#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 -0.60 -0.34 2.46 5.85 -2.05 0.21 115.31 120.84 2c8t h LEU 16 Ca 0.00 0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.89 2c8t h LEU 16 Cb 0.00 0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.23 2c8t h LEU 16 CO 0.00 -0.25 -0.13 0.74 -0.34 0.00 0.00 178.44 178.46 2c8t h THR 17 N -0.26 0.56 -0.44 1.05 2.02 -2.06 -0.63 112.91 113.15 2c8t h THR 17 Ca 0.09 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.24 2c8t h THR 17 Cb 0.39 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 2c8t h THR 17 CO -0.26 0.00 0.16 0.44 0.37 0.00 0.00 175.52 176.24 2c8t h ASP 18 N -0.07 0.62 -0.82 4.18 3.32 -1.90 -2.25 116.42 119.50 2c8t h ASP 18 Ca 0.17 -0.18 0.12 0.00 0.02 0.00 0.00 57.03 57.16 2c8t h ASP 18 Cb 0.33 -0.16 -0.08 0.00 0.22 0.00 0.00 39.33 39.63 2c8t h ASP 18 CO -0.39 0.63 0.43 -1.28 -1.72 0.00 0.00 179.24 176.92 2c8t h SER 19 N 0.57 0.55 -0.01 6.45 0.87 0.15 0.32 113.55 122.46 2c8t h SER 19 Ca 0.15 0.08 -0.00 0.00 -1.23 0.00 0.00 61.79 60.78 2c8t h SER 19 Cb 0.22 -0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 62.16 2c8t h SER 19 CO -0.01 0.27 0.00 0.58 -0.53 0.00 0.00 176.83 177.14 2c8t h VAL 20 N 0.66 1.21 -0.73 2.23 2.07 -0.84 -1.75 116.25 119.10 2c8t h VAL 20 Ca 0.43 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 2c8t h VAL 20 Cb 0.53 1.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.88 2c8t h VAL 20 CO -0.32 0.16 0.37 1.88 0.02 0.00 0.00 177.57 179.68 2c8t h TYR 21 N -0.25 1.02 0.22 1.57 -1.99 -0.88 -0.96 116.97 115.70 2c8t h TYR 21 Ca 0.00 -0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.69 2c8t h TYR 21 Cb 0.26 -0.32 -0.00 0.00 2.00 0.00 0.00 36.73 38.67 2c8t h TYR 21 CO 0.01 0.73 -0.11 0.93 -0.00 0.00 0.00 178.16 179.72 2c8t h GLU 22 N 1.03 -0.30 -0.92 4.88 5.08 -0.89 0.85 114.58 124.31 2c8t h GLU 22 Ca 0.26 0.02 0.07 0.00 -1.00 0.00 0.00 59.36 58.70 2c8t h GLU 22 Cb 0.08 0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.33 2c8t h GLU 22 CO -0.04 -0.20 0.58 0.00 -1.00 0.00 0.00 179.01 178.35 2c8t h ARG 23 N -0.31 1.02 0.00 2.33 3.08 -1.02 -1.55 114.38 117.93 2c8t h ARG 23 Ca -0.03 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 59.88 2c8t h ARG 23 Cb 0.25 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 2c8t h ARG 23 CO 0.04 0.67 -0.41 1.25 -1.07 0.00 0.00 179.97 180.45 2c8t h LEU 24 N 1.05 0.00 -0.95 3.04 5.85 -0.93 -1.97 115.31 121.40 2c8t h LEU 24 Ca 0.40 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 59.02 2c8t h LEU 24 Cb 0.19 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 2c8t h LEU 24 CO -0.18 0.41 -0.42 0.25 -0.34 0.00 0.00 178.44 178.17 2c8t h LEU 25 N 0.00 0.24 -0.11 2.25 5.85 0.16 -0.72 115.31 122.97 2c8t h LEU 25 Ca -0.00 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.62 2c8t h LEU 25 Cb 0.77 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.73 2c8t h LEU 25 CO 0.05 0.63 0.00 -1.20 -0.34 0.00 0.00 178.44 177.58 2c8t n SER 26 N -4.02 0.09 -1.57 1.25 7.64 -0.75 -2.03 113.62 114.23 2c8t n SER 26 Ca -0.02 0.52 0.08 0.00 1.01 0.00 0.00 58.87 60.47 2c8t n SER 26 Cb 0.48 -0.54 0.36 0.00 -1.01 0.00 0.00 64.21 63.49 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 -1.60 4.01 -3.73 1.43 -0.58 -0.65 -4.93 120.64 114.58 2c8t n GLU 27 Ca 0.03 -2.95 -0.29 0.00 -0.42 0.00 0.00 57.16 53.53 2c8t n GLU 27 Cb 0.16 -1.99 0.00 0.00 -0.57 0.00 0.00 31.44 29.04 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 0.75 -4.07 -4.95 3.49 5.12 -0.86 -4.89 116.66 111.26 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 -5.29 -0.14 0.00 -1.16 0.00 0.00 32.46 26.85 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 -3.14 2.81 0.02 0.55 1.01 -0.37 -0.89 121.20 121.18 2c8t s ILE 29 Ca 0.57 -0.79 0.00 0.00 0.00 0.00 0.00 60.65 60.43 2c8t s ILE 29 Cb -0.30 -2.11 -0.02 0.00 0.01 0.00 0.00 42.46 40.05 2c8t s ILE 29 CO 0.70 0.56 -0.03 -0.63 0.00 0.00 0.00 174.94 175.54 2c8t s ILE 30 N -0.25 0.15 -0.05 2.92 1.01 0.70 -3.51 121.20 122.16 2c8t s ILE 30 Ca 0.01 -0.86 0.05 0.00 0.00 0.00 0.00 60.65 59.84 2c8t s ILE 30 Cb -0.13 -0.28 -0.00 0.00 0.01 0.00 0.00 42.46 42.05 2c8t s ILE 30 CO 0.03 -0.45 -0.20 -0.36 0.00 0.00 0.00 174.94 173.96 2c8t s PHE 31 N -1.34 1.99 -0.45 3.97 0.40 -1.26 0.27 117.98 121.55 2c8t s PHE 31 Ca -0.14 -0.61 -0.05 0.00 -0.60 0.00 0.00 56.93 55.53 2c8t s PHE 31 Cb -0.09 -1.33 0.12 0.00 0.51 0.00 0.00 43.02 42.23 2c8t s PHE 31 CO -0.01 -0.21 0.27 -1.17 0.70 0.00 0.00 175.22 174.81 2c8t s LEU 32 N 0.04 5.40 -0.06 -0.37 2.96 0.73 -4.93 118.68 122.45 2c8t s LEU 32 Ca -0.06 -2.08 0.09 0.00 -0.22 0.00 0.00 54.13 51.87 2c8t s LEU 32 Cb -0.13 -1.89 0.16 0.00 0.50 0.00 0.00 46.19 44.83 2c8t s LEU 32 CO 0.03 -0.57 1.09 0.61 -1.32 0.00 0.00 176.35 176.19 2c8t n GLY 33 N 4.58 3.83 0.00 7.98 0.00 -1.26 -0.72 105.19 119.60 2c8t n GLY 33 Ca -0.03 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.46 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 -4.67 1.61 3.41 -1.24 -4.77 113.62 107.11 2c8t n SER 34 Ca 0.08 -0.96 -0.62 0.00 -0.26 0.00 0.00 58.87 57.11 2c8t n SER 34 Cb 0.45 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.31 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 0.36 -2.23 4.33 4.07 -1.26 -4.33 120.64 121.58 2c8t n GLU 35 Ca 0.00 0.13 -0.32 0.00 -0.06 0.00 0.00 57.16 56.91 2c8t n GLU 35 Cb 0.00 -1.68 -0.04 0.00 -0.06 0.00 0.00 31.44 29.65 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 2.24 3.62 0.45 6.31 1.01 0.34 -4.85 120.40 129.52 2c8t s VAL 36 Ca 0.99 -0.59 0.07 0.00 0.00 0.00 0.00 61.98 62.45 2c8t s VAL 36 Cb -1.31 -4.41 -0.02 0.00 0.00 0.00 0.00 36.38 30.64 2c8t s VAL 36 CO 0.70 -1.29 0.26 0.54 0.00 0.00 0.00 175.10 175.30 2c8t s ASN 37 N 6.85 4.57 0.19 3.32 4.22 -1.26 -1.02 114.94 131.81 2c8t s ASN 37 Ca 0.62 -1.09 -0.13 0.00 -2.14 0.00 0.00 52.86 50.12 2c8t s ASN 37 Cb -0.04 -0.22 0.19 0.00 1.28 0.00 0.00 41.25 42.46 2c8t s ASN 37 CO -0.02 -0.72 1.73 0.44 -2.04 0.00 0.00 177.10 176.49 2c8t h ASP 38 N 1.19 0.05 0.03 3.54 3.32 -1.95 0.27 116.42 122.88 2c8t h ASP 38 Ca -0.41 0.08 0.03 0.00 0.02 0.00 0.00 57.03 56.75 2c8t h ASP 38 Cb 1.27 0.10 -0.04 0.00 0.22 0.00 0.00 39.33 40.88 2c8t h ASP 38 CO 0.65 0.06 -0.26 -0.08 -1.72 0.00 0.00 179.24 177.89 2c8t h GLU 39 N 0.27 -0.40 -0.48 3.56 4.57 -1.97 0.13 114.58 120.25 2c8t h GLU 39 Ca 0.25 0.03 -0.07 0.00 -1.18 0.00 0.00 59.36 58.38 2c8t h GLU 39 Cb 0.31 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.97 2c8t h GLU 39 CO -0.30 -0.27 -0.01 0.82 -1.18 0.00 0.00 179.01 178.07 2c8t h ILE 40 N -0.42 1.24 0.08 2.32 2.04 -1.81 -1.68 117.51 119.28 2c8t h ILE 40 Ca 0.05 -1.02 -0.00 0.00 1.00 0.00 0.00 64.86 64.90 2c8t h ILE 40 Cb 0.49 0.89 -0.00 0.00 -0.74 0.00 0.00 36.82 37.45 2c8t h ILE 40 CO -0.21 0.36 -0.05 0.00 0.00 0.00 0.00 178.15 178.25 2c8t h ALA 41 N 1.25 -0.12 -0.40 1.87 0.00 -0.38 0.55 119.26 122.02 2c8t h ALA 41 Ca 0.14 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.11 2c8t h ALA 41 Cb 0.46 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.25 2c8t h ALA 41 CO 0.02 -0.57 -0.01 -0.91 0.00 0.00 0.00 179.25 177.78 2c8t h ASN 42 N -0.13 -0.19 -0.89 0.00 2.35 -0.62 -0.62 115.58 115.48 2c8t h ASN 42 Ca -0.01 0.10 -0.00 0.00 -0.55 0.00 0.00 56.30 55.84 2c8t h ASN 42 Cb 0.11 0.17 -0.04 0.00 0.05 0.00 0.00 38.32 38.61 2c8t h ASN 42 CO 0.00 -0.06 0.54 -0.09 -1.65 0.00 0.00 177.43 176.18 2c8t h ARG 43 N 0.09 1.21 -0.29 0.81 2.43 -0.76 0.33 114.38 118.20 2c8t h ARG 43 Ca 0.20 -0.11 -0.05 0.00 -0.81 0.00 0.00 59.98 59.21 2c8t h ARG 43 Cb 0.28 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 2c8t h ARG 43 CO -0.34 0.85 -0.02 -0.07 -1.51 0.00 0.00 179.97 178.88 2c8t h LEU 44 N 1.23 0.53 -0.34 3.80 3.38 -0.49 -0.95 115.31 122.46 2c8t h LEU 44 Ca 0.32 -0.33 0.05 0.00 0.09 0.00 0.00 57.88 58.01 2c8t h LEU 44 Cb -0.05 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 2c8t h LEU 44 CO -0.06 0.73 0.07 0.00 0.09 0.00 0.00 178.44 179.27 2c8t h ALA 46 N 1.25 0.18 -0.22 0.00 0.00 -0.81 0.10 119.26 119.76 2c8t h ALA 46 Ca 0.16 0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.24 2c8t h ALA 46 Cb 0.18 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2c8t h ALA 46 CO -0.21 -0.51 0.07 1.96 0.00 0.00 0.00 179.25 180.57 2c8t h GLN 47 N -0.07 0.17 -0.36 0.00 4.20 -0.11 -0.51 115.11 118.44 2c8t h GLN 47 Ca 0.19 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.90 2c8t h GLN 47 Cb 0.36 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 2c8t h GLN 47 CO -0.44 0.11 0.21 0.82 -0.67 0.00 0.00 178.83 178.87 2c8t h ILE 48 N 0.18 1.04 -0.57 2.54 2.04 0.11 -1.18 117.51 121.67 2c8t h ILE 48 Ca 0.10 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.82 2c8t h ILE 48 Cb 0.06 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 36.69 2c8t h ILE 48 CO -0.10 0.08 0.36 -0.07 0.00 0.00 0.00 178.15 178.42 2c8t h LEU 49 N 0.43 0.61 0.09 1.44 3.38 -0.55 -0.72 115.31 120.00 2c8t h LEU 49 Ca 0.14 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.11 2c8t h LEU 49 Cb -0.00 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2c8t h LEU 49 CO -0.06 0.44 -0.11 0.25 0.09 0.00 0.00 178.44 179.04 2c8t h LEU 50 N 0.73 -0.30 -0.33 1.67 5.85 -0.63 0.19 115.31 122.49 2c8t h LEU 50 Ca 0.22 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.98 2c8t h LEU 50 Cb -0.04 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 2c8t h LEU 50 CO -0.07 -0.17 0.20 -0.07 -0.34 0.00 0.00 178.44 177.99 2c8t h LEU 51 N -0.24 0.33 -0.77 2.25 3.38 -1.05 0.34 115.31 119.55 2c8t h LEU 51 Ca 0.01 -0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.00 2c8t h LEU 51 Cb 0.24 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.88 2c8t h LEU 51 CO -0.05 0.24 0.50 0.00 0.09 0.00 0.00 178.44 179.22 2c8t h ALA 52 N 1.14 1.00 -0.33 1.53 0.00 -0.93 -1.94 119.26 119.73 2c8t h ALA 52 Ca 0.13 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 2c8t h ALA 52 Cb -0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2c8t h ALA 52 CO -0.05 0.34 -0.14 0.00 0.00 0.00 0.00 179.25 179.40 2c8t h ALA 53 N 1.31 1.15 -0.10 0.00 0.00 -0.47 -2.85 119.26 118.29 2c8t h ALA 53 Ca 0.30 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2c8t h ALA 53 Cb -0.05 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2c8t h ALA 53 CO -0.09 0.54 -0.48 0.93 0.00 0.00 0.00 179.25 180.15 2c8t h GLU 54 N 0.53 0.26 -0.69 0.00 5.08 -0.29 -3.43 114.58 116.04 2c8t h GLU 54 Ca 0.09 -0.14 0.17 0.00 -1.00 0.00 0.00 59.36 58.48 2c8t h GLU 54 Cb 0.55 0.01 -0.21 0.00 0.50 0.00 0.00 28.75 29.59 2c8t h GLU 54 CO 0.03 0.69 -0.02 0.34 -1.00 0.00 0.00 179.01 179.05 2c8t s ASP 55 N -6.88 -0.84 0.00 1.42 -1.08 -0.79 -5.05 116.67 103.45 2c8t s ASP 55 Ca -0.04 0.59 0.28 0.00 -0.52 0.00 0.00 52.55 52.86 2c8t s ASP 55 Cb 0.13 1.73 1.14 0.00 -1.46 0.00 0.00 42.92 44.46 2c8t s ASP 55 CO 0.78 -0.16 1.84 0.00 0.52 0.00 0.00 175.17 178.16 2c8t n ALA 56 N 5.41 2.63 -0.12 3.66 0.00 -1.09 -4.14 120.51 126.87 2c8t n ALA 56 Ca -0.05 -0.17 -0.16 0.00 0.00 0.00 0.00 53.44 53.06 2c8t n ALA 56 Cb 0.52 -1.39 -0.13 0.00 0.00 0.00 0.00 19.45 18.46 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 -1.40 1.55 -4.77 0.00 3.41 -1.26 -3.07 113.62 108.07 2c8t n SER 57 Ca 0.09 -0.10 -0.36 0.00 -0.26 0.00 0.00 58.87 58.24 2c8t n SER 57 Cb 0.32 -0.05 -0.00 0.00 -0.26 0.00 0.00 64.21 64.22 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 -2.50 3.52 0.81 4.33 1.02 -1.26 -4.73 119.74 120.93 2c8t s LYS 58 Ca -0.28 1.66 -0.11 0.00 0.02 0.00 0.00 55.97 57.26 2c8t s LYS 58 Cb 0.08 -2.16 0.08 0.00 -0.52 0.00 0.00 37.83 35.31 2c8t s LYS 58 CO 0.64 -0.72 1.12 -0.51 -0.92 0.00 0.00 175.35 174.96 2c8t s ASP 59 N -1.63 4.04 -0.09 2.83 1.11 -1.26 -4.56 116.67 117.11 2c8t s ASP 59 Ca 0.69 1.98 0.03 0.00 0.18 0.00 0.00 52.55 55.42 2c8t s ASP 59 Cb -0.25 -2.54 -0.02 0.00 1.07 0.00 0.00 42.92 41.18 2c8t s ASP 59 CO 0.29 -2.35 -0.17 -0.63 1.18 0.00 0.00 175.17 173.50 2c8t s ILE 60 N -2.74 2.76 -0.26 0.77 1.01 -0.42 -4.86 121.20 117.46 2c8t s ILE 60 Ca 0.64 -0.79 -0.09 0.00 0.00 0.00 0.00 60.65 60.41 2c8t s ILE 60 Cb -0.20 -2.10 -0.03 0.00 0.01 0.00 0.00 42.46 40.14 2c8t s ILE 60 CO 0.55 0.56 0.11 -0.44 0.00 0.00 0.00 174.94 175.72 2c8t s SER 61 N -0.05 5.42 -0.26 3.58 0.01 -0.07 0.05 113.70 122.37 2c8t s SER 61 Ca -0.04 -0.18 -0.05 0.00 1.31 0.00 0.00 55.95 56.99 2c8t s SER 61 Cb -0.14 -1.99 0.00 0.00 0.21 0.00 0.00 66.02 64.10 2c8t s SER 61 CO 0.04 -0.05 0.02 -0.22 0.41 0.00 0.00 173.24 173.44 2c8t s LEU 62 N 1.66 3.40 -0.20 2.44 2.96 0.63 -0.22 118.68 129.35 2c8t s LEU 62 Ca 0.06 -0.58 -0.10 0.00 -0.22 0.00 0.00 54.13 53.29 2c8t s LEU 62 Cb -0.16 -1.81 -0.05 0.00 0.50 0.00 0.00 46.19 44.68 2c8t s LEU 62 CO 0.06 -0.11 0.14 -0.31 -1.32 0.00 0.00 176.35 174.81 2c8t s TYR 63 N 1.48 3.41 -0.20 5.38 1.51 0.14 -1.43 117.35 127.64 2c8t s TYR 63 Ca 0.04 0.35 0.00 0.00 -1.01 0.00 0.00 57.07 56.45 2c8t s TYR 63 Cb -0.16 -2.18 0.02 0.00 -0.11 0.00 0.00 41.96 39.54 2c8t s TYR 63 CO -0.00 0.28 -0.16 0.42 -1.11 0.00 0.00 175.55 174.98 2c8t s ILE 64 N 0.39 2.31 -0.43 2.71 1.01 0.89 -0.20 121.20 127.88 2c8t s ILE 64 Ca 0.09 -0.96 0.05 0.00 0.00 0.00 0.00 60.65 59.82 2c8t s ILE 64 Cb -0.11 -2.04 0.18 0.00 0.01 0.00 0.00 42.46 40.49 2c8t s ILE 64 CO -0.01 0.44 0.43 -3.20 0.00 0.00 0.00 174.94 172.59 2c8t n ASN 65 N 4.63 -1.08 -3.81 3.58 5.15 0.10 -0.80 115.26 123.04 2c8t n ASN 65 Ca -0.20 -2.49 -0.13 0.00 -0.60 0.00 0.00 54.58 51.16 2c8t n ASN 65 Cb 0.49 -0.08 -0.13 0.00 -0.53 0.00 0.00 39.78 39.52 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 0.17 -0.12 0.00 1.20 0.15 0.59 -3.69 113.70 111.98 2c8t s SER 66 Ca 0.32 0.26 0.25 0.00 0.70 0.00 0.00 55.95 57.49 2c8t s SER 66 Cb 0.04 0.24 1.52 0.00 -1.71 0.00 0.00 66.02 66.10 2c8t s SER 66 CO -0.17 -0.07 1.93 -0.81 1.20 0.00 0.00 173.24 175.32 2c8t n PRO 67 N 3.34 0.92 0.00 5.44 -0.04 -1.26 -2.15 135.00 141.25 2c8t n PRO 67 Ca -0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 2c8t n PRO 67 Cb 0.57 -1.43 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 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 0.78 0.14 0.00 0.55 0.00 -1.18 -4.33 105.19 101.14 2c8t n GLY 68 Ca 0.19 -1.38 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 0.26 3.63 -0.02 0.00 -1.26 0.13 105.19 107.93 2c8t n GLY 69 Ca 0.00 -1.35 -0.48 0.00 0.00 0.00 0.00 46.02 44.19 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 2.23 0.36 1.61 2.88 -0.18 -4.53 113.62 115.98 2c8t n SER 70 Ca 0.00 1.12 -0.18 0.00 -1.33 0.00 0.00 58.87 58.48 2c8t n SER 70 Cb 0.00 -1.31 -0.09 0.00 -0.75 0.00 0.00 64.21 62.06 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 3.20 0.24 -0.96 2.46 2.04 -1.99 -1.70 117.51 120.80 2c8t h ILE 71 Ca -0.45 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.41 2c8t h ILE 71 Cb 1.30 0.24 -0.05 0.00 -0.74 0.00 0.00 36.82 37.57 2c8t h ILE 71 CO 0.79 0.00 0.61 0.77 0.00 0.00 0.00 178.15 180.31 2c8t h SER 72 N -0.95 1.12 -0.39 1.72 4.64 -1.96 0.45 113.55 118.18 2c8t h SER 72 Ca -0.08 -0.05 0.05 0.00 -0.47 0.00 0.00 61.79 61.24 2c8t h SER 72 Cb 0.76 -0.28 -0.04 0.00 -0.31 0.00 0.00 62.40 62.53 2c8t h SER 72 CO 0.10 0.84 0.13 0.00 -0.87 0.00 0.00 176.83 177.03 2c8t h ALA 73 N 1.36 0.46 -0.18 5.18 0.00 -1.90 -0.36 119.26 123.82 2c8t h ALA 73 Ca 0.35 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.24 2c8t h ALA 73 Cb -0.11 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2c8t h ALA 73 CO -0.07 -0.26 -0.20 0.78 0.00 0.00 0.00 179.25 179.50 2c8t h GLY 74 N 0.29 0.33 1.60 0.00 0.00 -0.05 -2.74 103.07 102.50 2c8t h GLY 74 Ca 0.18 -0.24 -0.16 0.00 0.00 0.00 0.00 47.33 47.11 2c8t h GLY 74 CO -0.19 0.22 -0.63 1.98 0.00 0.00 0.00 176.54 177.92 2c8t h MET 75 N 0.28 0.41 -0.39 4.80 -1.53 0.54 -0.80 114.93 118.24 2c8t h MET 75 Ca 0.05 -0.29 0.03 0.00 -3.44 0.00 0.00 59.70 56.05 2c8t h MET 75 Cb 0.52 0.05 -0.03 0.00 -0.55 0.00 0.00 31.60 31.59 2c8t h MET 75 CO 0.03 0.91 0.19 0.00 0.14 0.00 0.00 176.91 178.18 2c8t h ALA 76 N 1.02 0.49 -0.35 0.39 0.00 -0.83 -0.12 119.26 119.86 2c8t h ALA 76 Ca -0.01 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2c8t h ALA 76 Cb 1.17 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 2c8t h ALA 76 CO 0.11 -0.18 0.20 0.82 0.00 0.00 0.00 179.25 180.20 2c8t h ILE 77 N 0.39 1.13 -0.02 0.00 2.04 -1.18 -1.99 117.51 117.87 2c8t h ILE 77 Ca 0.17 -0.32 0.03 0.00 1.00 0.00 0.00 64.86 65.74 2c8t h ILE 77 Cb 0.09 0.71 -0.04 0.00 -0.74 0.00 0.00 36.82 36.84 2c8t h ILE 77 CO -0.13 0.13 -0.23 0.22 0.00 0.00 0.00 178.15 178.15 2c8t h TYR 78 N 0.45 -0.60 -0.98 1.37 3.20 -0.78 0.03 116.97 119.66 2c8t h TYR 78 Ca 0.12 0.02 0.14 0.00 3.14 0.00 0.00 58.73 62.15 2c8t h TYR 78 Cb 0.04 0.27 -0.08 0.00 1.54 0.00 0.00 36.73 38.49 2c8t h TYR 78 CO -0.03 -0.31 0.62 -0.44 -1.64 0.00 0.00 178.16 176.35 2c8t h ASP 79 N -0.35 0.84 -0.32 -2.11 3.32 -0.83 -0.57 116.42 116.41 2c8t h ASP 79 Ca 0.07 0.05 -0.10 0.00 0.02 0.00 0.00 57.03 57.07 2c8t h ASP 79 Cb 0.44 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 2c8t h ASP 79 CO -0.22 0.42 -0.18 0.74 -1.72 0.00 0.00 179.24 178.29 2c8t h THR 80 N 0.89 1.29 -0.51 0.35 2.02 -0.54 0.20 112.91 116.62 2c8t h THR 80 Ca 0.50 -1.30 0.10 0.00 0.77 0.00 0.00 66.41 66.47 2c8t h THR 80 Cb 0.60 1.45 -0.08 0.00 -1.74 0.00 0.00 68.15 68.38 2c8t h THR 80 CO -0.26 0.42 0.02 0.24 0.37 0.00 0.00 175.52 176.30 2c8t h MET 81 N 0.44 0.13 -0.33 6.66 2.86 -0.05 0.36 114.93 125.00 2c8t h MET 81 Ca 0.07 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.68 2c8t h MET 81 Cb 0.72 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.33 2c8t h MET 81 CO 0.05 0.09 0.15 0.28 1.06 0.00 0.00 176.91 178.54 2c8t h VAL 82 N 0.14 1.17 -0.36 -2.22 2.07 -0.82 -3.02 116.25 113.21 2c8t h VAL 82 Ca 0.26 -0.50 0.06 0.00 0.82 0.00 0.00 66.70 67.33 2c8t h VAL 82 Cb 0.39 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 30.99 2c8t h VAL 82 CO -0.41 0.18 0.06 0.25 0.02 0.00 0.00 177.57 177.67 2c8t h LEU 83 N 0.40 -0.02 -9.43 2.57 5.85 -0.14 -3.42 115.31 111.12 2c8t h LEU 83 Ca 0.11 0.06 -0.56 0.00 0.84 0.00 0.00 57.88 58.34 2c8t h LEU 83 Cb 0.15 0.09 0.03 0.00 0.37 0.00 0.00 40.66 41.30 2c8t h LEU 83 CO -0.01 0.03 1.09 0.00 -0.34 0.00 0.00 178.44 179.21 2c8t n ALA 84 N -2.43 1.69 0.08 1.25 0.00 0.08 -4.86 120.51 116.32 2c8t n ALA 84 Ca 0.01 0.30 0.06 0.00 0.00 0.00 0.00 53.44 53.82 2c8t n ALA 84 Cb 0.16 -2.56 0.50 0.00 0.00 0.00 0.00 19.45 17.55 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 8.76 0.35 -7.24 0.00 0.11 -1.83 -3.44 132.00 128.72 2c8t h PRO 85 Ca -0.47 -0.02 -0.50 0.00 0.11 0.00 0.00 66.00 65.11 2c8t h PRO 85 Cb 1.24 -0.08 0.05 0.00 0.11 0.00 0.00 31.00 32.32 2c8t h PRO 85 CO 0.94 0.23 0.35 0.00 -0.21 0.00 0.00 178.00 179.31 2c8t s ASP 87 N -3.98 5.23 -0.25 0.00 1.01 -1.26 -4.88 116.67 112.54 2c8t s ASP 87 Ca 0.54 2.50 0.02 0.00 0.71 0.00 0.00 52.55 56.32 2c8t s ASP 87 Cb -0.11 -2.61 0.06 0.00 1.01 0.00 0.00 42.92 41.27 2c8t s ASP 87 CO 0.48 -1.57 -0.07 -0.63 0.21 0.00 0.00 175.17 173.60 2c8t s ILE 88 N -1.49 1.79 0.20 0.77 1.01 -1.26 -1.30 121.20 120.92 2c8t s ILE 88 Ca 0.75 -1.44 -0.26 0.00 0.00 0.00 0.00 60.65 59.70 2c8t s ILE 88 Cb -0.34 -2.02 -0.08 0.00 0.01 0.00 0.00 42.46 40.03 2c8t s ILE 88 CO 0.38 -0.11 0.83 0.00 0.00 0.00 0.00 174.94 176.03 2c8t s ALA 89 N 1.27 3.40 -0.05 9.38 0.00 0.11 -1.47 121.76 134.39 2c8t s ALA 89 Ca -0.06 0.43 0.05 0.00 0.00 0.00 0.00 51.96 52.38 2c8t s ALA 89 Cb -0.19 -3.03 -0.01 0.00 0.00 0.00 0.00 23.12 19.89 2c8t s ALA 89 CO -0.06 0.26 -0.21 0.99 0.00 0.00 0.00 175.76 176.74 2c8t s THR 90 N -1.23 1.70 -0.12 0.00 2.01 -0.31 -0.27 115.64 117.42 2c8t s THR 90 Ca 0.39 -0.87 -0.01 0.00 0.31 0.00 0.00 61.69 61.51 2c8t s THR 90 Cb -0.23 -1.45 0.03 0.00 0.01 0.00 0.00 72.50 70.86 2c8t s THR 90 CO 0.27 0.48 -0.04 -0.31 -0.69 0.00 0.00 174.62 174.33 2c8t s TYR 91 N -0.07 1.32 -0.44 4.92 1.51 -0.51 0.88 117.35 124.96 2c8t s TYR 91 Ca -0.03 -0.72 -0.28 0.00 -1.01 0.00 0.00 57.07 55.03 2c8t s TYR 91 Cb -0.12 -1.14 0.03 0.00 -0.11 0.00 0.00 41.96 40.61 2c8t s TYR 91 CO 0.03 -0.51 1.09 0.00 -1.11 0.00 0.00 175.55 175.05 2c8t s ALA 92 N 1.76 3.25 -0.27 3.71 0.00 0.04 -0.08 121.76 130.17 2c8t s ALA 92 Ca 0.03 -0.42 0.01 0.00 0.00 0.00 0.00 51.96 51.58 2c8t s ALA 92 Cb -0.14 -3.80 0.08 0.00 0.00 0.00 0.00 23.12 19.26 2c8t s ALA 92 CO -0.07 -2.03 0.02 1.41 0.00 0.00 0.00 175.76 175.08 2c8t s MET 93 N 4.15 1.24 1.36 0.00 0.00 0.02 -1.40 119.30 124.67 2c8t s MET 93 Ca 0.46 -1.14 0.00 0.00 0.00 0.00 0.00 55.69 55.01 2c8t s MET 93 Cb -0.09 -2.49 0.00 0.00 0.00 0.00 0.00 34.83 32.25 2c8t s MET 93 CO 0.27 -0.78 0.00 0.41 0.00 0.00 0.00 175.02 174.91 2c8t n GLY 94 N 4.67 1.67 2.81 2.11 0.00 -1.26 -3.82 105.19 111.37 2c8t n GLY 94 Ca -0.06 -0.26 -0.14 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.02 -0.32 1.61 -2.45 -1.26 -0.46 119.30 116.40 2c8t s MET 95 Ca 0.00 0.12 0.02 0.00 -1.25 0.00 0.00 55.69 54.57 2c8t s MET 95 Cb 0.00 -0.15 0.10 0.00 1.25 0.00 0.00 34.83 36.02 2c8t s MET 95 CO 0.00 -0.10 0.06 0.00 1.05 0.00 0.00 175.02 176.02 2c8t s ALA 96 N 0.66 2.25 0.24 4.11 0.00 -0.87 -0.30 121.76 127.85 2c8t s ALA 96 Ca -0.06 -2.06 0.11 0.00 0.00 0.00 0.00 51.96 49.95 2c8t s ALA 96 Cb -0.08 -1.77 -0.05 0.00 0.00 0.00 0.00 23.12 21.22 2c8t s ALA 96 CO -0.02 -1.63 -0.15 0.00 0.00 0.00 0.00 175.76 173.96 2c8t s ALA 97 N 1.24 2.82 0.00 0.00 0.00 -0.91 -1.24 121.76 123.68 2c8t s ALA 97 Ca 0.09 -1.72 0.00 0.00 0.00 0.00 0.00 51.96 50.33 2c8t s ALA 97 Cb -0.18 -0.46 0.00 0.00 0.00 0.00 0.00 23.12 22.48 2c8t s ALA 97 CO -0.15 0.34 0.00 0.43 0.00 0.00 0.00 175.76 176.38 2c8t n SER 98 N -0.39 0.00 0.28 0.00 7.64 -0.77 0.13 113.62 120.51 2c8t n SER 98 Ca -0.08 0.00 0.18 0.00 1.01 0.00 0.00 58.87 59.98 2c8t n SER 98 Cb 0.58 0.00 0.94 0.00 -1.01 0.00 0.00 64.21 64.72 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 -0.29 1.43 0.00 -1.86 0.29 114.93 114.51 2c8t h MET 99 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 59.70 59.56 2c8t h MET 99 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 31.60 31.60 2c8t h MET 99 CO 0.00 0.00 -0.35 0.78 0.00 0.00 0.00 176.91 177.34 2c8t h GLY 100 N 0.00 0.82 0.89 8.32 0.00 0.82 -1.38 103.07 112.54 2c8t h GLY 100 Ca 0.00 -0.87 -0.01 0.00 0.00 0.00 0.00 47.33 46.45 2c8t h GLY 100 CO 0.00 0.79 0.06 -2.09 0.00 0.00 0.00 176.54 175.30 2c8t h GLU 101 N 0.51 0.20 -0.39 4.80 4.22 -0.01 -1.20 114.58 122.71 2c8t h GLU 101 Ca 0.04 -0.03 0.08 0.00 0.08 0.00 0.00 59.36 59.52 2c8t h GLU 101 Cb 0.93 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 30.08 2c8t h GLU 101 CO 0.08 0.27 -0.06 0.35 -2.18 0.00 0.00 179.01 177.47 2c8t h PHE 102 N 0.08 -0.14 -0.47 0.92 3.57 -1.22 0.10 116.94 119.78 2c8t h PHE 102 Ca 0.05 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.45 2c8t h PHE 102 Cb 0.14 0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 2c8t h PHE 102 CO -0.02 -0.14 -0.21 -0.07 -2.23 0.00 0.00 178.31 175.64 2c8t h LEU 103 N 0.04 0.99 -0.14 0.59 3.38 -1.21 -0.38 115.31 118.57 2c8t h LEU 103 Ca 0.19 -0.37 0.05 0.00 0.09 0.00 0.00 57.88 57.84 2c8t h LEU 103 Cb 0.28 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.70 2c8t h LEU 103 CO -0.37 1.15 -0.30 0.25 0.09 0.00 0.00 178.44 179.26 2c8t h LEU 104 N 0.84 -0.94 -2.20 1.67 5.85 -0.36 -1.90 115.31 118.27 2c8t h LEU 104 Ca 0.11 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.96 2c8t h LEU 104 Cb 0.78 0.40 -0.00 0.00 0.37 0.00 0.00 40.66 42.21 2c8t h LEU 104 CO 0.06 -0.34 -0.06 0.00 -0.34 0.00 0.00 178.44 177.76 2c8t h ALA 105 N 0.49 1.36 -0.02 1.25 0.00 -0.36 -2.42 119.26 119.56 2c8t h ALA 105 Ca 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2c8t h ALA 105 Cb 0.53 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2c8t h ALA 105 CO -0.35 0.08 0.00 0.00 0.00 0.00 0.00 179.25 178.98 2c8t n ALA 106 N -2.28 2.62 -0.98 0.00 0.00 -0.20 -4.86 120.51 114.81 2c8t n ALA 106 Ca -0.02 -0.32 -0.33 0.00 0.00 0.00 0.00 53.44 52.77 2c8t n ALA 106 Cb 0.17 -1.32 0.14 0.00 0.00 0.00 0.00 19.45 18.44 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 -1.93 2.01 0.04 0.00 0.00 -0.91 -4.89 107.32 101.65 2c8t s GLY 107 Ca 0.41 0.77 -0.36 0.00 0.00 0.00 0.00 44.72 45.54 2c8t s GLY 107 CO 0.33 1.19 1.51 2.41 0.00 0.00 0.00 173.10 178.54 2c8t n THR 108 N -3.60 0.09 -1.72 0.90 -1.04 -0.54 -4.86 114.28 103.51 2c8t n THR 108 Ca 0.13 -0.02 -0.43 0.00 -2.04 0.00 0.00 64.05 61.70 2c8t n THR 108 Cb 0.51 -1.16 -0.02 0.00 -1.82 0.00 0.00 70.33 67.84 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 3.49 2.55 0.00 -2.82 5.02 -1.26 -1.05 118.16 124.09 2c8t n LYS 109 Ca 0.19 0.91 0.00 0.00 -2.02 0.00 0.00 58.31 57.39 2c8t n LYS 109 Cb 0.22 -2.67 0.00 0.00 -0.02 0.00 0.00 35.03 32.56 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 2.36 2.99 1.38 0.72 0.00 -1.26 -4.90 105.19 106.49 2c8t n GLY 110 Ca 0.10 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.42 2.71 -3.74 1.61 5.02 -0.22 -4.86 118.16 118.26 2c8t n LYS 111 Ca 0.00 -3.78 -0.37 0.00 -2.02 0.00 0.00 58.31 52.14 2c8t n LYS 111 Cb 0.00 -1.98 -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 3.69 0.15 1.97 0.52 -1.25 -1.16 118.95 119.44 2c8t s ARG 112 Ca 0.45 -0.46 0.11 0.00 -0.52 0.00 0.00 55.73 55.31 2c8t s ARG 112 Cb 0.39 -3.36 -0.04 0.00 0.52 0.00 0.00 34.95 32.47 2c8t s ARG 112 CO -0.01 -0.18 -0.25 0.71 0.02 0.00 0.00 175.30 175.59 2c8t s TYR 113 N 1.61 2.32 -0.03 -0.53 1.51 0.25 0.21 117.35 122.69 2c8t s TYR 113 Ca 0.06 -0.37 0.06 0.00 -1.01 0.00 0.00 57.07 55.82 2c8t s TYR 113 Cb -0.15 -1.22 -0.01 0.00 -0.11 0.00 0.00 41.96 40.46 2c8t s TYR 113 CO 0.04 0.39 -0.21 0.00 -1.11 0.00 0.00 175.55 174.66 2c8t s ALA 114 N -1.26 1.81 0.44 3.71 0.00 -0.32 -0.78 121.76 125.37 2c8t s ALA 114 Ca 0.16 -0.91 -0.16 0.00 0.00 0.00 0.00 51.96 51.05 2c8t s ALA 114 Cb -0.09 -0.50 -0.09 0.00 0.00 0.00 0.00 23.12 22.44 2c8t s ALA 114 CO 0.07 0.41 0.90 -0.51 0.00 0.00 0.00 175.76 176.64 2c8t s LEU 115 N -0.37 3.81 0.43 0.00 1.43 -0.49 -1.72 118.68 121.78 2c8t s LEU 115 Ca 0.05 1.48 0.16 0.00 -1.03 0.00 0.00 54.13 54.79 2c8t s LEU 115 Cb -0.10 -4.37 1.07 0.00 0.03 0.00 0.00 46.19 42.82 2c8t s LEU 115 CO 0.00 -0.43 1.91 -0.65 0.23 0.00 0.00 176.35 177.40 2c8t h PRO 116 N 1.45 0.39 -0.49 1.29 0.11 -1.91 0.10 132.00 132.96 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 1.18 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2c8t h PRO 116 CO 0.62 0.26 0.00 0.72 -0.21 0.00 0.00 178.00 179.39 2c8t n HIS 117 N -4.48 0.65 -1.83 0.65 8.25 -1.26 -4.42 115.22 112.77 2c8t n HIS 117 Ca 0.15 -0.44 -0.36 0.00 -0.26 0.00 0.00 57.72 56.81 2c8t n HIS 117 Cb 0.57 -0.01 0.06 0.00 1.12 0.00 0.00 29.99 31.73 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 -1.05 2.43 0.01 -1.41 0.00 0.35 -4.77 121.76 117.32 2c8t s ALA 118 Ca 0.35 1.09 0.01 0.00 0.00 0.00 0.00 51.96 53.41 2c8t s ALA 118 Cb 0.18 -3.50 -0.01 0.00 0.00 0.00 0.00 23.12 19.79 2c8t s ALA 118 CO 0.24 -1.43 -0.04 -0.98 0.00 0.00 0.00 175.76 173.55 2c8t s ARG 119 N -3.41 0.33 -0.14 0.00 1.70 0.40 -3.27 118.95 114.56 2c8t s ARG 119 Ca 0.80 -0.32 -0.04 0.00 -0.47 0.00 0.00 55.73 55.69 2c8t s ARG 119 Cb -0.34 -0.22 -0.03 0.00 -0.57 0.00 0.00 34.95 33.79 2c8t s ARG 119 CO 0.37 0.05 0.00 0.42 -1.08 0.00 0.00 175.30 175.07 2c8t s ILE 120 N -0.54 4.30 -0.14 4.99 1.09 -0.65 -2.06 121.20 128.18 2c8t s ILE 120 Ca -0.03 -0.22 0.02 0.00 -1.10 0.00 0.00 60.65 59.31 2c8t s ILE 120 Cb -0.04 -2.88 0.01 0.00 -1.06 0.00 0.00 42.46 38.49 2c8t s ILE 120 CO -0.00 0.52 -0.20 -0.76 -0.10 0.00 0.00 174.94 174.39 2c8t s LEU 121 N 0.01 2.20 0.21 2.97 2.01 -0.37 0.09 118.68 125.79 2c8t s LEU 121 Ca 0.03 -0.57 -0.10 0.00 0.01 0.00 0.00 54.13 53.49 2c8t s LEU 121 Cb -0.13 -1.47 -0.07 0.00 0.01 0.00 0.00 46.19 44.53 2c8t s LEU 121 CO 0.02 0.08 0.54 -0.04 1.01 0.00 0.00 176.35 177.96 2c8t s MET 122 N 0.83 3.83 -0.25 1.70 -1.94 -0.65 -1.84 119.30 120.99 2c8t s MET 122 Ca -0.06 0.30 -0.12 0.00 -1.71 0.00 0.00 55.69 54.10 2c8t s MET 122 Cb -0.15 -2.72 0.09 0.00 2.01 0.00 0.00 34.83 34.06 2c8t s MET 122 CO -0.02 0.36 0.58 -1.58 -0.01 0.00 0.00 175.02 174.35 2c8t s HIS 123 N -1.73 -0.98 -0.24 -0.03 5.04 -1.26 -3.95 115.29 112.14 2c8t s HIS 123 Ca 0.45 1.90 -0.31 0.00 -1.54 0.00 0.00 55.06 55.56 2c8t s HIS 123 Cb -0.12 0.54 -0.07 0.00 0.04 0.00 0.00 32.58 32.97 2c8t s HIS 123 CO 0.21 -0.51 2.19 0.94 -2.34 0.00 0.00 174.74 175.23 2c8t n GLN 124 N 4.68 1.76 -3.13 2.88 -0.06 -0.77 -4.78 117.38 117.96 2c8t n GLN 124 Ca -0.18 0.50 -0.33 0.00 -2.00 0.00 0.00 57.00 54.99 2c8t n GLN 124 Cb 0.55 -2.98 -0.06 0.00 -4.06 0.00 0.00 30.24 23.69 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 6.13 4.04 0.00 3.69 0.04 -1.26 -5.04 135.00 142.59 2c8t s PRO 125 Ca 1.02 0.70 0.00 0.00 0.04 0.00 0.00 61.00 62.77 2c8t s PRO 125 Cb -0.51 -2.49 0.00 0.00 0.04 0.00 0.00 34.50 31.54 2c8t s PRO 125 CO 0.40 0.19 0.00 1.28 0.04 0.00 0.00 177.00 178.91 2c8t n LEU 126 N -0.22 0.00 -0.07 -3.56 4.77 -1.26 -5.09 117.00 111.57 2c8t n LEU 126 Ca 0.03 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.94 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 -0.53 -0.38 -1.33 0.00 0.00 177.39 175.56 2c8t n ILE 136 N 0.00 1.28 -0.35 -0.08 5.41 -1.26 -5.18 119.36 119.18 2c8t n ILE 136 Ca 0.00 0.20 0.06 0.00 1.00 0.00 0.00 62.75 64.02 2c8t n ILE 136 Cb 0.00 -2.17 0.24 0.00 -0.71 0.00 0.00 39.64 37.00 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 -1.03 1.53 -0.31 -1.39 0.00 -2.06 -1.37 119.26 114.63 2c8t h ALA 137 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2c8t h ALA 137 Cb 0.78 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2c8t h ALA 137 CO 0.00 0.26 0.12 0.82 0.00 0.00 0.00 179.25 180.45 2c8t h ILE 138 N 1.01 1.19 -0.06 0.00 5.03 -2.06 -2.80 117.51 119.82 2c8t h ILE 138 Ca 0.46 -0.57 -0.04 0.00 -0.12 0.00 0.00 64.86 64.60 2c8t h ILE 138 Cb 0.40 0.99 -0.01 0.00 -3.03 0.00 0.00 36.82 35.17 2c8t h ILE 138 CO -0.22 0.20 -0.13 1.56 -0.68 0.00 0.00 178.15 178.87 2c8t h GLN 139 N 0.35 0.08 0.26 2.37 4.20 -1.74 -2.74 115.11 117.89 2c8t h GLN 139 Ca 0.10 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 2c8t h GLN 139 Cb 0.20 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.96 2c8t h GLN 139 CO -0.01 0.22 -0.13 0.00 -0.67 0.00 0.00 178.83 178.25 2c8t h ALA 140 N 1.79 -0.35 -0.53 3.87 0.00 -1.07 -1.03 119.26 121.93 2c8t h ALA 140 Ca 0.02 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 54.89 2c8t h ALA 140 Cb 0.29 0.14 -0.11 0.00 0.00 0.00 0.00 17.79 18.11 2c8t h ALA 140 CO 0.02 -0.61 -0.35 0.93 0.00 0.00 0.00 179.25 179.23 2c8t h GLU 141 N -0.52 -0.20 -0.41 0.00 5.08 -1.27 0.43 114.58 117.69 2c8t h GLU 141 Ca -0.04 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.37 2c8t h GLU 141 Cb 0.38 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.64 2c8t h GLU 141 CO 0.06 -0.13 0.19 1.96 -1.00 0.00 0.00 179.01 180.09 2c8t h GLN 142 N -0.20 0.38 -0.19 2.33 4.20 -1.40 -1.54 115.11 118.69 2c8t h GLN 142 Ca 0.20 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.88 2c8t h GLN 142 Cb 0.55 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 2c8t h GLN 142 CO -0.64 0.25 0.09 0.35 -0.67 0.00 0.00 178.83 178.21 2c8t h PHE 143 N 0.39 0.27 -0.56 2.96 3.57 -0.47 -1.57 116.94 121.53 2c8t h PHE 143 Ca 0.18 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.74 2c8t h PHE 143 Cb 0.11 -0.08 -0.06 0.00 2.79 0.00 0.00 35.95 38.71 2c8t h PHE 143 CO -0.11 0.30 0.24 0.00 -2.23 0.00 0.00 178.31 176.50 2c8t h ALA 144 N 0.95 0.71 -0.50 2.41 0.00 -0.63 0.16 119.26 122.35 2c8t h ALA 144 Ca 0.06 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2c8t h ALA 144 Cb 0.13 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2c8t h ALA 144 CO -0.01 -0.15 0.31 0.28 0.00 0.00 0.00 179.25 179.69 2c8t h VAL 145 N 0.45 1.15 0.00 0.00 2.07 -1.03 -2.01 116.25 116.87 2c8t h VAL 145 Ca 0.27 -0.32 -0.16 0.00 0.82 0.00 0.00 66.70 67.31 2c8t h VAL 145 Cb 0.26 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 2c8t h VAL 145 CO -0.24 0.15 -0.77 -0.29 0.02 0.00 0.00 177.57 176.44 2c8t h ILE 146 N 0.68 1.38 -0.11 4.57 2.10 -0.72 -2.49 117.51 122.92 2c8t h ILE 146 Ca 0.18 -2.81 -0.03 0.00 1.08 0.00 0.00 64.86 63.28 2c8t h ILE 146 Cb -0.03 2.59 -0.00 0.00 -1.09 0.00 0.00 36.82 38.29 2c8t h ILE 146 CO -0.04 0.76 -0.04 0.50 -1.08 0.00 0.00 178.15 178.25 2c8t h LYS 147 N 0.00 0.22 -0.70 2.19 3.64 -0.60 -0.92 116.57 120.40 2c8t h LYS 147 Ca -0.01 -0.09 0.04 0.00 -1.27 0.00 0.00 60.65 59.32 2c8t h LYS 147 Cb 1.53 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 33.29 2c8t h LYS 147 CO 0.10 0.55 0.42 -0.22 -2.27 0.00 0.00 179.45 178.03 2c8t h LYS 148 N -0.12 0.78 -0.40 1.90 3.64 -1.40 -1.61 116.57 119.35 2c8t h LYS 148 Ca 0.03 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.30 2c8t h LYS 148 Cb 0.48 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 2c8t h LYS 148 CO 0.01 0.51 -0.00 1.49 -2.27 0.00 0.00 179.45 179.19 2c8t h GLU 149 N 0.80 0.64 0.21 1.90 4.57 -1.32 -0.80 114.58 120.58 2c8t h GLU 149 Ca 0.29 -0.15 -0.01 0.00 -1.18 0.00 0.00 59.36 58.31 2c8t h GLU 149 Cb 0.09 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.60 2c8t h GLU 149 CO -0.14 0.66 -0.10 1.98 -1.18 0.00 0.00 179.01 180.23 2c8t h MET 150 N 0.60 -0.27 -0.55 1.92 4.05 -0.60 -2.23 114.93 117.86 2c8t h MET 150 Ca 0.12 0.02 0.11 0.00 -0.28 0.00 0.00 59.70 59.67 2c8t h MET 150 Cb 0.39 0.06 -0.10 0.00 -0.80 0.00 0.00 31.60 31.15 2c8t h MET 150 CO 0.01 0.03 -0.10 0.74 0.23 0.00 0.00 176.91 177.83 2c8t h PHE 151 N -0.57 -0.22 -0.41 1.39 0.05 -1.08 0.15 116.94 116.25 2c8t h PHE 151 Ca -0.03 0.05 0.09 0.00 3.82 0.00 0.00 57.97 61.89 2c8t h PHE 151 Cb 0.42 0.18 -0.09 0.00 2.00 0.00 0.00 35.95 38.47 2c8t h PHE 151 CO 0.02 -0.21 -0.24 -0.09 -0.18 0.00 0.00 178.31 177.61 2c8t h ARG 152 N 0.03 -0.16 -0.22 1.51 2.43 -1.08 -0.08 114.38 116.82 2c8t h ARG 152 Ca 0.27 0.01 -0.16 0.00 -0.81 0.00 0.00 59.98 59.29 2c8t h ARG 152 Cb 0.42 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 2c8t h ARG 152 CO -0.54 -0.10 -0.52 -0.07 -1.51 0.00 0.00 179.97 177.22 2c8t h LEU 153 N -0.16 0.69 -0.26 3.80 3.38 -0.67 -1.35 115.31 120.74 2c8t h LEU 153 Ca 0.20 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 2c8t h LEU 153 Cb 0.47 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2c8t h LEU 153 CO -0.51 1.08 0.15 -1.13 0.09 0.00 0.00 178.44 178.13 2c8t h ASN 154 N 0.49 0.32 -0.41 -0.43 -0.00 -0.33 0.46 115.58 115.67 2c8t h ASN 154 Ca 0.02 -0.07 0.08 0.00 -0.00 0.00 0.00 56.30 56.32 2c8t h ASN 154 Cb 1.07 -0.08 -0.07 0.00 -0.00 0.00 0.00 38.32 39.24 2c8t h ASN 154 CO 0.10 0.30 -0.01 0.00 -0.00 0.00 0.00 177.43 177.82 2c8t h ALA 155 N 1.03 0.37 -0.22 1.57 0.00 -0.92 -1.86 119.26 119.24 2c8t h ALA 155 Ca 0.09 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2c8t h ALA 155 Cb 0.05 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2c8t h ALA 155 CO -0.02 -0.40 0.08 1.49 0.00 0.00 0.00 179.25 180.41 2c8t h GLU 156 N 0.10 0.33 -0.30 0.00 4.81 -0.59 0.44 114.58 119.37 2c8t h GLU 156 Ca 0.20 -0.06 0.09 0.00 -0.13 0.00 0.00 59.36 59.46 2c8t h GLU 156 Cb 0.29 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 2c8t h GLU 156 CO -0.35 0.40 0.22 0.74 -0.73 0.00 0.00 179.01 179.29 2c8t h PHE 157 N 0.19 0.00 0.00 0.92 0.05 0.08 -3.24 116.94 114.94 2c8t h PHE 157 Ca 0.07 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.86 2c8t h PHE 157 Cb 0.20 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.15 2c8t h PHE 157 CO -0.00 0.00 -1.36 -2.37 -0.18 0.00 0.00 178.31 174.39 2c8t n THR 158 N -4.41 0.00 -0.79 -1.55 5.66 -0.72 -4.82 114.28 107.65 2c8t n THR 158 Ca 0.04 -0.27 0.00 0.00 -3.05 0.00 0.00 64.05 60.77 2c8t n THR 158 Cb 0.38 0.38 0.00 0.00 -1.55 0.00 0.00 70.33 69.54 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 1.69 0.71 3.98 1.09 0.00 0.11 -4.26 105.19 108.52 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 -0.21 3.22 0.44 1.61 -1.52 -1.03 -5.03 119.66 117.14 2c8t s GLN 160 Ca 0.00 -0.93 -0.23 0.00 -1.95 0.00 0.00 55.36 52.26 2c8t s GLN 160 Cb 0.00 -2.84 -0.08 0.00 -0.22 0.00 0.00 33.01 29.87 2c8t s GLN 160 CO 0.00 0.17 1.08 -2.14 -0.25 0.00 0.00 175.29 174.15 2c8t s PRO 161 N -4.12 3.92 0.27 2.91 0.02 -1.26 -4.59 135.00 132.15 2c8t s PRO 161 Ca 0.42 1.55 0.00 0.00 0.02 0.00 0.00 61.00 62.99 2c8t s PRO 161 Cb -0.09 -2.36 0.54 0.00 0.02 0.00 0.00 34.50 32.61 2c8t s PRO 161 CO 0.31 -0.36 1.80 0.82 -0.33 0.00 0.00 177.00 179.24 2c8t h ILE 162 N 1.89 0.83 -0.86 2.83 2.04 -1.93 -1.02 117.51 121.29 2c8t h ILE 162 Ca -0.49 -0.28 0.15 0.00 1.00 0.00 0.00 64.86 65.24 2c8t h ILE 162 Cb 1.23 -0.05 -0.10 0.00 -0.74 0.00 0.00 36.82 37.16 2c8t h ILE 162 CO 0.61 0.15 0.44 -0.33 0.00 0.00 0.00 178.15 179.01 2c8t h GLU 163 N 0.81 0.60 -0.02 2.37 3.07 -1.98 -0.42 114.58 119.01 2c8t h GLU 163 Ca 0.48 -0.04 -0.25 0.00 -0.50 0.00 0.00 59.36 59.05 2c8t h GLU 163 Cb 0.57 -0.13 0.02 0.00 -0.84 0.00 0.00 28.75 28.37 2c8t h GLU 163 CO -0.31 0.39 -0.99 -0.09 -1.40 0.00 0.00 179.01 176.62 2c8t h ARG 164 N 0.61 0.66 -0.83 2.33 2.43 -1.59 -1.53 114.38 116.47 2c8t h ARG 164 Ca 0.47 -0.68 0.07 0.00 -0.81 0.00 0.00 59.98 59.03 2c8t h ARG 164 Cb 0.69 0.19 -0.06 0.00 -0.42 0.00 0.00 29.97 30.36 2c8t h ARG 164 CO -0.37 1.28 0.51 0.82 -1.51 0.00 0.00 179.97 180.69 2c8t h ILE 165 N 0.39 1.02 0.47 1.20 1.08 -0.77 1.00 117.51 121.89 2c8t h ILE 165 Ca -0.11 -0.31 -0.02 0.00 -0.39 0.00 0.00 64.86 64.02 2c8t h ILE 165 Cb 1.63 0.02 0.00 0.00 -3.07 0.00 0.00 36.82 35.41 2c8t h ILE 165 CO 0.19 0.17 -0.23 -0.33 -0.69 0.00 0.00 178.15 177.26 2c8t h GLU 166 N 0.92 -0.61 -0.85 2.37 5.08 -1.03 -2.50 114.58 117.96 2c8t h GLU 166 Ca 0.37 0.04 0.17 0.00 -1.00 0.00 0.00 59.36 58.94 2c8t h GLU 166 Cb 0.20 0.14 -0.10 0.00 0.50 0.00 0.00 28.75 29.48 2c8t h GLU 166 CO -0.18 -0.31 0.41 0.00 -1.00 0.00 0.00 179.01 177.93 2c8t h ALA 167 N -0.78 1.30 -0.10 3.43 0.00 -1.14 -0.75 119.26 121.22 2c8t h ALA 167 Ca -0.06 0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 2c8t h ALA 167 Cb 0.58 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2c8t h ALA 167 CO 0.11 -0.18 -0.52 -0.44 0.00 0.00 0.00 179.25 178.22 2c8t h ASP 168 N 0.54 0.30 -0.35 0.00 3.32 -0.84 -2.41 116.42 116.98 2c8t h ASP 168 Ca 0.49 -0.15 -0.16 0.00 0.02 0.00 0.00 57.03 57.22 2c8t h ASP 168 Cb 0.77 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.23 2c8t h ASP 168 CO -0.42 0.77 -0.39 0.28 -1.72 0.00 0.00 179.24 177.77 2c8t h SER 169 N 0.22 0.97 -0.60 6.45 0.02 -0.74 -1.80 113.55 118.06 2c8t h SER 169 Ca 0.01 -0.44 -0.01 0.00 -0.84 0.00 0.00 61.79 60.50 2c8t h SER 169 Cb 0.99 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 63.23 2c8t h SER 169 CO 0.08 1.23 0.32 0.44 -1.14 0.00 0.00 176.83 177.77 2c8t h ASP 170 N 0.74 0.76 -0.09 3.07 3.32 -1.01 -1.96 116.42 121.24 2c8t h ASP 170 Ca 0.06 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.01 2c8t h ASP 170 Cb 0.98 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.33 2c8t h ASP 170 CO 0.09 0.64 0.00 -2.11 -1.72 0.00 0.00 179.24 176.14 2c8t n ARG 171 N -4.56 1.22 -3.04 3.56 1.85 -0.92 -4.88 116.66 109.88 2c8t n ARG 171 Ca 0.04 -0.34 -0.20 0.00 -1.00 0.00 0.00 57.85 56.35 2c8t n ARG 171 Cb 0.09 -1.10 0.00 0.00 -1.05 0.00 0.00 32.46 30.40 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 -0.25 -4.15 -4.65 2.89 8.00 -1.03 -4.87 116.55 112.49 2c8t n ASP 172 Ca 0.05 -0.20 -0.47 0.00 0.71 0.00 0.00 54.79 54.87 2c8t n ASP 172 Cb 0.09 -3.44 -0.04 0.00 -0.02 0.00 0.00 41.12 37.70 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 1.96 -4.10 -1.24 0.63 -0.70 -4.70 116.66 105.00 2c8t n ARG 173 Ca -0.07 0.71 -0.23 0.00 -0.92 0.00 0.00 57.85 57.34 2c8t n ARG 173 Cb 0.57 -2.45 -0.06 0.00 0.45 0.00 0.00 32.46 30.97 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 0.81 2.68 0.01 -0.14 1.48 -1.26 -1.63 118.94 120.88 2c8t s TRP 174 Ca 0.79 -0.41 -0.01 0.00 -1.06 0.00 0.00 56.10 55.41 2c8t s TRP 174 Cb -0.73 -1.68 -0.01 0.00 -1.16 0.00 0.00 33.47 29.89 2c8t s TRP 174 CO 0.40 0.32 0.01 -0.06 -4.06 0.00 0.00 176.95 173.55 2c8t s PHE 175 N -2.45 0.11 0.60 1.66 0.40 0.11 -4.98 117.98 113.42 2c8t s PHE 175 Ca 0.38 -0.22 -0.10 0.00 -0.60 0.00 0.00 56.93 56.40 2c8t s PHE 175 Cb -0.02 -0.08 -0.03 0.00 0.51 0.00 0.00 43.02 43.40 2c8t s PHE 175 CO 0.23 -0.11 0.98 0.99 0.70 0.00 0.00 175.22 178.00 2c8t s THR 176 N -0.75 4.53 0.24 0.64 2.01 -1.26 -1.64 115.64 119.40 2c8t s THR 176 Ca -0.08 0.64 -0.05 0.00 0.31 0.00 0.00 61.69 62.50 2c8t s THR 176 Cb -0.05 -3.79 0.20 0.00 0.01 0.00 0.00 72.50 68.86 2c8t s THR 176 CO -0.00 -0.98 1.75 0.00 -0.69 0.00 0.00 174.62 174.70 2c8t h ALA 177 N -0.24 1.02 0.03 7.40 0.00 -1.76 0.54 119.26 126.25 2c8t h ALA 177 Ca -0.45 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2c8t h ALA 177 Cb 1.21 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 2c8t h ALA 177 CO 0.62 -0.14 -0.03 0.00 0.00 0.00 0.00 179.25 179.70 2c8t h ALA 178 N 1.49 -0.06 -0.42 0.00 0.00 -1.91 -1.61 119.26 116.76 2c8t h ALA 178 Ca 0.39 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.24 2c8t h ALA 178 Cb 0.51 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2c8t h ALA 178 CO -0.34 -0.54 0.05 0.93 0.00 0.00 0.00 179.25 179.35 2c8t h GLU 179 N -0.07 0.64 -0.30 0.00 5.08 -1.58 -2.22 114.58 116.13 2c8t h GLU 179 Ca 0.00 -0.13 -0.09 0.00 -1.00 0.00 0.00 59.36 58.14 2c8t h GLU 179 Cb 0.06 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 2c8t h GLU 179 CO -0.01 0.62 -0.20 0.00 -1.00 0.00 0.00 179.01 178.42 2c8t h ALA 180 N 1.45 1.08 -0.41 3.43 0.00 0.18 -1.47 119.26 123.52 2c8t h ALA 180 Ca 0.13 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 2c8t h ALA 180 Cb 0.31 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2c8t h ALA 180 CO 0.01 0.56 -0.15 1.25 0.00 0.00 0.00 179.25 180.91 2c8t h LEU 181 N 0.50 0.77 -0.28 0.00 5.85 -0.71 -2.13 115.31 119.31 2c8t h LEU 181 Ca 0.08 -0.25 -0.10 0.00 0.84 0.00 0.00 57.88 58.45 2c8t h LEU 181 Cb 0.63 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2c8t h LEU 181 CO 0.04 0.93 -0.21 -0.33 -0.34 0.00 0.00 178.44 178.53 2c8t h GLU 182 N 0.69 0.63 0.00 1.25 5.08 -1.15 -3.10 114.58 117.98 2c8t h GLU 182 Ca 0.11 -0.31 -0.06 0.00 -1.00 0.00 0.00 59.36 58.10 2c8t h GLU 182 Cb 0.64 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 2c8t h GLU 182 CO 0.04 0.91 -0.27 -0.92 -1.00 0.00 0.00 179.01 177.77 2c8t h TYR 183 N 0.37 0.00 0.00 4.33 3.20 -1.22 -3.47 116.97 120.17 2c8t h TYR 183 Ca 0.05 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.92 2c8t h TYR 183 Cb 0.76 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.03 2c8t h TYR 183 CO 0.07 0.27 0.00 0.41 -1.64 0.00 0.00 178.16 177.27 2c8t n GLY 184 N 0.06 1.25 0.22 1.82 0.00 -0.89 -4.71 105.19 102.94 2c8t n GLY 184 Ca -0.00 0.00 0.15 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 -2.30 1.61 -1.00 -1.66 -3.38 116.94 110.21 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 -0.21 0.00 3.61 0.00 0.00 35.95 39.35 2c8t h PHE 185 CO 0.00 0.00 0.02 0.08 -1.61 0.00 0.00 178.31 176.80 2c8t s VAL 186 N -3.46 0.01 -0.09 -0.55 1.01 -1.25 -3.98 120.40 112.09 2c8t s VAL 186 Ca 0.04 -0.07 0.15 0.00 0.00 0.00 0.00 61.98 62.09 2c8t s VAL 186 Cb 0.09 -0.86 -0.22 0.00 0.00 0.00 0.00 36.38 35.39 2c8t s VAL 186 CO 0.52 -0.04 0.57 0.47 0.00 0.00 0.00 175.10 176.63 2c8t n ASP 187 N 1.93 0.69 -3.93 3.32 8.00 0.13 -4.55 116.55 122.14 2c8t n ASP 187 Ca -0.17 0.32 -0.10 0.00 0.71 0.00 0.00 54.79 55.56 2c8t n ASP 187 Cb 0.56 0.22 -0.10 0.00 -0.02 0.00 0.00 41.12 41.77 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 -2.65 0.16 -0.25 1.24 3.76 -0.66 -5.00 115.29 111.89 2c8t s HIS 188 Ca -0.05 -0.36 -0.08 0.00 -0.15 0.00 0.00 55.06 54.41 2c8t s HIS 188 Cb 0.08 -0.12 -0.03 0.00 1.11 0.00 0.00 32.58 33.61 2c8t s HIS 188 CO 0.83 -0.26 0.10 0.42 -0.85 0.00 0.00 174.74 174.98 2c8t s ILE 189 N -1.60 4.60 -0.02 0.60 1.01 -1.26 -1.18 121.20 123.35 2c8t s ILE 189 Ca -0.14 -0.07 -0.12 0.00 0.00 0.00 0.00 60.65 60.32 2c8t s ILE 189 Cb -0.08 -3.16 -0.05 0.00 0.01 0.00 0.00 42.46 39.18 2c8t s ILE 189 CO -0.00 0.32 0.33 0.27 0.00 0.00 0.00 174.94 175.86 2c8t s ILE 190 N 1.57 5.18 0.00 2.92 -4.36 -0.70 -4.95 121.20 120.85 2c8t s ILE 190 Ca 0.06 0.60 0.00 0.00 -0.26 0.00 0.00 60.65 61.05 2c8t s ILE 190 Cb -0.15 -3.62 0.00 0.00 1.25 0.00 0.00 42.46 39.94 2c8t s ILE 190 CO 0.05 0.55 0.00 0.41 0.24 0.00 0.00 174.94 176.19 2c8t n THR 191 N 1.73 0.00 -2.49 8.37 -1.04 -1.26 -3.98 114.28 115.61 2c8t n THR 191 Ca -0.15 0.00 -0.32 0.00 -2.04 0.00 0.00 64.05 61.54 2c8t n THR 191 Cb 0.53 -0.91 -0.03 0.00 -1.82 0.00 0.00 70.33 68.09 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 3.92 0.65 -2.82 0.52 -1.26 -5.03 118.95 114.94 2c8t s ARG 192 Ca 0.00 0.87 0.02 0.00 -0.52 0.00 0.00 55.73 56.10 2c8t s ARG 192 Cb 0.00 -2.18 0.10 0.00 0.52 0.00 0.00 34.95 33.39 2c8t s ARG 192 CO 0.00 -0.22 0.90 0.00 0.02 0.00 0.00 175.30 176.00 2c8t s ALA 193 N -2.57 4.00 0.00 2.13 0.00 -1.26 -5.21 121.76 118.85 2c8t s ALA 193 Ca 0.57 -1.78 0.00 0.00 0.00 0.00 0.00 51.96 50.76 2c8t s ALA 193 Cb -0.10 -1.87 0.00 0.00 0.00 0.00 0.00 23.12 21.15 2c8t s ALA 193 CO 0.31 -1.19 0.00 0.72 0.00 0.00 0.00 175.76 175.61