#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 -0.89 -0.66 1.04 5.85 -2.05 0.15 115.31 118.75 2c8t h LEU 16 Ca 0.00 0.10 0.13 0.00 0.84 0.00 0.00 57.88 58.95 2c8t h LEU 16 Cb 0.00 0.33 -0.13 0.00 0.37 0.00 0.00 40.66 41.23 2c8t h LEU 16 CO 0.00 -0.41 -0.23 0.74 -0.34 0.00 0.00 178.44 178.20 2c8t h THR 17 N -0.56 0.26 -0.55 1.05 2.02 -2.06 -0.11 112.91 112.96 2c8t h THR 17 Ca 0.02 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.13 2c8t h THR 17 Cb 0.57 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 2c8t h THR 17 CO -0.15 0.00 0.08 0.44 0.37 0.00 0.00 175.52 176.25 2c8t h ASP 18 N -0.05 0.88 -0.68 4.18 3.32 -1.88 -2.02 116.42 120.17 2c8t h ASP 18 Ca 0.30 -0.27 0.06 0.00 0.02 0.00 0.00 57.03 57.15 2c8t h ASP 18 Cb 0.52 -0.23 -0.06 0.00 0.22 0.00 0.00 39.33 39.78 2c8t h ASP 18 CO -0.71 0.93 0.37 -1.28 -1.72 0.00 0.00 179.24 176.83 2c8t h SER 19 N 0.80 0.55 -0.19 6.45 0.87 0.13 0.15 113.55 122.30 2c8t h SER 19 Ca 0.17 0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.74 2c8t h SER 19 Cb 0.43 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.31 2c8t h SER 19 CO 0.01 0.35 0.05 0.58 -0.53 0.00 0.00 176.83 177.29 2c8t h VAL 20 N 0.68 1.20 -0.30 2.23 2.07 -0.81 -1.70 116.25 119.62 2c8t h VAL 20 Ca 0.31 -0.62 -0.07 0.00 0.82 0.00 0.00 66.70 67.14 2c8t h VAL 20 Cb 0.21 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 2c8t h VAL 20 CO -0.20 0.19 -0.12 1.88 0.02 0.00 0.00 177.57 179.35 2c8t h TYR 21 N 0.13 0.55 0.25 1.57 -1.99 -0.68 -1.13 116.97 115.67 2c8t h TYR 21 Ca 0.06 -0.08 -0.01 0.00 2.00 0.00 0.00 58.73 60.70 2c8t h TYR 21 Cb 0.25 -0.15 0.00 0.00 2.00 0.00 0.00 36.73 38.83 2c8t h TYR 21 CO 0.01 0.62 -0.12 0.93 -0.00 0.00 0.00 178.16 179.59 2c8t h GLU 22 N 0.47 -0.33 -0.74 4.88 5.08 -0.68 -0.42 114.58 122.84 2c8t h GLU 22 Ca 0.09 0.02 0.11 0.00 -1.00 0.00 0.00 59.36 58.59 2c8t h GLU 22 Cb 0.49 0.07 -0.08 0.00 0.50 0.00 0.00 28.75 29.73 2c8t h GLU 22 CO 0.03 -0.13 0.35 0.00 -1.00 0.00 0.00 179.01 178.26 2c8t h ARG 23 N -0.47 0.54 0.00 2.33 3.08 -1.05 -0.62 114.38 118.20 2c8t h ARG 23 Ca -0.03 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.93 2c8t h ARG 23 Cb 0.35 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 2c8t h ARG 23 CO 0.06 0.36 -0.25 1.25 -1.07 0.00 0.00 179.97 180.31 2c8t h LEU 24 N 0.55 0.00 -0.63 3.04 5.85 -1.04 -1.65 115.31 121.44 2c8t h LEU 24 Ca 0.38 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.97 2c8t h LEU 24 Cb 0.48 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 2c8t h LEU 24 CO -0.32 0.25 -0.65 0.25 -0.34 0.00 0.00 178.44 177.64 2c8t h LEU 25 N 0.00 0.00 -0.37 2.25 5.85 0.51 -0.99 115.31 122.56 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 0.61 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.64 2c8t h LEU 25 CO 0.03 0.65 0.00 -1.20 -0.34 0.00 0.00 178.44 177.58 2c8t n SER 26 N -3.67 0.40 -1.66 1.25 7.64 -0.63 -1.94 113.62 115.01 2c8t n SER 26 Ca -0.01 0.59 0.09 0.00 1.01 0.00 0.00 58.87 60.55 2c8t n SER 26 Cb 0.66 -0.68 0.37 0.00 -1.01 0.00 0.00 64.21 63.55 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 -1.93 4.00 -3.88 1.43 -0.58 -0.78 -4.93 120.64 113.97 2c8t n GLU 27 Ca 0.03 -2.96 -0.30 0.00 -0.42 0.00 0.00 57.16 53.50 2c8t n GLU 27 Cb 0.22 -1.98 0.02 0.00 -0.57 0.00 0.00 31.44 29.13 2c8t n GLU 27 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2c8t n ARG 28 N 1.03 -5.04 -5.25 3.49 5.12 -0.82 -4.89 116.66 110.30 2c8t n ARG 28 Ca 0.26 0.57 -0.32 0.00 -1.93 0.00 0.00 57.85 56.44 2c8t n ARG 28 Cb 0.96 -5.43 -0.17 0.00 -1.16 0.00 0.00 32.46 26.67 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 -3.26 2.06 0.04 0.55 1.01 -0.44 -0.75 121.20 120.40 2c8t s ILE 29 Ca 0.65 -1.05 0.01 0.00 0.00 0.00 0.00 60.65 60.26 2c8t s ILE 29 Cb -0.33 -1.76 -0.02 0.00 0.01 0.00 0.00 42.46 40.36 2c8t s ILE 29 CO 0.80 0.57 -0.06 -0.63 0.00 0.00 0.00 174.94 175.62 2c8t s ILE 30 N 0.05 0.38 -0.08 2.92 1.01 0.40 -3.55 121.20 122.33 2c8t s ILE 30 Ca -0.10 -1.13 0.03 0.00 0.00 0.00 0.00 60.65 59.45 2c8t s ILE 30 Cb -0.16 -0.62 0.01 0.00 0.01 0.00 0.00 42.46 41.70 2c8t s ILE 30 CO 0.06 -0.50 -0.17 -0.36 0.00 0.00 0.00 174.94 173.97 2c8t s PHE 31 N -1.74 1.89 -0.47 3.97 0.40 -1.26 -0.47 117.98 120.30 2c8t s PHE 31 Ca -0.09 -0.75 -0.10 0.00 -0.60 0.00 0.00 56.93 55.39 2c8t s PHE 31 Cb -0.08 -1.32 0.11 0.00 0.51 0.00 0.00 43.02 42.24 2c8t s PHE 31 CO -0.01 -0.35 0.35 -1.17 0.70 0.00 0.00 175.22 174.74 2c8t s LEU 32 N 0.58 5.68 -0.05 -0.37 2.96 0.07 -4.93 118.68 122.62 2c8t s LEU 32 Ca -0.15 -1.83 0.07 0.00 -0.22 0.00 0.00 54.13 52.00 2c8t s LEU 32 Cb -0.16 -2.03 0.14 0.00 0.50 0.00 0.00 46.19 44.63 2c8t s LEU 32 CO 0.05 -0.69 1.08 0.61 -1.32 0.00 0.00 176.35 176.08 2c8t n GLY 33 N 4.95 3.61 0.00 7.98 0.00 -1.26 -0.69 105.19 119.79 2c8t n GLY 33 Ca -0.09 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.71 0.00 -4.67 1.61 3.41 -1.23 -4.75 113.62 107.27 2c8t n SER 34 Ca 0.07 -0.74 -0.57 0.00 -0.26 0.00 0.00 58.87 57.37 2c8t n SER 34 Cb 0.41 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.29 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 1.05 -2.27 4.33 4.07 -1.26 -4.31 120.64 122.25 2c8t n GLU 35 Ca 0.00 0.38 -0.33 0.00 -0.06 0.00 0.00 57.16 57.15 2c8t n GLU 35 Cb 0.00 -2.04 -0.04 0.00 -0.06 0.00 0.00 31.44 29.30 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 2.58 3.68 0.50 6.31 1.01 0.22 -4.84 120.40 129.85 2c8t s VAL 36 Ca 0.95 -0.70 0.06 0.00 0.00 0.00 0.00 61.98 62.29 2c8t s VAL 36 Cb -1.07 -4.53 0.01 0.00 0.00 0.00 0.00 36.38 30.78 2c8t s VAL 36 CO 0.61 -1.38 0.30 0.54 0.00 0.00 0.00 175.10 175.17 2c8t s ASN 37 N 6.49 4.56 0.21 3.32 4.22 -1.26 -1.36 114.94 131.12 2c8t s ASN 37 Ca 0.60 -1.21 -0.10 0.00 -2.14 0.00 0.00 52.86 50.01 2c8t s ASN 37 Cb -0.03 0.13 0.16 0.00 1.28 0.00 0.00 41.25 42.80 2c8t s ASN 37 CO -0.02 -0.90 1.88 0.44 -2.04 0.00 0.00 177.10 176.46 2c8t h ASP 38 N 1.00 0.87 0.42 3.54 3.32 -1.95 0.11 116.42 123.73 2c8t h ASP 38 Ca -0.39 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.62 2c8t h ASP 38 Cb 1.29 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.61 2c8t h ASP 38 CO 0.62 0.63 -0.34 -0.08 -1.72 0.00 0.00 179.24 178.35 2c8t h GLU 39 N 1.03 -0.73 -0.71 3.56 4.57 -1.97 0.15 114.58 120.48 2c8t h GLU 39 Ca 0.28 0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.51 2c8t h GLU 39 Cb -0.11 0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 28.61 2c8t h GLU 39 CO -0.06 -0.49 0.46 0.82 -1.18 0.00 0.00 179.01 178.56 2c8t h ILE 40 N -0.76 1.19 -0.09 2.32 2.04 -1.84 -2.00 117.51 118.37 2c8t h ILE 40 Ca -0.04 -0.36 0.04 0.00 1.00 0.00 0.00 64.86 65.50 2c8t h ILE 40 Cb 0.66 0.16 -0.05 0.00 -0.74 0.00 0.00 36.82 36.85 2c8t h ILE 40 CO -0.01 0.18 -0.22 0.00 0.00 0.00 0.00 178.15 178.10 2c8t h ALA 41 N 1.25 -0.21 -0.55 1.87 0.00 -0.52 0.44 119.26 121.54 2c8t h ALA 41 Ca 0.26 0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.29 2c8t h ALA 41 Cb -0.09 0.41 -0.07 0.00 0.00 0.00 0.00 17.79 18.04 2c8t h ALA 41 CO -0.05 -0.69 0.16 -0.91 0.00 0.00 0.00 179.25 177.76 2c8t h ASN 42 N -0.29 0.09 -0.76 0.00 2.35 -0.54 0.08 115.58 116.52 2c8t h ASN 42 Ca 0.09 0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.91 2c8t h ASN 42 Cb 0.42 0.10 -0.04 0.00 0.05 0.00 0.00 38.32 38.86 2c8t h ASN 42 CO -0.26 0.07 0.43 -0.09 -1.65 0.00 0.00 177.43 175.93 2c8t h ARG 43 N 0.31 1.05 -0.27 0.81 2.43 -0.53 -0.02 114.38 118.15 2c8t h ARG 43 Ca 0.28 -0.11 -0.03 0.00 -0.81 0.00 0.00 59.98 59.30 2c8t h ARG 43 Cb 0.37 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 2c8t h ARG 43 CO -0.33 0.76 0.04 -0.07 -1.51 0.00 0.00 179.97 178.86 2c8t h LEU 44 N 1.04 0.44 -0.33 3.80 3.38 -0.33 -0.85 115.31 122.46 2c8t h LEU 44 Ca 0.27 -0.27 0.04 0.00 0.09 0.00 0.00 57.88 58.01 2c8t h LEU 44 Cb 0.01 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 2c8t h LEU 44 CO -0.05 0.60 0.10 0.00 0.09 0.00 0.00 178.44 179.18 2c8t h ALA 46 N 1.22 0.33 -0.08 0.00 0.00 -0.82 0.56 119.26 120.46 2c8t h ALA 46 Ca 0.15 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.21 2c8t h ALA 46 Cb 0.13 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2c8t h ALA 46 CO -0.16 -0.42 0.02 1.96 0.00 0.00 0.00 179.25 180.64 2c8t h GLN 47 N 0.05 0.05 -0.50 0.00 4.20 -0.12 -0.69 115.11 118.09 2c8t h GLN 47 Ca 0.20 -0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.95 2c8t h GLN 47 Cb 0.30 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.03 2c8t h GLN 47 CO -0.38 0.03 0.26 0.82 -0.67 0.00 0.00 178.83 178.89 2c8t h ILE 48 N 0.05 0.97 -0.62 2.54 2.04 -0.29 -1.19 117.51 121.01 2c8t h ILE 48 Ca 0.03 -0.17 0.01 0.00 1.00 0.00 0.00 64.86 65.73 2c8t h ILE 48 Cb 0.03 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 36.49 2c8t h ILE 48 CO -0.05 0.09 0.41 -0.07 0.00 0.00 0.00 178.15 178.54 2c8t h LEU 49 N 0.51 0.71 0.18 1.44 3.38 -0.60 -0.91 115.31 120.02 2c8t h LEU 49 Ca 0.22 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 2c8t h LEU 49 Cb 0.12 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 2c8t h LEU 49 CO -0.15 0.52 -0.09 0.25 0.09 0.00 0.00 178.44 179.06 2c8t h LEU 50 N 0.84 -0.23 0.05 1.67 5.85 -0.58 0.15 115.31 123.07 2c8t h LEU 50 Ca 0.23 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.96 2c8t h LEU 50 Cb -0.10 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 40.99 2c8t h LEU 50 CO -0.05 -0.16 -0.05 -0.07 -0.34 0.00 0.00 178.44 177.78 2c8t h LEU 51 N -0.25 -0.12 -0.85 2.25 3.38 -1.10 0.35 115.31 118.96 2c8t h LEU 51 Ca -0.02 0.01 0.13 0.00 0.09 0.00 0.00 57.88 58.09 2c8t h LEU 51 Cb 0.20 0.04 -0.09 0.00 0.09 0.00 0.00 40.66 40.91 2c8t h LEU 51 CO 0.03 -0.07 0.46 0.00 0.09 0.00 0.00 178.44 178.95 2c8t h ALA 52 N 0.84 1.25 -0.17 1.53 0.00 -1.03 -1.06 119.26 120.61 2c8t h ALA 52 Ca 0.00 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 2c8t h ALA 52 Cb 0.10 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2c8t h ALA 52 CO -0.01 -0.00 -0.33 0.00 0.00 0.00 0.00 179.25 178.90 2c8t h ALA 53 N 1.52 1.12 -0.04 0.00 0.00 -0.28 -2.95 119.26 118.63 2c8t h ALA 53 Ca 0.44 -0.37 -0.17 0.00 0.00 0.00 0.00 54.91 54.81 2c8t h ALA 53 Cb 0.54 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2c8t h ALA 53 CO -0.31 0.56 -0.73 0.93 0.00 0.00 0.00 179.25 179.70 2c8t h GLU 54 N 0.30 0.23 -0.72 0.00 5.08 0.26 -3.43 114.58 116.30 2c8t h GLU 54 Ca 0.04 -0.19 0.15 0.00 -1.00 0.00 0.00 59.36 58.35 2c8t h GLU 54 Cb 0.73 0.04 -0.21 0.00 0.50 0.00 0.00 28.75 29.82 2c8t h GLU 54 CO 0.06 0.86 -0.11 0.34 -1.00 0.00 0.00 179.01 179.15 2c8t s ASP 55 N -6.91 -1.01 0.00 1.42 -1.08 -0.62 -5.05 116.67 103.41 2c8t s ASP 55 Ca -0.04 0.60 0.29 0.00 -0.52 0.00 0.00 52.55 52.88 2c8t s ASP 55 Cb 0.11 1.84 1.16 0.00 -1.46 0.00 0.00 42.92 44.57 2c8t s ASP 55 CO 0.81 -0.19 1.85 0.00 0.52 0.00 0.00 175.17 178.17 2c8t n ALA 56 N 5.44 2.63 -0.11 3.66 0.00 -1.12 -4.06 120.51 126.95 2c8t n ALA 56 Ca -0.03 -0.18 -0.15 0.00 0.00 0.00 0.00 53.44 53.08 2c8t n ALA 56 Cb 0.52 -1.39 -0.14 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 -1.37 1.26 -4.78 0.00 3.41 -1.26 -3.21 113.62 107.65 2c8t n SER 57 Ca 0.09 -0.06 -0.35 0.00 -0.26 0.00 0.00 58.87 58.30 2c8t n SER 57 Cb 0.31 0.07 -0.02 0.00 -0.26 0.00 0.00 64.21 64.32 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 3.61 0.81 4.33 1.02 -1.26 -4.73 119.74 121.01 2c8t s LYS 58 Ca -0.25 1.50 -0.10 0.00 0.02 0.00 0.00 55.97 57.14 2c8t s LYS 58 Cb 0.08 -2.09 0.08 0.00 -0.52 0.00 0.00 37.83 35.38 2c8t s LYS 58 CO 0.70 -0.61 1.10 -0.51 -0.92 0.00 0.00 175.35 175.11 2c8t s ASP 59 N -1.83 4.13 -0.07 2.83 1.01 -1.26 -4.57 116.67 116.90 2c8t s ASP 59 Ca 0.69 1.88 0.04 0.00 0.71 0.00 0.00 52.55 55.87 2c8t s ASP 59 Cb -0.21 -2.51 -0.02 0.00 1.01 0.00 0.00 42.92 41.19 2c8t s ASP 59 CO 0.24 -2.28 -0.18 -0.63 0.21 0.00 0.00 175.17 172.53 2c8t s ILE 60 N -2.85 2.73 -0.24 0.77 1.01 -0.70 -4.87 121.20 117.04 2c8t s ILE 60 Ca 0.62 -0.82 -0.07 0.00 0.00 0.00 0.00 60.65 60.39 2c8t s ILE 60 Cb -0.18 -2.07 -0.02 0.00 0.01 0.00 0.00 42.46 40.20 2c8t s ILE 60 CO 0.56 0.57 0.05 -0.44 0.00 0.00 0.00 174.94 175.68 2c8t s SER 61 N -0.29 4.96 -0.25 3.58 0.01 0.07 -0.02 113.70 121.75 2c8t s SER 61 Ca 0.02 -0.24 -0.04 0.00 1.31 0.00 0.00 55.95 57.00 2c8t s SER 61 Cb -0.13 -1.88 0.01 0.00 0.21 0.00 0.00 66.02 64.23 2c8t s SER 61 CO 0.03 -0.03 -0.01 -0.22 0.41 0.00 0.00 173.24 173.42 2c8t s LEU 62 N 1.56 3.31 -0.22 2.44 2.96 0.84 -0.46 118.68 129.12 2c8t s LEU 62 Ca 0.06 -0.68 -0.12 0.00 -0.22 0.00 0.00 54.13 53.17 2c8t s LEU 62 Cb -0.15 -1.75 -0.05 0.00 0.50 0.00 0.00 46.19 44.74 2c8t s LEU 62 CO 0.02 -0.12 0.21 -0.31 -1.32 0.00 0.00 176.35 174.84 2c8t s TYR 63 N 1.42 3.35 -0.19 5.38 1.51 0.38 -0.97 117.35 128.24 2c8t s TYR 63 Ca 0.03 0.34 -0.02 0.00 -1.01 0.00 0.00 57.07 56.40 2c8t s TYR 63 Cb -0.16 -2.31 -0.01 0.00 -0.11 0.00 0.00 41.96 39.37 2c8t s TYR 63 CO -0.02 0.09 -0.09 0.42 -1.11 0.00 0.00 175.55 174.84 2c8t s ILE 64 N 0.99 3.09 -0.44 2.71 1.01 0.21 -0.75 121.20 128.02 2c8t s ILE 64 Ca 0.10 -0.60 0.05 0.00 0.00 0.00 0.00 60.65 60.20 2c8t s ILE 64 Cb -0.13 -2.36 0.17 0.00 0.01 0.00 0.00 42.46 40.14 2c8t s ILE 64 CO 0.04 0.47 0.47 0.21 0.00 0.00 0.00 174.94 176.13 2c8t s ASN 65 N 1.15 0.46 -0.08 3.58 3.84 0.13 -0.76 114.94 123.27 2c8t s ASN 65 Ca 0.01 -2.34 -0.07 0.00 0.21 0.00 0.00 52.86 50.68 2c8t s ASN 65 Cb -0.14 0.51 0.02 0.00 -0.55 0.00 0.00 41.25 41.09 2c8t s ASN 65 CO -0.03 -0.15 0.21 -0.55 -2.79 0.00 0.00 177.10 173.80 2c8t s SER 66 N 0.61 -0.22 0.00 -4.21 0.15 0.10 -3.57 113.70 106.56 2c8t s SER 66 Ca 0.29 0.43 0.13 0.00 0.70 0.00 0.00 55.95 57.50 2c8t s SER 66 Cb -0.02 0.42 0.78 0.00 -1.71 0.00 0.00 66.02 65.50 2c8t s SER 66 CO -0.11 -0.09 1.45 -0.81 1.20 0.00 0.00 173.24 174.88 2c8t n PRO 67 N 3.15 0.93 0.00 5.44 -0.04 -1.26 -2.07 135.00 141.15 2c8t n PRO 67 Ca -0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 2c8t n PRO 67 Cb 0.58 -1.22 0.00 0.00 -0.04 0.00 0.00 33.50 32.82 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 0.62 0.08 0.00 0.55 0.00 -1.10 -4.39 105.19 100.94 2c8t n GLY 68 Ca 0.10 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 45.02 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 0.39 3.58 -0.02 0.00 -1.26 0.71 105.19 108.58 2c8t n GLY 69 Ca 0.00 -1.54 -0.56 0.00 0.00 0.00 0.00 46.02 43.92 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 1.05 0.27 1.61 2.88 -0.47 -4.51 113.62 114.46 2c8t n SER 70 Ca 0.00 1.14 -0.16 0.00 -1.33 0.00 0.00 58.87 58.51 2c8t n SER 70 Cb 0.00 -1.06 -0.08 0.00 -0.75 0.00 0.00 64.21 62.31 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 3.46 0.49 -0.51 2.46 2.04 -1.99 -1.20 117.51 122.27 2c8t h ILE 71 Ca -0.49 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.31 2c8t h ILE 71 Cb 1.37 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.92 2c8t h ILE 71 CO 0.76 0.00 0.07 0.77 0.00 0.00 0.00 178.15 179.75 2c8t h SER 72 N -0.66 0.76 0.09 1.72 4.64 -1.96 0.32 113.55 118.45 2c8t h SER 72 Ca -0.06 -0.15 0.01 0.00 -0.47 0.00 0.00 61.79 61.12 2c8t h SER 72 Cb 0.52 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.39 2c8t h SER 72 CO 0.08 0.78 -0.14 0.00 -0.87 0.00 0.00 176.83 176.68 2c8t h ALA 73 N 1.31 -0.24 -0.17 5.18 0.00 -1.89 -0.79 119.26 122.67 2c8t h ALA 73 Ca 0.16 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2c8t h ALA 73 Cb 0.36 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2c8t h ALA 73 CO 0.01 -0.66 0.10 0.78 0.00 0.00 0.00 179.25 179.47 2c8t h GLY 74 N -0.29 0.24 1.70 0.00 0.00 -0.15 -2.50 103.07 102.08 2c8t h GLY 74 Ca 0.02 -0.09 -0.18 0.00 0.00 0.00 0.00 47.33 47.07 2c8t h GLY 74 CO -0.07 0.09 -0.76 1.98 0.00 0.00 0.00 176.54 177.78 2c8t h MET 75 N 0.23 0.29 -0.16 4.80 -1.53 0.09 -1.21 114.93 117.44 2c8t h MET 75 Ca 0.06 -0.26 0.01 0.00 -3.44 0.00 0.00 59.70 56.07 2c8t h MET 75 Cb 0.00 0.06 -0.01 0.00 -0.55 0.00 0.00 31.60 31.10 2c8t h MET 75 CO -0.01 0.92 0.09 0.00 0.14 0.00 0.00 176.91 178.05 2c8t h ALA 76 N 1.00 0.20 -0.16 0.39 0.00 -0.73 -0.89 119.26 119.07 2c8t h ALA 76 Ca -0.03 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.91 2c8t h ALA 76 Cb 1.33 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 2c8t h ALA 76 CO 0.12 -0.34 -0.01 0.82 0.00 0.00 0.00 179.25 179.84 2c8t h ILE 77 N 0.19 0.88 -0.19 0.00 2.04 -1.22 -2.04 117.51 117.17 2c8t h ILE 77 Ca 0.06 -0.01 0.05 0.00 1.00 0.00 0.00 64.86 65.96 2c8t h ILE 77 Cb 0.00 0.84 -0.06 0.00 -0.74 0.00 0.00 36.82 36.86 2c8t h ILE 77 CO -0.04 0.01 -0.21 0.22 0.00 0.00 0.00 178.15 178.13 2c8t h TYR 78 N 0.04 -0.56 -0.70 1.37 3.20 -1.06 -0.10 116.97 119.15 2c8t h TYR 78 Ca 0.07 0.03 0.15 0.00 3.14 0.00 0.00 58.73 62.13 2c8t h TYR 78 Cb 0.09 0.28 -0.11 0.00 1.54 0.00 0.00 36.73 38.53 2c8t h TYR 78 CO -0.16 -0.29 0.11 -0.44 -1.64 0.00 0.00 178.16 175.73 2c8t h ASP 79 N -0.24 -0.11 -0.55 -2.11 3.32 -0.95 -0.97 116.42 114.80 2c8t h ASP 79 Ca 0.12 0.15 -0.09 0.00 0.02 0.00 0.00 57.03 57.23 2c8t h ASP 79 Cb 0.42 0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 2c8t h ASP 79 CO -0.33 -0.08 0.00 0.74 -1.72 0.00 0.00 179.24 177.85 2c8t h THR 80 N 0.20 1.26 -0.20 0.35 2.02 -0.61 0.29 112.91 116.23 2c8t h THR 80 Ca 0.39 -1.12 0.04 0.00 0.77 0.00 0.00 66.41 66.48 2c8t h THR 80 Cb 0.66 0.81 -0.04 0.00 -1.74 0.00 0.00 68.15 67.84 2c8t h THR 80 CO -0.53 0.41 -0.05 0.24 0.37 0.00 0.00 175.52 175.95 2c8t h MET 81 N 0.92 -0.01 -0.47 6.66 2.86 -0.04 0.66 114.93 125.52 2c8t h MET 81 Ca 0.17 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.80 2c8t h MET 81 Cb 0.54 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.17 2c8t h MET 81 CO 0.03 -0.00 0.27 0.28 1.06 0.00 0.00 176.91 178.55 2c8t h VAL 82 N -0.01 1.15 -0.17 -2.22 2.07 -0.74 -2.84 116.25 113.50 2c8t h VAL 82 Ca 0.10 -0.36 0.04 0.00 0.82 0.00 0.00 66.70 67.30 2c8t h VAL 82 Cb 0.15 0.54 -0.05 0.00 -1.52 0.00 0.00 31.29 30.42 2c8t h VAL 82 CO -0.21 0.16 -0.12 0.25 0.02 0.00 0.00 177.57 177.66 2c8t h LEU 83 N 0.62 -0.40 -9.37 2.57 5.85 -0.07 -3.42 115.31 111.10 2c8t h LEU 83 Ca 0.17 0.08 -0.57 0.00 0.84 0.00 0.00 57.88 58.40 2c8t h LEU 83 Cb 0.01 0.20 0.03 0.00 0.37 0.00 0.00 40.66 41.27 2c8t h LEU 83 CO -0.03 -0.16 1.12 0.00 -0.34 0.00 0.00 178.44 179.03 2c8t n ALA 84 N -2.54 1.42 0.14 1.25 0.00 0.19 -4.84 120.51 116.13 2c8t n ALA 84 Ca -0.02 0.28 0.10 0.00 0.00 0.00 0.00 53.44 53.79 2c8t n ALA 84 Cb 0.19 -2.57 0.60 0.00 0.00 0.00 0.00 19.45 17.68 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 9.28 0.12 -7.08 0.00 0.11 -1.83 -3.44 132.00 129.15 2c8t h PRO 85 Ca -0.48 -0.01 -0.50 0.00 0.11 0.00 0.00 66.00 65.12 2c8t h PRO 85 Cb 1.25 -0.03 0.04 0.00 0.11 0.00 0.00 31.00 32.37 2c8t h PRO 85 CO 0.94 0.08 0.23 0.00 -0.21 0.00 0.00 178.00 179.04 2c8t s ASP 87 N -4.04 4.81 -0.28 0.00 1.01 -1.26 -4.89 116.67 112.02 2c8t s ASP 87 Ca 0.51 2.54 0.02 0.00 0.71 0.00 0.00 52.55 56.32 2c8t s ASP 87 Cb -0.11 -2.61 0.08 0.00 1.01 0.00 0.00 42.92 41.29 2c8t s ASP 87 CO 0.47 -1.86 -0.00 -0.63 0.21 0.00 0.00 175.17 173.35 2c8t s ILE 88 N -1.47 1.66 0.25 0.77 1.01 -1.26 -1.72 121.20 120.44 2c8t s ILE 88 Ca 0.81 -1.59 -0.30 0.00 0.00 0.00 0.00 60.65 59.57 2c8t s ILE 88 Cb -0.35 -2.05 -0.09 0.00 0.01 0.00 0.00 42.46 39.98 2c8t s ILE 88 CO 0.37 -0.34 1.00 0.00 0.00 0.00 0.00 174.94 175.98 2c8t s ALA 89 N 1.28 3.37 -0.09 9.38 0.00 0.98 -1.53 121.76 135.13 2c8t s ALA 89 Ca 0.01 0.73 0.04 0.00 0.00 0.00 0.00 51.96 52.75 2c8t s ALA 89 Cb -0.19 -3.26 -0.00 0.00 0.00 0.00 0.00 23.12 19.67 2c8t s ALA 89 CO -0.10 0.06 -0.24 0.99 0.00 0.00 0.00 175.76 176.47 2c8t s THR 90 N -1.14 2.11 -0.15 0.00 2.01 -0.18 -0.11 115.64 118.18 2c8t s THR 90 Ca 0.43 -1.01 -0.00 0.00 0.31 0.00 0.00 61.69 61.41 2c8t s THR 90 Cb -0.28 -1.80 0.03 0.00 0.01 0.00 0.00 72.50 70.46 2c8t s THR 90 CO 0.36 0.56 -0.08 -0.31 -0.69 0.00 0.00 174.62 174.45 2c8t s TYR 91 N 0.25 1.77 -0.46 4.92 1.51 -0.14 0.13 117.35 125.33 2c8t s TYR 91 Ca -0.16 -1.03 -0.27 0.00 -1.01 0.00 0.00 57.07 54.61 2c8t s TYR 91 Cb -0.17 -1.37 0.03 0.00 -0.11 0.00 0.00 41.96 40.34 2c8t s TYR 91 CO 0.08 -0.60 1.00 0.00 -1.11 0.00 0.00 175.55 174.92 2c8t s ALA 92 N 1.61 3.22 -0.30 3.71 0.00 0.32 0.65 121.76 130.98 2c8t s ALA 92 Ca 0.03 -0.65 0.02 0.00 0.00 0.00 0.00 51.96 51.36 2c8t s ALA 92 Cb -0.14 -3.72 0.09 0.00 0.00 0.00 0.00 23.12 19.35 2c8t s ALA 92 CO -0.09 -2.09 0.02 1.41 0.00 0.00 0.00 175.76 175.02 2c8t s MET 93 N 3.97 1.41 1.08 0.00 0.00 0.06 -1.17 119.30 124.66 2c8t s MET 93 Ca 0.41 -1.46 0.00 0.00 0.00 0.00 0.00 55.69 54.64 2c8t s MET 93 Cb -0.09 -2.77 0.00 0.00 0.00 0.00 0.00 34.83 31.97 2c8t s MET 93 CO 0.27 -0.84 0.00 0.41 0.00 0.00 0.00 175.02 174.86 2c8t n GLY 94 N 4.49 1.23 2.87 2.11 0.00 -1.26 -3.81 105.19 110.82 2c8t n GLY 94 Ca -0.03 -0.48 -0.17 0.00 0.00 0.00 0.00 46.02 45.35 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 0.39 -0.30 1.61 -2.45 -1.26 -0.70 119.30 116.60 2c8t s MET 95 Ca 0.00 -0.02 0.03 0.00 -1.25 0.00 0.00 55.69 54.44 2c8t s MET 95 Cb 0.00 -0.48 0.08 0.00 1.25 0.00 0.00 34.83 35.68 2c8t s MET 95 CO 0.00 -0.05 0.00 0.00 1.05 0.00 0.00 175.02 176.02 2c8t s ALA 96 N 0.64 2.50 0.16 4.11 0.00 -0.74 0.00 121.76 128.43 2c8t s ALA 96 Ca -0.07 -2.05 0.09 0.00 0.00 0.00 0.00 51.96 49.94 2c8t s ALA 96 Cb -0.10 -1.75 -0.04 0.00 0.00 0.00 0.00 23.12 21.23 2c8t s ALA 96 CO -0.01 -1.48 -0.21 0.00 0.00 0.00 0.00 175.76 174.05 2c8t s ALA 97 N 1.12 2.14 0.00 0.00 0.00 -0.88 -0.90 121.76 123.24 2c8t s ALA 97 Ca 0.03 -1.47 0.00 0.00 0.00 0.00 0.00 51.96 50.52 2c8t s ALA 97 Cb -0.19 -0.25 0.00 0.00 0.00 0.00 0.00 23.12 22.68 2c8t s ALA 97 CO -0.09 0.34 0.00 0.43 0.00 0.00 0.00 175.76 176.44 2c8t n SER 98 N 0.52 0.00 0.28 0.00 7.64 -0.67 0.29 113.62 121.67 2c8t n SER 98 Ca -0.15 0.00 0.18 0.00 1.01 0.00 0.00 58.87 59.91 2c8t n SER 98 Cb 0.56 0.00 0.95 0.00 -1.01 0.00 0.00 64.21 64.70 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 -1.86 0.13 114.93 114.15 2c8t h MET 99 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 59.70 59.62 2c8t h MET 99 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 31.60 31.58 2c8t h MET 99 CO 0.00 0.00 -0.00 0.78 0.00 0.00 0.00 176.91 177.69 2c8t h GLY 100 N 0.00 0.93 0.90 8.32 0.00 -0.44 -0.95 103.07 111.83 2c8t h GLY 100 Ca 0.04 -0.69 -0.01 0.00 0.00 0.00 0.00 47.33 46.67 2c8t h GLY 100 CO -0.00 0.63 0.07 -2.09 0.00 0.00 0.00 176.54 175.15 2c8t h GLU 101 N 0.72 0.21 -0.48 4.80 4.22 -0.62 -1.79 114.58 121.64 2c8t h GLU 101 Ca 0.14 -0.03 0.09 0.00 0.08 0.00 0.00 59.36 59.64 2c8t h GLU 101 Cb 0.52 -0.04 -0.08 0.00 0.50 0.00 0.00 28.75 29.65 2c8t h GLU 101 CO 0.03 0.27 0.02 0.35 -2.18 0.00 0.00 179.01 177.50 2c8t h PHE 102 N 0.10 0.01 -0.43 0.92 3.57 -1.14 0.11 116.94 120.08 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 0.13 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 2c8t h PHE 102 CO -0.03 -0.09 -0.26 -0.07 -2.23 0.00 0.00 178.31 175.64 2c8t h LEU 103 N 0.14 0.95 -0.19 0.59 3.38 -1.15 -0.28 115.31 118.74 2c8t h LEU 103 Ca 0.24 -0.37 0.05 0.00 0.09 0.00 0.00 57.88 57.89 2c8t h LEU 103 Cb 0.36 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 2c8t h LEU 103 CO -0.38 1.15 -0.17 0.25 0.09 0.00 0.00 178.44 179.38 2c8t h LEU 104 N 0.78 -0.53 -1.79 1.67 5.85 -0.62 -1.71 115.31 118.97 2c8t h LEU 104 Ca 0.09 0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.89 2c8t h LEU 104 Cb 0.83 0.26 -0.00 0.00 0.37 0.00 0.00 40.66 42.11 2c8t h LEU 104 CO 0.07 -0.21 -0.15 0.00 -0.34 0.00 0.00 178.44 177.81 2c8t h ALA 105 N 0.92 1.50 -0.00 1.25 0.00 -0.39 -2.77 119.26 119.76 2c8t h ALA 105 Ca 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2c8t h ALA 105 Cb 0.35 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2c8t h ALA 105 CO -0.30 0.19 -0.00 0.00 0.00 0.00 0.00 179.25 179.14 2c8t n ALA 106 N -2.40 2.67 -0.80 0.00 0.00 -0.15 -4.87 120.51 114.95 2c8t n ALA 106 Ca -0.02 -0.23 -0.31 0.00 0.00 0.00 0.00 53.44 52.87 2c8t n ALA 106 Cb 0.24 -1.46 0.15 0.00 0.00 0.00 0.00 19.45 18.38 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 -2.04 1.72 -0.04 0.00 0.00 -1.05 -4.87 107.32 101.04 2c8t s GLY 107 Ca 0.45 0.56 -0.36 0.00 0.00 0.00 0.00 44.72 45.37 2c8t s GLY 107 CO 0.37 0.97 1.68 2.41 0.00 0.00 0.00 173.10 178.53 2c8t n THR 108 N -4.07 0.27 -1.71 0.90 -1.04 -0.58 -4.86 114.28 103.19 2c8t n THR 108 Ca 0.12 -0.05 -0.43 0.00 -2.04 0.00 0.00 64.05 61.64 2c8t n THR 108 Cb 0.52 -1.45 -0.03 0.00 -1.82 0.00 0.00 70.33 67.55 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 4.82 2.45 0.00 -2.82 5.02 -1.26 -0.60 118.16 125.77 2c8t n LYS 109 Ca 0.21 0.88 0.00 0.00 -2.02 0.00 0.00 58.31 57.38 2c8t n LYS 109 Cb 0.24 -2.64 0.00 0.00 -0.02 0.00 0.00 35.03 32.61 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 2.77 2.63 1.32 0.72 0.00 -1.26 -4.90 105.19 106.47 2c8t n GLY 110 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.32 2.47 -3.79 1.61 5.02 0.23 -4.85 118.16 118.53 2c8t n LYS 111 Ca 0.00 -3.63 -0.36 0.00 -2.02 0.00 0.00 58.31 52.30 2c8t n LYS 111 Cb 0.00 -1.94 -0.12 0.00 -0.02 0.00 0.00 35.03 32.95 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 -3.41 3.74 0.12 1.97 0.52 -1.25 -1.01 118.95 119.63 2c8t s ARG 112 Ca 0.45 -0.44 0.10 0.00 -0.52 0.00 0.00 55.73 55.32 2c8t s ARG 112 Cb 0.40 -3.34 -0.04 0.00 0.52 0.00 0.00 34.95 32.49 2c8t s ARG 112 CO -0.01 -0.11 -0.25 0.71 0.02 0.00 0.00 175.30 175.66 2c8t s TYR 113 N 1.41 2.10 -0.05 -0.53 1.51 0.35 0.05 117.35 122.20 2c8t s TYR 113 Ca 0.06 -0.40 0.04 0.00 -1.01 0.00 0.00 57.07 55.77 2c8t s TYR 113 Cb -0.15 -1.15 -0.00 0.00 -0.11 0.00 0.00 41.96 40.55 2c8t s TYR 113 CO 0.04 0.28 -0.19 0.00 -1.11 0.00 0.00 175.55 174.57 2c8t s ALA 114 N -1.09 1.69 0.52 3.71 0.00 -0.28 -0.52 121.76 125.79 2c8t s ALA 114 Ca 0.11 -0.77 -0.17 0.00 0.00 0.00 0.00 51.96 51.13 2c8t s ALA 114 Cb -0.10 -0.57 -0.07 0.00 0.00 0.00 0.00 23.12 22.38 2c8t s ALA 114 CO 0.05 0.29 1.00 -0.51 0.00 0.00 0.00 175.76 176.60 2c8t s LEU 115 N 0.07 3.66 0.44 0.00 1.43 -0.31 -1.93 118.68 122.03 2c8t s LEU 115 Ca -0.06 1.68 0.16 0.00 -1.03 0.00 0.00 54.13 54.89 2c8t s LEU 115 Cb -0.13 -4.52 1.08 0.00 0.03 0.00 0.00 46.19 42.65 2c8t s LEU 115 CO 0.03 -0.71 1.93 -0.65 0.23 0.00 0.00 176.35 177.19 2c8t h PRO 116 N 1.01 0.36 -0.26 1.29 0.11 -1.90 0.08 132.00 132.69 2c8t h PRO 116 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2c8t h PRO 116 Cb 1.20 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2c8t h PRO 116 CO 0.60 0.24 0.00 0.72 -0.21 0.00 0.00 178.00 179.35 2c8t n HIS 117 N -4.47 0.33 -1.67 0.65 8.25 -1.26 -4.38 115.22 112.68 2c8t n HIS 117 Ca 0.13 -0.24 -0.38 0.00 -0.26 0.00 0.00 57.72 56.97 2c8t n HIS 117 Cb 0.52 -0.01 0.05 0.00 1.12 0.00 0.00 29.99 31.67 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 0.95 0.76 -2.89 -1.41 0.00 0.01 -4.79 120.51 113.14 2c8t n ALA 118 Ca 0.13 0.07 -0.12 0.00 0.00 0.00 0.00 53.44 53.52 2c8t n ALA 118 Cb 0.46 -2.22 -0.13 0.00 0.00 0.00 0.00 19.45 17.56 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 -2.81 0.19 -0.16 0.00 1.70 0.13 -3.08 118.95 114.92 2c8t s ARG 119 Ca 0.74 -0.28 -0.04 0.00 -0.47 0.00 0.00 55.73 55.69 2c8t s ARG 119 Cb -0.43 -0.03 -0.03 0.00 -0.57 0.00 0.00 34.95 33.90 2c8t s ARG 119 CO 0.48 -0.00 -0.03 0.42 -1.08 0.00 0.00 175.30 175.08 2c8t s ILE 120 N -0.60 3.85 -0.16 4.99 1.09 -0.73 -1.79 121.20 127.86 2c8t s ILE 120 Ca -0.06 -0.37 -0.00 0.00 -1.10 0.00 0.00 60.65 59.12 2c8t s ILE 120 Cb -0.04 -2.70 -0.00 0.00 -1.06 0.00 0.00 42.46 38.66 2c8t s ILE 120 CO -0.00 0.48 -0.14 -0.76 -0.10 0.00 0.00 174.94 174.42 2c8t s LEU 121 N 0.51 2.57 0.18 2.97 2.01 -0.08 -0.26 118.68 126.57 2c8t s LEU 121 Ca -0.03 -0.43 -0.18 0.00 0.01 0.00 0.00 54.13 53.50 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 0.03 0.09 0.65 -0.04 1.01 0.00 0.00 176.35 178.08 2c8t s MET 122 N 0.81 4.16 -0.22 1.70 -1.94 -0.67 -1.67 119.30 121.46 2c8t s MET 122 Ca -0.05 0.73 -0.10 0.00 -1.71 0.00 0.00 55.69 54.56 2c8t s MET 122 Cb -0.15 -2.95 0.08 0.00 2.01 0.00 0.00 34.83 33.83 2c8t s MET 122 CO 0.00 0.46 0.51 -1.58 -0.01 0.00 0.00 175.02 174.40 2c8t s HIS 123 N -1.45 -0.89 -0.18 -0.03 5.04 -1.26 -3.89 115.29 112.63 2c8t s HIS 123 Ca 0.39 1.72 -0.30 0.00 -1.54 0.00 0.00 55.06 55.34 2c8t s HIS 123 Cb -0.17 0.45 -0.07 0.00 0.04 0.00 0.00 32.58 32.84 2c8t s HIS 123 CO 0.20 -0.48 2.15 0.94 -2.34 0.00 0.00 174.74 175.22 2c8t n GLN 124 N 4.80 2.04 -3.24 2.88 -0.06 -0.92 -4.78 117.38 118.10 2c8t n GLN 124 Ca -0.16 0.62 -0.33 0.00 -2.00 0.00 0.00 57.00 55.13 2c8t n GLN 124 Cb 0.53 -3.07 -0.06 0.00 -4.06 0.00 0.00 30.24 23.58 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 5.85 3.94 0.00 3.69 0.04 -1.26 -5.04 135.00 142.22 2c8t s PRO 125 Ca 0.99 0.53 0.00 0.00 0.04 0.00 0.00 61.00 62.56 2c8t s PRO 125 Cb -0.44 -2.55 0.00 0.00 0.04 0.00 0.00 34.50 31.56 2c8t s PRO 125 CO 0.39 0.24 0.00 1.28 0.04 0.00 0.00 177.00 178.95 2c8t n LEU 126 N -0.19 0.00 -0.08 -3.56 4.77 -1.26 -5.10 117.00 111.59 2c8t n LEU 126 Ca 0.02 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.90 2c8t n LEU 126 Cb 0.53 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.59 2c8t n LEU 126 CO 0.43 0.00 -0.65 -0.38 -1.33 0.00 0.00 177.39 175.45 2c8t n ILE 136 N 0.00 1.46 -0.34 -0.08 5.41 -1.26 -5.18 119.36 119.36 2c8t n ILE 136 Ca 0.00 0.13 0.05 0.00 1.00 0.00 0.00 62.75 63.93 2c8t n ILE 136 Cb 0.00 -2.22 0.21 0.00 -0.71 0.00 0.00 39.64 36.92 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 -0.87 1.39 -0.33 -1.39 0.00 -2.06 -1.56 119.26 114.44 2c8t h ALA 137 Ca -0.05 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.89 2c8t h ALA 137 Cb 0.93 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2c8t h ALA 137 CO -0.03 0.23 0.20 0.82 0.00 0.00 0.00 179.25 180.47 2c8t h ILE 138 N 0.97 1.05 0.00 0.00 5.03 -2.06 -2.79 117.51 119.71 2c8t h ILE 138 Ca 0.46 -0.14 -0.05 0.00 -0.12 0.00 0.00 64.86 65.01 2c8t h ILE 138 Cb 0.39 0.60 -0.01 0.00 -3.03 0.00 0.00 36.82 34.78 2c8t h ILE 138 CO -0.24 0.08 -0.23 1.56 -0.68 0.00 0.00 178.15 178.64 2c8t h GLN 139 N 0.41 0.00 0.07 2.37 4.20 -1.77 -2.64 115.11 117.76 2c8t h GLN 139 Ca 0.13 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 2c8t h GLN 139 Cb -0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.77 2c8t h GLN 139 CO -0.05 0.23 -0.03 0.00 -0.67 0.00 0.00 178.83 178.30 2c8t h ALA 140 N 1.77 -0.09 -0.47 3.87 0.00 -1.06 -1.24 119.26 122.05 2c8t h ALA 140 Ca -0.00 -0.15 0.09 0.00 0.00 0.00 0.00 54.91 54.85 2c8t h ALA 140 Cb 0.40 0.04 -0.10 0.00 0.00 0.00 0.00 17.79 18.13 2c8t h ALA 140 CO 0.03 -0.41 -0.30 0.93 0.00 0.00 0.00 179.25 179.50 2c8t h GLU 141 N -0.37 -0.19 -0.61 0.00 5.08 -1.31 -0.35 114.58 116.83 2c8t h GLU 141 Ca -0.01 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2c8t h GLU 141 Cb 0.33 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.58 2c8t h GLU 141 CO 0.02 -0.13 0.38 1.96 -1.00 0.00 0.00 179.01 180.24 2c8t h GLN 142 N -0.20 0.74 -0.19 2.33 4.20 -1.38 -1.74 115.11 118.87 2c8t h GLN 142 Ca 0.20 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.84 2c8t h GLN 142 Cb 0.53 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 2c8t h GLN 142 CO -0.58 0.49 0.03 0.35 -0.67 0.00 0.00 178.83 178.45 2c8t h PHE 143 N 0.76 0.33 -0.55 2.96 3.57 -0.67 -1.43 116.94 121.92 2c8t h PHE 143 Ca 0.24 -0.05 0.08 0.00 3.53 0.00 0.00 57.97 61.77 2c8t h PHE 143 Cb -0.01 -0.09 -0.07 0.00 2.79 0.00 0.00 35.95 38.57 2c8t h PHE 143 CO -0.05 0.47 0.18 0.00 -2.23 0.00 0.00 178.31 176.68 2c8t h ALA 144 N 0.83 0.68 -0.53 2.41 0.00 -0.84 0.24 119.26 122.05 2c8t h ALA 144 Ca 0.06 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2c8t h ALA 144 Cb 0.31 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2c8t h ALA 144 CO 0.00 -0.22 0.28 0.28 0.00 0.00 0.00 179.25 179.59 2c8t h VAL 145 N 0.35 1.19 0.00 0.00 2.07 -1.00 -1.83 116.25 117.03 2c8t h VAL 145 Ca 0.27 -0.49 -0.18 0.00 0.82 0.00 0.00 66.70 67.12 2c8t h VAL 145 Cb 0.33 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 2c8t h VAL 145 CO -0.29 0.20 -0.84 -0.29 0.02 0.00 0.00 177.57 176.37 2c8t h ILE 146 N 0.71 1.46 -0.16 4.57 2.10 -0.70 -2.45 117.51 123.03 2c8t h ILE 146 Ca 0.19 -3.04 -0.03 0.00 1.08 0.00 0.00 64.86 63.06 2c8t h ILE 146 Cb 0.07 2.71 -0.01 0.00 -1.09 0.00 0.00 36.82 38.50 2c8t h ILE 146 CO -0.03 0.83 -0.00 0.50 -1.08 0.00 0.00 178.15 178.36 2c8t h LYS 147 N 0.00 0.29 -0.54 2.19 3.64 -0.48 -0.77 116.57 120.91 2c8t h LYS 147 Ca -0.01 -0.09 0.01 0.00 -1.27 0.00 0.00 60.65 59.29 2c8t h LYS 147 Cb 1.64 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 33.41 2c8t h LYS 147 CO 0.11 0.52 0.35 -0.22 -2.27 0.00 0.00 179.45 177.94 2c8t h LYS 148 N 0.03 0.69 -0.79 1.90 3.64 -1.36 -1.70 116.57 118.97 2c8t h LYS 148 Ca 0.05 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 2c8t h LYS 148 Cb 0.39 -0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 32.01 2c8t h LYS 148 CO 0.01 0.46 0.46 1.49 -2.27 0.00 0.00 179.45 179.60 2c8t h GLU 149 N 0.71 1.08 0.33 1.90 4.57 -1.35 -1.20 114.58 120.62 2c8t h GLU 149 Ca 0.20 -0.10 -0.02 0.00 -1.18 0.00 0.00 59.36 58.26 2c8t h GLU 149 Cb -0.07 -0.22 0.00 0.00 -0.16 0.00 0.00 28.75 28.30 2c8t h GLU 149 CO -0.05 0.77 -0.16 1.98 -1.18 0.00 0.00 179.01 180.37 2c8t h MET 150 N 1.09 -0.42 -0.74 1.92 4.05 -0.56 -1.87 114.93 118.40 2c8t h MET 150 Ca 0.28 0.03 0.16 0.00 -0.28 0.00 0.00 59.70 59.89 2c8t h MET 150 Cb -0.02 0.10 -0.11 0.00 -0.80 0.00 0.00 31.60 30.76 2c8t h MET 150 CO -0.05 -0.17 0.16 0.74 0.23 0.00 0.00 176.91 177.82 2c8t h PHE 151 N -0.63 0.24 -0.27 1.39 0.05 -1.13 0.16 116.94 116.76 2c8t h PHE 151 Ca -0.04 0.04 0.06 0.00 3.82 0.00 0.00 57.97 61.85 2c8t h PHE 151 Cb 0.45 0.01 -0.06 0.00 2.00 0.00 0.00 35.95 38.35 2c8t h PHE 151 CO -0.01 -0.11 -0.13 -0.09 -0.18 0.00 0.00 178.31 177.79 2c8t h ARG 152 N 0.25 -0.09 -0.26 1.51 2.43 -1.09 -0.33 114.38 116.80 2c8t h ARG 152 Ca 0.42 0.01 -0.16 0.00 -0.81 0.00 0.00 59.98 59.43 2c8t h ARG 152 Cb 0.72 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.29 2c8t h ARG 152 CO -0.53 -0.06 -0.50 -0.07 -1.51 0.00 0.00 179.97 177.30 2c8t h LEU 153 N -0.10 0.78 -0.44 3.80 3.38 -0.34 -1.40 115.31 121.00 2c8t h LEU 153 Ca 0.14 -0.40 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 2c8t h LEU 153 Cb 0.31 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2c8t h LEU 153 CO -0.33 1.14 0.27 -1.13 0.09 0.00 0.00 178.44 178.48 2c8t h ASN 154 N 0.56 0.52 -0.37 -0.43 -0.00 -0.50 0.40 115.58 115.76 2c8t h ASN 154 Ca 0.02 -0.05 0.06 0.00 -0.00 0.00 0.00 56.30 56.33 2c8t h ASN 154 Cb 1.06 -0.13 -0.05 0.00 -0.00 0.00 0.00 38.32 39.20 2c8t h ASN 154 CO 0.10 0.42 0.07 0.00 -0.00 0.00 0.00 177.43 178.03 2c8t h ALA 155 N 1.13 0.40 -0.46 1.57 0.00 -0.97 -1.84 119.26 119.09 2c8t h ALA 155 Ca 0.16 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 2c8t h ALA 155 Cb -0.01 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2c8t h ALA 155 CO -0.03 -0.33 0.16 1.49 0.00 0.00 0.00 179.25 180.54 2c8t h GLU 156 N 0.20 0.71 -0.29 0.00 4.81 -0.44 0.45 114.58 120.01 2c8t h GLU 156 Ca 0.18 -0.14 0.04 0.00 -0.13 0.00 0.00 59.36 59.30 2c8t h GLU 156 Cb 0.21 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 2c8t h GLU 156 CO -0.23 0.66 0.20 0.74 -0.73 0.00 0.00 179.01 179.65 2c8t h PHE 157 N 0.61 0.23 0.00 0.92 0.05 -0.01 -3.25 116.94 115.49 2c8t h PHE 157 Ca 0.15 0.01 0.00 0.00 3.82 0.00 0.00 57.97 61.95 2c8t h PHE 157 Cb 0.24 -0.08 0.00 0.00 2.00 0.00 0.00 35.95 38.11 2c8t h PHE 157 CO 0.01 0.13 -1.10 -2.37 -0.18 0.00 0.00 178.31 174.80 2c8t n THR 158 N -4.49 0.00 -0.81 -1.55 5.66 -0.71 -4.84 114.28 107.53 2c8t n THR 158 Ca 0.03 -0.25 0.00 0.00 -3.05 0.00 0.00 64.05 60.77 2c8t n THR 158 Cb 0.19 0.57 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 1.59 0.84 3.98 1.09 0.00 0.11 -4.22 105.19 108.59 2c8t n GLY 159 Ca -0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.19 3.24 0.38 1.61 -1.52 -1.07 -5.03 119.66 117.09 2c8t s GLN 160 Ca 0.00 -0.87 -0.26 0.00 -1.95 0.00 0.00 55.36 52.28 2c8t s GLN 160 Cb 0.00 -2.83 -0.09 0.00 -0.22 0.00 0.00 33.01 29.88 2c8t s GLN 160 CO 0.00 0.18 1.16 -2.14 -0.25 0.00 0.00 175.29 174.23 2c8t s PRO 161 N -4.13 4.15 0.31 2.91 0.02 -1.26 -4.57 135.00 132.44 2c8t s PRO 161 Ca 0.41 1.82 0.07 0.00 0.02 0.00 0.00 61.00 63.33 2c8t s PRO 161 Cb -0.09 -2.74 0.79 0.00 0.02 0.00 0.00 34.50 32.48 2c8t s PRO 161 CO 0.31 -0.23 1.77 0.82 -0.33 0.00 0.00 177.00 179.34 2c8t h ILE 162 N 2.44 0.67 -0.92 2.83 2.04 -1.93 -0.47 117.51 122.17 2c8t h ILE 162 Ca -0.48 -0.24 0.08 0.00 1.00 0.00 0.00 64.86 65.22 2c8t h ILE 162 Cb 1.23 -0.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.15 2c8t h ILE 162 CO 0.63 0.13 0.59 -0.33 0.00 0.00 0.00 178.15 179.17 2c8t h GLU 163 N 0.71 0.95 0.03 2.37 3.07 -1.98 -0.93 114.58 118.80 2c8t h GLU 163 Ca 0.59 -0.06 -0.24 0.00 -0.50 0.00 0.00 59.36 59.15 2c8t h GLU 163 Cb 0.99 -0.21 0.02 0.00 -0.84 0.00 0.00 28.75 28.70 2c8t h GLU 163 CO -0.38 0.63 -0.94 -0.09 -1.40 0.00 0.00 179.01 176.83 2c8t h ARG 164 N 0.98 0.59 -0.58 2.33 2.43 -1.49 -1.93 114.38 116.70 2c8t h ARG 164 Ca 0.41 -0.67 0.09 0.00 -0.81 0.00 0.00 59.98 59.00 2c8t h ARG 164 Cb 0.31 0.20 -0.07 0.00 -0.42 0.00 0.00 29.97 29.99 2c8t h ARG 164 CO -0.17 1.27 0.21 0.82 -1.51 0.00 0.00 179.97 180.58 2c8t h ILE 165 N 0.19 0.78 0.47 1.20 1.08 -0.80 0.82 117.51 121.26 2c8t h ILE 165 Ca -0.12 -0.13 -0.02 0.00 -0.39 0.00 0.00 64.86 64.19 2c8t h ILE 165 Cb 1.62 0.36 0.00 0.00 -3.07 0.00 0.00 36.82 35.73 2c8t h ILE 165 CO 0.18 0.07 -0.23 -0.33 -0.69 0.00 0.00 178.15 177.15 2c8t h GLU 166 N 0.38 -0.61 -0.90 2.37 5.08 -1.22 -2.25 114.58 117.43 2c8t h GLU 166 Ca 0.29 0.04 0.15 0.00 -1.00 0.00 0.00 59.36 58.84 2c8t h GLU 166 Cb 0.35 0.14 -0.09 0.00 0.50 0.00 0.00 28.75 29.65 2c8t h GLU 166 CO -0.30 -0.31 0.50 0.00 -1.00 0.00 0.00 179.01 177.90 2c8t h ALA 167 N -0.54 1.37 -0.32 3.43 0.00 -1.20 -1.07 119.26 120.93 2c8t h ALA 167 Ca -0.07 0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 2c8t h ALA 167 Cb 0.59 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2c8t h ALA 167 CO 0.11 -0.02 -0.41 -0.44 0.00 0.00 0.00 179.25 178.48 2c8t h ASP 168 N 0.72 0.85 -0.64 0.00 3.32 -0.83 -2.56 116.42 117.28 2c8t h ASP 168 Ca 0.48 -0.40 -0.06 0.00 0.02 0.00 0.00 57.03 57.07 2c8t h ASP 168 Cb 0.65 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.93 2c8t h ASP 168 CO -0.34 1.15 0.15 0.28 -1.72 0.00 0.00 179.24 178.76 2c8t h SER 169 N 0.65 0.98 -0.44 6.45 0.02 -0.73 -1.66 113.55 118.81 2c8t h SER 169 Ca 0.05 -0.24 0.02 0.00 -0.84 0.00 0.00 61.79 60.78 2c8t h SER 169 Cb 0.98 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 63.23 2c8t h SER 169 CO 0.09 0.97 0.26 0.44 -1.14 0.00 0.00 176.83 177.45 2c8t h ASP 170 N 0.95 0.42 -0.01 3.07 3.32 -1.06 -2.32 116.42 120.80 2c8t h ASP 170 Ca 0.20 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.26 2c8t h ASP 170 Cb 0.37 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.84 2c8t h ASP 170 CO 0.00 0.30 0.00 -2.11 -1.72 0.00 0.00 179.24 175.71 2c8t n ARG 171 N -4.84 1.02 -2.97 3.56 1.85 -0.98 -4.87 116.66 109.42 2c8t n ARG 171 Ca 0.02 -0.03 -0.19 0.00 -1.00 0.00 0.00 57.85 56.65 2c8t n ARG 171 Cb 0.07 -1.05 0.00 0.00 -1.05 0.00 0.00 32.46 30.43 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 -0.52 -4.19 -4.66 2.89 8.00 -0.94 -4.87 116.55 112.27 2c8t n ASP 172 Ca 0.02 -0.16 -0.47 0.00 0.71 0.00 0.00 54.79 54.89 2c8t n ASP 172 Cb 0.02 -3.48 -0.04 0.00 -0.02 0.00 0.00 41.12 37.59 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 -3.44 1.99 -3.85 -1.24 0.63 -0.65 -4.67 116.66 105.42 2c8t n ARG 173 Ca -0.08 0.72 -0.23 0.00 -0.92 0.00 0.00 57.85 57.34 2c8t n ARG 173 Cb 0.58 -2.47 -0.05 0.00 0.45 0.00 0.00 32.46 30.96 2c8t n ARG 173 CO 0.00 0.00 0.00 1.67 -2.51 0.00 0.00 177.63 176.79 2c8t s TRP 174 N 1.09 2.67 -0.04 -0.14 1.48 -1.26 -1.67 118.94 121.06 2c8t s TRP 174 Ca 0.81 -0.52 -0.06 0.00 -1.06 0.00 0.00 56.10 55.27 2c8t s TRP 174 Cb -0.72 -2.04 0.01 0.00 -1.16 0.00 0.00 33.47 29.56 2c8t s TRP 174 CO 0.40 0.05 0.14 -0.06 -4.06 0.00 0.00 176.95 173.43 2c8t s PHE 175 N -2.52 -0.11 0.65 1.66 0.40 0.64 -4.98 117.98 113.72 2c8t s PHE 175 Ca 0.44 0.27 -0.11 0.00 -0.60 0.00 0.00 56.93 56.92 2c8t s PHE 175 Cb -0.00 0.03 -0.02 0.00 0.51 0.00 0.00 43.02 43.54 2c8t s PHE 175 CO 0.25 -0.13 1.04 0.99 0.70 0.00 0.00 175.22 178.08 2c8t s THR 176 N -0.28 4.34 0.27 0.64 2.01 -1.26 -1.77 115.64 119.58 2c8t s THR 176 Ca -0.04 0.79 -0.01 0.00 0.31 0.00 0.00 61.69 62.75 2c8t s THR 176 Cb -0.03 -3.62 0.25 0.00 0.01 0.00 0.00 72.50 69.11 2c8t s THR 176 CO 0.00 -0.97 1.73 0.00 -0.69 0.00 0.00 174.62 174.70 2c8t h ALA 177 N -0.43 1.26 0.03 7.40 0.00 -1.74 0.70 119.26 126.48 2c8t h ALA 177 Ca -0.44 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 2c8t h ALA 177 Cb 1.20 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2c8t h ALA 177 CO 0.59 -0.19 -0.02 0.00 0.00 0.00 0.00 179.25 179.63 2c8t h ALA 178 N 1.60 -0.04 -0.41 0.00 0.00 -1.91 -1.80 119.26 116.70 2c8t h ALA 178 Ca 0.48 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.27 2c8t h ALA 178 Cb 0.76 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 2c8t h ALA 178 CO -0.42 -0.49 -0.03 0.93 0.00 0.00 0.00 179.25 179.24 2c8t h GLU 179 N -0.11 0.67 -0.64 0.00 5.08 -1.59 -2.21 114.58 115.78 2c8t h GLU 179 Ca -0.00 -0.18 -0.05 0.00 -1.00 0.00 0.00 59.36 58.13 2c8t h GLU 179 Cb 0.10 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 2c8t h GLU 179 CO 0.01 0.71 0.21 0.00 -1.00 0.00 0.00 179.01 178.93 2c8t h ALA 180 N 1.34 1.16 -0.61 3.43 0.00 0.45 -1.28 119.26 123.75 2c8t h ALA 180 Ca 0.12 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 2c8t h ALA 180 Cb 0.44 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2c8t h ALA 180 CO 0.02 0.59 0.08 1.25 0.00 0.00 0.00 179.25 181.18 2c8t h LEU 181 N 0.94 0.98 -0.31 0.00 5.85 -0.90 -2.10 115.31 119.76 2c8t h LEU 181 Ca 0.21 -0.23 -0.06 0.00 0.84 0.00 0.00 57.88 58.63 2c8t h LEU 181 Cb 0.26 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 2c8t h LEU 181 CO -0.01 0.99 -0.05 -0.33 -0.34 0.00 0.00 178.44 178.70 2c8t h GLU 182 N 0.95 0.58 0.00 1.25 5.08 -1.07 -3.16 114.58 118.21 2c8t h GLU 182 Ca 0.19 -0.21 -0.06 0.00 -1.00 0.00 0.00 59.36 58.27 2c8t h GLU 182 Cb 0.45 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2c8t h GLU 182 CO 0.01 0.75 -0.31 -0.92 -1.00 0.00 0.00 179.01 177.55 2c8t h TYR 183 N 0.36 0.00 0.00 4.33 3.20 -1.24 -3.47 116.97 120.15 2c8t h TYR 183 Ca 0.08 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.95 2c8t h TYR 183 Cb 0.53 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.80 2c8t h TYR 183 CO 0.05 0.31 0.00 0.41 -1.64 0.00 0.00 178.16 177.28 2c8t n GLY 184 N -0.44 1.39 0.25 1.82 0.00 -1.01 -4.71 105.19 102.49 2c8t n GLY 184 Ca -0.02 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.15 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 -2.84 1.61 -1.00 -1.65 -3.38 116.94 109.68 2c8t h PHE 185 Ca 0.00 0.00 -0.12 0.00 2.81 0.00 0.00 57.97 60.66 2c8t h PHE 185 Cb 0.00 0.00 -0.22 0.00 3.61 0.00 0.00 35.95 39.34 2c8t h PHE 185 CO 0.00 0.06 -0.24 0.08 -1.61 0.00 0.00 178.31 176.60 2c8t s VAL 186 N -3.57 0.02 -0.11 -0.55 1.01 -1.25 -3.99 120.40 111.97 2c8t s VAL 186 Ca 0.02 -0.20 0.16 0.00 0.00 0.00 0.00 61.98 61.97 2c8t s VAL 186 Cb 0.08 -0.60 -0.20 0.00 0.00 0.00 0.00 36.38 35.66 2c8t s VAL 186 CO 0.59 -0.11 0.61 0.47 0.00 0.00 0.00 175.10 176.67 2c8t n ASP 187 N 2.09 0.66 -3.85 3.32 8.00 0.11 -4.57 116.55 122.30 2c8t n ASP 187 Ca -0.17 0.30 -0.11 0.00 0.71 0.00 0.00 54.79 55.52 2c8t n ASP 187 Cb 0.57 0.35 -0.10 0.00 -0.02 0.00 0.00 41.12 41.91 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 -2.77 -0.01 -0.26 1.24 3.76 -0.71 -5.00 115.29 111.54 2c8t s HIS 188 Ca -0.05 -0.01 -0.10 0.00 -0.15 0.00 0.00 55.06 54.76 2c8t s HIS 188 Cb 0.08 -0.02 -0.04 0.00 1.11 0.00 0.00 32.58 33.71 2c8t s HIS 188 CO 0.82 -0.26 0.14 0.42 -0.85 0.00 0.00 174.74 175.01 2c8t s ILE 189 N -1.15 4.96 -0.05 0.60 1.01 -1.26 -1.13 121.20 124.18 2c8t s ILE 189 Ca -0.12 0.05 -0.10 0.00 0.00 0.00 0.00 60.65 60.47 2c8t s ILE 189 Cb -0.06 -3.34 -0.05 0.00 0.01 0.00 0.00 42.46 39.02 2c8t s ILE 189 CO 0.02 0.30 0.27 0.27 0.00 0.00 0.00 174.94 175.80 2c8t s ILE 190 N 1.54 5.27 0.00 2.92 -4.36 -0.81 -4.95 121.20 120.81 2c8t s ILE 190 Ca 0.07 0.48 0.00 0.00 -0.26 0.00 0.00 60.65 60.94 2c8t s ILE 190 Cb -0.15 -3.55 0.00 0.00 1.25 0.00 0.00 42.46 40.00 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 1.80 0.00 -2.43 8.37 -1.04 -1.26 -4.00 114.28 115.73 2c8t n THR 191 Ca -0.16 0.00 -0.32 0.00 -2.04 0.00 0.00 64.05 61.52 2c8t n THR 191 Cb 0.54 -0.83 -0.04 0.00 -1.82 0.00 0.00 70.33 68.18 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 3.94 0.74 -2.82 0.52 -1.26 -5.03 118.95 115.04 2c8t s ARG 192 Ca 0.00 1.00 0.00 0.00 -0.52 0.00 0.00 55.73 56.21 2c8t s ARG 192 Cb 0.00 -2.13 0.14 0.00 0.52 0.00 0.00 34.95 33.48 2c8t s ARG 192 CO 0.00 -0.28 1.01 0.00 0.02 0.00 0.00 175.30 176.05 2c8t s ALA 193 N -2.55 3.79 0.00 2.13 0.00 -1.26 -5.20 121.76 118.67 2c8t s ALA 193 Ca 0.60 -1.87 0.00 0.00 0.00 0.00 0.00 51.96 50.69 2c8t s ALA 193 Cb -0.10 -1.92 0.00 0.00 0.00 0.00 0.00 23.12 21.10 2c8t s ALA 193 CO 0.29 -1.53 0.00 0.72 0.00 0.00 0.00 175.76 175.25