#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f3j n ALA 2 N 0.00 -0.08 -0.78 -5.12 0.00 -1.26 -4.73 120.51 108.54 2f3j n ALA 2 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2f3j n ALA 2 Cb 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.29 2f3j n ALA 2 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2f3j n ASP 3 N -0.46 0.00 -1.77 0.00 2.03 -1.26 -5.01 116.55 110.07 2f3j n ASP 3 Ca -0.05 0.00 -0.18 0.00 0.52 0.00 0.00 54.79 55.08 2f3j n ASP 3 Cb 0.36 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.73 2f3j n ASP 3 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2f3j n LYS 4 N -1.33 -1.35 -0.04 -0.67 4.76 -1.26 -4.84 118.16 113.43 2f3j n LYS 4 Ca 0.00 0.96 -0.09 0.00 -2.87 0.00 0.00 58.31 56.32 2f3j n LYS 4 Cb 0.00 -5.36 -0.03 0.00 -1.84 0.00 0.00 35.03 27.80 2f3j n LYS 4 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 2f3j n MET 5 N -2.62 0.22 -0.02 1.97 2.81 -1.26 -4.81 117.12 113.41 2f3j n MET 5 Ca -0.20 0.10 0.02 0.00 -1.81 0.00 0.00 57.70 55.81 2f3j n MET 5 Cb 0.63 -0.88 -0.10 0.00 -0.71 0.00 0.00 33.22 32.16 2f3j n MET 5 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2f3j n ASP 6 N -3.64 2.05 0.00 7.83 8.00 -1.26 -5.03 116.55 124.50 2f3j n ASP 6 Ca -0.15 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.35 2f3j n ASP 6 Cb 0.48 1.31 0.00 0.00 -0.02 0.00 0.00 41.12 42.89 2f3j n ASP 6 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2f3j n MET 7 N -2.12 0.00 -2.62 -1.24 2.81 -1.26 -4.28 117.12 108.41 2f3j n MET 7 Ca -0.08 0.00 -0.43 0.00 -1.81 0.00 0.00 57.70 55.38 2f3j n MET 7 Cb 0.53 0.00 -0.00 0.00 -0.71 0.00 0.00 33.22 33.04 2f3j n MET 7 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2f3j s SER 8 N -4.00 6.83 0.21 7.83 0.01 -1.26 -4.76 113.70 118.56 2f3j s SER 8 Ca 0.00 -2.40 -0.09 0.00 1.31 0.00 0.00 55.95 54.77 2f3j s SER 8 Cb 0.00 -2.56 0.16 0.00 0.21 0.00 0.00 66.02 63.83 2f3j s SER 8 CO 0.00 -1.16 1.82 -0.07 0.41 0.00 0.00 173.24 174.23 2f3j h LEU 9 N 12.29 1.02 -0.44 2.44 -0.00 -2.01 -2.42 115.31 126.20 2f3j h LEU 9 Ca 0.41 -0.12 0.03 0.00 -0.00 0.00 0.00 57.88 58.19 2f3j h LEU 9 Cb 0.89 -0.26 -0.03 0.00 -0.00 0.00 0.00 40.66 41.25 2f3j h LEU 9 CO 1.43 0.85 0.24 -2.24 -0.00 0.00 0.00 178.44 178.73 2f3j h ASP 10 N 1.12 0.37 -0.61 -0.43 3.04 -1.96 -0.02 116.42 117.94 2f3j h ASP 10 Ca 0.28 0.01 -0.01 0.00 -3.24 0.00 0.00 57.03 54.07 2f3j h ASP 10 Cb 0.09 -0.06 -0.03 0.00 -1.04 0.00 0.00 39.33 38.28 2f3j h ASP 10 CO -0.04 0.27 0.34 -0.78 -2.04 0.00 0.00 179.24 176.99 2f3j h ASP 11 N 0.48 0.77 0.03 4.15 3.58 -1.90 -0.26 116.42 123.28 2f3j h ASP 11 Ca 0.18 -0.06 -0.00 0.00 0.42 0.00 0.00 57.03 57.57 2f3j h ASP 11 Cb 0.05 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 40.90 2f3j h ASP 11 CO -0.10 0.63 -0.01 0.40 -2.88 0.00 0.00 179.24 177.27 2f3j h ILE 12 N 0.87 1.10 -0.50 2.25 2.04 -0.87 0.12 117.51 122.52 2f3j h ILE 12 Ca 0.22 -0.40 0.10 0.00 1.00 0.00 0.00 64.86 65.78 2f3j h ILE 12 Cb 0.03 1.37 -0.09 0.00 -0.74 0.00 0.00 36.82 37.39 2f3j h ILE 12 CO -0.04 0.10 -0.03 0.40 0.00 0.00 0.00 178.15 178.58 2f3j h ILE 13 N -0.21 0.57 -0.26 -0.67 2.04 -0.41 0.98 117.51 119.57 2f3j h ILE 13 Ca -0.00 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 65.83 2f3j h ILE 13 Cb 0.20 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 2f3j h ILE 13 CO 0.01 0.01 0.17 0.11 0.00 0.00 0.00 178.15 178.45 2f3j h LYS 14 N 0.08 0.33 -0.39 2.37 1.79 -0.93 0.48 116.57 120.30 2f3j h LYS 14 Ca 0.25 -0.02 -0.04 0.00 -2.18 0.00 0.00 60.65 58.66 2f3j h LYS 14 Cb 0.38 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 30.94 2f3j h LYS 14 CO -0.45 0.22 0.08 1.25 -1.08 0.00 0.00 179.45 179.47 2f3j h LEU 15 N 0.34 0.53 -0.03 2.94 6.46 0.44 -0.58 115.31 125.41 2f3j h LEU 15 Ca 0.09 -0.08 -0.04 0.00 -0.12 0.00 0.00 57.88 57.74 2f3j h LEU 15 Cb -0.03 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 39.75 2f3j h LEU 15 CO -0.03 0.55 -0.17 0.78 -0.62 0.00 0.00 178.44 178.96 2f3j h ASN 16 N 0.57 0.00 0.00 1.25 -0.26 0.14 -2.16 115.58 115.12 2f3j h ASN 16 Ca 0.13 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.87 2f3j h ASN 16 Cb 0.24 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.50 2f3j h ASN 16 CO -0.00 0.17 -0.01 0.03 -1.06 0.00 0.00 177.43 176.56 2f3j h ARG 17 N 0.00 0.00 -1.16 0.81 3.08 -0.29 -3.36 114.38 113.46 2f3j h ARG 17 Ca -0.00 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.53 2f3j h ARG 17 Cb 1.12 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 30.94 2f3j h ARG 17 CO 0.02 0.44 0.67 -1.71 -1.07 0.00 0.00 179.97 178.32 2f3j n ASN 18 N -4.70 6.48 0.00 7.04 5.15 -0.28 -4.30 115.26 124.64 2f3j n ASN 18 Ca -0.04 -3.47 0.14 0.00 -0.60 0.00 0.00 54.58 50.60 2f3j n ASN 18 Cb 0.21 -0.96 0.68 0.00 -0.53 0.00 0.00 39.78 39.18 2f3j n ASN 18 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2f3j n GLN 19 N -0.52 0.35 -2.85 1.20 10.64 -0.81 -4.27 117.38 121.12 2f3j n GLN 19 Ca 0.50 0.03 -0.43 0.00 -1.83 0.00 0.00 57.00 55.26 2f3j n GLN 19 Cb 0.80 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 28.68 2f3j n GLN 19 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 2f3j n ARG 20 N -1.31 3.83 0.00 2.61 3.00 -1.26 -4.76 116.66 118.77 2f3j n ARG 20 Ca 0.12 -4.08 0.09 0.00 -0.01 0.00 0.00 57.85 53.98 2f3j n ARG 20 Cb 0.23 -2.75 0.44 0.00 0.00 0.00 0.00 32.46 30.38 2f3j n ARG 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2f3j n ARG 21 N 3.20 0.06 0.19 5.56 3.00 -1.26 -1.79 116.66 125.63 2f3j n ARG 21 Ca 0.32 0.15 0.14 0.00 -0.01 0.00 0.00 57.85 58.45 2f3j n ARG 21 Cb 0.37 -1.50 0.49 0.00 0.00 0.00 0.00 32.46 31.82 2f3j n ARG 21 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2f3j h VAL 22 N 0.00 0.00 -1.78 1.55 2.07 -1.96 -3.40 116.25 112.73 2f3j h VAL 22 Ca 0.00 -0.50 -0.52 0.00 0.82 0.00 0.00 66.70 66.49 2f3j h VAL 22 Cb 0.30 1.42 -0.07 0.00 -1.52 0.00 0.00 31.29 31.42 2f3j h VAL 22 CO 0.00 0.00 1.20 0.21 0.02 0.00 0.00 177.57 179.00 2f3j s ASN 23 N -5.14 5.99 0.09 0.57 2.47 -0.74 -4.77 114.94 113.42 2f3j s ASN 23 Ca 0.05 -0.61 0.06 0.00 0.42 0.00 0.00 52.86 52.78 2f3j s ASN 23 Cb 0.09 -2.56 -0.22 0.00 -1.45 0.00 0.00 41.25 37.11 2f3j s ASN 23 CO 0.53 -1.94 1.18 0.03 -3.72 0.00 0.00 177.10 173.18 2f3j h ARG 24 N 10.95 0.04 0.00 0.43 -0.00 -1.88 -3.48 114.38 120.43 2f3j h ARG 24 Ca -0.11 -0.06 0.00 0.00 -0.50 0.00 0.00 59.98 59.31 2f3j h ARG 24 Cb 1.05 0.02 0.00 0.00 0.00 0.00 0.00 29.97 31.05 2f3j h ARG 24 CO 1.30 0.97 0.00 0.41 0.00 0.00 0.00 179.97 182.66 2f3j n GLY 25 N 1.40 2.21 1.28 0.04 0.00 -1.26 -4.66 105.19 104.21 2f3j n GLY 25 Ca -0.03 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2f3j n GLY 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f3j n GLY 26 N 0.00 0.81 0.24 -0.02 0.00 -1.26 -4.99 105.19 99.97 2f3j n GLY 26 Ca 0.00 -0.59 -0.15 0.00 0.00 0.00 0.00 46.02 45.28 2f3j n GLY 26 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2f3j h GLY 27 N 0.00 -0.55 -0.86 -0.02 0.00 -2.04 -2.11 103.07 97.49 2f3j h GLY 27 Ca 0.00 0.21 0.39 0.00 0.00 0.00 0.00 47.33 47.94 2f3j h GLY 27 CO 0.00 -0.20 0.85 -2.55 0.00 0.00 0.00 176.54 174.64 2f3j h PRO 28 N -0.53 0.14 0.00 4.80 0.10 -1.98 -3.45 132.00 131.09 2f3j h PRO 28 Ca -0.05 -0.01 0.00 0.00 0.10 0.00 0.00 66.00 66.04 2f3j h PRO 28 Cb 0.41 -0.03 0.00 0.00 0.10 0.00 0.00 31.00 31.48 2f3j h PRO 28 CO 0.08 0.09 0.00 0.54 0.10 0.00 0.00 178.00 178.81 2f3j n ARG 29 N -4.56 0.00 -3.62 1.05 1.74 -0.79 -4.49 116.66 105.98 2f3j n ARG 29 Ca 0.34 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 57.17 2f3j n ARG 29 Cb 1.32 0.00 0.08 0.00 -1.02 0.00 0.00 32.46 32.84 2f3j n ARG 29 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2f3j n ARG 30 N 0.00 -7.83 -4.30 5.56 1.74 -1.26 -5.00 116.66 105.58 2f3j n ARG 30 Ca 0.00 0.81 -0.19 0.00 -0.77 0.00 0.00 57.85 57.70 2f3j n ARG 30 Cb 0.00 -5.86 -0.11 0.00 -1.02 0.00 0.00 32.46 25.47 2f3j n ARG 30 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2f3j s ASN 31 N -3.32 2.33 -0.14 0.55 4.22 -1.26 -5.13 114.94 112.18 2f3j s ASN 31 Ca 0.59 -0.89 -0.15 0.00 -2.14 0.00 0.00 52.86 50.27 2f3j s ASN 31 Cb -0.26 -0.11 -0.05 0.00 1.28 0.00 0.00 41.25 42.11 2f3j s ASN 31 CO 0.74 -0.13 0.35 -0.13 -2.04 0.00 0.00 177.10 175.89 2f3j s ARG 32 N -3.03 4.27 0.26 3.55 1.81 -1.26 -4.98 118.95 119.57 2f3j s ARG 32 Ca 0.15 0.21 -0.02 0.00 -1.72 0.00 0.00 55.73 54.35 2f3j s ARG 32 Cb -0.04 -3.42 0.47 0.00 -0.45 0.00 0.00 34.95 31.52 2f3j s ARG 32 CO 0.05 0.23 1.80 -1.35 -0.68 0.00 0.00 175.30 175.35 2f3j h PRO 33 N 6.62 0.78 -5.75 3.54 0.11 -2.04 -3.47 132.00 131.79 2f3j h PRO 33 Ca -0.41 -0.05 -0.25 0.00 0.11 0.00 0.00 66.00 65.40 2f3j h PRO 33 Cb 1.17 -0.18 0.10 0.00 0.11 0.00 0.00 31.00 32.20 2f3j h PRO 33 CO 0.75 0.52 -0.67 0.00 -0.21 0.00 0.00 178.00 178.39 2f3j n ALA 34 N -2.38 -2.54 0.05 -0.75 0.00 -1.26 -4.94 120.51 108.69 2f3j n ALA 34 Ca 0.16 -0.04 0.03 0.00 0.00 0.00 0.00 53.44 53.59 2f3j n ALA 34 Cb 0.34 -3.79 -0.05 0.00 0.00 0.00 0.00 19.45 15.95 2f3j n ALA 34 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 2f3j n ILE 35 N -3.06 0.00 -2.97 0.00 0.13 -1.26 -4.94 119.36 107.26 2f3j n ILE 35 Ca -0.08 -0.18 -0.42 0.00 -1.10 0.00 0.00 62.75 60.97 2f3j n ILE 35 Cb 0.58 0.46 -0.05 0.00 -0.84 0.00 0.00 39.64 39.79 2f3j n ILE 35 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2f3j s ALA 36 N -2.32 3.51 0.87 1.51 0.00 -1.26 -5.04 121.76 119.04 2f3j s ALA 36 Ca -0.02 -0.49 -0.11 0.00 0.00 0.00 0.00 51.96 51.35 2f3j s ALA 36 Cb 0.04 -3.28 0.12 0.00 0.00 0.00 0.00 23.12 20.00 2f3j s ALA 36 CO 0.27 -1.23 1.10 -0.98 0.00 0.00 0.00 175.76 174.93 2f3j s ARG 37 N 2.93 1.41 0.00 0.00 3.03 -1.26 -5.03 118.95 120.03 2f3j s ARG 37 Ca 0.31 1.19 0.00 0.00 2.03 0.00 0.00 55.73 59.26 2f3j s ARG 37 Cb -0.14 -1.80 0.00 0.00 -1.03 0.00 0.00 34.95 31.98 2f3j s ARG 37 CO 0.13 -2.25 0.00 0.41 -1.13 0.00 0.00 175.30 172.46 2f3j n GLY 38 N -0.59 3.26 7.00 3.88 0.00 -1.26 -5.05 105.19 112.43 2f3j n GLY 38 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2f3j n GLY 38 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f3j n GLY 39 N 0.00 3.24 2.34 -0.02 0.00 -1.26 -2.65 105.19 106.84 2f3j n GLY 39 Ca 0.00 -0.16 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 2f3j n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f3j n ARG 40 N 13.07 3.12 -1.90 1.61 5.12 -1.26 -4.88 116.66 131.54 2f3j n ARG 40 Ca 0.00 -3.80 -0.42 0.00 -1.93 0.00 0.00 57.85 51.70 2f3j n ARG 40 Cb 0.00 -2.28 0.00 0.00 -1.16 0.00 0.00 32.46 29.02 2f3j n ARG 40 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2f3j n ASN 41 N -0.73 4.37 0.10 0.55 5.15 -1.08 -3.87 115.26 119.75 2f3j n ASN 41 Ca 0.52 -2.92 0.00 0.00 -0.60 0.00 0.00 54.58 51.58 2f3j n ASN 41 Cb 0.69 -1.60 0.00 0.00 -0.53 0.00 0.00 39.78 38.34 2f3j n ASN 41 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 2f3j n ARG 42 N 5.34 0.00 0.25 1.20 3.00 -1.26 -4.87 116.66 120.32 2f3j n ARG 42 Ca 0.49 0.00 0.17 0.00 -0.00 0.00 0.00 57.85 58.51 2f3j n ARG 42 Cb 0.38 0.00 0.75 0.00 0.00 0.00 0.00 32.46 33.59 2f3j n ARG 42 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.63 176.63 2f3j h PRO 43 N 0.00 0.00 -4.80 -0.14 0.13 -2.00 -3.39 132.00 121.80 2f3j h PRO 43 Ca 0.00 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.45 2f3j h PRO 43 Cb 0.00 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 30.88 2f3j h PRO 43 CO 0.00 0.00 -0.61 0.00 -0.23 0.00 0.00 178.00 177.16 2f3j s ALA 44 N -3.68 3.11 0.52 -0.56 0.00 -1.26 -4.75 121.76 115.13 2f3j s ALA 44 Ca 0.00 -1.44 0.26 0.00 0.00 0.00 0.00 51.96 50.78 2f3j s ALA 44 Cb 0.10 -2.20 1.37 0.00 0.00 0.00 0.00 23.12 22.39 2f3j s ALA 44 CO 0.45 -0.92 1.95 -1.35 0.00 0.00 0.00 175.76 175.89 2f3j h PRO 45 N 8.26 0.07 0.00 0.00 0.11 -1.81 -3.46 132.00 135.16 2f3j h PRO 45 Ca -0.32 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2f3j h PRO 45 Cb 1.13 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2f3j h PRO 45 CO 0.61 0.04 0.00 0.98 -0.21 0.00 0.00 178.00 179.42 2f3j n TYR 46 N -4.36 0.00 -0.36 0.65 4.19 -1.26 -5.01 117.16 111.01 2f3j n TYR 46 Ca 0.14 0.00 0.03 0.00 3.31 0.00 0.00 57.90 61.38 2f3j n TYR 46 Cb 0.72 0.00 0.18 0.00 0.49 0.00 0.00 39.34 40.73 2f3j n TYR 46 CO 0.00 0.00 0.00 0.77 0.91 0.00 0.00 176.86 178.54 2f3j h SER 47 N 0.00 0.97 -3.58 2.98 0.02 -2.03 -3.41 113.55 108.49 2f3j h SER 47 Ca 0.00 0.02 -0.34 0.00 -0.84 0.00 0.00 61.79 60.63 2f3j h SER 47 Cb 0.00 -0.18 -0.33 0.00 0.14 0.00 0.00 62.40 62.03 2f3j h SER 47 CO 0.00 0.60 -0.75 -0.60 -1.14 0.00 0.00 176.83 174.94 2f3j s ARG 48 N -6.03 0.36 -0.15 3.45 3.52 -1.26 -5.07 118.95 113.78 2f3j s ARG 48 Ca -0.12 0.01 -0.30 0.00 -0.13 0.00 0.00 55.73 55.19 2f3j s ARG 48 Cb 0.20 -0.47 -0.07 0.00 -1.56 0.00 0.00 34.95 33.05 2f3j s ARG 48 CO 0.81 -0.08 2.13 -2.30 -0.81 0.00 0.00 175.30 175.05 2f3j n PRO 49 N 3.85 2.17 -3.52 5.12 -0.02 -1.26 -4.60 135.00 136.74 2f3j n PRO 49 Ca -0.24 0.68 -0.29 0.00 -2.02 0.00 0.00 63.50 61.63 2f3j n PRO 49 Cb 0.52 -3.08 -0.04 0.00 -0.02 0.00 0.00 33.50 30.88 2f3j n PRO 49 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2f3j s LYS 50 N 5.67 3.62 0.00 -0.52 -0.14 -1.26 -4.96 119.74 122.15 2f3j s LYS 50 Ca 0.98 -0.08 0.07 0.00 -1.36 0.00 0.00 55.97 55.58 2f3j s LYS 50 Cb -0.42 -2.75 0.36 0.00 -1.68 0.00 0.00 37.83 33.34 2f3j s LYS 50 CO 0.39 0.34 1.11 -2.30 -0.76 0.00 0.00 175.35 174.13 2f3j n PRO 51 N -0.53 0.09 -3.67 -1.68 -0.02 -1.26 -3.88 135.00 124.05 2f3j n PRO 51 Ca -0.02 0.24 -0.38 0.00 -2.02 0.00 0.00 63.50 61.32 2f3j n PRO 51 Cb 0.53 -1.50 -0.09 0.00 -0.02 0.00 0.00 33.50 32.42 2f3j n PRO 51 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2f3j s LEU 52 N -2.63 5.44 0.00 2.45 1.02 -1.26 -5.06 118.68 118.64 2f3j s LEU 52 Ca 0.06 -2.70 0.00 0.00 0.02 0.00 0.00 54.13 51.51 2f3j s LEU 52 Cb 0.05 -1.90 0.00 0.00 0.02 0.00 0.00 46.19 44.36 2f3j s LEU 52 CO 0.11 -0.43 0.00 -0.81 0.02 0.00 0.00 176.35 175.24 2f3j n PRO 53 N 3.73 0.65 -1.03 1.29 -0.04 -1.25 -4.71 135.00 133.63 2f3j n PRO 53 Ca 0.07 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.37 2f3j n PRO 53 Cb 0.39 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.70 2f3j n PRO 53 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2f3j n ASP 54 N 0.00 5.68 -3.69 3.54 2.03 -1.26 -4.70 116.55 118.15 2f3j n ASP 54 Ca 0.00 -2.48 -0.28 0.00 0.52 0.00 0.00 54.79 52.55 2f3j n ASP 54 Cb 0.00 -1.43 -0.16 0.00 -0.72 0.00 0.00 41.12 38.81 2f3j n ASP 54 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 2f3j s LYS 55 N 1.18 0.53 0.68 -0.67 2.36 -1.26 -5.13 119.74 117.43 2f3j s LYS 55 Ca 0.67 -0.53 -0.12 0.00 -2.55 0.00 0.00 55.97 53.43 2f3j s LYS 55 Cb 0.30 -1.91 0.01 0.00 -1.05 0.00 0.00 37.83 35.17 2f3j s LYS 55 CO -0.01 -0.77 1.07 -1.58 1.55 0.00 0.00 175.35 175.61 2f3j s TRP 56 N 1.88 2.88 0.00 4.03 0.52 -1.26 -4.97 118.94 122.02 2f3j s TRP 56 Ca 0.03 1.49 0.00 0.00 0.02 0.00 0.00 56.10 57.64 2f3j s TRP 56 Cb -0.17 -2.99 0.00 0.00 -1.15 0.00 0.00 33.47 29.16 2f3j s TRP 56 CO -0.16 -1.41 0.00 1.04 0.02 0.00 0.00 176.95 176.44 2f3j n GLN 57 N -2.86 3.41 0.38 4.98 1.13 -1.26 -5.05 117.38 118.11 2f3j n GLN 57 Ca 0.09 0.00 -0.15 0.00 -1.94 0.00 0.00 57.00 54.99 2f3j n GLN 57 Cb 0.53 0.00 -0.07 0.00 0.11 0.00 0.00 30.24 30.81 2f3j n GLN 57 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 2f3j h HIS 58 N 0.01 -0.92 0.00 1.08 2.76 -2.08 -3.47 115.15 112.53 2f3j h HIS 58 Ca 0.00 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.15 2f3j h HIS 58 Cb 0.00 0.30 0.00 0.00 1.55 0.00 0.00 27.41 29.26 2f3j h HIS 58 CO 0.00 -0.57 0.00 -0.25 -1.30 0.00 0.00 177.93 175.81 2f3j n ASP 59 N -5.06 0.00 0.00 3.26 8.00 -1.26 -4.98 116.55 116.51 2f3j n ASP 59 Ca -0.12 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.38 2f3j n ASP 59 Cb 0.39 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.49 2f3j n ASP 59 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2f3j n LEU 60 N -0.98 0.00 -0.25 0.64 4.32 -1.26 -1.77 117.00 117.69 2f3j n LEU 60 Ca 0.00 0.00 0.12 0.00 -0.02 0.00 0.00 56.01 56.11 2f3j n LEU 60 Cb 0.00 0.00 0.12 0.00 -1.62 0.00 0.00 43.42 41.92 2f3j n LEU 60 CO 0.00 0.00 0.36 0.49 -1.22 0.00 0.00 177.39 177.02 2f3j n PHE 61 N 0.00 0.00 -0.70 -1.77 3.01 -1.26 -5.06 117.46 111.68 2f3j n PHE 61 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2f3j n PHE 61 Cb 0.00 -0.07 0.00 0.00 -0.01 0.00 0.00 39.48 39.40 2f3j n PHE 61 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2f3j n ASP 62 N -0.71 -4.56 -0.04 4.37 9.92 -0.73 -4.27 116.55 120.53 2f3j n ASP 62 Ca 0.09 0.52 -0.10 0.00 -0.53 0.00 0.00 54.79 54.77 2f3j n ASP 62 Cb 0.39 -1.40 -0.14 0.00 -0.64 0.00 0.00 41.12 39.32 2f3j n ASP 62 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2f3j n SER 63 N -0.53 0.77 -0.08 -2.24 7.64 -1.26 -3.72 113.62 114.21 2f3j n SER 63 Ca 0.00 0.29 -0.12 0.00 1.01 0.00 0.00 58.87 60.06 2f3j n SER 63 Cb 0.00 0.13 -0.07 0.00 -1.01 0.00 0.00 64.21 63.25 2f3j n SER 63 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2f3j h GLY 64 N 3.44 0.00 -3.94 0.23 0.00 -1.98 -3.38 103.07 97.43 2f3j h GLY 64 Ca -0.36 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 46.59 2f3j h GLY 64 CO 0.06 0.00 0.35 0.00 0.00 0.00 0.00 176.54 176.95 2f3j n GLY 66 N 0.73 1.05 0.52 0.00 0.00 -1.24 -4.73 105.19 101.52 2f3j n GLY 66 Ca 0.38 -1.29 0.02 0.00 0.00 0.00 0.00 46.02 45.13 2f3j n GLY 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f3j n GLY 67 N -1.15 1.31 7.00 -0.02 0.00 -1.25 -4.17 105.19 106.91 2f3j n GLY 67 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.75 2f3j n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f3j n GLY 68 N -0.20 -0.81 0.05 -0.02 0.00 -1.26 -2.04 105.19 100.91 2f3j n GLY 68 Ca 0.03 -1.16 -0.01 0.00 0.00 0.00 0.00 46.02 44.88 2f3j n GLY 68 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2f3j h GLU 69 N 0.00 0.00 0.00 1.61 3.07 -1.97 -3.43 114.58 113.86 2f3j h GLU 69 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2f3j h GLU 69 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 2f3j h GLU 69 CO 0.00 0.04 -0.17 0.41 -1.40 0.00 0.00 179.01 177.89 2f3j n GLY 70 N 1.76 -0.79 0.19 -3.84 0.00 -1.26 -4.57 105.19 96.68 2f3j n GLY 70 Ca -0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.15 2f3j n GLY 70 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2f3j h VAL 71 N 4.56 0.00 0.00 1.61 -1.51 -1.86 -3.39 116.25 115.66 2f3j h VAL 71 Ca 0.00 -0.50 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 2f3j h VAL 71 Cb 1.13 1.41 0.00 0.00 -2.13 0.00 0.00 31.29 31.71 2f3j h VAL 71 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 177.57 177.55 2f3j n GLU 72 N -2.68 0.00 -1.13 5.19 0.00 -0.99 -4.99 120.64 116.04 2f3j n GLU 72 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 57.16 56.78 2f3j n GLU 72 Cb 0.34 -0.15 -0.05 0.00 0.00 0.00 0.00 31.44 31.58 2f3j n GLU 72 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 2f3j n THR 73 N -0.51 2.01 -0.02 6.31 -2.24 -0.87 -4.63 114.28 114.33 2f3j n THR 73 Ca 0.00 -1.66 -0.00 0.00 -2.27 0.00 0.00 64.05 60.12 2f3j n THR 73 Cb 0.00 -2.31 -0.00 0.00 -2.10 0.00 0.00 70.33 65.92 2f3j n THR 73 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2f3j h GLY 74 N 12.76 0.00 -6.33 3.38 0.00 -1.85 -3.43 103.07 107.60 2f3j h GLY 74 Ca 0.44 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 47.11 2f3j h GLY 74 CO 1.89 0.00 -0.79 0.00 0.00 0.00 0.00 176.54 177.63 2f3j s ALA 75 N -2.79 2.56 -0.39 3.60 0.00 -0.65 -4.82 121.76 119.27 2f3j s ALA 75 Ca -0.00 -1.17 -0.06 0.00 0.00 0.00 0.00 51.96 50.73 2f3j s ALA 75 Cb 0.00 -1.40 0.08 0.00 0.00 0.00 0.00 23.12 21.80 2f3j s ALA 75 CO 0.01 -0.33 0.19 0.21 0.00 0.00 0.00 175.76 175.84 2f3j s LYS 76 N 1.28 2.44 0.37 0.00 2.20 -0.69 -2.23 119.74 123.11 2f3j s LYS 76 Ca 0.04 -1.49 0.03 0.00 -0.36 0.00 0.00 55.97 54.20 2f3j s LYS 76 Cb -0.14 -3.61 -0.01 0.00 -1.51 0.00 0.00 37.83 32.56 2f3j s LYS 76 CO -0.07 -0.90 0.54 -1.17 -0.36 0.00 0.00 175.35 173.40 2f3j s LEU 77 N 1.33 3.88 0.02 5.43 1.98 0.40 0.60 118.68 132.32 2f3j s LEU 77 Ca 0.03 0.07 -0.02 0.00 -2.89 0.00 0.00 54.13 51.32 2f3j s LEU 77 Cb -0.22 -2.97 -0.02 0.00 0.66 0.00 0.00 46.19 43.65 2f3j s LEU 77 CO 0.00 -0.49 0.02 -0.76 -1.89 0.00 0.00 176.35 173.23 2f3j s LEU 78 N -4.32 2.07 -0.01 -0.68 1.43 -0.12 -1.69 118.68 115.36 2f3j s LEU 78 Ca 0.45 -0.46 -0.02 0.00 -1.03 0.00 0.00 54.13 53.07 2f3j s LEU 78 Cb -0.10 0.27 -0.00 0.00 0.03 0.00 0.00 46.19 46.39 2f3j s LEU 78 CO 0.34 -0.34 0.04 0.68 0.23 0.00 0.00 176.35 177.29 2f3j s VAL 79 N -1.62 0.04 0.23 -1.59 -7.23 -0.49 -1.36 120.40 108.37 2f3j s VAL 79 Ca -0.14 -0.33 -0.22 0.00 -1.81 0.00 0.00 61.98 59.48 2f3j s VAL 79 Cb -0.08 -0.17 0.04 0.00 0.56 0.00 0.00 36.38 36.73 2f3j s VAL 79 CO -0.01 -0.18 0.75 -0.94 -0.31 0.00 0.00 175.10 174.41 2f3j s SER 80 N -0.54 -0.30 -1.39 4.85 1.04 -0.74 -1.31 113.70 115.30 2f3j s SER 80 Ca -0.06 -0.45 -0.09 0.00 0.48 0.00 0.00 55.95 55.84 2f3j s SER 80 Cb -0.04 0.65 0.03 0.00 0.10 0.00 0.00 66.02 66.77 2f3j s SER 80 CO -0.00 -1.18 1.07 -3.20 0.98 0.00 0.00 173.24 170.90 2f3j n ASN 81 N -0.44 -4.95 0.00 7.02 2.85 -1.26 -0.31 115.26 118.17 2f3j n ASN 81 Ca -0.07 -0.64 0.00 0.00 -0.11 0.00 0.00 54.58 53.76 2f3j n ASN 81 Cb 0.60 -4.64 0.00 0.00 1.24 0.00 0.00 39.78 36.99 2f3j n ASN 81 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2f3j n LEU 82 N -4.75 0.00 -4.81 1.20 -0.00 -1.26 -4.15 117.00 103.23 2f3j n LEU 82 Ca -0.04 0.00 -0.32 0.00 -0.00 0.00 0.00 56.01 55.65 2f3j n LEU 82 Cb 0.57 0.00 0.04 0.00 -0.00 0.00 0.00 43.42 44.03 2f3j n LEU 82 CO 0.68 0.00 0.71 -0.62 -0.00 0.00 0.00 177.39 178.16 2f3j s ASP 83 N -0.77 5.45 0.38 1.45 2.15 -1.26 -4.94 116.67 119.13 2f3j s ASP 83 Ca 0.00 1.74 0.26 0.00 0.43 0.00 0.00 52.55 54.98 2f3j s ASP 83 Cb 0.00 -2.52 0.69 0.00 -0.30 0.00 0.00 42.92 40.79 2f3j s ASP 83 CO 0.00 -1.39 1.73 -0.26 -0.17 0.00 0.00 175.17 175.07 2f3j h PHE 84 N -0.23 0.00 -0.39 -5.34 0.04 -1.98 -2.86 116.94 106.17 2f3j h PHE 84 Ca -0.45 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.25 2f3j h PHE 84 Cb 1.22 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.33 2f3j h PHE 84 CO 0.60 0.00 0.08 0.41 -0.60 0.00 0.00 178.31 178.80 2f3j n GLY 85 N 0.89 2.61 3.64 -1.45 0.00 -1.26 -4.97 105.19 104.64 2f3j n GLY 85 Ca 0.04 -0.57 -0.45 0.00 0.00 0.00 0.00 46.02 45.04 2f3j n GLY 85 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2f3j n VAL 86 N 0.20 1.35 -3.86 1.61 3.14 -1.08 -4.96 118.33 114.72 2f3j n VAL 86 Ca 0.20 -0.34 -0.11 0.00 -2.96 0.00 0.00 64.34 61.13 2f3j n VAL 86 Cb 0.89 -1.26 -0.11 0.00 -1.06 0.00 0.00 33.84 32.30 2f3j n VAL 86 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 2f3j s SER 87 N -0.06 -0.02 0.30 6.55 0.01 -1.26 -4.99 113.70 114.23 2f3j s SER 87 Ca 0.65 -0.07 0.05 0.00 1.31 0.00 0.00 55.95 57.89 2f3j s SER 87 Cb -0.69 0.23 0.73 0.00 0.21 0.00 0.00 66.02 66.51 2f3j s SER 87 CO 0.55 -0.27 1.75 -2.24 0.41 0.00 0.00 173.24 173.43 2f3j h ASP 88 N 4.77 0.66 0.03 2.44 2.03 -1.94 0.55 116.42 124.97 2f3j h ASP 88 Ca -0.29 0.11 -0.14 0.00 -0.73 0.00 0.00 57.03 55.98 2f3j h ASP 88 Cb 1.20 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.69 2f3j h ASP 88 CO 0.41 0.19 -0.47 0.00 -1.03 0.00 0.00 179.24 178.34 2f3j h ALA 89 N 1.66 0.81 -0.26 4.15 0.00 -1.96 -0.05 119.26 123.61 2f3j h ALA 89 Ca 0.57 -0.47 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 2f3j h ALA 89 Cb 0.95 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 2f3j h ALA 89 CO -0.42 0.66 -0.34 0.22 0.00 0.00 0.00 179.25 179.38 2f3j h ASP 90 N 0.41 0.74 0.03 0.00 3.58 -1.54 0.16 116.42 119.81 2f3j h ASP 90 Ca 0.02 -0.50 -0.00 0.00 0.42 0.00 0.00 57.03 56.97 2f3j h ASP 90 Cb 0.98 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.82 2f3j h ASP 90 CO 0.09 1.10 -0.01 0.40 -2.88 0.00 0.00 179.24 177.93 2f3j h ILE 91 N 0.41 1.05 -0.84 2.25 1.08 0.10 0.26 117.51 121.83 2f3j h ILE 91 Ca 0.03 -0.25 0.13 0.00 -0.39 0.00 0.00 64.86 64.38 2f3j h ILE 91 Cb 0.92 1.22 -0.09 0.00 -3.07 0.00 0.00 36.82 35.80 2f3j h ILE 91 CO 0.08 0.06 0.44 -0.61 -0.69 0.00 0.00 178.15 177.43 2f3j h GLN 92 N -0.14 0.65 -0.15 2.37 4.15 -1.00 -0.14 115.11 120.84 2f3j h GLN 92 Ca -0.00 -0.04 0.01 0.00 0.77 0.00 0.00 58.65 59.38 2f3j h GLN 92 Cb 0.13 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.67 2f3j h GLN 92 CO 0.01 0.43 0.09 1.49 -1.93 0.00 0.00 178.83 178.91 2f3j h GLU 93 N 0.67 0.18 -0.02 1.69 4.57 0.04 0.52 114.58 122.23 2f3j h GLU 93 Ca 0.44 -0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.63 2f3j h GLU 93 Cb 0.56 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.09 2f3j h GLU 93 CO -0.33 0.12 -0.08 -0.07 -1.18 0.00 0.00 179.01 177.47 2f3j h LEU 94 N 0.18 -0.24 0.06 1.64 3.38 0.18 -1.79 115.31 118.72 2f3j h LEU 94 Ca 0.06 0.04 -0.26 0.00 0.09 0.00 0.00 57.88 57.81 2f3j h LEU 94 Cb -0.00 0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2f3j h LEU 94 CO -0.03 -0.12 -1.17 -0.26 0.09 0.00 0.00 178.44 176.95 2f3j h PHE 95 N -0.14 0.47 -0.08 1.13 -1.00 -0.83 0.18 116.94 116.68 2f3j h PHE 95 Ca 0.04 -0.33 0.02 0.00 2.81 0.00 0.00 57.97 60.51 2f3j h PHE 95 Cb 0.19 -0.03 -0.00 0.00 3.61 0.00 0.00 35.95 39.72 2f3j h PHE 95 CO -0.16 1.23 0.06 0.00 -1.61 0.00 0.00 178.31 177.84 2f3j h ALA 96 N 0.65 1.93 0.19 2.45 0.00 0.05 0.19 119.26 124.71 2f3j h ALA 96 Ca -0.12 -0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.48 2f3j h ALA 96 Cb 1.88 0.01 0.03 0.00 0.00 0.00 0.00 17.79 19.71 2f3j h ALA 96 CO 0.19 -0.10 -1.36 1.49 0.00 0.00 0.00 179.25 179.47 2f3j h GLU 97 N 0.00 0.55 0.00 0.00 4.22 -0.82 -3.30 114.58 115.23 2f3j h GLU 97 Ca 0.04 -0.85 -0.04 0.00 0.08 0.00 0.00 59.36 58.59 2f3j h GLU 97 Cb 0.16 0.30 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2f3j h GLU 97 CO -0.00 1.39 -0.19 0.74 -2.18 0.00 0.00 179.01 178.77 2f3j h PHE 98 N 0.20 0.00 0.00 0.92 0.04 0.76 -3.48 116.94 115.38 2f3j h PHE 98 Ca -0.22 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.55 2f3j h PHE 98 Cb 2.04 0.00 0.00 0.00 2.20 0.00 0.00 35.95 40.19 2f3j h PHE 98 CO 0.12 0.19 0.00 0.41 -0.60 0.00 0.00 178.31 178.43 2f3j n GLY 99 N -0.55 -1.40 3.61 -1.45 0.00 0.54 -5.06 105.19 100.88 2f3j n GLY 99 Ca -0.02 0.55 -0.25 0.00 0.00 0.00 0.00 46.02 46.31 2f3j n GLY 99 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2f3j s THR 100 N 0.00 2.61 0.00 2.61 2.01 -1.24 -4.69 115.64 116.94 2f3j s THR 100 Ca 0.00 -2.04 0.00 0.00 0.31 0.00 0.00 61.69 59.96 2f3j s THR 100 Cb 0.00 -2.74 0.00 0.00 0.01 0.00 0.00 72.50 69.77 2f3j s THR 100 CO 0.00 -0.23 0.00 -0.11 -0.69 0.00 0.00 174.62 173.59 2f3j n LEU 101 N -0.90 0.00 0.00 4.42 -0.00 -1.26 -4.42 117.00 114.84 2f3j n LEU 101 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.96 2f3j n LEU 101 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.04 2f3j n LEU 101 CO 0.43 0.00 0.01 1.17 -0.00 0.00 0.00 177.39 179.00 2f3j n LYS 102 N 0.00 4.57 -3.15 1.96 0.00 0.67 -4.96 118.16 117.26 2f3j n LYS 102 Ca 0.00 -0.03 0.05 0.00 0.00 0.00 0.00 58.31 58.33 2f3j n LYS 102 Cb 0.00 -0.39 -0.00 0.00 0.00 0.00 0.00 35.03 34.63 2f3j n LYS 102 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 2f3j s LYS 103 N -0.66 0.26 -0.37 1.64 -2.85 -0.97 -4.98 119.74 111.80 2f3j s LYS 103 Ca 0.00 0.29 -0.10 0.00 -1.00 0.00 0.00 55.97 55.16 2f3j s LYS 103 Cb 0.00 0.14 0.03 0.00 -2.06 0.00 0.00 37.83 35.94 2f3j s LYS 103 CO 0.00 -0.45 0.20 0.00 0.10 0.00 0.00 175.35 175.20 2f3j s ALA 104 N 2.92 3.25 0.36 0.59 0.00 -1.26 0.31 121.76 127.94 2f3j s ALA 104 Ca 0.19 -1.73 0.07 0.00 0.00 0.00 0.00 51.96 50.49 2f3j s ALA 104 Cb -0.05 -2.56 -0.02 0.00 0.00 0.00 0.00 23.12 20.49 2f3j s ALA 104 CO -0.22 -1.39 0.39 0.00 0.00 0.00 0.00 175.76 174.53 2f3j s ALA 105 N 1.53 4.07 -0.03 0.00 0.00 0.13 -4.76 121.76 122.71 2f3j s ALA 105 Ca 0.01 -1.66 0.07 0.00 0.00 0.00 0.00 51.96 50.39 2f3j s ALA 105 Cb -0.19 -1.32 -0.02 0.00 0.00 0.00 0.00 23.12 21.59 2f3j s ALA 105 CO 0.06 -0.09 -0.24 0.08 0.00 0.00 0.00 175.76 175.57 2f3j s VAL 106 N -2.31 1.94 -0.19 0.00 1.01 -1.26 0.35 120.40 119.93 2f3j s VAL 106 Ca 0.45 -1.04 -0.02 0.00 0.00 0.00 0.00 61.98 61.37 2f3j s VAL 106 Cb -0.07 -1.62 -0.00 0.00 0.00 0.00 0.00 36.38 34.69 2f3j s VAL 106 CO 0.29 0.55 -0.09 -0.62 0.00 0.00 0.00 175.10 175.23 2f3j s ASP 107 N -0.49 4.02 0.94 3.32 2.15 0.16 -4.92 116.67 121.86 2f3j s ASP 107 Ca 0.07 -0.43 -0.15 0.00 0.43 0.00 0.00 52.55 52.47 2f3j s ASP 107 Cb -0.10 -1.66 0.17 0.00 -0.30 0.00 0.00 42.92 41.03 2f3j s ASP 107 CO -0.00 0.02 1.25 -0.31 -0.17 0.00 0.00 175.17 175.96 2f3j s TYR 108 N 1.21 1.90 0.73 -5.34 1.51 -1.26 -3.39 117.35 112.72 2f3j s TYR 108 Ca 0.02 0.49 -0.11 0.00 -1.01 0.00 0.00 57.07 56.46 2f3j s TYR 108 Cb -0.14 -3.83 0.03 0.00 -0.11 0.00 0.00 41.96 37.91 2f3j s TYR 108 CO -0.03 -2.54 1.11 0.16 -1.11 0.00 0.00 175.55 173.14 2f3j s ASP 109 N -4.63 5.16 0.58 2.29 1.47 -0.26 -4.89 116.67 116.39 2f3j s ASP 109 Ca 0.70 1.00 0.31 0.00 1.18 0.00 0.00 52.55 55.74 2f3j s ASP 109 Cb -0.07 -1.71 1.80 0.00 -0.34 0.00 0.00 42.92 42.59 2f3j s ASP 109 CO 0.52 -1.51 2.23 0.03 0.68 0.00 0.00 175.17 177.12 2f3j h ARG 110 N -0.76 0.00 -0.65 2.11 3.08 -1.97 0.11 114.38 116.30 2f3j h ARG 110 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.60 2f3j h ARG 110 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.33 2f3j h ARG 110 CO 0.64 0.03 0.00 0.43 -1.07 0.00 0.00 179.97 180.00 2f3j n SER 111 N -3.72 4.32 -2.68 7.04 7.64 -1.26 -4.92 113.62 120.04 2f3j n SER 111 Ca -0.03 -2.56 -0.19 0.00 1.01 0.00 0.00 58.87 57.10 2f3j n SER 111 Cb 0.12 -0.59 0.04 0.00 -1.01 0.00 0.00 64.21 62.77 2f3j n SER 111 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2f3j n GLY 112 N 0.70 -0.35 3.77 0.23 0.00 0.39 -5.02 105.19 104.92 2f3j n GLY 112 Ca 0.21 0.01 -0.23 0.00 0.00 0.00 0.00 46.02 46.01 2f3j n GLY 112 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2f3j s ARG 113 N -5.60 2.33 0.87 1.61 6.06 -1.26 -4.88 118.95 118.09 2f3j s ARG 113 Ca 0.29 -1.72 -0.12 0.00 -2.50 0.00 0.00 55.73 51.68 2f3j s ARG 113 Cb -0.13 -2.11 0.11 0.00 0.06 0.00 0.00 34.95 32.88 2f3j s ARG 113 CO 0.36 -0.11 1.08 0.43 -2.50 0.00 0.00 175.30 174.57 2f3j n SER 114 N -1.31 0.34 0.16 -2.12 7.64 -1.26 -1.10 113.62 115.97 2f3j n SER 114 Ca -0.00 0.48 0.00 0.00 1.01 0.00 0.00 58.87 60.36 2f3j n SER 114 Cb 0.63 -1.46 0.00 0.00 -1.01 0.00 0.00 64.21 62.38 2f3j n SER 114 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2f3j n LEU 115 N -3.49 -2.79 0.00 -3.43 7.94 -1.26 -4.50 117.00 109.47 2f3j n LEU 115 Ca 0.12 0.68 0.00 0.00 -1.11 0.00 0.00 56.01 55.70 2f3j n LEU 115 Cb 0.51 2.74 0.00 0.00 0.53 0.00 0.00 43.42 47.21 2f3j n LEU 115 CO 0.49 0.13 0.00 0.61 -1.11 0.00 0.00 177.39 177.51 2f3j n GLY 116 N -1.42 0.39 3.61 -3.96 0.00 -1.25 -4.77 105.19 97.79 2f3j n GLY 116 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2f3j n GLY 116 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2f3j s THR 117 N -2.00 3.50 0.31 2.61 2.01 -1.22 -4.63 115.64 116.24 2f3j s THR 117 Ca 0.00 0.53 0.08 0.00 0.31 0.00 0.00 61.69 62.61 2f3j s THR 117 Cb 0.00 -3.62 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 2f3j s THR 117 CO 0.00 -0.35 0.16 0.00 -0.69 0.00 0.00 174.62 173.73 2f3j s ALA 118 N 6.41 3.52 -0.26 7.40 0.00 -0.43 0.39 121.76 138.79 2f3j s ALA 118 Ca 0.79 -1.71 0.02 0.00 0.00 0.00 0.00 51.96 51.06 2f3j s ALA 118 Cb -0.24 -0.90 0.06 0.00 0.00 0.00 0.00 23.12 22.03 2f3j s ALA 118 CO 0.33 0.10 -0.10 0.34 0.00 0.00 0.00 175.76 176.43 2f3j s ASP 119 N -3.85 4.45 0.06 0.00 2.15 0.15 -1.40 116.67 118.24 2f3j s ASP 119 Ca 0.37 -1.33 0.03 0.00 0.43 0.00 0.00 52.55 52.04 2f3j s ASP 119 Cb -0.05 -1.57 -0.04 0.00 -0.30 0.00 0.00 42.92 40.96 2f3j s ASP 119 CO 0.23 -0.19 0.07 0.68 -0.17 0.00 0.00 175.17 175.79 2f3j s VAL 120 N 1.14 4.49 -0.03 1.11 -7.23 -0.68 0.21 120.40 119.41 2f3j s VAL 120 Ca -0.08 -0.73 0.01 0.00 -1.81 0.00 0.00 61.98 59.38 2f3j s VAL 120 Cb -0.20 -3.14 0.01 0.00 0.56 0.00 0.00 36.38 33.62 2f3j s VAL 120 CO -0.05 0.17 -0.04 -1.00 -0.31 0.00 0.00 175.10 173.87 2f3j s HIS 121 N -1.34 0.56 0.13 2.82 3.76 0.15 -0.45 115.29 120.91 2f3j s HIS 121 Ca 0.28 -0.12 0.05 0.00 -0.15 0.00 0.00 55.06 55.12 2f3j s HIS 121 Cb -0.12 -0.48 -0.04 0.00 1.11 0.00 0.00 32.58 33.05 2f3j s HIS 121 CO 0.20 -0.11 -0.12 -0.59 -0.85 0.00 0.00 174.74 173.27 2f3j s PHE 122 N 0.57 1.30 -1.54 1.40 -0.12 -0.95 -0.23 117.98 118.40 2f3j s PHE 122 Ca -0.07 -0.63 0.30 0.00 -0.05 0.00 0.00 56.93 56.48 2f3j s PHE 122 Cb -0.10 -0.67 1.56 0.00 -0.63 0.00 0.00 43.02 43.17 2f3j s PHE 122 CO -0.00 0.11 2.05 0.39 -0.05 0.00 0.00 175.22 177.72 2f3j n GLU 123 N 0.29 0.53 -3.70 1.99 4.71 -1.26 -1.64 120.64 121.55 2f3j n GLU 123 Ca -0.14 0.01 -0.39 0.00 -0.01 0.00 0.00 57.16 56.63 2f3j n GLU 123 Cb 0.58 -1.50 -0.12 0.00 -1.01 0.00 0.00 31.44 29.39 2f3j n GLU 123 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 2f3j s ARG 124 N -2.46 2.70 0.43 3.49 1.81 -1.26 -4.83 118.95 118.83 2f3j s ARG 124 Ca 0.31 -1.14 0.28 0.00 -1.72 0.00 0.00 55.73 53.46 2f3j s ARG 124 Cb 0.20 -3.54 0.87 0.00 -0.45 0.00 0.00 34.95 32.03 2f3j s ARG 124 CO 0.43 -0.67 1.79 -0.09 -0.68 0.00 0.00 175.30 176.08 2f3j h ARG 125 N 8.29 0.00 0.00 3.54 2.43 -1.89 -1.87 114.38 124.87 2f3j h ARG 125 Ca -0.24 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 2f3j h ARG 125 Cb 1.09 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 2f3j h ARG 125 CO 0.62 0.00 0.00 0.00 -1.51 0.00 0.00 179.97 179.08 2f3j n ALA 126 N -2.02 1.87 0.18 2.80 0.00 -1.26 -1.69 120.51 120.40 2f3j n ALA 126 Ca 0.03 0.02 0.10 0.00 0.00 0.00 0.00 53.44 53.59 2f3j n ALA 126 Cb 0.40 -1.39 0.11 0.00 0.00 0.00 0.00 19.45 18.57 2f3j n ALA 126 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2f3j h ASP 127 N 0.00 0.00 0.08 0.00 5.19 -1.75 0.36 116.42 120.31 2f3j h ASP 127 Ca 0.00 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2f3j h ASP 127 Cb 0.45 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.96 2f3j h ASP 127 CO 0.00 0.12 -0.04 0.00 -3.12 0.00 0.00 179.24 176.20 2f3j h ALA 128 N 1.88 -0.11 -1.18 3.45 0.00 -1.41 0.05 119.26 121.93 2f3j h ALA 128 Ca -0.01 -0.07 0.39 0.00 0.00 0.00 0.00 54.91 55.23 2f3j h ALA 128 Cb 1.10 0.04 -0.14 0.00 0.00 0.00 0.00 17.79 18.80 2f3j h ALA 128 CO 0.02 -0.11 0.73 1.25 0.00 0.00 0.00 179.25 181.14 2f3j h LEU 129 N -1.02 0.33 -0.11 0.00 6.46 -1.39 0.52 115.31 120.10 2f3j h LEU 129 Ca -0.01 0.16 -0.13 0.00 -0.12 0.00 0.00 57.88 57.78 2f3j h LEU 129 Cb 0.18 0.13 0.00 0.00 -0.73 0.00 0.00 40.66 40.25 2f3j h LEU 129 CO 0.02 -0.18 -0.44 0.50 -0.62 0.00 0.00 178.44 177.72 2f3j h LYS 130 N 0.16 0.50 -0.52 1.25 3.64 -0.27 -1.52 116.57 119.80 2f3j h LYS 130 Ca 0.78 -0.38 -0.08 0.00 -1.27 0.00 0.00 60.65 59.70 2f3j h LYS 130 Cb 2.23 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 34.10 2f3j h LYS 130 CO -0.49 1.01 -0.01 0.00 -2.27 0.00 0.00 179.45 177.69 2f3j h ALA 131 N 0.49 1.00 0.00 5.00 0.00 0.11 0.38 119.26 126.25 2f3j h ALA 131 Ca -0.02 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 2f3j h ALA 131 Cb 1.07 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 2f3j h ALA 131 CO 0.09 0.61 -0.01 0.00 0.00 0.00 0.00 179.25 179.94 2f3j h MET 132 N 0.82 0.00 0.00 0.00 -0.00 -0.04 0.14 114.93 115.86 2f3j h MET 132 Ca 0.15 0.00 -0.29 0.00 -0.00 0.00 0.00 59.70 59.57 2f3j h MET 132 Cb 0.50 0.00 -0.05 0.00 -0.00 0.00 0.00 31.60 32.05 2f3j h MET 132 CO 0.03 0.01 -2.06 1.63 -0.00 0.00 0.00 176.91 176.51 2f3j n LYS 133 N -3.10 0.66 -0.04 -0.10 4.01 -0.58 -4.32 118.16 114.70 2f3j n LYS 133 Ca 0.02 0.07 -0.04 0.00 -0.51 0.00 0.00 58.31 57.86 2f3j n LYS 133 Cb 0.43 -1.62 -0.01 0.00 -0.51 0.00 0.00 35.03 33.31 2f3j n LYS 133 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 2f3j n GLN 134 N -2.78 0.24 0.03 1.97 3.00 0.13 -4.76 117.38 115.20 2f3j n GLN 134 Ca -0.23 0.18 -0.05 0.00 -0.01 0.00 0.00 57.00 56.89 2f3j n GLN 134 Cb 1.03 -1.01 -0.10 0.00 0.00 0.00 0.00 30.24 30.16 2f3j n GLN 134 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.06 178.94 2f3j h TYR 135 N -0.47 0.00 -3.19 1.08 0.05 -1.24 -3.44 116.97 109.75 2f3j h TYR 135 Ca 0.00 0.00 -0.53 0.00 0.05 0.00 0.00 58.73 58.25 2f3j h TYR 135 Cb 0.41 0.00 0.06 0.00 1.01 0.00 0.00 36.73 38.21 2f3j h TYR 135 CO -0.18 0.83 0.82 0.21 -1.05 0.00 0.00 178.16 178.80 2f3j s LYS 136 N -2.75 4.22 0.00 4.88 2.20 0.33 -1.71 119.74 126.92 2f3j s LYS 136 Ca -0.02 2.38 0.00 0.00 -0.36 0.00 0.00 55.97 57.96 2f3j s LYS 136 Cb 0.09 -3.11 0.00 0.00 -1.51 0.00 0.00 37.83 33.30 2f3j s LYS 136 CO 0.81 -0.52 0.00 0.41 -0.36 0.00 0.00 175.35 175.69 2f3j n GLY 137 N 2.69 0.87 3.78 5.54 0.00 -1.26 -4.84 105.19 111.98 2f3j n GLY 137 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 2f3j n GLY 137 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f3j s VAL 138 N -3.46 4.86 0.00 1.61 1.01 -0.69 -4.99 120.40 118.74 2f3j s VAL 138 Ca 0.00 1.20 0.00 0.00 0.00 0.00 0.00 61.98 63.18 2f3j s VAL 138 Cb 0.00 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.48 2f3j s VAL 138 CO 0.00 0.47 0.00 -0.81 0.00 0.00 0.00 175.10 174.76 2f3j n PRO 139 N 2.34 0.87 -3.14 2.72 -0.04 -1.26 -2.34 135.00 134.15 2f3j n PRO 139 Ca -0.09 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.38 2f3j n PRO 139 Cb 0.51 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.96 2f3j n PRO 139 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2f3j s LEU 140 N 0.00 -1.38 0.00 1.53 2.96 0.13 -4.52 118.68 117.41 2f3j s LEU 140 Ca 0.00 -0.72 0.00 0.00 -0.22 0.00 0.00 54.13 53.19 2f3j s LEU 140 Cb 0.00 1.76 0.00 0.00 0.50 0.00 0.00 46.19 48.45 2f3j s LEU 140 CO 0.00 -0.15 0.00 -0.67 -1.32 0.00 0.00 176.35 174.21 2f3j n ASP 141 N 4.29 -3.31 -0.00 3.68 2.03 -1.26 -2.98 116.55 119.00 2f3j n ASP 141 Ca 0.10 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.41 2f3j n ASP 141 Cb 0.58 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.98 2f3j n ASP 141 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2f3j n GLY 142 N 0.00 0.00 2.80 0.27 0.00 -1.26 -4.21 105.19 102.79 2f3j n GLY 142 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2f3j n GLY 142 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2f3j s ARG 143 N -1.39 0.95 0.60 1.61 3.52 -1.16 -5.14 118.95 117.95 2f3j s ARG 143 Ca 0.00 -0.62 -0.16 0.00 -0.13 0.00 0.00 55.73 54.81 2f3j s ARG 143 Cb 0.00 -2.26 -0.03 0.00 -1.56 0.00 0.00 34.95 31.10 2f3j s ARG 143 CO 0.00 -0.64 1.09 -1.25 -0.81 0.00 0.00 175.30 173.69 2f3j s PRO 144 N 1.71 3.14 0.00 5.12 0.04 -1.26 -0.69 135.00 143.05 2f3j s PRO 144 Ca -0.02 1.38 0.00 0.00 0.04 0.00 0.00 61.00 62.40 2f3j s PRO 144 Cb -0.18 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.37 2f3j s PRO 144 CO -0.08 -0.98 0.00 0.00 0.04 0.00 0.00 177.00 175.98 2f3j n MET 145 N -1.97 1.32 -3.99 4.56 0.00 -0.99 -4.75 117.12 111.30 2f3j n MET 145 Ca 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 57.70 57.72 2f3j n MET 145 Cb 0.52 0.00 -0.09 0.00 0.00 0.00 0.00 33.22 33.65 2f3j n MET 145 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2f3j s ASP 146 N -1.00 0.32 0.12 3.17 2.15 0.58 -4.82 116.67 117.19 2f3j s ASP 146 Ca 0.00 -0.79 -0.26 0.00 0.43 0.00 0.00 52.55 51.94 2f3j s ASP 146 Cb 0.00 0.23 0.07 0.00 -0.30 0.00 0.00 42.92 42.92 2f3j s ASP 146 CO 0.00 -0.59 0.90 0.27 -0.17 0.00 0.00 175.17 175.58 2f3j s ILE 147 N -3.49 0.00 0.09 4.11 -0.00 -1.26 -1.80 121.20 118.86 2f3j s ILE 147 Ca 0.03 -0.48 -0.26 0.00 -0.00 0.00 0.00 60.65 59.94 2f3j s ILE 147 Cb 0.04 -1.68 0.08 0.00 -0.00 0.00 0.00 42.46 40.90 2f3j s ILE 147 CO -0.09 0.00 0.92 -1.10 -0.00 0.00 0.00 174.94 174.67 2f3j s GLN 148 N -3.31 1.06 -0.16 0.37 -0.21 -0.47 -4.87 119.66 112.07 2f3j s GLN 148 Ca 0.10 -0.51 -0.07 0.00 0.02 0.00 0.00 55.36 54.89 2f3j s GLN 148 Cb -0.02 0.41 0.07 0.00 1.00 0.00 0.00 33.01 34.47 2f3j s GLN 148 CO -0.01 -0.48 0.36 -0.51 -2.12 0.00 0.00 175.29 172.54 2f3j s LEU 149 N -2.75 -0.18 0.03 2.90 2.01 -1.26 -0.95 118.68 118.48 2f3j s LEU 149 Ca 0.09 0.81 0.05 0.00 0.01 0.00 0.00 54.13 55.09 2f3j s LEU 149 Cb -0.01 1.15 -0.02 0.00 0.01 0.00 0.00 46.19 47.32 2f3j s LEU 149 CO -0.03 -0.21 -0.14 -0.69 1.01 0.00 0.00 176.35 176.30 2f3j s VAL 150 N 1.83 1.10 -1.62 -1.59 1.01 0.20 -4.70 120.40 116.63 2f3j s VAL 150 Ca -0.06 -0.88 -0.03 0.00 0.00 0.00 0.00 61.98 61.01 2f3j s VAL 150 Cb -0.10 -0.97 0.01 0.00 0.00 0.00 0.00 36.38 35.31 2f3j s VAL 150 CO -0.11 0.08 0.33 0.00 0.00 0.00 0.00 175.10 175.40 2f3j n ALA 151 N 2.13 -0.83 -0.11 5.51 0.00 -1.26 -1.70 120.51 124.25 2f3j n ALA 151 Ca -0.17 0.22 -0.11 0.00 0.00 0.00 0.00 53.44 53.38 2f3j n ALA 151 Cb 0.55 -3.06 0.01 0.00 0.00 0.00 0.00 19.45 16.95 2f3j n ALA 151 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2f3j h SER 152 N -0.75 0.93 -0.06 0.00 4.64 -1.87 -3.13 113.55 113.30 2f3j h SER 152 Ca -0.50 -0.40 0.00 0.00 -0.47 0.00 0.00 61.79 60.41 2f3j h SER 152 Cb 1.36 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2f3j h SER 152 CO 0.56 1.18 0.00 0.00 -0.87 0.00 0.00 176.83 177.70 2f3j n GLN 153 N -4.07 1.99 -3.73 4.77 -0.00 -1.26 -4.68 117.38 110.40 2f3j n GLN 153 Ca -0.01 -1.36 -0.27 0.00 -0.00 0.00 0.00 57.00 55.36 2f3j n GLN 153 Cb 0.52 -1.06 -0.06 0.00 -0.00 0.00 0.00 30.24 29.64 2f3j n GLN 153 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.06 177.50 2f3j n ILE 154 N -0.16 -0.33 -0.05 -0.39 -5.35 -1.18 -4.81 119.36 107.09 2f3j n ILE 154 Ca 0.02 -0.17 -0.10 0.00 -0.27 0.00 0.00 62.75 62.23 2f3j n ILE 154 Cb 0.23 -0.52 -0.15 0.00 -1.74 0.00 0.00 39.64 37.46 2f3j n ILE 154 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 2f3j n ASP 155 N -1.74 0.75 0.04 7.28 2.03 -1.26 -4.21 116.55 119.44 2f3j n ASP 155 Ca -0.06 0.24 -0.11 0.00 0.52 0.00 0.00 54.79 55.38 2f3j n ASP 155 Cb 0.40 0.19 0.02 0.00 -0.72 0.00 0.00 41.12 41.01 2f3j n ASP 155 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 2f3j h LEU 156 N 0.01 0.54 -2.12 -2.67 -0.00 -1.99 -3.49 115.31 105.59 2f3j h LEU 156 Ca -0.39 -0.35 0.01 0.00 -0.00 0.00 0.00 57.88 57.14 2f3j h LEU 156 Cb 2.09 -0.16 -0.08 0.00 -0.00 0.00 0.00 40.66 42.51 2f3j h LEU 156 CO 0.06 1.10 -1.28 -0.62 -0.00 0.00 0.00 178.44 177.69 2f3j n GLU 157 N -3.86 -3.94 0.00 1.13 1.02 -1.26 -5.18 120.64 108.56 2f3j n GLU 157 Ca -0.05 3.05 0.00 0.00 -0.02 0.00 0.00 57.16 60.15 2f3j n GLU 157 Cb 0.71 -4.98 0.00 0.00 -0.02 0.00 0.00 31.44 27.14 2f3j n GLU 157 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03