#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 2.81 -0.78 1.12 0.08 -1.26 -5.02 117.98 114.93 2grm s PHE 2 Ca 0.00 -1.33 -0.11 0.00 0.12 0.00 0.00 56.93 55.61 2grm s PHE 2 Cb 0.00 -1.94 -0.09 0.00 -0.57 0.00 0.00 43.02 40.42 2grm s PHE 2 CO 0.00 -0.66 1.95 1.63 -0.10 0.00 0.00 175.22 178.04 2grm n LYS 3 N 4.48 1.69 -0.12 0.44 4.01 -1.25 -4.55 118.16 122.87 2grm n LYS 3 Ca -0.20 -1.49 -0.12 0.00 -0.51 0.00 0.00 58.31 55.99 2grm n LYS 3 Cb 0.51 -2.56 -0.02 0.00 -0.51 0.00 0.00 35.03 32.44 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 3.84 1.28 -0.51 -0.18 2.04 -1.94 -2.93 117.51 119.11 2grm h ILE 4 Ca 0.43 -1.37 0.05 0.00 1.00 0.00 0.00 64.86 64.97 2grm h ILE 4 Cb 0.32 1.37 -0.04 0.00 -0.74 0.00 0.00 36.82 37.72 2grm h ILE 4 CO 1.59 0.45 0.26 1.23 0.00 0.00 0.00 178.15 181.68 2grm h GLY 5 N 0.59 0.72 0.03 5.37 0.00 -1.80 -0.61 103.07 107.37 2grm h GLY 5 Ca 0.08 -0.18 0.13 0.00 0.00 0.00 0.00 47.33 47.36 2grm h GLY 5 CO 0.06 0.11 0.08 0.23 0.00 0.00 0.00 176.54 177.02 2grm h SER 6 N 0.50 -0.13 -0.16 0.19 0.87 -1.66 -1.46 113.55 111.70 2grm h SER 6 Ca 0.23 0.14 -0.02 0.00 -1.23 0.00 0.00 61.79 60.91 2grm h SER 6 Cb 0.14 0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.31 2grm h SER 6 CO -0.16 -0.06 0.04 0.58 -0.53 0.00 0.00 176.83 176.70 2grm h VAL 7 N 0.19 1.20 -0.46 2.23 2.07 -1.08 -1.28 116.25 119.12 2grm h VAL 7 Ca 0.33 -0.64 0.09 0.00 0.82 0.00 0.00 66.70 67.30 2grm h VAL 7 Cb 0.53 1.32 -0.09 0.00 -1.52 0.00 0.00 31.29 31.54 2grm h VAL 7 CO -0.48 0.19 -0.10 -0.07 0.02 0.00 0.00 177.57 177.14 2grm h LEU 8 N 0.06 -0.39 0.21 2.57 -0.00 -0.47 0.14 115.31 117.43 2grm h LEU 8 Ca 0.05 0.13 -0.00 0.00 -0.00 0.00 0.00 57.88 58.06 2grm h LEU 8 Cb 0.26 0.27 -0.01 0.00 -0.00 0.00 0.00 40.66 41.19 2grm h LEU 8 CO 0.00 -0.14 -0.17 0.50 -0.00 0.00 0.00 178.44 178.63 2grm h LYS 9 N 0.01 -0.38 -0.40 1.13 3.64 -1.13 0.38 116.57 119.82 2grm h LYS 9 Ca 0.22 0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.71 2grm h LYS 9 Cb 0.34 0.09 -0.09 0.00 -0.41 0.00 0.00 32.23 32.16 2grm h LYS 9 CO -0.46 -0.25 -0.19 0.37 -2.27 0.00 0.00 179.45 176.65 2grm h GLN 10 N -0.39 -0.11 -0.39 1.90 -0.00 -0.36 0.42 115.11 116.18 2grm h GLN 10 Ca -0.01 0.01 -0.05 0.00 -0.00 0.00 0.00 58.65 58.60 2grm h GLN 10 Cb 0.35 0.02 -0.02 0.00 0.00 0.00 0.00 27.48 27.84 2grm h GLN 10 CO -0.02 -0.07 0.06 0.82 0.00 0.00 0.00 178.83 179.62 2grm h ILE 11 N -0.11 1.24 -0.01 2.39 2.04 -0.49 -0.85 117.51 121.72 2grm h ILE 11 Ca 0.20 -0.87 0.02 0.00 1.00 0.00 0.00 64.86 65.21 2grm h ILE 11 Cb 0.42 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 2grm h ILE 11 CO -0.47 0.30 -0.12 -0.09 0.00 0.00 0.00 178.15 177.77 2grm h ARG 12 N 0.50 -0.19 -0.28 2.37 2.43 0.86 -0.15 114.38 119.91 2grm h ARG 12 Ca 0.12 0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.21 2grm h ARG 12 Cb 0.37 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 2grm h ARG 12 CO 0.01 -0.13 -0.20 1.96 -1.51 0.00 0.00 179.97 180.10 2grm h GLN 13 N -0.20 0.52 -0.29 0.20 4.20 -0.12 -0.42 115.11 119.00 2grm h GLN 13 Ca 0.05 -0.18 -0.15 0.00 0.06 0.00 0.00 58.65 58.43 2grm h GLN 13 Cb 0.25 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 2grm h GLN 13 CO -0.12 0.70 -0.41 1.49 -0.67 0.00 0.00 178.83 179.81 2grm h GLU 14 N 0.47 0.72 0.00 1.46 4.22 -0.87 -2.20 114.58 118.38 2grm h GLU 14 Ca 0.08 -0.38 0.00 0.00 0.08 0.00 0.00 59.36 59.14 2grm h GLU 14 Cb 0.61 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.88 2grm h GLU 14 CO 0.04 1.00 0.00 1.28 -2.18 0.00 0.00 179.01 179.15 2grm n LEU 15 N -4.03 0.00 -0.81 1.64 4.32 -0.09 -4.90 117.00 113.12 2grm n LEU 15 Ca -0.02 0.12 -0.11 0.00 -0.02 0.00 0.00 56.01 55.99 2grm n LEU 15 Cb 0.54 -0.12 -0.05 0.00 -1.62 0.00 0.00 43.42 42.17 2grm n LEU 15 CO 0.47 -0.01 -0.10 0.59 -1.22 0.00 0.00 177.39 177.12 2grm n ASN 16 N -1.12 -4.52 -4.84 -1.43 3.02 -0.67 -5.02 115.26 100.69 2grm n ASN 16 Ca 0.19 0.26 -0.32 0.00 -0.03 0.00 0.00 54.58 54.68 2grm n ASN 16 Cb 0.16 -2.95 -0.05 0.00 -0.61 0.00 0.00 39.78 36.33 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 -2.32 3.39 0.05 3.10 1.51 -0.26 -4.99 117.35 117.84 2grm s TYR 17 Ca 0.00 1.47 0.00 0.00 -1.01 0.00 0.00 57.07 57.53 2grm s TYR 17 Cb 0.00 -2.76 -0.04 0.00 -0.11 0.00 0.00 41.96 39.05 2grm s TYR 17 CO 0.00 -0.21 0.18 -1.01 -1.11 0.00 0.00 175.55 173.40 2grm s HIS 18 N -2.39 3.47 0.33 2.71 3.76 -1.26 -4.45 115.29 117.47 2grm s HIS 18 Ca 0.59 0.24 0.12 0.00 -0.15 0.00 0.00 55.06 55.86 2grm s HIS 18 Cb -0.10 -1.75 1.03 0.00 1.11 0.00 0.00 32.58 32.88 2grm s HIS 18 CO 0.23 0.59 1.62 1.96 -0.85 0.00 0.00 174.74 178.29 2grm h GLN 19 N 3.25 0.15 -0.80 1.40 4.20 -1.97 0.92 115.11 122.26 2grm h GLN 19 Ca -0.46 -0.01 0.14 0.00 0.06 0.00 0.00 58.65 58.38 2grm h GLN 19 Cb 1.17 -0.03 -0.06 0.00 0.30 0.00 0.00 27.48 28.85 2grm h GLN 19 CO 0.73 0.10 0.53 0.97 -0.67 0.00 0.00 178.83 180.49 2grm h ILE 20 N 0.16 0.84 0.00 2.54 6.09 -1.99 0.12 117.51 125.27 2grm h ILE 20 Ca 0.71 -0.19 0.00 0.00 -1.37 0.00 0.00 64.86 64.00 2grm h ILE 20 Cb 1.66 0.22 0.00 0.00 0.47 0.00 0.00 36.82 39.17 2grm h ILE 20 CO -0.71 0.10 0.00 0.44 -3.07 0.00 0.00 178.15 174.91 2grm h ASP 21 N 0.57 0.00 0.00 2.19 3.32 0.51 -2.64 116.42 120.36 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 0.72 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.27 2grm h ASP 21 CO -0.15 0.00 -0.67 0.18 -1.72 0.00 0.00 179.24 176.88 2grm n LEU 22 N -2.61 1.36 0.22 1.55 7.99 0.36 -4.72 117.00 121.16 2grm n LEU 22 Ca -0.00 0.23 0.09 0.00 -0.01 0.00 0.00 56.01 56.32 2grm n LEU 22 Cb 0.16 -0.64 0.47 0.00 -0.11 0.00 0.00 43.42 43.29 2grm n LEU 22 CO 0.19 -0.36 0.80 0.10 -1.51 0.00 0.00 177.39 176.61 2grm h TYR 23 N -0.67 0.00 -1.86 -1.77 -0.00 -1.54 -3.41 116.97 107.72 2grm h TYR 23 Ca 0.00 0.00 -0.60 0.00 -0.00 0.00 0.00 58.73 58.13 2grm h TYR 23 Cb 0.67 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.40 2grm h TYR 23 CO -0.29 0.24 1.41 -1.13 -0.00 0.00 0.00 178.16 178.39 2grm n SER 24 N -3.44 3.17 0.00 0.10 3.41 -1.00 -0.21 113.62 115.66 2grm n SER 24 Ca -0.00 0.40 0.00 0.00 -0.26 0.00 0.00 58.87 59.01 2grm n SER 24 Cb 0.42 -1.48 0.00 0.00 -0.26 0.00 0.00 64.21 62.89 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 5.64 3.02 0.10 5.00 0.00 -1.26 -4.85 105.19 112.84 2grm n GLY 25 Ca 0.30 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.18 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 -0.87 1.51 -3.98 -0.61 2.08 0.25 -5.10 119.36 112.64 2grm n ILE 26 Ca 0.00 0.01 -0.12 0.00 0.56 0.00 0.00 62.75 63.20 2grm n ILE 26 Cb 0.00 -2.23 -0.03 0.00 -0.75 0.00 0.00 39.64 36.63 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 0.55 -2.91 0.38 0.00 0.71 -5.10 117.12 106.34 2grm n MET 27 Ca -0.24 -2.28 -0.39 0.00 0.00 0.00 0.00 57.70 54.79 2grm n MET 27 Cb 0.61 2.17 -0.06 0.00 0.00 0.00 0.00 33.22 35.93 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 -2.75 7.44 0.54 3.17 1.04 -1.26 -4.28 113.70 117.60 2grm s SER 28 Ca 0.24 1.73 0.32 0.00 0.48 0.00 0.00 55.95 58.72 2grm s SER 28 Cb -0.01 -2.53 1.48 0.00 0.10 0.00 0.00 66.02 65.07 2grm s SER 28 CO 0.17 0.17 1.88 0.50 0.98 0.00 0.00 173.24 176.95 2grm h LYS 29 N 4.17 0.01 -0.03 4.02 3.64 -1.98 0.17 116.57 126.57 2grm h LYS 29 Ca -0.47 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 58.84 2grm h LYS 29 Cb 1.20 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 2grm h LYS 29 CO 0.66 0.01 -0.29 0.66 -2.27 0.00 0.00 179.45 178.22 2grm h SER 30 N 0.01 0.30 0.07 4.20 4.64 -1.99 -2.59 113.55 118.19 2grm h SER 30 Ca 0.44 -0.71 -0.10 0.00 -0.47 0.00 0.00 61.79 60.94 2grm h SER 30 Cb 1.75 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.74 2grm h SER 30 CO -0.01 0.97 -0.33 1.62 -0.87 0.00 0.00 176.83 178.20 2grm h VAL 31 N -0.35 1.28 -0.42 0.95 3.04 -1.48 -2.53 116.25 116.75 2grm h VAL 31 Ca -0.03 -1.39 -0.04 0.00 -1.01 0.00 0.00 66.70 64.24 2grm h VAL 31 Cb 0.99 1.51 -0.02 0.00 -2.01 0.00 0.00 31.29 31.77 2grm h VAL 31 CO 0.06 0.43 0.12 0.22 -1.01 0.00 0.00 177.57 177.39 2grm h TYR 32 N 0.32 0.68 0.00 3.17 5.03 -0.79 0.46 116.97 125.85 2grm h TYR 32 Ca 0.04 -0.07 -0.01 0.00 2.58 0.00 0.00 58.73 61.27 2grm h TYR 32 Cb 0.75 -0.20 -0.00 0.00 1.55 0.00 0.00 36.73 38.83 2grm h TYR 32 CO 0.02 0.63 -0.04 0.82 -1.32 0.00 0.00 178.16 178.27 2grm h ILE 33 N 0.54 0.63 -0.03 1.81 2.04 -1.24 0.26 117.51 121.51 2grm h ILE 33 Ca 0.13 -0.17 -0.20 0.00 1.00 0.00 0.00 64.86 65.63 2grm h ILE 33 Cb 0.28 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 2grm h ILE 33 CO -0.00 0.04 -0.82 0.11 0.00 0.00 0.00 178.15 177.48 2grm h LYS 34 N 0.00 0.33 0.41 2.37 1.57 -0.64 -2.61 116.57 118.00 2grm h LYS 34 Ca -0.00 -0.31 -0.02 0.00 -1.87 0.00 0.00 60.65 58.45 2grm h LYS 34 Cb 0.10 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.49 2grm h LYS 34 CO 0.01 0.98 -0.20 0.28 -0.57 0.00 0.00 179.45 179.95 2grm h VAL 35 N 0.20 0.17 0.00 0.50 2.07 0.12 -1.85 116.25 117.46 2grm h VAL 35 Ca -0.05 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.84 2grm h VAL 35 Cb 1.42 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.46 2grm h VAL 35 CO 0.14 0.04 0.02 1.21 0.02 0.00 0.00 177.57 179.00 2grm n GLU 36 N -5.15 0.00 0.00 1.57 2.13 0.65 -0.42 120.64 119.42 2grm n GLU 36 Ca -0.08 0.22 0.08 0.00 0.66 0.00 0.00 57.16 58.04 2grm n GLU 36 Cb 0.25 -1.52 0.02 0.00 0.27 0.00 0.00 31.44 30.46 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 -1.19 2.92 -3.32 4.31 0.00 -0.99 -4.03 120.51 118.21 2grm n ALA 37 Ca 0.00 -0.57 -0.18 0.00 0.00 0.00 0.00 53.44 52.69 2grm n ALA 37 Cb 0.02 -0.56 0.06 0.00 0.00 0.00 0.00 19.45 18.98 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 -4.97 -0.01 0.00 8.00 0.44 -4.89 116.55 115.38 2grm n ASP 38 Ca 0.08 -0.43 -0.01 0.00 0.71 0.00 0.00 54.79 55.14 2grm n ASP 38 Cb 0.36 -4.02 -0.02 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 -2.08 4.48 -4.44 -2.24 3.41 -0.95 -5.00 113.62 106.79 2grm n SER 39 Ca -0.02 -0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.26 2grm n SER 39 Cb 0.56 0.52 -0.13 0.00 -0.26 0.00 0.00 64.21 64.90 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 -2.05 2.95 0.74 4.33 3.52 -0.74 -5.01 118.95 122.69 2grm s ARG 40 Ca -0.01 -0.67 -0.15 0.00 -0.13 0.00 0.00 55.73 54.77 2grm s ARG 40 Cb 0.01 -2.53 0.04 0.00 -1.56 0.00 0.00 34.95 30.91 2grm s ARG 40 CO 0.08 0.44 1.22 -2.14 -0.81 0.00 0.00 175.30 174.08 2grm s PRO 41 N -0.23 2.09 -0.07 5.12 0.02 -1.26 -4.47 135.00 136.21 2grm s PRO 41 Ca 0.01 1.79 0.03 0.00 0.02 0.00 0.00 61.00 62.86 2grm s PRO 41 Cb -0.13 -1.82 0.00 0.00 0.02 0.00 0.00 34.50 32.57 2grm s PRO 41 CO 0.03 -1.88 -0.17 -1.50 -0.33 0.00 0.00 177.00 173.15 2grm s ILE 42 N -1.95 1.48 0.51 2.83 2.07 -1.26 -4.95 121.20 119.92 2grm s ILE 42 Ca 0.75 -0.70 -0.16 0.00 -1.41 0.00 0.00 60.65 59.13 2grm s ILE 42 Cb -0.30 -1.30 -0.08 0.00 0.13 0.00 0.00 42.46 40.92 2grm s ILE 42 CO 0.46 0.43 0.97 -0.94 -1.91 0.00 0.00 174.94 173.94 2grm s SER 43 N 0.36 6.61 0.41 4.50 1.04 -1.26 -4.89 113.70 120.47 2grm s SER 43 Ca -0.12 1.53 0.08 0.00 0.48 0.00 0.00 55.95 57.92 2grm s SER 43 Cb -0.15 -2.49 0.88 0.00 0.10 0.00 0.00 66.02 64.36 2grm s SER 43 CO 0.04 -0.57 2.05 -0.37 0.98 0.00 0.00 173.24 175.37 2grm h VAL 44 N 0.91 1.08 -0.28 5.02 -1.51 -2.00 -0.18 116.25 119.29 2grm h VAL 44 Ca -0.47 -0.18 -0.00 0.00 -1.23 0.00 0.00 66.70 64.82 2grm h VAL 44 Cb 1.18 0.50 -0.01 0.00 -2.13 0.00 0.00 31.29 30.83 2grm h VAL 44 CO 0.62 0.10 0.16 -0.08 -1.23 0.00 0.00 177.57 177.13 2grm h GLU 45 N 0.53 0.39 0.35 5.19 4.57 -1.99 0.42 114.58 124.05 2grm h GLU 45 Ca 0.16 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.28 2grm h GLU 45 Cb 0.01 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.52 2grm h GLU 45 CO -0.04 0.33 -0.17 0.93 -1.18 0.00 0.00 179.01 178.88 2grm h GLU 46 N 0.34 -0.46 -0.91 1.92 5.08 -1.64 -2.16 114.58 116.76 2grm h GLU 46 Ca 0.10 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.59 2grm h GLU 46 Cb 0.05 0.10 -0.07 0.00 0.50 0.00 0.00 28.75 29.34 2grm h GLU 46 CO -0.02 -0.30 0.59 1.25 -1.00 0.00 0.00 179.01 179.53 2grm h LEU 47 N -0.48 0.82 -0.91 1.33 5.85 -0.82 -0.22 115.31 120.87 2grm h LEU 47 Ca -0.05 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.74 2grm h LEU 47 Cb 0.37 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.20 2grm h LEU 47 CO 0.08 0.47 0.59 -1.28 -0.34 0.00 0.00 178.44 177.96 2grm h SER 48 N 0.90 0.96 -0.12 1.25 0.87 0.30 0.11 113.55 117.82 2grm h SER 48 Ca 0.43 -0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.75 2grm h SER 48 Cb 0.42 -0.21 0.01 0.00 -0.44 0.00 0.00 62.40 62.19 2grm h SER 48 CO -0.19 0.65 -0.82 0.11 -0.53 0.00 0.00 176.83 176.05 2grm h LYS 49 N 1.12 0.78 -0.44 2.24 1.57 -0.47 -2.33 116.57 119.05 2grm h LYS 49 Ca 0.37 -0.67 -0.07 0.00 -1.87 0.00 0.00 60.65 58.42 2grm h LYS 49 Cb 0.05 0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 2grm h LYS 49 CO -0.13 1.27 -0.01 0.74 -0.57 0.00 0.00 179.45 180.75 2grm h PHE 50 N 0.52 0.75 -0.58 -1.35 0.04 -0.87 -0.62 116.94 114.83 2grm h PHE 50 Ca -0.06 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.61 2grm h PHE 50 Cb 1.45 -0.21 -0.03 0.00 2.20 0.00 0.00 35.95 39.37 2grm h PHE 50 CO 0.09 0.71 0.38 1.03 -0.60 0.00 0.00 178.31 179.92 2grm h SER 51 N 0.67 0.67 -0.31 2.17 0.87 -0.70 0.70 113.55 117.63 2grm h SER 51 Ca 0.13 -0.02 -0.09 0.00 -1.23 0.00 0.00 61.79 60.58 2grm h SER 51 Cb 0.42 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.20 2grm h SER 51 CO 0.02 0.50 -0.12 -0.08 -0.53 0.00 0.00 176.83 176.61 2grm h GLU 52 N 0.79 0.74 -0.29 2.24 4.81 -0.80 -1.57 114.58 120.50 2grm h GLU 52 Ca 0.21 -0.25 -0.13 0.00 -0.13 0.00 0.00 59.36 59.07 2grm h GLU 52 Cb -0.08 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.23 2grm h GLU 52 CO -0.05 0.83 -0.32 0.00 -0.73 0.00 0.00 179.01 178.75 2grm h ARG 53 N 0.67 0.73 -0.15 1.92 3.08 -0.63 -3.15 114.38 116.85 2grm h ARG 53 Ca 0.11 -0.40 -0.08 0.00 0.07 0.00 0.00 59.98 59.69 2grm h ARG 53 Cb 0.59 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 2grm h ARG 53 CO 0.04 1.02 -0.25 -0.07 -1.07 0.00 0.00 179.97 179.63 2grm h LEU 54 N 0.47 0.27 0.00 3.04 3.38 -0.73 -3.47 115.31 118.27 2grm h LEU 54 Ca 0.04 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2grm h LEU 54 Cb 0.90 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.58 2grm h LEU 54 CO 0.08 0.53 0.00 0.61 0.09 0.00 0.00 178.44 179.74 2grm n GLY 55 N -0.55 0.61 3.59 0.83 0.00 -0.60 -5.06 105.19 104.01 2grm n GLY 55 Ca -0.01 -0.32 -0.33 0.00 0.00 0.00 0.00 46.02 45.36 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 3.69 0.21 1.61 1.01 -1.19 -5.07 120.40 118.66 2grm s VAL 56 Ca 0.00 -0.60 -0.32 0.00 0.00 0.00 0.00 61.98 61.06 2grm s VAL 56 Cb 0.00 -2.55 -0.14 0.00 0.00 0.00 0.00 36.38 33.69 2grm s VAL 56 CO 0.00 0.51 1.26 -3.20 0.00 0.00 0.00 175.10 173.67 2grm n ASN 57 N 1.94 1.98 0.18 3.32 2.85 -1.26 -4.66 115.26 119.61 2grm n ASN 57 Ca -0.17 1.15 -0.15 0.00 -0.11 0.00 0.00 54.58 55.30 2grm n ASN 57 Cb 0.53 -1.32 -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 3.61 -0.96 0.00 1.20 3.57 -1.95 -1.07 116.94 121.34 2grm h PHE 58 Ca -0.44 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.05 2grm h PHE 58 Cb 1.31 0.38 -0.00 0.00 2.79 0.00 0.00 35.95 40.43 2grm h PHE 58 CO 0.54 -0.48 -0.12 0.74 -2.23 0.00 0.00 178.31 176.77 2grm h PHE 59 N -0.68 0.00 -0.40 0.41 0.04 -2.00 -1.72 116.94 112.60 2grm h PHE 59 Ca -0.01 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.65 2grm h PHE 59 Cb 0.64 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.78 2grm h PHE 59 CO -0.24 0.12 -0.19 1.49 -0.60 0.00 0.00 178.31 178.89 2grm h GLU 60 N 0.00 0.84 0.01 1.51 4.81 -1.80 -0.34 114.58 119.61 2grm h GLU 60 Ca -0.00 -0.36 0.02 0.00 -0.13 0.00 0.00 59.36 58.88 2grm h GLU 60 Cb 0.21 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 2grm h GLU 60 CO 0.02 1.00 -0.11 0.82 -0.73 0.00 0.00 179.01 180.00 2grm h ILE 61 N 0.65 0.73 -0.22 2.32 2.04 -0.37 0.35 117.51 123.00 2grm h ILE 61 Ca 0.09 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.00 2grm h ILE 61 Cb 0.74 0.73 -0.05 0.00 -0.74 0.00 0.00 36.82 37.50 2grm h ILE 61 CO 0.06 0.00 -0.12 -0.07 0.00 0.00 0.00 178.15 178.02 2grm h LEU 62 N -0.19 -0.38 -0.23 1.44 3.38 -1.18 -0.32 115.31 117.82 2grm h LEU 62 Ca 0.04 0.09 0.05 0.00 0.09 0.00 0.00 57.88 58.14 2grm h LEU 62 Cb 0.24 0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 2grm h LEU 62 CO -0.10 -0.15 -0.07 0.78 0.09 0.00 0.00 178.44 178.99 2grm h ASN 63 N -0.09 -0.26 -0.10 -0.43 4.21 -0.49 0.03 115.58 118.45 2grm h ASN 63 Ca 0.12 0.07 0.03 0.00 1.21 0.00 0.00 56.30 57.73 2grm h ASN 63 Cb 0.27 0.16 -0.00 0.00 -1.12 0.00 0.00 38.32 37.63 2grm h ASN 63 CO -0.28 -0.10 0.08 0.03 -1.29 0.00 0.00 177.43 175.87 2grm h ARG 64 N -0.03 0.00 0.00 0.81 3.08 0.29 0.10 114.38 118.64 2grm h ARG 64 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 2grm h ARG 64 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.25 2grm h ARG 64 CO -0.25 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.65 2grm n ALA 65 N -2.45 1.79 0.00 0.04 0.00 -0.03 -4.84 120.51 115.02 2grm n ALA 65 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2grm n ALA 65 Cb 0.19 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.32 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 0.27 1.19 0.93 0.00 0.00 0.35 -3.77 105.19 104.15 2grm n GLY 66 Ca 0.04 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.10 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 -0.02 2.38 -0.61 1.61 2.81 -1.04 -3.98 117.12 118.27 2grm n MET 67 Ca 0.00 -1.36 -0.04 0.00 -1.81 0.00 0.00 57.70 54.49 2grm n MET 67 Cb 0.00 -1.61 0.18 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 0.38 3.63 -3.64 7.83 6.94 -1.11 -4.66 115.26 124.63 2grm n ASN 68 Ca 0.12 -2.72 -0.04 0.00 -0.02 0.00 0.00 54.58 51.92 2grm n ASN 68 Cb 0.52 -0.65 -0.06 0.00 -2.36 0.00 0.00 39.78 37.23 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 -1.98 -0.85 -0.63 5.53 -1.32 -1.26 -5.03 115.64 110.09 2grm s THR 69 Ca 0.33 0.07 -0.06 0.00 -1.21 0.00 0.00 61.69 60.81 2grm s THR 69 Cb 0.26 -0.86 -0.13 0.00 -1.51 0.00 0.00 72.50 70.26 2grm s THR 69 CO 0.08 0.03 2.68 0.29 -2.21 0.00 0.00 174.62 175.49 2grm n LYS 70 N 5.42 2.18 -0.22 7.08 4.76 -1.26 -2.91 118.16 133.22 2grm n LYS 70 Ca -0.10 -1.29 0.01 0.00 -2.87 0.00 0.00 58.31 54.06 2grm n LYS 70 Cb 0.49 -2.25 0.02 0.00 -1.84 0.00 0.00 35.03 31.45 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 3.29 0.48 0.08 4.39 2.88 -1.26 -4.07 113.62 119.40 2grm n SER 71 Ca 0.47 -1.77 -0.11 0.00 -1.33 0.00 0.00 58.87 56.13 2grm n SER 71 Cb 0.43 -0.14 -0.03 0.00 -0.75 0.00 0.00 64.21 63.73 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 4.04 1.46 -2.48 2.46 -1.51 -1.86 -3.45 116.25 114.90 2grm h VAL 72 Ca 0.00 -2.56 -0.52 0.00 -1.23 0.00 0.00 66.70 62.39 2grm h VAL 72 Cb 1.12 2.45 -0.14 0.00 -2.13 0.00 0.00 31.29 32.60 2grm h VAL 72 CO 0.00 0.75 -0.58 0.54 -1.23 0.00 0.00 177.57 177.05 2grm s ASN 73 N -6.99 2.75 0.00 4.19 2.20 -1.26 -5.06 114.94 110.77 2grm s ASN 73 Ca -0.04 -1.46 0.00 0.00 -0.94 0.00 0.00 52.86 50.42 2grm s ASN 73 Cb 0.10 0.05 0.00 0.00 -2.00 0.00 0.00 41.25 39.40 2grm s ASN 73 CO 0.84 -0.68 0.92 1.21 -2.94 0.00 0.00 177.10 176.46 2grm n GLU 74 N -0.81 0.00 -0.45 3.55 4.07 -1.26 -1.43 120.64 124.32 2grm n GLU 74 Ca -0.05 0.87 0.37 0.00 -0.06 0.00 0.00 57.16 58.29 2grm n GLU 74 Cb 0.66 -1.42 0.66 0.00 -0.06 0.00 0.00 31.44 31.28 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 0.17 0.24 6.31 1.35 -1.98 0.97 112.91 119.97 2grm h THR 75 Ca 0.00 -0.04 0.00 0.00 -0.55 0.00 0.00 66.41 65.82 2grm h THR 75 Cb 0.00 0.06 -0.01 0.00 -1.73 0.00 0.00 68.15 66.46 2grm h THR 75 CO 0.00 0.02 -0.21 1.23 -0.25 0.00 0.00 175.52 176.31 2grm h GLY 76 N 0.11 -0.47 0.61 5.82 0.00 -1.42 -2.00 103.07 105.72 2grm h GLY 76 Ca 0.79 0.23 0.07 0.00 0.00 0.00 0.00 47.33 48.43 2grm h GLY 76 CO -0.34 -0.20 0.39 0.50 0.00 0.00 0.00 176.54 176.89 2grm h LYS 77 N -0.46 0.67 -0.86 4.80 1.57 -0.73 -2.35 116.57 119.21 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 0.42 -0.15 -0.05 0.00 0.08 0.00 0.00 32.23 32.53 2grm h LYS 77 CO -0.03 0.44 0.56 0.93 -0.57 0.00 0.00 179.45 180.79 2grm h GLU 78 N 0.69 1.01 -0.07 3.15 4.39 -1.17 -1.73 114.58 120.84 2grm h GLU 78 Ca 0.33 -0.06 -0.16 0.00 0.34 0.00 0.00 59.36 59.80 2grm h GLU 78 Cb 0.26 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2grm h GLU 78 CO -0.21 0.67 -0.66 0.87 -1.16 0.00 0.00 179.01 178.52 2grm h LYS 79 N 1.05 0.31 0.00 2.33 1.57 -0.86 -2.77 116.57 118.19 2grm h LYS 79 Ca 0.35 -0.23 -0.11 0.00 -1.87 0.00 0.00 60.65 58.79 2grm h LYS 79 Cb 0.07 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 2grm h LYS 79 CO -0.11 0.86 -0.52 -0.07 -0.57 0.00 0.00 179.45 179.04 2grm h LEU 80 N 0.22 0.00 -1.13 2.94 3.38 -1.09 -2.90 115.31 116.72 2grm h LEU 80 Ca -0.02 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 2grm h LEU 80 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2grm h LEU 80 CO 0.11 0.52 -0.41 0.25 0.09 0.00 0.00 178.44 178.99 2grm h LEU 81 N 0.00 0.00 -0.61 1.67 5.85 -1.06 -3.11 115.31 118.05 2grm h LEU 81 Ca -0.01 0.00 0.11 0.00 0.84 0.00 0.00 57.88 58.82 2grm h LEU 81 Cb 0.94 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.89 2grm h LEU 81 CO 0.07 0.41 0.19 0.40 -0.34 0.00 0.00 178.44 179.17 2grm h ILE 82 N 0.00 0.70 -0.73 4.05 1.08 -1.29 0.22 117.51 121.55 2grm h ILE 82 Ca -0.00 -0.12 0.01 0.00 -0.39 0.00 0.00 64.86 64.36 2grm h ILE 82 Cb 0.78 0.33 -0.04 0.00 -3.07 0.00 0.00 36.82 34.82 2grm h ILE 82 CO 0.05 0.06 0.48 0.28 -0.69 0.00 0.00 178.15 178.34 2grm h SER 83 N 0.34 0.84 0.32 1.72 0.02 -1.69 -0.87 113.55 114.23 2grm h SER 83 Ca 0.32 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.23 2grm h SER 83 Cb 0.44 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.78 2grm h SER 83 CO -0.36 0.61 -0.16 0.50 -1.14 0.00 0.00 176.83 176.28 2grm h LYS 84 N 0.99 -0.42 0.00 3.45 3.64 -1.11 -2.16 116.57 120.96 2grm h LYS 84 Ca 0.27 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 2grm h LYS 84 Cb -0.12 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 2grm h LYS 84 CO -0.06 -0.26 0.00 0.82 -2.27 0.00 0.00 179.45 177.68 2grm h ILE 85 N -0.46 0.00 0.00 2.00 1.08 -0.40 -0.28 117.51 119.45 2grm h ILE 85 Ca -0.04 -0.12 -0.07 0.00 -0.39 0.00 0.00 64.86 64.23 2grm h ILE 85 Cb 0.35 0.87 -0.01 0.00 -3.07 0.00 0.00 36.82 34.96 2grm h ILE 85 CO 0.07 0.00 -0.51 0.15 -0.69 0.00 0.00 178.15 177.17 2grm h PHE 86 N 0.00 0.00 -0.01 1.37 3.57 -0.50 -2.92 116.94 118.45 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 0.15 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.89 2grm h PHE 86 CO 0.00 0.33 -0.26 0.25 -2.23 0.00 0.00 178.31 176.40 2grm n THR 87 N -3.10 0.00 -3.15 4.41 -2.24 -0.71 -4.58 114.28 104.91 2grm n THR 87 Ca 0.01 -0.37 -0.22 0.00 -2.27 0.00 0.00 64.05 61.20 2grm n THR 87 Cb 0.68 1.13 -0.04 0.00 -2.10 0.00 0.00 70.33 69.99 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 -0.30 1.81 0.00 3.42 3.02 -0.20 -4.96 115.26 118.05 2grm n ASN 88 Ca 0.05 -3.15 0.00 0.00 -0.03 0.00 0.00 54.58 51.45 2grm n ASN 88 Cb 0.24 -0.61 0.00 0.00 -0.61 0.00 0.00 39.78 38.79 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 0.41 0.00 0.09 3.52 -0.04 -1.10 -0.99 135.00 136.88 2grm n PRO 89 Ca 0.26 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.70 2grm n PRO 89 Cb 0.55 -1.45 -0.05 0.00 -0.04 0.00 0.00 33.50 32.51 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 -0.07 3.54 3.32 -1.93 -3.19 116.42 118.09 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 0.71 0.00 0.18 -1.72 0.00 0.00 179.24 178.41 2grm n LEU 91 N -3.22 0.56 0.15 1.55 4.77 -0.16 -4.32 117.00 116.32 2grm n LEU 91 Ca -0.01 -0.24 -0.06 0.00 -0.03 0.00 0.00 56.01 55.67 2grm n LEU 91 Cb 0.84 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.86 2grm n LEU 91 CO 0.43 0.12 0.51 0.15 -1.33 0.00 0.00 177.39 177.27 2grm h PHE 92 N 0.72 -0.35 0.00 -1.77 3.57 -1.71 -3.22 116.94 114.17 2grm h PHE 92 Ca 0.00 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.49 2grm h PHE 92 Cb 0.16 0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.01 2grm h PHE 92 CO 0.04 -0.22 0.00 -0.25 -2.23 0.00 0.00 178.31 175.66 2grm n ASP 93 N -3.02 0.00 -0.32 0.41 8.00 -1.26 0.06 116.55 120.41 2grm n ASP 93 Ca -0.05 0.67 0.19 0.00 0.71 0.00 0.00 54.79 56.32 2grm n ASP 93 Cb 0.15 -0.21 0.39 0.00 -0.02 0.00 0.00 41.12 41.43 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 0.35 -0.08 -1.24 1.57 -1.87 -0.77 116.57 114.52 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 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.23 2grm h LYS 94 CO 0.00 0.23 -0.26 -0.91 -0.57 0.00 0.00 179.45 177.94 2grm h ASN 95 N 0.36 0.37 -0.13 0.86 -0.26 -1.44 -3.19 115.58 112.15 2grm h ASN 95 Ca 0.65 -0.61 -0.01 0.00 -0.56 0.00 0.00 56.30 55.77 2grm h ASN 95 Cb 1.38 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 38.53 2grm h ASN 95 CO -0.58 0.92 0.07 0.15 -1.06 0.00 0.00 177.43 176.93 2grm h PHE 96 N -0.16 0.21 0.00 1.19 3.57 0.52 -1.19 116.94 121.08 2grm h PHE 96 Ca -0.01 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 2grm h PHE 96 Cb 0.89 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.56 2grm h PHE 96 CO 0.12 0.16 -0.11 1.96 -2.23 0.00 0.00 178.31 178.21 2grm h GLN 97 N 0.22 0.00 0.01 1.11 1.08 -1.16 -0.89 115.11 115.47 2grm h GLN 97 Ca 0.06 0.00 -0.29 0.00 -1.45 0.00 0.00 58.65 56.96 2grm h GLN 97 Cb 0.04 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.42 2grm h GLN 97 CO -0.01 0.11 -1.71 -2.13 -0.95 0.00 0.00 178.83 174.15 2grm n ARG 98 N -3.94 0.64 -0.05 1.46 0.63 -0.49 -4.36 116.66 110.54 2grm n ARG 98 Ca -0.02 0.30 -0.18 0.00 -0.92 0.00 0.00 57.85 57.03 2grm n ARG 98 Cb 0.20 -1.80 -0.13 0.00 0.45 0.00 0.00 32.46 31.19 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 1.39 -0.95 5.15 5.03 -1.22 -3.38 117.51 123.52 2grm h ILE 99 Ca -0.29 -2.33 0.19 0.00 -0.12 0.00 0.00 64.86 62.31 2grm h ILE 99 Cb 2.01 2.93 -0.18 0.00 -3.03 0.00 0.00 36.82 38.55 2grm h ILE 99 CO 0.08 0.55 -0.23 1.21 -0.68 0.00 0.00 178.15 179.08 2grm n GLU 100 N -4.39 -0.09 0.26 2.37 0.00 -0.36 0.20 120.64 118.64 2grm n GLU 100 Ca -0.19 1.48 0.12 0.00 0.00 0.00 0.00 57.16 58.57 2grm n GLU 100 Cb 0.65 -2.21 0.73 0.00 0.00 0.00 0.00 31.44 30.61 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 -0.60 5.31 0.11 -1.76 -2.84 132.00 132.22 2grm h PRO 101 Ca 0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.57 2grm h PRO 101 Cb 0.70 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.81 2grm h PRO 101 CO -0.98 0.11 0.00 1.63 -0.21 0.00 0.00 178.00 178.55 2grm n LYS 102 N -3.73 3.43 0.31 1.05 5.02 0.13 -4.65 118.16 119.73 2grm n LYS 102 Ca -0.02 -2.76 0.20 0.00 -2.02 0.00 0.00 58.31 53.71 2grm n LYS 102 Cb 0.22 -1.77 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 3.71 0.00 -0.32 1.97 0.11 -1.22 -1.54 114.38 117.09 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 1.30 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.38 2grm h ARG 103 CO 0.17 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.52 2grm n LEU 104 N -3.33 3.09 0.21 0.08 4.77 -1.26 -2.71 117.00 117.85 2grm n LEU 104 Ca -0.02 -2.21 0.07 0.00 -0.03 0.00 0.00 56.01 53.81 2grm n LEU 104 Cb 0.14 -0.29 0.47 0.00 -2.33 0.00 0.00 43.42 41.42 2grm n LEU 104 CO 0.22 0.71 0.80 0.74 -1.33 0.00 0.00 177.39 178.53 2grm h THR 105 N 1.91 0.93 -1.08 -5.08 2.02 -1.61 -3.46 112.91 106.53 2grm h THR 105 Ca 0.00 -1.08 0.28 0.00 0.77 0.00 0.00 66.41 66.37 2grm h THR 105 Cb 0.87 1.63 -0.24 0.00 -1.74 0.00 0.00 68.15 68.67 2grm h THR 105 CO 0.05 0.28 0.95 -0.94 0.37 0.00 0.00 175.52 176.23 2grm s SER 106 N -6.55 -0.04 0.46 4.18 1.04 -1.26 -5.00 113.70 106.54 2grm s SER 106 Ca -0.02 0.02 0.24 0.00 0.48 0.00 0.00 55.95 56.67 2grm s SER 106 Cb 0.13 0.03 1.26 0.00 0.10 0.00 0.00 66.02 67.54 2grm s SER 106 CO 0.67 -0.04 1.84 -0.07 0.98 0.00 0.00 173.24 176.62 2grm h LEU 107 N 2.03 0.25 0.37 2.42 3.38 -1.89 -1.02 115.31 120.85 2grm h LEU 107 Ca -0.06 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 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 0.08 -0.29 1.56 0.09 0.00 0.00 178.44 180.09 2grm h GLN 108 N 0.24 -0.64 0.00 1.13 1.08 -1.93 -1.16 115.11 113.83 2grm h GLN 108 Ca 0.49 0.04 -0.03 0.00 -1.45 0.00 0.00 58.65 57.70 2grm h GLN 108 Cb 1.51 0.14 -0.00 0.00 -0.05 0.00 0.00 27.48 29.08 2grm h GLN 108 CO -0.13 -0.43 -0.16 1.88 -0.95 0.00 0.00 178.83 179.04 2grm h TYR 109 N -0.66 0.00 -0.18 2.96 -1.99 -1.50 -1.88 116.97 113.72 2grm h TYR 109 Ca -0.03 0.00 -0.17 0.00 2.00 0.00 0.00 58.73 60.53 2grm h TYR 109 Cb 0.58 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.30 2grm h TYR 109 CO -0.14 0.16 -0.60 0.35 -0.00 0.00 0.00 178.16 177.93 2grm h PHE 110 N 0.00 0.76 -0.51 4.88 3.57 -1.02 0.32 116.94 124.94 2grm h PHE 110 Ca -0.00 -0.29 -0.04 0.00 3.53 0.00 0.00 57.97 61.17 2grm h PHE 110 Cb 0.30 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.88 2grm h PHE 110 CO 0.00 1.04 0.15 1.03 -2.23 0.00 0.00 178.31 178.31 2grm h SER 111 N 0.45 0.75 -0.77 0.41 0.87 -0.61 0.14 113.55 114.79 2grm h SER 111 Ca -0.00 -0.21 -0.04 0.00 -1.23 0.00 0.00 61.79 60.31 2grm h SER 111 Cb 1.16 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.89 2grm h SER 111 CO 0.11 0.76 0.32 0.40 -0.53 0.00 0.00 176.83 177.90 2grm h ILE 112 N 0.70 1.25 0.36 2.23 2.04 -1.09 -0.50 117.51 122.51 2grm h ILE 112 Ca 0.16 -0.78 -0.01 0.00 1.00 0.00 0.00 64.86 65.23 2grm h ILE 112 Cb 0.29 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 2grm h ILE 112 CO -0.00 0.32 -0.24 0.22 0.00 0.00 0.00 178.15 178.44 2grm h TYR 113 N 1.11 -0.64 -0.11 1.37 3.20 0.32 -1.39 116.97 120.84 2grm h TYR 113 Ca 0.26 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.16 2grm h TYR 113 Cb 0.19 0.23 -0.00 0.00 1.54 0.00 0.00 36.73 38.69 2grm h TYR 113 CO 0.02 -0.37 0.08 -0.07 -1.64 0.00 0.00 178.16 176.18 2grm h LEU 114 N -0.59 0.00 -0.19 2.82 3.38 -0.81 -0.85 115.31 119.07 2grm h LEU 114 Ca -0.03 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.95 2grm h LEU 114 Cb 0.50 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 2grm h LEU 114 CO 0.02 0.00 0.08 1.23 0.09 0.00 0.00 178.44 179.87 2grm h GLY 115 N 0.00 0.24 0.98 0.83 0.00 -0.02 -1.67 103.07 103.44 2grm h GLY 115 Ca 0.05 -0.06 -0.04 0.00 0.00 0.00 0.00 47.33 47.28 2grm h GLY 115 CO -0.00 0.05 0.16 -0.97 0.00 0.00 0.00 176.54 175.78 2grm h TYR 116 N 0.19 0.85 -0.66 5.60 -1.99 -0.53 -2.48 116.97 117.95 2grm h TYR 116 Ca 0.08 -0.09 0.13 0.00 2.00 0.00 0.00 58.73 60.85 2grm h TYR 116 Cb 0.03 -0.25 -0.04 0.00 2.00 0.00 0.00 36.73 38.47 2grm h TYR 116 CO -0.10 0.73 0.45 0.82 -0.00 0.00 0.00 178.16 180.06 2grm h ILE 117 N 0.73 0.82 0.24 -2.88 1.08 -1.00 -0.79 117.51 115.71 2grm h ILE 117 Ca 0.17 -0.12 -0.01 0.00 -0.39 0.00 0.00 64.86 64.51 2grm h ILE 117 Cb 0.28 0.44 0.00 0.00 -3.07 0.00 0.00 36.82 34.48 2grm h ILE 117 CO -0.00 0.06 -0.12 0.28 -0.69 0.00 0.00 178.15 177.68 2grm h SER 118 N 0.35 -0.28 -0.91 1.72 0.02 -0.84 -2.37 113.55 111.24 2grm h SER 118 Ca 0.32 -0.18 0.18 0.00 -0.84 0.00 0.00 61.79 61.27 2grm h SER 118 Cb 0.76 0.07 -0.10 0.00 0.14 0.00 0.00 62.40 63.27 2grm h SER 118 CO -0.09 0.04 0.48 0.40 -1.14 0.00 0.00 176.83 176.52 2grm h ILE 119 N -0.61 0.67 0.75 3.27 2.04 -1.14 -1.32 117.51 121.16 2grm h ILE 119 Ca -0.03 -0.21 -0.04 0.00 1.00 0.00 0.00 64.86 65.58 2grm h ILE 119 Cb 0.44 -0.01 0.01 0.00 -0.74 0.00 0.00 36.82 36.52 2grm h ILE 119 CO 0.06 0.11 -0.36 0.00 0.00 0.00 0.00 178.15 177.96 2grm h ALA 120 N 1.62 -1.00 -0.73 1.87 0.00 -1.03 -1.47 119.26 118.50 2grm h ALA 120 Ca 0.52 -0.22 0.10 0.00 0.00 0.00 0.00 54.91 55.31 2grm h ALA 120 Cb 0.82 0.39 -0.07 0.00 0.00 0.00 0.00 17.79 18.92 2grm h ALA 120 CO -0.40 -1.06 0.36 0.45 0.00 0.00 0.00 179.25 178.60 2grm h HIS 121 N -1.01 0.65 0.12 0.00 3.86 -0.89 0.45 115.15 118.33 2grm h HIS 121 Ca -0.10 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.16 2grm h HIS 121 Cb 0.77 -0.18 -0.04 0.00 1.06 0.00 0.00 27.41 29.02 2grm h HIS 121 CO -0.02 0.22 -0.29 1.25 0.86 0.00 0.00 177.93 179.95 2grm h HIS 122 N 0.60 -0.79 -0.20 2.45 6.17 -1.11 -1.88 115.15 120.39 2grm h HIS 122 Ca 0.37 0.02 -0.03 0.00 0.71 0.00 0.00 60.37 61.44 2grm h HIS 122 Cb 0.41 0.33 -0.02 0.00 2.52 0.00 0.00 27.41 30.66 2grm h HIS 122 CO -0.11 -0.40 0.04 0.66 0.71 0.00 0.00 177.93 178.83 2grm n TYR 123 N -5.40 0.69 -4.16 5.26 4.01 -0.57 -4.88 117.16 112.11 2grm n TYR 123 Ca -0.07 -0.35 -0.31 0.00 -0.16 0.00 0.00 57.90 57.01 2grm n TYR 123 Cb 0.31 -0.27 -0.04 0.00 -0.31 0.00 0.00 39.34 39.03 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 0.16 -1.12 -4.80 7.72 5.03 -0.25 -4.93 115.26 117.08 2grm n ASN 124 Ca 0.10 -1.08 -0.38 0.00 0.87 0.00 0.00 54.58 54.09 2grm n ASN 124 Cb 0.60 -2.54 -0.06 0.00 -1.02 0.00 0.00 39.78 36.76 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 -3.78 5.14 -0.06 2.41 1.01 0.14 -4.99 121.20 121.06 2grm s ILE 125 Ca 0.30 0.77 -0.30 0.00 0.00 0.00 0.00 60.65 61.43 2grm s ILE 125 Cb -0.17 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.56 2grm s ILE 125 CO 0.94 0.50 1.39 -1.61 0.00 0.00 0.00 174.94 176.15 2grm s GLU 126 N -0.47 4.26 -0.50 2.79 0.41 -1.26 -4.36 118.70 119.58 2grm s GLU 126 Ca 0.22 1.89 0.06 0.00 -0.41 0.00 0.00 54.97 56.74 2grm s GLU 126 Cb -0.15 -3.70 0.22 0.00 -1.78 0.00 0.00 34.13 28.72 2grm s GLU 126 CO 0.10 -0.64 0.53 1.33 -0.49 0.00 0.00 175.26 176.09 2grm n VAL 127 N 4.99 0.23 0.05 2.63 0.24 -1.26 -4.98 118.33 120.22 2grm n VAL 127 Ca 0.14 -4.29 0.03 0.00 -2.04 0.00 0.00 64.34 58.18 2grm n VAL 127 Cb 0.44 -1.96 0.40 0.00 -1.47 0.00 0.00 33.84 31.25 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 4.57 0.43 0.00 7.34 0.11 -2.02 -2.72 132.00 139.72 2grm h PRO 128 Ca 0.16 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.19 2grm h PRO 128 Cb 0.82 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.85 2grm h PRO 128 CO 0.56 0.39 -0.07 1.79 -0.21 0.00 0.00 178.00 180.46 2grm h THR 129 N 0.42 0.27 0.00 -1.15 1.35 -1.98 -2.83 112.91 109.00 2grm h THR 129 Ca 0.10 -0.50 0.00 0.00 -0.55 0.00 0.00 66.41 65.46 2grm h THR 129 Cb 0.15 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 67.96 2grm h THR 129 CO -0.01 0.07 0.00 0.33 -0.25 0.00 0.00 175.52 175.67 2grm n PHE 130 N -3.32 0.00 0.21 4.73 7.35 -1.02 -2.08 117.46 123.32 2grm n PHE 130 Ca -0.01 0.00 0.15 0.00 -0.76 0.00 0.00 57.45 56.83 2grm n PHE 130 Cb 0.25 -0.38 0.60 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 0.83 -2.13 2.35 -1.67 0.24 115.58 115.20 2grm h ASN 131 Ca 0.00 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.59 2grm h ASN 131 Cb 0.00 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.34 2grm h ASN 131 CO 0.00 0.00 -1.27 0.11 -1.65 0.00 0.00 177.43 174.62 2grm h LYS 132 N 0.00 0.00 0.00 0.81 1.57 -1.55 -3.42 116.57 113.99 2grm h LYS 132 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2grm h LYS 132 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 2grm h LYS 132 CO -0.00 0.32 0.00 0.25 -0.57 0.00 0.00 179.45 179.45 2grm n THR 133 N -2.94 0.00 -0.10 -0.16 -2.24 0.60 -4.84 114.28 104.60 2grm n THR 133 Ca -0.08 -0.40 -0.06 0.00 -2.27 0.00 0.00 64.05 61.24 2grm n THR 133 Cb 0.82 1.02 0.01 0.00 -2.10 0.00 0.00 70.33 70.09 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 0.02 0.88 -0.88 2.28 2.10 -1.07 0.15 117.51 121.00 2grm h ILE 134 Ca 0.00 -0.09 0.12 0.00 1.08 0.00 0.00 64.86 65.97 2grm h ILE 134 Cb 0.01 0.61 -0.07 0.00 -1.09 0.00 0.00 36.82 36.28 2grm h ILE 134 CO 0.00 0.05 0.57 0.74 -1.08 0.00 0.00 178.15 178.42 2grm h THR 135 N 0.25 0.90 0.01 2.19 2.02 -1.88 0.52 112.91 116.91 2grm h THR 135 Ca 0.16 -0.26 -0.00 0.00 0.77 0.00 0.00 66.41 67.08 2grm h THR 135 Cb 0.15 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.62 2grm h THR 135 CO -0.18 0.14 -0.01 -1.28 0.37 0.00 0.00 175.52 174.57 2grm h SER 136 N 0.77 -0.01 -0.17 4.18 0.87 -1.69 -2.12 113.55 115.37 2grm h SER 136 Ca 0.43 -0.38 0.05 0.00 -1.23 0.00 0.00 61.79 60.66 2grm h SER 136 Cb 0.57 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.48 2grm h SER 136 CO -0.19 0.37 -0.19 0.44 -0.53 0.00 0.00 176.83 176.74 2grm h ASP 137 N -0.40 -0.59 -0.51 6.23 3.32 0.50 -0.16 116.42 124.82 2grm h ASP 137 Ca -0.00 0.11 0.05 0.00 0.02 0.00 0.00 57.03 57.20 2grm h ASP 137 Cb 0.39 0.28 -0.05 0.00 0.22 0.00 0.00 39.33 40.17 2grm h ASP 137 CO 0.00 -0.23 0.25 -0.07 -1.72 0.00 0.00 179.24 177.47 2grm h LEU 138 N -0.21 0.35 -0.43 1.55 3.38 -1.01 0.43 115.31 119.37 2grm h LEU 138 Ca 0.11 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.19 2grm h LEU 138 Cb 0.38 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.03 2grm h LEU 138 CO -0.30 0.24 0.02 0.50 0.09 0.00 0.00 178.44 178.99 2grm h LYS 139 N 0.49 0.13 -0.71 1.13 1.63 -0.66 0.46 116.57 119.03 2grm h LYS 139 Ca 0.22 -0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 60.00 2grm h LYS 139 Cb 0.14 -0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 31.71 2grm h LYS 139 CO -0.16 0.08 0.38 1.25 -3.45 0.00 0.00 179.45 177.55 2grm h HIS 140 N 0.13 0.98 0.04 1.91 2.76 0.22 -3.23 115.15 117.96 2grm h HIS 140 Ca 0.21 -0.03 -0.08 0.00 -2.20 0.00 0.00 60.37 58.28 2grm h HIS 140 Cb 0.30 -0.31 0.01 0.00 1.55 0.00 0.00 27.41 28.96 2grm h HIS 140 CO -0.27 0.70 -0.33 -0.07 -1.30 0.00 0.00 177.93 176.67 2grm h LEU 141 N 0.98 0.22 -7.44 0.26 3.38 -0.31 -3.41 115.31 108.99 2grm h LEU 141 Ca 0.25 -0.90 -0.70 0.00 0.09 0.00 0.00 57.88 56.62 2grm h LEU 141 Cb 0.05 -0.07 -0.35 0.00 0.09 0.00 0.00 40.66 40.38 2grm h LEU 141 CO -0.04 1.10 -0.23 -0.31 0.09 0.00 0.00 178.44 179.05 2grm s TYR 142 N -2.63 3.65 0.00 1.13 2.02 0.16 -4.67 117.35 117.00 2grm s TYR 142 Ca -0.16 -2.87 0.00 0.00 -0.37 0.00 0.00 57.07 53.67 2grm s TYR 142 Cb -0.00 -3.22 0.00 0.00 -0.40 0.00 0.00 41.96 38.34 2grm s TYR 142 CO 0.75 -0.78 0.00 -3.47 -1.57 0.00 0.00 175.55 170.48 2grm n ASP 143 N 2.89 0.03 -1.75 2.29 4.64 -1.22 -4.60 116.55 118.83 2grm n ASP 143 Ca 0.15 0.00 -0.17 0.00 -1.38 0.00 0.00 54.79 53.39 2grm n ASP 143 Cb 0.38 0.00 0.16 0.00 -1.04 0.00 0.00 41.12 40.61 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 -2.20 2.26 -3.48 -0.67 4.76 -1.26 -5.00 118.16 112.58 2grm n LYS 144 Ca 0.00 -3.26 -0.37 0.00 -2.87 0.00 0.00 58.31 51.81 2grm n LYS 144 Cb 0.01 -2.05 -0.06 0.00 -1.84 0.00 0.00 35.03 31.09 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 -3.40 4.10 -0.01 1.97 1.81 -1.26 -4.96 118.95 117.21 2grm s ARG 145 Ca 0.52 0.31 0.00 0.00 -1.72 0.00 0.00 55.73 54.85 2grm s ARG 145 Cb 0.45 -3.33 -0.01 0.00 -0.45 0.00 0.00 34.95 31.61 2grm s ARG 145 CO 0.03 0.42 -0.00 0.25 -0.68 0.00 0.00 175.30 175.32 2grm n THR 146 N 2.82 0.04 -4.34 0.02 -2.24 -1.26 -5.07 114.28 104.24 2grm n THR 146 Ca -0.12 -0.02 -0.24 0.00 -2.27 0.00 0.00 64.05 61.40 2grm n THR 146 Cb 0.52 -0.77 -0.12 0.00 -2.10 0.00 0.00 70.33 67.87 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 -2.01 1.95 -0.03 4.28 -4.23 -1.26 -5.07 115.64 109.27 2grm s THR 147 Ca -0.01 -1.82 0.06 0.00 -1.18 0.00 0.00 61.69 58.75 2grm s THR 147 Cb 0.00 -1.84 -0.01 0.00 1.34 0.00 0.00 72.50 71.99 2grm s THR 147 CO 0.02 -0.16 -0.22 -0.36 -0.54 0.00 0.00 174.62 173.37 2grm s PHE 148 N -1.61 1.99 0.55 3.99 0.40 -1.26 -5.13 117.98 116.92 2grm s PHE 148 Ca 0.14 -0.44 0.09 0.00 -0.60 0.00 0.00 56.93 56.12 2grm s PHE 148 Cb -0.08 -1.30 0.09 0.00 0.51 0.00 0.00 43.02 42.24 2grm s PHE 148 CO 0.07 -0.08 0.72 1.19 0.70 0.00 0.00 175.22 177.81 2grm n PHE 149 N 2.69 -2.12 -0.11 0.36 3.01 -1.26 -4.97 117.46 115.05 2grm n PHE 149 Ca -0.16 -2.03 -0.05 0.00 1.01 0.00 0.00 57.45 56.22 2grm n PHE 149 Cb 0.52 -0.51 0.03 0.00 -0.01 0.00 0.00 39.48 39.51 2grm n PHE 149 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2grm h GLY 150 N 0.16 0.43 2.00 1.37 0.00 -1.95 -1.56 103.07 103.52 2grm h GLY 150 Ca -0.27 -0.01 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 2grm h GLY 150 CO 0.38 -0.05 -0.02 1.19 0.00 0.00 0.00 176.54 178.05 2grm h ILE 151 N 0.17 0.52 -0.08 2.60 6.09 -1.96 -1.76 117.51 123.09 2grm h ILE 151 Ca 0.18 -0.07 -0.00 0.00 -1.37 0.00 0.00 64.86 63.60 2grm h ILE 151 Cb 0.23 1.05 -0.00 0.00 0.47 0.00 0.00 36.82 38.56 2grm h ILE 151 CO -0.26 0.02 0.03 0.44 -3.07 0.00 0.00 178.15 175.31 2grm h ASP 152 N 0.00 0.10 0.02 2.19 3.45 -1.66 0.38 116.42 120.91 2grm h ASP 152 Ca -0.00 -0.16 -0.07 0.00 0.43 0.00 0.00 57.03 57.23 2grm h ASP 152 Cb 0.04 -0.03 -0.01 0.00 -0.56 0.00 0.00 39.33 38.77 2grm h ASP 152 CO 0.00 0.23 -0.21 1.88 -1.57 0.00 0.00 179.24 179.58 2grm h TYR 153 N -0.03 0.36 -0.01 4.55 -1.99 -1.26 -1.72 116.97 116.87 2grm h TYR 153 Ca 0.03 -0.06 -0.00 0.00 2.00 0.00 0.00 58.73 60.69 2grm h TYR 153 Cb 0.16 -0.09 -0.00 0.00 2.00 0.00 0.00 36.73 38.79 2grm h TYR 153 CO -0.02 0.52 0.00 1.49 -0.00 0.00 0.00 178.16 180.16 2grm h GLU 154 N 0.30 0.01 -0.01 4.88 4.81 -0.99 -1.32 114.58 122.26 2grm h GLU 154 Ca 0.05 -0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.31 2grm h GLU 154 Cb 0.54 -0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.87 2grm h GLU 154 CO 0.04 0.19 -0.27 0.82 -0.73 0.00 0.00 179.01 179.06 2grm h ILE 155 N -0.17 0.40 -0.04 2.32 2.04 -0.61 -1.55 117.51 119.88 2grm h ILE 155 Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 2grm h ILE 155 Cb 0.19 0.40 -0.00 0.00 -0.74 0.00 0.00 36.82 36.66 2grm h ILE 155 CO -0.00 0.00 -0.00 0.58 0.00 0.00 0.00 178.15 178.73 2grm h VAL 156 N -0.41 1.03 -0.41 1.67 2.07 -1.27 -0.28 116.25 118.66 2grm h VAL 156 Ca 0.06 -0.12 -0.04 0.00 0.82 0.00 0.00 66.70 67.42 2grm h VAL 156 Cb 0.49 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 2grm h VAL 156 CO -0.24 0.04 0.09 0.28 0.02 0.00 0.00 177.57 177.76 2grm h SER 157 N 0.06 0.63 0.76 0.57 0.02 -0.24 -1.64 113.55 113.71 2grm h SER 157 Ca 0.02 -0.24 -0.13 0.00 -0.84 0.00 0.00 61.79 60.59 2grm h SER 157 Cb 0.05 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.40 2grm h SER 157 CO 0.00 0.71 -0.62 0.78 -1.14 0.00 0.00 176.83 176.56 2grm h ASN 158 N 0.52 0.00 -0.42 3.07 -0.26 -0.93 -3.12 115.58 114.43 2grm h ASN 158 Ca 0.13 0.00 -0.09 0.00 -0.56 0.00 0.00 56.30 55.78 2grm h ASN 158 Cb 0.33 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.57 2grm h ASN 158 CO 0.00 0.62 -0.04 0.25 -1.06 0.00 0.00 177.43 177.21 2grm h LEU 159 N 0.00 0.83 -0.92 1.61 5.85 -0.75 -2.28 115.31 119.65 2grm h LEU 159 Ca -0.01 -0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.49 2grm h LEU 159 Cb 1.17 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.98 2grm h LEU 159 CO 0.08 0.91 0.00 0.18 -0.34 0.00 0.00 178.44 179.27 2grm n LEU 160 N -4.19 0.55 0.01 2.25 4.77 -0.64 -2.07 117.00 117.68 2grm n LEU 160 Ca 0.02 0.69 0.11 0.00 -0.03 0.00 0.00 56.01 56.80 2grm n LEU 160 Cb 0.33 -0.67 -0.04 0.00 -2.33 0.00 0.00 43.42 40.72 2grm n LEU 160 CO 0.43 -0.70 -0.11 -3.20 -1.33 0.00 0.00 177.39 172.48 2grm n ASN 161 N -2.17 0.62 -0.16 -1.43 5.15 -0.86 -4.41 115.26 112.00 2grm n ASN 161 Ca 0.01 -0.42 0.03 0.00 -0.60 0.00 0.00 54.58 53.61 2grm n ASN 161 Cb 0.14 1.01 0.05 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 -1.84 0.86 -3.78 3.44 0.24 -0.96 -5.01 118.33 111.28 2grm n VAL 162 Ca 0.02 -0.99 -0.13 0.00 -2.04 0.00 0.00 64.34 61.20 2grm n VAL 162 Cb 0.42 0.33 -0.12 0.00 -1.47 0.00 0.00 33.84 33.00 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 -1.20 0.98 0.19 1.34 2.96 -0.88 -5.08 118.68 117.00 2grm s LEU 163 Ca 0.11 0.43 -0.33 0.00 -0.22 0.00 0.00 54.13 54.12 2grm s LEU 163 Cb 0.10 0.69 -0.14 0.00 0.50 0.00 0.00 46.19 47.34 2grm s LEU 163 CO 0.01 -0.10 1.56 -0.81 -1.32 0.00 0.00 176.35 175.69 2grm n PRO 164 N 3.35 2.20 -0.31 0.98 -0.04 -1.26 -4.71 135.00 135.22 2grm n PRO 164 Ca -0.17 0.79 0.27 0.00 -0.04 0.00 0.00 63.50 64.35 2grm n PRO 164 Cb 0.57 -2.55 0.49 0.00 -0.04 0.00 0.00 33.50 31.97 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 3.10 0.99 0.25 0.54 9.36 -1.26 -0.19 117.16 129.95 2grm n TYR 165 Ca 0.15 1.12 0.10 0.00 3.32 0.00 0.00 57.90 62.59 2grm n TYR 165 Cb 0.30 -1.45 0.70 0.00 -0.63 0.00 0.00 39.34 38.26 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 0.03 2.98 4.57 -2.01 0.51 114.58 120.67 2grm h GLU 166 Ca 0.75 0.00 -0.22 0.00 -1.18 0.00 0.00 59.36 58.71 2grm h GLU 166 Cb 1.91 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.49 2grm h GLU 166 CO -0.76 0.00 -0.99 0.93 -1.18 0.00 0.00 179.01 177.02 2grm h GLU 167 N 0.00 0.19 0.00 1.92 5.08 -0.91 -3.30 114.58 117.55 2grm h GLU 167 Ca 0.02 -0.25 -0.16 0.00 -1.00 0.00 0.00 59.36 57.97 2grm h GLU 167 Cb 0.08 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 2grm h GLU 167 CO -0.00 1.03 -0.92 0.28 -1.00 0.00 0.00 179.01 178.40 2grm h VAL 168 N 0.09 1.03 -0.56 3.13 2.07 -1.39 -3.40 116.25 117.22 2grm h VAL 168 Ca -0.06 -2.55 0.05 0.00 0.82 0.00 0.00 66.70 64.96 2grm h VAL 168 Cb 1.66 2.46 -0.07 0.00 -1.52 0.00 0.00 31.29 33.83 2grm h VAL 168 CO 0.15 0.59 -0.36 -1.28 0.02 0.00 0.00 177.57 176.69 2grm h SER 169 N 0.00 -1.30 -0.37 0.57 0.87 -1.01 -1.11 113.55 111.20 2grm h SER 169 Ca -0.06 0.19 0.11 0.00 -1.23 0.00 0.00 61.79 60.80 2grm h SER 169 Cb 1.59 0.57 -0.01 0.00 -0.44 0.00 0.00 62.40 64.10 2grm h SER 169 CO 0.08 -0.16 0.32 0.77 -0.53 0.00 0.00 176.83 177.32 2grm h SER 170 N -0.04 0.00 0.50 6.23 4.64 -1.79 -1.94 113.55 121.16 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 0.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 2grm h SER 170 CO -0.54 0.00 -0.83 0.40 -0.87 0.00 0.00 176.83 174.99 2grm h ILE 171 N 0.00 1.46 0.02 0.95 1.08 -1.46 -3.36 117.51 116.20 2grm h ILE 171 Ca 0.17 -2.47 -0.00 0.00 -0.39 0.00 0.00 64.86 62.17 2grm h ILE 171 Cb 0.82 2.36 0.00 0.00 -3.07 0.00 0.00 36.82 36.93 2grm h ILE 171 CO -0.00 0.72 -0.01 0.40 -0.69 0.00 0.00 178.15 178.57 2grm h ILE 172 N 0.14 1.47 -0.98 -0.67 2.04 -1.07 -3.37 117.51 115.08 2grm h ILE 172 Ca -0.04 -1.61 0.30 0.00 1.00 0.00 0.00 64.86 64.50 2grm h ILE 172 Cb 1.44 2.54 -0.18 0.00 -0.74 0.00 0.00 36.82 39.88 2grm h ILE 172 CO 0.13 0.41 0.18 0.11 0.00 0.00 0.00 178.15 178.97 2grm h LYS 173 N -0.74 0.04 0.00 2.37 1.79 -1.66 0.80 116.57 119.18 2grm h LYS 173 Ca -0.00 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2grm h LYS 173 Cb 0.69 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.33 2grm h LYS 173 CO 0.00 0.02 0.00 -0.35 -1.08 0.00 0.00 179.45 178.05 2grm n PRO 174 N -5.40 0.67 -0.08 3.15 -0.04 -1.26 -3.05 135.00 128.99 2grm n PRO 174 Ca 0.26 0.01 0.12 0.00 -0.04 0.00 0.00 63.50 63.85 2grm n PRO 174 Cb 0.87 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 33.03 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 -1.02 2.31 -4.08 0.54 2.81 0.28 -4.94 117.12 113.01 2grm n MET 175 Ca 0.16 -1.93 -0.07 0.00 -1.81 0.00 0.00 57.70 54.05 2grm n MET 175 Cb 0.09 -1.48 -0.10 0.00 -0.71 0.00 0.00 33.22 31.02 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 -1.80 0.53 0.77 2.03 1.51 -1.17 -4.54 117.35 114.68 2grm s TYR 176 Ca 0.33 -1.05 -0.11 0.00 -1.01 0.00 0.00 57.07 55.23 2grm s TYR 176 Cb 0.21 -0.38 0.05 0.00 -0.11 0.00 0.00 41.96 41.74 2grm s TYR 176 CO 0.31 -0.41 1.08 -1.25 -1.11 0.00 0.00 175.55 174.17 2grm s PRO 177 N -3.93 2.30 0.20 -1.71 0.04 -1.26 -4.96 135.00 125.69 2grm s PRO 177 Ca 0.08 1.02 -0.14 0.00 0.04 0.00 0.00 61.00 62.00 2grm s PRO 177 Cb 0.08 -1.91 -0.08 0.00 0.04 0.00 0.00 34.50 32.63 2grm s PRO 177 CO -0.09 -1.57 0.61 0.42 0.04 0.00 0.00 177.00 176.42 2grm s ILE 178 N -2.97 4.79 0.00 0.56 1.01 -1.26 -5.00 121.20 118.33 2grm s ILE 178 Ca 0.60 0.86 0.00 0.00 0.00 0.00 0.00 60.65 62.12 2grm s ILE 178 Cb -0.16 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.59 2grm s ILE 178 CO 0.56 0.11 0.00 1.33 0.00 0.00 0.00 174.94 176.94 2grm n VAL 179 N 0.43 0.00 -3.87 2.92 0.24 -1.26 -4.95 118.33 111.84 2grm n VAL 179 Ca -0.02 -0.30 -0.09 0.00 -2.04 0.00 0.00 64.34 61.88 2grm n VAL 179 Cb 0.52 0.81 -0.06 0.00 -1.47 0.00 0.00 33.84 33.64 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 -1.29 -0.02 -0.06 -1.34 1.01 -1.26 -4.95 116.67 108.77 2grm s ASP 180 Ca 0.00 -0.71 -0.03 0.00 0.71 0.00 0.00 52.55 52.52 2grm s ASP 180 Cb 0.00 0.45 -0.04 0.00 1.01 0.00 0.00 42.92 44.34 2grm s ASP 180 CO 0.00 -0.89 0.09 -0.55 0.21 0.00 0.00 175.17 174.03 2grm s SER 181 N -2.92 5.83 -0.08 0.27 0.15 -1.26 -5.00 113.70 110.69 2grm s SER 181 Ca 0.12 0.25 0.22 0.00 0.70 0.00 0.00 55.95 57.24 2grm s SER 181 Cb 0.03 -1.75 0.44 0.00 -1.71 0.00 0.00 66.02 63.03 2grm s SER 181 CO -0.04 0.34 1.18 0.49 1.20 0.00 0.00 173.24 176.41 2grm n PHE 182 N 1.62 0.18 0.00 3.44 3.72 -1.26 -5.05 117.46 120.11 2grm n PHE 182 Ca -0.16 -0.91 0.00 0.00 -0.05 0.00 0.00 57.45 56.32 2grm n PHE 182 Cb 0.54 -0.18 0.00 0.00 -0.94 0.00 0.00 39.48 38.89 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 0.00 3.56 0.38 1.37 0.00 -1.26 -4.54 105.19 104.70 2grm n GLY 183 Ca 0.10 -1.81 -0.01 0.00 0.00 0.00 0.00 46.02 44.30 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 1.28 -0.28 1.61 1.79 -1.97 0.35 116.57 119.35 2grm h LYS 184 Ca 0.00 -0.08 -0.02 0.00 -2.18 0.00 0.00 60.65 58.38 2grm h LYS 184 Cb 0.00 -0.29 -0.01 0.00 -1.58 0.00 0.00 32.23 30.35 2grm h LYS 184 CO 0.00 0.84 0.12 -0.44 -1.08 0.00 0.00 179.45 178.89 2grm h ASP 185 N 1.31 0.39 -0.41 0.86 3.32 -1.99 -0.58 116.42 119.32 2grm h ASP 185 Ca 0.36 -0.16 -0.05 0.00 0.02 0.00 0.00 57.03 57.21 2grm h ASP 185 Cb -0.13 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.31 2grm h ASP 185 CO -0.09 0.44 0.07 0.22 -1.72 0.00 0.00 179.24 178.16 2grm h TYR 186 N 0.31 0.72 -0.23 4.55 5.03 -1.62 -1.91 116.97 123.82 2grm h TYR 186 Ca 0.10 -0.10 -0.01 0.00 2.58 0.00 0.00 58.73 61.29 2grm h TYR 186 Cb 0.17 -0.20 -0.01 0.00 1.55 0.00 0.00 36.73 38.24 2grm h TYR 186 CO -0.01 0.71 0.08 -0.44 -1.32 0.00 0.00 178.16 177.17 2grm h ASP 187 N 0.53 0.29 -0.03 -2.11 3.32 -0.12 -2.24 116.42 116.06 2grm h ASP 187 Ca 0.12 -0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.04 2grm h ASP 187 Cb 0.37 -0.07 0.01 0.00 0.22 0.00 0.00 39.33 39.86 2grm h ASP 187 CO 0.01 0.28 -0.42 0.25 -1.72 0.00 0.00 179.24 177.64 2grm h LEU 188 N 0.32 0.43 -1.12 1.55 7.12 -0.79 -3.14 115.31 119.69 2grm h LEU 188 Ca 0.08 -0.71 -0.08 0.00 0.13 0.00 0.00 57.88 57.30 2grm h LEU 188 Cb 0.10 -0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 40.09 2grm h LEU 188 CO -0.01 1.08 -0.40 0.71 -0.13 0.00 0.00 178.44 179.69 2grm h THR 189 N -0.19 1.10 0.00 1.05 1.35 -1.25 -1.84 112.91 113.13 2grm h THR 189 Ca -0.04 -1.46 -0.03 0.00 -0.55 0.00 0.00 66.41 64.33 2grm h THR 189 Cb 1.11 1.83 -0.00 0.00 -1.73 0.00 0.00 68.15 69.35 2grm h THR 189 CO 0.08 0.39 -0.12 0.16 -0.25 0.00 0.00 175.52 175.78 2grm h ILE 190 N 0.00 0.29 0.02 6.82 3.07 -1.46 -2.79 117.51 123.47 2grm h ILE 190 Ca -0.00 -0.89 -0.29 0.00 1.55 0.00 0.00 64.86 65.23 2grm h ILE 190 Cb 0.80 1.70 -0.04 0.00 -0.27 0.00 0.00 36.82 39.00 2grm h ILE 190 CO 0.05 0.12 -1.65 1.56 -1.05 0.00 0.00 178.15 177.18 2grm h GLN 191 N 0.00 0.04 -0.47 0.16 4.20 -1.40 -3.31 115.11 114.33 2grm h GLN 191 Ca -0.00 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 2grm h GLN 191 Cb 0.69 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.47 2grm h GLN 191 CO 0.02 0.65 0.23 1.15 -0.67 0.00 0.00 178.83 180.21 2grm h THR 192 N 0.01 1.19 -0.16 -0.54 2.02 -1.09 0.27 112.91 114.60 2grm h THR 192 Ca -0.27 -0.52 0.04 0.00 0.77 0.00 0.00 66.41 66.43 2grm h THR 192 Cb 1.99 0.67 -0.04 0.00 -1.74 0.00 0.00 68.15 69.03 2grm h THR 192 CO 0.09 0.20 -0.09 0.58 0.37 0.00 0.00 175.52 176.67 2grm h VAL 193 N 0.61 0.71 -0.52 3.16 2.07 -1.65 0.11 116.25 120.74 2grm h VAL 193 Ca 0.16 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.71 2grm h VAL 193 Cb 0.12 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 2grm h VAL 193 CO -0.02 0.00 0.29 -0.07 0.02 0.00 0.00 177.57 177.79 2grm h LEU 194 N -0.09 0.45 -0.59 2.57 3.38 -1.58 -0.22 115.31 119.24 2grm h LEU 194 Ca 0.09 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 2grm h LEU 194 Cb 0.23 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 2grm h LEU 194 CO -0.22 0.31 0.03 0.50 0.09 0.00 0.00 178.44 179.15 2grm h LYS 195 N 0.57 1.02 -0.12 1.13 3.11 -0.48 0.12 116.57 121.93 2grm h LYS 195 Ca 0.22 -0.31 -0.20 0.00 -2.81 0.00 0.00 60.65 57.55 2grm h LYS 195 Cb 0.07 -0.10 0.00 0.00 -1.00 0.00 0.00 32.23 31.20 2grm h LYS 195 CO -0.12 0.99 -0.74 -0.91 -2.81 0.00 0.00 179.45 175.86 2grm h ASN 196 N 0.91 0.68 0.02 4.20 2.35 -0.60 -2.56 115.58 120.58 2grm h ASN 196 Ca 0.17 -0.44 -0.15 0.00 -0.55 0.00 0.00 56.30 55.33 2grm h ASN 196 Cb 0.52 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 2grm h ASN 196 CO 0.03 1.21 -0.50 0.00 -1.65 0.00 0.00 177.43 176.52 2grm h ALA 197 N 0.78 0.76 -0.32 -0.83 0.00 -0.94 -1.72 119.26 117.00 2grm h ALA 197 Ca -0.04 -0.48 -0.10 0.00 0.00 0.00 0.00 54.91 54.29 2grm h ALA 197 Cb 1.34 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 2grm h ALA 197 CO 0.14 0.67 -0.22 1.25 0.00 0.00 0.00 179.25 181.10 2grm h LEU 198 N 0.43 0.60 -0.19 0.00 5.85 -0.75 -0.74 115.31 120.51 2grm h LEU 198 Ca 0.02 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.51 2grm h LEU 198 Cb 1.02 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.88 2grm h LEU 198 CO 0.09 0.82 0.01 0.74 -0.34 0.00 0.00 178.44 179.76 2grm h THR 199 N 0.53 1.25 -0.65 1.05 2.02 -1.26 -2.34 112.91 113.52 2grm h THR 199 Ca 0.08 -0.84 -0.00 0.00 0.77 0.00 0.00 66.41 66.42 2grm h THR 199 Cb 0.66 1.43 -0.03 0.00 -1.74 0.00 0.00 68.15 68.47 2grm h THR 199 CO 0.05 0.25 0.40 0.40 0.37 0.00 0.00 175.52 176.99 2grm h ILE 200 N 0.09 1.19 0.38 3.11 1.08 -1.08 -0.86 117.51 121.42 2grm h ILE 200 Ca 0.05 -0.41 -0.01 0.00 -0.39 0.00 0.00 64.86 64.11 2grm h ILE 200 Cb 0.37 0.28 -0.01 0.00 -3.07 0.00 0.00 36.82 34.40 2grm h ILE 200 CO 0.01 0.19 -0.27 0.28 -0.69 0.00 0.00 178.15 177.67 2grm h SER 201 N 0.88 -0.70 -0.99 1.72 0.02 -1.08 -2.04 113.55 111.37 2grm h SER 201 Ca 0.23 0.05 0.06 0.00 -0.84 0.00 0.00 61.79 61.30 2grm h SER 201 Cb -0.03 0.22 -0.07 0.00 0.14 0.00 0.00 62.40 62.66 2grm h SER 201 CO -0.04 -0.41 0.64 0.40 -1.14 0.00 0.00 176.83 176.27 2grm h ILE 202 N -0.64 1.09 0.00 3.27 1.08 -1.29 0.02 117.51 121.05 2grm h ILE 202 Ca -0.03 -0.40 -0.02 0.00 -0.39 0.00 0.00 64.86 64.01 2grm h ILE 202 Cb 0.54 -0.18 -0.00 0.00 -3.07 0.00 0.00 36.82 34.11 2grm h ILE 202 CO 0.01 0.21 -0.10 -0.03 -0.69 0.00 0.00 178.15 177.56 2grm h MET 203 N 1.17 0.00 -0.64 2.37 4.05 -0.86 -1.30 114.93 119.72 2grm h MET 203 Ca 0.42 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.84 2grm h MET 203 Cb 0.15 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.95 2grm h MET 203 CO -0.17 0.10 0.00 0.09 0.23 0.00 0.00 176.91 177.16 2grm n ASN 204 N -3.49 3.72 -0.06 1.39 5.03 -0.14 -4.92 115.26 116.78 2grm n ASN 204 Ca -0.01 -2.00 -0.01 0.00 0.87 0.00 0.00 54.58 53.43 2grm n ASN 204 Cb 0.24 -0.42 -0.00 0.00 -1.02 0.00 0.00 39.78 38.57 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 1.40 -1.97 -2.25 3.52 0.63 -0.39 -4.82 116.66 112.78 2grm n ARG 205 Ca 0.22 0.42 -0.33 0.00 -0.92 0.00 0.00 57.85 57.23 2grm n ARG 205 Cb 0.58 -4.50 -0.04 0.00 0.45 0.00 0.00 32.46 28.95 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 -1.61 5.67 0.39 6.15 3.84 -0.55 -4.76 114.94 124.07 2grm s ASN 206 Ca 0.00 -1.73 0.18 0.00 0.21 0.00 0.00 52.86 51.52 2grm s ASN 206 Cb 0.00 -2.58 0.80 0.00 -0.55 0.00 0.00 41.25 38.92 2grm s ASN 206 CO 0.00 -2.38 1.81 -0.07 -2.79 0.00 0.00 177.10 173.67 2grm h LEU 207 N 15.93 0.00 -1.06 3.21 3.38 -1.88 -2.47 115.31 132.42 2grm h LEU 207 Ca 0.26 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.19 2grm h LEU 207 Cb 0.93 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.66 2grm h LEU 207 CO 1.30 0.35 0.17 0.50 0.09 0.00 0.00 178.44 180.85 2grm h LYS 208 N 0.00 0.84 0.01 1.13 3.64 -1.97 -0.40 116.57 119.81 2grm h LYS 208 Ca -0.00 -0.15 -0.00 0.00 -1.27 0.00 0.00 60.65 59.22 2grm h LYS 208 Cb 0.75 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 2grm h LYS 208 CO 0.05 0.73 -0.00 0.93 -2.27 0.00 0.00 179.45 178.88 2grm h GLU 209 N 0.81 -0.01 -0.82 1.90 4.39 -1.94 -3.06 114.58 115.86 2grm h GLU 209 Ca 0.18 0.00 0.18 0.00 0.34 0.00 0.00 59.36 60.06 2grm h GLU 209 Cb 0.25 0.00 -0.11 0.00 -0.10 0.00 0.00 28.75 28.79 2grm h GLU 209 CO -0.01 0.75 0.32 0.00 -1.16 0.00 0.00 179.01 178.91 2grm h ALA 210 N 0.16 1.20 -0.90 3.43 0.00 -1.31 0.58 119.26 122.42 2grm h ALA 210 Ca -0.00 0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.09 2grm h ALA 210 Cb 0.77 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.64 2grm h ALA 210 CO 0.00 -0.28 0.58 0.37 0.00 0.00 0.00 179.25 179.92 2grm h GLN 211 N 0.40 1.09 0.07 0.00 5.75 -1.13 -1.56 115.11 119.73 2grm h GLN 211 Ca 0.48 -0.07 -0.00 0.00 -0.15 0.00 0.00 58.65 58.91 2grm h GLN 211 Cb 0.81 -0.25 0.00 0.00 1.07 0.00 0.00 27.48 29.12 2grm h GLN 211 CO -0.48 0.72 -0.03 -0.92 -2.65 0.00 0.00 178.83 175.47 2grm h TYR 212 N 1.12 -0.09 -0.73 3.99 3.20 0.21 -1.74 116.97 122.94 2grm h TYR 212 Ca 0.36 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.21 2grm h TYR 212 Cb 0.02 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.28 2grm h TYR 212 CO -0.02 0.07 0.38 1.88 -1.64 0.00 0.00 178.16 178.83 2grm h TYR 213 N -0.23 1.01 -0.24 -3.82 0.05 -1.04 0.51 116.97 113.22 2grm h TYR 213 Ca -0.01 -0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.74 2grm h TYR 213 Cb 0.20 -0.32 -0.01 0.00 1.01 0.00 0.00 36.73 37.61 2grm h TYR 213 CO -0.03 0.71 0.14 0.82 -1.05 0.00 0.00 178.16 178.76 2grm h ILE 214 N 1.02 1.09 -0.80 -2.88 2.04 -1.05 -0.27 117.51 116.66 2grm h ILE 214 Ca 0.26 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.88 2grm h ILE 214 Cb 0.06 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 36.92 2grm h ILE 214 CO -0.04 0.09 0.49 0.78 0.00 0.00 0.00 178.15 179.48 2grm h ASN 215 N 0.29 0.96 -0.79 1.72 -0.26 -0.77 0.93 115.58 117.67 2grm h ASN 215 Ca 0.08 -0.06 0.02 0.00 -0.56 0.00 0.00 56.30 55.78 2grm h ASN 215 Cb 0.03 -0.24 -0.04 0.00 -1.06 0.00 0.00 38.32 37.00 2grm h ASN 215 CO -0.02 0.73 0.51 1.56 -1.06 0.00 0.00 177.43 179.16 2grm h GLN 216 N 1.10 0.99 -0.21 0.81 1.08 -0.27 0.73 115.11 119.35 2grm h GLN 216 Ca 0.29 -0.06 -0.04 0.00 -1.45 0.00 0.00 58.65 57.39 2grm h GLN 216 Cb -0.05 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 27.14 2grm h GLN 216 CO -0.06 0.66 -0.03 0.35 -0.95 0.00 0.00 178.83 178.80 2grm h PHE 217 N 1.02 0.43 -0.86 2.96 3.57 -0.47 -2.71 116.94 120.89 2grm h PHE 217 Ca 0.30 -0.09 0.12 0.00 3.53 0.00 0.00 57.97 61.83 2grm h PHE 217 Cb -0.06 -0.11 -0.06 0.00 2.79 0.00 0.00 35.95 38.51 2grm h PHE 217 CO -0.02 0.62 0.56 1.49 -2.23 0.00 0.00 178.31 178.72 2grm h GLU 218 N 0.12 0.73 -0.70 1.11 4.57 -0.27 0.50 114.58 120.63 2grm h GLU 218 Ca 0.05 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.16 2grm h GLU 218 Cb 0.47 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.86 2grm h GLU 218 CO 0.02 0.48 0.33 1.25 -1.18 0.00 0.00 179.01 179.91 2grm h HIS 219 N 0.75 0.99 -0.71 0.92 2.76 -0.56 -2.62 115.15 116.67 2grm h HIS 219 Ca 0.41 -0.04 0.13 0.00 -2.20 0.00 0.00 60.37 58.67 2grm h HIS 219 Cb 0.56 -0.31 -0.05 0.00 1.55 0.00 0.00 27.41 29.16 2grm h HIS 219 CO -0.00 0.72 0.47 -0.07 -1.30 0.00 0.00 177.93 177.75 2grm h LEU 220 N 0.99 0.42 -1.65 0.26 4.07 -0.63 0.22 115.31 118.99 2grm h LEU 220 Ca 0.24 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.22 2grm h LEU 220 Cb 0.10 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 41.78 2grm h LEU 220 CO -0.03 0.23 0.00 0.11 -1.08 0.00 0.00 178.44 177.67 2grm h LYS 221 N 0.45 0.00 0.04 1.13 1.57 -1.46 -2.07 116.57 116.23 2grm h LYS 221 Ca 0.34 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.89 2grm h LYS 221 Cb 0.70 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.01 2grm h LYS 221 CO -0.11 0.00 -1.02 1.15 -0.57 0.00 0.00 179.45 178.90 2grm h THR 222 N 0.00 1.46 -2.91 -0.16 2.02 -0.67 -3.46 112.91 109.19 2grm h THR 222 Ca 0.00 -2.69 -0.53 0.00 0.77 0.00 0.00 66.41 63.96 2grm h THR 222 Cb 0.21 2.60 0.03 0.00 -1.74 0.00 0.00 68.15 69.25 2grm h THR 222 CO 0.00 0.79 0.80 -0.63 0.37 0.00 0.00 175.52 176.86 2grm s ILE 223 N -3.06 3.04 0.23 3.11 1.01 -0.78 -4.97 121.20 119.78 2grm s ILE 223 Ca -0.04 0.73 -0.30 0.00 0.00 0.00 0.00 60.65 61.04 2grm s ILE 223 Cb 0.09 -3.47 -0.09 0.00 0.01 0.00 0.00 42.46 39.00 2grm s ILE 223 CO 0.86 0.05 1.30 -0.75 0.00 0.00 0.00 174.94 176.40 2grm s LYS 224 N 1.26 4.40 -0.74 2.79 2.20 -1.26 -3.25 119.74 125.12 2grm s LYS 224 Ca 0.67 2.08 0.00 0.00 -0.36 0.00 0.00 55.97 58.36 2grm s LYS 224 Cb -0.39 -3.17 0.00 0.00 -1.51 0.00 0.00 37.83 32.76 2grm s LYS 224 CO 0.31 -0.21 0.00 0.09 -0.36 0.00 0.00 175.35 175.17 2grm n ASN 225 N 2.15 -4.39 -4.67 1.43 4.13 -1.26 -4.58 115.26 108.08 2grm n ASN 225 Ca 0.04 0.17 -0.39 0.00 1.68 0.00 0.00 54.58 56.09 2grm n ASN 225 Cb 0.43 -2.50 -0.07 0.00 -1.54 0.00 0.00 39.78 36.09 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 -2.08 5.13 -0.66 2.41 2.07 -1.20 -4.89 121.20 121.97 2grm s ILE 226 Ca 0.00 0.90 -0.24 0.00 -1.41 0.00 0.00 60.65 59.90 2grm s ILE 226 Cb 0.00 -3.82 0.06 0.00 0.13 0.00 0.00 42.46 38.83 2grm s ILE 226 CO 0.00 0.20 1.03 -0.44 -1.91 0.00 0.00 174.94 173.82 2grm s SER 227 N 1.12 6.19 -0.23 4.50 0.01 -1.26 -5.00 113.70 119.03 2grm s SER 227 Ca 0.23 -0.79 -0.29 0.00 1.31 0.00 0.00 55.95 56.41 2grm s SER 227 Cb -0.15 -2.45 0.01 0.00 0.21 0.00 0.00 66.02 63.63 2grm s SER 227 CO 0.09 -1.51 1.09 -0.63 0.41 0.00 0.00 173.24 172.69 2grm s ILE 228 N 4.43 4.58 0.08 1.44 -1.09 -1.26 -4.68 121.20 124.70 2grm s ILE 228 Ca 0.26 1.90 -0.31 0.00 -2.23 0.00 0.00 60.65 60.28 2grm s ILE 228 Cb -0.14 -4.27 -0.08 0.00 -1.58 0.00 0.00 42.46 36.38 2grm s ILE 228 CO 0.12 -0.21 1.66 0.21 -1.23 0.00 0.00 174.94 175.49 2grm s ASN 229 N 1.41 6.59 0.04 3.58 3.84 -1.26 -4.94 114.94 124.21 2grm s ASN 229 Ca 0.46 2.51 -0.16 0.00 0.21 0.00 0.00 52.86 55.88 2grm s ASN 229 Cb -0.16 -2.56 -0.07 0.00 -0.55 0.00 0.00 41.25 37.91 2grm s ASN 229 CO 0.09 -0.89 1.26 1.23 -2.79 0.00 0.00 177.10 175.99 2grm h GLY 230 N 8.49 -1.11 -0.45 1.21 0.00 -1.98 -0.83 103.07 108.41 2grm h GLY 230 Ca -0.43 0.53 0.07 0.00 0.00 0.00 0.00 47.33 47.50 2grm h GLY 230 CO 0.93 -0.35 -0.49 0.00 0.00 0.00 0.00 176.54 176.63 2grm h TYR 232 N -0.31 -0.17 -0.11 0.00 0.99 -1.96 0.29 116.97 115.70 2grm h TYR 232 Ca 0.13 0.05 0.03 0.00 2.00 0.00 0.00 58.73 60.94 2grm h TYR 232 Cb 0.58 0.16 -0.00 0.00 1.00 0.00 0.00 36.73 38.46 2grm h TYR 232 CO -0.72 -0.20 0.11 0.22 -0.00 0.00 0.00 178.16 177.58 2grm h ASP 233 N 0.06 0.00 0.13 3.88 3.58 0.50 0.77 116.42 125.33 2grm h ASP 233 Ca 0.29 0.00 -0.25 0.00 0.42 0.00 0.00 57.03 57.49 2grm h ASP 233 Cb 0.45 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.51 2grm h ASP 233 CO -0.54 0.00 -1.22 0.25 -2.88 0.00 0.00 179.24 174.85 2grm h LEU 234 N 0.00 0.41 -0.43 2.28 5.85 0.81 -2.80 115.31 121.44 2grm h LEU 234 Ca 0.05 -0.88 -0.13 0.00 0.84 0.00 0.00 57.88 57.77 2grm h LEU 234 Cb 0.27 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 2grm h LEU 234 CO -0.00 1.55 -0.22 -0.08 -0.34 0.00 0.00 178.44 179.34 2grm h GLU 235 N -0.33 0.91 -0.48 1.25 4.81 0.07 -1.88 114.58 118.94 2grm h GLU 235 Ca -0.25 -0.40 -0.09 0.00 -0.13 0.00 0.00 59.36 58.48 2grm h GLU 235 Cb 1.73 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 31.07 2grm h GLU 235 CO 0.09 1.06 -0.06 0.82 -0.73 0.00 0.00 179.01 180.18 2grm h ILE 236 N 0.73 1.26 -0.04 2.32 2.04 0.37 -1.27 117.51 122.92 2grm h ILE 236 Ca 0.09 -1.12 -0.05 0.00 1.00 0.00 0.00 64.86 64.77 2grm h ILE 236 Cb 0.80 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 2grm h ILE 236 CO 0.07 0.39 -0.22 -1.13 0.00 0.00 0.00 178.15 177.26 2grm h ASN 237 N 0.76 0.07 -0.18 1.72 -0.73 -1.27 0.17 115.58 116.12 2grm h ASN 237 Ca 0.14 -0.02 -0.13 0.00 1.87 0.00 0.00 56.30 58.16 2grm h ASN 237 Cb 0.55 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 39.12 2grm h ASN 237 CO 0.03 0.30 -0.39 0.22 -0.37 0.00 0.00 177.43 177.22 2grm h TYR 238 N 0.07 0.75 -0.11 0.67 5.03 -0.75 -2.58 116.97 120.05 2grm h TYR 238 Ca 0.01 -0.28 -0.04 0.00 2.58 0.00 0.00 58.73 61.01 2grm h TYR 238 Cb 0.44 -0.14 -0.01 0.00 1.55 0.00 0.00 36.73 38.57 2grm h TYR 238 CO 0.00 1.03 -0.10 -0.07 -1.32 0.00 0.00 178.16 177.70 2grm h LEU 239 N 0.25 0.15 -0.42 2.82 3.38 -0.39 -1.35 115.31 119.75 2grm h LEU 239 Ca 0.00 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2grm h LEU 239 Cb 0.99 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 2grm h LEU 239 CO 0.09 0.27 0.22 0.11 0.09 0.00 0.00 178.44 179.22 2grm h LYS 240 N 0.16 0.60 0.58 1.13 1.57 -0.77 -0.27 116.57 119.56 2grm h LYS 240 Ca 0.03 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 2grm h LYS 240 Cb 0.28 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 2grm h LYS 240 CO 0.02 0.50 -0.41 1.96 -0.57 0.00 0.00 179.45 180.94 2grm h GLN 241 N 0.54 -0.92 -0.38 3.15 1.08 -0.87 -0.50 115.11 117.21 2grm h GLN 241 Ca 0.15 0.06 0.11 0.00 -1.45 0.00 0.00 58.65 57.52 2grm h GLN 241 Cb 0.09 0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 27.71 2grm h GLN 241 CO -0.02 -0.61 0.29 0.82 -0.95 0.00 0.00 178.83 178.36 2grm h ILE 242 N -0.96 0.72 0.03 2.54 2.04 -1.32 -0.66 117.51 119.90 2grm h ILE 242 Ca -0.07 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.79 2grm h ILE 242 Cb 0.80 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 2grm h ILE 242 CO 0.03 0.00 -0.01 0.22 0.00 0.00 0.00 178.15 178.39 2grm h TYR 243 N 0.00 -0.03 -0.02 1.37 3.20 0.10 -1.03 116.97 120.56 2grm h TYR 243 Ca 0.18 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 2grm h TYR 243 Cb 0.77 0.01 -0.00 0.00 1.54 0.00 0.00 36.73 39.05 2grm h TYR 243 CO 0.00 0.22 -0.02 1.96 -1.64 0.00 0.00 178.16 178.69 2grm h GLN 244 N -0.29 0.03 -0.16 1.82 4.20 0.28 -1.28 115.11 119.70 2grm h GLN 244 Ca -0.00 -0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.62 2grm h GLN 244 Cb 0.28 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.05 2grm h GLN 244 CO 0.01 0.05 -0.22 0.35 -0.67 0.00 0.00 178.83 178.35 2grm h PHE 245 N 0.03 0.53 0.00 2.96 3.57 -0.85 -1.08 116.94 122.09 2grm h PHE 245 Ca 0.01 -0.17 -0.05 0.00 3.53 0.00 0.00 57.97 61.28 2grm h PHE 245 Cb 0.05 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 2grm h PHE 245 CO 0.00 0.84 -0.25 -0.07 -2.23 0.00 0.00 178.31 176.60 2grm h LEU 246 N 0.06 0.00 0.11 0.59 3.38 -0.68 0.15 115.31 118.93 2grm h LEU 246 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2grm h LEU 246 Cb 0.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.53 2grm h LEU 246 CO 0.05 0.25 -0.05 0.74 0.09 0.00 0.00 178.44 179.52 2grm h THR 247 N 0.00 0.00 -0.44 0.22 2.02 -1.07 -3.40 112.91 110.25 2grm h THR 247 Ca -0.00 -0.36 -0.07 0.00 0.77 0.00 0.00 66.41 66.75 2grm h THR 247 Cb 0.48 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 66.85 2grm h THR 247 CO 0.03 0.00 0.05 0.47 0.37 0.00 0.00 175.52 176.45 2grm n ASP 248 N -3.39 4.27 -2.92 4.18 8.00 -0.42 -4.94 116.55 121.31 2grm n ASP 248 Ca -0.02 -3.14 -0.10 0.00 0.71 0.00 0.00 54.79 52.24 2grm n ASP 248 Cb 0.06 -0.63 -0.02 0.00 -0.02 0.00 0.00 41.12 40.51 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 -0.31 -2.41 -2.42 -1.24 4.76 0.54 -4.83 118.16 112.24 2grm n LYS 249 Ca 0.28 0.03 -0.42 0.00 -2.87 0.00 0.00 58.31 55.34 2grm n LYS 249 Cb 1.08 -4.42 -0.03 0.00 -1.84 0.00 0.00 35.03 29.82 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 -2.24 7.10 0.11 4.39 3.84 -1.25 -4.96 114.94 121.94 2grm s ASN 250 Ca 0.19 2.07 -0.05 0.00 0.21 0.00 0.00 52.86 55.28 2grm s ASN 250 Cb -0.11 -2.59 -0.15 0.00 -0.55 0.00 0.00 41.25 37.85 2grm s ASN 250 CO 0.24 -0.42 1.26 -0.29 -2.79 0.00 0.00 177.10 175.10 2grm h ILE 251 N 4.25 1.41 -0.34 -5.21 2.10 -1.95 -3.23 117.51 114.54 2grm h ILE 251 Ca -0.43 -2.55 0.07 0.00 1.08 0.00 0.00 64.86 63.04 2grm h ILE 251 Cb 1.21 2.53 -0.07 0.00 -1.09 0.00 0.00 36.82 39.40 2grm h ILE 251 CO 0.79 0.76 -0.15 0.44 -1.08 0.00 0.00 178.15 178.90 2grm h ASP 252 N 0.21 -0.52 -0.81 2.19 3.45 -2.00 -0.46 116.42 118.49 2grm h ASP 252 Ca -0.10 0.13 0.11 0.00 0.43 0.00 0.00 57.03 57.60 2grm h ASP 252 Cb 1.68 0.29 -0.08 0.00 -0.56 0.00 0.00 39.33 40.66 2grm h ASP 252 CO 0.18 -0.19 0.43 0.28 -1.57 0.00 0.00 179.24 178.37 2grm h SER 253 N -0.10 0.58 -0.56 6.45 0.02 -1.90 -0.01 113.55 118.03 2grm h SER 253 Ca 0.17 0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 61.15 2grm h SER 253 Cb 0.36 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.84 2grm h SER 253 CO -0.40 0.30 0.22 0.22 -1.14 0.00 0.00 176.83 176.03 2grm h TYR 254 N 0.69 0.86 0.09 3.45 5.03 -1.27 -0.98 116.97 124.85 2grm h TYR 254 Ca 0.41 -0.07 -0.00 0.00 2.58 0.00 0.00 58.73 61.65 2grm h TYR 254 Cb 0.46 -0.26 0.00 0.00 1.55 0.00 0.00 36.73 38.48 2grm h TYR 254 CO -0.08 0.70 -0.04 -0.07 -1.32 0.00 0.00 178.16 177.35 2grm h LEU 255 N 0.77 -0.10 -0.67 2.82 3.38 0.28 -1.80 115.31 120.00 2grm h LEU 255 Ca 0.19 -0.04 0.13 0.00 0.09 0.00 0.00 57.88 58.25 2grm h LEU 255 Cb 0.21 0.03 -0.10 0.00 0.09 0.00 0.00 40.66 40.89 2grm h LEU 255 CO -0.01 -0.03 0.17 0.78 0.09 0.00 0.00 178.44 179.43 2grm h ASN 256 N -0.16 0.04 -0.70 -0.43 -0.26 -0.86 0.55 115.58 113.75 2grm h ASN 256 Ca -0.01 0.12 0.05 0.00 -0.56 0.00 0.00 56.30 55.90 2grm h ASN 256 Cb 0.13 0.16 -0.05 0.00 -1.06 0.00 0.00 38.32 37.50 2grm h ASN 256 CO 0.02 0.01 0.41 0.00 -1.06 0.00 0.00 177.43 176.81 2grm h ALA 257 N 1.53 0.94 -0.51 -0.83 0.00 -0.78 0.20 119.26 119.81 2grm h ALA 257 Ca 0.36 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 55.15 2grm h ALA 257 Cb 0.57 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2grm h ALA 257 CO -0.44 0.12 -0.16 0.28 0.00 0.00 0.00 179.25 179.05 2grm h VAL 258 N 0.77 1.27 -0.64 0.00 2.07 -0.12 -2.24 116.25 117.36 2grm h VAL 258 Ca 0.30 -1.32 -0.02 0.00 0.82 0.00 0.00 66.70 66.48 2grm h VAL 258 Cb 0.14 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 2grm h VAL 258 CO -0.16 0.46 0.30 -1.13 0.02 0.00 0.00 177.57 177.06 2grm h ASN 259 N 0.87 0.84 0.25 0.57 -0.00 0.11 -1.44 115.58 116.78 2grm h ASN 259 Ca 0.12 -0.13 -0.00 0.00 -0.00 0.00 0.00 56.30 56.29 2grm h ASN 259 Cb 0.73 -0.21 -0.01 0.00 -0.00 0.00 0.00 38.32 38.83 2grm h ASN 259 CO 0.06 0.74 -0.18 0.40 -0.00 0.00 0.00 177.43 178.44 2grm h ILE 260 N 0.88 0.61 -1.04 2.57 1.08 -0.47 -1.05 117.51 120.10 2grm h ILE 260 Ca 0.22 0.00 0.27 0.00 -0.39 0.00 0.00 64.86 64.96 2grm h ILE 260 Cb 0.13 0.61 -0.08 0.00 -3.07 0.00 0.00 36.82 34.41 2grm h ILE 260 CO -0.03 0.00 0.68 0.40 -0.69 0.00 0.00 178.15 178.52 2grm h ILE 261 N -0.43 0.53 0.01 -0.67 2.04 -1.06 0.13 117.51 118.05 2grm h ILE 261 Ca -0.02 -0.11 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 2grm h ILE 261 Cb 0.37 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.63 2grm h ILE 261 CO 0.00 0.06 -0.00 -1.13 0.00 0.00 0.00 178.15 177.08 2grm h ASN 262 N 0.32 -0.01 -1.00 1.72 -1.24 -0.13 -3.06 115.58 112.18 2grm h ASN 262 Ca 0.57 -0.26 0.21 0.00 0.71 0.00 0.00 56.30 57.53 2grm h ASN 262 Cb 1.58 0.00 -0.11 0.00 0.73 0.00 0.00 38.32 40.53 2grm h ASN 262 CO -0.23 0.26 0.61 0.40 -1.29 0.00 0.00 177.43 177.18 2grm h ILE 263 N -0.27 0.65 0.00 2.57 1.08 0.09 0.27 117.51 121.90 2grm h ILE 263 Ca -0.00 -0.23 -0.01 0.00 -0.39 0.00 0.00 64.86 64.23 2grm h ILE 263 Cb 0.27 -0.08 -0.00 0.00 -3.07 0.00 0.00 36.82 33.94 2grm h ILE 263 CO 0.00 0.12 -0.04 -0.26 -0.69 0.00 0.00 178.15 177.29 2grm h PHE 264 N 0.67 0.00 0.00 1.37 0.04 -1.37 -0.50 116.94 117.16 2grm h PHE 264 Ca 0.59 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 61.27 2grm h PHE 264 Cb 1.05 0.00 0.01 0.00 2.20 0.00 0.00 35.95 39.21 2grm h PHE 264 CO -0.00 0.04 -0.35 -0.22 -0.60 0.00 0.00 178.31 177.18 2grm h LYS 265 N 0.00 0.23 -0.97 1.51 3.64 -0.51 0.12 116.57 120.58 2grm h LYS 265 Ca -0.00 -0.25 0.07 0.00 -1.27 0.00 0.00 60.65 59.20 2grm h LYS 265 Cb 0.07 0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 31.89 2grm h LYS 265 CO 0.00 0.98 0.62 0.82 -2.27 0.00 0.00 179.45 179.61 2grm h ILE 266 N -0.42 1.05 -0.01 2.00 1.08 -0.69 -2.18 117.51 118.33 2grm h ILE 266 Ca -0.04 -0.37 0.00 0.00 -0.39 0.00 0.00 64.86 64.05 2grm h ILE 266 Cb 1.11 -0.13 0.00 0.00 -3.07 0.00 0.00 36.82 34.72 2grm h ILE 266 CO 0.07 0.20 -0.05 2.30 -0.69 0.00 0.00 178.15 179.98 2grm n ILE 267 N -4.51 0.00 -0.25 -0.67 -5.35 -0.26 -4.95 119.36 103.37 2grm n ILE 267 Ca 0.15 -0.18 0.00 0.00 -0.27 0.00 0.00 62.75 62.45 2grm n ILE 267 Cb 0.22 0.29 0.00 0.00 -1.74 0.00 0.00 39.64 38.41 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 1.18 0.64 3.44 3.28 0.00 -0.82 -5.00 105.19 107.92 2grm n GLY 268 Ca 0.18 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 -2.01 2.27 0.02 1.61 4.76 0.39 -4.83 118.16 120.37 2grm n LYS 269 Ca 0.00 -2.69 -0.10 0.00 -2.87 0.00 0.00 58.31 52.65 2grm n LYS 269 Cb 0.00 -3.51 -0.06 0.00 -1.84 0.00 0.00 35.03 29.62 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 8.39 -0.40 -0.72 1.97 4.39 -1.92 -1.71 114.58 124.58 2grm h GLU 270 Ca 0.36 0.03 0.02 0.00 0.34 0.00 0.00 59.36 60.11 2grm h GLU 270 Cb 0.85 0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 29.55 2grm h GLU 270 CO 1.46 -0.27 0.46 -0.44 -1.16 0.00 0.00 179.01 179.06 2grm h ASP 271 N -0.42 0.78 -0.96 1.42 3.32 -1.96 -1.03 116.42 117.57 2grm h ASP 271 Ca 0.01 -0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.07 2grm h ASP 271 Cb 0.46 -0.18 -0.05 0.00 0.22 0.00 0.00 39.33 39.78 2grm h ASP 271 CO -0.25 0.55 0.64 0.40 -1.72 0.00 0.00 179.24 178.85 2grm h ILE 272 N 0.92 1.23 0.42 0.35 1.08 -1.92 0.29 117.51 119.88 2grm h ILE 272 Ca 0.28 -0.44 -0.02 0.00 -0.39 0.00 0.00 64.86 64.29 2grm h ILE 272 Cb -0.04 -0.17 0.00 0.00 -3.07 0.00 0.00 36.82 33.55 2grm h ILE 272 CO -0.09 0.23 -0.20 -0.74 -0.69 0.00 0.00 178.15 176.67 2grm h HIS 273 N 1.28 -0.52 -0.68 1.37 2.76 -0.76 0.05 115.15 118.66 2grm h HIS 273 Ca 0.36 -0.01 0.15 0.00 -2.20 0.00 0.00 60.37 58.66 2grm h HIS 273 Cb -0.12 0.17 -0.11 0.00 1.55 0.00 0.00 27.41 28.90 2grm h HIS 273 CO -0.00 -0.20 0.05 -0.09 -1.30 0.00 0.00 177.93 176.39 2grm h ARG 274 N -0.84 0.15 0.70 5.26 2.43 -0.93 -0.99 114.38 120.16 2grm h ARG 274 Ca -0.06 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.08 2grm h ARG 274 Cb 0.55 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.06 2grm h ARG 274 CO 0.09 0.10 -0.45 1.03 -1.51 0.00 0.00 179.97 179.23 2grm h SER 275 N 0.15 -1.15 0.40 -3.80 0.87 -0.19 -2.41 113.55 107.42 2grm h SER 275 Ca 0.37 0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.99 2grm h SER 275 Cb 0.61 0.34 -0.00 0.00 -0.44 0.00 0.00 62.40 62.91 2grm h SER 275 CO -0.55 -0.69 -0.01 -0.07 -0.53 0.00 0.00 176.83 174.97 2grm h LEU 276 N -1.09 0.00 0.09 2.23 3.38 -0.58 -1.80 115.31 117.53 2grm h LEU 276 Ca -0.09 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 2grm h LEU 276 Cb 0.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.63 2grm h LEU 276 CO 0.08 0.01 -0.04 0.58 0.09 0.00 0.00 178.44 179.16 2grm h VAL 277 N 0.00 0.99 -0.01 1.22 2.07 -0.99 -1.07 116.25 118.46 2grm h VAL 277 Ca -0.00 -1.43 0.00 0.00 0.82 0.00 0.00 66.70 66.09 2grm h VAL 277 Cb 0.22 1.76 -0.00 0.00 -1.52 0.00 0.00 31.29 31.74 2grm h VAL 277 CO 0.00 0.29 0.05 -0.33 0.02 0.00 0.00 177.57 177.60 2grm h GLU 278 N -0.90 0.00 0.00 1.57 5.08 -1.22 -0.15 114.58 118.96 2grm h GLU 278 Ca -0.01 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 2grm h GLU 278 Cb 0.57 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 2grm h GLU 278 CO 0.02 0.00 -0.25 1.49 -1.00 0.00 0.00 179.01 179.27 2grm h GLU 279 N 0.00 0.00 0.00 2.33 4.81 -1.27 -3.07 114.58 117.39 2grm h GLU 279 Ca 0.01 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 2grm h GLU 279 Cb 0.11 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.48 2grm h GLU 279 CO -0.00 0.89 -0.09 1.25 -0.73 0.00 0.00 179.01 180.33 2grm h LEU 280 N -1.00 0.00 0.76 1.64 5.85 -0.53 -1.53 115.31 120.50 2grm h LEU 280 Ca -0.07 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.62 2grm h LEU 280 Cb 0.96 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.99 2grm h LEU 280 CO -0.04 0.09 -0.36 0.74 -0.34 0.00 0.00 178.44 178.53 2grm h THR 281 N 0.00 0.06 -0.33 1.05 2.02 -1.14 -1.41 112.91 113.17 2grm h THR 281 Ca -0.00 -0.23 0.07 0.00 0.77 0.00 0.00 66.41 67.01 2grm h THR 281 Cb 0.17 0.08 -0.06 0.00 -1.74 0.00 0.00 68.15 66.60 2grm h THR 281 CO 0.01 0.01 -0.09 0.11 0.37 0.00 0.00 175.52 175.92 2grm h LYS 282 N -1.23 -0.02 -0.42 6.66 1.57 -1.36 -0.04 116.57 121.72 2grm h LYS 282 Ca -0.10 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 2grm h LYS 282 Cb 0.79 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.08 2grm h LYS 282 CO 0.17 -0.01 0.23 0.97 -0.57 0.00 0.00 179.45 180.24 2grm h ILE 283 N -0.02 1.13 -0.20 1.86 -0.00 -1.34 -1.67 117.51 117.28 2grm h ILE 283 Ca 0.16 -0.33 -0.18 0.00 -0.00 0.00 0.00 64.86 64.51 2grm h ILE 283 Cb 0.26 0.56 -0.00 0.00 -0.00 0.00 0.00 36.82 37.64 2grm h ILE 283 CO -0.35 0.14 -0.59 0.28 -0.00 0.00 0.00 178.15 177.63 2grm h SER 284 N 0.58 0.73 0.68 2.19 0.02 -0.02 -2.97 113.55 114.76 2grm h SER 284 Ca 0.15 -0.41 -0.03 0.00 -0.84 0.00 0.00 61.79 60.66 2grm h SER 284 Cb 0.02 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.34 2grm h SER 284 CO -0.03 1.16 -0.44 0.00 -1.14 0.00 0.00 176.83 176.38 2grm h ALA 285 N 0.85 -1.22 0.00 3.77 0.00 -0.20 0.02 119.26 122.48 2grm h ALA 285 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2grm h ALA 285 Cb 1.17 0.56 0.00 0.00 0.00 0.00 0.00 17.79 19.52 2grm h ALA 285 CO 0.12 -1.19 0.15 1.63 0.00 0.00 0.00 179.25 179.95 2grm n LYS 286 N -5.19 0.00 -0.10 0.00 5.02 -0.71 0.14 118.16 117.32 2grm n LYS 286 Ca -0.13 0.30 0.06 0.00 -2.02 0.00 0.00 58.31 56.52 2grm n LYS 286 Cb 0.44 -1.65 0.11 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 -1.28 1.87 -3.19 1.97 -0.58 -0.14 -4.99 120.64 114.30 2grm n GLU 287 Ca 0.00 -1.67 -0.15 0.00 -0.42 0.00 0.00 57.16 54.92 2grm n GLU 287 Cb 0.15 -1.24 0.07 0.00 -0.57 0.00 0.00 31.44 29.84 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 0.56 -5.47 -4.30 3.49 4.76 0.12 -5.03 118.16 112.29 2grm n LYS 288 Ca 0.09 0.64 -0.16 0.00 -2.87 0.00 0.00 58.31 56.01 2grm n LYS 288 Cb 0.36 -5.06 -0.10 0.00 -1.84 0.00 0.00 35.03 28.39 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 -3.26 1.46 -0.30 2.13 0.40 -0.42 -5.04 117.98 112.96 2grm s PHE 289 Ca 0.19 -0.93 -0.00 0.00 -0.60 0.00 0.00 56.93 55.58 2grm s PHE 289 Cb -0.08 -0.83 0.10 0.00 0.51 0.00 0.00 43.02 42.71 2grm s PHE 289 CO 0.55 -0.07 0.08 0.99 0.70 0.00 0.00 175.22 177.48 2grm s THR 290 N -3.46 1.04 0.88 0.64 2.01 -1.26 -4.22 115.64 111.26 2grm s THR 290 Ca 0.26 -1.44 -0.14 0.00 0.31 0.00 0.00 61.69 60.68 2grm s THR 290 Cb 0.05 -1.74 -0.01 0.00 0.01 0.00 0.00 72.50 70.81 2grm s THR 290 CO 0.07 -0.61 0.28 -0.81 -0.69 0.00 0.00 174.62 172.86 2grm n PRO 291 N 4.79 -0.07 -0.89 4.92 -0.04 -1.26 -4.90 135.00 137.55 2grm n PRO 291 Ca -0.02 0.02 -0.35 0.00 -0.04 0.00 0.00 63.50 63.10 2grm n PRO 291 Cb 0.42 -1.72 0.08 0.00 -0.04 0.00 0.00 33.50 32.25 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 -0.81 -0.34 -0.03 0.54 -0.02 -1.26 -4.45 135.00 128.63 2grm n PRO 292 Ca 0.07 -0.08 0.04 0.00 -2.02 0.00 0.00 63.50 61.50 2grm n PRO 292 Cb 0.53 -1.36 0.41 0.00 -0.02 0.00 0.00 33.50 33.05 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 -1.33 0.59 0.79 -0.52 2.10 -1.98 -1.16 116.57 115.06 2grm h LYS 293 Ca -0.44 -0.04 -0.04 0.00 -2.00 0.00 0.00 60.65 58.13 2grm h LYS 293 Cb 1.32 -0.13 0.01 0.00 -0.90 0.00 0.00 32.23 32.53 2grm h LYS 293 CO 0.28 0.39 -0.38 1.49 -2.00 0.00 0.00 179.45 179.23 2grm h GLU 294 N 0.61 -1.02 0.02 0.07 4.81 -1.98 0.21 114.58 117.30 2grm h GLU 294 Ca 0.17 0.07 0.03 0.00 -0.13 0.00 0.00 59.36 59.50 2grm h GLU 294 Cb -0.04 0.23 -0.05 0.00 0.63 0.00 0.00 28.75 29.52 2grm h GLU 294 CO -0.04 -0.68 -0.34 0.28 -0.73 0.00 0.00 179.01 177.50 2grm h VAL 295 N -1.17 0.27 -0.59 0.32 2.07 -1.85 0.61 116.25 115.91 2grm h VAL 295 Ca -0.11 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.51 2grm h VAL 295 Cb 0.81 0.27 -0.08 0.00 -1.52 0.00 0.00 31.29 30.78 2grm h VAL 295 CO 0.18 0.00 0.18 0.74 0.02 0.00 0.00 177.57 178.69 2grm h THR 296 N -0.51 0.72 -0.26 2.57 2.02 -1.26 -0.15 112.91 116.04 2grm h THR 296 Ca 0.05 -0.11 -0.00 0.00 0.77 0.00 0.00 66.41 67.11 2grm h THR 296 Cb 0.59 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 67.34 2grm h THR 296 CO -0.26 0.06 0.14 0.24 0.37 0.00 0.00 175.52 176.07 2grm h MET 297 N 0.33 0.36 -0.37 6.66 2.86 0.01 -2.21 114.93 122.58 2grm h MET 297 Ca 0.30 -0.04 0.05 0.00 -2.06 0.00 0.00 59.70 57.94 2grm h MET 297 Cb 0.40 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 31.95 2grm h MET 297 CO -0.34 0.32 0.12 1.88 1.06 0.00 0.00 176.91 179.95 2grm h TYR 298 N 0.31 0.21 0.00 -0.22 0.99 -0.14 -2.41 116.97 115.72 2grm h TYR 298 Ca 0.09 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.84 2grm h TYR 298 Cb 0.06 -0.04 0.00 0.00 1.00 0.00 0.00 36.73 37.75 2grm h TYR 298 CO -0.03 0.08 0.00 0.98 -0.00 0.00 0.00 178.16 179.19 2grm n TYR 299 N -5.03 0.00 -0.45 4.88 9.36 -0.14 -0.09 117.16 125.70 2grm n TYR 299 Ca 0.02 0.00 0.37 0.00 3.32 0.00 0.00 57.90 61.61 2grm n TYR 299 Cb 0.14 -0.35 0.66 0.00 -0.63 0.00 0.00 39.34 39.16 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 0.10 -0.01 2.98 4.39 -1.40 0.49 114.58 121.14 2grm h GLU 300 Ca 0.00 -0.01 -0.15 0.00 0.34 0.00 0.00 59.36 59.55 2grm h GLU 300 Cb 0.00 -0.02 0.01 0.00 -0.10 0.00 0.00 28.75 28.64 2grm h GLU 300 CO 0.00 0.07 -0.57 -0.97 -1.16 0.00 0.00 179.01 176.38 2grm h ASN 301 N 0.11 0.51 0.49 1.42 -1.24 -1.05 -3.37 115.58 112.45 2grm h ASN 301 Ca 0.78 -0.76 -0.02 0.00 0.71 0.00 0.00 56.30 57.01 2grm h ASN 301 Cb 2.57 -0.16 0.00 0.00 0.73 0.00 0.00 38.32 41.46 2grm h ASN 301 CO -0.32 1.20 -0.24 1.88 -1.29 0.00 0.00 177.43 178.67 2grm h TYR 302 N -0.13 -0.62 -0.40 0.67 0.05 0.35 -3.32 116.97 113.58 2grm h TYR 302 Ca -0.07 -0.01 -0.26 0.00 0.05 0.00 0.00 58.73 58.43 2grm h TYR 302 Cb 1.28 0.20 -0.03 0.00 1.01 0.00 0.00 36.73 39.19 2grm h TYR 302 CO 0.15 -0.38 0.85 0.08 -1.05 0.00 0.00 178.16 177.80 2grm s VAL 303 N -4.31 3.43 0.00 -2.88 1.01 -0.05 -1.30 120.40 116.31 2grm s VAL 303 Ca -0.10 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.16 2grm s VAL 303 Cb 0.01 -4.43 0.00 0.00 0.00 0.00 0.00 36.38 31.96 2grm s VAL 303 CO 0.29 -0.79 0.00 0.00 0.00 0.00 0.00 175.10 174.60 2grm n ALA 304 N 15.54 0.00 -1.11 5.51 0.00 -1.25 -4.83 120.51 134.36 2grm n ALA 304 Ca 0.44 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.82 2grm n ALA 304 Cb 0.47 0.00 0.28 0.00 0.00 0.00 0.00 19.45 20.19 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 -1.71 2.86 0.00 0.00 -5.35 -0.42 -4.65 119.36 110.09 2grm n ILE 305 Ca 0.00 -1.84 0.00 0.00 -0.27 0.00 0.00 62.75 60.64 2grm n ILE 305 Cb 0.00 -0.36 0.00 0.00 -1.74 0.00 0.00 39.64 37.54 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 -0.42 0.00 0.00 6.28 2.13 -1.05 -5.05 120.64 122.52 2grm n GLU 306 Ca 0.40 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.22 2grm n GLU 306 Cb 1.33 0.00 0.00 0.00 0.27 0.00 0.00 31.44 33.04 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 -2.07 0.00 -3.68 4.31 3.02 -1.26 -4.38 115.26 111.19 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 -0.12 0.00 -0.61 0.00 0.00 39.78 39.05 2grm n ASN 307 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2grm s ASN 308 N -0.74 3.49 0.59 6.41 0.01 -1.26 -5.03 114.94 118.41 2grm s ASN 308 Ca 0.00 -2.80 -0.16 0.00 -0.71 0.00 0.00 52.86 49.19 2grm s ASN 308 Cb 0.00 -1.01 -0.04 0.00 0.41 0.00 0.00 41.25 40.62 2grm s ASN 308 CO 0.00 -0.24 1.06 -2.16 -1.51 0.00 0.00 177.10 174.25 2grm s PRO 309 N 0.14 3.34 -0.14 -0.60 0.04 -1.26 -5.01 135.00 131.50 2grm s PRO 309 Ca 0.20 1.24 -0.29 0.00 0.04 0.00 0.00 61.00 62.19 2grm s PRO 309 Cb -0.19 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.31 2grm s PRO 309 CO -0.04 -0.80 1.05 0.42 0.04 0.00 0.00 177.00 177.67 2grm s ILE 310 N -2.39 4.68 0.07 0.56 -1.09 -1.26 -4.96 121.20 116.81 2grm s ILE 310 Ca 0.64 1.98 -0.30 0.00 -2.23 0.00 0.00 60.65 60.74 2grm s ILE 310 Cb -0.16 -4.27 -0.10 0.00 -1.58 0.00 0.00 42.46 36.35 2grm s ILE 310 CO 0.35 -0.06 1.93 -0.81 -1.23 0.00 0.00 174.94 175.12 2grm n PRO 311 N 5.53 2.87 -1.55 2.79 -0.04 -1.26 -4.81 135.00 138.52 2grm n PRO 311 Ca 0.10 1.05 -0.56 0.00 -0.04 0.00 0.00 63.50 64.05 2grm n PRO 311 Cb 0.47 -2.99 -0.07 0.00 -0.04 0.00 0.00 33.50 30.88 2grm n PRO 311 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2grm n GLU 312 N 6.83 0.54 -4.53 0.54 0.28 -1.26 -4.93 120.64 118.11 2grm n GLU 312 Ca 0.19 0.19 -0.33 0.00 -0.16 0.00 0.00 57.16 57.05 2grm n GLU 312 Cb 0.40 -1.76 -0.14 0.00 1.43 0.00 0.00 31.44 31.37 2grm n GLU 312 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2grm s ILE 313 N 0.42 3.37 -0.10 3.84 1.01 -1.26 -5.10 121.20 123.37 2grm s ILE 313 Ca 0.89 -0.54 -0.11 0.00 0.00 0.00 0.00 60.65 60.89 2grm s ILE 313 Cb -1.13 -2.45 -0.05 0.00 0.01 0.00 0.00 42.46 38.84 2grm s ILE 313 CO 0.54 0.50 0.25 -0.75 0.00 0.00 0.00 174.94 175.48 2grm s LYS 314 N 0.51 3.85 0.00 2.79 2.47 -1.26 -5.19 119.74 122.91 2grm s LYS 314 Ca -0.06 0.07 0.00 0.00 -1.56 0.00 0.00 55.97 54.42 2grm s LYS 314 Cb -0.15 -3.28 0.00 0.00 -1.46 0.00 0.00 37.83 32.94 2grm s LYS 314 CO 0.04 0.58 0.08 0.39 0.16 0.00 0.00 175.35 176.59