#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 -0.87 -0.41 2.46 5.85 -2.05 0.19 115.31 120.47 2c8t h LEU 16 Ca 0.00 0.15 0.09 0.00 0.84 0.00 0.00 57.88 58.96 2c8t h LEU 16 Cb 0.00 0.41 -0.09 0.00 0.37 0.00 0.00 40.66 41.35 2c8t h LEU 16 CO 0.00 -0.30 -0.26 0.74 -0.34 0.00 0.00 178.44 178.29 2c8t h THR 17 N -0.26 0.32 -0.55 1.05 2.02 -2.06 -0.26 112.91 113.17 2c8t h THR 17 Ca 0.15 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.29 2c8t h THR 17 Cb 0.49 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 2c8t h THR 17 CO -0.43 0.00 0.19 0.44 0.37 0.00 0.00 175.52 176.09 2c8t h ASP 18 N -0.18 0.79 -0.69 4.18 3.32 -1.89 -2.16 116.42 119.79 2c8t h ASP 18 Ca 0.19 -0.20 0.07 0.00 0.02 0.00 0.00 57.03 57.12 2c8t h ASP 18 Cb 0.49 -0.21 -0.06 0.00 0.22 0.00 0.00 39.33 39.77 2c8t h ASP 18 CO -0.52 0.77 0.37 -1.28 -1.72 0.00 0.00 179.24 176.86 2c8t h SER 19 N 0.76 0.53 0.18 6.45 0.87 -0.05 0.60 113.55 122.88 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 0.25 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.16 2c8t h SER 19 CO -0.01 0.33 -0.09 0.58 -0.53 0.00 0.00 176.83 177.11 2c8t h VAL 20 N 0.66 0.85 -0.54 2.23 2.07 -0.79 -1.27 116.25 119.46 2c8t h VAL 20 Ca 0.32 -0.12 -0.03 0.00 0.82 0.00 0.00 66.70 67.69 2c8t h VAL 20 Cb 0.25 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 2c8t h VAL 20 CO -0.21 0.03 0.23 1.88 0.02 0.00 0.00 177.57 179.51 2c8t h TYR 21 N -0.30 0.77 0.34 1.57 -1.99 -0.99 -1.02 116.97 115.35 2c8t h TYR 21 Ca -0.02 -0.03 -0.02 0.00 2.00 0.00 0.00 58.73 60.66 2c8t h TYR 21 Cb 0.23 -0.24 0.00 0.00 2.00 0.00 0.00 36.73 38.72 2c8t h TYR 21 CO -0.05 0.59 -0.16 0.93 -0.00 0.00 0.00 178.16 179.47 2c8t h GLU 22 N 0.77 -0.43 -0.78 4.88 5.08 -0.80 -0.85 114.58 122.44 2c8t h GLU 22 Ca 0.19 0.03 0.14 0.00 -1.00 0.00 0.00 59.36 58.71 2c8t h GLU 22 Cb 0.13 0.10 -0.09 0.00 0.50 0.00 0.00 28.75 29.39 2c8t h GLU 22 CO -0.02 -0.21 0.36 0.00 -1.00 0.00 0.00 179.01 178.14 2c8t h ARG 23 N -0.59 0.52 0.00 2.33 3.08 -0.92 -0.09 114.38 118.71 2c8t h ARG 23 Ca -0.05 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.93 2c8t h ARG 23 Cb 0.43 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 2c8t h ARG 23 CO 0.08 0.34 -0.22 1.25 -1.07 0.00 0.00 179.97 180.35 2c8t h LEU 24 N 0.53 0.00 -0.47 3.04 5.85 -0.99 -1.26 115.31 122.02 2c8t h LEU 24 Ca 0.42 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.99 2c8t h LEU 24 Cb 0.60 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 2c8t h LEU 24 CO -0.37 0.22 -0.71 0.25 -0.34 0.00 0.00 178.44 177.50 2c8t h LEU 25 N 0.00 0.00 -0.17 2.25 5.85 0.46 -0.84 115.31 122.87 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 0.54 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.57 2c8t h LEU 25 CO 0.03 0.71 0.00 -1.20 -0.34 0.00 0.00 178.44 177.64 2c8t n SER 26 N -3.57 0.16 -1.43 1.25 7.64 -0.48 -1.68 113.62 115.51 2c8t n SER 26 Ca -0.00 0.54 0.08 0.00 1.01 0.00 0.00 58.87 60.50 2c8t n SER 26 Cb 0.72 -0.57 0.33 0.00 -1.01 0.00 0.00 64.21 63.68 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 -1.68 3.84 -3.34 1.43 -0.58 -0.69 -4.93 120.64 114.69 2c8t n GLU 27 Ca 0.03 -2.90 -0.24 0.00 -0.42 0.00 0.00 57.16 53.63 2c8t n GLU 27 Cb 0.19 -1.95 0.02 0.00 -0.57 0.00 0.00 31.44 29.13 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 0.50 -4.47 -5.02 3.49 5.12 -0.68 -4.88 116.66 110.74 2c8t n ARG 28 Ca 0.24 0.66 -0.32 0.00 -1.93 0.00 0.00 57.85 56.50 2c8t n ARG 28 Cb 0.95 -5.47 -0.15 0.00 -1.16 0.00 0.00 32.46 26.63 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 -3.09 2.64 0.02 0.55 1.01 -0.40 -0.30 121.20 121.63 2c8t s ILE 29 Ca 0.42 -0.85 0.00 0.00 0.00 0.00 0.00 60.65 60.22 2c8t s ILE 29 Cb -0.21 -2.03 -0.02 0.00 0.01 0.00 0.00 42.46 40.21 2c8t s ILE 29 CO 0.52 0.56 -0.04 -0.63 0.00 0.00 0.00 174.94 175.35 2c8t s ILE 30 N -0.18 0.17 -0.06 2.92 1.01 0.10 -3.64 121.20 121.52 2c8t s ILE 30 Ca -0.01 -0.98 0.03 0.00 0.00 0.00 0.00 60.65 59.68 2c8t s ILE 30 Cb -0.13 -0.37 0.01 0.00 0.01 0.00 0.00 42.46 41.97 2c8t s ILE 30 CO 0.03 -0.51 -0.15 -0.36 0.00 0.00 0.00 174.94 173.95 2c8t s PHE 31 N -1.59 1.67 -0.50 3.97 0.40 -1.26 -0.13 117.98 120.54 2c8t s PHE 31 Ca -0.14 -0.59 -0.10 0.00 -0.60 0.00 0.00 56.93 55.50 2c8t s PHE 31 Cb -0.09 -1.17 0.13 0.00 0.51 0.00 0.00 43.02 42.39 2c8t s PHE 31 CO -0.01 -0.26 0.38 -1.17 0.70 0.00 0.00 175.22 174.86 2c8t s LEU 32 N 0.43 5.77 -0.09 -0.37 2.96 0.11 -4.94 118.68 122.56 2c8t s LEU 32 Ca -0.12 -1.98 0.12 0.00 -0.22 0.00 0.00 54.13 51.93 2c8t s LEU 32 Cb -0.15 -2.03 0.25 0.00 0.50 0.00 0.00 46.19 44.76 2c8t s LEU 32 CO 0.04 -0.69 1.16 0.61 -1.32 0.00 0.00 176.35 176.15 2c8t n GLY 33 N 4.83 3.98 0.68 7.98 0.00 -1.26 -0.72 105.19 120.68 2c8t n GLY 33 Ca -0.07 -0.72 -0.01 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.81 -0.36 -4.67 1.61 3.41 -1.24 -4.79 113.62 106.77 2c8t n SER 34 Ca 0.12 -1.22 -0.61 0.00 -0.26 0.00 0.00 58.87 56.90 2c8t n SER 34 Cb 0.55 0.59 -0.08 0.00 -0.26 0.00 0.00 64.21 65.01 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 -0.11 0.56 -2.27 4.33 4.07 -1.26 -4.40 120.64 121.56 2c8t n GLU 35 Ca -0.01 0.21 -0.33 0.00 -0.06 0.00 0.00 57.16 56.96 2c8t n GLU 35 Cb 0.10 -1.79 -0.04 0.00 -0.06 0.00 0.00 31.44 29.66 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 2.29 3.68 0.51 6.31 1.01 0.21 -4.84 120.40 129.56 2c8t s VAL 36 Ca 0.97 -0.70 0.07 0.00 0.00 0.00 0.00 61.98 62.32 2c8t s VAL 36 Cb -1.23 -4.54 0.03 0.00 0.00 0.00 0.00 36.38 30.63 2c8t s VAL 36 CO 0.67 -1.39 0.45 0.54 0.00 0.00 0.00 175.10 175.37 2c8t s ASN 37 N 6.47 4.81 0.20 3.32 4.22 -1.26 -0.34 114.94 132.35 2c8t s ASN 37 Ca 0.60 -1.04 -0.11 0.00 -2.14 0.00 0.00 52.86 50.17 2c8t s ASN 37 Cb -0.03 0.08 0.16 0.00 1.28 0.00 0.00 41.25 42.74 2c8t s ASN 37 CO -0.02 -0.99 1.83 0.44 -2.04 0.00 0.00 177.10 176.33 2c8t h ASP 38 N 0.77 0.63 0.22 3.54 3.32 -1.95 0.52 116.42 123.48 2c8t h ASP 38 Ca -0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.68 2c8t h ASP 38 Cb 1.29 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.69 2c8t h ASP 38 CO 0.55 0.44 -0.20 -0.08 -1.72 0.00 0.00 179.24 178.23 2c8t h GLU 39 N 0.76 -0.43 -0.66 3.56 4.57 -1.97 0.74 114.58 121.14 2c8t h GLU 39 Ca 0.25 0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.44 2c8t h GLU 39 Cb 0.03 0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.68 2c8t h GLU 39 CO -0.11 -0.29 0.33 0.82 -1.18 0.00 0.00 179.01 178.59 2c8t h ILE 40 N -0.45 1.22 -0.04 2.32 2.04 -1.84 -1.61 117.51 119.15 2c8t h ILE 40 Ca -0.01 -0.60 0.03 0.00 1.00 0.00 0.00 64.86 65.29 2c8t h ILE 40 Cb 0.41 0.40 -0.05 0.00 -0.74 0.00 0.00 36.82 36.84 2c8t h ILE 40 CO -0.04 0.25 -0.23 0.00 0.00 0.00 0.00 178.15 178.14 2c8t h ALA 41 N 1.16 -0.27 -0.41 1.87 0.00 -0.64 -0.07 119.26 120.89 2c8t h ALA 41 Ca 0.23 0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.24 2c8t h ALA 41 Cb 0.09 0.42 -0.08 0.00 0.00 0.00 0.00 17.79 18.22 2c8t h ALA 41 CO -0.03 -0.72 -0.14 -0.91 0.00 0.00 0.00 179.25 177.45 2c8t h ASN 42 N -0.34 -0.49 -0.76 0.00 2.35 -0.67 0.14 115.58 115.80 2c8t h ASN 42 Ca 0.07 0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 55.95 2c8t h ASN 42 Cb 0.44 0.30 -0.04 0.00 0.05 0.00 0.00 38.32 39.07 2c8t h ASN 42 CO -0.24 -0.17 0.44 -0.09 -1.65 0.00 0.00 177.43 175.72 2c8t h ARG 43 N -0.05 1.06 -0.33 0.81 2.43 -0.69 0.68 114.38 118.30 2c8t h ARG 43 Ca 0.20 -0.11 -0.08 0.00 -0.81 0.00 0.00 59.98 59.18 2c8t h ARG 43 Cb 0.36 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 2c8t h ARG 43 CO -0.45 0.76 -0.12 -0.07 -1.51 0.00 0.00 179.97 178.58 2c8t h LEU 44 N 1.07 0.67 -0.48 3.80 3.38 -0.21 -1.52 115.31 122.03 2c8t h LEU 44 Ca 0.28 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2c8t h LEU 44 Cb -0.01 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2c8t h LEU 44 CO -0.05 0.90 0.32 0.00 0.09 0.00 0.00 178.44 179.70 2c8t h ALA 46 N 1.18 0.51 -0.26 0.00 0.00 -0.69 0.18 119.26 120.18 2c8t h ALA 46 Ca 0.18 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 2c8t h ALA 46 Cb -0.07 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2c8t h ALA 46 CO -0.04 -0.31 0.13 1.96 0.00 0.00 0.00 179.25 180.98 2c8t h GLN 47 N 0.22 0.37 -0.35 0.00 4.20 -0.39 -1.05 115.11 118.11 2c8t h GLN 47 Ca 0.23 -0.05 0.02 0.00 0.06 0.00 0.00 58.65 58.91 2c8t h GLN 47 Cb 0.30 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 2c8t h GLN 47 CO -0.31 0.35 0.17 0.82 -0.67 0.00 0.00 178.83 179.20 2c8t h ILE 48 N 0.29 0.98 -0.84 2.54 2.04 -0.33 -1.35 117.51 120.84 2c8t h ILE 48 Ca 0.09 -0.12 0.03 0.00 1.00 0.00 0.00 64.86 65.86 2c8t h ILE 48 Cb 0.10 0.59 -0.05 0.00 -0.74 0.00 0.00 36.82 36.73 2c8t h ILE 48 CO -0.01 0.07 0.54 -0.07 0.00 0.00 0.00 178.15 178.68 2c8t h LEU 49 N 0.36 0.91 -0.20 1.44 3.38 -0.70 -1.19 115.31 119.31 2c8t h LEU 49 Ca 0.15 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 2c8t h LEU 49 Cb 0.06 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2c8t h LEU 49 CO -0.10 0.63 0.05 0.25 0.09 0.00 0.00 178.44 179.35 2c8t h LEU 50 N 1.06 0.30 -0.09 1.67 5.85 -0.72 0.50 115.31 123.89 2c8t h LEU 50 Ca 0.33 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 2c8t h LEU 50 Cb -0.01 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 40.94 2c8t h LEU 50 CO -0.11 0.46 0.03 -0.07 -0.34 0.00 0.00 178.44 178.41 2c8t h LEU 51 N 0.13 0.12 -0.92 2.25 3.38 -1.06 0.86 115.31 120.07 2c8t h LEU 51 Ca 0.06 -0.17 0.10 0.00 0.09 0.00 0.00 57.88 57.97 2c8t h LEU 51 Cb 0.27 -0.03 -0.08 0.00 0.09 0.00 0.00 40.66 40.92 2c8t h LEU 51 CO 0.00 0.25 0.56 0.00 0.09 0.00 0.00 178.44 179.34 2c8t h ALA 52 N 0.87 1.34 -0.24 1.53 0.00 -1.12 -1.59 119.26 120.05 2c8t h ALA 52 Ca 0.03 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 2c8t h ALA 52 Cb 0.17 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2c8t h ALA 52 CO -0.00 0.20 -0.27 0.00 0.00 0.00 0.00 179.25 179.18 2c8t h ALA 53 N 1.49 1.09 -0.07 0.00 0.00 -0.19 -2.81 119.26 118.76 2c8t h ALA 53 Ca 0.44 -0.35 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 2c8t h ALA 53 Cb 0.38 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2c8t h ALA 53 CO -0.24 0.56 -0.65 0.93 0.00 0.00 0.00 179.25 179.85 2c8t h GLU 54 N 0.41 0.27 -0.92 0.00 5.08 0.07 -3.43 114.58 116.06 2c8t h GLU 54 Ca 0.06 -0.20 0.16 0.00 -1.00 0.00 0.00 59.36 58.37 2c8t h GLU 54 Cb 0.69 0.04 -0.22 0.00 0.50 0.00 0.00 28.75 29.76 2c8t h GLU 54 CO 0.05 0.83 0.01 0.34 -1.00 0.00 0.00 179.01 179.24 2c8t s ASP 55 N -6.91 -0.85 0.07 1.42 -1.08 -0.73 -5.05 116.67 103.54 2c8t s ASP 55 Ca -0.04 0.76 0.26 0.00 -0.52 0.00 0.00 52.55 53.01 2c8t s ASP 55 Cb 0.11 1.80 0.76 0.00 -1.46 0.00 0.00 42.92 44.14 2c8t s ASP 55 CO 0.81 -0.16 1.63 0.00 0.52 0.00 0.00 175.17 177.97 2c8t n ALA 56 N 5.32 2.77 -0.06 3.66 0.00 -1.07 -4.20 120.51 126.93 2c8t n ALA 56 Ca -0.06 -0.18 -0.17 0.00 0.00 0.00 0.00 53.44 53.03 2c8t n ALA 56 Cb 0.52 -1.31 -0.14 0.00 0.00 0.00 0.00 19.45 18.52 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 -1.79 1.60 -4.77 0.00 3.41 -1.26 -3.01 113.62 107.79 2c8t n SER 57 Ca 0.05 0.09 -0.35 0.00 -0.26 0.00 0.00 58.87 58.40 2c8t n SER 57 Cb 0.38 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 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 -2.54 3.34 0.79 4.33 1.02 -1.26 -4.71 119.74 120.70 2c8t s LYS 58 Ca -0.23 1.58 -0.11 0.00 0.02 0.00 0.00 55.97 57.23 2c8t s LYS 58 Cb 0.08 -2.01 0.07 0.00 -0.52 0.00 0.00 37.83 35.45 2c8t s LYS 58 CO 0.73 -0.85 1.12 -0.51 -0.92 0.00 0.00 175.35 174.91 2c8t s ASP 59 N -1.84 4.19 -0.08 2.83 1.01 -1.26 -4.56 116.67 116.96 2c8t s ASP 59 Ca 0.72 1.98 0.03 0.00 0.71 0.00 0.00 52.55 55.99 2c8t s ASP 59 Cb -0.23 -2.54 -0.02 0.00 1.01 0.00 0.00 42.92 41.14 2c8t s ASP 59 CO 0.28 -2.25 -0.15 -0.63 0.21 0.00 0.00 175.17 172.62 2c8t s ILE 60 N -2.69 2.91 -0.26 0.77 1.01 -0.34 -4.87 121.20 117.72 2c8t s ILE 60 Ca 0.64 -0.75 -0.10 0.00 0.00 0.00 0.00 60.65 60.45 2c8t s ILE 60 Cb -0.20 -2.16 -0.04 0.00 0.01 0.00 0.00 42.46 40.07 2c8t s ILE 60 CO 0.53 0.56 0.14 -0.44 0.00 0.00 0.00 174.94 175.74 2c8t s SER 61 N -0.26 5.70 -0.27 3.58 0.01 0.59 -0.35 113.70 122.70 2c8t s SER 61 Ca 0.01 -0.07 -0.05 0.00 1.31 0.00 0.00 55.95 57.16 2c8t s SER 61 Cb -0.13 -2.04 0.01 0.00 0.21 0.00 0.00 66.02 64.07 2c8t s SER 61 CO 0.03 -0.03 0.02 -0.22 0.41 0.00 0.00 173.24 173.45 2c8t s LEU 62 N 1.60 3.49 -0.19 2.44 2.96 0.62 0.00 118.68 129.61 2c8t s LEU 62 Ca 0.07 -0.71 -0.13 0.00 -0.22 0.00 0.00 54.13 53.14 2c8t s LEU 62 Cb -0.15 -1.79 -0.05 0.00 0.50 0.00 0.00 46.19 44.70 2c8t s LEU 62 CO 0.08 -0.14 0.24 -0.31 -1.32 0.00 0.00 176.35 174.89 2c8t s TYR 63 N 1.44 3.42 -0.18 5.38 1.51 0.82 -1.00 117.35 128.74 2c8t s TYR 63 Ca 0.02 0.47 -0.00 0.00 -1.01 0.00 0.00 57.07 56.55 2c8t s TYR 63 Cb -0.17 -2.30 0.01 0.00 -0.11 0.00 0.00 41.96 39.39 2c8t s TYR 63 CO -0.01 0.20 -0.15 0.42 -1.11 0.00 0.00 175.55 174.91 2c8t s ILE 64 N 0.61 2.58 -0.43 2.71 1.01 0.20 -0.71 121.20 127.17 2c8t s ILE 64 Ca 0.13 -0.77 0.05 0.00 0.00 0.00 0.00 60.65 60.06 2c8t s ILE 64 Cb -0.13 -2.11 0.19 0.00 0.01 0.00 0.00 42.46 40.42 2c8t s ILE 64 CO 0.03 0.50 0.45 -3.20 0.00 0.00 0.00 174.94 172.72 2c8t n ASN 65 N 4.47 -1.04 -3.89 3.58 5.15 0.11 -0.37 115.26 123.27 2c8t n ASN 65 Ca -0.20 -2.54 -0.11 0.00 -0.60 0.00 0.00 54.58 51.13 2c8t n ASN 65 Cb 0.51 -0.06 -0.13 0.00 -0.53 0.00 0.00 39.78 39.57 2c8t n ASN 65 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2c8t s SER 66 N 0.00 0.04 0.00 1.20 0.15 0.34 -3.67 113.70 111.76 2c8t s SER 66 Ca 0.33 -0.09 0.21 0.00 0.70 0.00 0.00 55.95 57.09 2c8t s SER 66 Cb 0.05 0.09 1.19 0.00 -1.71 0.00 0.00 66.02 65.65 2c8t s SER 66 CO -0.16 -0.11 1.78 -0.81 1.20 0.00 0.00 173.24 175.13 2c8t n PRO 67 N 2.57 1.08 0.00 5.44 -0.04 -1.26 -2.20 135.00 140.59 2c8t n PRO 67 Ca -0.16 -0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.18 2c8t n PRO 67 Cb 0.58 -1.34 0.00 0.00 -0.04 0.00 0.00 33.50 32.71 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 0.86 -0.23 0.00 0.55 0.00 -1.08 -4.38 105.19 100.92 2c8t n GLY 68 Ca 0.16 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.83 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 0.08 3.70 -0.02 0.00 -1.26 0.66 105.19 108.34 2c8t n GLY 69 Ca 0.00 -1.25 -0.44 0.00 0.00 0.00 0.00 46.02 44.33 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 3.51 0.15 1.61 2.88 0.53 -4.55 113.62 117.75 2c8t n SER 70 Ca 0.00 1.08 -0.14 0.00 -1.33 0.00 0.00 58.87 58.49 2c8t n SER 70 Cb 0.00 -1.50 -0.07 0.00 -0.75 0.00 0.00 64.21 61.89 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 3.63 0.71 -0.33 2.46 2.04 -1.99 -0.83 117.51 123.20 2c8t h ILE 71 Ca -0.44 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.33 2c8t h ILE 71 Cb 1.23 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 2c8t h ILE 71 CO 0.90 0.00 -0.18 0.77 0.00 0.00 0.00 178.15 179.64 2c8t h SER 72 N -0.34 0.59 -0.15 1.72 4.64 -1.97 0.76 113.55 118.80 2c8t h SER 72 Ca -0.02 -0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 2c8t h SER 72 Cb 0.29 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.21 2c8t h SER 72 CO 0.02 0.78 0.10 0.00 -0.87 0.00 0.00 176.83 176.86 2c8t h ALA 73 N 1.27 0.19 -0.95 5.18 0.00 -1.88 -1.09 119.26 121.99 2c8t h ALA 73 Ca 0.09 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.00 2c8t h ALA 73 Cb 0.61 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 2c8t h ALA 73 CO 0.04 -0.32 0.63 0.78 0.00 0.00 0.00 179.25 180.38 2c8t h GLY 74 N 0.21 1.34 1.61 0.00 0.00 0.01 -2.44 103.07 103.79 2c8t h GLY 74 Ca 0.06 -0.49 -0.11 0.00 0.00 0.00 0.00 47.33 46.78 2c8t h GLY 74 CO -0.01 0.47 -0.35 1.98 0.00 0.00 0.00 176.54 178.62 2c8t h MET 75 N 1.26 0.44 -0.64 4.80 -1.53 0.87 -0.95 114.93 119.18 2c8t h MET 75 Ca 0.35 -0.20 -0.01 0.00 -3.44 0.00 0.00 59.70 56.41 2c8t h MET 75 Cb -0.11 -0.01 -0.03 0.00 -0.55 0.00 0.00 31.60 30.90 2c8t h MET 75 CO -0.08 0.74 0.37 0.00 0.14 0.00 0.00 176.91 178.07 2c8t h ALA 76 N 1.25 0.82 -0.36 0.39 0.00 -0.76 0.01 119.26 120.62 2c8t h ALA 76 Ca 0.04 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2c8t h ALA 76 Cb 0.80 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2c8t h ALA 76 CO 0.06 0.32 0.17 0.82 0.00 0.00 0.00 179.25 180.62 2c8t h ILE 77 N 0.87 1.16 0.06 0.00 2.04 -0.97 -1.76 117.51 118.92 2c8t h ILE 77 Ca 0.23 -0.46 0.03 0.00 1.00 0.00 0.00 64.86 65.65 2c8t h ILE 77 Cb 0.01 0.81 -0.04 0.00 -0.74 0.00 0.00 36.82 36.85 2c8t h ILE 77 CO -0.04 0.17 -0.32 0.22 0.00 0.00 0.00 178.15 178.18 2c8t h TYR 78 N 0.44 -0.87 -0.70 1.37 3.20 -0.90 0.93 116.97 120.45 2c8t h TYR 78 Ca 0.12 0.02 0.14 0.00 3.14 0.00 0.00 58.73 62.16 2c8t h TYR 78 Cb 0.11 0.37 -0.10 0.00 1.54 0.00 0.00 36.73 38.66 2c8t h TYR 78 CO -0.02 -0.42 0.18 -0.44 -1.64 0.00 0.00 178.16 175.83 2c8t h ASP 79 N -0.50 0.04 -0.55 -2.11 3.32 -0.81 0.21 116.42 116.01 2c8t h ASP 79 Ca 0.05 0.13 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 2c8t h ASP 79 Cb 0.56 0.17 -0.03 0.00 0.22 0.00 0.00 39.33 40.26 2c8t h ASP 79 CO -0.22 -0.01 0.29 0.74 -1.72 0.00 0.00 179.24 178.32 2c8t h THR 80 N 0.29 1.19 -0.29 0.35 2.02 -0.72 0.21 112.91 115.96 2c8t h THR 80 Ca 0.39 -0.50 0.06 0.00 0.77 0.00 0.00 66.41 67.13 2c8t h THR 80 Cb 0.63 0.51 -0.06 0.00 -1.74 0.00 0.00 68.15 67.48 2c8t h THR 80 CO -0.47 0.21 -0.12 0.24 0.37 0.00 0.00 175.52 175.75 2c8t h MET 81 N 0.75 -0.07 -0.74 6.66 2.86 0.10 0.88 114.93 125.36 2c8t h MET 81 Ca 0.19 0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.86 2c8t h MET 81 Cb 0.07 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.70 2c8t h MET 81 CO -0.03 -0.05 0.48 0.28 1.06 0.00 0.00 176.91 178.65 2c8t h VAL 82 N -0.08 1.15 -0.29 -2.22 2.07 -0.66 -2.86 116.25 113.36 2c8t h VAL 82 Ca 0.15 -0.33 0.01 0.00 0.82 0.00 0.00 66.70 67.34 2c8t h VAL 82 Cb 0.30 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.15 2c8t h VAL 82 CO -0.34 0.18 0.18 0.25 0.02 0.00 0.00 177.57 177.86 2c8t h LEU 83 N 0.97 0.30 -9.44 2.57 5.85 0.45 -3.42 115.31 112.59 2c8t h LEU 83 Ca 0.28 -0.00 -0.53 0.00 0.84 0.00 0.00 57.88 58.47 2c8t h LEU 83 Cb -0.05 -0.07 0.03 0.00 0.37 0.00 0.00 40.66 40.94 2c8t h LEU 83 CO -0.08 0.22 1.16 0.00 -0.34 0.00 0.00 178.44 179.40 2c8t n ALA 84 N -2.19 1.93 0.06 1.25 0.00 0.20 -4.86 120.51 116.91 2c8t n ALA 84 Ca -0.01 0.27 0.09 0.00 0.00 0.00 0.00 53.44 53.78 2c8t n ALA 84 Cb 0.04 -2.63 0.53 0.00 0.00 0.00 0.00 19.45 17.39 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 9.39 0.30 -7.26 0.00 0.11 -1.83 -3.44 132.00 129.27 2c8t h PRO 85 Ca -0.48 -0.02 -0.50 0.00 0.11 0.00 0.00 66.00 65.11 2c8t h PRO 85 Cb 1.23 -0.07 0.06 0.00 0.11 0.00 0.00 31.00 32.33 2c8t h PRO 85 CO 0.95 0.20 0.34 0.00 -0.21 0.00 0.00 178.00 179.27 2c8t s ASP 87 N -4.19 5.36 -0.28 0.00 1.01 -1.26 -4.89 116.67 112.43 2c8t s ASP 87 Ca 0.53 2.57 0.03 0.00 0.71 0.00 0.00 52.55 56.39 2c8t s ASP 87 Cb -0.11 -2.62 0.07 0.00 1.01 0.00 0.00 42.92 41.27 2c8t s ASP 87 CO 0.51 -1.49 -0.06 -0.63 0.21 0.00 0.00 175.17 173.71 2c8t s ILE 88 N -1.43 2.09 0.23 0.77 1.01 -1.26 -1.20 121.20 121.41 2c8t s ILE 88 Ca 0.72 -1.76 -0.30 0.00 0.00 0.00 0.00 60.65 59.32 2c8t s ILE 88 Cb -0.35 -2.31 -0.09 0.00 0.01 0.00 0.00 42.46 39.72 2c8t s ILE 88 CO 0.41 -0.19 0.98 0.00 0.00 0.00 0.00 174.94 176.13 2c8t s ALA 89 N 1.10 3.34 -0.07 9.38 0.00 0.52 -1.41 121.76 134.63 2c8t s ALA 89 Ca -0.03 0.67 0.05 0.00 0.00 0.00 0.00 51.96 52.65 2c8t s ALA 89 Cb -0.20 -3.25 -0.00 0.00 0.00 0.00 0.00 23.12 19.67 2c8t s ALA 89 CO -0.06 0.09 -0.22 0.99 0.00 0.00 0.00 175.76 176.56 2c8t s THR 90 N -0.97 1.83 -0.15 0.00 2.01 -0.25 -0.27 115.64 117.85 2c8t s THR 90 Ca 0.43 -0.92 -0.00 0.00 0.31 0.00 0.00 61.69 61.50 2c8t s THR 90 Cb -0.27 -1.57 0.04 0.00 0.01 0.00 0.00 72.50 70.71 2c8t s THR 90 CO 0.33 0.51 -0.06 -0.31 -0.69 0.00 0.00 174.62 174.41 2c8t s TYR 91 N 0.08 1.61 -0.42 4.92 1.51 -0.17 0.33 117.35 125.22 2c8t s TYR 91 Ca -0.09 -0.95 -0.28 0.00 -1.01 0.00 0.00 57.07 54.75 2c8t s TYR 91 Cb -0.14 -1.28 0.02 0.00 -0.11 0.00 0.00 41.96 40.45 2c8t s TYR 91 CO 0.05 -0.58 1.03 0.00 -1.11 0.00 0.00 175.55 174.94 2c8t s ALA 92 N 1.67 3.30 -0.27 3.71 0.00 0.61 0.59 121.76 131.35 2c8t s ALA 92 Ca 0.02 -0.45 0.00 0.00 0.00 0.00 0.00 51.96 51.54 2c8t s ALA 92 Cb -0.14 -3.72 0.08 0.00 0.00 0.00 0.00 23.12 19.34 2c8t s ALA 92 CO -0.08 -1.91 0.02 1.41 0.00 0.00 0.00 175.76 175.20 2c8t s MET 93 N 3.93 1.21 1.43 0.00 0.00 0.50 -1.40 119.30 124.97 2c8t s MET 93 Ca 0.43 -1.12 0.00 0.00 0.00 0.00 0.00 55.69 55.00 2c8t s MET 93 Cb -0.10 -2.47 0.00 0.00 0.00 0.00 0.00 34.83 32.26 2c8t s MET 93 CO 0.24 -0.78 0.00 0.41 0.00 0.00 0.00 175.02 174.89 2c8t n GLY 94 N 4.69 1.48 2.90 2.11 0.00 -1.26 -3.79 105.19 111.31 2c8t n GLY 94 Ca -0.06 -0.36 -0.17 0.00 0.00 0.00 0.00 46.02 45.43 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 0.50 -0.28 1.61 -2.45 -1.26 -0.41 119.30 117.01 2c8t s MET 95 Ca 0.00 -0.08 0.02 0.00 -1.25 0.00 0.00 55.69 54.38 2c8t s MET 95 Cb 0.00 -0.55 0.08 0.00 1.25 0.00 0.00 34.83 35.60 2c8t s MET 95 CO 0.00 -0.02 -0.02 0.00 1.05 0.00 0.00 175.02 176.03 2c8t s ALA 96 N 0.52 2.28 0.12 4.11 0.00 -0.84 -0.50 121.76 127.46 2c8t s ALA 96 Ca -0.06 -1.79 0.09 0.00 0.00 0.00 0.00 51.96 50.20 2c8t s ALA 96 Cb -0.09 -1.63 -0.04 0.00 0.00 0.00 0.00 23.12 21.36 2c8t s ALA 96 CO -0.00 -1.38 -0.21 0.00 0.00 0.00 0.00 175.76 174.17 2c8t s ALA 97 N 1.23 1.91 0.00 0.00 0.00 -0.93 -1.01 121.76 122.95 2c8t s ALA 97 Ca -0.00 -1.33 0.00 0.00 0.00 0.00 0.00 51.96 50.63 2c8t s ALA 97 Cb -0.19 -0.24 0.00 0.00 0.00 0.00 0.00 23.12 22.69 2c8t s ALA 97 CO -0.09 0.34 0.00 0.43 0.00 0.00 0.00 175.76 176.45 2c8t n SER 98 N 0.86 0.00 0.30 0.00 7.64 -0.84 -0.21 113.62 121.36 2c8t n SER 98 Ca -0.18 0.00 0.19 0.00 1.01 0.00 0.00 58.87 59.89 2c8t n SER 98 Cb 0.54 0.00 1.00 0.00 -1.01 0.00 0.00 64.21 64.75 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 -0.58 1.43 0.00 -1.85 0.20 114.93 114.13 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 1.09 0.85 8.32 0.00 -0.87 -0.42 103.07 112.04 2c8t h GLY 100 Ca 0.02 -0.79 -0.01 0.00 0.00 0.00 0.00 47.33 46.54 2c8t h GLY 100 CO -0.00 0.73 0.05 -2.09 0.00 0.00 0.00 176.54 175.23 2c8t h GLU 101 N 0.90 0.27 -0.36 4.80 4.22 -0.56 -1.70 114.58 122.16 2c8t h GLU 101 Ca 0.17 -0.06 0.07 0.00 0.08 0.00 0.00 59.36 59.61 2c8t h GLU 101 Cb 0.53 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.68 2c8t h GLU 101 CO 0.03 0.40 -0.02 0.35 -2.18 0.00 0.00 179.01 177.59 2c8t h PHE 102 N 0.10 -0.05 -0.47 0.92 3.57 -1.11 0.14 116.94 120.05 2c8t h PHE 102 Ca 0.06 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.47 2c8t h PHE 102 Cb 0.24 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 2c8t h PHE 102 CO 0.00 -0.08 -0.17 -0.07 -2.23 0.00 0.00 178.31 175.76 2c8t h LEU 103 N 0.08 0.92 -0.16 0.59 3.38 -1.07 0.08 115.31 119.13 2c8t h LEU 103 Ca 0.17 -0.32 0.05 0.00 0.09 0.00 0.00 57.88 57.87 2c8t h LEU 103 Cb 0.25 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 2c8t h LEU 103 CO -0.31 1.08 -0.19 0.25 0.09 0.00 0.00 178.44 179.36 2c8t h LEU 104 N 0.80 -0.59 -1.87 1.67 5.85 -0.32 -1.89 115.31 118.95 2c8t h LEU 104 Ca 0.12 0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 2c8t h LEU 104 Cb 0.72 0.28 -0.00 0.00 0.37 0.00 0.00 40.66 42.02 2c8t h LEU 104 CO 0.06 -0.24 -0.13 0.00 -0.34 0.00 0.00 178.44 177.79 2c8t h ALA 105 N 0.82 1.45 0.00 1.25 0.00 -0.25 -2.77 119.26 119.75 2c8t h ALA 105 Ca 0.11 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2c8t h ALA 105 Cb 0.38 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2c8t h ALA 105 CO -0.29 0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.12 2c8t n ALA 106 N -2.36 2.58 -1.04 0.00 0.00 -0.03 -4.87 120.51 114.78 2c8t n ALA 106 Ca -0.02 -0.17 -0.31 0.00 0.00 0.00 0.00 53.44 52.93 2c8t n ALA 106 Cb 0.23 -1.49 0.12 0.00 0.00 0.00 0.00 19.45 18.31 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 -2.19 1.68 0.08 0.00 0.00 -1.05 -4.88 107.32 100.95 2c8t s GLY 107 Ca 0.40 0.39 -0.35 0.00 0.00 0.00 0.00 44.72 45.15 2c8t s GLY 107 CO 0.39 0.76 1.55 2.41 0.00 0.00 0.00 173.10 178.21 2c8t n THR 108 N -3.81 0.09 -1.71 0.90 -1.04 -0.50 -4.84 114.28 103.37 2c8t n THR 108 Ca 0.10 -0.02 -0.43 0.00 -2.04 0.00 0.00 64.05 61.66 2c8t n THR 108 Cb 0.53 -1.32 -0.03 0.00 -1.82 0.00 0.00 70.33 67.69 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 3.64 2.49 0.00 -2.82 5.02 -1.26 -0.98 118.16 124.25 2c8t n LYS 109 Ca 0.19 0.89 0.00 0.00 -2.02 0.00 0.00 58.31 57.37 2c8t n LYS 109 Cb 0.25 -2.66 0.00 0.00 -0.02 0.00 0.00 35.03 32.59 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 2.78 3.07 1.10 0.72 0.00 -1.26 -4.89 105.19 106.71 2c8t n GLY 110 Ca 0.12 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.10 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 -0.74 2.11 -3.69 1.61 5.02 -0.15 -4.86 118.16 117.45 2c8t n LYS 111 Ca 0.00 -3.46 -0.38 0.00 -2.02 0.00 0.00 58.31 52.46 2c8t n LYS 111 Cb 0.00 -1.83 -0.12 0.00 -0.02 0.00 0.00 35.03 33.06 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 -3.34 3.56 0.09 1.97 0.52 -1.24 -1.08 118.95 119.42 2c8t s ARG 112 Ca 0.43 -0.56 0.09 0.00 -0.52 0.00 0.00 55.73 55.18 2c8t s ARG 112 Cb 0.39 -3.48 -0.04 0.00 0.52 0.00 0.00 34.95 32.35 2c8t s ARG 112 CO -0.03 -0.29 -0.22 0.71 0.02 0.00 0.00 175.30 175.50 2c8t s TYR 113 N 1.63 2.44 -0.07 -0.53 1.51 0.15 0.47 117.35 122.96 2c8t s TYR 113 Ca 0.06 -0.32 0.05 0.00 -1.01 0.00 0.00 57.07 55.85 2c8t s TYR 113 Cb -0.16 -1.36 -0.01 0.00 -0.11 0.00 0.00 41.96 40.32 2c8t s TYR 113 CO 0.06 0.29 -0.24 0.00 -1.11 0.00 0.00 175.55 174.55 2c8t s ALA 114 N -1.00 2.15 0.48 3.71 0.00 -0.34 -0.28 121.76 126.47 2c8t s ALA 114 Ca 0.15 -1.01 -0.20 0.00 0.00 0.00 0.00 51.96 50.90 2c8t s ALA 114 Cb -0.10 -0.71 -0.09 0.00 0.00 0.00 0.00 23.12 22.22 2c8t s ALA 114 CO 0.06 0.37 1.00 -0.51 0.00 0.00 0.00 175.76 176.69 2c8t s LEU 115 N 0.00 3.81 0.38 0.00 1.43 -0.49 -1.79 118.68 122.02 2c8t s LEU 115 Ca -0.09 1.79 0.12 0.00 -1.03 0.00 0.00 54.13 54.92 2c8t s LEU 115 Cb -0.15 -4.54 0.91 0.00 0.03 0.00 0.00 46.19 42.44 2c8t s LEU 115 CO 0.05 -0.66 1.86 -0.65 0.23 0.00 0.00 176.35 177.19 2c8t h PRO 116 N 1.47 0.57 -0.46 1.29 0.11 -1.91 0.31 132.00 133.38 2c8t h PRO 116 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2c8t h PRO 116 Cb 1.20 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2c8t h PRO 116 CO 0.60 0.38 0.00 0.72 -0.21 0.00 0.00 178.00 179.49 2c8t n HIS 117 N -4.56 0.61 -1.74 0.65 8.25 -1.26 -4.34 115.22 112.83 2c8t n HIS 117 Ca 0.18 -0.33 -0.38 0.00 -0.26 0.00 0.00 57.72 56.94 2c8t n HIS 117 Cb 0.55 -0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.72 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 1.42 1.36 -2.84 -1.41 0.00 0.11 -4.77 120.51 114.38 2c8t n ALA 118 Ca 0.20 0.05 -0.13 0.00 0.00 0.00 0.00 53.44 53.56 2c8t n ALA 118 Cb 0.58 -2.34 -0.14 0.00 0.00 0.00 0.00 19.45 17.55 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 -3.18 0.23 -0.17 0.00 1.70 0.45 -3.06 118.95 114.91 2c8t s ARG 119 Ca 0.78 -0.20 -0.05 0.00 -0.47 0.00 0.00 55.73 55.79 2c8t s ARG 119 Cb -0.39 -0.16 -0.03 0.00 -0.57 0.00 0.00 34.95 33.80 2c8t s ARG 119 CO 0.44 0.04 0.01 0.42 -1.08 0.00 0.00 175.30 175.13 2c8t s ILE 120 N -0.33 4.32 -0.16 4.99 1.09 -0.76 -1.98 121.20 128.37 2c8t s ILE 120 Ca -0.02 -0.20 0.01 0.00 -1.10 0.00 0.00 60.65 59.33 2c8t s ILE 120 Cb -0.03 -2.92 0.00 0.00 -1.06 0.00 0.00 42.46 38.46 2c8t s ILE 120 CO -0.00 0.48 -0.17 -0.76 -0.10 0.00 0.00 174.94 174.39 2c8t s LEU 121 N 0.33 2.37 0.26 2.97 2.01 -0.18 0.36 118.68 126.80 2c8t s LEU 121 Ca -0.01 -0.53 -0.10 0.00 0.01 0.00 0.00 54.13 53.50 2c8t s LEU 121 Cb -0.13 -1.54 -0.07 0.00 0.01 0.00 0.00 46.19 44.46 2c8t s LEU 121 CO 0.02 0.06 0.60 -0.04 1.01 0.00 0.00 176.35 178.00 2c8t s MET 122 N 0.97 3.83 -0.28 1.70 -1.94 -0.36 -2.00 119.30 121.23 2c8t s MET 122 Ca -0.03 0.35 -0.11 0.00 -1.71 0.00 0.00 55.69 54.19 2c8t s MET 122 Cb -0.15 -2.58 0.11 0.00 2.01 0.00 0.00 34.83 34.22 2c8t s MET 122 CO -0.03 0.25 0.62 -1.58 -0.01 0.00 0.00 175.02 174.27 2c8t s HIS 123 N -1.91 -1.17 -0.39 -0.03 5.04 -1.26 -3.95 115.29 111.62 2c8t s HIS 123 Ca 0.49 2.14 -0.33 0.00 -1.54 0.00 0.00 55.06 55.82 2c8t s HIS 123 Cb -0.11 0.68 -0.11 0.00 0.04 0.00 0.00 32.58 33.08 2c8t s HIS 123 CO 0.22 -0.59 2.26 0.94 -2.34 0.00 0.00 174.74 175.22 2c8t n GLN 124 N 5.07 1.13 -3.03 2.88 -0.06 -0.78 -4.77 117.38 117.82 2c8t n GLN 124 Ca -0.14 0.27 -0.32 0.00 -2.00 0.00 0.00 57.00 54.80 2c8t n GLN 124 Cb 0.52 -2.64 -0.06 0.00 -4.06 0.00 0.00 30.24 24.00 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 6.70 4.00 0.00 3.69 0.04 -1.26 -5.04 135.00 143.12 2c8t s PRO 125 Ca 1.09 0.72 0.00 0.00 0.04 0.00 0.00 61.00 62.85 2c8t s PRO 125 Cb -0.72 -2.38 0.00 0.00 0.04 0.00 0.00 34.50 31.45 2c8t s PRO 125 CO 0.44 0.09 0.00 1.28 0.04 0.00 0.00 177.00 178.85 2c8t n LEU 126 N -0.58 0.00 -0.06 -3.56 4.77 -1.26 -5.10 117.00 111.21 2c8t n LEU 126 Ca 0.04 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.96 2c8t n LEU 126 Cb 0.53 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 -0.47 -0.38 -1.33 0.00 0.00 177.39 175.62 2c8t n ILE 136 N 0.00 1.06 -0.34 -0.08 5.41 -1.26 -5.18 119.36 118.97 2c8t n ILE 136 Ca 0.00 0.25 0.05 0.00 1.00 0.00 0.00 62.75 64.05 2c8t n ILE 136 Cb 0.00 -2.09 0.21 0.00 -0.71 0.00 0.00 39.64 37.05 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 -1.27 1.39 -0.29 -1.39 0.00 -2.06 -1.20 119.26 114.44 2c8t h ALA 137 Ca 0.00 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2c8t h ALA 137 Cb 0.69 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2c8t h ALA 137 CO 0.00 0.22 0.12 0.82 0.00 0.00 0.00 179.25 180.41 2c8t h ILE 138 N 0.96 1.17 -0.14 0.00 5.03 -2.06 -2.74 117.51 119.73 2c8t h ILE 138 Ca 0.46 -0.52 -0.02 0.00 -0.12 0.00 0.00 64.86 64.65 2c8t h ILE 138 Cb 0.40 0.98 -0.01 0.00 -3.03 0.00 0.00 36.82 35.15 2c8t h ILE 138 CO -0.24 0.18 -0.02 1.56 -0.68 0.00 0.00 178.15 178.94 2c8t h GLN 139 N 0.32 0.21 0.46 2.37 4.20 -1.73 -2.70 115.11 118.24 2c8t h GLN 139 Ca 0.10 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 2c8t h GLN 139 Cb 0.17 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.92 2c8t h GLN 139 CO -0.01 0.25 -0.22 0.00 -0.67 0.00 0.00 178.83 178.18 2c8t h ALA 140 N 1.78 -0.62 -0.63 3.87 0.00 -0.98 -1.36 119.26 121.32 2c8t h ALA 140 Ca 0.05 -0.15 0.11 0.00 0.00 0.00 0.00 54.91 54.91 2c8t h ALA 140 Cb 0.18 0.24 -0.12 0.00 0.00 0.00 0.00 17.79 18.09 2c8t h ALA 140 CO 0.01 -0.82 -0.36 0.93 0.00 0.00 0.00 179.25 179.01 2c8t h GLU 141 N -0.68 -0.15 -0.71 0.00 5.08 -1.27 0.27 114.58 117.12 2c8t h GLU 141 Ca -0.06 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.32 2c8t h GLU 141 Cb 0.51 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.75 2c8t h GLU 141 CO 0.10 -0.10 0.46 1.96 -1.00 0.00 0.00 179.01 180.44 2c8t h GLN 142 N -0.15 0.91 -0.42 2.33 4.20 -1.37 -1.65 115.11 118.96 2c8t h GLN 142 Ca 0.24 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.81 2c8t h GLN 142 Cb 0.56 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 2c8t h GLN 142 CO -0.71 0.60 -0.07 0.35 -0.67 0.00 0.00 178.83 178.33 2c8t h PHE 143 N 0.94 0.87 -0.34 2.96 3.57 -0.45 -1.52 116.94 122.98 2c8t h PHE 143 Ca 0.26 -0.18 0.03 0.00 3.53 0.00 0.00 57.97 61.62 2c8t h PHE 143 Cb -0.08 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.41 2c8t h PHE 143 CO -0.03 0.89 0.14 0.00 -2.23 0.00 0.00 178.31 177.08 2c8t h ALA 144 N 0.86 0.40 -0.46 2.41 0.00 -0.58 0.19 119.26 122.09 2c8t h ALA 144 Ca 0.11 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.06 2c8t h ALA 144 Cb 0.59 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 2c8t h ALA 144 CO 0.04 -0.24 0.29 0.28 0.00 0.00 0.00 179.25 179.61 2c8t h VAL 145 N 0.30 1.09 0.00 0.00 2.07 -1.18 -1.52 116.25 117.01 2c8t h VAL 145 Ca 0.15 -0.20 -0.15 0.00 0.82 0.00 0.00 66.70 67.31 2c8t h VAL 145 Cb 0.09 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 2c8t h VAL 145 CO -0.13 0.11 -0.72 -0.29 0.02 0.00 0.00 177.57 176.56 2c8t h ILE 146 N 0.59 1.32 -0.18 4.57 2.10 -0.83 -2.22 117.51 122.87 2c8t h ILE 146 Ca 0.18 -2.64 -0.06 0.00 1.08 0.00 0.00 64.86 63.41 2c8t h ILE 146 Cb -0.03 2.51 -0.00 0.00 -1.09 0.00 0.00 36.82 38.20 2c8t h ILE 146 CO -0.06 0.71 -0.13 0.50 -1.08 0.00 0.00 178.15 178.09 2c8t h LYS 147 N 0.00 0.40 -0.99 2.19 3.64 -0.47 -0.94 116.57 120.40 2c8t h LYS 147 Ca -0.01 -0.19 0.02 0.00 -1.27 0.00 0.00 60.65 59.20 2c8t h LYS 147 Cb 1.45 -0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 33.22 2c8t h LYS 147 CO 0.09 0.73 0.66 -0.22 -2.27 0.00 0.00 179.45 178.45 2c8t h LYS 148 N 0.07 1.29 -0.21 1.90 3.64 -1.28 -1.89 116.57 120.10 2c8t h LYS 148 Ca 0.04 -0.08 -0.10 0.00 -1.27 0.00 0.00 60.65 59.24 2c8t h LYS 148 Cb 0.63 -0.29 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 2c8t h LYS 148 CO 0.03 0.85 -0.29 1.49 -2.27 0.00 0.00 179.45 179.27 2c8t h GLU 149 N 1.33 0.40 -0.06 1.90 4.57 -1.25 -1.98 114.58 119.50 2c8t h GLU 149 Ca 0.37 -0.16 -0.02 0.00 -1.18 0.00 0.00 59.36 58.37 2c8t h GLU 149 Cb -0.12 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 28.45 2c8t h GLU 149 CO -0.09 0.66 -0.03 1.98 -1.18 0.00 0.00 179.01 180.34 2c8t h MET 150 N 0.36 0.13 -0.79 1.92 4.05 -0.69 -2.35 114.93 117.56 2c8t h MET 150 Ca 0.05 -0.06 0.15 0.00 -0.28 0.00 0.00 59.70 59.56 2c8t h MET 150 Cb 0.69 -0.00 -0.10 0.00 -0.80 0.00 0.00 31.60 31.39 2c8t h MET 150 CO 0.05 0.52 0.34 0.74 0.23 0.00 0.00 176.91 178.80 2c8t h PHE 151 N -0.26 0.59 0.07 1.39 0.05 -1.25 0.95 116.94 118.48 2c8t h PHE 151 Ca 0.01 0.04 0.01 0.00 3.82 0.00 0.00 57.97 61.85 2c8t h PHE 151 Cb 0.49 -0.14 -0.02 0.00 2.00 0.00 0.00 35.95 38.27 2c8t h PHE 151 CO 0.07 0.08 -0.14 -0.09 -0.18 0.00 0.00 178.31 178.05 2c8t h ARG 152 N 0.49 -0.27 -0.32 1.51 2.43 -1.27 -0.63 114.38 116.32 2c8t h ARG 152 Ca 0.44 0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.53 2c8t h ARG 152 Cb 0.67 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.27 2c8t h ARG 152 CO -0.40 -0.18 -0.23 -0.07 -1.51 0.00 0.00 179.97 177.58 2c8t h LEU 153 N -0.28 0.63 -0.36 3.80 3.38 -0.84 -1.02 115.31 120.63 2c8t h LEU 153 Ca 0.03 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.74 2c8t h LEU 153 Cb 0.30 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2c8t h LEU 153 CO -0.09 0.85 0.08 -1.13 0.09 0.00 0.00 178.44 178.24 2c8t h ASN 154 N 0.55 0.55 -0.34 -0.43 -0.00 -0.54 0.38 115.58 115.76 2c8t h ASN 154 Ca 0.08 -0.24 0.05 0.00 -0.00 0.00 0.00 56.30 56.19 2c8t h ASN 154 Cb 0.69 -0.15 -0.04 0.00 -0.00 0.00 0.00 38.32 38.82 2c8t h ASN 154 CO 0.05 0.65 0.07 0.00 -0.00 0.00 0.00 177.43 178.20 2c8t h ALA 155 N 0.92 0.36 -0.11 1.57 0.00 -0.99 -2.08 119.26 118.94 2c8t h ALA 155 Ca 0.11 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2c8t h ALA 155 Cb 0.32 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2c8t h ALA 155 CO 0.00 -0.34 0.05 1.49 0.00 0.00 0.00 179.25 180.45 2c8t h GLU 156 N 0.19 0.17 -0.60 0.00 4.81 -0.47 0.24 114.58 118.92 2c8t h GLU 156 Ca 0.16 -0.03 0.17 0.00 -0.13 0.00 0.00 59.36 59.53 2c8t h GLU 156 Cb 0.18 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.50 2c8t h GLU 156 CO -0.21 0.27 0.43 0.74 -0.73 0.00 0.00 179.01 179.50 2c8t h PHE 157 N 0.03 0.04 0.00 0.92 0.05 -0.11 -3.20 116.94 114.68 2c8t h PHE 157 Ca 0.04 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.83 2c8t h PHE 157 Cb 0.16 -0.01 0.00 0.00 2.00 0.00 0.00 35.95 38.10 2c8t h PHE 157 CO -0.02 0.02 -1.21 -2.37 -0.18 0.00 0.00 178.31 174.54 2c8t n THR 158 N -4.37 0.00 -0.80 -1.55 5.66 -0.80 -4.83 114.28 107.59 2c8t n THR 158 Ca 0.11 -0.25 0.00 0.00 -3.05 0.00 0.00 64.05 60.86 2c8t n THR 158 Cb 0.65 0.47 0.00 0.00 -1.55 0.00 0.00 70.33 69.89 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 1.70 0.79 3.98 1.09 0.00 0.04 -4.27 105.19 108.52 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 -0.20 3.08 0.43 1.61 -1.52 -1.09 -5.03 119.66 116.94 2c8t s GLN 160 Ca 0.00 -0.89 -0.23 0.00 -1.95 0.00 0.00 55.36 52.29 2c8t s GLN 160 Cb 0.00 -2.75 -0.09 0.00 -0.22 0.00 0.00 33.01 29.95 2c8t s GLN 160 CO 0.00 -0.04 1.05 -2.14 -0.25 0.00 0.00 175.29 173.90 2c8t s PRO 161 N -4.28 4.05 0.28 2.91 0.02 -1.26 -4.60 135.00 132.11 2c8t s PRO 161 Ca 0.46 1.47 0.02 0.00 0.02 0.00 0.00 61.00 62.97 2c8t s PRO 161 Cb -0.10 -2.40 0.62 0.00 0.02 0.00 0.00 34.50 32.64 2c8t s PRO 161 CO 0.33 -0.24 1.78 0.82 -0.33 0.00 0.00 177.00 179.37 2c8t h ILE 162 N 1.99 0.77 -0.90 2.83 2.04 -1.93 -0.76 117.51 121.54 2c8t h ILE 162 Ca -0.49 -0.26 0.13 0.00 1.00 0.00 0.00 64.86 65.24 2c8t h ILE 162 Cb 1.22 -0.07 -0.09 0.00 -0.74 0.00 0.00 36.82 37.14 2c8t h ILE 162 CO 0.61 0.14 0.52 -0.33 0.00 0.00 0.00 178.15 179.09 2c8t h GLU 163 N 0.77 0.77 0.02 2.37 3.07 -1.98 -0.75 114.58 118.85 2c8t h GLU 163 Ca 0.52 -0.05 -0.25 0.00 -0.50 0.00 0.00 59.36 59.08 2c8t h GLU 163 Cb 0.71 -0.17 0.01 0.00 -0.84 0.00 0.00 28.75 28.46 2c8t h GLU 163 CO -0.35 0.51 -1.03 -0.09 -1.40 0.00 0.00 179.01 176.65 2c8t h ARG 164 N 0.80 0.55 -0.56 2.33 2.43 -1.54 -1.53 114.38 116.86 2c8t h ARG 164 Ca 0.46 -0.62 0.06 0.00 -0.81 0.00 0.00 59.98 59.08 2c8t h ARG 164 Cb 0.54 0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 30.21 2c8t h ARG 164 CO -0.30 1.23 0.26 0.82 -1.51 0.00 0.00 179.97 180.48 2c8t h ILE 165 N 0.30 0.90 0.54 1.20 1.08 -0.74 0.74 117.51 121.53 2c8t h ILE 165 Ca -0.11 -0.17 -0.03 0.00 -0.39 0.00 0.00 64.86 64.16 2c8t h ILE 165 Cb 1.68 0.36 0.01 0.00 -3.07 0.00 0.00 36.82 35.79 2c8t h ILE 165 CO 0.19 0.09 -0.26 -0.33 -0.69 0.00 0.00 178.15 177.15 2c8t h GLU 166 N 0.50 -0.70 -0.82 2.37 5.08 -1.13 -2.24 114.58 117.63 2c8t h GLU 166 Ca 0.26 0.05 0.12 0.00 -1.00 0.00 0.00 59.36 58.78 2c8t h GLU 166 Cb 0.22 0.16 -0.08 0.00 0.50 0.00 0.00 28.75 29.54 2c8t h GLU 166 CO -0.21 -0.40 0.44 0.00 -1.00 0.00 0.00 179.01 177.85 2c8t h ALA 167 N -0.61 1.20 -0.19 3.43 0.00 -1.10 -0.81 119.26 121.17 2c8t h ALA 167 Ca -0.07 0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 2c8t h ALA 167 Cb 0.63 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2c8t h ALA 167 CO 0.12 -0.00 -0.37 -0.44 0.00 0.00 0.00 179.25 178.56 2c8t h ASP 168 N 0.69 0.44 -0.42 0.00 3.32 -0.87 -2.61 116.42 116.98 2c8t h ASP 168 Ca 0.42 -0.18 -0.15 0.00 0.02 0.00 0.00 57.03 57.14 2c8t h ASP 168 Cb 0.49 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 2c8t h ASP 168 CO -0.30 0.78 -0.31 0.28 -1.72 0.00 0.00 179.24 177.97 2c8t h SER 169 N 0.36 1.01 -0.76 6.45 0.02 -0.60 -1.62 113.55 118.41 2c8t h SER 169 Ca 0.04 -0.42 -0.01 0.00 -0.84 0.00 0.00 61.79 60.56 2c8t h SER 169 Cb 0.81 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 63.04 2c8t h SER 169 CO 0.07 1.22 0.45 0.44 -1.14 0.00 0.00 176.83 177.87 2c8t h ASP 170 N 0.81 0.91 -0.10 3.07 3.32 -1.09 -1.97 116.42 121.37 2c8t h ASP 170 Ca 0.08 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2c8t h ASP 170 Cb 0.89 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.21 2c8t h ASP 170 CO 0.08 0.71 0.00 -2.11 -1.72 0.00 0.00 179.24 176.21 2c8t n ARG 171 N -4.49 1.33 -2.88 3.56 1.85 -0.99 -4.88 116.66 110.14 2c8t n ARG 171 Ca 0.07 -0.50 -0.20 0.00 -1.00 0.00 0.00 57.85 56.22 2c8t n ARG 171 Cb 0.06 -1.25 0.01 0.00 -1.05 0.00 0.00 32.46 30.23 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 -0.21 -4.92 -4.65 2.89 8.00 -0.96 -4.88 116.55 111.82 2c8t n ASP 172 Ca 0.11 -0.16 -0.47 0.00 0.71 0.00 0.00 54.79 54.98 2c8t n ASP 172 Cb 0.16 -4.05 -0.04 0.00 -0.02 0.00 0.00 41.12 37.16 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 -3.51 1.82 -4.22 -1.24 0.63 -0.65 -4.66 116.66 104.83 2c8t n ARG 173 Ca -0.11 0.65 -0.24 0.00 -0.92 0.00 0.00 57.85 57.23 2c8t n ARG 173 Cb 0.61 -2.33 -0.08 0.00 0.45 0.00 0.00 32.46 31.11 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 0.39 2.62 0.01 -0.14 1.48 -1.26 -1.22 118.94 120.82 2c8t s TRP 174 Ca 0.76 -0.44 0.00 0.00 -1.06 0.00 0.00 56.10 55.35 2c8t s TRP 174 Cb -0.74 -1.63 -0.01 0.00 -1.16 0.00 0.00 33.47 29.93 2c8t s TRP 174 CO 0.45 0.38 -0.02 -0.06 -4.06 0.00 0.00 176.95 173.64 2c8t s PHE 175 N -2.50 0.15 0.60 1.66 0.40 0.16 -4.98 117.98 113.47 2c8t s PHE 175 Ca 0.37 -0.25 -0.10 0.00 -0.60 0.00 0.00 56.93 56.35 2c8t s PHE 175 Cb -0.00 -0.11 -0.03 0.00 0.51 0.00 0.00 43.02 43.39 2c8t s PHE 175 CO 0.21 -0.08 0.98 0.99 0.70 0.00 0.00 175.22 178.02 2c8t s THR 176 N -0.68 4.61 0.25 0.64 2.01 -1.26 -1.83 115.64 119.38 2c8t s THR 176 Ca -0.07 0.68 -0.03 0.00 0.31 0.00 0.00 61.69 62.58 2c8t s THR 176 Cb -0.05 -3.82 0.22 0.00 0.01 0.00 0.00 72.50 68.86 2c8t s THR 176 CO -0.00 -1.02 1.76 0.00 -0.69 0.00 0.00 174.62 174.66 2c8t h ALA 177 N -0.24 1.17 0.10 7.40 0.00 -1.73 0.58 119.26 126.55 2c8t h ALA 177 Ca -0.45 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 2c8t h ALA 177 Cb 1.20 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2c8t h ALA 177 CO 0.62 -0.10 -0.05 0.00 0.00 0.00 0.00 179.25 179.72 2c8t h ALA 178 N 1.53 -0.13 -0.61 0.00 0.00 -1.91 -1.89 119.26 116.24 2c8t h ALA 178 Ca 0.43 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.27 2c8t h ALA 178 Cb 0.58 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 2c8t h ALA 178 CO -0.35 -0.56 0.26 0.93 0.00 0.00 0.00 179.25 179.53 2c8t h GLU 179 N -0.16 0.87 -0.45 0.00 5.08 -1.71 -2.39 114.58 115.82 2c8t h GLU 179 Ca -0.01 -0.13 -0.07 0.00 -1.00 0.00 0.00 59.36 58.15 2c8t h GLU 179 Cb 0.13 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2c8t h GLU 179 CO 0.02 0.70 -0.02 0.00 -1.00 0.00 0.00 179.01 178.71 2c8t h ALA 180 N 1.42 1.12 -0.44 3.43 0.00 0.29 -1.83 119.26 123.25 2c8t h ALA 180 Ca 0.21 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 2c8t h ALA 180 Cb 0.14 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2c8t h ALA 180 CO -0.02 0.56 -0.09 1.25 0.00 0.00 0.00 179.25 180.95 2c8t h LEU 181 N 0.70 0.77 -0.33 0.00 5.85 -0.88 -2.06 115.31 119.36 2c8t h LEU 181 Ca 0.13 -0.22 -0.09 0.00 0.84 0.00 0.00 57.88 58.55 2c8t h LEU 181 Cb 0.46 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2c8t h LEU 181 CO 0.02 0.89 -0.13 -0.33 -0.34 0.00 0.00 178.44 178.55 2c8t h GLU 182 N 0.72 0.67 0.00 1.25 5.08 -1.20 -3.17 114.58 117.92 2c8t h GLU 182 Ca 0.12 -0.28 -0.07 0.00 -1.00 0.00 0.00 59.36 58.13 2c8t h GLU 182 Cb 0.56 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 2c8t h GLU 182 CO 0.03 0.87 -0.32 -0.92 -1.00 0.00 0.00 179.01 177.67 2c8t h TYR 183 N 0.44 0.00 0.00 4.33 3.20 -1.27 -3.47 116.97 120.20 2c8t h TYR 183 Ca 0.08 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.95 2c8t h TYR 183 Cb 0.66 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.93 2c8t h TYR 183 CO 0.06 0.32 0.00 0.41 -1.64 0.00 0.00 178.16 177.31 2c8t n GLY 184 N 0.03 1.32 0.14 1.82 0.00 -0.88 -4.70 105.19 102.92 2c8t n GLY 184 Ca -0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.14 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 -2.26 1.61 -1.00 -1.66 -3.38 116.94 110.25 2c8t h PHE 185 Ca 0.00 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.71 2c8t h PHE 185 Cb 0.00 0.00 -0.20 0.00 3.61 0.00 0.00 35.95 39.36 2c8t h PHE 185 CO 0.00 0.00 0.04 0.08 -1.61 0.00 0.00 178.31 176.82 2c8t s VAL 186 N -3.23 0.01 -0.09 -0.55 1.01 -1.25 -3.93 120.40 112.36 2c8t s VAL 186 Ca 0.07 -0.08 0.12 0.00 0.00 0.00 0.00 61.98 62.09 2c8t s VAL 186 Cb 0.10 -0.88 -0.24 0.00 0.00 0.00 0.00 36.38 35.36 2c8t s VAL 186 CO 0.53 -0.04 0.49 0.47 0.00 0.00 0.00 175.10 176.55 2c8t n ASP 187 N 1.69 0.84 -3.95 3.32 8.00 0.18 -4.54 116.55 122.08 2c8t n ASP 187 Ca -0.17 0.30 -0.09 0.00 0.71 0.00 0.00 54.79 55.53 2c8t n ASP 187 Cb 0.56 0.07 -0.10 0.00 -0.02 0.00 0.00 41.12 41.63 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 -2.57 0.22 -0.26 1.24 3.76 -0.59 -5.00 115.29 112.09 2c8t s HIS 188 Ca -0.08 -0.48 -0.08 0.00 -0.15 0.00 0.00 55.06 54.27 2c8t s HIS 188 Cb 0.07 -0.17 -0.04 0.00 1.11 0.00 0.00 32.58 33.56 2c8t s HIS 188 CO 0.82 -0.26 0.11 0.42 -0.85 0.00 0.00 174.74 174.98 2c8t s ILE 189 N -1.82 4.65 -0.01 0.60 1.01 -1.26 -1.20 121.20 123.17 2c8t s ILE 189 Ca -0.12 -0.06 -0.14 0.00 0.00 0.00 0.00 60.65 60.34 2c8t s ILE 189 Cb -0.07 -3.19 -0.06 0.00 0.01 0.00 0.00 42.46 39.16 2c8t s ILE 189 CO -0.02 0.32 0.38 0.27 0.00 0.00 0.00 174.94 175.90 2c8t s ILE 190 N 1.59 5.07 0.00 2.92 -4.36 -0.74 -4.95 121.20 120.73 2c8t s ILE 190 Ca 0.06 0.77 0.00 0.00 -0.26 0.00 0.00 60.65 61.22 2c8t s ILE 190 Cb -0.15 -3.68 0.00 0.00 1.25 0.00 0.00 42.46 39.88 2c8t s ILE 190 CO 0.06 0.57 0.00 0.41 0.24 0.00 0.00 174.94 176.22 2c8t n THR 191 N 1.80 0.00 -2.78 8.37 -1.04 -1.26 -3.99 114.28 115.38 2c8t n THR 191 Ca -0.14 0.00 -0.32 0.00 -2.04 0.00 0.00 64.05 61.55 2c8t n THR 191 Cb 0.53 -0.91 -0.05 0.00 -1.82 0.00 0.00 70.33 68.08 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 3.95 0.76 -2.82 0.52 -1.26 -5.03 118.95 115.07 2c8t s ARG 192 Ca 0.00 0.76 -0.02 0.00 -0.52 0.00 0.00 55.73 55.95 2c8t s ARG 192 Cb 0.00 -2.29 0.15 0.00 0.52 0.00 0.00 34.95 33.32 2c8t s ARG 192 CO 0.00 -0.06 1.04 0.00 0.02 0.00 0.00 175.30 176.31 2c8t s ALA 193 N -2.33 3.57 0.00 2.13 0.00 -1.26 -5.21 121.76 118.67 2c8t s ALA 193 Ca 0.56 -1.75 0.00 0.00 0.00 0.00 0.00 51.96 50.77 2c8t s ALA 193 Cb -0.10 -2.05 0.00 0.00 0.00 0.00 0.00 23.12 20.97 2c8t s ALA 193 CO 0.25 -1.62 0.00 0.72 0.00 0.00 0.00 175.76 175.11