#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ggg n LYS 26 N 0.00 0.55 0.27 3.23 4.01 -1.26 -3.84 118.16 121.12 3ggg n LYS 26 Ca 0.00 -0.07 0.15 0.00 -0.51 0.00 0.00 58.31 57.87 3ggg n LYS 26 Cb 0.00 -1.43 0.80 0.00 -0.51 0.00 0.00 35.03 33.89 3ggg n LYS 26 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 3ggg h SER 27 N 0.18 0.00 -0.73 4.39 4.64 -2.04 -1.77 113.55 118.22 3ggg h SER 27 Ca 0.00 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 61.43 3ggg h SER 27 Cb 0.48 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.53 3ggg h SER 27 CO 0.00 0.00 0.48 0.25 -0.87 0.00 0.00 176.83 176.69 3ggg h LEU 28 N 0.00 0.52 -0.19 5.97 5.85 -2.03 -2.78 115.31 122.65 3ggg h LEU 28 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3ggg h LEU 28 Cb 0.31 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.25 3ggg h LEU 28 CO 0.00 0.30 0.00 -1.54 -0.34 0.00 0.00 178.44 176.86 3ggg n SER 29 N -4.49 0.35 -3.25 1.25 3.41 -0.66 -4.57 113.62 105.66 3ggg n SER 29 Ca 0.12 0.56 -0.03 0.00 -0.26 0.00 0.00 58.87 59.27 3ggg n SER 29 Cb 0.38 -0.64 -0.04 0.00 -0.26 0.00 0.00 64.21 63.64 3ggg n SER 29 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 3ggg s MET 30 N -3.11 0.47 -0.01 4.33 -2.45 -1.05 -5.02 119.30 112.47 3ggg s MET 30 Ca 0.09 0.63 -0.00 0.00 -1.25 0.00 0.00 55.69 55.16 3ggg s MET 30 Cb 0.12 0.01 -0.00 0.00 1.25 0.00 0.00 34.83 36.21 3ggg s MET 30 CO 0.43 -0.76 -0.01 1.04 1.05 0.00 0.00 175.02 176.77 3ggg n GLN 31 N 5.39 0.01 -3.86 4.11 6.02 -1.26 -4.81 117.38 122.99 3ggg n GLN 31 Ca -0.01 0.01 -0.36 0.00 -0.01 0.00 0.00 57.00 56.63 3ggg n GLN 31 Cb 0.51 -0.54 -0.13 0.00 1.02 0.00 0.00 30.24 31.10 3ggg n GLN 31 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 3ggg s ASN 32 N -5.01 4.99 -0.09 1.08 0.01 -1.26 -1.91 114.94 112.75 3ggg s ASN 32 Ca -0.01 -1.19 -0.10 0.00 -0.71 0.00 0.00 52.86 50.85 3ggg s ASN 32 Cb 0.00 -1.76 -0.05 0.00 0.41 0.00 0.00 41.25 39.86 3ggg s ASN 32 CO 0.01 -0.27 0.22 -0.69 -1.51 0.00 0.00 177.10 174.86 3ggg s VAL 33 N 1.31 5.36 -0.17 1.60 1.01 -0.23 -1.01 120.40 128.27 3ggg s VAL 33 Ca -0.04 0.40 -0.00 0.00 0.00 0.00 0.00 61.98 62.34 3ggg s VAL 33 Cb -0.19 -3.50 0.00 0.00 0.00 0.00 0.00 36.38 32.69 3ggg s VAL 33 CO 0.00 0.59 -0.14 -0.22 0.00 0.00 0.00 175.10 175.33 3ggg s LEU 34 N -0.92 2.48 -0.28 3.92 2.96 -0.03 -0.25 118.68 126.56 3ggg s LEU 34 Ca 0.17 -0.50 -0.16 0.00 -0.22 0.00 0.00 54.13 53.43 3ggg s LEU 34 Cb -0.13 -1.58 -0.03 0.00 0.50 0.00 0.00 46.19 44.95 3ggg s LEU 34 CO 0.06 0.04 0.40 -0.63 -1.32 0.00 0.00 176.35 174.91 3ggg s ILE 35 N 1.07 5.14 -0.38 6.68 -1.09 0.10 -0.73 121.20 131.99 3ggg s ILE 35 Ca -0.00 0.55 -0.13 0.00 -2.23 0.00 0.00 60.65 58.84 3ggg s ILE 35 Cb -0.14 -3.75 0.02 0.00 -1.58 0.00 0.00 42.46 37.00 3ggg s ILE 35 CO -0.04 0.09 0.26 -0.69 -1.23 0.00 0.00 174.94 173.33 3ggg s VAL 36 N 2.13 5.02 0.00 2.92 1.01 -0.97 0.44 120.40 130.95 3ggg s VAL 36 Ca 0.16 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.50 3ggg s VAL 36 Cb -0.16 -3.76 0.00 0.00 0.00 0.00 0.00 36.38 32.47 3ggg s VAL 36 CO 0.10 -0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.59 3ggg n GLY 37 N 5.09 0.11 3.33 4.51 0.00 0.16 0.99 105.19 119.38 3ggg n GLY 37 Ca -0.12 -0.61 -0.44 0.00 0.00 0.00 0.00 46.02 44.86 3ggg n GLY 37 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3ggg n VAL 38 N -0.04 4.28 0.00 1.61 0.31 -1.25 -3.87 118.33 119.36 3ggg n VAL 38 Ca 0.00 -4.65 0.00 0.00 -0.01 0.00 0.00 64.34 59.68 3ggg n VAL 38 Cb 0.00 -2.44 0.00 0.00 -0.91 0.00 0.00 33.84 30.49 3ggg n VAL 38 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3ggg n GLY 39 N 3.80 5.27 0.18 2.92 0.00 -1.26 -4.19 105.19 111.90 3ggg n GLY 39 Ca 0.38 -1.38 -0.14 0.00 0.00 0.00 0.00 46.02 44.88 3ggg n GLY 39 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3ggg h PHE 40 N 0.00 -0.33 -0.07 1.61 3.57 -1.88 0.10 116.94 119.94 3ggg h PHE 40 Ca 0.00 -0.01 -0.25 0.00 3.53 0.00 0.00 57.97 61.25 3ggg h PHE 40 Cb 0.00 0.11 0.02 0.00 2.79 0.00 0.00 35.95 38.87 3ggg h PHE 40 CO 0.00 -0.04 -0.92 0.52 -2.23 0.00 0.00 178.31 175.64 3ggg h MET 41 N -0.61 0.74 -0.39 1.11 2.86 -1.90 -1.03 114.93 115.72 3ggg h MET 41 Ca -0.04 -0.71 -0.03 0.00 -2.06 0.00 0.00 59.70 56.87 3ggg h MET 41 Cb 0.44 0.18 -0.02 0.00 0.06 0.00 0.00 31.60 32.26 3ggg h MET 41 CO 0.06 1.29 0.13 0.78 1.06 0.00 0.00 176.91 180.24 3ggg h GLY 42 N 0.45 0.64 1.04 8.32 0.00 -1.67 -0.07 103.07 111.79 3ggg h GLY 42 Ca -0.09 -0.37 -0.07 0.00 0.00 0.00 0.00 47.33 46.80 3ggg h GLY 42 CO 0.18 0.35 0.13 -1.33 0.00 0.00 0.00 176.54 175.87 3ggg h GLY 43 N 0.49 1.11 0.98 4.60 0.00 -0.86 -1.11 103.07 108.27 3ggg h GLY 43 Ca 0.13 -0.72 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 3ggg h GLY 43 CO -0.01 0.67 0.26 1.76 0.00 0.00 0.00 176.54 179.23 3ggg h SER 44 N 0.95 0.63 -0.19 0.19 0.02 -1.07 0.20 113.55 114.28 3ggg h SER 44 Ca 0.20 -0.10 0.01 0.00 -0.84 0.00 0.00 61.79 61.05 3ggg h SER 44 Cb 0.40 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 3ggg h SER 44 CO 0.01 0.56 0.10 0.15 -1.14 0.00 0.00 176.83 176.50 3ggg h PHE 45 N 0.66 0.19 -0.73 3.45 3.57 -0.85 -1.02 116.94 122.20 3ggg h PHE 45 Ca 0.17 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.75 3ggg h PHE 45 Cb 0.07 -0.06 -0.06 0.00 2.79 0.00 0.00 35.95 38.70 3ggg h PHE 45 CO -0.01 0.11 0.42 0.00 -2.23 0.00 0.00 178.31 176.60 3ggg h ALA 46 N 1.09 1.00 -0.30 2.41 0.00 -0.88 -0.73 119.26 121.86 3ggg h ALA 46 Ca 0.08 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 3ggg h ALA 46 Cb 0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3ggg h ALA 46 CO -0.05 0.11 -0.13 0.87 0.00 0.00 0.00 179.25 180.06 3ggg h LYS 47 N 0.77 0.61 -0.20 0.00 1.57 -0.31 -2.55 116.57 116.47 3ggg h LYS 47 Ca 0.33 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 3ggg h LYS 47 Cb 0.20 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 3ggg h LYS 47 CO -0.19 0.84 0.13 0.77 -0.57 0.00 0.00 179.45 180.43 3ggg h SER 48 N 0.37 0.23 -0.14 0.86 0.02 -1.02 0.15 113.55 114.02 3ggg h SER 48 Ca 0.07 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 61.03 3ggg h SER 48 Cb 0.65 -0.06 -0.06 0.00 0.14 0.00 0.00 62.40 63.07 3ggg h SER 48 CO 0.04 0.18 -0.45 0.25 -1.14 0.00 0.00 176.83 175.71 3ggg h LEU 49 N 0.27 -1.45 -0.95 5.07 5.85 -1.16 0.17 115.31 123.10 3ggg h LEU 49 Ca 0.07 0.17 0.14 0.00 0.84 0.00 0.00 57.88 59.11 3ggg h LEU 49 Cb -0.02 0.57 -0.09 0.00 0.37 0.00 0.00 40.66 41.49 3ggg h LEU 49 CO -0.02 -0.39 0.56 -0.09 -0.34 0.00 0.00 178.44 178.16 3ggg h ARG 50 N -0.47 0.80 0.00 1.25 9.65 -1.32 -0.93 114.38 123.37 3ggg h ARG 50 Ca 0.03 -0.05 -0.07 0.00 -1.10 0.00 0.00 59.98 58.79 3ggg h ARG 50 Cb 0.56 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 28.95 3ggg h ARG 50 CO -0.38 0.53 -0.34 -0.09 2.80 0.00 0.00 179.97 182.49 3ggg h ARG 51 N 0.83 0.00 -0.00 0.20 2.43 -0.01 -2.59 114.38 115.24 3ggg h ARG 51 Ca 0.50 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.67 3ggg h ARG 51 Cb 0.61 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 3ggg h ARG 51 CO -0.31 0.34 -0.03 -1.13 -1.51 0.00 0.00 179.97 177.32 3ggg n SER 52 N -3.86 0.42 0.00 -3.80 3.41 0.53 -4.88 113.62 105.43 3ggg n SER 52 Ca -0.01 -0.87 0.00 0.00 -0.26 0.00 0.00 58.87 57.73 3ggg n SER 52 Cb 0.41 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 3ggg n SER 52 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ggg n GLY 53 N 1.15 0.95 3.69 5.00 0.00 -0.97 -5.06 105.19 109.94 3ggg n GLY 53 Ca 0.19 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.77 3ggg n GLY 53 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3ggg n PHE 54 N -0.63 2.48 0.54 1.61 7.35 -1.08 -4.88 117.46 122.85 3ggg n PHE 54 Ca 0.00 0.03 0.06 0.00 -0.76 0.00 0.00 57.45 56.78 3ggg n PHE 54 Cb 0.00 -2.65 0.02 0.00 0.35 0.00 0.00 39.48 37.20 3ggg n PHE 54 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 3ggg n LYS 55 N 4.89 1.39 0.00 -4.13 4.76 -1.26 -4.60 118.16 119.21 3ggg n LYS 55 Ca 0.18 -0.96 0.00 0.00 -2.87 0.00 0.00 58.31 54.67 3ggg n LYS 55 Cb 0.33 -1.20 0.00 0.00 -1.84 0.00 0.00 35.03 32.32 3ggg n LYS 55 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3ggg n GLY 56 N 0.86 -1.37 3.80 0.72 0.00 -1.26 -5.04 105.19 102.89 3ggg n GLY 56 Ca 0.06 -1.60 -0.39 0.00 0.00 0.00 0.00 46.02 44.10 3ggg n GLY 56 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ggg s LYS 57 N -2.01 4.24 -0.22 1.61 -0.14 -0.80 -4.99 119.74 117.43 3ggg s LYS 57 Ca 0.00 0.75 0.02 0.00 -1.36 0.00 0.00 55.97 55.38 3ggg s LYS 57 Cb 0.00 -3.26 0.04 0.00 -1.68 0.00 0.00 37.83 32.93 3ggg s LYS 57 CO 0.00 0.58 -0.15 0.42 -0.76 0.00 0.00 175.35 175.44 3ggg s ILE 58 N -0.90 2.04 0.29 2.17 1.01 -1.26 -1.07 121.20 123.48 3ggg s ILE 58 Ca 0.30 -1.24 0.08 0.00 0.00 0.00 0.00 60.65 59.79 3ggg s ILE 58 Cb -0.19 -2.01 -0.04 0.00 0.01 0.00 0.00 42.46 40.23 3ggg s ILE 58 CO 0.19 0.24 0.11 -0.31 0.00 0.00 0.00 174.94 175.17 3ggg s TYR 59 N 1.23 2.81 -0.03 3.97 2.02 0.66 -0.35 117.35 127.65 3ggg s TYR 59 Ca -0.02 -0.25 0.04 0.00 -0.37 0.00 0.00 57.07 56.47 3ggg s TYR 59 Cb -0.16 -1.42 -0.00 0.00 -0.40 0.00 0.00 41.96 39.97 3ggg s TYR 59 CO -0.09 0.48 -0.15 0.20 -1.57 0.00 0.00 175.55 174.42 3ggg s GLY 60 N -3.79 0.80 -0.06 0.71 0.00 -0.79 0.03 107.32 104.21 3ggg s GLY 60 Ca 0.34 -0.60 0.03 0.00 0.00 0.00 0.00 44.72 44.50 3ggg s GLY 60 CO 0.22 -0.33 -0.16 -0.47 0.00 0.00 0.00 173.10 172.36 3ggg s TYR 61 N -0.00 1.73 0.09 1.90 5.04 0.17 -1.66 117.35 124.62 3ggg s TYR 61 Ca -0.02 -0.60 -0.18 0.00 -2.44 0.00 0.00 57.07 53.84 3ggg s TYR 61 Cb -0.10 -1.20 0.04 0.00 0.35 0.00 0.00 41.96 41.05 3ggg s TYR 61 CO 0.01 -0.25 0.42 0.34 -1.34 0.00 0.00 175.55 174.73 3ggg s ASP 62 N 0.35 -0.28 0.00 4.32 2.15 -1.00 0.35 116.67 122.56 3ggg s ASP 62 Ca -0.11 -0.15 0.28 0.00 0.43 0.00 0.00 52.55 53.00 3ggg s ASP 62 Cb -0.14 0.46 0.99 0.00 -0.30 0.00 0.00 42.92 43.93 3ggg s ASP 62 CO 0.04 -0.78 1.74 2.30 -0.17 0.00 0.00 175.17 178.30 3ggg n ILE 63 N 0.09 0.00 -3.76 4.11 -5.35 -1.26 -3.99 119.36 109.20 3ggg n ILE 63 Ca -0.17 -0.02 -0.37 0.00 -0.27 0.00 0.00 62.75 61.93 3ggg n ILE 63 Cb 0.62 -0.14 -0.13 0.00 -1.74 0.00 0.00 39.64 38.26 3ggg n ILE 63 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 3ggg s ASN 64 N -2.86 5.08 0.32 7.28 3.84 -1.26 -4.95 114.94 122.39 3ggg s ASN 64 Ca 0.17 -0.32 0.14 0.00 0.21 0.00 0.00 52.86 53.06 3ggg s ASN 64 Cb 0.19 -1.90 0.50 0.00 -0.55 0.00 0.00 41.25 39.49 3ggg s ASN 64 CO 0.57 -0.07 1.67 1.55 -2.79 0.00 0.00 177.10 178.03 3ggg h PRO 65 N 8.23 0.00 -0.11 0.43 0.13 -1.97 -2.08 132.00 136.63 3ggg h PRO 65 Ca -0.37 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.70 3ggg h PRO 65 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 3ggg h PRO 65 CO 0.59 0.51 -0.18 0.93 -0.23 0.00 0.00 178.00 179.61 3ggg h GLU 66 N 0.00 0.18 -0.55 0.86 5.08 -1.99 -1.40 114.58 116.76 3ggg h GLU 66 Ca -0.01 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.25 3ggg h GLU 66 Cb 1.00 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 3ggg h GLU 66 CO 0.07 0.37 0.12 0.77 -1.00 0.00 0.00 179.01 179.33 3ggg h SER 67 N 0.17 0.85 0.24 1.42 0.02 -1.70 -1.38 113.55 113.17 3ggg h SER 67 Ca 0.03 -0.24 -0.01 0.00 -0.84 0.00 0.00 61.79 60.73 3ggg h SER 67 Cb 0.43 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.75 3ggg h SER 67 CO 0.03 0.88 -0.11 0.40 -1.14 0.00 0.00 176.83 176.88 3ggg h ILE 68 N 0.79 0.82 -0.06 3.27 1.08 -1.42 -2.29 117.51 119.70 3ggg h ILE 68 Ca 0.17 -0.29 -0.14 0.00 -0.39 0.00 0.00 64.86 64.20 3ggg h ILE 68 Cb 0.37 0.99 -0.01 0.00 -3.07 0.00 0.00 36.82 35.09 3ggg h ILE 68 CO 0.01 0.07 -0.61 0.77 -0.69 0.00 0.00 178.15 177.69 3ggg h SER 69 N -0.46 0.24 -0.24 1.72 4.64 -1.24 0.72 113.55 118.93 3ggg h SER 69 Ca -0.03 -0.14 0.04 0.00 -0.47 0.00 0.00 61.79 61.19 3ggg h SER 69 Cb 0.35 -0.07 -0.04 0.00 -0.31 0.00 0.00 62.40 62.33 3ggg h SER 69 CO 0.05 0.79 -0.03 0.11 -0.87 0.00 0.00 176.83 176.89 3ggg h LYS 70 N 0.16 0.04 -0.33 4.77 1.57 -1.31 0.18 116.57 121.65 3ggg h LYS 70 Ca -0.01 -0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.65 3ggg h LYS 70 Cb 1.11 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.40 3ggg h LYS 70 CO 0.09 0.03 -0.28 0.00 -0.57 0.00 0.00 179.45 178.72 3ggg h ALA 71 N 1.22 0.90 -0.06 3.86 0.00 -1.03 0.35 119.26 124.51 3ggg h ALA 71 Ca 0.11 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 3ggg h ALA 71 Cb 0.16 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 3ggg h ALA 71 CO -0.22 0.62 -0.00 0.28 0.00 0.00 0.00 179.25 179.93 3ggg h VAL 72 N 0.58 1.25 -0.75 0.00 2.07 -0.73 0.14 116.25 118.81 3ggg h VAL 72 Ca 0.07 -0.78 -0.02 0.00 0.82 0.00 0.00 66.70 66.80 3ggg h VAL 72 Cb 0.77 1.66 -0.04 0.00 -1.52 0.00 0.00 31.29 32.16 3ggg h VAL 72 CO 0.06 0.21 0.41 0.44 0.02 0.00 0.00 177.57 178.71 3ggg h ASP 73 N -0.19 0.93 0.72 0.57 5.19 -0.29 -1.66 116.42 121.69 3ggg h ASP 73 Ca 0.02 -0.08 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 3ggg h ASP 73 Cb 0.34 -0.24 0.00 0.00 0.18 0.00 0.00 39.33 39.61 3ggg h ASP 73 CO 0.00 0.75 0.00 0.18 -3.12 0.00 0.00 179.24 177.05 3ggg n LEU 74 N -4.35 0.00 -0.72 1.55 4.77 0.12 -4.92 117.00 113.45 3ggg n LEU 74 Ca 0.08 0.41 -0.08 0.00 -0.03 0.00 0.00 56.01 56.39 3ggg n LEU 74 Cb 0.10 -0.41 -0.02 0.00 -2.33 0.00 0.00 43.42 40.76 3ggg n LEU 74 CO 0.38 -0.05 -0.09 0.61 -1.33 0.00 0.00 177.39 176.91 3ggg n GLY 75 N 1.06 0.56 0.11 -0.72 0.00 -0.62 -4.94 105.19 100.64 3ggg n GLY 75 Ca 0.09 -0.64 -0.17 0.00 0.00 0.00 0.00 46.02 45.30 3ggg n GLY 75 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3ggg h ILE 76 N 0.00 1.23 -2.94 -0.61 2.04 -1.01 -3.45 117.51 112.76 3ggg h ILE 76 Ca -0.17 -2.84 -0.60 0.00 1.00 0.00 0.00 64.86 62.25 3ggg h ILE 76 Cb 0.79 2.82 -0.17 0.00 -0.74 0.00 0.00 36.82 39.52 3ggg h ILE 76 CO 0.22 0.84 -0.79 0.27 0.00 0.00 0.00 178.15 178.69 3ggg s ILE 77 N -2.62 2.23 0.19 -0.67 -4.36 -1.17 -4.70 121.20 110.10 3ggg s ILE 77 Ca -0.08 -2.12 0.06 0.00 -0.26 0.00 0.00 60.65 58.25 3ggg s ILE 77 Cb 0.07 -2.10 -0.12 0.00 1.25 0.00 0.00 42.46 41.55 3ggg s ILE 77 CO 0.87 -0.26 1.43 0.44 0.24 0.00 0.00 174.94 177.65 3ggg h ASP 78 N 2.93 0.14 -3.83 4.36 3.32 -1.01 -3.39 116.42 118.94 3ggg h ASP 78 Ca -0.43 -0.11 0.11 0.00 0.02 0.00 0.00 57.03 56.62 3ggg h ASP 78 Cb 1.22 -0.04 -0.24 0.00 0.22 0.00 0.00 39.33 40.49 3ggg h ASP 78 CO 0.53 0.89 0.63 -0.70 -1.72 0.00 0.00 179.24 178.87 3ggg s GLU 79 N -3.24 0.47 0.32 3.56 2.12 -1.25 -5.01 118.70 115.66 3ggg s GLU 79 Ca -0.02 0.14 -0.05 0.00 0.36 0.00 0.00 54.97 55.41 3ggg s GLU 79 Cb 0.11 0.22 0.02 0.00 0.26 0.00 0.00 34.13 34.74 3ggg s GLU 79 CO 0.81 -0.14 0.50 0.41 -0.54 0.00 0.00 175.26 176.30 3ggg n GLY 80 N 0.79 1.90 3.35 -1.50 0.00 -1.26 -1.89 105.19 106.59 3ggg n GLY 80 Ca -0.08 -1.48 -0.11 0.00 0.00 0.00 0.00 46.02 44.35 3ggg n GLY 80 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3ggg s THR 81 N -2.61 0.04 -1.31 2.61 -1.32 -0.66 -4.93 115.64 107.46 3ggg s THR 81 Ca 0.22 -0.37 0.13 0.00 -1.21 0.00 0.00 61.69 60.46 3ggg s THR 81 Cb -0.02 -1.10 0.28 0.00 -1.51 0.00 0.00 72.50 70.15 3ggg s THR 81 CO 0.16 -0.20 1.18 0.35 -2.21 0.00 0.00 174.62 173.89 3ggg n THR 82 N -0.23 0.66 -4.11 5.08 -2.24 -1.26 -2.37 114.28 109.82 3ggg n THR 82 Ca -0.17 -0.83 -0.34 0.00 -2.27 0.00 0.00 64.05 60.44 3ggg n THR 82 Cb 0.64 0.77 -0.14 0.00 -2.10 0.00 0.00 70.33 69.49 3ggg n THR 82 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3ggg s SER 83 N -1.04 4.15 0.28 3.42 0.15 -1.26 -4.80 113.70 114.59 3ggg s SER 83 Ca 0.24 -0.39 0.02 0.00 0.70 0.00 0.00 55.95 56.51 3ggg s SER 83 Cb 0.13 -1.69 0.39 0.00 -1.71 0.00 0.00 66.02 63.15 3ggg s SER 83 CO 0.18 0.02 1.72 0.40 1.20 0.00 0.00 173.24 176.77 3ggg h ILE 84 N 5.65 1.26 -0.88 6.45 5.03 -1.96 -1.86 117.51 131.20 3ggg h ILE 84 Ca -0.39 -1.23 0.09 0.00 -0.12 0.00 0.00 64.86 63.21 3ggg h ILE 84 Cb 1.17 1.29 -0.07 0.00 -3.03 0.00 0.00 36.82 36.17 3ggg h ILE 84 CO 0.60 0.40 0.53 0.00 -0.68 0.00 0.00 178.15 178.99 3ggg h ALA 85 N 1.29 1.26 -0.75 1.87 0.00 -1.99 0.10 119.26 121.04 3ggg h ALA 85 Ca 0.07 0.02 0.19 0.00 0.00 0.00 0.00 54.91 55.20 3ggg h ALA 85 Cb 0.64 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 3ggg h ALA 85 CO 0.05 0.17 0.52 -0.22 0.00 0.00 0.00 179.25 179.78 3ggg h LYS 86 N 0.89 0.15 -0.91 0.00 3.11 -1.77 -2.44 116.57 115.59 3ggg h LYS 86 Ca 0.42 -0.01 0.25 0.00 -2.81 0.00 0.00 60.65 58.50 3ggg h LYS 86 Cb 0.35 -0.03 -0.05 0.00 -1.00 0.00 0.00 32.23 31.49 3ggg h LYS 86 CO -0.23 0.10 0.64 0.28 -2.81 0.00 0.00 179.45 177.42 3ggg h VAL 87 N 0.16 0.58 -0.79 2.00 2.07 -0.83 -0.04 116.25 119.38 3ggg h VAL 87 Ca 0.37 -0.05 0.05 0.00 0.82 0.00 0.00 66.70 67.89 3ggg h VAL 87 Cb 1.22 0.43 -0.05 0.00 -1.52 0.00 0.00 31.29 31.37 3ggg h VAL 87 CO -0.06 0.02 0.52 -0.08 0.02 0.00 0.00 177.57 178.00 3ggg h GLU 88 N 0.14 0.89 0.00 1.57 4.57 -1.58 0.13 114.58 120.29 3ggg h GLU 88 Ca 0.45 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.58 3ggg h GLU 88 Cb 1.57 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.96 3ggg h GLU 88 CO -0.07 0.59 0.00 -0.44 -1.18 0.00 0.00 179.01 177.90 3ggg h ASP 89 N 0.91 0.00 0.09 1.04 3.45 -1.19 -2.51 116.42 118.21 3ggg h ASP 89 Ca 0.33 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.79 3ggg h ASP 89 Cb 0.15 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.92 3ggg h ASP 89 CO -0.11 0.00 -0.03 0.49 -1.57 0.00 0.00 179.24 178.02 3ggg n PHE 90 N -2.92 0.00 -2.20 4.55 3.72 0.45 -4.99 117.46 116.06 3ggg n PHE 90 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 3ggg n PHE 90 Cb 0.27 -0.05 0.00 0.00 -0.94 0.00 0.00 39.48 38.76 3ggg n PHE 90 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3ggg n SER 91 N -0.58 0.00 -4.77 4.37 3.41 -0.95 -4.82 113.62 110.28 3ggg n SER 91 Ca 0.20 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.40 3ggg n SER 91 Cb 0.24 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.17 3ggg n SER 91 CO 0.00 0.00 0.00 -2.84 -0.16 0.00 0.00 175.04 172.04 3ggg s PRO 92 N -1.73 4.32 0.00 4.33 0.02 -1.26 -4.70 135.00 135.98 3ggg s PRO 92 Ca 0.00 2.20 0.16 0.00 0.02 0.00 0.00 61.00 63.37 3ggg s PRO 92 Cb 0.00 -3.04 0.00 0.00 0.02 0.00 0.00 34.50 31.48 3ggg s PRO 92 CO 0.00 -0.21 0.84 -0.40 -0.33 0.00 0.00 177.00 176.90 3ggg n ASP 93 N 0.73 1.62 -3.66 2.53 5.68 -0.18 -4.62 116.55 118.65 3ggg n ASP 93 Ca 0.00 -1.31 -0.12 0.00 -0.50 0.00 0.00 54.79 52.87 3ggg n ASP 93 Cb 0.42 0.45 -0.12 0.00 -1.14 0.00 0.00 41.12 40.73 3ggg n ASP 93 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 3ggg s PHE 94 N -1.82 -0.54 -0.05 2.11 5.36 -1.12 -0.49 117.98 121.43 3ggg s PHE 94 Ca 0.13 1.15 0.05 0.00 -0.96 0.00 0.00 56.93 57.30 3ggg s PHE 94 Cb 0.12 0.08 -0.02 0.00 -0.34 0.00 0.00 43.02 42.86 3ggg s PHE 94 CO 0.38 -0.39 -0.20 0.08 -1.46 0.00 0.00 175.22 173.63 3ggg s VAL 95 N 2.44 2.54 -0.38 3.12 1.01 0.40 -0.85 120.40 128.67 3ggg s VAL 95 Ca -0.00 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.09 3ggg s VAL 95 Cb -0.12 -1.96 0.11 0.00 0.00 0.00 0.00 36.38 34.41 3ggg s VAL 95 CO -0.10 0.58 0.12 -0.32 0.00 0.00 0.00 175.10 175.37 3ggg s MET 96 N -0.47 1.68 -0.12 2.72 1.75 0.09 -1.52 119.30 123.43 3ggg s MET 96 Ca 0.06 -1.94 -0.29 0.00 -1.25 0.00 0.00 55.69 52.26 3ggg s MET 96 Cb -0.12 -3.32 -0.05 0.00 2.84 0.00 0.00 34.83 34.18 3ggg s MET 96 CO 0.01 -0.99 1.68 -0.51 -0.65 0.00 0.00 175.02 174.56 3ggg s LEU 97 N 0.83 4.13 -0.05 4.11 1.43 -0.20 -2.29 118.68 126.65 3ggg s LEU 97 Ca 0.11 2.02 0.22 0.00 -1.03 0.00 0.00 54.13 55.45 3ggg s LEU 97 Cb -0.21 -3.53 0.43 0.00 0.03 0.00 0.00 46.19 42.91 3ggg s LEU 97 CO -0.06 -1.10 1.18 -1.20 0.23 0.00 0.00 176.35 175.40 3ggg n SER 98 N 7.84 1.18 -4.72 2.29 7.64 0.28 -1.71 113.62 126.42 3ggg n SER 98 Ca 0.19 -2.48 -0.22 0.00 1.01 0.00 0.00 58.87 57.37 3ggg n SER 98 Cb 0.44 -0.36 0.03 0.00 -1.01 0.00 0.00 64.21 63.31 3ggg n SER 98 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3ggg n SER 99 N 0.10 2.37 -4.76 6.43 3.41 -1.11 -4.46 113.62 115.60 3ggg n SER 99 Ca 0.09 -2.64 -0.39 0.00 -0.26 0.00 0.00 58.87 55.67 3ggg n SER 99 Cb 1.03 -0.20 0.03 0.00 -0.26 0.00 0.00 64.21 64.81 3ggg n SER 99 CO 0.00 0.00 0.00 -2.84 -0.16 0.00 0.00 175.04 172.04 3ggg s PRO 100 N -4.29 3.42 0.51 4.33 0.02 -1.26 -4.87 135.00 132.86 3ggg s PRO 100 Ca 0.42 2.30 0.26 0.00 0.02 0.00 0.00 61.00 64.00 3ggg s PRO 100 Cb -0.03 -2.45 1.35 0.00 0.02 0.00 0.00 34.50 33.39 3ggg s PRO 100 CO 0.27 -0.99 2.04 -0.39 -0.33 0.00 0.00 177.00 177.59 3ggg h VAL 101 N 1.87 0.62 0.00 3.83 -1.51 -1.90 -1.32 116.25 117.83 3ggg h VAL 101 Ca -0.51 -0.61 0.00 0.00 -1.23 0.00 0.00 66.70 64.35 3ggg h VAL 101 Cb 1.28 1.39 0.00 0.00 -2.13 0.00 0.00 31.29 31.83 3ggg h VAL 101 CO 0.59 0.14 0.00 0.54 -1.23 0.00 0.00 177.57 177.61 3ggg n ARG 102 N -3.68 0.75 0.02 5.19 1.74 -1.26 -2.64 116.66 116.79 3ggg n ARG 102 Ca -0.02 0.01 0.12 0.00 -0.77 0.00 0.00 57.85 57.19 3ggg n ARG 102 Cb 0.26 -1.50 0.17 0.00 -1.02 0.00 0.00 32.46 30.37 3ggg n ARG 102 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3ggg n THR 103 N -1.03 0.14 -0.10 0.55 -2.24 -0.50 -4.53 114.28 106.58 3ggg n THR 103 Ca 0.18 -0.13 -0.09 0.00 -2.27 0.00 0.00 64.05 61.74 3ggg n THR 103 Cb 0.10 0.14 -0.02 0.00 -2.10 0.00 0.00 70.33 68.45 3ggg n THR 103 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 3ggg h PHE 104 N 0.00 0.44 0.44 4.78 -1.00 -1.64 -2.82 116.94 117.13 3ggg h PHE 104 Ca 0.00 -0.01 -0.01 0.00 2.81 0.00 0.00 57.97 60.76 3ggg h PHE 104 Cb 0.62 -0.14 -0.02 0.00 3.61 0.00 0.00 35.95 40.03 3ggg h PHE 104 CO 0.00 0.36 -0.36 0.00 -1.61 0.00 0.00 178.31 176.70 3ggg h ARG 105 N 0.39 -0.77 -0.98 1.51 3.08 -1.82 0.72 114.38 116.51 3ggg h ARG 105 Ca 0.11 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.22 3ggg h ARG 105 Cb 0.07 0.18 -0.05 0.00 0.08 0.00 0.00 29.97 30.25 3ggg h ARG 105 CO -0.02 -0.51 0.63 1.05 -1.07 0.00 0.00 179.97 180.05 3ggg h GLU 106 N -0.80 1.31 -0.51 0.04 9.09 -1.87 -0.96 114.58 120.88 3ggg h GLU 106 Ca -0.04 -0.10 -0.03 0.00 0.05 0.00 0.00 59.36 59.24 3ggg h GLU 106 Cb 0.69 -0.29 -0.02 0.00 -1.65 0.00 0.00 28.75 27.48 3ggg h GLU 106 CO -0.02 0.89 0.19 0.82 0.05 0.00 0.00 179.01 180.94 3ggg h ILE 107 N 1.34 1.22 -0.87 -1.06 2.04 -1.31 -2.71 117.51 116.16 3ggg h ILE 107 Ca 0.36 -0.70 0.04 0.00 1.00 0.00 0.00 64.86 65.56 3ggg h ILE 107 Cb -0.12 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 36.63 3ggg h ILE 107 CO -0.07 0.26 0.56 0.00 0.00 0.00 0.00 178.15 178.90 3ggg h ALA 108 N 1.04 1.15 -0.48 1.87 0.00 -0.23 0.31 119.26 122.93 3ggg h ALA 108 Ca 0.17 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 3ggg h ALA 108 Cb 0.22 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3ggg h ALA 108 CO -0.01 0.40 0.28 0.87 0.00 0.00 0.00 179.25 180.79 3ggg h LYS 109 N 1.09 0.65 -0.62 0.00 1.57 -1.08 0.44 116.57 118.62 3ggg h LYS 109 Ca 0.35 -0.07 0.05 0.00 -1.87 0.00 0.00 60.65 59.12 3ggg h LYS 109 Cb 0.02 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 32.14 3ggg h LYS 109 CO -0.12 0.49 0.34 0.87 -0.57 0.00 0.00 179.45 180.46 3ggg h LYS 110 N 0.63 0.62 0.00 3.15 1.79 -1.03 -2.86 116.57 118.86 3ggg h LYS 110 Ca 0.17 -0.04 -0.03 0.00 -2.18 0.00 0.00 60.65 58.58 3ggg h LYS 110 Cb 0.01 -0.14 -0.00 0.00 -1.58 0.00 0.00 32.23 30.52 3ggg h LYS 110 CO -0.03 0.41 -0.13 -0.07 -1.08 0.00 0.00 179.45 178.55 3ggg h LEU 111 N 0.64 0.00 -1.47 2.94 3.38 0.36 -2.85 115.31 118.31 3ggg h LEU 111 Ca 0.27 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.19 3ggg h LEU 111 Cb 0.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 3ggg h LEU 111 CO -0.17 0.13 -0.23 0.77 0.09 0.00 0.00 178.44 179.03 3ggg h SER 112 N 0.00 0.04 0.48 -0.43 4.64 0.06 -1.67 113.55 116.68 3ggg h SER 112 Ca -0.00 -0.01 -0.18 0.00 -0.47 0.00 0.00 61.79 61.12 3ggg h SER 112 Cb 0.58 -0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 62.63 3ggg h SER 112 CO 0.02 0.28 -1.67 -1.22 -0.87 0.00 0.00 176.83 173.37 3ggg n TYR 113 N -4.24 0.69 0.03 4.77 4.02 -1.08 -4.49 117.16 116.85 3ggg n TYR 113 Ca -0.02 0.23 -0.10 0.00 -0.01 0.00 0.00 57.90 58.00 3ggg n TYR 113 Cb 0.30 -1.00 -0.13 0.00 -0.02 0.00 0.00 39.34 38.49 3ggg n TYR 113 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 3ggg h ILE 114 N 0.00 1.23 -3.37 -0.72 2.04 -1.42 -3.46 117.51 111.81 3ggg h ILE 114 Ca -0.21 -2.99 -0.55 0.00 1.00 0.00 0.00 64.86 62.10 3ggg h ILE 114 Cb 1.64 2.65 -0.04 0.00 -0.74 0.00 0.00 36.82 40.33 3ggg h ILE 114 CO 0.04 0.74 -0.01 -0.76 0.00 0.00 0.00 178.15 178.16 3ggg s LEU 115 N -6.50 4.39 0.70 1.44 1.43 -0.65 -4.84 118.68 114.66 3ggg s LEU 115 Ca -0.04 1.23 -0.16 0.00 -1.03 0.00 0.00 54.13 54.13 3ggg s LEU 115 Cb 0.09 -3.26 0.02 0.00 0.03 0.00 0.00 46.19 43.07 3ggg s LEU 115 CO 0.83 0.13 1.24 -0.94 0.23 0.00 0.00 176.35 177.83 3ggg s SER 116 N -1.54 4.31 0.60 2.29 1.04 -1.26 -4.90 113.70 114.24 3ggg s SER 116 Ca 0.37 2.45 0.29 0.00 0.48 0.00 0.00 55.95 59.54 3ggg s SER 116 Cb -0.17 -2.60 1.67 0.00 0.10 0.00 0.00 66.02 65.03 3ggg s SER 116 CO 0.20 -2.19 2.09 -0.08 0.98 0.00 0.00 173.24 174.24 3ggg h GLU 117 N -0.02 0.00 0.00 4.02 4.81 -1.97 -2.78 114.58 118.65 3ggg h GLU 117 Ca -0.49 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 3ggg h GLU 117 Cb 1.31 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.69 3ggg h GLU 117 CO 0.51 0.00 -0.53 -0.25 -0.73 0.00 0.00 179.01 178.01 3ggg n ASP 118 N -3.73 0.59 -4.64 1.04 8.00 -1.26 -4.82 116.55 111.73 3ggg n ASP 118 Ca 0.02 0.05 -0.30 0.00 0.71 0.00 0.00 54.79 55.26 3ggg n ASP 118 Cb 0.34 0.12 0.18 0.00 -0.02 0.00 0.00 41.12 41.74 3ggg n ASP 118 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ggg s ALA 119 N -3.10 1.08 -0.03 2.24 0.00 -1.05 -5.02 121.76 115.89 3ggg s ALA 119 Ca 0.08 0.45 0.05 0.00 0.00 0.00 0.00 51.96 52.55 3ggg s ALA 119 Cb 0.15 -3.41 -0.01 0.00 0.00 0.00 0.00 23.12 19.85 3ggg s ALA 119 CO 0.70 -2.98 -0.17 0.99 0.00 0.00 0.00 175.76 174.30 3ggg s THR 120 N -2.61 1.39 -0.04 0.00 2.01 0.36 -4.66 115.64 112.09 3ggg s THR 120 Ca 0.67 -0.72 0.06 0.00 0.31 0.00 0.00 61.69 62.01 3ggg s THR 120 Cb -0.23 -1.17 -0.01 0.00 0.01 0.00 0.00 72.50 71.09 3ggg s THR 120 CO 0.59 0.40 -0.21 0.54 -0.69 0.00 0.00 174.62 175.24 3ggg s VAL 121 N -0.20 1.74 0.14 3.82 0.11 0.69 -0.46 120.40 126.24 3ggg s VAL 121 Ca 0.02 -0.91 0.02 0.00 -2.93 0.00 0.00 61.98 58.17 3ggg s VAL 121 Cb -0.09 -1.47 -0.01 0.00 -1.53 0.00 0.00 36.38 33.29 3ggg s VAL 121 CO 0.01 0.49 0.14 1.07 -3.33 0.00 0.00 175.10 173.48 3ggg n THR 122 N 2.84 0.00 -3.94 5.04 5.66 -0.58 0.48 114.28 123.79 3ggg n THR 122 Ca -0.17 -0.91 -0.09 0.00 -3.05 0.00 0.00 64.05 59.83 3ggg n THR 122 Cb 0.52 0.48 -0.03 0.00 -1.55 0.00 0.00 70.33 69.76 3ggg n THR 122 CO 0.00 0.00 0.00 1.51 -3.05 0.00 0.00 175.07 173.53 3ggg s ASP 123 N -1.93 0.01 -0.01 1.09 -4.77 -1.25 -1.03 116.67 108.78 3ggg s ASP 123 Ca 0.15 -0.95 0.01 0.00 -3.30 0.00 0.00 52.55 48.46 3ggg s ASP 123 Cb 0.00 0.68 0.01 0.00 -1.09 0.00 0.00 42.92 42.53 3ggg s ASP 123 CO 0.11 -1.31 0.91 0.00 0.70 0.00 0.00 175.17 175.57 3ggg n GLN 124 N -0.45 2.30 -1.82 2.11 6.02 -0.70 -3.83 117.38 121.02 3ggg n GLN 124 Ca -0.03 -1.35 -0.40 0.00 -0.01 0.00 0.00 57.00 55.21 3ggg n GLN 124 Cb 0.61 -0.92 0.01 0.00 1.02 0.00 0.00 30.24 30.96 3ggg n GLN 124 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 3ggg s GLY 125 N -0.90 2.92 0.00 1.08 0.00 -1.23 -4.38 107.32 104.81 3ggg s GLY 125 Ca 0.02 1.46 0.27 0.00 0.00 0.00 0.00 44.72 46.47 3ggg s GLY 125 CO 0.00 2.09 1.97 1.44 0.00 0.00 0.00 173.10 178.59 3ggg n SER 126 N -0.08 0.00 -4.14 1.64 7.64 -1.26 -4.47 113.62 112.94 3ggg n SER 126 Ca 0.04 -0.59 -0.20 0.00 1.01 0.00 0.00 58.87 59.14 3ggg n SER 126 Cb 0.42 -0.10 -0.13 0.00 -1.01 0.00 0.00 64.21 63.38 3ggg n SER 126 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3ggg s VAL 127 N -2.21 1.11 0.00 0.44 1.01 -1.26 -5.00 120.40 114.49 3ggg s VAL 127 Ca 0.36 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 61.32 3ggg s VAL 127 Cb 0.19 -1.01 0.00 0.00 0.00 0.00 0.00 36.38 35.56 3ggg s VAL 127 CO 0.35 -0.01 0.00 0.29 0.00 0.00 0.00 175.10 175.73 3ggg n LYS 128 N 1.86 0.00 0.00 2.72 4.76 -1.26 -4.91 118.16 121.33 3ggg n LYS 128 Ca -0.18 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.26 3ggg n LYS 128 Cb 0.55 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.74 3ggg n LYS 128 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3ggg n GLY 129 N 4.53 2.28 0.33 0.72 0.00 -0.71 -1.52 105.19 110.82 3ggg n GLY 129 Ca 0.00 -0.20 0.16 0.00 0.00 0.00 0.00 46.02 45.98 3ggg n GLY 129 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3ggg h LYS 130 N 0.00 0.00 -0.15 1.61 3.64 -1.93 -1.90 116.57 117.84 3ggg h LYS 130 Ca 0.00 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.32 3ggg h LYS 130 Cb 0.00 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 3ggg h LYS 130 CO 0.00 0.00 -0.19 1.25 -2.27 0.00 0.00 179.45 178.24 3ggg h LEU 131 N 0.00 0.24 -0.49 5.20 5.85 -1.64 -1.11 115.31 123.36 3ggg h LEU 131 Ca 0.10 -0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.68 3ggg h LEU 131 Cb 0.48 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 3ggg h LEU 131 CO -0.00 0.45 -0.00 0.58 -0.34 0.00 0.00 178.44 179.12 3ggg h VAL 132 N 0.23 1.26 -0.08 1.05 2.07 -1.35 -0.82 116.25 118.61 3ggg h VAL 132 Ca 0.04 -1.08 -0.18 0.00 0.82 0.00 0.00 66.70 66.30 3ggg h VAL 132 Cb 0.48 0.99 -0.00 0.00 -1.52 0.00 0.00 31.29 31.23 3ggg h VAL 132 CO 0.03 0.38 -0.72 1.88 0.02 0.00 0.00 177.57 179.16 3ggg h TYR 133 N 0.72 0.54 -0.72 1.57 -1.99 -1.52 -1.90 116.97 113.67 3ggg h TYR 133 Ca 0.14 -0.24 0.03 0.00 2.00 0.00 0.00 58.73 60.66 3ggg h TYR 133 Cb 0.52 -0.08 -0.05 0.00 2.00 0.00 0.00 36.73 39.12 3ggg h TYR 133 CO 0.04 0.99 0.45 -0.44 -0.00 0.00 0.00 178.16 179.20 3ggg h ASP 134 N 0.28 0.75 0.09 3.88 3.32 -1.06 -2.26 116.42 121.40 3ggg h ASP 134 Ca -0.03 -0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.87 3ggg h ASP 134 Cb 1.29 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.67 3ggg h ASP 134 CO 0.12 0.52 -0.51 -0.07 -1.72 0.00 0.00 179.24 177.58 3ggg h LEU 135 N 0.89 0.52 -1.16 1.55 3.38 -0.92 -2.19 115.31 117.37 3ggg h LEU 135 Ca 0.29 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3ggg h LEU 135 Cb 0.02 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 3ggg h LEU 135 CO -0.11 0.94 0.41 -0.33 0.09 0.00 0.00 178.44 179.44 3ggg h GLU 136 N 0.37 0.99 -0.05 1.13 5.08 -1.27 0.48 114.58 121.31 3ggg h GLU 136 Ca 0.01 -0.10 -0.15 0.00 -1.00 0.00 0.00 59.36 58.12 3ggg h GLU 136 Cb 1.03 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 3ggg h GLU 136 CO 0.09 0.71 -0.65 -0.91 -1.00 0.00 0.00 179.01 177.25 3ggg h ASN 137 N 1.00 0.25 0.16 1.42 2.35 -1.05 0.85 115.58 120.56 3ggg h ASN 137 Ca 0.26 -0.15 -0.29 0.00 -0.55 0.00 0.00 56.30 55.57 3ggg h ASN 137 Cb -0.00 -0.07 0.01 0.00 0.05 0.00 0.00 38.32 38.31 3ggg h ASN 137 CO -0.04 0.83 -1.38 0.40 -1.65 0.00 0.00 177.43 175.59 3ggg h ILE 138 N 0.15 1.15 0.00 2.81 2.04 -1.22 -3.38 117.51 119.06 3ggg h ILE 138 Ca -0.01 -2.51 0.00 0.00 1.00 0.00 0.00 64.86 63.34 3ggg h ILE 138 Cb 1.18 2.89 0.00 0.00 -0.74 0.00 0.00 36.82 40.15 3ggg h ILE 138 CO 0.10 0.76 -1.29 0.18 0.00 0.00 0.00 178.15 177.90 3ggg n LEU 139 N -3.86 0.60 0.00 1.44 4.77 0.14 -4.81 117.00 115.29 3ggg n LEU 139 Ca -0.21 -0.32 0.00 0.00 -0.03 0.00 0.00 56.01 55.45 3ggg n LEU 139 Cb 0.96 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.05 3ggg n LEU 139 CO 0.48 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 3ggg n GLY 140 N 1.42 1.07 0.00 -0.72 0.00 0.29 -3.36 105.19 103.89 3ggg n GLY 140 Ca 0.01 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.31 3ggg n GLY 140 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ggg n LYS 141 N 5.27 0.00 0.23 1.61 4.76 -1.26 -2.89 118.16 125.89 3ggg n LYS 141 Ca 0.00 0.43 0.13 0.00 -2.87 0.00 0.00 58.31 56.00 3ggg n LYS 141 Cb 0.00 -1.54 0.29 0.00 -1.84 0.00 0.00 35.03 31.94 3ggg n LYS 141 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3ggg h ARG 142 N 0.00 0.00 -5.52 1.97 3.08 -1.82 -3.40 114.38 108.69 3ggg h ARG 142 Ca 0.00 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.42 3ggg h ARG 142 Cb 0.08 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.04 3ggg h ARG 142 CO 0.00 0.02 -0.44 0.12 -1.07 0.00 0.00 179.97 178.60 3ggg s PHE 143 N -3.32 3.53 -0.13 3.04 5.36 -1.14 -0.23 117.98 125.09 3ggg s PHE 143 Ca 0.05 0.50 0.01 0.00 -0.96 0.00 0.00 56.93 56.54 3ggg s PHE 143 Cb 0.06 -2.09 0.02 0.00 -0.34 0.00 0.00 43.02 40.67 3ggg s PHE 143 CO 0.64 0.52 -0.15 0.08 -1.46 0.00 0.00 175.22 174.85 3ggg s VAL 144 N -0.37 1.58 0.16 3.12 1.01 0.18 -4.76 120.40 121.31 3ggg s VAL 144 Ca 0.13 -0.67 -0.30 0.00 0.00 0.00 0.00 61.98 61.14 3ggg s VAL 144 Cb -0.12 -1.45 -0.08 0.00 0.00 0.00 0.00 36.38 34.73 3ggg s VAL 144 CO 0.03 0.46 1.26 -0.83 0.00 0.00 0.00 175.10 176.02 3ggg s GLY 145 N 1.19 2.46 0.04 4.51 0.00 -1.26 -3.74 107.32 110.52 3ggg s GLY 145 Ca -0.02 1.01 -0.05 0.00 0.00 0.00 0.00 44.72 45.67 3ggg s GLY 145 CO -0.06 2.03 0.08 -0.32 0.00 0.00 0.00 173.10 174.83 3ggg s GLY 146 N 0.48 0.22 -0.29 0.20 0.00 -1.25 -0.45 107.32 106.22 3ggg s GLY 146 Ca 0.57 -0.67 -0.04 0.00 0.00 0.00 0.00 44.72 44.57 3ggg s GLY 146 CO 0.35 -0.81 0.60 -1.58 0.00 0.00 0.00 173.10 171.66 3ggg s HIS 147 N -2.90 -1.47 0.01 1.90 2.46 -0.06 -3.55 115.29 111.68 3ggg s HIS 147 Ca -0.02 1.86 -0.30 0.00 0.47 0.00 0.00 55.06 57.07 3ggg s HIS 147 Cb 0.01 0.61 -0.03 0.00 -0.13 0.00 0.00 32.58 33.03 3ggg s HIS 147 CO -0.06 -0.80 0.99 -1.25 -2.47 0.00 0.00 174.74 171.15 3ggg s PRO 148 N 2.85 4.57 -1.28 2.88 0.04 -1.26 -0.65 135.00 142.15 3ggg s PRO 148 Ca 0.12 1.44 -0.12 0.00 0.04 0.00 0.00 61.00 62.47 3ggg s PRO 148 Cb -0.14 -3.45 0.15 0.00 0.04 0.00 0.00 34.50 31.10 3ggg s PRO 148 CO -0.20 -0.03 1.75 -0.89 0.04 0.00 0.00 177.00 177.67 3ggg n ILE 149 N 3.80 4.20 -3.56 0.56 2.08 0.54 -4.88 119.36 122.10 3ggg n ILE 149 Ca 0.06 -4.35 -0.16 0.00 0.56 0.00 0.00 62.75 58.85 3ggg n ILE 149 Cb 0.51 -2.42 -0.06 0.00 -0.75 0.00 0.00 39.64 36.92 3ggg n ILE 149 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3ggg s ALA 150 N 1.37 -1.79 0.00 -1.39 0.00 -1.26 -4.39 121.76 114.29 3ggg s ALA 150 Ca 0.43 1.54 0.00 0.00 0.00 0.00 0.00 51.96 53.93 3ggg s ALA 150 Cb 0.05 -0.40 0.00 0.00 0.00 0.00 0.00 23.12 22.77 3ggg s ALA 150 CO 0.00 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 175.82 3ggg n GLY 151 N 1.41 0.81 3.05 0.00 0.00 -1.26 -5.08 105.19 104.10 3ggg n GLY 151 Ca -0.17 -1.83 -0.13 0.00 0.00 0.00 0.00 46.02 43.89 3ggg n GLY 151 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3ggg n THR 152 N 9.00 0.00 1.63 2.61 5.66 -1.26 -5.03 114.28 126.89 3ggg n THR 152 Ca 0.00 -1.62 0.14 0.00 -3.05 0.00 0.00 64.05 59.53 3ggg n THR 152 Cb 0.00 0.99 0.64 0.00 -1.55 0.00 0.00 70.33 70.41 3ggg n THR 152 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 3ggg n GLU 153 N -0.52 1.48 -3.01 1.09 0.00 -1.26 -4.91 120.64 113.50 3ggg n GLU 153 Ca 0.01 -0.69 -0.32 0.00 0.00 0.00 0.00 57.16 56.15 3ggg n GLU 153 Cb 0.53 -1.48 -0.06 0.00 0.00 0.00 0.00 31.44 30.44 3ggg n GLU 153 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 3ggg s LYS 154 N -1.99 3.98 0.16 3.44 -0.14 -1.26 -3.97 119.74 119.96 3ggg s LYS 154 Ca 0.40 0.70 0.07 0.00 -1.36 0.00 0.00 55.97 55.78 3ggg s LYS 154 Cb 0.21 -2.38 -0.04 0.00 -1.68 0.00 0.00 37.83 33.94 3ggg s LYS 154 CO 0.34 0.07 -0.15 -1.12 -0.76 0.00 0.00 175.35 173.73 3ggg s SER 155 N -2.47 2.39 0.00 2.83 0.01 -1.26 -4.89 113.70 110.31 3ggg s SER 155 Ca 0.55 -0.89 0.00 0.00 1.31 0.00 0.00 55.95 56.91 3ggg s SER 155 Cb -0.10 -0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.01 3ggg s SER 155 CO 0.20 -0.12 0.00 0.61 0.41 0.00 0.00 173.24 174.34 3ggg n GLY 156 N 0.17 1.45 0.27 3.44 0.00 -1.26 -4.57 105.19 104.69 3ggg n GLY 156 Ca -0.12 -1.68 0.10 0.00 0.00 0.00 0.00 46.02 44.32 3ggg n GLY 156 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3ggg h VAL 157 N 0.00 0.84 0.00 1.61 3.04 -1.73 -2.33 116.25 117.68 3ggg h VAL 157 Ca 0.00 -0.04 -0.01 0.00 -1.01 0.00 0.00 66.70 65.64 3ggg h VAL 157 Cb 0.00 1.02 -0.00 0.00 -2.01 0.00 0.00 31.29 30.30 3ggg h VAL 157 CO 0.00 0.01 -0.06 -0.33 -1.01 0.00 0.00 177.57 176.18 3ggg h GLU 158 N 0.00 0.00 -0.44 4.17 3.07 -1.89 -1.18 114.58 118.31 3ggg h GLU 158 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3ggg h GLU 158 Cb 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 3ggg h GLU 158 CO 0.00 0.06 0.00 0.66 -1.40 0.00 0.00 179.01 178.33 3ggg n TYR 159 N -4.10 0.58 -1.82 4.33 4.01 -0.88 -5.00 117.16 114.29 3ggg n TYR 159 Ca -0.03 -0.29 -0.35 0.00 -0.16 0.00 0.00 57.90 57.07 3ggg n TYR 159 Cb 0.14 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.23 3ggg n TYR 159 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 3ggg s SER 160 N -1.37 4.88 0.14 7.72 1.04 -0.45 -5.02 113.70 120.64 3ggg s SER 160 Ca 0.40 2.35 0.11 0.00 0.48 0.00 0.00 55.95 59.29 3ggg s SER 160 Cb 0.22 -2.59 -0.04 0.00 0.10 0.00 0.00 66.02 63.71 3ggg s SER 160 CO 0.31 -1.80 -0.25 -0.76 0.98 0.00 0.00 173.24 171.72 3ggg s LEU 161 N -4.46 2.34 0.00 2.42 1.02 -1.26 -4.87 118.68 113.87 3ggg s LEU 161 Ca 0.76 -0.76 0.23 0.00 0.02 0.00 0.00 54.13 54.37 3ggg s LEU 161 Cb -0.29 -1.15 0.63 0.00 0.02 0.00 0.00 46.19 45.39 3ggg s LEU 161 CO 0.37 0.15 1.50 -0.90 0.02 0.00 0.00 176.35 177.49 3ggg n ASP 162 N 0.82 2.32 -1.19 2.29 3.85 -1.26 -3.94 116.55 119.44 3ggg n ASP 162 Ca -0.17 -1.80 0.04 0.00 -0.71 0.00 0.00 54.79 52.15 3ggg n ASP 162 Cb 0.54 -0.12 0.06 0.00 -1.35 0.00 0.00 41.12 40.24 3ggg n ASP 162 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.20 175.73 3ggg n ASN 163 N 0.76 1.08 -0.01 -1.12 2.04 -1.26 -4.01 115.26 112.74 3ggg n ASN 163 Ca 0.17 -2.40 0.18 0.00 -0.44 0.00 0.00 54.58 52.09 3ggg n ASN 163 Cb 0.44 -0.34 0.65 0.00 -2.53 0.00 0.00 39.78 38.00 3ggg n ASN 163 CO 0.00 0.00 0.00 0.25 -0.44 0.00 0.00 177.26 177.07 3ggg h LEU 164 N 0.87 0.08 0.00 -4.53 5.85 -1.90 -3.02 115.31 112.67 3ggg h LEU 164 Ca -0.16 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.57 3ggg h LEU 164 Cb 1.65 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.67 3ggg h LEU 164 CO 0.07 0.05 -0.97 -1.22 -0.34 0.00 0.00 178.44 176.02 3ggg n TYR 165 N -4.41 0.00 -1.70 1.25 4.01 -1.26 -4.71 117.16 110.34 3ggg n TYR 165 Ca 0.10 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.41 3ggg n TYR 165 Cb 0.54 -0.04 -0.03 0.00 -0.31 0.00 0.00 39.34 39.50 3ggg n TYR 165 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 3ggg s GLU 166 N -3.01 3.98 0.00 -0.72 2.12 -1.14 -0.57 118.70 119.35 3ggg s GLU 166 Ca 0.08 2.46 0.00 0.00 0.36 0.00 0.00 54.97 57.87 3ggg s GLU 166 Cb 0.16 -4.18 0.00 0.00 0.26 0.00 0.00 34.13 30.37 3ggg s GLU 166 CO 0.85 -1.14 0.00 0.41 -0.54 0.00 0.00 175.26 174.85 3ggg n GLY 167 N 4.71 0.87 3.87 -1.50 0.00 0.20 -4.96 105.19 108.39 3ggg n GLY 167 Ca 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.88 3ggg n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ggg s LYS 168 N -0.05 3.69 0.43 1.61 -0.14 0.27 -4.85 119.74 120.69 3ggg s LYS 168 Ca 0.00 0.07 -0.25 0.00 -1.36 0.00 0.00 55.97 54.43 3ggg s LYS 168 Cb 0.00 -3.04 -0.08 0.00 -1.68 0.00 0.00 37.83 33.03 3ggg s LYS 168 CO 0.00 0.60 1.26 0.15 -0.76 0.00 0.00 175.35 176.60 3ggg s LYS 169 N -1.81 3.84 -0.13 1.68 1.02 -1.26 -0.53 119.74 122.56 3ggg s LYS 169 Ca 0.30 2.03 0.01 0.00 0.02 0.00 0.00 55.97 58.33 3ggg s LYS 169 Cb -0.14 -2.61 0.02 0.00 -0.52 0.00 0.00 37.83 34.58 3ggg s LYS 169 CO 0.17 -0.56 -0.14 0.08 -0.92 0.00 0.00 175.35 173.99 3ggg s VAL 170 N -1.35 1.48 -0.26 3.17 1.01 -0.43 -0.34 120.40 123.68 3ggg s VAL 170 Ca 0.60 -0.59 -0.14 0.00 0.00 0.00 0.00 61.98 61.84 3ggg s VAL 170 Cb -0.35 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 3ggg s VAL 170 CO 0.44 0.44 0.35 -0.63 0.00 0.00 0.00 175.10 175.70 3ggg s ILE 171 N 1.36 5.20 0.06 2.22 -1.09 0.18 -1.73 121.20 127.40 3ggg s ILE 171 Ca 0.01 0.54 0.01 0.00 -2.23 0.00 0.00 60.65 58.98 3ggg s ILE 171 Cb -0.13 -3.68 -0.04 0.00 -1.58 0.00 0.00 42.46 37.03 3ggg s ILE 171 CO -0.08 0.18 0.15 -0.76 -1.23 0.00 0.00 174.94 173.21 3ggg s LEU 172 N 1.92 4.11 -0.53 2.97 1.43 -0.47 -0.89 118.68 127.23 3ggg s LEU 172 Ca 0.14 0.15 0.07 0.00 -1.03 0.00 0.00 54.13 53.47 3ggg s LEU 172 Cb -0.16 -2.73 0.29 0.00 0.03 0.00 0.00 46.19 43.63 3ggg s LEU 172 CO 0.10 0.18 0.76 0.35 0.23 0.00 0.00 176.35 177.96 3ggg n THR 173 N 0.42 1.59 -1.69 5.49 -2.24 0.40 -1.73 114.28 116.51 3ggg n THR 173 Ca -0.07 -4.99 -0.36 0.00 -2.27 0.00 0.00 64.05 56.36 3ggg n THR 173 Cb 0.51 -1.62 0.07 0.00 -2.10 0.00 0.00 70.33 67.19 3ggg n THR 173 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3ggg s PRO 174 N -2.49 2.50 0.41 -0.78 0.04 -1.26 -4.49 135.00 128.93 3ggg s PRO 174 Ca 0.41 1.89 0.03 0.00 0.04 0.00 0.00 61.00 63.38 3ggg s PRO 174 Cb 0.22 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.87 3ggg s PRO 174 CO -0.08 -1.59 0.10 0.95 0.04 0.00 0.00 177.00 176.42 3ggg s THR 175 N -1.67 0.81 0.38 1.26 -4.23 -1.26 -4.71 115.64 106.22 3ggg s THR 175 Ca 0.78 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 59.47 3ggg s THR 175 Cb -0.33 -2.41 0.38 0.00 1.34 0.00 0.00 72.50 71.49 3ggg s THR 175 CO 0.40 0.00 1.71 0.11 -0.54 0.00 0.00 174.62 176.30 3ggg h LYS 176 N 1.77 0.34 0.00 3.99 1.57 -2.05 -0.83 116.57 121.36 3ggg h LYS 176 Ca -0.38 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 3ggg h LYS 176 Cb 1.27 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.51 3ggg h LYS 176 CO 0.62 0.23 0.00 0.87 -0.57 0.00 0.00 179.45 180.60 3ggg h LYS 177 N 0.35 0.00 -6.88 3.15 1.57 -2.01 -3.47 116.57 109.28 3ggg h LYS 177 Ca 0.68 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.92 3ggg h LYS 177 Cb 1.69 0.00 0.10 0.00 0.08 0.00 0.00 32.23 34.10 3ggg h LYS 177 CO -0.42 0.00 0.84 0.99 -0.57 0.00 0.00 179.45 180.28 3ggg s THR 178 N -3.29 2.02 -0.10 -0.16 2.01 -0.32 -4.90 115.64 110.90 3ggg s THR 178 Ca 0.06 0.02 -0.28 0.00 0.31 0.00 0.00 61.69 61.80 3ggg s THR 178 Cb 0.09 -3.01 -0.02 0.00 0.01 0.00 0.00 72.50 69.57 3ggg s THR 178 CO 0.57 0.00 0.95 -0.62 -0.69 0.00 0.00 174.62 174.84 3ggg s ASP 179 N 0.15 7.19 0.26 3.53 -1.08 -1.26 -4.91 116.67 120.55 3ggg s ASP 179 Ca 0.58 1.45 0.06 0.00 -0.52 0.00 0.00 52.55 54.12 3ggg s ASP 179 Cb -0.47 -2.53 0.34 0.00 -1.46 0.00 0.00 42.92 38.80 3ggg s ASP 179 CO 0.57 -0.40 1.62 0.11 0.52 0.00 0.00 175.17 177.59 3ggg h LYS 180 N 7.09 0.18 -0.34 4.34 1.57 -1.95 -2.23 116.57 125.23 3ggg h LYS 180 Ca -0.32 -0.11 -0.13 0.00 -1.87 0.00 0.00 60.65 58.22 3ggg h LYS 180 Cb 1.15 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.47 3ggg h LYS 180 CO 0.83 0.69 -0.31 0.87 -0.57 0.00 0.00 179.45 180.96 3ggg h LYS 181 N 0.14 0.74 -0.17 3.15 1.57 -2.00 -2.80 116.57 117.20 3ggg h LYS 181 Ca -0.00 -0.33 -0.17 0.00 -1.87 0.00 0.00 60.65 58.27 3ggg h LYS 181 Cb 1.01 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.31 3ggg h LYS 181 CO 0.08 0.95 -0.61 0.00 -0.57 0.00 0.00 179.45 179.30 3ggg h ARG 182 N 0.62 0.58 -0.59 3.15 3.08 -1.85 -1.52 114.38 117.85 3ggg h ARG 182 Ca 0.07 -0.40 0.01 0.00 0.07 0.00 0.00 59.98 59.73 3ggg h ARG 182 Cb 0.83 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.91 3ggg h ARG 182 CO 0.07 1.02 0.39 1.25 -1.07 0.00 0.00 179.97 181.62 3ggg h LEU 183 N 0.43 0.66 -0.10 3.04 5.85 -1.37 0.47 115.31 124.29 3ggg h LEU 183 Ca -0.01 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.72 3ggg h LEU 183 Cb 1.18 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 3ggg h LEU 183 CO 0.12 0.47 -0.04 0.50 -0.34 0.00 0.00 178.44 179.15 3ggg h LYS 184 N 0.78 -0.03 -0.40 1.25 3.64 -1.35 0.00 116.57 120.46 3ggg h LYS 184 Ca 0.22 0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.68 3ggg h LYS 184 Cb -0.06 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 31.69 3ggg h LYS 184 CO -0.06 -0.02 -0.07 1.25 -2.27 0.00 0.00 179.45 178.28 3ggg h LEU 185 N -0.03 -0.31 -0.35 5.20 5.85 -0.69 -1.63 115.31 123.35 3ggg h LEU 185 Ca 0.05 0.11 -0.10 0.00 0.84 0.00 0.00 57.88 58.79 3ggg h LEU 185 Cb 0.11 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 3ggg h LEU 185 CO -0.12 -0.11 -0.15 0.58 -0.34 0.00 0.00 178.44 178.30 3ggg h VAL 186 N 0.03 1.28 -0.30 1.05 2.07 -0.77 0.57 116.25 120.18 3ggg h VAL 186 Ca 0.20 -1.26 0.05 0.00 0.82 0.00 0.00 66.70 66.51 3ggg h VAL 186 Cb 0.29 1.36 -0.05 0.00 -1.52 0.00 0.00 31.29 31.37 3ggg h VAL 186 CO -0.39 0.41 -0.01 0.50 0.02 0.00 0.00 177.57 178.10 3ggg h LYS 187 N 0.51 0.07 -0.59 1.57 3.64 -0.91 -1.27 116.57 119.58 3ggg h LYS 187 Ca 0.08 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3ggg h LYS 187 Cb 0.69 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.46 3ggg h LYS 187 CO 0.05 0.05 0.37 -0.09 -2.27 0.00 0.00 179.45 177.55 3ggg h ARG 188 N 0.07 0.80 -0.69 1.90 9.65 -0.99 -1.41 114.38 123.71 3ggg h ARG 188 Ca 0.15 -0.07 -0.07 0.00 -1.10 0.00 0.00 59.98 58.89 3ggg h ARG 188 Cb 0.20 -0.17 -0.03 0.00 -1.39 0.00 0.00 29.97 28.58 3ggg h ARG 188 CO -0.26 0.56 0.17 0.28 2.80 0.00 0.00 179.97 183.53 3ggg h VAL 189 N 0.80 1.26 -0.01 0.20 2.07 -0.60 -1.05 116.25 118.92 3ggg h VAL 189 Ca 0.21 -0.96 -0.06 0.00 0.82 0.00 0.00 66.70 66.72 3ggg h VAL 189 Cb -0.04 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 3ggg h VAL 189 CO -0.04 0.37 -0.27 -0.50 0.02 0.00 0.00 177.57 177.14 3ggg h TRP 190 N 1.04 0.02 -0.15 1.57 4.06 -0.93 -2.86 115.95 118.70 3ggg h TRP 190 Ca 0.22 -0.00 -0.15 0.00 2.06 0.00 0.00 58.89 61.02 3ggg h TRP 190 Cb 0.36 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 28.52 3ggg h TRP 190 CO 0.03 0.29 -0.48 0.93 -3.56 0.00 0.00 178.44 175.65 3ggg h GLU 191 N 0.02 0.58 -1.00 0.49 5.08 -0.90 0.36 114.58 119.21 3ggg h GLU 191 Ca 0.00 -0.43 0.23 0.00 -1.00 0.00 0.00 59.36 58.16 3ggg h GLU 191 Cb 0.49 0.07 -0.09 0.00 0.50 0.00 0.00 28.75 29.72 3ggg h GLU 191 CO 0.04 1.05 0.63 -0.44 -1.00 0.00 0.00 179.01 179.29 3ggg h ASP 192 N 0.23 0.56 -0.45 1.42 3.32 -1.12 0.12 116.42 120.50 3ggg h ASP 192 Ca -0.02 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3ggg h ASP 192 Cb 1.10 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.64 3ggg h ASP 192 CO 0.10 0.16 0.00 1.33 -1.72 0.00 0.00 179.24 179.11 3ggg n VAL 193 N -4.67 0.60 -0.28 -1.35 0.24 -1.09 -4.80 118.33 106.98 3ggg n VAL 193 Ca 0.24 -0.61 0.00 0.00 -2.04 0.00 0.00 64.34 61.93 3ggg n VAL 193 Cb 0.74 0.33 0.00 0.00 -1.47 0.00 0.00 33.84 33.44 3ggg n VAL 193 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ggg n GLY 194 N 1.24 0.73 3.71 7.63 0.00 0.42 -3.75 105.19 115.18 3ggg n GLY 194 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 3ggg n GLY 194 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ggg s GLY 195 N -1.57 1.91 -0.26 -0.02 0.00 0.12 -0.62 107.32 106.89 3ggg s GLY 195 Ca 0.00 0.61 0.02 0.00 0.00 0.00 0.00 44.72 45.35 3ggg s GLY 195 CO 0.00 1.00 -0.08 0.14 0.00 0.00 0.00 173.10 174.16 3ggg s VAL 196 N -2.48 1.95 0.09 1.40 1.01 0.31 -4.27 120.40 118.41 3ggg s VAL 196 Ca 0.68 -1.54 -0.20 0.00 0.00 0.00 0.00 61.98 60.92 3ggg s VAL 196 Cb -0.23 -2.13 -0.07 0.00 0.00 0.00 0.00 36.38 33.95 3ggg s VAL 196 CO 0.53 -0.09 0.60 -0.69 0.00 0.00 0.00 175.10 175.44 3ggg s VAL 197 N 1.19 4.69 0.18 2.92 1.01 -1.26 -1.31 120.40 127.82 3ggg s VAL 197 Ca -0.07 1.27 -0.04 0.00 0.00 0.00 0.00 61.98 63.15 3ggg s VAL 197 Cb -0.20 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.23 3ggg s VAL 197 CO -0.06 0.53 0.17 -1.83 0.00 0.00 0.00 175.10 173.92 3ggg s GLU 198 N -1.17 1.15 -0.01 2.72 -1.05 -0.70 -4.93 118.70 114.71 3ggg s GLU 198 Ca 0.31 -1.45 0.05 0.00 -0.15 0.00 0.00 54.97 53.72 3ggg s GLU 198 Cb -0.20 0.30 -0.03 0.00 -0.44 0.00 0.00 34.13 33.77 3ggg s GLU 198 CO 0.20 -0.39 -0.14 0.71 0.95 0.00 0.00 175.26 176.59 3ggg s TYR 199 N -4.08 2.68 0.01 4.83 2.02 -1.26 -1.36 117.35 120.20 3ggg s TYR 199 Ca 0.29 -0.17 -0.05 0.00 -0.37 0.00 0.00 57.07 56.77 3ggg s TYR 199 Cb 0.06 -1.57 -0.01 0.00 -0.40 0.00 0.00 41.96 40.04 3ggg s TYR 199 CO 0.07 0.24 0.08 -1.64 -1.57 0.00 0.00 175.55 172.73 3ggg s MET 200 N -1.11 0.44 0.65 -0.62 -1.94 -0.71 -4.94 119.30 111.07 3ggg s MET 200 Ca 0.14 -0.51 -0.18 0.00 -1.71 0.00 0.00 55.69 53.43 3ggg s MET 200 Cb -0.11 0.18 -0.01 0.00 2.01 0.00 0.00 34.83 36.90 3ggg s MET 200 CO 0.04 -0.10 1.28 -1.54 -0.01 0.00 0.00 175.02 174.69 3ggg s SER 201 N -1.50 4.62 0.40 3.03 1.04 -1.26 -4.13 113.70 115.89 3ggg s SER 201 Ca -0.14 2.58 0.17 0.00 0.48 0.00 0.00 55.95 59.05 3ggg s SER 201 Cb -0.08 -2.61 1.07 0.00 0.10 0.00 0.00 66.02 64.50 3ggg s SER 201 CO 0.00 -1.99 1.79 -0.65 0.98 0.00 0.00 173.24 173.37 3ggg h PRO 202 N 0.51 0.42 0.02 4.02 0.11 -1.84 -1.55 132.00 133.69 3ggg h PRO 202 Ca -0.51 -0.03 -0.20 0.00 0.11 0.00 0.00 66.00 65.38 3ggg h PRO 202 Cb 1.33 -0.09 0.02 0.00 0.11 0.00 0.00 31.00 32.36 3ggg h PRO 202 CO 0.53 0.28 -0.79 0.93 -0.21 0.00 0.00 178.00 178.74 3ggg h GLU 203 N 0.43 0.50 -0.36 1.05 3.07 -1.90 -1.83 114.58 115.53 3ggg h GLU 203 Ca 0.56 -0.56 0.01 0.00 -0.50 0.00 0.00 59.36 58.87 3ggg h GLU 203 Cb 1.37 0.17 -0.02 0.00 -0.84 0.00 0.00 28.75 29.42 3ggg h GLU 203 CO -0.27 1.20 0.22 1.25 -1.40 0.00 0.00 179.01 180.01 3ggg h LEU 204 N 0.04 0.36 -0.65 1.33 5.85 -1.81 -2.15 115.31 118.28 3ggg h LEU 204 Ca -0.10 0.00 0.13 0.00 0.84 0.00 0.00 57.88 58.74 3ggg h LEU 204 Cb 1.49 -0.08 -0.12 0.00 0.37 0.00 0.00 40.66 42.32 3ggg h LEU 204 CO 0.15 0.26 -0.19 -0.74 -0.34 0.00 0.00 178.44 177.58 3ggg h HIS 205 N 0.45 -0.44 0.00 1.25 2.76 -1.35 0.26 115.15 118.07 3ggg h HIS 205 Ca 0.14 0.06 -0.09 0.00 -2.20 0.00 0.00 60.37 58.29 3ggg h HIS 205 Cb -0.01 0.29 -0.01 0.00 1.55 0.00 0.00 27.41 29.24 3ggg h HIS 205 CO -0.07 -0.30 -0.41 -0.44 -1.30 0.00 0.00 177.93 175.41 3ggg h ASP 206 N -0.03 0.00 0.35 3.26 3.32 -1.32 -0.66 116.42 121.34 3ggg h ASP 206 Ca 0.30 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.34 3ggg h ASP 206 Cb 0.50 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.05 3ggg h ASP 206 CO -0.68 0.41 -0.17 0.22 -1.72 0.00 0.00 179.24 177.30 3ggg h TYR 207 N 0.00 -0.43 -0.20 4.55 3.20 -0.72 -1.91 116.97 121.46 3ggg h TYR 207 Ca -0.00 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 3ggg h TYR 207 Cb 0.85 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 39.25 3ggg h TYR 207 CO 0.00 -0.10 0.12 0.28 -1.64 0.00 0.00 178.16 176.82 3ggg h VAL 208 N -0.85 1.09 0.00 1.81 2.07 -0.62 -2.77 116.25 116.98 3ggg h VAL 208 Ca -0.05 -0.22 -0.07 0.00 0.82 0.00 0.00 66.70 67.18 3ggg h VAL 208 Cb 0.53 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 3ggg h VAL 208 CO 0.08 0.08 -0.33 -0.26 0.02 0.00 0.00 177.57 177.16 3ggg h PHE 209 N 0.24 0.00 -0.56 1.57 0.04 -1.25 -1.08 116.94 115.89 3ggg h PHE 209 Ca 0.07 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.79 3ggg h PHE 209 Cb 0.03 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.16 3ggg h PHE 209 CO -0.05 0.33 0.14 0.78 -0.60 0.00 0.00 178.31 178.92 3ggg h GLY 210 N 3.01 0.93 0.09 -1.45 0.00 -1.08 0.12 103.07 104.69 3ggg h GLY 210 Ca -0.00 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 46.78 3ggg h GLY 210 CO 0.04 0.50 -0.04 -2.08 0.00 0.00 0.00 176.54 174.97 3ggg h VAL 211 N 0.83 1.74 -0.01 4.60 2.07 -1.36 0.64 116.25 124.76 3ggg h VAL 211 Ca 0.18 -2.23 0.00 0.00 0.82 0.00 0.00 66.70 65.47 3ggg h VAL 211 Cb 0.30 3.26 0.00 0.00 -1.52 0.00 0.00 31.29 33.32 3ggg h VAL 211 CO -0.00 0.58 -0.22 1.33 0.02 0.00 0.00 177.57 179.28 3ggg n VAL 212 N -4.61 0.00 0.04 2.57 0.24 -0.42 -4.15 118.33 112.00 3ggg n VAL 212 Ca -0.10 -0.18 0.00 0.00 -2.04 0.00 0.00 64.34 62.02 3ggg n VAL 212 Cb 0.47 0.54 0.00 0.00 -1.47 0.00 0.00 33.84 33.39 3ggg n VAL 212 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 3ggg n SER 213 N -0.36 -0.01 -0.03 -1.34 2.88 -0.53 -4.72 113.62 109.51 3ggg n SER 213 Ca 0.13 0.15 -0.11 0.00 -1.33 0.00 0.00 58.87 57.70 3ggg n SER 213 Cb 0.37 0.11 -0.06 0.00 -0.75 0.00 0.00 64.21 63.88 3ggg n SER 213 CO 0.00 0.00 0.00 0.45 -1.23 0.00 0.00 175.04 174.26 3ggg h HIS 214 N 0.00 0.19 0.11 0.66 3.86 -0.82 -2.62 115.15 116.53 3ggg h HIS 214 Ca 0.00 -0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.21 3ggg h HIS 214 Cb 0.08 -0.06 -0.04 0.00 1.06 0.00 0.00 27.41 28.46 3ggg h HIS 214 CO 0.00 0.31 -0.29 1.25 0.86 0.00 0.00 177.93 180.06 3ggg h LEU 215 N 0.02 -0.84 -1.40 2.43 5.85 -1.02 -1.79 115.31 118.56 3ggg h LEU 215 Ca 0.04 0.10 0.13 0.00 0.84 0.00 0.00 57.88 58.99 3ggg h LEU 215 Cb 0.21 0.32 -0.06 0.00 0.37 0.00 0.00 40.66 41.50 3ggg h LEU 215 CO -0.00 -0.38 0.54 -0.65 -0.34 0.00 0.00 178.44 177.61 3ggg h PRO 216 N -0.50 0.59 -0.03 5.25 0.11 -1.73 0.11 132.00 135.80 3ggg h PRO 216 Ca 0.03 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.10 3ggg h PRO 216 Cb 0.54 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.51 3ggg h PRO 216 CO -0.18 0.39 0.01 0.45 -0.21 0.00 0.00 178.00 178.46 3ggg h HIS 217 N 0.61 0.05 -0.43 0.65 3.86 -1.18 -0.49 115.15 118.22 3ggg h HIS 217 Ca 0.40 -0.01 0.09 0.00 -1.16 0.00 0.00 60.37 59.69 3ggg h HIS 217 Cb 0.70 -0.01 -0.08 0.00 1.06 0.00 0.00 27.41 29.07 3ggg h HIS 217 CO -0.00 0.28 -0.11 0.00 0.86 0.00 0.00 177.93 178.95 3ggg h ALA 218 N 0.77 0.27 -0.83 2.45 0.00 -0.42 -0.19 119.26 121.31 3ggg h ALA 218 Ca 0.01 0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.11 3ggg h ALA 218 Cb 0.25 0.34 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 3ggg h ALA 218 CO 0.00 -0.45 0.54 0.28 0.00 0.00 0.00 179.25 179.62 3ggg h VAL 219 N -0.01 1.17 -0.38 0.00 2.07 -0.72 -0.97 116.25 117.42 3ggg h VAL 219 Ca 0.21 -0.37 -0.09 0.00 0.82 0.00 0.00 66.70 67.27 3ggg h VAL 219 Cb 0.32 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.07 3ggg h VAL 219 CO -0.44 0.20 -0.10 0.00 0.02 0.00 0.00 177.57 177.25 3ggg h ALA 220 N 1.33 0.52 -0.20 1.67 0.00 -0.27 -1.92 119.26 120.38 3ggg h ALA 220 Ca 0.32 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.94 3ggg h ALA 220 Cb -0.06 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3ggg h ALA 220 CO -0.09 0.39 0.04 0.74 0.00 0.00 0.00 179.25 180.33 3ggg h PHE 221 N 0.54 0.07 0.00 0.00 0.04 -0.66 -1.94 116.94 114.99 3ggg h PHE 221 Ca 0.10 0.01 -0.06 0.00 2.80 0.00 0.00 57.97 60.82 3ggg h PHE 221 Cb 0.61 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.75 3ggg h PHE 221 CO 0.05 0.03 -0.26 0.00 -0.60 0.00 0.00 178.31 177.52 3ggg h ALA 222 N 1.14 1.10 -0.10 2.45 0.00 -1.11 -0.05 119.26 122.69 3ggg h ALA 222 Ca 0.09 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 3ggg h ALA 222 Cb 0.08 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3ggg h ALA 222 CO -0.11 0.33 -0.09 1.25 0.00 0.00 0.00 179.25 180.63 3ggg h LEU 223 N 0.00 0.24 -1.10 0.00 5.85 -1.05 0.21 115.31 119.46 3ggg h LEU 223 Ca -0.00 -0.47 -0.02 0.00 0.84 0.00 0.00 57.88 58.22 3ggg h LEU 223 Cb 0.69 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.62 3ggg h LEU 223 CO 0.03 0.66 0.32 0.58 -0.34 0.00 0.00 178.44 179.70 3ggg h VAL 224 N -0.17 1.22 0.00 1.05 2.07 -0.79 -1.92 116.25 117.71 3ggg h VAL 224 Ca 0.02 -0.61 -0.09 0.00 0.82 0.00 0.00 66.70 66.84 3ggg h VAL 224 Cb 0.59 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 3ggg h VAL 224 CO 0.02 0.26 -0.44 -0.78 0.02 0.00 0.00 177.57 176.65 3ggg h ASP 225 N 0.96 0.00 -0.54 0.57 3.58 -0.68 -2.39 116.42 117.91 3ggg h ASP 225 Ca 0.23 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.69 3ggg h ASP 225 Cb 0.10 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.12 3ggg h ASP 225 CO -0.03 0.44 0.35 0.74 -2.88 0.00 0.00 179.24 177.86 3ggg h THR 226 N 0.00 1.15 0.00 2.25 2.02 0.21 -1.95 112.91 116.59 3ggg h THR 226 Ca -0.00 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.89 3ggg h THR 226 Cb 0.85 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 3ggg h THR 226 CO 0.06 0.14 0.00 -0.07 0.37 0.00 0.00 175.52 176.02 3ggg h LEU 227 N 0.73 0.00 -0.09 2.58 3.38 -1.18 -1.89 115.31 118.84 3ggg h LEU 227 Ca 0.20 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 3ggg h LEU 227 Cb -0.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 3ggg h LEU 227 CO -0.04 0.00 -0.01 0.40 0.09 0.00 0.00 178.44 178.88 3ggg h ILE 228 N 0.00 1.28 -0.01 1.22 2.04 -1.25 -2.87 117.51 117.91 3ggg h ILE 228 Ca 0.00 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 64.98 3ggg h ILE 228 Cb 0.46 1.69 0.00 0.00 -0.74 0.00 0.00 36.82 38.23 3ggg h ILE 228 CO 0.00 0.25 -0.33 0.00 0.00 0.00 0.00 178.15 178.06 3ggg n HIS 229 N -4.80 0.00 1.06 1.37 1.44 -1.06 -3.11 115.22 110.11 3ggg n HIS 229 Ca -0.06 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.76 3ggg n HIS 229 Cb 0.22 -0.06 0.09 0.00 0.12 0.00 0.00 29.99 30.36 3ggg n HIS 229 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 3ggg n MET 230 N -0.30 1.31 -1.53 -1.40 2.81 -0.73 -4.89 117.12 112.38 3ggg n MET 230 Ca 0.11 -1.04 -0.31 0.00 -1.81 0.00 0.00 57.70 54.66 3ggg n MET 230 Cb 0.41 -1.48 0.06 0.00 -0.71 0.00 0.00 33.22 31.50 3ggg n MET 230 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 3ggg s SER 231 N -2.40 5.12 0.29 7.83 0.01 -1.08 -4.90 113.70 118.56 3ggg s SER 231 Ca 0.21 1.59 -0.08 0.00 1.31 0.00 0.00 55.95 58.99 3ggg s SER 231 Cb 0.19 -2.42 -0.00 0.00 0.21 0.00 0.00 66.02 63.99 3ggg s SER 231 CO 0.52 -1.61 0.46 0.42 0.41 0.00 0.00 173.24 173.44 3ggg s THR 232 N -3.05 0.00 0.56 1.44 -4.23 -0.40 -4.96 115.64 105.02 3ggg s THR 232 Ca 0.59 -1.52 0.28 0.00 -1.18 0.00 0.00 61.69 59.85 3ggg s THR 232 Cb -0.14 -2.45 0.39 0.00 1.34 0.00 0.00 72.50 71.64 3ggg s THR 232 CO 0.55 0.00 1.98 -0.65 -0.54 0.00 0.00 174.62 175.96 3ggg h PRO 233 N 2.22 0.00 -0.21 3.99 0.11 -2.02 -1.30 132.00 134.80 3ggg h PRO 233 Ca -0.28 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.64 3ggg h PRO 233 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3ggg h PRO 233 CO 0.39 0.00 -0.60 0.93 -0.21 0.00 0.00 178.00 178.50 3ggg h GLU 234 N 0.00 0.78 -2.59 1.05 5.08 -2.00 -3.48 114.58 113.42 3ggg h GLU 234 Ca 0.22 -0.56 -0.10 0.00 -1.00 0.00 0.00 59.36 57.92 3ggg h GLU 234 Cb 1.01 0.09 -0.25 0.00 0.50 0.00 0.00 28.75 30.10 3ggg h GLU 234 CO -0.00 1.18 -0.23 0.54 -1.00 0.00 0.00 179.01 179.50 3ggg s VAL 235 N -3.94 -0.01 -0.52 3.13 0.11 -0.49 -5.11 120.40 113.57 3ggg s VAL 235 Ca -0.11 0.05 -0.19 0.00 -2.93 0.00 0.00 61.98 58.80 3ggg s VAL 235 Cb 0.09 -0.65 0.07 0.00 -1.53 0.00 0.00 36.38 34.36 3ggg s VAL 235 CO 0.88 0.02 0.62 -0.62 -3.33 0.00 0.00 175.10 172.67 3ggg s ASP 236 N 0.94 6.20 0.54 3.54 -1.08 -1.26 -1.27 116.67 124.28 3ggg s ASP 236 Ca -0.06 -1.11 0.26 0.00 -0.52 0.00 0.00 52.55 51.13 3ggg s ASP 236 Cb -0.06 -2.28 1.56 0.00 -1.46 0.00 0.00 42.92 40.68 3ggg s ASP 236 CO -0.08 -0.92 2.15 -0.07 0.52 0.00 0.00 175.17 176.77 3ggg h LEU 237 N 9.64 0.00 -0.13 -1.34 3.38 -1.91 -1.87 115.31 123.09 3ggg h LEU 237 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3ggg h LEU 237 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3ggg h LEU 237 CO 0.99 0.07 0.00 0.49 0.09 0.00 0.00 178.44 180.08 3ggg n PHE 238 N -3.84 0.12 0.75 1.13 3.72 -1.26 -1.21 117.46 116.86 3ggg n PHE 238 Ca -0.02 0.05 0.10 0.00 -0.05 0.00 0.00 57.45 57.52 3ggg n PHE 238 Cb 0.16 -0.58 0.45 0.00 -0.94 0.00 0.00 39.48 38.58 3ggg n PHE 238 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3ggg n LYS 239 N -1.61 0.04 -0.06 -1.08 5.02 -0.70 -4.67 118.16 115.09 3ggg n LYS 239 Ca 0.03 0.14 -0.07 0.00 -2.02 0.00 0.00 58.31 56.39 3ggg n LYS 239 Cb 0.14 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.56 3ggg n LYS 239 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3ggg n TYR 240 N -1.47 0.00 -1.41 2.13 4.02 -0.35 -5.08 117.16 114.99 3ggg n TYR 240 Ca 0.06 0.00 -0.55 0.00 -0.01 0.00 0.00 57.90 57.39 3ggg n TYR 240 Cb 0.23 -0.60 -0.08 0.00 -0.02 0.00 0.00 39.34 38.88 3ggg n TYR 240 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 3ggg n PRO 241 N -2.52 0.00 0.14 -0.72 -0.01 -1.26 -4.97 135.00 125.66 3ggg n PRO 241 Ca -0.21 0.00 0.02 0.00 -0.01 0.00 0.00 63.50 63.31 3ggg n PRO 241 Cb 0.88 -1.36 0.03 0.00 -0.01 0.00 0.00 33.50 33.04 3ggg n PRO 241 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 175.50 176.27 3ggg h GLY 242 N 3.15 0.00 0.00 -1.23 0.00 -1.99 -3.47 103.07 99.53 3ggg h GLY 242 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 3ggg h GLY 242 CO 0.66 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.81 3ggg n GLY 243 N 1.21 1.14 0.00 4.60 0.00 -1.26 -4.88 105.19 105.99 3ggg n GLY 243 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3ggg n GLY 243 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ggg n GLY 244 N -0.45 -2.05 0.33 -0.02 0.00 -1.26 -3.72 105.19 98.01 3ggg n GLY 244 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 3ggg n GLY 244 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3ggg h PHE 245 N 0.00 1.09 0.36 1.61 3.57 -1.92 -2.74 116.94 118.92 3ggg h PHE 245 Ca 0.00 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 3ggg h PHE 245 Cb 0.00 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 38.38 3ggg h PHE 245 CO 0.06 0.70 -0.17 -0.22 -2.23 0.00 0.00 178.31 176.44 3ggg h LYS 246 N 1.17 -0.47 -0.16 1.11 3.64 -1.90 -2.55 116.57 117.42 3ggg h LYS 246 Ca 0.31 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.72 3ggg h LYS 246 Cb -0.12 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 3ggg h LYS 246 CO -0.07 -0.19 0.07 -0.44 -2.27 0.00 0.00 179.45 176.55 3ggg h ASP 247 N -0.70 0.21 0.04 4.20 3.32 -1.63 -2.38 116.42 119.47 3ggg h ASP 247 Ca -0.05 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.85 3ggg h ASP 247 Cb 0.49 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.99 3ggg h ASP 247 CO 0.08 0.30 0.00 0.49 -1.72 0.00 0.00 179.24 178.39 3ggg n PHE 248 N -4.88 0.51 -0.68 4.55 3.72 -1.04 -3.32 117.46 116.33 3ggg n PHE 248 Ca -0.05 0.26 0.04 0.00 -0.05 0.00 0.00 57.45 57.65 3ggg n PHE 248 Cb 0.11 -0.92 0.05 0.00 -0.94 0.00 0.00 39.48 37.78 3ggg n PHE 248 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 3ggg n THR 249 N -2.02 1.11 -0.15 4.37 5.66 -0.91 -4.65 114.28 117.69 3ggg n THR 249 Ca -0.01 -1.24 -0.02 0.00 -3.05 0.00 0.00 64.05 59.73 3ggg n THR 249 Cb 0.03 0.30 0.21 0.00 -1.55 0.00 0.00 70.33 69.32 3ggg n THR 249 CO 0.00 0.00 0.00 -0.09 -3.05 0.00 0.00 175.07 171.93 3ggg h ARG 250 N 0.00 0.86 0.00 1.09 2.43 -1.52 -2.25 114.38 114.98 3ggg h ARG 250 Ca 0.00 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.03 3ggg h ARG 250 Cb 0.82 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.22 3ggg h ARG 250 CO 0.00 0.72 0.00 0.44 -1.51 0.00 0.00 179.97 179.62 3ggg n ILE 251 N -4.31 0.40 0.88 1.20 -5.35 -1.26 -1.84 119.36 109.07 3ggg n ILE 251 Ca 0.05 0.10 0.11 0.00 -0.27 0.00 0.00 62.75 62.74 3ggg n ILE 251 Cb 0.18 -0.72 0.52 0.00 -1.74 0.00 0.00 39.64 37.87 3ggg n ILE 251 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3ggg n ALA 252 N -1.41 2.09 1.77 -1.28 0.00 -0.85 -2.16 120.51 118.67 3ggg n ALA 252 Ca 0.08 -0.09 0.11 0.00 0.00 0.00 0.00 53.44 53.54 3ggg n ALA 252 Cb 0.23 -1.37 0.58 0.00 0.00 0.00 0.00 19.45 18.88 3ggg n ALA 252 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3ggg n LYS 253 N -1.44 1.23 -1.16 0.00 5.02 -0.77 -4.96 118.16 116.09 3ggg n LYS 253 Ca 0.07 -0.35 -0.30 0.00 -2.02 0.00 0.00 58.31 55.72 3ggg n LYS 253 Cb 0.25 -1.37 0.14 0.00 -0.02 0.00 0.00 35.03 34.02 3ggg n LYS 253 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3ggg s SER 254 N -1.69 3.43 -0.06 4.39 0.01 -0.92 -4.81 113.70 114.04 3ggg s SER 254 Ca 0.34 1.55 -0.30 0.00 1.31 0.00 0.00 55.95 58.85 3ggg s SER 254 Cb 0.16 -2.22 -0.05 0.00 0.21 0.00 0.00 66.02 64.12 3ggg s SER 254 CO 0.27 -2.68 1.54 -0.62 0.41 0.00 0.00 173.24 172.16 3ggg s ASP 255 N -3.34 6.75 0.31 2.44 2.15 -1.26 -4.94 116.67 118.77 3ggg s ASP 255 Ca 0.64 2.12 -0.01 0.00 0.43 0.00 0.00 52.55 55.72 3ggg s ASP 255 Cb -0.18 -2.54 0.49 0.00 -0.30 0.00 0.00 42.92 40.39 3ggg s ASP 255 CO 0.57 -0.86 1.96 -0.65 -0.17 0.00 0.00 175.17 176.02 3ggg h PRO 256 N 8.97 1.03 -0.32 4.34 0.11 -1.97 -1.72 132.00 142.45 3ggg h PRO 256 Ca -0.36 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 65.65 3ggg h PRO 256 Cb 1.16 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 32.03 3ggg h PRO 256 CO 0.95 0.68 0.09 0.82 -0.21 0.00 0.00 178.00 180.33 3ggg h ILE 257 N 1.07 1.21 -0.78 4.15 2.04 -1.99 0.20 117.51 123.41 3ggg h ILE 257 Ca 0.32 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 3ggg h ILE 257 Cb -0.02 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 37.09 3ggg h ILE 257 CO -0.09 0.24 0.45 -0.03 0.00 0.00 0.00 178.15 178.72 3ggg h MET 258 N 0.36 1.07 0.00 2.37 4.05 -1.87 -2.52 114.93 118.40 3ggg h MET 258 Ca 0.10 -0.11 -0.18 0.00 -0.28 0.00 0.00 59.70 59.23 3ggg h MET 258 Cb 0.27 -0.22 0.01 0.00 -0.80 0.00 0.00 31.60 30.87 3ggg h MET 258 CO -0.00 0.78 -0.69 -1.49 0.23 0.00 0.00 176.91 175.73 3ggg h TRP 259 N 1.07 0.69 -0.51 1.39 4.06 -1.22 -1.75 115.95 119.67 3ggg h TRP 259 Ca 0.28 -0.38 0.10 0.00 2.06 0.00 0.00 58.89 60.95 3ggg h TRP 259 Cb -0.00 -0.08 -0.08 0.00 -1.00 0.00 0.00 29.16 28.00 3ggg h TRP 259 CO -0.00 1.20 0.02 -0.09 -3.56 0.00 0.00 178.44 176.01 3ggg h ARG 260 N -0.02 0.13 -0.44 0.49 2.43 -0.62 0.67 114.38 117.03 3ggg h ARG 260 Ca -0.09 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.06 3ggg h ARG 260 Cb 1.40 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.90 3ggg h ARG 260 CO 0.14 0.09 0.23 -0.44 -1.51 0.00 0.00 179.97 178.48 3ggg h ASP 261 N 0.14 0.55 -0.38 -3.80 3.45 -1.49 -1.86 116.42 113.03 3ggg h ASP 261 Ca 0.26 -0.10 0.04 0.00 0.43 0.00 0.00 57.03 57.66 3ggg h ASP 261 Cb 0.39 -0.14 -0.04 0.00 -0.56 0.00 0.00 39.33 38.99 3ggg h ASP 261 CO -0.41 0.49 0.17 0.40 -1.57 0.00 0.00 179.24 178.32 3ggg h ILE 262 N 0.57 0.94 -0.45 0.35 2.04 -1.02 -1.61 117.51 118.34 3ggg h ILE 262 Ca 0.15 -0.12 -0.05 0.00 1.00 0.00 0.00 64.86 65.84 3ggg h ILE 262 Cb 0.07 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.69 3ggg h ILE 262 CO -0.02 0.06 0.05 -0.26 0.00 0.00 0.00 178.15 177.98 3ggg h PHE 263 N 0.35 0.74 0.22 1.37 0.04 -0.66 -1.42 116.94 117.57 3ggg h PHE 263 Ca 0.17 -0.08 -0.34 0.00 2.80 0.00 0.00 57.97 60.52 3ggg h PHE 263 Cb 0.10 -0.21 0.03 0.00 2.20 0.00 0.00 35.95 38.07 3ggg h PHE 263 CO -0.12 0.66 -1.56 -0.07 -0.60 0.00 0.00 178.31 176.63 3ggg h LEU 264 N 0.68 0.72 -0.86 1.54 3.38 -1.27 -2.82 115.31 116.69 3ggg h LEU 264 Ca 0.14 -0.87 -0.10 0.00 0.09 0.00 0.00 57.88 57.15 3ggg h LEU 264 Cb 0.34 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3ggg h LEU 264 CO 0.01 1.70 -0.23 -0.08 0.09 0.00 0.00 178.44 179.93 3ggg h GLU 265 N 0.13 0.59 -0.75 1.13 4.57 -1.21 -3.07 114.58 115.97 3ggg h GLU 265 Ca -0.28 -0.22 -0.48 0.00 -1.18 0.00 0.00 59.36 57.20 3ggg h GLU 265 Cb 2.13 -0.03 -0.27 0.00 -0.16 0.00 0.00 28.75 30.41 3ggg h GLU 265 CO 0.24 0.78 0.17 -1.71 -1.18 0.00 0.00 179.01 177.30 3ggg n ASN 266 N -4.12 4.86 0.00 1.04 4.05 -0.54 -4.83 115.26 115.72 3ggg n ASN 266 Ca -0.00 -3.76 -0.10 0.00 0.45 0.00 0.00 54.58 51.18 3ggg n ASN 266 Cb 0.41 -0.71 -0.03 0.00 1.23 0.00 0.00 39.78 40.68 3ggg n ASN 266 CO 0.00 0.00 0.00 0.50 -3.05 0.00 0.00 177.26 174.71 3ggg h LYS 267 N 1.58 -0.30 -0.07 1.20 3.64 -1.39 0.84 116.57 122.06 3ggg h LYS 267 Ca 0.45 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.85 3ggg h LYS 267 Cb 1.57 0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 33.45 3ggg h LYS 267 CO 0.97 -0.20 0.04 0.93 -2.27 0.00 0.00 179.45 178.92 3ggg h GLU 268 N -0.32 0.10 -0.37 1.90 5.08 -1.88 0.06 114.58 119.16 3ggg h GLU 268 Ca 0.10 -0.01 -0.17 0.00 -1.00 0.00 0.00 59.36 58.29 3ggg h GLU 268 Cb 0.47 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 3ggg h GLU 268 CO -0.31 0.10 -0.42 -0.91 -1.00 0.00 0.00 179.01 176.47 3ggg h ASN 269 N 0.06 1.01 -0.84 1.42 4.21 -1.85 -1.67 115.58 117.92 3ggg h ASN 269 Ca 0.03 -0.48 0.08 0.00 1.21 0.00 0.00 56.30 57.13 3ggg h ASN 269 Cb 0.03 -0.28 -0.07 0.00 -1.12 0.00 0.00 38.32 36.88 3ggg h ASN 269 CO -0.00 1.28 0.50 0.58 -1.29 0.00 0.00 177.43 178.50 3ggg h VAL 270 N 0.75 0.97 0.16 2.81 2.07 -0.72 0.32 116.25 122.60 3ggg h VAL 270 Ca 0.05 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 3ggg h VAL 270 Cb 1.02 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 3ggg h VAL 270 CO 0.10 0.16 -0.08 0.24 0.02 0.00 0.00 177.57 178.01 3ggg h MET 271 N 0.87 -0.21 -0.94 1.57 2.86 -0.71 -1.05 114.93 117.34 3ggg h MET 271 Ca 0.39 0.01 0.18 0.00 -2.06 0.00 0.00 59.70 58.22 3ggg h MET 271 Cb 0.28 0.05 -0.08 0.00 0.06 0.00 0.00 31.60 31.91 3ggg h MET 271 CO -0.21 0.02 0.60 0.87 1.06 0.00 0.00 176.91 179.24 3ggg h LYS 272 N -0.41 0.59 0.02 1.72 1.57 -1.00 -1.67 116.57 117.39 3ggg h LYS 272 Ca -0.02 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3ggg h LYS 272 Cb 0.32 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3ggg h LYS 272 CO 0.04 0.39 -0.01 0.00 -0.57 0.00 0.00 179.45 179.30 3ggg h ALA 273 N 1.61 -0.02 -0.61 3.86 0.00 -0.57 -0.60 119.26 122.93 3ggg h ALA 273 Ca 0.50 -0.28 0.10 0.00 0.00 0.00 0.00 54.91 55.23 3ggg h ALA 273 Cb 0.95 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.67 3ggg h ALA 273 CO -0.25 -0.23 0.21 0.82 0.00 0.00 0.00 179.25 179.80 3ggg h ILE 274 N -0.59 0.75 -0.22 0.00 2.04 -1.02 0.15 117.51 118.62 3ggg h ILE 274 Ca -0.00 -0.13 -0.09 0.00 1.00 0.00 0.00 64.86 65.64 3ggg h ILE 274 Cb 0.56 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 3ggg h ILE 274 CO 0.00 0.07 -0.24 1.05 0.00 0.00 0.00 178.15 179.03 3ggg h GLU 275 N 0.38 0.40 -0.38 2.37 4.11 -1.28 0.84 114.58 121.03 3ggg h GLU 275 Ca 0.31 -0.14 0.03 0.00 0.07 0.00 0.00 59.36 59.62 3ggg h GLU 275 Cb 0.40 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 3ggg h GLU 275 CO -0.32 0.62 0.19 0.78 0.07 0.00 0.00 179.01 180.35 3ggg h GLY 276 N 1.00 0.52 0.76 1.06 0.00 0.13 -1.83 103.07 104.71 3ggg h GLY 276 Ca 0.06 -0.14 0.03 0.00 0.00 0.00 0.00 47.33 47.28 3ggg h GLY 276 CO 0.04 0.10 0.05 -2.75 0.00 0.00 0.00 176.54 173.99 3ggg h PHE 277 N 0.40 0.09 -0.56 5.60 3.57 0.02 -1.84 116.94 124.22 3ggg h PHE 277 Ca 0.16 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.74 3ggg h PHE 277 Cb 0.06 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 3ggg h PHE 277 CO -0.10 0.03 0.37 0.93 -2.23 0.00 0.00 178.31 177.31 3ggg h GLU 278 N 0.14 0.49 -0.11 1.11 5.08 -0.73 0.16 114.58 120.73 3ggg h GLU 278 Ca 0.10 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 3ggg h GLU 278 Cb 0.09 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 3ggg h GLU 278 CO -0.13 0.32 0.01 -0.22 -1.00 0.00 0.00 179.01 178.00 3ggg h LYS 279 N 0.50 0.18 -0.88 2.33 3.64 -0.70 -0.77 116.57 120.87 3ggg h LYS 279 Ca 0.24 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.55 3ggg h LYS 279 Cb 0.32 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.07 3ggg h LYS 279 CO -0.07 0.39 0.46 0.77 -2.27 0.00 0.00 179.45 178.73 3ggg h SER 280 N -0.06 1.12 -0.43 4.20 0.02 -0.30 -2.08 113.55 116.02 3ggg h SER 280 Ca 0.03 -0.11 -0.11 0.00 -0.84 0.00 0.00 61.79 60.76 3ggg h SER 280 Cb 0.30 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 3ggg h SER 280 CO 0.00 0.91 -0.17 0.25 -1.14 0.00 0.00 176.83 176.69 3ggg h LEU 281 N 1.24 0.90 -0.56 5.07 5.85 -0.69 -1.86 115.31 125.26 3ggg h LEU 281 Ca 0.31 -0.39 -0.10 0.00 0.84 0.00 0.00 57.88 58.54 3ggg h LEU 281 Cb 0.06 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 3ggg h LEU 281 CO -0.05 1.08 -0.02 0.78 -0.34 0.00 0.00 178.44 179.89 3ggg h ASN 282 N 0.71 1.00 -0.70 1.25 -0.26 -0.98 0.40 115.58 116.99 3ggg h ASN 282 Ca 0.10 -0.32 0.05 0.00 -0.56 0.00 0.00 56.30 55.58 3ggg h ASN 282 Cb 0.72 -0.27 -0.05 0.00 -1.06 0.00 0.00 38.32 37.66 3ggg h ASN 282 CO 0.05 1.07 0.41 -0.74 -1.06 0.00 0.00 177.43 177.17 3ggg h HIS 283 N 0.90 0.77 -0.02 1.19 2.76 -1.29 0.95 115.15 120.40 3ggg h HIS 283 Ca 0.16 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.35 3ggg h HIS 283 Cb 0.57 -0.24 -0.00 0.00 1.55 0.00 0.00 27.41 29.29 3ggg h HIS 283 CO 0.04 0.39 0.02 1.25 -1.30 0.00 0.00 177.93 178.33 3ggg h LEU 284 N 0.78 0.03 -1.40 0.26 5.85 -0.47 -1.38 115.31 118.98 3ggg h LEU 284 Ca 0.30 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.97 3ggg h LEU 284 Cb 0.14 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 3ggg h LEU 284 CO -0.16 0.03 -0.09 0.07 -0.34 0.00 0.00 178.44 177.95 3ggg h LYS 285 N 0.02 0.28 -0.60 1.25 2.10 -0.49 -1.14 116.57 118.00 3ggg h LYS 285 Ca 0.01 -0.06 -0.00 0.00 -2.00 0.00 0.00 60.65 58.59 3ggg h LYS 285 Cb 0.01 -0.04 -0.03 0.00 -0.90 0.00 0.00 32.23 31.27 3ggg h LYS 285 CO -0.00 0.39 0.35 1.49 -2.00 0.00 0.00 179.45 179.68 3ggg h GLU 286 N 0.27 0.81 -0.37 0.07 4.81 -0.46 0.17 114.58 119.88 3ggg h GLU 286 Ca 0.06 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 3ggg h GLU 286 Cb 0.34 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 3ggg h GLU 286 CO 0.02 0.59 0.08 -0.07 -0.73 0.00 0.00 179.01 178.90 3ggg h LEU 287 N 0.81 0.50 0.28 1.64 3.38 -0.10 -2.22 115.31 119.59 3ggg h LEU 287 Ca 0.21 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 3ggg h LEU 287 Cb -0.01 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.61 3ggg h LEU 287 CO -0.04 0.51 -0.14 0.40 0.09 0.00 0.00 178.44 179.26 3ggg h ILE 288 N 0.53 0.64 -0.50 1.22 2.04 -0.80 -2.16 117.51 118.48 3ggg h ILE 288 Ca 0.12 -0.79 0.10 0.00 1.00 0.00 0.00 64.86 65.29 3ggg h ILE 288 Cb 0.22 1.00 -0.10 0.00 -0.74 0.00 0.00 36.82 37.19 3ggg h ILE 288 CO -0.00 0.14 -0.26 0.58 0.00 0.00 0.00 178.15 178.61 3ggg h VAL 289 N -0.87 0.29 0.00 1.67 2.07 -0.54 -1.25 116.25 117.63 3ggg h VAL 289 Ca -0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.48 3ggg h VAL 289 Cb 0.51 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 3ggg h VAL 289 CO 0.06 0.00 0.00 0.54 0.02 0.00 0.00 177.57 178.19 3ggg n ARG 290 N -5.42 0.04 -3.63 1.57 1.74 -0.85 -4.91 116.66 105.21 3ggg n ARG 290 Ca 0.04 0.10 -0.23 0.00 -0.77 0.00 0.00 57.85 56.98 3ggg n ARG 290 Cb 0.33 -1.55 0.07 0.00 -1.02 0.00 0.00 32.46 30.29 3ggg n ARG 290 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3ggg n GLU 291 N -1.61 -6.99 -2.33 5.56 1.02 -0.47 -4.88 120.64 110.94 3ggg n GLU 291 Ca 0.06 0.78 -0.39 0.00 -0.02 0.00 0.00 57.16 57.58 3ggg n GLU 291 Cb 0.30 -5.75 -0.02 0.00 -0.02 0.00 0.00 31.44 25.95 3ggg n GLU 291 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3ggg n ALA 292 N -4.69 3.28 -0.27 0.62 0.00 -0.85 -4.84 120.51 113.75 3ggg n ALA 292 Ca -0.08 -3.63 0.03 0.00 0.00 0.00 0.00 53.44 49.76 3ggg n ALA 292 Cb 0.59 -3.57 0.16 0.00 0.00 0.00 0.00 19.45 16.62 3ggg n ALA 292 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3ggg h GLU 293 N 7.98 0.65 -0.16 0.00 4.81 -1.90 0.99 114.58 126.95 3ggg h GLU 293 Ca 0.40 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.53 3ggg h GLU 293 Cb 0.86 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 30.09 3ggg h GLU 293 CO 1.46 0.43 -0.16 1.49 -0.73 0.00 0.00 179.01 181.50 3ggg h GLU 294 N 0.67 0.39 -0.05 1.92 4.81 -2.00 -2.99 114.58 117.34 3ggg h GLU 294 Ca 0.38 -0.21 -0.15 0.00 -0.13 0.00 0.00 59.36 59.26 3ggg h GLU 294 Cb 0.40 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 3ggg h GLU 294 CO -0.27 0.76 -0.63 0.93 -0.73 0.00 0.00 179.01 179.07 3ggg h GLU 295 N 0.03 0.19 -0.16 1.92 5.08 -1.85 -2.42 114.58 117.36 3ggg h GLU 295 Ca 0.03 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 3ggg h GLU 295 Cb 0.69 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 3ggg h GLU 295 CO 0.04 0.76 0.02 1.25 -1.00 0.00 0.00 179.01 180.08 3ggg h LEU 296 N 0.13 0.27 -0.60 1.33 6.46 -0.86 -1.61 115.31 120.43 3ggg h LEU 296 Ca -0.01 -0.27 0.00 0.00 -0.12 0.00 0.00 57.88 57.48 3ggg h LEU 296 Cb 1.14 -0.07 -0.03 0.00 -0.73 0.00 0.00 40.66 40.97 3ggg h LEU 296 CO 0.09 0.47 0.39 1.62 -0.62 0.00 0.00 178.44 180.39 3ggg h VAL 297 N 0.05 1.16 -0.93 1.05 3.04 -1.41 -0.36 116.25 118.85 3ggg h VAL 297 Ca 0.05 -0.32 0.05 0.00 -1.01 0.00 0.00 66.70 65.47 3ggg h VAL 297 Cb 0.32 0.30 -0.06 0.00 -2.01 0.00 0.00 31.29 29.84 3ggg h VAL 297 CO 0.00 0.16 0.60 -0.33 -1.01 0.00 0.00 177.57 177.00 3ggg h GLU 298 N 0.81 1.11 -0.33 4.17 4.39 -1.33 0.46 114.58 123.87 3ggg h GLU 298 Ca 0.22 -0.07 0.01 0.00 0.34 0.00 0.00 59.36 59.86 3ggg h GLU 298 Cb -0.07 -0.25 -0.02 0.00 -0.10 0.00 0.00 28.75 28.31 3ggg h GLU 298 CO -0.05 0.73 0.21 -0.92 -1.16 0.00 0.00 179.01 177.83 3ggg h TYR 299 N 1.14 0.39 -0.13 4.33 3.20 -0.70 -2.63 116.97 122.57 3ggg h TYR 299 Ca 0.38 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 62.18 3ggg h TYR 299 Cb 0.06 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.19 3ggg h TYR 299 CO -0.01 0.24 -0.27 -0.07 -1.64 0.00 0.00 178.16 176.41 3ggg h LEU 300 N 0.42 0.24 -0.09 2.82 3.38 -0.30 -2.90 115.31 118.89 3ggg h LEU 300 Ca 0.12 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3ggg h LEU 300 Cb -0.03 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.65 3ggg h LEU 300 CO -0.04 0.52 0.00 0.29 0.09 0.00 0.00 178.44 179.30 3ggg n LYS 301 N -4.14 0.02 -0.19 1.13 5.02 0.16 -2.56 118.16 117.59 3ggg n LYS 301 Ca -0.01 0.30 0.15 0.00 -2.02 0.00 0.00 58.31 56.74 3ggg n LYS 301 Cb 0.38 -1.54 0.48 0.00 -0.02 0.00 0.00 35.03 34.33 3ggg n LYS 301 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3ggg h GLU 302 N 0.00 0.45 0.00 1.97 5.08 -1.40 -1.71 114.58 118.96 3ggg h GLU 302 Ca 0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3ggg h GLU 302 Cb 0.23 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.37 3ggg h GLU 302 CO 0.00 0.30 0.00 1.33 -1.00 0.00 0.00 179.01 179.64 3ggg n VAL 303 N -4.49 0.97 -0.57 3.13 0.24 -1.06 -4.38 118.33 112.17 3ggg n VAL 303 Ca 0.15 0.24 0.00 0.00 -2.04 0.00 0.00 64.34 62.70 3ggg n VAL 303 Cb 0.54 -1.14 0.00 0.00 -1.47 0.00 0.00 33.84 31.77 3ggg n VAL 303 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 3ggg n LYS 304 N -1.31 3.62 0.00 7.34 4.76 -0.64 -5.23 118.16 126.70 3ggg n LYS 304 Ca 0.03 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.47 3ggg n LYS 304 Cb 0.05 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.24 3ggg n LYS 304 CO 0.00 0.00 0.00 0.44 -1.37 0.00 0.00 177.40 176.47