#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ggj n PRO 5 N 0.00 3.14 0.00 -1.46 -0.04 -1.26 -4.82 135.00 130.56 3ggj n PRO 5 Ca 0.00 -2.72 0.00 0.00 -0.04 0.00 0.00 63.50 60.74 3ggj n PRO 5 Cb 0.00 -2.10 0.00 0.00 -0.04 0.00 0.00 33.50 31.36 3ggj n PRO 5 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ggj n GLY 6 N -0.30 -1.51 3.59 0.55 0.00 -1.26 -3.72 105.19 102.54 3ggj n GLY 6 Ca 0.41 -1.31 -0.42 0.00 0.00 0.00 0.00 46.02 44.70 3ggj n GLY 6 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ggj s VAL 7 N 0.00 3.75 -0.34 1.61 1.01 -0.98 -4.77 120.40 120.68 3ggj s VAL 7 Ca 0.00 0.73 -0.28 0.00 0.00 0.00 0.00 61.98 62.43 3ggj s VAL 7 Cb 0.00 -4.11 0.02 0.00 0.00 0.00 0.00 36.38 32.29 3ggj s VAL 7 CO 0.00 -0.77 1.04 -0.69 0.00 0.00 0.00 175.10 174.68 3ggj s VAL 8 N 6.10 4.51 -0.26 2.92 1.01 -1.26 -0.69 120.40 132.73 3ggj s VAL 8 Ca 0.64 1.56 -0.15 0.00 0.00 0.00 0.00 61.98 64.04 3ggj s VAL 8 Cb -0.15 -4.40 -0.04 0.00 0.00 0.00 0.00 36.38 31.79 3ggj s VAL 8 CO 0.31 -0.53 0.36 -0.63 0.00 0.00 0.00 175.10 174.61 3ggj s ILE 9 N 3.66 5.19 0.71 2.22 1.01 0.26 -4.95 121.20 129.30 3ggj s ILE 9 Ca 0.44 0.56 -0.11 0.00 0.00 0.00 0.00 60.65 61.54 3ggj s ILE 9 Cb -0.12 -3.69 0.02 0.00 0.01 0.00 0.00 42.46 38.69 3ggj s ILE 9 CO 0.17 0.19 1.07 -0.44 0.00 0.00 0.00 174.94 175.93 3ggj s SER 10 N 1.49 5.09 0.35 3.58 0.01 -1.26 -3.94 113.70 119.03 3ggj s SER 10 Ca 0.15 1.72 0.14 0.00 1.31 0.00 0.00 55.95 59.27 3ggj s SER 10 Cb -0.15 -2.51 0.65 0.00 0.21 0.00 0.00 66.02 64.22 3ggj s SER 10 CO 0.09 -1.64 1.76 0.44 0.41 0.00 0.00 173.24 174.31 3ggj h ASP 11 N -0.74 0.00 0.00 2.44 3.32 -1.97 -3.40 116.42 116.07 3ggj h ASP 11 Ca -0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.61 3ggj h ASP 11 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 3ggj h ASP 11 CO 0.55 0.43 0.00 -0.67 -1.72 0.00 0.00 179.24 177.83 3ggj n ASP 12 N -3.89 0.00 -4.55 6.45 2.03 -1.26 -4.38 116.55 110.95 3ggj n ASP 12 Ca -0.01 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.87 3ggj n ASP 12 Cb 0.47 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.83 3ggj n ASP 12 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 3ggj s GLU 13 N 0.00 3.47 0.00 -0.67 0.41 -1.26 -5.02 118.70 115.63 3ggj s GLU 13 Ca 0.00 0.03 0.00 0.00 -0.41 0.00 0.00 54.97 54.59 3ggj s GLU 13 Cb 0.00 -3.97 0.00 0.00 -1.78 0.00 0.00 34.13 28.38 3ggj s GLU 13 CO 0.00 -1.31 0.00 -2.30 -0.49 0.00 0.00 175.26 171.16 3ggj n PRO 14 N 7.26 0.00 0.00 0.39 -0.02 -1.26 -4.69 135.00 136.68 3ggj n PRO 14 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 3ggj n PRO 14 Cb 0.48 -0.21 0.00 0.00 -0.02 0.00 0.00 33.50 33.75 3ggj n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ggj n GLY 15 N 0.00 2.71 3.10 -1.23 0.00 -1.26 -4.58 105.19 103.94 3ggj n GLY 15 Ca 0.00 -0.30 -0.24 0.00 0.00 0.00 0.00 46.02 45.48 3ggj n GLY 15 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ggj s TYR 16 N 2.17 1.41 0.38 1.61 2.02 0.31 -4.97 117.35 120.29 3ggj s TYR 16 Ca 0.00 -0.35 -0.27 0.00 -0.37 0.00 0.00 57.07 56.08 3ggj s TYR 16 Cb 0.00 -0.95 -0.11 0.00 -0.40 0.00 0.00 41.96 40.50 3ggj s TYR 16 CO 0.00 -0.10 1.29 -3.47 -1.57 0.00 0.00 175.55 171.70 3ggj n ASP 17 N 3.02 2.70 -0.05 2.29 4.64 -1.26 -1.47 116.55 126.42 3ggj n ASP 17 Ca -0.17 1.16 0.02 0.00 -1.38 0.00 0.00 54.79 54.42 3ggj n ASP 17 Cb 0.54 -1.50 0.33 0.00 -1.04 0.00 0.00 41.12 39.46 3ggj n ASP 17 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 3ggj h LEU 18 N 2.36 0.57 0.00 -2.67 3.38 -1.95 -2.54 115.31 114.46 3ggj h LEU 18 Ca -0.47 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.45 3ggj h LEU 18 Cb 1.29 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.89 3ggj h LEU 18 CO 0.61 0.49 0.00 0.47 0.09 0.00 0.00 178.44 180.11 3ggj n ASP 19 N -4.39 0.00 0.10 -0.43 8.00 -1.26 -3.13 116.55 115.44 3ggj n ASP 19 Ca 0.04 0.33 -0.05 0.00 0.71 0.00 0.00 54.79 55.82 3ggj n ASP 19 Cb 0.12 -0.44 0.09 0.00 -0.02 0.00 0.00 41.12 40.87 3ggj n ASP 19 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3ggj h LEU 20 N 0.00 0.16 -9.84 0.64 3.38 -1.83 -3.46 115.31 104.35 3ggj h LEU 20 Ca 0.00 -0.11 -0.57 0.00 0.09 0.00 0.00 57.88 57.29 3ggj h LEU 20 Cb 0.38 -0.05 -0.09 0.00 0.09 0.00 0.00 40.66 40.99 3ggj h LEU 20 CO 0.00 0.81 -0.52 -0.36 0.09 0.00 0.00 178.44 178.46 3ggj s PHE 21 N -3.49 2.60 -0.29 1.13 0.08 -1.18 -5.10 117.98 111.72 3ggj s PHE 21 Ca -0.02 -0.56 -0.24 0.00 0.12 0.00 0.00 56.93 56.22 3ggj s PHE 21 Cb 0.12 -1.88 0.00 0.00 -0.57 0.00 0.00 43.02 40.69 3ggj s PHE 21 CO 0.80 0.25 0.83 0.00 -0.10 0.00 0.00 175.22 176.99 3ggj s ILE 23 N 3.01 0.75 0.32 0.00 -4.36 -1.26 -4.97 121.20 114.68 3ggj s ILE 23 Ca 0.34 -0.73 -0.29 0.00 -0.26 0.00 0.00 60.65 59.71 3ggj s ILE 23 Cb -0.14 -0.69 -0.12 0.00 1.25 0.00 0.00 42.46 42.75 3ggj s ILE 23 CO 0.12 -0.02 1.33 -2.65 0.24 0.00 0.00 174.94 173.95 3ggj n PRO 24 N 2.21 2.15 -0.18 0.37 -0.02 -1.26 -4.87 135.00 133.40 3ggj n PRO 24 Ca -0.17 0.76 0.12 0.00 -2.02 0.00 0.00 63.50 62.18 3ggj n PRO 24 Cb 0.56 -2.37 0.44 0.00 -0.02 0.00 0.00 33.50 32.11 3ggj n PRO 24 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 3ggj h ASN 25 N 2.99 0.51 0.42 2.55 2.35 -2.01 -2.16 115.58 120.23 3ggj h ASN 25 Ca -0.46 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 3ggj h ASN 25 Cb 1.28 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.56 3ggj h ASN 25 CO 0.66 0.29 0.00 0.00 -1.65 0.00 0.00 177.43 176.73 3ggj n HIS 26 N -4.50 0.00 0.35 1.19 1.44 -1.26 -1.80 115.22 110.64 3ggj n HIS 26 Ca 0.13 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.90 3ggj n HIS 26 Cb 0.41 -0.45 0.08 0.00 0.12 0.00 0.00 29.99 30.15 3ggj n HIS 26 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 3ggj n TYR 27 N -1.45 0.13 -0.27 -1.40 4.01 -0.81 -4.68 117.16 112.68 3ggj n TYR 27 Ca 0.04 -0.12 0.32 0.00 -0.16 0.00 0.00 57.90 57.98 3ggj n TYR 27 Cb 0.15 -0.01 0.59 0.00 -0.31 0.00 0.00 39.34 39.76 3ggj n TYR 27 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3ggj h ALA 28 N 2.42 3.02 0.00 -0.72 0.00 -1.36 0.19 119.26 122.82 3ggj h ALA 28 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3ggj h ALA 28 Cb 0.58 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3ggj h ALA 28 CO 0.00 -1.68 -0.51 -1.91 0.00 0.00 0.00 179.25 175.15 3ggj n GLU 29 N -3.53 3.75 -0.27 0.00 4.07 -1.26 -4.66 120.64 118.74 3ggj n GLU 29 Ca 0.25 -0.01 0.12 0.00 -0.06 0.00 0.00 57.16 57.46 3ggj n GLU 29 Cb 1.45 -0.94 0.26 0.00 -0.06 0.00 0.00 31.44 32.15 3ggj n GLU 29 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 3ggj n ASP 30 N -1.26 3.71 -4.25 4.31 8.00 0.67 -4.29 116.55 123.43 3ggj n ASP 30 Ca 0.01 -2.00 -0.16 0.00 0.71 0.00 0.00 54.79 53.36 3ggj n ASP 30 Cb 0.15 -0.36 -0.10 0.00 -0.02 0.00 0.00 41.12 40.79 3ggj n ASP 30 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3ggj s LEU 31 N -1.28 2.48 -0.05 0.64 1.43 -1.24 -0.46 118.68 120.20 3ggj s LEU 31 Ca 0.44 -0.93 -0.05 0.00 -1.03 0.00 0.00 54.13 52.55 3ggj s LEU 31 Cb 0.24 -0.42 -0.02 0.00 0.03 0.00 0.00 46.19 46.02 3ggj s LEU 31 CO 0.33 -0.26 -0.10 -0.62 0.23 0.00 0.00 176.35 175.93 3ggj n GLU 32 N 0.08 0.16 -4.24 1.70 1.02 0.05 -4.47 120.64 114.93 3ggj n GLU 32 Ca -0.12 0.12 -0.15 0.00 -0.02 0.00 0.00 57.16 56.99 3ggj n GLU 32 Cb 0.59 -0.84 -0.10 0.00 -0.02 0.00 0.00 31.44 31.07 3ggj n GLU 32 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3ggj s ARG 33 N -1.56 1.04 -0.18 3.49 0.52 -1.26 -4.65 118.95 116.36 3ggj s ARG 33 Ca -0.08 -1.41 -0.19 0.00 -0.52 0.00 0.00 55.73 53.52 3ggj s ARG 33 Cb 0.01 -0.65 -0.03 0.00 0.52 0.00 0.00 34.95 34.80 3ggj s ARG 33 CO 0.12 0.09 0.56 0.08 0.02 0.00 0.00 175.30 176.17 3ggj s VAL 34 N -3.13 5.09 -0.16 3.52 1.01 -0.54 -1.12 120.40 125.06 3ggj s VAL 34 Ca 0.15 1.06 -0.20 0.00 0.00 0.00 0.00 61.98 62.99 3ggj s VAL 34 Cb 0.01 -3.88 -0.23 0.00 0.00 0.00 0.00 36.38 32.28 3ggj s VAL 34 CO 0.01 0.19 0.42 -0.26 0.00 0.00 0.00 175.10 175.45 3ggj h PHE 35 N 7.29 0.16 -2.72 5.22 -1.00 -0.73 0.90 116.94 126.05 3ggj h PHE 35 Ca -0.35 -0.12 -0.55 0.00 2.81 0.00 0.00 57.97 59.77 3ggj h PHE 35 Cb 1.16 -0.01 -0.40 0.00 3.61 0.00 0.00 35.95 40.32 3ggj h PHE 35 CO 0.69 1.45 -0.80 0.42 -1.61 0.00 0.00 178.31 178.45 3ggj s ILE 36 N -2.38 0.04 0.56 -0.55 1.01 -0.60 -4.72 121.20 114.56 3ggj s ILE 36 Ca -0.24 -1.13 -0.19 0.00 0.00 0.00 0.00 60.65 59.09 3ggj s ILE 36 Cb 0.04 -1.05 -0.07 0.00 0.01 0.00 0.00 42.46 41.39 3ggj s ILE 36 CO 0.67 -0.83 0.75 -2.65 0.00 0.00 0.00 174.94 172.89 3ggj n PRO 37 N 4.79 0.74 -0.16 2.79 -0.02 -1.26 -1.46 135.00 140.43 3ggj n PRO 37 Ca 0.01 0.29 -0.03 0.00 -2.02 0.00 0.00 63.50 61.75 3ggj n PRO 37 Cb 0.40 -1.92 0.04 0.00 -0.02 0.00 0.00 33.50 32.01 3ggj n PRO 37 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3ggj h HIS 38 N 0.48 -0.19 -0.08 6.00 -0.00 -1.94 -1.01 115.15 118.41 3ggj h HIS 38 Ca -0.46 0.04 -0.00 0.00 -0.00 0.00 0.00 60.37 59.95 3ggj h HIS 38 Cb 1.38 0.16 -0.00 0.00 -0.00 0.00 0.00 27.41 28.95 3ggj h HIS 38 CO 0.35 -0.18 0.05 0.78 -0.00 0.00 0.00 177.93 178.92 3ggj h GLY 39 N 0.03 0.11 1.19 5.26 0.00 -1.91 0.86 103.07 108.61 3ggj h GLY 39 Ca 0.24 -0.04 -0.12 0.00 0.00 0.00 0.00 47.33 47.41 3ggj h GLY 39 CO -0.48 0.04 -0.19 -2.00 0.00 0.00 0.00 176.54 173.91 3ggj h LEU 40 N 0.11 0.95 -0.36 3.11 6.46 -1.54 -1.97 115.31 122.07 3ggj h LEU 40 Ca 0.03 -0.34 -0.04 0.00 -0.12 0.00 0.00 57.88 57.41 3ggj h LEU 40 Cb -0.01 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 39.65 3ggj h LEU 40 CO -0.01 1.11 0.09 0.40 -0.62 0.00 0.00 178.44 179.41 3ggj h ILE 41 N 0.82 1.23 -0.15 4.05 2.04 -0.48 -2.02 117.51 122.99 3ggj h ILE 41 Ca 0.11 -0.77 0.03 0.00 1.00 0.00 0.00 64.86 65.23 3ggj h ILE 41 Cb 0.75 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 3ggj h ILE 41 CO 0.06 0.26 -0.02 0.24 0.00 0.00 0.00 178.15 178.69 3ggj h MET 42 N 0.44 0.02 -0.30 2.37 2.86 -1.15 -0.48 114.93 118.68 3ggj h MET 42 Ca 0.11 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 3ggj h MET 42 Cb 0.31 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 3ggj h MET 42 CO 0.00 0.01 0.20 -0.44 1.06 0.00 0.00 176.91 177.74 3ggj h ASP 43 N 0.02 0.34 -0.80 1.22 3.32 -1.22 -0.38 116.42 118.92 3ggj h ASP 43 Ca 0.07 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 3ggj h ASP 43 Cb 0.10 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.53 3ggj h ASP 43 CO -0.14 0.25 0.48 -0.09 -1.72 0.00 0.00 179.24 178.02 3ggj h ARG 44 N 0.40 1.08 -0.30 3.56 9.65 -1.26 -2.70 114.38 124.82 3ggj h ARG 44 Ca 0.11 -0.10 -0.08 0.00 -1.10 0.00 0.00 59.98 58.81 3ggj h ARG 44 Cb -0.04 -0.23 -0.02 0.00 -1.39 0.00 0.00 29.97 28.29 3ggj h ARG 44 CO -0.03 0.76 -0.16 1.15 2.80 0.00 0.00 179.97 184.49 3ggj h THR 45 N 1.09 1.25 -0.74 0.20 2.02 -0.46 0.59 112.91 116.85 3ggj h THR 45 Ca 0.29 -1.12 0.01 0.00 0.77 0.00 0.00 66.41 66.35 3ggj h THR 45 Cb -0.05 1.20 -0.04 0.00 -1.74 0.00 0.00 68.15 67.52 3ggj h THR 45 CO -0.05 0.36 0.49 -0.08 0.37 0.00 0.00 175.52 176.61 3ggj h GLU 46 N 0.48 0.99 -0.20 6.66 4.81 -0.90 -0.69 114.58 125.73 3ggj h GLU 46 Ca 0.08 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.19 3ggj h GLU 46 Cb 0.56 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 3ggj h GLU 46 CO 0.04 0.66 -0.09 -0.09 -0.73 0.00 0.00 179.01 178.79 3ggj h ARG 47 N 1.01 0.42 -0.57 1.92 9.65 -0.81 -2.63 114.38 123.37 3ggj h ARG 47 Ca 0.27 -0.18 0.12 0.00 -1.10 0.00 0.00 59.98 59.09 3ggj h ARG 47 Cb -0.10 -0.01 -0.10 0.00 -1.39 0.00 0.00 29.97 28.37 3ggj h ARG 47 CO -0.06 0.71 -0.03 -0.07 2.80 0.00 0.00 179.97 183.32 3ggj h LEU 48 N 0.13 -0.32 -1.01 3.80 3.38 -0.72 0.51 115.31 121.08 3ggj h LEU 48 Ca 0.05 0.15 0.06 0.00 0.09 0.00 0.00 57.88 58.23 3ggj h LEU 48 Cb 0.58 0.27 -0.07 0.00 0.09 0.00 0.00 40.66 41.54 3ggj h LEU 48 CO 0.03 -0.12 0.65 0.00 0.09 0.00 0.00 178.44 179.09 3ggj h ALA 49 N 1.53 1.40 -0.23 1.53 0.00 -1.03 0.22 119.26 122.68 3ggj h ALA 49 Ca 0.29 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 3ggj h ALA 49 Cb 0.46 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3ggj h ALA 49 CO -0.51 0.46 0.10 -0.09 0.00 0.00 0.00 179.25 179.21 3ggj h ARG 50 N 1.19 0.34 -0.82 0.00 1.12 -0.72 -1.93 114.38 113.56 3ggj h ARG 50 Ca 0.43 -0.06 0.03 0.00 -1.11 0.00 0.00 59.98 59.28 3ggj h ARG 50 Cb 0.15 -0.06 -0.05 0.00 -0.01 0.00 0.00 29.97 30.01 3ggj h ARG 50 CO -0.17 0.37 0.54 -0.44 -3.11 0.00 0.00 179.97 177.15 3ggj h ASP 51 N 0.23 0.87 -0.57 -3.80 3.32 0.01 -1.86 116.42 114.62 3ggj h ASP 51 Ca 0.08 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.06 3ggj h ASP 51 Cb 0.15 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 3ggj h ASP 51 CO -0.01 0.60 0.13 0.58 -1.72 0.00 0.00 179.24 178.82 3ggj h VAL 52 N 1.01 1.25 0.00 -1.35 2.07 -0.24 -2.84 116.25 116.14 3ggj h VAL 52 Ca 0.32 -0.91 -0.08 0.00 0.82 0.00 0.00 66.70 66.85 3ggj h VAL 52 Cb 0.04 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 3ggj h VAL 52 CO -0.10 0.33 -0.40 0.24 0.02 0.00 0.00 177.57 177.67 3ggj h MET 53 N 0.82 0.00 -0.27 1.57 2.86 -0.91 -1.27 114.93 117.72 3ggj h MET 53 Ca 0.18 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.80 3ggj h MET 53 Cb 0.36 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 3ggj h MET 53 CO 0.00 0.40 0.09 -0.22 1.06 0.00 0.00 176.91 178.25 3ggj h LYS 54 N 0.00 0.42 0.00 1.72 3.64 -1.11 0.30 116.57 121.54 3ggj h LYS 54 Ca -0.00 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 3ggj h LYS 54 Cb 0.89 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.65 3ggj h LYS 54 CO 0.05 0.47 -0.80 0.93 -2.27 0.00 0.00 179.45 177.83 3ggj h GLU 55 N 0.28 0.00 0.00 1.90 5.08 -1.46 -3.38 114.58 117.00 3ggj h GLU 55 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3ggj h GLU 55 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 3ggj h GLU 55 CO -0.00 0.00 0.00 -1.33 -1.00 0.00 0.00 179.01 176.68 3ggj n MET 56 N -2.58 3.11 -0.98 2.33 2.81 -0.49 -5.08 117.12 116.23 3ggj n MET 56 Ca 0.01 -0.13 -0.34 0.00 -1.81 0.00 0.00 57.70 55.43 3ggj n MET 56 Cb 0.52 -0.54 0.10 0.00 -0.71 0.00 0.00 33.22 32.59 3ggj n MET 56 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3ggj n GLY 57 N 0.48 -1.78 5.00 3.03 0.00 0.11 -3.46 105.19 108.57 3ggj n GLY 57 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.42 3ggj n GLY 57 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ggj n GLY 58 N 1.54 1.45 3.47 -0.02 0.00 -1.26 -4.92 105.19 105.45 3ggj n GLY 58 Ca 0.08 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 3ggj n GLY 58 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3ggj n HIS 59 N 0.00 -0.79 0.12 1.61 -0.00 -1.22 -4.95 115.22 109.98 3ggj n HIS 59 Ca 0.00 0.14 -0.07 0.00 -0.00 0.00 0.00 57.72 57.79 3ggj n HIS 59 Cb 0.00 -1.77 -0.04 0.00 -0.00 0.00 0.00 29.99 28.18 3ggj n HIS 59 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 3ggj h HIS 60 N -2.10 -0.58 -2.76 4.41 -0.00 -1.84 -3.48 115.15 108.80 3ggj h HIS 60 Ca -0.51 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.86 3ggj h HIS 60 Cb 1.31 0.23 0.00 0.00 -0.00 0.00 0.00 27.41 28.95 3ggj h HIS 60 CO 0.33 -0.28 -0.64 0.44 -0.00 0.00 0.00 177.93 177.79 3ggj n ILE 61 N -3.60 -4.44 -3.87 6.26 -6.64 -1.25 -4.55 119.36 101.28 3ggj n ILE 61 Ca -0.05 1.79 -0.36 0.00 -1.77 0.00 0.00 62.75 62.37 3ggj n ILE 61 Cb 0.19 -2.72 -0.14 0.00 -1.44 0.00 0.00 39.64 35.53 3ggj n ILE 61 CO 0.00 0.00 0.00 -0.69 -1.77 0.00 0.00 176.55 174.09 3ggj s VAL 62 N -1.61 3.43 -0.46 7.28 1.01 0.20 -2.64 120.40 127.61 3ggj s VAL 62 Ca 0.00 -0.78 -0.22 0.00 0.00 0.00 0.00 61.98 60.98 3ggj s VAL 62 Cb 0.00 -2.72 0.03 0.00 0.00 0.00 0.00 36.38 33.69 3ggj s VAL 62 CO 0.00 0.19 0.72 0.00 0.00 0.00 0.00 175.10 176.02 3ggj s ALA 63 N 1.43 3.31 -0.27 5.51 0.00 0.16 -0.74 121.76 131.16 3ggj s ALA 63 Ca 0.02 -1.16 -0.07 0.00 0.00 0.00 0.00 51.96 50.75 3ggj s ALA 63 Cb -0.16 -3.41 -0.01 0.00 0.00 0.00 0.00 23.12 19.53 3ggj s ALA 63 CO -0.01 -1.91 0.08 -1.17 0.00 0.00 0.00 175.76 172.75 3ggj s LEU 64 N 3.09 3.64 -0.31 0.00 2.96 0.95 0.15 118.68 129.17 3ggj s LEU 64 Ca 0.26 -0.45 -0.18 0.00 -0.22 0.00 0.00 54.13 53.55 3ggj s LEU 64 Cb -0.13 -1.91 -0.02 0.00 0.50 0.00 0.00 46.19 44.63 3ggj s LEU 64 CO 0.20 -0.11 0.50 0.00 -1.32 0.00 0.00 176.35 175.61 3ggj s VAL 66 N 2.33 3.45 -0.57 0.00 1.01 -0.30 -0.76 120.40 125.55 3ggj s VAL 66 Ca 0.19 0.37 -0.10 0.00 0.00 0.00 0.00 61.98 62.44 3ggj s VAL 66 Cb -0.16 -3.85 0.15 0.00 0.00 0.00 0.00 36.38 32.52 3ggj s VAL 66 CO 0.12 -0.70 0.46 -0.22 0.00 0.00 0.00 175.10 174.75 3ggj s LEU 67 N 7.95 5.90 0.00 3.92 0.20 -0.73 -4.78 118.68 131.13 3ggj s LEU 67 Ca 0.72 -2.17 0.00 0.00 0.69 0.00 0.00 54.13 53.36 3ggj s LEU 67 Cb -0.16 -2.05 0.00 0.00 -0.43 0.00 0.00 46.19 43.54 3ggj s LEU 67 CO 0.27 -0.65 0.00 0.29 -0.29 0.00 0.00 176.35 175.97 3ggj n LYS 68 N 4.58 0.00 -0.07 1.98 4.01 -1.26 -2.14 118.16 125.26 3ggj n LYS 68 Ca -0.03 0.00 -0.09 0.00 -0.51 0.00 0.00 58.31 57.69 3ggj n LYS 68 Cb 0.41 -0.22 -0.09 0.00 -0.51 0.00 0.00 35.03 34.62 3ggj n LYS 68 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3ggj n GLY 69 N 2.55 -0.47 3.60 0.72 0.00 -1.26 -4.84 105.19 105.49 3ggj n GLY 69 Ca 0.00 -0.17 -0.12 0.00 0.00 0.00 0.00 46.02 45.73 3ggj n GLY 69 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ggj s GLY 70 N -5.09 0.98 -0.09 -0.02 0.00 -1.26 -5.06 107.32 96.78 3ggj s GLY 70 Ca -0.14 -1.17 0.22 0.00 0.00 0.00 0.00 44.72 43.63 3ggj s GLY 70 CO 0.48 -0.72 1.17 1.58 0.00 0.00 0.00 173.10 175.61 3ggj n TYR 71 N -0.52 0.30 -0.11 1.90 0.18 -1.26 -4.84 117.16 112.81 3ggj n TYR 71 Ca -0.02 -1.00 -0.05 0.00 1.88 0.00 0.00 57.90 58.70 3ggj n TYR 71 Cb 0.61 -0.19 0.01 0.00 -0.38 0.00 0.00 39.34 39.39 3ggj n TYR 71 CO 0.00 0.00 0.00 -0.22 -2.08 0.00 0.00 176.86 174.56 3ggj h LYS 72 N 1.29 -0.01 -0.54 -3.48 1.63 -1.89 -1.10 116.57 112.46 3ggj h LYS 72 Ca -0.15 0.00 0.05 0.00 -0.85 0.00 0.00 60.65 59.70 3ggj h LYS 72 Cb 1.62 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 33.21 3ggj h LYS 72 CO 0.12 -0.00 0.28 0.35 -3.45 0.00 0.00 179.45 176.74 3ggj h PHE 73 N -0.01 0.51 0.53 1.91 3.57 -1.91 -0.79 116.94 120.75 3ggj h PHE 73 Ca 0.18 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.69 3ggj h PHE 73 Cb 0.29 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 3ggj h PHE 73 CO -0.35 0.24 -0.34 0.35 -2.23 0.00 0.00 178.31 175.99 3ggj h PHE 74 N 0.53 -0.89 -0.89 0.41 3.57 -1.78 0.31 116.94 118.21 3ggj h PHE 74 Ca 0.24 -0.01 0.23 0.00 3.53 0.00 0.00 57.97 61.97 3ggj h PHE 74 Cb 0.15 0.32 -0.14 0.00 2.79 0.00 0.00 35.95 39.08 3ggj h PHE 74 CO -0.10 -0.51 0.31 0.00 -2.23 0.00 0.00 178.31 175.78 3ggj h ALA 75 N -0.43 1.37 -0.05 2.41 0.00 -0.99 0.15 119.26 121.72 3ggj h ALA 75 Ca -0.06 0.20 -0.24 0.00 0.00 0.00 0.00 54.91 54.81 3ggj h ALA 75 Cb 0.68 0.25 0.02 0.00 0.00 0.00 0.00 17.79 18.74 3ggj h ALA 75 CO 0.05 -0.44 -0.90 -0.44 0.00 0.00 0.00 179.25 177.52 3ggj h ASP 76 N 0.27 0.87 -0.73 0.00 3.32 -0.51 -1.66 116.42 117.99 3ggj h ASP 76 Ca 0.56 -0.71 -0.01 0.00 0.02 0.00 0.00 57.03 56.90 3ggj h ASP 76 Cb 1.13 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 40.38 3ggj h ASP 76 CO -0.61 1.46 0.42 0.25 -1.72 0.00 0.00 179.24 179.04 3ggj h LEU 77 N 0.37 0.89 -0.94 1.55 6.46 0.41 -2.70 115.31 121.35 3ggj h LEU 77 Ca -0.10 -0.08 -0.07 0.00 -0.12 0.00 0.00 57.88 57.52 3ggj h LEU 77 Cb 1.56 -0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 41.25 3ggj h LEU 77 CO 0.18 0.71 -0.31 -0.07 -0.62 0.00 0.00 178.44 178.33 3ggj h LEU 78 N 1.00 0.00 -0.38 2.25 4.07 -0.66 -1.53 115.31 120.06 3ggj h LEU 78 Ca 0.26 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 58.12 3ggj h LEU 78 Cb -0.00 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.73 3ggj h LEU 78 CO -0.05 0.31 -0.17 0.44 -1.08 0.00 0.00 178.44 177.90 3ggj h ASP 79 N 0.00 0.80 -0.35 -0.43 5.19 -0.99 -1.30 116.42 119.35 3ggj h ASP 79 Ca -0.00 -0.40 -0.10 0.00 -0.62 0.00 0.00 57.03 55.91 3ggj h ASP 79 Cb 0.87 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 40.14 3ggj h ASP 79 CO 0.04 1.02 -0.14 1.88 -3.12 0.00 0.00 179.24 178.92 3ggj h TYR 80 N 0.58 0.89 0.02 4.55 0.05 -1.25 -0.78 116.97 121.03 3ggj h TYR 80 Ca 0.09 -0.18 -0.00 0.00 0.05 0.00 0.00 58.73 58.69 3ggj h TYR 80 Cb 0.71 -0.22 0.00 0.00 1.01 0.00 0.00 36.73 38.23 3ggj h TYR 80 CO 0.06 0.89 -0.01 0.82 -1.05 0.00 0.00 178.16 178.87 3ggj h ILE 81 N 0.72 1.19 -0.80 -2.88 2.04 -1.25 -1.67 117.51 114.85 3ggj h ILE 81 Ca 0.11 -0.64 0.18 0.00 1.00 0.00 0.00 64.86 65.52 3ggj h ILE 81 Cb 0.64 1.62 -0.05 0.00 -0.74 0.00 0.00 36.82 38.29 3ggj h ILE 81 CO 0.04 0.16 0.54 0.11 0.00 0.00 0.00 178.15 179.01 3ggj h LYS 82 N -0.30 0.32 -0.15 2.37 1.57 -1.17 -1.03 116.57 118.18 3ggj h LYS 82 Ca -0.00 -0.02 -0.12 0.00 -1.87 0.00 0.00 60.65 58.64 3ggj h LYS 82 Cb 0.29 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 3ggj h LYS 82 CO 0.00 0.21 -0.43 0.00 -0.57 0.00 0.00 179.45 178.67 3ggj h ALA 83 N 1.63 0.99 -0.03 3.86 0.00 -0.46 -2.49 119.26 122.77 3ggj h ALA 83 Ca 0.40 -0.43 -0.15 0.00 0.00 0.00 0.00 54.91 54.72 3ggj h ALA 83 Cb 1.06 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 3ggj h ALA 83 CO -0.12 0.62 -0.68 -0.07 0.00 0.00 0.00 179.25 179.01 3ggj h LEU 84 N 0.30 0.16 -0.06 0.00 3.38 -0.34 -3.20 115.31 115.55 3ggj h LEU 84 Ca 0.02 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.89 3ggj h LEU 84 Cb 0.88 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.58 3ggj h LEU 84 CO 0.07 0.79 0.00 0.78 0.09 0.00 0.00 178.44 180.17 3ggj h ASN 85 N 0.10 0.00 -0.16 -0.43 -0.26 -1.03 -3.18 115.58 110.62 3ggj h ASN 85 Ca -0.01 0.00 0.05 0.00 -0.56 0.00 0.00 56.30 55.77 3ggj h ASN 85 Cb 1.20 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.46 3ggj h ASN 85 CO 0.10 0.00 0.36 0.03 -1.06 0.00 0.00 177.43 176.86 3ggj h ARG 86 N 0.00 0.00 0.00 0.81 3.08 -1.45 -2.85 114.38 113.98 3ggj h ARG 86 Ca 0.00 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 3ggj h ARG 86 Cb 0.78 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.82 3ggj h ARG 86 CO 0.00 0.00 -1.61 0.09 -1.07 0.00 0.00 179.97 177.38 3ggj n ASN 87 N -3.25 0.44 -4.71 7.04 3.02 -1.20 -4.99 115.26 111.62 3ggj n ASN 87 Ca 0.02 0.18 -0.43 0.00 -0.03 0.00 0.00 54.58 54.32 3ggj n ASN 87 Cb 0.46 1.02 -0.01 0.00 -0.61 0.00 0.00 39.78 40.64 3ggj n ASN 87 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3ggj n SER 88 N -2.58 3.04 -0.27 6.41 3.41 -1.08 -4.90 113.62 117.65 3ggj n SER 88 Ca -0.07 1.18 -0.03 0.00 -0.26 0.00 0.00 58.87 59.69 3ggj n SER 88 Cb 0.69 -1.50 0.08 0.00 -0.26 0.00 0.00 64.21 63.22 3ggj n SER 88 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3ggj h ASP 89 N 3.38 0.79 -2.74 4.04 5.19 -1.94 -3.39 116.42 121.75 3ggj h ASP 89 Ca -0.46 -0.01 -0.66 0.00 -0.62 0.00 0.00 57.03 55.28 3ggj h ASP 89 Cb 1.27 -0.18 -0.07 0.00 0.18 0.00 0.00 39.33 40.53 3ggj h ASP 89 CO 0.69 0.55 -0.49 -0.13 -3.12 0.00 0.00 179.24 176.73 3ggj s ARG 90 N -6.12 3.40 0.02 3.56 0.52 -1.26 -5.07 118.95 114.00 3ggj s ARG 90 Ca -0.13 -0.22 -0.30 0.00 -0.52 0.00 0.00 55.73 54.56 3ggj s ARG 90 Cb 0.16 -3.13 -0.04 0.00 0.52 0.00 0.00 34.95 32.46 3ggj s ARG 90 CO 0.78 0.74 1.10 -1.54 0.02 0.00 0.00 175.30 176.40 3ggj s SER 91 N -1.33 7.20 -0.32 0.23 1.04 -1.26 -5.01 113.70 114.25 3ggj s SER 91 Ca 0.19 1.84 -0.11 0.00 0.48 0.00 0.00 55.95 58.34 3ggj s SER 91 Cb -0.12 -2.57 -0.02 0.00 0.10 0.00 0.00 66.02 63.41 3ggj s SER 91 CO 0.09 -0.39 0.19 -0.63 0.98 0.00 0.00 173.24 173.48 3ggj s ILE 92 N 1.17 4.94 0.30 -1.02 -1.09 -1.26 -5.06 121.20 119.17 3ggj s ILE 92 Ca 0.55 -0.28 -0.30 0.00 -2.23 0.00 0.00 60.65 58.39 3ggj s ILE 92 Cb -0.25 -3.51 -0.11 0.00 -1.58 0.00 0.00 42.46 37.01 3ggj s ILE 92 CO 0.28 0.06 1.57 -2.16 -1.23 0.00 0.00 174.94 173.45 3ggj s PRO 93 N 1.67 4.14 -0.17 2.79 0.04 -1.26 -4.99 135.00 137.22 3ggj s PRO 93 Ca 0.05 2.55 0.01 0.00 0.04 0.00 0.00 61.00 63.65 3ggj s PRO 93 Cb -0.17 -3.03 0.02 0.00 0.04 0.00 0.00 34.50 31.36 3ggj s PRO 93 CO 0.08 -0.60 -0.19 -1.64 0.04 0.00 0.00 177.00 174.70 3ggj s MET 94 N -0.65 2.84 -0.25 4.56 1.00 -1.26 -4.67 119.30 120.87 3ggj s MET 94 Ca 0.62 -0.77 -0.15 0.00 0.00 0.00 0.00 55.69 55.38 3ggj s MET 94 Cb -0.47 -2.44 -0.04 0.00 0.00 0.00 0.00 34.83 31.88 3ggj s MET 94 CO 0.49 -0.18 0.39 0.99 0.00 0.00 0.00 175.02 176.71 3ggj s THR 95 N 1.25 5.17 -0.25 2.05 2.01 -1.08 -5.01 115.64 119.78 3ggj s THR 95 Ca 0.03 0.62 -0.08 0.00 0.31 0.00 0.00 61.69 62.57 3ggj s THR 95 Cb -0.13 -3.71 -0.03 0.00 0.01 0.00 0.00 72.50 68.63 3ggj s THR 95 CO -0.11 0.18 0.09 -0.69 -0.69 0.00 0.00 174.62 173.40 3ggj s VAL 96 N 1.89 4.52 0.23 3.82 1.01 -1.26 0.38 120.40 130.99 3ggj s VAL 96 Ca 0.16 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 62.06 3ggj s VAL 96 Cb -0.15 -3.12 -0.05 0.00 0.00 0.00 0.00 36.38 33.06 3ggj s VAL 96 CO 0.09 0.33 0.06 -0.62 0.00 0.00 0.00 175.10 174.97 3ggj s ASP 97 N 1.54 1.27 0.03 3.32 -1.08 0.12 -4.94 116.67 116.93 3ggj s ASP 97 Ca 0.06 -1.31 0.05 0.00 -0.52 0.00 0.00 52.55 50.83 3ggj s ASP 97 Cb -0.15 0.13 -0.02 0.00 -1.46 0.00 0.00 42.92 41.42 3ggj s ASP 97 CO 0.05 -0.67 -0.15 -0.36 0.52 0.00 0.00 175.17 174.56 3ggj s PHE 98 N -3.69 1.34 -0.24 -5.34 0.40 -1.26 -0.62 117.98 108.56 3ggj s PHE 98 Ca 0.33 -0.33 0.01 0.00 -0.60 0.00 0.00 56.93 56.35 3ggj s PHE 98 Cb 0.07 -0.81 0.06 0.00 0.51 0.00 0.00 43.02 42.85 3ggj s PHE 98 CO 0.11 0.03 -0.07 -1.50 0.70 0.00 0.00 175.22 174.49 3ggj s ILE 99 N -0.71 1.68 -0.18 0.64 2.07 0.06 -4.75 121.20 120.01 3ggj s ILE 99 Ca 0.04 -1.32 -0.20 0.00 -1.41 0.00 0.00 60.65 57.76 3ggj s ILE 99 Cb -0.07 -1.91 -0.03 0.00 0.13 0.00 0.00 42.46 40.58 3ggj s ILE 99 CO 0.01 -0.08 0.58 -0.60 -1.91 0.00 0.00 174.94 172.93 3ggj s ARG 100 N 1.33 4.24 -0.13 3.50 3.52 -1.16 -1.78 118.95 128.47 3ggj s ARG 100 Ca -0.07 0.55 0.01 0.00 -0.13 0.00 0.00 55.73 56.09 3ggj s ARG 100 Cb -0.19 -3.54 -0.01 0.00 -1.56 0.00 0.00 34.95 29.65 3ggj s ARG 100 CO -0.06 -0.13 -0.16 -0.51 -0.81 0.00 0.00 175.30 173.63 3ggj s LEU 101 N 1.55 2.53 0.06 -0.88 1.43 -0.91 -0.15 118.68 122.32 3ggj s LEU 101 Ca 0.27 -0.41 -0.10 0.00 -1.03 0.00 0.00 54.13 52.86 3ggj s LEU 101 Cb -0.16 -1.56 -0.06 0.00 0.03 0.00 0.00 46.19 44.45 3ggj s LEU 101 CO 0.11 0.14 0.39 -0.75 0.23 0.00 0.00 176.35 176.47 3ggj s LYS 102 N 0.46 3.77 0.06 1.70 2.47 -0.96 -4.54 119.74 122.70 3ggj s LYS 102 Ca -0.11 0.19 -0.21 0.00 -1.56 0.00 0.00 55.97 54.28 3ggj s LYS 102 Cb -0.16 -3.03 -0.06 0.00 -1.46 0.00 0.00 37.83 33.11 3ggj s LYS 102 CO 0.05 0.59 0.63 -1.54 0.16 0.00 0.00 175.35 175.24 3ggj s SER 103 N -1.65 7.11 0.11 1.43 1.04 -1.26 -4.36 113.70 116.12 3ggj s SER 103 Ca 0.31 1.32 0.00 0.00 0.48 0.00 0.00 55.95 58.06 3ggj s SER 103 Cb -0.14 -2.40 -0.04 0.00 0.10 0.00 0.00 66.02 63.54 3ggj s SER 103 CO 0.17 0.19 -0.00 -0.31 0.98 0.00 0.00 173.24 174.26 3ggj s TYR 104 N -0.74 0.86 -0.62 5.02 4.12 -1.26 -4.82 117.35 119.90 3ggj s TYR 104 Ca 0.32 -1.08 -0.08 0.00 0.02 0.00 0.00 57.07 56.25 3ggj s TYR 104 Cb -0.20 -0.51 0.08 0.00 -1.52 0.00 0.00 41.96 39.81 3ggj s TYR 104 CO 0.20 -0.34 0.20 0.00 0.02 0.00 0.00 175.55 175.63 3ggj n ASN 106 N -1.82 0.00 -0.79 0.00 3.02 -1.26 -2.96 115.26 111.45 3ggj n ASN 106 Ca 0.04 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.54 3ggj n ASN 106 Cb 0.49 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.61 3ggj n ASN 106 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3ggj n ASP 107 N 2.98 -0.62 0.06 6.41 -0.08 -1.25 -4.92 116.55 119.13 3ggj n ASP 107 Ca 0.00 -1.37 0.12 0.00 -1.51 0.00 0.00 54.79 52.04 3ggj n ASP 107 Cb 0.00 0.19 0.23 0.00 2.34 0.00 0.00 41.12 43.88 3ggj n ASP 107 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3ggj n GLN 108 N 0.00 0.25 -3.08 -0.67 3.00 -1.16 -4.49 117.38 111.24 3ggj n GLN 108 Ca -0.17 0.10 -0.17 0.00 -0.01 0.00 0.00 57.00 56.75 3ggj n GLN 108 Cb 0.55 -1.68 -0.04 0.00 0.00 0.00 0.00 30.24 29.06 3ggj n GLN 108 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 3ggj n SER 109 N -2.07 -1.68 0.09 1.08 7.64 -1.26 -4.99 113.62 112.43 3ggj n SER 109 Ca 0.04 -2.70 0.13 0.00 1.01 0.00 0.00 58.87 57.35 3ggj n SER 109 Cb 0.43 0.48 0.43 0.00 -1.01 0.00 0.00 64.21 64.53 3ggj n SER 109 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 3ggj n THR 110 N 2.57 0.51 0.28 0.44 -1.04 -1.26 -3.29 114.28 112.50 3ggj n THR 110 Ca 0.23 -0.25 0.16 0.00 -2.04 0.00 0.00 64.05 62.15 3ggj n THR 110 Cb 0.53 -0.57 0.83 0.00 -1.82 0.00 0.00 70.33 69.31 3ggj n THR 110 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 3ggj h GLY 111 N 4.59 0.00 -7.26 3.41 0.00 -1.92 -3.31 103.07 98.58 3ggj h GLY 111 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.77 3ggj h GLY 111 CO 0.00 0.00 0.93 0.99 0.00 0.00 0.00 176.54 178.46 3ggj s ASP 112 N -5.87 6.22 0.25 0.19 1.01 -1.21 -4.71 116.67 112.56 3ggj s ASP 112 Ca -0.03 -0.44 -0.19 0.00 0.71 0.00 0.00 52.55 52.60 3ggj s ASP 112 Cb 0.12 -2.53 -0.09 0.00 1.01 0.00 0.00 42.92 41.44 3ggj s ASP 112 CO 0.54 -1.68 0.74 0.27 0.21 0.00 0.00 175.17 175.25 3ggj s ILE 113 N 5.23 4.56 -0.45 0.77 -4.36 -1.26 -4.89 121.20 120.81 3ggj s ILE 113 Ca 0.34 1.26 0.03 0.00 -0.26 0.00 0.00 60.65 62.02 3ggj s ILE 113 Cb -0.10 -3.82 0.12 0.00 1.25 0.00 0.00 42.46 39.92 3ggj s ILE 113 CO 0.16 0.13 0.20 -0.54 0.24 0.00 0.00 174.94 175.13 3ggj s LYS 114 N -2.18 1.56 0.12 0.37 1.02 -1.26 -5.09 119.74 114.28 3ggj s LYS 114 Ca 0.46 -2.17 -0.30 0.00 0.02 0.00 0.00 55.97 53.98 3ggj s LYS 114 Cb -0.15 -2.86 -0.06 0.00 -0.52 0.00 0.00 37.83 34.23 3ggj s LYS 114 CO 0.20 -1.09 1.10 0.08 -0.92 0.00 0.00 175.35 174.73 3ggj s VAL 115 N 0.28 4.08 -0.05 3.17 1.01 -1.26 -2.27 120.40 125.36 3ggj s VAL 115 Ca 0.16 1.66 -0.07 0.00 0.00 0.00 0.00 61.98 63.72 3ggj s VAL 115 Cb -0.24 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.05 3ggj s VAL 115 CO -0.03 0.22 -0.15 -0.38 0.00 0.00 0.00 175.10 174.76 3ggj n ILE 116 N 3.04 1.12 -2.17 2.22 5.41 0.79 -4.82 119.36 124.95 3ggj n ILE 116 Ca 0.05 0.15 -0.43 0.00 1.00 0.00 0.00 62.75 63.52 3ggj n ILE 116 Cb 0.47 -1.83 0.00 0.00 -0.71 0.00 0.00 39.64 37.57 3ggj n ILE 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3ggj n GLY 117 N 2.52 3.51 2.52 7.39 0.00 -1.19 -4.75 105.19 115.19 3ggj n GLY 117 Ca -0.11 -1.54 -0.25 0.00 0.00 0.00 0.00 46.02 44.12 3ggj n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ggj n GLY 118 N 4.73 5.52 3.55 -0.02 0.00 -1.26 -2.98 105.19 114.73 3ggj n GLY 118 Ca 0.50 -2.61 -0.33 0.00 0.00 0.00 0.00 46.02 43.57 3ggj n GLY 118 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3ggj n ASP 119 N -0.42 -0.63 0.00 1.61 5.75 -1.26 -4.09 116.55 117.51 3ggj n ASP 119 Ca 0.35 0.47 0.00 0.00 -0.01 0.00 0.00 54.79 55.60 3ggj n ASP 119 Cb 0.66 -1.34 0.00 0.00 -1.03 0.00 0.00 41.12 39.41 3ggj n ASP 119 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 3ggj n ASP 120 N -2.18 0.00 0.31 -1.12 8.00 -1.26 -4.65 116.55 115.64 3ggj n ASP 120 Ca 0.10 0.00 0.21 0.00 0.71 0.00 0.00 54.79 55.81 3ggj n ASP 120 Cb 0.52 0.00 1.05 0.00 -0.02 0.00 0.00 41.12 42.67 3ggj n ASP 120 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3ggj h LEU 121 N 0.00 0.00 0.00 0.64 4.07 -2.01 -2.53 115.31 115.48 3ggj h LEU 121 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3ggj h LEU 121 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 3ggj h LEU 121 CO 0.00 0.00 0.00 -1.54 -1.08 0.00 0.00 178.44 175.82 3ggj n SER 122 N -2.98 0.00 0.06 -0.43 3.41 -1.26 -2.64 113.62 109.78 3ggj n SER 122 Ca -0.02 -1.91 -0.17 0.00 -0.26 0.00 0.00 58.87 56.50 3ggj n SER 122 Cb 0.11 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.98 3ggj n SER 122 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3ggj h THR 123 N 0.00 1.34 -0.98 6.66 1.35 -1.80 -3.30 112.91 116.18 3ggj h THR 123 Ca 0.00 -2.38 0.26 0.00 -0.55 0.00 0.00 66.41 63.74 3ggj h THR 123 Cb 0.00 2.44 -0.06 0.00 -1.73 0.00 0.00 68.15 68.80 3ggj h THR 123 CO 0.00 0.72 0.67 -0.07 -0.25 0.00 0.00 175.52 176.59 3ggj h LEU 124 N 0.31 0.21 -9.43 3.87 4.07 -1.75 -3.42 115.31 109.16 3ggj h LEU 124 Ca -0.11 0.03 -0.62 0.00 0.08 0.00 0.00 57.88 57.25 3ggj h LEU 124 Cb 1.68 -0.01 0.07 0.00 1.08 0.00 0.00 40.66 43.48 3ggj h LEU 124 CO 0.19 0.06 0.49 0.41 -1.08 0.00 0.00 178.44 178.51 3ggj n THR 125 N -4.40 0.64 -1.53 0.22 -1.04 -1.22 -0.85 114.28 106.10 3ggj n THR 125 Ca 0.21 -0.16 -0.18 0.00 -2.04 0.00 0.00 64.05 61.88 3ggj n THR 125 Cb 0.92 -1.15 -0.08 0.00 -1.82 0.00 0.00 70.33 68.20 3ggj n THR 125 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3ggj n GLY 126 N 2.34 1.74 3.40 3.41 0.00 -0.37 -4.87 105.19 110.84 3ggj n GLY 126 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 3ggj n GLY 126 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ggj s LYS 127 N -3.55 1.46 -0.55 1.61 -0.14 -0.03 -4.43 119.74 114.11 3ggj s LYS 127 Ca 0.00 -1.52 -0.25 0.00 -1.36 0.00 0.00 55.97 52.83 3ggj s LYS 127 Cb 0.00 -1.66 0.04 0.00 -1.68 0.00 0.00 37.83 34.52 3ggj s LYS 127 CO 0.00 0.35 1.01 -0.80 -0.76 0.00 0.00 175.35 175.15 3ggj s ASN 128 N -2.79 6.39 -0.24 2.83 0.02 -1.26 -1.66 114.94 118.24 3ggj s ASN 128 Ca 0.20 -0.16 -0.10 0.00 -1.02 0.00 0.00 52.86 51.78 3ggj s ASN 128 Cb -0.07 -2.47 -0.05 0.00 0.02 0.00 0.00 41.25 38.68 3ggj s ASN 128 CO 0.09 -1.28 0.14 -0.69 0.02 0.00 0.00 177.10 175.38 3ggj s VAL 129 N 4.22 5.12 -0.32 1.60 1.01 -0.46 0.59 120.40 132.17 3ggj s VAL 129 Ca 0.35 0.10 -0.10 0.00 0.00 0.00 0.00 61.98 62.32 3ggj s VAL 129 Cb -0.11 -3.38 -0.01 0.00 0.00 0.00 0.00 36.38 32.88 3ggj s VAL 129 CO 0.22 0.35 0.17 -0.22 0.00 0.00 0.00 175.10 175.62 3ggj s LEU 130 N 1.11 4.20 -0.22 3.92 2.96 0.08 -1.39 118.68 129.33 3ggj s LEU 130 Ca 0.07 -0.49 -0.15 0.00 -0.22 0.00 0.00 54.13 53.34 3ggj s LEU 130 Cb -0.14 -2.03 -0.04 0.00 0.50 0.00 0.00 46.19 44.48 3ggj s LEU 130 CO 0.05 -0.20 0.35 -0.63 -1.32 0.00 0.00 176.35 174.59 3ggj s ILE 131 N 1.64 5.22 -0.16 6.68 1.01 -0.04 -0.03 121.20 135.52 3ggj s ILE 131 Ca 0.05 0.57 -0.03 0.00 0.00 0.00 0.00 60.65 61.24 3ggj s ILE 131 Cb -0.17 -3.68 -0.02 0.00 0.01 0.00 0.00 42.46 38.60 3ggj s ILE 131 CO 0.07 0.25 -0.07 -0.69 0.00 0.00 0.00 174.94 174.50 3ggj s VAL 132 N 1.44 3.49 0.11 2.92 1.01 0.96 -0.62 120.40 129.71 3ggj s VAL 132 Ca 0.16 -0.49 0.05 0.00 0.00 0.00 0.00 61.98 61.70 3ggj s VAL 132 Cb -0.15 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 3ggj s VAL 132 CO 0.08 0.49 -0.12 -0.70 0.00 0.00 0.00 175.10 174.84 3ggj s GLU 133 N 0.62 0.94 -0.22 2.72 2.56 0.14 -1.15 118.70 124.31 3ggj s GLU 133 Ca -0.04 -1.21 -0.06 0.00 0.00 0.00 0.00 54.97 53.65 3ggj s GLU 133 Cb -0.15 -0.72 -0.19 0.00 2.00 0.00 0.00 34.13 35.07 3ggj s GLU 133 CO 0.03 0.13 -0.02 -0.40 -0.56 0.00 0.00 175.26 174.43 3ggj n ASP 134 N 0.51 2.01 -3.97 -1.70 5.68 -1.26 -2.08 116.55 115.73 3ggj n ASP 134 Ca -0.15 0.12 -0.13 0.00 -0.50 0.00 0.00 54.79 54.12 3ggj n ASP 134 Cb 0.57 -0.69 -0.13 0.00 -1.14 0.00 0.00 41.12 39.74 3ggj n ASP 134 CO 0.00 0.00 0.00 -0.51 -1.33 0.00 0.00 177.20 175.36 3ggj s ILE 135 N -2.51 0.31 -0.09 2.12 2.07 -1.26 -1.17 121.20 120.66 3ggj s ILE 135 Ca -0.31 -0.52 0.04 0.00 -1.41 0.00 0.00 60.65 58.45 3ggj s ILE 135 Cb 0.09 -0.33 0.00 0.00 0.13 0.00 0.00 42.46 42.35 3ggj s ILE 135 CO 0.63 -0.14 -0.20 -0.63 -1.91 0.00 0.00 174.94 172.68 3ggj s ILE 136 N -0.65 1.75 0.00 2.00 1.01 0.87 -4.95 121.20 121.22 3ggj s ILE 136 Ca -0.05 -0.84 0.00 0.00 0.00 0.00 0.00 60.65 59.76 3ggj s ILE 136 Cb -0.05 -1.53 0.00 0.00 0.01 0.00 0.00 42.46 40.89 3ggj s ILE 136 CO -0.00 0.49 0.00 -0.67 0.00 0.00 0.00 174.94 174.76 3ggj n ASP 137 N 3.58 0.00 0.25 3.58 2.03 -1.26 -0.95 116.55 123.78 3ggj n ASP 137 Ca -0.20 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.24 3ggj n ASP 137 Cb 0.53 0.00 0.57 0.00 -0.72 0.00 0.00 41.12 41.50 3ggj n ASP 137 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 3ggj h THR 138 N 0.00 0.38 0.00 5.18 1.35 -1.92 -3.40 112.91 114.49 3ggj h THR 138 Ca 0.00 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 65.01 3ggj h THR 138 Cb 0.00 1.63 0.00 0.00 -1.73 0.00 0.00 68.15 68.05 3ggj h THR 138 CO 0.00 0.14 0.00 0.61 -0.25 0.00 0.00 175.52 176.02 3ggj n GLY 139 N -0.00 1.10 0.22 5.82 0.00 -1.26 -0.29 105.19 110.77 3ggj n GLY 139 Ca -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 3ggj n GLY 139 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ggj h LYS 140 N 3.53 0.49 0.21 1.61 1.57 -1.91 -2.51 116.57 119.57 3ggj h LYS 140 Ca 0.00 -0.24 -0.00 0.00 -1.87 0.00 0.00 60.65 58.54 3ggj h LYS 140 Cb 0.00 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3ggj h LYS 140 CO 0.00 0.81 -0.16 1.15 -0.57 0.00 0.00 179.45 180.68 3ggj h THR 141 N 0.41 0.66 -0.22 -0.16 2.02 -1.85 -2.72 112.91 111.05 3ggj h THR 141 Ca 0.04 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.19 3ggj h THR 141 Cb 0.87 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 3ggj h THR 141 CO 0.07 0.00 0.03 -0.03 0.37 0.00 0.00 175.52 175.96 3ggj h MET 142 N -0.37 0.36 -0.16 6.66 1.85 -1.89 -0.51 114.93 120.87 3ggj h MET 142 Ca -0.01 -0.10 -0.03 0.00 -0.61 0.00 0.00 59.70 58.95 3ggj h MET 142 Cb 0.33 -0.04 -0.01 0.00 0.43 0.00 0.00 31.60 32.31 3ggj h MET 142 CO -0.00 0.51 -0.02 -0.56 -0.40 0.00 0.00 176.91 176.44 3ggj h GLN 143 N 0.15 0.22 0.00 0.39 3.07 -1.49 0.46 115.11 117.92 3ggj h GLN 143 Ca 0.06 -0.03 -0.05 0.00 0.09 0.00 0.00 58.65 58.72 3ggj h GLN 143 Cb 0.33 -0.04 -0.01 0.00 0.08 0.00 0.00 27.48 27.84 3ggj h GLN 143 CO 0.01 0.26 -0.82 1.79 0.09 0.00 0.00 178.83 180.16 3ggj h THR 144 N 0.22 0.21 -0.21 1.86 1.35 -1.27 -3.10 112.91 111.98 3ggj h THR 144 Ca 0.05 -1.36 -0.21 0.00 -0.55 0.00 0.00 66.41 64.34 3ggj h THR 144 Cb 0.19 1.83 0.01 0.00 -1.73 0.00 0.00 68.15 68.44 3ggj h THR 144 CO 0.01 0.12 -0.68 0.25 -0.25 0.00 0.00 175.52 174.97 3ggj h LEU 145 N 0.00 0.93 -0.89 3.87 7.12 0.35 -3.02 115.31 123.67 3ggj h LEU 145 Ca -0.04 -0.56 0.09 0.00 0.13 0.00 0.00 57.88 57.50 3ggj h LEU 145 Cb 1.17 -0.27 -0.07 0.00 -0.53 0.00 0.00 40.66 40.96 3ggj h LEU 145 CO 0.02 1.36 0.54 -0.07 -0.13 0.00 0.00 178.44 180.16 3ggj h LEU 146 N 0.58 0.81 -1.12 2.25 4.07 -0.22 -1.37 115.31 120.32 3ggj h LEU 146 Ca -0.02 0.04 -0.03 0.00 0.08 0.00 0.00 57.88 57.94 3ggj h LEU 146 Cb 1.29 -0.13 -0.03 0.00 1.08 0.00 0.00 40.66 42.88 3ggj h LEU 146 CO 0.14 0.47 0.24 0.28 -1.08 0.00 0.00 178.44 178.50 3ggj h SER 147 N 0.92 0.78 0.08 -0.43 0.02 -1.46 -1.19 113.55 112.27 3ggj h SER 147 Ca 0.42 -0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 61.27 3ggj h SER 147 Cb 0.33 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.67 3ggj h SER 147 CO -0.23 0.70 -0.04 0.25 -1.14 0.00 0.00 176.83 176.37 3ggj h LEU 148 N 0.85 -0.10 -0.94 5.07 6.46 -1.32 -3.19 115.31 122.14 3ggj h LEU 148 Ca 0.20 -0.39 -0.00 0.00 -0.12 0.00 0.00 57.88 57.57 3ggj h LEU 148 Cb 0.16 0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 40.07 3ggj h LEU 148 CO -0.02 0.36 0.57 0.58 -0.62 0.00 0.00 178.44 179.32 3ggj h VAL 149 N -0.58 1.26 0.00 1.05 2.07 -1.17 -2.79 116.25 116.09 3ggj h VAL 149 Ca -0.01 -0.55 -0.05 0.00 0.82 0.00 0.00 66.70 66.91 3ggj h VAL 149 Cb 0.48 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 3ggj h VAL 149 CO 0.02 0.27 -0.24 0.03 0.02 0.00 0.00 177.57 177.66 3ggj h ARG 150 N 1.29 0.00 0.00 1.57 3.08 -1.32 -2.66 114.38 116.35 3ggj h ARG 150 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.39 3ggj h ARG 150 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.98 3ggj h ARG 150 CO -0.06 0.24 0.00 1.96 -1.07 0.00 0.00 179.97 181.04 3ggj h GLN 151 N 0.00 0.00 -0.57 0.04 4.20 -1.48 0.57 115.11 117.87 3ggj h GLN 151 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3ggj h GLN 151 Cb 0.60 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.38 3ggj h GLN 151 CO 0.03 0.00 0.00 0.66 -0.67 0.00 0.00 178.83 178.85 3ggj n TYR 152 N -2.73 0.90 -2.67 2.96 4.02 -1.00 -5.00 117.16 113.64 3ggj n TYR 152 Ca 0.00 -0.38 -0.22 0.00 -0.01 0.00 0.00 57.90 57.29 3ggj n TYR 152 Cb 0.22 -0.13 0.02 0.00 -0.02 0.00 0.00 39.34 39.43 3ggj n TYR 152 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 3ggj n ASN 153 N 0.73 -3.93 -4.52 7.72 4.13 0.19 -3.42 115.26 116.16 3ggj n ASN 153 Ca 0.17 -0.04 -0.29 0.00 1.68 0.00 0.00 54.58 56.10 3ggj n ASN 153 Cb 0.57 -1.10 0.15 0.00 -1.54 0.00 0.00 39.78 37.87 3ggj n ASN 153 CO 0.00 0.00 0.00 -2.84 0.28 0.00 0.00 177.26 174.70 3ggj s PRO 154 N -1.50 0.88 0.36 3.52 0.02 -1.26 -1.24 135.00 135.78 3ggj s PRO 154 Ca 0.22 0.04 0.19 0.00 0.02 0.00 0.00 61.00 61.47 3ggj s PRO 154 Cb -0.02 -1.83 0.26 0.00 0.02 0.00 0.00 34.50 32.93 3ggj s PRO 154 CO 0.49 -2.33 1.55 -0.22 -0.33 0.00 0.00 177.00 176.16 3ggj h LYS 155 N -1.59 0.00 -1.03 5.54 3.64 -1.53 -3.41 116.57 118.19 3ggj h LYS 155 Ca -0.47 0.00 0.20 0.00 -1.27 0.00 0.00 60.65 59.11 3ggj h LYS 155 Cb 1.30 0.00 -0.34 0.00 -0.41 0.00 0.00 32.23 32.79 3ggj h LYS 155 CO 0.53 0.26 0.90 1.41 -2.27 0.00 0.00 179.45 180.28 3ggj s MET 156 N -3.12 0.02 -0.13 1.90 0.00 -1.25 -4.99 119.30 111.74 3ggj s MET 156 Ca 0.05 0.03 0.02 0.00 0.00 0.00 0.00 55.69 55.80 3ggj s MET 156 Cb 0.07 0.01 0.00 0.00 0.00 0.00 0.00 34.83 34.91 3ggj s MET 156 CO 0.70 -0.00 -0.21 0.08 0.00 0.00 0.00 175.02 175.59 3ggj s VAL 157 N 0.16 2.20 0.11 10.11 1.01 -1.26 -1.35 120.40 131.38 3ggj s VAL 157 Ca 0.05 -0.94 0.10 0.00 0.00 0.00 0.00 61.98 61.19 3ggj s VAL 157 Cb -0.05 -1.88 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 3ggj s VAL 157 CO -0.15 0.55 -0.26 -0.54 0.00 0.00 0.00 175.10 174.70 3ggj s LYS 158 N 0.66 1.55 -0.00 2.72 3.01 -0.49 -5.01 119.74 122.17 3ggj s LYS 158 Ca -0.10 -1.27 0.06 0.00 -1.01 0.00 0.00 55.97 53.65 3ggj s LYS 158 Cb -0.16 -1.95 -0.03 0.00 -1.01 0.00 0.00 37.83 34.68 3ggj s LYS 158 CO 0.02 0.47 -0.18 0.08 0.51 0.00 0.00 175.35 176.25 3ggj s VAL 159 N -1.01 2.77 -0.07 3.17 1.01 -1.26 -0.86 120.40 124.15 3ggj s VAL 159 Ca 0.14 -1.00 0.02 0.00 0.00 0.00 0.00 61.98 61.14 3ggj s VAL 159 Cb -0.10 -2.10 0.02 0.00 0.00 0.00 0.00 36.38 34.19 3ggj s VAL 159 CO 0.06 0.47 -0.10 0.00 0.00 0.00 0.00 175.10 175.53 3ggj s ALA 160 N -0.80 1.14 -0.06 5.51 0.00 0.21 -1.35 121.76 126.42 3ggj s ALA 160 Ca 0.13 -0.35 0.03 0.00 0.00 0.00 0.00 51.96 51.76 3ggj s ALA 160 Cb -0.10 -0.57 0.01 0.00 0.00 0.00 0.00 23.12 22.45 3ggj s ALA 160 CO 0.02 0.03 -0.13 0.45 0.00 0.00 0.00 175.76 176.13 3ggj s SER 161 N 0.83 1.82 0.11 0.00 0.15 0.24 -0.68 113.70 116.16 3ggj s SER 161 Ca -0.12 -0.31 -0.23 0.00 0.70 0.00 0.00 55.95 55.99 3ggj s SER 161 Cb -0.15 -0.78 -0.08 0.00 -1.71 0.00 0.00 66.02 63.30 3ggj s SER 161 CO 0.02 0.05 1.69 0.25 1.20 0.00 0.00 173.24 176.45 3ggj h LEU 162 N 6.83 -0.32 -8.02 3.45 6.46 -1.38 0.74 115.31 123.07 3ggj h LEU 162 Ca -0.31 0.05 -0.54 0.00 -0.12 0.00 0.00 57.88 56.97 3ggj h LEU 162 Cb 1.19 0.14 -0.34 0.00 -0.73 0.00 0.00 40.66 40.92 3ggj h LEU 162 CO 0.48 -0.16 -0.82 -0.76 -0.62 0.00 0.00 178.44 176.56 3ggj s LEU 163 N -10.31 1.69 -0.17 2.25 1.43 -0.32 0.42 118.68 113.66 3ggj s LEU 163 Ca -0.14 -0.34 -0.00 0.00 -1.03 0.00 0.00 54.13 52.62 3ggj s LEU 163 Cb 0.08 -0.91 0.00 0.00 0.03 0.00 0.00 46.19 45.40 3ggj s LEU 163 CO 0.67 0.04 -0.15 -0.69 0.23 0.00 0.00 176.35 176.45 3ggj s VAL 164 N 0.68 2.58 0.02 -1.59 1.01 -0.27 -0.09 120.40 122.74 3ggj s VAL 164 Ca -0.14 -0.78 -0.24 0.00 0.00 0.00 0.00 61.98 60.82 3ggj s VAL 164 Cb -0.16 -2.10 -0.05 0.00 0.00 0.00 0.00 36.38 34.07 3ggj s VAL 164 CO 0.04 0.51 0.74 -0.75 0.00 0.00 0.00 175.10 175.63 3ggj s LYS 165 N 1.09 4.46 -0.87 2.72 2.20 -0.12 -1.15 119.74 128.07 3ggj s LYS 165 Ca -0.00 1.00 -0.19 0.00 -0.36 0.00 0.00 55.97 56.42 3ggj s LYS 165 Cb -0.14 -3.38 0.12 0.00 -1.51 0.00 0.00 37.83 32.92 3ggj s LYS 165 CO -0.05 0.24 1.09 0.50 -0.36 0.00 0.00 175.35 176.78 3ggj s ARG 166 N 0.11 3.50 -0.02 4.03 3.52 -0.13 -4.82 118.95 125.15 3ggj s ARG 166 Ca 0.38 -1.58 0.05 0.00 -0.13 0.00 0.00 55.73 54.44 3ggj s ARG 166 Cb -0.20 -4.79 -0.01 0.00 -1.56 0.00 0.00 34.95 28.40 3ggj s ARG 166 CO 0.21 -1.78 -0.15 0.99 -0.81 0.00 0.00 175.30 173.76 3ggj s THR 167 N 2.95 1.23 0.64 4.11 2.01 -1.26 -3.81 115.64 121.50 3ggj s THR 167 Ca 0.30 -0.66 0.38 0.00 0.31 0.00 0.00 61.69 62.02 3ggj s THR 167 Cb -0.07 -1.03 0.40 0.00 0.01 0.00 0.00 72.50 71.81 3ggj s THR 167 CO -0.06 0.35 2.28 -0.65 -0.69 0.00 0.00 174.62 175.86 3ggj h PRO 168 N 5.83 0.00 0.00 4.92 0.11 -1.98 -1.26 132.00 139.62 3ggj h PRO 168 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 3ggj h PRO 168 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3ggj h PRO 168 CO 0.49 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.82 3ggj n ARG 169 N -3.37 0.62 -2.11 1.05 1.74 -1.26 -4.82 116.66 108.50 3ggj n ARG 169 Ca -0.02 0.02 -0.41 0.00 -0.77 0.00 0.00 57.85 56.66 3ggj n ARG 169 Cb 0.12 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.04 3ggj n ARG 169 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3ggj s SER 170 N -2.30 6.77 -0.03 0.55 0.15 -0.48 -4.54 113.70 113.81 3ggj s SER 170 Ca 0.33 2.62 0.12 0.00 0.70 0.00 0.00 55.95 59.72 3ggj s SER 170 Cb 0.19 -2.63 0.40 0.00 -1.71 0.00 0.00 66.02 62.27 3ggj s SER 170 CO 0.37 -0.58 1.30 1.33 1.20 0.00 0.00 173.24 176.86 3ggj n VAL 171 N 1.67 0.80 0.00 4.45 0.24 0.60 -4.93 118.33 121.16 3ggj n VAL 171 Ca 0.03 -0.63 0.00 0.00 -2.04 0.00 0.00 64.34 61.70 3ggj n VAL 171 Cb 0.41 0.15 0.00 0.00 -1.47 0.00 0.00 33.84 32.93 3ggj n VAL 171 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ggj n GLY 172 N 1.02 1.85 3.68 7.63 0.00 -1.26 -5.03 105.19 113.07 3ggj n GLY 172 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 3ggj n GLY 172 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3ggj n TYR 173 N -2.00 2.54 -4.49 1.61 9.36 -1.26 -4.99 117.16 117.93 3ggj n TYR 173 Ca 0.00 -0.19 -0.34 0.00 3.32 0.00 0.00 57.90 60.69 3ggj n TYR 173 Cb 0.00 -2.74 -0.14 0.00 -0.63 0.00 0.00 39.34 35.83 3ggj n TYR 173 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 3ggj s LYS 174 N 3.41 3.42 0.94 2.98 1.02 -1.26 -4.92 119.74 125.34 3ggj s LYS 174 Ca 0.86 -0.65 -0.11 0.00 0.02 0.00 0.00 55.97 56.09 3ggj s LYS 174 Cb -0.50 -2.77 0.16 0.00 -0.52 0.00 0.00 37.83 34.20 3ggj s LYS 174 CO 0.41 0.11 1.10 -1.25 -0.92 0.00 0.00 175.35 174.80 3ggj s PRO 175 N 0.64 0.83 0.30 -1.68 0.04 -1.26 -4.94 135.00 128.92 3ggj s PRO 175 Ca -0.05 1.14 0.15 0.00 0.04 0.00 0.00 61.00 62.28 3ggj s PRO 175 Cb -0.15 -1.73 0.26 0.00 0.04 0.00 0.00 34.50 32.91 3ggj s PRO 175 CO 0.03 -2.63 1.53 -0.44 0.04 0.00 0.00 177.00 175.53 3ggj h ASP 176 N -1.85 0.00 -3.27 6.66 3.32 -1.60 -3.44 116.42 116.24 3ggj h ASP 176 Ca -0.49 0.00 -0.43 0.00 0.02 0.00 0.00 57.03 56.13 3ggj h ASP 176 Cb 1.28 0.00 -0.38 0.00 0.22 0.00 0.00 39.33 40.45 3ggj h ASP 176 CO 0.48 0.51 -0.76 -0.36 -1.72 0.00 0.00 179.24 177.39 3ggj s PHE 177 N -3.17 0.61 -0.12 4.55 0.08 -0.57 -5.00 117.98 114.35 3ggj s PHE 177 Ca 0.02 -0.13 0.02 0.00 0.12 0.00 0.00 56.93 56.97 3ggj s PHE 177 Cb 0.09 -0.76 -0.00 0.00 -0.57 0.00 0.00 43.02 41.78 3ggj s PHE 177 CO 0.73 -0.31 -0.20 0.08 -0.10 0.00 0.00 175.22 175.42 3ggj s VAL 178 N 1.92 2.32 -0.01 -0.44 1.01 -1.26 -0.60 120.40 123.35 3ggj s VAL 178 Ca 0.04 -0.91 -0.13 0.00 0.00 0.00 0.00 61.98 60.98 3ggj s VAL 178 Cb -0.12 -1.93 -0.07 0.00 0.00 0.00 0.00 36.38 34.26 3ggj s VAL 178 CO -0.05 0.54 0.75 1.23 0.00 0.00 0.00 175.10 177.57 3ggj h GLY 179 N 6.97 -0.49 -5.69 4.51 0.00 -0.23 -3.38 103.07 104.75 3ggj h GLY 179 Ca -0.26 0.18 -0.22 0.00 0.00 0.00 0.00 47.33 47.04 3ggj h GLY 179 CO 0.52 -0.18 -0.60 -1.36 0.00 0.00 0.00 176.54 174.92 3ggj s PHE 180 N -3.29 -0.12 -0.29 5.60 0.40 0.17 -2.32 117.98 118.13 3ggj s PHE 180 Ca -0.07 0.33 -0.11 0.00 -0.60 0.00 0.00 56.93 56.47 3ggj s PHE 180 Cb 0.01 -0.00 -0.04 0.00 0.51 0.00 0.00 43.02 43.49 3ggj s PHE 180 CO 0.21 -0.08 0.20 -2.00 0.70 0.00 0.00 175.22 174.24 3ggj s GLU 181 N 0.36 3.87 0.27 0.44 2.12 0.14 -1.11 118.70 124.78 3ggj s GLU 181 Ca -0.02 -0.38 0.12 0.00 0.36 0.00 0.00 54.97 55.05 3ggj s GLU 181 Cb -0.04 -3.68 -0.05 0.00 0.26 0.00 0.00 34.13 30.62 3ggj s GLU 181 CO -0.01 -0.22 -0.20 0.96 -0.54 0.00 0.00 175.26 175.24 3ggj s ILE 182 N 1.75 2.47 0.89 -3.70 -4.36 -0.30 -0.57 121.20 117.38 3ggj s ILE 182 Ca 0.07 -2.36 -0.10 0.00 -0.26 0.00 0.00 60.65 58.00 3ggj s ILE 182 Cb -0.16 -2.28 0.13 0.00 1.25 0.00 0.00 42.46 41.40 3ggj s ILE 182 CO 0.11 -0.37 1.13 -2.84 0.24 0.00 0.00 174.94 173.22 3ggj s PRO 183 N -3.41 1.23 -1.36 0.37 0.02 -1.25 -0.95 135.00 129.65 3ggj s PRO 183 Ca 0.29 1.45 -0.15 0.00 0.02 0.00 0.00 61.00 62.60 3ggj s PRO 183 Cb -0.05 -1.76 0.02 0.00 0.02 0.00 0.00 34.50 32.72 3ggj s PRO 183 CO 0.14 -2.45 2.14 -3.47 -0.33 0.00 0.00 177.00 173.03 3ggj n ASP 184 N -4.10 3.81 -4.09 2.53 2.03 -1.25 -4.55 116.55 110.92 3ggj n ASP 184 Ca 0.11 -2.83 -0.12 0.00 0.52 0.00 0.00 54.79 52.47 3ggj n ASP 184 Cb 0.52 -1.61 -0.11 0.00 -0.72 0.00 0.00 41.12 39.21 3ggj n ASP 184 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 3ggj s LYS 185 N 3.56 0.62 -0.40 -0.67 1.02 -1.26 -5.10 119.74 117.51 3ggj s LYS 185 Ca 0.49 -0.92 -0.26 0.00 0.02 0.00 0.00 55.97 55.30 3ggj s LYS 185 Cb 0.13 -0.27 0.02 0.00 -0.52 0.00 0.00 37.83 37.18 3ggj s LYS 185 CO -0.05 0.03 0.93 0.12 -0.92 0.00 0.00 175.35 175.47 3ggj s PHE 186 N -2.01 3.01 0.16 3.18 5.36 -1.26 -5.03 117.98 121.40 3ggj s PHE 186 Ca -0.04 0.63 0.05 0.00 -0.96 0.00 0.00 56.93 56.61 3ggj s PHE 186 Cb -0.06 -3.78 -0.04 0.00 -0.34 0.00 0.00 43.02 38.80 3ggj s PHE 186 CO -0.01 -0.94 0.12 0.14 -1.46 0.00 0.00 175.22 173.08 3ggj s VAL 187 N 3.60 4.42 0.17 3.12 -7.23 -1.26 -1.89 120.40 121.32 3ggj s VAL 187 Ca 0.38 -1.11 -0.00 0.00 -1.81 0.00 0.00 61.98 59.44 3ggj s VAL 187 Cb -0.11 -3.25 -0.04 0.00 0.56 0.00 0.00 36.38 33.53 3ggj s VAL 187 CO 0.22 -0.11 0.06 0.68 -0.31 0.00 0.00 175.10 175.64 3ggj s VAL 188 N -1.75 0.28 0.00 1.32 -7.23 -0.16 -4.89 120.40 107.98 3ggj s VAL 188 Ca 0.31 -1.96 0.00 0.00 -1.81 0.00 0.00 61.98 58.52 3ggj s VAL 188 Cb -0.10 -2.23 0.00 0.00 0.56 0.00 0.00 36.38 34.61 3ggj s VAL 188 CO 0.23 -0.32 0.00 0.61 -0.31 0.00 0.00 175.10 175.31 3ggj n GLY 189 N -0.21 1.68 5.37 2.32 0.00 0.61 -0.92 105.19 114.04 3ggj n GLY 189 Ca -0.04 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.93 3ggj n GLY 189 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3ggj n TYR 190 N 0.91 0.00 -0.00 1.61 9.36 0.21 -1.12 117.16 128.13 3ggj n TYR 190 Ca 0.00 0.00 0.04 0.00 3.32 0.00 0.00 57.90 61.26 3ggj n TYR 190 Cb 0.00 0.00 -0.06 0.00 -0.63 0.00 0.00 39.34 38.65 3ggj n TYR 190 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3ggj n ALA 191 N 2.78 2.30 -2.53 2.98 0.00 -1.26 -4.88 120.51 119.90 3ggj n ALA 191 Ca 0.00 -0.21 -0.42 0.00 0.00 0.00 0.00 53.44 52.81 3ggj n ALA 191 Cb 0.00 -0.28 -0.07 0.00 0.00 0.00 0.00 19.45 19.10 3ggj n ALA 191 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3ggj s LEU 192 N -3.60 4.47 0.54 0.00 1.43 -0.28 -4.59 118.68 116.66 3ggj s LEU 192 Ca -0.03 -0.22 -0.03 0.00 -1.03 0.00 0.00 54.13 52.82 3ggj s LEU 192 Cb 0.05 -2.64 0.01 0.00 0.03 0.00 0.00 46.19 43.64 3ggj s LEU 192 CO 0.35 -0.63 0.81 1.51 0.23 0.00 0.00 176.35 178.62 3ggj s ASP 193 N 1.87 5.58 -0.24 2.29 -4.77 -1.26 -0.28 116.67 119.86 3ggj s ASP 193 Ca 0.20 0.45 -0.01 0.00 -3.30 0.00 0.00 52.55 49.89 3ggj s ASP 193 Cb -0.15 -1.50 0.07 0.00 -1.09 0.00 0.00 42.92 40.26 3ggj s ASP 193 CO 0.16 -0.99 0.04 -0.47 0.70 0.00 0.00 175.17 174.61 3ggj s TYR 194 N -2.83 1.54 -1.52 2.11 5.04 0.30 -4.82 117.35 117.16 3ggj s TYR 194 Ca 0.53 -1.32 -0.05 0.00 -2.44 0.00 0.00 57.07 53.79 3ggj s TYR 194 Cb -0.10 -1.36 0.04 0.00 0.35 0.00 0.00 41.96 40.89 3ggj s TYR 194 CO 0.42 -0.73 0.40 0.09 -1.34 0.00 0.00 175.55 174.39 3ggj n ASN 195 N 4.90 -0.69 -0.12 4.32 3.02 -1.26 -0.23 115.26 125.21 3ggj n ASN 195 Ca -0.07 -1.08 -0.02 0.00 -0.03 0.00 0.00 54.58 53.38 3ggj n ASN 195 Cb 0.45 -2.60 -0.01 0.00 -0.61 0.00 0.00 39.78 37.01 3ggj n ASN 195 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 3ggj n GLU 196 N -4.43 -0.66 -4.12 3.52 0.00 -1.26 -4.99 120.64 108.71 3ggj n GLU 196 Ca -0.22 0.30 -0.23 0.00 0.00 0.00 0.00 57.16 57.01 3ggj n GLU 196 Cb 0.64 -3.88 -0.06 0.00 0.00 0.00 0.00 31.44 28.14 3ggj n GLU 196 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 3ggj s TYR 197 N -1.78 2.81 -0.46 -1.84 1.51 0.68 -4.58 117.35 113.68 3ggj s TYR 197 Ca 0.00 -0.27 0.00 0.00 -1.01 0.00 0.00 57.07 55.79 3ggj s TYR 197 Cb 0.00 -1.49 0.00 0.00 -0.11 0.00 0.00 41.96 40.36 3ggj s TYR 197 CO 0.00 0.43 0.00 1.19 -1.11 0.00 0.00 175.55 176.06 3ggj n PHE 198 N -1.12 0.00 -0.12 2.71 3.72 -1.26 -0.54 117.46 120.85 3ggj n PHE 198 Ca -0.05 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.32 3ggj n PHE 198 Cb 0.60 -1.36 0.18 0.00 -0.94 0.00 0.00 39.48 37.96 3ggj n PHE 198 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 3ggj h ARG 199 N 0.30 0.81 -0.06 -1.08 9.65 -1.87 -2.36 114.38 119.78 3ggj h ARG 199 Ca -0.09 -0.18 0.00 0.00 -1.10 0.00 0.00 59.98 58.61 3ggj h ARG 199 Cb 0.54 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 29.00 3ggj h ARG 199 CO 0.13 0.76 0.00 -0.40 2.80 0.00 0.00 179.97 183.26 3ggj n ASP 200 N -4.26 1.10 -4.62 -3.80 5.75 -1.26 -4.78 116.55 104.68 3ggj n ASP 200 Ca 0.03 -1.48 -0.42 0.00 -0.01 0.00 0.00 54.79 52.92 3ggj n ASP 200 Cb 0.25 -0.04 -0.05 0.00 -1.03 0.00 0.00 41.12 40.25 3ggj n ASP 200 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 3ggj s LEU 201 N -1.79 4.09 0.21 -2.12 2.96 -0.89 -4.94 118.68 116.20 3ggj s LEU 201 Ca 0.36 0.73 0.08 0.00 -0.22 0.00 0.00 54.13 55.08 3ggj s LEU 201 Cb 0.19 -3.04 0.14 0.00 0.50 0.00 0.00 46.19 43.97 3ggj s LEU 201 CO 0.30 -0.54 1.48 0.78 -1.32 0.00 0.00 176.35 177.05 3ggj h ASN 202 N 8.00 0.06 -2.55 3.68 4.21 -1.86 0.61 115.58 127.73 3ggj h ASN 202 Ca -0.25 -0.04 -0.54 0.00 1.21 0.00 0.00 56.30 56.68 3ggj h ASN 202 Cb 1.10 -0.02 -0.03 0.00 -1.12 0.00 0.00 38.32 38.25 3ggj h ASN 202 CO 0.86 0.79 -0.48 -1.00 -1.29 0.00 0.00 177.43 176.31 3ggj s HIS 203 N -3.32 3.41 -0.44 1.19 3.76 -1.26 -3.51 115.29 115.12 3ggj s HIS 203 Ca -0.01 0.08 -0.26 0.00 -0.15 0.00 0.00 55.06 54.71 3ggj s HIS 203 Cb 0.12 -1.63 0.02 0.00 1.11 0.00 0.00 32.58 32.20 3ggj s HIS 203 CO 0.79 0.51 0.97 0.08 -0.85 0.00 0.00 174.74 176.24 3ggj s VAL 204 N -1.77 4.44 0.06 -0.90 1.01 -0.53 -3.06 120.40 119.65 3ggj s VAL 204 Ca 0.34 0.96 0.07 0.00 0.00 0.00 0.00 61.98 63.34 3ggj s VAL 204 Cb -0.11 -4.45 -0.03 0.00 0.00 0.00 0.00 36.38 31.80 3ggj s VAL 204 CO 0.28 -0.80 -0.19 0.00 0.00 0.00 0.00 175.10 174.38 3ggj s VAL 206 N -0.92 3.21 0.05 0.00 1.01 -0.28 -0.99 120.40 122.48 3ggj s VAL 206 Ca 0.05 0.92 -0.31 0.00 0.00 0.00 0.00 61.98 62.65 3ggj s VAL 206 Cb -0.09 -3.59 -0.06 0.00 0.00 0.00 0.00 36.38 32.64 3ggj s VAL 206 CO 0.02 0.10 1.21 -0.51 0.00 0.00 0.00 175.10 175.93 3ggj s ILE 207 N 0.65 4.01 0.77 2.22 2.07 -0.79 -0.77 121.20 129.34 3ggj s ILE 207 Ca 0.61 1.43 -0.12 0.00 -1.41 0.00 0.00 60.65 61.17 3ggj s ILE 207 Cb -0.37 -3.92 0.05 0.00 0.13 0.00 0.00 42.46 38.35 3ggj s ILE 207 CO 0.34 0.10 1.13 -0.94 -1.91 0.00 0.00 174.94 173.66 3ggj s SER 208 N 1.12 4.87 0.23 4.50 1.04 0.39 -4.61 113.70 121.24 3ggj s SER 208 Ca 0.59 1.01 0.05 0.00 0.48 0.00 0.00 55.95 58.07 3ggj s SER 208 Cb -0.30 -1.67 0.23 0.00 0.10 0.00 0.00 66.02 64.38 3ggj s SER 208 CO 0.29 -1.70 1.54 -0.33 0.98 0.00 0.00 173.24 174.02 3ggj h GLU 209 N -0.91 0.22 0.00 4.02 4.39 -1.90 0.34 114.58 120.75 3ggj h GLU 209 Ca -0.46 -0.16 -0.11 0.00 0.34 0.00 0.00 59.36 58.97 3ggj h GLU 209 Cb 1.29 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.95 3ggj h GLU 209 CO 0.64 0.78 -0.51 1.79 -1.16 0.00 0.00 179.01 180.55 3ggj h THR 210 N 0.16 1.21 0.11 1.13 1.35 -1.92 -2.35 112.91 112.60 3ggj h THR 210 Ca -0.01 -1.84 -0.29 0.00 -0.55 0.00 0.00 66.41 63.72 3ggj h THR 210 Cb 1.15 2.04 0.03 0.00 -1.73 0.00 0.00 68.15 69.63 3ggj h THR 210 CO 0.10 0.50 -1.22 1.23 -0.25 0.00 0.00 175.52 175.88 3ggj h GLY 211 N 1.90 0.66 1.09 5.82 0.00 -1.70 -1.76 103.07 109.08 3ggj h GLY 211 Ca -0.01 -1.36 0.09 0.00 0.00 0.00 0.00 47.33 46.05 3ggj h GLY 211 CO 0.07 1.20 0.39 1.70 0.00 0.00 0.00 176.54 179.89 3ggj h LYS 212 N 0.26 0.38 0.12 4.80 3.64 -0.22 -2.50 116.57 123.05 3ggj h LYS 212 Ca -0.17 -0.02 -0.34 0.00 -1.27 0.00 0.00 60.65 58.84 3ggj h LYS 212 Cb 1.89 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 33.61 3ggj h LYS 212 CO 0.23 0.25 -1.85 0.00 -2.27 0.00 0.00 179.45 175.81 3ggj h ALA 213 N 1.71 0.36 -0.08 5.00 0.00 -1.46 -3.10 119.26 121.69 3ggj h ALA 213 Ca 0.26 -1.32 -0.00 0.00 0.00 0.00 0.00 54.91 53.85 3ggj h ALA 213 Cb 0.52 0.66 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 3ggj h ALA 213 CO -0.07 1.18 0.04 -0.22 0.00 0.00 0.00 179.25 180.19 3ggj h LYS 214 N -0.06 0.10 -0.01 0.00 3.64 -1.26 -3.24 116.57 115.75 3ggj h LYS 214 Ca -0.40 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.97 3ggj h LYS 214 Cb 1.95 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.75 3ggj h LYS 214 CO 0.07 0.08 -0.26 0.66 -2.27 0.00 0.00 179.45 177.72 3ggj n TYR 215 N -4.52 0.00 -1.55 1.91 4.01 -0.95 -5.04 117.16 111.02 3ggj n TYR 215 Ca -0.02 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.35 3ggj n TYR 215 Cb 0.09 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.18 3ggj n TYR 215 CO 0.00 0.00 0.00 0.36 -0.46 0.00 0.00 176.86 176.76 3ggj n LYS 216 N -0.27 0.77 0.00 -0.72 0.00 -1.17 -4.68 118.16 112.08 3ggj n LYS 216 Ca 0.05 0.31 0.10 0.00 -0.00 0.00 0.00 58.31 58.77 3ggj n LYS 216 Cb 0.24 -2.18 0.58 0.00 -0.00 0.00 0.00 35.03 33.67 3ggj n LYS 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40