#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1loq s LEU 15 N 0.00 1.89 -0.15 0.55 2.96 -1.26 -0.94 118.68 121.72 1loq s LEU 15 Ca 0.00 -0.50 0.00 0.00 -0.22 0.00 0.00 54.13 53.42 1loq s LEU 15 Cb 0.00 -1.24 -0.00 0.00 0.50 0.00 0.00 46.19 45.45 1loq s LEU 15 CO 0.00 0.05 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.29 1loq s ILE 16 N 0.85 2.61 -0.16 6.68 1.01 -0.08 -2.96 121.20 129.14 1loq s ILE 16 Ca -0.08 -0.79 -0.25 0.00 0.00 0.00 0.00 60.65 59.53 1loq s ILE 16 Cb -0.15 -2.10 -0.02 0.00 0.01 0.00 0.00 42.46 40.20 1loq s ILE 16 CO -0.00 0.52 0.80 -0.22 0.00 0.00 0.00 174.94 176.03 1loq s LEU 17 N 0.82 4.18 -0.69 2.97 2.96 -1.01 -0.97 118.68 126.94 1loq s LEU 17 Ca -0.05 1.14 -0.21 0.00 -0.22 0.00 0.00 54.13 54.79 1loq s LEU 17 Cb -0.15 -3.18 0.09 0.00 0.50 0.00 0.00 46.19 43.45 1loq s LEU 17 CO -0.00 -0.36 0.92 0.00 -1.32 0.00 0.00 176.35 175.59 1loq s ALA 18 N 2.00 3.26 -0.98 5.97 0.00 0.04 -0.15 121.76 131.89 1loq s ALA 18 Ca 0.37 -2.14 -0.18 0.00 0.00 0.00 0.00 51.96 50.00 1loq s ALA 18 Cb -0.17 -3.80 0.13 0.00 0.00 0.00 0.00 23.12 19.29 1loq s ALA 18 CO 0.13 -2.69 1.21 1.41 0.00 0.00 0.00 175.76 175.82 1loq s MET 19 N 3.36 3.67 -0.07 0.00 1.75 -0.41 -4.38 119.30 123.23 1loq s MET 19 Ca 0.21 -1.83 0.16 0.00 -1.25 0.00 0.00 55.69 52.98 1loq s MET 19 Cb -0.17 -4.98 0.56 0.00 2.84 0.00 0.00 34.83 33.08 1loq s MET 19 CO 0.05 -1.82 1.47 -0.25 -0.65 0.00 0.00 175.02 173.83 1loq n ASP 20 N 6.64 3.97 -4.76 1.11 8.00 -1.26 -4.42 116.55 125.82 1loq n ASP 20 Ca 0.27 -2.33 -0.36 0.00 0.71 0.00 0.00 54.79 53.08 1loq n ASP 20 Cb 0.48 -0.46 0.02 0.00 -0.02 0.00 0.00 41.12 41.14 1loq n ASP 20 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1loq s LEU 21 N -1.61 3.78 0.14 0.64 1.43 -1.26 -4.58 118.68 117.23 1loq s LEU 21 Ca 0.41 2.36 0.20 0.00 -1.03 0.00 0.00 54.13 56.07 1loq s LEU 21 Cb 0.26 -4.48 -0.06 0.00 0.03 0.00 0.00 46.19 41.94 1loq s LEU 21 CO 0.21 -1.35 0.95 1.15 0.23 0.00 0.00 176.35 177.55 1loq n MET 22 N -1.21 0.61 -3.40 1.70 0.00 -1.26 -4.12 117.12 109.44 1loq n MET 22 Ca 0.11 0.16 -0.37 0.00 0.00 0.00 0.00 57.70 57.60 1loq n MET 22 Cb 0.49 -1.82 -0.07 0.00 0.00 0.00 0.00 33.22 31.82 1loq n MET 22 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 1loq s ASN 23 N -5.53 6.54 0.21 3.17 3.84 -1.26 -4.51 114.94 117.40 1loq s ASN 23 Ca -0.02 0.64 -0.09 0.00 0.21 0.00 0.00 52.86 53.60 1loq s ASN 23 Cb 0.09 -2.24 0.29 0.00 -0.55 0.00 0.00 41.25 38.84 1loq s ASN 23 CO 0.80 0.01 1.76 -0.09 -2.79 0.00 0.00 177.10 176.79 1loq h ARG 24 N 6.89 0.48 -0.44 0.43 2.43 -1.95 0.11 114.38 122.33 1loq h ARG 24 Ca -0.40 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 58.73 1loq h ARG 24 Cb 1.17 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.59 1loq h ARG 24 CO 0.75 0.32 0.23 -0.44 -1.51 0.00 0.00 179.97 179.32 1loq h ASP 25 N 0.49 0.56 -0.47 -3.80 3.32 -1.99 -0.26 116.42 114.27 1loq h ASP 25 Ca 0.32 -0.10 -0.08 0.00 0.02 0.00 0.00 57.03 57.19 1loq h ASP 25 Cb 0.35 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 1loq h ASP 25 CO -0.28 0.50 -0.01 0.44 -1.72 0.00 0.00 179.24 178.17 1loq h ASP 26 N 0.57 0.82 -0.79 6.45 3.32 -1.88 -1.21 116.42 123.70 1loq h ASP 26 Ca 0.15 -0.31 -0.01 0.00 0.02 0.00 0.00 57.03 56.88 1loq h ASP 26 Cb 0.07 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.36 1loq h ASP 26 CO -0.02 0.94 0.44 0.00 -1.72 0.00 0.00 179.24 178.88 1loq h ALA 27 N 0.91 1.01 -0.48 3.45 0.00 -0.70 -1.35 119.26 122.11 1loq h ALA 27 Ca 0.13 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 1loq h ALA 27 Cb 0.52 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1loq h ALA 27 CO 0.03 0.52 -0.16 -0.07 0.00 0.00 0.00 179.25 179.56 1loq h LEU 28 N 1.10 0.97 0.55 0.00 3.38 -0.95 -1.71 115.31 118.64 1loq h LEU 28 Ca 0.28 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 1loq h LEU 28 Cb 0.02 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.50 1loq h LEU 28 CO -0.05 1.13 -0.31 -0.09 0.09 0.00 0.00 178.44 179.21 1loq h ARG 29 N 0.81 -0.77 -0.47 1.13 2.43 -0.81 -1.20 114.38 115.50 1loq h ARG 29 Ca 0.12 0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.31 1loq h ARG 29 Cb 0.73 0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 30.43 1loq h ARG 29 CO 0.06 -0.51 0.19 0.28 -1.51 0.00 0.00 179.97 178.47 1loq h VAL 30 N -0.80 1.21 -0.79 0.20 2.07 -1.28 -1.19 116.25 115.66 1loq h VAL 30 Ca -0.07 -0.64 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 1loq h VAL 30 Cb 0.64 0.75 -0.04 0.00 -1.52 0.00 0.00 31.29 31.13 1loq h VAL 30 CO 0.09 0.24 0.46 0.74 0.02 0.00 0.00 177.57 179.12 1loq h THR 31 N 0.61 1.23 -0.47 2.57 2.02 -1.27 -1.96 112.91 115.64 1loq h THR 31 Ca 0.16 -0.53 -0.09 0.00 0.77 0.00 0.00 66.41 66.72 1loq h THR 31 Cb 0.19 0.14 -0.02 0.00 -1.74 0.00 0.00 68.15 66.72 1loq h THR 31 CO -0.01 0.24 -0.07 1.23 0.37 0.00 0.00 175.52 177.28 1loq h GLY 32 N 1.09 0.89 1.99 2.16 0.00 -0.92 -2.04 103.07 106.24 1loq h GLY 32 Ca 0.28 -0.65 -0.06 0.00 0.00 0.00 0.00 47.33 46.90 1loq h GLY 32 CO -0.05 0.60 -0.29 0.83 0.00 0.00 0.00 176.54 177.63 1loq h GLU 33 N 0.75 0.01 -0.41 4.80 5.08 -0.68 -3.13 114.58 121.00 1loq h GLU 33 Ca 0.13 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1loq h GLU 33 Cb 0.56 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1loq h GLU 33 CO 0.03 0.29 0.00 1.33 -1.00 0.00 0.00 179.01 179.67 1loq n VAL 34 N -4.20 0.88 -0.24 3.13 0.24 -0.79 -4.56 118.33 112.79 1loq n VAL 34 Ca -0.02 -0.94 0.20 0.00 -2.04 0.00 0.00 64.34 61.54 1loq n VAL 34 Cb 0.34 0.59 0.53 0.00 -1.47 0.00 0.00 33.84 33.83 1loq n VAL 34 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1loq h ARG 35 N 2.71 0.35 0.00 7.34 9.65 -1.32 -0.05 114.38 133.07 1loq h ARG 35 Ca 0.00 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 1loq h ARG 35 Cb 0.79 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.29 1loq h ARG 35 CO 0.00 0.23 0.00 -0.85 2.80 0.00 0.00 179.97 182.15 1loq n GLU 36 N -4.49 0.14 0.00 0.20 0.28 -1.26 -2.97 120.64 112.53 1loq n GLU 36 Ca 0.20 0.32 0.10 0.00 -0.16 0.00 0.00 57.16 57.61 1loq n GLU 36 Cb 0.74 -1.74 -0.04 0.00 1.43 0.00 0.00 31.44 31.83 1loq n GLU 36 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1loq n TYR 37 N -2.00 0.00 -4.50 -1.84 4.02 -0.04 -4.99 117.16 107.82 1loq n TYR 37 Ca 0.03 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.68 1loq n TYR 37 Cb 0.25 0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.46 1loq n TYR 37 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 1loq s ILE 38 N -2.47 1.86 0.00 -0.72 -4.36 -1.16 -4.58 121.20 109.78 1loq s ILE 38 Ca 0.13 -2.12 0.00 0.00 -0.26 0.00 0.00 60.65 58.40 1loq s ILE 38 Cb 0.16 -2.63 0.00 0.00 1.25 0.00 0.00 42.46 41.23 1loq s ILE 38 CO 0.61 -0.19 0.14 -0.90 0.24 0.00 0.00 174.94 174.84 1loq n ASP 39 N -0.72 0.28 -3.72 4.36 3.85 -1.16 -4.94 116.55 114.51 1loq n ASP 39 Ca -0.05 -0.68 -0.14 0.00 -0.71 0.00 0.00 54.79 53.21 1loq n ASP 39 Cb 0.64 0.21 -0.09 0.00 -1.35 0.00 0.00 41.12 40.54 1loq n ASP 39 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 1loq s THR 40 N -0.21 0.03 -0.15 2.12 2.01 -1.26 -3.72 115.64 114.46 1loq s THR 40 Ca 0.00 -0.23 0.00 0.00 0.31 0.00 0.00 61.69 61.77 1loq s THR 40 Cb 0.00 -0.65 -0.00 0.00 0.01 0.00 0.00 72.50 71.85 1loq s THR 40 CO 0.00 -0.13 -0.15 -0.69 -0.69 0.00 0.00 174.62 172.96 1loq s VAL 41 N -0.71 2.69 -0.26 3.82 1.01 -0.19 -2.40 120.40 124.36 1loq s VAL 41 Ca -0.08 -0.77 -0.15 0.00 0.00 0.00 0.00 61.98 60.98 1loq s VAL 41 Cb -0.04 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 1loq s VAL 41 CO 0.04 0.52 0.38 -0.75 0.00 0.00 0.00 175.10 175.29 1loq s LYS 42 N 0.72 4.04 -0.10 2.72 2.20 0.79 -1.49 119.74 128.62 1loq s LYS 42 Ca -0.07 0.08 0.01 0.00 -0.36 0.00 0.00 55.97 55.63 1loq s LYS 42 Cb -0.16 -3.64 -0.02 0.00 -1.51 0.00 0.00 37.83 32.50 1loq s LYS 42 CO 0.01 -0.25 -0.12 0.42 -0.36 0.00 0.00 175.35 175.05 1loq s ILE 43 N 1.99 3.21 0.00 5.43 1.01 -0.01 -1.29 121.20 131.55 1loq s ILE 43 Ca 0.16 -0.63 0.00 0.00 0.00 0.00 0.00 60.65 60.18 1loq s ILE 43 Cb -0.16 -2.32 0.00 0.00 0.01 0.00 0.00 42.46 39.99 1loq s ILE 43 CO 0.10 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.20 1loq n GLY 44 N 3.00 5.03 0.20 6.18 0.00 -1.26 -0.45 105.19 117.89 1loq n GLY 44 Ca -0.18 -2.00 0.03 0.00 0.00 0.00 0.00 46.02 43.87 1loq n GLY 44 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1loq h TYR 45 N 0.71 0.04 -0.91 1.61 0.99 -1.97 -1.91 116.97 115.53 1loq h TYR 45 Ca 0.00 -0.01 0.08 0.00 2.00 0.00 0.00 58.73 60.81 1loq h TYR 45 Cb 0.00 -0.01 -0.07 0.00 1.00 0.00 0.00 36.73 37.65 1loq h TYR 45 CO 0.00 0.34 0.56 -1.35 -0.00 0.00 0.00 178.16 177.70 1loq h PRO 46 N 0.03 0.93 0.13 4.88 0.11 -1.93 0.91 132.00 137.07 1loq h PRO 46 Ca 0.00 -0.06 -0.25 0.00 0.11 0.00 0.00 66.00 65.81 1loq h PRO 46 Cb 0.55 -0.21 0.01 0.00 0.11 0.00 0.00 31.00 31.46 1loq h PRO 46 CO 0.04 0.62 -1.19 1.25 -0.21 0.00 0.00 178.00 178.50 1loq h LEU 47 N 0.96 0.44 -0.70 2.35 5.85 -1.68 -3.28 115.31 119.25 1loq h LEU 47 Ca 0.42 -0.89 -0.08 0.00 0.84 0.00 0.00 57.88 58.16 1loq h LEU 47 Cb 0.29 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 1loq h LEU 47 CO -0.21 1.54 0.09 0.58 -0.34 0.00 0.00 178.44 180.10 1loq h VAL 48 N -0.31 1.26 0.00 1.05 2.07 -1.22 0.07 116.25 119.17 1loq h VAL 48 Ca -0.24 -1.05 0.00 0.00 0.82 0.00 0.00 66.70 66.23 1loq h VAL 48 Cb 1.74 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 32.16 1loq h VAL 48 CO 0.10 0.39 0.00 0.18 0.02 0.00 0.00 177.57 178.27 1loq n LEU 49 N -4.21 0.55 -0.07 2.57 4.77 0.30 -0.14 117.00 120.78 1loq n LEU 49 Ca 0.04 0.60 -0.18 0.00 -0.03 0.00 0.00 56.01 56.43 1loq n LEU 49 Cb 0.30 -0.47 -0.13 0.00 -2.33 0.00 0.00 43.42 40.78 1loq n LEU 49 CO 0.43 -0.33 -1.08 -1.20 -1.33 0.00 0.00 177.39 173.88 1loq n SER 50 N -2.07 1.85 -0.16 -1.43 7.64 -0.97 -4.67 113.62 113.81 1loq n SER 50 Ca 0.04 0.04 0.03 0.00 1.01 0.00 0.00 58.87 59.99 1loq n SER 50 Cb 0.30 -0.48 0.01 0.00 -1.01 0.00 0.00 64.21 63.03 1loq n SER 50 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1loq n GLU 51 N -3.30 1.79 0.00 1.43 -0.58 -0.03 -5.05 120.64 114.91 1loq n GLU 51 Ca -0.38 -0.56 0.00 0.00 -0.42 0.00 0.00 57.16 55.80 1loq n GLU 51 Cb 1.03 -0.99 0.00 0.00 -0.57 0.00 0.00 31.44 30.90 1loq n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1loq n GLY 52 N 0.64 0.62 0.31 0.62 0.00 0.80 -4.61 105.19 103.58 1loq n GLY 52 Ca 0.03 -1.71 0.19 0.00 0.00 0.00 0.00 46.02 44.53 1loq n GLY 52 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1loq h MET 53 N 0.00 0.00 0.00 1.61 2.86 -1.94 -2.54 114.93 114.92 1loq h MET 53 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1loq h MET 53 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1loq h MET 53 CO 0.00 0.02 0.00 -0.44 1.06 0.00 0.00 176.91 177.55 1loq h ASP 54 N 0.00 0.00 0.12 1.22 3.32 -1.92 -2.12 116.42 117.04 1loq h ASP 54 Ca -0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1loq h ASP 54 Cb 0.20 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.74 1loq h ASP 54 CO 0.00 0.00 -0.05 -0.29 -1.72 0.00 0.00 179.24 177.18 1loq h ILE 55 N 0.00 0.62 -0.02 0.35 6.09 -1.70 -2.17 117.51 120.67 1loq h ILE 55 Ca 0.00 -0.21 -0.00 0.00 -1.37 0.00 0.00 64.86 63.28 1loq h ILE 55 Cb 0.16 1.13 -0.00 0.00 0.47 0.00 0.00 36.82 38.58 1loq h ILE 55 CO 0.00 0.05 0.00 0.40 -3.07 0.00 0.00 178.15 175.53 1loq h ILE 56 N 0.00 1.24 -0.26 2.19 2.04 -1.62 -1.24 117.51 119.87 1loq h ILE 56 Ca -0.00 -0.73 -0.08 0.00 1.00 0.00 0.00 64.86 65.05 1loq h ILE 56 Cb 0.12 1.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 1loq h ILE 56 CO 0.01 0.19 -0.19 0.00 0.00 0.00 0.00 178.15 178.16 1loq h ALA 57 N 0.71 1.19 -0.36 1.87 0.00 -1.52 -1.50 119.26 119.64 1loq h ALA 57 Ca 0.01 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 1loq h ALA 57 Cb 0.31 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1loq h ALA 57 CO 0.00 0.52 0.15 1.49 0.00 0.00 0.00 179.25 181.41 1loq h GLU 58 N 0.42 0.54 -0.46 0.00 4.81 -1.25 -1.05 114.58 117.59 1loq h GLU 58 Ca 0.07 -0.10 -0.02 0.00 -0.13 0.00 0.00 59.36 59.18 1loq h GLU 58 Cb 0.58 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.85 1loq h GLU 58 CO 0.04 0.52 0.20 0.74 -0.73 0.00 0.00 179.01 179.78 1loq h PHE 59 N 0.44 0.68 -0.74 0.92 -1.00 -0.93 0.22 116.94 116.52 1loq h PHE 59 Ca 0.12 -0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.86 1loq h PHE 59 Cb 0.18 -0.21 -0.04 0.00 3.61 0.00 0.00 35.95 39.50 1loq h PHE 59 CO -0.00 0.57 0.48 -0.09 -1.61 0.00 0.00 178.31 177.66 1loq h ARG 60 N 0.60 0.98 0.13 1.51 2.43 -1.11 -1.44 114.38 117.49 1loq h ARG 60 Ca 0.15 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 1loq h ARG 60 Cb 0.16 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 1loq h ARG 60 CO -0.02 0.66 -0.06 -0.22 -1.51 0.00 0.00 179.97 178.82 1loq h LYS 61 N 1.01 -0.17 -0.52 0.20 3.64 -0.97 -0.70 116.57 119.06 1loq h LYS 61 Ca 0.27 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.64 1loq h LYS 61 Cb -0.10 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 1loq h LYS 61 CO -0.06 0.22 0.22 -0.09 -2.27 0.00 0.00 179.45 177.48 1loq h ARG 62 N -0.62 0.76 0.00 1.90 2.43 -0.90 -3.33 114.38 114.63 1loq h ARG 62 Ca -0.02 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 1loq h ARG 62 Cb 0.47 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1loq h ARG 62 CO 0.03 0.65 -1.43 1.19 -1.51 0.00 0.00 179.97 178.91 1loq n PHE 63 N -4.56 0.00 -2.07 2.20 3.01 -0.55 -5.10 117.46 110.39 1loq n PHE 63 Ca 0.02 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.45 1loq n PHE 63 Cb 0.14 -0.25 0.00 0.00 -0.01 0.00 0.00 39.48 39.36 1loq n PHE 63 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1loq n GLY 64 N 1.55 -0.93 3.61 1.37 0.00 -0.27 -5.06 105.19 105.47 1loq n GLY 64 Ca -0.01 0.44 -0.31 0.00 0.00 0.00 0.00 46.02 46.14 1loq n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1loq s ARG 66 N -1.78 2.39 -0.15 1.61 1.81 -1.24 -5.05 118.95 116.54 1loq s ARG 66 Ca 0.10 -0.87 0.02 0.00 -1.72 0.00 0.00 55.73 53.26 1loq s ARG 66 Cb -0.03 -2.44 0.01 0.00 -0.45 0.00 0.00 34.95 32.05 1loq s ARG 66 CO 0.32 0.55 -0.21 0.42 -0.68 0.00 0.00 175.30 175.70 1loq s ILE 67 N -1.16 2.04 -0.23 1.52 -1.09 -1.26 -1.02 121.20 119.99 1loq s ILE 67 Ca 0.21 -0.96 -0.08 0.00 -2.23 0.00 0.00 60.65 57.59 1loq s ILE 67 Cb -0.11 -1.81 -0.04 0.00 -1.58 0.00 0.00 42.46 38.92 1loq s ILE 67 CO 0.13 0.54 0.09 -0.63 -1.23 0.00 0.00 174.94 173.84 1loq s ILE 68 N 0.95 4.64 -0.47 2.92 1.01 -0.55 -0.92 121.20 128.77 1loq s ILE 68 Ca -0.04 -0.07 -0.23 0.00 0.00 0.00 0.00 60.65 60.32 1loq s ILE 68 Cb -0.15 -3.15 0.03 0.00 0.01 0.00 0.00 42.46 39.20 1loq s ILE 68 CO -0.05 0.36 0.79 0.00 0.00 0.00 0.00 174.94 176.04 1loq s ALA 69 N 1.23 3.28 -1.27 9.38 0.00 0.35 -0.83 121.76 133.89 1loq s ALA 69 Ca 0.05 -1.13 -0.12 0.00 0.00 0.00 0.00 51.96 50.76 1loq s ALA 69 Cb -0.14 -3.50 0.15 0.00 0.00 0.00 0.00 23.12 19.63 1loq s ALA 69 CO 0.04 -2.01 1.76 -3.47 0.00 0.00 0.00 175.76 172.08 1loq n ASP 70 N 6.77 5.03 -0.31 0.00 2.03 0.41 -1.44 116.55 129.02 1loq n ASP 70 Ca 0.01 -3.04 0.12 0.00 0.52 0.00 0.00 54.79 52.40 1loq n ASP 70 Cb 0.48 -1.54 0.18 0.00 -0.72 0.00 0.00 41.12 39.52 1loq n ASP 70 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1loq n PHE 71 N 4.86 0.00 -4.08 -0.67 0.99 -1.25 -4.36 117.46 112.95 1loq n PHE 71 Ca 0.40 0.00 -0.28 0.00 -0.00 0.00 0.00 57.45 57.57 1loq n PHE 71 Cb 0.39 -0.07 -0.05 0.00 -1.00 0.00 0.00 39.48 38.75 1loq n PHE 71 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 1loq n LYS 72 N -0.53 -2.25 -1.67 -1.08 5.02 -0.44 -4.74 118.16 112.48 1loq n LYS 72 Ca 0.10 0.28 -0.49 0.00 -2.02 0.00 0.00 58.31 56.17 1loq n LYS 72 Cb 0.39 -4.10 -0.05 0.00 -0.02 0.00 0.00 35.03 31.26 1loq n LYS 72 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1loq n VAL 73 N -4.49 0.25 -2.68 -0.18 0.31 -1.08 -4.36 118.33 106.10 1loq n VAL 73 Ca -0.31 -0.04 -0.08 0.00 -0.01 0.00 0.00 64.34 63.90 1loq n VAL 73 Cb 0.69 -1.51 0.07 0.00 -0.91 0.00 0.00 33.84 32.17 1loq n VAL 73 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1loq n ALA 74 N 4.70 2.47 -4.13 3.52 0.00 -1.26 -0.95 120.51 124.86 1loq n ALA 74 Ca 0.20 -2.32 -0.15 0.00 0.00 0.00 0.00 53.44 51.18 1loq n ALA 74 Cb 0.26 -0.96 -0.02 0.00 0.00 0.00 0.00 19.45 18.72 1loq n ALA 74 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1loq n ASP 75 N -0.32 2.38 -4.73 0.00 -0.08 -1.26 -4.98 116.55 107.56 1loq n ASP 75 Ca 0.04 -2.01 -0.30 0.00 -1.51 0.00 0.00 54.79 51.01 1loq n ASP 75 Cb 0.83 0.11 0.13 0.00 2.34 0.00 0.00 41.12 44.53 1loq n ASP 75 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 1loq s ILE 76 N -1.67 2.77 0.17 5.18 -4.36 -1.26 -4.74 121.20 117.29 1loq s ILE 76 Ca 0.05 0.25 -0.15 0.00 -0.26 0.00 0.00 60.65 60.53 1loq s ILE 76 Cb -0.00 -2.76 0.10 0.00 1.25 0.00 0.00 42.46 41.04 1loq s ILE 76 CO 0.03 -0.32 1.68 -0.65 0.24 0.00 0.00 174.94 175.92 1loq h PRO 77 N -1.46 0.08 -0.56 0.37 0.11 -1.88 -0.78 132.00 127.88 1loq h PRO 77 Ca -0.49 -0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.67 1loq h PRO 77 Cb 1.28 -0.02 -0.05 0.00 0.11 0.00 0.00 31.00 32.32 1loq h PRO 77 CO 0.55 0.05 0.28 0.93 -0.21 0.00 0.00 178.00 179.60 1loq h GLU 78 N 0.08 0.51 -0.10 1.05 3.07 -1.95 -0.91 114.58 116.33 1loq h GLU 78 Ca 0.21 -0.03 -0.18 0.00 -0.50 0.00 0.00 59.36 58.86 1loq h GLU 78 Cb 0.31 -0.12 -0.00 0.00 -0.84 0.00 0.00 28.75 28.10 1loq h GLU 78 CO -0.38 0.34 -0.69 1.15 -1.40 0.00 0.00 179.01 178.03 1loq h THR 79 N 0.53 1.36 -0.76 1.13 2.02 -1.87 -2.80 112.91 112.52 1loq h THR 79 Ca 0.25 -2.05 0.04 0.00 0.77 0.00 0.00 66.41 65.42 1loq h THR 79 Cb 0.18 2.03 -0.05 0.00 -1.74 0.00 0.00 68.15 68.56 1loq h THR 79 CO -0.18 0.62 0.47 0.78 0.37 0.00 0.00 175.52 177.58 1loq h ASN 80 N 0.32 0.76 -0.66 4.18 4.21 -0.67 0.32 115.58 124.05 1loq h ASN 80 Ca -0.02 0.01 -0.00 0.00 1.21 0.00 0.00 56.30 57.49 1loq h ASN 80 Cb 1.26 -0.16 -0.03 0.00 -1.12 0.00 0.00 38.32 38.27 1loq h ASN 80 CO 0.12 0.51 0.40 -0.33 -1.29 0.00 0.00 177.43 176.84 1loq h GLU 81 N 0.90 0.89 -0.55 0.81 5.08 -0.96 -0.45 114.58 120.30 1loq h GLU 81 Ca 0.31 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.57 1loq h GLU 81 Cb 0.07 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 1loq h GLU 81 CO -0.13 0.63 0.26 0.87 -1.00 0.00 0.00 179.01 179.64 1loq h LYS 82 N 0.89 0.79 -0.38 2.33 1.57 -1.09 -0.29 116.57 120.39 1loq h LYS 82 Ca 0.24 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 58.86 1loq h LYS 82 Cb -0.03 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 1loq h LYS 82 CO -0.04 0.65 0.08 0.82 -0.57 0.00 0.00 179.45 180.39 1loq h ILE 83 N 0.74 1.23 -0.72 1.86 2.04 -0.64 -2.08 117.51 119.95 1loq h ILE 83 Ca 0.19 -0.81 -0.06 0.00 1.00 0.00 0.00 64.86 65.18 1loq h ILE 83 Cb 0.12 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 1loq h ILE 83 CO -0.02 0.28 0.21 0.00 0.00 0.00 0.00 178.15 178.62 1loq h ARG 85 N 1.07 0.60 -0.56 0.00 2.43 -0.88 0.10 114.38 117.14 1loq h ARG 85 Ca 0.23 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.29 1loq h ARG 85 Cb 0.32 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.72 1loq h ARG 85 CO -0.01 0.43 0.13 0.00 -1.51 0.00 0.00 179.97 179.02 1loq h ALA 86 N 1.13 1.17 -0.31 2.80 0.00 -1.23 -0.04 119.26 122.78 1loq h ALA 86 Ca 0.16 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1loq h ALA 86 Cb -0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1loq h ALA 86 CO -0.03 0.56 -0.21 1.15 0.00 0.00 0.00 179.25 180.72 1loq h THR 87 N 0.83 1.30 -0.12 0.00 2.02 -0.83 -1.73 112.91 114.37 1loq h THR 87 Ca 0.18 -1.34 -0.16 0.00 0.77 0.00 0.00 66.41 65.86 1loq h THR 87 Cb 0.31 1.49 -0.01 0.00 -1.74 0.00 0.00 68.15 68.20 1loq h THR 87 CO 0.00 0.43 -0.61 -0.26 0.37 0.00 0.00 175.52 175.45 1loq h PHE 88 N 0.44 0.51 -0.42 3.16 0.04 -0.85 -2.72 116.94 117.11 1loq h PHE 88 Ca 0.06 -0.20 -0.01 0.00 2.80 0.00 0.00 57.97 60.62 1loq h PHE 88 Cb 0.75 -0.09 -0.02 0.00 2.20 0.00 0.00 35.95 38.79 1loq h PHE 88 CO 0.06 0.90 0.21 -0.22 -0.60 0.00 0.00 178.31 178.66 1loq h LYS 89 N 0.30 0.57 0.00 1.51 3.64 -0.89 -0.16 116.57 121.54 1loq h LYS 89 Ca -0.01 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1loq h LYS 89 Cb 1.14 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 1loq h LYS 89 CO 0.10 0.44 0.00 0.00 -2.27 0.00 0.00 179.45 177.73 1loq n ALA 90 N -2.47 1.92 0.00 5.00 0.00 -0.66 -4.88 120.51 119.41 1loq n ALA 90 Ca 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1loq n ALA 90 Cb 0.11 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.27 1loq n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1loq n GLY 91 N 0.32 0.74 3.77 0.00 0.00 -0.07 -3.51 105.19 106.43 1loq n GLY 91 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1loq n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1loq s ALA 92 N -2.00 3.50 0.05 4.61 0.00 -1.05 -4.86 121.76 122.00 1loq s ALA 92 Ca 0.00 1.27 0.10 0.00 0.00 0.00 0.00 51.96 53.33 1loq s ALA 92 Cb 0.00 -3.48 -0.08 0.00 0.00 0.00 0.00 23.12 19.56 1loq s ALA 92 CO 0.00 -0.66 1.36 -0.44 0.00 0.00 0.00 175.76 176.02 1loq h ASP 93 N 3.41 0.00 -5.09 0.00 3.32 -1.38 -3.43 116.42 113.25 1loq h ASP 93 Ca -0.49 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.51 1loq h ASP 93 Cb 1.23 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.65 1loq h ASP 93 CO 0.66 0.82 -0.08 0.00 -1.72 0.00 0.00 179.24 178.92 1loq s ALA 94 N -2.85 -0.85 -0.00 3.45 0.00 -1.10 -2.35 121.76 118.06 1loq s ALA 94 Ca 0.02 -0.16 0.02 0.00 0.00 0.00 0.00 51.96 51.84 1loq s ALA 94 Cb 0.09 0.73 -0.01 0.00 0.00 0.00 0.00 23.12 23.94 1loq s ALA 94 CO 0.79 -0.67 -0.08 -1.50 0.00 0.00 0.00 175.76 174.30 1loq s ILE 95 N -3.83 0.59 -0.18 0.00 2.07 -0.68 -0.50 121.20 118.67 1loq s ILE 95 Ca 0.05 -0.38 -0.15 0.00 -1.41 0.00 0.00 60.65 58.76 1loq s ILE 95 Cb 0.01 -0.51 -0.04 0.00 0.13 0.00 0.00 42.46 42.05 1loq s ILE 95 CO -0.09 0.12 0.37 -0.63 -1.91 0.00 0.00 174.94 172.80 1loq s ILE 96 N -0.27 5.23 0.02 2.00 1.01 -0.52 -0.76 121.20 127.91 1loq s ILE 96 Ca 0.02 0.67 0.08 0.00 0.00 0.00 0.00 60.65 61.42 1loq s ILE 96 Cb -0.03 -3.70 -0.02 0.00 0.01 0.00 0.00 42.46 38.71 1loq s ILE 96 CO -0.00 0.30 -0.23 0.68 0.00 0.00 0.00 174.94 175.69 1loq s VAL 97 N 1.01 1.82 0.31 2.92 -7.23 -0.10 -1.33 120.40 117.80 1loq s VAL 97 Ca 0.19 -1.16 -0.28 0.00 -1.81 0.00 0.00 61.98 58.92 1loq s VAL 97 Cb -0.14 -1.55 -0.09 0.00 0.56 0.00 0.00 36.38 35.15 1loq s VAL 97 CO 0.07 0.36 1.05 -1.00 -0.31 0.00 0.00 175.10 175.26 1loq s HIS 98 N -0.70 3.58 -0.45 2.82 3.76 -0.13 -0.85 115.29 123.32 1loq s HIS 98 Ca 0.09 1.73 0.22 0.00 -0.15 0.00 0.00 55.06 56.95 1loq s HIS 98 Cb -0.09 -3.17 -0.09 0.00 1.11 0.00 0.00 32.58 30.34 1loq s HIS 98 CO 0.01 -0.34 0.87 0.41 -0.85 0.00 0.00 174.74 174.84 1loq n GLY 99 N 0.99 -1.16 0.28 -2.22 0.00 -1.14 -4.42 105.19 97.51 1loq n GLY 99 Ca 0.00 -0.43 0.12 0.00 0.00 0.00 0.00 46.02 45.71 1loq n GLY 99 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 1loq h PHE 100 N 0.00 0.00 0.00 1.61 -5.15 -1.93 -1.44 116.94 110.03 1loq h PHE 100 Ca 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 1loq h PHE 100 Cb 0.81 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.98 1loq h PHE 100 CO 0.00 0.03 0.00 -2.30 -2.00 0.00 0.00 178.31 174.04 1loq n PRO 101 N -4.11 0.33 0.00 6.09 -0.02 -1.26 -4.98 135.00 131.05 1loq n PRO 101 Ca -0.03 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 1loq n PRO 101 Cb 0.11 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 1loq n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1loq n GLY 102 N 0.32 1.99 0.32 -1.23 0.00 -0.54 -4.66 105.19 101.38 1loq n GLY 102 Ca 0.10 -2.06 -0.05 0.00 0.00 0.00 0.00 46.02 44.02 1loq n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1loq h ALA 103 N 0.00 1.11 -0.62 4.61 0.00 -1.94 -2.54 119.26 119.88 1loq h ALA 103 Ca 0.00 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 1loq h ALA 103 Cb 0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 1loq h ALA 103 CO 0.00 0.61 0.18 0.38 0.00 0.00 0.00 179.25 180.42 1loq h ASP 104 N 0.97 0.89 -0.19 0.00 2.03 -1.99 0.15 116.42 118.28 1loq h ASP 104 Ca 0.21 -0.16 -0.11 0.00 -0.73 0.00 0.00 57.03 56.24 1loq h ASP 104 Cb 0.29 -0.23 -0.01 0.00 -0.83 0.00 0.00 39.33 38.55 1loq h ASP 104 CO -0.01 0.84 -0.25 0.28 -1.03 0.00 0.00 179.24 179.07 1loq h SER 105 N 0.92 0.68 -0.18 4.15 0.02 -1.77 -1.58 113.55 115.77 1loq h SER 105 Ca 0.20 -0.25 -0.14 0.00 -0.84 0.00 0.00 61.79 60.77 1loq h SER 105 Cb 0.28 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.64 1loq h SER 105 CO -0.01 0.91 -0.44 0.58 -1.14 0.00 0.00 176.83 176.73 1loq h VAL 106 N 0.58 1.33 -0.84 2.27 2.07 -1.02 -3.16 116.25 117.48 1loq h VAL 106 Ca 0.08 -1.68 0.06 0.00 0.82 0.00 0.00 66.70 65.97 1loq h VAL 106 Cb 0.74 1.92 -0.05 0.00 -1.52 0.00 0.00 31.29 32.37 1loq h VAL 106 CO 0.06 0.52 0.55 -0.09 0.02 0.00 0.00 177.57 178.63 1loq h ARG 107 N 0.30 0.93 -0.78 1.57 9.65 -0.51 -0.45 114.38 125.08 1loq h ARG 107 Ca -0.00 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 1loq h ARG 107 Cb 1.05 -0.21 -0.04 0.00 -1.39 0.00 0.00 29.97 29.38 1loq h ARG 107 CO 0.10 0.61 0.50 0.00 2.80 0.00 0.00 179.97 183.98 1loq h ALA 108 N 1.54 1.42 -0.26 2.80 0.00 -1.26 0.68 119.26 124.18 1loq h ALA 108 Ca 0.35 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 55.08 1loq h ALA 108 Cb 0.17 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1loq h ALA 108 CO -0.12 0.53 -0.28 0.00 0.00 0.00 0.00 179.25 179.37 1loq h LEU 110 N 0.38 1.01 -0.60 0.00 3.38 -0.71 -1.04 115.31 117.73 1loq h LEU 110 Ca 0.04 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1loq h LEU 110 Cb 0.85 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 1loq h LEU 110 CO 0.07 0.75 0.26 0.78 0.09 0.00 0.00 178.44 180.39 1loq h ASN 111 N 1.17 0.80 -0.33 -0.43 2.35 -0.79 -1.10 115.58 117.26 1loq h ASN 111 Ca 0.31 -0.15 -0.13 0.00 -0.55 0.00 0.00 56.30 55.78 1loq h ASN 111 Cb -0.10 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.05 1loq h ASN 111 CO -0.06 0.73 -0.28 0.58 -1.65 0.00 0.00 177.43 176.74 1loq h VAL 112 N 0.82 1.27 -0.75 2.81 2.07 -1.19 -2.09 116.25 119.19 1loq h VAL 112 Ca 0.20 -1.43 0.00 0.00 0.82 0.00 0.00 66.70 66.29 1loq h VAL 112 Cb 0.16 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 1loq h VAL 112 CO -0.02 0.48 0.47 0.00 0.02 0.00 0.00 177.57 178.52 1loq h ALA 113 N 0.96 1.42 -0.31 1.67 0.00 -0.84 -1.42 119.26 120.73 1loq h ALA 113 Ca 0.08 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1loq h ALA 113 Cb 0.83 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1loq h ALA 113 CO 0.07 0.52 -0.01 1.49 0.00 0.00 0.00 179.25 181.32 1loq h GLU 114 N 1.03 0.57 -0.25 0.00 4.81 -0.96 0.12 114.58 119.90 1loq h GLU 114 Ca 0.27 -0.19 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 1loq h GLU 114 Cb -0.07 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 1loq h GLU 114 CO -0.05 0.71 0.05 0.93 -0.73 0.00 0.00 179.01 179.91 1loq h GLU 115 N 0.36 0.36 -0.16 1.92 5.08 -0.92 -2.98 114.58 118.23 1loq h GLU 115 Ca 0.09 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1loq h GLU 115 Cb 0.47 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1loq h GLU 115 CO 0.02 0.35 0.00 -1.33 -1.00 0.00 0.00 179.01 177.05 1loq n MET 116 N -4.38 2.21 -3.30 2.33 2.81 -0.58 -4.98 117.12 111.23 1loq n MET 116 Ca 0.01 -1.98 -0.17 0.00 -1.81 0.00 0.00 57.70 53.74 1loq n MET 116 Cb 0.17 -1.45 0.06 0.00 -0.71 0.00 0.00 33.22 31.29 1loq n MET 116 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1loq n GLY 117 N 1.30 -0.17 0.96 3.03 0.00 0.18 -5.02 105.19 105.47 1loq n GLY 117 Ca 0.15 0.02 -0.08 0.00 0.00 0.00 0.00 46.02 46.11 1loq n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1loq n ARG 118 N -3.83 1.36 -4.25 1.61 5.12 0.17 -5.04 116.66 111.80 1loq n ARG 118 Ca -0.01 -0.98 -0.21 0.00 -1.93 0.00 0.00 57.85 54.71 1loq n ARG 118 Cb 0.55 0.36 -0.12 0.00 -1.16 0.00 0.00 32.46 32.09 1loq n ARG 118 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1loq s GLU 119 N -2.47 1.03 -0.10 5.56 2.02 -0.99 -4.52 118.70 119.23 1loq s GLU 119 Ca 0.02 -1.15 0.00 0.00 0.02 0.00 0.00 54.97 53.87 1loq s GLU 119 Cb 0.00 -1.12 -0.02 0.00 0.10 0.00 0.00 34.13 33.09 1loq s GLU 119 CO 0.01 0.25 -0.11 0.08 0.02 0.00 0.00 175.26 175.51 1loq s VAL 120 N -1.49 3.27 -0.16 2.63 1.01 -1.26 -1.68 120.40 122.72 1loq s VAL 120 Ca 0.06 -0.61 -0.04 0.00 0.00 0.00 0.00 61.98 61.39 1loq s VAL 120 Cb -0.08 -2.35 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 1loq s VAL 120 CO 0.04 0.55 -0.04 -0.36 0.00 0.00 0.00 175.10 175.29 1loq s PHE 121 N -0.10 3.02 -0.27 5.22 0.40 0.06 -4.19 117.98 122.12 1loq s PHE 121 Ca -0.01 -0.30 -0.14 0.00 -0.60 0.00 0.00 56.93 55.88 1loq s PHE 121 Cb -0.14 -1.96 -0.04 0.00 0.51 0.00 0.00 43.02 41.39 1loq s PHE 121 CO 0.03 -0.04 0.33 -1.17 0.70 0.00 0.00 175.22 175.08 1loq s LEU 122 N 0.37 4.03 -0.39 -0.37 2.96 0.01 -0.92 118.68 124.37 1loq s LEU 122 Ca -0.04 0.22 -0.26 0.00 -0.22 0.00 0.00 54.13 53.83 1loq s LEU 122 Cb -0.14 -2.35 0.02 0.00 0.50 0.00 0.00 46.19 44.21 1loq s LEU 122 CO 0.03 -0.15 0.94 -0.22 -1.32 0.00 0.00 176.35 175.63 1loq s LEU 123 N 2.00 3.98 -0.23 -0.68 2.96 -0.03 -1.05 118.68 125.62 1loq s LEU 123 Ca 0.13 0.51 0.09 0.00 -0.22 0.00 0.00 54.13 54.63 1loq s LEU 123 Cb -0.16 -3.27 -0.21 0.00 0.50 0.00 0.00 46.19 43.05 1loq s LEU 123 CO 0.10 -0.91 -0.07 0.35 -1.32 0.00 0.00 176.35 174.50 1loq n THR 124 N 6.10 1.46 -3.76 3.68 -2.24 -0.91 -2.89 114.28 115.72 1loq n THR 124 Ca 0.07 -0.70 -0.12 0.00 -2.27 0.00 0.00 64.05 61.03 1loq n THR 124 Cb 0.48 -1.03 -0.12 0.00 -2.10 0.00 0.00 70.33 67.56 1loq n THR 124 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1loq s GLU 125 N -2.51 0.26 0.48 -0.78 2.12 -1.26 -4.30 118.70 112.72 1loq s GLU 125 Ca -0.24 0.45 -0.02 0.00 0.36 0.00 0.00 54.97 55.53 1loq s GLU 125 Cb 0.08 0.02 -0.00 0.00 0.26 0.00 0.00 34.13 34.48 1loq s GLU 125 CO 0.70 -0.10 0.73 -1.64 -0.54 0.00 0.00 175.26 174.42 1loq s MET 126 N 0.69 3.08 0.18 4.30 -1.94 -1.26 -3.66 119.30 120.69 1loq s MET 126 Ca -0.05 -0.31 0.23 0.00 -1.71 0.00 0.00 55.69 53.85 1loq s MET 126 Cb -0.06 -2.48 0.07 0.00 2.01 0.00 0.00 34.83 34.38 1loq s MET 126 CO -0.04 -0.36 1.10 0.66 -0.01 0.00 0.00 175.02 176.37 1loq h SER 127 N 0.25 0.00 -4.26 3.03 4.64 -1.93 -3.43 113.55 111.85 1loq h SER 127 Ca -0.46 -0.07 -0.49 0.00 -0.47 0.00 0.00 61.79 60.30 1loq h SER 127 Cb 1.25 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.41 1loq h SER 127 CO 0.59 0.03 0.35 -1.38 -0.87 0.00 0.00 176.83 175.55 1loq s HIS 128 N -3.31 3.32 0.24 4.77 -3.43 -1.26 -4.72 115.29 110.89 1loq s HIS 128 Ca 0.01 0.95 -0.06 0.00 -0.80 0.00 0.00 55.06 55.17 1loq s HIS 128 Cb 0.11 -2.97 0.37 0.00 -1.43 0.00 0.00 32.58 28.65 1loq s HIS 128 CO 0.78 -1.07 1.80 -1.35 -2.00 0.00 0.00 174.74 172.89 1loq h PRO 129 N -0.52 0.69 0.00 -0.38 0.11 -1.99 -1.69 132.00 128.22 1loq h PRO 129 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1loq h PRO 129 Cb 1.25 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1loq h PRO 129 CO 0.63 0.45 0.00 0.78 -0.21 0.00 0.00 178.00 179.65 1loq h GLY 130 N 0.71 0.00 2.00 -0.55 0.00 -1.98 -2.11 103.07 101.14 1loq h GLY 130 Ca 0.37 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.70 1loq h GLY 130 CO -0.25 0.00 -0.00 0.00 0.00 0.00 0.00 176.54 176.28 1loq h ALA 131 N 2.00 1.14 0.00 3.60 0.00 -1.61 -1.44 119.26 122.95 1loq h ALA 131 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1loq h ALA 131 Cb 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1loq h ALA 131 CO 0.00 0.01 -0.07 0.93 0.00 0.00 0.00 179.25 180.12 1loq h GLU 132 N 0.00 0.00 -0.08 0.00 5.08 -1.57 -0.51 114.58 117.50 1loq h GLU 132 Ca -0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1loq h GLU 132 Cb 0.04 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 1loq h GLU 132 CO 0.00 0.07 0.01 1.98 -1.00 0.00 0.00 179.01 180.07 1loq h MET 133 N 0.00 0.13 0.00 2.33 4.05 -1.47 -3.41 114.93 116.56 1loq h MET 133 Ca -0.00 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.38 1loq h MET 133 Cb 0.69 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.47 1loq h MET 133 CO 0.01 0.34 -0.39 1.19 0.23 0.00 0.00 176.91 178.30 1loq n PHE 134 N -4.88 0.00 -0.12 1.39 3.01 -1.25 -4.89 117.46 110.72 1loq n PHE 134 Ca -0.06 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.28 1loq n PHE 134 Cb 0.16 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.60 1loq n PHE 134 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1loq h ILE 135 N 0.00 1.28 -0.74 4.37 2.04 -1.77 -3.19 117.51 119.50 1loq h ILE 135 Ca 0.00 -1.22 0.09 0.00 1.00 0.00 0.00 64.86 64.74 1loq h ILE 135 Cb 0.39 1.33 -0.07 0.00 -0.74 0.00 0.00 36.82 37.72 1loq h ILE 135 CO 0.00 0.40 0.38 -0.61 0.00 0.00 0.00 178.15 178.32 1loq h GLN 136 N 0.50 0.63 0.00 2.37 4.15 -1.32 0.20 115.11 121.64 1loq h GLN 136 Ca 0.09 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.47 1loq h GLN 136 Cb 0.65 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 28.20 1loq h GLN 136 CO 0.04 0.41 0.00 0.78 -1.93 0.00 0.00 178.83 178.14 1loq h GLY 137 N 0.64 0.00 -0.31 2.39 0.00 -1.81 -2.52 103.07 101.46 1loq h GLY 137 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.69 1loq h GLY 137 CO -0.26 0.00 -0.56 0.00 0.00 0.00 0.00 176.54 175.71 1loq n ALA 138 N -2.06 3.66 -0.27 3.60 0.00 -0.46 -4.72 120.51 120.27 1loq n ALA 138 Ca -0.01 -0.48 -0.00 0.00 0.00 0.00 0.00 53.44 52.95 1loq n ALA 138 Cb 0.19 -0.56 0.12 0.00 0.00 0.00 0.00 19.45 19.20 1loq n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1loq h ALA 139 N 2.45 1.02 -0.57 0.00 0.00 -0.54 0.33 119.26 121.95 1loq h ALA 139 Ca 0.00 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1loq h ALA 139 Cb 0.44 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1loq h ALA 139 CO 0.00 0.14 0.20 -0.44 0.00 0.00 0.00 179.25 179.14 1loq h ASP 140 N 0.80 0.81 -0.59 0.00 5.19 -1.84 -0.21 116.42 120.58 1loq h ASP 140 Ca 0.34 -0.19 -0.08 0.00 -0.62 0.00 0.00 57.03 56.47 1loq h ASP 140 Cb 0.20 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 39.47 1loq h ASP 140 CO -0.18 0.79 0.05 -0.33 -3.12 0.00 0.00 179.24 176.44 1loq h GLU 141 N 0.79 1.03 -0.82 3.56 5.08 -1.79 -0.23 114.58 122.21 1loq h GLU 141 Ca 0.19 -0.29 -0.04 0.00 -1.00 0.00 0.00 59.36 58.21 1loq h GLU 141 Cb 0.25 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.35 1loq h GLU 141 CO -0.01 0.98 0.36 0.82 -1.00 0.00 0.00 179.01 180.16 1loq h ILE 142 N 0.96 1.26 -0.52 3.13 2.04 -0.49 -0.05 117.51 123.83 1loq h ILE 142 Ca 0.18 -0.78 -0.09 0.00 1.00 0.00 0.00 64.86 65.17 1loq h ILE 142 Cb 0.49 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 1loq h ILE 142 CO 0.02 0.32 -0.04 0.00 0.00 0.00 0.00 178.15 178.46 1loq h ALA 143 N 1.19 0.71 -0.75 1.87 0.00 -0.64 -1.24 119.26 120.41 1loq h ALA 143 Ca 0.28 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1loq h ALA 143 Cb 0.17 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1loq h ALA 143 CO -0.03 0.56 0.39 -0.09 0.00 0.00 0.00 179.25 180.08 1loq h ARG 144 N 0.82 1.06 -0.52 0.00 9.65 -0.76 -0.80 114.38 123.83 1loq h ARG 144 Ca 0.14 -0.14 0.03 0.00 -1.10 0.00 0.00 59.98 58.91 1loq h ARG 144 Cb 0.58 -0.20 -0.04 0.00 -1.39 0.00 0.00 29.97 28.92 1loq h ARG 144 CO 0.03 0.80 0.30 1.98 2.80 0.00 0.00 179.97 185.89 1loq h MET 145 N 1.04 0.58 -0.49 0.20 4.05 -0.76 -0.12 114.93 119.43 1loq h MET 145 Ca 0.26 -0.03 0.03 0.00 -0.28 0.00 0.00 59.70 59.68 1loq h MET 145 Cb 0.07 -0.13 -0.04 0.00 -0.80 0.00 0.00 31.60 30.70 1loq h MET 145 CO -0.04 0.38 0.27 0.78 0.23 0.00 0.00 176.91 178.53 1loq h GLY 146 N 0.60 0.68 0.98 1.39 0.00 -0.36 -0.51 103.07 105.84 1loq h GLY 146 Ca 0.21 -0.19 0.01 0.00 0.00 0.00 0.00 47.33 47.36 1loq h GLY 146 CO -0.10 0.14 0.28 -2.08 0.00 0.00 0.00 176.54 174.78 1loq h VAL 147 N 0.53 1.09 -0.30 4.60 2.07 -0.46 -0.77 116.25 123.01 1loq h VAL 147 Ca 0.20 -0.19 0.01 0.00 0.82 0.00 0.00 66.70 67.54 1loq h VAL 147 Cb 0.07 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 1loq h VAL 147 CO -0.12 0.10 0.20 0.44 0.02 0.00 0.00 177.57 178.21 1loq h ASP 148 N 0.57 0.32 0.27 0.57 3.32 -0.54 -1.98 116.42 118.94 1loq h ASP 148 Ca 0.16 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1loq h ASP 148 Cb -0.05 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.42 1loq h ASP 148 CO -0.05 0.23 -0.15 0.18 -1.72 0.00 0.00 179.24 177.74 1loq n LEU 149 N -4.49 0.76 0.00 1.55 4.77 -0.25 -4.93 117.00 114.41 1loq n LEU 149 Ca 0.02 -0.14 0.00 0.00 -0.03 0.00 0.00 56.01 55.86 1loq n LEU 149 Cb 0.09 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 1loq n LEU 149 CO 0.35 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1loq n GLY 150 N 1.28 0.70 3.75 -0.72 0.00 -0.75 -5.04 105.19 104.43 1loq n GLY 150 Ca 0.14 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1loq n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1loq s VAL 151 N -2.00 2.63 -0.01 1.61 1.01 -0.35 -4.92 120.40 118.36 1loq s VAL 151 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 61.98 62.54 1loq s VAL 151 Cb 0.00 -3.36 0.00 0.00 0.00 0.00 0.00 36.38 33.02 1loq s VAL 151 CO 0.00 0.10 0.50 0.29 0.00 0.00 0.00 175.10 176.00 1loq n LYS 152 N 1.77 -0.95 -4.52 2.72 4.76 -1.26 -4.60 118.16 116.08 1loq n LYS 152 Ca 0.04 -0.50 -0.24 0.00 -2.87 0.00 0.00 58.31 54.74 1loq n LYS 152 Cb 0.41 -1.00 -0.17 0.00 -1.84 0.00 0.00 35.03 32.43 1loq n LYS 152 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1loq s ASN 153 N -0.01 1.71 0.12 4.39 0.01 -1.26 -0.94 114.94 118.96 1loq s ASN 153 Ca 0.00 -0.28 0.03 0.00 -0.71 0.00 0.00 52.86 51.90 1loq s ASN 153 Cb 0.00 -0.79 -0.04 0.00 0.41 0.00 0.00 41.25 40.83 1loq s ASN 153 CO 0.00 0.02 -0.09 -0.31 -1.51 0.00 0.00 177.10 175.21 1loq s TYR 154 N 0.73 1.09 -0.08 2.20 1.51 0.59 -0.81 117.35 122.57 1loq s TYR 154 Ca -0.14 -0.81 0.02 0.00 -1.01 0.00 0.00 57.07 55.13 1loq s TYR 154 Cb -0.16 -0.58 0.01 0.00 -0.11 0.00 0.00 41.96 41.13 1loq s TYR 154 CO 0.03 -0.02 -0.13 0.08 -1.11 0.00 0.00 175.55 174.39 1loq s VAL 155 N -3.35 1.29 0.12 0.71 1.01 -0.22 -1.01 120.40 118.95 1loq s VAL 155 Ca 0.13 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.58 1loq s VAL 155 Cb 0.03 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.19 1loq s VAL 155 CO -0.02 0.39 -0.01 -0.83 0.00 0.00 0.00 175.10 174.64 1loq s GLY 156 N 0.83 0.91 -0.14 4.51 0.00 -0.94 -2.14 107.32 110.34 1loq s GLY 156 Ca -0.11 -1.43 -0.29 0.00 0.00 0.00 0.00 44.72 42.89 1loq s GLY 156 CO 0.02 -1.43 1.03 2.56 0.00 0.00 0.00 173.10 175.28 1loq s PRO 157 N -3.93 4.37 0.36 2.90 0.04 -1.24 -3.62 135.00 133.87 1loq s PRO 157 Ca 0.18 1.40 0.09 0.00 0.04 0.00 0.00 61.00 62.71 1loq s PRO 157 Cb 0.07 -3.58 0.68 0.00 0.04 0.00 0.00 34.50 31.70 1loq s PRO 157 CO -0.01 -0.42 1.83 1.03 0.04 0.00 0.00 177.00 179.47 1loq h SER 158 N 7.24 0.18 0.54 6.66 0.87 -1.45 -2.76 113.55 124.84 1loq h SER 158 Ca -0.27 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.23 1loq h SER 158 Cb 1.12 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.03 1loq h SER 158 CO 0.90 0.45 0.00 0.35 -0.53 0.00 0.00 176.83 178.00 1loq n THR 159 N -4.17 0.95 -3.49 2.23 -2.24 -1.26 -3.89 114.28 102.41 1loq n THR 159 Ca -0.01 0.32 -0.27 0.00 -2.27 0.00 0.00 64.05 61.82 1loq n THR 159 Cb 0.36 -1.24 -0.10 0.00 -2.10 0.00 0.00 70.33 67.25 1loq n THR 159 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1loq s ARG 160 N -3.28 1.19 0.58 -0.78 0.52 -1.04 -4.96 118.95 111.18 1loq s ARG 160 Ca 0.03 -2.33 0.28 0.00 -0.52 0.00 0.00 55.73 53.20 1loq s ARG 160 Cb 0.08 -1.78 1.75 0.00 0.52 0.00 0.00 34.95 35.52 1loq s ARG 160 CO 0.32 -1.37 2.23 -1.35 0.02 0.00 0.00 175.30 175.16 1loq h PRO 161 N 5.61 0.00 -0.11 3.54 0.11 -1.72 0.25 132.00 139.68 1loq h PRO 161 Ca 0.24 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 66.23 1loq h PRO 161 Cb 0.88 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.98 1loq h PRO 161 CO 0.43 0.00 -0.49 1.05 -0.21 0.00 0.00 178.00 178.78 1loq h GLU 162 N 0.00 0.28 0.00 1.05 9.09 -1.94 0.80 114.58 123.87 1loq h GLU 162 Ca 0.01 -0.15 -0.22 0.00 0.05 0.00 0.00 59.36 59.04 1loq h GLU 162 Cb 0.04 0.01 -0.00 0.00 -1.65 0.00 0.00 28.75 27.15 1loq h GLU 162 CO -0.00 0.71 -0.93 0.00 0.05 0.00 0.00 179.01 178.84 1loq h ARG 163 N 0.22 0.35 -0.62 1.06 2.47 -1.36 -2.25 114.38 114.25 1loq h ARG 163 Ca 0.01 -0.38 -0.07 0.00 -1.26 0.00 0.00 59.98 58.28 1loq h ARG 163 Cb 0.95 0.11 -0.03 0.00 -1.65 0.00 0.00 29.97 29.35 1loq h ARG 163 CO 0.08 1.07 0.12 1.25 0.56 0.00 0.00 179.97 183.05 1loq h LEU 164 N 0.20 0.93 -0.40 3.04 5.85 -0.89 -0.08 115.31 123.96 1loq h LEU 164 Ca -0.07 -0.20 -0.05 0.00 0.84 0.00 0.00 57.88 58.40 1loq h LEU 164 Cb 1.57 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 42.33 1loq h LEU 164 CO 0.16 0.92 0.07 -1.28 -0.34 0.00 0.00 178.44 177.97 1loq h SER 165 N 0.93 0.64 -0.78 1.25 0.87 -0.79 -0.64 113.55 115.03 1loq h SER 165 Ca 0.19 -0.26 -0.00 0.00 -1.23 0.00 0.00 61.79 60.49 1loq h SER 165 Cb 0.38 -0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 62.13 1loq h SER 165 CO 0.01 0.73 0.48 -0.09 -0.53 0.00 0.00 176.83 177.43 1loq h ARG 166 N 0.52 1.05 -0.47 2.24 9.65 -1.00 -0.18 114.38 126.19 1loq h ARG 166 Ca 0.12 -0.09 -0.02 0.00 -1.10 0.00 0.00 59.98 58.89 1loq h ARG 166 Cb 0.36 -0.22 -0.02 0.00 -1.39 0.00 0.00 29.97 28.70 1loq h ARG 166 CO 0.01 0.74 0.20 1.25 2.80 0.00 0.00 179.97 184.97 1loq h LEU 167 N 1.06 0.64 -1.15 3.80 5.85 -0.80 -2.07 115.31 122.64 1loq h LEU 167 Ca 0.28 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1loq h LEU 167 Cb -0.05 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.78 1loq h LEU 167 CO -0.05 0.62 0.43 -0.09 -0.34 0.00 0.00 178.44 179.01 1loq h ARG 168 N 0.62 1.02 -0.79 1.25 9.65 -0.66 -1.30 114.38 124.17 1loq h ARG 168 Ca 0.16 -0.10 -0.01 0.00 -1.10 0.00 0.00 59.98 58.93 1loq h ARG 168 Cb 0.17 -0.21 -0.04 0.00 -1.39 0.00 0.00 29.97 28.50 1loq h ARG 168 CO -0.02 0.73 0.44 1.49 2.80 0.00 0.00 179.97 185.41 1loq h GLU 169 N 1.03 1.09 -0.04 0.20 4.81 -0.41 -1.13 114.58 120.13 1loq h GLU 169 Ca 0.27 -0.12 -0.17 0.00 -0.13 0.00 0.00 59.36 59.21 1loq h GLU 169 Cb -0.02 -0.22 0.01 0.00 0.63 0.00 0.00 28.75 29.16 1loq h GLU 169 CO -0.05 0.79 -0.62 0.82 -0.73 0.00 0.00 179.01 179.22 1loq h ILE 170 N 1.10 1.38 0.00 2.32 2.04 -0.72 -3.33 117.51 120.31 1loq h ILE 170 Ca 0.28 -2.00 0.00 0.00 1.00 0.00 0.00 64.86 64.14 1loq h ILE 170 Cb 0.01 2.40 0.00 0.00 -0.74 0.00 0.00 36.82 38.49 1loq h ILE 170 CO -0.05 0.60 -0.22 0.16 0.00 0.00 0.00 178.15 178.64 1loq h ILE 171 N 0.06 0.00 0.00 -0.67 3.07 -1.18 -3.49 117.51 115.30 1loq h ILE 171 Ca -0.07 -0.51 0.00 0.00 1.55 0.00 0.00 64.86 65.83 1loq h ILE 171 Cb 1.30 1.37 0.00 0.00 -0.27 0.00 0.00 36.82 39.22 1loq h ILE 171 CO 0.13 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.84 1loq n GLY 172 N 1.31 -0.34 0.19 0.16 0.00 -0.44 -4.27 105.19 101.81 1loq n GLY 172 Ca 0.05 -1.71 0.07 0.00 0.00 0.00 0.00 46.02 44.42 1loq n GLY 172 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1loq h GLN 173 N 0.00 0.00 0.00 1.61 1.08 -1.94 -3.24 115.11 112.62 1loq h GLN 173 Ca 0.00 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 1loq h GLN 173 Cb 0.00 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1loq h GLN 173 CO 0.00 0.33 -0.13 -0.44 -0.95 0.00 0.00 178.83 177.64 1loq h ASP 174 N 0.00 0.00 -4.10 1.46 3.32 -1.97 -3.45 116.42 111.68 1loq h ASP 174 Ca -0.00 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.56 1loq h ASP 174 Cb 1.00 0.00 0.05 0.00 0.22 0.00 0.00 39.33 40.61 1loq h ASP 174 CO 0.04 0.11 0.40 -0.44 -1.72 0.00 0.00 179.24 177.63 1loq s SER 175 N -6.24 5.99 -0.17 6.45 0.01 -1.23 -5.02 113.70 113.50 1loq s SER 175 Ca 0.06 2.01 -0.15 0.00 1.31 0.00 0.00 55.95 59.19 1loq s SER 175 Cb 0.06 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.68 1loq s SER 175 CO 0.69 -1.03 0.33 0.12 0.41 0.00 0.00 173.24 173.76 1loq s PHE 176 N -1.97 3.44 -0.11 2.43 5.36 -0.12 -4.98 117.98 122.03 1loq s PHE 176 Ca 0.69 0.61 0.01 0.00 -0.96 0.00 0.00 56.93 57.28 1loq s PHE 176 Cb -0.19 -2.40 0.02 0.00 -0.34 0.00 0.00 43.02 40.11 1loq s PHE 176 CO 0.25 0.17 -0.11 -1.17 -1.46 0.00 0.00 175.22 172.90 1loq s LEU 177 N 0.69 1.47 0.18 6.12 2.96 -1.26 -0.30 118.68 128.54 1loq s LEU 177 Ca 0.18 -0.36 0.09 0.00 -0.22 0.00 0.00 54.13 53.81 1loq s LEU 177 Cb -0.14 -0.96 -0.04 0.00 0.50 0.00 0.00 46.19 45.56 1loq s LEU 177 CO 0.05 -0.05 -0.09 0.27 -1.32 0.00 0.00 176.35 175.21 1loq s ILE 178 N 1.33 3.25 -0.07 6.68 -4.36 -0.18 -0.12 121.20 127.73 1loq s ILE 178 Ca -0.01 -1.61 -0.03 0.00 -0.26 0.00 0.00 60.65 58.74 1loq s ILE 178 Cb -0.14 -2.61 0.04 0.00 1.25 0.00 0.00 42.46 41.01 1loq s ILE 178 CO -0.05 -0.10 0.10 -0.55 0.24 0.00 0.00 174.94 174.58 1loq s SER 179 N -2.80 1.19 0.42 4.36 0.15 -0.56 -2.22 113.70 114.25 1loq s SER 179 Ca 0.25 0.05 0.03 0.00 0.70 0.00 0.00 55.95 56.98 1loq s SER 179 Cb -0.09 -0.03 0.00 0.00 -1.71 0.00 0.00 66.02 64.20 1loq s SER 179 CO 0.15 -0.26 0.61 -2.16 1.20 0.00 0.00 173.24 172.78 1loq s PRO 180 N 2.20 3.00 0.00 5.44 0.04 -1.24 -0.94 135.00 143.51 1loq s PRO 180 Ca 0.04 -0.74 0.00 0.00 0.04 0.00 0.00 61.00 60.34 1loq s PRO 180 Cb -0.13 -2.65 0.00 0.00 0.04 0.00 0.00 34.50 31.76 1loq s PRO 180 CO -0.05 -0.21 0.00 0.41 0.04 0.00 0.00 177.00 177.19 1loq n GLY 181 N -1.95 1.07 3.71 0.56 0.00 -1.26 -1.22 105.19 106.10 1loq n GLY 181 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1loq n GLY 181 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1loq s VAL 182 N -2.00 4.93 0.00 1.61 1.01 -1.26 -0.52 120.40 124.18 1loq s VAL 182 Ca 0.00 1.84 0.00 0.00 0.00 0.00 0.00 61.98 63.82 1loq s VAL 182 Cb 0.00 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 32.16 1loq s VAL 182 CO 0.00 0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.90 1loq n GLY 183 N 2.97 1.35 0.30 4.51 0.00 -0.30 -4.51 105.19 109.52 1loq n GLY 183 Ca 0.03 -0.54 0.07 0.00 0.00 0.00 0.00 46.02 45.58 1loq n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1loq h ALA 184 N 0.00 1.25 -0.00 4.61 0.00 -1.89 0.41 119.26 123.64 1loq h ALA 184 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1loq h ALA 184 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1loq h ALA 184 CO 0.00 -0.09 -0.03 1.04 0.00 0.00 0.00 179.25 180.17 1loq n GLN 185 N -4.87 0.69 0.00 0.00 6.02 -1.25 -4.90 117.38 113.06 1loq n GLN 185 Ca 0.16 -0.09 0.00 0.00 -0.01 0.00 0.00 57.00 57.06 1loq n GLN 185 Cb 0.42 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.18 1loq n GLN 185 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1loq n GLY 186 N 1.20 1.06 3.77 1.08 0.00 0.14 -4.93 105.19 107.51 1loq n GLY 186 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 1loq n GLY 186 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1loq s GLY 187 N -2.11 2.68 -0.18 -0.02 0.00 0.32 -4.73 107.32 103.27 1loq s GLY 187 Ca 0.00 0.88 -0.09 0.00 0.00 0.00 0.00 44.72 45.51 1loq s GLY 187 CO 0.00 1.26 0.11 -0.35 0.00 0.00 0.00 173.10 174.12 1loq s ASP 188 N -1.66 6.04 0.10 1.64 2.15 -1.26 -1.15 116.67 122.53 1loq s ASP 188 Ca 0.72 0.21 -0.29 0.00 0.43 0.00 0.00 52.55 53.62 1loq s ASP 188 Cb -0.26 -2.04 -0.11 0.00 -0.30 0.00 0.00 42.92 40.22 1loq s ASP 188 CO 0.29 0.21 1.63 -0.65 -0.17 0.00 0.00 175.17 176.48 1loq h PRO 189 N 6.45 -0.57 -0.31 4.34 0.11 -1.95 -1.53 132.00 138.55 1loq h PRO 189 Ca -0.42 0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1loq h PRO 189 Cb 1.16 0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 1loq h PRO 189 CO 0.72 -0.38 0.19 0.78 -0.21 0.00 0.00 178.00 179.10 1loq h GLY 190 N -0.59 0.44 1.03 -0.55 0.00 -1.92 -1.10 103.07 100.37 1loq h GLY 190 Ca 0.00 -0.17 -0.04 0.00 0.00 0.00 0.00 47.33 47.12 1loq h GLY 190 CO -0.11 0.17 0.29 0.83 0.00 0.00 0.00 176.54 177.72 1loq h GLU 191 N 0.40 1.08 -0.76 4.80 4.39 -1.96 -2.67 114.58 119.85 1loq h GLU 191 Ca 0.11 -0.19 -0.05 0.00 0.34 0.00 0.00 59.36 59.57 1loq h GLU 191 Cb -0.02 -0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 28.42 1loq h GLU 191 CO -0.02 0.88 0.28 1.15 -1.16 0.00 0.00 179.01 180.14 1loq h THR 192 N 1.03 1.26 0.00 1.13 2.02 -0.98 -2.33 112.91 115.04 1loq h THR 192 Ca 0.24 -0.84 0.00 0.00 0.77 0.00 0.00 66.41 66.58 1loq h THR 192 Cb 0.20 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 66.98 1loq h THR 192 CO -0.02 0.34 0.00 0.18 0.37 0.00 0.00 175.52 176.39 1loq n LEU 193 N -4.27 0.00 0.18 2.58 4.77 -0.44 -0.90 117.00 118.91 1loq n LEU 193 Ca 0.07 0.14 0.03 0.00 -0.03 0.00 0.00 56.01 56.22 1loq n LEU 193 Cb 0.20 -0.14 0.32 0.00 -2.33 0.00 0.00 43.42 41.47 1loq n LEU 193 CO 0.41 -0.05 0.65 0.03 -1.33 0.00 0.00 177.39 177.10 1loq h ARG 194 N 0.00 0.00 0.00 3.23 3.08 -1.18 -3.38 114.38 116.13 1loq h ARG 194 Ca 0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 1loq h ARG 194 Cb 0.09 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 1loq h ARG 194 CO 0.00 0.43 -1.22 1.19 -1.07 0.00 0.00 179.97 179.30 1loq n PHE 195 N -3.75 0.00 -3.17 3.04 3.01 -0.76 -5.05 117.46 110.78 1loq n PHE 195 Ca -0.01 0.00 -0.28 0.00 1.01 0.00 0.00 57.45 58.17 1loq n PHE 195 Cb 0.50 -0.15 -0.03 0.00 -0.01 0.00 0.00 39.48 39.79 1loq n PHE 195 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1loq s ALA 196 N -2.08 3.55 0.10 4.37 0.00 -0.08 -4.91 121.76 122.70 1loq s ALA 196 Ca -0.04 -0.50 0.05 0.00 0.00 0.00 0.00 51.96 51.47 1loq s ALA 196 Cb 0.01 -2.40 -0.23 0.00 0.00 0.00 0.00 23.12 20.50 1loq s ALA 196 CO 0.10 0.11 1.20 -0.44 0.00 0.00 0.00 175.76 176.73 1loq h ASP 197 N 1.38 0.09 -5.02 0.00 3.32 -0.84 -3.40 116.42 111.94 1loq h ASP 197 Ca -0.48 -0.10 -0.11 0.00 0.02 0.00 0.00 57.03 56.36 1loq h ASP 197 Cb 1.19 -0.03 -0.19 0.00 0.22 0.00 0.00 39.33 40.53 1loq h ASP 197 CO 0.65 1.08 -0.30 0.00 -1.72 0.00 0.00 179.24 178.95 1loq s ALA 198 N -2.69 -0.66 0.03 3.45 0.00 -1.12 -4.75 121.76 116.01 1loq s ALA 198 Ca -0.01 0.10 0.03 0.00 0.00 0.00 0.00 51.96 52.08 1loq s ALA 198 Cb 0.09 0.19 -0.04 0.00 0.00 0.00 0.00 23.12 23.37 1loq s ALA 198 CO 0.83 -0.32 -0.03 0.96 0.00 0.00 0.00 175.76 177.20 1loq s ILE 199 N -1.93 3.92 -0.18 0.00 -4.36 -0.12 -1.49 121.20 117.04 1loq s ILE 199 Ca -0.09 -0.77 -0.07 0.00 -0.26 0.00 0.00 60.65 59.45 1loq s ILE 199 Cb -0.03 -2.77 -0.04 0.00 1.25 0.00 0.00 42.46 40.87 1loq s ILE 199 CO 0.00 0.31 0.06 -0.63 0.24 0.00 0.00 174.94 174.93 1loq s ILE 200 N -1.11 4.78 -0.06 8.37 1.01 -0.12 -0.90 121.20 133.17 1loq s ILE 200 Ca 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.82 1loq s ILE 200 Cb -0.11 -3.15 0.02 0.00 0.01 0.00 0.00 42.46 39.23 1loq s ILE 200 CO 0.11 0.47 -0.04 -0.69 0.00 0.00 0.00 174.94 174.78 1loq s VAL 201 N 0.33 0.62 0.00 2.92 1.01 -0.14 -3.98 120.40 121.15 1loq s VAL 201 Ca 0.03 -0.12 0.00 0.00 0.00 0.00 0.00 61.98 61.89 1loq s VAL 201 Cb -0.12 -0.67 0.00 0.00 0.00 0.00 0.00 36.38 35.59 1loq s VAL 201 CO 0.00 0.27 0.00 0.61 0.00 0.00 0.00 175.10 175.98 1loq n GLY 202 N 4.42 0.30 0.35 4.51 0.00 -1.26 -0.78 105.19 112.73 1loq n GLY 202 Ca -0.18 0.00 0.16 0.00 0.00 0.00 0.00 46.02 45.99 1loq n GLY 202 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1loq h ARG 203 N 0.00 0.64 -0.23 1.61 3.08 -1.92 0.03 114.38 117.58 1loq h ARG 203 Ca 0.00 -0.04 0.07 0.00 0.07 0.00 0.00 59.98 60.08 1loq h ARG 203 Cb 0.00 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.90 1loq h ARG 203 CO 0.00 0.42 0.21 0.77 -1.07 0.00 0.00 179.97 180.30 1loq h SER 204 N 0.66 0.00 0.00 7.04 0.02 -1.91 -1.13 113.55 118.23 1loq h SER 204 Ca 0.61 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 61.28 1loq h SER 204 Cb 1.09 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.59 1loq h SER 204 CO -0.43 0.00 -1.88 -0.38 -1.14 0.00 0.00 176.83 173.00 1loq n ILE 205 N -4.10 1.52 0.50 3.27 5.41 -0.18 -4.30 119.36 121.49 1loq n ILE 205 Ca 0.03 -0.17 0.12 0.00 1.00 0.00 0.00 62.75 63.73 1loq n ILE 205 Cb 0.35 -2.07 0.46 0.00 -0.71 0.00 0.00 39.64 37.67 1loq n ILE 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1loq n TYR 206 N -4.35 0.84 0.98 1.39 0.18 -0.19 -2.15 117.16 113.86 1loq n TYR 206 Ca -0.38 0.29 0.11 0.00 1.88 0.00 0.00 57.90 59.80 1loq n TYR 206 Cb 0.73 -0.97 0.04 0.00 -0.38 0.00 0.00 39.34 38.76 1loq n TYR 206 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 1loq n LEU 207 N -2.23 2.46 -4.77 -3.48 4.77 -0.44 -5.00 117.00 108.32 1loq n LEU 207 Ca 0.04 -0.87 -0.34 0.00 -0.03 0.00 0.00 56.01 54.81 1loq n LEU 207 Cb 0.31 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.43 1loq n LEU 207 CO 0.24 0.43 0.76 0.00 -1.33 0.00 0.00 177.39 177.49 1loq s ALA 208 N -2.22 2.56 0.37 -1.18 0.00 -0.92 -4.92 121.76 115.45 1loq s ALA 208 Ca 0.23 0.67 0.07 0.00 0.00 0.00 0.00 51.96 52.92 1loq s ALA 208 Cb 0.19 -3.34 0.71 0.00 0.00 0.00 0.00 23.12 20.68 1loq s ALA 208 CO 0.44 -1.07 1.92 -0.44 0.00 0.00 0.00 175.76 176.61 1loq h ASP 209 N 0.52 0.39 -3.14 0.00 3.45 -1.94 -3.33 116.42 112.37 1loq h ASP 209 Ca -0.48 -0.06 -0.60 0.00 0.43 0.00 0.00 57.03 56.31 1loq h ASP 209 Cb 1.25 -0.10 -0.40 0.00 -0.56 0.00 0.00 39.33 39.53 1loq h ASP 209 CO 0.55 0.46 -0.78 0.21 -1.57 0.00 0.00 179.24 178.11 1loq s ASN 210 N -6.79 3.34 0.26 6.45 3.84 -1.26 -5.01 114.94 115.77 1loq s ASN 210 Ca -0.07 -2.56 -0.02 0.00 0.21 0.00 0.00 52.86 50.42 1loq s ASN 210 Cb 0.16 -0.82 0.52 0.00 -0.55 0.00 0.00 41.25 40.55 1loq s ASN 210 CO 0.75 -0.27 1.74 -0.65 -2.79 0.00 0.00 177.10 175.88 1loq h PRO 211 N 6.71 0.50 -0.73 0.43 0.11 -1.73 0.19 132.00 137.47 1loq h PRO 211 Ca 0.03 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.10 1loq h PRO 211 Cb 0.93 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.90 1loq h PRO 211 CO 0.42 0.33 0.39 0.00 -0.21 0.00 0.00 178.00 178.93 1loq h ALA 212 N 1.57 0.94 -0.52 -0.75 0.00 -1.89 0.41 119.26 119.01 1loq h ALA 212 Ca 0.45 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 55.13 1loq h ALA 212 Cb 0.68 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1loq h ALA 212 CO -0.40 0.46 -0.12 0.00 0.00 0.00 0.00 179.25 179.20 1loq h ALA 213 N 1.20 0.81 -0.45 0.00 0.00 -1.66 -0.36 119.26 118.80 1loq h ALA 213 Ca 0.26 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1loq h ALA 213 Cb 0.05 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1loq h ALA 213 CO -0.04 0.66 0.16 0.00 0.00 0.00 0.00 179.25 180.04 1loq h ALA 214 N 0.98 0.58 -0.46 0.00 0.00 -0.55 0.41 119.26 120.23 1loq h ALA 214 Ca 0.14 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1loq h ALA 214 Cb 0.67 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1loq h ALA 214 CO 0.05 0.21 0.16 0.00 0.00 0.00 0.00 179.25 179.67 1loq h ALA 215 N 1.01 0.60 -0.77 0.00 0.00 -0.70 -1.44 119.26 117.95 1loq h ALA 215 Ca 0.15 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1loq h ALA 215 Cb 0.22 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 1loq h ALA 215 CO -0.01 0.23 0.50 0.00 0.00 0.00 0.00 179.25 179.97 1loq h ALA 216 N 1.01 0.98 -0.74 0.00 0.00 -0.88 -1.74 119.26 117.89 1loq h ALA 216 Ca 0.15 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1loq h ALA 216 Cb 0.24 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1loq h ALA 216 CO -0.01 0.42 0.41 0.78 0.00 0.00 0.00 179.25 180.85 1loq h GLY 217 N 1.05 1.11 0.95 0.00 0.00 -0.59 0.31 103.07 105.91 1loq h GLY 217 Ca 0.28 -0.50 -0.03 0.00 0.00 0.00 0.00 47.33 47.08 1loq h GLY 217 CO -0.06 0.48 0.15 -2.22 0.00 0.00 0.00 176.54 174.89 1loq h ILE 218 N 1.03 1.22 -0.69 2.60 2.04 -0.79 -1.39 117.51 121.53 1loq h ILE 218 Ca 0.26 -0.71 -0.07 0.00 1.00 0.00 0.00 64.86 65.35 1loq h ILE 218 Cb 0.03 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 1loq h ILE 218 CO -0.04 0.26 0.17 0.40 0.00 0.00 0.00 178.15 178.94 1loq h ILE 219 N 0.59 1.26 0.00 -0.67 2.04 -1.09 -2.49 117.51 117.14 1loq h ILE 219 Ca 0.15 -0.96 -0.04 0.00 1.00 0.00 0.00 64.86 65.01 1loq h ILE 219 Cb 0.25 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1loq h ILE 219 CO -0.01 0.37 -0.17 -0.08 0.00 0.00 0.00 178.15 178.26 1loq h GLU 220 N 1.04 0.00 0.00 2.37 4.57 -0.67 -2.48 114.58 119.40 1loq h GLU 220 Ca 0.22 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.40 1loq h GLU 220 Cb 0.37 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.96 1loq h GLU 220 CO 0.00 0.17 0.00 -1.13 -1.18 0.00 0.00 179.01 176.88 1loq n SER 221 N -4.21 0.56 0.00 1.04 3.41 -0.55 -5.09 113.62 108.79 1loq n SER 221 Ca -0.02 0.58 0.14 0.00 -0.26 0.00 0.00 58.87 59.31 1loq n SER 221 Cb 0.24 -0.72 0.85 0.00 -0.26 0.00 0.00 64.21 64.32 1loq n SER 221 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50