#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2grm s PHE 2 N 0.00 2.79 -0.92 1.12 0.08 -1.26 -5.02 117.98 114.77 2grm s PHE 2 Ca 0.00 -1.23 -0.07 0.00 0.12 0.00 0.00 56.93 55.75 2grm s PHE 2 Cb 0.00 -1.92 -0.06 0.00 -0.57 0.00 0.00 43.02 40.47 2grm s PHE 2 CO 0.00 -0.59 2.11 1.63 -0.10 0.00 0.00 175.22 178.26 2grm n LYS 3 N 4.32 2.07 -0.11 0.44 4.01 -1.25 -4.54 118.16 123.09 2grm n LYS 3 Ca -0.20 -1.51 -0.10 0.00 -0.51 0.00 0.00 58.31 55.99 2grm n LYS 3 Cb 0.51 -2.51 -0.03 0.00 -0.51 0.00 0.00 35.03 32.50 2grm n LYS 3 CO 0.00 0.00 0.00 0.82 -1.11 0.00 0.00 177.40 177.11 2grm h ILE 4 N 3.53 1.24 -0.54 -0.18 2.04 -1.95 -2.80 117.51 118.85 2grm h ILE 4 Ca 0.50 -0.83 0.08 0.00 1.00 0.00 0.00 64.86 65.60 2grm h ILE 4 Cb 0.21 1.16 -0.06 0.00 -0.74 0.00 0.00 36.82 37.38 2grm h ILE 4 CO 1.50 0.28 0.20 1.23 0.00 0.00 0.00 178.15 181.36 2grm h GLY 5 N 0.37 0.74 0.02 5.37 0.00 -1.80 -0.21 103.07 107.56 2grm h GLY 5 Ca 0.10 -0.11 0.12 0.00 0.00 0.00 0.00 47.33 47.44 2grm h GLY 5 CO 0.01 0.00 0.03 0.23 0.00 0.00 0.00 176.54 176.81 2grm h SER 6 N 0.38 -0.20 -0.28 0.19 0.87 -1.65 -1.45 113.55 111.42 2grm h SER 6 Ca 0.27 0.14 -0.02 0.00 -1.23 0.00 0.00 61.79 60.94 2grm h SER 6 Cb 0.30 0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.48 2grm h SER 6 CO -0.27 -0.08 0.08 0.58 -0.53 0.00 0.00 176.83 176.61 2grm h VAL 7 N 0.15 1.20 -0.39 2.23 2.07 -0.84 -1.71 116.25 118.96 2grm h VAL 7 Ca 0.31 -0.65 0.08 0.00 0.82 0.00 0.00 66.70 67.27 2grm h VAL 7 Cb 0.50 1.11 -0.08 0.00 -1.52 0.00 0.00 31.29 31.30 2grm h VAL 7 CO -0.48 0.21 -0.15 -0.07 0.02 0.00 0.00 177.57 177.10 2grm h LEU 8 N 0.28 -0.51 0.22 2.57 -0.00 -0.35 0.17 115.31 117.70 2grm h LEU 8 Ca 0.09 0.13 0.00 0.00 -0.00 0.00 0.00 57.88 58.11 2grm h LEU 8 Cb 0.25 0.30 -0.02 0.00 -0.00 0.00 0.00 40.66 41.19 2grm h LEU 8 CO -0.00 -0.18 -0.22 0.50 -0.00 0.00 0.00 178.44 178.54 2grm h LYS 9 N -0.07 -0.45 -0.38 1.13 3.64 -1.15 0.38 116.57 119.68 2grm h LYS 9 Ca 0.19 0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.68 2grm h LYS 9 Cb 0.36 0.10 -0.09 0.00 -0.41 0.00 0.00 32.23 32.19 2grm h LYS 9 CO -0.44 -0.30 -0.25 0.37 -2.27 0.00 0.00 179.45 176.56 2grm h GLN 10 N -0.47 -0.18 -0.46 1.90 -0.00 -0.63 0.37 115.11 115.64 2grm h GLN 10 Ca -0.00 0.01 -0.06 0.00 -0.00 0.00 0.00 58.65 58.60 2grm h GLN 10 Cb 0.44 0.04 -0.02 0.00 0.00 0.00 0.00 27.48 27.94 2grm h GLN 10 CO -0.05 -0.12 0.04 0.82 0.00 0.00 0.00 178.83 179.51 2grm h ILE 11 N -0.19 1.25 -0.01 2.39 2.04 -0.41 -1.12 117.51 121.46 2grm h ILE 11 Ca 0.18 -0.98 0.01 0.00 1.00 0.00 0.00 64.86 65.08 2grm h ILE 11 Cb 0.48 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 2grm h ILE 11 CO -0.49 0.34 -0.08 -0.09 0.00 0.00 0.00 178.15 177.83 2grm h ARG 12 N 0.64 -0.12 -0.37 2.37 2.43 0.75 -0.22 114.38 119.85 2grm h ARG 12 Ca 0.13 0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.23 2grm h ARG 12 Cb 0.44 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 2grm h ARG 12 CO 0.02 -0.08 -0.12 1.96 -1.51 0.00 0.00 179.97 180.23 2grm h GLN 13 N -0.13 0.66 -0.37 0.20 4.20 -0.26 -0.20 115.11 119.22 2grm h GLN 13 Ca 0.03 -0.21 -0.14 0.00 0.06 0.00 0.00 58.65 58.39 2grm h GLN 13 Cb 0.17 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 2grm h GLN 13 CO -0.08 0.76 -0.32 1.49 -0.67 0.00 0.00 178.83 180.01 2grm h GLU 14 N 0.60 0.82 0.00 1.46 4.22 -0.93 -1.94 114.58 118.80 2grm h GLU 14 Ca 0.10 -0.39 0.00 0.00 0.08 0.00 0.00 59.36 59.16 2grm h GLU 14 Cb 0.56 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.81 2grm h GLU 14 CO 0.04 1.02 0.00 1.28 -2.18 0.00 0.00 179.01 179.17 2grm n LEU 15 N -4.07 0.00 -0.71 1.64 4.32 -0.12 -4.90 117.00 113.16 2grm n LEU 15 Ca -0.01 0.21 -0.09 0.00 -0.02 0.00 0.00 56.01 56.10 2grm n LEU 15 Cb 0.50 -0.21 -0.04 0.00 -1.62 0.00 0.00 43.42 42.05 2grm n LEU 15 CO 0.46 -0.02 -0.09 0.59 -1.22 0.00 0.00 177.39 177.12 2grm n ASN 16 N -1.21 -4.27 -4.85 -1.43 3.02 -0.49 -5.02 115.26 101.00 2grm n ASN 16 Ca 0.16 0.23 -0.32 0.00 -0.03 0.00 0.00 54.58 54.62 2grm n ASN 16 Cb 0.19 -2.59 -0.04 0.00 -0.61 0.00 0.00 39.78 36.73 2grm n ASN 16 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2grm s TYR 17 N -2.30 3.44 0.05 3.10 1.51 -0.20 -4.99 117.35 117.95 2grm s TYR 17 Ca 0.00 1.39 0.00 0.00 -1.01 0.00 0.00 57.07 57.45 2grm s TYR 17 Cb 0.00 -2.72 -0.04 0.00 -0.11 0.00 0.00 41.96 39.09 2grm s TYR 17 CO 0.00 -0.27 0.16 -1.01 -1.11 0.00 0.00 175.55 173.32 2grm s HIS 18 N -2.50 3.42 0.34 2.71 3.76 -1.26 -4.44 115.29 117.31 2grm s HIS 18 Ca 0.58 0.22 0.12 0.00 -0.15 0.00 0.00 55.06 55.82 2grm s HIS 18 Cb -0.10 -1.74 1.05 0.00 1.11 0.00 0.00 32.58 32.90 2grm s HIS 18 CO 0.29 0.58 1.60 1.96 -0.85 0.00 0.00 174.74 178.32 2grm h GLN 19 N 3.38 0.07 -0.80 1.40 4.20 -1.97 0.70 115.11 122.10 2grm h GLN 19 Ca -0.47 -0.00 0.14 0.00 0.06 0.00 0.00 58.65 58.38 2grm h GLN 19 Cb 1.17 -0.02 -0.06 0.00 0.30 0.00 0.00 27.48 28.87 2grm h GLN 19 CO 0.71 0.05 0.53 0.97 -0.67 0.00 0.00 178.83 180.41 2grm h ILE 20 N 0.08 0.81 0.00 2.54 6.09 -1.99 0.82 117.51 125.86 2grm h ILE 20 Ca 0.72 -0.18 0.00 0.00 -1.37 0.00 0.00 64.86 64.03 2grm h ILE 20 Cb 1.71 0.25 0.00 0.00 0.47 0.00 0.00 36.82 39.25 2grm h ILE 20 CO -0.78 0.09 0.00 0.44 -3.07 0.00 0.00 178.15 174.84 2grm h ASP 21 N 0.52 0.00 0.00 2.19 3.32 0.05 -2.58 116.42 119.91 2grm h ASP 21 Ca 0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.44 2grm h ASP 21 Cb 0.79 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.34 2grm h ASP 21 CO -0.15 0.00 -0.69 0.18 -1.72 0.00 0.00 179.24 176.86 2grm n LEU 22 N -2.54 1.48 0.22 1.55 7.99 0.24 -4.74 117.00 121.20 2grm n LEU 22 Ca -0.00 0.25 0.10 0.00 -0.01 0.00 0.00 56.01 56.34 2grm n LEU 22 Cb 0.15 -0.63 0.45 0.00 -0.11 0.00 0.00 43.42 43.28 2grm n LEU 22 CO 0.18 -0.37 0.80 0.10 -1.51 0.00 0.00 177.39 176.58 2grm h TYR 23 N -0.69 0.00 -2.04 -1.77 -0.00 -1.57 -3.41 116.97 107.49 2grm h TYR 23 Ca 0.00 0.00 -0.58 0.00 -0.00 0.00 0.00 58.73 58.15 2grm h TYR 23 Cb 0.69 0.00 0.01 0.00 -0.00 0.00 0.00 36.73 37.43 2grm h TYR 23 CO -0.30 0.23 1.40 -1.13 -0.00 0.00 0.00 178.16 178.36 2grm n SER 24 N -3.39 3.48 0.00 0.10 3.41 -0.97 -0.15 113.62 116.10 2grm n SER 24 Ca 0.00 0.46 0.00 0.00 -0.26 0.00 0.00 58.87 59.07 2grm n SER 24 Cb 0.43 -1.52 0.00 0.00 -0.26 0.00 0.00 64.21 62.86 2grm n SER 24 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2grm n GLY 25 N 5.39 3.03 0.10 5.00 0.00 -1.26 -4.85 105.19 112.60 2grm n GLY 25 Ca 0.27 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.16 2grm n GLY 25 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2grm n ILE 26 N -0.73 1.51 -4.00 -0.61 2.08 0.11 -5.10 119.36 112.62 2grm n ILE 26 Ca 0.00 0.03 -0.12 0.00 0.56 0.00 0.00 62.75 63.22 2grm n ILE 26 Cb 0.00 -2.25 -0.03 0.00 -0.75 0.00 0.00 39.64 36.61 2grm n ILE 26 CO 0.00 0.00 0.00 1.15 0.56 0.00 0.00 176.55 178.26 2grm n MET 27 N -4.41 0.49 -2.96 0.38 0.00 0.79 -5.09 117.12 106.30 2grm n MET 27 Ca -0.23 -2.21 -0.38 0.00 0.00 0.00 0.00 57.70 54.89 2grm n MET 27 Cb 0.60 2.05 -0.06 0.00 0.00 0.00 0.00 33.22 35.81 2grm n MET 27 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 2grm s SER 28 N -2.67 7.31 0.53 3.17 1.04 -1.26 -4.27 113.70 117.55 2grm s SER 28 Ca 0.24 1.64 0.28 0.00 0.48 0.00 0.00 55.95 58.59 2grm s SER 28 Cb -0.00 -2.50 1.42 0.00 0.10 0.00 0.00 66.02 65.04 2grm s SER 28 CO 0.17 0.11 1.94 0.50 0.98 0.00 0.00 173.24 176.94 2grm h LYS 29 N 3.86 0.03 -0.03 4.02 3.64 -1.99 0.15 116.57 126.26 2grm h LYS 29 Ca -0.47 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 58.83 2grm h LYS 29 Cb 1.20 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 33.02 2grm h LYS 29 CO 0.66 0.02 -0.29 0.66 -2.27 0.00 0.00 179.45 178.22 2grm h SER 30 N 0.03 0.30 -0.04 4.20 4.64 -1.99 -2.76 113.55 117.93 2grm h SER 30 Ca 0.35 -0.71 -0.10 0.00 -0.47 0.00 0.00 61.79 60.85 2grm h SER 30 Cb 1.36 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.34 2grm h SER 30 CO -0.01 0.97 -0.28 1.62 -0.87 0.00 0.00 176.83 178.25 2grm h VAL 31 N -0.34 1.27 -0.46 0.95 3.04 -1.60 -2.64 116.25 116.47 2grm h VAL 31 Ca -0.03 -1.33 -0.03 0.00 -1.01 0.00 0.00 66.70 64.30 2grm h VAL 31 Cb 0.99 1.40 -0.02 0.00 -2.01 0.00 0.00 31.29 31.65 2grm h VAL 31 CO 0.06 0.42 0.17 0.22 -1.01 0.00 0.00 177.57 177.43 2grm h TYR 32 N 0.42 0.72 0.00 3.17 5.03 -0.83 0.16 116.97 125.64 2grm h TYR 32 Ca 0.06 -0.06 -0.01 0.00 2.58 0.00 0.00 58.73 61.29 2grm h TYR 32 Cb 0.71 -0.21 -0.00 0.00 1.55 0.00 0.00 36.73 38.78 2grm h TYR 32 CO 0.02 0.63 -0.06 0.82 -1.32 0.00 0.00 178.16 178.25 2grm h ILE 33 N 0.61 0.49 -0.01 1.81 2.04 -1.32 0.33 117.51 121.47 2grm h ILE 33 Ca 0.15 -0.26 -0.21 0.00 1.00 0.00 0.00 64.86 65.54 2grm h ILE 33 Cb 0.23 1.17 -0.00 0.00 -0.74 0.00 0.00 36.82 37.48 2grm h ILE 33 CO -0.01 0.06 -0.88 0.11 0.00 0.00 0.00 178.15 177.43 2grm h LYS 34 N 0.00 0.31 0.36 2.37 1.57 -0.74 -2.76 116.57 117.69 2grm h LYS 34 Ca -0.00 -0.33 -0.02 0.00 -1.87 0.00 0.00 60.65 58.44 2grm h LYS 34 Cb 0.17 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.57 2grm h LYS 34 CO 0.01 1.02 -0.17 0.28 -0.57 0.00 0.00 179.45 180.01 2grm h VAL 35 N 0.18 0.24 0.00 0.50 2.07 0.11 -1.78 116.25 117.57 2grm h VAL 35 Ca -0.06 -0.71 0.00 0.00 0.82 0.00 0.00 66.70 66.76 2grm h VAL 35 Cb 1.50 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 2grm h VAL 35 CO 0.14 0.06 0.03 1.21 0.02 0.00 0.00 177.57 179.03 2grm n GLU 36 N -5.10 0.00 0.00 1.57 2.13 0.88 -0.43 120.64 119.68 2grm n GLU 36 Ca -0.07 0.25 0.08 0.00 0.66 0.00 0.00 57.16 58.08 2grm n GLU 36 Cb 0.24 -1.53 0.02 0.00 0.27 0.00 0.00 31.44 30.44 2grm n GLU 36 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2grm n ALA 37 N -1.23 2.95 -3.35 4.31 0.00 -1.04 -4.01 120.51 118.15 2grm n ALA 37 Ca 0.00 -0.58 -0.18 0.00 0.00 0.00 0.00 53.44 52.68 2grm n ALA 37 Cb 0.03 -0.58 0.06 0.00 0.00 0.00 0.00 19.45 18.96 2grm n ALA 37 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2grm n ASP 38 N 0.26 -5.35 -0.02 0.00 8.00 0.43 -4.89 116.55 114.97 2grm n ASP 38 Ca 0.08 -0.42 -0.02 0.00 0.71 0.00 0.00 54.79 55.14 2grm n ASP 38 Cb 0.38 -4.02 -0.03 0.00 -0.02 0.00 0.00 41.12 37.43 2grm n ASP 38 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2grm n SER 39 N -2.01 3.97 -4.47 -2.24 3.41 -0.91 -5.00 113.62 106.37 2grm n SER 39 Ca 0.00 -0.01 -0.33 0.00 -0.26 0.00 0.00 58.87 58.28 2grm n SER 39 Cb 0.55 0.46 -0.13 0.00 -0.26 0.00 0.00 64.21 64.83 2grm n SER 39 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2grm s ARG 40 N -2.09 3.04 0.75 4.33 3.52 -0.72 -5.01 118.95 122.77 2grm s ARG 40 Ca -0.03 -0.63 -0.15 0.00 -0.13 0.00 0.00 55.73 54.80 2grm s ARG 40 Cb 0.01 -2.60 0.05 0.00 -1.56 0.00 0.00 34.95 30.85 2grm s ARG 40 CO 0.15 0.44 1.21 -2.14 -0.81 0.00 0.00 175.30 174.14 2grm s PRO 41 N -0.22 2.04 -0.05 5.12 0.02 -1.26 -4.45 135.00 136.20 2grm s PRO 41 Ca 0.02 1.75 0.04 0.00 0.02 0.00 0.00 61.00 62.83 2grm s PRO 41 Cb -0.13 -1.82 -0.00 0.00 0.02 0.00 0.00 34.50 32.56 2grm s PRO 41 CO 0.03 -1.91 -0.19 -1.50 -0.33 0.00 0.00 177.00 173.10 2grm s ILE 42 N -2.03 1.56 0.47 2.83 2.07 -1.26 -4.94 121.20 119.90 2grm s ILE 42 Ca 0.74 -0.78 -0.13 0.00 -1.41 0.00 0.00 60.65 59.07 2grm s ILE 42 Cb -0.29 -1.34 -0.07 0.00 0.13 0.00 0.00 42.46 40.89 2grm s ILE 42 CO 0.46 0.45 0.87 -0.94 -1.91 0.00 0.00 174.94 173.88 2grm s SER 43 N 0.08 6.53 0.46 4.50 1.04 -1.26 -4.90 113.70 120.15 2grm s SER 43 Ca -0.06 1.32 0.11 0.00 0.48 0.00 0.00 55.95 57.80 2grm s SER 43 Cb -0.13 -2.40 1.05 0.00 0.10 0.00 0.00 66.02 64.64 2grm s SER 43 CO 0.03 -0.51 2.10 -0.37 0.98 0.00 0.00 173.24 175.47 2grm h VAL 44 N 0.89 1.06 0.07 5.02 -1.51 -2.00 -0.35 116.25 119.43 2grm h VAL 44 Ca -0.47 -0.11 -0.00 0.00 -1.23 0.00 0.00 66.70 64.89 2grm h VAL 44 Cb 1.19 0.75 0.00 0.00 -2.13 0.00 0.00 31.29 31.10 2grm h VAL 44 CO 0.63 0.06 -0.03 -0.08 -1.23 0.00 0.00 177.57 176.91 2grm h GLU 45 N 0.29 -0.09 0.31 5.19 4.57 -1.99 0.31 114.58 123.16 2grm h GLU 45 Ca 0.08 0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.26 2grm h GLU 45 Cb -0.03 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.56 2grm h GLU 45 CO -0.02 0.09 -0.29 0.93 -1.18 0.00 0.00 179.01 178.54 2grm h GLU 46 N -0.26 -0.60 -0.98 1.92 5.08 -1.71 -2.04 114.58 115.98 2grm h GLU 46 Ca -0.01 0.04 0.16 0.00 -1.00 0.00 0.00 59.36 58.55 2grm h GLU 46 Cb 0.23 0.14 -0.09 0.00 0.50 0.00 0.00 28.75 29.52 2grm h GLU 46 CO 0.02 -0.40 0.61 1.25 -1.00 0.00 0.00 179.01 179.49 2grm h LEU 47 N -0.63 0.77 -0.60 1.33 5.85 -0.99 -0.50 115.31 120.54 2grm h LEU 47 Ca -0.02 0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.83 2grm h LEU 47 Cb 0.57 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.47 2grm h LEU 47 CO -0.05 0.34 0.31 -1.28 -0.34 0.00 0.00 178.44 177.42 2grm h SER 48 N 0.79 0.45 -0.24 1.25 0.87 0.28 0.16 113.55 117.11 2grm h SER 48 Ca 0.52 0.03 -0.17 0.00 -1.23 0.00 0.00 61.79 60.95 2grm h SER 48 Cb 0.78 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.68 2grm h SER 48 CO -0.30 0.30 -0.50 0.11 -0.53 0.00 0.00 176.83 175.92 2grm h LYS 49 N 0.59 0.77 -0.39 2.24 1.57 -0.52 -2.45 116.57 118.37 2grm h LYS 49 Ca 0.27 -0.50 -0.04 0.00 -1.87 0.00 0.00 60.65 58.51 2grm h LYS 49 Cb 0.18 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 2grm h LYS 49 CO -0.18 1.13 0.08 0.74 -0.57 0.00 0.00 179.45 180.64 2grm h PHE 50 N 0.50 0.59 -0.68 -1.35 0.04 -0.87 -0.38 116.94 114.80 2grm h PHE 50 Ca 0.01 -0.04 -0.01 0.00 2.80 0.00 0.00 57.97 60.72 2grm h PHE 50 Cb 1.11 -0.18 -0.03 0.00 2.20 0.00 0.00 35.95 39.05 2grm h PHE 50 CO 0.08 0.53 0.38 1.03 -0.60 0.00 0.00 178.31 179.73 2grm h SER 51 N 0.57 0.85 0.07 2.17 0.87 -0.54 -0.18 113.55 117.36 2grm h SER 51 Ca 0.13 -0.09 -0.11 0.00 -1.23 0.00 0.00 61.79 60.49 2grm h SER 51 Cb 0.25 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.98 2grm h SER 51 CO -0.00 0.69 -0.38 -0.08 -0.53 0.00 0.00 176.83 176.53 2grm h GLU 52 N 0.94 0.41 -0.13 2.24 4.81 -0.86 -1.59 114.58 120.40 2grm h GLU 52 Ca 0.24 -0.19 -0.20 0.00 -0.13 0.00 0.00 59.36 59.08 2grm h GLU 52 Cb 0.03 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.40 2grm h GLU 52 CO -0.04 0.73 -0.74 0.00 -0.73 0.00 0.00 179.01 178.23 2grm h ARG 53 N 0.35 0.63 -0.06 1.92 3.08 -0.56 -3.19 114.38 116.54 2grm h ARG 53 Ca 0.04 -0.50 -0.13 0.00 0.07 0.00 0.00 59.98 59.45 2grm h ARG 53 Cb 0.82 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.96 2grm h ARG 53 CO 0.07 1.12 -0.56 -0.07 -1.07 0.00 0.00 179.97 179.46 2grm h LEU 54 N 0.43 0.19 0.00 3.04 3.38 -0.90 -3.47 115.31 117.98 2grm h LEU 54 Ca -0.04 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.83 2grm h LEU 54 Cb 1.34 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.04 2grm h LEU 54 CO 0.14 0.71 0.00 0.61 0.09 0.00 0.00 178.44 179.99 2grm n GLY 55 N 0.14 0.60 3.52 0.83 0.00 -0.61 -5.05 105.19 104.62 2grm n GLY 55 Ca -0.02 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.29 2grm n GLY 55 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2grm s VAL 56 N -2.00 3.28 0.20 1.61 1.01 -1.18 -5.07 120.40 118.25 2grm s VAL 56 Ca 0.00 -0.78 -0.32 0.00 0.00 0.00 0.00 61.98 60.88 2grm s VAL 56 Cb 0.00 -2.35 -0.15 0.00 0.00 0.00 0.00 36.38 33.88 2grm s VAL 56 CO 0.00 0.49 1.28 -3.20 0.00 0.00 0.00 175.10 173.67 2grm n ASN 57 N 1.94 2.01 0.14 3.32 2.85 -1.26 -4.65 115.26 119.61 2grm n ASN 57 Ca -0.17 1.14 -0.14 0.00 -0.11 0.00 0.00 54.58 55.30 2grm n ASN 57 Cb 0.52 -1.31 -0.07 0.00 1.24 0.00 0.00 39.78 40.16 2grm n ASN 57 CO 0.00 0.00 0.00 0.15 -2.11 0.00 0.00 177.26 175.30 2grm h PHE 58 N 3.82 -1.04 -0.07 1.20 3.57 -1.95 -0.97 116.94 121.49 2grm h PHE 58 Ca -0.44 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.05 2grm h PHE 58 Cb 1.31 0.44 -0.01 0.00 2.79 0.00 0.00 35.95 40.48 2grm h PHE 58 CO 0.55 -0.49 -0.10 0.74 -2.23 0.00 0.00 178.31 176.79 2grm h PHE 59 N -0.64 0.10 -0.44 0.41 0.04 -1.99 -1.61 116.94 112.80 2grm h PHE 59 Ca 0.02 -0.01 -0.13 0.00 2.80 0.00 0.00 57.97 60.66 2grm h PHE 59 Cb 0.65 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.76 2grm h PHE 59 CO -0.31 0.20 -0.21 1.49 -0.60 0.00 0.00 178.31 178.87 2grm h GLU 60 N 0.09 0.93 0.05 1.51 4.81 -1.76 -0.27 114.58 119.94 2grm h GLU 60 Ca 0.02 -0.40 0.01 0.00 -0.13 0.00 0.00 59.36 58.86 2grm h GLU 60 Cb 0.24 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 2grm h GLU 60 CO 0.01 1.06 -0.09 0.82 -0.73 0.00 0.00 179.01 180.09 2grm h ILE 61 N 0.76 0.78 -0.31 2.32 2.04 -0.40 0.28 117.51 122.99 2grm h ILE 61 Ca 0.10 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.02 2grm h ILE 61 Cb 0.78 0.78 -0.06 0.00 -0.74 0.00 0.00 36.82 37.58 2grm h ILE 61 CO 0.06 0.00 -0.10 -0.07 0.00 0.00 0.00 178.15 178.04 2grm h LEU 62 N -0.18 -0.36 -0.17 1.44 3.38 -1.10 -0.41 115.31 117.91 2grm h LEU 62 Ca 0.02 0.10 0.04 0.00 0.09 0.00 0.00 57.88 58.13 2grm h LEU 62 Cb 0.20 0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 2grm h LEU 62 CO -0.06 -0.13 -0.06 0.78 0.09 0.00 0.00 178.44 179.06 2grm h ASN 63 N -0.04 -0.21 0.00 -0.43 4.21 -0.46 0.18 115.58 118.84 2grm h ASN 63 Ca 0.15 0.06 -0.00 0.00 1.21 0.00 0.00 56.30 57.72 2grm h ASN 63 Cb 0.27 0.13 -0.00 0.00 -1.12 0.00 0.00 38.32 37.60 2grm h ASN 63 CO -0.34 -0.08 -0.00 0.03 -1.29 0.00 0.00 177.43 175.75 2grm h ARG 64 N -0.03 0.00 0.00 0.81 3.08 0.21 0.57 114.38 119.02 2grm h ARG 64 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 2grm h ARG 64 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.21 2grm h ARG 64 CO -0.19 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.71 2grm n ALA 65 N -2.32 1.90 0.00 0.04 0.00 0.03 -4.84 120.51 115.32 2grm n ALA 65 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2grm n ALA 65 Cb 0.08 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.15 2grm n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2grm n GLY 66 N 0.52 1.12 0.90 0.00 0.00 0.17 -3.76 105.19 104.14 2grm n GLY 66 Ca 0.04 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.09 2grm n GLY 66 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2grm n MET 67 N 0.00 2.31 -0.64 1.61 2.81 -1.06 -3.95 117.12 118.21 2grm n MET 67 Ca 0.00 -1.24 -0.04 0.00 -1.81 0.00 0.00 57.70 54.61 2grm n MET 67 Cb 0.00 -1.62 0.19 0.00 -0.71 0.00 0.00 33.22 31.08 2grm n MET 67 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 2grm n ASN 68 N 0.31 3.73 -3.64 7.83 6.94 -1.09 -4.67 115.26 124.67 2grm n ASN 68 Ca 0.11 -2.75 -0.04 0.00 -0.02 0.00 0.00 54.58 51.88 2grm n ASN 68 Cb 0.51 -0.65 -0.06 0.00 -2.36 0.00 0.00 39.78 37.21 2grm n ASN 68 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 2grm s THR 69 N -2.06 -0.85 -0.81 5.53 -1.32 -1.25 -5.04 115.64 109.84 2grm s THR 69 Ca 0.34 0.07 -0.07 0.00 -1.21 0.00 0.00 61.69 60.83 2grm s THR 69 Cb 0.27 -0.86 -0.12 0.00 -1.51 0.00 0.00 72.50 70.29 2grm s THR 69 CO 0.09 0.03 2.68 0.29 -2.21 0.00 0.00 174.62 175.49 2grm n LYS 70 N 5.42 2.40 -0.21 7.08 4.76 -1.26 -2.91 118.16 133.44 2grm n LYS 70 Ca -0.10 -1.44 0.01 0.00 -2.87 0.00 0.00 58.31 53.90 2grm n LYS 70 Cb 0.49 -2.36 0.01 0.00 -1.84 0.00 0.00 35.03 31.34 2grm n LYS 70 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2grm n SER 71 N 3.43 0.36 0.08 4.39 2.88 -1.26 -4.09 113.62 119.41 2grm n SER 71 Ca 0.51 -1.67 -0.10 0.00 -1.33 0.00 0.00 58.87 56.28 2grm n SER 71 Cb 0.37 -0.12 -0.02 0.00 -0.75 0.00 0.00 64.21 63.69 2grm n SER 71 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 2grm h VAL 72 N 4.16 1.47 -2.68 2.46 -1.51 -1.87 -3.45 116.25 114.84 2grm h VAL 72 Ca 0.00 -2.60 -0.50 0.00 -1.23 0.00 0.00 66.70 62.37 2grm h VAL 72 Cb 1.12 2.48 -0.14 0.00 -2.13 0.00 0.00 31.29 32.62 2grm h VAL 72 CO 0.00 0.76 -0.60 0.54 -1.23 0.00 0.00 177.57 177.05 2grm s ASN 73 N -6.97 2.56 0.00 4.19 2.20 -1.26 -5.06 114.94 110.60 2grm s ASN 73 Ca -0.04 -1.41 0.00 0.00 -0.94 0.00 0.00 52.86 50.47 2grm s ASN 73 Cb 0.10 -0.03 0.00 0.00 -2.00 0.00 0.00 41.25 39.32 2grm s ASN 73 CO 0.84 -0.64 0.88 1.21 -2.94 0.00 0.00 177.10 176.45 2grm n GLU 74 N -0.74 0.00 -0.48 3.55 4.07 -1.26 -1.17 120.64 124.61 2grm n GLU 74 Ca -0.03 0.85 0.39 0.00 -0.06 0.00 0.00 57.16 58.31 2grm n GLU 74 Cb 0.66 -1.38 0.68 0.00 -0.06 0.00 0.00 31.44 31.35 2grm n GLU 74 CO 0.00 0.00 0.00 1.79 -0.06 0.00 0.00 177.13 178.86 2grm h THR 75 N 0.00 0.14 0.21 6.31 1.35 -1.98 0.10 112.91 119.05 2grm h THR 75 Ca 0.00 -0.03 -0.00 0.00 -0.55 0.00 0.00 66.41 65.83 2grm h THR 75 Cb 0.00 0.06 -0.01 0.00 -1.73 0.00 0.00 68.15 66.47 2grm h THR 75 CO 0.00 0.01 -0.17 1.23 -0.25 0.00 0.00 175.52 176.34 2grm h GLY 76 N 0.08 -0.40 0.68 5.82 0.00 -1.32 -2.14 103.07 105.80 2grm h GLY 76 Ca 0.81 0.20 0.06 0.00 0.00 0.00 0.00 47.33 48.39 2grm h GLY 76 CO -0.30 -0.17 0.38 0.50 0.00 0.00 0.00 176.54 176.95 2grm h LYS 77 N -0.40 0.68 -0.75 4.80 1.57 -0.72 -2.45 116.57 119.32 2grm h LYS 77 Ca -0.01 -0.04 0.04 0.00 -1.87 0.00 0.00 60.65 58.77 2grm h LYS 77 Cb 0.36 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.47 2grm h LYS 77 CO -0.02 0.45 0.49 0.93 -0.57 0.00 0.00 179.45 180.73 2grm h GLU 78 N 0.70 0.87 -0.06 3.15 4.39 -1.20 -1.27 114.58 121.16 2grm h GLU 78 Ca 0.30 -0.05 -0.18 0.00 0.34 0.00 0.00 59.36 59.77 2grm h GLU 78 Cb 0.19 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 2grm h GLU 78 CO -0.18 0.57 -0.74 0.87 -1.16 0.00 0.00 179.01 178.37 2grm h LYS 79 N 0.89 0.35 -0.10 2.33 1.57 -0.94 -2.82 116.57 117.85 2grm h LYS 79 Ca 0.30 -0.29 -0.10 0.00 -1.87 0.00 0.00 60.65 58.69 2grm h LYS 79 Cb 0.08 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 2grm h LYS 79 CO -0.09 0.94 -0.38 -0.07 -0.57 0.00 0.00 179.45 179.28 2grm h LEU 80 N 0.23 0.22 -1.21 2.94 3.38 -0.99 -2.72 115.31 117.16 2grm h LEU 80 Ca -0.03 -0.08 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 2grm h LEU 80 Cb 1.31 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 2grm h LEU 80 CO 0.12 0.59 -0.36 0.25 0.09 0.00 0.00 178.44 179.13 2grm h LEU 81 N 0.18 0.05 -0.76 1.67 5.85 -1.06 -3.09 115.31 118.15 2grm h LEU 81 Ca 0.02 -0.02 0.14 0.00 0.84 0.00 0.00 57.88 58.86 2grm h LEU 81 Cb 0.76 -0.01 -0.09 0.00 0.37 0.00 0.00 40.66 41.69 2grm h LEU 81 CO 0.06 0.42 0.32 0.40 -0.34 0.00 0.00 178.44 179.29 2grm h ILE 82 N 0.04 0.68 -0.67 4.05 1.08 -1.24 0.18 117.51 121.63 2grm h ILE 82 Ca 0.00 -0.16 -0.01 0.00 -0.39 0.00 0.00 64.86 64.30 2grm h ILE 82 Cb 0.67 0.16 -0.03 0.00 -3.07 0.00 0.00 36.82 34.55 2grm h ILE 82 CO 0.05 0.09 0.38 0.28 -0.69 0.00 0.00 178.15 178.26 2grm h SER 83 N 0.48 0.82 0.30 1.72 0.02 -1.68 -0.94 113.55 114.27 2grm h SER 83 Ca 0.41 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 61.27 2grm h SER 83 Cb 0.61 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.94 2grm h SER 83 CO -0.39 0.66 -0.14 0.50 -1.14 0.00 0.00 176.83 176.32 2grm h LYS 84 N 0.92 -0.39 0.00 3.45 3.64 -1.12 -2.17 116.57 120.90 2grm h LYS 84 Ca 0.24 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 2grm h LYS 84 Cb 0.01 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2grm h LYS 84 CO -0.04 -0.22 0.00 0.82 -2.27 0.00 0.00 179.45 177.74 2grm h ILE 85 N -0.46 0.00 0.00 2.00 1.08 -0.53 -0.30 117.51 119.30 2grm h ILE 85 Ca -0.04 -0.14 -0.09 0.00 -0.39 0.00 0.00 64.86 64.20 2grm h ILE 85 Cb 0.35 0.92 -0.01 0.00 -3.07 0.00 0.00 36.82 35.00 2grm h ILE 85 CO 0.07 0.00 -0.55 0.15 -0.69 0.00 0.00 178.15 177.13 2grm h PHE 86 N 0.00 0.00 -0.01 1.37 3.57 -0.52 -2.83 116.94 118.52 2grm h PHE 86 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2grm h PHE 86 Cb 0.16 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.90 2grm h PHE 86 CO 0.00 0.39 -0.30 0.25 -2.23 0.00 0.00 178.31 176.41 2grm n THR 87 N -3.13 0.00 -3.15 4.41 -2.24 -0.81 -4.56 114.28 104.81 2grm n THR 87 Ca 0.01 -0.35 -0.22 0.00 -2.27 0.00 0.00 64.05 61.22 2grm n THR 87 Cb 0.70 1.13 -0.04 0.00 -2.10 0.00 0.00 70.33 70.01 2grm n THR 87 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2grm n ASN 88 N -0.36 1.92 0.00 3.42 3.02 -0.19 -4.96 115.26 118.12 2grm n ASN 88 Ca 0.05 -3.17 0.00 0.00 -0.03 0.00 0.00 54.58 51.43 2grm n ASN 88 Cb 0.25 -0.61 0.00 0.00 -0.61 0.00 0.00 39.78 38.81 2grm n ASN 88 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2grm n PRO 89 N 0.38 0.00 0.09 3.52 -0.04 -1.07 -1.10 135.00 136.77 2grm n PRO 89 Ca 0.26 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.71 2grm n PRO 89 Cb 0.55 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.46 2grm n PRO 89 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2grm h ASP 90 N 0.00 0.00 -0.04 3.54 3.32 -1.93 -3.15 116.42 118.16 2grm h ASP 90 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2grm h ASP 90 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2grm h ASP 90 CO 0.00 0.69 0.00 0.18 -1.72 0.00 0.00 179.24 178.39 2grm n LEU 91 N -3.21 0.39 0.03 1.55 4.77 -0.26 -4.32 117.00 115.95 2grm n LEU 91 Ca -0.01 -0.17 -0.01 0.00 -0.03 0.00 0.00 56.01 55.79 2grm n LEU 91 Cb 0.83 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.89 2grm n LEU 91 CO 0.43 0.08 0.50 0.15 -1.33 0.00 0.00 177.39 177.23 2grm h PHE 92 N 0.51 -0.07 0.00 -1.77 3.57 -1.71 -3.19 116.94 114.28 2grm h PHE 92 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2grm h PHE 92 Cb 0.11 0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.88 2grm h PHE 92 CO 0.03 -0.04 0.00 -0.25 -2.23 0.00 0.00 178.31 175.82 2grm n ASP 93 N -2.23 0.00 -0.34 0.41 8.00 -1.26 -0.24 116.55 120.89 2grm n ASP 93 Ca -0.01 0.46 0.25 0.00 0.71 0.00 0.00 54.79 56.20 2grm n ASP 93 Cb 0.03 -0.07 0.49 0.00 -0.02 0.00 0.00 41.12 41.55 2grm n ASP 93 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2grm h LYS 94 N 0.00 0.30 -0.04 -1.24 1.57 -1.87 -0.75 116.57 114.54 2grm h LYS 94 Ca 0.00 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.68 2grm h LYS 94 Cb 0.00 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.25 2grm h LYS 94 CO 0.00 0.20 -0.28 -0.91 -0.57 0.00 0.00 179.45 177.89 2grm h ASN 95 N 0.31 0.31 -0.02 0.86 -0.26 -1.32 -3.23 115.58 112.22 2grm h ASN 95 Ca 0.73 -0.69 0.01 0.00 -0.56 0.00 0.00 56.30 55.79 2grm h ASN 95 Cb 1.75 -0.09 -0.00 0.00 -1.06 0.00 0.00 38.32 38.92 2grm h ASN 95 CO -0.57 0.95 0.02 0.15 -1.06 0.00 0.00 177.43 176.92 2grm h PHE 96 N -0.31 0.00 0.00 1.19 3.57 0.59 -0.41 116.94 121.57 2grm h PHE 96 Ca -0.02 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.43 2grm h PHE 96 Cb 0.97 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.70 2grm h PHE 96 CO 0.15 0.00 -0.19 1.96 -2.23 0.00 0.00 178.31 177.99 2grm h GLN 97 N 0.00 0.00 0.00 1.11 1.08 -1.20 -1.33 115.11 114.77 2grm h GLN 97 Ca 0.01 0.00 -0.26 0.00 -1.45 0.00 0.00 58.65 56.95 2grm h GLN 97 Cb 0.05 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.43 2grm h GLN 97 CO -0.00 0.19 -1.69 -2.13 -0.95 0.00 0.00 178.83 174.25 2grm n ARG 98 N -3.73 0.63 -0.07 1.46 0.63 -0.21 -4.39 116.66 110.98 2grm n ARG 98 Ca -0.02 0.25 -0.18 0.00 -0.92 0.00 0.00 57.85 56.98 2grm n ARG 98 Cb 0.31 -1.77 -0.13 0.00 0.45 0.00 0.00 32.46 31.32 2grm n ARG 98 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 2grm h ILE 99 N 0.00 1.34 -0.90 5.15 5.03 -1.32 -3.39 117.51 123.42 2grm h ILE 99 Ca -0.27 -2.29 0.17 0.00 -0.12 0.00 0.00 64.86 62.35 2grm h ILE 99 Cb 1.91 2.82 -0.16 0.00 -3.03 0.00 0.00 36.82 38.36 2grm h ILE 99 CO 0.07 0.50 -0.27 1.21 -0.68 0.00 0.00 178.15 178.97 2grm n GLU 100 N -4.45 -0.12 0.27 2.37 0.00 -0.51 0.03 120.64 118.22 2grm n GLU 100 Ca -0.21 1.40 0.13 0.00 0.00 0.00 0.00 57.16 58.48 2grm n GLU 100 Cb 0.62 -2.09 0.76 0.00 0.00 0.00 0.00 31.44 30.73 2grm n GLU 100 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.13 175.78 2grm h PRO 101 N 0.00 0.00 -0.68 5.31 0.11 -1.77 -2.77 132.00 132.20 2grm h PRO 101 Ca 0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.51 2grm h PRO 101 Cb 0.62 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.73 2grm h PRO 101 CO -0.92 0.09 0.00 1.63 -0.21 0.00 0.00 178.00 178.59 2grm n LYS 102 N -3.78 3.29 0.31 1.05 5.02 0.10 -4.62 118.16 119.54 2grm n LYS 102 Ca -0.02 -2.78 0.19 0.00 -2.02 0.00 0.00 58.31 53.68 2grm n LYS 102 Cb 0.19 -1.74 1.06 0.00 -0.02 0.00 0.00 35.03 34.52 2grm n LYS 102 CO 0.00 0.00 0.00 0.07 -0.52 0.00 0.00 177.40 176.95 2grm h ARG 103 N 4.12 0.00 -0.37 1.97 0.11 -1.19 -1.23 114.38 117.79 2grm h ARG 103 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2grm h ARG 103 Cb 1.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.32 2grm h ARG 103 CO 0.13 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.48 2grm n LEU 104 N -3.41 3.00 0.23 0.08 4.77 -1.26 -2.72 117.00 117.70 2grm n LEU 104 Ca -0.03 -1.85 0.07 0.00 -0.03 0.00 0.00 56.01 54.18 2grm n LEU 104 Cb 0.11 -0.24 0.55 0.00 -2.33 0.00 0.00 43.42 41.51 2grm n LEU 104 CO 0.23 0.73 0.89 0.74 -1.33 0.00 0.00 177.39 178.65 2grm h THR 105 N 2.56 0.95 -1.14 -5.08 2.02 -1.55 -3.46 112.91 107.21 2grm h THR 105 Ca 0.00 -0.74 0.27 0.00 0.77 0.00 0.00 66.41 66.72 2grm h THR 105 Cb 0.76 1.42 -0.23 0.00 -1.74 0.00 0.00 68.15 68.35 2grm h THR 105 CO 0.00 0.20 0.93 -0.94 0.37 0.00 0.00 175.52 176.07 2grm s SER 106 N -6.68 -0.06 0.46 4.18 1.04 -1.26 -4.99 113.70 106.39 2grm s SER 106 Ca -0.03 0.03 0.23 0.00 0.48 0.00 0.00 55.95 56.66 2grm s SER 106 Cb 0.14 0.05 1.24 0.00 0.10 0.00 0.00 66.02 67.56 2grm s SER 106 CO 0.66 -0.07 1.85 -0.07 0.98 0.00 0.00 173.24 176.59 2grm h LEU 107 N 2.04 0.26 0.50 2.42 3.38 -1.89 -0.80 115.31 121.22 2grm h LEU 107 Ca -0.06 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2grm h LEU 107 Cb 1.16 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 2grm h LEU 107 CO 0.21 0.09 -0.32 1.56 0.09 0.00 0.00 178.44 180.07 2grm h GLN 108 N 0.25 -0.75 0.00 1.13 1.08 -1.94 -1.35 115.11 113.53 2grm h GLN 108 Ca 0.48 0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 57.71 2grm h GLN 108 Cb 1.46 0.17 -0.00 0.00 -0.05 0.00 0.00 27.48 29.06 2grm h GLN 108 CO -0.13 -0.50 -0.11 1.88 -0.95 0.00 0.00 178.83 179.02 2grm h TYR 109 N -0.78 0.00 -0.13 2.96 -1.99 -1.46 -2.06 116.97 113.51 2grm h TYR 109 Ca -0.06 0.00 -0.19 0.00 2.00 0.00 0.00 58.73 60.48 2grm h TYR 109 Cb 0.64 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.37 2grm h TYR 109 CO -0.11 0.11 -0.70 0.35 -0.00 0.00 0.00 178.16 177.81 2grm h PHE 110 N 0.00 0.77 -0.59 4.88 3.57 -1.01 0.17 116.94 124.74 2grm h PHE 110 Ca -0.00 -0.33 -0.05 0.00 3.53 0.00 0.00 57.97 61.13 2grm h PHE 110 Cb 0.22 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 2grm h PHE 110 CO 0.00 1.11 0.18 1.03 -2.23 0.00 0.00 178.31 178.40 2grm h SER 111 N 0.41 0.85 -0.81 0.41 0.87 -0.60 0.19 113.55 114.88 2grm h SER 111 Ca -0.03 -0.21 -0.05 0.00 -1.23 0.00 0.00 61.79 60.28 2grm h SER 111 Cb 1.29 -0.22 -0.04 0.00 -0.44 0.00 0.00 62.40 62.99 2grm h SER 111 CO 0.13 0.83 0.33 0.40 -0.53 0.00 0.00 176.83 177.99 2grm h ILE 112 N 0.83 1.26 0.37 2.23 2.04 -1.15 -0.32 117.51 122.77 2grm h ILE 112 Ca 0.19 -0.82 -0.02 0.00 1.00 0.00 0.00 64.86 65.21 2grm h ILE 112 Cb 0.28 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 36.66 2grm h ILE 112 CO -0.01 0.34 -0.18 0.22 0.00 0.00 0.00 178.15 178.52 2grm h TYR 113 N 1.18 -0.46 -0.33 1.37 3.20 0.08 -1.16 116.97 120.85 2grm h TYR 113 Ca 0.27 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.19 2grm h TYR 113 Cb 0.21 0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 2grm h TYR 113 CO 0.02 -0.27 0.23 -0.07 -1.64 0.00 0.00 178.16 176.42 2grm h LEU 114 N -0.52 0.13 0.00 2.82 3.38 -0.74 -0.79 115.31 119.59 2grm h LEU 114 Ca -0.05 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.94 2grm h LEU 114 Cb 0.39 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 2grm h LEU 114 CO 0.08 0.08 -0.14 1.23 0.09 0.00 0.00 178.44 179.78 2grm h GLY 115 N 0.15 -0.18 0.99 0.83 0.00 0.13 -1.37 103.07 103.62 2grm h GLY 115 Ca 0.15 0.17 -0.00 0.00 0.00 0.00 0.00 47.33 47.65 2grm h GLY 115 CO -0.02 -0.14 0.34 -0.97 0.00 0.00 0.00 176.54 175.75 2grm h TYR 116 N -0.24 0.75 -0.61 5.60 -1.99 -0.37 -2.24 116.97 117.87 2grm h TYR 116 Ca 0.05 -0.00 0.14 0.00 2.00 0.00 0.00 58.73 60.92 2grm h TYR 116 Cb 0.30 -0.25 -0.03 0.00 2.00 0.00 0.00 36.73 38.76 2grm h TYR 116 CO -0.20 0.52 0.42 0.82 -0.00 0.00 0.00 178.16 179.72 2grm h ILE 117 N 0.77 0.78 0.02 -2.88 1.08 -0.79 -0.60 117.51 115.88 2grm h ILE 117 Ca 0.20 -0.06 -0.00 0.00 -0.39 0.00 0.00 64.86 64.61 2grm h ILE 117 Cb -0.01 0.57 0.00 0.00 -3.07 0.00 0.00 36.82 34.31 2grm h ILE 117 CO -0.04 0.03 -0.01 0.28 -0.69 0.00 0.00 178.15 177.72 2grm h SER 118 N 0.19 -0.03 -0.72 1.72 0.02 -0.66 -2.36 113.55 111.71 2grm h SER 118 Ca 0.29 -0.38 0.12 0.00 -0.84 0.00 0.00 61.79 60.98 2grm h SER 118 Cb 0.90 0.01 -0.08 0.00 0.14 0.00 0.00 62.40 63.36 2grm h SER 118 CO -0.05 0.37 0.31 0.40 -1.14 0.00 0.00 176.83 176.72 2grm h ILE 119 N -0.43 0.74 0.40 3.27 2.04 -1.01 -1.53 117.51 120.99 2grm h ILE 119 Ca -0.00 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 2grm h ILE 119 Cb 0.40 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 2grm h ILE 119 CO 0.01 0.09 -0.25 0.00 0.00 0.00 0.00 178.15 177.99 2grm h ALA 120 N 1.49 -0.62 -0.87 1.87 0.00 -1.06 -1.69 119.26 118.38 2grm h ALA 120 Ca 0.38 -0.12 0.08 0.00 0.00 0.00 0.00 54.91 55.25 2grm h ALA 120 Cb 0.51 0.31 -0.07 0.00 0.00 0.00 0.00 17.79 18.54 2grm h ALA 120 CO -0.34 -0.86 0.53 0.45 0.00 0.00 0.00 179.25 179.02 2grm h HIS 121 N -0.63 0.97 0.24 0.00 3.86 -1.03 0.60 115.15 119.16 2grm h HIS 121 Ca -0.04 0.03 0.01 0.00 -1.16 0.00 0.00 60.37 59.20 2grm h HIS 121 Cb 0.52 -0.31 -0.02 0.00 1.06 0.00 0.00 27.41 28.66 2grm h HIS 121 CO -0.10 0.45 -0.27 1.25 0.86 0.00 0.00 177.93 180.12 2grm h HIS 122 N 0.93 -0.73 -0.25 2.45 6.17 -1.07 -1.83 115.15 120.82 2grm h HIS 122 Ca 0.40 0.01 -0.08 0.00 0.71 0.00 0.00 60.37 61.40 2grm h HIS 122 Cb 0.26 0.29 -0.05 0.00 2.52 0.00 0.00 27.41 30.43 2grm h HIS 122 CO -0.04 -0.39 0.10 0.66 0.71 0.00 0.00 177.93 178.97 2grm n TYR 123 N -5.39 0.82 -4.31 5.26 4.01 -0.65 -4.88 117.16 112.02 2grm n TYR 123 Ca -0.08 -0.57 -0.32 0.00 -0.16 0.00 0.00 57.90 56.76 2grm n TYR 123 Cb 0.30 -0.35 -0.08 0.00 -0.31 0.00 0.00 39.34 38.90 2grm n TYR 123 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2grm n ASN 124 N 0.09 0.15 -4.83 7.72 5.03 -0.45 -4.92 115.26 118.04 2grm n ASN 124 Ca 0.14 -1.23 -0.38 0.00 0.87 0.00 0.00 54.58 53.99 2grm n ASN 124 Cb 0.71 -1.84 -0.06 0.00 -1.02 0.00 0.00 39.78 37.57 2grm n ASN 124 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2grm s ILE 125 N -4.10 5.20 -0.10 2.41 1.01 0.20 -4.99 121.20 120.83 2grm s ILE 125 Ca 0.17 0.63 -0.30 0.00 0.00 0.00 0.00 60.65 61.15 2grm s ILE 125 Cb -0.10 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.73 2grm s ILE 125 CO 0.99 0.56 1.25 -1.61 0.00 0.00 0.00 174.94 176.13 2grm s GLU 126 N -0.85 4.29 -0.49 2.79 0.41 -1.26 -4.36 118.70 119.23 2grm s GLU 126 Ca 0.20 1.70 0.06 0.00 -0.41 0.00 0.00 54.97 56.52 2grm s GLU 126 Cb -0.15 -3.67 0.22 0.00 -1.78 0.00 0.00 34.13 28.75 2grm s GLU 126 CO 0.09 -0.59 0.51 1.33 -0.49 0.00 0.00 175.26 176.12 2grm n VAL 127 N 5.00 0.08 0.08 2.63 0.24 -1.26 -4.98 118.33 120.12 2grm n VAL 127 Ca 0.13 -4.20 0.01 0.00 -2.04 0.00 0.00 64.34 58.23 2grm n VAL 127 Cb 0.45 -1.93 0.33 0.00 -1.47 0.00 0.00 33.84 31.22 2grm n VAL 127 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 2grm h PRO 128 N 4.70 0.33 0.00 7.34 0.11 -2.02 -2.83 132.00 139.63 2grm h PRO 128 Ca 0.16 -0.09 -0.01 0.00 0.11 0.00 0.00 66.00 66.18 2grm h PRO 128 Cb 0.83 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.89 2grm h PRO 128 CO 0.55 0.47 -0.06 1.79 -0.21 0.00 0.00 178.00 180.53 2grm h THR 129 N 0.32 0.32 0.00 -1.15 1.35 -1.98 -2.81 112.91 108.96 2grm h THR 129 Ca 0.06 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 2grm h THR 129 Cb 0.43 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 68.13 2grm h THR 129 CO 0.02 0.06 0.00 0.33 -0.25 0.00 0.00 175.52 175.69 2grm n PHE 130 N -3.41 0.00 -0.10 4.73 7.35 -1.07 -1.95 117.46 123.01 2grm n PHE 130 Ca -0.02 0.00 0.27 0.00 -0.76 0.00 0.00 57.45 56.94 2grm n PHE 130 Cb 0.21 -0.39 0.67 0.00 0.35 0.00 0.00 39.48 40.31 2grm n PHE 130 CO 0.00 0.00 0.00 -0.91 -0.76 0.00 0.00 176.76 175.09 2grm h ASN 131 N 0.00 0.00 0.79 -2.13 2.35 -1.67 0.11 115.58 115.03 2grm h ASN 131 Ca 0.00 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.51 2grm h ASN 131 Cb 0.00 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.33 2grm h ASN 131 CO 0.00 0.00 -1.28 0.11 -1.65 0.00 0.00 177.43 174.61 2grm h LYS 132 N 0.00 0.00 -0.00 0.81 1.57 -1.56 -3.41 116.57 113.98 2grm h LYS 132 Ca 0.38 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 2grm h LYS 132 Cb 1.92 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.23 2grm h LYS 132 CO -0.00 0.80 -0.01 0.25 -0.57 0.00 0.00 179.45 179.91 2grm n THR 133 N -3.23 0.00 -0.04 -0.16 -2.24 0.05 -4.83 114.28 103.83 2grm n THR 133 Ca -0.07 -0.49 -0.09 0.00 -2.27 0.00 0.00 64.05 61.13 2grm n THR 133 Cb 0.99 1.00 -0.03 0.00 -2.10 0.00 0.00 70.33 70.19 2grm n THR 133 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 2grm h ILE 134 N 0.01 0.87 -0.94 2.28 2.10 -1.11 0.42 117.51 121.15 2grm h ILE 134 Ca 0.00 -0.02 0.12 0.00 1.08 0.00 0.00 64.86 66.04 2grm h ILE 134 Cb 0.01 0.79 -0.08 0.00 -1.09 0.00 0.00 36.82 36.45 2grm h ILE 134 CO 0.00 0.01 0.60 0.74 -1.08 0.00 0.00 178.15 178.42 2grm h THR 135 N 0.07 0.90 0.20 2.19 2.02 -1.88 0.89 112.91 117.31 2grm h THR 135 Ca 0.09 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 66.96 2grm h THR 135 Cb 0.11 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.48 2grm h THR 135 CO -0.15 0.16 -0.10 -1.28 0.37 0.00 0.00 175.52 174.52 2grm h SER 136 N 0.87 -0.23 -0.38 4.18 0.87 -1.72 -2.04 113.55 115.10 2grm h SER 136 Ca 0.46 -0.15 0.08 0.00 -1.23 0.00 0.00 61.79 60.95 2grm h SER 136 Cb 0.54 0.06 -0.08 0.00 -0.44 0.00 0.00 62.40 62.49 2grm h SER 136 CO -0.22 0.02 -0.13 0.44 -0.53 0.00 0.00 176.83 176.41 2grm h ASP 137 N -0.48 -0.45 -0.53 6.23 3.32 0.73 -0.97 116.42 124.27 2grm h ASP 137 Ca -0.03 0.13 0.02 0.00 0.02 0.00 0.00 57.03 57.17 2grm h ASP 137 Cb 0.36 0.27 -0.04 0.00 0.22 0.00 0.00 39.33 40.15 2grm h ASP 137 CO 0.05 -0.16 0.32 -0.07 -1.72 0.00 0.00 179.24 177.65 2grm h LEU 138 N -0.05 0.51 -0.37 1.55 3.38 -0.91 0.14 115.31 119.57 2grm h LEU 138 Ca 0.18 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.23 2grm h LEU 138 Cb 0.33 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.91 2grm h LEU 138 CO -0.41 0.36 -0.03 0.50 0.09 0.00 0.00 178.44 178.95 2grm h LYS 139 N 0.63 0.06 -0.80 1.13 1.63 -0.56 0.58 116.57 119.24 2grm h LYS 139 Ca 0.21 -0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.98 2grm h LYS 139 Cb 0.02 -0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 31.60 2grm h LYS 139 CO -0.10 0.04 0.40 1.25 -3.45 0.00 0.00 179.45 177.59 2grm h HIS 140 N 0.06 1.13 0.13 1.91 2.76 -0.18 -3.22 115.15 117.74 2grm h HIS 140 Ca 0.18 -0.04 -0.24 0.00 -2.20 0.00 0.00 60.37 58.06 2grm h HIS 140 Cb 0.26 -0.35 0.01 0.00 1.55 0.00 0.00 27.41 28.87 2grm h HIS 140 CO -0.28 0.81 -1.20 -0.07 -1.30 0.00 0.00 177.93 175.89 2grm h LEU 141 N 1.13 0.42 -7.41 0.26 3.38 -0.03 -3.41 115.31 109.64 2grm h LEU 141 Ca 0.28 -0.89 -0.69 0.00 0.09 0.00 0.00 57.88 56.67 2grm h LEU 141 Cb 0.09 -0.14 -0.36 0.00 0.09 0.00 0.00 40.66 40.35 2grm h LEU 141 CO -0.04 1.54 -0.26 -0.31 0.09 0.00 0.00 178.44 179.46 2grm s TYR 142 N -2.46 3.63 0.00 1.13 2.02 0.20 -4.68 117.35 117.18 2grm s TYR 142 Ca -0.17 -2.91 0.00 0.00 -0.37 0.00 0.00 57.07 53.62 2grm s TYR 142 Cb 0.03 -3.18 0.00 0.00 -0.40 0.00 0.00 41.96 38.41 2grm s TYR 142 CO 0.79 -0.77 0.00 -3.47 -1.57 0.00 0.00 175.55 170.53 2grm n ASP 143 N 2.85 0.05 -1.81 2.29 4.64 -1.22 -4.59 116.55 118.75 2grm n ASP 143 Ca 0.15 0.00 -0.19 0.00 -1.38 0.00 0.00 54.79 53.37 2grm n ASP 143 Cb 0.37 0.00 0.14 0.00 -1.04 0.00 0.00 41.12 40.59 2grm n ASP 143 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 2grm n LYS 144 N -2.17 2.43 -3.61 -0.67 4.76 -1.26 -5.00 118.16 112.64 2grm n LYS 144 Ca 0.00 -3.35 -0.37 0.00 -2.87 0.00 0.00 58.31 51.71 2grm n LYS 144 Cb 0.02 -2.08 -0.06 0.00 -1.84 0.00 0.00 35.03 31.06 2grm n LYS 144 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2grm s ARG 145 N -3.46 3.88 0.00 1.97 1.81 -1.26 -4.97 118.95 116.92 2grm s ARG 145 Ca 0.53 0.19 0.00 0.00 -1.72 0.00 0.00 55.73 54.73 2grm s ARG 145 Cb 0.45 -3.27 0.00 0.00 -0.45 0.00 0.00 34.95 31.68 2grm s ARG 145 CO 0.02 0.59 0.00 0.25 -0.68 0.00 0.00 175.30 175.49 2grm n THR 146 N 2.33 0.00 -4.36 0.02 -2.24 -1.26 -5.07 114.28 103.70 2grm n THR 146 Ca -0.15 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.39 2grm n THR 146 Cb 0.53 -0.61 -0.12 0.00 -2.10 0.00 0.00 70.33 68.04 2grm n THR 146 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2grm s THR 147 N -1.92 2.01 0.00 4.28 -4.23 -1.26 -5.06 115.64 109.46 2grm s THR 147 Ca 0.00 -1.93 0.06 0.00 -1.18 0.00 0.00 61.69 58.65 2grm s THR 147 Cb 0.00 -1.92 -0.02 0.00 1.34 0.00 0.00 72.50 71.90 2grm s THR 147 CO 0.00 -0.22 -0.20 -0.36 -0.54 0.00 0.00 174.62 173.31 2grm s PHE 148 N -1.83 1.75 0.57 3.99 0.40 -1.26 -5.13 117.98 116.47 2grm s PHE 148 Ca 0.17 -0.34 0.08 0.00 -0.60 0.00 0.00 56.93 56.24 2grm s PHE 148 Cb -0.07 -1.10 0.07 0.00 0.51 0.00 0.00 43.02 42.44 2grm s PHE 148 CO 0.08 0.01 0.66 -0.06 0.70 0.00 0.00 175.22 176.60 2grm s PHE 149 N -0.57 1.43 0.17 0.36 0.40 -1.26 -4.97 117.98 113.55 2grm s PHE 149 Ca 0.07 -0.78 -0.16 0.00 -0.60 0.00 0.00 56.93 55.47 2grm s PHE 149 Cb -0.08 -2.10 0.12 0.00 0.51 0.00 0.00 43.02 41.47 2grm s PHE 149 CO 0.00 -0.94 1.69 0.78 0.70 0.00 0.00 175.22 177.46 2grm h GLY 150 N 0.36 0.40 2.00 4.36 0.00 -1.95 -1.01 103.07 107.23 2grm h GLY 150 Ca -0.32 0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 2grm h GLY 150 CO 0.46 -0.11 -0.03 1.19 0.00 0.00 0.00 176.54 178.06 2grm h ILE 151 N 0.10 0.69 -0.14 2.60 6.09 -1.96 -1.49 117.51 123.39 2grm h ILE 151 Ca 0.20 -0.10 -0.00 0.00 -1.37 0.00 0.00 64.86 63.59 2grm h ILE 151 Cb 0.29 1.06 -0.01 0.00 0.47 0.00 0.00 36.82 38.63 2grm h ILE 151 CO -0.34 0.03 0.08 0.44 -3.07 0.00 0.00 178.15 175.28 2grm h ASP 152 N 0.00 0.16 -0.17 2.19 3.45 -1.56 0.79 116.42 121.29 2grm h ASP 152 Ca -0.00 -0.05 -0.09 0.00 0.43 0.00 0.00 57.03 57.32 2grm h ASP 152 Cb 0.06 -0.04 -0.02 0.00 -0.56 0.00 0.00 39.33 38.77 2grm h ASP 152 CO 0.00 0.17 -0.16 1.88 -1.57 0.00 0.00 179.24 179.56 2grm h TYR 153 N 0.15 0.62 0.13 4.55 -1.99 -1.18 -2.10 116.97 117.15 2grm h TYR 153 Ca 0.05 -0.11 -0.01 0.00 2.00 0.00 0.00 58.73 60.66 2grm h TYR 153 Cb 0.04 -0.16 0.00 0.00 2.00 0.00 0.00 36.73 38.61 2grm h TYR 153 CO -0.05 0.70 -0.06 1.49 -0.00 0.00 0.00 178.16 180.24 2grm h GLU 154 N 0.52 -0.17 -0.13 4.88 4.81 -0.92 -0.90 114.58 122.67 2grm h GLU 154 Ca 0.09 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.38 2grm h GLU 154 Cb 0.58 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.94 2grm h GLU 154 CO 0.04 -0.08 -0.23 0.82 -0.73 0.00 0.00 179.01 178.82 2grm h ILE 155 N -0.20 0.44 -0.00 2.32 2.04 -0.56 -1.64 117.51 119.91 2grm h ILE 155 Ca -0.02 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 2grm h ILE 155 Cb 0.16 0.44 -0.00 0.00 -0.74 0.00 0.00 36.82 36.68 2grm h ILE 155 CO 0.03 0.00 -0.10 0.58 0.00 0.00 0.00 178.15 178.66 2grm h VAL 156 N -0.29 1.07 -0.36 1.67 2.07 -1.29 -0.43 116.25 118.69 2grm h VAL 156 Ca 0.10 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.23 2grm h VAL 156 Cb 0.44 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 2grm h VAL 156 CO -0.30 0.10 0.03 0.28 0.02 0.00 0.00 177.57 177.70 2grm h SER 157 N 0.00 0.59 0.39 0.57 0.02 -0.21 -1.69 113.55 113.22 2grm h SER 157 Ca -0.00 -0.28 -0.14 0.00 -0.84 0.00 0.00 61.79 60.52 2grm h SER 157 Cb 0.18 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 2grm h SER 157 CO 0.01 0.73 -0.61 0.78 -1.14 0.00 0.00 176.83 176.60 2grm h ASN 158 N 0.43 0.25 -0.76 3.07 -0.26 -1.07 -3.12 115.58 114.12 2grm h ASN 158 Ca 0.11 -0.14 -0.04 0.00 -0.56 0.00 0.00 56.30 55.66 2grm h ASN 158 Cb 0.40 -0.07 -0.03 0.00 -1.06 0.00 0.00 38.32 37.56 2grm h ASN 158 CO 0.01 0.79 0.33 0.25 -1.06 0.00 0.00 177.43 177.75 2grm h LEU 159 N 0.16 1.04 -1.26 1.61 5.85 -0.90 -1.60 115.31 120.21 2grm h LEU 159 Ca -0.01 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.57 2grm h LEU 159 Cb 1.11 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.87 2grm h LEU 159 CO 0.09 0.91 0.00 -0.07 -0.34 0.00 0.00 178.44 179.03 2grm h LEU 160 N 1.11 0.00 0.00 2.25 3.38 -1.24 -2.07 115.31 118.74 2grm h LEU 160 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2grm h LEU 160 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2grm h LEU 160 CO -0.03 0.00 -1.20 -3.20 0.09 0.00 0.00 178.44 174.10 2grm n ASN 161 N -2.32 0.56 -0.24 -0.43 5.15 -0.61 -4.38 115.26 113.00 2grm n ASN 161 Ca -0.00 -0.21 0.05 0.00 -0.60 0.00 0.00 54.58 53.82 2grm n ASN 161 Cb 0.11 1.01 0.08 0.00 -0.53 0.00 0.00 39.78 40.45 2grm n ASN 161 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 2grm n VAL 162 N -2.03 1.06 -3.77 3.44 0.24 -0.84 -5.02 118.33 111.41 2grm n VAL 162 Ca 0.01 -1.27 -0.13 0.00 -2.04 0.00 0.00 64.34 60.92 2grm n VAL 162 Cb 0.46 0.11 -0.12 0.00 -1.47 0.00 0.00 33.84 32.82 2grm n VAL 162 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2grm s LEU 163 N -1.60 0.90 0.22 1.34 2.96 -0.86 -5.07 118.68 116.58 2grm s LEU 163 Ca 0.17 0.55 -0.32 0.00 -0.22 0.00 0.00 54.13 54.31 2grm s LEU 163 Cb 0.15 0.91 -0.12 0.00 0.50 0.00 0.00 46.19 47.63 2grm s LEU 163 CO 0.02 -0.10 1.62 -0.81 -1.32 0.00 0.00 176.35 175.76 2grm n PRO 164 N 3.08 2.54 -0.31 0.98 -0.04 -1.26 -4.72 135.00 135.27 2grm n PRO 164 Ca -0.14 0.91 0.27 0.00 -0.04 0.00 0.00 63.50 64.50 2grm n PRO 164 Cb 0.58 -2.70 0.50 0.00 -0.04 0.00 0.00 33.50 31.83 2grm n PRO 164 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 2grm n TYR 165 N 3.15 1.01 0.22 0.54 9.36 -1.26 -0.27 117.16 129.90 2grm n TYR 165 Ca 0.14 1.12 0.12 0.00 3.32 0.00 0.00 57.90 62.60 2grm n TYR 165 Cb 0.34 -1.46 0.71 0.00 -0.63 0.00 0.00 39.34 38.29 2grm n TYR 165 CO 0.00 0.00 0.00 1.49 0.22 0.00 0.00 176.86 178.57 2grm h GLU 166 N 0.00 0.00 0.01 2.98 4.57 -2.01 0.14 114.58 120.27 2grm h GLU 166 Ca 0.76 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 58.73 2grm h GLU 166 Cb 1.94 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 30.50 2grm h GLU 166 CO -0.76 0.00 -1.00 0.93 -1.18 0.00 0.00 179.01 177.00 2grm h GLU 167 N 0.00 0.01 0.00 1.92 5.08 -0.98 -3.31 114.58 117.30 2grm h GLU 167 Ca 0.05 -0.02 -0.20 0.00 -1.00 0.00 0.00 59.36 58.18 2grm h GLU 167 Cb 0.20 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 2grm h GLU 167 CO -0.00 1.00 -1.19 0.28 -1.00 0.00 0.00 179.01 178.10 2grm h VAL 168 N 0.00 1.04 -0.54 3.13 2.07 -1.12 -3.40 116.25 117.43 2grm h VAL 168 Ca -0.02 -2.68 0.05 0.00 0.82 0.00 0.00 66.70 64.87 2grm h VAL 168 Cb 1.76 2.47 -0.07 0.00 -1.52 0.00 0.00 31.29 33.93 2grm h VAL 168 CO 0.13 0.59 -0.33 -1.28 0.02 0.00 0.00 177.57 176.71 2grm h SER 169 N 0.00 -1.20 -0.44 0.57 0.87 -0.88 -1.39 113.55 111.08 2grm h SER 169 Ca -0.12 0.18 0.13 0.00 -1.23 0.00 0.00 61.79 60.75 2grm h SER 169 Cb 1.72 0.53 -0.02 0.00 -0.44 0.00 0.00 62.40 64.19 2grm h SER 169 CO 0.09 -0.13 0.38 0.77 -0.53 0.00 0.00 176.83 177.40 2grm h SER 170 N -0.01 0.00 0.52 6.23 4.64 -1.78 -1.91 113.55 121.24 2grm h SER 170 Ca 0.09 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.22 2grm h SER 170 Cb 0.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 2grm h SER 170 CO -0.51 0.00 -0.83 0.40 -0.87 0.00 0.00 176.83 175.02 2grm h ILE 171 N 0.00 1.47 0.11 0.95 1.08 -1.51 -3.36 117.51 116.24 2grm h ILE 171 Ca 0.21 -2.49 -0.01 0.00 -0.39 0.00 0.00 64.86 62.19 2grm h ILE 171 Cb 0.96 2.37 0.00 0.00 -3.07 0.00 0.00 36.82 37.09 2grm h ILE 171 CO -0.00 0.73 -0.05 0.40 -0.69 0.00 0.00 178.15 178.53 2grm h ILE 172 N 0.13 1.08 -0.98 -0.67 2.04 -1.10 -3.37 117.51 114.64 2grm h ILE 172 Ca -0.04 -1.25 0.31 0.00 1.00 0.00 0.00 64.86 64.88 2grm h ILE 172 Cb 1.44 1.80 -0.18 0.00 -0.74 0.00 0.00 36.82 39.14 2grm h ILE 172 CO 0.13 0.28 0.21 0.11 0.00 0.00 0.00 178.15 178.87 2grm h LYS 173 N -0.78 0.04 0.00 2.37 1.79 -1.67 0.85 116.57 119.17 2grm h LYS 173 Ca -0.01 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 2grm h LYS 173 Cb 0.56 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 2grm h LYS 173 CO 0.02 0.02 0.00 -0.35 -1.08 0.00 0.00 179.45 178.07 2grm n PRO 174 N -5.39 0.76 -0.02 3.15 -0.04 -1.26 -2.91 135.00 129.30 2grm n PRO 174 Ca 0.27 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.85 2grm n PRO 174 Cb 0.91 -1.33 0.10 0.00 -0.04 0.00 0.00 33.50 33.13 2grm n PRO 174 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2grm n MET 175 N -0.83 2.13 -4.11 0.54 2.81 0.29 -4.95 117.12 112.99 2grm n MET 175 Ca 0.12 -1.87 -0.08 0.00 -1.81 0.00 0.00 57.70 54.06 2grm n MET 175 Cb 0.06 -1.43 -0.10 0.00 -0.71 0.00 0.00 33.22 31.03 2grm n MET 175 CO 0.00 0.00 0.00 0.71 1.51 0.00 0.00 175.97 178.19 2grm s TYR 176 N -1.82 0.63 0.68 2.03 1.51 -1.15 -4.55 117.35 114.69 2grm s TYR 176 Ca 0.27 -1.01 -0.11 0.00 -1.01 0.00 0.00 57.07 55.20 2grm s TYR 176 Cb 0.19 -0.43 0.00 0.00 -0.11 0.00 0.00 41.96 41.62 2grm s TYR 176 CO 0.28 -0.31 1.06 -1.25 -1.11 0.00 0.00 175.55 174.22 2grm s PRO 177 N -3.85 2.97 0.20 -1.71 0.04 -1.26 -4.95 135.00 126.43 2grm s PRO 177 Ca 0.08 1.00 -0.18 0.00 0.04 0.00 0.00 61.00 61.94 2grm s PRO 177 Cb 0.07 -1.99 -0.08 0.00 0.04 0.00 0.00 34.50 32.54 2grm s PRO 177 CO -0.08 -1.08 0.67 0.42 0.04 0.00 0.00 177.00 176.97 2grm s ILE 178 N -2.96 4.66 -0.03 0.56 1.01 -1.26 -5.00 121.20 118.17 2grm s ILE 178 Ca 0.59 1.15 0.01 0.00 0.00 0.00 0.00 60.65 62.40 2grm s ILE 178 Cb -0.14 -3.82 -0.02 0.00 0.01 0.00 0.00 42.46 38.48 2grm s ILE 178 CO 0.53 0.23 0.04 1.33 0.00 0.00 0.00 174.94 177.07 2grm n VAL 179 N 0.78 0.00 -3.94 2.92 0.24 -1.26 -4.94 118.33 112.12 2grm n VAL 179 Ca -0.03 -0.21 -0.10 0.00 -2.04 0.00 0.00 64.34 61.96 2grm n VAL 179 Cb 0.51 0.68 -0.07 0.00 -1.47 0.00 0.00 33.84 33.50 2grm n VAL 179 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2grm s ASP 180 N -1.75 0.01 0.03 -1.34 1.01 -1.26 -4.93 116.67 108.44 2grm s ASP 180 Ca -0.00 -0.84 0.01 0.00 0.71 0.00 0.00 52.55 52.42 2grm s ASP 180 Cb 0.01 0.45 -0.04 0.00 1.01 0.00 0.00 42.92 44.35 2grm s ASP 180 CO 0.06 -0.91 0.10 -0.55 0.21 0.00 0.00 175.17 174.08 2grm s SER 181 N -2.96 5.76 -0.10 0.27 0.15 -1.26 -5.01 113.70 110.56 2grm s SER 181 Ca 0.17 0.13 0.24 0.00 0.70 0.00 0.00 55.95 57.18 2grm s SER 181 Cb 0.03 -1.65 0.45 0.00 -1.71 0.00 0.00 66.02 63.14 2grm s SER 181 CO 0.00 0.23 1.15 0.49 1.20 0.00 0.00 173.24 176.31 2grm n PHE 182 N 0.82 0.44 0.00 3.44 3.72 -1.26 -5.06 117.46 119.56 2grm n PHE 182 Ca -0.10 -1.08 0.00 0.00 -0.05 0.00 0.00 57.45 56.21 2grm n PHE 182 Cb 0.52 -0.18 0.00 0.00 -0.94 0.00 0.00 39.48 38.88 2grm n PHE 182 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2grm n GLY 183 N 0.06 3.38 0.37 1.37 0.00 -1.26 -4.54 105.19 104.57 2grm n GLY 183 Ca 0.08 -1.87 0.04 0.00 0.00 0.00 0.00 46.02 44.27 2grm n GLY 183 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2grm h LYS 184 N 0.00 1.03 -0.28 1.61 1.79 -1.97 0.28 116.57 119.04 2grm h LYS 184 Ca 0.00 -0.06 -0.03 0.00 -2.18 0.00 0.00 60.65 58.38 2grm h LYS 184 Cb 0.00 -0.23 -0.01 0.00 -1.58 0.00 0.00 32.23 30.41 2grm h LYS 184 CO 0.00 0.68 0.07 -0.44 -1.08 0.00 0.00 179.45 178.68 2grm h ASP 185 N 1.06 0.42 -0.33 0.86 3.32 -1.99 -0.49 116.42 119.27 2grm h ASP 185 Ca 0.40 -0.23 -0.04 0.00 0.02 0.00 0.00 57.03 57.18 2grm h ASP 185 Cb 0.20 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 2grm h ASP 185 CO -0.15 0.54 0.04 0.22 -1.72 0.00 0.00 179.24 178.16 2grm h TYR 186 N 0.28 0.60 0.00 4.55 5.03 -1.59 -1.49 116.97 124.35 2grm h TYR 186 Ca 0.09 -0.09 -0.02 0.00 2.58 0.00 0.00 58.73 61.29 2grm h TYR 186 Cb 0.28 -0.16 -0.00 0.00 1.55 0.00 0.00 36.73 38.40 2grm h TYR 186 CO 0.01 0.64 -0.07 -0.44 -1.32 0.00 0.00 178.16 176.98 2grm h ASP 187 N 0.38 0.00 0.06 -2.11 3.32 -0.23 -1.82 116.42 116.02 2grm h ASP 187 Ca 0.10 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.97 2grm h ASP 187 Cb 0.38 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.95 2grm h ASP 187 CO 0.01 0.07 -0.72 0.25 -1.72 0.00 0.00 179.24 177.13 2grm h LEU 188 N 0.00 0.53 -0.95 1.55 7.12 -0.64 -3.15 115.31 119.77 2grm h LEU 188 Ca -0.00 -0.84 -0.11 0.00 0.13 0.00 0.00 57.88 57.06 2grm h LEU 188 Cb 0.13 -0.17 -0.01 0.00 -0.53 0.00 0.00 40.66 40.08 2grm h LEU 188 CO 0.01 1.31 -0.51 0.71 -0.13 0.00 0.00 178.44 179.83 2grm h THR 189 N -0.19 1.37 0.00 1.05 1.35 -1.06 -2.24 112.91 113.19 2grm h THR 189 Ca -0.11 -1.75 -0.02 0.00 -0.55 0.00 0.00 66.41 63.98 2grm h THR 189 Cb 1.48 1.93 -0.00 0.00 -1.73 0.00 0.00 68.15 69.83 2grm h THR 189 CO 0.14 0.50 -0.10 0.16 -0.25 0.00 0.00 175.52 175.97 2grm h ILE 190 N 0.03 0.28 0.00 6.82 3.07 -1.41 -2.60 117.51 123.70 2grm h ILE 190 Ca -0.00 -0.73 -0.24 0.00 1.55 0.00 0.00 64.86 65.44 2grm h ILE 190 Cb 0.91 1.57 -0.04 0.00 -0.27 0.00 0.00 36.82 38.99 2grm h ILE 190 CO 0.07 0.10 -1.49 1.56 -1.05 0.00 0.00 178.15 177.33 2grm h GLN 191 N 0.00 0.00 -0.49 0.16 4.20 -1.42 -3.32 115.11 114.24 2grm h GLN 191 Ca -0.00 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.62 2grm h GLN 191 Cb 0.56 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.32 2grm h GLN 191 CO 0.01 0.51 -0.05 1.15 -0.67 0.00 0.00 178.83 179.78 2grm h THR 192 N 0.00 1.27 -0.36 -0.54 2.02 -1.04 0.42 112.91 114.68 2grm h THR 192 Ca -0.21 -1.16 0.03 0.00 0.77 0.00 0.00 66.41 65.84 2grm h THR 192 Cb 1.85 1.02 -0.03 0.00 -1.74 0.00 0.00 68.15 69.25 2grm h THR 192 CO 0.08 0.40 0.17 0.58 0.37 0.00 0.00 175.52 177.12 2grm h VAL 193 N 0.76 0.96 -0.38 3.16 2.07 -1.65 0.16 116.25 121.34 2grm h VAL 193 Ca 0.13 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.53 2grm h VAL 193 Cb 0.59 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 2grm h VAL 193 CO 0.04 0.06 0.22 -0.07 0.02 0.00 0.00 177.57 177.84 2grm h LEU 194 N 0.35 0.46 -0.68 2.57 3.38 -1.60 0.30 115.31 120.10 2grm h LEU 194 Ca 0.16 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.96 2grm h LEU 194 Cb 0.08 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2grm h LEU 194 CO -0.12 0.39 -0.05 0.50 0.09 0.00 0.00 178.44 179.26 2grm h LYS 195 N 0.49 0.97 -0.05 1.13 3.11 -0.52 0.69 116.57 122.38 2grm h LYS 195 Ca 0.13 -0.32 -0.23 0.00 -2.81 0.00 0.00 60.65 57.42 2grm h LYS 195 Cb 0.02 -0.08 0.01 0.00 -1.00 0.00 0.00 32.23 31.18 2grm h LYS 195 CO -0.02 0.99 -0.91 -0.91 -2.81 0.00 0.00 179.45 175.79 2grm h ASN 196 N 0.88 0.76 0.18 4.20 2.35 -0.57 -2.59 115.58 120.80 2grm h ASN 196 Ca 0.15 -0.56 -0.13 0.00 -0.55 0.00 0.00 56.30 55.20 2grm h ASN 196 Cb 0.58 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.72 2grm h ASN 196 CO 0.04 1.36 -0.49 0.00 -1.65 0.00 0.00 177.43 176.68 2grm h ALA 197 N 0.61 0.90 -0.16 -0.83 0.00 -0.85 -1.90 119.26 117.02 2grm h ALA 197 Ca -0.08 -0.48 -0.12 0.00 0.00 0.00 0.00 54.91 54.23 2grm h ALA 197 Cb 1.54 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 2grm h ALA 197 CO 0.17 0.66 -0.43 1.25 0.00 0.00 0.00 179.25 180.91 2grm h LEU 198 N 0.29 0.40 -0.08 0.00 5.85 -0.89 -1.03 115.31 119.86 2grm h LEU 198 Ca 0.01 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 2grm h LEU 198 Cb 0.98 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.89 2grm h LEU 198 CO 0.08 0.79 -0.00 0.74 -0.34 0.00 0.00 178.44 179.71 2grm h THR 199 N 0.31 1.26 -0.64 1.05 2.02 -1.22 -2.22 112.91 113.47 2grm h THR 199 Ca 0.03 -0.81 0.01 0.00 0.77 0.00 0.00 66.41 66.41 2grm h THR 199 Cb 0.89 1.64 -0.03 0.00 -1.74 0.00 0.00 68.15 68.90 2grm h THR 199 CO 0.07 0.23 0.42 0.40 0.37 0.00 0.00 175.52 177.01 2grm h ILE 200 N -0.15 1.14 0.03 3.11 1.08 -1.21 -0.65 117.51 120.86 2grm h ILE 200 Ca 0.02 -0.29 0.02 0.00 -0.39 0.00 0.00 64.86 64.22 2grm h ILE 200 Cb 0.36 0.23 -0.02 0.00 -3.07 0.00 0.00 36.82 34.31 2grm h ILE 200 CO 0.00 0.15 -0.12 0.28 -0.69 0.00 0.00 178.15 177.78 2grm h SER 201 N 0.84 -0.34 -0.78 1.72 0.02 -1.11 -1.68 113.55 112.22 2grm h SER 201 Ca 0.24 0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 61.24 2grm h SER 201 Cb -0.07 0.14 -0.04 0.00 0.14 0.00 0.00 62.40 62.58 2grm h SER 201 CO -0.07 -0.17 0.48 0.40 -1.14 0.00 0.00 176.83 176.33 2grm h ILE 202 N -0.22 1.22 0.00 3.27 1.08 -1.14 -0.39 117.51 121.34 2grm h ILE 202 Ca 0.03 -0.47 -0.01 0.00 -0.39 0.00 0.00 64.86 64.02 2grm h ILE 202 Cb 0.26 0.12 -0.00 0.00 -3.07 0.00 0.00 36.82 34.13 2grm h ILE 202 CO -0.10 0.22 -0.06 -0.03 -0.69 0.00 0.00 178.15 177.49 2grm h MET 203 N 1.07 0.00 -0.57 2.37 4.05 -0.81 -0.64 114.93 120.40 2grm h MET 203 Ca 0.28 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.70 2grm h MET 203 Cb -0.05 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.75 2grm h MET 203 CO -0.05 0.06 0.00 0.09 0.23 0.00 0.00 176.91 177.24 2grm n ASN 204 N -3.49 3.67 -0.32 1.39 5.03 -0.39 -4.92 115.26 116.24 2grm n ASN 204 Ca -0.02 -1.99 -0.04 0.00 0.87 0.00 0.00 54.58 53.41 2grm n ASN 204 Cb 0.19 -0.37 -0.02 0.00 -1.02 0.00 0.00 39.78 38.56 2grm n ASN 204 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.26 174.29 2grm n ARG 205 N 1.50 -1.87 -2.36 3.52 0.63 -0.25 -4.83 116.66 113.00 2grm n ARG 205 Ca 0.21 0.55 -0.36 0.00 -0.92 0.00 0.00 57.85 57.33 2grm n ARG 205 Cb 0.60 -4.75 -0.03 0.00 0.45 0.00 0.00 32.46 28.73 2grm n ARG 205 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 2grm s ASN 206 N -1.84 6.05 0.39 6.15 3.84 -0.29 -4.76 114.94 124.47 2grm s ASN 206 Ca 0.00 -2.02 0.14 0.00 0.21 0.00 0.00 52.86 51.20 2grm s ASN 206 Cb 0.00 -2.58 0.79 0.00 -0.55 0.00 0.00 41.25 38.91 2grm s ASN 206 CO 0.00 -2.00 1.85 -0.07 -2.79 0.00 0.00 177.10 174.09 2grm h LEU 207 N 14.80 0.00 -1.17 3.21 3.38 -1.88 -2.44 115.31 131.21 2grm h LEU 207 Ca 0.33 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.27 2grm h LEU 207 Cb 0.91 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.63 2grm h LEU 207 CO 1.36 0.34 0.22 0.50 0.09 0.00 0.00 178.44 180.95 2grm h LYS 208 N 0.00 0.80 0.06 1.13 3.64 -1.97 0.38 116.57 120.61 2grm h LYS 208 Ca -0.00 -0.12 -0.00 0.00 -1.27 0.00 0.00 60.65 59.25 2grm h LYS 208 Cb 0.63 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 2grm h LYS 208 CO 0.04 0.66 -0.03 0.93 -2.27 0.00 0.00 179.45 178.79 2grm h GLU 209 N 0.79 -0.07 -0.75 1.90 4.39 -1.94 -3.00 114.58 115.90 2grm h GLU 209 Ca 0.19 0.00 0.17 0.00 0.34 0.00 0.00 59.36 60.06 2grm h GLU 209 Cb 0.16 0.02 -0.12 0.00 -0.10 0.00 0.00 28.75 28.71 2grm h GLU 209 CO -0.02 0.54 0.10 0.00 -1.16 0.00 0.00 179.01 178.47 2grm h ALA 210 N -0.03 0.89 -0.73 3.43 0.00 -1.24 0.95 119.26 122.54 2grm h ALA 210 Ca -0.01 0.20 0.08 0.00 0.00 0.00 0.00 54.91 55.19 2grm h ALA 210 Cb 0.64 0.32 -0.07 0.00 0.00 0.00 0.00 17.79 18.69 2grm h ALA 210 CO 0.01 -0.39 0.40 0.37 0.00 0.00 0.00 179.25 179.63 2grm h GLN 211 N 0.18 0.67 -0.23 0.00 5.75 -0.97 -1.37 115.11 119.14 2grm h GLN 211 Ca 0.42 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.88 2grm h GLN 211 Cb 0.75 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 29.14 2grm h GLN 211 CO -0.59 0.44 0.13 -0.92 -2.65 0.00 0.00 178.83 175.24 2grm h TYR 212 N 0.69 0.31 -0.35 3.99 3.20 0.10 -1.41 116.97 123.51 2grm h TYR 212 Ca 0.35 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.14 2grm h TYR 212 Cb 0.30 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 2grm h TYR 212 CO -0.08 0.27 -0.08 1.88 -1.64 0.00 0.00 178.16 178.51 2grm h TYR 213 N 0.27 0.61 -0.11 -3.82 0.05 -0.88 -0.46 116.97 112.62 2grm h TYR 213 Ca 0.08 -0.09 -0.00 0.00 0.05 0.00 0.00 58.73 58.77 2grm h TYR 213 Cb 0.06 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 37.63 2grm h TYR 213 CO -0.04 0.64 0.05 0.82 -1.05 0.00 0.00 178.16 178.59 2grm h ILE 214 N 0.54 1.12 -0.92 -2.88 2.04 -0.82 -0.59 117.51 116.00 2grm h ILE 214 Ca 0.10 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.61 2grm h ILE 214 Cb 0.46 1.15 -0.04 0.00 -0.74 0.00 0.00 36.82 37.65 2grm h ILE 214 CO 0.02 0.11 0.58 0.78 0.00 0.00 0.00 178.15 179.65 2grm h ASN 215 N 0.05 1.07 -0.72 1.72 -0.26 -0.89 0.60 115.58 117.17 2grm h ASN 215 Ca 0.04 -0.04 -0.02 0.00 -0.56 0.00 0.00 56.30 55.72 2grm h ASN 215 Cb 0.13 -0.27 -0.03 0.00 -1.06 0.00 0.00 38.32 37.08 2grm h ASN 215 CO -0.00 0.80 0.37 1.56 -1.06 0.00 0.00 177.43 179.09 2grm h GLN 216 N 1.25 1.01 0.04 0.81 1.08 -0.69 0.05 115.11 118.67 2grm h GLN 216 Ca 0.33 -0.13 -0.00 0.00 -1.45 0.00 0.00 58.65 57.40 2grm h GLN 216 Cb -0.11 -0.19 0.00 0.00 -0.05 0.00 0.00 27.48 27.13 2grm h GLN 216 CO -0.07 0.78 -0.02 0.35 -0.95 0.00 0.00 178.83 178.92 2grm h PHE 217 N 0.99 -0.05 -0.95 2.96 3.57 -0.41 -2.77 116.94 120.28 2grm h PHE 217 Ca 0.25 -0.00 0.21 0.00 3.53 0.00 0.00 57.97 61.95 2grm h PHE 217 Cb 0.08 0.02 -0.08 0.00 2.79 0.00 0.00 35.95 38.75 2grm h PHE 217 CO 0.00 0.26 0.61 1.49 -2.23 0.00 0.00 178.31 178.45 2grm h GLU 218 N -0.37 0.50 -0.62 1.11 4.57 -0.67 0.12 114.58 119.22 2grm h GLU 218 Ca -0.01 -0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 58.09 2grm h GLU 218 Cb 0.34 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.79 2grm h GLU 218 CO 0.01 0.33 0.17 1.25 -1.18 0.00 0.00 179.01 179.58 2grm h HIS 219 N 0.51 0.98 -0.64 0.92 2.76 -0.74 -2.80 115.15 116.15 2grm h HIS 219 Ca 0.52 -0.09 0.13 0.00 -2.20 0.00 0.00 60.37 58.73 2grm h HIS 219 Cb 1.13 -0.29 -0.04 0.00 1.55 0.00 0.00 27.41 29.77 2grm h HIS 219 CO -0.00 0.80 0.44 -0.07 -1.30 0.00 0.00 177.93 177.80 2grm h LEU 220 N 0.92 0.27 -1.97 0.26 4.07 -0.49 0.67 115.31 119.03 2grm h LEU 220 Ca 0.20 0.01 -0.00 0.00 0.08 0.00 0.00 57.88 58.17 2grm h LEU 220 Cb 0.30 -0.04 -0.00 0.00 1.08 0.00 0.00 40.66 42.00 2grm h LEU 220 CO -0.00 0.15 -0.02 0.11 -1.08 0.00 0.00 178.44 177.60 2grm h LYS 221 N 0.29 0.00 -0.08 1.13 1.57 -1.50 -2.39 116.57 115.59 2grm h LYS 221 Ca 0.31 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.87 2grm h LYS 221 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.12 2grm h LYS 221 CO -0.07 0.02 -0.82 1.15 -0.57 0.00 0.00 179.45 179.15 2grm h THR 222 N 0.00 1.34 -2.82 -0.16 2.02 -0.97 -3.46 112.91 108.85 2grm h THR 222 Ca -0.00 -2.16 -0.52 0.00 0.77 0.00 0.00 66.41 64.50 2grm h THR 222 Cb 0.34 2.16 0.05 0.00 -1.74 0.00 0.00 68.15 68.96 2grm h THR 222 CO 0.00 0.66 0.90 -0.63 0.37 0.00 0.00 175.52 176.82 2grm s ILE 223 N -3.56 2.51 0.25 3.11 1.01 -0.90 -4.96 121.20 118.65 2grm s ILE 223 Ca -0.08 0.37 -0.30 0.00 0.00 0.00 0.00 60.65 60.64 2grm s ILE 223 Cb 0.09 -3.23 -0.09 0.00 0.01 0.00 0.00 42.46 39.23 2grm s ILE 223 CO 0.88 0.03 1.26 -0.75 0.00 0.00 0.00 174.94 176.36 2grm s LYS 224 N 1.07 4.43 -0.72 2.79 2.20 -1.26 -3.36 119.74 124.89 2grm s LYS 224 Ca 0.70 2.03 0.00 0.00 -0.36 0.00 0.00 55.97 58.35 2grm s LYS 224 Cb -0.45 -3.17 0.00 0.00 -1.51 0.00 0.00 37.83 32.71 2grm s LYS 224 CO 0.32 -0.14 0.00 0.09 -0.36 0.00 0.00 175.35 175.26 2grm n ASN 225 N 1.90 -4.35 -4.68 1.43 4.13 -1.26 -4.57 115.26 107.85 2grm n ASN 225 Ca 0.03 0.17 -0.39 0.00 1.68 0.00 0.00 54.58 56.07 2grm n ASN 225 Cb 0.43 -2.45 -0.06 0.00 -1.54 0.00 0.00 39.78 36.16 2grm n ASN 225 CO 0.00 0.00 0.00 -0.51 0.28 0.00 0.00 177.26 177.03 2grm s ILE 226 N -2.07 5.11 -0.61 2.41 2.07 -1.21 -4.90 121.20 122.00 2grm s ILE 226 Ca 0.00 1.02 -0.23 0.00 -1.41 0.00 0.00 60.65 60.02 2grm s ILE 226 Cb 0.00 -3.86 0.05 0.00 0.13 0.00 0.00 42.46 38.78 2grm s ILE 226 CO 0.00 0.21 0.97 -0.44 -1.91 0.00 0.00 174.94 173.77 2grm s SER 227 N 1.00 6.25 -0.23 4.50 0.01 -1.26 -5.00 113.70 118.96 2grm s SER 227 Ca 0.26 -0.67 -0.28 0.00 1.31 0.00 0.00 55.95 56.57 2grm s SER 227 Cb -0.16 -2.43 0.01 0.00 0.21 0.00 0.00 66.02 63.65 2grm s SER 227 CO 0.10 -1.36 0.99 -0.63 0.41 0.00 0.00 173.24 172.76 2grm s ILE 228 N 4.09 4.72 0.09 1.44 -1.09 -1.26 -4.69 121.20 124.49 2grm s ILE 228 Ca 0.26 1.93 -0.31 0.00 -2.23 0.00 0.00 60.65 60.31 2grm s ILE 228 Cb -0.14 -4.27 -0.09 0.00 -1.58 0.00 0.00 42.46 36.38 2grm s ILE 228 CO 0.14 -0.15 1.70 0.21 -1.23 0.00 0.00 174.94 175.61 2grm s ASN 229 N 1.23 6.55 0.04 3.58 3.84 -1.26 -4.94 114.94 123.97 2grm s ASN 229 Ca 0.42 2.56 -0.14 0.00 0.21 0.00 0.00 52.86 55.92 2grm s ASN 229 Cb -0.15 -2.56 -0.06 0.00 -0.55 0.00 0.00 41.25 37.92 2grm s ASN 229 CO 0.07 -0.92 1.22 1.23 -2.79 0.00 0.00 177.10 175.91 2grm h GLY 230 N 8.54 -1.07 -0.57 1.21 0.00 -1.98 -1.09 103.07 108.10 2grm h GLY 230 Ca -0.44 0.50 0.10 0.00 0.00 0.00 0.00 47.33 47.50 2grm h GLY 230 CO 0.93 -0.35 -0.40 0.00 0.00 0.00 0.00 176.54 176.73 2grm h TYR 232 N -0.16 -0.06 -0.12 0.00 0.99 -1.95 0.16 116.97 115.83 2grm h TYR 232 Ca 0.23 0.03 0.03 0.00 2.00 0.00 0.00 58.73 61.02 2grm h TYR 232 Cb 0.56 0.10 -0.00 0.00 1.00 0.00 0.00 36.73 38.38 2grm h TYR 232 CO -0.72 -0.11 0.11 0.22 -0.00 0.00 0.00 178.16 177.66 2grm h ASP 233 N 0.09 0.00 0.12 3.88 3.58 0.26 0.89 116.42 125.25 2grm h ASP 233 Ca 0.22 0.00 -0.23 0.00 0.42 0.00 0.00 57.03 57.45 2grm h ASP 233 Cb 0.33 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.39 2grm h ASP 233 CO -0.39 0.00 -1.09 0.25 -2.88 0.00 0.00 179.24 175.13 2grm h LEU 234 N 0.00 0.41 -0.64 2.28 5.85 0.32 -2.78 115.31 120.74 2grm h LEU 234 Ca 0.06 -0.89 -0.13 0.00 0.84 0.00 0.00 57.88 57.75 2grm h LEU 234 Cb 0.28 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 2grm h LEU 234 CO -0.00 1.50 -0.34 -0.08 -0.34 0.00 0.00 178.44 179.17 2grm h GLU 235 N -0.37 0.68 -0.22 1.25 4.81 0.00 -1.50 114.58 119.24 2grm h GLU 235 Ca -0.22 -0.32 -0.15 0.00 -0.13 0.00 0.00 59.36 58.54 2grm h GLU 235 Cb 1.68 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 31.04 2grm h GLU 235 CO 0.10 0.93 -0.48 0.82 -0.73 0.00 0.00 179.01 179.64 2grm h ILE 236 N 0.58 1.31 -0.22 2.32 2.04 0.65 -1.72 117.51 122.46 2grm h ILE 236 Ca 0.06 -1.69 -0.08 0.00 1.00 0.00 0.00 64.86 64.15 2grm h ILE 236 Cb 0.86 1.66 -0.01 0.00 -0.74 0.00 0.00 36.82 38.58 2grm h ILE 236 CO 0.07 0.53 -0.23 -1.13 0.00 0.00 0.00 178.15 177.39 2grm h ASN 237 N 0.45 0.41 -0.34 1.72 -0.73 -1.24 0.26 115.58 116.11 2grm h ASN 237 Ca 0.02 -0.13 -0.07 0.00 1.87 0.00 0.00 56.30 57.99 2grm h ASN 237 Cb 1.00 -0.11 -0.01 0.00 0.27 0.00 0.00 38.32 39.47 2grm h ASN 237 CO 0.09 0.64 -0.07 0.22 -0.37 0.00 0.00 177.43 177.94 2grm h TYR 238 N 0.37 0.73 -0.18 0.67 5.03 -0.88 -1.98 116.97 120.72 2grm h TYR 238 Ca 0.06 -0.15 -0.02 0.00 2.58 0.00 0.00 58.73 61.19 2grm h TYR 238 Cb 0.61 -0.18 -0.01 0.00 1.55 0.00 0.00 36.73 38.70 2grm h TYR 238 CO 0.02 0.81 0.02 -0.07 -1.32 0.00 0.00 178.16 177.61 2grm h LEU 239 N 0.43 0.23 -0.63 2.82 3.38 -0.80 -0.68 115.31 120.06 2grm h LEU 239 Ca 0.09 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 2grm h LEU 239 Cb 0.57 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 2grm h LEU 239 CO 0.03 0.27 0.30 0.11 0.09 0.00 0.00 178.44 179.24 2grm h LYS 240 N 0.26 0.91 0.48 1.13 1.57 -0.33 -0.43 116.57 120.15 2grm h LYS 240 Ca 0.06 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 2grm h LYS 240 Cb 0.15 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.30 2grm h LYS 240 CO 0.00 0.73 -0.23 1.96 -0.57 0.00 0.00 179.45 181.34 2grm h GLN 241 N 0.87 -0.62 -0.11 3.15 1.08 -0.44 -1.13 115.11 117.91 2grm h GLN 241 Ca 0.22 0.04 0.03 0.00 -1.45 0.00 0.00 58.65 57.49 2grm h GLN 241 Cb 0.12 0.14 -0.00 0.00 -0.05 0.00 0.00 27.48 27.69 2grm h GLN 241 CO -0.03 -0.40 0.09 0.82 -0.95 0.00 0.00 178.83 178.37 2grm h ILE 242 N -0.66 0.72 -0.14 2.54 2.04 -1.27 -0.95 117.51 119.78 2grm h ILE 242 Ca -0.07 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.77 2grm h ILE 242 Cb 0.50 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 2grm h ILE 242 CO 0.11 0.00 0.01 0.22 0.00 0.00 0.00 178.15 178.49 2grm h TYR 243 N 0.00 0.26 0.00 1.37 3.20 -0.18 -1.06 116.97 120.56 2grm h TYR 243 Ca 0.05 -0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.84 2grm h TYR 243 Cb 0.24 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.43 2grm h TYR 243 CO 0.00 0.45 -0.18 1.96 -1.64 0.00 0.00 178.16 178.75 2grm h GLN 244 N -0.00 0.00 -0.15 1.82 4.20 -0.03 -1.64 115.11 119.30 2grm h GLN 244 Ca 0.04 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.65 2grm h GLN 244 Cb 0.34 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.12 2grm h GLN 244 CO 0.01 0.18 -0.30 0.35 -0.67 0.00 0.00 178.83 178.39 2grm h PHE 245 N 0.00 0.60 -0.02 2.96 3.57 -0.86 -1.55 116.94 121.64 2grm h PHE 245 Ca -0.00 -0.22 -0.06 0.00 3.53 0.00 0.00 57.97 61.22 2grm h PHE 245 Cb 0.33 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 2grm h PHE 245 CO 0.00 0.93 -0.27 -0.07 -2.23 0.00 0.00 178.31 176.67 2grm h LEU 246 N 0.10 0.03 0.19 0.59 3.38 -0.89 0.16 115.31 118.87 2grm h LEU 246 Ca 0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2grm h LEU 246 Cb 0.90 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.64 2grm h LEU 246 CO 0.07 0.30 -0.09 0.74 0.09 0.00 0.00 178.44 179.55 2grm h THR 247 N 0.03 0.00 -0.37 0.22 2.02 -1.17 -3.39 112.91 110.25 2grm h THR 247 Ca 0.00 -0.43 -0.05 0.00 0.77 0.00 0.00 66.41 66.70 2grm h THR 247 Cb 0.49 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.87 2grm h THR 247 CO 0.04 0.00 0.03 0.47 0.37 0.00 0.00 175.52 176.42 2grm n ASP 248 N -3.87 4.03 -2.78 4.18 8.00 -0.60 -4.95 116.55 120.55 2grm n ASP 248 Ca -0.03 -3.14 -0.07 0.00 0.71 0.00 0.00 54.79 52.26 2grm n ASP 248 Cb 0.10 -0.60 -0.01 0.00 -0.02 0.00 0.00 41.12 40.59 2grm n ASP 248 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2grm n LYS 249 N -0.43 -2.62 -2.39 -1.24 4.76 0.54 -4.84 118.16 111.94 2grm n LYS 249 Ca 0.26 0.02 -0.42 0.00 -2.87 0.00 0.00 58.31 55.31 2grm n LYS 249 Cb 1.02 -4.47 -0.03 0.00 -1.84 0.00 0.00 35.03 29.71 2grm n LYS 249 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2grm s ASN 250 N -2.16 7.07 0.16 4.39 3.84 -1.25 -4.95 114.94 122.04 2grm s ASN 250 Ca 0.13 2.10 0.00 0.00 0.21 0.00 0.00 52.86 55.30 2grm s ASN 250 Cb -0.07 -2.59 -0.01 0.00 -0.55 0.00 0.00 41.25 38.02 2grm s ASN 250 CO 0.16 -0.44 1.37 -0.29 -2.79 0.00 0.00 177.10 175.10 2grm h ILE 251 N 4.24 1.45 -0.31 -5.21 2.10 -1.95 -3.24 117.51 114.59 2grm h ILE 251 Ca -0.43 -2.50 0.06 0.00 1.08 0.00 0.00 64.86 63.08 2grm h ILE 251 Cb 1.21 2.40 -0.06 0.00 -1.09 0.00 0.00 36.82 39.28 2grm h ILE 251 CO 0.79 0.73 -0.05 0.44 -1.08 0.00 0.00 178.15 178.98 2grm h ASP 252 N 0.16 -0.24 -0.89 2.19 3.45 -1.99 -0.28 116.42 118.82 2grm h ASP 252 Ca -0.05 0.09 0.10 0.00 0.43 0.00 0.00 57.03 57.60 2grm h ASP 252 Cb 1.49 0.17 -0.08 0.00 -0.56 0.00 0.00 39.33 40.35 2grm h ASP 252 CO 0.14 -0.08 0.52 0.28 -1.57 0.00 0.00 179.24 178.53 2grm h SER 253 N 0.03 0.76 -0.46 6.45 0.02 -1.89 0.27 113.55 118.71 2grm h SER 253 Ca 0.15 0.05 -0.04 0.00 -0.84 0.00 0.00 61.79 61.11 2grm h SER 253 Cb 0.22 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.65 2grm h SER 253 CO -0.30 0.42 0.12 0.22 -1.14 0.00 0.00 176.83 176.14 2grm h TYR 254 N 0.86 0.78 -0.06 3.45 5.03 -1.33 -1.64 116.97 124.05 2grm h TYR 254 Ca 0.43 -0.09 0.00 0.00 2.58 0.00 0.00 58.73 61.65 2grm h TYR 254 Cb 0.41 -0.22 -0.01 0.00 1.55 0.00 0.00 36.73 38.46 2grm h TYR 254 CO -0.04 0.71 0.03 -0.07 -1.32 0.00 0.00 178.16 177.46 2grm h LEU 255 N 0.62 0.04 -0.67 2.82 3.38 0.55 -1.56 115.31 120.50 2grm h LEU 255 Ca 0.15 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.24 2grm h LEU 255 Cb 0.32 -0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.98 2grm h LEU 255 CO 0.00 0.03 0.25 0.78 0.09 0.00 0.00 178.44 179.59 2grm h ASN 256 N 0.06 0.22 -0.53 -0.43 -0.26 -0.86 0.35 115.58 114.13 2grm h ASN 256 Ca 0.02 0.10 0.05 0.00 -0.56 0.00 0.00 56.30 55.91 2grm h ASN 256 Cb 0.01 0.08 -0.05 0.00 -1.06 0.00 0.00 38.32 37.30 2grm h ASN 256 CO -0.02 0.11 0.27 0.00 -1.06 0.00 0.00 177.43 176.73 2grm h ALA 257 N 1.48 0.68 -0.63 -0.83 0.00 -0.84 0.28 119.26 119.40 2grm h ALA 257 Ca 0.35 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.21 2grm h ALA 257 Cb 0.49 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2grm h ALA 257 CO -0.36 -0.08 0.07 0.28 0.00 0.00 0.00 179.25 179.16 2grm h VAL 258 N 0.52 1.26 -0.53 0.00 2.07 -0.10 -1.75 116.25 117.71 2grm h VAL 258 Ca 0.24 -1.06 -0.05 0.00 0.82 0.00 0.00 66.70 66.65 2grm h VAL 258 Cb 0.15 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 2grm h VAL 258 CO -0.17 0.39 0.14 -1.13 0.02 0.00 0.00 177.57 176.83 2grm h ASN 259 N 0.98 0.80 0.24 0.57 -0.00 0.47 -1.40 115.58 117.24 2grm h ASN 259 Ca 0.19 -0.22 -0.01 0.00 -0.00 0.00 0.00 56.30 56.26 2grm h ASN 259 Cb 0.47 -0.21 -0.01 0.00 -0.00 0.00 0.00 38.32 38.57 2grm h ASN 259 CO 0.02 0.81 -0.16 0.40 -0.00 0.00 0.00 177.43 178.50 2grm h ILE 260 N 0.74 0.66 -1.04 2.57 1.08 -0.16 -0.97 117.51 120.40 2grm h ILE 260 Ca 0.17 0.00 0.27 0.00 -0.39 0.00 0.00 64.86 64.91 2grm h ILE 260 Cb 0.32 0.66 -0.11 0.00 -3.07 0.00 0.00 36.82 34.62 2grm h ILE 260 CO -0.00 0.00 0.64 0.40 -0.69 0.00 0.00 178.15 178.50 2grm h ILE 261 N -0.39 0.48 -0.12 -0.67 2.04 -1.08 0.73 117.51 118.50 2grm h ILE 261 Ca -0.02 -0.16 -0.00 0.00 1.00 0.00 0.00 64.86 65.68 2grm h ILE 261 Cb 0.33 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 2grm h ILE 261 CO 0.02 0.08 0.06 -1.13 0.00 0.00 0.00 178.15 177.18 2grm h ASN 262 N 0.45 0.15 -0.93 1.72 -1.24 -0.08 -2.91 115.58 112.75 2grm h ASN 262 Ca 0.64 -0.10 0.17 0.00 0.71 0.00 0.00 56.30 57.72 2grm h ASN 262 Cb 1.46 -0.04 -0.08 0.00 0.73 0.00 0.00 38.32 40.39 2grm h ASN 262 CO -0.41 0.21 0.60 0.40 -1.29 0.00 0.00 177.43 176.93 2grm h ILE 263 N 0.08 0.76 -0.11 2.57 1.08 -0.01 0.25 117.51 122.13 2grm h ILE 263 Ca 0.04 -0.22 -0.02 0.00 -0.39 0.00 0.00 64.86 64.27 2grm h ILE 263 Cb 0.10 0.06 -0.01 0.00 -3.07 0.00 0.00 36.82 33.90 2grm h ILE 263 CO -0.01 0.12 -0.02 -0.26 -0.69 0.00 0.00 178.15 177.29 2grm h PHE 264 N 0.64 0.15 -0.04 1.37 0.04 -1.27 -0.66 116.94 117.17 2grm h PHE 264 Ca 0.49 -0.00 -0.07 0.00 2.80 0.00 0.00 57.97 61.18 2grm h PHE 264 Cb 0.89 -0.05 0.00 0.00 2.20 0.00 0.00 35.95 38.99 2grm h PHE 264 CO -0.00 0.19 -0.25 -0.22 -0.60 0.00 0.00 178.31 177.42 2grm h LYS 265 N 0.15 0.24 -0.96 1.51 3.64 -0.56 0.37 116.57 120.96 2grm h LYS 265 Ca 0.04 -0.21 0.09 0.00 -1.27 0.00 0.00 60.65 59.30 2grm h LYS 265 Cb 0.15 0.05 -0.08 0.00 -0.41 0.00 0.00 32.23 31.94 2grm h LYS 265 CO 0.00 0.87 0.60 0.82 -2.27 0.00 0.00 179.45 179.48 2grm h ILE 266 N -0.32 0.98 -0.05 2.00 1.08 -0.75 -2.23 117.51 118.23 2grm h ILE 266 Ca -0.02 -0.35 0.00 0.00 -0.39 0.00 0.00 64.86 64.10 2grm h ILE 266 Cb 0.93 -0.12 0.00 0.00 -3.07 0.00 0.00 36.82 34.56 2grm h ILE 266 CO 0.05 0.19 0.00 2.30 -0.69 0.00 0.00 178.15 180.00 2grm n ILE 267 N -4.61 0.05 -0.17 -0.67 -5.35 -0.31 -4.95 119.36 103.35 2grm n ILE 267 Ca 0.16 -0.24 0.00 0.00 -0.27 0.00 0.00 62.75 62.40 2grm n ILE 267 Cb 0.27 0.37 0.00 0.00 -1.74 0.00 0.00 39.64 38.54 2grm n ILE 267 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2grm n GLY 268 N 1.14 0.61 3.48 3.28 0.00 -0.84 -5.00 105.19 107.86 2grm n GLY 268 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 2grm n GLY 268 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2grm n LYS 269 N -2.00 2.39 0.05 1.61 4.76 0.11 -4.82 118.16 120.25 2grm n LYS 269 Ca 0.00 -2.79 -0.11 0.00 -2.87 0.00 0.00 58.31 52.54 2grm n LYS 269 Cb 0.00 -3.54 -0.07 0.00 -1.84 0.00 0.00 35.03 29.59 2grm n LYS 269 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 2grm h GLU 270 N 8.36 -0.44 -0.53 1.97 4.39 -1.92 -1.50 114.58 124.90 2grm h GLU 270 Ca 0.36 0.03 0.03 0.00 0.34 0.00 0.00 59.36 60.12 2grm h GLU 270 Cb 0.87 0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 29.58 2grm h GLU 270 CO 1.43 -0.30 0.31 -0.44 -1.16 0.00 0.00 179.01 178.86 2grm h ASP 271 N -0.46 0.50 -0.98 1.42 3.32 -1.96 -1.23 116.42 117.02 2grm h ASP 271 Ca 0.00 0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.10 2grm h ASP 271 Cb 0.48 -0.10 -0.06 0.00 0.22 0.00 0.00 39.33 39.88 2grm h ASP 271 CO -0.23 0.35 0.64 0.40 -1.72 0.00 0.00 179.24 178.69 2grm h ILE 272 N 0.62 1.15 0.33 0.35 1.08 -1.93 0.40 117.51 119.51 2grm h ILE 272 Ca 0.22 -0.42 -0.02 0.00 -0.39 0.00 0.00 64.86 64.25 2grm h ILE 272 Cb 0.04 -0.18 0.00 0.00 -3.07 0.00 0.00 36.82 33.61 2grm h ILE 272 CO -0.10 0.22 -0.16 -0.74 -0.69 0.00 0.00 178.15 176.68 2grm h HIS 273 N 1.23 -0.41 -0.51 1.37 2.76 -0.64 -0.03 115.15 118.91 2grm h HIS 273 Ca 0.40 -0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.66 2grm h HIS 273 Cb 0.04 0.14 -0.09 0.00 1.55 0.00 0.00 27.41 29.04 2grm h HIS 273 CO -0.00 -0.13 -0.08 -0.09 -1.30 0.00 0.00 177.93 176.33 2grm h ARG 274 N -0.66 0.04 0.47 5.26 2.43 -0.80 -0.41 114.38 120.70 2grm h ARG 274 Ca -0.05 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 2grm h ARG 274 Cb 0.47 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.99 2grm h ARG 274 CO 0.07 0.03 -0.45 1.03 -1.51 0.00 0.00 179.97 179.14 2grm h SER 275 N 0.04 -1.21 0.59 -3.80 0.87 0.06 -2.53 113.55 107.57 2grm h SER 275 Ca 0.25 0.10 -0.00 0.00 -1.23 0.00 0.00 61.79 60.91 2grm h SER 275 Cb 0.39 0.40 -0.00 0.00 -0.44 0.00 0.00 62.40 62.74 2grm h SER 275 CO -0.49 -0.61 -0.02 -0.07 -0.53 0.00 0.00 176.83 175.11 2grm h LEU 276 N -0.92 0.00 0.14 2.23 3.38 -0.59 -1.76 115.31 117.79 2grm h LEU 276 Ca -0.05 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2grm h LEU 276 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2grm h LEU 276 CO -0.05 0.02 -0.07 0.58 0.09 0.00 0.00 178.44 179.01 2grm h VAL 277 N 0.00 0.88 -0.10 1.22 2.07 -0.85 -1.49 116.25 117.98 2grm h VAL 277 Ca -0.00 -1.21 0.03 0.00 0.82 0.00 0.00 66.70 66.34 2grm h VAL 277 Cb 0.32 1.50 -0.00 0.00 -1.52 0.00 0.00 31.29 31.58 2grm h VAL 277 CO 0.00 0.24 0.14 -0.33 0.02 0.00 0.00 177.57 177.64 2grm h GLU 278 N -0.87 0.00 0.02 1.57 5.08 -1.30 0.37 114.58 119.46 2grm h GLU 278 Ca -0.02 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 2grm h GLU 278 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2grm h GLU 278 CO 0.03 0.00 -0.12 1.49 -1.00 0.00 0.00 179.01 179.41 2grm h GLU 279 N 0.00 0.05 0.00 2.33 4.81 -1.26 -2.99 114.58 117.51 2grm h GLU 279 Ca 0.05 -0.08 -0.04 0.00 -0.13 0.00 0.00 59.36 59.16 2grm h GLU 279 Cb 0.33 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 2grm h GLU 279 CO -0.00 1.03 -0.20 1.25 -0.73 0.00 0.00 179.01 180.37 2grm h LEU 280 N -0.90 0.00 0.59 1.64 5.85 -0.50 -1.52 115.31 120.47 2grm h LEU 280 Ca -0.02 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 2grm h LEU 280 Cb 1.09 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.13 2grm h LEU 280 CO 0.02 0.20 -0.28 0.74 -0.34 0.00 0.00 178.44 178.78 2grm h THR 281 N 0.00 0.33 -0.23 1.05 2.02 -1.01 -1.40 112.91 113.67 2grm h THR 281 Ca -0.00 -0.27 0.05 0.00 0.77 0.00 0.00 66.41 66.95 2grm h THR 281 Cb 0.39 0.42 -0.04 0.00 -1.74 0.00 0.00 68.15 67.18 2grm h THR 281 CO 0.03 0.03 -0.06 0.11 0.37 0.00 0.00 175.52 176.00 2grm h LYS 282 N -0.99 -0.01 -0.42 6.66 1.57 -1.32 0.30 116.57 122.36 2grm h LYS 282 Ca -0.08 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 2grm h LYS 282 Cb 0.66 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.95 2grm h LYS 282 CO 0.13 -0.00 0.22 0.97 -0.57 0.00 0.00 179.45 180.20 2grm h ILE 283 N -0.01 1.13 -0.15 1.86 -0.00 -1.33 -1.62 117.51 117.40 2grm h ILE 283 Ca 0.11 -0.35 -0.18 0.00 -0.00 0.00 0.00 64.86 64.44 2grm h ILE 283 Cb 0.17 0.58 -0.00 0.00 -0.00 0.00 0.00 36.82 37.57 2grm h ILE 283 CO -0.24 0.15 -0.65 0.28 -0.00 0.00 0.00 178.15 177.69 2grm h SER 284 N 0.58 0.65 0.81 2.19 0.02 -0.07 -2.90 113.55 114.83 2grm h SER 284 Ca 0.15 -0.39 -0.04 0.00 -0.84 0.00 0.00 61.79 60.67 2grm h SER 284 Cb 0.03 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.38 2grm h SER 284 CO -0.02 1.13 -0.48 0.00 -1.14 0.00 0.00 176.83 176.32 2grm h ALA 285 N 0.87 -1.24 0.00 3.77 0.00 -0.15 -0.09 119.26 122.42 2grm h ALA 285 Ca -0.02 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2grm h ALA 285 Cb 1.23 0.58 0.00 0.00 0.00 0.00 0.00 17.79 19.59 2grm h ALA 285 CO 0.12 -1.21 0.16 1.63 0.00 0.00 0.00 179.25 179.95 2grm n LYS 286 N -5.62 0.02 -0.12 0.00 5.02 -0.69 -0.21 118.16 116.57 2grm n LYS 286 Ca -0.15 0.41 0.07 0.00 -2.02 0.00 0.00 58.31 56.62 2grm n LYS 286 Cb 0.50 -1.73 0.13 0.00 -0.02 0.00 0.00 35.03 33.91 2grm n LYS 286 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2grm n GLU 287 N -1.52 1.93 -3.11 1.97 -0.58 -0.18 -4.98 120.64 114.17 2grm n GLU 287 Ca -0.00 -1.77 -0.14 0.00 -0.42 0.00 0.00 57.16 54.82 2grm n GLU 287 Cb 0.16 -1.30 0.06 0.00 -0.57 0.00 0.00 31.44 29.79 2grm n GLU 287 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2grm n LYS 288 N 0.76 -5.07 -4.28 3.49 4.76 0.71 -5.04 118.16 113.49 2grm n LYS 288 Ca 0.11 0.60 -0.15 0.00 -2.87 0.00 0.00 58.31 56.00 2grm n LYS 288 Cb 0.41 -4.90 -0.10 0.00 -1.84 0.00 0.00 35.03 28.59 2grm n LYS 288 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2grm s PHE 289 N -3.25 1.36 -0.28 2.13 0.40 -0.40 -5.04 117.98 112.91 2grm s PHE 289 Ca 0.15 -0.92 -0.00 0.00 -0.60 0.00 0.00 56.93 55.56 2grm s PHE 289 Cb -0.07 -0.77 0.08 0.00 0.51 0.00 0.00 43.02 42.78 2grm s PHE 289 CO 0.52 -0.08 0.05 0.99 0.70 0.00 0.00 175.22 177.40 2grm s THR 290 N -3.49 1.14 0.93 0.64 2.01 -1.26 -4.19 115.64 111.42 2grm s THR 290 Ca 0.24 -1.33 -0.13 0.00 0.31 0.00 0.00 61.69 60.78 2grm s THR 290 Cb 0.05 -1.71 0.04 0.00 0.01 0.00 0.00 72.50 70.89 2grm s THR 290 CO 0.05 -0.46 0.48 -0.81 -0.69 0.00 0.00 174.62 173.19 2grm n PRO 291 N 4.77 -0.26 -0.86 4.92 -0.04 -1.26 -4.91 135.00 137.36 2grm n PRO 291 Ca -0.05 -0.03 -0.34 0.00 -0.04 0.00 0.00 63.50 63.04 2grm n PRO 291 Cb 0.43 -1.90 0.10 0.00 -0.04 0.00 0.00 33.50 32.09 2grm n PRO 291 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2grm n PRO 292 N -1.84 -0.40 -0.09 0.54 -0.02 -1.26 -4.53 135.00 127.39 2grm n PRO 292 Ca 0.07 -0.09 0.08 0.00 -2.02 0.00 0.00 63.50 61.54 2grm n PRO 292 Cb 0.53 -1.48 0.44 0.00 -0.02 0.00 0.00 33.50 32.97 2grm n PRO 292 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2grm h LYS 293 N -1.42 0.54 0.09 -0.52 2.10 -1.97 -2.11 116.57 113.27 2grm h LYS 293 Ca -0.45 -0.03 -0.00 0.00 -2.00 0.00 0.00 60.65 58.16 2grm h LYS 293 Cb 1.31 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 2grm h LYS 293 CO 0.30 0.36 -0.04 1.05 -2.00 0.00 0.00 179.45 179.12 2grm h GLU 294 N 0.55 -0.11 -0.43 0.07 9.09 -1.97 0.20 114.58 121.98 2grm h GLU 294 Ca 0.26 0.01 0.09 0.00 0.05 0.00 0.00 59.36 59.76 2grm h GLU 294 Cb 0.31 0.03 -0.09 0.00 -1.65 0.00 0.00 28.75 27.34 2grm h GLU 294 CO -0.08 0.43 -0.23 0.28 0.05 0.00 0.00 179.01 179.46 2grm h VAL 295 N -0.80 0.35 0.00 -1.06 2.07 -1.88 0.79 116.25 115.72 2grm h VAL 295 Ca -0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.51 2grm h VAL 295 Cb 0.59 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 2grm h VAL 295 CO 0.02 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.61 2grm h THR 296 N -0.15 0.00 0.18 2.57 1.03 -1.45 -2.47 112.91 112.62 2grm h THR 296 Ca 0.20 -0.35 -0.32 0.00 -0.01 0.00 0.00 66.41 65.93 2grm h THR 296 Cb 0.47 1.29 0.03 0.00 -1.07 0.00 0.00 68.15 68.87 2grm h THR 296 CO -0.52 0.00 -1.36 -0.03 -0.01 0.00 0.00 175.52 173.60 2grm h MET 297 N 0.00 0.58 -0.27 0.00 -1.53 0.26 -3.32 114.93 110.64 2grm h MET 297 Ca 0.00 -0.87 -0.05 0.00 -3.44 0.00 0.00 59.70 55.34 2grm h MET 297 Cb 0.38 0.31 -0.01 0.00 -0.55 0.00 0.00 31.60 31.72 2grm h MET 297 CO 0.00 1.41 -0.01 1.88 0.14 0.00 0.00 176.91 180.33 2grm h TYR 298 N 0.21 0.53 0.00 1.39 0.99 -0.19 -3.17 116.97 116.74 2grm h TYR 298 Ca -0.22 -0.10 0.00 0.00 2.00 0.00 0.00 58.73 60.42 2grm h TYR 298 Cb 2.04 -0.14 0.00 0.00 1.00 0.00 0.00 36.73 39.63 2grm h TYR 298 CO 0.12 0.65 0.00 0.98 -0.00 0.00 0.00 178.16 179.91 2grm n TYR 299 N -4.59 0.00 -0.27 4.88 9.36 -0.96 0.41 117.16 125.99 2grm n TYR 299 Ca -0.03 0.00 0.16 0.00 3.32 0.00 0.00 57.90 61.35 2grm n TYR 299 Cb 0.26 -0.38 0.44 0.00 -0.63 0.00 0.00 39.34 39.03 2grm n TYR 299 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 2grm h GLU 300 N 0.00 0.54 -0.55 2.98 3.07 -1.69 0.43 114.58 119.36 2grm h GLU 300 Ca 0.00 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 58.82 2grm h GLU 300 Cb 0.00 -0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 27.76 2grm h GLU 300 CO 0.00 0.36 0.31 -0.97 -1.40 0.00 0.00 179.01 177.30 2grm h ASN 301 N 0.55 0.68 0.19 1.42 -0.73 -0.89 -3.23 115.58 113.57 2grm h ASN 301 Ca 0.49 -0.09 -0.01 0.00 1.87 0.00 0.00 56.30 58.56 2grm h ASN 301 Cb 1.00 -0.17 0.00 0.00 0.27 0.00 0.00 38.32 39.42 2grm h ASN 301 CO -0.23 0.57 -0.09 1.88 -0.37 0.00 0.00 177.43 179.20 2grm h TYR 302 N 0.74 -0.23 -0.20 0.67 0.05 0.26 -3.27 116.97 114.98 2grm h TYR 302 Ca 0.20 -0.01 -0.17 0.00 0.05 0.00 0.00 58.73 58.80 2grm h TYR 302 Cb 0.04 0.08 -0.00 0.00 1.01 0.00 0.00 36.73 37.85 2grm h TYR 302 CO -0.02 -0.14 0.52 0.28 -1.05 0.00 0.00 178.16 177.75 2grm n VAL 303 N -3.35 0.70 0.00 -2.88 0.31 0.13 -0.70 118.33 112.53 2grm n VAL 303 Ca -0.03 -0.72 0.00 0.00 -0.01 0.00 0.00 64.34 63.58 2grm n VAL 303 Cb 0.10 -2.07 0.00 0.00 -0.91 0.00 0.00 33.84 30.96 2grm n VAL 303 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2grm n ALA 304 N 17.16 0.00 -0.85 3.52 0.00 -1.25 -4.68 120.51 134.41 2grm n ALA 304 Ca 0.43 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.95 2grm n ALA 304 Cb 0.46 0.00 0.37 0.00 0.00 0.00 0.00 19.45 20.28 2grm n ALA 304 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2grm n ILE 305 N 0.00 2.46 0.02 0.00 -5.35 0.12 -4.61 119.36 112.00 2grm n ILE 305 Ca 0.00 -1.44 0.00 0.00 -0.27 0.00 0.00 62.75 61.04 2grm n ILE 305 Cb 0.00 -0.17 0.00 0.00 -1.74 0.00 0.00 39.64 37.73 2grm n ILE 305 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 2grm n GLU 306 N 0.54 0.00 0.00 6.28 2.13 -0.08 -5.02 120.64 124.50 2grm n GLU 306 Ca 0.26 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.08 2grm n GLU 306 Cb 1.07 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.78 2grm n GLU 306 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2grm n ASN 307 N -2.62 0.00 -3.57 4.31 3.02 -1.25 -4.44 115.26 110.70 2grm n ASN 307 Ca 0.00 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.26 2grm n ASN 307 Cb 0.00 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.04 2grm n ASN 307 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2grm s ASN 308 N 0.00 3.37 0.57 6.41 3.84 -1.26 -4.97 114.94 122.90 2grm s ASN 308 Ca 0.00 -2.10 -0.14 0.00 0.21 0.00 0.00 52.86 50.83 2grm s ASN 308 Cb 0.00 -0.62 -0.06 0.00 -0.55 0.00 0.00 41.25 40.02 2grm s ASN 308 CO 0.00 -0.33 1.01 -2.16 -2.79 0.00 0.00 177.10 172.83 2grm s PRO 309 N 1.10 3.72 -0.05 0.43 0.04 -1.26 -5.05 135.00 133.92 2grm s PRO 309 Ca 0.16 0.88 -0.22 0.00 0.04 0.00 0.00 61.00 61.86 2grm s PRO 309 Cb -0.22 -2.10 -0.04 0.00 0.04 0.00 0.00 34.50 32.18 2grm s PRO 309 CO -0.08 -0.46 0.63 0.42 0.04 0.00 0.00 177.00 177.55 2grm s ILE 310 N -2.86 5.02 0.83 0.56 1.09 -1.26 -5.05 121.20 119.53 2grm s ILE 310 Ca 0.58 1.31 -0.12 0.00 -1.10 0.00 0.00 60.65 61.32 2grm s ILE 310 Cb -0.11 -3.97 0.09 0.00 -1.06 0.00 0.00 42.46 37.41 2grm s ILE 310 CO 0.42 0.32 1.15 -2.16 -0.10 0.00 0.00 174.94 174.57 2grm s PRO 311 N 0.46 1.63 0.50 2.79 0.04 -1.26 -4.95 135.00 134.20 2grm s PRO 311 Ca 0.34 1.53 -0.23 0.00 0.04 0.00 0.00 61.00 62.67 2grm s PRO 311 Cb -0.17 -1.80 -0.06 0.00 0.04 0.00 0.00 34.50 32.51 2grm s PRO 311 CO 0.17 -2.17 1.29 -2.00 0.04 0.00 0.00 177.00 174.32 2grm s GLU 312 N -4.49 3.46 -0.06 4.56 2.12 -1.26 -5.03 118.70 118.01 2grm s GLU 312 Ca 0.68 2.08 -0.02 0.00 0.36 0.00 0.00 54.97 58.07 2grm s GLU 312 Cb -0.23 -2.38 0.03 0.00 0.26 0.00 0.00 34.13 31.81 2grm s GLU 312 CO 0.54 -0.88 0.03 0.42 -0.54 0.00 0.00 175.26 174.82 2grm s ILE 313 N -1.38 0.18 -0.04 -3.70 1.01 -1.26 -5.14 121.20 110.88 2grm s ILE 313 Ca 0.67 0.23 -0.03 0.00 0.00 0.00 0.00 60.65 61.52 2grm s ILE 313 Cb -0.36 -0.39 -0.04 0.00 0.01 0.00 0.00 42.46 41.68 2grm s ILE 313 CO 0.44 0.22 0.11 -0.54 0.00 0.00 0.00 174.94 175.17 2grm s LYS 314 N 2.05 3.24 0.00 2.79 3.01 -1.26 -5.18 119.74 124.39 2grm s LYS 314 Ca 0.05 -0.35 0.00 0.00 -1.01 0.00 0.00 55.97 54.66 2grm s LYS 314 Cb -0.12 -2.99 0.00 0.00 -1.01 0.00 0.00 37.83 33.71 2grm s LYS 314 CO -0.04 0.69 0.00 0.39 0.51 0.00 0.00 175.35 176.90