#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 -0.66 -0.48 -3.43 5.85 -2.05 0.14 115.31 114.68 2c8t h LEU 16 Ca 0.00 0.08 0.10 0.00 0.84 0.00 0.00 57.88 58.89 2c8t h LEU 16 Cb 0.00 0.25 -0.09 0.00 0.37 0.00 0.00 40.66 41.19 2c8t h LEU 16 CO 0.00 -0.32 -0.14 0.74 -0.34 0.00 0.00 178.44 178.38 2c8t h THR 17 N -0.42 0.48 -0.51 1.05 2.02 -2.06 0.45 112.91 113.92 2c8t h THR 17 Ca 0.03 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.17 2c8t h THR 17 Cb 0.45 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 67.32 2c8t h THR 17 CO -0.14 0.00 0.17 0.44 0.37 0.00 0.00 175.52 176.37 2c8t h ASP 18 N -0.03 0.73 -0.53 4.18 3.32 -1.91 -2.10 116.42 120.08 2c8t h ASP 18 Ca 0.23 -0.20 0.08 0.00 0.02 0.00 0.00 57.03 57.17 2c8t h ASP 18 Cb 0.38 -0.19 -0.07 0.00 0.22 0.00 0.00 39.33 39.67 2c8t h ASP 18 CO -0.51 0.73 0.16 -1.28 -1.72 0.00 0.00 179.24 176.62 2c8t h SER 19 N 0.69 0.12 0.06 6.45 0.87 0.14 0.16 113.55 122.05 2c8t h SER 19 Ca 0.17 0.08 -0.00 0.00 -1.23 0.00 0.00 61.79 60.80 2c8t h SER 19 Cb 0.25 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.29 2c8t h SER 19 CO -0.01 0.09 -0.03 0.58 -0.53 0.00 0.00 176.83 176.93 2c8t h VAL 20 N 0.32 0.95 -0.42 2.23 2.07 -0.66 -1.63 116.25 119.11 2c8t h VAL 20 Ca 0.26 -0.05 -0.06 0.00 0.82 0.00 0.00 66.70 67.67 2c8t h VAL 20 Cb 0.32 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 2c8t h VAL 20 CO -0.29 0.01 0.02 1.88 0.02 0.00 0.00 177.57 179.21 2c8t h TYR 21 N -0.11 0.70 0.06 1.57 0.99 -0.76 -0.47 116.97 118.95 2c8t h TYR 21 Ca -0.01 -0.08 -0.00 0.00 2.00 0.00 0.00 58.73 60.64 2c8t h TYR 21 Cb 0.09 -0.20 0.00 0.00 1.00 0.00 0.00 36.73 37.62 2c8t h TYR 21 CO -0.07 0.65 -0.03 0.93 -0.00 0.00 0.00 178.16 179.64 2c8t h GLU 22 N 0.63 -0.08 -0.94 4.88 5.08 -0.61 0.74 114.58 124.29 2c8t h GLU 22 Ca 0.13 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.54 2c8t h GLU 22 Cb 0.37 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.58 2c8t h GLU 22 CO 0.01 -0.00 0.61 0.00 -1.00 0.00 0.00 179.01 178.63 2c8t h ARG 23 N -0.14 1.13 0.00 2.33 3.08 -0.85 -1.33 114.38 118.61 2c8t h ARG 23 Ca -0.01 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 59.90 2c8t h ARG 23 Cb 0.11 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.90 2c8t h ARG 23 CO 0.01 0.75 -0.35 1.25 -1.07 0.00 0.00 179.97 180.56 2c8t h LEU 24 N 1.17 0.00 -0.85 3.04 5.85 -0.87 -1.58 115.31 122.06 2c8t h LEU 24 Ca 0.38 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.99 2c8t h LEU 24 Cb 0.04 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 2c8t h LEU 24 CO -0.13 0.35 -0.52 0.25 -0.34 0.00 0.00 178.44 178.06 2c8t h LEU 25 N 0.00 0.00 0.00 2.25 5.85 0.29 -0.37 115.31 123.34 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 0.76 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.79 2c8t h LEU 25 CO 0.05 0.52 0.00 -1.20 -0.34 0.00 0.00 178.44 177.46 2c8t n SER 26 N -3.72 0.00 -1.48 1.25 7.64 -0.60 -2.02 113.62 114.68 2c8t n SER 26 Ca -0.01 0.46 0.08 0.00 1.01 0.00 0.00 58.87 60.41 2c8t n SER 26 Cb 0.57 -0.48 0.35 0.00 -1.01 0.00 0.00 64.21 63.63 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 -1.48 4.08 -4.08 1.43 -0.58 -0.92 -4.93 120.64 114.15 2c8t n GLU 27 Ca 0.05 -3.02 -0.34 0.00 -0.42 0.00 0.00 57.16 53.42 2c8t n GLU 27 Cb 0.20 -2.08 -0.01 0.00 -0.57 0.00 0.00 31.44 28.98 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 0.21 -3.61 -5.02 3.49 5.12 -0.86 -4.88 116.66 111.11 2c8t n ARG 28 Ca 0.25 0.42 -0.32 0.00 -1.93 0.00 0.00 57.85 56.27 2c8t n ARG 28 Cb 1.06 -5.18 -0.14 0.00 -1.16 0.00 0.00 32.46 27.03 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 -3.24 2.68 0.01 0.55 1.01 -0.19 -0.62 121.20 121.40 2c8t s ILE 29 Ca 0.70 -0.85 -0.02 0.00 0.00 0.00 0.00 60.65 60.48 2c8t s ILE 29 Cb -0.38 -2.03 -0.01 0.00 0.01 0.00 0.00 42.46 40.05 2c8t s ILE 29 CO 0.86 0.57 0.03 -0.63 0.00 0.00 0.00 174.94 175.77 2c8t s ILE 30 N -0.40 0.08 -0.04 2.92 1.01 0.70 -3.41 121.20 122.06 2c8t s ILE 30 Ca 0.04 -0.67 0.06 0.00 0.00 0.00 0.00 60.65 60.08 2c8t s ILE 30 Cb -0.12 -0.26 -0.01 0.00 0.01 0.00 0.00 42.46 42.08 2c8t s ILE 30 CO 0.02 -0.37 -0.23 -0.36 0.00 0.00 0.00 174.94 174.01 2c8t s PHE 31 N -1.13 2.15 -0.47 3.97 0.40 -1.26 -0.24 117.98 121.41 2c8t s PHE 31 Ca -0.12 -0.57 -0.03 0.00 -0.60 0.00 0.00 56.93 55.61 2c8t s PHE 31 Cb -0.07 -1.41 0.12 0.00 0.51 0.00 0.00 43.02 42.17 2c8t s PHE 31 CO -0.00 -0.15 0.27 -1.17 0.70 0.00 0.00 175.22 174.87 2c8t s LEU 32 N -0.23 5.27 -0.06 -0.37 2.96 -0.07 -4.94 118.68 121.24 2c8t s LEU 32 Ca 0.00 -2.23 0.10 0.00 -0.22 0.00 0.00 54.13 51.78 2c8t s LEU 32 Cb -0.12 -1.84 0.23 0.00 0.50 0.00 0.00 46.19 44.96 2c8t s LEU 32 CO 0.02 -0.51 1.16 0.61 -1.32 0.00 0.00 176.35 176.32 2c8t n GLY 33 N 4.33 3.62 0.27 7.98 0.00 -1.26 -0.80 105.19 119.33 2c8t n GLY 33 Ca 0.00 -0.55 -0.01 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 -0.53 -0.15 -4.70 1.61 3.41 -1.24 -4.77 113.62 107.24 2c8t n SER 34 Ca 0.10 -1.10 -0.64 0.00 -0.26 0.00 0.00 58.87 56.97 2c8t n SER 34 Cb 0.50 0.26 -0.09 0.00 -0.26 0.00 0.00 64.21 64.62 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 -0.04 0.33 -2.15 4.33 4.07 -1.26 -4.31 120.64 121.61 2c8t n GLU 35 Ca -0.01 0.12 -0.30 0.00 -0.06 0.00 0.00 57.16 56.92 2c8t n GLU 35 Cb 0.04 -1.67 -0.05 0.00 -0.06 0.00 0.00 31.44 29.70 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 2.61 3.58 0.49 6.31 1.01 0.31 -4.85 120.40 129.87 2c8t s VAL 36 Ca 1.01 -0.74 0.07 0.00 0.00 0.00 0.00 61.98 62.31 2c8t s VAL 36 Cb -1.34 -4.41 0.01 0.00 0.00 0.00 0.00 36.38 30.64 2c8t s VAL 36 CO 0.73 -1.14 0.40 0.54 0.00 0.00 0.00 175.10 175.63 2c8t s ASN 37 N 6.86 4.78 0.18 3.32 4.22 -1.26 -0.70 114.94 132.34 2c8t s ASN 37 Ca 0.66 -1.04 -0.13 0.00 -2.14 0.00 0.00 52.86 50.22 2c8t s ASN 37 Cb -0.03 -0.01 0.15 0.00 1.28 0.00 0.00 41.25 42.64 2c8t s ASN 37 CO 0.04 -0.91 1.78 0.44 -2.04 0.00 0.00 177.10 176.41 2c8t h ASP 38 N 0.87 0.36 0.39 3.54 3.32 -1.95 0.11 116.42 123.07 2c8t h ASP 38 Ca -0.38 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 56.69 2c8t h ASP 38 Cb 1.28 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 40.77 2c8t h ASP 38 CO 0.57 0.25 -0.43 -0.08 -1.72 0.00 0.00 179.24 177.83 2c8t h GLU 39 N 0.50 -0.82 -0.72 3.56 4.57 -1.97 0.30 114.58 120.00 2c8t h GLU 39 Ca 0.23 0.06 0.04 0.00 -1.18 0.00 0.00 59.36 58.51 2c8t h GLU 39 Cb 0.15 0.19 -0.05 0.00 -0.16 0.00 0.00 28.75 28.88 2c8t h GLU 39 CO -0.17 -0.55 0.43 0.82 -1.18 0.00 0.00 179.01 178.37 2c8t h ILE 40 N -0.85 1.05 -0.01 2.32 2.04 -1.84 -1.39 117.51 118.81 2c8t h ILE 40 Ca -0.03 -0.28 0.03 0.00 1.00 0.00 0.00 64.86 65.57 2c8t h ILE 40 Cb 0.77 0.15 -0.03 0.00 -0.74 0.00 0.00 36.82 36.96 2c8t h ILE 40 CO -0.09 0.15 -0.16 0.00 0.00 0.00 0.00 178.15 178.05 2c8t h ALA 41 N 1.33 -0.18 -0.43 1.87 0.00 -0.37 0.98 119.26 122.47 2c8t h ALA 41 Ca 0.30 0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.31 2c8t h ALA 41 Cb 0.10 0.28 -0.07 0.00 0.00 0.00 0.00 17.79 18.10 2c8t h ALA 41 CO -0.14 -0.65 -0.03 -0.91 0.00 0.00 0.00 179.25 177.52 2c8t h ASN 42 N -0.26 -0.25 -0.88 0.00 2.35 -0.13 -0.37 115.58 116.04 2c8t h ASN 42 Ca 0.06 0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.90 2c8t h ASN 42 Cb 0.33 0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.87 2c8t h ASN 42 CO -0.16 -0.08 0.49 -0.09 -1.65 0.00 0.00 177.43 175.93 2c8t h ARG 43 N 0.07 1.23 -0.17 0.81 2.43 -0.36 0.72 114.38 119.12 2c8t h ARG 43 Ca 0.21 -0.14 -0.02 0.00 -0.81 0.00 0.00 59.98 59.22 2c8t h ARG 43 Cb 0.32 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 2c8t h ARG 43 CO -0.39 0.90 0.01 -0.07 -1.51 0.00 0.00 179.97 178.92 2c8t h LEU 44 N 1.23 0.28 -0.57 3.80 3.38 -0.25 -0.48 115.31 122.70 2c8t h LEU 44 Ca 0.31 -0.28 0.09 0.00 0.09 0.00 0.00 57.88 58.09 2c8t h LEU 44 Cb 0.02 -0.08 -0.07 0.00 0.09 0.00 0.00 40.66 40.63 2c8t h LEU 44 CO -0.05 0.50 0.19 0.00 0.09 0.00 0.00 178.44 179.17 2c8t h ALA 46 N 1.40 0.32 -0.50 0.00 0.00 -0.66 0.82 119.26 120.64 2c8t h ALA 46 Ca 0.29 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.28 2c8t h ALA 46 Cb 0.36 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2c8t h ALA 46 CO -0.31 -0.35 0.31 1.96 0.00 0.00 0.00 179.25 180.86 2c8t h GLN 47 N 0.16 0.60 -0.60 0.00 4.20 -0.06 -0.79 115.11 118.63 2c8t h GLN 47 Ca 0.14 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.80 2c8t h GLN 47 Cb 0.16 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 27.78 2c8t h GLN 47 CO -0.20 0.40 0.31 0.82 -0.67 0.00 0.00 178.83 179.49 2c8t h ILE 48 N 0.62 1.20 -0.35 2.54 2.04 -0.25 -1.92 117.51 121.40 2c8t h ILE 48 Ca 0.20 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 2c8t h ILE 48 Cb -0.01 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 2c8t h ILE 48 CO -0.08 0.22 0.18 -0.07 0.00 0.00 0.00 178.15 178.41 2c8t h LEU 49 N 0.81 0.44 -0.00 1.44 3.38 -0.43 -1.09 115.31 119.87 2c8t h LEU 49 Ca 0.21 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.10 2c8t h LEU 49 Cb 0.08 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2c8t h LEU 49 CO -0.03 0.42 -0.12 0.25 0.09 0.00 0.00 178.44 179.04 2c8t h LEU 50 N 0.43 -0.36 -0.30 1.67 5.85 -0.98 -0.04 115.31 121.58 2c8t h LEU 50 Ca 0.12 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 2c8t h LEU 50 Cb 0.08 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 2c8t h LEU 50 CO -0.02 -0.18 0.15 -0.07 -0.34 0.00 0.00 178.44 177.99 2c8t h LEU 51 N -0.21 0.39 -0.95 2.25 3.38 -1.20 0.55 115.31 119.50 2c8t h LEU 51 Ca 0.04 -0.11 0.06 0.00 0.09 0.00 0.00 57.88 57.97 2c8t h LEU 51 Cb 0.27 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.85 2c8t h LEU 51 CO -0.12 0.38 0.61 0.00 0.09 0.00 0.00 178.44 179.40 2c8t h ALA 52 N 1.02 1.32 -0.07 1.53 0.00 -1.05 -1.71 119.26 120.30 2c8t h ALA 52 Ca 0.10 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 2c8t h ALA 52 Cb 0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2c8t h ALA 52 CO -0.01 0.39 -0.49 0.00 0.00 0.00 0.00 179.25 179.13 2c8t h ALA 53 N 1.44 1.05 -0.03 0.00 0.00 -0.25 -2.83 119.26 118.64 2c8t h ALA 53 Ca 0.41 -0.46 -0.18 0.00 0.00 0.00 0.00 54.91 54.68 2c8t h ALA 53 Cb 0.16 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2c8t h ALA 53 CO -0.17 0.64 -0.76 0.93 0.00 0.00 0.00 179.25 179.89 2c8t h GLU 54 N 0.13 0.22 -0.81 0.00 5.08 -0.24 -3.43 114.58 115.53 2c8t h GLU 54 Ca 0.00 -0.20 0.15 0.00 -1.00 0.00 0.00 59.36 58.32 2c8t h GLU 54 Cb 0.92 0.05 -0.21 0.00 0.50 0.00 0.00 28.75 30.01 2c8t h GLU 54 CO 0.07 0.88 -0.09 0.34 -1.00 0.00 0.00 179.01 179.21 2c8t s ASP 55 N -6.92 -0.99 0.00 1.42 -1.08 -0.71 -5.05 116.67 103.35 2c8t s ASP 55 Ca -0.03 0.70 0.28 0.00 -0.52 0.00 0.00 52.55 52.98 2c8t s ASP 55 Cb 0.11 1.86 1.09 0.00 -1.46 0.00 0.00 42.92 44.53 2c8t s ASP 55 CO 0.82 -0.19 1.82 0.00 0.52 0.00 0.00 175.17 178.14 2c8t n ALA 56 N 5.42 2.61 -0.08 3.66 0.00 -1.08 -4.15 120.51 126.89 2c8t n ALA 56 Ca -0.04 -0.16 -0.19 0.00 0.00 0.00 0.00 53.44 53.05 2c8t n ALA 56 Cb 0.52 -1.39 -0.13 0.00 0.00 0.00 0.00 19.45 18.45 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 -1.48 1.94 -4.78 0.00 3.41 -1.26 -2.98 113.62 108.47 2c8t n SER 57 Ca 0.07 -0.01 -0.35 0.00 -0.26 0.00 0.00 58.87 58.32 2c8t n SER 57 Cb 0.33 -0.50 -0.01 0.00 -0.26 0.00 0.00 64.21 63.78 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 -2.53 3.53 0.82 4.33 1.02 -1.26 -4.72 119.74 120.93 2c8t s LYS 58 Ca -0.29 1.62 -0.10 0.00 0.02 0.00 0.00 55.97 57.21 2c8t s LYS 58 Cb 0.08 -2.13 0.09 0.00 -0.52 0.00 0.00 37.83 35.35 2c8t s LYS 58 CO 0.67 -0.71 1.11 -0.51 -0.92 0.00 0.00 175.35 174.99 2c8t s ASP 59 N -1.69 3.96 -0.08 2.83 1.01 -1.26 -4.59 116.67 116.85 2c8t s ASP 59 Ca 0.69 1.92 0.04 0.00 0.71 0.00 0.00 52.55 55.92 2c8t s ASP 59 Cb -0.24 -2.52 -0.01 0.00 1.01 0.00 0.00 42.92 41.16 2c8t s ASP 59 CO 0.28 -2.40 -0.21 -0.63 0.21 0.00 0.00 175.17 172.41 2c8t s ILE 60 N -2.82 2.34 -0.22 0.77 1.01 -0.65 -4.86 121.20 116.76 2c8t s ILE 60 Ca 0.63 -0.94 -0.09 0.00 0.00 0.00 0.00 60.65 60.25 2c8t s ILE 60 Cb -0.19 -1.90 -0.04 0.00 0.01 0.00 0.00 42.46 40.34 2c8t s ILE 60 CO 0.57 0.56 0.11 -0.44 0.00 0.00 0.00 174.94 175.73 2c8t s SER 61 N 0.02 5.72 -0.22 3.58 0.01 0.21 -0.45 113.70 122.58 2c8t s SER 61 Ca -0.08 0.02 -0.01 0.00 1.31 0.00 0.00 55.95 57.20 2c8t s SER 61 Cb -0.15 -2.02 0.02 0.00 0.21 0.00 0.00 66.02 64.08 2c8t s SER 61 CO 0.05 0.07 -0.12 -0.22 0.41 0.00 0.00 173.24 173.44 2c8t s LEU 62 N 0.98 2.71 -0.21 2.44 2.96 0.24 -0.21 118.68 127.59 2c8t s LEU 62 Ca 0.05 -0.72 -0.09 0.00 -0.22 0.00 0.00 54.13 53.16 2c8t s LEU 62 Cb -0.14 -1.60 -0.04 0.00 0.50 0.00 0.00 46.19 44.91 2c8t s LEU 62 CO 0.03 -0.06 0.11 -0.31 -1.32 0.00 0.00 176.35 174.80 2c8t s TYR 63 N 1.33 3.29 -0.20 5.38 1.51 0.67 -1.08 117.35 128.25 2c8t s TYR 63 Ca 0.03 0.14 -0.00 0.00 -1.01 0.00 0.00 57.07 56.22 2c8t s TYR 63 Cb -0.15 -2.17 0.02 0.00 -0.11 0.00 0.00 41.96 39.55 2c8t s TYR 63 CO -0.08 0.11 -0.15 0.42 -1.11 0.00 0.00 175.55 174.75 2c8t s ILE 64 N 0.69 2.45 -0.41 2.71 1.01 0.13 -0.89 121.20 126.89 2c8t s ILE 64 Ca 0.06 -0.87 0.04 0.00 0.00 0.00 0.00 60.65 59.87 2c8t s ILE 64 Cb -0.13 -2.09 0.17 0.00 0.01 0.00 0.00 42.46 40.42 2c8t s ILE 64 CO 0.01 0.46 0.36 0.21 0.00 0.00 0.00 174.94 175.98 2c8t s ASN 65 N 1.33 1.29 -0.05 3.58 2.47 0.02 -1.04 114.94 122.53 2c8t s ASN 65 Ca 0.04 -2.83 -0.04 0.00 0.42 0.00 0.00 52.86 50.45 2c8t s ASN 65 Cb -0.14 -0.20 0.02 0.00 -1.45 0.00 0.00 41.25 39.48 2c8t s ASN 65 CO -0.10 -0.18 0.13 -0.55 -3.72 0.00 0.00 177.10 172.69 2c8t s SER 66 N 0.26 -0.13 0.00 -4.21 0.15 0.89 -3.64 113.70 107.02 2c8t s SER 66 Ca 0.31 0.27 0.10 0.00 0.70 0.00 0.00 55.95 57.33 2c8t s SER 66 Cb 0.01 0.25 0.60 0.00 -1.71 0.00 0.00 66.02 65.17 2c8t s SER 66 CO -0.16 -0.07 1.33 -0.81 1.20 0.00 0.00 173.24 174.73 2c8t n PRO 67 N 3.26 0.93 0.00 5.44 -0.04 -1.26 -2.16 135.00 141.17 2c8t n PRO 67 Ca -0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 2c8t n PRO 67 Cb 0.58 -1.17 0.00 0.00 -0.04 0.00 0.00 33.50 32.87 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 0.58 -0.16 0.00 0.55 0.00 -1.09 -4.41 105.19 100.66 2c8t n GLY 68 Ca 0.08 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.92 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 -0.09 3.63 -0.02 0.00 -1.26 0.11 105.19 107.56 2c8t n GLY 69 Ca 0.00 -1.07 -0.49 0.00 0.00 0.00 0.00 46.02 44.46 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 2.35 0.27 1.61 2.88 0.13 -4.53 113.62 116.33 2c8t n SER 70 Ca 0.00 1.11 -0.16 0.00 -1.33 0.00 0.00 58.87 58.48 2c8t n SER 70 Cb 0.00 -1.31 -0.08 0.00 -0.75 0.00 0.00 64.21 62.07 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 3.40 0.37 -0.54 2.46 2.04 -1.99 -0.96 117.51 122.29 2c8t h ILE 71 Ca -0.46 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.36 2c8t h ILE 71 Cb 1.30 0.37 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 2c8t h ILE 71 CO 0.82 0.00 0.17 0.77 0.00 0.00 0.00 178.15 179.91 2c8t h SER 72 N -0.74 0.74 -0.02 1.72 4.64 -1.96 0.34 113.55 118.26 2c8t h SER 72 Ca -0.05 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 2c8t h SER 72 Cb 0.62 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 62.52 2c8t h SER 72 CO 0.04 0.70 0.00 0.00 -0.87 0.00 0.00 176.83 176.70 2c8t h ALA 73 N 1.40 0.02 -0.22 5.18 0.00 -1.89 -0.32 119.26 123.43 2c8t h ALA 73 Ca 0.18 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 2c8t h ALA 73 Cb 0.23 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2c8t h ALA 73 CO -0.01 -0.49 -0.01 0.78 0.00 0.00 0.00 179.25 179.52 2c8t h GLY 74 N 0.01 0.35 1.50 0.00 0.00 0.09 -2.71 103.07 102.32 2c8t h GLY 74 Ca 0.01 -0.19 -0.16 0.00 0.00 0.00 0.00 47.33 46.99 2c8t h GLY 74 CO -0.02 0.18 -0.56 1.98 0.00 0.00 0.00 176.54 178.12 2c8t h MET 75 N 0.32 0.52 -0.39 4.80 -1.53 0.14 -0.88 114.93 117.91 2c8t h MET 75 Ca 0.07 -0.33 0.03 0.00 -3.44 0.00 0.00 59.70 56.03 2c8t h MET 75 Cb 0.24 0.04 -0.03 0.00 -0.55 0.00 0.00 31.60 31.30 2c8t h MET 75 CO 0.01 0.94 0.21 0.00 0.14 0.00 0.00 176.91 178.20 2c8t h ALA 76 N 0.99 0.49 -0.33 0.39 0.00 -0.83 0.92 119.26 120.89 2c8t h ALA 76 Ca 0.00 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2c8t h ALA 76 Cb 1.10 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 2c8t h ALA 76 CO 0.10 -0.15 0.18 0.82 0.00 0.00 0.00 179.25 180.20 2c8t h ILE 77 N 0.42 1.01 -0.22 0.00 2.04 -1.17 -2.09 117.51 117.50 2c8t h ILE 77 Ca 0.16 -0.12 0.05 0.00 1.00 0.00 0.00 64.86 65.95 2c8t h ILE 77 Cb 0.05 0.61 -0.05 0.00 -0.74 0.00 0.00 36.82 36.70 2c8t h ILE 77 CO -0.10 0.07 -0.08 0.22 0.00 0.00 0.00 178.15 178.25 2c8t h TYR 78 N 0.36 -0.18 -0.64 1.37 3.20 -0.71 -0.57 116.97 119.80 2c8t h TYR 78 Ca 0.14 0.02 0.08 0.00 3.14 0.00 0.00 58.73 62.11 2c8t h TYR 78 Cb 0.03 0.11 -0.07 0.00 1.54 0.00 0.00 36.73 38.35 2c8t h TYR 78 CO -0.09 -0.13 0.29 -0.44 -1.64 0.00 0.00 178.16 176.16 2c8t h ASP 79 N -0.04 0.36 -0.81 -2.11 3.32 -0.53 -0.34 116.42 116.28 2c8t h ASP 79 Ca 0.11 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 2c8t h ASP 79 Cb 0.21 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.72 2c8t h ASP 79 CO -0.25 0.22 0.44 0.74 -1.72 0.00 0.00 179.24 178.67 2c8t h THR 80 N 0.52 1.24 -0.24 0.35 2.02 -0.72 0.25 112.91 116.32 2c8t h THR 80 Ca 0.31 -0.60 0.04 0.00 0.77 0.00 0.00 66.41 66.93 2c8t h THR 80 Cb 0.33 0.17 -0.04 0.00 -1.74 0.00 0.00 68.15 66.87 2c8t h THR 80 CO -0.26 0.27 0.02 0.24 0.37 0.00 0.00 175.52 176.16 2c8t h MET 81 N 1.12 0.10 -0.24 6.66 2.86 0.04 0.54 114.93 126.01 2c8t h MET 81 Ca 0.28 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.91 2c8t h MET 81 Cb 0.04 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.66 2c8t h MET 81 CO -0.05 0.07 0.13 0.28 1.06 0.00 0.00 176.91 178.40 2c8t h VAL 82 N 0.10 1.13 -0.38 -2.22 2.07 -0.52 -2.98 116.25 113.45 2c8t h VAL 82 Ca 0.11 -0.34 0.08 0.00 0.82 0.00 0.00 66.70 67.37 2c8t h VAL 82 Cb 0.13 0.91 -0.08 0.00 -1.52 0.00 0.00 31.29 30.73 2c8t h VAL 82 CO -0.17 0.12 -0.12 0.25 0.02 0.00 0.00 177.57 177.67 2c8t h LEU 83 N 0.28 -0.43 -9.45 2.57 5.85 -0.18 -3.41 115.31 110.54 2c8t h LEU 83 Ca 0.09 0.12 -0.53 0.00 0.84 0.00 0.00 57.88 58.40 2c8t h LEU 83 Cb 0.08 0.27 0.03 0.00 0.37 0.00 0.00 40.66 41.41 2c8t h LEU 83 CO -0.01 -0.15 1.17 0.00 -0.34 0.00 0.00 178.44 179.11 2c8t n ALA 84 N -2.73 1.96 -0.00 1.25 0.00 0.15 -4.85 120.51 116.29 2c8t n ALA 84 Ca 0.02 0.27 0.10 0.00 0.00 0.00 0.00 53.44 53.83 2c8t n ALA 84 Cb 0.23 -2.64 0.52 0.00 0.00 0.00 0.00 19.45 17.56 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 9.52 0.34 -7.22 0.00 0.11 -1.83 -3.44 132.00 129.48 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 -0.08 0.04 0.00 0.11 0.00 0.00 31.00 32.30 2c8t h PRO 85 CO 0.95 0.22 0.34 0.00 -0.21 0.00 0.00 178.00 179.30 2c8t s ASP 87 N -3.83 5.11 -0.24 0.00 1.01 -1.26 -4.89 116.67 112.57 2c8t s ASP 87 Ca 0.55 2.52 0.02 0.00 0.71 0.00 0.00 52.55 56.34 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 0.46 -1.66 -0.08 -0.63 0.21 0.00 0.00 175.17 173.47 2c8t s ILE 88 N -1.48 1.78 0.18 0.77 1.01 -1.26 -1.64 121.20 120.56 2c8t s ILE 88 Ca 0.77 -1.38 -0.28 0.00 0.00 0.00 0.00 60.65 59.76 2c8t s ILE 88 Cb -0.34 -1.98 -0.08 0.00 0.01 0.00 0.00 42.46 40.07 2c8t s ILE 88 CO 0.38 -0.07 0.87 0.00 0.00 0.00 0.00 174.94 176.12 2c8t s ALA 89 N 1.28 3.37 -0.08 9.38 0.00 0.41 -1.30 121.76 134.82 2c8t s ALA 89 Ca -0.07 0.49 0.05 0.00 0.00 0.00 0.00 51.96 52.42 2c8t s ALA 89 Cb -0.19 -3.11 -0.00 0.00 0.00 0.00 0.00 23.12 19.82 2c8t s ALA 89 CO -0.06 0.19 -0.23 0.99 0.00 0.00 0.00 175.76 176.65 2c8t s THR 90 N -0.89 1.95 -0.16 0.00 2.01 -0.30 -0.59 115.64 117.65 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 -0.24 -1.68 0.04 0.00 0.01 0.00 0.00 72.50 70.63 2c8t s THR 90 CO 0.29 0.54 -0.08 -0.31 -0.69 0.00 0.00 174.62 174.36 2c8t s TYR 91 N 0.17 1.91 -0.40 4.92 1.51 -0.24 0.98 117.35 126.21 2c8t s TYR 91 Ca -0.12 -1.17 -0.27 0.00 -1.01 0.00 0.00 57.07 54.50 2c8t s TYR 91 Cb -0.16 -1.42 0.02 0.00 -0.11 0.00 0.00 41.96 40.29 2c8t s TYR 91 CO 0.06 -0.64 1.01 0.00 -1.11 0.00 0.00 175.55 174.87 2c8t s ALA 92 N 1.57 3.35 -0.29 3.71 0.00 0.36 0.21 121.76 130.66 2c8t s ALA 92 Ca 0.02 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.57 2c8t s ALA 92 Cb -0.15 -3.66 0.09 0.00 0.00 0.00 0.00 23.12 19.40 2c8t s ALA 92 CO -0.08 -1.79 0.04 1.41 0.00 0.00 0.00 175.76 175.34 2c8t s MET 93 N 3.78 1.09 1.42 0.00 0.00 -0.21 -1.14 119.30 124.24 2c8t s MET 93 Ca 0.42 -1.15 0.00 0.00 0.00 0.00 0.00 55.69 54.96 2c8t s MET 93 Cb -0.11 -2.40 0.00 0.00 0.00 0.00 0.00 34.83 32.32 2c8t s MET 93 CO 0.22 -0.84 0.00 0.41 0.00 0.00 0.00 175.02 174.81 2c8t n GLY 94 N 4.70 1.39 2.85 2.11 0.00 -1.26 -3.81 105.19 111.17 2c8t n GLY 94 Ca -0.04 -0.42 -0.17 0.00 0.00 0.00 0.00 46.02 45.39 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 0.36 -0.32 1.61 -2.45 -1.26 -0.40 119.30 116.84 2c8t s MET 95 Ca 0.00 0.01 0.04 0.00 -1.25 0.00 0.00 55.69 54.49 2c8t s MET 95 Cb 0.00 -0.47 0.09 0.00 1.25 0.00 0.00 34.83 35.69 2c8t s MET 95 CO 0.00 -0.08 0.00 0.00 1.05 0.00 0.00 175.02 175.99 2c8t s ALA 96 N 0.76 2.79 0.17 4.11 0.00 -0.82 -0.08 121.76 128.69 2c8t s ALA 96 Ca -0.08 -2.30 0.11 0.00 0.00 0.00 0.00 51.96 49.69 2c8t s ALA 96 Cb -0.11 -1.85 -0.04 0.00 0.00 0.00 0.00 23.12 21.11 2c8t s ALA 96 CO -0.01 -1.55 -0.25 0.00 0.00 0.00 0.00 175.76 173.95 2c8t s ALA 97 N 0.97 2.49 0.00 0.00 0.00 -0.92 -0.72 121.76 123.58 2c8t s ALA 97 Ca 0.05 -1.58 0.00 0.00 0.00 0.00 0.00 51.96 50.44 2c8t s ALA 97 Cb -0.19 -0.36 0.00 0.00 0.00 0.00 0.00 23.12 22.57 2c8t s ALA 97 CO -0.07 0.47 0.00 0.43 0.00 0.00 0.00 175.76 176.59 2c8t n SER 98 N 0.50 0.00 0.29 0.00 7.64 -0.63 0.51 113.62 121.94 2c8t n SER 98 Ca -0.14 0.00 0.16 0.00 1.01 0.00 0.00 58.87 59.90 2c8t n SER 98 Cb 0.55 0.00 0.88 0.00 -1.01 0.00 0.00 64.21 64.62 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 -0.23 1.43 0.00 -1.86 0.46 114.93 114.73 2c8t h MET 99 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 59.70 59.51 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 -0.60 0.78 0.00 0.00 0.00 176.91 177.09 2c8t h GLY 100 N 0.00 0.83 0.76 8.32 0.00 -0.20 -1.11 103.07 111.67 2c8t h GLY 100 Ca 0.00 -1.02 -0.01 0.00 0.00 0.00 0.00 47.33 46.30 2c8t h GLY 100 CO 0.00 0.91 0.01 -2.09 0.00 0.00 0.00 176.54 175.37 2c8t h GLU 101 N 0.57 0.08 -0.52 4.80 4.22 0.06 -1.56 114.58 122.23 2c8t h GLU 101 Ca -0.00 -0.02 0.10 0.00 0.08 0.00 0.00 59.36 59.52 2c8t h GLU 101 Cb 1.20 -0.01 -0.10 0.00 0.50 0.00 0.00 28.75 30.34 2c8t h GLU 101 CO 0.13 0.33 -0.11 0.35 -2.18 0.00 0.00 179.01 177.52 2c8t h PHE 102 N -0.17 -0.25 -0.33 0.92 3.57 -1.20 0.10 116.94 119.58 2c8t h PHE 102 Ca 0.01 0.05 -0.14 0.00 3.53 0.00 0.00 57.97 61.42 2c8t h PHE 102 Cb 0.29 0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.21 2c8t h PHE 102 CO 0.02 -0.21 -0.36 -0.07 -2.23 0.00 0.00 178.31 175.45 2c8t h LEU 103 N 0.01 0.79 -0.06 0.59 3.38 -1.18 -0.36 115.31 118.48 2c8t h LEU 103 Ca 0.25 -0.34 0.04 0.00 0.09 0.00 0.00 57.88 57.92 2c8t h LEU 103 Cb 0.39 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 2c8t h LEU 103 CO -0.53 1.07 -0.27 0.25 0.09 0.00 0.00 178.44 179.05 2c8t h LEU 104 N 0.63 -0.83 -1.99 1.67 5.85 -0.15 -2.20 115.31 118.28 2c8t h LEU 104 Ca 0.06 0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 2c8t h LEU 104 Cb 0.90 0.35 -0.00 0.00 0.37 0.00 0.00 40.66 42.28 2c8t h LEU 104 CO 0.08 -0.33 -0.09 0.00 -0.34 0.00 0.00 178.44 177.76 2c8t h ALA 105 N 0.46 1.58 -0.00 1.25 0.00 -0.48 -2.78 119.26 119.29 2c8t h ALA 105 Ca 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2c8t h ALA 105 Cb 0.50 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2c8t h ALA 105 CO -0.28 0.11 -0.01 0.00 0.00 0.00 0.00 179.25 179.08 2c8t n ALA 106 N -2.40 2.61 -1.07 0.00 0.00 -0.18 -4.87 120.51 114.60 2c8t n ALA 106 Ca -0.02 -0.19 -0.33 0.00 0.00 0.00 0.00 53.44 52.90 2c8t n ALA 106 Cb 0.18 -1.49 0.13 0.00 0.00 0.00 0.00 19.45 18.27 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 -2.26 2.08 -0.24 0.00 0.00 -1.05 -4.87 107.32 100.98 2c8t s GLY 107 Ca 0.39 0.79 -0.40 0.00 0.00 0.00 0.00 44.72 45.50 2c8t s GLY 107 CO 0.41 1.21 1.69 2.41 0.00 0.00 0.00 173.10 178.82 2c8t n THR 108 N -3.41 0.26 -1.62 0.90 -1.04 -0.42 -4.85 114.28 104.10 2c8t n THR 108 Ca 0.13 -0.05 -0.49 0.00 -2.04 0.00 0.00 64.05 61.60 2c8t n THR 108 Cb 0.51 -1.15 -0.05 0.00 -1.82 0.00 0.00 70.33 67.82 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 4.99 1.56 0.00 -2.82 5.02 -1.26 -0.26 118.16 125.40 2c8t n LYS 109 Ca 0.26 0.56 0.00 0.00 -2.02 0.00 0.00 58.31 57.11 2c8t n LYS 109 Cb 0.13 -2.23 0.00 0.00 -0.02 0.00 0.00 35.03 32.91 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 2.73 2.59 1.67 0.72 0.00 -1.26 -4.89 105.19 106.75 2c8t n GLY 110 Ca 0.17 0.00 -0.17 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 -0.03 2.95 -3.74 1.61 5.02 0.65 -4.86 118.16 119.77 2c8t n LYS 111 Ca 0.00 -3.83 -0.37 0.00 -2.02 0.00 0.00 58.31 52.09 2c8t n LYS 111 Cb 0.00 -2.10 -0.12 0.00 -0.02 0.00 0.00 35.03 32.78 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 -3.51 3.63 0.12 1.97 0.52 -1.24 -1.15 118.95 119.28 2c8t s ARG 112 Ca 0.49 -0.49 0.11 0.00 -0.52 0.00 0.00 55.73 55.31 2c8t s ARG 112 Cb 0.41 -3.35 -0.04 0.00 0.52 0.00 0.00 34.95 32.49 2c8t s ARG 112 CO 0.01 -0.21 -0.26 0.71 0.02 0.00 0.00 175.30 175.57 2c8t s TYR 113 N 1.62 2.32 -0.06 -0.53 1.51 0.28 0.29 117.35 122.78 2c8t s TYR 113 Ca 0.06 -0.38 0.04 0.00 -1.01 0.00 0.00 57.07 55.79 2c8t s TYR 113 Cb -0.15 -1.28 -0.00 0.00 -0.11 0.00 0.00 41.96 40.42 2c8t s TYR 113 CO 0.04 0.31 -0.20 0.00 -1.11 0.00 0.00 175.55 174.59 2c8t s ALA 114 N -1.02 1.80 0.53 3.71 0.00 -0.52 -0.49 121.76 125.76 2c8t s ALA 114 Ca 0.14 -0.81 -0.17 0.00 0.00 0.00 0.00 51.96 51.12 2c8t s ALA 114 Cb -0.10 -0.63 -0.07 0.00 0.00 0.00 0.00 23.12 22.33 2c8t s ALA 114 CO 0.06 0.29 1.02 -0.51 0.00 0.00 0.00 175.76 176.62 2c8t s LEU 115 N 0.15 3.65 0.36 0.00 1.43 -0.29 -2.01 118.68 121.97 2c8t s LEU 115 Ca -0.09 1.74 0.11 0.00 -1.03 0.00 0.00 54.13 54.86 2c8t s LEU 115 Cb -0.14 -4.53 0.89 0.00 0.03 0.00 0.00 46.19 42.44 2c8t s LEU 115 CO 0.04 -0.81 1.83 -0.65 0.23 0.00 0.00 176.35 176.99 2c8t h PRO 116 N 0.97 0.59 -0.41 1.29 0.11 -1.91 0.73 132.00 133.37 2c8t h PRO 116 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 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 0.59 0.39 0.00 0.72 -0.21 0.00 0.00 178.00 179.50 2c8t n HIS 117 N -4.61 0.54 -1.47 0.65 8.25 -1.26 -4.33 115.22 112.99 2c8t n HIS 117 Ca 0.20 -0.32 -0.36 0.00 -0.26 0.00 0.00 57.72 56.99 2c8t n HIS 117 Cb 0.60 -0.01 0.09 0.00 1.12 0.00 0.00 29.99 31.80 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 1.26 0.56 -3.00 -1.41 0.00 0.25 -4.77 120.51 113.40 2c8t n ALA 118 Ca 0.18 -0.14 -0.11 0.00 0.00 0.00 0.00 53.44 53.37 2c8t n ALA 118 Cb 0.54 -2.27 -0.12 0.00 0.00 0.00 0.00 19.45 17.61 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 -3.61 0.24 -0.17 0.00 1.70 0.46 -3.27 118.95 114.30 2c8t s ARG 119 Ca 0.78 -0.16 -0.04 0.00 -0.47 0.00 0.00 55.73 55.84 2c8t s ARG 119 Cb -0.35 0.10 -0.03 0.00 -0.57 0.00 0.00 34.95 34.10 2c8t s ARG 119 CO 0.45 -0.04 -0.02 0.42 -1.08 0.00 0.00 175.30 175.02 2c8t s ILE 120 N -0.62 3.96 -0.19 4.99 1.09 -0.58 -1.94 121.20 127.92 2c8t s ILE 120 Ca -0.07 -0.33 -0.01 0.00 -1.10 0.00 0.00 60.65 59.14 2c8t s ILE 120 Cb -0.04 -2.75 0.01 0.00 -1.06 0.00 0.00 42.46 38.61 2c8t s ILE 120 CO 0.00 0.48 -0.13 -0.76 -0.10 0.00 0.00 174.94 174.42 2c8t s LEU 121 N 0.51 2.47 0.25 2.97 2.01 0.11 0.37 118.68 127.37 2c8t s LEU 121 Ca -0.02 -0.52 -0.14 0.00 0.01 0.00 0.00 54.13 53.45 2c8t s LEU 121 Cb -0.14 -1.59 -0.08 0.00 0.01 0.00 0.00 46.19 44.39 2c8t s LEU 121 CO 0.02 0.01 0.66 -0.04 1.01 0.00 0.00 176.35 178.01 2c8t s MET 122 N 1.26 4.00 -0.25 1.70 -1.94 -0.59 -1.60 119.30 121.88 2c8t s MET 122 Ca 0.03 0.58 -0.11 0.00 -1.71 0.00 0.00 55.69 54.48 2c8t s MET 122 Cb -0.14 -2.65 0.09 0.00 2.01 0.00 0.00 34.83 34.15 2c8t s MET 122 CO -0.07 0.29 0.58 -1.58 -0.01 0.00 0.00 175.02 174.23 2c8t s HIS 123 N -1.77 -1.01 -0.30 -0.03 5.04 -1.26 -3.98 115.29 111.97 2c8t s HIS 123 Ca 0.48 1.93 -0.31 0.00 -1.54 0.00 0.00 55.06 55.61 2c8t s HIS 123 Cb -0.12 0.56 -0.08 0.00 0.04 0.00 0.00 32.58 32.97 2c8t s HIS 123 CO 0.19 -0.53 2.22 0.94 -2.34 0.00 0.00 174.74 175.23 2c8t n GLN 124 N 4.82 1.48 -3.02 2.88 -0.06 -0.78 -4.78 117.38 117.93 2c8t n GLN 124 Ca -0.16 0.39 -0.33 0.00 -2.00 0.00 0.00 57.00 54.89 2c8t n GLN 124 Cb 0.54 -2.87 -0.06 0.00 -4.06 0.00 0.00 30.24 23.78 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 6.42 4.13 0.00 3.69 0.04 -1.26 -5.04 135.00 142.98 2c8t s PRO 125 Ca 1.05 0.86 0.00 0.00 0.04 0.00 0.00 61.00 62.96 2c8t s PRO 125 Cb -0.58 -2.41 0.00 0.00 0.04 0.00 0.00 34.50 31.55 2c8t s PRO 125 CO 0.41 0.13 0.00 1.28 0.04 0.00 0.00 177.00 178.86 2c8t n LEU 126 N -0.30 0.00 -0.10 -3.56 4.77 -1.26 -5.09 117.00 111.45 2c8t n LEU 126 Ca 0.04 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.86 2c8t n LEU 126 Cb 0.53 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.57 2c8t n LEU 126 CO 0.40 0.00 -0.92 -0.38 -1.33 0.00 0.00 177.39 175.16 2c8t n ILE 136 N 0.00 1.48 -0.32 -0.08 5.41 -1.26 -5.17 119.36 119.41 2c8t n ILE 136 Ca 0.00 -0.03 0.05 0.00 1.00 0.00 0.00 62.75 63.76 2c8t n ILE 136 Cb 0.00 -2.16 0.23 0.00 -0.71 0.00 0.00 39.64 37.01 2c8t n ILE 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2c8t h ALA 137 N -0.96 1.51 -0.40 -1.39 0.00 -2.06 -1.77 119.26 114.19 2c8t h ALA 137 Ca -0.24 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.57 2c8t h ALA 137 Cb 1.18 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2c8t h ALA 137 CO -0.15 0.33 -0.07 0.82 0.00 0.00 0.00 179.25 180.19 2c8t h ILE 138 N 1.04 1.27 -0.09 0.00 5.03 -2.06 -2.83 117.51 119.87 2c8t h ILE 138 Ca 0.41 -1.14 -0.06 0.00 -0.12 0.00 0.00 64.86 63.96 2c8t h ILE 138 Cb 0.25 1.19 -0.01 0.00 -3.03 0.00 0.00 36.82 35.22 2c8t h ILE 138 CO -0.17 0.38 -0.21 1.56 -0.68 0.00 0.00 178.15 179.03 2c8t h GLN 139 N 0.57 0.15 0.02 2.37 4.20 -1.86 -2.74 115.11 117.83 2c8t h GLN 139 Ca 0.11 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.77 2c8t h GLN 139 Cb 0.58 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.34 2c8t h GLN 139 CO 0.03 0.36 -0.01 0.00 -0.67 0.00 0.00 178.83 178.55 2c8t h ALA 140 N 1.65 -0.02 -0.33 3.87 0.00 -1.13 -0.57 119.26 122.72 2c8t h ALA 140 Ca 0.03 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 54.96 2c8t h ALA 140 Cb 0.46 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.19 2c8t h ALA 140 CO 0.03 -0.47 -0.12 0.93 0.00 0.00 0.00 179.25 179.62 2c8t h GLU 141 N -0.11 -0.06 -0.05 0.00 5.08 -1.34 0.54 114.58 118.64 2c8t h GLU 141 Ca -0.00 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2c8t h GLU 141 Cb 0.11 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2c8t h GLU 141 CO 0.00 -0.04 -0.04 1.96 -1.00 0.00 0.00 179.01 179.90 2c8t h GLN 142 N -0.06 -0.04 -0.41 2.33 4.20 -1.37 -1.57 115.11 118.19 2c8t h GLN 142 Ca 0.16 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.90 2c8t h GLN 142 Cb 0.31 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.07 2c8t h GLN 142 CO -0.37 -0.03 0.22 0.35 -0.67 0.00 0.00 178.83 178.33 2c8t h PHE 143 N -0.04 0.40 -0.24 2.96 3.57 -0.69 -0.69 116.94 122.21 2c8t h PHE 143 Ca 0.03 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.60 2c8t h PHE 143 Cb 0.09 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 38.67 2c8t h PHE 143 CO -0.13 0.22 -0.04 0.00 -2.23 0.00 0.00 178.31 176.12 2c8t h ALA 144 N 1.20 0.18 -0.39 2.41 0.00 -0.70 0.18 119.26 122.14 2c8t h ALA 144 Ca 0.17 0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.19 2c8t h ALA 144 Cb 0.06 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2c8t h ALA 144 CO -0.11 -0.45 0.20 0.28 0.00 0.00 0.00 179.25 179.17 2c8t h VAL 145 N 0.03 0.98 0.00 0.00 2.07 -0.96 -2.03 116.25 116.33 2c8t h VAL 145 Ca 0.11 -0.14 -0.14 0.00 0.82 0.00 0.00 66.70 67.35 2c8t h VAL 145 Cb 0.17 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 2c8t h VAL 145 CO -0.23 0.07 -0.68 -0.29 0.02 0.00 0.00 177.57 176.47 2c8t h ILE 146 N 0.40 1.33 -0.19 4.57 2.10 -0.64 -2.47 117.51 122.60 2c8t h ILE 146 Ca 0.17 -2.46 -0.05 0.00 1.08 0.00 0.00 64.86 63.60 2c8t h ILE 146 Cb 0.07 2.39 -0.00 0.00 -1.09 0.00 0.00 36.82 38.19 2c8t h ILE 146 CO -0.12 0.66 -0.09 0.50 -1.08 0.00 0.00 178.15 178.03 2c8t h LYS 147 N 0.00 0.39 -0.77 2.19 3.64 -0.54 -1.39 116.57 120.10 2c8t h LYS 147 Ca -0.01 -0.17 0.02 0.00 -1.27 0.00 0.00 60.65 59.22 2c8t h LYS 147 Cb 1.33 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 33.10 2c8t h LYS 147 CO 0.09 0.69 0.50 -0.22 -2.27 0.00 0.00 179.45 178.23 2c8t h LYS 148 N 0.08 0.96 -0.27 1.90 3.64 -1.39 -1.72 116.57 119.77 2c8t h LYS 148 Ca 0.04 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.28 2c8t h LYS 148 Cb 0.57 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 2c8t h LYS 148 CO 0.03 0.63 -0.20 1.49 -2.27 0.00 0.00 179.45 179.13 2c8t h GLU 149 N 0.99 0.49 0.24 1.90 4.57 -1.38 -1.13 114.58 120.27 2c8t h GLU 149 Ca 0.30 -0.17 -0.01 0.00 -1.18 0.00 0.00 59.36 58.30 2c8t h GLU 149 Cb -0.04 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.51 2c8t h GLU 149 CO -0.09 0.67 -0.12 1.98 -1.18 0.00 0.00 179.01 180.27 2c8t h MET 150 N 0.44 -0.32 -0.68 1.92 4.05 -0.75 -2.35 114.93 117.25 2c8t h MET 150 Ca 0.07 0.02 0.15 0.00 -0.28 0.00 0.00 59.70 59.66 2c8t h MET 150 Cb 0.59 0.07 -0.12 0.00 -0.80 0.00 0.00 31.60 31.35 2c8t h MET 150 CO 0.04 0.01 0.02 0.74 0.23 0.00 0.00 176.91 177.96 2c8t h PHE 151 N -0.69 -0.01 -0.36 1.39 0.05 -1.20 0.22 116.94 116.35 2c8t h PHE 151 Ca -0.03 0.05 0.07 0.00 3.82 0.00 0.00 57.97 61.88 2c8t h PHE 151 Cb 0.48 0.11 -0.07 0.00 2.00 0.00 0.00 35.95 38.47 2c8t h PHE 151 CO 0.03 -0.18 -0.06 -0.09 -0.18 0.00 0.00 178.31 177.83 2c8t h ARG 152 N 0.13 0.03 -0.13 1.51 2.43 -1.15 -0.48 114.38 116.72 2c8t h ARG 152 Ca 0.37 -0.00 -0.20 0.00 -0.81 0.00 0.00 59.98 59.34 2c8t h ARG 152 Cb 0.62 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 2c8t h ARG 152 CO -0.58 0.02 -0.72 -0.07 -1.51 0.00 0.00 179.97 177.11 2c8t h LEU 153 N 0.03 0.71 -0.07 3.80 3.38 -0.72 -1.78 115.31 120.66 2c8t h LEU 153 Ca 0.18 -0.45 0.02 0.00 0.09 0.00 0.00 57.88 57.72 2c8t h LEU 153 Cb 0.26 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2c8t h LEU 153 CO -0.35 1.22 -0.06 -1.13 0.09 0.00 0.00 178.44 178.21 2c8t h ASN 154 N 0.42 -0.19 -0.46 -0.43 -0.00 -0.32 0.32 115.58 114.92 2c8t h ASN 154 Ca -0.03 0.04 0.09 0.00 -0.00 0.00 0.00 56.30 56.40 2c8t h ASN 154 Cb 1.32 0.10 -0.09 0.00 -0.00 0.00 0.00 38.32 39.64 2c8t h ASN 154 CO 0.14 -0.08 -0.18 0.00 -0.00 0.00 0.00 177.43 177.31 2c8t h ALA 155 N 0.99 0.20 -0.52 1.57 0.00 -1.04 -1.65 119.26 118.81 2c8t h ALA 155 Ca 0.05 0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 2c8t h ALA 155 Cb 0.14 0.46 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2c8t h ALA 155 CO -0.12 -0.51 0.17 1.49 0.00 0.00 0.00 179.25 180.28 2c8t h GLU 156 N -0.07 0.79 0.00 0.00 4.81 -0.69 0.15 114.58 119.57 2c8t h GLU 156 Ca 0.22 -0.17 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 2c8t h GLU 156 Cb 0.42 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 2c8t h GLU 156 CO -0.51 0.73 -0.03 0.74 -0.73 0.00 0.00 179.01 179.21 2c8t h PHE 157 N 0.70 0.00 0.00 0.92 0.05 0.06 -3.26 116.94 115.41 2c8t h PHE 157 Ca 0.17 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.96 2c8t h PHE 157 Cb 0.26 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.21 2c8t h PHE 157 CO 0.01 0.03 -1.36 -2.37 -0.18 0.00 0.00 178.31 174.44 2c8t n THR 158 N -4.36 0.00 -0.67 -1.55 5.66 -0.66 -4.83 114.28 107.87 2c8t n THR 158 Ca -0.03 -0.24 0.00 0.00 -3.05 0.00 0.00 64.05 60.73 2c8t n THR 158 Cb 0.11 0.35 0.00 0.00 -1.55 0.00 0.00 70.33 69.24 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 1.83 0.79 3.97 1.09 0.00 0.47 -4.24 105.19 109.11 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 -0.33 3.23 0.37 1.61 -1.52 -1.09 -5.03 119.66 116.89 2c8t s GLN 160 Ca 0.00 -0.74 -0.26 0.00 -1.95 0.00 0.00 55.36 52.41 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 0.08 1.11 -2.14 -0.25 0.00 0.00 175.29 174.09 2c8t s PRO 161 N -4.24 4.25 0.31 2.91 0.02 -1.26 -4.59 135.00 132.40 2c8t s PRO 161 Ca 0.43 1.73 0.06 0.00 0.02 0.00 0.00 61.00 63.24 2c8t s PRO 161 Cb -0.10 -2.77 0.74 0.00 0.02 0.00 0.00 34.50 32.40 2c8t s PRO 161 CO 0.33 -0.12 1.80 0.82 -0.33 0.00 0.00 177.00 179.50 2c8t h ILE 162 N 2.49 0.75 -0.85 2.83 2.04 -1.94 0.56 117.51 123.40 2c8t h ILE 162 Ca -0.48 -0.26 0.13 0.00 1.00 0.00 0.00 64.86 65.24 2c8t h ILE 162 Cb 1.22 -0.09 -0.09 0.00 -0.74 0.00 0.00 36.82 37.12 2c8t h ILE 162 CO 0.64 0.14 0.46 -0.33 0.00 0.00 0.00 178.15 179.06 2c8t h GLU 163 N 0.77 0.68 0.02 2.37 3.07 -1.98 -0.51 114.58 119.01 2c8t h GLU 163 Ca 0.55 -0.04 -0.27 0.00 -0.50 0.00 0.00 59.36 59.10 2c8t h GLU 163 Cb 0.85 -0.15 0.02 0.00 -0.84 0.00 0.00 28.75 28.62 2c8t h GLU 163 CO -0.33 0.45 -1.06 -0.09 -1.40 0.00 0.00 179.01 176.58 2c8t h ARG 164 N 0.70 0.68 -0.45 2.33 2.43 -1.29 -1.93 114.38 116.85 2c8t h ARG 164 Ca 0.44 -0.76 0.08 0.00 -0.81 0.00 0.00 59.98 58.93 2c8t h ARG 164 Cb 0.54 0.22 -0.07 0.00 -0.42 0.00 0.00 29.97 30.24 2c8t h ARG 164 CO -0.31 1.33 0.05 0.82 -1.51 0.00 0.00 179.97 180.34 2c8t h ILE 165 N 0.34 0.71 0.65 1.20 1.08 -0.93 0.83 117.51 121.39 2c8t h ILE 165 Ca -0.14 -0.06 -0.03 0.00 -0.39 0.00 0.00 64.86 64.24 2c8t h ILE 165 Cb 1.72 0.52 0.01 0.00 -3.07 0.00 0.00 36.82 35.99 2c8t h ILE 165 CO 0.21 0.03 -0.31 -0.33 -0.69 0.00 0.00 178.15 177.06 2c8t h GLU 166 N 0.17 -0.84 -0.86 2.37 5.08 -1.10 -2.07 114.58 117.33 2c8t h GLU 166 Ca 0.22 0.06 0.16 0.00 -1.00 0.00 0.00 59.36 58.80 2c8t h GLU 166 Cb 0.31 0.19 -0.10 0.00 0.50 0.00 0.00 28.75 29.65 2c8t h GLU 166 CO -0.33 -0.52 0.43 0.00 -1.00 0.00 0.00 179.01 177.59 2c8t h ALA 167 N -0.77 1.30 -0.17 3.43 0.00 -1.23 -1.40 119.26 120.43 2c8t h ALA 167 Ca -0.09 0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 2c8t h ALA 167 Cb 0.71 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2c8t h ALA 167 CO 0.15 -0.13 -0.54 -0.44 0.00 0.00 0.00 179.25 178.29 2c8t h ASP 168 N 0.59 0.54 -0.60 0.00 3.32 -0.82 -2.53 116.42 116.92 2c8t h ASP 168 Ca 0.48 -0.28 -0.09 0.00 0.02 0.00 0.00 57.03 57.15 2c8t h ASP 168 Cb 0.72 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.09 2c8t h ASP 168 CO -0.39 0.98 0.00 0.28 -1.72 0.00 0.00 179.24 178.39 2c8t h SER 169 N 0.38 1.03 -0.62 6.45 0.02 -0.61 -1.78 113.55 118.42 2c8t h SER 169 Ca 0.01 -0.30 -0.01 0.00 -0.84 0.00 0.00 61.79 60.64 2c8t h SER 169 Cb 1.07 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 63.30 2c8t h SER 169 CO 0.10 1.08 0.35 0.44 -1.14 0.00 0.00 176.83 177.66 2c8t h ASP 170 N 0.95 0.76 -0.07 3.07 3.32 -1.17 -1.97 116.42 121.31 2c8t h ASP 170 Ca 0.17 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2c8t h ASP 170 Cb 0.55 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.91 2c8t h ASP 170 CO 0.03 0.63 0.00 -2.11 -1.72 0.00 0.00 179.24 176.07 2c8t n ARG 171 N -4.57 1.27 -2.42 3.56 1.85 -0.96 -4.89 116.66 110.49 2c8t n ARG 171 Ca 0.04 -0.40 -0.19 0.00 -1.00 0.00 0.00 57.85 56.29 2c8t n ARG 171 Cb 0.08 -1.30 -0.01 0.00 -1.05 0.00 0.00 32.46 30.18 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 -0.35 -5.59 -4.62 2.89 8.00 -0.96 -4.88 116.55 111.03 2c8t n ASP 172 Ca 0.13 0.01 -0.49 0.00 0.71 0.00 0.00 54.79 55.15 2c8t n ASP 172 Cb 0.15 -4.66 -0.05 0.00 -0.02 0.00 0.00 41.12 36.54 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 -3.01 1.59 -4.00 -1.24 0.63 -0.71 -4.65 116.66 105.26 2c8t n ARG 173 Ca -0.23 0.57 -0.23 0.00 -0.92 0.00 0.00 57.85 57.05 2c8t n ARG 173 Cb 0.67 -2.26 -0.06 0.00 0.45 0.00 0.00 32.46 31.27 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 0.59 2.74 0.02 -0.14 1.48 -1.26 -1.54 118.94 120.82 2c8t s TRP 174 Ca 0.81 -0.39 0.00 0.00 -1.06 0.00 0.00 56.10 55.46 2c8t s TRP 174 Cb -0.83 -1.74 -0.01 0.00 -1.16 0.00 0.00 33.47 29.73 2c8t s TRP 174 CO 0.44 0.26 -0.03 -0.06 -4.06 0.00 0.00 176.95 173.50 2c8t s PHE 175 N -2.42 0.25 0.64 1.66 0.40 0.16 -4.98 117.98 113.69 2c8t s PHE 175 Ca 0.39 -0.36 -0.09 0.00 -0.60 0.00 0.00 56.93 56.27 2c8t s PHE 175 Cb -0.03 -0.17 -0.00 0.00 0.51 0.00 0.00 43.02 43.33 2c8t s PHE 175 CO 0.24 -0.12 1.00 0.99 0.70 0.00 0.00 175.22 178.03 2c8t s THR 176 N -0.99 3.89 0.22 0.64 2.01 -1.26 -1.53 115.64 118.62 2c8t s THR 176 Ca -0.10 0.40 -0.08 0.00 0.31 0.00 0.00 61.69 62.22 2c8t s THR 176 Cb -0.07 -3.58 0.18 0.00 0.01 0.00 0.00 72.50 69.04 2c8t s THR 176 CO -0.01 -0.70 1.72 0.00 -0.69 0.00 0.00 174.62 174.95 2c8t h ALA 177 N -0.38 0.84 0.02 7.40 0.00 -1.74 0.55 119.26 125.94 2c8t h ALA 177 Ca -0.45 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 2c8t h ALA 177 Cb 1.24 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2c8t h ALA 177 CO 0.62 -0.24 -0.01 0.00 0.00 0.00 0.00 179.25 179.63 2c8t h ALA 178 N 1.48 -0.02 -0.25 0.00 0.00 -1.92 -1.47 119.26 117.08 2c8t h ALA 178 Ca 0.34 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.17 2c8t h ALA 178 Cb 0.49 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2c8t h ALA 178 CO -0.38 -0.50 -0.13 0.93 0.00 0.00 0.00 179.25 179.17 2c8t h GLU 179 N -0.04 0.43 -0.51 0.00 5.08 -1.73 -2.61 114.58 115.20 2c8t h GLU 179 Ca -0.00 -0.12 -0.11 0.00 -1.00 0.00 0.00 59.36 58.13 2c8t h GLU 179 Cb 0.04 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 2c8t h GLU 179 CO 0.00 0.56 -0.12 0.00 -1.00 0.00 0.00 179.01 178.45 2c8t h ALA 180 N 1.47 0.83 -0.77 3.43 0.00 0.28 -1.77 119.26 122.73 2c8t h ALA 180 Ca 0.08 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 2c8t h ALA 180 Cb 0.47 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 2c8t h ALA 180 CO 0.03 0.66 0.38 1.25 0.00 0.00 0.00 179.25 181.57 2c8t h LEU 181 N 0.85 0.98 -0.35 0.00 5.85 -0.94 -2.30 115.31 119.40 2c8t h LEU 181 Ca 0.13 -0.10 -0.12 0.00 0.84 0.00 0.00 57.88 58.63 2c8t h LEU 181 Cb 0.67 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 2c8t h LEU 181 CO 0.05 0.82 -0.26 -0.33 -0.34 0.00 0.00 178.44 178.37 2c8t h GLU 182 N 1.09 0.80 0.00 1.25 5.08 -1.25 -3.16 114.58 118.39 2c8t h GLU 182 Ca 0.27 -0.39 -0.08 0.00 -1.00 0.00 0.00 59.36 58.15 2c8t h GLU 182 Cb 0.08 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2c8t h GLU 182 CO -0.04 1.02 -0.39 -0.92 -1.00 0.00 0.00 179.01 177.68 2c8t h TYR 183 N 0.59 0.00 0.00 4.33 3.20 -1.26 -3.47 116.97 120.36 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 0.83 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.10 2c8t h TYR 183 CO 0.06 0.39 0.00 0.41 -1.64 0.00 0.00 178.16 177.39 2c8t n GLY 184 N 0.06 1.30 0.27 1.82 0.00 -0.94 -4.70 105.19 103.00 2c8t n GLY 184 Ca -0.01 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.17 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 -2.63 1.61 -1.00 -1.69 -3.38 116.94 109.85 2c8t h PHE 185 Ca 0.00 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.68 2c8t h PHE 185 Cb 0.00 0.00 -0.21 0.00 3.61 0.00 0.00 35.95 39.35 2c8t h PHE 185 CO 0.00 0.05 -0.12 0.08 -1.61 0.00 0.00 178.31 176.71 2c8t s VAL 186 N -3.69 0.02 -0.09 -0.55 1.01 -1.25 -3.91 120.40 111.94 2c8t s VAL 186 Ca 0.01 -0.20 0.15 0.00 0.00 0.00 0.00 61.98 61.93 2c8t s VAL 186 Cb 0.09 -0.73 -0.22 0.00 0.00 0.00 0.00 36.38 35.53 2c8t s VAL 186 CO 0.56 -0.11 0.57 0.47 0.00 0.00 0.00 175.10 176.59 2c8t n ASP 187 N 1.71 0.68 -3.89 3.32 8.00 0.15 -4.56 116.55 121.95 2c8t n ASP 187 Ca -0.18 0.32 -0.11 0.00 0.71 0.00 0.00 54.79 55.53 2c8t n ASP 187 Cb 0.56 0.23 -0.10 0.00 -0.02 0.00 0.00 41.12 41.79 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 0.07 -0.26 1.24 3.76 -0.74 -5.00 115.29 111.71 2c8t s HIS 188 Ca -0.05 -0.19 -0.10 0.00 -0.15 0.00 0.00 55.06 54.57 2c8t s HIS 188 Cb 0.08 -0.07 -0.04 0.00 1.11 0.00 0.00 32.58 33.66 2c8t s HIS 188 CO 0.83 -0.27 0.15 0.42 -0.85 0.00 0.00 174.74 175.01 2c8t s ILE 189 N -1.38 5.04 -0.06 0.60 1.01 -1.26 -1.44 121.20 123.70 2c8t s ILE 189 Ca -0.15 0.07 -0.12 0.00 0.00 0.00 0.00 60.65 60.46 2c8t s ILE 189 Cb -0.08 -3.37 -0.05 0.00 0.01 0.00 0.00 42.46 38.97 2c8t s ILE 189 CO 0.01 0.31 0.30 0.27 0.00 0.00 0.00 174.94 175.83 2c8t s ILE 190 N 1.48 5.23 0.00 2.92 -4.36 -0.85 -4.95 121.20 120.67 2c8t s ILE 190 Ca 0.07 0.58 0.00 0.00 -0.26 0.00 0.00 60.65 61.04 2c8t s ILE 190 Cb -0.15 -3.59 0.00 0.00 1.25 0.00 0.00 42.46 39.97 2c8t s ILE 190 CO 0.07 0.57 0.00 0.41 0.24 0.00 0.00 174.94 176.23 2c8t n THR 191 N 2.13 0.00 -2.53 8.37 -1.04 -1.26 -3.97 114.28 115.97 2c8t n THR 191 Ca -0.16 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.54 2c8t n THR 191 Cb 0.53 -0.89 -0.03 0.00 -1.82 0.00 0.00 70.33 68.13 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 3.81 0.69 -2.82 0.52 -1.26 -5.03 118.95 114.86 2c8t s ARG 192 Ca 0.00 0.68 0.04 0.00 -0.52 0.00 0.00 55.73 55.93 2c8t s ARG 192 Cb 0.00 -2.25 0.13 0.00 0.52 0.00 0.00 34.95 33.35 2c8t s ARG 192 CO 0.00 -0.21 0.95 0.00 0.02 0.00 0.00 175.30 176.06 2c8t s ALA 193 N -2.60 4.12 0.00 2.13 0.00 -1.26 -5.21 121.76 118.94 2c8t s ALA 193 Ca 0.55 -1.99 0.00 0.00 0.00 0.00 0.00 51.96 50.51 2c8t s ALA 193 Cb -0.10 -1.75 0.00 0.00 0.00 0.00 0.00 23.12 21.27 2c8t s ALA 193 CO 0.35 -1.33 0.00 0.72 0.00 0.00 0.00 175.76 175.50