#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ddm s SER 3 N 0.00 6.38 0.00 6.43 1.04 -1.09 -4.65 113.70 121.81 2ddm s SER 3 Ca 0.00 2.97 0.25 0.00 0.48 0.00 0.00 55.95 59.65 2ddm s SER 3 Cb 0.00 -2.65 0.41 0.00 0.10 0.00 0.00 66.02 63.88 2ddm s SER 3 CO 0.00 -0.88 1.38 0.18 0.98 0.00 0.00 173.24 174.90 2ddm n LEU 4 N 1.51 2.68 -4.56 2.42 4.77 -1.26 -4.83 117.00 117.73 2ddm n LEU 4 Ca 0.05 -0.93 -0.37 0.00 -0.03 0.00 0.00 56.01 54.74 2ddm n LEU 4 Cb 0.38 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.41 2ddm n LEU 4 CO 0.63 0.46 1.42 -0.76 -1.33 0.00 0.00 177.39 177.82 2ddm s LEU 5 N -1.95 3.38 0.40 2.23 1.43 -1.26 -4.79 118.68 118.12 2ddm s LEU 5 Ca 0.31 -1.11 0.10 0.00 -1.03 0.00 0.00 54.13 52.40 2ddm s LEU 5 Cb 0.20 -2.57 0.83 0.00 0.03 0.00 0.00 46.19 44.68 2ddm s LEU 5 CO 0.31 -1.91 1.95 0.25 0.23 0.00 0.00 176.35 177.17 2ddm h LEU 6 N 14.37 0.24 -0.11 1.79 6.46 -2.03 -2.36 115.31 133.66 2ddm h LEU 6 Ca 0.12 -0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.84 2ddm h LEU 6 Cb 1.02 -0.06 0.00 0.00 -0.73 0.00 0.00 40.66 40.88 2ddm h LEU 6 CO 1.35 0.35 -0.04 0.49 -0.62 0.00 0.00 178.44 179.97 2ddm n PHE 7 N -4.32 0.00 -1.91 1.25 0.99 -1.26 -4.90 117.46 107.31 2ddm n PHE 7 Ca -0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.45 57.04 2ddm n PHE 7 Cb 0.23 -0.18 -0.01 0.00 -1.00 0.00 0.00 39.48 38.52 2ddm n PHE 7 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.76 175.96 2ddm s ASN 8 N -2.40 6.50 0.82 4.37 0.02 -0.89 -4.99 114.94 118.37 2ddm s ASN 8 Ca 0.33 2.89 -0.11 0.00 -1.02 0.00 0.00 52.86 54.95 2ddm s ASN 8 Cb 0.21 -2.65 0.09 0.00 0.02 0.00 0.00 41.25 38.91 2ddm s ASN 8 CO 0.44 -0.76 1.09 -1.81 0.02 0.00 0.00 177.10 176.09 2ddm s ASP 9 N -0.12 4.19 0.13 -1.22 1.01 -1.26 -4.96 116.67 114.44 2ddm s ASP 9 Ca 0.53 1.40 -0.31 0.00 0.71 0.00 0.00 52.55 54.88 2ddm s ASP 9 Cb -0.44 -2.12 -0.09 0.00 1.01 0.00 0.00 42.92 41.28 2ddm s ASP 9 CO 0.56 -2.17 1.56 -0.75 0.21 0.00 0.00 175.17 174.58 2ddm s LYS 10 N -5.07 4.23 0.00 8.23 2.20 -1.26 -5.01 119.74 123.07 2ddm s LYS 10 Ca 0.62 2.29 -0.16 0.00 -0.36 0.00 0.00 55.97 58.36 2ddm s LYS 10 Cb -0.16 -3.30 -0.06 0.00 -1.51 0.00 0.00 37.83 32.81 2ddm s LYS 10 CO 0.55 -0.61 0.45 0.45 -0.36 0.00 0.00 175.35 175.83 2ddm s SER 11 N 1.49 6.85 0.00 1.43 0.15 -1.26 -4.98 113.70 117.38 2ddm s SER 11 Ca 0.70 1.01 0.24 0.00 0.70 0.00 0.00 55.95 58.60 2ddm s SER 11 Cb -0.41 -2.28 0.43 0.00 -1.71 0.00 0.00 66.02 62.05 2ddm s SER 11 CO 0.31 0.28 1.40 0.54 1.20 0.00 0.00 173.24 176.97 2ddm n ARG 12 N 2.00 2.25 -1.99 5.44 1.74 -1.26 -4.97 116.66 119.87 2ddm n ARG 12 Ca -0.12 -1.84 -0.31 0.00 -0.77 0.00 0.00 57.85 54.81 2ddm n ARG 12 Cb 0.52 -1.47 0.01 0.00 -1.02 0.00 0.00 32.46 30.49 2ddm n ARG 12 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ddm s ALA 13 N -1.81 3.14 0.51 7.54 0.00 -1.26 -5.03 121.76 124.84 2ddm s ALA 13 Ca 0.33 -0.13 -0.22 0.00 0.00 0.00 0.00 51.96 51.94 2ddm s ALA 13 Cb 0.21 -3.02 -0.06 0.00 0.00 0.00 0.00 23.12 20.25 2ddm s ALA 13 CO 0.31 -0.63 1.23 -0.51 0.00 0.00 0.00 175.76 176.16 2ddm s LEU 14 N -5.08 3.90 0.15 0.00 1.43 -1.26 -4.94 118.68 112.88 2ddm s LEU 14 Ca 0.54 2.47 0.10 0.00 -1.03 0.00 0.00 54.13 56.21 2ddm s LEU 14 Cb -0.11 -4.31 -0.04 0.00 0.03 0.00 0.00 46.19 41.76 2ddm s LEU 14 CO 0.52 -1.24 -0.21 -1.10 0.23 0.00 0.00 176.35 174.55 2ddm s GLN 15 N -2.87 1.65 0.01 1.70 -1.52 -1.26 -4.46 119.66 112.90 2ddm s GLN 15 Ca 0.68 -1.34 0.00 0.00 -1.95 0.00 0.00 55.36 52.75 2ddm s GLN 15 Cb -0.33 -1.99 -0.01 0.00 -0.22 0.00 0.00 33.01 30.47 2ddm s GLN 15 CO 0.39 0.44 -0.01 0.00 -0.25 0.00 0.00 175.29 175.85 2ddm s ALA 16 N -1.37 0.06 0.12 6.09 0.00 -1.24 -4.79 121.76 120.64 2ddm s ALA 16 Ca 0.19 -0.22 0.02 0.00 0.00 0.00 0.00 51.96 51.95 2ddm s ALA 16 Cb -0.09 0.05 -0.16 0.00 0.00 0.00 0.00 23.12 22.92 2ddm s ALA 16 CO 0.10 -0.06 1.28 -0.44 0.00 0.00 0.00 175.76 176.64 2ddm h ASP 17 N 5.59 0.20 -4.61 0.00 3.32 -1.35 -2.77 116.42 116.80 2ddm h ASP 17 Ca -0.27 -0.19 -0.31 0.00 0.02 0.00 0.00 57.03 56.27 2ddm h ASP 17 Cb 1.21 -0.06 -0.20 0.00 0.22 0.00 0.00 39.33 40.49 2ddm h ASP 17 CO 0.47 1.10 -0.74 -0.63 -1.72 0.00 0.00 179.24 177.72 2ddm s ILE 18 N -2.87 0.77 -0.21 0.35 1.01 -0.93 -0.73 121.20 118.59 2ddm s ILE 18 Ca -0.02 -1.30 0.00 0.00 0.00 0.00 0.00 60.65 59.33 2ddm s ILE 18 Cb 0.09 -0.94 0.05 0.00 0.01 0.00 0.00 42.46 41.67 2ddm s ILE 18 CO 0.84 -0.41 -0.06 -0.69 0.00 0.00 0.00 174.94 174.62 2ddm s VAL 19 N -1.72 1.42 -0.24 2.92 1.01 -0.80 -1.30 120.40 121.70 2ddm s VAL 19 Ca -0.04 -1.01 -0.09 0.00 0.00 0.00 0.00 61.98 60.84 2ddm s VAL 19 Cb -0.08 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 2ddm s VAL 19 CO 0.00 0.01 0.12 0.00 0.00 0.00 0.00 175.10 175.24 2ddm s ALA 20 N 1.47 3.44 -0.37 5.51 0.00 -0.39 -1.55 121.76 129.86 2ddm s ALA 20 Ca -0.03 -0.96 -0.05 0.00 0.00 0.00 0.00 51.96 50.93 2ddm s ALA 20 Cb -0.17 -2.21 0.07 0.00 0.00 0.00 0.00 23.12 20.82 2ddm s ALA 20 CO -0.07 -0.25 0.15 0.08 0.00 0.00 0.00 175.76 175.67 2ddm s VAL 21 N 1.18 3.55 0.00 0.00 1.01 -0.25 -1.19 120.40 124.70 2ddm s VAL 21 Ca 0.06 -1.56 0.00 0.00 0.00 0.00 0.00 61.98 60.48 2ddm s VAL 21 Cb -0.14 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 33.05 2ddm s VAL 21 CO 0.05 -0.41 0.00 0.00 0.00 0.00 0.00 175.10 174.74 2ddm n GLN 22 N 4.72 0.00 -1.89 2.72 6.02 -0.89 -1.22 117.38 126.84 2ddm n GLN 22 Ca -0.09 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.61 2ddm n GLN 22 Cb 0.43 0.00 0.06 0.00 1.02 0.00 0.00 30.24 31.75 2ddm n GLN 22 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2ddm s SER 23 N -0.11 5.19 -0.03 1.08 1.04 -1.25 0.28 113.70 119.90 2ddm s SER 23 Ca 0.00 1.03 -0.03 0.00 0.48 0.00 0.00 55.95 57.43 2ddm s SER 23 Cb 0.00 -1.75 0.01 0.00 0.10 0.00 0.00 66.02 64.38 2ddm s SER 23 CO 0.00 -1.50 0.08 -1.58 0.98 0.00 0.00 173.24 171.23 2ddm s GLN 24 N -5.42 0.14 -0.05 4.02 0.74 -0.31 -1.62 119.66 117.16 2ddm s GLN 24 Ca 0.59 0.05 0.03 0.00 0.05 0.00 0.00 55.36 56.08 2ddm s GLN 24 Cb -0.11 0.06 0.00 0.00 1.10 0.00 0.00 33.01 34.07 2ddm s GLN 24 CO 0.51 -0.02 -0.13 0.14 -0.55 0.00 0.00 175.29 175.24 2ddm s VAL 25 N -0.13 1.14 0.15 1.34 -7.23 -1.26 -0.74 120.40 113.67 2ddm s VAL 25 Ca -0.02 -0.53 -0.15 0.00 -1.81 0.00 0.00 61.98 59.47 2ddm s VAL 25 Cb -0.02 -1.01 0.03 0.00 0.56 0.00 0.00 36.38 35.95 2ddm s VAL 25 CO 0.00 0.34 1.77 0.58 -0.31 0.00 0.00 175.10 177.49 2ddm h VAL 26 N 5.56 1.15 -3.29 1.32 2.07 -1.02 -3.40 116.25 118.64 2ddm h VAL 26 Ca -0.32 -0.37 -0.66 0.00 0.82 0.00 0.00 66.70 66.16 2ddm h VAL 26 Cb 1.18 0.57 -0.30 0.00 -1.52 0.00 0.00 31.29 31.23 2ddm h VAL 26 CO 0.48 0.16 -0.79 -0.47 0.02 0.00 0.00 177.57 176.97 2ddm s TYR 27 N -5.92 2.82 0.00 1.57 5.04 0.22 -5.04 117.35 116.04 2ddm s TYR 27 Ca -0.13 -0.99 0.00 0.00 -2.44 0.00 0.00 57.07 53.51 2ddm s TYR 27 Cb 0.11 -1.92 0.00 0.00 0.35 0.00 0.00 41.96 40.50 2ddm s TYR 27 CO 0.74 -0.46 0.00 0.41 -1.34 0.00 0.00 175.55 174.90 2ddm n GLY 28 N 4.12 1.13 2.40 8.97 0.00 -1.26 -4.15 105.19 116.40 2ddm n GLY 28 Ca -0.19 -2.24 -0.24 0.00 0.00 0.00 0.00 46.02 43.35 2ddm n GLY 28 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ddm n SER 29 N 0.00 2.14 -4.29 1.61 7.64 -1.26 -4.79 113.62 114.66 2ddm n SER 29 Ca 0.00 -3.16 -0.16 0.00 1.01 0.00 0.00 58.87 56.56 2ddm n SER 29 Cb 0.00 -0.63 -0.10 0.00 -1.01 0.00 0.00 64.21 62.47 2ddm n SER 29 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2ddm s VAL 30 N -2.48 1.27 0.00 0.44 -7.23 -1.26 -4.31 120.40 106.83 2ddm s VAL 30 Ca 0.40 -2.09 0.00 0.00 -1.81 0.00 0.00 61.98 58.49 2ddm s VAL 30 Cb 0.23 -2.01 0.00 0.00 0.56 0.00 0.00 36.38 35.16 2ddm s VAL 30 CO -0.08 -0.62 0.00 0.61 -0.31 0.00 0.00 175.10 174.70 2ddm n GLY 31 N -0.29 2.35 0.30 2.32 0.00 -1.26 -1.81 105.19 106.79 2ddm n GLY 31 Ca -0.09 -0.41 0.19 0.00 0.00 0.00 0.00 46.02 45.72 2ddm n GLY 31 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2ddm h ASN 32 N 8.27 0.00 0.32 1.61 2.35 -1.62 -1.27 115.58 125.25 2ddm h ASN 32 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2ddm h ASN 32 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 2ddm h ASN 32 CO 0.00 0.02 0.00 0.28 -1.65 0.00 0.00 177.43 176.08 2ddm h SER 33 N 0.00 0.00 0.00 5.81 0.02 -1.55 -0.84 113.55 116.99 2ddm h SER 33 Ca -0.00 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 2ddm h SER 33 Cb 0.24 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 2ddm h SER 33 CO 0.00 0.00 -1.30 0.00 -1.14 0.00 0.00 176.83 174.39 2ddm n ILE 34 N -2.85 0.30 -0.02 3.27 0.13 -0.85 -4.66 119.36 114.68 2ddm n ILE 34 Ca -0.01 -0.16 -0.12 0.00 -1.10 0.00 0.00 62.75 61.36 2ddm n ILE 34 Cb 0.14 -0.81 -0.08 0.00 -0.84 0.00 0.00 39.64 38.05 2ddm n ILE 34 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2ddm h ALA 35 N 0.13 0.09 -0.08 1.51 0.00 -1.12 -2.44 119.26 117.35 2ddm h ALA 35 Ca -0.12 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.66 2ddm h ALA 35 Cb 1.23 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 2ddm h ALA 35 CO -0.00 -0.23 -0.24 0.28 0.00 0.00 0.00 179.25 179.06 2ddm h VAL 36 N -0.17 0.44 -0.90 0.00 2.07 -1.40 0.28 116.25 116.56 2ddm h VAL 36 Ca 0.02 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.54 2ddm h VAL 36 Cb 0.34 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.51 2ddm h VAL 36 CO 0.00 0.00 0.55 -0.65 0.02 0.00 0.00 177.57 177.50 2ddm h PRO 37 N -0.33 1.22 -0.52 1.57 0.11 -1.77 0.15 132.00 132.44 2ddm h PRO 37 Ca 0.08 -0.10 -0.04 0.00 0.11 0.00 0.00 66.00 66.05 2ddm h PRO 37 Cb 0.45 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 31.28 2ddm h PRO 37 CO -0.27 0.84 0.17 0.00 -0.21 0.00 0.00 178.00 178.53 2ddm h ALA 38 N 1.37 0.68 -0.53 -0.75 0.00 -0.91 0.07 119.26 119.19 2ddm h ALA 38 Ca 0.33 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2ddm h ALA 38 Cb -0.07 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2ddm h ALA 38 CO -0.06 0.33 0.23 0.82 0.00 0.00 0.00 179.25 180.56 2ddm h ILE 39 N 0.70 1.21 -0.86 0.00 2.04 0.28 -2.29 117.51 118.59 2ddm h ILE 39 Ca 0.17 -0.63 0.06 0.00 1.00 0.00 0.00 64.86 65.45 2ddm h ILE 39 Cb 0.27 0.65 -0.06 0.00 -0.74 0.00 0.00 36.82 36.94 2ddm h ILE 39 CO -0.01 0.24 0.54 0.11 0.00 0.00 0.00 178.15 179.04 2ddm h LYS 40 N 0.71 0.97 -0.81 2.37 6.56 -0.38 -1.09 116.57 124.90 2ddm h LYS 40 Ca 0.18 -0.06 0.12 0.00 -1.06 0.00 0.00 60.65 59.83 2ddm h LYS 40 Cb 0.17 -0.22 -0.06 0.00 -0.57 0.00 0.00 32.23 31.55 2ddm h LYS 40 CO -0.02 0.64 0.53 1.96 -2.06 0.00 0.00 179.45 180.50 2ddm h GLN 41 N 1.00 0.62 0.00 3.15 4.20 -0.41 0.51 115.11 124.18 2ddm h GLN 41 Ca 0.37 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.04 2ddm h GLN 41 Cb 0.13 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.77 2ddm h GLN 41 CO -0.16 0.41 0.00 0.09 -0.67 0.00 0.00 178.83 178.50 2ddm n ASN 42 N -4.52 0.00 -0.55 1.46 3.02 -0.42 -4.86 115.26 109.39 2ddm n ASN 42 Ca 0.15 -1.55 -0.06 0.00 -0.03 0.00 0.00 54.58 53.09 2ddm n ASN 42 Cb 0.42 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.57 2ddm n ASN 42 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ddm n GLY 43 N 0.52 0.47 3.62 7.41 0.00 0.17 -5.04 105.19 112.34 2ddm n GLY 43 Ca 0.06 -0.72 -0.23 0.00 0.00 0.00 0.00 46.02 45.13 2ddm n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ddm s LEU 44 N -1.48 3.10 0.04 0.99 2.01 -1.15 -5.05 118.68 117.13 2ddm s LEU 44 Ca 0.00 -0.71 0.02 0.00 0.01 0.00 0.00 54.13 53.45 2ddm s LEU 44 Cb 0.00 -1.61 -0.04 0.00 0.01 0.00 0.00 46.19 44.55 2ddm s LEU 44 CO 0.00 0.01 0.06 0.20 1.01 0.00 0.00 176.35 177.62 2ddm s ASN 45 N -3.65 5.45 -0.03 2.29 0.01 -1.26 -4.08 114.94 113.67 2ddm s ASN 45 Ca 0.31 0.02 -0.13 0.00 -0.71 0.00 0.00 52.86 52.35 2ddm s ASN 45 Cb -0.06 -1.47 0.02 0.00 0.41 0.00 0.00 41.25 40.15 2ddm s ASN 45 CO 0.19 0.22 0.28 0.54 -1.51 0.00 0.00 177.10 176.83 2ddm s VAL 46 N -1.27 0.05 -0.16 1.60 0.11 -1.26 -1.22 120.40 118.25 2ddm s VAL 46 Ca 0.25 -0.43 -0.04 0.00 -2.93 0.00 0.00 61.98 58.83 2ddm s VAL 46 Cb -0.12 -0.56 -0.03 0.00 -1.53 0.00 0.00 36.38 34.15 2ddm s VAL 46 CO 0.17 -0.24 -0.03 -0.36 -3.33 0.00 0.00 175.10 171.31 2ddm s PHE 47 N -1.10 3.02 -0.26 1.54 2.99 -0.42 -5.00 117.98 118.76 2ddm s PHE 47 Ca -0.12 -0.34 -0.10 0.00 0.00 0.00 0.00 56.93 56.37 2ddm s PHE 47 Cb -0.05 -1.98 -0.05 0.00 0.00 0.00 0.00 43.02 40.94 2ddm s PHE 47 CO 0.03 -0.08 0.17 0.00 -0.00 0.00 0.00 175.22 175.35 2ddm s ALA 48 N 0.47 3.52 -0.29 5.36 0.00 -1.26 -1.26 121.76 128.30 2ddm s ALA 48 Ca -0.03 -1.03 -0.01 0.00 0.00 0.00 0.00 51.96 50.89 2ddm s ALA 48 Cb -0.14 -2.39 0.05 0.00 0.00 0.00 0.00 23.12 20.64 2ddm s ALA 48 CO 0.03 -0.42 -0.03 0.08 0.00 0.00 0.00 175.76 175.42 2ddm s VAL 49 N 1.51 2.87 0.36 0.00 1.01 -0.33 -4.99 120.40 120.82 2ddm s VAL 49 Ca 0.07 -1.35 -0.25 0.00 0.00 0.00 0.00 61.98 60.45 2ddm s VAL 49 Cb -0.15 -2.62 -0.09 0.00 0.00 0.00 0.00 36.38 33.52 2ddm s VAL 49 CO 0.08 -0.04 1.03 -2.16 0.00 0.00 0.00 175.10 174.01 2ddm s PRO 50 N 1.25 4.34 -0.20 2.72 0.04 -1.25 -2.10 135.00 139.80 2ddm s PRO 50 Ca -0.05 1.50 0.13 0.00 0.04 0.00 0.00 61.00 62.62 2ddm s PRO 50 Cb -0.19 -2.69 -0.22 0.00 0.04 0.00 0.00 34.50 31.44 2ddm s PRO 50 CO -0.02 0.02 -0.00 0.25 0.04 0.00 0.00 177.00 177.28 2ddm n THR 51 N 0.26 1.33 -3.84 1.26 -2.24 0.14 -4.77 114.28 106.42 2ddm n THR 51 Ca 0.03 -0.74 -0.12 0.00 -2.27 0.00 0.00 64.05 60.95 2ddm n THR 51 Cb 0.49 -0.71 -0.10 0.00 -2.10 0.00 0.00 70.33 67.91 2ddm n THR 51 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2ddm s VAL 52 N -2.47 0.07 -0.35 2.28 -7.23 -1.26 -0.73 120.40 110.71 2ddm s VAL 52 Ca -0.15 -0.57 0.03 0.00 -1.81 0.00 0.00 61.98 59.47 2ddm s VAL 52 Cb 0.06 -0.45 0.10 0.00 0.56 0.00 0.00 36.38 36.66 2ddm s VAL 52 CO 0.73 -0.31 0.09 -0.22 -0.31 0.00 0.00 175.10 175.07 2ddm s LEU 53 N -1.20 4.03 0.23 1.32 1.98 -0.43 -1.16 118.68 123.44 2ddm s LEU 53 Ca -0.13 -2.12 0.07 0.00 -2.89 0.00 0.00 54.13 49.07 2ddm s LEU 53 Cb -0.06 -1.42 -0.04 0.00 0.66 0.00 0.00 46.19 45.33 2ddm s LEU 53 CO 0.02 -0.37 0.10 -0.76 -1.89 0.00 0.00 176.35 173.44 2ddm s LEU 54 N 0.96 3.55 0.25 -0.68 1.43 0.08 -2.99 118.68 121.27 2ddm s LEU 54 Ca 0.11 -0.37 0.03 0.00 -1.03 0.00 0.00 54.13 52.88 2ddm s LEU 54 Cb -0.19 -2.12 0.31 0.00 0.03 0.00 0.00 46.19 44.22 2ddm s LEU 54 CO -0.11 0.01 1.62 0.77 0.23 0.00 0.00 176.35 178.87 2ddm h SER 55 N 1.97 0.40 -5.58 2.29 4.64 -1.00 -0.17 113.55 116.09 2ddm h SER 55 Ca -0.47 -0.18 0.25 0.00 -0.47 0.00 0.00 61.79 60.91 2ddm h SER 55 Cb 1.23 -0.11 -0.07 0.00 -0.31 0.00 0.00 62.40 63.14 2ddm h SER 55 CO 0.60 0.80 0.70 0.54 -0.87 0.00 0.00 176.83 178.60 2ddm s ASN 56 N -6.88 -0.04 0.65 4.97 4.22 -1.26 -0.61 114.94 115.99 2ddm s ASN 56 Ca -0.06 -0.39 -0.17 0.00 -2.14 0.00 0.00 52.86 50.10 2ddm s ASN 56 Cb 0.13 0.34 -0.01 0.00 1.28 0.00 0.00 41.25 42.99 2ddm s ASN 56 CO 0.80 -0.65 1.22 0.42 -2.04 0.00 0.00 177.10 176.85 2ddm s THR 57 N -2.40 2.43 -2.00 0.54 -4.23 -1.26 -4.71 115.64 104.00 2ddm s THR 57 Ca 0.20 0.24 0.11 0.00 -1.18 0.00 0.00 61.69 61.07 2ddm s THR 57 Cb -0.00 -2.99 0.33 0.00 1.34 0.00 0.00 72.50 71.18 2ddm s THR 57 CO 0.01 -0.08 1.11 -2.65 -0.54 0.00 0.00 174.62 172.47 2ddm n PRO 58 N -2.05 0.43 0.11 3.99 -0.02 -1.26 -3.05 135.00 133.15 2ddm n PRO 58 Ca 0.14 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.59 2ddm n PRO 58 Cb 0.50 -1.42 0.05 0.00 -0.02 0.00 0.00 33.50 32.61 2ddm n PRO 58 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2ddm h HIS 59 N 0.00 0.00 -3.86 6.00 3.86 -1.91 -3.46 115.15 115.78 2ddm h HIS 59 Ca 0.00 0.00 -0.44 0.00 -1.16 0.00 0.00 60.37 58.77 2ddm h HIS 59 Cb 0.00 0.00 0.16 0.00 1.06 0.00 0.00 27.41 28.63 2ddm h HIS 59 CO 0.00 0.74 0.25 0.71 0.86 0.00 0.00 177.93 180.48 2ddm s TYR 60 N -3.14 1.48 0.42 2.45 1.51 -1.17 -4.94 117.35 113.96 2ddm s TYR 60 Ca 0.01 0.62 0.10 0.00 -1.01 0.00 0.00 57.07 56.78 2ddm s TYR 60 Cb 0.11 -3.55 0.91 0.00 -0.11 0.00 0.00 41.96 39.32 2ddm s TYR 60 CO 0.78 -3.09 2.03 -0.44 -1.11 0.00 0.00 175.55 173.71 2ddm h ASP 61 N -2.00 0.30 -4.68 2.29 3.32 -1.91 -3.43 116.42 110.29 2ddm h ASP 61 Ca -0.48 -0.03 -0.24 0.00 0.02 0.00 0.00 57.03 56.31 2ddm h ASP 61 Cb 1.30 -0.08 -0.17 0.00 0.22 0.00 0.00 39.33 40.60 2ddm h ASP 61 CO 0.46 0.29 -0.71 0.42 -1.72 0.00 0.00 179.24 177.98 2ddm s THR 62 N -5.14 0.63 -0.15 0.35 -4.23 -1.26 -5.16 115.64 100.67 2ddm s THR 62 Ca -0.07 -1.65 -0.29 0.00 -1.18 0.00 0.00 61.69 58.50 2ddm s THR 62 Cb 0.17 -1.33 0.11 0.00 1.34 0.00 0.00 72.50 72.79 2ddm s THR 62 CO 0.72 -0.72 0.90 0.72 -0.54 0.00 0.00 174.62 175.70 2ddm s PHE 63 N -2.91 -0.48 0.20 3.99 -0.71 -1.26 -4.89 117.98 111.92 2ddm s PHE 63 Ca 0.05 0.90 0.00 0.00 -1.04 0.00 0.00 56.93 56.84 2ddm s PHE 63 Cb 0.00 0.42 -0.04 0.00 -1.21 0.00 0.00 43.02 42.19 2ddm s PHE 63 CO -0.03 -0.40 0.08 0.71 -1.34 0.00 0.00 175.22 174.24 2ddm s TYR 64 N -0.88 1.22 0.00 3.49 1.51 -1.26 -4.96 117.35 116.48 2ddm s TYR 64 Ca -0.03 -1.22 0.00 0.00 -1.01 0.00 0.00 57.07 54.81 2ddm s TYR 64 Cb -0.01 -0.67 0.00 0.00 -0.11 0.00 0.00 41.96 41.17 2ddm s TYR 64 CO 0.03 -0.44 0.00 0.41 -1.11 0.00 0.00 175.55 174.44 2ddm n GLY 65 N -0.29 -3.42 0.00 0.71 0.00 -1.26 -0.37 105.19 100.57 2ddm n GLY 65 Ca -0.02 -2.15 0.00 0.00 0.00 0.00 0.00 46.02 43.85 2ddm n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ddm n GLY 66 N -0.17 2.32 3.76 -0.02 0.00 -1.16 -4.90 105.19 105.03 2ddm n GLY 66 Ca 0.00 -0.77 -0.40 0.00 0.00 0.00 0.00 46.02 44.85 2ddm n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ddm s ALA 67 N -1.00 3.38 0.05 4.61 0.00 -1.26 -1.32 121.76 126.22 2ddm s ALA 67 Ca 0.00 0.97 -0.31 0.00 0.00 0.00 0.00 51.96 52.62 2ddm s ALA 67 Cb 0.00 -3.36 -0.07 0.00 0.00 0.00 0.00 23.12 19.69 2ddm s ALA 67 CO 0.00 -0.31 1.41 0.42 0.00 0.00 0.00 175.76 177.28 2ddm s ILE 68 N -1.22 3.50 0.33 0.00 -1.09 0.09 -4.91 121.20 117.90 2ddm s ILE 68 Ca 0.48 0.99 -0.28 0.00 -2.23 0.00 0.00 60.65 59.60 2ddm s ILE 68 Cb -0.33 -3.63 -0.13 0.00 -1.58 0.00 0.00 42.46 36.79 2ddm s ILE 68 CO 0.42 0.03 1.24 -2.65 -1.23 0.00 0.00 174.94 172.76 2ddm n PRO 69 N 4.76 1.97 -0.29 2.79 -0.02 -1.26 -4.63 135.00 138.33 2ddm n PRO 69 Ca 0.13 0.69 0.10 0.00 -2.02 0.00 0.00 63.50 62.39 2ddm n PRO 69 Cb 0.43 -2.23 0.23 0.00 -0.02 0.00 0.00 33.50 31.90 2ddm n PRO 69 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2ddm h ASP 70 N 2.49 -0.24 -0.56 2.55 3.32 -1.98 0.27 116.42 122.27 2ddm h ASP 70 Ca -0.45 0.21 -0.00 0.00 0.02 0.00 0.00 57.03 56.81 2ddm h ASP 70 Cb 1.29 0.34 -0.03 0.00 0.22 0.00 0.00 39.33 41.15 2ddm h ASP 70 CO 0.63 -0.20 0.35 -0.08 -1.72 0.00 0.00 179.24 178.22 2ddm h GLU 71 N 0.13 0.76 0.03 3.56 4.81 -1.99 0.21 114.58 122.09 2ddm h GLU 71 Ca 0.49 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.66 2ddm h GLU 71 Cb 0.95 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.17 2ddm h GLU 71 CO -0.70 0.53 -0.02 -1.49 -0.73 0.00 0.00 179.01 176.60 2ddm h TRP 72 N 0.76 -0.04 -0.07 0.92 4.06 -1.35 -1.45 115.95 118.78 2ddm h TRP 72 Ca 0.20 -0.00 0.04 0.00 2.06 0.00 0.00 58.89 61.19 2ddm h TRP 72 Cb -0.04 0.01 -0.05 0.00 -1.00 0.00 0.00 29.16 28.08 2ddm h TRP 72 CO -0.03 0.32 -0.26 0.35 -3.56 0.00 0.00 178.44 175.27 2ddm h PHE 73 N -0.41 -0.69 -0.77 0.49 3.57 -0.34 0.20 116.94 119.00 2ddm h PHE 73 Ca -0.00 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.54 2ddm h PHE 73 Cb 0.38 0.32 -0.04 0.00 2.79 0.00 0.00 35.95 39.39 2ddm h PHE 73 CO 0.05 -0.34 0.50 0.66 -2.23 0.00 0.00 178.31 176.95 2ddm h SER 74 N -0.36 0.85 -0.87 0.41 4.64 -0.65 -2.33 113.55 115.25 2ddm h SER 74 Ca 0.08 -0.02 0.01 0.00 -0.47 0.00 0.00 61.79 61.40 2ddm h SER 74 Cb 0.48 -0.21 -0.04 0.00 -0.31 0.00 0.00 62.40 62.32 2ddm h SER 74 CO -0.28 0.61 0.57 1.23 -0.87 0.00 0.00 176.83 178.10 2ddm h GLY 75 N 1.01 1.23 0.89 -0.77 0.00 -0.16 -0.50 103.07 104.76 2ddm h GLY 75 Ca 0.29 -0.45 0.02 0.00 0.00 0.00 0.00 47.33 47.19 2ddm h GLY 75 CO -0.08 0.44 0.22 -0.97 0.00 0.00 0.00 176.54 176.16 2ddm h TYR 76 N 1.17 0.42 -0.46 5.60 0.99 -0.11 0.39 116.97 124.97 2ddm h TYR 76 Ca 0.32 0.01 -0.06 0.00 2.00 0.00 0.00 58.73 61.00 2ddm h TYR 76 Cb -0.12 -0.13 -0.02 0.00 1.00 0.00 0.00 36.73 37.46 2ddm h TYR 76 CO -0.01 0.24 0.05 -0.07 -0.00 0.00 0.00 178.16 178.37 2ddm h LEU 77 N 0.45 0.74 -0.61 3.88 3.38 -1.15 -2.82 115.31 119.19 2ddm h LEU 77 Ca 0.16 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 2ddm h LEU 77 Cb 0.02 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 2ddm h LEU 77 CO -0.08 0.83 0.20 -0.09 0.09 0.00 0.00 178.44 179.40 2ddm h ARG 78 N 0.63 0.94 -0.86 1.13 2.43 -0.70 -2.78 114.38 115.16 2ddm h ARG 78 Ca 0.14 -0.20 0.07 0.00 -0.81 0.00 0.00 59.98 59.18 2ddm h ARG 78 Cb 0.42 -0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 29.78 2ddm h ARG 78 CO 0.01 0.83 0.56 0.00 -1.51 0.00 0.00 179.97 179.86 2ddm h ALA 79 N 1.07 1.58 -0.57 2.80 0.00 -0.06 -0.91 119.26 123.17 2ddm h ALA 79 Ca 0.20 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.11 2ddm h ALA 79 Cb 0.27 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2ddm h ALA 79 CO -0.01 0.28 0.38 -0.07 0.00 0.00 0.00 179.25 179.83 2ddm h LEU 80 N 0.94 0.61 0.03 0.00 3.38 -1.25 0.21 115.31 119.24 2ddm h LEU 80 Ca 0.37 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.33 2ddm h LEU 80 Cb 0.25 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2ddm h LEU 80 CO -0.14 0.43 -0.02 1.56 0.09 0.00 0.00 178.44 180.36 2ddm h GLN 81 N 0.71 -0.05 0.00 1.13 4.20 -1.24 -2.80 115.11 117.06 2ddm h GLN 81 Ca 0.22 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.92 2ddm h GLN 81 Cb 0.00 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 27.79 2ddm h GLN 81 CO -0.05 0.60 -0.04 0.93 -0.67 0.00 0.00 178.83 179.60 2ddm h GLU 82 N -0.77 0.00 -0.01 1.46 5.08 -0.80 0.12 114.58 119.66 2ddm h GLU 82 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2ddm h GLU 82 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 2ddm h GLU 82 CO 0.01 0.04 -0.16 0.54 -1.00 0.00 0.00 179.01 178.44 2ddm n ARG 83 N -3.43 0.92 -3.77 2.33 5.12 0.71 -4.94 116.66 113.60 2ddm n ARG 83 Ca -0.02 -0.47 -0.25 0.00 -1.93 0.00 0.00 57.85 55.18 2ddm n ARG 83 Cb 0.16 -1.49 0.04 0.00 -1.16 0.00 0.00 32.46 30.01 2ddm n ARG 83 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 2ddm n ASP 84 N -0.63 -3.00 -1.41 0.55 2.03 0.40 -4.70 116.55 109.79 2ddm n ASP 84 Ca 0.14 -0.78 0.07 0.00 0.52 0.00 0.00 54.79 54.75 2ddm n ASP 84 Cb 0.32 -4.09 0.33 0.00 -0.72 0.00 0.00 41.12 36.96 2ddm n ASP 84 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ddm n ALA 85 N -4.49 3.49 -0.69 -1.67 0.00 -1.06 -4.54 120.51 111.55 2ddm n ALA 85 Ca -0.14 -2.15 0.07 0.00 0.00 0.00 0.00 53.44 51.23 2ddm n ALA 85 Cb 0.61 -0.93 0.22 0.00 0.00 0.00 0.00 19.45 19.35 2ddm n ALA 85 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2ddm n LEU 86 N 0.03 3.49 -0.09 0.00 4.77 -1.26 -3.60 117.00 120.33 2ddm n LEU 86 Ca 0.25 -2.64 0.05 0.00 -0.03 0.00 0.00 56.01 53.64 2ddm n LEU 86 Cb 1.06 -0.42 0.39 0.00 -2.33 0.00 0.00 43.42 42.11 2ddm n LEU 86 CO 0.25 0.69 1.19 0.03 -1.33 0.00 0.00 177.39 178.22 2ddm h ARG 87 N 1.82 0.64 -0.13 3.23 -0.00 -1.90 -2.21 114.38 115.84 2ddm h ARG 87 Ca 0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 59.98 59.44 2ddm h ARG 87 Cb 1.17 -0.15 0.00 0.00 0.00 0.00 0.00 29.97 30.99 2ddm h ARG 87 CO 0.14 0.43 0.00 1.04 0.00 0.00 0.00 179.97 181.57 2ddm n GLN 88 N -4.47 2.19 -1.66 0.04 1.13 -1.26 -2.67 117.38 110.67 2ddm n GLN 88 Ca 0.07 -1.75 -0.45 0.00 -1.94 0.00 0.00 57.00 52.92 2ddm n GLN 88 Cb 0.13 -1.47 -0.04 0.00 0.11 0.00 0.00 30.24 28.97 2ddm n GLN 88 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 2ddm n LEU 89 N 1.06 3.76 -0.00 1.08 7.94 -0.83 -4.28 117.00 125.73 2ddm n LEU 89 Ca 0.17 0.88 0.01 0.00 -1.11 0.00 0.00 56.01 55.96 2ddm n LEU 89 Cb 0.53 -1.45 -0.02 0.00 0.53 0.00 0.00 43.42 43.01 2ddm n LEU 89 CO 0.15 0.02 -0.21 0.54 -1.11 0.00 0.00 177.39 176.79 2ddm n ARG 90 N 7.25 3.83 -3.50 1.96 1.74 0.09 0.93 116.66 128.96 2ddm n ARG 90 Ca 0.22 -0.01 -0.13 0.00 -0.77 0.00 0.00 57.85 57.16 2ddm n ARG 90 Cb 0.36 -0.79 -0.04 0.00 -1.02 0.00 0.00 32.46 30.97 2ddm n ARG 90 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ddm s ALA 91 N -1.60 -1.76 -0.08 7.54 0.00 -0.77 -2.03 121.76 123.05 2ddm s ALA 91 Ca 0.00 1.08 -0.01 0.00 0.00 0.00 0.00 51.96 53.03 2ddm s ALA 91 Cb 0.02 0.19 0.03 0.00 0.00 0.00 0.00 23.12 23.36 2ddm s ALA 91 CO 0.11 -0.53 -0.01 0.08 0.00 0.00 0.00 175.76 175.41 2ddm s VAL 92 N -2.26 0.47 0.08 0.00 1.01 -0.93 -1.91 120.40 116.86 2ddm s VAL 92 Ca -0.03 0.05 0.03 0.00 0.00 0.00 0.00 61.98 62.03 2ddm s VAL 92 Cb -0.01 -0.62 -0.04 0.00 0.00 0.00 0.00 36.38 35.72 2ddm s VAL 92 CO -0.02 0.26 0.08 0.42 0.00 0.00 0.00 175.10 175.84 2ddm s THR 93 N 1.93 4.52 -0.02 3.92 -4.23 -0.60 -1.53 115.64 119.64 2ddm s THR 93 Ca 0.05 -0.79 0.03 0.00 -1.18 0.00 0.00 61.69 59.80 2ddm s THR 93 Cb -0.12 -3.18 -0.00 0.00 1.34 0.00 0.00 72.50 70.53 2ddm s THR 93 CO -0.06 0.11 -0.12 0.42 -0.54 0.00 0.00 174.62 174.43 2ddm s THR 94 N -1.41 0.99 0.00 3.99 -4.23 -0.38 -1.09 115.64 113.52 2ddm s THR 94 Ca 0.29 -0.50 0.00 0.00 -1.18 0.00 0.00 61.69 60.30 2ddm s THR 94 Cb -0.12 -0.84 0.00 0.00 1.34 0.00 0.00 72.50 72.88 2ddm s THR 94 CO 0.22 0.29 0.00 0.61 -0.54 0.00 0.00 174.62 175.20 2ddm n GLY 95 N 3.00 5.43 3.70 3.99 0.00 -0.36 -1.14 105.19 119.82 2ddm n GLY 95 Ca -0.16 -1.27 -0.57 0.00 0.00 0.00 0.00 46.02 44.02 2ddm n GLY 95 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2ddm n TYR 96 N 0.00 2.03 -4.15 1.61 9.36 -1.26 -4.72 117.16 120.04 2ddm n TYR 96 Ca 0.00 0.52 -0.36 0.00 3.32 0.00 0.00 57.90 61.39 2ddm n TYR 96 Cb 0.00 -2.46 -0.08 0.00 -0.63 0.00 0.00 39.34 36.17 2ddm n TYR 96 CO 0.00 0.00 0.00 -1.64 0.22 0.00 0.00 176.86 175.44 2ddm s MET 97 N 3.38 3.22 0.05 2.98 -1.94 -1.26 -3.82 119.30 121.90 2ddm s MET 97 Ca 0.97 -0.28 -0.18 0.00 -1.71 0.00 0.00 55.69 54.49 2ddm s MET 97 Cb -1.05 -2.98 -0.16 0.00 2.01 0.00 0.00 34.83 32.65 2ddm s MET 97 CO 0.64 0.72 1.28 0.78 -0.01 0.00 0.00 175.02 178.43 2ddm h GLY 98 N 5.14 0.57 -2.47 -0.03 0.00 -1.93 -3.48 103.07 100.87 2ddm h GLY 98 Ca -0.52 -0.73 -0.13 0.00 0.00 0.00 0.00 47.33 45.95 2ddm h GLY 98 CO 0.56 0.65 -0.33 -0.51 0.00 0.00 0.00 176.54 176.92 2ddm s THR 99 N -3.88 0.02 0.29 4.70 -4.23 -1.26 -5.00 115.64 106.27 2ddm s THR 99 Ca -0.13 -1.60 0.04 0.00 -1.18 0.00 0.00 61.69 58.82 2ddm s THR 99 Cb 0.06 -2.22 0.06 0.00 1.34 0.00 0.00 72.50 71.74 2ddm s THR 99 CO 0.81 -0.07 1.71 0.00 -0.54 0.00 0.00 174.62 176.54 2ddm h ALA 100 N 2.44 1.11 -0.55 3.99 0.00 -1.92 -2.72 119.26 121.60 2ddm h ALA 100 Ca -0.31 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.20 2ddm h ALA 100 Cb 1.24 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 2ddm h ALA 100 CO 0.44 0.56 0.20 0.66 0.00 0.00 0.00 179.25 181.11 2ddm h SER 101 N 0.33 0.75 -0.59 0.00 4.64 -1.96 -1.23 113.55 115.48 2ddm h SER 101 Ca 0.04 -0.10 -0.10 0.00 -0.47 0.00 0.00 61.79 61.16 2ddm h SER 101 Cb 0.73 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.60 2ddm h SER 101 CO 0.06 0.69 -0.02 1.56 -0.87 0.00 0.00 176.83 178.25 2ddm h GLN 102 N 0.80 1.07 -0.85 4.77 4.20 -1.90 -1.02 115.11 122.18 2ddm h GLN 102 Ca 0.19 -0.35 -0.00 0.00 0.06 0.00 0.00 58.65 58.55 2ddm h GLN 102 Cb 0.20 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 27.84 2ddm h GLN 102 CO -0.01 1.05 0.52 0.82 -0.67 0.00 0.00 178.83 180.53 2ddm h ILE 103 N 0.97 1.24 -0.23 2.54 2.04 -1.10 0.39 117.51 123.36 2ddm h ILE 103 Ca 0.17 -0.51 -0.03 0.00 1.00 0.00 0.00 64.86 65.49 2ddm h ILE 103 Cb 0.58 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 2ddm h ILE 103 CO 0.03 0.25 0.05 0.50 0.00 0.00 0.00 178.15 178.98 2ddm h LYS 104 N 1.17 0.38 -0.37 2.37 3.64 -0.98 -0.29 116.57 122.49 2ddm h LYS 104 Ca 0.31 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 2ddm h LYS 104 Cb -0.05 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 2ddm h LYS 104 CO -0.06 0.50 0.23 0.82 -2.27 0.00 0.00 179.45 178.68 2ddm h ILE 105 N 0.19 1.11 -0.22 2.00 2.04 -0.65 -1.14 117.51 120.85 2ddm h ILE 105 Ca 0.07 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.68 2ddm h ILE 105 Cb 0.30 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 2ddm h ILE 105 CO 0.00 0.11 0.12 0.25 0.00 0.00 0.00 178.15 178.64 2ddm h LEU 106 N 0.49 0.27 -0.54 1.44 5.85 -0.14 -2.09 115.31 120.59 2ddm h LEU 106 Ca 0.13 -0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.84 2ddm h LEU 106 Cb -0.02 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 40.89 2ddm h LEU 106 CO -0.03 0.26 0.26 0.00 -0.34 0.00 0.00 178.44 178.60 2ddm h ALA 107 N 1.01 0.70 -0.79 1.25 0.00 -0.77 0.66 119.26 121.32 2ddm h ALA 107 Ca 0.08 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2ddm h ALA 107 Cb 0.05 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 2ddm h ALA 107 CO -0.01 -0.10 0.43 0.93 0.00 0.00 0.00 179.25 180.49 2ddm h GLU 108 N 0.49 1.11 -0.50 0.00 5.08 -1.00 0.88 114.58 120.65 2ddm h GLU 108 Ca 0.25 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 2ddm h GLU 108 Cb 0.19 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2ddm h GLU 108 CO -0.19 0.83 0.28 2.35 -1.00 0.00 0.00 179.01 181.27 2ddm h TRP 109 N 1.10 0.68 -0.61 4.33 7.01 -0.67 -2.35 115.95 125.44 2ddm h TRP 109 Ca 0.28 -0.01 -0.05 0.00 2.11 0.00 0.00 58.89 61.21 2ddm h TRP 109 Cb 0.04 -0.22 -0.03 0.00 -2.10 0.00 0.00 29.16 26.86 2ddm h TRP 109 CO 0.00 0.50 0.19 -0.07 -2.79 0.00 0.00 178.44 176.27 2ddm h LEU 110 N 0.66 0.89 -0.66 0.65 3.38 -0.13 -1.15 115.31 118.96 2ddm h LEU 110 Ca 0.18 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2ddm h LEU 110 Cb 0.04 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 2ddm h LEU 110 CO -0.03 0.87 0.39 0.71 0.09 0.00 0.00 178.44 180.46 2ddm h THR 111 N 0.87 1.20 0.17 0.22 1.35 -0.65 0.15 112.91 116.22 2ddm h THR 111 Ca 0.20 -0.45 -0.01 0.00 -0.55 0.00 0.00 66.41 65.60 2ddm h THR 111 Cb 0.29 0.30 0.00 0.00 -1.73 0.00 0.00 68.15 67.02 2ddm h THR 111 CO -0.01 0.21 -0.08 0.00 -0.25 0.00 0.00 175.52 175.39 2ddm h ALA 112 N 1.20 -0.23 -0.45 6.62 0.00 -1.20 -3.05 119.26 122.15 2ddm h ALA 112 Ca 0.23 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.16 2ddm h ALA 112 Cb -0.01 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 2ddm h ALA 112 CO -0.04 -0.63 0.11 -0.07 0.00 0.00 0.00 179.25 178.62 2ddm h LEU 113 N -0.23 0.05 -1.83 0.00 4.07 -0.80 -2.13 115.31 114.43 2ddm h LEU 113 Ca -0.02 0.07 0.37 0.00 0.08 0.00 0.00 57.88 58.38 2ddm h LEU 113 Cb 0.18 0.09 -0.07 0.00 1.08 0.00 0.00 40.66 41.94 2ddm h LEU 113 CO 0.04 0.06 0.89 0.03 -1.08 0.00 0.00 178.44 178.38 2ddm h ARG 114 N 0.25 0.08 0.00 1.13 2.47 -0.86 0.18 114.38 117.62 2ddm h ARG 114 Ca 0.22 -0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.87 2ddm h ARG 114 Cb 0.27 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.56 2ddm h ARG 114 CO -0.27 0.05 -0.33 0.87 0.56 0.00 0.00 179.97 180.85 2ddm h LYS 115 N 0.08 0.00 -0.00 0.04 1.57 -1.41 -3.07 116.57 113.77 2ddm h LYS 115 Ca 0.64 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.42 2ddm h LYS 115 Cb 2.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.66 2ddm h LYS 115 CO -0.10 0.33 -0.53 -0.25 -0.57 0.00 0.00 179.45 178.34 2ddm n ASP 116 N -3.77 0.90 -3.44 0.86 8.00 0.46 -4.71 116.55 114.86 2ddm n ASP 116 Ca -0.01 -0.95 -0.26 0.00 0.71 0.00 0.00 54.79 54.28 2ddm n ASP 116 Cb 0.42 0.84 -0.09 0.00 -0.02 0.00 0.00 41.12 42.26 2ddm n ASP 116 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2ddm n HIS 117 N -0.96 0.97 0.29 1.24 8.25 -0.25 -4.31 115.22 120.45 2ddm n HIS 117 Ca 0.04 -3.75 0.15 0.00 -0.26 0.00 0.00 57.72 53.90 2ddm n HIS 117 Cb 0.24 -0.26 0.90 0.00 1.12 0.00 0.00 29.99 31.99 2ddm n HIS 117 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2ddm h PRO 118 N 4.80 0.00 -0.01 -0.41 0.13 -1.82 -1.59 132.00 133.11 2ddm h PRO 118 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2ddm h PRO 118 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 2ddm h PRO 118 CO 0.56 0.00 -0.00 -0.40 -0.23 0.00 0.00 178.00 177.93 2ddm n ASP 119 N -3.85 1.27 -4.67 1.44 5.75 -1.26 -4.95 116.55 110.28 2ddm n ASP 119 Ca -0.02 -1.42 -0.51 0.00 -0.01 0.00 0.00 54.79 52.83 2ddm n ASP 119 Cb 0.11 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.15 2ddm n ASP 119 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 2ddm n LEU 120 N -0.01 2.80 -4.31 -2.12 0.00 -0.60 -4.88 117.00 107.88 2ddm n LEU 120 Ca 0.20 1.05 -0.44 0.00 0.00 0.00 0.00 56.01 56.82 2ddm n LEU 120 Cb 0.32 -1.30 -0.07 0.00 0.00 0.00 0.00 43.42 42.37 2ddm n LEU 120 CO 0.17 -0.37 0.04 -0.22 0.00 0.00 0.00 177.39 177.01 2ddm s LEU 121 N 2.57 5.77 -0.38 -1.96 0.20 -0.86 -4.94 118.68 119.07 2ddm s LEU 121 Ca 0.89 -1.63 -0.19 0.00 0.69 0.00 0.00 54.13 53.89 2ddm s LEU 121 Cb -0.82 -2.13 0.01 0.00 -0.43 0.00 0.00 46.19 42.81 2ddm s LEU 121 CO 0.51 -0.72 0.57 -0.63 -0.29 0.00 0.00 176.35 175.79 2ddm s ILE 122 N 1.54 4.94 -0.21 6.68 1.01 -1.26 -2.19 121.20 131.71 2ddm s ILE 122 Ca 0.04 0.25 -0.05 0.00 0.00 0.00 0.00 60.65 60.90 2ddm s ILE 122 Cb -0.27 -4.06 -0.02 0.00 0.01 0.00 0.00 42.46 38.13 2ddm s ILE 122 CO 0.03 -0.37 -0.02 -0.32 0.00 0.00 0.00 174.94 174.27 2ddm s MET 123 N 2.55 3.50 -0.11 2.79 1.75 -0.58 0.46 119.30 129.66 2ddm s MET 123 Ca 0.20 -0.57 0.00 0.00 -1.25 0.00 0.00 55.69 54.07 2ddm s MET 123 Cb -0.15 -3.05 -0.02 0.00 2.84 0.00 0.00 34.83 34.44 2ddm s MET 123 CO 0.15 -0.10 -0.11 0.08 -0.65 0.00 0.00 175.02 174.39 2ddm s VAL 124 N 1.27 3.28 -0.41 10.11 1.01 -0.35 -1.25 120.40 134.07 2ddm s VAL 124 Ca 0.03 -0.60 -0.05 0.00 0.00 0.00 0.00 61.98 61.36 2ddm s VAL 124 Cb -0.14 -2.36 0.10 0.00 0.00 0.00 0.00 36.38 33.97 2ddm s VAL 124 CO -0.00 0.54 0.22 -0.62 0.00 0.00 0.00 175.10 175.24 2ddm s ASP 125 N -0.04 5.38 -0.63 3.32 2.15 -0.29 -1.69 116.67 124.87 2ddm s ASP 125 Ca -0.02 -1.82 -0.04 0.00 0.43 0.00 0.00 52.55 51.10 2ddm s ASP 125 Cb -0.14 -1.88 -0.04 0.00 -0.30 0.00 0.00 42.92 40.56 2ddm s ASP 125 CO 0.04 -0.54 1.77 -2.65 -0.17 0.00 0.00 175.17 173.62 2ddm n PRO 126 N 4.72 1.44 -1.64 4.34 -0.02 -1.26 -4.41 135.00 138.16 2ddm n PRO 126 Ca -0.06 -1.17 -0.33 0.00 -2.02 0.00 0.00 63.50 59.92 2ddm n PRO 126 Cb 0.42 -2.32 -0.04 0.00 -0.02 0.00 0.00 33.50 31.54 2ddm n PRO 126 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2ddm s VAL 127 N 3.94 3.07 -0.10 -1.45 1.01 -1.26 -4.88 120.40 120.72 2ddm s VAL 127 Ca 0.28 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.27 2ddm s VAL 127 Cb 0.07 -3.18 0.03 0.00 0.00 0.00 0.00 36.38 33.30 2ddm s VAL 127 CO -0.02 -0.17 -0.04 -0.63 0.00 0.00 0.00 175.10 174.23 2ddm s ILE 128 N 12.10 0.76 0.00 2.22 1.01 -1.26 -4.75 121.20 131.28 2ddm s ILE 128 Ca 0.92 -0.12 0.00 0.00 0.00 0.00 0.00 60.65 61.44 2ddm s ILE 128 Cb -0.15 -0.83 0.00 0.00 0.01 0.00 0.00 42.46 41.48 2ddm s ILE 128 CO 0.22 0.32 0.00 0.61 0.00 0.00 0.00 174.94 176.09 2ddm n GLY 129 N 5.00 1.65 0.00 6.18 0.00 -1.26 -4.74 105.19 112.02 2ddm n GLY 129 Ca -0.11 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 43.89 2ddm n GLY 129 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ddm n ASP 130 N 0.00 0.00 0.05 1.61 8.00 -1.26 -5.20 116.55 119.75 2ddm n ASP 130 Ca 0.00 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.57 2ddm n ASP 130 Cb 0.00 0.00 0.33 0.00 -0.02 0.00 0.00 41.12 41.43 2ddm n ASP 130 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2ddm n ILE 131 N 0.00 1.15 0.00 0.53 -5.35 -1.26 -5.23 119.36 109.20 2ddm n ILE 131 Ca 0.00 0.34 0.00 0.00 -0.27 0.00 0.00 62.75 62.82 2ddm n ILE 131 Cb 0.00 -1.21 0.00 0.00 -1.74 0.00 0.00 39.64 36.69 2ddm n ILE 131 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2ddm n LYS 138 N -1.76 0.00 -0.38 6.28 4.01 -1.26 -5.27 118.16 119.77 2ddm n LYS 138 Ca 0.02 0.00 0.35 0.00 -0.51 0.00 0.00 58.31 58.17 2ddm n LYS 138 Cb 0.14 0.00 0.61 0.00 -0.51 0.00 0.00 35.03 35.27 2ddm n LYS 138 CO 0.00 0.00 0.00 -2.30 -1.11 0.00 0.00 177.40 173.99 2ddm n PRO 139 N 0.19 -0.04 -0.11 1.97 -0.02 -1.26 -2.77 135.00 132.96 2ddm n PRO 139 Ca 0.00 1.25 -0.13 0.00 -2.02 0.00 0.00 63.50 62.60 2ddm n PRO 139 Cb 0.00 -2.36 -0.08 0.00 -0.02 0.00 0.00 33.50 31.04 2ddm n PRO 139 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2ddm h ASP 140 N 0.00 -1.68 0.08 2.55 3.58 -2.04 -3.26 116.42 115.65 2ddm h ASP 140 Ca 0.83 0.23 0.01 0.00 0.42 0.00 0.00 57.03 58.51 2ddm h ASP 140 Cb 2.45 0.69 -0.01 0.00 1.72 0.00 0.00 39.33 44.18 2ddm h ASP 140 CO -0.58 -0.41 -0.11 0.25 -2.88 0.00 0.00 179.24 175.52 2ddm h LEU 141 N -0.41 -0.29 -0.69 2.28 5.85 -1.92 -2.91 115.31 117.21 2ddm h LEU 141 Ca 0.09 0.03 0.13 0.00 0.84 0.00 0.00 57.88 58.97 2ddm h LEU 141 Cb 0.61 0.11 -0.09 0.00 0.37 0.00 0.00 40.66 41.66 2ddm h LEU 141 CO -0.55 -0.17 0.24 -0.65 -0.34 0.00 0.00 178.44 176.97 2ddm h PRO 142 N -0.23 0.38 -0.39 5.25 0.11 -1.75 -1.71 132.00 133.66 2ddm h PRO 142 Ca 0.01 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 66.00 2ddm h PRO 142 Cb 0.23 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.24 2ddm h PRO 142 CO -0.05 0.25 -0.18 0.93 -0.21 0.00 0.00 178.00 178.74 2ddm h GLU 143 N 0.39 0.73 -0.63 1.05 5.08 -1.61 -1.61 114.58 117.99 2ddm h GLU 143 Ca 0.37 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 2ddm h GLU 143 Cb 0.55 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 2ddm h GLU 143 CO -0.39 0.87 0.34 0.00 -1.00 0.00 0.00 179.01 178.83 2ddm h ALA 144 N 1.15 0.81 -0.38 3.43 0.00 -1.13 0.60 119.26 123.73 2ddm h ALA 144 Ca 0.10 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2ddm h ALA 144 Cb 0.66 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2ddm h ALA 144 CO 0.05 0.33 0.16 1.88 0.00 0.00 0.00 179.25 181.67 2ddm h TYR 145 N 0.86 0.57 -0.40 0.00 -1.99 -1.13 0.07 116.97 114.94 2ddm h TYR 145 Ca 0.22 -0.04 -0.06 0.00 2.00 0.00 0.00 58.73 60.85 2ddm h TYR 145 Cb 0.05 -0.17 -0.02 0.00 2.00 0.00 0.00 36.73 38.59 2ddm h TYR 145 CO -0.01 0.51 0.03 0.00 -0.00 0.00 0.00 178.16 178.69 2ddm h ARG 146 N 0.47 0.70 -0.03 4.88 3.08 -0.89 0.31 114.38 122.90 2ddm h ARG 146 Ca 0.13 -0.21 -0.13 0.00 0.07 0.00 0.00 59.98 59.84 2ddm h ARG 146 Cb 0.18 -0.07 0.01 0.00 0.08 0.00 0.00 29.97 30.17 2ddm h ARG 146 CO -0.01 0.77 -0.50 0.37 -1.07 0.00 0.00 179.97 179.52 2ddm h GLN 147 N 0.53 0.39 0.00 0.04 4.15 -0.85 -3.40 115.11 115.97 2ddm h GLN 147 Ca 0.12 -0.38 -0.25 0.00 0.77 0.00 0.00 58.65 58.90 2ddm h GLN 147 Cb 0.43 0.10 -0.04 0.00 0.21 0.00 0.00 27.48 28.19 2ddm h GLN 147 CO 0.02 1.05 -1.84 0.66 -1.93 0.00 0.00 178.83 176.78 2ddm n TYR 148 N -4.28 0.00 0.08 3.99 4.02 0.00 -4.72 117.16 116.26 2ddm n TYR 148 Ca -0.10 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.57 2ddm n TYR 148 Cb 0.62 -0.77 -0.15 0.00 -0.02 0.00 0.00 39.34 39.02 2ddm n TYR 148 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 2ddm h LEU 149 N -1.00 0.62 -0.53 7.72 5.85 -1.55 -3.38 115.31 123.04 2ddm h LEU 149 Ca -0.38 -0.86 0.07 0.00 0.84 0.00 0.00 57.88 57.55 2ddm h LEU 149 Cb 1.33 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 42.10 2ddm h LEU 149 CO -0.23 1.72 0.20 0.25 -0.34 0.00 0.00 178.44 180.04 2ddm h LEU 150 N 0.11 0.22 0.00 2.25 5.85 -0.62 -0.72 115.31 122.41 2ddm h LEU 150 Ca -0.31 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.47 2ddm h LEU 150 Cb 2.10 0.03 0.00 0.00 0.37 0.00 0.00 40.66 43.16 2ddm h LEU 150 CO 0.19 0.15 0.00 -2.65 -0.34 0.00 0.00 178.44 175.80 2ddm n PRO 151 N -4.98 0.08 -0.03 5.25 -0.02 -1.26 -2.82 135.00 131.22 2ddm n PRO 151 Ca 0.06 0.26 0.01 0.00 -2.02 0.00 0.00 63.50 61.81 2ddm n PRO 151 Cb 0.21 -1.50 -0.10 0.00 -0.02 0.00 0.00 33.50 32.09 2ddm n PRO 151 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2ddm n LEU 152 N -1.36 0.00 -4.77 2.45 4.77 -0.34 -4.90 117.00 112.85 2ddm n LEU 152 Ca 0.03 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.62 2ddm n LEU 152 Cb 0.08 0.12 -0.01 0.00 -2.33 0.00 0.00 43.42 41.28 2ddm n LEU 152 CO 0.07 0.12 0.95 0.00 -1.33 0.00 0.00 177.39 177.20 2ddm s ALA 153 N -2.65 3.25 -0.11 -1.18 0.00 -0.80 -4.71 121.76 115.57 2ddm s ALA 153 Ca -0.05 1.21 0.15 0.00 0.00 0.00 0.00 51.96 53.27 2ddm s ALA 153 Cb 0.06 -3.48 -0.24 0.00 0.00 0.00 0.00 23.12 19.47 2ddm s ALA 153 CO 0.52 -0.80 0.43 0.94 0.00 0.00 0.00 175.76 176.84 2ddm n GLN 154 N 0.13 0.65 -3.78 0.00 7.27 0.17 -3.24 117.38 118.59 2ddm n GLN 154 Ca 0.04 0.17 -0.13 0.00 0.07 0.00 0.00 57.00 57.15 2ddm n GLN 154 Cb 0.44 -1.68 -0.09 0.00 2.41 0.00 0.00 30.24 31.31 2ddm n GLN 154 CO 0.00 0.00 0.00 0.20 0.07 0.00 0.00 177.06 177.33 2ddm s GLY 155 N -5.26 -0.14 0.05 1.69 0.00 -1.14 0.39 107.32 102.92 2ddm s GLY 155 Ca -0.07 0.39 0.04 0.00 0.00 0.00 0.00 44.72 45.08 2ddm s GLY 155 CO 0.83 0.21 -0.11 -0.26 0.00 0.00 0.00 173.10 173.77 2ddm s ILE 156 N -0.98 0.83 -0.59 0.90 -4.36 -0.97 -1.21 121.20 114.82 2ddm s ILE 156 Ca -0.11 -1.17 0.06 0.00 -0.26 0.00 0.00 60.65 59.18 2ddm s ILE 156 Cb -0.05 -0.84 0.28 0.00 1.25 0.00 0.00 42.46 43.11 2ddm s ILE 156 CO 0.03 -0.28 0.80 0.35 0.24 0.00 0.00 174.94 176.07 2ddm n THR 157 N 1.42 2.27 -2.65 8.37 -2.24 -0.68 -0.38 114.28 120.39 2ddm n THR 157 Ca -0.22 -5.23 -0.28 0.00 -2.27 0.00 0.00 64.05 56.05 2ddm n THR 157 Cb 0.54 -1.78 -0.01 0.00 -2.10 0.00 0.00 70.33 66.99 2ddm n THR 157 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2ddm s PRO 158 N -2.71 3.60 0.70 -0.78 0.04 -1.11 -4.54 135.00 130.19 2ddm s PRO 158 Ca 0.43 0.30 0.02 0.00 0.04 0.00 0.00 61.00 61.78 2ddm s PRO 158 Cb 0.20 -2.36 0.12 0.00 0.04 0.00 0.00 34.50 32.50 2ddm s PRO 158 CO -0.06 -0.18 0.96 0.54 0.04 0.00 0.00 177.00 178.29 2ddm s ASN 159 N -3.87 4.47 0.16 6.66 6.03 -1.26 -2.00 114.94 125.13 2ddm s ASN 159 Ca 0.49 -0.52 -0.18 0.00 -1.03 0.00 0.00 52.86 51.63 2ddm s ASN 159 Cb -0.10 0.13 0.07 0.00 -3.03 0.00 0.00 41.25 38.32 2ddm s ASN 159 CO 0.42 -1.78 1.67 0.40 -2.03 0.00 0.00 177.10 175.78 2ddm h ILE 160 N -0.39 0.62 -0.21 0.54 2.04 -1.90 -0.09 117.51 118.13 2ddm h ILE 160 Ca -0.34 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.55 2ddm h ILE 160 Cb 1.27 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.94 2ddm h ILE 160 CO 0.39 0.00 0.01 0.15 0.00 0.00 0.00 178.15 178.70 2ddm h PHE 161 N -0.01 0.00 -0.27 1.37 3.57 -1.94 -0.92 116.94 118.75 2ddm h PHE 161 Ca 0.18 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.62 2ddm h PHE 161 Cb 0.28 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 2ddm h PHE 161 CO -0.34 -0.02 -0.13 0.93 -2.23 0.00 0.00 178.31 176.52 2ddm h GLU 162 N 0.08 0.45 -0.46 1.11 5.08 -1.76 -0.45 114.58 118.64 2ddm h GLU 162 Ca 0.10 -0.13 -0.08 0.00 -1.00 0.00 0.00 59.36 58.25 2ddm h GLU 162 Cb 0.12 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 2ddm h GLU 162 CO -0.16 0.58 -0.05 1.25 -1.00 0.00 0.00 179.01 179.63 2ddm h LEU 163 N 0.42 0.76 -0.29 1.33 5.85 -0.44 -1.45 115.31 121.48 2ddm h LEU 163 Ca 0.08 -0.20 -0.16 0.00 0.84 0.00 0.00 57.88 58.44 2ddm h LEU 163 Cb 0.48 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 2ddm h LEU 163 CO 0.03 0.85 -0.44 -0.33 -0.34 0.00 0.00 178.44 178.21 2ddm h GLU 164 N 0.72 0.81 0.43 1.25 5.08 -0.48 -2.40 114.58 119.98 2ddm h GLU 164 Ca 0.13 -0.48 -0.02 0.00 -1.00 0.00 0.00 59.36 57.99 2ddm h GLU 164 Cb 0.51 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.81 2ddm h GLU 164 CO 0.03 1.11 -0.20 0.82 -1.00 0.00 0.00 179.01 179.76 2ddm h ILE 165 N 0.57 0.58 -0.58 3.13 1.08 -0.84 1.45 117.51 122.90 2ddm h ILE 165 Ca 0.03 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.53 2ddm h ILE 165 Cb 1.03 0.58 -0.04 0.00 -3.07 0.00 0.00 36.82 35.33 2ddm h ILE 165 CO 0.10 0.00 0.35 -0.07 -0.69 0.00 0.00 178.15 177.84 2ddm h LEU 166 N -0.57 0.55 0.00 1.44 -0.00 -1.31 -3.13 115.31 112.29 2ddm h LEU 166 Ca -0.06 0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.83 2ddm h LEU 166 Cb 0.44 -0.11 0.00 0.00 -0.00 0.00 0.00 40.66 40.99 2ddm h LEU 166 CO 0.10 0.39 -1.18 0.35 -0.00 0.00 0.00 178.44 178.09 2ddm n THR 167 N -4.77 0.43 -1.18 0.22 -2.24 -0.91 -4.96 114.28 100.88 2ddm n THR 167 Ca 0.05 -0.48 -0.06 0.00 -2.27 0.00 0.00 64.05 61.29 2ddm n THR 167 Cb 0.09 -0.19 -0.03 0.00 -2.10 0.00 0.00 70.33 68.11 2ddm n THR 167 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ddm n GLY 168 N 1.23 0.77 3.87 3.38 0.00 0.50 -4.99 105.19 109.94 2ddm n GLY 168 Ca -0.00 -0.25 -0.21 0.00 0.00 0.00 0.00 46.02 45.56 2ddm n GLY 168 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ddm s LYS 169 N -2.09 2.86 -0.10 1.61 1.02 -1.20 -5.03 119.74 116.80 2ddm s LYS 169 Ca 0.00 -1.17 -0.19 0.00 0.02 0.00 0.00 55.97 54.63 2ddm s LYS 169 Cb 0.00 -2.56 -0.04 0.00 -0.52 0.00 0.00 37.83 34.71 2ddm s LYS 169 CO 0.00 0.19 0.50 -0.80 -0.92 0.00 0.00 175.35 174.32 2ddm s ASN 170 N -3.97 6.73 -0.43 2.83 0.01 -1.26 -4.50 114.94 114.34 2ddm s ASN 170 Ca 0.39 0.87 0.10 0.00 -0.71 0.00 0.00 52.86 53.50 2ddm s ASN 170 Cb -0.07 -2.30 0.39 0.00 0.41 0.00 0.00 41.25 39.68 2ddm s ASN 170 CO 0.27 0.01 0.94 0.00 -1.51 0.00 0.00 177.10 176.81 2ddm n ARG 172 N -0.15 2.50 -3.59 0.00 5.12 -1.26 -4.57 116.66 114.72 2ddm n ARG 172 Ca 0.27 -3.22 -0.08 0.00 -1.93 0.00 0.00 57.85 52.89 2ddm n ARG 172 Cb 0.63 -2.21 -0.04 0.00 -1.16 0.00 0.00 32.46 29.67 2ddm n ARG 172 CO 0.00 0.00 0.00 0.16 -1.93 0.00 0.00 177.63 175.86 2ddm s ASP 173 N -1.77 -0.27 0.13 0.55 1.47 -1.26 -5.05 116.67 110.47 2ddm s ASP 173 Ca 0.60 0.23 -0.32 0.00 1.18 0.00 0.00 52.55 54.24 2ddm s ASP 173 Cb 0.49 0.23 -0.09 0.00 -0.34 0.00 0.00 42.92 43.21 2ddm s ASP 173 CO 0.04 -0.29 1.55 0.25 0.68 0.00 0.00 175.17 177.40 2ddm h LEU 174 N 2.32 -1.77 -0.73 2.11 6.46 -1.99 -0.10 115.31 121.61 2ddm h LEU 174 Ca -0.15 0.24 0.11 0.00 -0.12 0.00 0.00 57.88 57.95 2ddm h LEU 174 Cb 1.18 0.73 -0.08 0.00 -0.73 0.00 0.00 40.66 41.76 2ddm h LEU 174 CO 0.28 -0.41 0.34 0.44 -0.62 0.00 0.00 178.44 178.48 2ddm h ASP 175 N -0.40 0.42 -0.23 1.25 3.32 -1.98 0.33 116.42 119.13 2ddm h ASP 175 Ca 0.08 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.17 2ddm h ASP 175 Cb 0.60 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 2ddm h ASP 175 CO -0.58 0.22 0.01 0.28 -1.72 0.00 0.00 179.24 177.45 2ddm h SER 176 N 0.56 0.38 -0.49 6.45 0.02 -1.75 0.20 113.55 118.93 2ddm h SER 176 Ca 0.37 -0.30 0.03 0.00 -0.84 0.00 0.00 61.79 61.05 2ddm h SER 176 Cb 0.45 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.85 2ddm h SER 176 CO -0.31 0.58 0.27 0.00 -1.14 0.00 0.00 176.83 176.24 2ddm h ALA 177 N 0.81 0.62 -0.16 3.77 0.00 -0.53 0.67 119.26 124.45 2ddm h ALA 177 Ca 0.07 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2ddm h ALA 177 Cb 0.38 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2ddm h ALA 177 CO 0.01 -0.05 0.09 0.82 0.00 0.00 0.00 179.25 180.12 2ddm h ILE 178 N 0.54 1.09 -0.40 0.00 2.04 -0.78 -1.43 117.51 118.56 2ddm h ILE 178 Ca 0.20 -0.22 0.08 0.00 1.00 0.00 0.00 64.86 65.92 2ddm h ILE 178 Cb 0.06 0.94 -0.07 0.00 -0.74 0.00 0.00 36.82 37.01 2ddm h ILE 178 CO -0.11 0.08 -0.03 0.00 0.00 0.00 0.00 178.15 178.09 2ddm h ALA 179 N 1.00 0.34 -0.29 1.87 0.00 0.25 0.31 119.26 122.74 2ddm h ALA 179 Ca 0.06 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 2ddm h ALA 179 Cb 0.05 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2ddm h ALA 179 CO -0.01 -0.41 0.16 0.00 0.00 0.00 0.00 179.25 178.99 2ddm h ALA 180 N 1.37 0.37 -0.28 0.00 0.00 -0.70 -1.44 119.26 118.58 2ddm h ALA 180 Ca 0.20 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.07 2ddm h ALA 180 Cb 0.29 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2ddm h ALA 180 CO -0.36 -0.11 0.11 0.00 0.00 0.00 0.00 179.25 178.89 2ddm h ALA 181 N 1.04 0.32 -0.98 0.00 0.00 -0.52 -1.83 119.26 117.30 2ddm h ALA 181 Ca 0.10 0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.15 2ddm h ALA 181 Cb 0.05 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.74 2ddm h ALA 181 CO -0.02 -0.29 0.62 0.87 0.00 0.00 0.00 179.25 180.44 2ddm h LYS 182 N 0.25 0.93 0.00 0.00 1.79 -0.12 -0.93 116.57 118.49 2ddm h LYS 182 Ca 0.12 -0.06 -0.01 0.00 -2.18 0.00 0.00 60.65 58.52 2ddm h LYS 182 Cb 0.07 -0.21 -0.00 0.00 -1.58 0.00 0.00 32.23 30.51 2ddm h LYS 182 CO -0.11 0.61 -0.05 0.66 -1.08 0.00 0.00 179.45 179.49 2ddm h SER 183 N 0.96 0.00 1.37 0.86 4.64 -0.39 -1.59 113.55 119.40 2ddm h SER 183 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 2ddm h SER 183 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 2ddm h SER 183 CO -0.24 0.05 -0.44 -0.07 -0.87 0.00 0.00 176.83 175.26 2ddm h LEU 184 N 0.00 0.00-10.18 5.97 3.38 -1.01 -3.47 115.31 110.00 2ddm h LEU 184 Ca -0.00 -0.05 -0.54 0.00 0.09 0.00 0.00 57.88 57.38 2ddm h LEU 184 Cb 0.16 0.00 0.17 0.00 0.09 0.00 0.00 40.66 41.08 2ddm h LEU 184 CO 0.01 0.02 0.39 -0.76 0.09 0.00 0.00 178.44 178.19 2ddm s LEU 185 N -5.27 3.29 0.00 1.67 1.43 -0.60 -4.74 118.68 114.46 2ddm s LEU 185 Ca 0.05 2.41 0.00 0.00 -1.03 0.00 0.00 54.13 55.56 2ddm s LEU 185 Cb 0.09 -4.59 0.00 0.00 0.03 0.00 0.00 46.19 41.72 2ddm s LEU 185 CO 0.71 -2.39 0.00 -1.54 0.23 0.00 0.00 176.35 173.36 2ddm n SER 186 N -2.82 0.00 0.22 2.29 3.41 -0.70 -4.90 113.62 111.13 2ddm n SER 186 Ca 0.14 -0.87 0.15 0.00 -0.26 0.00 0.00 58.87 58.03 2ddm n SER 186 Cb 0.50 0.00 0.54 0.00 -0.26 0.00 0.00 64.21 64.99 2ddm n SER 186 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2ddm h ASP 187 N 0.00 0.00 0.00 4.04 3.32 -2.00 -3.27 116.42 118.51 2ddm h ASP 187 Ca 0.00 0.00 -0.42 0.00 0.02 0.00 0.00 57.03 56.63 2ddm h ASP 187 Cb 0.00 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.49 2ddm h ASP 187 CO 0.00 0.00 -2.33 0.41 -1.72 0.00 0.00 179.24 175.60 2ddm n THR 188 N -2.81 1.53 -2.60 0.35 -1.04 -1.26 -4.83 114.28 103.62 2ddm n THR 188 Ca 0.02 -0.36 -0.42 0.00 -2.04 0.00 0.00 64.05 61.25 2ddm n THR 188 Cb 0.33 -1.84 -0.03 0.00 -1.82 0.00 0.00 70.33 66.97 2ddm n THR 188 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 2ddm s LEU 189 N -7.43 3.42 0.02 -4.42 1.98 -1.20 -4.08 118.68 106.97 2ddm s LEU 189 Ca -0.36 -0.26 0.14 0.00 -2.89 0.00 0.00 54.13 50.75 2ddm s LEU 189 Cb 0.13 -2.80 -0.19 0.00 0.66 0.00 0.00 46.19 43.99 2ddm s LEU 189 CO 0.53 -1.63 0.79 0.11 -1.89 0.00 0.00 176.35 174.26 2ddm h LYS 190 N 9.76 0.00 -3.00 1.98 1.79 -0.27 -1.85 116.57 124.98 2ddm h LYS 190 Ca -0.27 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.12 2ddm h LYS 190 Cb 1.06 0.00 -0.17 0.00 -1.58 0.00 0.00 32.23 31.53 2ddm h LYS 190 CO 1.22 0.46 -0.13 1.67 -1.08 0.00 0.00 179.45 181.59 2ddm s TRP 191 N -2.73 -0.26 -0.10 -1.35 1.48 -0.83 -4.19 118.94 110.96 2ddm s TRP 191 Ca -0.03 0.26 0.00 0.00 -1.06 0.00 0.00 56.10 55.27 2ddm s TRP 191 Cb 0.08 0.19 0.02 0.00 -1.16 0.00 0.00 33.47 32.61 2ddm s TRP 191 CO 0.82 -0.53 -0.08 0.08 -4.06 0.00 0.00 176.95 173.17 2ddm s VAL 192 N -2.19 1.01 -0.38 -0.66 1.01 0.07 -2.30 120.40 116.95 2ddm s VAL 192 Ca -0.07 -0.32 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 2ddm s VAL 192 Cb -0.02 -1.00 0.08 0.00 0.00 0.00 0.00 36.38 35.44 2ddm s VAL 192 CO -0.00 0.35 0.17 -0.69 0.00 0.00 0.00 175.10 174.93 2ddm s VAL 193 N 1.39 3.60 -0.17 2.92 1.01 0.49 -0.66 120.40 128.99 2ddm s VAL 193 Ca -0.01 -1.59 -0.08 0.00 0.00 0.00 0.00 61.98 60.30 2ddm s VAL 193 Cb -0.13 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 2ddm s VAL 193 CO -0.05 -0.45 0.09 0.54 0.00 0.00 0.00 175.10 175.23 2ddm s VAL 194 N 1.29 5.07 0.10 2.92 0.11 -0.52 -2.77 120.40 126.60 2ddm s VAL 194 Ca 0.03 0.06 0.07 0.00 -2.93 0.00 0.00 61.98 59.21 2ddm s VAL 194 Cb -0.22 -3.27 -0.03 0.00 -1.53 0.00 0.00 36.38 31.33 2ddm s VAL 194 CO -0.01 0.49 -0.18 0.42 -3.33 0.00 0.00 175.10 172.50 2ddm s THR 195 N 0.04 1.51 -0.10 5.04 -4.23 -0.85 -0.37 115.64 116.69 2ddm s THR 195 Ca 0.07 -1.54 -0.04 0.00 -1.18 0.00 0.00 61.69 59.00 2ddm s THR 195 Cb -0.12 -1.46 0.05 0.00 1.34 0.00 0.00 72.50 72.32 2ddm s THR 195 CO 0.00 -0.18 0.19 -0.94 -0.54 0.00 0.00 174.62 173.15 2ddm s SER 196 N -2.02 0.47 -0.37 3.99 1.04 0.53 -2.67 113.70 114.67 2ddm s SER 196 Ca 0.05 0.41 -0.22 0.00 0.48 0.00 0.00 55.95 56.67 2ddm s SER 196 Cb -0.09 0.39 0.01 0.00 0.10 0.00 0.00 66.02 66.43 2ddm s SER 196 CO 0.04 -0.23 0.74 0.00 0.98 0.00 0.00 173.24 174.77 2ddm s ALA 197 N 2.11 3.43 -0.45 5.32 0.00 -1.26 -0.95 121.76 129.96 2ddm s ALA 197 Ca 0.00 -0.73 -0.17 0.00 0.00 0.00 0.00 51.96 51.07 2ddm s ALA 197 Cb -0.12 -3.31 0.05 0.00 0.00 0.00 0.00 23.12 19.73 2ddm s ALA 197 CO -0.07 -1.46 0.43 -1.12 0.00 0.00 0.00 175.76 173.54 2ddm s SER 198 N 1.84 6.17 0.49 0.00 0.01 0.13 -4.88 113.70 117.47 2ddm s SER 198 Ca 0.29 -0.99 -0.15 0.00 1.31 0.00 0.00 55.95 56.42 2ddm s SER 198 Cb -0.13 -2.21 -0.07 0.00 0.21 0.00 0.00 66.02 63.81 2ddm s SER 198 CO 0.16 -0.64 0.94 -0.83 0.41 0.00 0.00 173.24 173.28 2ddm s GLY 199 N 2.22 2.01 0.00 3.44 0.00 -1.26 0.15 107.32 113.88 2ddm s GLY 199 Ca 0.08 0.07 0.00 0.00 0.00 0.00 0.00 44.72 44.88 2ddm s GLY 199 CO 0.10 0.33 0.00 -2.21 0.00 0.00 0.00 173.10 171.32 2ddm n GLU 202 N -1.58 0.00 -3.73 2.90 4.07 -1.26 -4.88 120.64 116.16 2ddm n GLU 202 Ca 0.05 0.00 -0.30 0.00 -0.06 0.00 0.00 57.16 56.86 2ddm n GLU 202 Cb 0.54 0.00 -0.14 0.00 -0.06 0.00 0.00 31.44 31.78 2ddm n GLU 202 CO 0.00 0.00 0.00 -0.80 -0.06 0.00 0.00 177.13 176.27 2ddm s ASN 203 N 0.00 3.87 0.31 4.31 0.02 -1.26 -3.39 114.94 118.80 2ddm s ASN 203 Ca 0.00 -2.14 -0.29 0.00 -1.02 0.00 0.00 52.86 49.41 2ddm s ASN 203 Cb 0.00 -0.98 -0.11 0.00 0.02 0.00 0.00 41.25 40.19 2ddm s ASN 203 CO 0.00 -0.34 1.46 -1.10 0.02 0.00 0.00 177.10 177.14 2ddm s GLN 204 N 0.98 4.21 -0.17 -0.60 -0.21 0.15 -4.70 119.66 119.31 2ddm s GLN 204 Ca 0.14 2.42 -0.09 0.00 0.02 0.00 0.00 55.36 57.84 2ddm s GLN 204 Cb -0.21 -3.04 -0.05 0.00 1.00 0.00 0.00 33.01 30.71 2ddm s GLN 204 CO -0.11 -0.45 0.14 -2.00 -2.12 0.00 0.00 175.29 170.75 2ddm s GLU 205 N -1.15 3.97 -0.57 2.91 2.12 0.12 0.49 118.70 126.59 2ddm s GLU 205 Ca 0.56 -0.17 -0.18 0.00 0.36 0.00 0.00 54.97 55.54 2ddm s GLU 205 Cb -0.44 -3.35 0.11 0.00 0.26 0.00 0.00 34.13 30.71 2ddm s GLU 205 CO 0.52 0.44 0.62 -1.64 -0.54 0.00 0.00 175.26 174.66 2ddm s MET 206 N -0.06 3.02 -0.12 4.30 -1.94 0.13 0.22 119.30 124.86 2ddm s MET 206 Ca 0.11 -1.46 -0.20 0.00 -1.71 0.00 0.00 55.69 52.43 2ddm s MET 206 Cb -0.11 -4.28 -0.04 0.00 2.01 0.00 0.00 34.83 32.41 2ddm s MET 206 CO 0.00 -1.45 0.54 -0.65 -0.01 0.00 0.00 175.02 173.45 2ddm s GLN 207 N 2.27 4.33 -0.03 2.03 -0.21 -0.12 -1.77 119.66 126.16 2ddm s GLN 207 Ca 0.08 0.55 0.03 0.00 0.02 0.00 0.00 55.36 56.05 2ddm s GLN 207 Cb -0.26 -3.47 -0.00 0.00 1.00 0.00 0.00 33.01 30.28 2ddm s GLN 207 CO 0.05 0.06 -0.12 0.08 -2.12 0.00 0.00 175.29 173.24 2ddm s VAL 208 N 0.90 1.03 -0.17 1.09 1.01 0.62 -0.35 120.40 124.53 2ddm s VAL 208 Ca 0.28 -0.50 -0.00 0.00 0.00 0.00 0.00 61.98 61.76 2ddm s VAL 208 Cb -0.16 -0.89 0.04 0.00 0.00 0.00 0.00 36.38 35.37 2ddm s VAL 208 CO 0.12 0.31 -0.07 -0.69 0.00 0.00 0.00 175.10 174.76 2ddm s VAL 209 N 0.07 1.30 -0.29 2.92 1.01 0.51 -0.41 120.40 125.50 2ddm s VAL 209 Ca -0.02 -0.73 -0.15 0.00 0.00 0.00 0.00 61.98 61.09 2ddm s VAL 209 Cb -0.09 -1.42 -0.03 0.00 0.00 0.00 0.00 36.38 34.85 2ddm s VAL 209 CO 0.01 0.17 0.35 -0.69 0.00 0.00 0.00 175.10 174.95 2ddm s VAL 210 N 1.56 5.18 -0.11 2.92 1.01 0.15 -1.44 120.40 129.67 2ddm s VAL 210 Ca 0.01 0.36 0.03 0.00 0.00 0.00 0.00 61.98 62.38 2ddm s VAL 210 Cb -0.15 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.50 2ddm s VAL 210 CO -0.08 0.08 -0.23 -0.69 0.00 0.00 0.00 175.10 174.19 2ddm s VAL 211 N 2.03 2.16 0.37 2.92 1.01 0.17 -1.16 120.40 127.90 2ddm s VAL 211 Ca 0.13 -0.98 0.04 0.00 0.00 0.00 0.00 61.98 61.17 2ddm s VAL 211 Cb -0.16 -1.84 -0.01 0.00 0.00 0.00 0.00 36.38 34.37 2ddm s VAL 211 CO 0.11 0.55 0.13 0.35 0.00 0.00 0.00 175.10 176.24 2ddm n THR 212 N 3.63 0.00 -0.01 3.92 -2.24 -0.45 -0.75 114.28 118.38 2ddm n THR 212 Ca -0.19 -2.17 -0.06 0.00 -2.27 0.00 0.00 64.05 59.36 2ddm n THR 212 Cb 0.53 0.78 0.14 0.00 -2.10 0.00 0.00 70.33 69.67 2ddm n THR 212 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ddm h ALA 213 N 1.62 0.95 -0.01 6.98 0.00 -1.94 -3.30 119.26 123.56 2ddm h ALA 213 Ca -0.29 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.23 2ddm h ALA 213 Cb 1.11 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2ddm h ALA 213 CO 0.46 0.61 -0.45 -0.25 0.00 0.00 0.00 179.25 179.62 2ddm n ASP 214 N -4.08 1.38 -3.80 0.00 8.00 -1.26 -5.04 116.55 111.75 2ddm n ASP 214 Ca -0.01 -1.19 -0.09 0.00 0.71 0.00 0.00 54.79 54.21 2ddm n ASP 214 Cb 0.46 0.62 -0.06 0.00 -0.02 0.00 0.00 41.12 42.12 2ddm n ASP 214 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2ddm s SER 215 N -2.06 -0.04 -0.09 -2.24 1.04 -1.24 -5.13 113.70 103.93 2ddm s SER 215 Ca 0.11 -0.59 -0.02 0.00 0.48 0.00 0.00 55.95 55.94 2ddm s SER 215 Cb 0.13 0.42 0.03 0.00 0.10 0.00 0.00 66.02 66.71 2ddm s SER 215 CO 0.47 -0.84 0.02 -0.69 0.98 0.00 0.00 173.24 173.18 2ddm s VAL 216 N -3.87 0.33 0.09 5.02 1.01 -1.26 -1.34 120.40 120.38 2ddm s VAL 216 Ca 0.08 0.03 0.08 0.00 0.00 0.00 0.00 61.98 62.17 2ddm s VAL 216 Cb 0.03 -0.58 -0.03 0.00 0.00 0.00 0.00 36.38 35.80 2ddm s VAL 216 CO -0.08 0.16 -0.22 0.20 0.00 0.00 0.00 175.10 175.16 2ddm s ASN 217 N 1.98 2.67 0.01 3.32 0.01 -0.31 -4.99 114.94 117.63 2ddm s ASN 217 Ca 0.04 -0.65 0.06 0.00 -0.71 0.00 0.00 52.86 51.60 2ddm s ASN 217 Cb -0.13 -0.18 -0.02 0.00 0.41 0.00 0.00 41.25 41.34 2ddm s ASN 217 CO -0.06 0.11 -0.18 0.68 -1.51 0.00 0.00 177.10 176.15 2ddm s VAL 218 N -1.03 1.41 0.04 1.60 -7.23 -1.26 0.32 120.40 114.25 2ddm s VAL 218 Ca 0.08 -0.90 0.06 0.00 -1.81 0.00 0.00 61.98 59.41 2ddm s VAL 218 Cb -0.10 -1.20 -0.02 0.00 0.56 0.00 0.00 36.38 35.62 2ddm s VAL 218 CO 0.04 0.28 -0.17 -0.63 -0.31 0.00 0.00 175.10 174.31 2ddm s ILE 219 N -0.57 1.34 -0.14 -0.62 1.01 0.46 -5.00 121.20 117.67 2ddm s ILE 219 Ca 0.06 -1.06 -0.04 0.00 0.00 0.00 0.00 60.65 59.61 2ddm s ILE 219 Cb -0.07 -1.18 0.05 0.00 0.01 0.00 0.00 42.46 41.26 2ddm s ILE 219 CO 0.00 0.10 0.07 -0.55 0.00 0.00 0.00 174.94 174.56 2ddm s SER 220 N -1.12 2.09 0.11 3.58 0.15 -1.26 -0.27 113.70 116.97 2ddm s SER 220 Ca 0.04 -0.45 0.08 0.00 0.70 0.00 0.00 55.95 56.32 2ddm s SER 220 Cb -0.08 -0.26 -0.04 0.00 -1.71 0.00 0.00 66.02 63.93 2ddm s SER 220 CO 0.01 -0.32 -0.13 -1.00 1.20 0.00 0.00 173.24 173.01 2ddm s HIS 221 N 2.11 2.68 -0.13 3.44 3.76 -0.73 -4.96 115.29 121.45 2ddm s HIS 221 Ca 0.03 -0.19 -0.08 0.00 -0.15 0.00 0.00 55.06 54.67 2ddm s HIS 221 Cb -0.15 -1.41 -0.04 0.00 1.11 0.00 0.00 32.58 32.09 2ddm s HIS 221 CO -0.07 0.41 0.15 0.45 -0.85 0.00 0.00 174.74 174.83 2ddm s SER 222 N -2.17 6.37 0.00 1.40 0.15 -1.26 0.20 113.70 118.40 2ddm s SER 222 Ca 0.20 0.44 0.01 0.00 0.70 0.00 0.00 55.95 57.31 2ddm s SER 222 Cb -0.11 -2.08 -0.01 0.00 -1.71 0.00 0.00 66.02 62.11 2ddm s SER 222 CO 0.12 0.35 -0.05 -0.60 1.20 0.00 0.00 173.24 174.27 2ddm s ARG 223 N -0.72 0.37 0.23 5.44 3.52 0.18 -4.91 118.95 123.05 2ddm s ARG 223 Ca 0.14 -0.25 -0.30 0.00 -0.13 0.00 0.00 55.73 55.19 2ddm s ARG 223 Cb -0.12 -0.31 -0.09 0.00 -1.56 0.00 0.00 34.95 32.88 2ddm s ARG 223 CO 0.03 0.08 1.00 0.08 -0.81 0.00 0.00 175.30 175.68 2ddm s VAL 224 N -0.33 3.95 0.30 7.11 1.01 -1.26 0.30 120.40 131.48 2ddm s VAL 224 Ca -0.01 1.88 -0.30 0.00 0.00 0.00 0.00 61.98 63.56 2ddm s VAL 224 Cb -0.03 -4.20 -0.11 0.00 0.00 0.00 0.00 36.38 32.04 2ddm s VAL 224 CO -0.00 0.42 1.53 -0.75 0.00 0.00 0.00 175.10 176.29 2ddm s LYS 225 N -1.01 4.16 0.11 2.72 2.20 -1.22 -4.77 119.74 121.93 2ddm s LYS 225 Ca 0.44 2.50 -0.11 0.00 -0.36 0.00 0.00 55.97 58.44 2ddm s LYS 225 Cb -0.28 -3.03 0.01 0.00 -1.51 0.00 0.00 37.83 33.02 2ddm s LYS 225 CO 0.34 -0.55 0.26 0.99 -0.36 0.00 0.00 175.35 176.04 2ddm s THR 226 N -0.29 0.11 -1.66 3.43 2.01 -1.26 -5.03 115.64 112.96 2ddm s THR 226 Ca 0.60 -1.05 0.23 0.00 0.31 0.00 0.00 61.69 61.78 2ddm s THR 226 Cb -0.46 -1.37 -0.02 0.00 0.01 0.00 0.00 72.50 70.67 2ddm s THR 226 CO 0.50 -0.51 1.15 0.47 -0.69 0.00 0.00 174.62 175.54 2ddm n ASP 227 N -0.13 1.49 -4.61 3.53 10.43 -1.26 -4.97 116.55 121.03 2ddm n ASP 227 Ca -0.14 -1.19 -0.47 0.00 2.57 0.00 0.00 54.79 55.56 2ddm n ASP 227 Cb 0.63 0.53 -0.04 0.00 1.84 0.00 0.00 41.12 44.09 2ddm n ASP 227 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 2ddm n LEU 228 N -0.61 2.13 -4.87 0.64 4.77 -1.26 -4.98 117.00 112.82 2ddm n LEU 228 Ca 0.08 1.14 -0.21 0.00 -0.03 0.00 0.00 56.01 56.99 2ddm n LEU 228 Cb 0.40 -1.30 -0.03 0.00 -2.33 0.00 0.00 43.42 40.17 2ddm n LEU 228 CO 0.32 -0.99 -0.04 -0.54 -1.33 0.00 0.00 177.39 174.81 2ddm s LYS 229 N -0.38 2.66 0.00 3.23 -0.14 -1.26 -4.66 119.74 119.19 2ddm s LYS 229 Ca 0.71 -1.38 0.00 0.00 -1.36 0.00 0.00 55.97 53.94 2ddm s LYS 229 Cb -0.77 -2.46 0.00 0.00 -1.68 0.00 0.00 37.83 32.92 2ddm s LYS 229 CO 0.51 -0.03 0.00 0.41 -0.76 0.00 0.00 175.35 175.48 2ddm n GLY 230 N -1.46 1.87 0.30 -3.33 0.00 -1.26 -4.68 105.19 96.62 2ddm n GLY 230 Ca 0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.07 2ddm n GLY 230 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2ddm h THR 231 N 0.00 1.10 -0.39 2.61 1.35 -1.86 -0.10 112.91 115.62 2ddm h THR 231 Ca 0.00 -0.25 -0.11 0.00 -0.55 0.00 0.00 66.41 65.50 2ddm h THR 231 Cb 0.00 0.65 -0.01 0.00 -1.73 0.00 0.00 68.15 67.06 2ddm h THR 231 CO 0.00 0.11 -0.18 1.23 -0.25 0.00 0.00 175.52 176.43 2ddm h GLY 232 N 0.52 0.88 1.45 5.82 0.00 -1.96 0.20 103.07 109.97 2ddm h GLY 232 Ca 0.12 -0.79 -0.07 0.00 0.00 0.00 0.00 47.33 46.59 2ddm h GLY 232 CO -0.02 0.72 -0.04 -0.55 0.00 0.00 0.00 176.54 176.65 2ddm h ASP 233 N 0.62 0.65 -0.37 0.19 3.32 -1.74 -1.20 116.42 117.89 2ddm h ASP 233 Ca 0.09 -0.16 -0.08 0.00 0.02 0.00 0.00 57.03 56.90 2ddm h ASP 233 Cb 0.74 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 2ddm h ASP 233 CO 0.06 0.75 -0.08 0.25 -1.72 0.00 0.00 179.24 178.49 2ddm h LEU 234 N 0.63 0.71 -0.29 1.55 6.46 -0.74 -1.21 115.31 122.41 2ddm h LEU 234 Ca 0.12 -0.36 0.05 0.00 -0.12 0.00 0.00 57.88 57.57 2ddm h LEU 234 Cb 0.46 -0.19 -0.04 0.00 -0.73 0.00 0.00 40.66 40.15 2ddm h LEU 234 CO 0.02 0.90 0.03 0.15 -0.62 0.00 0.00 178.44 178.93 2ddm h PHE 235 N 0.51 0.04 -0.70 1.25 3.57 -0.14 -0.62 116.94 120.86 2ddm h PHE 235 Ca 0.09 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.59 2ddm h PHE 235 Cb 0.59 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.32 2ddm h PHE 235 CO 0.05 -0.01 0.35 0.00 -2.23 0.00 0.00 178.31 176.47 2ddm h ALA 237 N 1.17 0.27 0.00 0.00 0.00 -0.51 -0.28 119.26 119.92 2ddm h ALA 237 Ca 0.24 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.10 2ddm h ALA 237 Cb 0.09 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2ddm h ALA 237 CO -0.03 -0.33 -0.39 1.96 0.00 0.00 0.00 179.25 180.46 2ddm h GLN 238 N 0.19 0.00 0.23 0.00 1.08 -0.81 -1.61 115.11 114.19 2ddm h GLN 238 Ca 0.11 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.30 2ddm h GLN 238 Cb 0.08 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.51 2ddm h GLN 238 CO -0.12 0.39 -0.11 1.25 -0.95 0.00 0.00 178.83 179.29 2ddm h LEU 239 N 0.00 -0.26 -1.31 1.46 5.85 0.11 0.21 115.31 121.37 2ddm h LEU 239 Ca -0.00 -0.27 -0.02 0.00 0.84 0.00 0.00 57.88 58.44 2ddm h LEU 239 Cb 0.76 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 2ddm h LEU 239 CO 0.05 0.19 0.27 -0.29 -0.34 0.00 0.00 178.44 178.32 2ddm h ILE 240 N -0.79 1.17 -0.31 4.05 6.09 -1.07 -0.21 117.51 126.44 2ddm h ILE 240 Ca -0.03 -0.47 -0.03 0.00 -1.37 0.00 0.00 64.86 62.96 2ddm h ILE 240 Cb 0.51 0.48 -0.01 0.00 0.47 0.00 0.00 36.82 38.26 2ddm h ILE 240 CO 0.05 0.20 0.09 0.28 -3.07 0.00 0.00 178.15 175.70 2ddm h SER 241 N 0.75 0.46 -0.39 2.19 0.02 -1.27 -0.65 113.55 114.65 2ddm h SER 241 Ca 0.19 -0.22 0.01 0.00 -0.84 0.00 0.00 61.79 60.93 2ddm h SER 241 Cb 0.06 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.46 2ddm h SER 241 CO -0.03 0.56 0.25 1.23 -1.14 0.00 0.00 176.83 177.70 2ddm h GLY 242 N 0.34 0.55 0.99 -3.77 0.00 -0.10 -1.92 103.07 99.15 2ddm h GLY 242 Ca 0.10 -0.20 -0.02 0.00 0.00 0.00 0.00 47.33 47.21 2ddm h GLY 242 CO -0.00 0.19 0.29 1.41 0.00 0.00 0.00 176.54 178.43 2ddm h LEU 243 N 0.51 0.80 -0.62 3.11 3.38 -0.90 -1.77 115.31 119.82 2ddm h LEU 243 Ca 0.15 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2ddm h LEU 243 Cb -0.05 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.50 2ddm h LEU 243 CO -0.04 0.71 0.00 0.18 0.09 0.00 0.00 178.44 179.38 2ddm n LEU 244 N -4.51 0.66 -1.65 1.67 4.77 -0.27 -2.46 117.00 115.21 2ddm n LEU 244 Ca 0.04 0.65 -0.04 0.00 -0.03 0.00 0.00 56.01 56.63 2ddm n LEU 244 Cb 0.13 -0.55 0.27 0.00 -2.33 0.00 0.00 43.42 40.94 2ddm n LEU 244 CO 0.38 -0.52 0.93 0.29 -1.33 0.00 0.00 177.39 177.15 2ddm n LYS 245 N -2.22 3.12 0.00 3.23 5.02 -0.74 -4.95 118.16 121.62 2ddm n LYS 245 Ca 0.02 -3.06 0.00 0.00 -2.02 0.00 0.00 58.31 53.26 2ddm n LYS 245 Cb 0.25 -2.07 0.00 0.00 -0.02 0.00 0.00 35.03 33.18 2ddm n LYS 245 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ddm n GLY 246 N -0.48 3.28 3.73 0.72 0.00 -1.03 -5.03 105.19 106.37 2ddm n GLY 246 Ca 0.37 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.97 2ddm n GLY 246 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ddm n LYS 247 N -2.00 2.40 -2.10 1.61 4.76 -0.72 -4.96 118.16 117.15 2ddm n LYS 247 Ca 0.00 0.84 -0.33 0.00 -2.87 0.00 0.00 58.31 55.95 2ddm n LYS 247 Cb 0.00 -2.51 0.01 0.00 -1.84 0.00 0.00 35.03 30.69 2ddm n LYS 247 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ddm s ALA 248 N -0.86 2.71 0.11 7.82 0.00 -1.26 -4.37 121.76 125.91 2ddm s ALA 248 Ca 0.57 0.49 -0.22 0.00 0.00 0.00 0.00 51.96 52.80 2ddm s ALA 248 Cb -0.53 -3.26 -0.05 0.00 0.00 0.00 0.00 23.12 19.27 2ddm s ALA 248 CO 0.60 -0.80 1.39 1.25 0.00 0.00 0.00 175.76 178.19 2ddm h LEU 249 N 0.62 -1.55 -1.08 0.00 6.46 -1.98 0.46 115.31 118.24 2ddm h LEU 249 Ca -0.48 0.23 0.00 0.00 -0.12 0.00 0.00 57.88 57.52 2ddm h LEU 249 Cb 1.23 0.68 -0.04 0.00 -0.73 0.00 0.00 40.66 41.80 2ddm h LEU 249 CO 0.57 -0.18 0.56 0.74 -0.62 0.00 0.00 178.44 179.51 2ddm h THR 250 N -0.02 1.24 -0.34 1.05 2.02 -1.99 0.14 112.91 115.00 2ddm h THR 250 Ca 0.11 -0.47 -0.05 0.00 0.77 0.00 0.00 66.41 66.77 2ddm h THR 250 Cb 0.31 -0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.66 2ddm h THR 250 CO -0.66 0.24 0.02 -0.78 0.37 0.00 0.00 175.52 174.71 2ddm h ASP 251 N 1.21 0.56 -0.43 4.18 3.58 -1.63 -0.18 116.42 123.72 2ddm h ASP 251 Ca 0.32 -0.29 -0.04 0.00 0.42 0.00 0.00 57.03 57.44 2ddm h ASP 251 Cb -0.10 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 40.78 2ddm h ASP 251 CO -0.06 0.71 0.15 0.00 -2.88 0.00 0.00 179.24 177.16 2ddm h ALA 252 N 0.87 1.35 -0.02 -0.78 0.00 0.43 0.32 119.26 121.43 2ddm h ALA 252 Ca 0.10 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2ddm h ALA 252 Cb 0.41 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2ddm h ALA 252 CO 0.01 0.47 -0.01 0.28 0.00 0.00 0.00 179.25 180.00 2ddm h VAL 253 N 0.70 1.32 0.05 0.00 2.07 -0.48 -0.73 116.25 119.19 2ddm h VAL 253 Ca 0.16 -0.98 0.02 0.00 0.82 0.00 0.00 66.70 66.72 2ddm h VAL 253 Cb 0.21 1.94 -0.03 0.00 -1.52 0.00 0.00 31.29 31.89 2ddm h VAL 253 CO -0.01 0.26 -0.18 -0.74 0.02 0.00 0.00 177.57 176.93 2ddm h HIS 254 N -0.35 -0.46 -0.74 1.57 6.17 -0.74 -1.25 115.15 119.35 2ddm h HIS 254 Ca 0.01 0.01 -0.01 0.00 0.71 0.00 0.00 60.37 61.08 2ddm h HIS 254 Cb 0.43 0.20 -0.03 0.00 2.52 0.00 0.00 27.41 30.52 2ddm h HIS 254 CO 0.07 -0.26 0.41 0.00 0.71 0.00 0.00 177.93 178.86 2ddm h ARG 255 N -0.32 1.02 -0.92 5.26 3.08 -0.97 -1.52 114.38 120.02 2ddm h ARG 255 Ca 0.04 -0.11 0.05 0.00 0.07 0.00 0.00 59.98 60.02 2ddm h ARG 255 Cb 0.36 -0.20 -0.06 0.00 0.08 0.00 0.00 29.97 30.15 2ddm h ARG 255 CO -0.13 0.75 0.59 0.00 -1.07 0.00 0.00 179.97 180.11 2ddm h ALA 256 N 1.21 1.24 -0.52 0.04 0.00 -0.79 0.10 119.26 120.54 2ddm h ALA 256 Ca 0.26 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 2ddm h ALA 256 Cb 0.02 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2ddm h ALA 256 CO -0.04 0.41 0.00 0.78 0.00 0.00 0.00 179.25 180.40 2ddm h GLY 257 N 1.11 0.98 1.01 0.00 0.00 -0.69 -1.89 103.07 103.59 2ddm h GLY 257 Ca 0.38 -0.72 -0.07 0.00 0.00 0.00 0.00 47.33 46.91 2ddm h GLY 257 CO -0.14 0.67 0.04 1.41 0.00 0.00 0.00 176.54 178.51 2ddm h LEU 258 N 0.78 0.86 -0.96 3.11 3.38 -0.56 -1.65 115.31 120.27 2ddm h LEU 258 Ca 0.15 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 2ddm h LEU 258 Cb 0.52 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 2ddm h LEU 258 CO 0.03 0.93 0.49 -0.09 0.09 0.00 0.00 178.44 179.88 2ddm h ARG 259 N 0.75 1.21 -0.08 1.13 9.65 -0.73 0.14 114.38 126.45 2ddm h ARG 259 Ca 0.15 -0.13 -0.00 0.00 -1.10 0.00 0.00 59.98 58.89 2ddm h ARG 259 Cb 0.47 -0.24 -0.00 0.00 -1.39 0.00 0.00 29.97 28.80 2ddm h ARG 259 CO 0.02 0.88 0.04 0.28 2.80 0.00 0.00 179.97 183.98 2ddm h VAL 260 N 1.22 1.13 -0.89 0.20 2.07 -1.11 -0.30 116.25 118.57 2ddm h VAL 260 Ca 0.31 -0.38 0.06 0.00 0.82 0.00 0.00 66.70 67.51 2ddm h VAL 260 Cb 0.01 1.23 -0.06 0.00 -1.52 0.00 0.00 31.29 30.96 2ddm h VAL 260 CO -0.05 0.11 0.56 -0.07 0.02 0.00 0.00 177.57 178.14 2ddm h LEU 261 N -0.01 0.88 -0.68 2.57 3.38 -0.73 -0.03 115.31 120.69 2ddm h LEU 261 Ca 0.03 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2ddm h LEU 261 Cb 0.15 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2ddm h LEU 261 CO -0.00 0.57 0.38 -0.08 0.09 0.00 0.00 178.44 179.40 2ddm h GLU 262 N 1.02 0.94 -0.39 1.13 4.81 -0.31 -0.99 114.58 120.80 2ddm h GLU 262 Ca 0.38 -0.10 -0.12 0.00 -0.13 0.00 0.00 59.36 59.39 2ddm h GLU 262 Cb 0.15 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 2ddm h GLU 262 CO -0.17 0.69 -0.24 0.28 -0.73 0.00 0.00 179.01 178.85 2ddm h VAL 263 N 0.93 1.27 -0.26 0.32 2.07 -0.08 -1.96 116.25 118.54 2ddm h VAL 263 Ca 0.24 -1.36 -0.03 0.00 0.82 0.00 0.00 66.70 66.37 2ddm h VAL 263 Cb 0.02 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 2ddm h VAL 263 CO -0.04 0.45 0.05 0.24 0.02 0.00 0.00 177.57 178.29 2ddm h MET 264 N 0.69 0.42 -0.23 1.57 2.86 -0.70 -0.13 114.93 119.41 2ddm h MET 264 Ca 0.09 -0.11 0.01 0.00 -2.06 0.00 0.00 59.70 57.63 2ddm h MET 264 Cb 0.76 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.35 2ddm h MET 264 CO 0.06 0.54 0.13 0.00 1.06 0.00 0.00 176.91 178.70 2ddm h ARG 265 N 0.23 0.27 -0.64 1.72 3.08 -1.11 -0.28 114.38 117.65 2ddm h ARG 265 Ca 0.08 -0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.17 2ddm h ARG 265 Cb 0.32 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.26 2ddm h ARG 265 CO 0.00 0.18 0.35 -0.92 -1.07 0.00 0.00 179.97 178.51 2ddm h TYR 266 N 0.28 0.64 -0.50 3.04 3.20 -1.24 0.59 116.97 122.97 2ddm h TYR 266 Ca 0.09 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.00 2ddm h TYR 266 Cb -0.00 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.05 2ddm h TYR 266 CO -0.08 0.30 0.32 1.15 -1.64 0.00 0.00 178.16 178.20 2ddm h THR 267 N 0.64 1.09 -0.36 1.81 2.02 -0.43 -1.89 112.91 115.79 2ddm h THR 267 Ca 0.29 -0.22 -0.15 0.00 0.77 0.00 0.00 66.41 67.10 2ddm h THR 267 Cb 0.20 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 2ddm h THR 267 CO -0.19 0.12 -0.36 1.56 0.37 0.00 0.00 175.52 177.01 2ddm h GLN 268 N 0.64 0.84 -0.74 6.66 4.20 -0.23 -1.14 115.11 125.33 2ddm h GLN 268 Ca 0.19 -0.43 0.13 0.00 0.06 0.00 0.00 58.65 58.61 2ddm h GLN 268 Cb -0.03 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.71 2ddm h GLN 268 CO -0.07 1.07 0.49 0.37 -0.67 0.00 0.00 178.83 180.02 2ddm h GLN 269 N 0.70 0.47 -0.59 1.46 4.15 0.64 0.37 115.11 122.31 2ddm h GLN 269 Ca 0.06 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.46 2ddm h GLN 269 Cb 0.93 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.51 2ddm h GLN 269 CO 0.09 0.31 0.00 0.72 -1.93 0.00 0.00 178.83 178.02 2ddm n HIS 270 N -4.49 0.78 -3.83 3.99 8.25 -0.76 -4.97 115.22 114.20 2ddm n HIS 270 Ca 0.14 -0.39 -0.30 0.00 -0.26 0.00 0.00 57.72 56.90 2ddm n HIS 270 Cb 0.47 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.59 2ddm n HIS 270 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2ddm n GLU 271 N 1.42 -2.01 -4.69 -0.41 1.02 0.13 -4.98 120.64 111.13 2ddm n GLU 271 Ca 0.21 0.40 -0.34 0.00 -0.02 0.00 0.00 57.16 57.42 2ddm n GLU 271 Cb 0.56 -4.15 -0.12 0.00 -0.02 0.00 0.00 31.44 27.72 2ddm n GLU 271 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2ddm s SER 272 N -3.85 4.49 0.00 1.62 0.15 -0.51 -5.01 113.70 110.59 2ddm s SER 272 Ca 0.28 -0.07 0.22 0.00 0.70 0.00 0.00 55.95 57.08 2ddm s SER 272 Cb -0.11 -1.11 0.95 0.00 -1.71 0.00 0.00 66.02 64.04 2ddm s SER 272 CO 0.88 0.35 1.66 0.47 1.20 0.00 0.00 173.24 177.80 2ddm n ASP 273 N 2.29 1.08 -4.01 5.45 8.00 -1.26 -4.65 116.55 123.45 2ddm n ASP 273 Ca -0.18 -1.56 -0.16 0.00 0.71 0.00 0.00 54.79 53.60 2ddm n ASP 273 Cb 0.53 -0.06 -0.14 0.00 -0.02 0.00 0.00 41.12 41.43 2ddm n ASP 273 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2ddm s GLU 274 N -1.89 0.56 0.33 -1.24 0.41 -1.26 -4.76 118.70 110.86 2ddm s GLU 274 Ca 0.33 -0.35 -0.29 0.00 -0.41 0.00 0.00 54.97 54.24 2ddm s GLU 274 Cb 0.17 -0.51 -0.12 0.00 -1.78 0.00 0.00 34.13 31.89 2ddm s GLU 274 CO 0.26 0.13 1.44 1.28 -0.49 0.00 0.00 175.26 177.89 2ddm n LEU 275 N 2.62 4.06 -3.90 1.80 4.77 -1.26 -4.96 117.00 120.13 2ddm n LEU 275 Ca -0.15 1.19 -0.24 0.00 -0.03 0.00 0.00 56.01 56.79 2ddm n LEU 275 Cb 0.57 -1.55 -0.17 0.00 -2.33 0.00 0.00 43.42 39.95 2ddm n LEU 275 CO 0.24 -0.13 -0.42 0.27 -1.33 0.00 0.00 177.39 176.02 2ddm s ILE 276 N -0.68 0.77 -0.06 -0.08 -4.36 -1.26 -4.71 121.20 110.82 2ddm s ILE 276 Ca 0.59 -0.19 -0.30 0.00 -0.26 0.00 0.00 60.65 60.49 2ddm s ILE 276 Cb -0.53 -0.80 -0.02 0.00 1.25 0.00 0.00 42.46 42.36 2ddm s ILE 276 CO 0.57 0.30 1.09 -0.76 0.24 0.00 0.00 174.94 176.38 2ddm s LEU 277 N 1.32 4.28 0.59 0.37 1.43 -1.26 -4.49 118.68 120.93 2ddm s LEU 277 Ca -0.04 1.68 -0.00 0.00 -1.03 0.00 0.00 54.13 54.74 2ddm s LEU 277 Cb -0.14 -3.56 0.04 0.00 0.03 0.00 0.00 46.19 42.57 2ddm s LEU 277 CO -0.03 -0.48 0.84 -2.16 0.23 0.00 0.00 176.35 174.75 2ddm s PRO 278 N 1.91 2.43 1.02 1.29 0.04 -1.26 -5.04 135.00 135.38 2ddm s PRO 278 Ca 0.52 -0.69 -0.14 0.00 0.04 0.00 0.00 61.00 60.73 2ddm s PRO 278 Cb -0.22 -2.41 0.09 0.00 0.04 0.00 0.00 34.50 32.00 2ddm s PRO 278 CO 0.21 -0.86 0.42 -2.30 0.04 0.00 0.00 177.00 174.51 2ddm n PRO 279 N -2.49 -0.87 0.00 0.56 -0.02 -1.26 -5.09 135.00 125.83 2ddm n PRO 279 Ca 0.08 -0.22 0.06 0.00 -2.02 0.00 0.00 63.50 61.41 2ddm n PRO 279 Cb 0.60 -1.89 0.05 0.00 -0.02 0.00 0.00 33.50 32.24 2ddm n PRO 279 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37