#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g1s h VAL 6 N 0.00 0.61 -0.08 1.55 2.07 -1.99 -3.28 116.25 115.13 3g1s h VAL 6 Ca 0.00 -1.90 0.00 0.00 0.82 0.00 0.00 66.70 65.62 3g1s h VAL 6 Cb 0.00 2.25 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 3g1s h VAL 6 CO 0.00 0.35 0.00 -0.90 0.02 0.00 0.00 177.57 177.04 3g1s n ASP 7 N -3.13 1.00 -4.56 0.57 5.75 -1.26 -4.84 116.55 110.08 3g1s n ASP 7 Ca 0.01 -1.53 -0.28 0.00 -0.01 0.00 0.00 54.79 52.98 3g1s n ASP 7 Cb 0.70 -0.05 -0.10 0.00 -1.03 0.00 0.00 41.12 40.64 3g1s n ASP 7 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 3g1s s VAL 8 N -1.90 3.17 0.62 2.12 -7.23 -1.24 -5.10 120.40 110.84 3g1s s VAL 8 Ca 0.33 -1.53 -0.19 0.00 -1.81 0.00 0.00 61.98 58.79 3g1s s VAL 8 Cb 0.17 -2.53 -0.02 0.00 0.56 0.00 0.00 36.38 34.56 3g1s s VAL 8 CO 0.27 -0.01 1.29 0.00 -0.31 0.00 0.00 175.10 176.33 3g1s s MET 9 N -2.54 2.72 -0.25 4.82 0.23 -1.26 -4.89 119.30 118.13 3g1s s MET 9 Ca 0.23 2.05 -0.07 0.00 -1.03 0.00 0.00 55.69 56.87 3g1s s MET 9 Cb -0.10 -1.92 -0.02 0.00 -1.53 0.00 0.00 34.83 31.26 3g1s s MET 9 CO 0.14 -1.46 0.06 0.34 -2.03 0.00 0.00 175.02 172.06 3g1s s ASP 10 N -1.36 5.02 -0.34 -1.18 3.68 -1.26 -5.04 116.67 116.19 3g1s s ASP 10 Ca 0.80 -0.30 -0.12 0.00 2.13 0.00 0.00 52.55 55.06 3g1s s ASP 10 Cb -0.37 -1.89 -0.02 0.00 -1.45 0.00 0.00 42.92 39.19 3g1s s ASP 10 CO 0.40 -0.05 0.23 -0.69 0.13 0.00 0.00 175.17 175.18 3g1s s VAL 11 N 1.58 5.16 0.17 1.11 1.01 -1.26 -5.02 120.40 123.15 3g1s s VAL 11 Ca 0.06 -0.26 -0.34 0.00 0.00 0.00 0.00 61.98 61.44 3g1s s VAL 11 Cb -0.15 -3.65 -0.14 0.00 0.00 0.00 0.00 36.38 32.44 3g1s s VAL 11 CO 0.03 0.00 1.49 0.80 0.00 0.00 0.00 175.10 177.42 3g1s n MET 12 N 5.08 1.95 -1.10 2.72 1.56 -1.26 -0.90 117.12 125.17 3g1s n MET 12 Ca -0.13 0.70 -0.04 0.00 -0.27 0.00 0.00 57.70 57.96 3g1s n MET 12 Cb 0.50 -2.42 -0.02 0.00 2.15 0.00 0.00 33.22 33.43 3g1s n MET 12 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 3g1s n ASN 13 N 2.96 -5.81 -2.40 6.12 3.02 -1.26 -2.69 115.26 115.20 3g1s n ASN 13 Ca 0.16 0.09 -0.14 0.00 -0.03 0.00 0.00 54.58 54.66 3g1s n ASN 13 Cb 0.28 -3.70 -0.01 0.00 -0.61 0.00 0.00 39.78 35.74 3g1s n ASN 13 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3g1s n ARG 14 N 0.36 -2.08 -4.10 3.52 1.74 -0.08 -4.94 116.66 111.07 3g1s n ARG 14 Ca -0.04 0.69 -0.29 0.00 -0.77 0.00 0.00 57.85 57.45 3g1s n ARG 14 Cb 0.53 -5.30 -0.17 0.00 -1.02 0.00 0.00 32.46 26.50 3g1s n ARG 14 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3g1s s LEU 15 N -5.66 1.55 -0.18 0.55 2.96 -1.09 -1.48 118.68 115.33 3g1s s LEU 15 Ca 0.00 -0.42 -0.04 0.00 -0.22 0.00 0.00 54.13 53.46 3g1s s LEU 15 Cb 0.00 -1.05 -0.02 0.00 0.50 0.00 0.00 46.19 45.61 3g1s s LEU 15 CO 0.00 -0.05 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.31 3g1s s ILE 16 N 1.41 3.80 -0.15 6.68 1.01 0.39 -4.61 121.20 129.73 3g1s s ILE 16 Ca 0.02 -0.38 -0.25 0.00 0.00 0.00 0.00 60.65 60.04 3g1s s ILE 16 Cb -0.13 -2.69 -0.02 0.00 0.01 0.00 0.00 42.46 39.63 3g1s s ILE 16 CO -0.08 0.46 0.81 -0.22 0.00 0.00 0.00 174.94 175.92 3g1s s LEU 17 N 0.70 4.20 -0.68 2.97 2.96 -0.94 -0.84 118.68 127.05 3g1s s LEU 17 Ca -0.02 1.18 -0.19 0.00 -0.22 0.00 0.00 54.13 54.88 3g1s s LEU 17 Cb -0.14 -3.22 0.11 0.00 0.50 0.00 0.00 46.19 43.44 3g1s s LEU 17 CO 0.02 -0.35 0.83 0.00 -1.32 0.00 0.00 176.35 175.53 3g1s s ALA 18 N 1.93 3.40 -1.05 5.97 0.00 0.10 -0.38 121.76 131.73 3g1s s ALA 18 Ca 0.38 -2.32 -0.19 0.00 0.00 0.00 0.00 51.96 49.83 3g1s s ALA 18 Cb -0.17 -3.68 0.10 0.00 0.00 0.00 0.00 23.12 19.37 3g1s s ALA 18 CO 0.14 -2.54 1.36 1.41 0.00 0.00 0.00 175.76 176.12 3g1s s MET 19 N 2.78 3.72 0.00 0.00 1.75 -0.50 -4.42 119.30 122.63 3g1s s MET 19 Ca 0.18 -1.71 0.27 0.00 -1.25 0.00 0.00 55.69 53.18 3g1s s MET 19 Cb -0.18 -5.16 0.93 0.00 2.84 0.00 0.00 34.83 33.25 3g1s s MET 19 CO 0.03 -1.98 1.67 -0.25 -0.65 0.00 0.00 175.02 173.85 3g1s n ASP 20 N 7.40 1.06 -4.76 1.11 8.00 -1.26 -4.50 116.55 123.60 3g1s n ASP 20 Ca 0.32 -1.02 -0.41 0.00 0.71 0.00 0.00 54.79 54.39 3g1s n ASP 20 Cb 0.48 0.06 -0.02 0.00 -0.02 0.00 0.00 41.12 41.63 3g1s n ASP 20 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3g1s s LEU 21 N -2.35 4.38 0.02 0.64 1.43 -1.26 -4.72 118.68 116.83 3g1s s LEU 21 Ca 0.29 2.79 0.25 0.00 -1.03 0.00 0.00 54.13 56.43 3g1s s LEU 21 Cb 0.20 -3.64 0.50 0.00 0.03 0.00 0.00 46.19 43.28 3g1s s LEU 21 CO 0.46 -0.71 1.41 0.23 0.23 0.00 0.00 176.35 177.97 3g1s n MET 22 N 1.39 0.05 -3.47 1.70 2.81 -1.26 -4.43 117.12 113.91 3g1s n MET 22 Ca 0.03 0.01 -0.37 0.00 -1.81 0.00 0.00 57.70 55.56 3g1s n MET 22 Cb 0.40 -1.53 -0.08 0.00 -0.71 0.00 0.00 33.22 31.30 3g1s n MET 22 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 3g1s s ASN 23 N -3.21 6.37 0.15 7.83 2.47 -1.26 -4.65 114.94 122.64 3g1s s ASN 23 Ca 0.10 0.43 -0.17 0.00 0.42 0.00 0.00 52.86 53.64 3g1s s ASN 23 Cb 0.17 -2.20 0.05 0.00 -1.45 0.00 0.00 41.25 37.83 3g1s s ASN 23 CO 0.70 -0.01 1.70 -0.09 -3.72 0.00 0.00 177.10 175.68 3g1s h ARG 24 N 7.26 0.08 -0.10 0.43 2.43 -1.93 0.12 114.38 122.66 3g1s h ARG 24 Ca -0.37 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 58.82 3g1s h ARG 24 Cb 1.16 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.66 3g1s h ARG 24 CO 0.71 0.05 -0.09 -0.44 -1.51 0.00 0.00 179.97 178.70 3g1s h ASP 25 N 0.08 -0.28 -0.40 -3.80 3.45 -1.99 -0.73 116.42 112.75 3g1s h ASP 25 Ca 0.16 0.06 -0.05 0.00 0.43 0.00 0.00 57.03 57.63 3g1s h ASP 25 Cb 0.22 0.14 -0.02 0.00 -0.56 0.00 0.00 39.33 39.11 3g1s h ASP 25 CO -0.27 -0.12 0.07 0.44 -1.57 0.00 0.00 179.24 177.79 3g1s h ASP 26 N -0.11 0.64 -0.36 6.45 3.32 -1.91 0.50 116.42 124.95 3g1s h ASP 26 Ca 0.07 -0.25 0.02 0.00 0.02 0.00 0.00 57.03 56.88 3g1s h ASP 26 Cb 0.21 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 3g1s h ASP 26 CO -0.16 0.73 0.21 0.00 -1.72 0.00 0.00 179.24 178.29 3g1s h ALA 27 N 0.93 0.45 -0.40 3.45 0.00 -0.59 0.13 119.26 123.23 3g1s h ALA 27 Ca 0.12 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.88 3g1s h ALA 27 Cb 0.36 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3g1s h ALA 27 CO 0.01 -0.14 -0.33 -0.07 0.00 0.00 0.00 179.25 178.71 3g1s h LEU 28 N 0.42 0.97 0.33 0.00 3.38 -1.07 -1.62 115.31 117.72 3g1s h LEU 28 Ca 0.14 -0.41 -0.02 0.00 0.09 0.00 0.00 57.88 57.68 3g1s h LEU 28 Cb 0.01 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.50 3g1s h LEU 28 CO -0.07 1.20 -0.16 -0.09 0.09 0.00 0.00 178.44 179.41 3g1s h ARG 29 N 0.77 -0.43 -0.86 1.13 2.43 -0.49 -0.44 114.38 116.50 3g1s h ARG 29 Ca 0.08 0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.25 3g1s h ARG 29 Cb 0.91 0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 30.52 3g1s h ARG 29 CO 0.08 -0.17 0.42 0.28 -1.51 0.00 0.00 179.97 179.08 3g1s h VAL 30 N -0.64 1.26 -0.79 0.20 2.07 -0.80 -1.65 116.25 115.90 3g1s h VAL 30 Ca -0.05 -0.71 -0.04 0.00 0.82 0.00 0.00 66.70 66.72 3g1s h VAL 30 Cb 0.46 0.15 -0.04 0.00 -1.52 0.00 0.00 31.29 30.34 3g1s h VAL 30 CO 0.07 0.31 0.34 0.74 0.02 0.00 0.00 177.57 179.05 3g1s h THR 31 N 1.21 1.26 -0.70 2.57 2.02 -1.24 -2.25 112.91 115.78 3g1s h THR 31 Ca 0.30 -0.77 -0.01 0.00 0.77 0.00 0.00 66.41 66.69 3g1s h THR 31 Cb 0.10 0.30 -0.03 0.00 -1.74 0.00 0.00 68.15 66.78 3g1s h THR 31 CO -0.04 0.32 0.39 1.23 0.37 0.00 0.00 175.52 177.79 3g1s h GLY 32 N 1.13 1.03 2.00 2.16 0.00 -0.41 -0.19 103.07 108.79 3g1s h GLY 32 Ca 0.27 -0.44 -0.03 0.00 0.00 0.00 0.00 47.33 47.12 3g1s h GLY 32 CO -0.03 0.43 -0.16 0.83 0.00 0.00 0.00 176.54 177.61 3g1s h GLU 33 N 0.97 0.00 -0.26 4.80 5.08 -0.71 -2.90 114.58 121.55 3g1s h GLU 33 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 3g1s h GLU 33 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 3g1s h GLU 33 CO -0.04 0.16 0.00 1.33 -1.00 0.00 0.00 179.01 179.46 3g1s n VAL 34 N -4.10 1.17 0.16 3.13 0.24 -0.85 -4.53 118.33 113.54 3g1s n VAL 34 Ca -0.02 -1.13 0.19 0.00 -2.04 0.00 0.00 64.34 61.33 3g1s n VAL 34 Cb 0.24 0.40 0.78 0.00 -1.47 0.00 0.00 33.84 33.79 3g1s n VAL 34 CO 0.00 0.00 0.00 0.08 -2.14 0.00 0.00 176.83 174.77 3g1s h ARG 35 N 1.57 0.00 0.00 7.34 0.11 -0.84 -1.13 114.38 121.43 3g1s h ARG 35 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3g1s h ARG 35 Cb 0.77 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.85 3g1s h ARG 35 CO 0.02 0.00 0.00 1.05 0.10 0.00 0.00 179.97 181.14 3g1s h GLU 36 N 0.00 0.00 -0.02 0.08 4.11 -1.84 -3.26 114.58 113.65 3g1s h GLU 36 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.57 3g1s h GLU 36 Cb 0.84 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.09 3g1s h GLU 36 CO -0.00 0.00 -0.34 0.66 0.07 0.00 0.00 179.01 179.40 3g1s n TYR 37 N -2.34 0.00 -3.75 2.06 4.02 -0.43 -5.00 117.16 111.72 3g1s n TYR 37 Ca 0.04 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.82 3g1s n TYR 37 Cb 0.38 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.63 3g1s n TYR 37 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 3g1s s ILE 38 N -2.29 0.09 0.00 -0.72 1.01 -1.23 -4.70 121.20 113.36 3g1s s ILE 38 Ca 0.20 -0.71 0.00 0.00 0.00 0.00 0.00 60.65 60.14 3g1s s ILE 38 Cb 0.18 -1.01 0.00 0.00 0.01 0.00 0.00 42.46 41.64 3g1s s ILE 38 CO 0.48 -0.39 0.57 -0.90 0.00 0.00 0.00 174.94 174.70 3g1s n ASP 39 N 0.42 0.81 -3.83 3.58 5.75 -1.26 -4.85 116.55 117.16 3g1s n ASP 39 Ca -0.18 -1.32 -0.21 0.00 -0.01 0.00 0.00 54.79 53.07 3g1s n ASP 39 Cb 0.60 0.00 -0.17 0.00 -1.03 0.00 0.00 41.12 40.52 3g1s n ASP 39 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3g1s s THR 40 N -0.32 0.46 -0.04 2.12 2.01 -1.26 -0.03 115.64 118.58 3g1s s THR 40 Ca 0.00 -0.01 0.04 0.00 0.31 0.00 0.00 61.69 62.04 3g1s s THR 40 Cb 0.00 -0.55 -0.00 0.00 0.01 0.00 0.00 72.50 71.96 3g1s s THR 40 CO 0.00 0.24 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.32 3g1s s VAL 41 N 1.43 1.37 -0.23 3.82 1.01 -0.03 -2.21 120.40 125.56 3g1s s VAL 41 Ca -0.03 -0.68 -0.09 0.00 0.00 0.00 0.00 61.98 61.17 3g1s s VAL 41 Cb -0.13 -1.17 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 3g1s s VAL 41 CO -0.03 0.40 0.12 -0.75 0.00 0.00 0.00 175.10 174.84 3g1s s LYS 42 N 0.04 3.98 -0.06 2.72 2.20 0.49 -1.06 119.74 128.04 3g1s s LYS 42 Ca -0.03 -0.32 0.05 0.00 -0.36 0.00 0.00 55.97 55.31 3g1s s LYS 42 Cb -0.11 -3.43 -0.02 0.00 -1.51 0.00 0.00 37.83 32.76 3g1s s LYS 42 CO 0.02 0.06 -0.22 0.42 -0.36 0.00 0.00 175.35 175.27 3g1s s ILE 43 N 1.01 2.35 0.18 5.43 -1.09 -0.21 -1.41 121.20 127.45 3g1s s ILE 43 Ca 0.06 -0.97 0.00 0.00 -2.23 0.00 0.00 60.65 57.52 3g1s s ILE 43 Cb -0.14 -1.87 0.00 0.00 -1.58 0.00 0.00 42.46 38.87 3g1s s ILE 43 CO 0.04 0.57 0.02 0.61 -1.23 0.00 0.00 174.94 174.95 3g1s n GLY 44 N 2.78 3.80 0.32 6.18 0.00 -1.26 -0.28 105.19 116.72 3g1s n GLY 44 Ca -0.17 -2.26 0.02 0.00 0.00 0.00 0.00 46.02 43.61 3g1s n GLY 44 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3g1s h TYR 45 N 0.99 0.70 -0.41 1.61 0.99 -1.93 -2.68 116.97 116.24 3g1s h TYR 45 Ca -0.14 0.00 0.09 0.00 2.00 0.00 0.00 58.73 60.68 3g1s h TYR 45 Cb 0.44 -0.23 -0.08 0.00 1.00 0.00 0.00 36.73 37.86 3g1s h TYR 45 CO 0.00 0.48 -0.15 -1.35 -0.00 0.00 0.00 178.16 177.13 3g1s h PRO 46 N 0.74 -0.06 -0.07 4.88 0.11 -1.96 0.26 132.00 135.90 3g1s h PRO 46 Ca 0.19 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.24 3g1s h PRO 46 Cb -0.01 0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3g1s h PRO 46 CO -0.04 -0.04 -0.23 1.25 -0.21 0.00 0.00 178.00 178.73 3g1s h LEU 47 N -0.07 0.32 -0.86 2.35 5.85 -1.75 -2.86 115.31 118.29 3g1s h LEU 47 Ca 0.20 -0.62 -0.05 0.00 0.84 0.00 0.00 57.88 58.24 3g1s h LEU 47 Cb 0.37 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 3g1s h LEU 47 CO -0.46 0.89 0.21 0.58 -0.34 0.00 0.00 178.44 179.32 3g1s h VAL 48 N -0.23 1.25 -0.02 1.05 2.07 -1.26 -0.17 116.25 118.95 3g1s h VAL 48 Ca -0.01 -0.87 -0.15 0.00 0.82 0.00 0.00 66.70 66.49 3g1s h VAL 48 Cb 0.86 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 3g1s h VAL 48 CO 0.05 0.34 -0.67 -0.07 0.02 0.00 0.00 177.57 177.24 3g1s h LEU 49 N 1.02 0.09 0.08 2.57 3.38 -0.59 0.32 115.31 122.19 3g1s h LEU 49 Ca 0.22 -0.06 -0.26 0.00 0.09 0.00 0.00 57.88 57.88 3g1s h LEU 49 Cb 0.29 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3g1s h LEU 49 CO -0.01 0.73 -1.20 0.28 0.09 0.00 0.00 178.44 178.34 3g1s h SER 50 N 0.05 0.28 0.00 -0.43 0.02 -1.26 -3.38 113.55 108.82 3g1s h SER 50 Ca -0.01 -0.31 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 3g1s h SER 50 Cb 1.18 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.63 3g1s h SER 50 CO 0.09 1.24 -0.32 -0.62 -1.14 0.00 0.00 176.83 176.08 3g1s n GLU 51 N -3.46 4.92 0.00 3.45 -0.58 -0.09 -5.04 120.64 119.84 3g1s n GLU 51 Ca -0.06 -0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.67 3g1s n GLU 51 Cb 1.00 -0.76 0.00 0.00 -0.57 0.00 0.00 31.44 31.11 3g1s n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3g1s n GLY 52 N 1.22 2.21 0.30 0.62 0.00 0.11 -4.72 105.19 104.92 3g1s n GLY 52 Ca 0.01 -1.74 0.20 0.00 0.00 0.00 0.00 46.02 44.48 3g1s n GLY 52 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3g1s h MET 53 N 0.00 0.00 0.00 1.61 2.86 -1.93 -2.39 114.93 115.08 3g1s h MET 53 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3g1s h MET 53 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 3g1s h MET 53 CO 0.00 0.00 0.00 -0.44 1.06 0.00 0.00 176.91 177.53 3g1s h ASP 54 N 0.00 0.00 0.25 1.22 3.32 -1.92 -1.56 116.42 117.73 3g1s h ASP 54 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3g1s h ASP 54 Cb 0.20 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.74 3g1s h ASP 54 CO 0.00 0.00 -0.12 -0.29 -1.72 0.00 0.00 179.24 177.11 3g1s h ILE 55 N 0.00 0.72 0.01 0.35 6.09 -1.71 -2.38 117.51 120.59 3g1s h ILE 55 Ca 0.00 -0.46 -0.00 0.00 -1.37 0.00 0.00 64.86 63.03 3g1s h ILE 55 Cb 0.01 1.28 0.00 0.00 0.47 0.00 0.00 36.82 38.58 3g1s h ILE 55 CO 0.00 0.11 -0.01 0.40 -3.07 0.00 0.00 178.15 175.59 3g1s h ILE 56 N 0.00 1.12 -0.21 2.19 2.04 -1.53 -1.56 117.51 119.56 3g1s h ILE 56 Ca -0.00 -0.41 -0.05 0.00 1.00 0.00 0.00 64.86 65.39 3g1s h ILE 56 Cb 0.27 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 3g1s h ILE 56 CO 0.02 0.11 -0.10 0.00 0.00 0.00 0.00 178.15 178.17 3g1s h ALA 57 N 0.79 1.43 -0.72 1.87 0.00 -1.55 -2.26 119.26 118.82 3g1s h ALA 57 Ca -0.00 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 3g1s h ALA 57 Cb 0.19 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3g1s h ALA 57 CO 0.00 0.40 0.21 1.49 0.00 0.00 0.00 179.25 181.35 3g1s h GLU 58 N 0.32 1.13 -0.32 0.00 4.81 -1.12 -1.55 114.58 117.86 3g1s h GLU 58 Ca 0.07 -0.25 -0.04 0.00 -0.13 0.00 0.00 59.36 59.00 3g1s h GLU 58 Cb 0.39 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 3g1s h GLU 58 CO 0.02 0.98 0.04 0.74 -0.73 0.00 0.00 179.01 180.06 3g1s h PHE 59 N 1.08 0.57 -0.71 0.92 -1.00 -0.79 -0.53 116.94 116.48 3g1s h PHE 59 Ca 0.23 -0.08 -0.02 0.00 2.81 0.00 0.00 57.97 60.91 3g1s h PHE 59 Cb 0.33 -0.15 -0.03 0.00 3.61 0.00 0.00 35.95 39.70 3g1s h PHE 59 CO 0.03 0.62 0.37 0.00 -1.61 0.00 0.00 178.31 177.72 3g1s h ARG 60 N 0.35 0.99 0.08 1.51 3.08 -1.24 -0.98 114.38 118.17 3g1s h ARG 60 Ca 0.09 -0.12 -0.23 0.00 0.07 0.00 0.00 59.98 59.80 3g1s h ARG 60 Cb 0.37 -0.19 0.02 0.00 0.08 0.00 0.00 29.97 30.25 3g1s h ARG 60 CO 0.01 0.74 -0.95 -0.22 -1.07 0.00 0.00 179.97 178.48 3g1s h LYS 61 N 1.00 0.51 0.00 0.04 3.64 -1.19 0.21 116.57 120.77 3g1s h LYS 61 Ca 0.25 -0.65 -0.12 0.00 -1.27 0.00 0.00 60.65 58.86 3g1s h LYS 61 Cb 0.05 0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 3g1s h LYS 61 CO -0.04 1.27 -0.56 0.00 -2.27 0.00 0.00 179.45 177.85 3g1s h ARG 62 N 0.05 0.00 0.00 1.90 3.08 -0.99 -3.35 114.38 115.07 3g1s h ARG 62 Ca -0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.91 3g1s h ARG 62 Cb 1.66 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.71 3g1s h ARG 62 CO 0.18 0.56 0.00 1.19 -1.07 0.00 0.00 179.97 180.83 3g1s n PHE 63 N -3.86 0.00 -2.38 3.04 3.01 -0.38 -5.00 117.46 111.89 3g1s n PHE 63 Ca -0.01 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.26 3g1s n PHE 63 Cb 0.57 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 40.03 3g1s n PHE 63 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3g1s n GLY 64 N 0.67 -0.40 3.97 1.37 0.00 0.72 -4.98 105.19 106.55 3g1s n GLY 64 Ca 0.00 -0.10 -0.21 0.00 0.00 0.00 0.00 46.02 45.71 3g1s n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1s s ARG 66 N -4.04 4.60 -0.13 0.00 3.52 0.95 -4.50 118.95 119.36 3g1s s ARG 66 Ca 0.36 1.23 0.02 0.00 -0.13 0.00 0.00 55.73 57.21 3g1s s ARG 66 Cb -0.09 -3.16 0.00 0.00 -1.56 0.00 0.00 34.95 30.15 3g1s s ARG 66 CO 0.30 0.50 -0.20 0.42 -0.81 0.00 0.00 175.30 175.50 3g1s s ILE 67 N -1.27 2.25 -0.22 4.11 -1.09 -1.26 -0.86 121.20 122.88 3g1s s ILE 67 Ca 0.40 -0.92 -0.05 0.00 -2.23 0.00 0.00 60.65 57.85 3g1s s ILE 67 Cb -0.22 -1.91 -0.02 0.00 -1.58 0.00 0.00 42.46 38.73 3g1s s ILE 67 CO 0.27 0.54 -0.01 -0.63 -1.23 0.00 0.00 174.94 173.88 3g1s s ILE 68 N 0.66 3.74 -0.54 2.92 1.01 -0.23 -0.93 121.20 127.83 3g1s s ILE 68 Ca -0.10 -0.37 -0.25 0.00 0.00 0.00 0.00 60.65 59.93 3g1s s ILE 68 Cb -0.16 -2.71 0.04 0.00 0.01 0.00 0.00 42.46 39.64 3g1s s ILE 68 CO 0.02 0.41 0.99 0.00 0.00 0.00 0.00 174.94 176.35 3g1s s ALA 69 N 1.32 3.14 -1.46 9.38 0.00 0.10 -1.05 121.76 133.20 3g1s s ALA 69 Ca 0.04 -1.11 -0.08 0.00 0.00 0.00 0.00 51.96 50.82 3g1s s ALA 69 Cb -0.15 -3.78 0.00 0.00 0.00 0.00 0.00 23.12 19.20 3g1s s ALA 69 CO 0.00 -2.39 2.71 0.41 0.00 0.00 0.00 175.76 176.49 3g1s n GLY 70 N 5.08 4.67 0.18 0.00 0.00 0.61 -1.21 105.19 114.53 3g1s n GLY 70 Ca 0.04 -1.75 0.12 0.00 0.00 0.00 0.00 46.02 44.42 3g1s n GLY 70 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3g1s h PHE 71 N 4.77 0.00 -6.14 1.61 0.05 -1.80 -3.41 116.94 112.01 3g1s h PHE 71 Ca 0.79 0.00 -0.42 0.00 3.82 0.00 0.00 57.97 62.16 3g1s h PHE 71 Cb 0.31 0.00 0.07 0.00 2.00 0.00 0.00 35.95 38.33 3g1s h PHE 71 CO 1.76 0.00 -0.89 1.63 -0.18 0.00 0.00 178.31 180.62 3g1s n LYS 72 N -2.93 -2.66 -1.67 1.51 5.02 -0.21 -4.82 118.16 112.41 3g1s n LYS 72 Ca 0.03 0.54 -0.47 0.00 -2.02 0.00 0.00 58.31 56.39 3g1s n LYS 72 Cb 0.53 -4.66 -0.04 0.00 -0.02 0.00 0.00 35.03 30.84 3g1s n LYS 72 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3g1s n VAL 73 N -4.14 0.10 -2.68 -0.18 0.31 -0.89 -4.36 118.33 106.50 3g1s n VAL 73 Ca -0.18 -0.02 -0.08 0.00 -0.01 0.00 0.00 64.34 64.05 3g1s n VAL 73 Cb 0.63 -1.55 0.06 0.00 -0.91 0.00 0.00 33.84 32.07 3g1s n VAL 73 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3g1s n ALA 74 N 3.91 2.74 -3.79 3.52 0.00 -1.26 -0.60 120.51 125.03 3g1s n ALA 74 Ca 0.18 -2.54 -0.05 0.00 0.00 0.00 0.00 53.44 51.03 3g1s n ALA 74 Cb 0.28 -0.95 -0.00 0.00 0.00 0.00 0.00 19.45 18.78 3g1s n ALA 74 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3g1s n ASP 75 N -0.27 1.66 -4.77 0.00 -0.08 -1.26 -4.95 116.55 106.87 3g1s n ASP 75 Ca 0.05 -1.34 -0.30 0.00 -1.51 0.00 0.00 54.79 51.68 3g1s n ASP 75 Cb 0.83 0.02 0.09 0.00 2.34 0.00 0.00 41.12 44.40 3g1s n ASP 75 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 3g1s s ILE 76 N -0.79 3.27 0.18 5.18 -4.36 -1.26 -4.70 121.20 118.71 3g1s s ILE 76 Ca 0.03 0.41 -0.20 0.00 -0.26 0.00 0.00 60.65 60.63 3g1s s ILE 76 Cb -0.00 -3.01 0.11 0.00 1.25 0.00 0.00 42.46 40.81 3g1s s ILE 76 CO 0.02 -0.54 1.61 -0.65 0.24 0.00 0.00 174.94 175.62 3g1s h PRO 77 N -1.13 -0.17 -0.77 0.37 0.11 -1.88 0.15 132.00 128.68 3g1s h PRO 77 Ca -0.46 0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.73 3g1s h PRO 77 Cb 1.25 0.04 -0.06 0.00 0.11 0.00 0.00 31.00 32.34 3g1s h PRO 77 CO 0.55 -0.11 0.46 0.93 -0.21 0.00 0.00 178.00 179.62 3g1s h GLU 78 N -0.17 0.81 -0.20 1.05 5.08 -1.94 -0.62 114.58 118.58 3g1s h GLU 78 Ca 0.21 -0.05 -0.20 0.00 -1.00 0.00 0.00 59.36 58.32 3g1s h GLU 78 Cb 0.51 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.58 3g1s h GLU 78 CO -0.57 0.54 -0.67 1.15 -1.00 0.00 0.00 179.01 178.46 3g1s h THR 79 N 0.84 1.29 -0.85 1.13 2.02 -1.82 -2.54 112.91 112.98 3g1s h THR 79 Ca 0.34 -1.88 0.02 0.00 0.77 0.00 0.00 66.41 65.66 3g1s h THR 79 Cb 0.19 1.84 -0.05 0.00 -1.74 0.00 0.00 68.15 68.39 3g1s h THR 79 CO -0.18 0.60 0.56 0.78 0.37 0.00 0.00 175.52 177.65 3g1s h ASN 80 N 0.56 0.95 -0.24 4.18 4.21 -0.49 0.11 115.58 124.85 3g1s h ASN 80 Ca -0.02 -0.02 0.01 0.00 1.21 0.00 0.00 56.30 57.49 3g1s h ASN 80 Cb 1.28 -0.23 -0.02 0.00 -1.12 0.00 0.00 38.32 38.23 3g1s h ASN 80 CO 0.14 0.67 0.12 -0.08 -1.29 0.00 0.00 177.43 176.99 3g1s h GLU 81 N 1.11 0.24 -0.68 0.81 4.81 -1.01 -0.55 114.58 119.32 3g1s h GLU 81 Ca 0.32 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.50 3g1s h GLU 81 Cb -0.08 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.22 3g1s h GLU 81 CO -0.09 0.16 0.27 0.87 -0.73 0.00 0.00 179.01 179.50 3g1s h LYS 82 N 0.25 1.02 -0.42 1.92 1.57 -0.96 -0.51 116.57 119.43 3g1s h LYS 82 Ca 0.10 -0.18 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 3g1s h LYS 82 Cb 0.03 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 3g1s h LYS 82 CO -0.07 0.84 0.16 0.82 -0.57 0.00 0.00 179.45 180.64 3g1s h ILE 83 N 0.96 1.20 -0.41 1.86 2.04 -0.54 -1.33 117.51 121.31 3g1s h ILE 83 Ca 0.23 -0.64 -0.03 0.00 1.00 0.00 0.00 64.86 65.42 3g1s h ILE 83 Cb 0.21 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 3g1s h ILE 83 CO -0.02 0.23 0.13 0.00 0.00 0.00 0.00 178.15 178.49 3g1s h ARG 85 N 0.52 0.75 -0.67 0.00 2.43 -0.96 0.56 114.38 117.00 3g1s h ARG 85 Ca 0.13 -0.11 -0.03 0.00 -0.81 0.00 0.00 59.98 59.16 3g1s h ARG 85 Cb 0.26 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 3g1s h ARG 85 CO -0.00 0.62 0.30 0.00 -1.51 0.00 0.00 179.97 179.38 3g1s h ALA 86 N 1.09 0.87 -0.44 2.80 0.00 -1.12 0.11 119.26 122.57 3g1s h ALA 86 Ca 0.18 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 3g1s h ALA 86 Cb 0.12 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3g1s h ALA 86 CO -0.02 0.45 -0.15 1.15 0.00 0.00 0.00 179.25 180.69 3g1s h THR 87 N 0.94 1.27 -0.16 0.00 2.02 -0.86 -1.82 112.91 114.29 3g1s h THR 87 Ca 0.23 -1.28 -0.17 0.00 0.77 0.00 0.00 66.41 65.97 3g1s h THR 87 Cb 0.15 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 3g1s h THR 87 CO -0.03 0.43 -0.59 -0.26 0.37 0.00 0.00 175.52 175.45 3g1s h PHE 88 N 0.71 0.67 -0.11 3.16 0.04 -0.73 -2.53 116.94 118.15 3g1s h PHE 88 Ca 0.11 -0.25 -0.03 0.00 2.80 0.00 0.00 57.97 60.60 3g1s h PHE 88 Cb 0.70 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 38.72 3g1s h PHE 88 CO 0.05 0.98 -0.06 0.87 -0.60 0.00 0.00 178.31 179.55 3g1s h LYS 89 N 0.40 0.16 0.00 1.51 1.57 -0.65 0.13 116.57 119.68 3g1s h LYS 89 Ca -0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3g1s h LYS 89 Cb 1.14 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.42 3g1s h LYS 89 CO 0.11 0.24 0.00 0.00 -0.57 0.00 0.00 179.45 179.22 3g1s n ALA 90 N -2.50 2.47 0.00 3.86 0.00 -0.70 -4.89 120.51 118.74 3g1s n ALA 90 Ca -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.27 3g1s n ALA 90 Cb 0.19 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.20 3g1s n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g1s n GLY 91 N 0.78 0.51 3.76 0.00 0.00 0.03 -3.61 105.19 106.67 3g1s n GLY 91 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3g1s n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1s s ALA 92 N -2.00 3.63 -0.05 4.61 0.00 -0.98 -4.85 121.76 122.12 3g1s s ALA 92 Ca 0.00 1.50 0.12 0.00 0.00 0.00 0.00 51.96 53.58 3g1s s ALA 92 Cb 0.00 -3.60 -0.08 0.00 0.00 0.00 0.00 23.12 19.44 3g1s s ALA 92 CO 0.00 -0.93 1.23 -0.44 0.00 0.00 0.00 175.76 175.62 3g1s h ASP 93 N 3.96 0.00 -5.12 0.00 3.32 -1.38 -3.42 116.42 113.77 3g1s h ASP 93 Ca -0.49 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.51 3g1s h ASP 93 Cb 1.23 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.66 3g1s h ASP 93 CO 0.71 0.72 -0.09 0.00 -1.72 0.00 0.00 179.24 178.87 3g1s s ALA 94 N -2.84 -0.71 0.01 3.45 0.00 -1.04 -1.85 121.76 118.78 3g1s s ALA 94 Ca 0.01 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 51.65 3g1s s ALA 94 Cb 0.09 0.79 -0.01 0.00 0.00 0.00 0.00 23.12 23.99 3g1s s ALA 94 CO 0.79 -0.71 -0.01 -1.50 0.00 0.00 0.00 175.76 174.32 3g1s s ILE 95 N -3.87 0.07 -0.19 0.00 2.07 -0.55 -0.72 121.20 118.01 3g1s s ILE 95 Ca 0.09 -0.27 -0.13 0.00 -1.41 0.00 0.00 60.65 58.93 3g1s s ILE 95 Cb 0.01 -0.11 -0.05 0.00 0.13 0.00 0.00 42.46 42.44 3g1s s ILE 95 CO -0.05 -0.13 0.24 -0.63 -1.91 0.00 0.00 174.94 172.46 3g1s s ILE 96 N -0.41 5.33 0.00 2.00 1.01 -0.35 -0.72 121.20 128.06 3g1s s ILE 96 Ca -0.04 0.42 0.06 0.00 0.00 0.00 0.00 60.65 61.09 3g1s s ILE 96 Cb -0.03 -3.58 -0.02 0.00 0.01 0.00 0.00 42.46 38.84 3g1s s ILE 96 CO -0.00 0.38 -0.20 -0.69 0.00 0.00 0.00 174.94 174.43 3g1s s VAL 97 N 0.61 1.56 0.43 2.92 1.01 0.30 -1.04 120.40 126.19 3g1s s VAL 97 Ca 0.13 -0.93 -0.22 0.00 0.00 0.00 0.00 61.98 60.96 3g1s s VAL 97 Cb -0.13 -1.32 -0.09 0.00 0.00 0.00 0.00 36.38 34.85 3g1s s VAL 97 CO 0.03 0.37 1.03 -1.00 0.00 0.00 0.00 175.10 175.52 3g1s s HIS 98 N -0.55 3.19 -0.35 5.22 3.76 0.23 -0.70 115.29 126.10 3g1s s HIS 98 Ca 0.07 1.62 0.19 0.00 -0.15 0.00 0.00 55.06 56.80 3g1s s HIS 98 Cb -0.08 -3.06 -0.27 0.00 1.11 0.00 0.00 32.58 30.29 3g1s s HIS 98 CO -0.00 -0.59 0.57 0.41 -0.85 0.00 0.00 174.74 174.28 3g1s n GLY 99 N 0.01 -0.86 0.38 -2.22 0.00 -1.24 -4.51 105.19 96.75 3g1s n GLY 99 Ca 0.07 -0.49 0.16 0.00 0.00 0.00 0.00 46.02 45.75 3g1s n GLY 99 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3g1s h PHE 100 N 0.00 0.55 0.00 1.61 3.57 -1.93 -1.03 116.94 119.70 3g1s h PHE 100 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3g1s h PHE 100 Cb 0.73 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.30 3g1s h PHE 100 CO 0.00 0.19 0.00 -2.30 -2.23 0.00 0.00 178.31 173.97 3g1s n PRO 101 N -4.50 0.31 0.00 6.41 -0.02 -1.26 -4.99 135.00 130.96 3g1s n PRO 101 Ca 0.16 0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 3g1s n PRO 101 Cb 0.56 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.54 3g1s n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g1s n GLY 102 N 0.07 1.52 0.29 -1.23 0.00 -0.39 -4.61 105.19 100.83 3g1s n GLY 102 Ca 0.09 -2.07 -0.07 0.00 0.00 0.00 0.00 46.02 43.96 3g1s n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1s h ALA 103 N 0.00 0.83 -0.51 4.61 0.00 -1.94 -2.73 119.26 119.52 3g1s h ALA 103 Ca 0.00 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 3g1s h ALA 103 Cb 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3g1s h ALA 103 CO 0.00 0.50 0.04 0.38 0.00 0.00 0.00 179.25 180.16 3g1s h ASP 104 N 0.91 0.79 -0.06 0.00 2.03 -1.99 0.62 116.42 118.72 3g1s h ASP 104 Ca 0.21 -0.18 -0.09 0.00 -0.73 0.00 0.00 57.03 56.24 3g1s h ASP 104 Cb 0.28 -0.21 -0.01 0.00 -0.83 0.00 0.00 39.33 38.56 3g1s h ASP 104 CO -0.01 0.83 -0.21 0.28 -1.03 0.00 0.00 179.24 179.10 3g1s h SER 105 N 0.78 0.46 -0.09 4.15 0.02 -1.79 -1.56 113.55 115.52 3g1s h SER 105 Ca 0.16 -0.14 -0.10 0.00 -0.84 0.00 0.00 61.79 60.86 3g1s h SER 105 Cb 0.41 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.83 3g1s h SER 105 CO 0.01 0.68 -0.35 0.58 -1.14 0.00 0.00 176.83 176.61 3g1s h VAL 106 N 0.42 1.40 -0.62 2.27 2.07 -1.14 -3.23 116.25 117.41 3g1s h VAL 106 Ca 0.07 -1.71 0.03 0.00 0.82 0.00 0.00 66.70 65.90 3g1s h VAL 106 Cb 0.60 2.25 -0.03 0.00 -1.52 0.00 0.00 31.29 32.58 3g1s h VAL 106 CO 0.04 0.50 0.41 -0.09 0.02 0.00 0.00 177.57 178.45 3g1s h ARG 107 N -0.07 0.72 -0.89 1.57 2.43 -0.74 -0.77 114.38 116.64 3g1s h ARG 107 Ca -0.02 -0.04 0.07 0.00 -0.81 0.00 0.00 59.98 59.17 3g1s h ARG 107 Cb 0.99 -0.16 -0.06 0.00 -0.42 0.00 0.00 29.97 30.32 3g1s h ARG 107 CO 0.07 0.48 0.58 0.00 -1.51 0.00 0.00 179.97 179.59 3g1s h ALA 108 N 1.64 1.54 -0.15 2.80 0.00 -1.31 0.14 119.26 123.92 3g1s h ALA 108 Ca 0.25 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 55.01 3g1s h ALA 108 Cb 0.07 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3g1s h ALA 108 CO -0.07 0.32 -0.40 0.00 0.00 0.00 0.00 179.25 179.10 3g1s h LEU 110 N 0.16 1.10 -0.23 0.00 3.38 -0.37 -1.28 115.31 118.07 3g1s h LEU 110 Ca -0.01 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.97 3g1s h LEU 110 Cb 1.02 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 3g1s h LEU 110 CO 0.09 0.75 0.08 0.78 0.09 0.00 0.00 178.44 180.23 3g1s h ASN 111 N 1.27 0.10 -0.53 -0.43 2.35 -0.74 -0.41 115.58 117.19 3g1s h ASN 111 Ca 0.40 0.02 -0.09 0.00 -0.55 0.00 0.00 56.30 56.08 3g1s h ASN 111 Cb 0.00 0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 3g1s h ASN 111 CO -0.13 0.09 -0.02 0.58 -1.65 0.00 0.00 177.43 176.30 3g1s h VAL 112 N 0.19 1.27 -0.73 2.81 2.07 -1.38 -1.56 116.25 118.91 3g1s h VAL 112 Ca 0.10 -1.13 -0.03 0.00 0.82 0.00 0.00 66.70 66.45 3g1s h VAL 112 Cb 0.06 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 3g1s h VAL 112 CO -0.10 0.40 0.33 0.00 0.02 0.00 0.00 177.57 178.23 3g1s h ALA 113 N 0.94 1.21 0.15 1.67 0.00 -1.00 -0.30 119.26 121.92 3g1s h ALA 113 Ca 0.15 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3g1s h ALA 113 Cb 0.56 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3g1s h ALA 113 CO 0.03 0.59 -0.07 1.49 0.00 0.00 0.00 179.25 181.30 3g1s h GLU 114 N 1.04 -0.19 -0.66 0.00 4.57 -0.86 0.21 114.58 118.70 3g1s h GLU 114 Ca 0.25 0.01 0.07 0.00 -1.18 0.00 0.00 59.36 58.52 3g1s h GLU 114 Cb 0.14 0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 28.71 3g1s h GLU 114 CO -0.03 0.03 0.34 1.49 -1.18 0.00 0.00 179.01 179.66 3g1s h GLU 115 N -0.39 0.59 -0.03 1.92 4.81 -0.99 -2.81 114.58 117.68 3g1s h GLU 115 Ca -0.02 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3g1s h GLU 115 Cb 0.31 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.56 3g1s h GLU 115 CO 0.03 0.39 0.00 -1.33 -0.73 0.00 0.00 179.01 177.37 3g1s n MET 116 N -4.85 1.94 -3.12 1.92 2.81 -0.15 -4.97 117.12 110.71 3g1s n MET 116 Ca 0.09 -1.37 -0.14 0.00 -1.81 0.00 0.00 57.70 54.47 3g1s n MET 116 Cb 0.21 -1.47 0.05 0.00 -0.71 0.00 0.00 33.22 31.30 3g1s n MET 116 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g1s n GLY 117 N 1.25 0.05 0.80 3.03 0.00 0.29 -5.04 105.19 105.57 3g1s n GLY 117 Ca 0.17 -0.12 -0.07 0.00 0.00 0.00 0.00 46.02 46.00 3g1s n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g1s n ARG 118 N -3.16 1.71 -4.39 1.61 5.12 0.49 -5.03 116.66 113.02 3g1s n ARG 118 Ca -0.01 -0.82 -0.25 0.00 -1.93 0.00 0.00 57.85 54.84 3g1s n ARG 118 Cb 0.54 0.22 -0.13 0.00 -1.16 0.00 0.00 32.46 31.94 3g1s n ARG 118 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 3g1s s GLU 119 N -2.40 1.22 -0.09 5.56 0.41 -0.77 -4.53 118.70 118.09 3g1s s GLU 119 Ca 0.00 -1.13 0.02 0.00 -0.41 0.00 0.00 54.97 53.45 3g1s s GLU 119 Cb 0.00 -1.47 -0.02 0.00 -1.78 0.00 0.00 34.13 30.86 3g1s s GLU 119 CO 0.00 0.35 -0.16 0.08 -0.49 0.00 0.00 175.26 175.04 3g1s s VAL 120 N -1.06 2.84 -0.17 2.63 1.01 -1.26 -1.48 120.40 122.91 3g1s s VAL 120 Ca 0.07 -0.77 -0.03 0.00 0.00 0.00 0.00 61.98 61.26 3g1s s VAL 120 Cb -0.10 -2.14 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 3g1s s VAL 120 CO 0.04 0.55 -0.06 -0.36 0.00 0.00 0.00 175.10 175.27 3g1s s PHE 121 N -0.04 2.95 -0.24 5.22 0.40 0.10 -4.08 117.98 122.29 3g1s s PHE 121 Ca -0.04 -0.55 -0.17 0.00 -0.60 0.00 0.00 56.93 55.57 3g1s s PHE 121 Cb -0.14 -1.97 -0.03 0.00 0.51 0.00 0.00 43.02 41.39 3g1s s PHE 121 CO 0.04 -0.22 0.45 -1.17 0.70 0.00 0.00 175.22 175.03 3g1s s LEU 122 N 0.66 4.08 -0.46 -0.37 2.96 -0.17 -0.54 118.68 124.85 3g1s s LEU 122 Ca -0.03 0.48 -0.27 0.00 -0.22 0.00 0.00 54.13 54.08 3g1s s LEU 122 Cb -0.15 -2.57 0.03 0.00 0.50 0.00 0.00 46.19 44.00 3g1s s LEU 122 CO 0.02 -0.20 1.02 -0.22 -1.32 0.00 0.00 176.35 175.65 3g1s s LEU 123 N 1.93 3.85 0.03 -0.68 2.96 0.12 -1.11 118.68 125.79 3g1s s LEU 123 Ca 0.19 0.30 0.14 0.00 -0.22 0.00 0.00 54.13 54.54 3g1s s LEU 123 Cb -0.15 -3.35 -0.18 0.00 0.50 0.00 0.00 46.19 43.01 3g1s s LEU 123 CO 0.09 -1.12 0.83 0.71 -1.32 0.00 0.00 176.35 175.54 3g1s h THR 124 N 6.12 0.81 -1.81 3.68 1.35 -1.64 -3.29 112.91 118.13 3g1s h THR 124 Ca -0.23 -2.49 0.00 0.00 -0.55 0.00 0.00 66.41 63.14 3g1s h THR 124 Cb 1.07 2.32 -0.21 0.00 -1.73 0.00 0.00 68.15 69.60 3g1s h THR 124 CO 1.07 0.46 0.34 -0.70 -0.25 0.00 0.00 175.52 176.44 3g1s s GLU 125 N -2.75 0.86 0.29 4.72 2.12 -1.26 -4.24 118.70 118.45 3g1s s GLU 125 Ca -0.03 0.21 0.09 0.00 0.36 0.00 0.00 54.97 55.60 3g1s s GLU 125 Cb 0.08 0.40 -0.04 0.00 0.26 0.00 0.00 34.13 34.84 3g1s s GLU 125 CO 0.81 -0.27 0.08 -1.64 -0.54 0.00 0.00 175.26 173.71 3g1s s MET 126 N -1.15 2.42 0.00 4.30 -1.94 -1.26 -3.88 119.30 117.79 3g1s s MET 126 Ca -0.07 -1.41 0.13 0.00 -1.71 0.00 0.00 55.69 52.63 3g1s s MET 126 Cb -0.00 -2.23 -0.09 0.00 2.01 0.00 0.00 34.83 34.52 3g1s s MET 126 CO 0.06 0.27 0.61 -1.13 -0.01 0.00 0.00 175.02 174.83 3g1s n SER 127 N -1.03 0.90 -4.73 3.03 3.41 -1.26 -4.81 113.62 109.12 3g1s n SER 127 Ca -0.05 -0.95 -0.34 0.00 -0.26 0.00 0.00 58.87 57.27 3g1s n SER 127 Cb 0.60 0.81 0.09 0.00 -0.26 0.00 0.00 64.21 65.44 3g1s n SER 127 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 3g1s s HIS 128 N -2.00 2.16 0.22 7.33 -3.43 -1.26 -4.88 115.29 113.43 3g1s s HIS 128 Ca 0.07 1.60 -0.15 0.00 -0.80 0.00 0.00 55.06 55.78 3g1s s HIS 128 Cb 0.10 -3.40 0.25 0.00 -1.43 0.00 0.00 32.58 28.11 3g1s s HIS 128 CO 0.45 -2.41 1.59 -1.35 -2.00 0.00 0.00 174.74 171.02 3g1s h PRO 129 N -0.31 -0.05 0.00 -0.38 0.11 -2.06 -0.98 132.00 128.33 3g1s h PRO 129 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3g1s h PRO 129 Cb 1.28 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.40 3g1s h PRO 129 CO 0.50 -0.03 0.07 0.41 -0.21 0.00 0.00 178.00 178.74 3g1s n GLY 130 N -1.48 -0.78 0.32 -0.55 0.00 -1.26 -2.37 105.19 99.07 3g1s n GLY 130 Ca 0.09 0.17 0.20 0.00 0.00 0.00 0.00 46.02 46.47 3g1s n GLY 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1s h ALA 131 N 1.80 1.14 0.00 4.61 0.00 -1.49 -2.32 119.26 123.01 3g1s h ALA 131 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3g1s h ALA 131 Cb 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3g1s h ALA 131 CO 0.00 0.01 0.00 1.05 0.00 0.00 0.00 179.25 180.31 3g1s h GLU 132 N 0.00 0.00 0.08 0.00 -0.00 -1.68 0.25 114.58 113.24 3g1s h GLU 132 Ca -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 59.36 59.36 3g1s h GLU 132 Cb 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.83 3g1s h GLU 132 CO 0.00 0.00 -0.04 0.52 -0.00 0.00 0.00 179.01 179.49 3g1s h MET 133 N 0.00 -0.11 0.00 1.06 2.86 -1.67 -3.41 114.93 113.66 3g1s h MET 133 Ca 0.00 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 3g1s h MET 133 Cb 0.62 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.31 3g1s h MET 133 CO 0.00 0.03 -0.37 1.19 1.06 0.00 0.00 176.91 178.82 3g1s n PHE 134 N -5.09 0.00 -0.08 -0.22 3.01 -1.24 -4.88 117.46 108.96 3g1s n PHE 134 Ca -0.08 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.27 3g1s n PHE 134 Cb 0.12 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.55 3g1s n PHE 134 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 3g1s h ILE 135 N 0.00 1.20 -0.72 4.37 2.04 -1.71 -3.06 117.51 119.62 3g1s h ILE 135 Ca 0.00 -0.64 0.06 0.00 1.00 0.00 0.00 64.86 65.29 3g1s h ILE 135 Cb 0.37 1.15 -0.06 0.00 -0.74 0.00 0.00 36.82 37.54 3g1s h ILE 135 CO 0.00 0.21 0.41 -0.61 0.00 0.00 0.00 178.15 178.16 3g1s h GLN 136 N 0.23 0.74 0.00 2.37 4.15 -1.20 -1.76 115.11 119.64 3g1s h GLN 136 Ca 0.08 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.46 3g1s h GLN 136 Cb 0.25 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 27.77 3g1s h GLN 136 CO -0.00 0.49 0.00 0.78 -1.93 0.00 0.00 178.83 178.17 3g1s h GLY 137 N 0.76 0.00 -0.37 2.39 0.00 -1.81 -3.00 103.07 101.04 3g1s h GLY 137 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.65 3g1s h GLY 137 CO -0.18 0.00 -0.65 0.00 0.00 0.00 0.00 176.54 175.70 3g1s n ALA 138 N -2.04 3.91 -0.07 3.60 0.00 -0.85 -4.68 120.51 120.38 3g1s n ALA 138 Ca 0.00 -0.54 -0.07 0.00 0.00 0.00 0.00 53.44 52.83 3g1s n ALA 138 Cb 0.27 -0.66 -0.01 0.00 0.00 0.00 0.00 19.45 19.05 3g1s n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g1s h ALA 139 N 2.85 -0.06 -0.46 0.00 0.00 -1.19 -0.15 119.26 120.25 3g1s h ALA 139 Ca 0.00 0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.02 3g1s h ALA 139 Cb 0.52 0.50 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 3g1s h ALA 139 CO 0.00 -0.63 0.30 -0.44 0.00 0.00 0.00 179.25 178.47 3g1s h ASP 140 N -0.20 0.51 -0.55 0.00 3.32 -1.83 -0.44 116.42 117.21 3g1s h ASP 140 Ca 0.16 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.14 3g1s h ASP 140 Cb 0.45 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 3g1s h ASP 140 CO -0.42 0.36 0.15 -0.33 -1.72 0.00 0.00 179.24 177.29 3g1s h GLU 141 N 0.60 0.91 -0.45 3.56 5.08 -1.77 -0.72 114.58 121.79 3g1s h GLU 141 Ca 0.17 -0.19 -0.07 0.00 -1.00 0.00 0.00 59.36 58.27 3g1s h GLU 141 Cb -0.05 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 3g1s h GLU 141 CO -0.05 0.81 0.00 0.82 -1.00 0.00 0.00 179.01 179.59 3g1s h ILE 142 N 0.88 1.26 -0.41 3.13 2.04 -0.65 0.34 117.51 124.10 3g1s h ILE 142 Ca 0.19 -1.04 -0.02 0.00 1.00 0.00 0.00 64.86 64.99 3g1s h ILE 142 Cb 0.31 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 3g1s h ILE 142 CO -0.00 0.36 0.19 0.00 0.00 0.00 0.00 178.15 178.70 3g1s h ALA 143 N 0.91 0.53 -0.60 1.87 0.00 -0.77 -0.89 119.26 120.31 3g1s h ALA 143 Ca 0.13 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 3g1s h ALA 143 Cb 0.50 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 3g1s h ALA 143 CO 0.02 0.10 0.25 0.00 0.00 0.00 0.00 179.25 179.63 3g1s h ARG 144 N 0.52 0.87 -0.54 0.00 3.08 -0.96 -1.11 114.38 116.24 3g1s h ARG 144 Ca 0.14 -0.13 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 3g1s h ARG 144 Cb 0.14 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 3g1s h ARG 144 CO -0.02 0.70 0.27 1.98 -1.07 0.00 0.00 179.97 181.84 3g1s h MET 145 N 0.86 0.77 -0.33 0.04 4.05 -0.45 -0.59 114.93 119.28 3g1s h MET 145 Ca 0.21 -0.11 0.02 0.00 -0.28 0.00 0.00 59.70 59.54 3g1s h MET 145 Cb 0.15 -0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 30.78 3g1s h MET 145 CO -0.02 0.62 0.18 0.78 0.23 0.00 0.00 176.91 178.71 3g1s h GLY 146 N 0.73 0.45 1.01 1.39 0.00 -0.37 -1.77 103.07 104.51 3g1s h GLY 146 Ca 0.19 -0.13 0.01 0.00 0.00 0.00 0.00 47.33 47.39 3g1s h GLY 146 CO -0.03 0.11 0.42 -2.08 0.00 0.00 0.00 176.54 174.97 3g1s h VAL 147 N 0.38 1.16 0.00 4.60 2.07 -0.92 -0.22 116.25 123.33 3g1s h VAL 147 Ca 0.13 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 3g1s h VAL 147 Cb 0.02 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 30.01 3g1s h VAL 147 CO -0.07 0.16 -0.07 0.44 0.02 0.00 0.00 177.57 178.05 3g1s h ASP 148 N 0.87 0.00 -0.31 0.57 3.32 -0.75 -2.12 116.42 118.00 3g1s h ASP 148 Ca 0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.28 3g1s h ASP 148 Cb -0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.45 3g1s h ASP 148 CO -0.05 0.07 0.00 0.18 -1.72 0.00 0.00 179.24 177.72 3g1s n LEU 149 N -3.37 3.09 0.00 1.55 4.77 -0.70 -4.95 117.00 117.39 3g1s n LEU 149 Ca -0.01 -1.29 0.00 0.00 -0.03 0.00 0.00 56.01 54.67 3g1s n LEU 149 Cb 0.23 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 3g1s n LEU 149 CO 0.27 0.65 0.00 0.61 -1.33 0.00 0.00 177.39 177.59 3g1s n GLY 150 N 1.43 0.50 3.73 -0.72 0.00 -0.80 -5.00 105.19 104.33 3g1s n GLY 150 Ca 0.18 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 3g1s n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1s s VAL 151 N -2.00 2.51 -0.05 1.61 1.01 -0.16 -4.90 120.40 118.42 3g1s s VAL 151 Ca 0.00 0.39 0.18 0.00 0.00 0.00 0.00 61.98 62.55 3g1s s VAL 151 Cb 0.00 -3.25 -0.28 0.00 0.00 0.00 0.00 36.38 32.86 3g1s s VAL 151 CO 0.00 0.04 0.36 0.29 0.00 0.00 0.00 175.10 175.79 3g1s n LYS 152 N 3.35 0.65 -4.89 2.72 4.76 -1.26 -4.58 118.16 118.91 3g1s n LYS 152 Ca 0.12 -0.15 -0.33 0.00 -2.87 0.00 0.00 58.31 55.08 3g1s n LYS 152 Cb 0.38 -1.44 -0.14 0.00 -1.84 0.00 0.00 35.03 32.00 3g1s n LYS 152 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3g1s s ASN 153 N -4.26 3.91 0.08 4.39 0.01 -1.26 0.08 114.94 117.89 3g1s s ASN 153 Ca -0.07 -0.29 0.02 0.00 -0.71 0.00 0.00 52.86 51.81 3g1s s ASN 153 Cb 0.11 -1.18 -0.03 0.00 0.41 0.00 0.00 41.25 40.55 3g1s s ASN 153 CO 0.76 0.26 -0.08 -0.31 -1.51 0.00 0.00 177.10 176.21 3g1s s TYR 154 N -0.19 0.86 -0.13 2.20 1.51 0.54 -0.99 117.35 121.14 3g1s s TYR 154 Ca -0.00 -0.69 0.02 0.00 -1.01 0.00 0.00 57.07 55.38 3g1s s TYR 154 Cb -0.13 -0.50 0.02 0.00 -0.11 0.00 0.00 41.96 41.24 3g1s s TYR 154 CO 0.03 -0.08 -0.17 0.08 -1.11 0.00 0.00 175.55 174.30 3g1s s VAL 155 N -2.48 1.67 0.23 0.71 1.01 -0.26 -1.19 120.40 120.09 3g1s s VAL 155 Ca 0.02 -0.73 0.04 0.00 0.00 0.00 0.00 61.98 61.31 3g1s s VAL 155 Cb -0.03 -1.52 -0.05 0.00 0.00 0.00 0.00 36.38 34.78 3g1s s VAL 155 CO -0.02 0.47 -0.02 -0.83 0.00 0.00 0.00 175.10 174.71 3g1s s GLY 156 N 1.07 1.57 0.88 4.51 0.00 -0.69 -1.68 107.32 112.97 3g1s s GLY 156 Ca -0.04 -1.77 -0.12 0.00 0.00 0.00 0.00 44.72 42.80 3g1s s GLY 156 CO -0.04 -1.70 1.09 2.56 0.00 0.00 0.00 173.10 175.02 3g1s s PRO 157 N -3.82 1.40 0.00 2.90 0.04 -1.25 -3.96 135.00 130.31 3g1s s PRO 157 Ca 0.28 0.77 0.00 0.00 0.04 0.00 0.00 61.00 62.08 3g1s s PRO 157 Cb 0.05 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.76 3g1s s PRO 157 CO 0.09 -2.13 0.00 0.45 0.04 0.00 0.00 177.00 175.45 3g1s n SER 158 N -3.80 2.86 -0.26 6.66 2.88 -1.26 -4.63 113.62 116.08 3g1s n SER 158 Ca 0.07 -0.15 0.03 0.00 -1.33 0.00 0.00 58.87 57.48 3g1s n SER 158 Cb 0.56 0.87 0.15 0.00 -0.75 0.00 0.00 64.21 65.04 3g1s n SER 158 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 3g1s h THR 159 N 0.00 0.82 -3.67 2.46 1.35 -1.96 -3.36 112.91 108.56 3g1s h THR 159 Ca 0.00 -0.21 -0.67 0.00 -0.55 0.00 0.00 66.41 64.98 3g1s h THR 159 Cb 0.00 0.16 -0.37 0.00 -1.73 0.00 0.00 68.15 66.21 3g1s h THR 159 CO 0.00 0.11 -0.68 -0.13 -0.25 0.00 0.00 175.52 174.57 3g1s s ARG 160 N -6.04 1.83 0.37 4.72 0.52 -1.26 -5.00 118.95 114.08 3g1s s ARG 160 Ca -0.12 -1.72 0.12 0.00 -0.52 0.00 0.00 55.73 53.48 3g1s s ARG 160 Cb 0.19 -3.26 0.91 0.00 0.52 0.00 0.00 34.95 33.31 3g1s s ARG 160 CO 0.77 -0.89 1.83 -1.00 0.02 0.00 0.00 175.30 176.03 3g1s h PRO 161 N 7.79 0.57 0.00 3.54 0.13 -1.92 -0.17 132.00 141.94 3g1s h PRO 161 Ca -0.10 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.98 3g1s h PRO 161 Cb 1.03 -0.13 -0.00 0.00 0.13 0.00 0.00 31.00 32.03 3g1s h PRO 161 CO 0.56 0.38 -0.05 1.05 -0.23 0.00 0.00 178.00 179.71 3g1s h GLU 162 N 0.59 0.00 0.11 0.86 9.09 -1.96 -0.53 114.58 122.74 3g1s h GLU 162 Ca 0.50 0.00 -0.27 0.00 0.05 0.00 0.00 59.36 59.64 3g1s h GLU 162 Cb 0.98 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.08 3g1s h GLU 162 CO -0.24 0.05 -1.20 0.00 0.05 0.00 0.00 179.01 177.66 3g1s h ARG 163 N 0.00 0.27 -0.21 1.06 3.08 -1.42 -2.49 114.38 114.66 3g1s h ARG 163 Ca -0.00 -0.43 -0.13 0.00 0.07 0.00 0.00 59.98 59.48 3g1s h ARG 163 Cb 0.28 0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 3g1s h ARG 163 CO 0.01 1.20 -0.43 1.25 -1.07 0.00 0.00 179.97 180.92 3g1s h LEU 164 N 0.08 0.55 -0.60 3.04 5.85 -1.14 -1.19 115.31 121.90 3g1s h LEU 164 Ca -0.12 -0.25 -0.11 0.00 0.84 0.00 0.00 57.88 58.24 3g1s h LEU 164 Cb 1.93 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 42.78 3g1s h LEU 164 CO 0.20 0.91 -0.10 -1.28 -0.34 0.00 0.00 178.44 177.83 3g1s h SER 165 N 0.42 1.00 -0.46 1.25 0.87 -1.15 -0.32 113.55 115.16 3g1s h SER 165 Ca 0.03 -0.33 -0.04 0.00 -1.23 0.00 0.00 61.79 60.23 3g1s h SER 165 Cb 0.92 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.59 3g1s h SER 165 CO 0.08 1.11 0.15 -0.09 -0.53 0.00 0.00 176.83 177.55 3g1s h ARG 166 N 0.90 0.72 -0.23 2.24 9.65 -1.17 -0.65 114.38 125.84 3g1s h ARG 166 Ca 0.14 -0.15 -0.01 0.00 -1.10 0.00 0.00 59.98 58.86 3g1s h ARG 166 Cb 0.66 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 29.12 3g1s h ARG 166 CO 0.05 0.68 0.10 1.25 2.80 0.00 0.00 179.97 184.85 3g1s h LEU 167 N 0.61 0.30 -1.35 3.80 6.46 -1.01 -1.89 115.31 122.23 3g1s h LEU 167 Ca 0.15 -0.14 0.03 0.00 -0.12 0.00 0.00 57.88 57.80 3g1s h LEU 167 Cb 0.27 -0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 40.08 3g1s h LEU 167 CO -0.00 0.36 0.46 -0.09 -0.62 0.00 0.00 178.44 178.55 3g1s h ARG 168 N 0.22 0.83 -0.71 1.25 9.65 -0.89 -0.48 114.38 124.26 3g1s h ARG 168 Ca 0.08 -0.05 -0.04 0.00 -1.10 0.00 0.00 59.98 58.86 3g1s h ARG 168 Cb 0.15 -0.19 -0.03 0.00 -1.39 0.00 0.00 29.97 28.51 3g1s h ARG 168 CO -0.01 0.55 0.28 1.49 2.80 0.00 0.00 179.97 185.07 3g1s h GLU 169 N 0.85 1.07 -0.11 0.20 4.57 -0.59 0.19 114.58 120.75 3g1s h GLU 169 Ca 0.28 -0.20 -0.07 0.00 -1.18 0.00 0.00 59.36 58.19 3g1s h GLU 169 Cb 0.05 -0.17 -0.00 0.00 -0.16 0.00 0.00 28.75 28.47 3g1s h GLU 169 CO -0.08 0.89 -0.19 0.82 -1.18 0.00 0.00 179.01 179.27 3g1s h ILE 170 N 1.02 1.38 0.00 2.32 2.04 -0.49 -3.28 117.51 120.50 3g1s h ILE 170 Ca 0.24 -1.45 0.00 0.00 1.00 0.00 0.00 64.86 64.65 3g1s h ILE 170 Cb 0.22 2.06 0.00 0.00 -0.74 0.00 0.00 36.82 38.37 3g1s h ILE 170 CO -0.02 0.42 -0.09 2.30 0.00 0.00 0.00 178.15 180.76 3g1s n ILE 171 N -4.53 0.25 0.00 -0.67 -5.35 -0.29 -4.94 119.36 103.82 3g1s n ILE 171 Ca -0.07 -0.13 0.00 0.00 -0.27 0.00 0.00 62.75 62.28 3g1s n ILE 171 Cb 0.40 -0.44 0.00 0.00 -1.74 0.00 0.00 39.64 37.86 3g1s n ILE 171 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3g1s n GLY 172 N 1.42 -1.46 0.17 3.28 0.00 0.05 -4.03 105.19 104.61 3g1s n GLY 172 Ca 0.06 -1.57 0.13 0.00 0.00 0.00 0.00 46.02 44.64 3g1s n GLY 172 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3g1s h GLN 173 N 0.00 0.00 0.02 1.61 1.08 -1.92 -3.24 115.11 112.65 3g1s h GLN 173 Ca 0.00 0.00 -0.21 0.00 -1.45 0.00 0.00 58.65 56.99 3g1s h GLN 173 Cb 0.00 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.41 3g1s h GLN 173 CO 0.00 0.00 -0.96 -0.44 -0.95 0.00 0.00 178.83 176.48 3g1s h ASP 174 N 0.00 0.09 -4.22 1.46 3.45 -1.95 -3.46 116.42 111.78 3g1s h ASP 174 Ca 0.00 -0.09 -0.52 0.00 0.43 0.00 0.00 57.03 56.85 3g1s h ASP 174 Cb 0.69 -0.03 0.15 0.00 -0.56 0.00 0.00 39.33 39.58 3g1s h ASP 174 CO 0.00 0.99 0.34 -0.44 -1.57 0.00 0.00 179.24 178.57 3g1s s SER 175 N -6.82 4.24 -0.22 6.45 0.01 -1.23 -4.92 113.70 111.22 3g1s s SER 175 Ca -0.01 2.15 -0.11 0.00 1.31 0.00 0.00 55.95 59.29 3g1s s SER 175 Cb 0.10 -2.56 -0.05 0.00 0.21 0.00 0.00 66.02 63.72 3g1s s SER 175 CO 0.82 -2.22 0.17 0.12 0.41 0.00 0.00 173.24 172.54 3g1s s PHE 176 N -2.35 3.37 -0.08 2.43 5.36 0.11 -5.00 117.98 121.82 3g1s s PHE 176 Ca 0.69 0.31 0.02 0.00 -0.96 0.00 0.00 56.93 56.99 3g1s s PHE 176 Cb -0.24 -2.24 0.01 0.00 -0.34 0.00 0.00 43.02 40.21 3g1s s PHE 176 CO 0.48 0.16 -0.13 -1.17 -1.46 0.00 0.00 175.22 173.11 3g1s s LEU 177 N 0.75 1.64 0.09 6.12 2.96 -1.26 -0.34 118.68 128.64 3g1s s LEU 177 Ca 0.09 -0.34 0.10 0.00 -0.22 0.00 0.00 54.13 53.76 3g1s s LEU 177 Cb -0.13 -0.91 -0.03 0.00 0.50 0.00 0.00 46.19 45.62 3g1s s LEU 177 CO 0.02 0.02 -0.25 0.27 -1.32 0.00 0.00 176.35 175.09 3g1s s ILE 178 N 0.79 2.07 -0.01 6.68 -4.36 -0.34 0.14 121.20 126.18 3g1s s ILE 178 Ca -0.12 -1.54 -0.01 0.00 -0.26 0.00 0.00 60.65 58.72 3g1s s ILE 178 Cb -0.15 -1.81 0.00 0.00 1.25 0.00 0.00 42.46 41.74 3g1s s ILE 178 CO 0.02 0.17 0.02 -0.44 0.24 0.00 0.00 174.94 174.95 3g1s s SER 179 N -1.68 -0.02 -1.24 4.36 0.01 -0.75 -1.71 113.70 112.67 3g1s s SER 179 Ca 0.11 0.05 -0.10 0.00 1.31 0.00 0.00 55.95 57.32 3g1s s SER 179 Cb -0.10 0.05 -0.07 0.00 0.21 0.00 0.00 66.02 66.11 3g1s s SER 179 CO 0.04 -0.01 2.43 -0.81 0.41 0.00 0.00 173.24 175.31 3g1s n PRO 180 N 3.07 2.74 0.00 12.44 -0.04 -1.25 -0.31 135.00 151.64 3g1s n PRO 180 Ca -0.12 -1.91 0.00 0.00 -0.04 0.00 0.00 63.50 61.43 3g1s n PRO 180 Cb 0.60 -2.72 0.00 0.00 -0.04 0.00 0.00 33.50 31.33 3g1s n PRO 180 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3g1s n GLY 190 N 3.81 0.92 0.15 0.55 0.00 -1.26 -4.34 105.19 105.02 3g1s n GLY 190 Ca 0.59 0.42 0.08 0.00 0.00 0.00 0.00 46.02 47.11 3g1s n GLY 190 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3g1s h GLU 191 N 0.00 0.00 -0.81 1.61 4.81 -2.00 -3.33 114.58 114.85 3g1s h GLU 191 Ca 0.00 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.35 3g1s h GLU 191 Cb 0.00 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 29.30 3g1s h GLU 191 CO 0.00 0.14 0.43 1.15 -0.73 0.00 0.00 179.01 180.00 3g1s h THR 192 N 0.00 0.82 0.00 0.32 2.02 -1.96 -0.10 112.91 114.00 3g1s h THR 192 Ca -0.02 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 66.92 3g1s h THR 192 Cb 1.16 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 3g1s h THR 192 CO 0.02 0.12 0.00 0.18 0.37 0.00 0.00 175.52 176.21 3g1s n LEU 193 N -4.83 0.00 0.19 2.58 4.77 -1.25 -0.85 117.00 117.61 3g1s n LEU 193 Ca 0.14 0.15 0.07 0.00 -0.03 0.00 0.00 56.01 56.35 3g1s n LEU 193 Cb 0.34 -0.15 0.32 0.00 -2.33 0.00 0.00 43.42 41.60 3g1s n LEU 193 CO 0.24 -0.08 0.70 0.03 -1.33 0.00 0.00 177.39 176.94 3g1s h ARG 194 N 0.00 0.00 0.00 3.23 3.08 -1.23 -3.36 114.38 116.10 3g1s h ARG 194 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 3g1s h ARG 194 Cb 0.07 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 3g1s h ARG 194 CO 0.00 0.32 -1.07 1.19 -1.07 0.00 0.00 179.97 179.34 3g1s n PHE 195 N -3.38 0.00 -3.32 3.04 3.01 -0.74 -5.04 117.46 111.03 3g1s n PHE 195 Ca 0.01 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 58.13 3g1s n PHE 195 Cb 0.52 -0.05 -0.06 0.00 -0.01 0.00 0.00 39.48 39.89 3g1s n PHE 195 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3g1s s ALA 196 N -2.02 3.51 0.08 4.37 0.00 -0.03 -4.88 121.76 122.78 3g1s s ALA 196 Ca -0.01 -0.14 0.09 0.00 0.00 0.00 0.00 51.96 51.90 3g1s s ALA 196 Cb 0.00 -2.56 -0.13 0.00 0.00 0.00 0.00 23.12 20.44 3g1s s ALA 196 CO 0.03 0.44 1.33 -0.44 0.00 0.00 0.00 175.76 177.12 3g1s h ASP 197 N 2.82 0.00 -5.02 0.00 3.32 -0.60 -3.39 116.42 113.56 3g1s h ASP 197 Ca -0.48 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.48 3g1s h ASP 197 Cb 1.18 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 40.54 3g1s h ASP 197 CO 0.67 0.89 -0.19 0.00 -1.72 0.00 0.00 179.24 178.89 3g1s s ALA 198 N -2.80 -0.89 0.06 3.45 0.00 -1.14 -4.76 121.76 115.68 3g1s s ALA 198 Ca 0.01 0.33 0.05 0.00 0.00 0.00 0.00 51.96 52.35 3g1s s ALA 198 Cb 0.10 0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.36 3g1s s ALA 198 CO 0.80 -0.35 -0.04 0.96 0.00 0.00 0.00 175.76 177.14 3g1s s ILE 199 N -1.85 3.81 -0.25 0.00 -4.36 -0.55 -1.81 121.20 116.20 3g1s s ILE 199 Ca -0.10 -0.95 -0.06 0.00 -0.26 0.00 0.00 60.65 59.28 3g1s s ILE 199 Cb -0.03 -2.76 -0.02 0.00 1.25 0.00 0.00 42.46 40.90 3g1s s ILE 199 CO 0.02 0.21 0.04 -0.63 0.24 0.00 0.00 174.94 174.82 3g1s s ILE 200 N -1.19 4.01 -0.06 8.37 1.01 0.58 -0.46 121.20 133.45 3g1s s ILE 200 Ca 0.22 -0.32 0.05 0.00 0.00 0.00 0.00 60.65 60.61 3g1s s ILE 200 Cb -0.11 -2.88 -0.01 0.00 0.01 0.00 0.00 42.46 39.46 3g1s s ILE 200 CO 0.14 0.33 -0.23 -0.69 0.00 0.00 0.00 174.94 174.49 3g1s s VAL 201 N 1.57 1.92 0.00 2.92 1.01 -0.02 -4.39 120.40 123.40 3g1s s VAL 201 Ca 0.06 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 61.06 3g1s s VAL 201 Cb -0.15 -1.63 0.00 0.00 0.00 0.00 0.00 36.38 34.60 3g1s s VAL 201 CO 0.02 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.26 3g1s n GLY 202 N 3.08 0.85 0.32 4.51 0.00 -1.26 -0.72 105.19 111.96 3g1s n GLY 202 Ca -0.18 -0.02 0.16 0.00 0.00 0.00 0.00 46.02 45.98 3g1s n GLY 202 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3g1s h ARG 203 N 0.00 0.16 -0.15 1.61 3.08 -1.97 0.38 114.38 117.50 3g1s h ARG 203 Ca 0.00 -0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.08 3g1s h ARG 203 Cb 0.00 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 3g1s h ARG 203 CO 0.00 0.11 0.22 0.77 -1.07 0.00 0.00 179.97 179.99 3g1s h SER 204 N 0.16 0.00 0.00 7.04 0.02 -1.97 -1.58 113.55 117.22 3g1s h SER 204 Ca 0.60 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.55 3g1s h SER 204 Cb 1.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.82 3g1s h SER 204 CO -0.71 0.00 -0.71 -0.38 -1.14 0.00 0.00 176.83 173.89 3g1s n ILE 205 N -3.56 1.13 0.33 3.27 5.41 0.12 -4.21 119.36 121.86 3g1s n ILE 205 Ca 0.01 0.23 0.12 0.00 1.00 0.00 0.00 62.75 64.11 3g1s n ILE 205 Cb 0.32 -2.10 0.55 0.00 -0.71 0.00 0.00 39.64 37.70 3g1s n ILE 205 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 176.55 176.65 3g1s h TYR 206 N -0.71 0.00 0.00 1.39 -0.00 -1.34 -2.90 116.97 113.40 3g1s h TYR 206 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 3g1s h TYR 206 Cb 0.71 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.44 3g1s h TYR 206 CO -0.31 0.00 -1.40 1.28 -0.00 0.00 0.00 178.16 177.73 3g1s n LEU 207 N -2.33 0.38 -4.69 0.10 4.77 -0.60 -4.94 117.00 109.69 3g1s n LEU 207 Ca 0.01 -0.22 -0.34 0.00 -0.03 0.00 0.00 56.01 55.43 3g1s n LEU 207 Cb 0.18 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.40 3g1s n LEU 207 CO 0.18 0.10 0.77 0.00 -1.33 0.00 0.00 177.39 177.11 3g1s n ALA 208 N -1.82 0.01 -0.36 -1.18 0.00 -1.09 -4.88 120.51 111.19 3g1s n ALA 208 Ca -0.00 -0.32 0.11 0.00 0.00 0.00 0.00 53.44 53.22 3g1s n ALA 208 Cb 0.39 -2.25 0.30 0.00 0.00 0.00 0.00 19.45 17.89 3g1s n ALA 208 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3g1s h ASP 209 N -0.88 0.83 -2.90 0.00 3.32 -1.94 -3.33 116.42 111.53 3g1s h ASP 209 Ca -0.46 0.08 -0.52 0.00 0.02 0.00 0.00 57.03 56.15 3g1s h ASP 209 Cb 1.30 -0.07 -0.40 0.00 0.22 0.00 0.00 39.33 40.37 3g1s h ASP 209 CO 0.46 0.35 -0.77 0.21 -1.72 0.00 0.00 179.24 177.76 3g1s s ASN 210 N -5.50 3.33 0.47 6.45 2.47 -1.26 -5.02 114.94 115.88 3g1s s ASN 210 Ca -0.11 -1.17 0.12 0.00 0.42 0.00 0.00 52.86 52.12 3g1s s ASN 210 Cb 0.24 -0.39 1.09 0.00 -1.45 0.00 0.00 41.25 40.74 3g1s s ASN 210 CO 0.80 -0.41 2.10 1.55 -3.72 0.00 0.00 177.10 177.42 3g1s h PRO 211 N 8.37 0.24 0.39 0.43 0.13 -1.68 -2.27 132.00 137.61 3g1s h PRO 211 Ca -0.18 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 64.91 3g1s h PRO 211 Cb 1.04 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.12 3g1s h PRO 211 CO 0.41 0.16 -0.19 0.00 -0.23 0.00 0.00 178.00 178.15 3g1s h ALA 212 N 1.88 -0.52 -0.63 -0.56 0.00 -1.87 0.21 119.26 117.77 3g1s h ALA 212 Ca 0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3g1s h ALA 212 Cb 0.01 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3g1s h ALA 212 CO -0.02 -0.77 0.33 0.00 0.00 0.00 0.00 179.25 178.79 3g1s h ALA 213 N 0.05 1.39 -0.35 0.00 0.00 -1.89 0.77 119.26 119.23 3g1s h ALA 213 Ca -0.05 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 3g1s h ALA 213 Cb 0.42 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3g1s h ALA 213 CO 0.09 0.49 0.06 0.00 0.00 0.00 0.00 179.25 179.89 3g1s h ALA 214 N 1.48 0.46 -0.29 0.00 0.00 -1.09 -0.37 119.26 119.44 3g1s h ALA 214 Ca 0.22 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 3g1s h ALA 214 Cb 0.05 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3g1s h ALA 214 CO -0.03 0.16 -0.05 0.00 0.00 0.00 0.00 179.25 179.33 3g1s h ALA 215 N 0.90 0.40 -0.73 0.00 0.00 -0.18 -2.59 119.26 117.07 3g1s h ALA 215 Ca 0.11 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.78 3g1s h ALA 215 Cb 0.35 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 3g1s h ALA 215 CO 0.01 0.20 0.46 0.00 0.00 0.00 0.00 179.25 179.92 3g1s h ALA 216 N 0.80 0.96 -0.00 0.00 0.00 -0.76 -2.35 119.26 117.90 3g1s h ALA 216 Ca 0.08 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3g1s h ALA 216 Cb 0.51 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 3g1s h ALA 216 CO 0.02 0.25 0.00 0.78 0.00 0.00 0.00 179.25 180.31 3g1s h GLY 217 N 0.90 0.01 0.33 0.00 0.00 -0.97 -1.98 103.07 101.36 3g1s h GLY 217 Ca 0.29 -0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.68 3g1s h GLY 217 CO -0.11 0.00 -0.12 -2.22 0.00 0.00 0.00 176.54 174.10 3g1s h ILE 218 N -0.03 0.61 -0.66 2.60 2.04 -1.19 -2.47 117.51 118.42 3g1s h ILE 218 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.87 3g1s h ILE 218 Cb 0.03 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 36.69 3g1s h ILE 218 CO -0.00 0.00 0.43 0.40 0.00 0.00 0.00 178.15 178.98 3g1s h ILE 219 N -0.07 1.17 -0.49 -0.67 2.04 -1.34 -1.94 117.51 116.21 3g1s h ILE 219 Ca 0.15 -0.33 0.14 0.00 1.00 0.00 0.00 64.86 65.82 3g1s h ILE 219 Cb 0.29 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 36.56 3g1s h ILE 219 CO -0.33 0.17 0.40 -0.08 0.00 0.00 0.00 178.15 178.31 3g1s h GLU 220 N 0.90 0.00 0.00 2.37 4.81 -0.89 0.66 114.58 122.43 3g1s h GLU 220 Ca 0.24 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.47 3g1s h GLU 220 Cb -0.09 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.29 3g1s h GLU 220 CO -0.05 0.00 0.00 0.43 -0.73 0.00 0.00 179.01 178.66 3g1s n SER 221 N -4.11 0.00 -0.61 1.04 7.64 -0.73 -5.12 113.62 111.73 3g1s n SER 221 Ca 0.09 0.13 0.13 0.00 1.01 0.00 0.00 58.87 60.24 3g1s n SER 221 Cb 0.61 -0.37 0.41 0.00 -1.01 0.00 0.00 64.21 63.85 3g1s n SER 221 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65