#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g3t s PHE 4 N 0.00 -0.11 0.05 5.58 -0.71 -1.26 -4.36 117.98 117.16 2g3t s PHE 4 Ca 0.00 0.00 0.03 0.00 -1.04 0.00 0.00 56.93 55.93 2g3t s PHE 4 Cb 0.00 0.54 -0.02 0.00 -1.21 0.00 0.00 43.02 42.33 2g3t s PHE 4 CO 0.00 -0.33 -0.10 0.08 -1.34 0.00 0.00 175.22 173.53 2g3t s VAL 5 N -2.58 0.78 -0.20 -2.49 1.01 -0.13 -4.97 120.40 111.83 2g3t s VAL 5 Ca 0.11 -1.06 -0.04 0.00 0.00 0.00 0.00 61.98 60.99 2g3t s VAL 5 Cb 0.01 -0.78 -0.02 0.00 0.00 0.00 0.00 36.38 35.60 2g3t s VAL 5 CO -0.04 -0.24 -0.02 -0.63 0.00 0.00 0.00 175.10 174.18 2g3t s ILE 6 N -1.17 3.81 0.13 2.22 -1.09 -1.26 -0.95 121.20 122.89 2g3t s ILE 6 Ca -0.05 -0.36 -0.09 0.00 -2.23 0.00 0.00 60.65 57.92 2g3t s ILE 6 Cb -0.09 -2.71 -0.01 0.00 -1.58 0.00 0.00 42.46 38.07 2g3t s ILE 6 CO 0.01 0.44 0.24 0.00 -1.23 0.00 0.00 174.94 174.40 2g3t s ARG 7 N 1.00 1.02 0.52 2.79 1.70 -0.64 -4.96 118.95 120.38 2g3t s ARG 7 Ca 0.01 -1.09 -0.21 0.00 -0.47 0.00 0.00 55.73 53.98 2g3t s ARG 7 Cb -0.14 0.36 -0.06 0.00 -0.57 0.00 0.00 34.95 34.54 2g3t s ARG 7 CO 0.01 -0.36 1.16 -1.25 -1.08 0.00 0.00 175.30 173.78 2g3t s PRO 8 N -3.92 3.44 0.57 3.89 0.04 -1.26 -0.26 135.00 137.49 2g3t s PRO 8 Ca 0.12 1.71 -0.16 0.00 0.04 0.00 0.00 61.00 62.71 2g3t s PRO 8 Cb 0.04 -2.14 -0.05 0.00 0.04 0.00 0.00 34.50 32.39 2g3t s PRO 8 CO -0.05 -0.80 1.03 0.00 0.04 0.00 0.00 177.00 177.23 2g3t s ALA 9 N -1.66 2.86 0.36 8.56 0.00 0.06 -4.73 121.76 127.22 2g3t s ALA 9 Ca 0.70 0.31 0.06 0.00 0.00 0.00 0.00 51.96 53.03 2g3t s ALA 9 Cb -0.27 -3.19 -0.07 0.00 0.00 0.00 0.00 23.12 19.59 2g3t s ALA 9 CO 0.31 -0.60 0.01 0.95 0.00 0.00 0.00 175.76 176.43 2g3t s THR 10 N -2.53 1.69 0.39 0.00 -4.23 -1.26 -4.92 115.64 104.78 2g3t s THR 10 Ca 0.62 -2.03 0.12 0.00 -1.18 0.00 0.00 61.69 59.22 2g3t s THR 10 Cb -0.14 -2.84 0.34 0.00 1.34 0.00 0.00 72.50 71.20 2g3t s THR 10 CO 0.35 -0.05 1.88 0.00 -0.54 0.00 0.00 174.62 176.26 2g3t h ALA 11 N 1.96 1.98 0.00 3.99 0.00 -1.97 0.64 119.26 125.86 2g3t h ALA 11 Ca -0.42 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 2g3t h ALA 11 Cb 1.24 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 2g3t h ALA 11 CO 0.75 -0.22 -0.01 0.00 0.00 0.00 0.00 179.25 179.77 2g3t h ALA 12 N 1.61 1.04 -0.00 0.00 0.00 -2.03 -2.26 119.26 117.62 2g3t h ALA 12 Ca 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.34 2g3t h ALA 12 Cb 0.85 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2g3t h ALA 12 CO -0.18 0.01 -0.14 -0.25 0.00 0.00 0.00 179.25 178.69 2g3t n ASP 13 N -3.15 0.44 0.10 0.00 8.00 0.22 -4.20 116.55 117.97 2g3t n ASP 13 Ca -0.02 -0.44 0.10 0.00 0.71 0.00 0.00 54.79 55.14 2g3t n ASP 13 Cb 0.15 -0.08 0.59 0.00 -0.02 0.00 0.00 41.12 41.76 2g3t n ASP 13 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2g3t h SER 15 N 0.16 0.84 -0.62 0.00 4.64 -1.82 -1.71 113.55 115.04 2g3t h SER 15 Ca 0.12 -0.42 -0.07 0.00 -0.47 0.00 0.00 61.79 60.96 2g3t h SER 15 Cb 0.29 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.12 2g3t h SER 15 CO -0.02 1.08 0.13 0.44 -0.87 0.00 0.00 176.83 177.59 2g3t h ASP 16 N 0.61 0.97 -0.30 4.97 3.32 -1.51 -1.74 116.42 122.73 2g3t h ASP 16 Ca 0.08 -0.24 -0.03 0.00 0.02 0.00 0.00 57.03 56.86 2g3t h ASP 16 Cb 0.78 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.06 2g3t h ASP 16 CO 0.06 0.96 0.07 0.40 -1.72 0.00 0.00 179.24 179.02 2g3t h ILE 17 N 0.93 1.22 -0.60 0.35 2.04 -1.05 -0.87 117.51 119.52 2g3t h ILE 17 Ca 0.19 -0.72 -0.04 0.00 1.00 0.00 0.00 64.86 65.29 2g3t h ILE 17 Cb 0.39 1.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.56 2g3t h ILE 17 CO 0.01 0.24 0.21 0.25 0.00 0.00 0.00 178.15 178.85 2g3t h LEU 18 N 0.32 0.82 -0.57 1.44 5.85 -1.23 0.22 115.31 122.16 2g3t h LEU 18 Ca 0.09 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 2g3t h LEU 18 Cb 0.29 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 2g3t h LEU 18 CO 0.00 0.76 0.32 -0.09 -0.34 0.00 0.00 178.44 179.10 2g3t h ARG 19 N 0.87 0.78 -0.04 1.25 2.43 -1.00 -0.10 114.38 118.58 2g3t h ARG 19 Ca 0.20 -0.08 -0.13 0.00 -0.81 0.00 0.00 59.98 59.16 2g3t h ARG 19 Cb 0.22 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2g3t h ARG 19 CO -0.01 0.59 -0.58 -0.07 -1.51 0.00 0.00 179.97 178.38 2g3t h LEU 20 N 0.77 0.15 -0.32 3.80 3.38 -0.55 -1.60 115.31 120.94 2g3t h LEU 20 Ca 0.20 -0.08 -0.08 0.00 0.09 0.00 0.00 57.88 58.01 2g3t h LEU 20 Cb 0.02 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2g3t h LEU 20 CO -0.03 0.70 -0.13 0.40 0.09 0.00 0.00 178.44 179.46 2g3t h ILE 21 N 0.10 1.29 -0.03 1.22 2.04 -0.16 0.18 117.51 122.16 2g3t h ILE 21 Ca -0.00 -1.21 -0.07 0.00 1.00 0.00 0.00 64.86 64.58 2g3t h ILE 21 Cb 1.05 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 38.53 2g3t h ILE 21 CO 0.08 0.39 -0.29 0.11 0.00 0.00 0.00 178.15 178.45 2g3t h LYS 22 N 0.41 0.05 -0.00 2.37 1.57 -0.90 0.23 116.57 120.30 2g3t h LYS 22 Ca 0.07 -0.02 -0.19 0.00 -1.87 0.00 0.00 60.65 58.65 2g3t h LYS 22 Cb 0.64 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 2g3t h LYS 22 CO 0.04 0.34 -0.84 1.49 -0.57 0.00 0.00 179.45 179.91 2g3t h GLU 23 N 0.05 0.18 -0.27 3.15 4.81 -1.01 -2.62 114.58 118.87 2g3t h GLU 23 Ca 0.01 -0.19 -0.16 0.00 -0.13 0.00 0.00 59.36 58.88 2g3t h GLU 23 Cb 0.54 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.97 2g3t h GLU 23 CO 0.04 0.92 -0.47 1.25 -0.73 0.00 0.00 179.01 180.02 2g3t h LEU 24 N 0.11 0.88 -1.74 1.64 5.85 0.22 -1.95 115.31 120.32 2g3t h LEU 24 Ca -0.04 -0.53 0.00 0.00 0.84 0.00 0.00 57.88 58.16 2g3t h LEU 24 Cb 1.46 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.22 2g3t h LEU 24 CO 0.13 1.24 0.17 0.00 -0.34 0.00 0.00 178.44 179.64 2g3t h ALA 25 N 0.67 1.81 -0.09 1.25 0.00 -0.51 0.33 119.26 122.70 2g3t h ALA 25 Ca 0.02 -0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.68 2g3t h ALA 25 Cb 1.07 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.77 2g3t h ALA 25 CO 0.11 0.18 -0.83 -0.22 0.00 0.00 0.00 179.25 178.49 2g3t h LYS 26 N 0.35 0.72 0.09 0.00 3.64 -1.30 -3.27 116.57 116.81 2g3t h LYS 26 Ca 0.09 -0.65 0.01 0.00 -1.27 0.00 0.00 60.65 58.83 2g3t h LYS 26 Cb -0.03 0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 2g3t h LYS 26 CO -0.02 1.25 -0.11 -0.92 -2.27 0.00 0.00 179.45 177.38 2g3t h TYR 27 N 0.42 -0.29 -2.95 1.91 3.20 -0.44 -3.43 116.97 115.38 2g3t h TYR 27 Ca -0.08 0.00 -0.54 0.00 3.14 0.00 0.00 58.73 61.25 2g3t h TYR 27 Cb 1.47 0.12 0.22 0.00 1.54 0.00 0.00 36.73 40.08 2g3t h TYR 27 CO 0.10 -0.17 -0.94 0.39 -1.64 0.00 0.00 178.16 175.90 2g3t n GLU 28 N -5.23 -0.14 -0.08 1.82 -0.58 -0.01 -4.94 120.64 111.48 2g3t n GLU 28 Ca -0.07 -0.01 -0.07 0.00 -0.42 0.00 0.00 57.16 56.59 2g3t n GLU 28 Cb 0.16 -1.59 -0.15 0.00 -0.57 0.00 0.00 31.44 29.29 2g3t n GLU 28 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2g3t n TYR 29 N -3.10 0.00 -0.99 -0.32 4.01 -1.26 -4.55 117.16 110.94 2g3t n TYR 29 Ca 0.05 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.53 2g3t n TYR 29 Cb 0.54 -0.87 -0.06 0.00 -0.31 0.00 0.00 39.34 38.64 2g3t n TYR 29 CO 0.00 0.00 0.00 -0.12 -0.46 0.00 0.00 176.86 176.28 2g3t n MET 30 N -2.63 2.60 -1.06 -0.72 1.56 -1.26 -4.91 117.12 110.69 2g3t n MET 30 Ca -0.27 -1.56 -0.44 0.00 -0.27 0.00 0.00 57.70 55.16 2g3t n MET 30 Cb 1.04 -2.43 -0.07 0.00 2.15 0.00 0.00 33.22 33.90 2g3t n MET 30 CO 0.00 0.00 0.00 -1.91 -0.73 0.00 0.00 175.97 173.33 2g3t n GLU 31 N 3.48 0.00 -3.87 2.12 4.07 -1.26 -4.96 120.64 120.21 2g3t n GLU 31 Ca 0.55 0.00 -0.11 0.00 -0.06 0.00 0.00 57.16 57.54 2g3t n GLU 31 Cb 0.35 -1.02 -0.10 0.00 -0.06 0.00 0.00 31.44 30.61 2g3t n GLU 31 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 2g3t s GLU 32 N 2.81 0.44 0.05 5.31 2.12 -1.26 -5.15 118.70 123.02 2g3t s GLU 32 Ca 0.75 -0.35 -0.28 0.00 0.36 0.00 0.00 54.97 55.45 2g3t s GLU 32 Cb -1.02 0.18 -0.05 0.00 0.26 0.00 0.00 34.13 33.51 2g3t s GLU 32 CO 0.52 -0.10 0.88 -1.14 -0.54 0.00 0.00 175.26 174.88 2g3t s GLN 33 N -1.24 4.58 -0.34 4.30 2.00 -1.26 -4.96 119.66 122.73 2g3t s GLN 33 Ca -0.13 1.27 -0.29 0.00 -2.00 0.00 0.00 55.36 54.21 2g3t s GLN 33 Cb -0.07 -3.40 0.02 0.00 0.80 0.00 0.00 33.01 30.36 2g3t s GLN 33 CO 0.01 0.15 1.07 0.08 -0.50 0.00 0.00 175.29 176.10 2g3t s VAL 34 N 0.32 4.48 -0.14 1.34 1.01 -1.26 -4.87 120.40 121.28 2g3t s VAL 34 Ca 0.45 1.62 0.22 0.00 0.00 0.00 0.00 61.98 64.27 2g3t s VAL 34 Cb -0.21 -4.43 -0.16 0.00 0.00 0.00 0.00 36.38 31.57 2g3t s VAL 34 CO 0.26 -0.55 0.77 -0.38 0.00 0.00 0.00 175.10 175.20 2g3t n ILE 35 N 6.01 0.36 -1.75 2.22 2.08 -1.26 -4.96 119.36 122.06 2g3t n ILE 35 Ca 0.11 -0.53 -0.40 0.00 0.56 0.00 0.00 62.75 62.49 2g3t n ILE 35 Cb 0.47 -0.19 0.02 0.00 -0.75 0.00 0.00 39.64 39.19 2g3t n ILE 35 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 2g3t n LEU 36 N -2.49 5.02 -4.59 1.39 4.77 -1.26 -5.03 117.00 114.82 2g3t n LEU 36 Ca -0.02 1.10 -0.26 0.00 -0.03 0.00 0.00 56.01 56.80 2g3t n LEU 36 Cb 0.57 -1.58 -0.10 0.00 -2.33 0.00 0.00 43.42 39.98 2g3t n LEU 36 CO 0.43 -0.30 -0.34 0.42 -1.33 0.00 0.00 177.39 176.27 2g3t s THR 37 N -1.21 2.38 0.40 -5.08 -4.23 -1.26 -5.01 115.64 101.62 2g3t s THR 37 Ca 0.63 -2.09 0.08 0.00 -1.18 0.00 0.00 61.69 59.13 2g3t s THR 37 Cb -0.45 -2.73 0.21 0.00 1.34 0.00 0.00 72.50 70.86 2g3t s THR 37 CO 0.56 -0.18 1.98 -0.08 -0.54 0.00 0.00 174.62 176.36 2g3t h GLU 38 N 1.91 0.38 -0.72 3.99 4.81 -1.96 -1.51 114.58 121.49 2g3t h GLU 38 Ca -0.42 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 58.76 2g3t h GLU 38 Cb 1.25 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.53 2g3t h GLU 38 CO 0.70 0.37 0.47 -0.22 -0.73 0.00 0.00 179.01 179.61 2g3t h LYS 39 N 0.38 0.95 -0.04 1.92 3.11 -1.97 -0.91 116.57 120.01 2g3t h LYS 39 Ca 0.09 -0.06 -0.00 0.00 -2.81 0.00 0.00 60.65 57.87 2g3t h LYS 39 Cb 0.18 -0.21 -0.00 0.00 -1.00 0.00 0.00 32.23 31.19 2g3t h LYS 39 CO -0.00 0.63 0.02 -0.44 -2.81 0.00 0.00 179.45 176.85 2g3t h ASP 40 N 0.97 0.06 -0.70 4.20 3.32 -1.69 -0.74 116.42 121.85 2g3t h ASP 40 Ca 0.26 -0.11 0.06 0.00 0.02 0.00 0.00 57.03 57.26 2g3t h ASP 40 Cb -0.11 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.38 2g3t h ASP 40 CO -0.06 0.15 0.46 -0.07 -1.72 0.00 0.00 179.24 178.00 2g3t h LEU 41 N -0.04 0.65 0.08 1.55 3.38 -1.11 0.32 115.31 120.13 2g3t h LEU 41 Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2g3t h LEU 41 Cb 0.11 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2g3t h LEU 41 CO -0.00 0.43 -0.04 -0.07 0.09 0.00 0.00 178.44 178.85 2g3t h LEU 42 N 0.75 -0.09 -0.42 1.67 3.38 -0.88 -1.17 115.31 118.54 2g3t h LEU 42 Ca 0.29 -0.44 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 2g3t h LEU 42 Cb 0.21 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2g3t h LEU 42 CO -0.09 0.42 0.14 -0.08 0.09 0.00 0.00 178.44 178.92 2g3t h GLU 43 N -0.63 0.65 0.00 1.13 4.81 -0.84 0.30 114.58 119.99 2g3t h GLU 43 Ca -0.01 -0.14 -0.09 0.00 -0.13 0.00 0.00 59.36 58.99 2g3t h GLU 43 Cb 0.52 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 2g3t h GLU 43 CO 0.02 0.63 -0.43 -0.44 -0.73 0.00 0.00 179.01 178.06 2g3t h ASP 44 N 0.54 0.00 0.00 1.04 3.32 -0.47 -2.87 116.42 117.98 2g3t h ASP 44 Ca 0.14 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.06 2g3t h ASP 44 Cb 0.24 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 2g3t h ASP 44 CO -0.01 0.43 -1.85 0.61 -1.72 0.00 0.00 179.24 176.70 2g3t n GLY 45 N 0.94 -0.71 0.91 2.75 0.00 -0.44 -0.13 105.19 108.51 2g3t n GLY 45 Ca 0.02 -0.31 0.05 0.00 0.00 0.00 0.00 46.02 45.78 2g3t n GLY 45 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2g3t n PHE 46 N -2.28 0.00 -0.30 1.61 3.01 0.10 -4.57 117.46 115.03 2g3t n PHE 46 Ca -0.13 -0.90 0.00 0.00 1.01 0.00 0.00 57.45 57.43 2g3t n PHE 46 Cb 0.68 -0.18 0.00 0.00 -0.01 0.00 0.00 39.48 39.97 2g3t n PHE 46 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2g3t n GLY 47 N -0.38 1.50 0.20 1.37 0.00 -1.08 -4.87 105.19 101.91 2g3t n GLY 47 Ca 0.12 -1.66 -0.13 0.00 0.00 0.00 0.00 46.02 44.35 2g3t n GLY 47 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2g3t h GLU 48 N 0.00 0.62 -4.66 1.61 5.08 -1.95 -3.43 114.58 111.86 2g3t h GLU 48 Ca 0.00 -0.30 -0.58 0.00 -1.00 0.00 0.00 59.36 57.49 2g3t h GLU 48 Cb 0.00 -0.01 -0.35 0.00 0.50 0.00 0.00 28.75 28.89 2g3t h GLU 48 CO 0.00 0.88 -0.83 -1.58 -1.00 0.00 0.00 179.01 176.49 2g3t s HIS 49 N -4.50 1.91 -0.25 4.33 5.04 -1.26 -5.11 115.29 115.45 2g3t s HIS 49 Ca -0.13 -0.92 -0.29 0.00 -1.54 0.00 0.00 55.06 52.18 2g3t s HIS 49 Cb 0.08 -1.40 0.01 0.00 0.04 0.00 0.00 32.58 31.31 2g3t s HIS 49 CO 0.80 -0.50 1.07 -1.25 -2.34 0.00 0.00 174.74 172.52 2g3t s PRO 50 N 1.12 4.20 0.00 2.88 0.04 -1.26 -4.67 135.00 137.31 2g3t s PRO 50 Ca -0.04 1.30 0.27 0.00 0.04 0.00 0.00 61.00 62.57 2g3t s PRO 50 Cb -0.14 -3.68 0.87 0.00 0.04 0.00 0.00 34.50 31.59 2g3t s PRO 50 CO -0.03 -0.71 1.64 1.19 0.04 0.00 0.00 177.00 179.12 2g3t n PHE 51 N 6.51 0.00 -3.57 0.56 3.01 0.82 -4.90 117.46 119.88 2g3t n PHE 51 Ca 0.12 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.48 2g3t n PHE 51 Cb 0.46 -0.14 -0.02 0.00 -0.01 0.00 0.00 39.48 39.77 2g3t n PHE 51 CO 0.00 0.00 0.00 1.52 1.01 0.00 0.00 176.76 179.29 2g3t s TYR 52 N -2.51 -0.40 0.04 1.38 -0.85 -1.26 -4.86 117.35 108.89 2g3t s TYR 52 Ca 0.25 0.11 0.03 0.00 -0.52 0.00 0.00 57.07 56.94 2g3t s TYR 52 Cb 0.19 0.56 -0.02 0.00 0.38 0.00 0.00 41.96 43.07 2g3t s TYR 52 CO 0.51 -0.94 -0.10 -1.01 -1.52 0.00 0.00 175.55 172.49 2g3t s HIS 53 N -3.80 0.86 0.03 -3.49 3.76 0.72 -4.74 115.29 108.62 2g3t s HIS 53 Ca 0.04 -0.40 0.03 0.00 -0.15 0.00 0.00 55.06 54.59 2g3t s HIS 53 Cb -0.02 -0.51 -0.02 0.00 1.11 0.00 0.00 32.58 33.14 2g3t s HIS 53 CO -0.07 -0.02 -0.10 0.00 -0.85 0.00 0.00 174.74 173.69 2g3t s LEU 55 N -1.08 3.04 0.08 0.00 1.43 -0.40 -0.76 118.68 121.00 2g3t s LEU 55 Ca -0.02 -0.36 0.04 0.00 -1.03 0.00 0.00 54.13 52.76 2g3t s LEU 55 Cb -0.07 -1.82 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 2g3t s LEU 55 CO 0.01 0.19 -0.11 0.68 0.23 0.00 0.00 176.35 177.35 2g3t s VAL 56 N -1.18 0.93 -0.33 -1.59 -7.23 0.64 -1.70 120.40 109.94 2g3t s VAL 56 Ca 0.21 -1.49 -0.08 0.00 -1.81 0.00 0.00 61.98 58.80 2g3t s VAL 56 Cb -0.11 -1.20 0.02 0.00 0.56 0.00 0.00 36.38 35.65 2g3t s VAL 56 CO 0.13 -0.46 0.13 0.00 -0.31 0.00 0.00 175.10 174.59 2g3t s ALA 57 N -2.04 3.14 -0.13 1.32 0.00 -0.44 -1.62 121.76 122.00 2g3t s ALA 57 Ca 0.02 -1.59 -0.04 0.00 0.00 0.00 0.00 51.96 50.35 2g3t s ALA 57 Cb -0.05 -2.33 -0.03 0.00 0.00 0.00 0.00 23.12 20.71 2g3t s ALA 57 CO 0.01 -1.14 0.02 -2.00 0.00 0.00 0.00 175.76 172.64 2g3t s GLU 58 N 1.50 3.42 0.05 0.00 2.12 -0.13 -0.94 118.70 124.73 2g3t s GLU 58 Ca 0.02 -0.40 0.04 0.00 0.36 0.00 0.00 54.97 54.99 2g3t s GLU 58 Cb -0.18 -2.95 -0.04 0.00 0.26 0.00 0.00 34.13 31.22 2g3t s GLU 58 CO 0.04 0.50 -0.03 0.14 -0.54 0.00 0.00 175.26 175.37 2g3t s VAL 59 N -0.30 3.86 0.47 3.70 -7.23 0.18 -0.95 120.40 120.13 2g3t s VAL 59 Ca 0.07 -0.90 -0.20 0.00 -1.81 0.00 0.00 61.98 59.14 2g3t s VAL 59 Cb -0.12 -2.77 -0.13 0.00 0.56 0.00 0.00 36.38 33.91 2g3t s VAL 59 CO 0.02 0.23 0.25 -2.65 -0.31 0.00 0.00 175.10 172.64 2g3t n PRO 60 N 0.98 0.26 0.03 4.82 -0.02 -1.26 -4.68 135.00 135.13 2g3t n PRO 60 Ca -0.13 0.10 0.22 0.00 -2.02 0.00 0.00 63.50 61.66 2g3t n PRO 60 Cb 0.52 -1.28 0.73 0.00 -0.02 0.00 0.00 33.50 33.45 2g3t n PRO 60 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2g3t h LYS 61 N 0.34 0.00 -1.00 -0.52 -0.00 -1.98 0.17 116.57 113.58 2g3t h LYS 61 Ca -0.41 0.00 -0.58 0.00 -0.00 0.00 0.00 60.65 59.66 2g3t h LYS 61 Cb 1.42 0.00 -0.30 0.00 -0.00 0.00 0.00 32.23 33.35 2g3t h LYS 61 CO 0.47 0.00 0.75 -0.85 -0.00 0.00 0.00 179.45 179.82 2g3t n GLU 62 N -3.92 2.43 -0.24 0.07 -0.00 -1.26 -3.92 120.64 113.80 2g3t n GLU 62 Ca 0.09 -3.11 0.00 0.00 -0.00 0.00 0.00 57.16 54.14 2g3t n GLU 62 Cb 0.67 -2.22 0.00 0.00 -0.00 0.00 0.00 31.44 29.89 2g3t n GLU 62 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.13 178.71 2g3t n HIS 63 N -1.04 0.00 -0.52 -1.84 -0.00 0.04 -5.14 115.22 106.71 2g3t n HIS 63 Ca 0.61 0.00 -0.26 0.00 -0.00 0.00 0.00 57.72 58.07 2g3t n HIS 63 Cb 1.25 0.14 0.20 0.00 -0.00 0.00 0.00 29.99 31.58 2g3t n HIS 63 CO 0.00 0.00 0.00 0.91 -0.00 0.00 0.00 176.34 177.25 2g3t n TRP 64 N 0.00 -2.19 -2.39 1.57 7.02 -1.14 -4.84 117.44 115.47 2g3t n TRP 64 Ca 0.00 -0.12 -0.33 0.00 -1.02 0.00 0.00 57.50 56.03 2g3t n TRP 64 Cb 0.52 -1.47 -0.02 0.00 -2.42 0.00 0.00 31.31 27.92 2g3t n TRP 64 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 2g3t s THR 65 N -2.17 3.98 0.59 -0.99 2.01 0.20 -4.78 115.64 114.48 2g3t s THR 65 Ca 0.52 1.09 0.29 0.00 0.31 0.00 0.00 61.69 63.90 2g3t s THR 65 Cb -0.11 -3.49 0.41 0.00 0.01 0.00 0.00 72.50 69.32 2g3t s THR 65 CO 0.52 -0.40 1.72 -0.65 -0.69 0.00 0.00 174.62 175.12 2g3t h PRO 66 N 1.13 0.00 -0.18 4.92 0.11 -1.93 1.90 132.00 137.95 2g3t h PRO 66 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2g3t h PRO 66 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2g3t h PRO 66 CO 0.59 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.77 2g3t n GLU 67 N -3.62 1.91 -1.69 1.05 -0.58 -1.26 -4.94 120.64 111.52 2g3t n GLU 67 Ca 0.14 -1.36 0.00 0.00 -0.42 0.00 0.00 57.16 55.52 2g3t n GLU 67 Cb 0.97 -1.43 0.00 0.00 -0.57 0.00 0.00 31.44 30.41 2g3t n GLU 67 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2g3t n GLY 68 N 1.22 0.56 3.24 0.62 0.00 0.65 -5.09 105.19 106.39 2g3t n GLY 68 Ca 0.17 -0.41 -0.29 0.00 0.00 0.00 0.00 46.02 45.49 2g3t n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2g3t s HIS 69 N -2.82 2.09 -0.22 1.61 3.76 -1.22 -4.79 115.29 113.70 2g3t s HIS 69 Ca 0.00 -0.49 0.22 0.00 -0.15 0.00 0.00 55.06 54.65 2g3t s HIS 69 Cb 0.00 -1.36 -0.12 0.00 1.11 0.00 0.00 32.58 32.21 2g3t s HIS 69 CO 0.00 -0.10 0.83 -1.13 -0.85 0.00 0.00 174.74 173.49 2g3t n SER 70 N 2.72 0.50 -4.60 1.40 3.41 -1.26 0.60 113.62 116.40 2g3t n SER 70 Ca -0.16 0.12 -0.39 0.00 -0.26 0.00 0.00 58.87 58.17 2g3t n SER 70 Cb 0.52 1.07 -0.09 0.00 -0.26 0.00 0.00 64.21 65.46 2g3t n SER 70 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2g3t s ILE 71 N -3.40 5.17 -0.02 -1.33 1.09 -1.26 0.52 121.20 121.98 2g3t s ILE 71 Ca -0.03 0.50 0.03 0.00 -1.10 0.00 0.00 60.65 60.05 2g3t s ILE 71 Cb 0.12 -3.72 0.04 0.00 -1.06 0.00 0.00 42.46 37.84 2g3t s ILE 71 CO 0.84 0.12 1.02 1.33 -0.10 0.00 0.00 174.94 178.15 2g3t n VAL 72 N 5.14 1.12 -3.58 2.92 0.24 -0.11 -5.00 118.33 119.06 2g3t n VAL 72 Ca -0.08 -1.17 -0.06 0.00 -2.04 0.00 0.00 64.34 60.99 2g3t n VAL 72 Cb 0.51 0.40 -0.02 0.00 -1.47 0.00 0.00 33.84 33.26 2g3t n VAL 72 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2g3t s GLY 73 N -1.26 -0.38 0.08 7.63 0.00 -1.24 -0.38 107.32 111.77 2g3t s GLY 73 Ca 0.04 0.99 -0.26 0.00 0.00 0.00 0.00 44.72 45.50 2g3t s GLY 73 CO 0.00 0.31 0.72 -0.11 0.00 0.00 0.00 173.10 174.02 2g3t s PHE 74 N -2.90 -0.47 -0.01 1.90 -0.12 -0.24 -1.32 117.98 114.81 2g3t s PHE 74 Ca 0.08 0.35 0.01 0.00 -0.05 0.00 0.00 56.93 57.32 2g3t s PHE 74 Cb -0.00 0.54 0.01 0.00 -0.63 0.00 0.00 43.02 42.93 2g3t s PHE 74 CO -0.06 -0.71 -0.03 0.00 -0.05 0.00 0.00 175.22 174.37 2g3t s ALA 75 N -3.29 0.35 -0.10 1.99 0.00 -0.69 -1.34 121.76 118.68 2g3t s ALA 75 Ca 0.02 -0.06 0.03 0.00 0.00 0.00 0.00 51.96 51.94 2g3t s ALA 75 Cb -0.01 -0.18 -0.01 0.00 0.00 0.00 0.00 23.12 22.93 2g3t s ALA 75 CO -0.10 0.03 -0.19 1.41 0.00 0.00 0.00 175.76 176.91 2g3t s MET 76 N 0.30 3.09 0.20 0.00 1.75 0.13 -1.28 119.30 123.50 2g3t s MET 76 Ca -0.03 -0.79 -0.07 0.00 -1.25 0.00 0.00 55.69 53.55 2g3t s MET 76 Cb -0.06 -2.42 -0.02 0.00 2.84 0.00 0.00 34.83 35.16 2g3t s MET 76 CO -0.01 0.25 0.27 1.52 -0.65 0.00 0.00 175.02 176.41 2g3t s TYR 77 N 0.21 0.71 0.32 4.11 -0.85 0.14 -0.76 117.35 121.22 2g3t s TYR 77 Ca -0.12 -1.02 -0.17 0.00 -0.52 0.00 0.00 57.07 55.25 2g3t s TYR 77 Cb -0.16 -0.19 0.03 0.00 0.38 0.00 0.00 41.96 42.01 2g3t s TYR 77 CO 0.06 -0.77 0.71 1.52 -1.52 0.00 0.00 175.55 175.55 2g3t s TYR 78 N -4.06 0.06 -0.08 -3.49 -0.85 -0.77 -0.20 117.35 107.95 2g3t s TYR 78 Ca 0.28 -0.58 -0.04 0.00 -0.52 0.00 0.00 57.07 56.21 2g3t s TYR 78 Cb 0.04 0.66 -0.04 0.00 0.38 0.00 0.00 41.96 42.99 2g3t s TYR 78 CO 0.08 -1.33 0.08 -0.06 -1.52 0.00 0.00 175.55 172.79 2g3t s PHE 79 N -3.28 3.37 0.18 -3.49 0.08 -1.26 -0.82 117.98 112.77 2g3t s PHE 79 Ca 0.15 0.33 0.00 0.00 0.12 0.00 0.00 56.93 57.54 2g3t s PHE 79 Cb -0.05 -1.84 -0.00 0.00 -0.57 0.00 0.00 43.02 40.56 2g3t s PHE 79 CO 0.10 0.60 0.01 0.25 -0.10 0.00 0.00 175.22 176.08 2g3t n THR 80 N 1.85 0.00 -3.82 0.64 -2.24 -0.25 -4.92 114.28 105.54 2g3t n THR 80 Ca -0.18 -0.89 -0.12 0.00 -2.27 0.00 0.00 64.05 60.59 2g3t n THR 80 Cb 0.54 0.21 -0.12 0.00 -2.10 0.00 0.00 70.33 68.86 2g3t n THR 80 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2g3t s TYR 81 N -1.78 -0.16 -0.11 4.78 5.04 -1.26 -1.34 117.35 122.52 2g3t s TYR 81 Ca 0.02 0.38 0.03 0.00 -2.44 0.00 0.00 57.07 55.06 2g3t s TYR 81 Cb 0.00 0.05 0.01 0.00 0.35 0.00 0.00 41.96 42.37 2g3t s TYR 81 CO 0.01 -0.13 -0.21 0.34 -1.34 0.00 0.00 175.55 174.23 2g3t s ASP 82 N -0.16 2.84 0.59 4.32 2.15 0.31 -4.95 116.67 121.78 2g3t s ASP 82 Ca -0.03 -0.52 0.30 0.00 0.43 0.00 0.00 52.55 52.73 2g3t s ASP 82 Cb -0.02 -1.30 1.77 0.00 -0.30 0.00 0.00 42.92 43.07 2g3t s ASP 82 CO 0.00 0.10 2.19 -0.65 -0.17 0.00 0.00 175.17 176.65 2g3t h PRO 83 N 7.00 0.00 0.15 4.34 0.11 -2.01 0.46 132.00 142.06 2g3t h PRO 83 Ca -0.26 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.57 2g3t h PRO 83 Cb 1.21 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.33 2g3t h PRO 83 CO 0.50 0.00 -1.41 -1.49 -0.21 0.00 0.00 178.00 175.38 2g3t h TRP 84 N 0.00 0.59 0.00 0.65 6.55 -2.05 -3.42 115.95 118.26 2g3t h TRP 84 Ca 0.04 -0.43 0.00 0.00 0.95 0.00 0.00 58.89 59.45 2g3t h TRP 84 Cb 0.22 -0.02 0.00 0.00 -0.86 0.00 0.00 29.16 28.50 2g3t h TRP 84 CO 0.00 1.55 -0.21 1.51 -1.05 0.00 0.00 178.44 180.24 2g3t n ILE 85 N -3.85 0.00 0.00 1.49 0.13 -1.12 -5.14 119.36 110.87 2g3t n ILE 85 Ca -0.22 -0.39 0.00 0.00 -1.10 0.00 0.00 62.75 61.03 2g3t n ILE 85 Cb 0.95 0.89 0.00 0.00 -0.84 0.00 0.00 39.64 40.65 2g3t n ILE 85 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2g3t n GLY 86 N 1.32 0.14 3.75 4.50 0.00 0.16 -4.86 105.19 110.19 2g3t n GLY 86 Ca 0.00 -1.82 -0.42 0.00 0.00 0.00 0.00 46.02 43.79 2g3t n GLY 86 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2g3t s LYS 87 N 0.00 4.14 0.19 1.61 2.20 -1.26 -0.53 119.74 126.10 2g3t s LYS 87 Ca 0.00 2.54 0.07 0.00 -0.36 0.00 0.00 55.97 58.22 2g3t s LYS 87 Cb 0.00 -3.04 -0.05 0.00 -1.51 0.00 0.00 37.83 33.23 2g3t s LYS 87 CO 0.00 -0.61 -0.13 -0.51 -0.36 0.00 0.00 175.35 173.73 2g3t s LEU 88 N -0.31 2.55 -0.16 5.43 1.43 -0.45 -2.49 118.68 124.67 2g3t s LEU 88 Ca 0.64 -1.02 -0.07 0.00 -1.03 0.00 0.00 54.13 52.64 2g3t s LEU 88 Cb -0.47 -0.61 -0.04 0.00 0.03 0.00 0.00 46.19 45.10 2g3t s LEU 88 CO 0.46 -0.20 0.09 -0.22 0.23 0.00 0.00 176.35 176.70 2g3t s LEU 89 N -3.29 4.02 -0.17 1.79 2.96 -0.74 -1.09 118.68 122.16 2g3t s LEU 89 Ca 0.21 0.22 0.01 0.00 -0.22 0.00 0.00 54.13 54.35 2g3t s LEU 89 Cb -0.00 -2.00 0.02 0.00 0.50 0.00 0.00 46.19 44.71 2g3t s LEU 89 CO 0.06 0.26 -0.20 -0.47 -1.32 0.00 0.00 176.35 174.67 2g3t s TYR 90 N -0.11 2.76 -0.38 5.38 5.04 0.00 -0.94 117.35 129.10 2g3t s TYR 90 Ca 0.08 -1.58 -0.19 0.00 -2.44 0.00 0.00 57.07 52.94 2g3t s TYR 90 Cb -0.12 -1.90 0.01 0.00 0.35 0.00 0.00 41.96 40.30 2g3t s TYR 90 CO 0.01 -0.77 0.55 -1.17 -1.34 0.00 0.00 175.55 172.84 2g3t s LEU 91 N 1.19 4.43 -0.13 6.97 2.96 -0.27 -1.85 118.68 131.98 2g3t s LEU 91 Ca 0.02 -0.15 -0.25 0.00 -0.22 0.00 0.00 54.13 53.54 2g3t s LEU 91 Cb -0.14 -2.63 -0.26 0.00 0.50 0.00 0.00 46.19 43.67 2g3t s LEU 91 CO -0.11 -0.58 0.68 -0.08 -1.32 0.00 0.00 176.35 174.95 2g3t h GLU 92 N 8.59 0.10 -2.68 1.98 4.57 -1.26 -3.40 114.58 122.48 2g3t h GLU 92 Ca -0.27 -0.16 -0.05 0.00 -1.18 0.00 0.00 59.36 57.70 2g3t h GLU 92 Cb 1.11 0.06 -0.15 0.00 -0.16 0.00 0.00 28.75 29.61 2g3t h GLU 92 CO 0.81 1.08 0.12 -0.51 -1.18 0.00 0.00 179.01 179.33 2g3t s ASP 93 N -6.59 -0.52 -0.11 1.04 1.01 -1.10 -4.91 116.67 105.49 2g3t s ASP 93 Ca -0.19 0.23 -0.05 0.00 0.71 0.00 0.00 52.55 53.25 2g3t s ASP 93 Cb 0.00 0.54 0.05 0.00 1.01 0.00 0.00 42.92 44.52 2g3t s ASP 93 CO 0.71 -0.77 0.24 0.12 0.21 0.00 0.00 175.17 175.68 2g3t s PHE 94 N -2.59 -0.34 -0.15 4.23 2.19 -1.26 -0.69 117.98 119.36 2g3t s PHE 94 Ca -0.04 0.83 -0.12 0.00 0.33 0.00 0.00 56.93 57.92 2g3t s PHE 94 Cb -0.01 -0.04 0.04 0.00 -1.31 0.00 0.00 43.02 41.71 2g3t s PHE 94 CO -0.03 -0.29 0.39 0.12 1.83 0.00 0.00 175.22 177.25 2g3t s PHE 95 N 1.92 -0.47 -0.06 10.12 5.36 -0.45 -5.02 117.98 129.37 2g3t s PHE 95 Ca -0.03 1.10 0.02 0.00 -0.96 0.00 0.00 56.93 57.07 2g3t s PHE 95 Cb -0.11 0.17 0.01 0.00 -0.34 0.00 0.00 43.02 42.75 2g3t s PHE 95 CO -0.08 -0.24 -0.12 0.08 -1.46 0.00 0.00 175.22 173.40 2g3t s VAL 96 N 0.53 1.12 0.34 3.12 1.01 -1.26 -1.08 120.40 124.17 2g3t s VAL 96 Ca -0.03 -0.48 -0.27 0.00 0.00 0.00 0.00 61.98 61.21 2g3t s VAL 96 Cb -0.04 -1.02 -0.13 0.00 0.00 0.00 0.00 36.38 35.19 2g3t s VAL 96 CO -0.03 0.35 1.04 0.23 0.00 0.00 0.00 175.10 176.69 2g3t n MET 97 N 3.75 1.47 -0.29 2.72 2.81 0.49 -4.75 117.12 123.31 2g3t n MET 97 Ca -0.22 0.52 -0.07 0.00 -1.81 0.00 0.00 57.70 56.11 2g3t n MET 97 Cb 0.52 -1.97 -0.03 0.00 -0.71 0.00 0.00 33.22 31.03 2g3t n MET 97 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2g3t h SER 98 N 1.93 -1.64 0.00 7.83 4.64 -1.98 -0.30 113.55 124.03 2g3t h SER 98 Ca -0.42 0.28 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 2g3t h SER 98 Cb 1.33 0.76 0.00 0.00 -0.31 0.00 0.00 62.40 64.18 2g3t h SER 98 CO 0.60 -0.30 0.00 0.47 -0.87 0.00 0.00 176.83 176.72 2g3t n ASP 99 N -5.39 1.45 0.00 4.97 8.00 -1.26 -2.40 116.55 121.93 2g3t n ASP 99 Ca 0.04 -1.43 0.00 0.00 0.71 0.00 0.00 54.79 54.11 2g3t n ASP 99 Cb 0.34 -0.36 0.00 0.00 -0.02 0.00 0.00 41.12 41.09 2g3t n ASP 99 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2g3t n TYR 100 N 0.40 0.00 -2.44 1.24 4.01 -0.14 -5.09 117.16 115.14 2g3t n TYR 100 Ca 0.00 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.42 2g3t n TYR 100 Cb 0.27 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.26 2g3t n TYR 100 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2g3t s ARG 101 N 0.00 3.98 0.00 -0.72 3.00 -1.01 -3.97 118.95 120.23 2g3t s ARG 101 Ca 0.00 0.97 0.00 0.00 0.00 0.00 0.00 55.73 56.70 2g3t s ARG 101 Cb 0.00 -2.14 0.00 0.00 0.00 0.00 0.00 34.95 32.81 2g3t s ARG 101 CO 0.00 -0.24 0.00 0.41 0.00 0.00 0.00 175.30 175.47 2g3t n GLY 102 N -1.48 0.38 0.00 -3.53 0.00 -1.26 -4.91 105.19 94.39 2g3t n GLY 102 Ca 0.07 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.13 2g3t n GLY 102 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2g3t n PHE 103 N -3.67 0.00 -0.06 1.61 3.01 -1.25 -4.99 117.46 112.10 2g3t n PHE 103 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2g3t n PHE 103 Cb 0.34 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.81 2g3t n PHE 103 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2g3t n GLY 104 N 0.36 0.57 0.26 1.37 0.00 -1.26 -4.95 105.19 101.54 2g3t n GLY 104 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 2g3t n GLY 104 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2g3t h ILE 105 N 0.00 0.58 -0.60 -0.61 2.04 -1.94 -0.13 117.51 116.85 2g3t h ILE 105 Ca 0.00 -0.10 0.04 0.00 1.00 0.00 0.00 64.86 65.80 2g3t h ILE 105 Cb 0.00 0.27 -0.05 0.00 -0.74 0.00 0.00 36.82 36.30 2g3t h ILE 105 CO 0.00 0.05 0.35 1.23 0.00 0.00 0.00 178.15 179.78 2g3t h GLY 106 N 0.29 0.87 2.00 5.37 0.00 -1.92 -1.04 103.07 108.64 2g3t h GLY 106 Ca 0.38 -0.25 -0.09 0.00 0.00 0.00 0.00 47.33 47.37 2g3t h GLY 106 CO -0.46 0.18 -0.42 1.76 0.00 0.00 0.00 176.54 177.60 2g3t h SER 107 N 0.66 0.00 -0.24 0.19 0.02 -1.61 -2.44 113.55 110.14 2g3t h SER 107 Ca 0.26 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 61.01 2g3t h SER 107 Cb 0.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.65 2g3t h SER 107 CO -0.14 0.42 -0.63 -0.08 -1.14 0.00 0.00 176.83 175.26 2g3t h GLU 108 N 0.00 0.86 -0.19 3.45 4.57 -0.36 -1.56 114.58 121.35 2g3t h GLU 108 Ca -0.00 -0.60 -0.00 0.00 -1.18 0.00 0.00 59.36 57.57 2g3t h GLU 108 Cb 0.83 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.50 2g3t h GLU 108 CO 0.06 1.22 0.10 0.82 -1.18 0.00 0.00 179.01 180.03 2g3t h ILE 109 N 0.63 1.11 -0.93 2.32 2.04 -1.06 -0.08 117.51 121.55 2g3t h ILE 109 Ca -0.01 -0.31 0.06 0.00 1.00 0.00 0.00 64.86 65.60 2g3t h ILE 109 Cb 1.25 0.98 -0.06 0.00 -0.74 0.00 0.00 36.82 38.25 2g3t h ILE 109 CO 0.14 0.11 0.59 0.25 0.00 0.00 0.00 178.15 179.24 2g3t h LEU 110 N 0.19 0.95 -0.38 1.44 7.12 -1.40 0.20 115.31 123.43 2g3t h LEU 110 Ca 0.07 0.01 -0.00 0.00 0.13 0.00 0.00 57.88 58.08 2g3t h LEU 110 Cb 0.08 -0.19 -0.02 0.00 -0.53 0.00 0.00 40.66 40.01 2g3t h LEU 110 CO -0.01 0.61 0.22 0.50 -0.13 0.00 0.00 178.44 179.63 2g3t h LYS 111 N 1.08 0.52 -0.70 1.25 3.64 -0.69 -1.00 116.57 120.68 2g3t h LYS 111 Ca 0.40 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.66 2g3t h LYS 111 Cb 0.15 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 2g3t h LYS 111 CO -0.17 0.41 0.17 -0.91 -2.27 0.00 0.00 179.45 176.69 2g3t h ASN 112 N 0.49 1.06 -0.73 4.20 2.35 0.00 -2.13 115.58 120.82 2g3t h ASN 112 Ca 0.13 -0.23 -0.04 0.00 -0.55 0.00 0.00 56.30 55.61 2g3t h ASN 112 Cb 0.03 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.09 2g3t h ASN 112 CO -0.02 1.01 0.30 -0.07 -1.65 0.00 0.00 177.43 177.00 2g3t h LEU 113 N 1.05 1.01 -1.16 1.61 3.38 -0.37 -1.79 115.31 119.05 2g3t h LEU 113 Ca 0.22 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 2g3t h LEU 113 Cb 0.37 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 2g3t h LEU 113 CO 0.00 0.90 0.36 0.28 0.09 0.00 0.00 178.44 180.07 2g3t h SER 114 N 1.08 0.85 0.04 -0.43 0.02 -0.74 -1.10 113.55 113.27 2g3t h SER 114 Ca 0.25 -0.07 -0.11 0.00 -0.84 0.00 0.00 61.79 61.02 2g3t h SER 114 Cb 0.19 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 2g3t h SER 114 CO -0.02 0.69 -0.36 1.56 -1.14 0.00 0.00 176.83 177.56 2g3t h GLN 115 N 0.95 0.43 -0.37 3.45 4.20 -0.81 -1.51 115.11 121.46 2g3t h GLN 115 Ca 0.24 -0.20 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 2g3t h GLN 115 Cb 0.04 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.80 2g3t h GLN 115 CO -0.04 0.74 0.14 0.28 -0.67 0.00 0.00 178.83 179.28 2g3t h VAL 116 N 0.37 1.20 -0.43 -0.54 2.07 -0.51 0.64 116.25 119.05 2g3t h VAL 116 Ca 0.04 -0.62 0.04 0.00 0.82 0.00 0.00 66.70 66.98 2g3t h VAL 116 Cb 0.81 0.92 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 2g3t h VAL 116 CO 0.07 0.22 0.20 0.00 0.02 0.00 0.00 177.57 178.08 2g3t h ALA 117 N 0.98 0.53 -0.19 1.67 0.00 -0.91 0.72 119.26 122.06 2g3t h ALA 117 Ca 0.12 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2g3t h ALA 117 Cb 0.21 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2g3t h ALA 117 CO -0.01 -0.16 0.10 0.52 0.00 0.00 0.00 179.25 179.70 2g3t h MET 118 N 0.41 0.27 -0.84 0.00 2.07 -0.95 -0.99 114.93 114.90 2g3t h MET 118 Ca 0.19 -0.04 -0.01 0.00 -2.07 0.00 0.00 59.70 57.77 2g3t h MET 118 Cb 0.11 -0.05 -0.04 0.00 -1.87 0.00 0.00 31.60 29.75 2g3t h MET 118 CO -0.14 0.29 0.48 -0.09 1.07 0.00 0.00 176.91 178.52 2g3t h ARG 119 N 0.19 1.17 -0.64 1.72 2.43 -0.48 -2.84 114.38 115.92 2g3t h ARG 119 Ca 0.07 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2g3t h ARG 119 Cb 0.10 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.42 2g3t h ARG 119 CO -0.01 0.85 0.00 0.00 -1.51 0.00 0.00 179.97 179.30 2g3t n ARG 121 N 0.59 -4.55 -3.53 0.00 3.00 -1.03 -4.98 116.66 106.16 2g3t n ARG 121 Ca 0.18 0.60 -0.37 0.00 -0.01 0.00 0.00 57.85 58.25 2g3t n ARG 121 Cb 0.72 -5.09 -0.07 0.00 0.00 0.00 0.00 32.46 28.01 2g3t n ARG 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2g3t h SER 123 N 6.89 0.00 -5.51 0.00 0.02 -1.81 -3.44 113.55 109.70 2g3t h SER 123 Ca -0.40 0.00 0.23 0.00 -0.84 0.00 0.00 61.79 60.78 2g3t h SER 123 Cb 1.16 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.63 2g3t h SER 123 CO 0.74 0.12 0.64 -0.94 -1.14 0.00 0.00 176.83 176.25 2g3t s SER 124 N -6.06 -0.08 -0.13 3.07 1.04 -1.26 -5.09 113.70 105.19 2g3t s SER 124 Ca -0.02 -0.40 0.02 0.00 0.48 0.00 0.00 55.95 56.04 2g3t s SER 124 Cb 0.12 0.38 0.01 0.00 0.10 0.00 0.00 66.02 66.63 2g3t s SER 124 CO 0.58 -0.72 -0.20 -0.32 0.98 0.00 0.00 173.24 173.55 2g3t s MET 125 N -2.64 2.80 0.16 4.02 1.75 -1.26 -1.79 119.30 122.34 2g3t s MET 125 Ca 0.17 -0.78 0.05 0.00 -1.25 0.00 0.00 55.69 53.89 2g3t s MET 125 Cb -0.00 -2.26 -0.04 0.00 2.84 0.00 0.00 34.83 35.37 2g3t s MET 125 CO 0.01 0.00 0.11 -1.01 -0.65 0.00 0.00 175.02 173.49 2g3t s HIS 126 N 0.79 3.10 -0.01 4.11 3.76 -0.12 -4.98 115.29 121.95 2g3t s HIS 126 Ca -0.09 -0.03 -0.30 0.00 -0.15 0.00 0.00 55.06 54.49 2g3t s HIS 126 Cb -0.16 -1.49 0.11 0.00 1.11 0.00 0.00 32.58 32.15 2g3t s HIS 126 CO -0.00 0.52 1.12 -0.59 -0.85 0.00 0.00 174.74 174.93 2g3t s PHE 127 N -1.74 -0.14 0.02 1.40 -0.12 -1.26 -1.12 117.98 115.03 2g3t s PHE 127 Ca 0.30 -0.01 0.01 0.00 -0.05 0.00 0.00 56.93 57.18 2g3t s PHE 127 Cb -0.10 0.56 -0.04 0.00 -0.63 0.00 0.00 43.02 42.81 2g3t s PHE 127 CO 0.23 -0.45 0.06 -0.51 -0.05 0.00 0.00 175.22 174.50 2g3t s LEU 128 N -2.70 3.78 -0.02 -1.99 1.43 -1.26 -5.05 118.68 112.86 2g3t s LEU 128 Ca 0.11 0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.28 2g3t s LEU 128 Cb 0.01 -2.27 0.02 0.00 0.03 0.00 0.00 46.19 43.98 2g3t s LEU 128 CO -0.03 0.24 0.00 -0.69 0.23 0.00 0.00 176.35 176.10 2g3t s VAL 129 N -1.23 0.12 0.23 -1.59 1.01 -1.26 -5.11 120.40 112.58 2g3t s VAL 129 Ca 0.24 0.07 -0.30 0.00 0.00 0.00 0.00 61.98 61.99 2g3t s VAL 129 Cb -0.12 -0.20 -0.09 0.00 0.00 0.00 0.00 36.38 35.97 2g3t s VAL 129 CO 0.15 0.11 1.27 0.00 0.00 0.00 0.00 175.10 176.64 2g3t s ALA 130 N 0.79 3.50 0.53 5.51 0.00 -1.26 -4.90 121.76 125.92 2g3t s ALA 130 Ca -0.07 1.09 0.22 0.00 0.00 0.00 0.00 51.96 53.20 2g3t s ALA 130 Cb -0.11 -3.46 1.38 0.00 0.00 0.00 0.00 23.12 20.93 2g3t s ALA 130 CO -0.02 -0.50 2.07 1.05 0.00 0.00 0.00 175.76 178.36 2g3t h GLU 131 N 4.87 0.00 0.00 0.00 4.11 -2.04 -0.91 114.58 120.61 2g3t h GLU 131 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 2g3t h GLU 131 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 2g3t h GLU 131 CO 0.74 0.00 -0.05 -2.67 0.07 0.00 0.00 179.01 177.10 2g3t n TRP 132 N -4.38 0.33 -2.23 2.06 4.27 -1.26 -4.40 117.44 111.83 2g3t n TRP 132 Ca 0.04 0.10 -0.42 0.00 -3.89 0.00 0.00 57.50 53.32 2g3t n TRP 132 Cb 0.38 -0.64 0.00 0.00 -1.36 0.00 0.00 31.31 29.70 2g3t n TRP 132 CO 0.00 0.00 0.00 -1.71 -2.29 0.00 0.00 177.69 173.69 2g3t n ASN 133 N -1.77 4.75 -0.35 -0.67 2.85 -0.35 -4.80 115.26 114.92 2g3t n ASN 133 Ca 0.06 -3.02 0.05 0.00 -0.11 0.00 0.00 54.58 51.56 2g3t n ASN 133 Cb 0.37 -1.55 0.22 0.00 1.24 0.00 0.00 39.78 40.06 2g3t n ASN 133 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 2g3t h GLU 134 N 6.01 1.04 -0.74 1.20 4.39 -1.83 -0.60 114.58 124.05 2g3t h GLU 134 Ca 0.44 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 60.07 2g3t h GLU 134 Cb 0.66 -0.24 -0.04 0.00 -0.10 0.00 0.00 28.75 29.04 2g3t h GLU 134 CO 1.66 0.69 0.42 -1.35 -1.16 0.00 0.00 179.01 179.28 2g3t h PRO 135 N 1.07 1.02 -0.23 2.33 0.11 -1.98 -1.03 132.00 133.30 2g3t h PRO 135 Ca 0.45 -0.11 -0.17 0.00 0.11 0.00 0.00 66.00 66.28 2g3t h PRO 135 Cb 0.30 -0.21 -0.00 0.00 0.11 0.00 0.00 31.00 31.20 2g3t h PRO 135 CO -0.20 0.75 -0.55 1.03 -0.21 0.00 0.00 178.00 178.81 2g3t h SER 136 N 1.02 0.78 -0.46 -2.05 0.87 -1.85 -1.33 113.55 110.53 2g3t h SER 136 Ca 0.26 -0.42 0.00 0.00 -1.23 0.00 0.00 61.79 60.41 2g3t h SER 136 Cb 0.01 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.72 2g3t h SER 136 CO -0.05 1.17 0.31 0.40 -0.53 0.00 0.00 176.83 178.13 2g3t h ILE 137 N 0.53 1.12 -0.27 2.23 2.04 -0.76 -1.93 117.51 120.48 2g3t h ILE 137 Ca 0.01 -0.22 -0.15 0.00 1.00 0.00 0.00 64.86 65.50 2g3t h ILE 137 Cb 1.13 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 2g3t h ILE 137 CO 0.11 0.11 -0.45 0.78 0.00 0.00 0.00 178.15 178.70 2g3t h ASN 138 N 0.63 0.75 -0.62 1.72 2.35 -1.15 -1.36 115.58 117.90 2g3t h ASN 138 Ca 0.17 -0.36 0.07 0.00 -0.55 0.00 0.00 56.30 55.63 2g3t h ASN 138 Cb -0.07 -0.21 -0.06 0.00 0.05 0.00 0.00 38.32 38.03 2g3t h ASN 138 CO -0.04 1.09 0.30 0.15 -1.65 0.00 0.00 177.43 177.28 2g3t h PHE 139 N 0.56 0.54 0.03 1.19 3.04 -0.92 0.63 116.94 122.01 2g3t h PHE 139 Ca 0.03 0.03 -0.23 0.00 3.98 0.00 0.00 57.97 61.78 2g3t h PHE 139 Cb 1.00 -0.15 -0.00 0.00 2.56 0.00 0.00 35.95 39.36 2g3t h PHE 139 CO 0.05 0.22 -0.99 1.88 -2.02 0.00 0.00 178.31 177.45 2g3t h TYR 140 N 0.55 0.47 -0.13 0.41 -1.99 -1.26 -3.17 116.97 111.84 2g3t h TYR 140 Ca 0.29 -0.28 -0.07 0.00 2.00 0.00 0.00 58.73 60.67 2g3t h TYR 140 Cb 0.25 -0.04 -0.01 0.00 2.00 0.00 0.00 36.73 38.93 2g3t h TYR 140 CO -0.11 1.12 -0.23 0.87 -0.00 0.00 0.00 178.16 179.81 2g3t h LYS 141 N 0.15 0.22 0.00 4.88 1.57 -0.78 -0.96 116.57 121.65 2g3t h LYS 141 Ca -0.08 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 2g3t h LYS 141 Cb 1.65 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.94 2g3t h LYS 141 CO 0.16 0.45 0.00 0.54 -0.57 0.00 0.00 179.45 180.03 2g3t n ARG 142 N -4.19 0.09 -0.33 3.15 1.74 0.17 -1.91 116.66 115.39 2g3t n ARG 142 Ca -0.01 0.37 0.07 0.00 -0.77 0.00 0.00 57.85 57.51 2g3t n ARG 142 Cb 0.34 -1.69 0.21 0.00 -1.02 0.00 0.00 32.46 30.30 2g3t n ARG 142 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2g3t n ARG 143 N -1.87 2.93 -0.22 5.56 1.74 -0.47 -4.96 116.66 119.37 2g3t n ARG 143 Ca 0.02 -2.48 0.00 0.00 -0.77 0.00 0.00 57.85 54.62 2g3t n ARG 143 Cb 0.17 -1.58 0.00 0.00 -1.02 0.00 0.00 32.46 30.03 2g3t n ARG 143 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2g3t n GLY 144 N -0.01 0.62 3.75 -0.13 0.00 -0.80 -5.07 105.19 103.56 2g3t n GLY 144 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 2g3t n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g3t s ALA 145 N -2.43 2.63 -0.01 4.61 0.00 -0.61 -4.99 121.76 120.96 2g3t s ALA 145 Ca 0.00 1.09 0.08 0.00 0.00 0.00 0.00 51.96 53.13 2g3t s ALA 145 Cb 0.00 -3.48 -0.02 0.00 0.00 0.00 0.00 23.12 19.62 2g3t s ALA 145 CO 0.00 -1.19 -0.26 -1.12 0.00 0.00 0.00 175.76 173.19 2g3t s SER 146 N -1.42 3.10 -0.63 0.00 0.01 -1.26 -4.53 113.70 108.96 2g3t s SER 146 Ca 0.75 -0.49 -0.22 0.00 1.31 0.00 0.00 55.95 57.30 2g3t s SER 146 Cb -0.33 -0.34 0.07 0.00 0.21 0.00 0.00 66.02 65.62 2g3t s SER 146 CO 0.37 0.31 0.93 -0.62 0.41 0.00 0.00 173.24 174.64 2g3t s ASP 147 N -0.73 6.20 0.40 2.44 -1.08 -1.26 -4.89 116.67 117.74 2g3t s ASP 147 Ca 0.10 -0.91 0.21 0.00 -0.52 0.00 0.00 52.55 51.43 2g3t s ASP 147 Cb -0.10 -2.41 0.74 0.00 -1.46 0.00 0.00 42.92 39.69 2g3t s ASP 147 CO -0.00 -1.37 1.75 -0.07 0.52 0.00 0.00 175.17 176.00 2g3t h LEU 148 N 11.16 0.00 -0.34 -1.34 3.38 -1.98 -0.17 115.31 126.02 2g3t h LEU 148 Ca -0.28 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.54 2g3t h LEU 148 Cb 1.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 2g3t h LEU 148 CO 1.15 0.32 -0.37 0.28 0.09 0.00 0.00 178.44 179.92 2g3t h SER 149 N 0.00 0.91 -0.08 -0.43 0.02 -1.90 0.28 113.55 112.34 2g3t h SER 149 Ca -0.00 -0.48 -0.19 0.00 -0.84 0.00 0.00 61.79 60.28 2g3t h SER 149 Cb 0.87 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.15 2g3t h SER 149 CO 0.04 1.20 -0.65 0.28 -1.14 0.00 0.00 176.83 176.56 2g3t h SER 150 N 0.64 0.81 0.01 3.07 0.02 -1.84 0.75 113.55 117.00 2g3t h SER 150 Ca 0.05 -0.48 -0.05 0.00 -0.84 0.00 0.00 61.79 60.47 2g3t h SER 150 Cb 0.95 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.26 2g3t h SER 150 CO 0.09 1.25 -0.20 -0.33 -1.14 0.00 0.00 176.83 176.50 2g3t h GLU 151 N 0.51 0.12 -0.01 3.45 5.08 -1.00 -3.39 114.58 119.34 2g3t h GLU 151 Ca -0.02 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 2g3t h GLU 151 Cb 1.25 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.54 2g3t h GLU 151 CO 0.13 0.92 -0.11 0.39 -1.00 0.00 0.00 179.01 179.34 2g3t n GLU 152 N -4.54 1.33 -1.02 2.33 1.02 0.97 -5.01 120.64 115.73 2g3t n GLU 152 Ca -0.10 -1.11 -0.01 0.00 -0.02 0.00 0.00 57.16 55.92 2g3t n GLU 152 Cb 0.49 -1.25 -0.00 0.00 -0.02 0.00 0.00 31.44 30.66 2g3t n GLU 152 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2g3t n GLY 153 N 0.91 0.48 3.75 0.62 0.00 0.25 -4.99 105.19 106.21 2g3t n GLY 153 Ca 0.07 -0.31 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 2g3t n GLY 153 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2g3t s TRP 154 N -1.96 2.91 -0.03 1.61 0.52 -1.24 -4.97 118.94 115.78 2g3t s TRP 154 Ca 0.00 1.01 0.06 0.00 0.02 0.00 0.00 56.10 57.19 2g3t s TRP 154 Cb 0.00 -3.89 -0.01 0.00 -1.15 0.00 0.00 33.47 28.42 2g3t s TRP 154 CO 0.00 -2.86 -0.21 1.03 0.02 0.00 0.00 176.95 174.93 2g3t s ARG 155 N -0.69 1.90 -0.14 4.98 1.81 -1.26 -4.54 118.95 121.01 2g3t s ARG 155 Ca 0.59 -0.75 -0.24 0.00 -1.72 0.00 0.00 55.73 53.61 2g3t s ARG 155 Cb -0.44 -1.73 -0.02 0.00 -0.45 0.00 0.00 34.95 32.31 2g3t s ARG 155 CO 0.47 0.38 0.75 -1.17 -0.68 0.00 0.00 175.30 175.05 2g3t s LEU 156 N -0.29 4.22 0.19 2.53 2.96 -1.26 -5.05 118.68 121.98 2g3t s LEU 156 Ca 0.03 1.11 0.09 0.00 -0.22 0.00 0.00 54.13 55.14 2g3t s LEU 156 Cb -0.10 -3.11 -0.04 0.00 0.50 0.00 0.00 46.19 43.43 2g3t s LEU 156 CO 0.01 -0.28 -0.12 -0.36 -1.32 0.00 0.00 176.35 174.28 2g3t s PHE 157 N 1.66 2.57 -0.01 5.38 0.40 -1.26 -5.15 117.98 121.57 2g3t s PHE 157 Ca 0.36 -0.25 -0.02 0.00 -0.60 0.00 0.00 56.93 56.43 2g3t s PHE 157 Cb -0.17 -1.25 -0.00 0.00 0.51 0.00 0.00 43.02 42.11 2g3t s PHE 157 CO 0.14 0.51 0.04 0.21 0.70 0.00 0.00 175.22 176.82 2g3t s LYS 158 N -2.82 0.13 -0.17 0.44 2.20 -1.26 -5.13 119.74 113.13 2g3t s LYS 158 Ca 0.24 -0.10 0.00 0.00 -0.36 0.00 0.00 55.97 55.75 2g3t s LYS 158 Cb -0.09 0.05 0.03 0.00 -1.51 0.00 0.00 37.83 36.32 2g3t s LYS 158 CO 0.14 -0.02 -0.12 0.42 -0.36 0.00 0.00 175.35 175.41 2g3t s ILE 159 N -0.37 1.56 0.83 5.43 1.01 -1.26 -5.13 121.20 123.27 2g3t s ILE 159 Ca -0.04 -0.76 -0.11 0.00 0.00 0.00 0.00 60.65 59.74 2g3t s ILE 159 Cb -0.03 -1.54 0.09 0.00 0.01 0.00 0.00 42.46 40.99 2g3t s ILE 159 CO -0.00 0.34 1.09 -0.62 0.00 0.00 0.00 174.94 175.75 2g3t s ASP 160 N 1.47 4.05 0.28 3.58 2.15 -1.26 -4.76 116.67 122.17 2g3t s ASP 160 Ca 0.03 1.67 0.00 0.00 0.43 0.00 0.00 52.55 54.69 2g3t s ASP 160 Cb -0.14 -2.36 0.53 0.00 -0.30 0.00 0.00 42.92 40.65 2g3t s ASP 160 CO -0.10 -2.30 1.83 0.50 -0.17 0.00 0.00 175.17 174.93 2g3t h LYS 161 N -1.31 0.92 -0.58 4.34 3.64 -2.00 0.20 116.57 121.78 2g3t h LYS 161 Ca -0.46 -0.06 0.10 0.00 -1.27 0.00 0.00 60.65 58.96 2g3t h LYS 161 Cb 1.25 -0.21 -0.08 0.00 -0.41 0.00 0.00 32.23 32.79 2g3t h LYS 161 CO 0.53 0.61 0.16 1.49 -2.27 0.00 0.00 179.45 179.96 2g3t h GLU 162 N 0.94 0.29 0.00 1.90 4.81 -2.00 0.22 114.58 120.74 2g3t h GLU 162 Ca 0.48 -0.02 -0.15 0.00 -0.13 0.00 0.00 59.36 59.55 2g3t h GLU 162 Cb 0.49 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 2g3t h GLU 162 CO -0.27 0.19 -0.70 1.88 -0.73 0.00 0.00 179.01 179.39 2g3t h TYR 163 N 0.30 0.00 -0.45 0.92 -1.99 -1.61 -3.04 116.97 111.10 2g3t h TYR 163 Ca 0.30 0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.93 2g3t h TYR 163 Cb 0.41 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.12 2g3t h TYR 163 CO -0.21 0.70 -0.08 -0.07 -0.00 0.00 0.00 178.16 178.49 2g3t h LEU 164 N 0.00 0.85 -1.08 3.88 3.38 0.03 -2.57 115.31 119.81 2g3t h LEU 164 Ca -0.01 -0.35 0.01 0.00 0.09 0.00 0.00 57.88 57.62 2g3t h LEU 164 Cb 1.42 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.90 2g3t h LEU 164 CO 0.09 1.00 0.62 0.25 0.09 0.00 0.00 178.44 180.49 2g3t h LEU 165 N 0.68 1.08 -0.29 1.67 5.85 -0.59 -0.15 115.31 123.56 2g3t h LEU 165 Ca 0.12 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 2g3t h LEU 165 Cb 0.61 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 2g3t h LEU 165 CO 0.04 0.78 0.13 0.11 -0.34 0.00 0.00 178.44 179.16 2g3t h LYS 166 N 1.27 0.43 0.00 1.25 1.57 -1.40 -2.03 116.57 117.66 2g3t h LYS 166 Ca 0.35 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.97 2g3t h LYS 166 Cb -0.14 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.08 2g3t h LYS 166 CO -0.08 0.42 -0.39 0.52 -0.57 0.00 0.00 179.45 179.35 2g3t h MET 167 N 0.33 0.00 0.00 3.15 2.86 -1.05 -2.55 114.93 117.67 2g3t h MET 167 Ca 0.10 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.68 2g3t h MET 167 Cb 0.15 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 2g3t h MET 167 CO -0.01 0.39 -0.30 0.00 1.06 0.00 0.00 176.91 178.05 2g3t h ALA 168 N 1.61 0.94 -1.12 6.32 0.00 -0.69 -3.31 119.26 123.00 2g3t h ALA 168 Ca -0.00 -0.28 -0.47 0.00 0.00 0.00 0.00 54.91 54.16 2g3t h ALA 168 Cb 0.74 -0.05 -0.41 0.00 0.00 0.00 0.00 17.79 18.07 2g3t h ALA 168 CO 0.05 0.38 -0.93 0.25 0.00 0.00 0.00 179.25 179.00 2g3t n THR 169 N -3.38 1.85 -4.54 0.00 -2.24 -0.79 -5.08 114.28 100.10 2g3t n THR 169 Ca 0.01 -4.02 -0.26 0.00 -2.27 0.00 0.00 64.05 57.51 2g3t n THR 169 Cb 0.51 -0.37 -0.11 0.00 -2.10 0.00 0.00 70.33 68.27 2g3t n THR 169 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2g3t s GLU 170 N -3.45 1.81 0.00 -0.78 -1.05 -0.99 -4.95 118.70 109.29 2g3t s GLU 170 Ca 0.40 -1.96 0.00 0.00 -0.15 0.00 0.00 54.97 53.26 2g3t s GLU 170 Cb 0.41 -1.56 0.00 0.00 -0.44 0.00 0.00 34.13 32.55 2g3t s GLU 170 CO -0.07 0.06 0.41 -0.85 0.95 0.00 0.00 175.26 175.76