21 0.00 0.50 0.00 0.00 28.75 29.91 2c8t h GLU 54 CO 0.07 0.76 -0.03 0.34 -1.00 0.00 0.00 179.01 179.16 2c8t s ASP 55 N -6.89 -0.87 0.06 1.42 -1.08 -0.67 -5.05 116.67 103.59 2c8t s ASP 55 Ca -0.04 0.66 0.27 0.00 -0.52 0.00 0.00 52.55 52.91 2c8t s ASP 55 Cb 0.12 1.78 0.82 0.00 -1.46 0.00 0.00 42.92 44.18 2c8t s ASP 55 CO 0.80 -0.16 1.67 0.00 0.52 0.00 0.00 175.17 177.99 2c8t n ALA 56 N 5.39 2.75 -0.04 3.66 0.00 -1.12 -4.19 120.51 126.96 2c8t n ALA 56 Ca -0.05 -0.18 -0.19 0.00 0.00 0.00 0.00 53.44 53.02 2c8t n ALA 56 Cb 0.52 -1.33 -0.13 0.00 0.00 0.00 0.00 19.45 18.51 2c8t n ALA 56 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2c8t n SER 57 N -1.73 1.96 -4.76 0.00 3.41 -1.26 -3.02 113.62 108.21 2c8t n SER 57 Ca 0.06 0.10 -0.37 0.00 -0.26 0.00 0.00 58.87 58.40 2c8t n SER 57 Cb 0.37 -0.62 0.01 0.00 -0.26 0.00 0.00 64.21 63.71 2c8t n SER 57 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2c8t s LYS 58 N -2.55 3.36 0.90 4.33 1.02 -1.26 -4.72 119.74 120.83 2c8t s LYS 58 Ca -0.25 1.82 -0.11 0.00 0.02 0.00 0.00 55.97 57.45 2c8t s LYS 58 Cb 0.07 -2.17 0.13 0.00 -0.52 0.00 0.00 37.83 35.35 2c8t s LYS 58 CO 0.72 -0.89 1.10 -0.51 -0.92 0.00 0.00 175.35 174.85 2c8t s ASP 59 N -1.45 3.30 -0.04 2.83 1.11 -1.26 -4.56 116.67 116.59 2c8t s ASP 59 Ca 0.71 1.79 0.07 0.00 0.18 0.00 0.00 52.55 55.29 2c8t s ASP 59 Cb -0.30 -2.40 -0.01 0.00 1.07 0.00 0.00 42.92 41.28 2c8t s ASP 59 CO 0.34 -2.79 -0.25 -0.63 1.18 0.00 0.00 175.17 173.02 2c8t s ILE 60 N -2.79 2.00 -0.22 0.77 1.01 -0.49 -4.87 121.20 116.62 2c8t s ILE 60 Ca 0.64 -1.05 -0.06 0.00 0.00 0.00 0.00 60.65 60.18 2c8t s ILE 60 Cb -0.20 -1.69 -0.03 0.00 0.01 0.00 0.00 42.46 40.56 2c8t s ILE 60 CO 0.58 0.56 0.03 -0.44 0.00 0.00 0.00 174.94 175.67 2c8t s SER 61 N -0.29 4.94 -0.25 3.58 0.01 0.40 -0.60 113.70 121.50 2c8t s SER 61 Ca 0.01 -0.20 -0.05 0.00 1.31 0.00 0.00 55.95 57.01 2c8t s SER 61 Cb -0.12 -1.86 -0.00 0.00 0.21 0.00 0.00 66.02 64.24 2c8t s SER 61 CO 0.02 0.03 0.02 -0.22 0.41 0.00 0.00 173.24 173.49 2c8t s LEU 62 N 1.24 3.33 -0.15 2.44 2.96 0.62 -0.60 118.68 128.51 2c8t s LEU 62 Ca 0.04 -0.50 -0.13 0.00 -0.22 0.00 0.00 54.13 53.32 2c8t s LEU 62 Cb -0.15 -1.81 -0.05 0.00 0.50 0.00 0.00 46.19 44.69 2c8t s LEU 62 CO 0.02 -0.09 0.28 -0.31 -1.32 0.00 0.00 176.35 174.94 2c8t s TYR 63 N 1.50 3.48 -0.19 5.38 1.51 0.11 -1.44 117.35 127.68 2c8t s TYR 63 Ca 0.04 0.60 0.01 0.00 -1.01 0.00 0.00 57.07 56.70 2c8t s TYR 63 Cb -0.16 -2.31 0.02 0.00 -0.11 0.00 0.00 41.96 39.40 2c8t s TYR 63 CO -0.00 0.28 -0.18 0.42 -1.11 0.00 0.00 175.55 174.96 2c8t s ILE 64 N 0.33 2.21 -0.44 2.71 1.01 0.11 0.17 121.20 127.28 2c8t s ILE 64 Ca 0.16 -0.95 0.05 0.00 0.00 0.00 0.00 60.65 59.91 2c8t s ILE 64 Cb -0.13 -1.97 0.18 0.00 0.01 0.00 0.00 42.46 40.55 2c8t s ILE 64 CO 0.04 0.48 0.45 -3.20 0.00 0.00 0.00 174.94 172.71 2c8t n ASN 65 N 4.62 -1.37 -3.80 3.58 2.85 -0.12 -0.90 115.26 120.12 2c8t n ASN 65 Ca -0.20 -2.53 -0.13 0.00 -0.11 0.00 0.00 54.58 51.61 2c8t n ASN 65 Cb 0.49 0.13 -0.12 0.00 1.24 0.00 0.00 39.78 41.52 2c8t n ASN 65 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 2c8t s SER 66 N 0.29 -0.21 0.00 1.20 0.15 0.63 -3.64 113.70 112.13 2c8t s SER 66 Ca 0.32 0.40 0.22 0.00 0.70 0.00 0.00 55.95 57.59 2c8t s SER 66 Cb 0.03 0.41 1.31 0.00 -1.71 0.00 0.00 66.02 66.06 2c8t s SER 66 CO -0.16 -0.07 1.82 -0.81 1.20 0.00 0.00 173.24 175.22 2c8t n PRO 67 N 2.96 0.96 0.00 5.44 -0.04 -1.26 -2.16 135.00 140.90 2c8t n PRO 67 Ca -0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 2c8t n PRO 67 Cb 0.59 -1.36 0.00 0.00 -0.04 0.00 0.00 33.50 32.69 2c8t n PRO 67 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2c8t n GLY 68 N 0.79 -0.04 0.00 0.55 0.00 -1.18 -4.35 105.19 100.97 2c8t n GLY 68 Ca 0.17 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.88 2c8t n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c8t n GLY 69 N 0.00 0.43 3.58 -0.02 0.00 -1.26 0.65 105.19 108.58 2c8t n GLY 69 Ca 0.00 -1.53 -0.52 0.00 0.00 0.00 0.00 46.02 43.97 2c8t n GLY 69 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2c8t n SER 70 N 0.00 1.47 0.19 1.61 2.88 0.16 -4.47 113.62 115.46 2c8t n SER 70 Ca 0.00 1.12 -0.14 0.00 -1.33 0.00 0.00 58.87 58.52 2c8t n SER 70 Cb 0.00 -1.17 -0.07 0.00 -0.75 0.00 0.00 64.21 62.22 2c8t n SER 70 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 2c8t h ILE 71 N 3.25 0.45 -0.16 2.46 2.04 -1.99 -1.11 117.51 122.45 2c8t h ILE 71 Ca -0.48 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.27 2c8t h ILE 71 Cb 1.34 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 2c8t h ILE 71 CO 0.76 0.00 -0.38 0.77 0.00 0.00 0.00 178.15 179.30 2c8t h SER 72 N -0.57 0.36 0.10 1.72 4.64 -1.97 0.23 113.55 118.05 2c8t h SER 72 Ca -0.02 -0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 2c8t h SER 72 Cb 0.51 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.49 2c8t h SER 72 CO -0.03 0.71 -0.10 0.00 -0.87 0.00 0.00 176.83 176.54 2c8t h ALA 73 N 1.31 -0.19 -0.01 5.18 0.00 -1.89 -0.76 119.26 122.91 2c8t h ALA 73 Ca 0.03 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2c8t h ALA 73 Cb 0.80 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2c8t h ALA 73 CO 0.06 -0.62 -0.17 0.78 0.00 0.00 0.00 179.25 179.30 2c8t h GLY 74 N -0.22 0.01 1.68 0.00 0.00 0.01 -2.38 103.07 102.17 2c8t h GLY 74 Ca 0.01 -0.01 -0.19 0.00 0.00 0.00 0.00 47.33 47.14 2c8t h GLY 74 CO -0.03 0.00 -0.78 1.98 0.00 0.00 0.00 176.54 177.72 2c8t h MET 75 N 0.01 0.31 -0.43 4.80 -1.53 -0.30 -1.33 114.93 116.44 2c8t h MET 75 Ca 0.00 -0.27 0.03 0.00 -3.44 0.00 0.00 59.70 56.01 2c8t h MET 75 Cb 0.31 0.07 -0.03 0.00 -0.55 0.00 0.00 31.60 31.39 2c8t h MET 75 CO 0.02 0.94 0.23 0.00 0.14 0.00 0.00 176.91 178.24 2c8t h ALA 76 N 0.97 0.54 0.17 0.39 0.00 -0.65 -0.16 119.26 120.53 2c8t h ALA 76 Ca -0.04 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2c8t h ALA 76 Cb 1.36 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 2c8t h ALA 76 CO 0.13 -0.12 -0.13 0.82 0.00 0.00 0.00 179.25 179.95 2c8t h ILE 77 N 0.46 0.71 -0.42 0.00 2.04 -1.16 -2.33 117.51 116.81 2c8t h ILE 77 Ca 0.18 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.12 2c8t h ILE 77 Cb 0.07 0.71 -0.09 0.00 -0.74 0.00 0.00 36.82 36.77 2c8t h ILE 77 CO -0.11 0.00 -0.40 0.22 0.00 0.00 0.00 178.15 177.86 2c8t h TYR 78 N -0.31 -1.14 -0.67 1.37 3.20 -1.07 0.88 116.97 119.23 2c8t h TYR 78 Ca -0.01 0.07 0.13 0.00 3.14 0.00 0.00 58.73 62.06 2c8t h TYR 78 Cb 0.28 0.56 -0.10 0.00 1.54 0.00 0.00 36.73 39.01 2c8t h TYR 78 CO -0.11 -0.42 0.15 -0.44 -1.64 0.00 0.00 178.16 175.70 2c8t h ASP 79 N -0.30 0.01 -0.72 -2.11 3.32 -0.89 0.14 116.42 115.87 2c8t h ASP 79 Ca 0.15 0.13 -0.06 0.00 0.02 0.00 0.00 57.03 57.27 2c8t h ASP 79 Cb 0.57 0.17 -0.03 0.00 0.22 0.00 0.00 39.33 40.26 2c8t h ASP 79 CO -0.57 -0.01 0.22 0.74 -1.72 0.00 0.00 179.24 177.90 2c8t h THR 80 N 0.27 1.26 -0.50 0.35 2.02 -0.74 0.45 112.91 116.03 2c8t h THR 80 Ca 0.36 -0.91 0.05 0.00 0.77 0.00 0.00 66.41 66.68 2c8t h THR 80 Cb 0.57 0.48 -0.05 0.00 -1.74 0.00 0.00 68.15 67.42 2c8t h THR 80 CO -0.45 0.36 0.23 0.24 0.37 0.00 0.00 175.52 176.26 2c8t h MET 81 N 1.07 0.43 -0.20 6.66 2.86 0.96 0.31 114.93 127.03 2c8t h MET 81 Ca 0.23 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.82 2c8t h MET 81 Cb 0.32 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.87 2c8t h MET 81 CO -0.01 0.29 0.05 0.28 1.06 0.00 0.00 176.91 178.58 2c8t h VAL 82 N 0.44 1.21 -0.17 -2.22 2.07 -0.33 -3.11 116.25 114.14 2c8t h VAL 82 Ca 0.23 -0.68 0.05 0.00 0.82 0.00 0.00 66.70 67.12 2c8t h VAL 82 Cb 0.17 1.27 -0.06 0.00 -1.52 0.00 0.00 31.29 31.15 2c8t h VAL 82 CO -0.18 0.21 -0.26 0.25 0.02 0.00 0.00 177.57 177.61 2c8t h LEU 83 N 0.14 -0.81 -9.30 2.57 5.85 0.23 -3.41 115.31 110.58 2c8t h LEU 83 Ca 0.06 0.13 -0.63 0.00 0.84 0.00 0.00 57.88 58.28 2c8t h LEU 83 Cb 0.28 0.36 0.03 0.00 0.37 0.00 0.00 40.66 41.70 2c8t h LEU 83 CO 0.00 -0.30 0.97 0.00 -0.34 0.00 0.00 178.44 178.77 2c8t n ALA 84 N -2.78 0.69 0.18 1.25 0.00 0.07 -4.84 120.51 115.08 2c8t n ALA 84 Ca -0.02 0.35 0.07 0.00 0.00 0.00 0.00 53.44 53.83 2c8t n ALA 84 Cb 0.29 -2.40 0.57 0.00 0.00 0.00 0.00 19.45 17.92 2c8t n ALA 84 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2c8t h PRO 85 N 7.94 0.15 -7.11 0.00 0.11 -1.83 -3.44 132.00 127.82 2c8t h PRO 85 Ca -0.47 -0.01 -0.49 0.00 0.11 0.00 0.00 66.00 65.13 2c8t h PRO 85 Cb 1.28 -0.03 0.03 0.00 0.11 0.00 0.00 31.00 32.38 2c8t h PRO 85 CO 0.93 0.11 0.28 0.00 -0.21 0.00 0.00 178.00 179.11 2c8t s ASP 87 N -3.61 5.20 -0.21 0.00 1.01 -1.26 -4.89 116.67 112.90 2c8t s ASP 87 Ca 0.54 2.66 0.02 0.00 0.71 0.00 0.00 52.55 56.48 2c8t s ASP 87 Cb -0.10 -2.63 0.04 0.00 1.01 0.00 0.00 42.92 41.24 2c8t s ASP 87 CO 0.41 -1.61 -0.13 -0.63 0.21 0.00 0.00 175.17 173.42 2c8t s ILE 88 N -1.37 1.93 0.06 0.77 1.01 -1.26 -1.39 121.20 120.95 2c8t s ILE 88 Ca 0.74 -1.20 -0.17 0.00 0.00 0.00 0.00 60.65 60.01 2c8t s ILE 88 Cb -0.38 -1.94 -0.06 0.00 0.01 0.00 0.00 42.46 40.08 2c8t s ILE 88 CO 0.44 0.20 0.51 0.00 0.00 0.00 0.00 174.94 176.08 2c8t s ALA 89 N 1.27 3.63 -0.04 9.38 0.00 0.23 -1.21 121.76 135.02 2c8t s ALA 89 Ca -0.02 -0.08 0.05 0.00 0.00 0.00 0.00 51.96 51.91 2c8t s ALA 89 Cb -0.17 -2.53 -0.01 0.00 0.00 0.00 0.00 23.12 20.42 2c8t s ALA 89 CO -0.08 0.44 -0.21 0.99 0.00 0.00 0.00 175.76 176.90 2c8t s THR 90 N -1.16 1.68 -0.14 0.00 2.01 -0.36 -0.27 115.64 117.40 2c8t s THR 90 Ca 0.29 -0.87 -0.01 0.00 0.31 0.00 0.00 61.69 61.41 2c8t s THR 90 Cb -0.18 -1.43 0.04 0.00 0.01 0.00 0.00 72.50 70.94 2c8t s THR 90 CO 0.17 0.48 -0.02 -0.31 -0.69 0.00 0.00 174.62 174.25 2c8t s TYR 91 N -0.11 1.22 -0.37 4.92 1.51 -0.52 0.73 117.35 124.72 2c8t s TYR 91 Ca -0.02 -0.73 -0.28 0.00 -1.01 0.00 0.00 57.07 55.03 2c8t s TYR 91 Cb -0.12 -1.09 0.02 0.00 -0.11 0.00 0.00 41.96 40.66 2c8t s TYR 91 CO 0.02 -0.52 1.03 0.00 -1.11 0.00 0.00 175.55 174.97 2c8t s ALA 92 N 1.79 3.39 -0.31 3.71 0.00 0.04 0.03 121.76 130.41 2c8t s ALA 92 Ca 0.02 -0.30 0.02 0.00 0.00 0.00 0.00 51.96 51.70 2c8t s ALA 92 Cb -0.15 -3.67 0.09 0.00 0.00 0.00 0.00 23.12 19.40 2c8t s ALA 92 CO -0.07 -1.70 0.05 1.41 0.00 0.00 0.00 175.76 175.46 2c8t s MET 93 N 3.75 1.20 0.71 0.00 0.00 -0.07 -1.23 119.30 123.65 2c8t s MET 93 Ca 0.43 -1.43 0.00 0.00 0.00 0.00 0.00 55.69 54.69 2c8t s MET 93 Cb -0.11 -2.63 0.00 0.00 0.00 0.00 0.00 34.83 32.09 2c8t s MET 93 CO 0.20 -0.91 0.00 0.41 0.00 0.00 0.00 175.02 174.72 2c8t n GLY 94 N 4.55 1.06 3.02 2.11 0.00 -1.26 -3.80 105.19 110.87 2c8t n GLY 94 Ca -0.01 -0.60 -0.24 0.00 0.00 0.00 0.00 46.02 45.17 2c8t n GLY 94 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2c8t s MET 95 N 0.00 1.59 -0.33 1.61 -2.45 -1.26 0.26 119.30 118.71 2c8t s MET 95 Ca 0.00 -0.39 0.03 0.00 -1.25 0.00 0.00 55.69 54.08 2c8t s MET 95 Cb 0.00 -1.33 0.09 0.00 1.25 0.00 0.00 34.83 34.84 2c8t s MET 95 CO 0.00 0.03 0.04 0.00 1.05 0.00 0.00 175.02 176.14 2c8t s ALA 96 N 0.63 2.88 0.26 4.11 0.00 -0.73 -0.27 121.76 128.64 2c8t s ALA 96 Ca -0.13 -2.40 0.11 0.00 0.00 0.00 0.00 51.96 49.55 2c8t s ALA 96 Cb -0.15 -1.96 -0.05 0.00 0.00 0.00 0.00 23.12 20.96 2c8t s ALA 96 CO 0.03 -1.61 -0.17 0.00 0.00 0.00 0.00 175.76 174.01 2c8t s ALA 97 N 0.97 2.79 0.00 0.00 0.00 -0.92 -1.64 121.76 122.96 2c8t s ALA 97 Ca 0.07 -1.81 0.00 0.00 0.00 0.00 0.00 51.96 50.22 2c8t s ALA 97 Cb -0.20 -0.36 0.00 0.00 0.00 0.00 0.00 23.12 22.56 2c8t s ALA 97 CO -0.07 0.30 0.00 0.43 0.00 0.00 0.00 175.76 176.42 2c8t n SER 98 N -0.54 0.00 0.27 0.00 7.64 -0.62 0.10 113.62 120.48 2c8t n SER 98 Ca -0.06 0.00 0.18 0.00 1.01 0.00 0.00 58.87 60.00 2c8t n SER 98 Cb 0.59 0.00 0.94 0.00 -1.01 0.00 0.00 64.21 64.73 2c8t n SER 98 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 2c8t h MET 99 N 0.00 0.00 -0.60 1.43 0.00 -1.85 0.21 114.93 114.11 2c8t h MET 99 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 59.70 59.61 2c8t h MET 99 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 31.60 31.58 2c8t h MET 99 CO 0.00 0.00 0.02 0.78 0.00 0.00 0.00 176.91 177.71 2c8t h GLY 100 N 0.00 1.12 0.79 8.32 0.00 0.42 -0.26 103.07 113.45 2c8t h GLY 100 Ca 0.04 -0.79 -0.03 0.00 0.00 0.00 0.00 47.33 46.55 2c8t h GLY 100 CO -0.00 0.73 -0.00 -2.09 0.00 0.00 0.00 176.54 175.18 2c8t h GLU 101 N 0.95 0.27 -0.37 4.80 4.22 -0.27 -2.15 114.58 122.04 2c8t h GLU 101 Ca 0.17 -0.09 0.07 0.00 0.08 0.00 0.00 59.36 59.60 2c8t h GLU 101 Cb 0.52 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.68 2c8t h GLU 101 CO 0.03 0.50 -0.06 0.35 -2.18 0.00 0.00 179.01 177.65 2c8t h PHE 102 N 0.01 -0.13 -0.04 0.92 3.57 -1.15 0.13 116.94 120.26 2c8t h PHE 102 Ca 0.04 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.45 2c8t h PHE 102 Cb 0.38 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 2c8t h PHE 102 CO 0.04 -0.13 -0.55 -0.07 -2.23 0.00 0.00 178.31 175.36 2c8t h LEU 103 N 0.04 0.13 0.21 0.59 3.38 -1.05 0.53 115.31 119.14 2c8t h LEU 103 Ca 0.18 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2c8t h LEU 103 Cb 0.27 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2c8t h LEU 103 CO -0.35 0.66 -0.18 0.25 0.09 0.00 0.00 178.44 178.90 2c8t h LEU 104 N 0.09 -0.47 -2.11 1.67 5.85 -0.60 -2.80 115.31 116.94 2c8t h LEU 104 Ca -0.00 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 2c8t h LEU 104 Cb 1.01 0.16 -0.00 0.00 0.37 0.00 0.00 40.66 42.19 2c8t h LEU 104 CO 0.08 -0.27 -0.07 0.00 -0.34 0.00 0.00 178.44 177.84 2c8t h ALA 105 N 0.34 1.55 -0.00 1.25 0.00 -0.18 -2.61 119.26 119.61 2c8t h ALA 105 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2c8t h ALA 105 Cb 0.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2c8t h ALA 105 CO -0.03 0.08 -0.02 0.00 0.00 0.00 0.00 179.25 179.29 2c8t n ALA 106 N -2.37 2.66 -1.08 0.00 0.00 0.13 -4.84 120.51 115.00 2c8t n ALA 106 Ca -0.03 -0.25 -0.30 0.00 0.00 0.00 0.00 53.44 52.86 2c8t n ALA 106 Cb 0.15 -1.42 0.14 0.00 0.00 0.00 0.00 19.45 18.32 2c8t n ALA 106 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2c8t s GLY 107 N -2.15 1.64 0.13 0.00 0.00 -0.99 -4.88 107.32 101.08 2c8t s GLY 107 Ca 0.41 0.16 -0.34 0.00 0.00 0.00 0.00 44.72 44.95 2c8t s GLY 107 CO 0.39 0.61 1.62 2.41 0.00 0.00 0.00 173.10 178.13 2c8t n THR 108 N -3.91 0.07 -1.77 0.90 -1.04 -0.35 -4.86 114.28 103.31 2c8t n THR 108 Ca 0.08 -0.01 -0.41 0.00 -2.04 0.00 0.00 64.05 61.67 2c8t n THR 108 Cb 0.54 -1.59 -0.02 0.00 -1.82 0.00 0.00 70.33 67.45 2c8t n THR 108 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2c8t s LYS 109 N 1.27 4.12 0.00 -2.82 1.02 -1.26 -0.87 119.74 121.20 2c8t s LYS 109 Ca 0.80 2.59 0.00 0.00 0.02 0.00 0.00 55.97 59.38 2c8t s LYS 109 Cb -0.67 -3.02 0.00 0.00 -0.52 0.00 0.00 37.83 33.61 2c8t s LYS 109 CO 0.39 -0.64 0.00 0.41 -0.92 0.00 0.00 175.35 174.59 2c8t n GLY 110 N 2.23 2.52 1.87 -3.33 0.00 -1.26 -4.90 105.19 102.33 2c8t n GLY 110 Ca 0.08 -0.11 -0.22 0.00 0.00 0.00 0.00 46.02 45.78 2c8t n GLY 110 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2c8t n LYS 111 N 0.00 3.04 -4.10 1.61 5.02 -0.05 -4.85 118.16 118.83 2c8t n LYS 111 Ca 0.00 -3.80 -0.35 0.00 -2.02 0.00 0.00 58.31 52.15 2c8t n LYS 111 Cb 0.00 -2.17 -0.13 0.00 -0.02 0.00 0.00 35.03 32.70 2c8t n LYS 111 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2c8t s ARG 112 N -3.57 3.50 0.11 1.97 0.52 -1.25 -1.23 118.95 119.00 2c8t s ARG 112 Ca 0.52 -0.58 0.07 0.00 -0.52 0.00 0.00 55.73 55.23 2c8t s ARG 112 Cb 0.43 -3.00 -0.04 0.00 0.52 0.00 0.00 34.95 32.87 2c8t s ARG 112 CO 0.02 -0.04 -0.18 0.71 0.02 0.00 0.00 175.30 175.83 2c8t s TYR 113 N 1.08 1.64 -0.05 -0.53 1.51 0.22 0.38 117.35 121.61 2c8t s TYR 113 Ca 0.01 -0.45 0.04 0.00 -1.01 0.00 0.00 57.07 55.67 2c8t s TYR 113 Cb -0.15 -0.88 -0.00 0.00 -0.11 0.00 0.00 41.96 40.82 2c8t s TYR 113 CO 0.00 0.19 -0.18 0.00 -1.11 0.00 0.00 175.55 174.46 2c8t s ALA 114 N -1.46 1.60 0.49 3.71 0.00 -0.30 -0.78 121.76 125.02 2c8t s ALA 114 Ca 0.07 -0.72 -0.19 0.00 0.00 0.00 0.00 51.96 51.12 2c8t s ALA 114 Cb -0.09 -0.54 -0.08 0.00 0.00 0.00 0.00 23.12 22.41 2c8t s ALA 114 CO 0.04 0.28 1.00 -0.51 0.00 0.00 0.00 175.76 176.57 2c8t s LEU 115 N 0.08 3.77 0.46 0.00 1.43 -0.37 -1.53 118.68 122.51 2c8t s LEU 115 Ca -0.05 1.74 0.17 0.00 -1.03 0.00 0.00 54.13 54.96 2c8t s LEU 115 Cb -0.12 -4.54 1.14 0.00 0.03 0.00 0.00 46.19 42.70 2c8t s LEU 115 CO 0.03 -0.65 1.97 -0.65 0.23 0.00 0.00 176.35 177.29 2c8t h PRO 116 N 1.34 0.28 -0.37 1.29 0.11 -1.91 0.24 132.00 132.98 2c8t h PRO 116 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2c8t h PRO 116 Cb 1.20 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2c8t h PRO 116 CO 0.60 0.19 0.00 0.72 -0.21 0.00 0.00 178.00 179.30 2c8t n HIS 117 N -4.45 0.49 -1.58 0.65 8.25 -1.26 -4.40 115.22 112.91 2c8t n HIS 117 Ca 0.11 -0.34 -0.39 0.00 -0.26 0.00 0.00 57.72 56.84 2c8t n HIS 117 Cb 0.46 -0.01 0.03 0.00 1.12 0.00 0.00 29.99 31.60 2c8t n HIS 117 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2c8t n ALA 118 N 1.05 -0.09 -2.85 -1.41 0.00 0.85 -4.75 120.51 113.31 2c8t n ALA 118 Ca 0.16 0.08 -0.13 0.00 0.00 0.00 0.00 53.44 53.54 2c8t n ALA 118 Cb 0.50 -2.04 -0.12 0.00 0.00 0.00 0.00 19.45 17.78 2c8t n ALA 118 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2c8t s ARG 119 N -2.35 0.47 -0.15 0.00 1.70 0.14 -3.01 118.95 115.76 2c8t s ARG 119 Ca 0.70 -0.59 -0.02 0.00 -0.47 0.00 0.00 55.73 55.34 2c8t s ARG 119 Cb -0.47 -0.28 -0.02 0.00 -0.57 0.00 0.00 34.95 33.61 2c8t s ARG 119 CO 0.52 0.06 -0.08 0.42 -1.08 0.00 0.00 175.30 175.14 2c8t s ILE 120 N -1.05 3.46 -0.23 4.99 1.09 -0.54 -1.78 121.20 127.14 2c8t s ILE 120 Ca -0.07 -0.51 -0.01 0.00 -1.10 0.00 0.00 60.65 58.96 2c8t s ILE 120 Cb -0.08 -2.50 0.02 0.00 -1.06 0.00 0.00 42.46 38.85 2c8t s ILE 120 CO 0.00 0.50 -0.11 -0.76 -0.10 0.00 0.00 174.94 174.48 2c8t s LEU 121 N 0.47 2.86 0.40 2.97 2.01 -0.65 0.63 118.68 127.36 2c8t s LEU 121 Ca -0.06 -0.80 -0.19 0.00 0.01 0.00 0.00 54.13 53.09 2c8t s LEU 121 Cb -0.15 -1.61 -0.10 0.00 0.01 0.00 0.00 46.19 44.34 2c8t s LEU 121 CO 0.04 -0.08 0.89 -0.04 1.01 0.00 0.00 176.35 178.16 2c8t s MET 122 N 1.31 4.15 -0.29 1.70 -1.94 -0.69 -1.59 119.30 121.96 2c8t s MET 122 Ca 0.01 0.98 -0.12 0.00 -1.71 0.00 0.00 55.69 54.85 2c8t s MET 122 Cb -0.16 -2.25 0.11 0.00 2.01 0.00 0.00 34.83 34.54 2c8t s MET 122 CO -0.07 0.02 0.66 -1.58 -0.01 0.00 0.00 175.02 174.03 2c8t s HIS 123 N -2.14 -1.20 -0.27 -0.03 5.04 -1.26 -3.93 115.29 111.50 2c8t s HIS 123 Ca 0.60 2.21 -0.33 0.00 -1.54 0.00 0.00 55.06 56.00 2c8t s HIS 123 Cb -0.09 0.71 -0.09 0.00 0.04 0.00 0.00 32.58 33.14 2c8t s HIS 123 CO 0.15 -0.60 2.16 0.94 -2.34 0.00 0.00 174.74 175.05 2c8t n GLN 124 N 4.94 1.50 -3.16 2.88 -0.06 -0.77 -4.77 117.38 117.94 2c8t n GLN 124 Ca -0.16 0.43 -0.32 0.00 -2.00 0.00 0.00 57.00 54.96 2c8t n GLN 124 Cb 0.53 -2.73 -0.05 0.00 -4.06 0.00 0.00 30.24 23.93 2c8t n GLN 124 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 2c8t s PRO 125 N 5.97 3.89 0.00 3.69 0.04 -1.26 -5.04 135.00 142.28 2c8t s PRO 125 Ca 1.05 0.50 0.00 0.00 0.04 0.00 0.00 61.00 62.59 2c8t s PRO 125 Cb -0.67 -2.49 0.00 0.00 0.04 0.00 0.00 34.50 31.38 2c8t s PRO 125 CO 0.45 0.16 0.00 1.28 0.04 0.00 0.00 177.00 178.93 2c8t n LEU 126 N -0.51 0.00 -0.08 -3.56 4.77 -1.26 -5.10 117.00 111.26 2c8t n LEU 126 Ca 0.02 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.92 2c8t n LEU 126 Cb 0.53 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.59 2c8t n LEU 126 CO 0.44 0.00 -0.65 -0.38 -1.33 0.00 0.00 177.39 175.46 2c8t n ILE 136 N 0.00 1.49 -0.36 -0.08 5.41 -1.26 -5.18 119.36 119.37 2c8t n ILE 136 Ca 0.00 0.15 0.05 0.00 1.00 0.00 0.00 62.75 63.95 2c8t n ILE 136 Cb 0.00 -2.31 0.21 0.00 -0.71 0.00 0.00 39.64 36.83 2c8t n ILE 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2c8t h ALA 137 N -0.95 1.43 -0.61 -1.39 0.00 -2.06 -1.34 119.26 114.34 2c8t h ALA 137 Ca -0.01 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2c8t h ALA 137 Cb 0.96 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 2c8t h ALA 137 CO -0.00 0.30 0.19 0.82 0.00 0.00 0.00 179.25 180.56 2c8t h ILE 138 N 1.05 1.25 -0.10 0.00 5.03 -2.06 -2.83 117.51 119.84 2c8t h ILE 138 Ca 0.46 -0.84 -0.09 0.00 -0.12 0.00 0.00 64.86 64.27 2c8t h ILE 138 Cb 0.35 0.63 -0.01 0.00 -3.03 0.00 0.00 36.82 34.76 2c8t h ILE 138 CO -0.23 0.32 -0.34 1.56 -0.68 0.00 0.00 178.15 178.78 2c8t h GLN 139 N 0.88 0.21 0.49 2.37 4.20 -1.73 -2.75 115.11 118.76 2c8t h GLN 139 Ca 0.20 -0.08 -0.02 0.00 0.06 0.00 0.00 58.65 58.81 2c8t h GLN 139 Cb 0.30 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.06 2c8t h GLN 139 CO -0.01 0.53 -0.30 0.00 -0.67 0.00 0.00 178.83 178.39 2c8t h ALA 140 N 1.47 -0.75 -0.62 3.87 0.00 -1.07 -0.85 119.26 121.31 2c8t h ALA 140 Ca 0.02 -0.15 0.11 0.00 0.00 0.00 0.00 54.91 54.90 2c8t h ALA 140 Cb 0.70 0.37 -0.12 0.00 0.00 0.00 0.00 17.79 18.74 2c8t h ALA 140 CO 0.05 -0.93 -0.29 0.93 0.00 0.00 0.00 179.25 179.01 2c8t h GLU 141 N -0.74 -0.11 -0.35 0.00 5.08 -1.42 0.55 114.58 117.58 2c8t h GLU 141 Ca -0.06 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2c8t h GLU 141 Cb 0.61 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 2c8t h GLU 141 CO 0.06 -0.07 0.22 1.96 -1.00 0.00 0.00 179.01 180.17 2c8t h GLN 142 N -0.12 0.47 0.06 2.33 4.20 -1.34 -1.70 115.11 119.02 2c8t h GLN 142 Ca 0.26 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.93 2c8t h GLN 142 Cb 0.54 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.22 2c8t h GLN 142 CO -0.69 0.33 -0.03 0.35 -0.67 0.00 0.00 178.83 178.12 2c8t h PHE 143 N 0.46 -0.07 -0.65 2.96 3.57 -0.40 -0.94 116.94 121.86 2c8t h PHE 143 Ca 0.13 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.75 2c8t h PHE 143 Cb -0.02 0.02 -0.09 0.00 2.79 0.00 0.00 35.95 38.65 2c8t h PHE 143 CO -0.05 -0.02 0.17 0.00 -2.23 0.00 0.00 178.31 176.19 2c8t h ALA 144 N 0.83 0.81 -0.37 2.41 0.00 -0.74 0.41 119.26 122.61 2c8t h ALA 144 Ca -0.01 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2c8t h ALA 144 Cb 0.09 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2c8t h ALA 144 CO 0.01 -0.29 0.15 0.28 0.00 0.00 0.00 179.25 179.40 2c8t h VAL 145 N 0.29 1.19 0.01 0.00 2.07 -0.96 -1.62 116.25 117.23 2c8t h VAL 145 Ca 0.35 -0.57 -0.19 0.00 0.82 0.00 0.00 66.70 67.11 2c8t h VAL 145 Cb 0.53 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 2c8t h VAL 145 CO -0.42 0.20 -0.90 -0.29 0.02 0.00 0.00 177.57 176.18 2c8t h ILE 146 N 0.45 1.59 -0.01 4.57 2.10 -0.22 -2.42 117.51 123.56 2c8t h ILE 146 Ca 0.12 -2.91 -0.00 0.00 1.08 0.00 0.00 64.86 63.15 2c8t h ILE 146 Cb 0.18 2.60 -0.00 0.00 -1.09 0.00 0.00 36.82 38.51 2c8t h ILE 146 CO -0.01 0.84 0.00 0.50 -1.08 0.00 0.00 178.15 178.40 2c8t h LYS 147 N 0.03 0.01 -0.68 2.19 3.64 -0.16 -0.41 116.57 121.20 2c8t h LYS 147 Ca -0.03 -0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.39 2c8t h LYS 147 Cb 1.57 -0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 33.34 2c8t h LYS 147 CO 0.13 0.16 0.40 -0.22 -2.27 0.00 0.00 179.45 177.65 2c8t h LYS 148 N -0.13 0.75 -0.57 1.90 3.64 -1.30 -1.54 116.57 119.32 2c8t h LYS 148 Ca 0.00 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 2c8t h LYS 148 Cb 0.15 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 2c8t h LYS 148 CO -0.00 0.49 0.22 1.49 -2.27 0.00 0.00 179.45 179.38 2c8t h GLU 149 N 0.77 0.82 0.30 1.90 4.57 -1.28 -1.05 114.58 120.61 2c8t h GLU 149 Ca 0.29 -0.13 -0.01 0.00 -1.18 0.00 0.00 59.36 58.33 2c8t h GLU 149 Cb 0.10 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.55 2c8t h GLU 149 CO -0.14 0.68 -0.14 1.98 -1.18 0.00 0.00 179.01 180.20 2c8t h MET 150 N 0.81 -0.39 -0.71 1.92 4.05 -0.16 -2.15 114.93 118.30 2c8t h MET 150 Ca 0.19 0.03 0.12 0.00 -0.28 0.00 0.00 59.70 59.75 2c8t h MET 150 Cb 0.17 0.09 -0.13 0.00 -0.80 0.00 0.00 31.60 30.93 2c8t h MET 150 CO -0.02 -0.08 -0.37 0.74 0.23 0.00 0.00 176.91 177.41 2c8t h PHE 151 N -0.70 -1.05 -0.60 1.39 0.05 -1.21 0.28 116.94 115.09 2c8t h PHE 151 Ca -0.04 0.08 0.11 0.00 3.82 0.00 0.00 57.97 61.95 2c8t h PHE 151 Cb 0.48 0.56 -0.12 0.00 2.00 0.00 0.00 35.95 38.88 2c8t h PHE 151 CO 0.02 -0.40 -0.25 -0.09 -0.18 0.00 0.00 178.31 177.41 2c8t h ARG 152 N -0.12 -0.10 -0.14 1.51 2.43 -1.11 0.11 114.38 116.96 2c8t h ARG 152 Ca 0.25 0.01 -0.19 0.00 -0.81 0.00 0.00 59.98 59.24 2c8t h ARG 152 Cb 0.56 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.13 2c8t h ARG 152 CO -0.77 -0.06 -0.68 -0.07 -1.51 0.00 0.00 179.97 176.87 2c8t h LEU 153 N -0.10 0.67 -0.04 3.80 3.38 -0.51 -1.71 115.31 120.79 2c8t h LEU 153 Ca 0.26 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.83 2c8t h LEU 153 Cb 0.52 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 2c8t h LEU 153 CO -0.66 1.16 0.02 -1.13 0.09 0.00 0.00 178.44 177.92 2c8t h ASN 154 N 0.41 0.04 -0.60 -0.43 -0.00 0.28 0.28 115.58 115.57 2c8t h ASN 154 Ca -0.02 -0.00 0.12 0.00 -0.00 0.00 0.00 56.30 56.40 2c8t h ASN 154 Cb 1.26 -0.01 -0.11 0.00 -0.00 0.00 0.00 38.32 39.46 2c8t h ASN 154 CO 0.13 0.03 -0.09 0.00 -0.00 0.00 0.00 177.43 177.51 2c8t h ALA 155 N 1.01 0.48 -0.02 1.57 0.00 -0.74 -1.67 119.26 119.89 2c8t h ALA 155 Ca 0.01 0.21 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 2c8t h ALA 155 Cb -0.00 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2c8t h ALA 155 CO -0.00 -0.42 0.00 1.49 0.00 0.00 0.00 179.25 180.32 2c8t h GLU 156 N 0.05 0.04 -0.63 0.00 4.81 -0.45 0.90 114.58 119.30 2c8t h GLU 156 Ca 0.30 -0.01 0.14 0.00 -0.13 0.00 0.00 59.36 59.66 2c8t h GLU 156 Cb 0.47 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.81 2c8t h GLU 156 CO -0.57 0.27 0.43 0.74 -0.73 0.00 0.00 179.01 179.15 2c8t h PHE 157 N -0.20 0.27 0.00 0.92 0.05 -0.28 -3.12 116.94 114.57 2c8t h PHE 157 Ca 0.01 0.01 0.00 0.00 3.82 0.00 0.00 57.97 61.80 2c8t h PHE 157 Cb 0.25 -0.09 0.00 0.00 2.00 0.00 0.00 35.95 38.12 2c8t h PHE 157 CO 0.01 0.11 -1.34 -2.37 -0.18 0.00 0.00 178.31 174.54 2c8t n THR 158 N -4.43 0.00 -0.58 -1.55 5.66 -0.64 -4.84 114.28 107.89 2c8t n THR 158 Ca 0.11 -0.28 0.00 0.00 -3.05 0.00 0.00 64.05 60.84 2c8t n THR 158 Cb 0.53 0.42 0.00 0.00 -1.55 0.00 0.00 70.33 69.73 2c8t n THR 158 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2c8t n GLY 159 N 1.60 0.78 3.92 1.09 0.00 0.28 -4.29 105.19 108.57 2c8t n GLY 159 Ca -0.01 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.81 2c8t n GLY 159 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c8t s GLN 160 N -0.42 2.96 0.40 1.61 -1.52 -1.02 -5.02 119.66 116.64 2c8t s GLN 160 Ca 0.00 -1.13 -0.24 0.00 -1.95 0.00 0.00 55.36 52.04 2c8t s GLN 160 Cb 0.00 -2.66 -0.09 0.00 -0.22 0.00 0.00 33.01 30.04 2c8t s GLN 160 CO 0.00 0.11 1.10 -2.14 -0.25 0.00 0.00 175.29 174.11 2c8t s PRO 161 N -4.07 4.10 0.35 2.91 0.02 -1.26 -4.58 135.00 132.46 2c8t s PRO 161 Ca 0.42 1.66 0.10 0.00 0.02 0.00 0.00 61.00 63.20 2c8t s PRO 161 Cb -0.08 -2.59 0.87 0.00 0.02 0.00 0.00 34.50 32.71 2c8t s PRO 161 CO 0.29 -0.23 1.81 0.82 -0.33 0.00 0.00 177.00 179.36 2c8t h ILE 162 N 2.23 0.71 -0.98 2.83 2.04 -1.93 -0.44 117.51 121.97 2c8t h ILE 162 Ca -0.48 -0.22 0.09 0.00 1.00 0.00 0.00 64.86 65.24 2c8t h ILE 162 Cb 1.23 0.01 -0.07 0.00 -0.74 0.00 0.00 36.82 37.25 2c8t h ILE 162 CO 0.62 0.12 0.63 -0.33 0.00 0.00 0.00 178.15 179.19 2c8t h GLU 163 N 0.64 1.03 0.10 2.37 3.07 -1.99 -1.14 114.58 118.67 2c8t h GLU 163 Ca 0.53 -0.06 -0.27 0.00 -0.50 0.00 0.00 59.36 59.06 2c8t h GLU 163 Cb 0.99 -0.23 0.01 0.00 -0.84 0.00 0.00 28.75 28.68 2c8t h GLU 163 CO -0.29 0.68 -1.17 -0.09 -1.40 0.00 0.00 179.01 176.74 2c8t h ARG 164 N 1.06 0.42 -0.46 2.33 2.43 -1.48 -1.61 114.38 117.08 2c8t h ARG 164 Ca 0.44 -0.58 -0.00 0.00 -0.81 0.00 0.00 59.98 59.03 2c8t h ARG 164 Cb 0.30 0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 2c8t h ARG 164 CO -0.20 1.24 0.28 0.82 -1.51 0.00 0.00 179.97 180.61 2c8t h ILE 165 N 0.17 1.14 0.76 1.20 1.08 -0.87 0.41 117.51 121.40 2c8t h ILE 165 Ca -0.14 -0.30 -0.04 0.00 -0.39 0.00 0.00 64.86 64.00 2c8t h ILE 165 Cb 1.86 0.51 0.01 0.00 -3.07 0.00 0.00 36.82 36.13 2c8t h ILE 165 CO 0.21 0.14 -0.37 -0.33 -0.69 0.00 0.00 178.15 177.11 2c8t h GLU 166 N 0.61 -0.99 -0.85 2.37 5.08 -1.24 -2.27 114.58 117.29 2c8t h GLU 166 Ca 0.16 0.07 0.18 0.00 -1.00 0.00 0.00 59.36 58.78 2c8t h GLU 166 Cb -0.02 0.22 -0.11 0.00 0.50 0.00 0.00 28.75 29.34 2c8t h GLU 166 CO -0.03 -0.64 0.37 0.00 -1.00 0.00 0.00 179.01 177.71 2c8t h ALA 167 N -0.98 1.29 -0.19 3.43 0.00 -1.15 -0.34 119.26 121.31 2c8t h ALA 167 Ca -0.10 0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 2c8t h ALA 167 Cb 0.80 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2c8t h ALA 167 CO 0.17 -0.26 -0.43 -0.44 0.00 0.00 0.00 179.25 178.29 2c8t h ASP 168 N 0.45 0.49 -0.08 0.00 3.32 -0.92 -2.51 116.42 117.17 2c8t h ASP 168 Ca 0.50 -0.22 -0.17 0.00 0.02 0.00 0.00 57.03 57.16 2c8t h ASP 168 Cb 0.86 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.27 2c8t h ASP 168 CO -0.47 0.86 -0.54 0.28 -1.72 0.00 0.00 179.24 177.65 2c8t h SER 169 N 0.38 0.74 -0.70 6.45 0.02 -0.51 -1.63 113.55 118.31 2c8t h SER 169 Ca 0.03 -0.39 -0.03 0.00 -0.84 0.00 0.00 61.79 60.56 2c8t h SER 169 Cb 0.91 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.21 2c8t h SER 169 CO 0.08 1.13 0.33 0.44 -1.14 0.00 0.00 176.83 177.67 2c8t h ASP 170 N 0.51 0.92 -0.20 3.07 3.32 -1.03 -1.95 116.42 121.06 2c8t h ASP 170 Ca 0.01 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.93 2c8t h ASP 170 Cb 1.10 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.42 2c8t h ASP 170 CO 0.11 0.80 0.00 -2.11 -1.72 0.00 0.00 179.24 176.32 2c8t n ARG 171 N -4.43 1.55 -2.78 3.56 1.85 -0.96 -4.89 116.66 110.55 2c8t n ARG 171 Ca 0.06 -0.76 -0.17 0.00 -1.00 0.00 0.00 57.85 55.97 2c8t n ARG 171 Cb 0.13 -1.23 0.00 0.00 -1.05 0.00 0.00 32.46 30.32 2c8t n ARG 171 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2c8t n ASP 172 N 0.11 -4.30 -4.65 2.89 8.00 -0.99 -4.86 116.55 112.75 2c8t n ASP 172 Ca 0.07 -0.05 -0.47 0.00 0.71 0.00 0.00 54.79 55.05 2c8t n ASP 172 Cb 0.21 -3.59 -0.04 0.00 -0.02 0.00 0.00 41.12 37.69 2c8t n ASP 172 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 2c8t n ARG 173 N -3.26 1.88 -3.71 -1.24 0.63 -0.65 -4.66 116.66 105.66 2c8t n ARG 173 Ca -0.11 0.68 -0.22 0.00 -0.92 0.00 0.00 57.85 57.28 2c8t n ARG 173 Cb 0.60 -2.37 -0.04 0.00 0.45 0.00 0.00 32.46 31.10 2c8t n ARG 173 CO 0.00 0.00 0.00 1.67 -2.51 0.00 0.00 177.63 176.79 2c8t s TRP 174 N 0.44 2.69 -0.03 -0.14 1.48 -1.26 -1.71 118.94 120.41 2c8t s TRP 174 Ca 0.76 -0.51 -0.04 0.00 -1.06 0.00 0.00 56.10 55.24 2c8t s TRP 174 Cb -0.72 -2.11 0.01 0.00 -1.16 0.00 0.00 33.47 29.48 2c8t s TRP 174 CO 0.44 -0.04 0.11 -0.06 -4.06 0.00 0.00 176.95 173.34 2c8t s PHE 175 N -2.50 -0.05 0.65 1.66 0.40 0.20 -4.97 117.98 113.38 2c8t s PHE 175 Ca 0.46 0.12 -0.11 0.00 -0.60 0.00 0.00 56.93 56.81 2c8t s PHE 175 Cb -0.02 -0.00 -0.02 0.00 0.51 0.00 0.00 43.02 43.49 2c8t s PHE 175 CO 0.27 -0.13 1.04 0.99 0.70 0.00 0.00 175.22 178.09 2c8t s THR 176 N -0.42 4.45 0.25 0.64 2.01 -1.26 -1.47 115.64 119.84 2c8t s THR 176 Ca -0.05 0.80 -0.03 0.00 0.31 0.00 0.00 61.69 62.72 2c8t s THR 176 Cb -0.03 -3.69 0.22 0.00 0.01 0.00 0.00 72.50 69.01 2c8t s THR 176 CO 0.00 -1.04 1.74 0.00 -0.69 0.00 0.00 174.62 174.64 2c8t h ALA 177 N -0.45 1.13 0.22 7.40 0.00 -1.74 0.58 119.26 126.39 2c8t h ALA 177 Ca -0.44 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 2c8t h ALA 177 Cb 1.20 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 2c8t h ALA 177 CO 0.60 -0.16 -0.18 0.00 0.00 0.00 0.00 179.25 179.51 2c8t h ALA 178 N 1.54 -0.39 -0.45 0.00 0.00 -1.91 -1.51 119.26 116.55 2c8t h ALA 178 Ca 0.43 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 2c8t h ALA 178 Cb 0.62 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 2c8t h ALA 178 CO -0.38 -0.74 0.23 0.93 0.00 0.00 0.00 179.25 179.29 2c8t h GLU 179 N -0.41 0.62 -0.34 0.00 5.08 -1.69 -2.09 114.58 115.75 2c8t h GLU 179 Ca -0.01 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.19 2c8t h GLU 179 Cb 0.37 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2c8t h GLU 179 CO -0.01 0.48 -0.19 0.00 -1.00 0.00 0.00 179.01 178.28 2c8t h ALA 180 N 1.63 1.02 -0.42 3.43 0.00 0.34 -1.89 119.26 123.37 2c8t h ALA 180 Ca 0.16 -0.34 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 2c8t h ALA 180 Cb 0.05 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2c8t h ALA 180 CO -0.02 0.58 -0.16 1.25 0.00 0.00 0.00 179.25 180.90 2c8t h LEU 181 N 0.57 0.78 -0.37 0.00 5.85 -0.61 -2.14 115.31 119.39 2c8t h LEU 181 Ca 0.09 -0.25 -0.07 0.00 0.84 0.00 0.00 57.88 58.48 2c8t h LEU 181 Cb 0.65 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2c8t h LEU 181 CO 0.05 0.94 -0.05 -0.33 -0.34 0.00 0.00 178.44 178.71 2c8t h GLU 182 N 0.70 0.69 0.00 1.25 5.08 -1.18 -3.10 114.58 118.02 2c8t h GLU 182 Ca 0.11 -0.24 -0.09 0.00 -1.00 0.00 0.00 59.36 58.13 2c8t h GLU 182 Cb 0.65 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 2c8t h GLU 182 CO 0.05 0.82 -0.44 -0.92 -1.00 0.00 0.00 179.01 177.52 2c8t h TYR 183 N 0.49 0.00 0.00 4.33 3.20 -1.29 -3.47 116.97 120.24 2c8t h TYR 183 Ca 0.10 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.97 2c8t h TYR 183 Cb 0.54 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.81 2c8t h TYR 183 CO 0.04 0.44 0.00 0.41 -1.64 0.00 0.00 178.16 177.41 2c8t n GLY 184 N 0.22 1.44 0.21 1.82 0.00 -0.86 -4.70 105.19 103.32 2c8t n GLY 184 Ca -0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 2c8t n GLY 184 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2c8t h PHE 185 N 0.00 0.00 -2.64 1.61 -1.00 -1.67 -3.39 116.94 109.86 2c8t h PHE 185 Ca 0.00 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.68 2c8t h PHE 185 Cb 0.00 0.00 -0.21 0.00 3.61 0.00 0.00 35.95 39.35 2c8t h PHE 185 CO 0.00 0.00 -0.12 0.08 -1.61 0.00 0.00 178.31 176.66 2c8t s VAL 186 N -3.37 0.03 -0.09 -0.55 1.01 -1.25 -3.91 120.40 112.27 2c8t s VAL 186 Ca 0.05 -0.23 0.15 0.00 0.00 0.00 0.00 61.98 61.95 2c8t s VAL 186 Cb 0.08 -0.73 -0.22 0.00 0.00 0.00 0.00 36.38 35.51 2c8t s VAL 186 CO 0.57 -0.13 0.56 0.47 0.00 0.00 0.00 175.10 176.57 2c8t n ASP 187 N 1.55 0.67 -3.85 3.32 8.00 0.16 -4.60 116.55 121.80 2c8t n ASP 187 Ca -0.19 0.32 -0.11 0.00 0.71 0.00 0.00 54.79 55.52 2c8t n ASP 187 Cb 0.56 0.23 -0.09 0.00 -0.02 0.00 0.00 41.12 41.81 2c8t n ASP 187 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 2c8t s HIS 188 N -2.64 0.04 -0.27 1.24 3.76 -0.82 -5.00 115.29 111.59 2c8t s HIS 188 Ca -0.06 -0.20 -0.10 0.00 -0.15 0.00 0.00 55.06 54.55 2c8t s HIS 188 Cb 0.08 -0.03 -0.05 0.00 1.11 0.00 0.00 32.58 33.70 2c8t s HIS 188 CO 0.83 -0.39 0.16 0.42 -0.85 0.00 0.00 174.74 174.90 2c8t s ILE 189 N -2.21 5.11 0.08 0.60 1.01 -1.26 -1.15 121.20 123.38 2c8t s ILE 189 Ca -0.08 0.10 -0.13 0.00 0.00 0.00 0.00 60.65 60.54 2c8t s ILE 189 Cb -0.03 -3.41 -0.06 0.00 0.01 0.00 0.00 42.46 38.97 2c8t s ILE 189 CO -0.02 0.29 0.46 -0.63 0.00 0.00 0.00 174.94 175.04 2c8t s ILE 190 N 1.59 4.98 0.00 2.92 1.01 -0.58 -4.94 121.20 126.18 2c8t s ILE 190 Ca 0.07 0.71 0.00 0.00 0.00 0.00 0.00 60.65 61.43 2c8t s ILE 190 Cb -0.15 -3.71 0.00 0.00 0.01 0.00 0.00 42.46 38.61 2c8t s ILE 190 CO 0.08 0.37 0.00 0.41 0.00 0.00 0.00 174.94 175.80 2c8t n THR 191 N 1.16 0.00 -2.43 2.92 -1.04 -1.26 -4.02 114.28 109.61 2c8t n THR 191 Ca -0.09 0.01 -0.31 0.00 -2.04 0.00 0.00 64.05 61.61 2c8t n THR 191 Cb 0.52 -0.83 -0.03 0.00 -1.82 0.00 0.00 70.33 68.17 2c8t n THR 191 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2c8t s ARG 192 N -0.02 3.85 0.77 -2.82 0.52 -1.26 -5.03 118.95 114.96 2c8t s ARG 192 Ca 0.00 0.79 -0.02 0.00 -0.52 0.00 0.00 55.73 55.99 2c8t s ARG 192 Cb 0.00 -2.19 0.15 0.00 0.52 0.00 0.00 34.95 33.43 2c8t s ARG 192 CO 0.00 -0.26 1.05 0.00 0.02 0.00 0.00 175.30 176.11 2c8t s ALA 193 N -2.66 3.62 0.00 2.13 0.00 -1.26 -5.21 121.76 118.38 2c8t s ALA 193 Ca 0.56 -1.82 0.00 0.00 0.00 0.00 0.00 51.96 50.70 2c8t s ALA 193 Cb -0.10 -2.00 0.00 0.00 0.00 0.00 0.00 23.12 21.02 2c8t s ALA 193 CO 0.35 -1.66 0.00 0.72 0.00 0.00 0.00 175.76 175.17