#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 -0.90 -0.43 1.04 5.85 -2.05 0.08 115.31 118.90 2c8t h LEU 16 Ca 0.00 0.13 0.09 0.00 0.84 0.00 0.00 57.88 58.94 2c8t h LEU 16 Cb 0.00 0.38 -0.09 0.00 0.37 0.00 0.00 40.66 41.32 2c8t h LEU 16 CO 0.00 -0.34 -0.18 0.74 -0.34 0.00 0.00 178.44 178.32 2c8t h THR 17 N -0.39 0.44 -0.62 1.05 2.02 -2.06 -0.01 112.91 113.35 2c8t h THR 17 Ca 0.09 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.25 2c8t h THR 17 Cb 0.52 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 67.34 2c8t h THR 17 CO -0.31 0.00 0.31 0.44 0.37 0.00 0.00 175.52 176.33 2c8t h ASP 18 N -0.09 0.80 -0.69 4.18 3.32 -1.91 -2.24 116.42 119.79 2c8t h ASP 18 Ca 0.21 -0.12 0.04 0.00 0.02 0.00 0.00 57.03 57.18 2c8t h ASP 18 Cb 0.41 -0.21 -0.05 0.00 0.22 0.00 0.00 39.33 39.70 2c8t h ASP 18 CO -0.49 0.70 0.42 -1.28 -1.72 0.00 0.00 179.24 176.87 2c8t h SER 19 N 0.85 0.67 0.03 6.45 0.87 -0.08 0.14 113.55 122.48 2c8t h SER 19 Ca 0.22 0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.78 2c8t h SER 19 Cb 0.10 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 61.92 2c8t h SER 19 CO -0.03 0.46 -0.02 0.58 -0.53 0.00 0.00 176.83 177.29 2c8t h VAL 20 N 0.81 1.05 -0.60 2.23 2.07 -0.77 -1.94 116.25 119.09 2c8t h VAL 20 Ca 0.29 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 67.54 2c8t h VAL 20 Cb 0.07 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 2c8t h VAL 20 CO -0.13 0.06 0.26 1.88 0.02 0.00 0.00 177.57 179.67 2c8t h TYR 21 N -0.15 0.85 0.23 1.57 -1.99 -0.89 -0.34 116.97 116.25 2c8t h TYR 21 Ca -0.00 -0.04 -0.01 0.00 2.00 0.00 0.00 58.73 60.68 2c8t h TYR 21 Cb 0.13 -0.27 0.00 0.00 2.00 0.00 0.00 36.73 38.60 2c8t h TYR 21 CO -0.04 0.64 -0.11 0.93 -0.00 0.00 0.00 178.16 179.58 2c8t h GLU 22 N 0.85 -0.30 -0.91 4.88 5.08 -0.65 0.37 114.58 123.91 2c8t h GLU 22 Ca 0.21 0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.67 2c8t h GLU 22 Cb 0.13 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.37 2c8t h GLU 22 CO -0.02 -0.13 0.56 0.00 -1.00 0.00 0.00 179.01 178.41 2c8t h ARG 23 N -0.39 0.94 0.00 2.33 3.08 -1.08 -0.33 114.38 118.93 2c8t h ARG 23 Ca -0.03 -0.06 -0.07 0.00 0.07 0.00 0.00 59.98 59.89 2c8t h ARG 23 Cb 0.30 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 2c8t h ARG 23 CO 0.05 0.62 -0.32 1.25 -1.07 0.00 0.00 179.97 180.51 2c8t h LEU 24 N 0.97 0.00 -0.85 3.04 5.85 -0.81 -1.95 115.31 121.55 2c8t h LEU 24 Ca 0.42 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 59.01 2c8t h LEU 24 Cb 0.28 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 2c8t h LEU 24 CO -0.21 0.32 -0.55 0.25 -0.34 0.00 0.00 178.44 177.92 2c8t h LEU 25 N 0.00 0.08 -0.41 2.25 5.85 0.81 -1.04 115.31 122.86 2c8t h LEU 25 Ca -0.00 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.67 2c8t h LEU 25 Cb 0.60 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.61 2c8t h LEU 25 CO 0.04 0.61 0.00 -1.20 -0.34 0.00 0.00 178.44 177.55 2c8t n SER 26 N -3.90 0.34 -1.47 1.25 7.64 -0.74 -1.70 113.62 115.04 2c8t n SER 26 Ca -0.02 0.59 0.08 0.00 1.01 0.00 0.00 58.87 60.54 2c8t n SER 26 Cb 0.56 -0.66 0.34 0.00 -1.01 0.00 0.00 64.21 63.44 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 -1.88 3.94 -4.04 1.43 -0.58 -0.73 -4.93 120.64 113.84 2c8t n GLU 27 Ca 0.02 -2.94 -0.31 0.00 -0.42 0.00 0.00 57.16 53.52 2c8t n GLU 27 Cb 0.18 -1.99 -0.01 0.00 -0.57 0.00 0.00 31.44 29.05 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 0.47 -3.87 -5.22 3.49 5.12 -0.69 -4.88 116.66 111.08 2c8t n ARG 28 Ca 0.25 0.45 -0.31 0.00 -1.93 0.00 0.00 57.85 56.31 2c8t n ARG 28 Cb 0.98 -5.04 -0.16 0.00 -1.16 0.00 0.00 32.46 27.08 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 -3.51 1.98 0.02 0.55 1.01 -0.47 -0.92 121.20 119.87 2c8t s ILE 29 Ca 0.47 -1.03 0.00 0.00 0.00 0.00 0.00 60.65 60.10 2c8t s ILE 29 Cb -0.25 -1.68 -0.02 0.00 0.01 0.00 0.00 42.46 40.52 2c8t s ILE 29 CO 0.89 0.55 -0.03 -0.63 0.00 0.00 0.00 174.94 175.72 2c8t s ILE 30 N -0.16 0.17 -0.06 2.92 1.01 0.62 -3.45 121.20 122.26 2c8t s ILE 30 Ca -0.03 -0.83 0.04 0.00 0.00 0.00 0.00 60.65 59.83 2c8t s ILE 30 Cb -0.13 -0.29 -0.00 0.00 0.01 0.00 0.00 42.46 42.04 2c8t s ILE 30 CO 0.03 -0.42 -0.19 -0.36 0.00 0.00 0.00 174.94 174.00 2c8t s PHE 31 N -1.28 1.98 -0.42 3.97 0.40 -1.26 -0.29 117.98 121.09 2c8t s PHE 31 Ca -0.13 -0.65 -0.06 0.00 -0.60 0.00 0.00 56.93 55.50 2c8t s PHE 31 Cb -0.09 -1.34 0.10 0.00 0.51 0.00 0.00 43.02 42.21 2c8t s PHE 31 CO -0.01 -0.24 0.24 -1.17 0.70 0.00 0.00 175.22 174.74 2c8t s LEU 32 N 0.13 5.26 -0.06 -0.37 2.96 0.49 -4.93 118.68 122.16 2c8t s LEU 32 Ca -0.08 -1.85 0.09 0.00 -0.22 0.00 0.00 54.13 52.07 2c8t s LEU 32 Cb -0.14 -1.90 0.13 0.00 0.50 0.00 0.00 46.19 44.79 2c8t s LEU 32 CO 0.04 -0.56 1.03 0.61 -1.32 0.00 0.00 176.35 176.15 2c8t n GLY 33 N 4.74 3.19 0.00 7.98 0.00 -1.26 -0.93 105.19 118.91 2c8t n GLY 33 Ca -0.06 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.85 0.00 -4.68 1.61 3.41 -1.24 -4.79 113.62 107.08 2c8t n SER 34 Ca 0.07 -0.68 -0.59 0.00 -0.26 0.00 0.00 58.87 57.42 2c8t n SER 34 Cb 0.49 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.37 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 0.00 0.86 -2.23 4.33 4.07 -1.26 -4.27 120.64 122.14 2c8t n GLU 35 Ca 0.00 0.31 -0.32 0.00 -0.06 0.00 0.00 57.16 57.09 2c8t n GLU 35 Cb 0.00 -1.94 -0.04 0.00 -0.06 0.00 0.00 31.44 29.40 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 2.64 3.63 0.50 6.31 1.01 0.36 -4.85 120.40 130.00 2c8t s VAL 36 Ca 0.97 -0.60 0.06 0.00 0.00 0.00 0.00 61.98 62.41 2c8t s VAL 36 Cb -1.14 -4.42 0.01 0.00 0.00 0.00 0.00 36.38 30.82 2c8t s VAL 36 CO 0.65 -1.30 0.33 0.54 0.00 0.00 0.00 175.10 175.31 2c8t s ASN 37 N 6.81 4.60 0.18 3.32 4.22 -1.26 -1.04 114.94 131.77 2c8t s ASN 37 Ca 0.62 -1.20 -0.14 0.00 -2.14 0.00 0.00 52.86 50.00 2c8t s ASN 37 Cb -0.04 0.16 0.11 0.00 1.28 0.00 0.00 41.25 42.76 2c8t s ASN 37 CO -0.02 -0.94 1.80 0.44 -2.04 0.00 0.00 177.10 176.34 2c8t h ASP 38 N 0.95 0.43 0.08 3.54 3.32 -1.94 0.94 116.42 123.73 2c8t h ASP 38 Ca -0.39 0.01 0.02 0.00 0.02 0.00 0.00 57.03 56.70 2c8t h ASP 38 Cb 1.29 -0.07 -0.04 0.00 0.22 0.00 0.00 39.33 40.73 2c8t h ASP 38 CO 0.61 0.30 -0.31 -0.08 -1.72 0.00 0.00 179.24 178.04 2c8t h GLU 39 N 0.55 -0.49 -0.61 3.56 4.57 -1.97 0.18 114.58 120.36 2c8t h GLU 39 Ca 0.21 0.03 -0.06 0.00 -1.18 0.00 0.00 59.36 58.36 2c8t h GLU 39 Cb 0.07 0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.74 2c8t h GLU 39 CO -0.12 -0.33 0.13 0.82 -1.18 0.00 0.00 179.01 178.33 2c8t h ILE 40 N -0.51 1.25 0.13 2.32 2.04 -1.84 -1.67 117.51 119.22 2c8t h ILE 40 Ca 0.04 -0.93 0.00 0.00 1.00 0.00 0.00 64.86 64.98 2c8t h ILE 40 Cb 0.56 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 2c8t h ILE 40 CO -0.21 0.35 -0.13 0.00 0.00 0.00 0.00 178.15 178.15 2c8t h ALA 41 N 1.21 -0.26 -0.39 1.87 0.00 -0.27 0.12 119.26 121.54 2c8t h ALA 41 Ca 0.19 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.15 2c8t h ALA 41 Cb 0.36 0.19 -0.09 0.00 0.00 0.00 0.00 17.79 18.26 2c8t h ALA 41 CO 0.00 -0.67 -0.21 -0.91 0.00 0.00 0.00 179.25 177.47 2c8t h ASN 42 N -0.29 -0.71 -0.75 0.00 2.35 -0.50 0.26 115.58 115.93 2c8t h ASN 42 Ca 0.01 0.16 0.02 0.00 -0.55 0.00 0.00 56.30 55.93 2c8t h ASN 42 Cb 0.28 0.38 -0.04 0.00 0.05 0.00 0.00 38.32 38.99 2c8t h ASN 42 CO -0.04 -0.24 0.49 -0.09 -1.65 0.00 0.00 177.43 175.90 2c8t h ARG 43 N -0.14 0.96 -0.29 0.81 2.43 -0.73 0.79 114.38 118.21 2c8t h ARG 43 Ca 0.19 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.28 2c8t h ARG 43 Cb 0.44 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 2c8t h ARG 43 CO -0.48 0.63 0.08 -0.07 -1.51 0.00 0.00 179.97 178.62 2c8t h LEU 44 N 0.98 0.43 -0.48 3.80 3.38 -0.32 -1.21 115.31 121.88 2c8t h LEU 44 Ca 0.28 -0.22 0.05 0.00 0.09 0.00 0.00 57.88 58.09 2c8t h LEU 44 Cb -0.07 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.52 2c8t h LEU 44 CO -0.08 0.53 0.20 0.00 0.09 0.00 0.00 178.44 179.19 2c8t h ALA 46 N 1.29 0.18 -0.12 0.00 0.00 -0.73 -0.15 119.26 119.74 2c8t h ALA 46 Ca 0.22 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.28 2c8t h ALA 46 Cb 0.19 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2c8t h ALA 46 CO -0.20 -0.50 0.07 1.96 0.00 0.00 0.00 179.25 180.58 2c8t h GLN 47 N -0.06 0.16 -0.30 0.00 4.20 -0.24 -0.49 115.11 118.37 2c8t h GLN 47 Ca 0.19 -0.01 0.05 0.00 0.06 0.00 0.00 58.65 58.93 2c8t h GLN 47 Cb 0.35 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.05 2c8t h GLN 47 CO -0.42 0.14 0.05 0.82 -0.67 0.00 0.00 178.83 178.74 2c8t h ILE 48 N 0.13 0.84 -0.48 2.54 2.04 -0.59 -1.77 117.51 120.21 2c8t h ILE 48 Ca 0.04 -0.05 0.04 0.00 1.00 0.00 0.00 64.86 65.89 2c8t h ILE 48 Cb 0.02 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 36.73 2c8t h ILE 48 CO -0.01 0.03 0.23 -0.07 0.00 0.00 0.00 178.15 178.34 2c8t h LEU 49 N 0.15 0.33 0.09 1.44 3.38 -0.76 -0.36 115.31 119.58 2c8t h LEU 49 Ca 0.14 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.16 2c8t h LEU 49 Cb 0.16 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 2c8t h LEU 49 CO -0.20 0.23 -0.19 0.25 0.09 0.00 0.00 178.44 178.63 2c8t h LEU 50 N 0.46 -0.52 -0.24 1.67 5.85 -0.74 0.42 115.31 122.21 2c8t h LEU 50 Ca 0.21 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.99 2c8t h LEU 50 Cb 0.14 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 2c8t h LEU 50 CO -0.16 -0.26 0.13 -0.07 -0.34 0.00 0.00 178.44 177.74 2c8t h LEU 51 N -0.35 0.30 -0.74 2.25 3.38 -1.14 0.61 115.31 119.63 2c8t h LEU 51 Ca 0.03 -0.09 0.12 0.00 0.09 0.00 0.00 57.88 58.03 2c8t h LEU 51 Cb 0.38 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 40.97 2c8t h LEU 51 CO -0.11 0.31 0.34 0.00 0.09 0.00 0.00 178.44 179.06 2c8t h ALA 52 N 1.01 1.04 -0.12 1.53 0.00 -0.90 -2.05 119.26 119.77 2c8t h ALA 52 Ca 0.08 0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.96 2c8t h ALA 52 Cb 0.08 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2c8t h ALA 52 CO -0.01 -0.12 -0.44 0.00 0.00 0.00 0.00 179.25 178.67 2c8t h ALA 53 N 1.49 1.03 -0.05 0.00 0.00 -0.19 -2.87 119.26 118.67 2c8t h ALA 53 Ca 0.39 -0.44 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 2c8t h ALA 53 Cb 0.50 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2c8t h ALA 53 CO -0.33 0.62 -0.57 0.93 0.00 0.00 0.00 179.25 179.89 2c8t h GLU 54 N 0.23 0.17 -0.63 0.00 5.08 -0.23 -3.43 114.58 115.76 2c8t h GLU 54 Ca 0.02 -0.11 0.19 0.00 -1.00 0.00 0.00 59.36 58.45 2c8t h GLU 54 Cb 0.88 0.01 -0.21 0.00 0.50 0.00 0.00 28.75 29.93 2c8t h GLU 54 CO 0.07 0.69 0.04 0.34 -1.00 0.00 0.00 179.01 179.15 2c8t s ASP 55 N -6.88 -0.73 0.00 1.42 -1.08 -0.86 -5.05 116.67 103.49 2c8t s ASP 55 Ca -0.03 0.54 0.29 0.00 -0.52 0.00 0.00 52.55 52.82 2c8t s ASP 55 Cb 0.12 1.65 1.25 0.00 -1.46 0.00 0.00 42.92 44.49 2c8t s ASP 55 CO 0.78 -0.14 1.89 0.00 0.52 0.00 0.00 175.17 178.23 2c8t n ALA 56 N 5.39 2.66 -0.10 3.66 0.00 -1.09 -4.15 120.51 126.87 2c8t n ALA 56 Ca -0.06 -0.20 -0.13 0.00 0.00 0.00 0.00 53.44 53.05 2c8t n ALA 56 Cb 0.53 -1.39 -0.11 0.00 0.00 0.00 0.00 19.45 18.47 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 -1.22 1.76 -4.77 0.00 3.41 -1.26 -3.40 113.62 108.14 2c8t n SER 57 Ca 0.12 -0.08 -0.35 0.00 -0.26 0.00 0.00 58.87 58.29 2c8t n SER 57 Cb 0.28 0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 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 -2.44 3.41 0.85 4.33 1.02 -1.26 -4.75 119.74 120.90 2c8t s LYS 58 Ca -0.23 1.66 -0.10 0.00 0.02 0.00 0.00 55.97 57.31 2c8t s LYS 58 Cb 0.07 -2.08 0.10 0.00 -0.52 0.00 0.00 37.83 35.41 2c8t s LYS 58 CO 0.58 -0.81 1.11 -0.51 -0.92 0.00 0.00 175.35 174.80 2c8t s ASP 59 N -1.68 3.70 -0.07 2.83 1.11 -1.26 -4.58 116.67 116.71 2c8t s ASP 59 Ca 0.71 1.96 0.04 0.00 0.18 0.00 0.00 52.55 55.44 2c8t s ASP 59 Cb -0.25 -2.52 -0.02 0.00 1.07 0.00 0.00 42.92 41.20 2c8t s ASP 59 CO 0.29 -2.57 -0.19 -0.63 1.18 0.00 0.00 175.17 173.25 2c8t s ILE 60 N -2.79 2.60 -0.25 0.77 1.01 -0.54 -4.87 121.20 117.14 2c8t s ILE 60 Ca 0.64 -0.86 -0.09 0.00 0.00 0.00 0.00 60.65 60.33 2c8t s ILE 60 Cb -0.20 -2.01 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 2c8t s ILE 60 CO 0.57 0.57 0.12 -0.44 0.00 0.00 0.00 174.94 175.75 2c8t s SER 61 N -0.20 5.61 -0.24 3.58 0.01 -0.09 -0.22 113.70 122.14 2c8t s SER 61 Ca -0.01 -0.06 -0.03 0.00 1.31 0.00 0.00 55.95 57.15 2c8t s SER 61 Cb -0.13 -2.01 0.01 0.00 0.21 0.00 0.00 66.02 64.09 2c8t s SER 61 CO 0.03 0.00 -0.04 -0.22 0.41 0.00 0.00 173.24 173.43 2c8t s LEU 62 N 1.42 3.15 -0.23 2.44 2.96 0.81 -0.27 118.68 128.96 2c8t s LEU 62 Ca 0.06 -0.68 -0.12 0.00 -0.22 0.00 0.00 54.13 53.17 2c8t s LEU 62 Cb -0.15 -1.71 -0.05 0.00 0.50 0.00 0.00 46.19 44.78 2c8t s LEU 62 CO 0.06 -0.10 0.22 -0.31 -1.32 0.00 0.00 176.35 174.90 2c8t s TYR 63 N 1.40 3.33 -0.20 5.38 1.51 0.60 -1.06 117.35 128.31 2c8t s TYR 63 Ca 0.03 0.33 -0.01 0.00 -1.01 0.00 0.00 57.07 56.40 2c8t s TYR 63 Cb -0.16 -2.34 0.01 0.00 -0.11 0.00 0.00 41.96 39.36 2c8t s TYR 63 CO -0.03 0.04 -0.12 0.42 -1.11 0.00 0.00 175.55 174.75 2c8t s ILE 64 N 1.13 2.70 -0.42 2.71 1.01 0.64 -0.38 121.20 128.58 2c8t s ILE 64 Ca 0.11 -0.75 0.04 0.00 0.00 0.00 0.00 60.65 60.05 2c8t s ILE 64 Cb -0.14 -2.20 0.17 0.00 0.01 0.00 0.00 42.46 40.31 2c8t s ILE 64 CO 0.05 0.46 0.38 -3.20 0.00 0.00 0.00 174.94 172.64 2c8t n ASN 65 N 4.70 -0.82 -3.84 3.58 2.85 -0.11 -0.40 115.26 121.23 2c8t n ASN 65 Ca -0.19 -2.43 -0.12 0.00 -0.11 0.00 0.00 54.58 51.72 2c8t n ASN 65 Cb 0.50 -0.30 -0.14 0.00 1.24 0.00 0.00 39.78 41.09 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 0.14 -0.06 0.00 1.20 0.15 1.00 -3.63 113.70 112.50 2c8t s SER 66 Ca 0.33 0.13 0.16 0.00 0.70 0.00 0.00 55.95 57.27 2c8t s SER 66 Cb 0.04 0.12 0.96 0.00 -1.71 0.00 0.00 66.02 65.43 2c8t s SER 66 CO -0.18 -0.04 1.49 -0.81 1.20 0.00 0.00 173.24 174.90 2c8t n PRO 67 N 3.21 0.82 0.00 5.44 -0.04 -1.26 -1.98 135.00 141.19 2c8t n PRO 67 Ca -0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 2c8t n PRO 67 Cb 0.58 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.74 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 0.52 0.16 0.00 0.55 0.00 -1.15 -4.39 105.19 100.88 2c8t n GLY 68 Ca 0.12 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.84 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 0.40 3.63 -0.02 0.00 -1.26 0.13 105.19 108.07 2c8t n GLY 69 Ca 0.00 -1.42 -0.48 0.00 0.00 0.00 0.00 46.02 44.12 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 2.33 0.28 1.61 2.88 -0.21 -4.51 113.62 116.01 2c8t n SER 70 Ca 0.00 1.11 -0.16 0.00 -1.33 0.00 0.00 58.87 58.49 2c8t n SER 70 Cb 0.00 -1.32 -0.08 0.00 -0.75 0.00 0.00 64.21 62.05 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 3.29 0.50 -0.54 2.46 2.04 -1.99 -1.35 117.51 121.93 2c8t h ILE 71 Ca -0.46 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.34 2c8t h ILE 71 Cb 1.30 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 2c8t h ILE 71 CO 0.80 0.00 0.06 0.77 0.00 0.00 0.00 178.15 179.79 2c8t h SER 72 N -0.68 0.82 -0.27 1.72 4.64 -1.96 0.39 113.55 118.22 2c8t h SER 72 Ca -0.07 -0.18 0.04 0.00 -0.47 0.00 0.00 61.79 61.11 2c8t h SER 72 Cb 0.52 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 62.36 2c8t h SER 72 CO 0.11 0.85 0.05 0.00 -0.87 0.00 0.00 176.83 176.97 2c8t h ALA 73 N 1.25 0.28 -0.53 5.18 0.00 -1.90 -0.36 119.26 123.18 2c8t h ALA 73 Ca 0.17 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 2c8t h ALA 73 Cb 0.40 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2c8t h ALA 73 CO 0.01 -0.36 0.10 0.78 0.00 0.00 0.00 179.25 179.79 2c8t h GLY 74 N 0.16 0.89 1.45 0.00 0.00 -0.01 -2.77 103.07 102.79 2c8t h GLY 74 Ca 0.12 -0.53 -0.11 0.00 0.00 0.00 0.00 47.33 46.81 2c8t h GLY 74 CO -0.16 0.49 -0.27 1.98 0.00 0.00 0.00 176.54 178.58 2c8t h MET 75 N 0.79 0.63 -0.14 4.80 -1.53 0.22 -0.26 114.93 119.45 2c8t h MET 75 Ca 0.17 -0.26 0.03 0.00 -3.44 0.00 0.00 59.70 56.19 2c8t h MET 75 Cb 0.33 -0.03 -0.02 0.00 -0.55 0.00 0.00 31.60 31.33 2c8t h MET 75 CO 0.00 0.84 -0.02 0.00 0.14 0.00 0.00 176.91 177.87 2c8t h ALA 76 N 1.16 0.10 -0.18 0.39 0.00 -0.81 0.63 119.26 120.55 2c8t h ALA 76 Ca 0.07 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.06 2c8t h ALA 76 Cb 0.75 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 2c8t h ALA 76 CO 0.06 -0.47 -0.01 0.82 0.00 0.00 0.00 179.25 179.65 2c8t h ILE 77 N 0.02 0.87 -0.24 0.00 2.04 -1.20 -1.87 117.51 117.12 2c8t h ILE 77 Ca 0.06 -0.02 0.06 0.00 1.00 0.00 0.00 64.86 65.97 2c8t h ILE 77 Cb 0.09 0.82 -0.07 0.00 -0.74 0.00 0.00 36.82 36.91 2c8t h ILE 77 CO -0.13 0.01 -0.33 0.22 0.00 0.00 0.00 178.15 177.92 2c8t h TYR 78 N 0.05 -0.91 -0.79 1.37 3.20 -0.73 0.16 116.97 119.33 2c8t h TYR 78 Ca 0.08 0.05 0.14 0.00 3.14 0.00 0.00 58.73 62.14 2c8t h TYR 78 Cb 0.11 0.43 -0.09 0.00 1.54 0.00 0.00 36.73 38.72 2c8t h TYR 78 CO -0.17 -0.39 0.36 -0.44 -1.64 0.00 0.00 178.16 175.88 2c8t h ASP 79 N -0.34 0.40 -0.52 -2.11 3.32 -0.52 -0.83 116.42 115.83 2c8t h ASP 79 Ca 0.13 0.10 -0.12 0.00 0.02 0.00 0.00 57.03 57.16 2c8t h ASP 79 Cb 0.54 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 2c8t h ASP 79 CO -0.43 0.17 -0.13 0.74 -1.72 0.00 0.00 179.24 177.87 2c8t h THR 80 N 0.53 1.27 -0.26 0.35 2.02 -0.59 0.14 112.91 116.37 2c8t h THR 80 Ca 0.43 -1.28 0.06 0.00 0.77 0.00 0.00 66.41 66.38 2c8t h THR 80 Cb 0.61 1.03 -0.06 0.00 -1.74 0.00 0.00 68.15 67.98 2c8t h THR 80 CO -0.37 0.45 -0.13 0.24 0.37 0.00 0.00 175.52 176.08 2c8t h MET 81 N 0.86 -0.09 -0.45 6.66 2.86 0.34 0.42 114.93 125.52 2c8t h MET 81 Ca 0.13 0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.77 2c8t h MET 81 Cb 0.70 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.36 2c8t h MET 81 CO 0.05 -0.06 0.25 0.28 1.06 0.00 0.00 176.91 178.49 2c8t h VAL 82 N -0.10 1.16 -0.08 -2.22 2.07 -0.95 -2.88 116.25 113.26 2c8t h VAL 82 Ca 0.14 -0.41 0.04 0.00 0.82 0.00 0.00 66.70 67.29 2c8t h VAL 82 Cb 0.31 0.61 -0.05 0.00 -1.52 0.00 0.00 31.29 30.64 2c8t h VAL 82 CO -0.33 0.17 -0.20 0.25 0.02 0.00 0.00 177.57 177.48 2c8t h LEU 83 N 0.59 -0.62 -9.29 2.57 5.85 -0.33 -3.41 115.31 110.67 2c8t h LEU 83 Ca 0.16 0.10 -0.62 0.00 0.84 0.00 0.00 57.88 58.36 2c8t h LEU 83 Cb 0.05 0.27 0.02 0.00 0.37 0.00 0.00 40.66 41.38 2c8t h LEU 83 CO -0.03 -0.26 1.05 0.00 -0.34 0.00 0.00 178.44 178.86 2c8t n ALA 84 N -2.63 0.83 0.20 1.25 0.00 0.10 -4.83 120.51 115.43 2c8t n ALA 84 Ca -0.04 0.31 0.10 0.00 0.00 0.00 0.00 53.44 53.81 2c8t n ALA 84 Cb 0.25 -2.46 0.64 0.00 0.00 0.00 0.00 19.45 17.88 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 8.69 0.03 -7.03 0.00 0.11 -1.84 -3.44 132.00 128.52 2c8t h PRO 85 Ca -0.48 -0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.13 2c8t h PRO 85 Cb 1.27 -0.01 0.03 0.00 0.11 0.00 0.00 31.00 32.41 2c8t h PRO 85 CO 0.94 0.02 0.20 0.00 -0.21 0.00 0.00 178.00 178.95 2c8t s ASP 87 N -3.83 5.32 -0.27 0.00 1.01 -1.26 -4.88 116.67 112.76 2c8t s ASP 87 Ca 0.51 2.74 0.03 0.00 0.71 0.00 0.00 52.55 56.53 2c8t s ASP 87 Cb -0.10 -2.63 0.06 0.00 1.01 0.00 0.00 42.92 41.26 2c8t s ASP 87 CO 0.43 -1.53 -0.09 -0.63 0.21 0.00 0.00 175.17 173.55 2c8t s ILE 88 N -1.32 2.15 0.21 0.77 1.01 -1.26 -1.46 121.20 121.30 2c8t s ILE 88 Ca 0.71 -1.68 -0.29 0.00 0.00 0.00 0.00 60.65 59.39 2c8t s ILE 88 Cb -0.40 -2.29 -0.08 0.00 0.01 0.00 0.00 42.46 39.70 2c8t s ILE 88 CO 0.47 -0.08 0.91 0.00 0.00 0.00 0.00 174.94 176.23 2c8t s ALA 89 N 1.10 3.35 -0.06 9.38 0.00 0.69 -1.39 121.76 134.83 2c8t s ALA 89 Ca -0.07 0.56 0.05 0.00 0.00 0.00 0.00 51.96 52.50 2c8t s ALA 89 Cb -0.20 -3.16 -0.01 0.00 0.00 0.00 0.00 23.12 19.75 2c8t s ALA 89 CO -0.05 0.20 -0.23 0.99 0.00 0.00 0.00 175.76 176.67 2c8t s THR 90 N -1.04 1.92 -0.17 0.00 2.01 -0.36 -0.13 115.64 117.87 2c8t s THR 90 Ca 0.40 -0.98 -0.00 0.00 0.31 0.00 0.00 61.69 61.42 2c8t s THR 90 Cb -0.25 -1.64 0.04 0.00 0.01 0.00 0.00 72.50 70.66 2c8t s THR 90 CO 0.30 0.54 -0.07 -0.31 -0.69 0.00 0.00 174.62 174.39 2c8t s TYR 91 N -0.02 1.91 -0.37 4.92 1.51 -0.22 0.79 117.35 125.87 2c8t s TYR 91 Ca -0.07 -1.22 -0.29 0.00 -1.01 0.00 0.00 57.07 54.49 2c8t s TYR 91 Cb -0.14 -1.41 0.02 0.00 -0.11 0.00 0.00 41.96 40.32 2c8t s TYR 91 CO 0.04 -0.65 1.09 0.00 -1.11 0.00 0.00 175.55 174.93 2c8t s ALA 92 N 1.56 3.40 -0.29 3.71 0.00 0.54 -0.26 121.76 130.42 2c8t s ALA 92 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 51.96 51.79 2c8t s ALA 92 Cb -0.15 -3.74 0.09 0.00 0.00 0.00 0.00 23.12 19.32 2c8t s ALA 92 CO -0.08 -1.71 0.05 1.41 0.00 0.00 0.00 175.76 175.43 2c8t s MET 93 N 3.88 1.04 1.25 0.00 0.00 0.47 -1.58 119.30 124.36 2c8t s MET 93 Ca 0.46 -1.15 0.00 0.00 0.00 0.00 0.00 55.69 55.00 2c8t s MET 93 Cb -0.11 -2.36 0.00 0.00 0.00 0.00 0.00 34.83 32.36 2c8t s MET 93 CO 0.20 -0.87 0.00 0.41 0.00 0.00 0.00 175.02 174.76 2c8t n GLY 94 N 4.71 1.49 2.82 2.11 0.00 -1.26 -3.88 105.19 111.18 2c8t n GLY 94 Ca -0.04 -0.33 -0.14 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.00 -0.31 1.61 -2.45 -1.26 -0.58 119.30 116.30 2c8t s MET 95 Ca 0.00 0.20 0.03 0.00 -1.25 0.00 0.00 55.69 54.67 2c8t s MET 95 Cb 0.00 -0.19 0.09 0.00 1.25 0.00 0.00 34.83 35.98 2c8t s MET 95 CO 0.00 -0.14 0.03 0.00 1.05 0.00 0.00 175.02 175.96 2c8t s ALA 96 N 0.93 2.49 0.23 4.11 0.00 -0.84 -0.00 121.76 128.68 2c8t s ALA 96 Ca -0.08 -2.15 0.11 0.00 0.00 0.00 0.00 51.96 49.84 2c8t s ALA 96 Cb -0.11 -1.80 -0.05 0.00 0.00 0.00 0.00 23.12 21.17 2c8t s ALA 96 CO -0.03 -1.58 -0.17 0.00 0.00 0.00 0.00 175.76 173.98 2c8t s ALA 97 N 1.12 2.76 0.00 0.00 0.00 -0.84 -1.42 121.76 123.38 2c8t s ALA 97 Ca 0.07 -1.71 0.00 0.00 0.00 0.00 0.00 51.96 50.32 2c8t s ALA 97 Cb -0.19 -0.42 0.00 0.00 0.00 0.00 0.00 23.12 22.52 2c8t s ALA 97 CO -0.11 0.36 0.00 0.43 0.00 0.00 0.00 175.76 176.44 2c8t n SER 98 N -0.26 0.00 0.32 0.00 7.64 -0.72 0.12 113.62 120.72 2c8t n SER 98 Ca -0.09 0.00 0.19 0.00 1.01 0.00 0.00 58.87 59.99 2c8t n SER 98 Cb 0.58 0.00 1.08 0.00 -1.01 0.00 0.00 64.21 64.85 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 -0.43 1.43 0.00 -1.86 0.13 114.93 114.20 2c8t h MET 99 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 59.70 59.65 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 0.06 0.78 0.00 0.00 0.00 176.91 177.75 2c8t h GLY 100 N 0.00 0.78 0.94 8.32 0.00 0.66 -0.73 103.07 113.05 2c8t h GLY 100 Ca 0.00 -0.52 -0.00 0.00 0.00 0.00 0.00 47.33 46.81 2c8t h GLY 100 CO -0.00 0.48 -0.03 -2.09 0.00 0.00 0.00 176.54 174.90 2c8t h GLU 101 N 0.58 -0.09 -0.44 4.80 4.22 -0.43 -1.19 114.58 122.03 2c8t h GLU 101 Ca 0.13 0.01 0.09 0.00 0.08 0.00 0.00 59.36 59.67 2c8t h GLU 101 Cb 0.39 0.02 -0.09 0.00 0.50 0.00 0.00 28.75 29.57 2c8t h GLU 101 CO 0.01 -0.01 -0.16 0.35 -2.18 0.00 0.00 179.01 177.02 2c8t h PHE 102 N -0.15 -0.38 -0.40 0.92 3.57 -1.17 0.11 116.94 119.43 2c8t h PHE 102 Ca -0.01 0.04 -0.12 0.00 3.53 0.00 0.00 57.97 61.41 2c8t h PHE 102 Cb 0.13 0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.09 2c8t h PHE 102 CO -0.05 -0.24 -0.24 -0.07 -2.23 0.00 0.00 178.31 175.47 2c8t h LEU 103 N -0.06 0.84 -0.22 0.59 3.38 -1.09 -0.27 115.31 118.48 2c8t h LEU 103 Ca 0.21 -0.31 0.05 0.00 0.09 0.00 0.00 57.88 57.92 2c8t h LEU 103 Cb 0.39 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 40.85 2c8t h LEU 103 CO -0.48 1.04 -0.14 0.25 0.09 0.00 0.00 178.44 179.19 2c8t h LEU 104 N 0.71 -0.47 -1.79 1.67 5.85 -0.32 -2.42 115.31 118.54 2c8t h LEU 104 Ca 0.09 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 2c8t h LEU 104 Cb 0.77 0.24 -0.00 0.00 0.37 0.00 0.00 40.66 42.04 2c8t h LEU 104 CO 0.06 -0.18 -0.12 0.00 -0.34 0.00 0.00 178.44 177.86 2c8t h ALA 105 N 1.02 1.17 -0.00 1.25 0.00 -0.41 -2.91 119.26 119.38 2c8t h ALA 105 Ca 0.13 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2c8t h ALA 105 Cb 0.32 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2c8t h ALA 105 CO -0.30 0.15 -0.05 0.00 0.00 0.00 0.00 179.25 179.05 2c8t n ALA 106 N -2.23 2.63 -0.69 0.00 0.00 -0.15 -4.85 120.51 115.22 2c8t n ALA 106 Ca -0.01 -0.21 -0.31 0.00 0.00 0.00 0.00 53.44 52.91 2c8t n ALA 106 Cb 0.27 -1.42 0.17 0.00 0.00 0.00 0.00 19.45 18.47 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 -2.47 1.69 -0.01 0.00 0.00 -1.10 -4.87 107.32 100.56 2c8t s GLY 107 Ca 0.31 0.60 -0.36 0.00 0.00 0.00 0.00 44.72 45.27 2c8t s GLY 107 CO 0.46 1.02 1.63 2.41 0.00 0.00 0.00 173.10 178.62 2c8t n THR 108 N -4.25 0.21 -1.71 0.90 -1.04 -0.48 -4.87 114.28 103.04 2c8t n THR 108 Ca 0.12 -0.04 -0.43 0.00 -2.04 0.00 0.00 64.05 61.66 2c8t n THR 108 Cb 0.52 -1.39 -0.02 0.00 -1.82 0.00 0.00 70.33 67.61 2c8t n THR 108 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2c8t n LYS 109 N 4.44 2.52 0.00 -2.82 5.02 -1.26 -0.90 118.16 125.16 2c8t n LYS 109 Ca 0.21 0.90 0.00 0.00 -2.02 0.00 0.00 58.31 57.40 2c8t n LYS 109 Cb 0.24 -2.68 0.00 0.00 -0.02 0.00 0.00 35.03 32.57 2c8t n LYS 109 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2c8t n GLY 110 N 2.79 2.57 1.42 0.72 0.00 -1.26 -4.90 105.19 106.53 2c8t n GLY 110 Ca 0.12 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.22 2.66 -3.74 1.61 5.02 -0.08 -4.86 118.16 118.55 2c8t n LYS 111 Ca 0.00 -3.73 -0.37 0.00 -2.02 0.00 0.00 58.31 52.20 2c8t n LYS 111 Cb 0.00 -1.99 -0.12 0.00 -0.02 0.00 0.00 35.03 32.90 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 -3.44 3.64 0.12 1.97 0.52 -1.25 -1.22 118.95 119.29 2c8t s ARG 112 Ca 0.46 -0.49 0.10 0.00 -0.52 0.00 0.00 55.73 55.28 2c8t s ARG 112 Cb 0.40 -3.35 -0.04 0.00 0.52 0.00 0.00 34.95 32.48 2c8t s ARG 112 CO -0.01 -0.20 -0.25 0.71 0.02 0.00 0.00 175.30 175.56 2c8t s TYR 113 N 1.62 2.17 -0.04 -0.53 1.51 0.24 0.30 117.35 122.62 2c8t s TYR 113 Ca 0.06 -0.39 0.05 0.00 -1.01 0.00 0.00 57.07 55.78 2c8t s TYR 113 Cb -0.15 -1.19 -0.01 0.00 -0.11 0.00 0.00 41.96 40.50 2c8t s TYR 113 CO 0.04 0.29 -0.20 0.00 -1.11 0.00 0.00 175.55 174.57 2c8t s ALA 114 N -1.07 1.76 0.47 3.71 0.00 -0.36 -0.34 121.76 125.93 2c8t s ALA 114 Ca 0.12 -0.84 -0.19 0.00 0.00 0.00 0.00 51.96 51.05 2c8t s ALA 114 Cb -0.10 -0.54 -0.10 0.00 0.00 0.00 0.00 23.12 22.38 2c8t s ALA 114 CO 0.05 0.35 0.97 -0.51 0.00 0.00 0.00 175.76 176.62 2c8t s LEU 115 N -0.12 3.80 0.38 0.00 1.43 -0.61 -1.69 118.68 121.86 2c8t s LEU 115 Ca -0.01 1.64 0.13 0.00 -1.03 0.00 0.00 54.13 54.85 2c8t s LEU 115 Cb -0.11 -4.53 0.94 0.00 0.03 0.00 0.00 46.19 42.52 2c8t s LEU 115 CO 0.02 -0.46 1.85 -0.65 0.23 0.00 0.00 176.35 177.34 2c8t h PRO 116 N 1.46 0.54 -0.46 1.29 0.11 -1.91 0.12 132.00 133.14 2c8t h PRO 116 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2c8t h PRO 116 Cb 1.18 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2c8t h PRO 116 CO 0.61 0.36 0.00 0.72 -0.21 0.00 0.00 178.00 179.48 2c8t n HIS 117 N -4.56 0.61 -1.76 0.65 8.25 -1.26 -4.38 115.22 112.77 2c8t n HIS 117 Ca 0.19 -0.35 -0.38 0.00 -0.26 0.00 0.00 57.72 56.93 2c8t n HIS 117 Cb 0.59 -0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.75 2c8t n HIS 117 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2c8t s ALA 118 N -1.23 2.58 0.01 -1.41 0.00 0.41 -4.77 121.76 117.34 2c8t s ALA 118 Ca 0.38 1.27 0.01 0.00 0.00 0.00 0.00 51.96 53.62 2c8t s ALA 118 Cb 0.21 -3.56 -0.01 0.00 0.00 0.00 0.00 23.12 19.76 2c8t s ALA 118 CO 0.29 -1.50 -0.03 -0.98 0.00 0.00 0.00 175.76 173.53 2c8t s ARG 119 N -3.17 0.27 -0.17 0.00 1.70 0.25 -3.09 118.95 114.74 2c8t s ARG 119 Ca 0.78 -0.28 -0.05 0.00 -0.47 0.00 0.00 55.73 55.71 2c8t s ARG 119 Cb -0.39 -0.15 -0.03 0.00 -0.57 0.00 0.00 34.95 33.81 2c8t s ARG 119 CO 0.43 0.03 -0.01 0.42 -1.08 0.00 0.00 175.30 175.10 2c8t s ILE 120 N -0.51 4.15 -0.17 4.99 1.09 -0.71 -1.99 121.20 128.06 2c8t s ILE 120 Ca -0.04 -0.26 -0.00 0.00 -1.10 0.00 0.00 60.65 59.25 2c8t s ILE 120 Cb -0.04 -2.84 0.00 0.00 -1.06 0.00 0.00 42.46 38.52 2c8t s ILE 120 CO -0.00 0.48 -0.15 -0.76 -0.10 0.00 0.00 174.94 174.41 2c8t s LEU 121 N 0.42 2.47 0.19 2.97 2.01 -0.51 0.13 118.68 126.37 2c8t s LEU 121 Ca -0.02 -0.49 -0.12 0.00 0.01 0.00 0.00 54.13 53.51 2c8t s LEU 121 Cb -0.14 -1.57 -0.07 0.00 0.01 0.00 0.00 46.19 44.42 2c8t s LEU 121 CO 0.02 0.05 0.56 -0.04 1.01 0.00 0.00 176.35 177.95 2c8t s MET 122 N 1.00 3.90 -0.25 1.70 -1.94 -0.52 -1.76 119.30 121.43 2c8t s MET 122 Ca -0.02 0.40 -0.10 0.00 -1.71 0.00 0.00 55.69 54.27 2c8t s MET 122 Cb -0.15 -2.78 0.10 0.00 2.01 0.00 0.00 34.83 34.02 2c8t s MET 122 CO -0.03 0.39 0.56 -1.58 -0.01 0.00 0.00 175.02 174.35 2c8t s HIS 123 N -1.65 -1.07 -0.38 -0.03 5.04 -1.26 -3.91 115.29 112.04 2c8t s HIS 123 Ca 0.43 1.96 -0.32 0.00 -1.54 0.00 0.00 55.06 55.59 2c8t s HIS 123 Cb -0.13 0.58 -0.10 0.00 0.04 0.00 0.00 32.58 32.97 2c8t s HIS 123 CO 0.20 -0.56 2.26 0.94 -2.34 0.00 0.00 174.74 175.24 2c8t n GLN 124 N 5.14 1.22 -2.79 2.88 -0.06 -0.78 -4.77 117.38 118.21 2c8t n GLN 124 Ca -0.13 0.29 -0.32 0.00 -2.00 0.00 0.00 57.00 54.84 2c8t n GLN 124 Cb 0.51 -2.73 -0.05 0.00 -4.06 0.00 0.00 30.24 23.91 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 6.71 4.04 0.00 3.69 0.04 -1.26 -5.04 135.00 143.17 2c8t s PRO 125 Ca 1.08 0.88 0.00 0.00 0.04 0.00 0.00 61.00 62.99 2c8t s PRO 125 Cb -0.66 -2.26 0.00 0.00 0.04 0.00 0.00 34.50 31.62 2c8t s PRO 125 CO 0.43 -0.05 0.00 1.28 0.04 0.00 0.00 177.00 178.70 2c8t n LEU 126 N -0.91 0.00 -0.07 -3.56 4.77 -1.26 -5.10 117.00 110.86 2c8t n LEU 126 Ca 0.05 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.96 2c8t n LEU 126 Cb 0.54 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.60 2c8t n LEU 126 CO 0.42 0.00 -0.57 -0.38 -1.33 0.00 0.00 177.39 175.53 2c8t n ILE 136 N 0.00 1.32 -0.31 -0.08 5.41 -1.26 -5.18 119.36 119.27 2c8t n ILE 136 Ca 0.00 0.19 0.11 0.00 1.00 0.00 0.00 62.75 64.05 2c8t n ILE 136 Cb 0.00 -2.21 0.34 0.00 -0.71 0.00 0.00 39.64 37.06 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 -1.04 1.75 -0.27 -1.39 0.00 -2.06 -1.55 119.26 114.70 2c8t h ALA 137 Ca 0.00 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2c8t h ALA 137 Cb 0.83 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2c8t h ALA 137 CO 0.00 -0.02 -0.05 0.82 0.00 0.00 0.00 179.25 180.00 2c8t h ILE 138 N 0.77 1.28 0.00 0.00 5.03 -2.06 -2.72 117.51 119.80 2c8t h ILE 138 Ca 0.49 -1.05 -0.04 0.00 -0.12 0.00 0.00 64.86 64.14 2c8t h ILE 138 Cb 0.72 1.43 -0.01 0.00 -3.03 0.00 0.00 36.82 35.94 2c8t h ILE 138 CO -0.25 0.33 -0.18 1.56 -0.68 0.00 0.00 178.15 178.93 2c8t h GLN 139 N 0.26 0.00 0.14 2.37 4.20 -1.80 -2.65 115.11 117.63 2c8t h GLN 139 Ca 0.07 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 2c8t h GLN 139 Cb 0.52 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.30 2c8t h GLN 139 CO 0.02 0.18 -0.06 0.00 -0.67 0.00 0.00 178.83 178.30 2c8t h ALA 140 N 1.82 -0.18 -0.45 3.87 0.00 -1.02 -0.89 119.26 122.41 2c8t h ALA 140 Ca -0.00 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 54.87 2c8t h ALA 140 Cb 0.36 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.12 2c8t h ALA 140 CO 0.02 -0.49 -0.23 0.93 0.00 0.00 0.00 179.25 179.49 2c8t h GLU 141 N -0.41 -0.13 -0.34 0.00 5.08 -1.25 0.64 114.58 118.17 2c8t h GLU 141 Ca -0.02 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2c8t h GLU 141 Cb 0.33 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 2c8t h GLU 141 CO 0.03 -0.09 0.22 1.96 -1.00 0.00 0.00 179.01 180.13 2c8t h GLN 142 N -0.14 0.44 -0.25 2.33 4.20 -1.37 -2.02 115.11 118.30 2c8t h GLN 142 Ca 0.21 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.89 2c8t h GLN 142 Cb 0.47 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 2c8t h GLN 142 CO -0.54 0.30 0.15 0.35 -0.67 0.00 0.00 178.83 178.42 2c8t h PHE 143 N 0.45 0.33 -0.52 2.96 3.57 -0.52 -1.62 116.94 121.59 2c8t h PHE 143 Ca 0.12 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.70 2c8t h PHE 143 Cb -0.04 -0.11 -0.07 0.00 2.79 0.00 0.00 35.95 38.52 2c8t h PHE 143 CO -0.05 0.26 0.15 0.00 -2.23 0.00 0.00 178.31 176.44 2c8t h ALA 144 N 1.04 0.62 -0.74 2.41 0.00 -0.66 0.20 119.26 122.14 2c8t h ALA 144 Ca 0.09 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 2c8t h ALA 144 Cb 0.03 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2c8t h ALA 144 CO -0.02 -0.25 0.32 0.28 0.00 0.00 0.00 179.25 179.58 2c8t h VAL 145 N 0.31 1.25 0.00 0.00 2.07 -1.15 -1.92 116.25 116.81 2c8t h VAL 145 Ca 0.26 -0.74 -0.17 0.00 0.82 0.00 0.00 66.70 66.86 2c8t h VAL 145 Cb 0.32 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 2c8t h VAL 145 CO -0.29 0.31 -0.92 -0.29 0.02 0.00 0.00 177.57 176.39 2c8t h ILE 146 N 1.06 1.19 0.01 4.57 2.10 -0.70 -2.54 117.51 123.20 2c8t h ILE 146 Ca 0.25 -2.76 -0.00 0.00 1.08 0.00 0.00 64.86 63.43 2c8t h ILE 146 Cb 0.17 2.57 0.00 0.00 -1.09 0.00 0.00 36.82 38.47 2c8t h ILE 146 CO -0.03 0.68 -0.00 0.50 -1.08 0.00 0.00 178.15 178.22 2c8t h LYS 147 N 0.00 -0.01 -0.72 2.19 3.64 -0.52 -1.15 116.57 120.00 2c8t h LYS 147 Ca -0.05 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.42 2c8t h LYS 147 Cb 1.63 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 33.38 2c8t h LYS 147 CO 0.09 0.38 0.37 -0.22 -2.27 0.00 0.00 179.45 177.80 2c8t h LYS 148 N -0.39 0.61 -0.29 1.90 3.64 -1.42 -1.03 116.57 119.59 2c8t h LYS 148 Ca -0.00 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.27 2c8t h LYS 148 Cb 0.39 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.05 2c8t h LYS 148 CO 0.00 0.41 -0.12 1.49 -2.27 0.00 0.00 179.45 178.96 2c8t h GLU 149 N 0.63 0.49 0.07 1.90 4.57 -1.36 -1.32 114.58 119.56 2c8t h GLU 149 Ca 0.35 -0.14 -0.00 0.00 -1.18 0.00 0.00 59.36 58.39 2c8t h GLU 149 Cb 0.36 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.89 2c8t h GLU 149 CO -0.26 0.61 -0.03 1.98 -1.18 0.00 0.00 179.01 180.13 2c8t h MET 150 N 0.46 -0.09 -0.65 1.92 4.05 0.00 -2.17 114.93 118.45 2c8t h MET 150 Ca 0.09 0.01 0.13 0.00 -0.28 0.00 0.00 59.70 59.64 2c8t h MET 150 Cb 0.48 0.02 -0.10 0.00 -0.80 0.00 0.00 31.60 31.21 2c8t h MET 150 CO 0.03 0.23 0.13 0.74 0.23 0.00 0.00 176.91 178.27 2c8t h PHE 151 N -0.41 0.20 -0.13 1.39 0.05 -1.07 0.51 116.94 117.48 2c8t h PHE 151 Ca -0.01 0.04 0.04 0.00 3.82 0.00 0.00 57.97 61.86 2c8t h PHE 151 Cb 0.36 0.01 -0.05 0.00 2.00 0.00 0.00 35.95 38.27 2c8t h PHE 151 CO 0.03 -0.06 -0.18 -0.09 -0.18 0.00 0.00 178.31 177.83 2c8t h ARG 152 N 0.25 -0.22 -0.20 1.51 2.43 -1.07 0.25 114.38 117.32 2c8t h ARG 152 Ca 0.35 0.02 -0.15 0.00 -0.81 0.00 0.00 59.98 59.38 2c8t h ARG 152 Cb 0.55 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 2c8t h ARG 152 CO -0.45 -0.15 -0.51 -0.07 -1.51 0.00 0.00 179.97 177.28 2c8t h LEU 153 N -0.23 0.62 -0.22 3.80 3.38 -0.71 -1.50 115.31 120.45 2c8t h LEU 153 Ca 0.10 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2c8t h LEU 153 Cb 0.37 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2c8t h LEU 153 CO -0.26 1.02 0.14 -1.13 0.09 0.00 0.00 178.44 178.29 2c8t h ASN 154 N 0.44 0.25 -0.41 -0.43 -0.00 -0.58 0.44 115.58 115.30 2c8t h ASN 154 Ca 0.02 -0.03 0.08 0.00 -0.00 0.00 0.00 56.30 56.37 2c8t h ASN 154 Cb 1.04 -0.06 -0.07 0.00 -0.00 0.00 0.00 38.32 39.23 2c8t h ASN 154 CO 0.10 0.21 -0.03 0.00 -0.00 0.00 0.00 177.43 177.70 2c8t h ALA 155 N 1.06 0.35 -0.19 1.57 0.00 -0.80 -1.67 119.26 119.57 2c8t h ALA 155 Ca 0.08 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2c8t h ALA 155 Cb -0.01 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2c8t h ALA 155 CO -0.02 -0.41 0.06 1.49 0.00 0.00 0.00 179.25 180.37 2c8t h GLU 156 N 0.07 0.30 -0.61 0.00 4.81 -0.60 0.36 114.58 118.91 2c8t h GLU 156 Ca 0.20 -0.06 0.15 0.00 -0.13 0.00 0.00 59.36 59.52 2c8t h GLU 156 Cb 0.30 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.60 2c8t h GLU 156 CO -0.37 0.39 0.42 0.74 -0.73 0.00 0.00 179.01 179.47 2c8t h PHE 157 N 0.14 0.19 0.00 0.92 0.05 0.10 -3.21 116.94 115.14 2c8t h PHE 157 Ca 0.06 0.01 0.00 0.00 3.82 0.00 0.00 57.97 61.86 2c8t h PHE 157 Cb 0.22 -0.06 0.00 0.00 2.00 0.00 0.00 35.95 38.11 2c8t h PHE 157 CO -0.00 0.08 -1.18 -2.37 -0.18 0.00 0.00 178.31 174.65 2c8t n THR 158 N -4.42 0.00 -0.82 -1.55 5.66 -0.65 -4.83 114.28 107.67 2c8t n THR 158 Ca 0.11 -0.26 0.00 0.00 -3.05 0.00 0.00 64.05 60.86 2c8t n THR 158 Cb 0.56 0.51 0.00 0.00 -1.55 0.00 0.00 70.33 69.85 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 1.62 0.83 3.97 1.09 0.00 0.08 -4.26 105.19 108.51 2c8t n GLY 159 Ca -0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.18 3.21 0.40 1.61 -1.52 -1.11 -5.03 119.66 117.04 2c8t s GLN 160 Ca 0.00 -0.72 -0.24 0.00 -1.95 0.00 0.00 55.36 52.45 2c8t s GLN 160 Cb 0.00 -2.73 -0.09 0.00 -0.22 0.00 0.00 33.01 29.97 2c8t s GLN 160 CO 0.00 0.04 1.11 -2.14 -0.25 0.00 0.00 175.29 174.05 2c8t s PRO 161 N -4.27 4.08 0.35 2.91 0.02 -1.26 -4.58 135.00 132.24 2c8t s PRO 161 Ca 0.43 1.66 0.09 0.00 0.02 0.00 0.00 61.00 63.21 2c8t s PRO 161 Cb -0.10 -2.59 0.81 0.00 0.02 0.00 0.00 34.50 32.65 2c8t s PRO 161 CO 0.33 -0.25 1.85 0.82 -0.33 0.00 0.00 177.00 179.43 2c8t h ILE 162 N 2.21 0.81 -0.97 2.83 2.04 -1.93 -0.26 117.51 122.23 2c8t h ILE 162 Ca -0.48 -0.24 0.08 0.00 1.00 0.00 0.00 64.86 65.21 2c8t h ILE 162 Cb 1.23 0.05 -0.07 0.00 -0.74 0.00 0.00 36.82 37.29 2c8t h ILE 162 CO 0.62 0.13 0.62 -0.33 0.00 0.00 0.00 178.15 179.19 2c8t h GLU 163 N 0.70 1.06 -0.06 2.37 3.07 -1.98 -0.82 114.58 118.92 2c8t h GLU 163 Ca 0.47 -0.06 -0.25 0.00 -0.50 0.00 0.00 59.36 59.02 2c8t h GLU 163 Cb 0.77 -0.24 0.02 0.00 -0.84 0.00 0.00 28.75 28.46 2c8t h GLU 163 CO -0.23 0.70 -0.93 -0.09 -1.40 0.00 0.00 179.01 177.06 2c8t h ARG 164 N 1.09 0.73 -0.71 2.33 2.43 -1.45 -1.83 114.38 116.97 2c8t h ARG 164 Ca 0.43 -0.71 0.10 0.00 -0.81 0.00 0.00 59.98 58.99 2c8t h ARG 164 Cb 0.23 0.18 -0.07 0.00 -0.42 0.00 0.00 29.97 29.89 2c8t h ARG 164 CO -0.19 1.30 0.35 0.82 -1.51 0.00 0.00 179.97 180.73 2c8t h ILE 165 N 0.43 0.84 0.64 1.20 1.08 -0.95 0.13 117.51 120.87 2c8t h ILE 165 Ca -0.10 -0.20 -0.03 0.00 -0.39 0.00 0.00 64.86 64.14 2c8t h ILE 165 Cb 1.58 0.19 0.01 0.00 -3.07 0.00 0.00 36.82 35.53 2c8t h ILE 165 CO 0.19 0.11 -0.31 -0.33 -0.69 0.00 0.00 178.15 177.12 2c8t h GLU 166 N 0.59 -0.82 -0.82 2.37 5.08 -1.15 -2.31 114.58 117.52 2c8t h GLU 166 Ca 0.35 0.06 0.20 0.00 -1.00 0.00 0.00 59.36 58.97 2c8t h GLU 166 Cb 0.38 0.19 -0.12 0.00 0.50 0.00 0.00 28.75 29.69 2c8t h GLU 166 CO -0.28 -0.55 0.25 0.00 -1.00 0.00 0.00 179.01 177.44 2c8t h ALA 167 N -1.29 1.17 -0.19 3.43 0.00 -1.21 -0.03 119.26 121.14 2c8t h ALA 167 Ca -0.09 0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 2c8t h ALA 167 Cb 0.65 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2c8t h ALA 167 CO 0.14 -0.37 -0.41 -0.44 0.00 0.00 0.00 179.25 178.17 2c8t h ASP 168 N 0.29 0.47 -0.46 0.00 3.32 -0.77 -2.56 116.42 116.72 2c8t h ASP 168 Ca 0.49 -0.21 -0.13 0.00 0.02 0.00 0.00 57.03 57.21 2c8t h ASP 168 Cb 0.92 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.32 2c8t h ASP 168 CO -0.56 0.83 -0.21 0.28 -1.72 0.00 0.00 179.24 177.86 2c8t h SER 169 N 0.37 0.99 -0.81 6.45 0.02 -0.46 -2.06 113.55 118.05 2c8t h SER 169 Ca 0.03 -0.37 -0.01 0.00 -0.84 0.00 0.00 61.79 60.61 2c8t h SER 169 Cb 0.87 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 63.10 2c8t h SER 169 CO 0.07 1.15 0.47 0.44 -1.14 0.00 0.00 176.83 177.83 2c8t h ASP 170 N 0.84 0.99 -0.13 3.07 3.32 -1.06 -1.97 116.42 121.48 2c8t h ASP 170 Ca 0.11 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2c8t h ASP 170 Cb 0.77 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.07 2c8t h ASP 170 CO 0.06 0.79 0.00 -2.11 -1.72 0.00 0.00 179.24 176.26 2c8t n ARG 171 N -4.43 1.35 -3.22 3.56 1.85 -0.97 -4.89 116.66 109.90 2c8t n ARG 171 Ca 0.08 -0.54 -0.22 0.00 -1.00 0.00 0.00 57.85 56.17 2c8t n ARG 171 Cb 0.07 -1.20 0.01 0.00 -1.05 0.00 0.00 32.46 30.29 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 -0.13 -4.33 -4.67 2.89 8.00 -0.95 -4.87 116.55 112.50 2c8t n ASP 172 Ca 0.09 -0.33 -0.47 0.00 0.71 0.00 0.00 54.79 54.78 2c8t n ASP 172 Cb 0.15 -3.56 -0.05 0.00 -0.02 0.00 0.00 41.12 37.65 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 -3.75 2.04 -3.92 -1.24 0.63 -0.81 -4.69 116.66 104.92 2c8t n ARG 173 Ca -0.05 0.74 -0.22 0.00 -0.92 0.00 0.00 57.85 57.40 2c8t n ARG 173 Cb 0.57 -2.51 -0.05 0.00 0.45 0.00 0.00 32.46 30.92 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 1.66 2.83 0.01 -0.14 1.48 -1.26 -1.44 118.94 122.08 2c8t s TRP 174 Ca 0.83 -0.34 -0.01 0.00 -1.06 0.00 0.00 56.10 55.53 2c8t s TRP 174 Cb -0.72 -1.74 -0.01 0.00 -1.16 0.00 0.00 33.47 29.84 2c8t s TRP 174 CO 0.42 0.24 0.00 -0.06 -4.06 0.00 0.00 176.95 173.49 2c8t s PHE 175 N -2.35 0.12 0.56 1.66 0.40 0.12 -4.98 117.98 113.50 2c8t s PHE 175 Ca 0.40 -0.24 -0.09 0.00 -0.60 0.00 0.00 56.93 56.40 2c8t s PHE 175 Cb -0.04 -0.09 -0.04 0.00 0.51 0.00 0.00 43.02 43.35 2c8t s PHE 175 CO 0.25 -0.11 0.93 0.99 0.70 0.00 0.00 175.22 177.98 2c8t s THR 176 N -0.77 4.78 0.21 0.64 2.01 -1.26 -1.74 115.64 119.51 2c8t s THR 176 Ca -0.08 0.63 -0.10 0.00 0.31 0.00 0.00 61.69 62.44 2c8t s THR 176 Cb -0.05 -3.86 0.19 0.00 0.01 0.00 0.00 72.50 68.79 2c8t s THR 176 CO -0.00 -1.01 1.68 0.00 -0.69 0.00 0.00 174.62 174.59 2c8t h ALA 177 N -0.04 0.66 -0.02 7.40 0.00 -1.74 0.64 119.26 126.16 2c8t h ALA 177 Ca -0.45 0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.65 2c8t h ALA 177 Cb 1.20 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 19.24 2c8t h ALA 177 CO 0.62 -0.37 -0.08 0.00 0.00 0.00 0.00 179.25 179.42 2c8t h ALA 178 N 1.54 -0.07 -0.49 0.00 0.00 -1.91 -1.58 119.26 116.75 2c8t h ALA 178 Ca 0.33 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.20 2c8t h ALA 178 Cb 0.52 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2c8t h ALA 178 CO -0.49 -0.56 0.11 0.93 0.00 0.00 0.00 179.25 179.24 2c8t h GLU 179 N -0.12 0.75 -0.58 0.00 5.08 -1.68 -2.47 114.58 115.55 2c8t h GLU 179 Ca 0.04 -0.15 -0.07 0.00 -1.00 0.00 0.00 59.36 58.18 2c8t h GLU 179 Cb 0.17 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 2c8t h GLU 179 CO -0.09 0.68 0.10 0.00 -1.00 0.00 0.00 179.01 178.70 2c8t h ALA 180 N 1.40 1.07 -0.65 3.43 0.00 0.47 -1.59 119.26 123.39 2c8t h ALA 180 Ca 0.16 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2c8t h ALA 180 Cb 0.28 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2c8t h ALA 180 CO -0.00 0.60 0.17 1.25 0.00 0.00 0.00 179.25 181.27 2c8t h LEU 181 N 0.89 0.95 -0.32 0.00 5.85 -0.88 -2.20 115.31 119.60 2c8t h LEU 181 Ca 0.18 -0.18 -0.10 0.00 0.84 0.00 0.00 57.88 58.62 2c8t h LEU 181 Cb 0.39 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 2c8t h LEU 181 CO 0.01 0.91 -0.19 -0.33 -0.34 0.00 0.00 178.44 178.50 2c8t h GLU 182 N 0.97 0.70 0.00 1.25 5.08 -1.14 -3.06 114.58 118.38 2c8t h GLU 182 Ca 0.21 -0.32 -0.03 0.00 -1.00 0.00 0.00 59.36 58.22 2c8t h GLU 182 Cb 0.33 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 2c8t h GLU 182 CO -0.00 0.92 -0.15 -0.92 -1.00 0.00 0.00 179.01 177.86 2c8t h TYR 183 N 0.46 0.00 0.00 4.33 3.20 -1.24 -3.47 116.97 120.26 2c8t h TYR 183 Ca 0.07 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.94 2c8t h TYR 183 Cb 0.73 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.00 2c8t h TYR 183 CO 0.06 0.15 0.00 0.41 -1.64 0.00 0.00 178.16 177.14 2c8t n GLY 184 N 0.16 1.14 0.27 1.82 0.00 -0.90 -4.69 105.19 102.99 2c8t n GLY 184 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.19 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 -2.40 1.61 -1.00 -1.67 -3.39 116.94 110.09 2c8t h PHE 185 Ca 0.00 0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.70 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 -0.03 0.08 -1.61 0.00 0.00 178.31 176.75 2c8t s VAL 186 N -3.63 0.01 -0.10 -0.55 1.01 -1.25 -3.92 120.40 111.97 2c8t s VAL 186 Ca 0.02 -0.11 0.15 0.00 0.00 0.00 0.00 61.98 62.03 2c8t s VAL 186 Cb 0.09 -0.82 -0.23 0.00 0.00 0.00 0.00 36.38 35.42 2c8t s VAL 186 CO 0.54 -0.06 0.48 0.47 0.00 0.00 0.00 175.10 176.53 2c8t n ASP 187 N 1.83 0.58 -3.91 3.32 8.00 0.15 -4.56 116.55 121.96 2c8t n ASP 187 Ca -0.17 0.28 -0.10 0.00 0.71 0.00 0.00 54.79 55.50 2c8t n ASP 187 Cb 0.56 0.30 -0.10 0.00 -0.02 0.00 0.00 41.12 41.86 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 -2.58 0.11 -0.26 1.24 3.76 -0.63 -5.00 115.29 111.93 2c8t s HIS 188 Ca -0.06 -0.26 -0.09 0.00 -0.15 0.00 0.00 55.06 54.50 2c8t s HIS 188 Cb 0.07 -0.10 -0.04 0.00 1.11 0.00 0.00 32.58 33.63 2c8t s HIS 188 CO 0.83 -0.24 0.12 0.42 -0.85 0.00 0.00 174.74 175.01 2c8t s ILE 189 N -1.34 4.74 -0.04 0.60 1.01 -1.26 -1.22 121.20 123.69 2c8t s ILE 189 Ca -0.14 -0.03 -0.13 0.00 0.00 0.00 0.00 60.65 60.35 2c8t s ILE 189 Cb -0.08 -3.23 -0.05 0.00 0.01 0.00 0.00 42.46 39.11 2c8t s ILE 189 CO 0.01 0.31 0.34 0.27 0.00 0.00 0.00 174.94 175.86 2c8t s ILE 190 N 1.59 5.16 0.00 2.92 -4.36 -0.68 -4.95 121.20 120.88 2c8t s ILE 190 Ca 0.06 0.67 0.00 0.00 -0.26 0.00 0.00 60.65 61.13 2c8t s ILE 190 Cb -0.15 -3.63 0.00 0.00 1.25 0.00 0.00 42.46 39.93 2c8t s ILE 190 CO 0.06 0.58 0.00 0.41 0.24 0.00 0.00 174.94 176.23 2c8t n THR 191 N 1.96 0.00 -2.56 8.37 -1.04 -1.26 -3.99 114.28 115.76 2c8t n THR 191 Ca -0.15 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.55 2c8t n THR 191 Cb 0.53 -0.95 -0.03 0.00 -1.82 0.00 0.00 70.33 68.06 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 0.00 3.84 0.66 -2.82 0.52 -1.26 -5.03 118.95 114.87 2c8t s ARG 192 Ca 0.00 0.71 0.02 0.00 -0.52 0.00 0.00 55.73 55.95 2c8t s ARG 192 Cb 0.00 -2.25 0.11 0.00 0.52 0.00 0.00 34.95 33.33 2c8t s ARG 192 CO 0.00 -0.19 0.92 0.00 0.02 0.00 0.00 175.30 176.04 2c8t s ALA 193 N -2.56 4.01 0.00 2.13 0.00 -1.26 -5.21 121.76 118.87 2c8t s ALA 193 Ca 0.55 -1.82 0.00 0.00 0.00 0.00 0.00 51.96 50.69 2c8t s ALA 193 Cb -0.10 -1.85 0.00 0.00 0.00 0.00 0.00 23.12 21.17 2c8t s ALA 193 CO 0.33 -1.23 0.00 0.72 0.00 0.00 0.00 175.76 175.58