#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ama n SER 4 N 0.00 1.17 -0.03 -3.46 7.64 -1.26 -5.04 113.62 112.64 1ama n SER 4 Ca 0.00 -0.35 -0.14 0.00 1.01 0.00 0.00 58.87 59.39 1ama n SER 4 Cb 0.00 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.10 1ama n SER 4 CO 0.00 0.00 0.00 -0.50 -3.01 0.00 0.00 175.04 171.53 1ama h TRP 5 N 0.21 0.21 -0.56 1.43 -0.00 -2.06 -3.36 115.95 111.81 1ama h TRP 5 Ca 0.00 -0.10 -0.15 0.00 -0.00 0.00 0.00 58.89 58.65 1ama h TRP 5 Cb 0.00 -0.03 -0.09 0.00 -0.00 0.00 0.00 29.16 29.04 1ama h TRP 5 CO 0.00 0.81 0.14 0.91 -0.00 0.00 0.00 178.44 180.30 1ama n TRP 6 N -4.60 1.89 0.26 0.49 7.02 -1.26 -4.63 117.44 116.61 1ama n TRP 6 Ca -0.09 -1.15 0.13 0.00 -1.02 0.00 0.00 57.50 55.37 1ama n TRP 6 Cb 0.42 -0.56 0.68 0.00 -2.42 0.00 0.00 31.31 29.43 1ama n TRP 6 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1ama h SER 7 N 2.33 0.00 0.43 -0.99 4.64 -1.97 -2.78 113.55 115.21 1ama h SER 7 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1ama h SER 7 Cb 2.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.11 1ama h SER 7 CO 0.56 0.13 -0.29 0.00 -0.87 0.00 0.00 176.83 176.36 1ama n HIS 8 N -3.52 0.00 -2.42 4.77 1.44 -1.26 -4.82 115.22 109.41 1ama n HIS 8 Ca -0.01 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.27 1ama n HIS 8 Cb 0.28 -0.22 -0.02 0.00 0.12 0.00 0.00 29.99 30.15 1ama n HIS 8 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 1ama s VAL 9 N -2.73 4.23 0.61 0.61 1.01 -1.05 -5.00 120.40 118.08 1ama s VAL 9 Ca 0.19 1.46 -0.01 0.00 0.00 0.00 0.00 61.98 63.62 1ama s VAL 9 Cb 0.19 -4.04 0.05 0.00 0.00 0.00 0.00 36.38 32.58 1ama s VAL 9 CO 0.58 -0.24 0.87 -1.61 0.00 0.00 0.00 175.10 174.69 1ama s GLU 10 N 3.73 2.32 -0.16 2.72 2.02 -1.26 -5.04 118.70 123.03 1ama s GLU 10 Ca 0.55 -0.71 -0.29 0.00 0.02 0.00 0.00 54.97 54.54 1ama s GLU 10 Cb -0.20 -2.39 -0.02 0.00 0.10 0.00 0.00 34.13 31.63 1ama s GLU 10 CO 0.17 -0.96 1.27 1.41 0.02 0.00 0.00 175.26 177.18 1ama s MET 11 N -4.94 4.23 0.33 1.61 -2.45 -1.26 -5.03 119.30 111.79 1ama s MET 11 Ca 0.59 1.68 0.02 0.00 -1.25 0.00 0.00 55.69 56.73 1ama s MET 11 Cb -0.10 -3.77 -0.03 0.00 1.25 0.00 0.00 34.83 32.19 1ama s MET 11 CO 0.41 -0.71 0.50 0.20 1.05 0.00 0.00 175.02 176.47 1ama s GLY 12 N 2.01 1.33 0.75 2.11 0.00 -1.26 -5.09 107.32 107.18 1ama s GLY 12 Ca 0.55 -1.04 -0.12 0.00 0.00 0.00 0.00 44.72 44.12 1ama s GLY 12 CO 0.15 -0.99 1.10 2.56 0.00 0.00 0.00 173.10 175.93 1ama s PRO 13 N -4.24 2.47 0.56 2.90 0.04 -1.26 -5.04 135.00 130.43 1ama s PRO 13 Ca 0.39 0.51 -0.18 0.00 0.04 0.00 0.00 61.00 61.76 1ama s PRO 13 Cb -0.09 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.42 1ama s PRO 13 CO 0.34 -1.32 1.07 -2.14 0.04 0.00 0.00 177.00 174.99 1ama s PRO 14 N -5.29 3.41 0.43 0.56 0.02 -1.26 -4.96 135.00 127.91 1ama s PRO 14 Ca 0.59 1.37 -0.26 0.00 0.02 0.00 0.00 61.00 62.73 1ama s PRO 14 Cb -0.12 -2.04 -0.09 0.00 0.02 0.00 0.00 34.50 32.27 1ama s PRO 14 CO 0.53 -0.76 1.45 -3.47 -0.33 0.00 0.00 177.00 174.42 1ama n ASP 15 N -1.57 3.47 -0.19 2.53 2.03 -1.26 -4.82 116.55 116.74 1ama n ASP 15 Ca 0.10 1.15 0.12 0.00 0.52 0.00 0.00 54.79 56.68 1ama n ASP 15 Cb 0.52 -1.61 0.44 0.00 -0.72 0.00 0.00 41.12 39.75 1ama n ASP 15 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1ama h PRO 16 N 2.49 0.55 0.00 -0.67 0.11 -1.97 -1.53 132.00 130.99 1ama h PRO 16 Ca -0.51 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1ama h PRO 16 Cb 1.26 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1ama h PRO 16 CO 0.62 0.36 -0.40 -0.89 -0.21 0.00 0.00 178.00 177.48 1ama n ILE 17 N -4.50 0.64 -0.15 4.15 5.41 -1.26 -4.55 119.36 119.10 1ama n ILE 17 Ca 0.14 0.33 0.02 0.00 1.00 0.00 0.00 62.75 64.24 1ama n ILE 17 Cb 0.43 -1.82 0.31 0.00 -0.71 0.00 0.00 39.64 37.85 1ama n ILE 17 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1ama h LEU 18 N -0.40 0.73 -2.40 1.39 4.07 -1.97 -1.03 115.31 115.70 1ama h LEU 18 Ca 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1ama h LEU 18 Cb 0.40 -0.18 -0.00 0.00 1.08 0.00 0.00 40.66 41.96 1ama h LEU 18 CO 0.00 0.53 0.01 1.23 -1.08 0.00 0.00 178.44 179.12 1ama h GLY 19 N 0.86 0.00 1.28 0.83 0.00 -1.55 -0.88 103.07 103.61 1ama h GLY 19 Ca 0.24 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.46 1ama h GLY 19 CO -0.06 0.00 -0.19 -2.08 0.00 0.00 0.00 176.54 174.22 1ama h VAL 20 N 0.00 1.27 -0.46 4.60 2.07 -1.30 -2.47 116.25 119.96 1ama h VAL 20 Ca 0.00 -1.30 -0.05 0.00 0.82 0.00 0.00 66.70 66.17 1ama h VAL 20 Cb 0.02 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 1ama h VAL 20 CO -0.00 0.44 0.06 0.74 0.02 0.00 0.00 177.57 178.83 1ama h THR 21 N 0.74 1.22 0.04 2.57 2.02 -1.26 -0.24 112.91 118.00 1ama h THR 21 Ca 0.11 -0.84 -0.00 0.00 0.77 0.00 0.00 66.41 66.45 1ama h THR 21 Cb 0.71 0.81 0.00 0.00 -1.74 0.00 0.00 68.15 67.93 1ama h THR 21 CO 0.05 0.30 -0.02 -0.33 0.37 0.00 0.00 175.52 175.89 1ama h GLU 22 N 0.68 -0.05 -0.66 6.66 5.08 -1.39 -0.55 114.58 124.34 1ama h GLU 22 Ca 0.15 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 1ama h GLU 22 Cb 0.33 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.57 1ama h GLU 22 CO 0.01 0.07 0.35 0.00 -1.00 0.00 0.00 179.01 178.44 1ama h ALA 23 N 0.79 0.85 -0.43 3.43 0.00 -1.23 -2.55 119.26 120.11 1ama h ALA 23 Ca -0.01 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.82 1ama h ALA 23 Cb 0.15 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1ama h ALA 23 CO 0.01 0.38 0.22 0.35 0.00 0.00 0.00 179.25 180.20 1ama h PHE 24 N 0.91 0.40 -0.77 0.00 3.04 -0.90 -3.05 116.94 116.57 1ama h PHE 24 Ca 0.23 0.02 0.18 0.00 3.98 0.00 0.00 57.97 62.38 1ama h PHE 24 Cb 0.06 -0.12 -0.13 0.00 2.56 0.00 0.00 35.95 38.32 1ama h PHE 24 CO -0.00 0.21 0.07 0.87 -2.02 0.00 0.00 178.31 177.44 1ama h LYS 25 N 0.44 0.14 0.00 1.11 1.57 -0.66 -2.18 116.57 117.00 1ama h LYS 25 Ca 0.18 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1ama h LYS 25 Cb 0.09 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1ama h LYS 25 CO -0.13 0.09 0.00 0.00 -0.57 0.00 0.00 179.45 178.85 1ama h ARG 26 N 0.15 0.00 -6.82 3.15 3.08 -1.52 -3.46 114.38 108.95 1ama h ARG 26 Ca 0.44 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.97 1ama h ARG 26 Cb 0.79 0.00 0.05 0.00 0.08 0.00 0.00 29.97 30.89 1ama h ARG 26 CO -0.64 0.00 0.64 0.34 -1.07 0.00 0.00 179.97 179.24 1ama s ASP 27 N -5.47 6.84 0.00 7.04 -1.08 -0.82 -4.95 116.67 118.23 1ama s ASP 27 Ca 0.04 2.59 0.23 0.00 -0.52 0.00 0.00 52.55 54.88 1ama s ASP 27 Cb 0.08 -2.64 0.09 0.00 -1.46 0.00 0.00 42.92 39.00 1ama s ASP 27 CO 0.55 -0.51 1.15 0.35 0.52 0.00 0.00 175.17 177.24 1ama n THR 28 N 1.34 0.00 -1.82 1.71 -2.24 -1.26 -4.95 114.28 107.06 1ama n THR 28 Ca 0.02 -0.39 -0.42 0.00 -2.27 0.00 0.00 64.05 60.98 1ama n THR 28 Cb 0.42 1.37 -0.03 0.00 -2.10 0.00 0.00 70.33 70.00 1ama n THR 28 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1ama s ASN 29 N -2.17 6.25 0.32 3.42 3.84 -1.26 -4.87 114.94 120.47 1ama s ASN 29 Ca 0.23 2.18 0.22 0.00 0.21 0.00 0.00 52.86 55.70 1ama s ASN 29 Cb 0.19 -2.53 1.16 0.00 -0.55 0.00 0.00 41.25 39.52 1ama s ASN 29 CO 0.42 -1.28 1.68 -1.54 -2.79 0.00 0.00 177.10 173.59 1ama n SER 30 N 8.58 0.59 -1.19 -4.21 3.41 -1.26 -1.84 113.62 117.71 1ama n SER 30 Ca 0.21 0.75 0.08 0.00 -0.26 0.00 0.00 58.87 59.65 1ama n SER 30 Cb 0.43 -0.84 0.29 0.00 -0.26 0.00 0.00 64.21 63.84 1ama n SER 30 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ama n LYS 31 N -2.27 3.47 -1.99 4.33 5.02 -1.26 -5.02 118.16 120.44 1ama n LYS 31 Ca -0.01 -2.79 -0.36 0.00 -2.02 0.00 0.00 58.31 53.14 1ama n LYS 31 Cb 0.07 -1.84 0.03 0.00 -0.02 0.00 0.00 35.03 33.27 1ama n LYS 31 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1ama s LYS 32 N -2.31 2.96 -0.03 1.97 -2.85 -0.77 -4.84 119.74 113.88 1ama s LYS 32 Ca 0.43 1.77 0.02 0.00 -1.00 0.00 0.00 55.97 57.20 1ama s LYS 32 Cb 0.32 -1.93 0.00 0.00 -2.06 0.00 0.00 37.83 34.16 1ama s LYS 32 CO 0.15 -1.20 -0.09 -1.64 0.10 0.00 0.00 175.35 172.66 1ama s MET 33 N -3.41 0.96 -0.60 1.78 -1.94 -0.51 -4.99 119.30 110.59 1ama s MET 33 Ca 0.76 -0.30 -0.10 0.00 -1.71 0.00 0.00 55.69 54.35 1ama s MET 33 Cb -0.29 -0.89 0.15 0.00 2.01 0.00 0.00 34.83 35.81 1ama s MET 33 CO 0.34 0.10 0.49 1.21 -0.01 0.00 0.00 175.02 177.15 1ama s ASN 34 N 0.22 5.92 -0.32 3.03 3.04 -1.26 -1.69 114.94 123.87 1ama s ASN 34 Ca -0.03 -2.29 0.08 0.00 0.04 0.00 0.00 52.86 50.66 1ama s ASN 34 Cb -0.09 -2.05 0.55 0.00 -1.54 0.00 0.00 41.25 38.13 1ama s ASN 34 CO 0.00 -0.61 1.58 0.18 -3.04 0.00 0.00 177.10 175.21 1ama n LEU 35 N 4.41 4.79 0.00 3.21 4.77 0.27 -4.71 117.00 129.73 1ama n LEU 35 Ca 0.00 -3.68 0.00 0.00 -0.03 0.00 0.00 56.01 52.30 1ama n LEU 35 Cb 0.42 -0.68 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 1ama n LEU 35 CO 0.40 1.16 0.02 0.61 -1.33 0.00 0.00 177.39 178.25 1ama n GLY 36 N -1.06 1.39 3.82 -0.72 0.00 -0.62 -1.32 105.19 106.69 1ama n GLY 36 Ca 0.39 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.08 1ama n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ama s VAL 37 N -0.12 4.26 -1.04 1.61 0.11 -1.26 -4.59 120.40 119.37 1ama s VAL 37 Ca 0.00 1.24 -0.20 0.00 -2.93 0.00 0.00 61.98 60.09 1ama s VAL 37 Cb 0.00 -3.59 -0.08 0.00 -1.53 0.00 0.00 36.38 31.18 1ama s VAL 37 CO 0.00 -0.47 1.97 0.61 -3.33 0.00 0.00 175.10 173.88 1ama n GLY 38 N -0.96 2.61 3.04 6.54 0.00 -1.26 -4.81 105.19 110.34 1ama n GLY 38 Ca 0.07 -1.23 -0.28 0.00 0.00 0.00 0.00 46.02 44.58 1ama n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ama s ALA 39 N 5.81 1.58 0.31 4.61 0.00 -1.26 -4.95 121.76 127.86 1ama s ALA 39 Ca 0.57 -0.66 -0.29 0.00 0.00 0.00 0.00 51.96 51.59 1ama s ALA 39 Cb 0.10 -0.79 -0.10 0.00 0.00 0.00 0.00 23.12 22.34 1ama s ALA 39 CO 0.08 -0.06 1.25 -0.47 0.00 0.00 0.00 175.76 176.55 1ama s TYR 40 N 0.98 3.21 0.07 0.00 5.04 -1.26 -3.91 117.35 121.48 1ama s TYR 40 Ca -0.07 1.48 0.05 0.00 -2.44 0.00 0.00 57.07 56.09 1ama s TYR 40 Cb -0.15 -3.56 -0.03 0.00 0.35 0.00 0.00 41.96 38.57 1ama s TYR 40 CO -0.01 -1.48 -0.14 1.03 -1.34 0.00 0.00 175.55 173.61 1ama s ARG 41 N -1.59 0.80 0.56 4.97 1.81 -1.17 -4.05 118.95 120.28 1ama s ARG 41 Ca 0.48 -0.96 -0.09 0.00 -1.72 0.00 0.00 55.73 53.45 1ama s ARG 41 Cb -0.37 -0.78 0.13 0.00 -0.45 0.00 0.00 34.95 33.47 1ama s ARG 41 CO 0.49 0.17 0.76 -0.40 -0.68 0.00 0.00 175.30 175.64 1ama n ASP 42 N 1.24 0.14 -0.07 0.23 5.68 0.90 -4.82 116.55 119.86 1ama n ASP 42 Ca -0.21 -1.33 0.00 0.00 -0.50 0.00 0.00 54.79 52.75 1ama n ASP 42 Cb 0.54 -0.57 0.00 0.00 -1.14 0.00 0.00 41.12 39.95 1ama n ASP 42 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 1ama n ASP 43 N -3.44 0.08 -0.09 -1.12 2.03 -1.26 -0.62 116.55 112.12 1ama n ASP 43 Ca 0.10 -1.12 0.02 0.00 0.52 0.00 0.00 54.79 54.31 1ama n ASP 43 Cb 0.34 -0.04 0.00 0.00 -0.72 0.00 0.00 41.12 40.70 1ama n ASP 43 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1ama n ASN 44 N -0.40 0.84 -2.24 1.67 3.02 -1.26 -3.68 115.26 113.20 1ama n ASN 44 Ca 0.00 -0.92 -0.10 0.00 -0.03 0.00 0.00 54.58 53.53 1ama n ASN 44 Cb 0.02 0.42 0.05 0.00 -0.61 0.00 0.00 39.78 39.66 1ama n ASN 44 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ama n GLY 45 N 0.59 0.06 3.25 7.41 0.00 0.21 -5.00 105.19 111.71 1ama n GLY 45 Ca 0.02 -0.18 -0.26 0.00 0.00 0.00 0.00 46.02 45.60 1ama n GLY 45 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ama s LYS 46 N -5.00 1.52 0.40 1.61 2.47 -1.25 -4.84 119.74 114.64 1ama s LYS 46 Ca 0.09 -0.89 -0.26 0.00 -1.56 0.00 0.00 55.97 53.35 1ama s LYS 46 Cb -0.04 -1.58 -0.11 0.00 -1.46 0.00 0.00 37.83 34.64 1ama s LYS 46 CO 0.39 0.41 1.17 -2.30 0.16 0.00 0.00 175.35 175.18 1ama n PRO 47 N 2.08 1.73 -4.22 4.03 -0.02 -1.26 -0.07 135.00 137.27 1ama n PRO 47 Ca -0.16 0.62 -0.32 0.00 -2.02 0.00 0.00 63.50 61.61 1ama n PRO 47 Cb 0.53 -2.23 -0.16 0.00 -0.02 0.00 0.00 33.50 31.62 1ama n PRO 47 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1ama s TYR 48 N -1.20 2.51 -0.28 6.00 5.04 -1.26 -4.72 117.35 123.45 1ama s TYR 48 Ca 0.61 -1.41 -0.10 0.00 -2.44 0.00 0.00 57.07 53.73 1ama s TYR 48 Cb -0.55 -1.76 -0.03 0.00 0.35 0.00 0.00 41.96 39.97 1ama s TYR 48 CO 0.58 -0.71 0.15 0.08 -1.34 0.00 0.00 175.55 174.32 1ama s VAL 49 N 1.24 4.87 0.43 3.14 1.01 -1.26 -4.89 120.40 124.94 1ama s VAL 49 Ca 0.02 -0.06 -0.26 0.00 0.00 0.00 0.00 61.98 61.68 1ama s VAL 49 Cb -0.14 -3.35 -0.09 0.00 0.00 0.00 0.00 36.38 32.81 1ama s VAL 49 CO -0.09 0.23 1.43 -0.76 0.00 0.00 0.00 175.10 175.90 1ama s LEU 50 N 1.69 4.17 0.18 3.92 1.02 -1.26 -4.83 118.68 123.56 1ama s LEU 50 Ca 0.06 2.92 -0.14 0.00 0.02 0.00 0.00 54.13 57.00 1ama s LEU 50 Cb -0.16 -3.87 0.16 0.00 0.02 0.00 0.00 46.19 42.34 1ama s LEU 50 CO 0.08 -1.08 1.72 0.78 0.02 0.00 0.00 176.35 177.87 1ama h ASN 51 N 2.51 0.01 0.08 2.29 2.35 -1.97 0.13 115.58 120.97 1ama h ASN 51 Ca -0.51 0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.31 1ama h ASN 51 Cb 1.26 0.11 -0.00 0.00 0.05 0.00 0.00 38.32 39.74 1ama h ASN 51 CO 0.62 0.04 -0.06 0.00 -1.65 0.00 0.00 177.43 176.37 1ama h VAL 53 N 0.00 1.45 -0.95 0.00 2.07 -1.22 -1.75 116.25 115.85 1ama h VAL 53 Ca -0.00 -1.33 0.10 0.00 0.82 0.00 0.00 66.70 66.28 1ama h VAL 53 Cb 0.11 2.36 -0.07 0.00 -1.52 0.00 0.00 31.29 32.18 1ama h VAL 53 CO 0.01 0.35 0.61 0.03 0.02 0.00 0.00 177.57 178.58 1ama h ARG 54 N -0.57 0.95 -0.02 1.57 2.47 -0.34 -1.17 114.38 117.28 1ama h ARG 54 Ca 0.00 -0.06 -0.19 0.00 -1.26 0.00 0.00 59.98 58.47 1ama h ARG 54 Cb 0.57 -0.21 -0.01 0.00 -1.65 0.00 0.00 29.97 28.66 1ama h ARG 54 CO 0.00 0.63 -0.82 0.87 0.56 0.00 0.00 179.97 181.21 1ama h LYS 55 N 0.98 0.25 -0.07 0.04 1.57 -1.41 -2.92 116.57 115.01 1ama h LYS 55 Ca 0.44 -0.24 -0.18 0.00 -1.87 0.00 0.00 60.65 58.80 1ama h LYS 55 Cb 0.38 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 1ama h LYS 55 CO -0.20 0.94 -0.72 0.00 -0.57 0.00 0.00 179.45 178.90 1ama h ALA 56 N 0.99 0.63 -0.38 3.86 0.00 -0.78 -2.85 119.26 120.73 1ama h ALA 56 Ca -0.04 -0.61 -0.11 0.00 0.00 0.00 0.00 54.91 54.16 1ama h ALA 56 Cb 1.42 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.13 1ama h ALA 56 CO 0.13 0.77 -0.20 0.93 0.00 0.00 0.00 179.25 180.88 1ama h GLU 57 N 0.24 0.72 0.00 0.00 5.08 -1.26 -2.93 114.58 116.43 1ama h GLU 57 Ca -0.03 -0.28 -0.05 0.00 -1.00 0.00 0.00 59.36 58.01 1ama h GLU 57 Cb 1.29 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 1ama h GLU 57 CO 0.12 0.87 -0.23 0.00 -1.00 0.00 0.00 179.01 178.76 1ama h ALA 58 N 1.14 1.16 0.00 3.43 0.00 -1.41 -2.29 119.26 121.28 1ama h ALA 58 Ca 0.09 -0.21 -0.19 0.00 0.00 0.00 0.00 54.91 54.60 1ama h ALA 58 Cb 0.69 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1ama h ALA 58 CO 0.05 0.29 -1.09 0.52 0.00 0.00 0.00 179.25 179.02 1ama h MET 59 N 0.00 0.00 -0.46 0.00 2.86 -1.34 -1.99 114.93 114.00 1ama h MET 59 Ca -0.00 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.53 1ama h MET 59 Cb 0.61 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.26 1ama h MET 59 CO 0.03 0.66 -0.12 0.82 1.06 0.00 0.00 176.91 179.36 1ama h ILE 60 N 0.00 1.27 0.10 -1.22 2.04 -1.33 -1.41 117.51 116.95 1ama h ILE 60 Ca -0.09 -1.25 -0.00 0.00 1.00 0.00 0.00 64.86 64.52 1ama h ILE 60 Cb 1.70 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.90 1ama h ILE 60 CO 0.09 0.43 -0.05 0.00 0.00 0.00 0.00 178.15 178.62 1ama h ALA 61 N 0.87 -0.13 -0.94 1.87 0.00 -1.44 -2.88 119.26 116.61 1ama h ALA 61 Ca 0.12 -0.24 0.18 0.00 0.00 0.00 0.00 54.91 54.97 1ama h ALA 61 Cb 0.67 0.05 -0.11 0.00 0.00 0.00 0.00 17.79 18.40 1ama h ALA 61 CO 0.05 -0.31 0.53 0.00 0.00 0.00 0.00 179.25 179.51 1ama h ALA 62 N 0.14 1.52 0.00 0.00 0.00 -1.37 0.43 119.26 119.97 1ama h ALA 62 Ca -0.01 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1ama h ALA 62 Cb 0.52 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1ama h ALA 62 CO 0.02 -0.11 -0.06 -0.22 0.00 0.00 0.00 179.25 178.88 1ama h LYS 63 N 0.66 0.00 -5.90 0.00 3.64 -1.26 -3.48 116.57 110.24 1ama h LYS 63 Ca 0.54 0.00 -0.38 0.00 -1.27 0.00 0.00 60.65 59.54 1ama h LYS 63 Cb 0.86 0.00 0.10 0.00 -0.41 0.00 0.00 32.23 32.78 1ama h LYS 63 CO -0.40 0.06 -0.78 1.63 -2.27 0.00 0.00 179.45 177.69 1ama n LYS 64 N -3.20 -6.06 -2.40 1.90 4.76 0.15 -4.95 118.16 108.35 1ama n LYS 64 Ca 0.00 0.74 -0.34 0.00 -2.87 0.00 0.00 58.31 55.84 1ama n LYS 64 Cb 0.31 -5.58 -0.02 0.00 -1.84 0.00 0.00 35.03 27.90 1ama n LYS 64 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 1ama s MET 66 N -5.82 3.66 1.12 1.97 -1.94 -1.22 -5.07 119.30 112.00 1ama s MET 66 Ca 0.13 1.31 -0.15 0.00 -1.71 0.00 0.00 55.69 55.28 1ama s MET 66 Cb -0.06 -2.08 0.25 0.00 2.01 0.00 0.00 34.83 34.95 1ama s MET 66 CO 0.77 -0.54 1.08 0.16 -0.01 0.00 0.00 175.02 176.48 1ama s ASP 67 N -2.22 1.56 -0.13 3.03 1.47 -1.26 -5.00 116.67 114.12 1ama s ASP 67 Ca 0.66 1.04 0.17 0.00 1.18 0.00 0.00 52.55 55.60 1ama s ASP 67 Cb -0.16 -1.59 0.43 0.00 -0.34 0.00 0.00 42.92 41.26 1ama s ASP 67 CO 0.25 -3.78 1.19 0.29 0.68 0.00 0.00 175.17 173.81 1ama n LYS 68 N -4.58 1.08 -1.98 2.11 5.02 -1.26 -5.08 118.16 113.47 1ama n LYS 68 Ca 0.07 -2.84 -0.34 0.00 -2.02 0.00 0.00 58.31 53.18 1ama n LYS 68 Cb 0.58 -1.01 0.02 0.00 -0.02 0.00 0.00 35.03 34.60 1ama n LYS 68 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1ama s GLU 69 N -1.99 3.09 0.33 1.97 0.41 -1.26 -4.96 118.70 116.28 1ama s GLU 69 Ca 0.37 1.41 -0.28 0.00 -0.41 0.00 0.00 54.97 56.06 1ama s GLU 69 Cb 0.38 -1.99 -0.13 0.00 -1.78 0.00 0.00 34.13 30.61 1ama s GLU 69 CO -0.10 -1.03 1.16 0.66 -0.49 0.00 0.00 175.26 175.46 1ama n TYR 70 N -1.99 1.81 -3.58 1.61 4.01 -1.26 -5.00 117.16 112.76 1ama n TYR 70 Ca 0.10 0.61 -0.30 0.00 -0.16 0.00 0.00 57.90 58.15 1ama n TYR 70 Cb 0.52 -2.34 -0.04 0.00 -0.31 0.00 0.00 39.34 37.17 1ama n TYR 70 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1ama s LEU 71 N -0.44 4.21 0.97 7.72 2.96 -1.26 -5.07 118.68 127.76 1ama s LEU 71 Ca 0.57 0.62 -0.12 0.00 -0.22 0.00 0.00 54.13 54.98 1ama s LEU 71 Cb -0.62 -3.38 0.09 0.00 0.50 0.00 0.00 46.19 42.78 1ama s LEU 71 CO 0.61 -0.02 0.62 -2.65 -1.32 0.00 0.00 176.35 173.58 1ama n PRO 72 N -0.25 -0.56 -0.14 0.98 -0.02 -1.26 -4.80 135.00 128.95 1ama n PRO 72 Ca -0.02 -0.12 0.12 0.00 -2.02 0.00 0.00 63.50 61.46 1ama n PRO 72 Cb 0.53 -2.01 0.47 0.00 -0.02 0.00 0.00 33.50 32.46 1ama n PRO 72 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1ama h ILE 73 N -1.76 0.88 -0.00 4.25 2.04 -1.97 -2.36 117.51 118.59 1ama h ILE 73 Ca -0.45 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.24 1ama h ILE 73 Cb 1.29 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.71 1ama h ILE 73 CO 0.37 0.09 -0.09 0.00 0.00 0.00 0.00 178.15 178.52 1ama n ALA 74 N -2.50 2.65 0.00 1.87 0.00 -1.26 -4.55 120.51 116.71 1ama n ALA 74 Ca 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1ama n ALA 74 Cb 0.40 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.46 1ama n ALA 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ama n GLY 75 N 1.37 -2.54 3.66 0.00 0.00 -0.89 -0.81 105.19 105.98 1ama n GLY 75 Ca 0.11 -2.18 -0.43 0.00 0.00 0.00 0.00 46.02 43.53 1ama n GLY 75 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ama s LEU 76 N 0.00 4.24 0.25 0.99 2.96 -1.26 -4.41 118.68 121.45 1ama s LEU 76 Ca 0.00 1.91 -0.04 0.00 -0.22 0.00 0.00 54.13 55.78 1ama s LEU 76 Cb 0.00 -3.54 0.49 0.00 0.50 0.00 0.00 46.19 43.65 1ama s LEU 76 CO 0.00 -0.82 1.68 0.00 -1.32 0.00 0.00 176.35 175.89 1ama h ALA 77 N 8.70 1.00 -0.62 5.97 0.00 -1.98 -0.42 119.26 131.91 1ama h ALA 77 Ca -0.32 0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1ama h ALA 77 Cb 1.13 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 1ama h ALA 77 CO 0.96 -0.34 0.26 -0.44 0.00 0.00 0.00 179.25 179.69 1ama h ASP 78 N 0.28 0.81 -0.10 0.00 5.19 -1.97 0.33 116.42 120.95 1ama h ASP 78 Ca 0.43 -0.10 -0.07 0.00 -0.62 0.00 0.00 57.03 56.67 1ama h ASP 78 Cb 0.75 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 40.05 1ama h ASP 78 CO -0.52 0.72 -0.20 0.15 -3.12 0.00 0.00 179.24 176.27 1ama h PHE 79 N 0.88 0.40 -0.15 4.55 3.57 -1.50 -1.25 116.94 123.44 1ama h PHE 79 Ca 0.21 -0.14 0.04 0.00 3.53 0.00 0.00 57.97 61.61 1ama h PHE 79 Cb 0.16 -0.07 -0.05 0.00 2.79 0.00 0.00 35.95 38.77 1ama h PHE 79 CO 0.01 0.81 -0.16 1.15 -2.23 0.00 0.00 178.31 177.90 1ama h THR 80 N -0.13 0.58 -0.30 4.41 2.02 -0.84 -0.14 112.91 118.51 1ama h THR 80 Ca 0.00 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.09 1ama h THR 80 Cb 0.79 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 1ama h THR 80 CO 0.04 0.00 -0.18 -0.09 0.37 0.00 0.00 175.52 175.66 1ama h ARG 81 N -0.18 0.66 0.00 6.66 2.43 -0.42 -2.76 114.38 120.76 1ama h ARG 81 Ca 0.10 -0.30 -0.02 0.00 -0.81 0.00 0.00 59.98 58.95 1ama h ARG 81 Cb 0.33 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1ama h ARG 81 CO -0.26 0.90 -0.08 0.00 -1.51 0.00 0.00 179.97 179.02 1ama h ALA 82 N 0.74 1.73 0.02 2.80 0.00 -0.89 -2.23 119.26 121.43 1ama h ALA 82 Ca 0.06 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ama h ALA 82 Cb 0.72 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1ama h ALA 82 CO 0.05 0.10 -0.01 0.77 0.00 0.00 0.00 179.25 180.16 1ama h SER 83 N 0.00 -0.03 -0.31 0.00 0.02 -0.95 -1.98 113.55 110.30 1ama h SER 83 Ca -0.00 -0.59 0.07 0.00 -0.84 0.00 0.00 61.79 60.43 1ama h SER 83 Cb 0.16 0.01 -0.08 0.00 0.14 0.00 0.00 62.40 62.63 1ama h SER 83 CO 0.01 0.59 -0.34 0.00 -1.14 0.00 0.00 176.83 175.94 1ama h ALA 84 N 0.27 -0.29 -0.75 3.77 0.00 -1.33 0.36 119.26 121.29 1ama h ALA 84 Ca -0.00 0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.02 1ama h ALA 84 Cb 0.61 0.71 -0.05 0.00 0.00 0.00 0.00 17.79 19.06 1ama h ALA 84 CO 0.01 -0.78 0.46 1.49 0.00 0.00 0.00 179.25 180.43 1ama h GLU 85 N -0.32 0.83 -0.79 0.00 4.81 -1.45 0.76 114.58 118.43 1ama h GLU 85 Ca 0.14 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.27 1ama h GLU 85 Cb 0.55 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.71 1ama h GLU 85 CO -0.49 0.55 0.30 1.25 -0.73 0.00 0.00 179.01 179.90 1ama h LEU 86 N 0.86 1.10 0.35 1.64 5.85 -0.37 0.35 115.31 125.09 1ama h LEU 86 Ca 0.32 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 1ama h LEU 86 Cb 0.12 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 40.86 1ama h LEU 86 CO -0.15 0.99 -0.17 0.00 -0.34 0.00 0.00 178.44 178.77 1ama h ALA 87 N 1.17 -0.47 -0.12 1.25 0.00 0.32 -3.39 119.26 118.01 1ama h ALA 87 Ca 0.26 -0.18 -0.21 0.00 0.00 0.00 0.00 54.91 54.79 1ama h ALA 87 Cb 0.24 0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.22 1ama h ALA 87 CO -0.02 -0.51 -0.73 -0.07 0.00 0.00 0.00 179.25 177.93 1ama h LEU 88 N -0.98 0.86 0.00 0.00 4.07 -0.88 -3.45 115.31 114.92 1ama h LEU 88 Ca -0.05 -0.64 0.00 0.00 0.08 0.00 0.00 57.88 57.27 1ama h LEU 88 Cb 0.51 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 42.00 1ama h LEU 88 CO 0.08 1.37 0.00 0.61 -1.08 0.00 0.00 178.44 179.41 1ama n GLY 89 N 0.75 2.45 0.15 0.83 0.00 0.12 -4.61 105.19 104.89 1ama n GLY 89 Ca -0.08 -1.67 0.02 0.00 0.00 0.00 0.00 46.02 44.29 1ama n GLY 89 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1ama h GLU 90 N 0.00 0.00 -0.41 1.61 4.11 -1.97 -3.27 114.58 114.65 1ama h GLU 90 Ca 0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.34 1ama h GLU 90 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1ama h GLU 90 CO 0.00 0.54 -0.10 -2.95 0.07 0.00 0.00 179.01 176.57 1ama h ASN 91 N 0.00 0.70 -0.85 3.06 7.08 -1.97 -3.43 115.58 120.17 1ama h ASN 91 Ca -0.01 -0.20 -0.64 0.00 -3.08 0.00 0.00 56.30 52.38 1ama h ASN 91 Cb 1.11 -0.19 0.06 0.00 -2.08 0.00 0.00 38.32 37.22 1ama h ASN 91 CO 0.07 0.83 -0.10 -0.24 -2.08 0.00 0.00 177.43 175.91 1ama n SER 92 N -4.18 -0.33 0.02 6.14 2.88 -1.24 -4.85 113.62 112.08 1ama n SER 92 Ca 0.01 0.98 -0.18 0.00 -1.33 0.00 0.00 58.87 58.35 1ama n SER 92 Cb 0.35 -0.79 -0.08 0.00 -0.75 0.00 0.00 64.21 62.94 1ama n SER 92 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1ama h GLU 93 N 2.04 0.69 -0.54 -1.46 4.22 -1.92 -1.02 114.58 116.59 1ama h GLU 93 Ca -0.37 -0.66 0.10 0.00 0.08 0.00 0.00 59.36 58.51 1ama h GLU 93 Cb 1.22 0.17 -0.08 0.00 0.50 0.00 0.00 28.75 30.55 1ama h GLU 93 CO 0.53 1.26 0.04 0.00 -2.18 0.00 0.00 179.01 178.66 1ama h ALA 94 N 0.52 0.55 -0.06 2.92 0.00 -1.96 0.83 119.26 122.06 1ama h ALA 94 Ca -0.09 0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 1ama h ALA 94 Cb 1.56 0.23 0.01 0.00 0.00 0.00 0.00 17.79 19.59 1ama h ALA 94 CO 0.18 -0.36 -0.36 0.35 0.00 0.00 0.00 179.25 179.06 1ama h PHE 95 N 0.16 0.49 0.00 0.00 3.57 -1.88 -2.07 116.94 117.20 1ama h PHE 95 Ca 0.27 -0.22 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 1ama h PHE 95 Cb 0.41 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 1ama h PHE 95 CO -0.29 0.97 -0.20 0.87 -2.23 0.00 0.00 178.31 177.43 1ama h LYS 96 N -0.13 0.00 -0.00 1.11 6.56 -0.55 -2.35 116.57 121.21 1ama h LYS 96 Ca -0.03 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.56 1ama h LYS 96 Cb 1.02 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.68 1ama h LYS 96 CO 0.07 0.20 -0.40 -1.13 -2.06 0.00 0.00 179.45 176.13 1ama n SER 97 N -4.19 0.59 -1.08 0.86 3.41 0.28 -4.95 113.62 108.54 1ama n SER 97 Ca -0.02 -0.37 -0.12 0.00 -0.26 0.00 0.00 58.87 58.09 1ama n SER 97 Cb 0.26 0.17 -0.04 0.00 -0.26 0.00 0.00 64.21 64.34 1ama n SER 97 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ama n GLY 98 N 1.45 0.91 1.20 5.00 0.00 -0.89 -4.58 105.19 108.29 1ama n GLY 98 Ca 0.08 -0.43 -0.02 0.00 0.00 0.00 0.00 46.02 45.64 1ama n GLY 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ama n ARG 99 N -2.51 1.11 -4.27 1.61 1.74 -0.81 -4.35 116.66 109.17 1ama n ARG 99 Ca -0.13 -0.25 -0.15 0.00 -0.77 0.00 0.00 57.85 56.55 1ama n ARG 99 Cb 0.46 -1.10 -0.10 0.00 -1.02 0.00 0.00 32.46 30.71 1ama n ARG 99 CO 0.00 0.00 0.00 1.52 -1.52 0.00 0.00 177.63 177.63 1ama s TYR 100 N -0.28 1.35 -0.06 -1.55 1.13 -1.26 -0.88 117.35 115.80 1ama s TYR 100 Ca 0.05 -0.98 -0.03 0.00 -1.41 0.00 0.00 57.07 54.70 1ama s TYR 100 Cb 0.04 -0.77 0.04 0.00 -1.10 0.00 0.00 41.96 40.17 1ama s TYR 100 CO 0.01 -0.15 0.11 0.54 -2.51 0.00 0.00 175.55 173.55 1ama s VAL 101 N -3.57 -0.18 -0.10 -3.49 0.11 -0.72 -4.88 120.40 107.58 1ama s VAL 101 Ca 0.26 0.39 0.03 0.00 -2.93 0.00 0.00 61.98 59.72 1ama s VAL 101 Cb 0.06 -0.22 0.01 0.00 -1.53 0.00 0.00 36.38 34.70 1ama s VAL 101 CO 0.06 0.16 -0.18 -0.89 -3.33 0.00 0.00 175.10 170.92 1ama s THR 102 N 2.19 1.68 -0.08 5.04 2.01 -1.26 0.48 115.64 125.70 1ama s THR 102 Ca 0.04 -0.78 0.02 0.00 0.31 0.00 0.00 61.69 61.28 1ama s THR 102 Cb -0.12 -1.50 0.01 0.00 0.01 0.00 0.00 72.50 70.91 1ama s THR 102 CO -0.04 0.48 -0.14 0.54 -0.69 0.00 0.00 174.62 174.76 1ama s VAL 103 N 0.68 1.32 0.26 3.82 0.11 0.90 -4.92 120.40 122.58 1ama s VAL 103 Ca -0.12 -0.57 -0.30 0.00 -2.93 0.00 0.00 61.98 58.06 1ama s VAL 103 Cb -0.16 -1.21 -0.11 0.00 -1.53 0.00 0.00 36.38 33.37 1ama s VAL 103 CO 0.03 0.40 1.54 -1.58 -3.33 0.00 0.00 175.10 172.16 1ama s GLN 104 N 0.78 4.19 0.35 1.54 0.74 0.01 -0.30 119.66 126.96 1ama s GLN 104 Ca -0.12 2.45 0.04 0.00 0.05 0.00 0.00 55.36 57.79 1ama s GLN 104 Cb -0.16 -3.07 -0.06 0.00 1.10 0.00 0.00 33.01 30.83 1ama s GLN 104 CO 0.02 -0.55 0.06 0.20 -0.55 0.00 0.00 175.29 174.47 1ama s GLY 105 N 0.51 2.22 -1.42 2.59 0.00 -0.67 -4.74 107.32 105.82 1ama s GLY 105 Ca 0.63 -1.94 -0.13 0.00 0.00 0.00 0.00 44.72 43.27 1ama s GLY 105 CO 0.44 -1.87 2.14 1.39 0.00 0.00 0.00 173.10 175.21 1ama n ILE 106 N -0.77 3.63 -4.48 0.90 5.41 -1.26 -2.67 119.36 120.13 1ama n ILE 106 Ca -0.04 -3.31 0.00 0.00 1.00 0.00 0.00 62.75 60.41 1ama n ILE 106 Cb 0.66 -2.55 0.00 0.00 -0.71 0.00 0.00 39.64 37.04 1ama n ILE 106 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1ama n SER 107 N 5.79 -2.39 0.08 4.38 2.88 -1.26 -1.65 113.62 121.45 1ama n SER 107 Ca 0.50 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.91 1ama n SER 107 Cb 0.39 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.79 1ama n SER 107 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1ama h GLY 108 N 0.00 -0.15 0.11 0.46 0.00 -1.80 -1.15 103.07 100.55 1ama h GLY 108 Ca 0.00 0.09 0.04 0.00 0.00 0.00 0.00 47.33 47.47 1ama h GLY 108 CO 0.00 -0.09 -0.37 -0.84 0.00 0.00 0.00 176.54 175.25 1ama h THR 109 N -0.17 0.22 -0.91 4.70 2.02 -1.92 0.97 112.91 117.82 1ama h THR 109 Ca 0.01 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.23 1ama h THR 109 Cb 0.18 0.22 -0.06 0.00 -1.74 0.00 0.00 68.15 66.75 1ama h THR 109 CO -0.04 0.00 0.58 1.23 0.37 0.00 0.00 175.52 177.67 1ama h GLY 110 N -0.45 1.33 0.86 2.16 0.00 -1.25 0.31 103.07 106.04 1ama h GLY 110 Ca 0.08 -0.44 -0.03 0.00 0.00 0.00 0.00 47.33 46.94 1ama h GLY 110 CO -0.36 0.37 0.04 1.76 0.00 0.00 0.00 176.54 178.34 1ama h SER 111 N 1.12 0.41 -0.87 0.19 0.02 -0.58 0.11 113.55 113.95 1ama h SER 111 Ca 0.37 -0.27 0.09 0.00 -0.84 0.00 0.00 61.79 61.14 1ama h SER 111 Cb 0.03 -0.11 -0.07 0.00 0.14 0.00 0.00 62.40 62.39 1ama h SER 111 CO -0.13 0.57 0.52 0.25 -1.14 0.00 0.00 176.83 176.90 1ama h LEU 112 N 0.23 0.77 -0.07 5.07 5.85 -0.47 0.99 115.31 127.67 1ama h LEU 112 Ca 0.08 0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.76 1ama h LEU 112 Cb 0.34 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.26 1ama h LEU 112 CO 0.01 0.45 -0.27 -0.09 -0.34 0.00 0.00 178.44 178.20 1ama h ARG 113 N 0.88 0.31 -0.81 1.25 9.65 -0.61 -1.58 114.38 123.47 1ama h ARG 113 Ca 0.41 -0.24 0.11 0.00 -1.10 0.00 0.00 59.98 59.16 1ama h ARG 113 Cb 0.33 0.04 -0.06 0.00 -1.39 0.00 0.00 29.97 28.89 1ama h ARG 113 CO -0.23 0.87 0.53 0.28 2.80 0.00 0.00 179.97 184.22 1ama h VAL 114 N -0.18 0.92 -0.51 0.20 2.07 -0.31 0.46 116.25 118.90 1ama h VAL 114 Ca -0.01 -0.25 -0.12 0.00 0.82 0.00 0.00 66.70 67.14 1ama h VAL 114 Cb 0.90 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1ama h VAL 114 CO 0.06 0.13 -0.16 1.23 0.02 0.00 0.00 177.57 178.84 1ama h GLY 115 N 0.72 1.10 1.97 2.17 0.00 -0.76 -0.97 103.07 107.30 1ama h GLY 115 Ca 0.38 -0.93 -0.16 0.00 0.00 0.00 0.00 47.33 46.62 1ama h GLY 115 CO -0.15 0.85 -0.74 0.00 0.00 0.00 0.00 176.54 176.50 1ama h ALA 116 N 0.89 0.77 -0.00 3.60 0.00 -0.16 -1.91 119.26 122.44 1ama h ALA 116 Ca 0.12 -0.67 -0.18 0.00 0.00 0.00 0.00 54.91 54.19 1ama h ALA 116 Cb 0.74 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1ama h ALA 116 CO 0.06 0.91 -0.81 -0.91 0.00 0.00 0.00 179.25 178.50 1ama h ASN 117 N 0.01 0.10 -0.00 0.00 4.21 -0.86 -0.81 115.58 118.23 1ama h ASN 117 Ca -0.01 -0.08 -0.00 0.00 1.21 0.00 0.00 56.30 57.42 1ama h ASN 117 Cb 1.31 -0.03 -0.00 0.00 -1.12 0.00 0.00 38.32 38.48 1ama h ASN 117 CO 0.10 0.87 -0.00 0.15 -1.29 0.00 0.00 177.43 177.25 1ama h PHE 118 N 0.04 0.01 -0.02 1.19 3.57 -1.07 -2.40 116.94 118.26 1ama h PHE 118 Ca -0.02 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.49 1ama h PHE 118 Cb 1.43 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 40.15 1ama h PHE 118 CO 0.01 0.37 -0.06 -0.07 -2.23 0.00 0.00 178.31 176.33 1ama h LEU 119 N -0.36 -0.17 -1.03 0.59 3.38 -1.32 0.85 115.31 117.24 1ama h LEU 119 Ca 0.00 0.03 0.11 0.00 0.09 0.00 0.00 57.88 58.11 1ama h LEU 119 Cb 0.37 0.08 -0.08 0.00 0.09 0.00 0.00 40.66 41.12 1ama h LEU 119 CO 0.00 -0.09 0.63 -0.61 0.09 0.00 0.00 178.44 178.46 1ama h GLN 120 N -0.10 0.98 0.00 1.13 -0.00 -1.15 0.26 115.11 116.25 1ama h GLN 120 Ca 0.03 -0.06 -0.00 0.00 -0.00 0.00 0.00 58.65 58.62 1ama h GLN 120 Cb 0.14 -0.22 0.00 0.00 0.00 0.00 0.00 27.48 27.40 1ama h GLN 120 CO -0.08 0.65 -0.00 -0.09 0.00 0.00 0.00 178.83 179.31 1ama h ARG 121 N 1.01 -0.00 0.00 1.69 2.43 -0.82 -3.42 114.38 115.28 1ama h ARG 121 Ca 0.48 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.65 1ama h ARG 121 Cb 0.43 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1ama h ARG 121 CO -0.24 0.84 -0.81 1.19 -1.51 0.00 0.00 179.97 179.44 1ama n PHE 122 N -4.69 0.00 -2.64 2.20 3.72 0.29 -4.85 117.46 111.50 1ama n PHE 122 Ca -0.09 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.89 1ama n PHE 122 Cb 0.41 -0.06 -0.03 0.00 -0.94 0.00 0.00 39.48 38.86 1ama n PHE 122 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 176.76 176.83 1ama s PHE 123 N -2.36 2.66 -1.84 1.38 5.36 0.91 -4.81 117.98 119.28 1ama s PHE 123 Ca 0.03 -0.99 0.27 0.00 -0.96 0.00 0.00 56.93 55.28 1ama s PHE 123 Cb 0.10 -4.62 1.53 0.00 -0.34 0.00 0.00 43.02 39.69 1ama s PHE 123 CO 0.54 -1.84 1.94 0.36 -1.46 0.00 0.00 175.22 174.76 1ama n LYS 124 N 8.38 0.71 0.01 10.12 2.85 -1.26 -3.91 118.16 135.06 1ama n LYS 124 Ca 0.32 0.01 0.11 0.00 -1.05 0.00 0.00 58.31 57.70 1ama n LYS 124 Cb 0.50 -1.50 0.06 0.00 -0.65 0.00 0.00 35.03 33.44 1ama n LYS 124 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1ama n PHE 125 N -1.08 0.06 -3.61 5.58 3.72 -1.26 -5.02 117.46 115.84 1ama n PHE 125 Ca 0.18 0.02 0.00 0.00 -0.05 0.00 0.00 57.45 57.60 1ama n PHE 125 Cb 0.13 -0.21 -0.01 0.00 -0.94 0.00 0.00 39.48 38.45 1ama n PHE 125 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1ama s SER 126 N -3.23 -0.07 0.00 4.37 0.15 -1.25 -4.81 113.70 108.85 1ama s SER 126 Ca 0.08 -0.09 0.00 0.00 0.70 0.00 0.00 55.95 56.64 1ama s SER 126 Cb 0.16 0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 1ama s SER 126 CO 0.79 -0.26 0.63 0.54 1.20 0.00 0.00 173.24 176.13 1ama n ARG 129 N -0.37 0.44 -3.19 5.44 5.12 -1.26 -4.91 116.66 117.93 1ama n ARG 129 Ca -0.06 -0.79 -0.42 0.00 -1.93 0.00 0.00 57.85 54.65 1ama n ARG 129 Cb 0.62 -0.94 -0.07 0.00 -1.16 0.00 0.00 32.46 30.90 1ama n ARG 129 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1ama s ASP 130 N -0.33 6.36 -0.19 0.55 1.01 -1.26 0.26 116.67 123.06 1ama s ASP 130 Ca 0.00 0.04 -0.04 0.00 0.71 0.00 0.00 52.55 53.26 1ama s ASP 130 Cb 0.00 -2.29 -0.02 0.00 1.01 0.00 0.00 42.92 41.62 1ama s ASP 130 CO 0.00 -0.53 -0.02 -0.69 0.21 0.00 0.00 175.17 174.14 1ama s VAL 133 N 2.52 3.75 -0.26 -1.27 1.01 -0.39 -2.14 120.40 123.63 1ama s VAL 133 Ca 0.21 -0.39 -0.15 0.00 0.00 0.00 0.00 61.98 61.66 1ama s VAL 133 Cb -0.15 -2.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1ama s VAL 133 CO 0.14 0.44 0.37 -0.31 0.00 0.00 0.00 175.10 175.74 1ama s TYR 134 N 0.98 3.27 0.10 5.22 1.51 0.18 -0.99 117.35 127.62 1ama s TYR 134 Ca 0.01 0.44 0.05 0.00 -1.01 0.00 0.00 57.07 56.55 1ama s TYR 134 Cb -0.14 -2.55 -0.04 0.00 -0.11 0.00 0.00 41.96 39.12 1ama s TYR 134 CO 0.01 -0.18 0.01 -0.51 -1.11 0.00 0.00 175.55 173.77 1ama s LEU 135 N 1.89 3.49 0.84 -1.29 1.43 -0.39 -0.12 118.68 124.53 1ama s LEU 135 Ca 0.15 -0.17 -0.12 0.00 -1.03 0.00 0.00 54.13 52.96 1ama s LEU 135 Cb -0.15 -2.21 0.10 0.00 0.03 0.00 0.00 46.19 43.95 1ama s LEU 135 CO 0.09 0.17 1.10 -2.84 0.23 0.00 0.00 176.35 175.10 1ama s PRO 136 N -2.37 1.72 -0.30 1.29 0.02 -1.26 -0.98 135.00 133.12 1ama s PRO 136 Ca 0.26 0.64 0.03 0.00 0.02 0.00 0.00 61.00 61.96 1ama s PRO 136 Cb -0.12 -1.88 0.08 0.00 0.02 0.00 0.00 34.50 32.61 1ama s PRO 136 CO 0.19 -1.88 -0.02 0.15 -0.33 0.00 0.00 177.00 175.11 1ama s LYS 137 N -5.11 1.83 0.68 5.54 1.02 -0.88 -3.19 119.74 119.63 1ama s LYS 137 Ca 0.62 -1.62 -0.03 0.00 0.02 0.00 0.00 55.97 54.96 1ama s LYS 137 Cb -0.15 -3.05 0.08 0.00 -0.52 0.00 0.00 37.83 34.19 1ama s LYS 137 CO 0.55 -0.77 0.95 -1.25 -0.92 0.00 0.00 175.35 173.91 1ama s PRO 138 N 1.00 2.03 0.27 -1.68 0.04 -1.26 -1.03 135.00 134.37 1ama s PRO 138 Ca 0.02 -0.74 0.02 0.00 0.04 0.00 0.00 61.00 60.33 1ama s PRO 138 Cb -0.19 -2.31 -0.04 0.00 0.04 0.00 0.00 34.50 31.99 1ama s PRO 138 CO -0.07 -1.22 0.13 0.45 0.04 0.00 0.00 177.00 176.34 1ama s SER 139 N -4.59 1.14 0.14 6.66 0.15 -1.19 -4.71 113.70 111.30 1ama s SER 139 Ca 0.62 -1.46 -0.31 0.00 0.70 0.00 0.00 55.95 55.50 1ama s SER 139 Cb -0.08 0.30 -0.09 0.00 -1.71 0.00 0.00 66.02 64.44 1ama s SER 139 CO 0.43 -0.82 1.43 0.86 1.20 0.00 0.00 173.24 176.34 1ama s TRP 140 N -3.77 3.19 0.34 3.44 -0.00 -1.00 -4.56 118.94 116.58 1ama s TRP 140 Ca 0.37 0.90 0.12 0.00 -0.00 0.00 0.00 56.10 57.49 1ama s TRP 140 Cb 0.06 -3.74 1.06 0.00 -0.00 0.00 0.00 33.47 30.85 1ama s TRP 140 CO 0.15 -2.60 1.61 0.78 -0.00 0.00 0.00 176.95 176.89 1ama h GLY 141 N 6.62 1.86 2.00 5.86 0.00 -1.99 -0.88 103.07 116.53 1ama h GLY 141 Ca -0.43 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 46.82 1ama h GLY 141 CO 0.87 -0.60 0.00 -0.57 0.00 0.00 0.00 176.54 176.24 1ama h ASN 142 N 0.11 0.00 -0.95 0.19 -1.24 -2.02 -3.22 115.58 108.46 1ama h ASN 142 Ca 0.72 0.00 0.09 0.00 0.71 0.00 0.00 56.30 57.82 1ama h ASN 142 Cb 1.71 0.00 -0.07 0.00 0.73 0.00 0.00 38.32 40.68 1ama h ASN 142 CO -0.74 0.00 0.59 0.45 -1.29 0.00 0.00 177.43 176.43 1ama h HIS 143 N 0.00 1.08 0.30 0.67 3.86 -1.53 -2.24 115.15 117.28 1ama h HIS 143 Ca 0.00 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.23 1ama h HIS 143 Cb 0.45 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 28.57 1ama h HIS 143 CO 0.00 0.48 -0.23 1.15 0.86 0.00 0.00 177.93 180.18 1ama h THR 144 N 0.99 0.00 0.00 2.45 2.02 -1.76 -2.77 112.91 113.84 1ama h THR 144 Ca 0.44 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.58 1ama h THR 144 Cb 0.34 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.75 1ama h THR 144 CO -0.23 0.00 -0.19 1.55 0.37 0.00 0.00 175.52 177.02 1ama h PRO 145 N -0.51 0.00 -0.51 6.66 0.13 -1.76 -0.84 132.00 135.16 1ama h PRO 145 Ca -0.04 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.09 1ama h PRO 145 Cb 0.43 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.53 1ama h PRO 145 CO 0.01 0.19 0.30 0.82 -0.23 0.00 0.00 178.00 179.09 1ama h ILE 146 N 0.00 1.16 0.10 -3.56 2.04 -1.33 0.16 117.51 116.07 1ama h ILE 146 Ca -0.00 -0.36 -0.28 0.00 1.00 0.00 0.00 64.86 65.21 1ama h ILE 146 Cb 0.35 0.48 0.02 0.00 -0.74 0.00 0.00 36.82 36.93 1ama h ILE 146 CO 0.02 0.16 -1.19 -0.26 0.00 0.00 0.00 178.15 176.88 1ama h PHE 147 N 0.68 0.90 -0.50 1.37 0.04 -1.29 -3.02 116.94 115.12 1ama h PHE 147 Ca 0.18 -0.56 -0.11 0.00 2.80 0.00 0.00 57.97 60.28 1ama h PHE 147 Cb -0.00 -0.07 -0.02 0.00 2.20 0.00 0.00 35.95 38.06 1ama h PHE 147 CO -0.03 1.40 -0.13 -0.09 -0.60 0.00 0.00 178.31 178.87 1ama h ARG 148 N 0.25 0.97 -0.11 1.51 2.43 -1.08 -0.50 114.38 117.85 1ama h ARG 148 Ca -0.16 -0.38 -0.14 0.00 -0.81 0.00 0.00 59.98 58.49 1ama h ARG 148 Cb 1.87 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 31.35 1ama h ARG 148 CO 0.22 1.05 -0.52 -0.44 -1.51 0.00 0.00 179.97 178.77 1ama h ASP 149 N 0.83 0.35 0.97 -3.80 5.19 -1.07 -2.73 116.42 116.16 1ama h ASP 149 Ca 0.13 -0.18 0.00 0.00 -0.62 0.00 0.00 57.03 56.36 1ama h ASP 149 Cb 0.69 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 40.10 1ama h ASP 149 CO 0.05 0.81 0.00 0.00 -3.12 0.00 0.00 179.24 176.98 1ama h ALA 150 N 1.20 1.00 0.00 3.45 0.00 -1.40 -3.47 119.26 120.04 1ama h ALA 150 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ama h ALA 150 Cb 1.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1ama h ALA 150 CO 0.09 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.75 1ama n GLY 151 N 0.06 1.56 3.96 0.00 0.00 -1.00 -4.75 105.19 105.02 1ama n GLY 151 Ca 0.01 -0.17 -0.22 0.00 0.00 0.00 0.00 46.02 45.63 1ama n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ama s LEU 152 N 0.00 2.99 0.14 0.99 1.43 -0.23 -5.00 118.68 118.99 1ama s LEU 152 Ca 0.00 -0.99 0.02 0.00 -1.03 0.00 0.00 54.13 52.13 1ama s LEU 152 Cb 0.00 -1.53 -0.04 0.00 0.03 0.00 0.00 46.19 44.65 1ama s LEU 152 CO 0.00 -1.14 0.27 -1.10 0.23 0.00 0.00 176.35 174.61 1ama s GLN 154 N -4.43 3.42 -0.01 1.70 -1.52 0.71 -4.35 119.66 115.19 1ama s GLN 154 Ca 0.48 -0.58 0.05 0.00 -1.95 0.00 0.00 55.36 53.36 1ama s GLN 154 Cb -0.04 -2.97 -0.03 0.00 -0.22 0.00 0.00 33.01 29.75 1ama s GLN 154 CO 0.30 0.53 -0.15 -0.51 -0.25 0.00 0.00 175.29 175.22 1ama s LEU 155 N -3.12 2.74 0.28 2.90 2.01 -1.26 -1.26 118.68 120.98 1ama s LEU 155 Ca 0.34 -0.27 0.03 0.00 0.01 0.00 0.00 54.13 54.24 1ama s LEU 155 Cb -0.11 -1.58 -0.04 0.00 0.01 0.00 0.00 46.19 44.47 1ama s LEU 155 CO 0.28 0.30 0.15 -1.10 1.01 0.00 0.00 176.35 177.00 1ama s GLN 156 N -1.07 1.52 0.02 1.70 -1.52 -0.16 -4.91 119.66 115.24 1ama s GLN 156 Ca 0.13 -1.86 0.00 0.00 -1.95 0.00 0.00 55.36 51.69 1ama s GLN 156 Cb -0.11 -0.06 -0.02 0.00 -0.22 0.00 0.00 33.01 32.60 1ama s GLN 156 CO 0.03 -0.43 -0.04 0.00 -0.25 0.00 0.00 175.29 174.61 1ama s ALA 157 N -3.69 0.19 0.02 6.09 0.00 -1.26 -1.26 121.76 121.84 1ama s ALA 157 Ca 0.37 -0.62 0.06 0.00 0.00 0.00 0.00 51.96 51.76 1ama s ALA 157 Cb 0.06 0.14 -0.02 0.00 0.00 0.00 0.00 23.12 23.29 1ama s ALA 157 CO 0.17 -0.14 -0.19 1.52 0.00 0.00 0.00 175.76 177.11 1ama s TYR 158 N -1.49 1.65 0.37 0.00 -0.85 -0.15 -4.89 117.35 111.98 1ama s TYR 158 Ca -0.15 -0.34 -0.28 0.00 -0.52 0.00 0.00 57.07 55.78 1ama s TYR 158 Cb -0.10 -1.01 -0.10 0.00 0.38 0.00 0.00 41.96 41.13 1ama s TYR 158 CO -0.01 0.04 1.35 1.03 -1.52 0.00 0.00 175.55 176.44 1ama s ARG 159 N -0.87 4.17 0.09 -3.49 0.52 -1.26 -2.07 118.95 116.04 1ama s ARG 159 Ca 0.06 2.29 0.00 0.00 -0.52 0.00 0.00 55.73 57.57 1ama s ARG 159 Cb -0.08 -2.95 0.00 0.00 0.52 0.00 0.00 34.95 32.44 1ama s ARG 159 CO 0.01 -0.37 0.00 0.98 0.02 0.00 0.00 175.30 175.94 1ama n TYR 160 N 0.51 -0.73 -3.58 -0.53 9.36 -1.16 -3.79 117.16 117.25 1ama n TYR 160 Ca 0.01 0.13 -0.35 0.00 3.32 0.00 0.00 57.90 61.01 1ama n TYR 160 Cb 0.42 0.42 -0.06 0.00 -0.63 0.00 0.00 39.34 39.49 1ama n TYR 160 CO 0.00 0.00 0.00 -0.47 0.22 0.00 0.00 176.86 176.61 1ama s TYR 161 N -1.35 3.61 -0.31 2.98 5.04 -0.19 0.23 117.35 127.36 1ama s TYR 161 Ca 0.00 0.81 0.03 0.00 -2.44 0.00 0.00 57.07 55.48 1ama s TYR 161 Cb 0.00 -2.17 0.09 0.00 0.35 0.00 0.00 41.96 40.23 1ama s TYR 161 CO 0.00 0.56 0.01 0.34 -1.34 0.00 0.00 175.55 175.12 1ama s ASP 162 N -1.59 4.58 0.54 4.32 2.15 0.15 -4.71 116.67 122.11 1ama s ASP 162 Ca 0.30 -1.89 0.35 0.00 0.43 0.00 0.00 52.55 51.74 1ama s ASP 162 Cb -0.14 -1.52 1.53 0.00 -0.30 0.00 0.00 42.92 42.49 1ama s ASP 162 CO 0.17 -0.33 2.03 1.55 -0.17 0.00 0.00 175.17 178.41 1ama h PRO 163 N 7.71 0.00 -0.20 4.34 0.13 -1.96 0.36 132.00 142.37 1ama h PRO 163 Ca -0.09 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.83 1ama h PRO 163 Cb 1.03 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.16 1ama h PRO 163 CO 0.50 0.00 -0.70 0.87 -0.23 0.00 0.00 178.00 178.43 1ama h LYS 164 N 0.00 0.83 -0.02 0.86 1.57 -1.93 -3.31 116.57 114.57 1ama h LYS 164 Ca 0.00 -0.63 0.00 0.00 -1.87 0.00 0.00 60.65 58.15 1ama h LYS 164 Cb 0.39 0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1ama h LYS 164 CO 0.00 1.24 -0.11 2.41 -0.57 0.00 0.00 179.45 182.42 1ama n THR 165 N -3.96 0.00 -3.58 -0.16 -1.04 -1.09 -5.02 114.28 99.43 1ama n THR 165 Ca -0.06 -0.44 -0.22 0.00 -2.04 0.00 0.00 64.05 61.28 1ama n THR 165 Cb 0.71 1.28 0.07 0.00 -1.82 0.00 0.00 70.33 70.57 1ama n THR 165 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ama s SER 167 N -3.84 0.08 0.13 0.00 1.04 -0.84 -4.99 113.70 105.29 1ama s SER 167 Ca 0.30 -1.09 -0.32 0.00 0.48 0.00 0.00 55.95 55.31 1ama s SER 167 Cb -0.14 0.79 -0.12 0.00 0.10 0.00 0.00 66.02 66.66 1ama s SER 167 CO 0.75 -1.56 1.74 -0.11 0.98 0.00 0.00 173.24 175.05 1ama n LEU 168 N -0.52 3.71 -4.44 2.42 7.94 -1.26 0.32 117.00 125.17 1ama n LEU 168 Ca -0.06 1.03 -0.44 0.00 -1.11 0.00 0.00 56.01 55.43 1ama n LEU 168 Cb 0.60 -1.50 -0.01 0.00 0.53 0.00 0.00 43.42 43.04 1ama n LEU 168 CO 0.25 0.02 1.15 -0.62 -1.11 0.00 0.00 177.39 177.08 1ama s ASP 169 N 1.97 6.92 0.17 1.96 -1.08 0.64 -4.79 116.67 122.46 1ama s ASP 169 Ca 0.80 -2.69 -0.11 0.00 -0.52 0.00 0.00 52.55 50.03 1ama s ASP 169 Cb -0.56 -2.38 0.07 0.00 -1.46 0.00 0.00 42.92 38.60 1ama s ASP 169 CO 0.38 -0.81 1.71 0.15 0.52 0.00 0.00 175.17 177.11 1ama h PHE 170 N 7.75 0.96 -0.10 -5.34 3.57 -1.92 0.38 116.94 122.23 1ama h PHE 170 Ca 0.24 -0.09 -0.09 0.00 3.53 0.00 0.00 57.97 61.55 1ama h PHE 170 Cb 0.94 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.38 1ama h PHE 170 CO 1.10 0.78 -0.36 1.15 -2.23 0.00 0.00 178.31 178.75 1ama h THR 171 N 0.85 1.28 0.09 4.41 2.02 -1.98 -1.25 112.91 118.34 1ama h THR 171 Ca 0.20 -1.37 -0.27 0.00 0.77 0.00 0.00 66.41 65.74 1ama h THR 171 Cb 0.27 1.60 0.01 0.00 -1.74 0.00 0.00 68.15 68.29 1ama h THR 171 CO -0.01 0.41 -1.16 1.23 0.37 0.00 0.00 175.52 176.36 1ama h GLY 172 N 1.13 0.51 0.88 2.16 0.00 -1.89 -2.24 103.07 103.62 1ama h GLY 172 Ca 0.02 -1.06 -0.05 0.00 0.00 0.00 0.00 47.33 46.24 1ama h GLY 172 CO 0.05 0.94 0.00 0.00 0.00 0.00 0.00 176.54 177.53 1ama h ALA 173 N 0.52 0.40 -0.45 3.60 0.00 -0.74 -1.59 119.26 121.00 1ama h ALA 173 Ca -0.14 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.49 1ama h ALA 173 Cb 1.83 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.49 1ama h ALA 173 CO 0.21 0.15 0.08 0.52 0.00 0.00 0.00 179.25 180.21 1ama h MET 174 N 0.32 0.69 -0.10 0.00 2.86 -1.30 0.21 114.93 117.61 1ama h MET 174 Ca 0.09 -0.14 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 1ama h MET 174 Cb 0.43 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 31.99 1ama h MET 174 CO 0.02 0.65 -0.08 0.93 1.06 0.00 0.00 176.91 179.48 1ama h GLU 175 N 0.66 0.23 -0.27 1.72 5.08 -1.16 -0.82 114.58 120.03 1ama h GLU 175 Ca 0.15 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1ama h GLU 175 Cb 0.30 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 1ama h GLU 175 CO 0.00 0.63 0.12 -0.44 -1.00 0.00 0.00 179.01 178.33 1ama h ASP 176 N -0.16 0.36 -0.47 1.42 3.32 -1.09 -2.92 116.42 116.88 1ama h ASP 176 Ca 0.02 -0.13 -0.08 0.00 0.02 0.00 0.00 57.03 56.85 1ama h ASP 176 Cb 0.58 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.02 1ama h ASP 176 CO 0.02 0.39 0.01 0.40 -1.72 0.00 0.00 179.24 178.34 1ama h ILE 177 N 0.30 1.25 0.00 0.35 2.04 -0.62 -2.67 117.51 118.17 1ama h ILE 177 Ca 0.09 -1.05 0.00 0.00 1.00 0.00 0.00 64.86 64.90 1ama h ILE 177 Cb 0.13 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1ama h ILE 177 CO -0.01 0.38 0.00 0.77 0.00 0.00 0.00 178.15 179.29 1ama h SER 178 N 0.83 0.00 -0.14 1.72 4.64 -1.02 -2.73 113.55 116.85 1ama h SER 178 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1ama h SER 178 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1ama h SER 178 CO 0.02 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.27 1ama n LYS 179 N -2.95 1.50 -2.27 4.77 5.02 -1.03 -4.98 118.16 118.23 1ama n LYS 179 Ca -0.01 -1.59 -0.41 0.00 -2.02 0.00 0.00 58.31 54.29 1ama n LYS 179 Cb 0.20 -1.29 -0.03 0.00 -0.02 0.00 0.00 35.03 33.90 1ama n LYS 179 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1ama s ILE 180 N -1.10 3.17 0.45 -0.18 1.01 -1.03 -4.94 121.20 118.58 1ama s ILE 180 Ca 0.20 1.08 -0.25 0.00 0.00 0.00 0.00 60.65 61.69 1ama s ILE 180 Cb 0.13 -3.69 -0.08 0.00 0.01 0.00 0.00 42.46 38.83 1ama s ILE 180 CO 0.18 0.22 1.34 -2.84 0.00 0.00 0.00 174.94 173.84 1ama s PRO 181 N -1.00 3.71 0.54 2.79 0.02 -1.26 -4.95 135.00 134.85 1ama s PRO 181 Ca 0.51 2.22 -0.19 0.00 0.02 0.00 0.00 61.00 63.56 1ama s PRO 181 Cb -0.36 -2.61 -0.09 0.00 0.02 0.00 0.00 34.50 31.46 1ama s PRO 181 CO 0.43 -0.72 0.51 0.39 -0.33 0.00 0.00 177.00 177.28 1ama n GLU 182 N -0.23 0.52 -1.79 5.54 1.02 -1.26 -2.38 120.64 122.06 1ama n GLU 182 Ca 0.06 0.20 -0.15 0.00 -0.02 0.00 0.00 57.16 57.24 1ama n GLU 182 Cb 0.44 -1.65 -0.05 0.00 -0.02 0.00 0.00 31.44 30.16 1ama n GLU 182 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1ama n LYS 183 N 0.11 -1.58 -2.41 3.49 5.02 0.16 -4.95 118.16 118.00 1ama n LYS 183 Ca 0.11 0.86 -0.25 0.00 -2.02 0.00 0.00 58.31 57.01 1ama n LYS 183 Cb 0.46 -5.26 0.10 0.00 -0.02 0.00 0.00 35.03 30.31 1ama n LYS 183 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1ama s SER 184 N -2.22 4.34 -0.10 4.39 0.01 -1.00 -4.31 113.70 114.82 1ama s SER 184 Ca 0.00 -0.06 -0.00 0.00 1.31 0.00 0.00 55.95 57.20 1ama s SER 184 Cb 0.00 -0.38 -0.03 0.00 0.21 0.00 0.00 66.02 65.83 1ama s SER 184 CO 0.00 -1.87 -0.07 -0.63 0.41 0.00 0.00 173.24 171.08 1ama s ILE 185 N -3.24 3.64 -0.04 1.44 1.01 -0.91 -0.87 121.20 122.22 1ama s ILE 185 Ca 0.65 -0.48 0.02 0.00 0.00 0.00 0.00 60.65 60.84 1ama s ILE 185 Cb -0.07 -2.52 0.01 0.00 0.01 0.00 0.00 42.46 39.90 1ama s ILE 185 CO 0.45 0.56 -0.09 -0.51 0.00 0.00 0.00 174.94 175.35 1ama s ILE 186 N -0.34 0.85 -0.24 2.92 2.07 -0.48 0.49 121.20 126.47 1ama s ILE 186 Ca 0.05 -0.34 -0.12 0.00 -1.41 0.00 0.00 60.65 58.82 1ama s ILE 186 Cb -0.12 -0.79 -0.05 0.00 0.13 0.00 0.00 42.46 41.63 1ama s ILE 186 CO 0.02 0.28 0.23 -0.22 -1.91 0.00 0.00 174.94 173.35 1ama s LEU 187 N 0.55 4.11 0.00 8.50 0.20 0.83 -0.65 118.68 132.22 1ama s LEU 187 Ca -0.10 0.21 0.06 0.00 0.69 0.00 0.00 54.13 54.99 1ama s LEU 187 Cb -0.13 -2.23 -0.02 0.00 -0.43 0.00 0.00 46.19 43.39 1ama s LEU 187 CO 0.02 0.00 -0.18 -0.76 -0.29 0.00 0.00 176.35 175.14 1ama s LEU 188 N 1.25 2.07 -0.23 -0.68 1.43 0.16 -4.41 118.68 118.26 1ama s LEU 188 Ca 0.11 -0.37 -0.19 0.00 -1.03 0.00 0.00 54.13 52.66 1ama s LEU 188 Cb -0.14 -0.90 -0.03 0.00 0.03 0.00 0.00 46.19 45.15 1ama s LEU 188 CO 0.06 0.19 0.54 -1.00 0.23 0.00 0.00 176.35 176.37 1ama s HIS 189 N -0.51 3.31 0.24 0.29 3.76 -1.26 -2.00 115.29 119.12 1ama s HIS 189 Ca 0.07 0.72 -0.05 0.00 -0.15 0.00 0.00 55.06 55.65 1ama s HIS 189 Cb -0.07 -2.72 0.46 0.00 1.11 0.00 0.00 32.58 31.36 1ama s HIS 189 CO -0.00 -0.21 1.70 0.00 -0.85 0.00 0.00 174.74 175.37 1ama h ALA 190 N 7.76 0.97 -1.77 -1.40 0.00 -1.74 -3.46 119.26 119.63 1ama h ALA 190 Ca -0.30 0.16 0.14 0.00 0.00 0.00 0.00 54.91 54.90 1ama h ALA 190 Cb 1.14 0.20 -0.19 0.00 0.00 0.00 0.00 17.79 18.94 1ama h ALA 190 CO 0.73 -0.31 0.61 0.00 0.00 0.00 0.00 179.25 180.29 1ama n ALA 192 N 0.17 -2.53 -1.73 0.00 0.00 -1.26 -4.55 120.51 110.61 1ama n ALA 192 Ca -0.07 -0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.95 1ama n ALA 192 Cb 0.59 -3.06 -0.02 0.00 0.00 0.00 0.00 19.45 16.97 1ama n ALA 192 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1ama n HIS 193 N -2.54 2.69 -4.01 0.00 -0.00 -1.26 -4.78 115.22 105.31 1ama n HIS 193 Ca -0.06 0.30 -0.35 0.00 0.46 0.00 0.00 57.72 58.07 1ama n HIS 193 Cb 0.56 -2.56 -0.13 0.00 -0.12 0.00 0.00 29.99 27.74 1ama n HIS 193 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1ama s ASN 194 N 0.44 4.69 -0.06 0.26 2.47 -1.26 0.12 114.94 121.60 1ama s ASN 194 Ca 0.65 -0.26 0.18 0.00 0.42 0.00 0.00 52.86 53.85 1ama s ASN 194 Cb -0.53 -1.81 0.64 0.00 -1.45 0.00 0.00 41.25 38.11 1ama s ASN 194 CO 0.49 0.03 1.54 -0.81 -3.72 0.00 0.00 177.10 174.63 1ama n PRO 195 N 4.46 3.16 0.04 0.43 -0.04 -1.26 -2.38 135.00 139.41 1ama n PRO 195 Ca -0.17 -2.57 -0.11 0.00 -0.04 0.00 0.00 63.50 60.61 1ama n PRO 195 Cb 0.51 -1.73 0.02 0.00 -0.04 0.00 0.00 33.50 32.27 1ama n PRO 195 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1ama h THR 196 N 3.88 1.36 -0.03 0.52 1.35 -1.86 -3.39 112.91 114.75 1ama h THR 196 Ca 0.00 -2.10 -0.01 0.00 -0.55 0.00 0.00 66.41 63.74 1ama h THR 196 Cb 1.19 2.08 -0.01 0.00 -1.73 0.00 0.00 68.15 69.68 1ama h THR 196 CO 0.13 0.64 -0.01 0.61 -0.25 0.00 0.00 175.52 176.64 1ama n GLY 197 N 0.56 0.26 3.33 5.82 0.00 0.32 -4.65 105.19 110.83 1ama n GLY 197 Ca -0.05 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 1ama n GLY 197 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ama s VAL 198 N -1.46 3.43 0.22 1.61 1.01 -1.26 -1.40 120.40 122.55 1ama s VAL 198 Ca 0.00 -0.48 0.09 0.00 0.00 0.00 0.00 61.98 61.59 1ama s VAL 198 Cb 0.00 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 1ama s VAL 198 CO 0.00 0.43 -0.04 -1.81 0.00 0.00 0.00 175.10 173.68 1ama s ASP 199 N 1.38 4.45 0.77 3.32 1.01 -1.26 -4.48 116.67 121.86 1ama s ASP 199 Ca 0.05 -0.60 -0.14 0.00 0.71 0.00 0.00 52.55 52.57 1ama s ASP 199 Cb -0.14 -0.81 0.06 0.00 1.01 0.00 0.00 42.92 43.03 1ama s ASP 199 CO -0.02 0.05 1.21 -2.84 0.21 0.00 0.00 175.17 173.78 1ama s PRO 200 N -3.28 1.89 0.36 8.23 0.02 -1.26 -4.99 135.00 135.98 1ama s PRO 200 Ca 0.29 1.76 -0.13 0.00 0.02 0.00 0.00 61.00 62.94 1ama s PRO 200 Cb -0.08 -1.80 -0.08 0.00 0.02 0.00 0.00 34.50 32.56 1ama s PRO 200 CO 0.18 -2.02 0.76 1.03 -0.33 0.00 0.00 177.00 176.62 1ama s ARG 201 N -4.02 3.92 0.22 5.54 0.52 -1.26 -4.78 118.95 119.08 1ama s ARG 201 Ca 0.74 0.61 -0.02 0.00 -0.52 0.00 0.00 55.73 56.54 1ama s ARG 201 Cb -0.29 -2.40 0.45 0.00 0.52 0.00 0.00 34.95 33.23 1ama s ARG 201 CO 0.48 0.06 1.15 1.04 0.02 0.00 0.00 175.30 178.05 1ama n GLN 202 N -0.78 -0.06 0.03 3.54 6.02 -1.26 0.15 117.38 125.01 1ama n GLN 202 Ca 0.03 1.12 -0.04 0.00 -0.01 0.00 0.00 57.00 58.11 1ama n GLN 202 Cb 0.53 -1.73 0.19 0.00 1.02 0.00 0.00 30.24 30.25 1ama n GLN 202 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1ama h GLU 203 N 0.00 0.44 -0.28 -1.09 3.07 -1.99 -1.29 114.58 113.44 1ama h GLU 203 Ca 0.40 -0.19 -0.17 0.00 -0.50 0.00 0.00 59.36 58.90 1ama h GLU 203 Cb 0.72 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.62 1ama h GLU 203 CO -0.73 0.71 -0.51 1.96 -1.40 0.00 0.00 179.01 179.05 1ama h GLN 204 N 0.38 0.84 -0.63 2.33 4.20 0.10 -2.99 115.11 119.36 1ama h GLN 204 Ca 0.05 -0.53 -0.03 0.00 0.06 0.00 0.00 58.65 58.20 1ama h GLN 204 Cb 0.75 0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.56 1ama h GLN 204 CO 0.06 1.16 0.28 -1.49 -0.67 0.00 0.00 178.83 178.17 1ama h TRP 205 N 0.62 0.93 -0.52 2.96 4.06 -0.38 -1.85 115.95 121.76 1ama h TRP 205 Ca 0.02 -0.06 0.05 0.00 2.06 0.00 0.00 58.89 60.96 1ama h TRP 205 Cb 1.11 -0.28 -0.03 0.00 -1.00 0.00 0.00 29.16 28.96 1ama h TRP 205 CO 0.08 0.72 0.35 0.87 -3.56 0.00 0.00 178.44 176.89 1ama h LYS 206 N 0.87 0.49 -0.12 0.49 1.57 -1.14 -0.68 116.57 118.05 1ama h LYS 206 Ca 0.21 -0.03 -0.23 0.00 -1.87 0.00 0.00 60.65 58.73 1ama h LYS 206 Cb 0.16 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.37 1ama h LYS 206 CO -0.02 0.32 -0.82 1.49 -0.57 0.00 0.00 179.45 179.85 1ama h GLU 207 N 0.50 0.75 -0.41 3.15 4.57 -1.32 -3.09 114.58 118.74 1ama h GLU 207 Ca 0.22 -0.64 -0.12 0.00 -1.18 0.00 0.00 59.36 57.64 1ama h GLU 207 Cb 0.24 0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.96 1ama h GLU 207 CO -0.06 1.24 -0.22 -0.07 -1.18 0.00 0.00 179.01 178.72 1ama h LEU 208 N 0.49 0.90 -0.93 1.64 3.38 -0.89 -2.86 115.31 117.04 1ama h LEU 208 Ca -0.06 -0.41 0.09 0.00 0.09 0.00 0.00 57.88 57.58 1ama h LEU 208 Cb 1.45 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 41.88 1ama h LEU 208 CO 0.17 1.12 0.58 0.00 0.09 0.00 0.00 178.44 180.39 1ama h ALA 209 N 0.81 1.33 -0.03 1.53 0.00 -1.16 0.28 119.26 122.02 1ama h ALA 209 Ca 0.09 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1ama h ALA 209 Cb 0.79 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1ama h ALA 209 CO 0.07 0.26 0.01 0.77 0.00 0.00 0.00 179.25 180.35 1ama h SER 210 N 0.99 0.04 -0.02 0.00 0.02 -1.44 -0.80 113.55 112.33 1ama h SER 210 Ca 0.43 -0.24 -0.12 0.00 -0.84 0.00 0.00 61.79 61.02 1ama h SER 210 Cb 0.31 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 1ama h SER 210 CO -0.22 0.27 -0.37 0.58 -1.14 0.00 0.00 176.83 175.95 1ama h VAL 211 N -0.19 1.29 -0.11 2.27 2.07 -1.26 0.65 116.25 120.98 1ama h VAL 211 Ca 0.01 -1.51 -0.02 0.00 0.82 0.00 0.00 66.70 66.00 1ama h VAL 211 Cb 0.25 1.52 -0.00 0.00 -1.52 0.00 0.00 31.29 31.53 1ama h VAL 211 CO 0.00 0.47 0.00 0.58 0.02 0.00 0.00 177.57 178.65 1ama h VAL 212 N 0.44 1.25 -0.42 2.57 2.07 -0.88 0.19 116.25 121.46 1ama h VAL 212 Ca 0.04 -0.80 -0.04 0.00 0.82 0.00 0.00 66.70 66.73 1ama h VAL 212 Cb 0.85 1.56 -0.02 0.00 -1.52 0.00 0.00 31.29 32.16 1ama h VAL 212 CO 0.07 0.23 0.10 0.50 0.02 0.00 0.00 177.57 178.49 1ama h LYS 213 N -0.07 0.68 -0.40 1.57 1.63 -1.07 -1.06 116.57 117.85 1ama h LYS 213 Ca 0.03 -0.17 0.02 0.00 -0.85 0.00 0.00 60.65 59.68 1ama h LYS 213 Cb 0.35 -0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 31.87 1ama h LYS 213 CO 0.01 0.70 0.24 -0.22 -3.45 0.00 0.00 179.45 176.72 1ama h LYS 214 N 0.55 0.46 -0.01 1.90 3.64 0.54 -2.32 116.57 121.33 1ama h LYS 214 Ca 0.13 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1ama h LYS 214 Cb 0.32 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1ama h LYS 214 CO 0.00 0.31 0.00 0.54 -2.27 0.00 0.00 179.45 178.03 1ama n ARG 215 N -4.86 1.30 -3.63 1.90 5.12 0.66 -4.94 116.66 112.21 1ama n ARG 215 Ca 0.01 -0.43 -0.23 0.00 -1.93 0.00 0.00 57.85 55.27 1ama n ARG 215 Cb 0.06 -1.48 0.04 0.00 -1.16 0.00 0.00 32.46 29.92 1ama n ARG 215 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1ama n ASN 216 N -0.46 -2.95 -4.92 0.55 4.05 -0.46 -3.16 115.26 107.90 1ama n ASN 216 Ca 0.21 -0.85 -0.29 0.00 0.45 0.00 0.00 54.58 54.10 1ama n ASN 216 Cb 0.22 -4.06 -0.04 0.00 1.23 0.00 0.00 39.78 37.13 1ama n ASN 216 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1ama s LEU 217 N -6.44 4.32 -0.30 1.20 1.43 -0.85 0.38 118.68 118.42 1ama s LEU 217 Ca 0.18 0.21 -0.20 0.00 -1.03 0.00 0.00 54.13 53.29 1ama s LEU 217 Cb -0.05 -2.91 -0.01 0.00 0.03 0.00 0.00 46.19 43.25 1ama s LEU 217 CO 0.81 0.12 0.63 -0.22 0.23 0.00 0.00 176.35 177.92 1ama s LEU 218 N -2.83 4.14 -0.25 1.79 2.96 -0.05 -4.80 118.68 119.64 1ama s LEU 218 Ca 0.34 0.44 -0.23 0.00 -0.22 0.00 0.00 54.13 54.46 1ama s LEU 218 Cb -0.12 -2.82 -0.01 0.00 0.50 0.00 0.00 46.19 43.75 1ama s LEU 218 CO 0.28 -0.47 0.77 0.00 -1.32 0.00 0.00 176.35 175.61 1ama s ALA 219 N 2.60 3.63 -0.35 5.97 0.00 -1.26 -1.38 121.76 130.96 1ama s ALA 219 Ca 0.25 -0.24 -0.05 0.00 0.00 0.00 0.00 51.96 51.92 1ama s ALA 219 Cb -0.15 -3.22 0.06 0.00 0.00 0.00 0.00 23.12 19.81 1ama s ALA 219 CO 0.12 -0.92 0.11 -0.47 0.00 0.00 0.00 175.76 174.60 1ama s TYR 220 N 2.76 3.33 -0.20 0.00 6.14 0.18 -2.06 117.35 127.49 1ama s TYR 220 Ca 0.32 -1.73 -0.10 0.00 0.64 0.00 0.00 57.07 56.20 1ama s TYR 220 Cb -0.15 -2.48 -0.05 0.00 0.42 0.00 0.00 41.96 39.69 1ama s TYR 220 CO 0.08 -0.81 0.14 -0.06 0.64 0.00 0.00 175.55 175.54 1ama s PHE 221 N 1.32 3.40 -0.42 4.97 0.40 -0.30 -0.66 117.98 126.69 1ama s PHE 221 Ca -0.00 0.33 -0.11 0.00 -0.60 0.00 0.00 56.93 56.55 1ama s PHE 221 Cb -0.21 -2.18 0.06 0.00 0.51 0.00 0.00 43.02 41.20 1ama s PHE 221 CO 0.00 0.26 0.27 0.34 0.70 0.00 0.00 175.22 176.79 1ama s ASP 222 N 0.46 5.76 -0.83 1.36 2.15 -0.85 -0.60 116.67 124.11 1ama s ASP 222 Ca 0.08 -1.33 0.01 0.00 0.43 0.00 0.00 52.55 51.74 1ama s ASP 222 Cb -0.11 -2.03 0.21 0.00 -0.30 0.00 0.00 42.92 40.68 1ama s ASP 222 CO -0.01 -0.52 0.73 0.80 -0.17 0.00 0.00 175.17 176.00 1ama n MET 223 N 4.99 2.47 0.01 4.34 0.00 0.12 -1.84 117.12 127.21 1ama n MET 223 Ca -0.11 -4.51 0.11 0.00 -0.00 0.00 0.00 57.70 53.19 1ama n MET 223 Cb 0.44 -2.37 -0.10 0.00 0.00 0.00 0.00 33.22 31.20 1ama n MET 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1ama n ALA 224 N 2.02 3.52 -1.83 -5.12 0.00 -1.26 -2.64 120.51 115.21 1ama n ALA 224 Ca 0.22 -0.50 -0.11 0.00 0.00 0.00 0.00 53.44 53.05 1ama n ALA 224 Cb 0.37 -0.83 0.10 0.00 0.00 0.00 0.00 19.45 19.09 1ama n ALA 224 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ama n TYR 225 N -1.98 1.54 -1.92 0.00 4.01 -1.26 -4.59 117.16 112.96 1ama n TYR 225 Ca 0.00 -1.91 -0.43 0.00 -0.16 0.00 0.00 57.90 55.41 1ama n TYR 225 Cb 0.46 -0.31 -0.03 0.00 -0.31 0.00 0.00 39.34 39.16 1ama n TYR 225 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 1ama s GLN 226 N -3.44 3.78 0.00 -0.72 0.74 -1.26 -1.06 119.66 117.69 1ama s GLN 226 Ca 0.45 1.98 0.00 0.00 0.05 0.00 0.00 55.36 57.85 1ama s GLN 226 Cb 0.39 -4.12 0.00 0.00 1.10 0.00 0.00 33.01 30.38 1ama s GLN 226 CO -0.01 -1.33 0.00 0.41 -0.55 0.00 0.00 175.29 173.81 1ama n GLY 227 N 4.79 0.54 0.00 2.59 0.00 -1.26 -4.77 105.19 107.08 1ama n GLY 227 Ca 0.21 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.33 1ama n GLY 227 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ama n PHE 228 N -1.61 0.00 -0.01 1.61 3.72 -0.23 -2.34 117.46 118.60 1ama n PHE 228 Ca 0.00 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.20 1ama n PHE 228 Cb 0.00 -0.11 -0.13 0.00 -0.94 0.00 0.00 39.48 38.30 1ama n PHE 228 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ama h ALA 229 N 2.63 0.11 0.00 4.37 0.00 -1.92 -3.17 119.26 121.28 1ama h ALA 229 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 54.91 53.96 1ama h ALA 229 Cb 0.58 0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1ama h ALA 229 CO 0.00 0.60 -0.13 -1.13 0.00 0.00 0.00 179.25 178.59 1ama n SER 230 N -4.14 0.63 0.00 0.00 3.41 -1.26 -4.55 113.62 107.71 1ama n SER 230 Ca -0.22 -0.36 0.00 0.00 -0.26 0.00 0.00 58.87 58.03 1ama n SER 230 Cb 0.79 0.86 0.00 0.00 -0.26 0.00 0.00 64.21 65.59 1ama n SER 230 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ama n GLY 231 N 1.04 0.69 2.93 5.00 0.00 -0.99 -5.02 105.19 108.84 1ama n GLY 231 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1ama n GLY 231 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ama s ASP 232 N -2.92 2.98 0.13 1.61 -1.08 -1.25 -4.29 116.67 111.85 1ama s ASP 232 Ca 0.00 -0.72 -0.18 0.00 -0.52 0.00 0.00 52.55 51.13 1ama s ASP 232 Cb 0.00 -1.01 -0.03 0.00 -1.46 0.00 0.00 42.92 40.42 1ama s ASP 232 CO 0.00 -0.17 1.75 0.16 0.52 0.00 0.00 175.17 177.44 1ama h ILE 233 N 6.37 1.11 -0.44 4.11 3.07 -1.89 -1.59 117.51 128.25 1ama h ILE 233 Ca -0.26 -0.28 -0.07 0.00 1.55 0.00 0.00 64.86 65.80 1ama h ILE 233 Cb 1.11 0.73 -0.02 0.00 -0.27 0.00 0.00 36.82 38.37 1ama h ILE 233 CO 0.43 0.11 -0.02 0.78 -1.05 0.00 0.00 178.15 178.40 1ama h ASN 234 N 0.40 0.70 0.09 2.16 4.21 -1.97 -2.23 115.58 118.95 1ama h ASN 234 Ca 0.11 -0.17 -0.10 0.00 1.21 0.00 0.00 56.30 57.35 1ama h ASN 234 Cb 0.02 -0.19 -0.01 0.00 -1.12 0.00 0.00 38.32 37.02 1ama h ASN 234 CO -0.02 0.79 -0.32 -0.09 -1.29 0.00 0.00 177.43 176.49 1ama h ARG 235 N 0.68 0.35 0.00 0.81 2.43 -1.96 -2.84 114.38 113.86 1ama h ARG 235 Ca 0.13 -0.14 -0.07 0.00 -0.81 0.00 0.00 59.98 59.09 1ama h ARG 235 Cb 0.45 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1ama h ARG 235 CO 0.02 0.63 -0.33 -0.44 -1.51 0.00 0.00 179.97 178.34 1ama h ASP 236 N 0.30 0.00 -0.17 -3.80 5.19 -0.76 -3.07 116.42 114.12 1ama h ASP 236 Ca 0.04 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.45 1ama h ASP 236 Cb 0.72 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.23 1ama h ASP 236 CO 0.05 0.33 0.00 0.00 -3.12 0.00 0.00 179.24 176.51 1ama n ALA 237 N -2.31 2.48 -0.04 3.45 0.00 -0.89 -4.58 120.51 118.62 1ama n ALA 237 Ca -0.01 -0.70 -0.05 0.00 0.00 0.00 0.00 53.44 52.68 1ama n ALA 237 Cb 0.46 -0.95 -0.03 0.00 0.00 0.00 0.00 19.45 18.92 1ama n ALA 237 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1ama h TRP 238 N 3.68 -0.57 -0.65 0.00 7.01 -1.42 -1.76 115.95 122.24 1ama h TRP 238 Ca 0.00 0.03 0.13 0.00 2.11 0.00 0.00 58.89 61.16 1ama h TRP 238 Cb 0.79 0.27 -0.10 0.00 -2.10 0.00 0.00 29.16 28.02 1ama h TRP 238 CO 0.10 -0.17 0.13 0.00 -2.79 0.00 0.00 178.44 175.71 1ama h ALA 239 N -0.89 0.78 -0.43 2.65 0.00 -1.82 0.51 119.26 120.06 1ama h ALA 239 Ca 0.02 0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1ama h ALA 239 Cb 0.20 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1ama h ALA 239 CO -0.20 -0.32 0.26 1.25 0.00 0.00 0.00 179.25 180.24 1ama h LEU 240 N 0.25 0.42 -0.59 0.00 5.85 -1.78 -2.33 115.31 117.14 1ama h LEU 240 Ca 0.35 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.92 1ama h LEU 240 Cb 0.55 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1ama h LEU 240 CO -0.45 0.31 -0.56 0.03 -0.34 0.00 0.00 178.44 177.42 1ama h ARG 241 N 0.52 0.43 -0.76 1.25 3.08 -0.53 -3.01 114.38 115.36 1ama h ARG 241 Ca 0.17 -0.27 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 1ama h ARG 241 Cb -0.01 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.04 1ama h ARG 241 CO -0.07 0.87 0.44 1.25 -1.07 0.00 0.00 179.97 181.40 1ama h HIS 242 N 0.33 1.02 -0.11 3.04 2.76 0.23 0.94 115.15 123.36 1ama h HIS 242 Ca 0.00 -0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.16 1ama h HIS 242 Cb 1.08 -0.33 -0.00 0.00 1.55 0.00 0.00 27.41 29.70 1ama h HIS 242 CO 0.04 0.70 0.05 0.74 -1.30 0.00 0.00 177.93 178.15 1ama h PHE 243 N 1.05 0.15 -0.30 5.26 -1.00 -1.34 -1.55 116.94 119.21 1ama h PHE 243 Ca 0.27 -0.01 -0.09 0.00 2.81 0.00 0.00 57.97 60.96 1ama h PHE 243 Cb -0.01 -0.05 -0.02 0.00 3.61 0.00 0.00 35.95 39.49 1ama h PHE 243 CO -0.01 0.21 -0.19 0.82 -1.61 0.00 0.00 178.31 177.54 1ama h ILE 244 N 0.05 1.25 0.00 -0.55 2.04 -1.39 -0.29 117.51 118.62 1ama h ILE 244 Ca 0.04 -1.18 0.00 0.00 1.00 0.00 0.00 64.86 64.72 1ama h ILE 244 Cb 0.12 1.23 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 1ama h ILE 244 CO -0.00 0.38 0.00 -1.84 0.00 0.00 0.00 178.15 176.69 1ama n GLU 245 N -4.15 0.19 0.00 2.37 0.28 0.31 -1.90 120.64 117.74 1ama n GLU 245 Ca 0.00 0.23 0.13 0.00 -0.16 0.00 0.00 57.16 57.36 1ama n GLU 245 Cb 0.38 -1.76 0.34 0.00 1.43 0.00 0.00 31.44 31.83 1ama n GLU 245 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1ama n GLN 246 N -2.10 1.01 -0.04 3.44 1.13 -0.60 -4.92 117.38 115.30 1ama n GLN 246 Ca 0.05 -0.64 0.00 0.00 -1.94 0.00 0.00 57.00 54.47 1ama n GLN 246 Cb 0.36 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.22 1ama n GLN 246 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ama n GLY 247 N 1.33 0.95 3.67 1.08 0.00 -0.80 -5.06 105.19 106.36 1ama n GLY 247 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 1ama n GLY 247 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ama s ILE 248 N -2.01 5.06 -0.52 -0.61 1.01 -0.20 -5.00 121.20 118.94 1ama s ILE 248 Ca 0.00 1.12 -0.21 0.00 0.00 0.00 0.00 60.65 61.56 1ama s ILE 248 Cb 0.00 -3.91 0.05 0.00 0.01 0.00 0.00 42.46 38.60 1ama s ILE 248 CO 0.00 0.15 0.75 -1.81 0.00 0.00 0.00 174.94 174.03 1ama s ASP 249 N 1.13 6.28 0.62 3.58 1.11 -1.26 -3.70 116.67 124.43 1ama s ASP 249 Ca 0.28 -0.62 0.08 0.00 0.18 0.00 0.00 52.55 52.48 1ama s ASP 249 Cb -0.16 -2.35 0.11 0.00 1.07 0.00 0.00 42.92 41.59 1ama s ASP 249 CO 0.11 -1.01 0.86 0.68 1.18 0.00 0.00 175.17 176.98 1ama s VAL 250 N 3.18 2.00 0.01 -1.27 -7.23 -1.26 -4.52 120.40 111.32 1ama s VAL 250 Ca 0.22 -0.94 0.04 0.00 -1.81 0.00 0.00 61.98 59.49 1ama s VAL 250 Cb -0.16 -2.06 -0.01 0.00 0.56 0.00 0.00 36.38 34.71 1ama s VAL 250 CO 0.16 0.00 -0.12 0.68 -0.31 0.00 0.00 175.10 175.51 1ama s VAL 251 N -2.79 0.90 0.05 1.32 -7.23 -0.88 -1.36 120.40 110.42 1ama s VAL 251 Ca 0.64 -0.71 -0.17 0.00 -1.81 0.00 0.00 61.98 59.93 1ama s VAL 251 Cb -0.05 -0.80 0.03 0.00 0.56 0.00 0.00 36.38 36.13 1ama s VAL 251 CO 0.41 0.09 0.38 -1.48 -0.31 0.00 0.00 175.10 174.19 1ama s LEU 252 N -0.70 0.52 -0.06 1.32 0.05 -0.15 -1.15 118.68 118.52 1ama s LEU 252 Ca 0.02 -0.08 0.05 0.00 0.05 0.00 0.00 54.13 54.16 1ama s LEU 252 Cb -0.06 1.65 -0.00 0.00 -2.05 0.00 0.00 46.19 45.73 1ama s LEU 252 CO 0.00 -0.67 -0.21 -0.55 -0.55 0.00 0.00 176.35 174.37 1ama s SER 253 N -2.10 2.67 0.04 1.48 0.15 0.23 -1.04 113.70 115.13 1ama s SER 253 Ca -0.04 -0.45 0.08 0.00 0.70 0.00 0.00 55.95 56.24 1ama s SER 253 Cb -0.00 -0.87 -0.03 0.00 -1.71 0.00 0.00 66.02 63.41 1ama s SER 253 CO -0.04 0.18 -0.23 -1.10 1.20 0.00 0.00 173.24 173.25 1ama s GLN 254 N 0.06 1.59 0.05 5.44 -0.21 0.19 0.15 119.66 126.92 1ama s GLN 254 Ca -0.07 -1.02 0.08 0.00 0.02 0.00 0.00 55.36 54.37 1ama s GLN 254 Cb -0.14 -1.73 -0.03 0.00 1.00 0.00 0.00 33.01 32.11 1ama s GLN 254 CO 0.04 0.45 -0.23 0.45 -2.12 0.00 0.00 175.29 173.88 1ama s SER 255 N -1.19 2.70 -0.03 5.90 0.15 -1.08 -1.04 113.70 119.11 1ama s SER 255 Ca 0.10 -0.55 0.04 0.00 0.70 0.00 0.00 55.95 56.24 1ama s SER 255 Cb -0.09 -0.23 0.06 0.00 -1.71 0.00 0.00 66.02 64.05 1ama s SER 255 CO 0.02 0.19 1.03 -1.22 1.20 0.00 0.00 173.24 174.46 1ama n TYR 256 N 1.81 0.00 -0.08 3.44 4.01 -0.92 -4.72 117.16 120.70 1ama n TYR 256 Ca -0.17 -0.60 -0.10 0.00 -0.16 0.00 0.00 57.90 56.86 1ama n TYR 256 Cb 0.53 -0.07 -0.03 0.00 -0.31 0.00 0.00 39.34 39.45 1ama n TYR 256 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ama h ALA 257 N 0.00 0.34 0.01 -0.72 0.00 -1.84 -2.95 119.26 114.10 1ama h ALA 257 Ca 0.00 -0.14 -0.38 0.00 0.00 0.00 0.00 54.91 54.39 1ama h ALA 257 Cb 0.61 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.24 1ama h ALA 257 CO 0.00 -0.04 -2.13 1.63 0.00 0.00 0.00 179.25 178.71 1ama n LYS 258 N -4.74 0.61 0.27 0.00 4.01 -1.26 -2.40 118.16 114.65 1ama n LYS 258 Ca -0.03 0.33 0.14 0.00 -0.51 0.00 0.00 58.31 58.24 1ama n LYS 258 Cb 0.16 -1.59 0.77 0.00 -0.51 0.00 0.00 35.03 33.86 1ama n LYS 258 CO 0.00 0.00 0.00 -2.95 -1.11 0.00 0.00 177.40 173.34 1ama h ASN 259 N -0.70 0.00 -0.00 4.39 7.08 -1.83 -2.93 115.58 121.60 1ama h ASN 259 Ca -0.56 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.66 1ama h ASN 259 Cb 1.63 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.87 1ama h ASN 259 CO -0.25 0.09 -0.16 0.23 -2.08 0.00 0.00 177.43 175.27 1ama n MET 260 N -3.58 4.67 -3.24 4.14 2.81 -1.12 -4.85 117.12 115.95 1ama n MET 260 Ca -0.02 -0.13 -0.21 0.00 -1.81 0.00 0.00 57.70 55.53 1ama n MET 260 Cb 0.22 -0.76 0.05 0.00 -0.71 0.00 0.00 33.22 32.03 1ama n MET 260 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ama n GLY 261 N 0.96 -0.41 1.82 3.03 0.00 -1.05 -4.64 105.19 104.90 1ama n GLY 261 Ca 0.01 0.11 -0.03 0.00 0.00 0.00 0.00 46.02 46.12 1ama n GLY 261 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ama n LEU 262 N -4.16 5.45 0.00 0.99 4.77 -1.01 -4.87 117.00 118.17 1ama n LEU 262 Ca -0.05 -2.82 0.00 0.00 -0.03 0.00 0.00 56.01 53.12 1ama n LEU 262 Cb 0.58 -0.70 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1ama n LEU 262 CO 0.51 0.70 0.12 -1.22 -1.33 0.00 0.00 177.39 176.18 1ama n TYR 263 N 0.06 0.00 1.49 -1.77 4.02 -1.17 -1.22 117.16 118.56 1ama n TYR 263 Ca 0.33 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 58.35 1ama n TYR 263 Cb 1.21 -0.08 0.74 0.00 -0.02 0.00 0.00 39.34 41.19 1ama n TYR 263 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ama n GLY 264 N -0.83 -0.97 0.10 2.72 0.00 -1.26 -3.04 105.19 101.90 1ama n GLY 264 Ca 0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 46.02 45.85 1ama n GLY 264 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1ama h GLU 265 N 0.00 0.00 -5.25 1.61 4.39 -1.56 -3.50 114.58 110.27 1ama h GLU 265 Ca 0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1ama h GLU 265 Cb 0.10 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1ama h GLU 265 CO 0.00 0.47 -0.74 0.54 -1.16 0.00 0.00 179.01 178.11 1ama n ARG 266 N -3.05 -2.87 -4.58 2.33 5.12 -1.03 -4.42 116.66 108.15 1ama n ARG 266 Ca -0.07 2.41 -0.30 0.00 -1.93 0.00 0.00 57.85 57.96 1ama n ARG 266 Cb 0.87 -5.45 -0.17 0.00 -1.16 0.00 0.00 32.46 26.56 1ama n ARG 266 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ama s ALA 267 N -2.14 1.85 0.22 7.54 0.00 -1.26 -4.09 121.76 123.88 1ama s ALA 267 Ca 0.14 -0.83 -0.08 0.00 0.00 0.00 0.00 51.96 51.19 1ama s ALA 267 Cb -0.04 -0.86 0.03 0.00 0.00 0.00 0.00 23.12 22.26 1ama s ALA 267 CO 0.77 -0.02 0.44 0.41 0.00 0.00 0.00 175.76 177.36 1ama n GLY 268 N 4.09 1.42 3.56 0.00 0.00 -1.09 -2.17 105.19 111.00 1ama n GLY 268 Ca -0.19 -1.15 -0.16 0.00 0.00 0.00 0.00 46.02 44.52 1ama n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ama s ALA 269 N -1.60 -1.81 -0.12 4.61 0.00 -0.21 -1.67 121.76 120.96 1ama s ALA 269 Ca 0.09 1.55 0.01 0.00 0.00 0.00 0.00 51.96 53.61 1ama s ALA 269 Cb -0.03 -0.45 -0.01 0.00 0.00 0.00 0.00 23.12 22.64 1ama s ALA 269 CO 0.07 -0.35 -0.17 0.12 0.00 0.00 0.00 175.76 175.43 1ama s PHE 270 N -0.74 2.72 0.01 0.00 5.36 0.59 -0.64 117.98 125.28 1ama s PHE 270 Ca -0.06 -0.84 0.06 0.00 -0.96 0.00 0.00 56.93 55.13 1ama s PHE 270 Cb -0.01 -1.80 -0.02 0.00 -0.34 0.00 0.00 43.02 40.84 1ama s PHE 270 CO 0.06 -0.32 -0.19 0.99 -1.46 0.00 0.00 175.22 174.29 1ama s THR 271 N 0.41 1.53 -0.11 0.12 2.01 -0.21 -0.07 115.64 119.33 1ama s THR 271 Ca -0.13 -0.96 0.02 0.00 0.31 0.00 0.00 61.69 60.93 1ama s THR 271 Cb -0.17 -1.30 0.01 0.00 0.01 0.00 0.00 72.50 71.05 1ama s THR 271 CO 0.06 0.32 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.46 1ama s VAL 272 N -0.59 1.56 -0.32 3.82 1.01 0.18 -0.98 120.40 125.08 1ama s VAL 272 Ca 0.07 -0.69 -0.18 0.00 0.00 0.00 0.00 61.98 61.18 1ama s VAL 272 Cb -0.08 -1.42 -0.01 0.00 0.00 0.00 0.00 36.38 34.87 1ama s VAL 272 CO 0.00 0.45 0.53 -0.63 0.00 0.00 0.00 175.10 175.46 1ama s ILE 273 N 0.89 5.02 0.46 2.22 -1.09 -0.46 -1.75 121.20 126.47 1ama s ILE 273 Ca -0.08 0.59 0.07 0.00 -2.23 0.00 0.00 60.65 58.99 1ama s ILE 273 Cb -0.15 -3.93 -0.01 0.00 -1.58 0.00 0.00 42.46 36.79 1ama s ILE 273 CO -0.00 -0.12 0.36 0.00 -1.23 0.00 0.00 174.94 173.95 1ama h ARG 275 N 1.01 0.23 -4.48 0.00 1.12 -1.96 -3.45 114.38 106.86 1ama h ARG 275 Ca -0.40 -0.25 -0.31 0.00 -1.11 0.00 0.00 59.98 57.91 1ama h ARG 275 Cb 1.27 0.07 -0.12 0.00 -0.01 0.00 0.00 29.97 31.18 1ama h ARG 275 CO 0.59 0.96 -0.41 -0.51 -3.11 0.00 0.00 179.97 177.50 1ama s ASP 276 N -6.95 0.86 0.07 -3.80 1.11 -1.26 -4.99 116.67 101.71 1ama s ASP 276 Ca -0.03 -1.50 -0.14 0.00 0.18 0.00 0.00 52.55 51.06 1ama s ASP 276 Cb 0.10 0.54 -0.22 0.00 1.07 0.00 0.00 42.92 44.41 1ama s ASP 276 CO 0.83 -1.07 1.21 0.00 1.18 0.00 0.00 175.17 177.32 1ama h ALA 277 N 2.28 0.16 -0.69 5.23 0.00 -1.81 -2.84 119.26 121.60 1ama h ALA 277 Ca -0.29 -0.66 -0.06 0.00 0.00 0.00 0.00 54.91 53.90 1ama h ALA 277 Cb 1.24 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 1ama h ALA 277 CO 0.42 0.64 0.21 1.49 0.00 0.00 0.00 179.25 182.01 1ama h GLU 278 N 0.37 1.07 -0.88 0.00 4.57 -1.96 -0.14 114.58 117.61 1ama h GLU 278 Ca -0.11 -0.23 0.00 0.00 -1.18 0.00 0.00 59.36 57.84 1ama h GLU 278 Cb 1.58 -0.15 -0.04 0.00 -0.16 0.00 0.00 28.75 29.98 1ama h GLU 278 CO 0.18 0.93 0.55 1.49 -1.18 0.00 0.00 179.01 180.98 1ama h GLU 279 N 1.01 1.18 -0.39 1.92 4.81 -1.96 -1.36 114.58 119.78 1ama h GLU 279 Ca 0.22 -0.09 -0.15 0.00 -0.13 0.00 0.00 59.36 59.21 1ama h GLU 279 Cb 0.31 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1ama h GLU 279 CO -0.01 0.81 -0.35 0.00 -0.73 0.00 0.00 179.01 178.74 1ama h ALA 280 N 1.40 0.65 0.00 2.92 0.00 -1.20 -1.34 119.26 121.68 1ama h ALA 280 Ca 0.32 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1ama h ALA 280 Cb -0.08 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1ama h ALA 280 CO -0.06 0.67 -0.16 0.87 0.00 0.00 0.00 179.25 180.57 1ama h LYS 281 N 0.75 0.00 0.00 0.00 1.57 0.08 -2.06 116.57 116.91 1ama h LYS 281 Ca 0.07 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.64 1ama h LYS 281 Cb 0.92 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.20 1ama h LYS 281 CO 0.09 0.16 -1.31 0.00 -0.57 0.00 0.00 179.45 177.81 1ama h ARG 282 N 0.00 0.00 -0.03 3.15 3.08 -1.00 -3.27 114.38 116.32 1ama h ARG 282 Ca -0.00 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.89 1ama h ARG 282 Cb 0.36 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 1ama h ARG 282 CO 0.02 0.55 -0.69 0.28 -1.07 0.00 0.00 179.97 179.06 1ama h VAL 283 N 0.00 1.45 -0.07 2.04 2.07 -0.96 -3.14 116.25 117.64 1ama h VAL 283 Ca -0.15 -2.25 -0.00 0.00 0.82 0.00 0.00 66.70 65.12 1ama h VAL 283 Cb 1.76 2.20 -0.00 0.00 -1.52 0.00 0.00 31.29 33.73 1ama h VAL 283 CO 0.08 0.65 0.04 -0.08 0.02 0.00 0.00 177.57 178.28 1ama h GLU 284 N 0.09 0.09 -0.83 1.57 4.57 -1.49 -1.33 114.58 117.25 1ama h GLU 284 Ca -0.01 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.13 1ama h GLU 284 Cb 1.23 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.76 1ama h GLU 284 CO 0.10 0.10 0.42 0.66 -1.18 0.00 0.00 179.01 179.11 1ama h SER 285 N 0.05 1.07 0.62 1.04 4.64 -1.60 -1.86 113.55 117.52 1ama h SER 285 Ca 0.02 -0.12 -0.12 0.00 -0.47 0.00 0.00 61.79 61.10 1ama h SER 285 Cb 0.04 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 61.83 1ama h SER 285 CO -0.00 0.89 -0.58 1.56 -0.87 0.00 0.00 176.83 177.83 1ama h GLN 286 N 1.18 0.00 -0.19 4.77 1.08 -1.48 -1.85 115.11 118.62 1ama h GLN 286 Ca 0.29 0.00 -0.17 0.00 -1.45 0.00 0.00 58.65 57.32 1ama h GLN 286 Cb 0.09 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.51 1ama h GLN 286 CO -0.04 0.58 -0.57 -0.07 -0.95 0.00 0.00 178.83 177.78 1ama h LEU 287 N 0.00 0.66 -0.51 1.46 3.38 -0.76 -2.45 115.31 117.09 1ama h LEU 287 Ca -0.01 -0.36 -0.16 0.00 0.09 0.00 0.00 57.88 57.45 1ama h LEU 287 Cb 1.04 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 1ama h LEU 287 CO 0.07 1.09 -0.49 0.11 0.09 0.00 0.00 178.44 179.32 1ama h LYS 288 N 0.45 0.67 0.00 1.13 1.57 -1.22 -1.34 116.57 117.82 1ama h LYS 288 Ca 0.00 -0.39 -0.07 0.00 -1.87 0.00 0.00 60.65 58.33 1ama h LYS 288 Cb 1.12 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 1ama h LYS 288 CO 0.11 1.00 -0.33 0.82 -0.57 0.00 0.00 179.45 180.48 1ama h ILE 289 N 0.53 1.19 0.05 1.86 2.04 -1.22 -1.36 117.51 120.59 1ama h ILE 289 Ca 0.03 -1.16 -0.18 0.00 1.00 0.00 0.00 64.86 64.54 1ama h ILE 289 Cb 1.04 1.63 0.02 0.00 -0.74 0.00 0.00 36.82 38.77 1ama h ILE 289 CO 0.10 0.33 -0.73 0.25 0.00 0.00 0.00 178.15 178.10 1ama h LEU 290 N 0.00 0.56 -0.15 1.44 7.12 -1.16 -3.37 115.31 119.75 1ama h LEU 290 Ca -0.00 -0.82 -0.14 0.00 0.13 0.00 0.00 57.88 57.05 1ama h LEU 290 Cb 0.61 -0.17 0.00 0.00 -0.53 0.00 0.00 40.66 40.57 1ama h LEU 290 CO 0.04 1.31 -0.46 0.40 -0.13 0.00 0.00 178.44 179.61 1ama h ILE 291 N -0.12 1.35 -0.67 4.05 2.04 -1.19 -3.37 117.51 119.60 1ama h ILE 291 Ca -0.10 -1.73 0.11 0.00 1.00 0.00 0.00 64.86 64.13 1ama h ILE 291 Cb 1.47 2.04 -0.12 0.00 -0.74 0.00 0.00 36.82 39.47 1ama h ILE 291 CO 0.14 0.53 -0.39 -0.09 0.00 0.00 0.00 178.15 178.34 1ama h ARG 292 N 0.21 -0.15 -0.17 2.37 9.65 -1.40 -1.01 114.38 123.88 1ama h ARG 292 Ca -0.02 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 1ama h ARG 292 Cb 1.08 0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.70 1ama h ARG 292 CO 0.10 -0.10 0.00 -0.35 2.80 0.00 0.00 179.97 182.42 1ama n PRO 293 N -5.42 1.26 -0.05 0.20 -0.05 -1.26 -2.31 135.00 127.36 1ama n PRO 293 Ca 0.04 -0.37 -0.05 0.00 -0.05 0.00 0.00 63.50 63.07 1ama n PRO 293 Cb 0.36 -1.12 -0.02 0.00 -0.05 0.00 0.00 33.50 32.67 1ama n PRO 293 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 175.50 174.12 1ama n MET 294 N -0.18 0.32 0.00 0.54 2.81 -0.43 -4.91 117.12 115.26 1ama n MET 294 Ca 0.03 0.13 0.00 0.00 -1.81 0.00 0.00 57.70 56.05 1ama n MET 294 Cb 0.11 -1.03 0.00 0.00 -0.71 0.00 0.00 33.22 31.58 1ama n MET 294 CO 0.00 0.00 0.00 2.48 1.51 0.00 0.00 175.97 179.96 1ama n TYR 295 N -3.76 0.00 0.00 2.03 0.18 -0.95 -5.06 117.16 109.61 1ama n TYR 295 Ca -0.08 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.70 1ama n TYR 295 Cb 0.31 0.05 0.00 0.00 -0.38 0.00 0.00 39.34 39.32 1ama n TYR 295 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 1ama n SER 296 N 0.00 0.00 -3.65 9.48 2.88 -0.98 -4.64 113.62 116.71 1ama n SER 296 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 1ama n SER 296 Cb 0.49 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.89 1ama n SER 296 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ama s ASN 297 N 0.00 -0.29 0.43 -3.46 2.20 -1.26 -4.34 114.94 108.22 1ama s ASN 297 Ca 0.00 -0.05 -0.03 0.00 -0.94 0.00 0.00 52.86 51.84 1ama s ASN 297 Cb 0.00 0.44 -0.03 0.00 -2.00 0.00 0.00 41.25 39.66 1ama s ASN 297 CO 0.00 -0.71 0.70 -2.16 -2.94 0.00 0.00 177.10 171.99 1ama s PRO 298 N -2.74 3.52 -0.13 3.55 0.04 -1.26 -5.04 135.00 132.93 1ama s PRO 298 Ca -0.04 0.01 -0.29 0.00 0.04 0.00 0.00 61.00 60.72 1ama s PRO 298 Cb -0.00 -2.48 -0.05 0.00 0.04 0.00 0.00 34.50 32.01 1ama s PRO 298 CO -0.04 -0.08 1.85 -1.25 0.04 0.00 0.00 177.00 177.51 1ama s PRO 299 N -4.59 3.78 0.24 0.56 0.04 -1.26 -4.80 135.00 128.97 1ama s PRO 299 Ca 0.45 2.05 -0.01 0.00 0.04 0.00 0.00 61.00 63.54 1ama s PRO 299 Cb -0.10 -4.14 0.29 0.00 0.04 0.00 0.00 34.50 30.59 1ama s PRO 299 CO 0.42 -1.34 1.66 0.00 0.04 0.00 0.00 177.00 177.78 1ama h MET 300 N 11.54 0.59 0.15 4.56 -0.00 -1.94 -3.38 114.93 126.45 1ama h MET 300 Ca -0.40 -0.25 -0.00 0.00 -0.00 0.00 0.00 59.70 59.05 1ama h MET 300 Cb 1.20 -0.02 -0.02 0.00 -0.00 0.00 0.00 31.60 32.76 1ama h MET 300 CO 0.97 0.81 -0.24 -0.97 -0.00 0.00 0.00 176.91 177.49 1ama h ASN 301 N 0.51 -0.68 -1.01 -0.10 -0.00 -1.92 -1.46 115.58 110.94 1ama h ASN 301 Ca 0.07 0.06 0.20 0.00 -0.00 0.00 0.00 56.30 56.63 1ama h ASN 301 Cb 0.75 0.24 -0.11 0.00 -0.00 0.00 0.00 38.32 39.20 1ama h ASN 301 CO 0.06 -0.28 0.61 1.23 -0.00 0.00 0.00 177.43 179.05 1ama h GLY 302 N -0.41 1.83 2.00 1.57 0.00 -1.77 0.05 103.07 106.33 1ama h GLY 302 Ca -0.02 -0.35 -0.13 0.00 0.00 0.00 0.00 47.33 46.83 1ama h GLY 302 CO -0.07 -0.11 -0.64 0.00 0.00 0.00 0.00 176.54 175.71 1ama h ALA 303 N 1.67 0.94 0.02 3.60 0.00 -1.71 -1.61 119.26 122.16 1ama h ALA 303 Ca 0.60 -0.58 -0.25 0.00 0.00 0.00 0.00 54.91 54.67 1ama h ALA 303 Cb 0.98 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 18.69 1ama h ALA 303 CO -0.41 0.80 -1.00 0.00 0.00 0.00 0.00 179.25 178.64 1ama h ARG 304 N 0.00 0.65 0.32 0.00 3.08 -0.01 -2.55 114.38 115.87 1ama h ARG 304 Ca -0.01 -0.72 -0.02 0.00 0.07 0.00 0.00 59.98 59.30 1ama h ARG 304 Cb 1.14 0.21 0.00 0.00 0.08 0.00 0.00 29.97 31.40 1ama h ARG 304 CO 0.08 1.30 -0.15 0.82 -1.07 0.00 0.00 179.97 180.95 1ama h ILE 305 N 0.30 0.68 -0.28 2.04 2.04 -1.00 -2.60 117.51 118.70 1ama h ILE 305 Ca -0.13 -0.52 0.07 0.00 1.00 0.00 0.00 64.86 65.28 1ama h ILE 305 Cb 1.67 0.94 -0.07 0.00 -0.74 0.00 0.00 36.82 38.62 1ama h ILE 305 CO 0.20 0.10 -0.26 0.00 0.00 0.00 0.00 178.15 178.19 1ama h ALA 306 N -0.18 -0.13 -0.35 1.87 0.00 -1.38 -2.61 119.26 116.48 1ama h ALA 306 Ca -0.04 0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1ama h ALA 306 Cb 0.49 0.54 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1ama h ALA 306 CO 0.07 -0.68 0.19 1.03 0.00 0.00 0.00 179.25 179.87 1ama h SER 307 N -0.25 0.30 -0.81 0.00 0.87 -1.53 0.40 113.55 112.53 1ama h SER 307 Ca 0.15 0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.73 1ama h SER 307 Cb 0.48 -0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 62.34 1ama h SER 307 CO -0.42 0.22 0.53 0.25 -0.53 0.00 0.00 176.83 176.88 1ama h LEU 308 N 0.39 0.89 0.44 2.23 5.85 -1.27 0.21 115.31 124.06 1ama h LEU 308 Ca 0.14 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 1ama h LEU 308 Cb 0.02 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 40.84 1ama h LEU 308 CO -0.08 0.63 -0.21 0.40 -0.34 0.00 0.00 178.44 178.84 1ama h ILE 309 N 1.05 0.34 -0.87 4.05 2.04 -1.14 -1.62 117.51 121.36 1ama h ILE 309 Ca 0.31 -0.56 0.03 0.00 1.00 0.00 0.00 64.86 65.65 1ama h ILE 309 Cb -0.05 0.51 -0.05 0.00 -0.74 0.00 0.00 36.82 36.48 1ama h ILE 309 CO -0.09 0.06 0.56 -0.07 0.00 0.00 0.00 178.15 178.61 1ama h LEU 310 N -1.01 0.93 -1.22 1.44 3.38 -0.09 -2.24 115.31 116.51 1ama h LEU 310 Ca -0.06 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1ama h LEU 310 Cb 0.56 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1ama h LEU 310 CO 0.10 0.64 0.00 0.59 0.09 0.00 0.00 178.44 179.86 1ama n ASN 311 N -4.54 1.87 -4.10 -0.43 3.02 0.72 -4.76 115.26 107.05 1ama n ASN 311 Ca 0.11 -1.65 -0.34 0.00 -0.03 0.00 0.00 54.58 52.66 1ama n ASN 311 Cb 0.09 -0.04 -0.13 0.00 -0.61 0.00 0.00 39.78 39.08 1ama n ASN 311 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1ama s THR 312 N -1.91 2.92 0.20 3.41 2.01 -0.61 -5.01 115.64 116.66 1ama s THR 312 Ca 0.35 -2.01 0.04 0.00 0.31 0.00 0.00 61.69 60.38 1ama s THR 312 Cb 0.20 -2.97 0.26 0.00 0.01 0.00 0.00 72.50 70.00 1ama s THR 312 CO 0.31 -0.54 0.99 -2.65 -0.69 0.00 0.00 174.62 172.04 1ama n PRO 313 N 4.50 -0.05 0.14 4.92 -0.02 -1.26 0.20 135.00 143.43 1ama n PRO 313 Ca -0.03 0.93 0.12 0.00 -2.02 0.00 0.00 63.50 62.51 1ama n PRO 313 Cb 0.42 -1.51 0.22 0.00 -0.02 0.00 0.00 33.50 32.60 1ama n PRO 313 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1ama h GLU 314 N 0.00 0.00 0.10 -0.52 3.07 -1.95 -2.70 114.58 112.58 1ama h GLU 314 Ca 0.41 0.00 -0.32 0.00 -0.50 0.00 0.00 59.36 58.95 1ama h GLU 314 Cb 0.91 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.81 1ama h GLU 314 CO -0.57 0.00 -1.71 -0.07 -1.40 0.00 0.00 179.01 175.26 1ama h LEU 315 N 0.00 0.34 -0.28 1.33 3.38 0.21 -2.72 115.31 117.57 1ama h LEU 315 Ca 0.00 -0.59 -0.01 0.00 0.09 0.00 0.00 57.88 57.38 1ama h LEU 315 Cb 0.88 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1ama h LEU 315 CO 0.00 1.51 0.14 -0.09 0.09 0.00 0.00 178.44 180.09 1ama h ARG 316 N 0.06 0.40 0.09 1.13 2.43 0.72 0.11 114.38 119.32 1ama h ARG 316 Ca -0.31 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 58.81 1ama h ARG 316 Cb 2.03 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 31.49 1ama h ARG 316 CO 0.13 0.37 -0.10 0.87 -1.51 0.00 0.00 179.97 179.72 1ama h LYS 317 N 0.33 -0.22 -0.40 0.20 1.57 -1.58 -1.21 116.57 115.27 1ama h LYS 317 Ca 0.10 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1ama h LYS 317 Cb 0.09 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 1ama h LYS 317 CO -0.01 -0.15 0.25 1.49 -0.57 0.00 0.00 179.45 180.46 1ama h GLU 318 N -0.23 0.54 -0.76 3.15 4.81 -1.40 -1.78 114.58 118.91 1ama h GLU 318 Ca 0.01 -0.04 0.15 0.00 -0.13 0.00 0.00 59.36 59.35 1ama h GLU 318 Cb 0.23 -0.12 -0.10 0.00 0.63 0.00 0.00 28.75 29.39 1ama h GLU 318 CO -0.04 0.38 0.27 2.35 -0.73 0.00 0.00 179.01 181.25 1ama h TRP 319 N 0.53 0.46 -0.12 0.92 7.01 -0.40 -0.79 115.95 123.56 1ama h TRP 319 Ca 0.14 0.04 -0.10 0.00 2.11 0.00 0.00 58.89 61.09 1ama h TRP 319 Cb -0.02 -0.09 -0.01 0.00 -2.10 0.00 0.00 29.16 26.94 1ama h TRP 319 CO -0.04 0.02 -0.36 -0.07 -2.79 0.00 0.00 178.44 175.20 1ama h LEU 320 N 0.39 0.25 -0.61 0.65 3.38 -0.74 -0.54 115.31 118.09 1ama h LEU 320 Ca 0.42 -0.09 -0.15 0.00 0.09 0.00 0.00 57.88 58.15 1ama h LEU 320 Cb 0.68 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1ama h LEU 320 CO -0.44 0.59 -0.58 0.58 0.09 0.00 0.00 178.44 178.69 1ama h VAL 321 N 0.21 1.36 -0.01 1.22 2.07 -0.33 -2.57 116.25 118.19 1ama h VAL 321 Ca 0.02 -1.88 -0.18 0.00 0.82 0.00 0.00 66.70 65.48 1ama h VAL 321 Cb 0.73 1.90 -0.01 0.00 -1.52 0.00 0.00 31.29 32.39 1ama h VAL 321 CO 0.06 0.57 -0.79 -0.33 0.02 0.00 0.00 177.57 177.09 1ama h GLU 322 N 0.28 0.17 0.00 1.57 5.08 -0.92 -1.79 114.58 118.97 1ama h GLU 322 Ca -0.00 -0.17 -0.12 0.00 -1.00 0.00 0.00 59.36 58.07 1ama h GLU 322 Cb 1.09 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 1ama h GLU 322 CO 0.10 0.88 -0.59 0.28 -1.00 0.00 0.00 179.01 178.67 1ama h VAL 323 N 0.11 1.34 -0.15 3.13 2.07 -1.05 -2.43 116.25 119.27 1ama h VAL 323 Ca -0.03 -2.07 -0.15 0.00 0.82 0.00 0.00 66.70 65.27 1ama h VAL 323 Cb 1.38 2.14 0.00 0.00 -1.52 0.00 0.00 31.29 33.30 1ama h VAL 323 CO 0.12 0.58 -0.48 0.11 0.02 0.00 0.00 177.57 177.91 1ama h LYS 324 N 0.00 0.59 -0.95 1.57 1.57 -1.31 -3.05 116.57 114.98 1ama h LYS 324 Ca -0.01 -0.43 0.04 0.00 -1.87 0.00 0.00 60.65 58.38 1ama h LYS 324 Cb 1.10 0.08 -0.06 0.00 0.08 0.00 0.00 32.23 33.43 1ama h LYS 324 CO 0.08 1.06 0.62 0.78 -0.57 0.00 0.00 179.45 181.41 1ama h GLY 325 N 0.24 1.39 1.09 3.86 0.00 -1.15 -2.04 103.07 106.45 1ama h GLY 325 Ca -0.02 -0.47 -0.15 0.00 0.00 0.00 0.00 47.33 46.69 1ama h GLY 325 CO 0.10 0.40 -0.36 -0.33 0.00 0.00 0.00 176.54 176.35 1ama h MET 326 N 1.20 0.88 -0.37 4.80 2.86 -1.49 -2.81 114.93 119.98 1ama h MET 326 Ca 0.38 -0.47 -0.15 0.00 -2.06 0.00 0.00 59.70 57.40 1ama h MET 326 Cb 0.01 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 1ama h MET 326 CO -0.12 1.11 -0.36 0.00 1.06 0.00 0.00 176.91 178.59 1ama h ALA 327 N 0.75 0.65 -0.58 6.32 0.00 -1.40 -2.61 119.26 122.39 1ama h ALA 327 Ca 0.06 -0.44 -0.04 0.00 0.00 0.00 0.00 54.91 54.49 1ama h ALA 327 Cb 0.95 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 1ama h ALA 327 CO 0.09 0.67 0.22 -0.44 0.00 0.00 0.00 179.25 179.79 1ama h ASP 328 N 0.72 0.81 -0.47 0.00 3.32 -1.41 -2.02 116.42 117.37 1ama h ASP 328 Ca 0.06 -0.18 -0.10 0.00 0.02 0.00 0.00 57.03 56.83 1ama h ASP 328 Cb 0.94 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.26 1ama h ASP 328 CO 0.09 0.77 -0.08 -0.09 -1.72 0.00 0.00 179.24 178.21 1ama h ARG 329 N 0.81 0.94 -0.54 3.56 2.43 -1.48 0.37 114.38 120.46 1ama h ARG 329 Ca 0.19 -0.32 -0.08 0.00 -0.81 0.00 0.00 59.98 58.96 1ama h ARG 329 Cb 0.22 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 1ama h ARG 329 CO -0.01 0.98 0.01 0.82 -1.51 0.00 0.00 179.97 180.25 1ama h ILE 330 N 0.85 1.25 -0.24 1.20 2.04 -1.29 0.68 117.51 121.99 1ama h ILE 330 Ca 0.14 -1.07 -0.01 0.00 1.00 0.00 0.00 64.86 64.92 1ama h ILE 330 Cb 0.61 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 1ama h ILE 330 CO 0.04 0.38 0.12 0.40 0.00 0.00 0.00 178.15 179.09 1ama h ILE 331 N 0.85 1.14 0.00 -0.67 2.04 -0.81 0.81 117.51 120.87 1ama h ILE 331 Ca 0.16 -0.41 -0.05 0.00 1.00 0.00 0.00 64.86 65.56 1ama h ILE 331 Cb 0.49 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 1ama h ILE 331 CO 0.02 0.14 -0.22 -1.28 0.00 0.00 0.00 178.15 176.82 1ama h SER 332 N 0.26 0.00 0.16 1.72 0.87 0.23 -2.07 113.55 114.73 1ama h SER 332 Ca 0.08 0.00 -0.21 0.00 -1.23 0.00 0.00 61.79 60.43 1ama h SER 332 Cb 0.12 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 1ama h SER 332 CO -0.01 0.22 -0.82 0.24 -0.53 0.00 0.00 176.83 175.92 1ama h MET 333 N 0.00 0.52 0.43 2.24 2.86 -0.13 -2.84 114.93 118.01 1ama h MET 333 Ca -0.00 -0.47 -0.02 0.00 -2.06 0.00 0.00 59.70 57.15 1ama h MET 333 Cb 0.38 0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.16 1ama h MET 333 CO 0.03 1.10 -0.21 0.00 1.06 0.00 0.00 176.91 178.89 1ama h ARG 334 N 0.34 -0.56 -0.35 1.72 3.08 -0.35 -1.84 114.38 116.41 1ama h ARG 334 Ca -0.06 0.04 0.06 0.00 0.07 0.00 0.00 59.98 60.09 1ama h ARG 334 Cb 1.43 0.13 -0.08 0.00 0.08 0.00 0.00 29.97 31.53 1ama h ARG 334 CO 0.15 -0.36 -0.48 1.15 -1.07 0.00 0.00 179.97 179.36 1ama h THR 335 N -0.60 0.07 -0.31 2.04 2.02 -1.44 -1.54 112.91 113.15 1ama h THR 335 Ca -0.06 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.14 1ama h THR 335 Cb 0.46 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 1ama h THR 335 CO 0.10 0.00 0.21 1.56 0.37 0.00 0.00 175.52 177.76 1ama h GLN 336 N -0.40 0.36 -0.09 6.66 4.20 -1.53 -2.20 115.11 122.11 1ama h GLN 336 Ca 0.10 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.74 1ama h GLN 336 Cb 0.61 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.30 1ama h GLN 336 CO -0.55 0.24 -0.14 1.25 -0.67 0.00 0.00 178.83 178.96 1ama h LEU 337 N 0.37 0.29 -0.81 1.46 5.85 -0.40 -2.02 115.31 120.05 1ama h LEU 337 Ca 0.12 -0.53 -0.06 0.00 0.84 0.00 0.00 57.88 58.24 1ama h LEU 337 Cb 0.03 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 1ama h LEU 337 CO -0.03 0.77 0.16 0.58 -0.34 0.00 0.00 178.44 179.58 1ama h VAL 338 N -0.18 1.25 -0.78 1.05 2.07 -1.33 -0.08 116.25 118.25 1ama h VAL 338 Ca 0.01 -0.94 -0.03 0.00 0.82 0.00 0.00 66.70 66.56 1ama h VAL 338 Cb 0.70 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 31.01 1ama h VAL 338 CO 0.03 0.36 0.37 -1.28 0.02 0.00 0.00 177.57 177.08 1ama h SER 339 N 1.00 1.03 0.31 0.57 0.87 -1.44 -1.64 113.55 114.24 1ama h SER 339 Ca 0.21 -0.14 -0.18 0.00 -1.23 0.00 0.00 61.79 60.45 1ama h SER 339 Cb 0.36 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 1ama h SER 339 CO 0.00 0.88 -0.73 0.78 -0.53 0.00 0.00 176.83 177.23 1ama h ASN 340 N 1.11 0.43 -0.41 6.23 -0.26 -0.96 -1.60 115.58 120.12 1ama h ASN 340 Ca 0.27 -0.28 -0.04 0.00 -0.56 0.00 0.00 56.30 55.69 1ama h ASN 340 Cb 0.12 -0.13 -0.02 0.00 -1.06 0.00 0.00 38.32 37.24 1ama h ASN 340 CO -0.03 1.02 0.11 -0.07 -1.06 0.00 0.00 177.43 177.40 1ama h LEU 341 N 0.24 0.60 -0.38 1.61 3.38 -0.62 0.72 115.31 120.86 1ama h LEU 341 Ca -0.03 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.66 1ama h LEU 341 Cb 1.30 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 1ama h LEU 341 CO 0.12 0.66 0.01 0.11 0.09 0.00 0.00 178.44 179.44 1ama h LYS 342 N 0.51 0.67 -0.60 1.13 1.57 -1.24 0.40 116.57 119.02 1ama h LYS 342 Ca 0.13 -0.21 0.03 0.00 -1.87 0.00 0.00 60.65 58.73 1ama h LYS 342 Cb 0.29 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 1ama h LYS 342 CO -0.00 0.76 0.39 -0.22 -0.57 0.00 0.00 179.45 179.81 1ama h LYS 343 N 0.50 0.67 0.00 3.15 3.64 -0.81 0.48 116.57 124.20 1ama h LYS 343 Ca 0.11 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1ama h LYS 343 Cb 0.45 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1ama h LYS 343 CO 0.02 0.44 0.00 0.93 -2.27 0.00 0.00 179.45 178.57 1ama h GLU 344 N 0.69 0.00 0.00 1.90 4.39 0.86 -3.47 114.58 118.96 1ama h GLU 344 Ca 0.24 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.94 1ama h GLU 344 Cb 0.09 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 1ama h GLU 344 CO -0.06 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.20 1ama n GLY 345 N 0.72 1.80 3.69 -3.84 0.00 0.16 -5.07 105.19 102.65 1ama n GLY 345 Ca 0.04 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 1ama n GLY 345 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ama s SER 346 N -2.09 6.52 0.10 1.61 0.15 0.14 -4.90 113.70 115.22 1ama s SER 346 Ca 0.00 2.62 0.27 0.00 0.70 0.00 0.00 55.95 59.54 1ama s SER 346 Cb 0.00 -2.57 1.02 0.00 -1.71 0.00 0.00 66.02 62.76 1ama s SER 346 CO 0.00 -0.94 1.83 -0.24 1.20 0.00 0.00 173.24 175.09 1ama n SER 347 N 5.55 0.35 -4.88 5.45 2.88 -1.26 -4.67 113.62 117.05 1ama n SER 347 Ca 0.17 0.54 -0.30 0.00 -1.33 0.00 0.00 58.87 57.94 1ama n SER 347 Cb 0.39 -0.63 0.00 0.00 -0.75 0.00 0.00 64.21 63.22 1ama n SER 347 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1ama s HIS 348 N -3.06 3.60 -0.40 0.66 3.76 -1.26 -5.03 115.29 113.56 1ama s HIS 348 Ca 0.12 1.17 -0.25 0.00 -0.15 0.00 0.00 55.06 55.95 1ama s HIS 348 Cb 0.15 -2.61 0.02 0.00 1.11 0.00 0.00 32.58 31.25 1ama s HIS 348 CO 0.53 -0.55 0.86 1.21 -0.85 0.00 0.00 174.74 175.95 1ama s ASN 349 N -4.08 6.56 -0.16 1.40 3.84 -1.26 -4.90 114.94 116.34 1ama s ASN 349 Ca 0.53 0.31 0.16 0.00 0.21 0.00 0.00 52.86 54.07 1ama s ASN 349 Cb -0.11 -2.43 0.56 0.00 -0.55 0.00 0.00 41.25 38.73 1ama s ASN 349 CO 0.50 -0.87 1.47 0.79 -2.79 0.00 0.00 177.10 176.20 1ama n TRP 350 N 6.75 1.11 -0.32 0.43 7.02 -1.26 -4.74 117.44 126.43 1ama n TRP 350 Ca 0.05 -0.80 0.26 0.00 -1.02 0.00 0.00 57.50 55.99 1ama n TRP 350 Cb 0.48 -0.31 0.57 0.00 -2.42 0.00 0.00 31.31 29.63 1ama n TRP 350 CO 0.00 0.00 0.00 0.37 -2.02 0.00 0.00 177.69 176.04 1ama h GLN 351 N 2.32 0.28 -0.32 -0.99 5.75 -1.99 -1.38 115.11 118.77 1ama h GLN 351 Ca 0.00 -0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 58.47 1ama h GLN 351 Cb 1.45 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 29.93 1ama h GLN 351 CO 0.24 0.18 0.12 1.12 -2.65 0.00 0.00 178.83 177.85 1ama h HIS 352 N 0.28 0.43 -0.64 3.99 2.07 -1.95 -1.00 115.15 118.33 1ama h HIS 352 Ca 0.58 -0.01 0.13 0.00 -2.85 0.00 0.00 60.37 58.22 1ama h HIS 352 Cb 1.69 -0.14 -0.10 0.00 2.57 0.00 0.00 27.41 31.44 1ama h HIS 352 CO -0.00 0.35 0.12 0.82 -3.07 0.00 0.00 177.93 176.15 1ama h ILE 353 N 0.44 0.58 0.00 6.12 2.04 -1.62 0.25 117.51 125.32 1ama h ILE 353 Ca 0.11 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.89 1ama h ILE 353 Cb 0.10 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 1ama h ILE 353 CO -0.01 0.04 -0.94 0.35 0.00 0.00 0.00 178.15 177.59 1ama n THR 354 N -5.16 0.33 0.03 -0.27 -2.24 -1.12 -4.06 114.28 101.79 1ama n THR 354 Ca 0.10 -0.34 -0.19 0.00 -2.27 0.00 0.00 64.05 61.35 1ama n THR 354 Cb 0.36 -0.04 -0.13 0.00 -2.10 0.00 0.00 70.33 68.43 1ama n THR 354 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1ama h ASP 355 N 0.00 0.56 -4.06 3.42 5.19 -0.23 -3.46 116.42 117.84 1ama h ASP 355 Ca 0.00 -0.84 -0.54 0.00 -0.62 0.00 0.00 57.03 55.04 1ama h ASP 355 Cb 0.81 -0.18 0.12 0.00 0.18 0.00 0.00 39.33 40.27 1ama h ASP 355 CO 0.00 1.34 0.54 -1.10 -3.12 0.00 0.00 179.24 176.90 1ama s GLN 356 N -2.91 3.16 0.32 3.56 -0.21 0.78 -5.00 119.66 119.36 1ama s GLN 356 Ca -0.13 2.02 0.10 0.00 0.02 0.00 0.00 55.36 57.38 1ama s GLN 356 Cb 0.03 -2.16 -0.06 0.00 1.00 0.00 0.00 33.01 31.82 1ama s GLN 356 CO 0.84 -1.11 -0.11 0.96 -2.12 0.00 0.00 175.29 173.75 1ama s ILE 357 N -1.43 2.40 0.00 1.08 -5.25 -0.50 -4.99 121.20 112.51 1ama s ILE 357 Ca 0.73 -2.23 0.00 0.00 -0.99 0.00 0.00 60.65 58.15 1ama s ILE 357 Cb -0.35 -2.56 0.00 0.00 2.95 0.00 0.00 42.46 42.49 1ama s ILE 357 CO 0.40 -0.27 0.00 0.61 -1.79 0.00 0.00 174.94 173.90 1ama n GLY 358 N -0.76 -1.36 0.01 6.27 0.00 -1.20 -4.32 105.19 103.82 1ama n GLY 358 Ca -0.05 -1.98 0.12 0.00 0.00 0.00 0.00 46.02 44.11 1ama n GLY 358 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1ama n MET 359 N 0.00 0.04 -3.90 1.61 2.81 -1.26 -4.89 117.12 111.52 1ama n MET 359 Ca 0.00 0.01 -0.21 0.00 -1.81 0.00 0.00 57.70 55.68 1ama n MET 359 Cb 0.00 -1.52 -0.05 0.00 -0.71 0.00 0.00 33.22 30.94 1ama n MET 359 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1ama n PHE 360 N -1.57 0.39 -3.92 2.03 3.01 -1.26 -0.45 117.46 115.69 1ama n PHE 360 Ca 0.05 -1.96 -0.13 0.00 1.01 0.00 0.00 57.45 56.42 1ama n PHE 360 Cb 0.35 -0.09 -0.14 0.00 -0.01 0.00 0.00 39.48 39.58 1ama n PHE 360 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ama s PHE 362 N 0.13 3.82 0.42 0.00 5.36 -1.26 -1.46 117.98 124.98 1ama s PHE 362 Ca -0.01 -3.12 0.09 0.00 -0.96 0.00 0.00 56.93 52.93 1ama s PHE 362 Cb -0.02 -3.10 0.91 0.00 -0.34 0.00 0.00 43.02 40.47 1ama s PHE 362 CO -0.00 -0.69 2.05 1.79 -1.46 0.00 0.00 175.22 176.91 1ama h THR 363 N 4.14 1.06 0.00 0.12 1.35 -1.91 -3.48 112.91 114.19 1ama h THR 363 Ca 0.16 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.84 1ama h THR 363 Cb 0.79 0.51 0.00 0.00 -1.73 0.00 0.00 68.15 67.73 1ama h THR 363 CO 0.82 0.09 0.00 0.61 -0.25 0.00 0.00 175.52 176.79 1ama n GLY 364 N -1.49 0.73 3.71 5.82 0.00 -1.26 -5.05 105.19 107.65 1ama n GLY 364 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1ama n GLY 364 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ama n LEU 365 N 0.00 4.55 -4.92 0.99 4.77 -1.26 -5.00 117.00 116.13 1ama n LEU 365 Ca 0.00 1.02 -0.26 0.00 -0.03 0.00 0.00 56.01 56.74 1ama n LEU 365 Cb 0.00 -1.52 0.01 0.00 -2.33 0.00 0.00 43.42 39.59 1ama n LEU 365 CO 0.00 -0.76 0.45 -0.54 -1.33 0.00 0.00 177.39 175.20 1ama s LYS 366 N -2.52 3.24 0.54 3.23 1.02 -1.26 -4.24 119.74 119.75 1ama s LYS 366 Ca 0.67 0.01 0.20 0.00 0.02 0.00 0.00 55.97 56.87 1ama s LYS 366 Cb -0.46 -2.37 1.43 0.00 -0.52 0.00 0.00 37.83 35.91 1ama s LYS 366 CO 0.54 -0.39 2.17 -1.35 -0.92 0.00 0.00 175.35 175.39 1ama h PRO 367 N 0.11 0.00 -0.16 -1.68 0.11 -1.95 -1.84 132.00 126.59 1ama h PRO 367 Ca -0.46 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.50 1ama h PRO 367 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1ama h PRO 367 CO 0.61 0.00 -0.52 0.93 -0.21 0.00 0.00 178.00 178.81 1ama h GLU 368 N 0.00 0.46 -0.10 1.05 3.07 -1.96 -1.80 114.58 115.31 1ama h GLU 368 Ca 0.02 -0.27 -0.19 0.00 -0.50 0.00 0.00 59.36 58.42 1ama h GLU 368 Cb 0.08 0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.01 1ama h GLU 368 CO -0.00 0.87 -0.72 1.96 -1.40 0.00 0.00 179.01 179.72 1ama h GLN 369 N 0.36 0.46 -0.40 2.33 4.20 -1.70 -0.47 115.11 119.88 1ama h GLN 369 Ca 0.01 -0.36 -0.07 0.00 0.06 0.00 0.00 58.65 58.29 1ama h GLN 369 Cb 1.03 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.87 1ama h GLN 369 CO 0.09 1.00 -0.03 0.28 -0.67 0.00 0.00 178.83 179.50 1ama h VAL 370 N 0.32 1.27 -0.16 -0.54 2.07 -1.30 -1.78 116.25 116.12 1ama h VAL 370 Ca -0.03 -1.07 -0.01 0.00 0.82 0.00 0.00 66.70 66.42 1ama h VAL 370 Cb 1.29 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 32.21 1ama h VAL 370 CO 0.13 0.36 0.08 -0.08 0.02 0.00 0.00 177.57 178.07 1ama h GLU 371 N 0.55 0.23 -0.34 1.57 4.81 -1.29 -2.33 114.58 117.78 1ama h GLU 371 Ca 0.11 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.22 1ama h GLU 371 Cb 0.52 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 1ama h GLU 371 CO 0.03 0.28 -0.14 0.00 -0.73 0.00 0.00 179.01 178.44 1ama h ARG 372 N 0.13 0.61 -0.46 1.92 3.08 -1.03 -2.39 114.38 116.24 1ama h ARG 372 Ca 0.06 -0.19 0.03 0.00 0.07 0.00 0.00 59.98 59.94 1ama h ARG 372 Cb 0.12 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 1ama h ARG 372 CO -0.01 0.73 0.25 1.25 -1.07 0.00 0.00 179.97 181.12 1ama h LEU 373 N 0.55 0.39 -0.11 3.04 5.85 -1.06 0.32 115.31 124.30 1ama h LEU 373 Ca 0.10 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 1ama h LEU 373 Cb 0.56 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.52 1ama h LEU 373 CO 0.04 0.28 -0.11 0.74 -0.34 0.00 0.00 178.44 179.04 1ama h THR 374 N 0.50 1.36 0.01 1.05 2.02 -1.20 -1.64 112.91 115.02 1ama h THR 374 Ca 0.19 -1.27 -0.19 0.00 0.77 0.00 0.00 66.41 65.91 1ama h THR 374 Cb 0.05 1.95 0.02 0.00 -1.74 0.00 0.00 68.15 68.43 1ama h THR 374 CO -0.11 0.36 -0.76 0.50 0.37 0.00 0.00 175.52 175.89 1ama h LYS 375 N -0.13 0.49 0.04 6.66 3.64 -1.40 -2.28 116.57 123.59 1ama h LYS 375 Ca 0.02 -0.54 -0.32 0.00 -1.27 0.00 0.00 60.65 58.54 1ama h LYS 375 Cb 0.63 0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 32.57 1ama h LYS 375 CO 0.03 1.18 -1.80 0.39 -2.27 0.00 0.00 179.45 176.98 1ama n GLU 376 N -4.10 0.67 0.00 1.90 1.02 0.11 -4.56 120.64 115.69 1ama n GLU 376 Ca -0.11 0.29 0.03 0.00 -0.02 0.00 0.00 57.16 57.35 1ama n GLU 376 Cb 0.75 -1.77 -0.00 0.00 -0.02 0.00 0.00 31.44 30.40 1ama n GLU 376 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1ama n PHE 377 N -3.18 0.00 -3.16 -0.32 3.72 -0.67 -5.01 117.46 108.84 1ama n PHE 377 Ca -0.22 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 56.97 1ama n PHE 377 Cb 1.05 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 39.64 1ama n PHE 377 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1ama n SER 378 N -0.41 -5.83 -4.40 4.37 7.64 -0.86 -4.61 113.62 109.53 1ama n SER 378 Ca 0.03 -0.35 -0.39 0.00 1.01 0.00 0.00 58.87 59.17 1ama n SER 378 Cb 0.14 -4.57 -0.12 0.00 -1.01 0.00 0.00 64.21 58.65 1ama n SER 378 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1ama s ILE 379 N -3.19 4.49 -0.26 0.44 1.01 -0.98 -1.43 121.20 121.28 1ama s ILE 379 Ca 0.38 -0.62 -0.11 0.00 0.00 0.00 0.00 60.65 60.29 1ama s ILE 379 Cb -0.17 -3.37 -0.05 0.00 0.01 0.00 0.00 42.46 38.88 1ama s ILE 379 CO 0.46 -0.04 0.18 -0.31 0.00 0.00 0.00 174.94 175.24 1ama s TYR 380 N 1.57 3.28 0.29 3.97 1.51 -0.68 -2.68 117.35 124.61 1ama s TYR 380 Ca 0.03 0.20 0.05 0.00 -1.01 0.00 0.00 57.07 56.34 1ama s TYR 380 Cb -0.18 -2.32 -0.03 0.00 -0.11 0.00 0.00 41.96 39.31 1ama s TYR 380 CO 0.06 -0.03 0.23 0.00 -1.11 0.00 0.00 175.55 174.70 1ama s MET 381 N 1.36 1.57 0.54 -0.62 0.23 -1.26 0.93 119.30 122.05 1ama s MET 381 Ca 0.08 -1.89 -0.09 0.00 -1.03 0.00 0.00 55.69 52.75 1ama s MET 381 Cb -0.15 0.30 -0.04 0.00 -1.53 0.00 0.00 34.83 33.41 1ama s MET 381 CO 0.07 -0.56 0.91 0.95 -2.03 0.00 0.00 175.02 174.36 1ama s THR 382 N -3.68 4.78 0.33 3.16 -4.23 -1.04 -4.82 115.64 110.15 1ama s THR 382 Ca 0.40 0.62 0.38 0.00 -1.18 0.00 0.00 61.69 61.91 1ama s THR 382 Cb 0.04 -3.85 0.41 0.00 1.34 0.00 0.00 72.50 70.44 1ama s THR 382 CO 0.22 -0.95 2.14 0.11 -0.54 0.00 0.00 174.62 175.61 1ama h LYS 383 N 0.11 0.00 0.00 3.99 1.79 -1.89 -2.97 116.57 117.59 1ama h LYS 383 Ca -0.46 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.01 1ama h LYS 383 Cb 1.20 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.85 1ama h LYS 383 CO 0.62 0.00 0.00 -0.40 -1.08 0.00 0.00 179.45 178.59 1ama n ASP 384 N -3.06 0.00 0.00 0.86 5.75 -1.26 -4.51 116.55 114.32 1ama n ASP 384 Ca -0.01 -1.23 0.00 0.00 -0.01 0.00 0.00 54.79 53.54 1ama n ASP 384 Cb 0.20 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 1ama n ASP 384 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ama n GLY 385 N 0.60 0.77 3.69 6.12 0.00 -1.12 -4.75 105.19 110.49 1ama n GLY 385 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1ama n GLY 385 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ama s ARG 386 N -0.42 4.31 0.04 1.61 3.52 -1.25 -3.47 118.95 123.28 1ama s ARG 386 Ca 0.00 1.89 0.09 0.00 -0.13 0.00 0.00 55.73 57.58 1ama s ARG 386 Cb 0.00 -3.54 -0.03 0.00 -1.56 0.00 0.00 34.95 29.82 1ama s ARG 386 CO 0.00 -0.52 -0.26 0.96 -0.81 0.00 0.00 175.30 174.67 1ama s ILE 387 N 2.22 2.09 -0.58 4.11 -4.36 -0.54 -2.48 121.20 121.65 1ama s ILE 387 Ca 0.62 -1.34 -0.19 0.00 -0.26 0.00 0.00 60.65 59.47 1ama s ILE 387 Cb -0.30 -1.78 0.09 0.00 1.25 0.00 0.00 42.46 41.72 1ama s ILE 387 CO 0.26 0.38 0.73 -0.55 0.24 0.00 0.00 174.94 175.99 1ama s SER 388 N -1.17 6.19 0.43 4.36 0.15 -0.43 -1.85 113.70 121.38 1ama s SER 388 Ca 0.11 -1.25 0.23 0.00 0.70 0.00 0.00 55.95 55.74 1ama s SER 388 Cb -0.10 -2.32 0.80 0.00 -1.71 0.00 0.00 66.02 62.69 1ama s SER 388 CO 0.02 -1.12 1.77 1.62 1.20 0.00 0.00 173.24 176.73 1ama h VAL 389 N 5.92 0.52 -0.46 4.45 3.04 -1.08 -2.93 116.25 125.72 1ama h VAL 389 Ca -0.29 -1.22 0.13 0.00 -1.01 0.00 0.00 66.70 64.31 1ama h VAL 389 Cb 1.09 1.85 -0.02 0.00 -2.01 0.00 0.00 31.29 32.20 1ama h VAL 389 CO 1.08 0.23 0.33 0.00 -1.01 0.00 0.00 177.57 178.20 1ama h ALA 390 N 1.77 2.42 -0.35 3.17 0.00 -1.74 -1.34 119.26 123.19 1ama h ALA 390 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ama h ALA 390 Cb 0.83 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1ama h ALA 390 CO 0.03 -0.57 0.00 0.41 0.00 0.00 0.00 179.25 179.12 1ama n GLY 391 N -1.62 0.81 3.87 0.00 0.00 -1.11 -3.06 105.19 104.08 1ama n GLY 391 Ca 0.08 -0.39 -0.35 0.00 0.00 0.00 0.00 46.02 45.36 1ama n GLY 391 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ama s VAL 392 N -1.55 5.18 0.29 1.61 1.01 -0.51 -4.89 120.40 121.55 1ama s VAL 392 Ca 0.24 0.36 0.11 0.00 0.00 0.00 0.00 61.98 62.70 1ama s VAL 392 Cb 0.13 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 32.84 1ama s VAL 392 CO 0.16 0.35 -0.17 0.00 0.00 0.00 0.00 175.10 175.44 1ama s ALA 393 N -1.32 2.75 0.53 5.51 0.00 -1.26 -4.83 121.76 123.15 1ama s ALA 393 Ca 0.30 -1.92 0.27 0.00 0.00 0.00 0.00 51.96 50.60 1ama s ALA 393 Cb -0.14 -0.19 1.42 0.00 0.00 0.00 0.00 23.12 24.21 1ama s ALA 393 CO 0.17 0.22 1.98 0.77 0.00 0.00 0.00 175.76 178.89 1ama h SER 394 N 2.23 0.00 1.38 0.00 0.02 -1.91 -1.67 113.55 113.60 1ama h SER 394 Ca -0.40 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 1ama h SER 394 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 1ama h SER 394 CO 0.63 0.00 0.00 0.77 -1.14 0.00 0.00 176.83 177.09 1ama h SER 395 N 0.00 0.00 0.00 3.07 4.64 -1.96 -3.35 113.55 115.95 1ama h SER 395 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 1ama h SER 395 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1ama h SER 395 CO -0.00 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.50 1ama n ASN 396 N -2.33 0.84 -0.08 4.97 0.23 -0.66 -4.74 115.26 113.49 1ama n ASN 396 Ca 0.05 -1.37 0.00 0.00 -0.53 0.00 0.00 54.58 52.73 1ama n ASN 396 Cb 0.40 0.00 0.29 0.00 -2.08 0.00 0.00 39.78 38.40 1ama n ASN 396 CO 0.00 0.00 0.00 1.62 -0.93 0.00 0.00 177.26 177.95 1ama h VAL 397 N 1.37 1.18 -0.04 3.53 3.04 -1.61 -1.74 116.25 121.97 1ama h VAL 397 Ca 0.00 -0.53 -0.01 0.00 -1.01 0.00 0.00 66.70 65.15 1ama h VAL 397 Cb 0.66 0.56 -0.00 0.00 -2.01 0.00 0.00 31.29 30.50 1ama h VAL 397 CO 0.00 0.21 0.01 1.23 -1.01 0.00 0.00 177.57 178.01 1ama h GLY 398 N 0.84 0.08 0.64 3.17 0.00 -1.85 -1.61 103.07 104.33 1ama h GLY 398 Ca 0.17 -0.05 0.06 0.00 0.00 0.00 0.00 47.33 47.52 1ama h GLY 398 CO -0.02 0.05 0.32 -1.82 0.00 0.00 0.00 176.54 175.07 1ama h TYR 399 N -0.18 0.59 -0.12 5.60 3.20 -1.68 -1.43 116.97 122.95 1ama h TYR 399 Ca 0.01 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 1ama h TYR 399 Cb 0.28 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.37 1ama h TYR 399 CO 0.02 0.27 0.03 1.25 -1.64 0.00 0.00 178.16 178.08 1ama h LEU 400 N 0.60 0.19 -0.45 2.82 5.85 -1.28 -2.06 115.31 120.99 1ama h LEU 400 Ca 0.29 -0.24 0.09 0.00 0.84 0.00 0.00 57.88 58.86 1ama h LEU 400 Cb 0.21 -0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.12 1ama h LEU 400 CO -0.20 0.38 -0.04 0.00 -0.34 0.00 0.00 178.44 178.23 1ama h ALA 401 N 0.82 0.37 -0.30 1.25 0.00 -1.01 0.43 119.26 120.82 1ama h ALA 401 Ca 0.04 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1ama h ALA 401 Cb 0.26 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1ama h ALA 401 CO 0.00 -0.42 0.19 1.25 0.00 0.00 0.00 179.25 180.28 1ama h HIS 402 N 0.06 0.38 -0.16 0.00 -0.00 -1.21 -1.08 115.15 113.14 1ama h HIS 402 Ca 0.22 0.01 -0.05 0.00 -0.00 0.00 0.00 60.37 60.55 1ama h HIS 402 Cb 0.33 -0.13 -0.00 0.00 -0.00 0.00 0.00 27.41 27.61 1ama h HIS 402 CO -0.33 0.25 -0.08 0.00 -0.00 0.00 0.00 177.93 177.77 1ama h ALA 403 N 1.10 0.23 -0.91 5.26 0.00 -0.68 -0.02 119.26 124.24 1ama h ALA 403 Ca 0.11 -0.27 0.12 0.00 0.00 0.00 0.00 54.91 54.87 1ama h ALA 403 Cb -0.04 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.61 1ama h ALA 403 CO -0.02 0.04 0.53 0.82 0.00 0.00 0.00 179.25 180.61 1ama h ILE 404 N 0.01 0.85 -0.18 0.00 2.04 -0.08 -1.99 117.51 118.17 1ama h ILE 404 Ca 0.04 -0.28 -0.04 0.00 1.00 0.00 0.00 64.86 65.58 1ama h ILE 404 Cb 0.55 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1ama h ILE 404 CO 0.02 0.15 -0.03 -0.74 0.00 0.00 0.00 178.15 177.56 1ama h HIS 405 N 0.82 0.38 0.02 1.37 2.76 -0.95 -2.82 115.15 116.73 1ama h HIS 405 Ca 0.46 -0.08 0.02 0.00 -2.20 0.00 0.00 60.37 58.58 1ama h HIS 405 Cb 0.52 -0.09 -0.03 0.00 1.55 0.00 0.00 27.41 29.35 1ama h HIS 405 CO -0.04 0.58 -0.19 1.96 -1.30 0.00 0.00 177.93 178.94 1ama h GLN 406 N 0.07 -0.30 0.00 5.26 1.08 -0.28 1.76 115.11 122.70 1ama h GLN 406 Ca 0.05 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 1ama h GLN 406 Cb 0.45 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.94 1ama h GLN 406 CO 0.01 -0.20 0.00 0.28 -0.95 0.00 0.00 178.83 177.97 1ama n VAL 408 N -5.32 0.99 -0.04 -0.54 0.31 -0.92 -2.93 118.33 109.88 1ama n VAL 408 Ca -0.05 0.25 -0.04 0.00 -0.01 0.00 0.00 64.34 64.50 1ama n VAL 408 Cb 0.23 -1.05 -0.06 0.00 -0.91 0.00 0.00 33.84 32.05 1ama n VAL 408 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1ama n THR 409 N -1.65 0.51 0.00 2.52 -1.04 -0.91 -4.88 114.28 108.83 1ama n THR 409 Ca 0.03 -0.32 0.00 0.00 -2.04 0.00 0.00 64.05 61.73 1ama n THR 409 Cb 0.18 -0.80 0.00 0.00 -1.82 0.00 0.00 70.33 67.88 1ama n THR 409 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60