#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 -0.25 -0.35 1.04 5.85 -2.05 0.75 115.31 120.31 2c8t h LEU 16 Ca 0.00 0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.83 2c8t h LEU 16 Cb 0.00 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.08 2c8t h LEU 16 CO 0.00 -0.12 -0.07 0.74 -0.34 0.00 0.00 178.44 178.65 2c8t h THR 17 N -0.12 0.67 -0.62 1.05 2.02 -2.06 -0.31 112.91 113.55 2c8t h THR 17 Ca 0.05 -0.01 -0.05 0.00 0.77 0.00 0.00 66.41 67.17 2c8t h THR 17 Cb 0.19 0.65 -0.03 0.00 -1.74 0.00 0.00 68.15 67.22 2c8t h THR 17 CO -0.12 0.00 0.17 0.44 0.37 0.00 0.00 175.52 176.39 2c8t h ASP 18 N 0.02 0.91 -0.62 4.18 3.32 -1.91 -2.08 116.42 120.23 2c8t h ASP 18 Ca 0.17 -0.22 0.08 0.00 0.02 0.00 0.00 57.03 57.08 2c8t h ASP 18 Cb 0.25 -0.24 -0.06 0.00 0.22 0.00 0.00 39.33 39.50 2c8t h ASP 18 CO -0.34 0.89 0.28 -1.28 -1.72 0.00 0.00 179.24 177.07 2c8t h SER 19 N 0.89 0.35 0.27 6.45 0.87 -0.13 0.76 113.55 123.02 2c8t h SER 19 Ca 0.20 0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.80 2c8t h SER 19 Cb 0.32 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.29 2c8t h SER 19 CO -0.00 0.22 -0.13 0.58 -0.53 0.00 0.00 176.83 176.96 2c8t h VAL 20 N 0.51 0.77 -0.53 2.23 2.07 -0.81 -2.00 116.25 118.47 2c8t h VAL 20 Ca 0.30 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.63 2c8t h VAL 20 Cb 0.31 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 2c8t h VAL 20 CO -0.25 0.04 0.35 1.88 0.02 0.00 0.00 177.57 179.62 2c8t h TYR 21 N -0.47 0.64 -0.09 1.57 -1.99 -0.95 -0.96 116.97 114.73 2c8t h TYR 21 Ca -0.04 0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.70 2c8t h TYR 21 Cb 0.35 -0.22 -0.00 0.00 2.00 0.00 0.00 36.73 38.86 2c8t h TYR 21 CO -0.03 0.39 0.02 0.93 -0.00 0.00 0.00 178.16 179.47 2c8t h GLU 22 N 0.68 0.14 -0.94 4.88 5.08 -0.75 -0.33 114.58 123.34 2c8t h GLU 22 Ca 0.20 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 2c8t h GLU 22 Cb -0.01 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.18 2c8t h GLU 22 CO -0.05 0.34 0.60 0.00 -1.00 0.00 0.00 179.01 178.89 2c8t h ARG 23 N -0.07 1.25 0.00 2.33 3.08 -0.88 -1.31 114.38 118.78 2c8t h ARG 23 Ca 0.03 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 59.91 2c8t h ARG 23 Cb 0.26 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 2c8t h ARG 23 CO 0.00 0.85 -0.37 1.25 -1.07 0.00 0.00 179.97 180.63 2c8t h LEU 24 N 1.28 0.00 -0.76 3.04 5.85 -0.98 -2.16 115.31 121.58 2c8t h LEU 24 Ca 0.34 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.93 2c8t h LEU 24 Cb -0.10 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 2c8t h LEU 24 CO -0.07 0.37 -0.53 0.25 -0.34 0.00 0.00 178.44 178.13 2c8t h LEU 25 N 0.00 0.27 -0.05 2.25 5.85 0.10 -1.18 115.31 122.55 2c8t h LEU 25 Ca -0.00 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.58 2c8t h LEU 25 Cb 0.77 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.72 2c8t h LEU 25 CO 0.05 0.75 0.00 -1.20 -0.34 0.00 0.00 178.44 177.69 2c8t n SER 26 N -3.93 0.05 -1.52 1.25 7.64 -0.82 -1.63 113.62 114.66 2c8t n SER 26 Ca -0.02 0.51 0.08 0.00 1.01 0.00 0.00 58.87 60.45 2c8t n SER 26 Cb 0.56 -0.52 0.35 0.00 -1.01 0.00 0.00 64.21 63.59 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 -1.56 4.10 -3.65 1.43 -0.58 -0.76 -4.94 120.64 114.69 2c8t n GLU 27 Ca 0.03 -3.00 -0.28 0.00 -0.42 0.00 0.00 57.16 53.50 2c8t n GLU 27 Cb 0.18 -2.06 0.01 0.00 -0.57 0.00 0.00 31.44 29.00 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 0.37 -4.38 -5.09 3.49 5.12 -0.64 -4.88 116.66 110.64 2c8t n ARG 28 Ca 0.25 0.56 -0.32 0.00 -1.93 0.00 0.00 57.85 56.41 2c8t n ARG 28 Cb 1.04 -5.36 -0.16 0.00 -1.16 0.00 0.00 32.46 26.82 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 2.43 0.01 0.55 1.01 -0.52 -0.41 121.20 121.14 2c8t s ILE 29 Ca 0.54 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 60.29 2c8t s ILE 29 Cb -0.28 -1.94 -0.01 0.00 0.01 0.00 0.00 42.46 40.24 2c8t s ILE 29 CO 0.67 0.56 -0.03 -0.63 0.00 0.00 0.00 174.94 175.50 2c8t s ILE 30 N 0.00 0.19 -0.05 2.92 1.01 0.40 -3.50 121.20 122.18 2c8t s ILE 30 Ca -0.07 -0.56 0.06 0.00 0.00 0.00 0.00 60.65 60.08 2c8t s ILE 30 Cb -0.15 -0.26 -0.01 0.00 0.01 0.00 0.00 42.46 42.05 2c8t s ILE 30 CO 0.05 -0.24 -0.24 -0.36 0.00 0.00 0.00 174.94 174.15 2c8t s PHE 31 N -0.81 2.33 -0.47 3.97 0.40 -1.26 -0.18 117.98 121.95 2c8t s PHE 31 Ca -0.07 -0.66 -0.05 0.00 -0.60 0.00 0.00 56.93 55.55 2c8t s PHE 31 Cb -0.06 -1.53 0.12 0.00 0.51 0.00 0.00 43.02 42.07 2c8t s PHE 31 CO -0.00 -0.19 0.30 -1.17 0.70 0.00 0.00 175.22 174.86 2c8t s LEU 32 N -0.20 5.44 -0.09 -0.37 2.96 0.03 -4.95 118.68 121.50 2c8t s LEU 32 Ca -0.02 -2.12 0.13 0.00 -0.22 0.00 0.00 54.13 51.89 2c8t s LEU 32 Cb -0.13 -1.90 0.23 0.00 0.50 0.00 0.00 46.19 44.89 2c8t s LEU 32 CO 0.03 -0.57 1.14 0.61 -1.32 0.00 0.00 176.35 176.24 2c8t n GLY 33 N 4.53 4.12 0.80 7.98 0.00 -1.26 -0.78 105.19 120.59 2c8t n GLY 33 Ca -0.02 -0.75 -0.02 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.96 -0.46 -4.31 1.61 3.41 -1.24 -4.77 113.62 106.91 2c8t n SER 34 Ca 0.11 -1.31 -0.59 0.00 -0.26 0.00 0.00 58.87 56.83 2c8t n SER 34 Cb 0.54 0.77 -0.08 0.00 -0.26 0.00 0.00 64.21 65.17 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 -0.12 0.00 -2.34 4.33 4.07 -1.26 -4.36 120.64 120.95 2c8t n GLU 35 Ca -0.02 0.00 -0.35 0.00 -0.06 0.00 0.00 57.16 56.73 2c8t n GLU 35 Cb 0.13 -1.39 -0.04 0.00 -0.06 0.00 0.00 31.44 30.07 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 1.52 3.74 0.51 6.31 1.01 0.28 -4.85 120.40 128.93 2c8t s VAL 36 Ca 0.92 -0.72 0.06 0.00 0.00 0.00 0.00 61.98 62.24 2c8t s VAL 36 Cb -1.30 -4.65 0.02 0.00 0.00 0.00 0.00 36.38 30.45 2c8t s VAL 36 CO 0.66 -1.52 0.35 0.54 0.00 0.00 0.00 175.10 175.13 2c8t s ASN 37 N 6.15 4.62 0.18 3.32 4.22 -1.26 -0.92 114.94 131.25 2c8t s ASN 37 Ca 0.57 -1.20 -0.13 0.00 -2.14 0.00 0.00 52.86 49.96 2c8t s ASN 37 Cb -0.02 0.22 0.13 0.00 1.28 0.00 0.00 41.25 42.85 2c8t s ASN 37 CO -0.04 -0.98 1.81 0.44 -2.04 0.00 0.00 177.10 176.29 2c8t h ASP 38 N 0.89 0.51 0.43 3.54 3.32 -1.95 0.53 116.42 123.69 2c8t h ASP 38 Ca -0.38 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 56.66 2c8t h ASP 38 Cb 1.29 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.74 2c8t h ASP 38 CO 0.60 0.35 -0.30 -0.08 -1.72 0.00 0.00 179.24 178.09 2c8t h GLU 39 N 0.63 -0.69 -0.89 3.56 4.57 -1.97 0.20 114.58 119.98 2c8t h GLU 39 Ca 0.22 0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.43 2c8t h GLU 39 Cb 0.05 0.16 -0.04 0.00 -0.16 0.00 0.00 28.75 28.76 2c8t h GLU 39 CO -0.11 -0.46 0.48 0.82 -1.18 0.00 0.00 179.01 178.56 2c8t h ILE 40 N -0.72 1.26 0.06 2.32 2.04 -1.85 -1.09 117.51 119.53 2c8t h ILE 40 Ca -0.04 -0.66 0.01 0.00 1.00 0.00 0.00 64.86 65.17 2c8t h ILE 40 Cb 0.60 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 2c8t h ILE 40 CO 0.02 0.30 -0.10 0.00 0.00 0.00 0.00 178.15 178.37 2c8t h ALA 41 N 1.27 -0.16 -0.48 1.87 0.00 -0.52 0.13 119.26 121.37 2c8t h ALA 41 Ca 0.31 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.30 2c8t h ALA 41 Cb 0.04 0.15 -0.08 0.00 0.00 0.00 0.00 17.79 17.90 2c8t h ALA 41 CO -0.05 -0.61 -0.03 -0.91 0.00 0.00 0.00 179.25 177.65 2c8t h ASN 42 N -0.20 -0.27 -0.87 0.00 2.35 -0.39 0.09 115.58 116.29 2c8t h ASN 42 Ca 0.02 0.12 0.01 0.00 -0.55 0.00 0.00 56.30 55.90 2c8t h ASN 42 Cb 0.21 0.23 -0.04 0.00 0.05 0.00 0.00 38.32 38.77 2c8t h ASN 42 CO -0.06 -0.09 0.57 -0.09 -1.65 0.00 0.00 177.43 176.11 2c8t h ARG 43 N 0.08 1.15 -0.44 0.81 2.43 -0.52 -0.24 114.38 117.66 2c8t h ARG 43 Ca 0.24 -0.07 -0.09 0.00 -0.81 0.00 0.00 59.98 59.24 2c8t h ARG 43 Cb 0.36 -0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 2c8t h ARG 43 CO -0.42 0.77 -0.09 -0.07 -1.51 0.00 0.00 179.97 178.65 2c8t h LEU 44 N 1.18 0.83 -0.49 3.80 3.38 -0.03 -1.34 115.31 122.65 2c8t h LEU 44 Ca 0.32 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2c8t h LEU 44 Cb -0.13 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.37 2c8t h LEU 44 CO -0.07 0.99 0.33 0.00 0.09 0.00 0.00 178.44 179.78 2c8t h ALA 46 N 1.18 -0.11 -0.23 0.00 0.00 -0.88 0.57 119.26 119.79 2c8t h ALA 46 Ca 0.18 0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.17 2c8t h ALA 46 Cb -0.08 0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 2c8t h ALA 46 CO -0.04 -0.62 -0.04 1.96 0.00 0.00 0.00 179.25 180.51 2c8t h GLN 47 N -0.21 0.02 -0.53 0.00 4.20 -0.54 -0.21 115.11 117.85 2c8t h GLN 47 Ca 0.09 -0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.83 2c8t h GLN 47 Cb 0.34 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.07 2c8t h GLN 47 CO -0.23 0.01 0.29 0.82 -0.67 0.00 0.00 178.83 179.06 2c8t h ILE 48 N 0.02 0.99 -0.65 2.54 2.04 -0.54 -0.95 117.51 120.97 2c8t h ILE 48 Ca 0.11 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.78 2c8t h ILE 48 Cb 0.16 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.59 2c8t h ILE 48 CO -0.22 0.10 0.42 -0.07 0.00 0.00 0.00 178.15 178.38 2c8t h LEU 49 N 0.56 0.75 0.21 1.44 3.38 -0.35 -1.25 115.31 120.06 2c8t h LEU 49 Ca 0.23 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 2c8t h LEU 49 Cb 0.10 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2c8t h LEU 49 CO -0.14 0.56 -0.14 0.25 0.09 0.00 0.00 178.44 179.06 2c8t h LEU 50 N 0.88 -0.37 -0.43 1.67 5.85 -0.45 0.57 115.31 123.03 2c8t h LEU 50 Ca 0.24 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.98 2c8t h LEU 50 Cb -0.08 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 2c8t h LEU 50 CO -0.05 -0.23 0.25 -0.07 -0.34 0.00 0.00 178.44 178.00 2c8t h LEU 51 N -0.36 0.53 -0.71 2.25 3.38 -1.07 0.12 115.31 119.46 2c8t h LEU 51 Ca -0.02 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 2c8t h LEU 51 Cb 0.30 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 2c8t h LEU 51 CO 0.01 0.46 0.44 0.00 0.09 0.00 0.00 178.44 179.43 2c8t h ALA 52 N 1.10 0.91 -0.47 1.53 0.00 -1.08 -2.05 119.26 119.19 2c8t h ALA 52 Ca 0.15 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2c8t h ALA 52 Cb 0.03 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2c8t h ALA 52 CO -0.03 0.37 0.09 0.00 0.00 0.00 0.00 179.25 179.68 2c8t h ALA 53 N 1.23 1.27 -0.17 0.00 0.00 -0.39 -2.89 119.26 118.31 2c8t h ALA 53 Ca 0.26 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 2c8t h ALA 53 Cb -0.05 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2c8t h ALA 53 CO -0.05 0.50 -0.44 0.93 0.00 0.00 0.00 179.25 180.19 2c8t h GLU 54 N 0.70 0.40 -0.91 0.00 5.08 -0.50 -3.43 114.58 115.93 2c8t h GLU 54 Ca 0.15 -0.21 0.15 0.00 -1.00 0.00 0.00 59.36 58.45 2c8t h GLU 54 Cb 0.30 0.01 -0.21 0.00 0.50 0.00 0.00 28.75 29.34 2c8t h GLU 54 CO 0.00 0.77 -0.06 0.34 -1.00 0.00 0.00 179.01 179.06 2c8t s ASP 55 N -6.87 -0.96 0.00 1.42 -1.08 -0.82 -5.04 116.67 103.32 2c8t s ASP 55 Ca -0.06 0.76 0.28 0.00 -0.52 0.00 0.00 52.55 53.02 2c8t s ASP 55 Cb 0.13 1.87 1.09 0.00 -1.46 0.00 0.00 42.92 44.54 2c8t s ASP 55 CO 0.80 -0.18 1.79 0.00 0.52 0.00 0.00 175.17 178.11 2c8t n ALA 56 N 5.38 2.78 -0.12 3.66 0.00 -1.10 -4.18 120.51 126.93 2c8t n ALA 56 Ca -0.05 -0.22 -0.15 0.00 0.00 0.00 0.00 53.44 53.02 2c8t n ALA 56 Cb 0.52 -1.34 -0.14 0.00 0.00 0.00 0.00 19.45 18.49 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 -1.28 1.18 -4.78 0.00 3.41 -1.26 -3.28 113.62 107.61 2c8t n SER 57 Ca 0.10 -0.08 -0.35 0.00 -0.26 0.00 0.00 58.87 58.29 2c8t n SER 57 Cb 0.31 0.16 -0.01 0.00 -0.26 0.00 0.00 64.21 64.41 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 -2.51 3.49 0.87 4.33 1.02 -1.26 -4.73 119.74 120.95 2c8t s LYS 58 Ca -0.25 1.50 -0.11 0.00 0.02 0.00 0.00 55.97 57.14 2c8t s LYS 58 Cb 0.08 -2.03 0.12 0.00 -0.52 0.00 0.00 37.83 35.47 2c8t s LYS 58 CO 0.69 -0.72 1.11 -0.51 -0.92 0.00 0.00 175.35 175.00 2c8t s ASP 59 N -1.91 3.49 -0.07 2.83 1.11 -1.26 -4.55 116.67 116.31 2c8t s ASP 59 Ca 0.70 1.87 0.05 0.00 0.18 0.00 0.00 52.55 55.35 2c8t s ASP 59 Cb -0.21 -2.46 -0.01 0.00 1.07 0.00 0.00 42.92 41.31 2c8t s ASP 59 CO 0.25 -2.68 -0.22 -0.63 1.18 0.00 0.00 175.17 173.07 2c8t s ILE 60 N -2.79 2.33 -0.21 0.77 1.01 -0.40 -4.88 121.20 117.04 2c8t s ILE 60 Ca 0.64 -0.97 -0.07 0.00 0.00 0.00 0.00 60.65 60.25 2c8t s ILE 60 Cb -0.20 -1.87 -0.04 0.00 0.01 0.00 0.00 42.46 40.36 2c8t s ILE 60 CO 0.57 0.57 0.07 -0.44 0.00 0.00 0.00 174.94 175.71 2c8t s SER 61 N -0.17 5.43 -0.22 3.58 0.01 0.45 -0.39 113.70 122.39 2c8t s SER 61 Ca -0.03 -0.04 -0.01 0.00 1.31 0.00 0.00 55.95 57.18 2c8t s SER 61 Cb -0.14 -1.95 0.02 0.00 0.21 0.00 0.00 66.02 64.16 2c8t s SER 61 CO 0.04 0.08 -0.10 -0.22 0.41 0.00 0.00 173.24 173.44 2c8t s LEU 62 N 0.93 2.85 -0.22 2.44 2.96 0.67 -0.45 118.68 127.86 2c8t s LEU 62 Ca 0.04 -0.77 -0.13 0.00 -0.22 0.00 0.00 54.13 53.05 2c8t s LEU 62 Cb -0.14 -1.61 -0.05 0.00 0.50 0.00 0.00 46.19 44.89 2c8t s LEU 62 CO 0.03 -0.08 0.25 -0.31 -1.32 0.00 0.00 176.35 174.92 2c8t s TYR 63 N 1.32 3.35 -0.20 5.38 1.51 0.74 -1.25 117.35 128.20 2c8t s TYR 63 Ca 0.02 0.39 -0.03 0.00 -1.01 0.00 0.00 57.07 56.44 2c8t s TYR 63 Cb -0.15 -2.36 -0.00 0.00 -0.11 0.00 0.00 41.96 39.33 2c8t s TYR 63 CO -0.07 0.06 -0.08 0.42 -1.11 0.00 0.00 175.55 174.77 2c8t s ILE 64 N 1.07 3.10 -0.43 2.71 1.01 0.13 -0.79 121.20 128.00 2c8t s ILE 64 Ca 0.12 -0.59 0.05 0.00 0.00 0.00 0.00 60.65 60.23 2c8t s ILE 64 Cb -0.14 -2.38 0.20 0.00 0.01 0.00 0.00 42.46 40.15 2c8t s ILE 64 CO 0.05 0.46 0.47 -3.20 0.00 0.00 0.00 174.94 172.72 2c8t n ASN 65 N 4.61 -0.92 -3.88 3.58 2.85 0.04 -0.50 115.26 121.05 2c8t n ASN 65 Ca -0.19 -2.58 -0.12 0.00 -0.11 0.00 0.00 54.58 51.58 2c8t n ASN 65 Cb 0.51 -0.09 -0.14 0.00 1.24 0.00 0.00 39.78 41.30 2c8t n ASN 65 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 2c8t s SER 66 N -0.21 0.01 0.00 1.20 0.15 0.71 -3.60 113.70 111.96 2c8t s SER 66 Ca 0.33 -0.02 0.18 0.00 0.70 0.00 0.00 55.95 57.14 2c8t s SER 66 Cb 0.08 0.03 1.09 0.00 -1.71 0.00 0.00 66.02 65.50 2c8t s SER 66 CO -0.16 -0.03 1.67 -0.81 1.20 0.00 0.00 173.24 175.11 2c8t n PRO 67 N 2.94 0.96 0.00 5.44 -0.04 -1.26 -2.26 135.00 140.78 2c8t n PRO 67 Ca -0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 2c8t n PRO 67 Cb 0.59 -1.30 0.00 0.00 -0.04 0.00 0.00 33.50 32.76 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 0.73 -0.31 0.00 0.55 0.00 -1.17 -4.37 105.19 100.62 2c8t n GLY 68 Ca 0.14 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.75 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 0.11 3.55 -0.02 0.00 -1.26 0.10 105.19 107.66 2c8t n GLY 69 Ca 0.00 -1.38 -0.51 0.00 0.00 0.00 0.00 46.02 44.13 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 0.85 0.23 1.61 2.88 -0.10 -4.49 113.62 114.60 2c8t n SER 70 Ca 0.00 1.14 -0.15 0.00 -1.33 0.00 0.00 58.87 58.53 2c8t n SER 70 Cb 0.00 -1.13 -0.08 0.00 -0.75 0.00 0.00 64.21 62.25 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 2.61 0.57 -0.56 2.46 2.04 -1.99 -1.69 117.51 120.95 2c8t h ILE 71 Ca -0.43 -0.27 -0.06 0.00 1.00 0.00 0.00 64.86 65.09 2c8t h ILE 71 Cb 1.37 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 38.12 2c8t h ILE 71 CO 0.69 0.05 0.10 0.77 0.00 0.00 0.00 178.15 179.76 2c8t h SER 72 N -0.73 0.84 -0.11 1.72 4.64 -1.96 0.54 113.55 118.48 2c8t h SER 72 Ca -0.06 -0.17 0.03 0.00 -0.47 0.00 0.00 61.79 61.12 2c8t h SER 72 Cb 0.52 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 62.35 2c8t h SER 72 CO 0.10 0.84 -0.10 0.00 -0.87 0.00 0.00 176.83 176.80 2c8t h ALA 73 N 1.27 -0.01 -0.20 5.18 0.00 -1.91 0.10 119.26 123.70 2c8t h ALA 73 Ca 0.18 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 2c8t h ALA 73 Cb 0.36 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2c8t h ALA 73 CO 0.01 -0.55 0.03 0.78 0.00 0.00 0.00 179.25 179.52 2c8t h GLY 74 N -0.11 0.30 1.53 0.00 0.00 -0.24 -2.61 103.07 101.93 2c8t h GLY 74 Ca 0.08 -0.14 -0.19 0.00 0.00 0.00 0.00 47.33 47.08 2c8t h GLY 74 CO -0.18 0.14 -0.73 1.98 0.00 0.00 0.00 176.54 177.75 2c8t h MET 75 N 0.28 0.46 -0.39 4.80 -1.53 0.63 -1.48 114.93 117.71 2c8t h MET 75 Ca 0.07 -0.37 0.02 0.00 -3.44 0.00 0.00 59.70 55.97 2c8t h MET 75 Cb 0.14 0.08 -0.03 0.00 -0.55 0.00 0.00 31.60 31.24 2c8t h MET 75 CO -0.00 1.01 0.23 0.00 0.14 0.00 0.00 176.91 178.28 2c8t h ALA 76 N 0.89 0.49 -0.41 0.39 0.00 -0.63 -0.51 119.26 119.48 2c8t h ALA 76 Ca -0.03 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.89 2c8t h ALA 76 Cb 1.31 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 2c8t h ALA 76 CO 0.13 -0.11 0.24 0.82 0.00 0.00 0.00 179.25 180.33 2c8t h ILE 77 N 0.46 1.03 0.09 0.00 2.04 -1.28 -1.90 117.51 117.95 2c8t h ILE 77 Ca 0.15 -0.16 0.02 0.00 1.00 0.00 0.00 64.86 65.87 2c8t h ILE 77 Cb 0.01 0.51 -0.04 0.00 -0.74 0.00 0.00 36.82 36.56 2c8t h ILE 77 CO -0.07 0.09 -0.26 0.22 0.00 0.00 0.00 178.15 178.13 2c8t h TYR 78 N 0.48 -0.69 -0.83 1.37 3.20 -0.86 -0.47 116.97 119.17 2c8t h TYR 78 Ca 0.17 0.02 0.18 0.00 3.14 0.00 0.00 58.73 62.23 2c8t h TYR 78 Cb 0.02 0.29 -0.11 0.00 1.54 0.00 0.00 36.73 38.47 2c8t h TYR 78 CO -0.08 -0.36 0.34 -0.44 -1.64 0.00 0.00 178.16 175.98 2c8t h ASP 79 N -0.45 0.29 -0.49 -2.11 3.32 -0.87 -0.31 116.42 115.80 2c8t h ASP 79 Ca 0.04 0.13 -0.09 0.00 0.02 0.00 0.00 57.03 57.13 2c8t h ASP 79 Cb 0.49 0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 2c8t h ASP 79 CO -0.17 0.05 -0.04 0.74 -1.72 0.00 0.00 179.24 178.10 2c8t h THR 80 N 0.42 1.26 -0.12 0.35 2.02 -0.57 0.25 112.91 116.53 2c8t h THR 80 Ca 0.48 -1.15 0.02 0.00 0.77 0.00 0.00 66.41 66.53 2c8t h THR 80 Cb 0.83 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 68.11 2c8t h THR 80 CO -0.47 0.41 0.02 0.24 0.37 0.00 0.00 175.52 176.09 2c8t h MET 81 N 0.86 0.06 -0.43 6.66 2.86 0.39 -0.23 114.93 125.11 2c8t h MET 81 Ca 0.15 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.77 2c8t h MET 81 Cb 0.56 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.19 2c8t h MET 81 CO 0.03 0.04 0.22 0.28 1.06 0.00 0.00 176.91 178.55 2c8t h VAL 82 N 0.07 1.17 -0.22 -2.22 2.07 -0.77 -3.01 116.25 113.34 2c8t h VAL 82 Ca 0.05 -0.46 0.05 0.00 0.82 0.00 0.00 66.70 67.17 2c8t h VAL 82 Cb 0.05 0.68 -0.05 0.00 -1.52 0.00 0.00 31.29 30.44 2c8t h VAL 82 CO -0.08 0.18 -0.13 0.25 0.02 0.00 0.00 177.57 177.81 2c8t h LEU 83 N 0.56 -0.43 -9.39 2.57 5.85 -0.17 -3.42 115.31 110.89 2c8t h LEU 83 Ca 0.15 0.10 -0.56 0.00 0.84 0.00 0.00 57.88 58.40 2c8t h LEU 83 Cb 0.09 0.23 0.03 0.00 0.37 0.00 0.00 40.66 41.37 2c8t h LEU 83 CO -0.02 -0.17 1.11 0.00 -0.34 0.00 0.00 178.44 179.02 2c8t n ALA 84 N -2.60 1.50 0.19 1.25 0.00 -0.13 -4.85 120.51 115.87 2c8t n ALA 84 Ca -0.01 0.29 0.09 0.00 0.00 0.00 0.00 53.44 53.81 2c8t n ALA 84 Cb 0.21 -2.56 0.62 0.00 0.00 0.00 0.00 19.45 17.72 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 9.06 0.07 -7.11 0.00 0.11 -1.83 -3.44 132.00 128.85 2c8t h PRO 85 Ca -0.48 -0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.13 2c8t h PRO 85 Cb 1.25 -0.02 0.05 0.00 0.11 0.00 0.00 31.00 32.39 2c8t h PRO 85 CO 0.94 0.05 0.24 0.00 -0.21 0.00 0.00 178.00 179.01 2c8t s ASP 87 N -4.14 5.63 -0.25 0.00 1.01 -1.26 -4.88 116.67 112.77 2c8t s ASP 87 Ca 0.51 2.50 0.03 0.00 0.71 0.00 0.00 52.55 56.30 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 0.49 -1.30 -0.11 -0.63 0.21 0.00 0.00 175.17 173.82 2c8t s ILE 88 N -1.46 2.11 0.20 0.77 1.01 -1.26 -1.27 121.20 121.31 2c8t s ILE 88 Ca 0.69 -1.55 -0.26 0.00 0.00 0.00 0.00 60.65 59.53 2c8t s ILE 88 Cb -0.34 -2.21 -0.08 0.00 0.01 0.00 0.00 42.46 39.84 2c8t s ILE 88 CO 0.39 0.01 0.82 0.00 0.00 0.00 0.00 174.94 176.17 2c8t s ALA 89 N 1.14 3.40 -0.07 9.38 0.00 0.48 -1.06 121.76 135.03 2c8t s ALA 89 Ca -0.08 0.41 0.04 0.00 0.00 0.00 0.00 51.96 52.34 2c8t s ALA 89 Cb -0.19 -3.02 -0.00 0.00 0.00 0.00 0.00 23.12 19.91 2c8t s ALA 89 CO -0.06 0.27 -0.20 0.99 0.00 0.00 0.00 175.76 176.76 2c8t s THR 90 N -1.24 1.71 -0.16 0.00 2.01 -0.23 -0.23 115.64 117.50 2c8t s THR 90 Ca 0.39 -0.84 -0.01 0.00 0.31 0.00 0.00 61.69 61.54 2c8t s THR 90 Cb -0.23 -1.48 0.04 0.00 0.01 0.00 0.00 72.50 70.84 2c8t s THR 90 CO 0.27 0.48 -0.05 -0.31 -0.69 0.00 0.00 174.62 174.32 2c8t s TYR 91 N 0.23 1.68 -0.38 4.92 1.51 -0.38 0.73 117.35 125.65 2c8t s TYR 91 Ca -0.11 -1.06 -0.29 0.00 -1.01 0.00 0.00 57.07 54.60 2c8t s TYR 91 Cb -0.15 -1.30 0.01 0.00 -0.11 0.00 0.00 41.96 40.41 2c8t s TYR 91 CO 0.05 -0.61 1.28 0.00 -1.11 0.00 0.00 175.55 175.16 2c8t s ALA 92 N 1.64 3.22 -0.30 3.71 0.00 0.82 0.17 121.76 131.02 2c8t s ALA 92 Ca 0.01 -0.13 0.01 0.00 0.00 0.00 0.00 51.96 51.85 2c8t s ALA 92 Cb -0.15 -3.85 0.09 0.00 0.00 0.00 0.00 23.12 19.21 2c8t s ALA 92 CO -0.08 -2.07 0.05 1.41 0.00 0.00 0.00 175.76 175.07 2c8t s MET 93 N 4.45 1.13 1.39 0.00 0.00 0.35 -1.29 119.30 125.33 2c8t s MET 93 Ca 0.55 -1.29 0.00 0.00 0.00 0.00 0.00 55.69 54.95 2c8t s MET 93 Cb -0.13 -2.50 0.00 0.00 0.00 0.00 0.00 34.83 32.20 2c8t s MET 93 CO 0.28 -0.88 0.00 0.41 0.00 0.00 0.00 175.02 174.82 2c8t n GLY 94 N 4.63 1.39 2.83 2.11 0.00 -1.26 -3.89 105.19 111.00 2c8t n GLY 94 Ca -0.02 -0.42 -0.15 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 0.15 -0.28 1.61 -2.45 -1.26 -0.57 119.30 116.50 2c8t s MET 95 Ca 0.00 0.06 0.02 0.00 -1.25 0.00 0.00 55.69 54.52 2c8t s MET 95 Cb 0.00 -0.30 0.07 0.00 1.25 0.00 0.00 34.83 35.86 2c8t s MET 95 CO 0.00 -0.08 -0.03 0.00 1.05 0.00 0.00 175.02 175.96 2c8t s ALA 96 N 0.65 2.33 0.20 4.11 0.00 -0.81 -0.21 121.76 128.03 2c8t s ALA 96 Ca -0.06 -1.81 0.09 0.00 0.00 0.00 0.00 51.96 50.18 2c8t s ALA 96 Cb -0.09 -1.64 -0.04 0.00 0.00 0.00 0.00 23.12 21.35 2c8t s ALA 96 CO -0.01 -1.37 -0.19 0.00 0.00 0.00 0.00 175.76 174.18 2c8t s ALA 97 N 1.20 2.22 0.00 0.00 0.00 -0.96 -0.96 121.76 123.27 2c8t s ALA 97 Ca -0.01 -1.61 0.00 0.00 0.00 0.00 0.00 51.96 50.34 2c8t s ALA 97 Cb -0.19 -0.20 0.00 0.00 0.00 0.00 0.00 23.12 22.72 2c8t s ALA 97 CO -0.08 0.25 0.00 0.43 0.00 0.00 0.00 175.76 176.35 2c8t n SER 98 N 0.02 0.00 0.32 0.00 7.64 -0.75 0.80 113.62 121.64 2c8t n SER 98 Ca -0.11 0.00 0.20 0.00 1.01 0.00 0.00 58.87 59.97 2c8t n SER 98 Cb 0.58 0.00 1.09 0.00 -1.01 0.00 0.00 64.21 64.87 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 -0.49 1.43 0.00 -1.85 -0.11 114.93 113.91 2c8t h MET 99 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 59.70 59.59 2c8t h MET 99 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 31.60 31.59 2c8t h MET 99 CO 0.00 0.00 -0.14 0.78 0.00 0.00 0.00 176.91 177.55 2c8t h GLY 100 N 0.00 1.04 0.88 8.32 0.00 0.13 -1.08 103.07 112.36 2c8t h GLY 100 Ca 0.00 -0.88 -0.00 0.00 0.00 0.00 0.00 47.33 46.46 2c8t h GLY 100 CO -0.00 0.80 0.04 -2.09 0.00 0.00 0.00 176.54 175.29 2c8t h GLU 101 N 0.82 0.12 -0.41 4.80 4.22 -0.76 -1.37 114.58 122.00 2c8t h GLU 101 Ca 0.12 -0.02 0.08 0.00 0.08 0.00 0.00 59.36 59.62 2c8t h GLU 101 Cb 0.70 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.86 2c8t h GLU 101 CO 0.05 0.22 -0.04 0.35 -2.18 0.00 0.00 179.01 177.41 2c8t h PHE 102 N 0.00 -0.10 -0.44 0.92 3.57 -1.18 0.19 116.94 119.90 2c8t h PHE 102 Ca 0.03 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.43 2c8t h PHE 102 Cb 0.13 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 2c8t h PHE 102 CO -0.03 -0.12 -0.24 -0.07 -2.23 0.00 0.00 178.31 175.62 2c8t h LEU 103 N 0.06 0.94 -0.27 0.59 3.38 -1.18 -0.34 115.31 118.48 2c8t h LEU 103 Ca 0.20 -0.36 0.05 0.00 0.09 0.00 0.00 57.88 57.86 2c8t h LEU 103 Cb 0.30 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 2c8t h LEU 103 CO -0.37 1.13 -0.06 0.25 0.09 0.00 0.00 178.44 179.48 2c8t h LEU 104 N 0.78 -0.23 -1.93 1.67 5.85 -0.23 -2.11 115.31 119.12 2c8t h LEU 104 Ca 0.10 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 2c8t h LEU 104 Cb 0.80 0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.99 2c8t h LEU 104 CO 0.07 -0.08 -0.10 0.00 -0.34 0.00 0.00 178.44 177.99 2c8t h ALA 105 N 1.27 1.21 -0.01 1.25 0.00 -0.20 -3.00 119.26 119.77 2c8t h ALA 105 Ca 0.13 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2c8t h ALA 105 Cb 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2c8t h ALA 105 CO -0.27 0.12 -0.00 0.00 0.00 0.00 0.00 179.25 179.10 2c8t n ALA 106 N -2.23 2.62 -0.84 0.00 0.00 -0.18 -4.85 120.51 115.02 2c8t n ALA 106 Ca -0.02 -0.36 -0.31 0.00 0.00 0.00 0.00 53.44 52.76 2c8t n ALA 106 Cb 0.24 -1.29 0.15 0.00 0.00 0.00 0.00 19.45 18.55 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 -2.01 1.68 0.01 0.00 0.00 -1.14 -4.88 107.32 100.98 2c8t s GLY 107 Ca 0.41 0.45 -0.35 0.00 0.00 0.00 0.00 44.72 45.23 2c8t s GLY 107 CO 0.35 0.87 1.68 2.41 0.00 0.00 0.00 173.10 178.41 2c8t n THR 108 N -4.09 0.25 -1.71 0.90 -1.04 -0.22 -4.87 114.28 103.50 2c8t n THR 108 Ca 0.11 -0.04 -0.43 0.00 -2.04 0.00 0.00 64.05 61.64 2c8t n THR 108 Cb 0.52 -1.53 -0.03 0.00 -1.82 0.00 0.00 70.33 67.48 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 4.69 2.52 0.00 -2.82 5.02 -1.26 -0.67 118.16 125.64 2c8t n LYS 109 Ca 0.20 0.90 0.00 0.00 -2.02 0.00 0.00 58.31 57.39 2c8t n LYS 109 Cb 0.26 -2.68 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 2.97 2.45 1.54 0.72 0.00 -1.26 -4.90 105.19 106.71 2c8t n GLY 110 Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.24 2.84 -3.81 1.61 5.02 0.15 -4.87 118.16 118.87 2c8t n LYS 111 Ca 0.00 -3.80 -0.36 0.00 -2.02 0.00 0.00 58.31 52.13 2c8t n LYS 111 Cb 0.00 -2.05 -0.13 0.00 -0.02 0.00 0.00 35.03 32.83 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 -3.48 3.48 0.10 1.97 0.52 -1.25 -1.07 118.95 119.23 2c8t s ARG 112 Ca 0.47 -0.58 0.10 0.00 -0.52 0.00 0.00 55.73 55.20 2c8t s ARG 112 Cb 0.40 -3.23 -0.04 0.00 0.52 0.00 0.00 34.95 32.61 2c8t s ARG 112 CO 0.00 -0.23 -0.26 0.71 0.02 0.00 0.00 175.30 175.54 2c8t s TYR 113 N 1.55 2.24 -0.05 -0.53 1.51 0.22 0.54 117.35 122.83 2c8t s TYR 113 Ca 0.06 -0.39 0.06 0.00 -1.01 0.00 0.00 57.07 55.79 2c8t s TYR 113 Cb -0.15 -1.25 -0.01 0.00 -0.11 0.00 0.00 41.96 40.44 2c8t s TYR 113 CO 0.01 0.26 -0.25 0.00 -1.11 0.00 0.00 175.55 174.46 2c8t s ALA 114 N -0.99 2.15 0.51 3.71 0.00 -0.41 -0.12 121.76 126.61 2c8t s ALA 114 Ca 0.12 -1.05 -0.19 0.00 0.00 0.00 0.00 51.96 50.85 2c8t s ALA 114 Cb -0.10 -0.65 -0.07 0.00 0.00 0.00 0.00 23.12 22.29 2c8t s ALA 114 CO 0.05 0.43 1.02 -0.51 0.00 0.00 0.00 175.76 176.75 2c8t s LEU 115 N -0.21 3.73 0.42 0.00 1.43 -0.41 -1.80 118.68 121.84 2c8t s LEU 115 Ca -0.02 1.81 0.14 0.00 -1.03 0.00 0.00 54.13 55.03 2c8t s LEU 115 Cb -0.13 -4.54 1.01 0.00 0.03 0.00 0.00 46.19 42.55 2c8t s LEU 115 CO 0.03 -0.80 1.92 -0.65 0.23 0.00 0.00 176.35 177.09 2c8t h PRO 116 N 1.21 0.45 -0.55 1.29 0.11 -1.90 0.17 132.00 132.78 2c8t h PRO 116 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2c8t h PRO 116 Cb 1.21 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2c8t h PRO 116 CO 0.59 0.30 0.00 0.72 -0.21 0.00 0.00 178.00 179.40 2c8t n HIS 117 N -4.49 0.73 -1.79 0.65 8.25 -1.26 -4.41 115.22 112.90 2c8t n HIS 117 Ca 0.14 -0.43 -0.36 0.00 -0.26 0.00 0.00 57.72 56.81 2c8t n HIS 117 Cb 0.49 -0.01 0.06 0.00 1.12 0.00 0.00 29.99 31.65 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 -1.09 2.39 0.02 -1.41 0.00 0.58 -4.77 121.76 117.47 2c8t s ALA 118 Ca 0.40 1.03 0.02 0.00 0.00 0.00 0.00 51.96 53.40 2c8t s ALA 118 Cb 0.21 -3.48 -0.01 0.00 0.00 0.00 0.00 23.12 19.84 2c8t s ALA 118 CO 0.28 -1.46 -0.06 -0.98 0.00 0.00 0.00 175.76 173.54 2c8t s ARG 119 N -3.50 0.46 -0.17 0.00 1.70 0.26 -3.23 118.95 114.46 2c8t s ARG 119 Ca 0.78 -0.48 -0.06 0.00 -0.47 0.00 0.00 55.73 55.51 2c8t s ARG 119 Cb -0.32 -0.32 -0.03 0.00 -0.57 0.00 0.00 34.95 33.71 2c8t s ARG 119 CO 0.38 0.07 0.01 0.42 -1.08 0.00 0.00 175.30 175.11 2c8t s ILE 120 N -0.78 4.33 -0.15 4.99 1.09 -0.79 -1.93 121.20 127.94 2c8t s ILE 120 Ca -0.05 -0.20 0.01 0.00 -1.10 0.00 0.00 60.65 59.31 2c8t s ILE 120 Cb -0.06 -2.93 0.00 0.00 -1.06 0.00 0.00 42.46 38.42 2c8t s ILE 120 CO 0.00 0.47 -0.18 -0.76 -0.10 0.00 0.00 174.94 174.37 2c8t s LEU 121 N 0.40 2.31 0.22 2.97 2.01 -0.13 0.27 118.68 126.73 2c8t s LEU 121 Ca -0.00 -0.54 -0.09 0.00 0.01 0.00 0.00 54.13 53.51 2c8t s LEU 121 Cb -0.13 -1.51 -0.07 0.00 0.01 0.00 0.00 46.19 44.48 2c8t s LEU 121 CO 0.02 0.07 0.53 -0.04 1.01 0.00 0.00 176.35 177.94 2c8t s MET 122 N 0.89 3.77 -0.28 1.70 -1.94 -0.47 -1.81 119.30 121.15 2c8t s MET 122 Ca -0.05 0.21 -0.14 0.00 -1.71 0.00 0.00 55.69 54.00 2c8t s MET 122 Cb -0.15 -2.67 0.09 0.00 2.01 0.00 0.00 34.83 34.11 2c8t s MET 122 CO -0.02 0.33 0.67 -1.58 -0.01 0.00 0.00 175.02 174.41 2c8t s HIS 123 N -1.82 -1.14 -0.17 -0.03 5.04 -1.26 -3.89 115.29 112.01 2c8t s HIS 123 Ca 0.46 2.18 -0.30 0.00 -1.54 0.00 0.00 55.06 55.86 2c8t s HIS 123 Cb -0.11 0.68 -0.07 0.00 0.04 0.00 0.00 32.58 33.12 2c8t s HIS 123 CO 0.22 -0.57 2.15 0.94 -2.34 0.00 0.00 174.74 175.15 2c8t n GLN 124 N 4.64 2.06 -3.16 2.88 -0.06 -0.88 -4.78 117.38 118.10 2c8t n GLN 124 Ca -0.18 0.63 -0.33 0.00 -2.00 0.00 0.00 57.00 55.12 2c8t n GLN 124 Cb 0.56 -3.08 -0.06 0.00 -4.06 0.00 0.00 30.24 23.60 2c8t n GLN 124 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 2c8t s PRO 125 N 5.84 4.04 0.00 3.69 0.04 -1.26 -5.04 135.00 142.30 2c8t s PRO 125 Ca 0.99 0.68 0.00 0.00 0.04 0.00 0.00 61.00 62.71 2c8t s PRO 125 Cb -0.43 -2.55 0.00 0.00 0.04 0.00 0.00 34.50 31.56 2c8t s PRO 125 CO 0.39 0.22 0.00 1.28 0.04 0.00 0.00 177.00 178.93 2c8t n LEU 126 N -0.11 0.00 -0.07 -3.56 4.77 -1.26 -5.10 117.00 111.68 2c8t n LEU 126 Ca 0.02 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.93 2c8t n LEU 126 Cb 0.53 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.59 2c8t n LEU 126 CO 0.42 0.00 -0.52 -0.38 -1.33 0.00 0.00 177.39 175.58 2c8t n ILE 136 N 0.00 1.20 -0.29 -0.08 5.41 -1.26 -5.18 119.36 119.17 2c8t n ILE 136 Ca 0.00 0.22 0.07 0.00 1.00 0.00 0.00 62.75 64.03 2c8t n ILE 136 Cb 0.00 -2.14 0.22 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 -1.12 1.23 -0.37 -1.39 0.00 -2.06 -1.51 119.26 114.04 2c8t h ALA 137 Ca 0.00 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.02 2c8t h ALA 137 Cb 0.76 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 2c8t h ALA 137 CO 0.00 -0.12 0.22 0.82 0.00 0.00 0.00 179.25 180.16 2c8t h ILE 138 N 0.58 1.04 0.00 0.00 5.03 -2.06 -2.82 117.51 119.28 2c8t h ILE 138 Ca 0.45 -0.15 -0.04 0.00 -0.12 0.00 0.00 64.86 65.00 2c8t h ILE 138 Cb 0.65 0.56 -0.01 0.00 -3.03 0.00 0.00 36.82 34.99 2c8t h ILE 138 CO -0.37 0.08 -0.19 1.56 -0.68 0.00 0.00 178.15 178.55 2c8t h GLN 139 N 0.44 0.00 -0.02 2.37 4.20 -1.75 -2.73 115.11 117.62 2c8t h GLN 139 Ca 0.15 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.85 2c8t h GLN 139 Cb 0.01 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.79 2c8t h GLN 139 CO -0.07 0.19 -0.00 0.00 -0.67 0.00 0.00 178.83 178.28 2c8t h ALA 140 N 1.81 0.02 -0.37 3.87 0.00 -1.11 -0.96 119.26 122.52 2c8t h ALA 140 Ca -0.00 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.80 2c8t h ALA 140 Cb 0.35 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.04 2c8t h ALA 140 CO 0.02 -0.29 -0.37 0.93 0.00 0.00 0.00 179.25 179.54 2c8t h GLU 141 N -0.32 -0.29 -0.59 0.00 5.08 -1.33 -0.54 114.58 116.59 2c8t h GLU 141 Ca 0.00 0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.44 2c8t h GLU 141 Cb 0.37 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.63 2c8t h GLU 141 CO 0.00 -0.20 0.31 1.96 -1.00 0.00 0.00 179.01 180.09 2c8t h GLN 142 N -0.30 0.57 -0.31 2.33 4.20 -1.41 -1.74 115.11 118.44 2c8t h GLN 142 Ca 0.15 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.79 2c8t h GLN 142 Cb 0.56 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 2c8t h GLN 142 CO -0.53 0.37 0.06 0.35 -0.67 0.00 0.00 178.83 178.41 2c8t h PHE 143 N 0.58 0.54 -0.48 2.96 3.57 -0.71 -1.46 116.94 121.94 2c8t h PHE 143 Ca 0.26 -0.07 0.04 0.00 3.53 0.00 0.00 57.97 61.74 2c8t h PHE 143 Cb 0.17 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 38.72 2c8t h PHE 143 CO -0.09 0.58 0.23 0.00 -2.23 0.00 0.00 178.31 176.80 2c8t h ALA 144 N 0.89 0.61 -0.38 2.41 0.00 -0.80 0.19 119.26 122.18 2c8t h ALA 144 Ca 0.10 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2c8t h ALA 144 Cb 0.33 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2c8t h ALA 144 CO 0.00 -0.12 0.21 0.28 0.00 0.00 0.00 179.25 179.62 2c8t h VAL 145 N 0.46 1.15 0.00 0.00 2.07 -1.09 -1.77 116.25 117.07 2c8t h VAL 145 Ca 0.21 -0.39 -0.16 0.00 0.82 0.00 0.00 66.70 67.19 2c8t h VAL 145 Cb 0.13 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 2c8t h VAL 145 CO -0.16 0.15 -0.76 -0.29 0.02 0.00 0.00 177.57 176.53 2c8t h ILE 146 N 0.49 1.44 -0.23 4.57 2.10 -0.93 -2.30 117.51 122.65 2c8t h ILE 146 Ca 0.14 -2.72 -0.05 0.00 1.08 0.00 0.00 64.86 63.30 2c8t h ILE 146 Cb 0.06 2.51 -0.01 0.00 -1.09 0.00 0.00 36.82 38.29 2c8t h ILE 146 CO -0.02 0.75 -0.06 0.50 -1.08 0.00 0.00 178.15 178.23 2c8t h LYS 147 N 0.00 0.45 -0.78 2.19 3.64 -0.56 -0.58 116.57 120.92 2c8t h LYS 147 Ca -0.01 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 59.19 2c8t h LYS 147 Cb 1.45 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 33.21 2c8t h LYS 147 CO 0.10 0.69 0.47 -0.22 -2.27 0.00 0.00 179.45 178.22 2c8t h LYS 148 N 0.17 1.06 -0.45 1.90 3.64 -1.33 -1.33 116.57 120.23 2c8t h LYS 148 Ca 0.06 -0.10 -0.09 0.00 -1.27 0.00 0.00 60.65 59.25 2c8t h LYS 148 Cb 0.53 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 2c8t h LYS 148 CO 0.02 0.75 -0.08 1.49 -2.27 0.00 0.00 179.45 179.36 2c8t h GLU 149 N 1.07 0.80 0.43 1.90 4.57 -1.32 -1.28 114.58 120.75 2c8t h GLU 149 Ca 0.28 -0.26 -0.02 0.00 -1.18 0.00 0.00 59.36 58.18 2c8t h GLU 149 Cb -0.04 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.49 2c8t h GLU 149 CO -0.05 0.86 -0.20 1.98 -1.18 0.00 0.00 179.01 180.41 2c8t h MET 150 N 0.73 -0.55 -0.66 1.92 4.05 -0.69 -2.08 114.93 117.65 2c8t h MET 150 Ca 0.13 0.04 0.14 0.00 -0.28 0.00 0.00 59.70 59.73 2c8t h MET 150 Cb 0.56 0.13 -0.11 0.00 -0.80 0.00 0.00 31.60 31.38 2c8t h MET 150 CO 0.03 -0.30 0.01 0.74 0.23 0.00 0.00 176.91 177.62 2c8t h PHE 151 N -0.71 -0.04 -0.32 1.39 0.05 -1.05 0.13 116.94 116.38 2c8t h PHE 151 Ca -0.06 0.05 0.07 0.00 3.82 0.00 0.00 57.97 61.85 2c8t h PHE 151 Cb 0.51 0.12 -0.08 0.00 2.00 0.00 0.00 35.95 38.50 2c8t h PHE 151 CO -0.02 -0.18 -0.22 -0.09 -0.18 0.00 0.00 178.31 177.62 2c8t h ARG 152 N 0.12 -0.18 -0.19 1.51 2.43 -1.09 0.11 114.38 117.08 2c8t h ARG 152 Ca 0.35 0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.39 2c8t h ARG 152 Cb 0.58 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.16 2c8t h ARG 152 CO -0.57 -0.12 -0.48 -0.07 -1.51 0.00 0.00 179.97 177.22 2c8t h LEU 153 N -0.18 0.56 -0.26 3.80 3.38 -0.38 -1.15 115.31 121.08 2c8t h LEU 153 Ca 0.16 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2c8t h LEU 153 Cb 0.44 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2c8t h LEU 153 CO -0.43 0.95 0.13 -1.13 0.09 0.00 0.00 178.44 178.05 2c8t h ASN 154 N 0.41 0.33 -0.41 -0.43 -0.00 -0.12 0.27 115.58 115.62 2c8t h ASN 154 Ca 0.02 -0.11 0.08 0.00 -0.00 0.00 0.00 56.30 56.29 2c8t h ASN 154 Cb 1.00 -0.08 -0.07 0.00 -0.00 0.00 0.00 38.32 39.16 2c8t h ASN 154 CO 0.09 0.34 -0.03 0.00 -0.00 0.00 0.00 177.43 177.84 2c8t h ALA 155 N 1.00 0.36 -0.37 1.57 0.00 -0.64 -1.64 119.26 119.54 2c8t h ALA 155 Ca 0.09 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 2c8t h ALA 155 Cb 0.10 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2c8t h ALA 155 CO -0.01 -0.41 0.14 1.49 0.00 0.00 0.00 179.25 180.46 2c8t h GLU 156 N 0.08 0.57 -0.17 0.00 4.81 -0.50 0.10 114.58 119.47 2c8t h GLU 156 Ca 0.20 -0.11 0.01 0.00 -0.13 0.00 0.00 59.36 59.34 2c8t h GLU 156 Cb 0.30 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 2c8t h GLU 156 CO -0.36 0.55 0.11 0.74 -0.73 0.00 0.00 179.01 179.32 2c8t h PHE 157 N 0.46 0.17 0.00 0.92 0.05 -0.24 -3.24 116.94 115.07 2c8t h PHE 157 Ca 0.12 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.92 2c8t h PHE 157 Cb 0.21 -0.06 0.00 0.00 2.00 0.00 0.00 35.95 38.10 2c8t h PHE 157 CO 0.00 0.11 -1.43 -2.37 -0.18 0.00 0.00 178.31 174.44 2c8t n THR 158 N -4.51 0.00 -0.84 -1.55 5.66 -0.64 -4.84 114.28 107.56 2c8t n THR 158 Ca -0.00 -0.29 0.00 0.00 -3.05 0.00 0.00 64.05 60.70 2c8t n THR 158 Cb 0.11 0.37 0.00 0.00 -1.55 0.00 0.00 70.33 69.26 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 1.59 0.71 3.97 1.09 0.00 0.31 -4.27 105.19 108.59 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 -0.16 3.34 0.43 1.61 -1.52 -1.06 -5.03 119.66 117.28 2c8t s GLN 160 Ca 0.00 -0.83 -0.24 0.00 -1.95 0.00 0.00 55.36 52.34 2c8t s GLN 160 Cb 0.00 -2.86 -0.08 0.00 -0.22 0.00 0.00 33.01 29.85 2c8t s GLN 160 CO 0.00 0.34 1.18 -2.14 -0.25 0.00 0.00 175.29 174.42 2c8t s PRO 161 N -4.02 3.88 0.31 2.91 0.02 -1.26 -4.59 135.00 132.25 2c8t s PRO 161 Ca 0.37 1.82 0.05 0.00 0.02 0.00 0.00 61.00 63.26 2c8t s PRO 161 Cb -0.09 -2.53 0.71 0.00 0.02 0.00 0.00 34.50 32.61 2c8t s PRO 161 CO 0.29 -0.46 1.81 0.82 -0.33 0.00 0.00 177.00 179.13 2c8t h ILE 162 N 2.08 0.78 -0.86 2.83 2.04 -1.93 -0.38 117.51 122.07 2c8t h ILE 162 Ca -0.49 -0.28 0.12 0.00 1.00 0.00 0.00 64.86 65.22 2c8t h ILE 162 Cb 1.24 -0.10 -0.09 0.00 -0.74 0.00 0.00 36.82 37.14 2c8t h ILE 162 CO 0.61 0.15 0.48 -0.33 0.00 0.00 0.00 178.15 179.06 2c8t h GLU 163 N 0.81 0.71 -0.02 2.37 3.07 -1.99 -1.27 114.58 118.27 2c8t h GLU 163 Ca 0.54 -0.04 -0.22 0.00 -0.50 0.00 0.00 59.36 59.13 2c8t h GLU 163 Cb 0.77 -0.16 0.02 0.00 -0.84 0.00 0.00 28.75 28.54 2c8t h GLU 163 CO -0.32 0.47 -0.86 -0.09 -1.40 0.00 0.00 179.01 176.82 2c8t h ARG 164 N 0.73 0.61 -0.62 2.33 2.43 -1.47 -1.27 114.38 117.12 2c8t h ARG 164 Ca 0.45 -0.63 0.10 0.00 -0.81 0.00 0.00 59.98 59.08 2c8t h ARG 164 Cb 0.53 0.17 -0.08 0.00 -0.42 0.00 0.00 29.97 30.18 2c8t h ARG 164 CO -0.31 1.24 0.23 0.82 -1.51 0.00 0.00 179.97 180.44 2c8t h ILE 165 N 0.24 0.75 0.70 1.20 1.08 -1.04 0.12 117.51 120.56 2c8t h ILE 165 Ca -0.10 -0.14 -0.03 0.00 -0.39 0.00 0.00 64.86 64.20 2c8t h ILE 165 Cb 1.52 0.31 0.01 0.00 -3.07 0.00 0.00 36.82 35.60 2c8t h ILE 165 CO 0.17 0.07 -0.34 -0.33 -0.69 0.00 0.00 178.15 177.04 2c8t h GLU 166 N 0.40 -0.91 -0.94 2.37 5.08 -1.19 -2.39 114.58 117.01 2c8t h GLU 166 Ca 0.32 0.06 0.16 0.00 -1.00 0.00 0.00 59.36 58.90 2c8t h GLU 166 Cb 0.41 0.21 -0.10 0.00 0.50 0.00 0.00 28.75 29.76 2c8t h GLU 166 CO -0.32 -0.58 0.54 0.00 -1.00 0.00 0.00 179.01 177.65 2c8t h ALA 167 N -1.03 1.48 -0.09 3.43 0.00 -1.04 -0.65 119.26 121.36 2c8t h ALA 167 Ca -0.10 0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 2c8t h ALA 167 Cb 0.75 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2c8t h ALA 167 CO 0.16 -0.03 -0.61 -0.44 0.00 0.00 0.00 179.25 178.33 2c8t h ASP 168 N 0.73 0.37 -0.30 0.00 3.32 -0.80 -2.55 116.42 117.18 2c8t h ASP 168 Ca 0.52 -0.21 -0.14 0.00 0.02 0.00 0.00 57.03 57.22 2c8t h ASP 168 Cb 0.74 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.18 2c8t h ASP 168 CO -0.36 0.89 -0.32 0.28 -1.72 0.00 0.00 179.24 178.00 2c8t h SER 169 N 0.24 0.87 -0.70 6.45 0.02 -0.63 -1.97 113.55 117.83 2c8t h SER 169 Ca -0.01 -0.36 -0.02 0.00 -0.84 0.00 0.00 61.79 60.56 2c8t h SER 169 Cb 1.13 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 63.40 2c8t h SER 169 CO 0.10 1.12 0.37 0.44 -1.14 0.00 0.00 176.83 177.71 2c8t h ASP 170 N 0.70 0.89 -0.10 3.07 3.32 -1.04 -2.20 116.42 121.05 2c8t h ASP 170 Ca 0.07 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.01 2c8t h ASP 170 Cb 0.88 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.20 2c8t h ASP 170 CO 0.08 0.74 0.00 -2.11 -1.72 0.00 0.00 179.24 176.23 2c8t n ARG 171 N -4.47 1.31 -3.50 3.56 1.85 -0.98 -4.88 116.66 109.55 2c8t n ARG 171 Ca 0.06 -0.48 -0.26 0.00 -1.00 0.00 0.00 57.85 56.17 2c8t n ARG 171 Cb 0.10 -1.24 0.02 0.00 -1.05 0.00 0.00 32.46 30.30 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 -0.22 -4.85 -4.71 2.89 8.00 -0.90 -4.88 116.55 111.88 2c8t n ASP 172 Ca 0.10 -0.52 -0.43 0.00 0.71 0.00 0.00 54.79 54.65 2c8t n ASP 172 Cb 0.15 -3.92 -0.03 0.00 -0.02 0.00 0.00 41.12 37.30 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 -4.23 2.55 -4.14 -1.24 0.63 -0.77 -4.70 116.66 104.76 2c8t n ARG 173 Ca -0.01 0.92 -0.23 0.00 -0.92 0.00 0.00 57.85 57.60 2c8t n ARG 173 Cb 0.55 -2.72 -0.06 0.00 0.45 0.00 0.00 32.46 30.68 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 0.85 2.72 0.02 -0.14 1.48 -1.26 -1.36 118.94 121.24 2c8t s TRP 174 Ca 0.74 -0.35 0.01 0.00 -1.06 0.00 0.00 56.10 55.44 2c8t s TRP 174 Cb -0.56 -1.55 -0.01 0.00 -1.16 0.00 0.00 33.47 30.18 2c8t s TRP 174 CO 0.37 0.40 -0.04 -0.06 -4.06 0.00 0.00 176.95 173.55 2c8t s PHE 175 N -2.40 0.39 0.59 1.66 0.40 0.14 -4.98 117.98 113.77 2c8t s PHE 175 Ca 0.36 -0.35 -0.09 0.00 -0.60 0.00 0.00 56.93 56.26 2c8t s PHE 175 Cb -0.03 -0.25 -0.03 0.00 0.51 0.00 0.00 43.02 43.22 2c8t s PHE 175 CO 0.22 -0.09 0.96 0.99 0.70 0.00 0.00 175.22 178.00 2c8t s THR 176 N -0.94 4.57 0.25 0.64 2.01 -1.26 -1.89 115.64 119.02 2c8t s THR 176 Ca -0.08 0.57 -0.03 0.00 0.31 0.00 0.00 61.69 62.47 2c8t s THR 176 Cb -0.07 -3.80 0.23 0.00 0.01 0.00 0.00 72.50 68.87 2c8t s THR 176 CO -0.00 -0.96 1.75 0.00 -0.69 0.00 0.00 174.62 174.72 2c8t h ALA 177 N -0.18 1.17 -0.10 7.40 0.00 -1.76 0.78 119.26 126.57 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 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 2c8t h ALA 177 CO 0.62 -0.12 0.05 0.00 0.00 0.00 0.00 179.25 179.79 2c8t h ALA 178 N 1.54 0.13 -0.37 0.00 0.00 -1.91 -1.46 119.26 117.19 2c8t h ALA 178 Ca 0.43 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.21 2c8t h ALA 178 Cb 0.61 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2c8t h ALA 178 CO -0.37 -0.31 -0.06 0.93 0.00 0.00 0.00 179.25 179.44 2c8t h GLU 179 N 0.04 0.61 -0.42 0.00 5.08 -1.65 -2.55 114.58 115.69 2c8t h GLU 179 Ca 0.03 -0.16 -0.10 0.00 -1.00 0.00 0.00 59.36 58.13 2c8t h GLU 179 Cb 0.12 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 2c8t h GLU 179 CO -0.00 0.68 -0.15 0.00 -1.00 0.00 0.00 179.01 178.53 2c8t h ALA 180 N 1.37 0.94 -0.61 3.43 0.00 0.67 -1.74 119.26 123.32 2c8t h ALA 180 Ca 0.11 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 2c8t h ALA 180 Cb 0.46 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2c8t h ALA 180 CO 0.02 0.62 0.22 1.25 0.00 0.00 0.00 179.25 181.36 2c8t h LEU 181 N 0.71 0.86 -0.44 0.00 5.85 -0.98 -2.18 115.31 119.12 2c8t h LEU 181 Ca 0.11 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.60 2c8t h LEU 181 Cb 0.65 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 2c8t h LEU 181 CO 0.05 0.82 0.09 -0.33 -0.34 0.00 0.00 178.44 178.72 2c8t h GLU 182 N 0.86 0.71 0.00 1.25 5.08 -1.25 -3.03 114.58 118.20 2c8t h GLU 182 Ca 0.20 -0.18 -0.07 0.00 -1.00 0.00 0.00 59.36 58.32 2c8t h GLU 182 Cb 0.24 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 2c8t h GLU 182 CO -0.01 0.72 -0.31 -0.92 -1.00 0.00 0.00 179.01 177.49 2c8t h TYR 183 N 0.58 0.00 0.00 4.33 3.20 -1.29 -3.47 116.97 120.32 2c8t h TYR 183 Ca 0.14 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.01 2c8t h TYR 183 Cb 0.34 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.61 2c8t h TYR 183 CO 0.02 0.31 0.00 0.41 -1.64 0.00 0.00 178.16 177.26 2c8t n GLY 184 N -0.22 1.28 0.27 1.82 0.00 -0.95 -4.70 105.19 102.69 2c8t n GLY 184 Ca -0.01 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.18 2c8t n GLY 184 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2c8t h PHE 185 N 0.00 0.00 -2.64 1.61 -1.00 -1.66 -3.39 116.94 109.86 2c8t h PHE 185 Ca 0.00 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.68 2c8t h PHE 185 Cb 0.00 0.00 -0.21 0.00 3.61 0.00 0.00 35.95 39.35 2c8t h PHE 185 CO 0.00 0.00 -0.14 0.08 -1.61 0.00 0.00 178.31 176.64 2c8t s VAL 186 N -3.64 0.02 -0.12 -0.55 1.01 -1.25 -3.97 120.40 111.91 2c8t s VAL 186 Ca 0.01 -0.18 0.16 0.00 0.00 0.00 0.00 61.98 61.98 2c8t s VAL 186 Cb 0.09 -0.71 -0.23 0.00 0.00 0.00 0.00 36.38 35.53 2c8t s VAL 186 CO 0.54 -0.10 0.46 0.47 0.00 0.00 0.00 175.10 176.47 2c8t n ASP 187 N 1.87 0.49 -3.95 3.32 8.00 0.19 -4.58 116.55 121.90 2c8t n ASP 187 Ca -0.18 0.23 -0.09 0.00 0.71 0.00 0.00 54.79 55.46 2c8t n ASP 187 Cb 0.56 0.49 -0.10 0.00 -0.02 0.00 0.00 41.12 42.05 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 -2.67 0.21 -0.23 1.24 3.76 -0.69 -5.00 115.29 111.91 2c8t s HIS 188 Ca -0.07 -0.47 -0.07 0.00 -0.15 0.00 0.00 55.06 54.31 2c8t s HIS 188 Cb 0.08 -0.16 -0.03 0.00 1.11 0.00 0.00 32.58 33.58 2c8t s HIS 188 CO 0.83 -0.27 0.05 0.42 -0.85 0.00 0.00 174.74 174.92 2c8t s ILE 189 N -1.92 4.31 -0.04 0.60 1.01 -1.26 -1.28 121.20 122.61 2c8t s ILE 189 Ca -0.11 -0.18 -0.12 0.00 0.00 0.00 0.00 60.65 60.24 2c8t s ILE 189 Cb -0.06 -2.99 -0.05 0.00 0.01 0.00 0.00 42.46 39.37 2c8t s ILE 189 CO -0.02 0.38 0.32 0.27 0.00 0.00 0.00 174.94 175.88 2c8t s ILE 190 N 1.30 5.19 0.00 2.92 -4.36 -0.75 -4.95 121.20 120.55 2c8t s ILE 190 Ca 0.05 0.63 0.00 0.00 -0.26 0.00 0.00 60.65 61.07 2c8t s ILE 190 Cb -0.15 -3.61 0.00 0.00 1.25 0.00 0.00 42.46 39.96 2c8t s ILE 190 CO 0.03 0.59 0.00 0.41 0.24 0.00 0.00 174.94 176.21 2c8t n THR 191 N 1.87 0.00 -2.86 8.37 -1.04 -1.26 -3.96 114.28 115.41 2c8t n THR 191 Ca -0.16 0.00 -0.32 0.00 -2.04 0.00 0.00 64.05 61.53 2c8t n THR 191 Cb 0.53 -0.90 -0.06 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 4.06 0.75 -2.82 0.52 -1.26 -5.03 118.95 115.16 2c8t s ARG 192 Ca 0.00 0.87 -0.02 0.00 -0.52 0.00 0.00 55.73 56.06 2c8t s ARG 192 Cb 0.00 -2.28 0.14 0.00 0.52 0.00 0.00 34.95 33.33 2c8t s ARG 192 CO 0.00 -0.01 1.03 0.00 0.02 0.00 0.00 175.30 176.34 2c8t s ALA 193 N -2.21 3.56 0.00 2.13 0.00 -1.26 -5.21 121.76 118.77 2c8t s ALA 193 Ca 0.58 -1.69 0.00 0.00 0.00 0.00 0.00 51.96 50.85 2c8t s ALA 193 Cb -0.10 -2.08 0.00 0.00 0.00 0.00 0.00 23.12 20.95 2c8t s ALA 193 CO 0.19 -1.57 0.00 0.72 0.00 0.00 0.00 175.76 175.11