#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 -1.17 0.00 -5.12 0.00 -1.26 -4.72 120.51 108.24 2f3j n ALA 2 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.67 2f3j n ALA 2 Cb 0.00 -4.19 0.00 0.00 0.00 0.00 0.00 19.45 15.26 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 -2.68 0.00 -1.58 0.00 2.03 -1.26 -4.90 116.55 108.16 2f3j n ASP 3 Ca -0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.30 2f3j n ASP 3 Cb 0.56 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.96 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 -0.85 0.60 -0.11 -0.67 5.02 -1.26 -3.30 118.16 117.59 2f3j n LYS 4 Ca 0.00 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.12 2f3j n LYS 4 Cb 0.00 -1.20 -0.13 0.00 -0.02 0.00 0.00 35.03 33.68 2f3j n LYS 4 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 2f3j n MET 5 N 1.53 0.67 -0.03 1.97 2.81 -1.26 -4.79 117.12 118.01 2f3j n MET 5 Ca 0.00 0.14 -0.08 0.00 -1.81 0.00 0.00 57.70 55.96 2f3j n MET 5 Cb 0.30 -1.55 -0.03 0.00 -0.71 0.00 0.00 33.22 31.24 2f3j n MET 5 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 2f3j n ASP 6 N -3.21 0.72 0.00 7.83 5.68 -1.21 -5.02 116.55 121.35 2f3j n ASP 6 Ca -0.42 0.12 0.00 0.00 -0.50 0.00 0.00 54.79 53.99 2f3j n ASP 6 Cb 1.02 -0.28 0.00 0.00 -1.14 0.00 0.00 41.12 40.72 2f3j n ASP 6 CO 0.00 0.00 0.00 0.23 -1.33 0.00 0.00 177.20 176.10 2f3j n MET 7 N -3.44 0.00 -2.20 0.11 2.81 -1.24 -4.60 117.12 108.56 2f3j n MET 7 Ca -0.14 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.33 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 0.43 1.51 0.00 0.00 175.97 177.91 2f3j n SER 8 N 2.74 4.68 -0.04 7.83 7.64 -1.26 -4.73 113.62 130.48 2f3j n SER 8 Ca 0.00 -3.00 -0.03 0.00 1.01 0.00 0.00 58.87 56.85 2f3j n SER 8 Cb 0.00 -1.57 0.20 0.00 -1.01 0.00 0.00 64.21 61.84 2f3j n SER 8 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2f3j h LEU 9 N 9.06 0.60 -1.15 -3.43 4.07 -1.99 -3.11 115.31 119.35 2f3j h LEU 9 Ca 0.45 -0.16 0.15 0.00 0.08 0.00 0.00 57.88 58.40 2f3j h LEU 9 Cb 0.67 -0.16 -0.08 0.00 1.08 0.00 0.00 40.66 42.17 2f3j h LEU 9 CO 1.67 0.74 0.60 -2.24 -1.08 0.00 0.00 178.44 178.14 2f3j h ASP 10 N 0.56 0.75 -0.40 -0.43 2.03 -1.98 0.40 116.42 117.35 2f3j h ASP 10 Ca 0.10 0.06 -0.14 0.00 -0.73 0.00 0.00 57.03 56.32 2f3j h ASP 10 Cb 0.52 -0.09 -0.01 0.00 -0.83 0.00 0.00 39.33 38.92 2f3j h ASP 10 CO 0.03 0.36 -0.27 -0.78 -1.03 0.00 0.00 179.24 177.55 2f3j h ASP 11 N 0.79 0.96 -0.17 4.15 3.58 -1.96 0.00 116.42 123.78 2f3j h ASP 11 Ca 0.49 -0.39 -0.07 0.00 0.42 0.00 0.00 57.03 57.49 2f3j h ASP 11 Cb 0.72 -0.27 -0.00 0.00 1.72 0.00 0.00 39.33 41.50 2f3j h ASP 11 CO -0.26 1.17 -0.17 0.40 -2.88 0.00 0.00 179.24 177.49 2f3j h ILE 12 N 0.79 1.34 -0.79 2.25 2.04 -1.21 -1.44 117.51 120.48 2f3j h ILE 12 Ca 0.09 -1.34 0.16 0.00 1.00 0.00 0.00 64.86 64.77 2f3j h ILE 12 Cb 0.84 1.84 -0.10 0.00 -0.74 0.00 0.00 36.82 38.66 2f3j h ILE 12 CO 0.07 0.40 0.31 0.40 0.00 0.00 0.00 178.15 179.33 2f3j h ILE 13 N 0.05 0.59 0.13 -0.67 2.04 -0.17 0.94 117.51 120.42 2f3j h ILE 13 Ca 0.03 -0.14 0.01 0.00 1.00 0.00 0.00 64.86 65.75 2f3j h ILE 13 Cb 0.71 0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 2f3j h ILE 13 CO 0.04 0.08 -0.19 0.11 0.00 0.00 0.00 178.15 178.19 2f3j h LYS 14 N 0.42 -0.36 0.00 2.37 1.79 -0.77 0.26 116.57 120.28 2f3j h LYS 14 Ca 0.45 0.02 -0.03 0.00 -2.18 0.00 0.00 60.65 58.92 2f3j h LYS 14 Cb 0.75 0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 31.47 2f3j h LYS 14 CO -0.45 -0.24 -0.13 1.25 -1.08 0.00 0.00 179.45 178.80 2f3j h LEU 15 N -0.37 0.00 -0.24 2.94 7.12 -0.09 -1.89 115.31 122.78 2f3j h LEU 15 Ca 0.02 0.00 -0.21 0.00 0.13 0.00 0.00 57.88 57.82 2f3j h LEU 15 Cb 0.38 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 40.51 2f3j h LEU 15 CO -0.09 0.13 -0.69 0.78 -0.13 0.00 0.00 178.44 178.45 2f3j h ASN 16 N 0.00 0.91 -0.04 1.25 2.35 0.16 0.59 115.58 120.80 2f3j h ASN 16 Ca -0.00 -0.56 -0.03 0.00 -0.55 0.00 0.00 56.30 55.16 2f3j h ASN 16 Cb 0.29 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 2f3j h ASN 16 CO 0.02 1.35 -0.05 0.03 -1.65 0.00 0.00 177.43 177.13 2f3j h ARG 17 N 0.57 0.23 0.00 0.81 3.08 0.26 -3.19 114.38 116.14 2f3j h ARG 17 Ca -0.03 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2f3j h ARG 17 Cb 1.30 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.31 2f3j h ARG 17 CO 0.14 0.30 0.00 -1.71 -1.07 0.00 0.00 179.97 177.63 2f3j n ASN 18 N -4.35 0.00 -1.89 7.04 5.15 -0.88 -4.93 115.26 115.39 2f3j n ASN 18 Ca -0.01 0.50 -0.16 0.00 -0.60 0.00 0.00 54.58 54.32 2f3j n ASN 18 Cb 0.20 -0.45 -0.04 0.00 -0.53 0.00 0.00 39.78 38.97 2f3j n ASN 18 CO 0.00 0.00 0.00 1.67 1.40 0.00 0.00 177.26 180.33 2f3j n GLN 19 N -1.84 -1.65 -3.50 1.20 -0.06 0.20 -4.93 117.38 106.81 2f3j n GLN 19 Ca 0.00 0.85 -0.42 0.00 -2.00 0.00 0.00 57.00 55.43 2f3j n GLN 19 Cb 0.00 -5.29 -0.07 0.00 -4.06 0.00 0.00 30.24 20.81 2f3j n GLN 19 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 2f3j s ARG 20 N -4.10 2.64 -0.89 3.69 3.00 -1.26 -4.97 118.95 117.06 2f3j s ARG 20 Ca 0.00 -1.81 -0.07 0.00 0.00 0.00 0.00 55.73 53.84 2f3j s ARG 20 Cb 0.00 -4.03 -0.10 0.00 0.00 0.00 0.00 34.95 30.82 2f3j s ARG 20 CO 0.00 -1.23 3.08 -2.13 0.00 0.00 0.00 175.30 175.02 2f3j n ARG 21 N 4.89 3.10 -4.25 3.54 0.63 -1.26 -4.79 116.66 118.51 2f3j n ARG 21 Ca -0.08 -2.00 -0.21 0.00 -0.92 0.00 0.00 57.85 54.64 2f3j n ARG 21 Cb 0.41 -2.42 -0.16 0.00 0.45 0.00 0.00 32.46 30.73 2f3j n ARG 21 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 2f3j s VAL 22 N 0.73 0.70 -1.37 5.15 -7.23 -1.26 -5.05 120.40 112.07 2f3j s VAL 22 Ca 0.65 -0.21 -0.11 0.00 -1.81 0.00 0.00 61.98 60.50 2f3j s VAL 22 Cb 0.25 -0.70 0.11 0.00 0.56 0.00 0.00 36.38 36.60 2f3j s VAL 22 CO -0.07 0.26 2.08 -3.20 -0.31 0.00 0.00 175.10 173.87 2f3j n ASN 23 N 4.04 4.92 -4.67 4.85 5.15 -1.26 -4.95 115.26 123.34 2f3j n ASN 23 Ca -0.23 -2.99 -0.40 0.00 -0.60 0.00 0.00 54.58 50.36 2f3j n ASN 23 Cb 0.51 -1.54 -0.05 0.00 -0.53 0.00 0.00 39.78 38.16 2f3j n ASN 23 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 2f3j s ARG 24 N 1.44 4.27 -0.20 1.20 3.52 -1.26 -4.93 118.95 123.00 2f3j s ARG 24 Ca 0.44 0.68 -0.04 0.00 -0.13 0.00 0.00 55.73 56.69 2f3j s ARG 24 Cb 0.12 -3.54 -0.11 0.00 -1.56 0.00 0.00 34.95 29.86 2f3j s ARG 24 CO -0.04 -0.17 -0.21 0.41 -0.81 0.00 0.00 175.30 174.48 2f3j n GLY 25 N 3.61 -0.29 0.00 8.12 0.00 -1.26 -5.13 105.19 110.24 2f3j n GLY 25 Ca -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 2.20 -1.75 0.00 -0.02 0.00 -1.26 -5.09 105.19 99.26 2f3j n GLY 26 Ca -0.36 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 43.62 2f3j n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f3j n GLY 27 N 0.00 0.77 3.81 -0.02 0.00 -1.26 -5.12 105.19 103.37 2f3j n GLY 27 Ca 0.00 -0.67 -0.31 0.00 0.00 0.00 0.00 46.02 45.04 2f3j n GLY 27 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2f3j s PRO 28 N -0.10 2.67 -0.68 1.61 0.04 -1.26 -5.01 135.00 132.26 2f3j s PRO 28 Ca 0.00 0.89 0.04 0.00 0.04 0.00 0.00 61.00 61.97 2f3j s PRO 28 Cb 0.00 -1.96 0.28 0.00 0.04 0.00 0.00 34.50 32.86 2f3j s PRO 28 CO 0.00 -1.27 0.92 0.54 0.04 0.00 0.00 177.00 177.23 2f3j n ARG 29 N -3.24 3.05 -1.36 4.56 3.00 -1.26 -5.03 116.66 116.38 2f3j n ARG 29 Ca 0.07 -4.72 0.00 0.00 -0.01 0.00 0.00 57.85 53.19 2f3j n ARG 29 Cb 0.54 -2.29 0.00 0.00 0.00 0.00 0.00 32.46 30.72 2f3j n ARG 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2f3j n ARG 30 N 0.54 2.63 -2.26 5.56 3.00 -1.26 -4.84 116.66 120.04 2f3j n ARG 30 Ca 0.31 0.00 -0.20 0.00 -0.01 0.00 0.00 57.85 57.95 2f3j n ARG 30 Cb 0.39 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.83 2f3j n ARG 30 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 2f3j n ASN 31 N -0.69 -5.60 0.00 0.55 2.85 -1.26 -4.92 115.26 106.20 2f3j n ASN 31 Ca 0.00 0.05 -0.11 0.00 -0.11 0.00 0.00 54.58 54.42 2f3j n ASN 31 Cb 0.00 -4.66 -0.08 0.00 1.24 0.00 0.00 39.78 36.27 2f3j n ASN 31 CO 0.00 0.00 0.00 -0.09 -2.11 0.00 0.00 177.26 175.06 2f3j h ARG 32 N 0.00 -0.11 0.00 1.20 2.43 -1.99 -2.40 114.38 113.51 2f3j h ARG 32 Ca -0.46 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 58.72 2f3j h ARG 32 Cb 1.34 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.91 2f3j h ARG 32 CO 0.56 0.43 -0.02 -1.00 -1.51 0.00 0.00 179.97 178.43 2f3j h PRO 33 N -0.87 0.00 -0.34 0.20 0.13 -2.01 -1.64 132.00 127.48 2f3j h PRO 33 Ca -0.01 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.94 2f3j h PRO 33 Cb 0.59 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.61 2f3j h PRO 33 CO 0.02 0.02 -0.11 0.00 -0.23 0.00 0.00 178.00 177.70 2f3j n ALA 34 N -2.26 4.32 0.24 -0.56 0.00 -1.24 -4.54 120.51 116.47 2f3j n ALA 34 Ca -0.03 -3.17 0.11 0.00 0.00 0.00 0.00 53.44 50.36 2f3j n ALA 34 Cb 0.10 -0.72 0.54 0.00 0.00 0.00 0.00 19.45 19.37 2f3j n ALA 34 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 2f3j h ILE 35 N 1.00 0.51 0.00 0.00 6.09 -0.75 -3.45 117.51 120.91 2f3j h ILE 35 Ca 0.22 -0.95 0.00 0.00 -1.37 0.00 0.00 64.86 62.76 2f3j h ILE 35 Cb 1.64 1.66 0.00 0.00 0.47 0.00 0.00 36.82 40.58 2f3j h ILE 35 CO 0.38 0.18 0.00 0.00 -3.07 0.00 0.00 178.15 175.64 2f3j n ALA 36 N -2.22 0.37 -3.36 0.18 0.00 -1.26 -5.10 120.51 109.12 2f3j n ALA 36 Ca -0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 2f3j n ALA 36 Cb 0.38 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.80 2f3j n ALA 36 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2f3j s ARG 37 N 0.58 1.20 0.00 0.00 3.03 -1.26 -5.18 118.95 117.32 2f3j s ARG 37 Ca 0.00 -0.41 0.00 0.00 2.03 0.00 0.00 55.73 57.35 2f3j s ARG 37 Cb 0.00 0.55 -0.00 0.00 -1.03 0.00 0.00 34.95 34.47 2f3j s ARG 37 CO 0.00 -0.50 0.00 0.41 -1.13 0.00 0.00 175.30 174.08 2f3j n GLY 38 N -0.15 3.78 2.41 3.88 0.00 -1.26 -5.04 105.19 108.81 2f3j n GLY 38 Ca -0.17 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.27 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 0.93 5.00 -0.02 0.00 -1.26 -4.97 105.19 104.86 2f3j n GLY 39 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.94 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 4.13 0.00 -2.61 1.61 5.12 -1.26 -4.64 116.66 119.01 2f3j n ARG 40 Ca 0.00 0.00 -0.43 0.00 -1.93 0.00 0.00 57.85 55.49 2f3j n ARG 40 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 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 2.71 4.97 0.07 0.55 5.15 -1.26 -3.94 115.26 123.51 2f3j n ASN 41 Ca 0.00 -2.97 0.00 0.00 -0.60 0.00 0.00 54.58 51.01 2f3j n ASN 41 Cb 0.00 -1.62 0.00 0.00 -0.53 0.00 0.00 39.78 37.63 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 6.26 0.00 0.00 1.20 0.63 -1.26 -4.88 116.66 118.61 2f3j n ARG 42 Ca 0.43 0.00 0.10 0.00 -0.92 0.00 0.00 57.85 57.46 2f3j n ARG 42 Cb 0.42 0.00 0.61 0.00 0.45 0.00 0.00 32.46 33.95 2f3j n ARG 42 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 2f3j n PRO 43 N -2.81 0.69 -4.64 -0.14 -0.02 -1.25 -4.66 135.00 122.17 2f3j n PRO 43 Ca 0.00 0.00 -0.26 0.00 -2.02 0.00 0.00 63.50 61.22 2f3j n PRO 43 Cb 0.00 -1.47 -0.17 0.00 -0.02 0.00 0.00 33.50 31.85 2f3j n PRO 43 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2f3j s ALA 44 N -2.00 1.38 0.12 3.55 0.00 -1.26 -4.78 121.76 118.77 2f3j s ALA 44 Ca 0.31 -0.49 -0.28 0.00 0.00 0.00 0.00 51.96 51.50 2f3j s ALA 44 Cb 0.14 -0.61 -0.08 0.00 0.00 0.00 0.00 23.12 22.58 2f3j s ALA 44 CO 0.24 0.12 1.61 -1.35 0.00 0.00 0.00 175.76 176.38 2f3j h PRO 45 N 6.98 -0.51 -2.20 0.00 0.11 -1.83 -3.39 132.00 131.15 2f3j h PRO 45 Ca -0.29 0.03 -0.42 0.00 0.11 0.00 0.00 66.00 65.43 2f3j h PRO 45 Cb 1.19 0.12 -0.34 0.00 0.11 0.00 0.00 31.00 32.08 2f3j h PRO 45 CO 0.47 -0.34 -0.72 -0.47 -0.21 0.00 0.00 178.00 176.74 2f3j s TYR 46 N -6.00 -0.07 0.00 0.65 6.14 -1.26 -4.97 117.35 111.84 2f3j s TYR 46 Ca -0.16 -0.84 0.00 0.00 0.64 0.00 0.00 57.07 56.71 2f3j s TYR 46 Cb 0.08 -0.57 0.00 0.00 0.42 0.00 0.00 41.96 41.89 2f3j s TYR 46 CO 0.65 -0.92 0.00 0.43 0.64 0.00 0.00 175.55 176.35 2f3j n SER 47 N 4.54 0.00 -3.84 4.32 7.64 -1.26 -4.71 113.62 120.31 2f3j n SER 47 Ca 0.07 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.82 2f3j n SER 47 Cb 0.43 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.49 2f3j n SER 47 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2f3j s ARG 48 N 0.00 -0.01 -0.29 1.43 1.81 -1.26 -4.85 118.95 115.78 2f3j s ARG 48 Ca 0.00 0.06 -0.29 0.00 -1.72 0.00 0.00 55.73 53.78 2f3j s ARG 48 Cb 0.00 -0.08 -0.01 0.00 -0.45 0.00 0.00 34.95 34.41 2f3j s ARG 48 CO 0.00 -0.06 1.46 -2.14 -0.68 0.00 0.00 175.30 173.89 2f3j s PRO 49 N 0.35 3.78 0.04 3.54 0.02 -1.26 -4.60 135.00 136.88 2f3j s PRO 49 Ca -0.03 1.36 0.05 0.00 0.02 0.00 0.00 61.00 62.39 2f3j s PRO 49 Cb -0.04 -3.98 -0.04 0.00 0.02 0.00 0.00 34.50 30.46 2f3j s PRO 49 CO -0.01 -1.30 -0.08 -1.59 -0.33 0.00 0.00 177.00 173.70 2f3j s LYS 50 N 4.56 2.41 -0.25 5.54 0.00 -1.26 -5.07 119.74 125.67 2f3j s LYS 50 Ca 0.64 -0.83 -0.23 0.00 0.00 0.00 0.00 55.97 55.55 2f3j s LYS 50 Cb -0.19 -2.43 -0.01 0.00 0.00 0.00 0.00 37.83 35.19 2f3j s LYS 50 CO 0.27 0.57 0.76 -1.25 0.00 0.00 0.00 175.35 175.70 2f3j s PRO 51 N -1.74 4.14 -0.40 1.78 0.04 -1.26 -4.97 135.00 132.59 2f3j s PRO 51 Ca 0.19 0.78 0.11 0.00 0.04 0.00 0.00 61.00 62.11 2f3j s PRO 51 Cb -0.11 -3.66 0.33 0.00 0.04 0.00 0.00 34.50 31.10 2f3j s PRO 51 CO 0.10 -0.50 0.70 1.47 0.04 0.00 0.00 177.00 178.82 2f3j n LEU 52 N 5.93 1.04 0.00 -3.56 -0.00 -1.26 -5.08 117.00 114.07 2f3j n LEU 52 Ca 0.03 -5.01 0.00 0.00 -0.00 0.00 0.00 56.01 51.04 2f3j n LEU 52 Cb 0.48 0.57 0.00 0.00 -0.00 0.00 0.00 43.42 44.47 2f3j n LEU 52 CO 0.46 2.25 0.00 -0.81 -0.00 0.00 0.00 177.39 179.29 2f3j n PRO 53 N 0.48 3.47 -1.52 1.47 -0.04 -1.26 -4.88 135.00 132.73 2f3j n PRO 53 Ca 0.25 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.31 2f3j n PRO 53 Cb 0.61 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 34.05 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 7.83 -3.48 3.54 2.03 -1.26 -4.61 116.55 120.60 2f3j n ASP 54 Ca 0.00 -2.72 -0.27 0.00 0.52 0.00 0.00 54.79 52.32 2f3j n ASP 54 Cb 0.00 -1.54 -0.10 0.00 -0.72 0.00 0.00 41.12 38.76 2f3j n ASP 54 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2f3j s LYS 55 N 1.71 1.18 0.00 -0.67 3.01 -1.26 -4.99 119.74 118.72 2f3j s LYS 55 Ca 0.63 -2.33 0.00 0.00 -1.01 0.00 0.00 55.97 53.26 2f3j s LYS 55 Cb 0.17 -1.77 0.00 0.00 -1.01 0.00 0.00 37.83 35.22 2f3j s LYS 55 CO -0.07 -1.37 0.00 0.91 0.51 0.00 0.00 175.35 175.33 2f3j n TRP 56 N 2.68 0.00 -1.63 3.18 7.02 -1.26 -4.83 117.44 122.61 2f3j n TRP 56 Ca 0.28 0.00 -0.36 0.00 -1.02 0.00 0.00 57.50 56.40 2f3j n TRP 56 Cb 0.46 0.00 0.05 0.00 -2.42 0.00 0.00 31.31 29.39 2f3j n TRP 56 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2f3j n GLN 57 N -0.25 2.65 0.00 -0.99 0.00 -1.26 -4.92 117.38 112.61 2f3j n GLN 57 Ca 0.00 -3.24 0.00 0.00 0.00 0.00 0.00 57.00 53.76 2f3j n GLN 57 Cb 0.00 -2.23 0.00 0.00 0.00 0.00 0.00 30.24 28.01 2f3j n GLN 57 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.06 178.64 2f3j n HIS 58 N -0.51 0.00 0.12 2.61 -0.00 -1.26 -2.83 115.22 113.36 2f3j n HIS 58 Ca 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 58.27 2f3j n HIS 58 Cb 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.42 2f3j n HIS 58 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 2f3j n ASP 59 N 2.46 -0.37 0.00 0.26 5.68 -1.26 -4.87 116.55 118.44 2f3j n ASP 59 Ca 0.00 0.43 0.00 0.00 -0.50 0.00 0.00 54.79 54.72 2f3j n ASP 59 Cb 0.00 0.54 0.00 0.00 -1.14 0.00 0.00 41.12 40.52 2f3j n ASP 59 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 2f3j n LEU 60 N -3.29 0.00 -1.02 -2.12 0.00 -1.13 -4.92 117.00 104.52 2f3j n LEU 60 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 56.01 56.00 2f3j n LEU 60 Cb 0.00 0.00 0.21 0.00 0.00 0.00 0.00 43.42 43.63 2f3j n LEU 60 CO 0.00 0.00 0.66 0.49 0.00 0.00 0.00 177.39 178.54 2f3j n PHE 61 N 0.00 0.92 -4.71 1.96 3.01 -1.26 -5.01 117.46 112.37 2f3j n PHE 61 Ca 0.00 -1.45 0.00 0.00 1.01 0.00 0.00 57.45 57.01 2f3j n PHE 61 Cb 0.00 -0.43 0.00 0.00 -0.01 0.00 0.00 39.48 39.04 2f3j n PHE 61 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 2f3j n ASP 62 N -1.05 -1.98 -0.53 4.37 -0.08 -1.26 -1.64 116.55 114.39 2f3j n ASP 62 Ca 0.29 0.00 0.12 0.00 -1.51 0.00 0.00 54.79 53.69 2f3j n ASP 62 Cb 0.97 0.00 0.43 0.00 2.34 0.00 0.00 41.12 44.85 2f3j n ASP 62 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2f3j n SER 63 N -2.10 1.60 0.00 1.67 7.64 -1.26 -4.65 113.62 116.51 2f3j n SER 63 Ca 0.00 -1.63 0.00 0.00 1.01 0.00 0.00 58.87 58.25 2f3j n SER 63 Cb 0.00 -0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.13 2f3j n SER 63 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2f3j n GLY 64 N 1.14 -1.05 3.56 0.23 0.00 -1.23 -5.07 105.19 102.76 2f3j n GLY 64 Ca 0.17 0.33 -0.42 0.00 0.00 0.00 0.00 46.02 46.10 2f3j n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f3j n GLY 66 N 5.38 -1.03 0.00 0.00 0.00 -1.26 -5.01 105.19 103.27 2f3j n GLY 66 Ca 0.49 0.57 0.00 0.00 0.00 0.00 0.00 46.02 47.08 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 0.00 5.25 3.57 -0.02 0.00 -1.26 -5.09 105.19 107.65 2f3j n GLY 67 Ca 0.00 -1.31 -0.42 0.00 0.00 0.00 0.00 46.02 44.29 2f3j n GLY 67 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2f3j s GLY 68 N 0.00 0.93 0.00 -0.02 0.00 -1.26 -4.84 107.32 102.13 2f3j s GLY 68 Ca 0.00 -0.79 0.28 0.00 0.00 0.00 0.00 44.72 44.21 2f3j s GLY 68 CO 0.00 2.73 1.91 -2.21 0.00 0.00 0.00 173.10 175.53 2f3j n GLU 69 N 8.70 0.06 -0.90 2.90 2.13 -1.26 -4.88 120.64 127.39 2f3j n GLU 69 Ca 0.11 0.02 0.00 0.00 0.66 0.00 0.00 57.16 57.94 2f3j n GLU 69 Cb 0.49 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.70 2f3j n GLU 69 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2f3j n GLY 70 N 1.36 0.52 0.20 8.31 0.00 -1.26 -4.90 105.19 109.41 2f3j n GLY 70 Ca 0.08 -0.29 0.09 0.00 0.00 0.00 0.00 46.02 45.90 2f3j n GLY 70 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2f3j h VAL 71 N 0.00 0.34 0.00 1.61 3.04 -1.98 -3.24 116.25 116.03 2f3j h VAL 71 Ca 0.00 -1.39 -0.18 0.00 -1.01 0.00 0.00 66.70 64.12 2f3j h VAL 71 Cb 0.00 2.09 -0.03 0.00 -2.01 0.00 0.00 31.29 31.34 2f3j h VAL 71 CO 0.00 0.19 -1.90 -0.62 -1.01 0.00 0.00 177.57 174.23 2f3j n GLU 72 N -3.17 0.65 -1.74 4.17 4.71 -1.26 -4.56 120.64 119.45 2f3j n GLU 72 Ca 0.03 0.02 -0.42 0.00 -0.01 0.00 0.00 57.16 56.78 2f3j n GLU 72 Cb 0.58 -1.63 -0.00 0.00 -1.01 0.00 0.00 31.44 29.38 2f3j n GLU 72 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 2f3j n THR 73 N -2.65 3.56 -4.33 2.62 -2.24 -1.22 -4.87 114.28 105.14 2f3j n THR 73 Ca -0.16 -3.06 -0.16 0.00 -2.27 0.00 0.00 64.05 58.40 2f3j n THR 73 Cb 0.86 -2.60 -0.04 0.00 -2.10 0.00 0.00 70.33 66.45 2f3j n THR 73 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2f3j n GLY 74 N 3.99 3.62 3.13 3.38 0.00 -1.26 -4.78 105.19 113.26 2f3j n GLY 74 Ca 0.53 -2.09 -0.33 0.00 0.00 0.00 0.00 46.02 44.13 2f3j n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f3j s ALA 75 N -2.65 2.47 -0.31 4.61 0.00 0.16 -4.67 121.76 121.37 2f3j s ALA 75 Ca 0.10 -1.39 -0.11 0.00 0.00 0.00 0.00 51.96 50.56 2f3j s ALA 75 Cb 0.01 -1.39 -0.02 0.00 0.00 0.00 0.00 23.12 21.71 2f3j s ALA 75 CO 0.07 -0.64 0.19 0.21 0.00 0.00 0.00 175.76 175.59 2f3j s LYS 76 N 1.26 3.53 -0.22 0.00 2.20 -0.68 -1.34 119.74 124.50 2f3j s LYS 76 Ca 0.01 -0.60 -0.07 0.00 -0.36 0.00 0.00 55.97 54.95 2f3j s LYS 76 Cb -0.15 -3.66 -0.03 0.00 -1.51 0.00 0.00 37.83 32.48 2f3j s LYS 76 CO -0.09 -0.37 0.05 -1.17 -0.36 0.00 0.00 175.35 173.42 2f3j s LEU 77 N 1.68 3.53 -0.33 5.43 1.98 0.68 0.72 118.68 132.37 2f3j s LEU 77 Ca 0.06 -0.11 -0.01 0.00 -2.89 0.00 0.00 54.13 51.17 2f3j s LEU 77 Cb -0.17 -1.92 0.07 0.00 0.66 0.00 0.00 46.19 44.84 2f3j s LEU 77 CO 0.09 0.06 0.06 -0.76 -1.89 0.00 0.00 176.35 173.90 2f3j s LEU 78 N 1.06 4.36 -0.16 -0.68 1.43 0.15 -1.29 118.68 123.56 2f3j s LEU 78 Ca 0.04 -1.58 -0.05 0.00 -1.03 0.00 0.00 54.13 51.51 2f3j s LEU 78 Cb -0.14 -1.73 -0.03 0.00 0.03 0.00 0.00 46.19 44.31 2f3j s LEU 78 CO 0.03 -0.35 0.01 0.68 0.23 0.00 0.00 176.35 176.95 2f3j s VAL 79 N 1.18 4.36 -0.28 -1.59 -7.23 -0.47 -1.08 120.40 115.29 2f3j s VAL 79 Ca 0.00 -0.19 0.00 0.00 -1.81 0.00 0.00 61.98 59.98 2f3j s VAL 79 Cb -0.21 -2.93 0.08 0.00 0.56 0.00 0.00 36.38 33.89 2f3j s VAL 79 CO -0.03 0.49 0.04 -0.44 -0.31 0.00 0.00 175.10 174.86 2f3j s SER 80 N 0.21 4.01 0.00 4.85 0.01 0.25 -0.17 113.70 122.86 2f3j s SER 80 Ca 0.01 -1.53 0.00 0.00 1.31 0.00 0.00 55.95 55.75 2f3j s SER 80 Cb -0.13 -1.07 0.00 0.00 0.21 0.00 0.00 66.02 65.03 2f3j s SER 80 CO 0.02 -0.35 0.00 -3.20 0.41 0.00 0.00 173.24 170.12 2f3j n ASN 81 N 4.70 0.00 0.00 2.44 2.85 -1.22 0.02 115.26 124.04 2f3j n ASN 81 Ca -0.04 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.43 2f3j n ASN 81 Cb 0.43 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.45 2f3j n ASN 81 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 2f3j n LEU 82 N 0.00 0.00 0.00 1.20 7.94 -0.33 -4.65 117.00 121.15 2f3j n LEU 82 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 2f3j n LEU 82 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 2f3j n LEU 82 CO 0.00 0.00 0.00 -0.67 -1.11 0.00 0.00 177.39 175.61 2f3j n ASP 83 N 0.00 -1.27 0.02 1.96 2.03 -1.26 -3.37 116.55 114.66 2f3j n ASP 83 Ca 0.00 0.00 0.12 0.00 0.52 0.00 0.00 54.79 55.43 2f3j n ASP 83 Cb 0.00 0.00 0.23 0.00 -0.72 0.00 0.00 41.12 40.63 2f3j n ASP 83 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 2f3j n PHE 84 N 0.00 0.18 0.00 -0.67 7.35 -1.26 -4.93 117.46 118.13 2f3j n PHE 84 Ca 0.00 0.05 0.00 0.00 -0.76 0.00 0.00 57.45 56.74 2f3j n PHE 84 Cb 0.00 -0.39 0.00 0.00 0.35 0.00 0.00 39.48 39.44 2f3j n PHE 84 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2f3j n GLY 85 N 1.44 1.97 3.54 7.13 0.00 -1.22 -5.10 105.19 112.95 2f3j n GLY 85 Ca 0.05 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 2f3j n GLY 85 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f3j s VAL 86 N 0.00 4.73 0.87 1.61 1.01 -1.26 -5.05 120.40 122.31 2f3j s VAL 86 Ca 0.00 0.38 -0.11 0.00 0.00 0.00 0.00 61.98 62.24 2f3j s VAL 86 Cb 0.00 -4.26 0.16 0.00 0.00 0.00 0.00 36.38 32.28 2f3j s VAL 86 CO 0.00 -0.63 1.21 -0.44 0.00 0.00 0.00 175.10 175.24 2f3j s SER 87 N 2.05 3.66 0.18 3.32 0.01 -1.26 -4.91 113.70 116.75 2f3j s SER 87 Ca 0.27 0.18 -0.13 0.00 1.31 0.00 0.00 55.95 57.59 2f3j s SER 87 Cb -0.13 -0.39 0.17 0.00 0.21 0.00 0.00 66.02 65.88 2f3j s SER 87 CO 0.21 -2.37 1.75 -0.78 0.41 0.00 0.00 173.24 172.45 2f3j h ASP 88 N -1.25 0.18 1.61 2.44 3.58 -1.96 -1.25 116.42 119.78 2f3j h ASP 88 Ca -0.43 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.08 2f3j h ASP 88 Cb 1.26 0.04 0.00 0.00 1.72 0.00 0.00 39.33 42.35 2f3j h ASP 88 CO 0.43 0.13 0.00 0.00 -2.88 0.00 0.00 179.24 176.92 2f3j h ALA 89 N 1.33 1.00 0.47 -0.78 0.00 -1.93 -3.28 119.26 116.06 2f3j h ALA 89 Ca 0.24 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 2f3j h ALA 89 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2f3j h ALA 89 CO -0.24 0.00 -0.22 -0.44 0.00 0.00 0.00 179.25 178.35 2f3j h ASP 90 N 0.00 -0.53 -0.23 0.00 3.32 -1.58 0.18 116.42 117.59 2f3j h ASP 90 Ca 0.00 0.02 0.07 0.00 0.02 0.00 0.00 57.03 57.13 2f3j h ASP 90 Cb 0.81 0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.48 2f3j h ASP 90 CO 0.00 -0.35 0.18 -0.29 -1.72 0.00 0.00 179.24 177.06 2f3j h ILE 91 N -0.69 0.75 -0.20 0.35 6.09 -1.70 0.74 117.51 122.85 2f3j h ILE 91 Ca -0.06 0.00 -0.06 0.00 -1.37 0.00 0.00 64.86 63.37 2f3j h ILE 91 Cb 0.48 0.87 -0.01 0.00 0.47 0.00 0.00 36.82 38.64 2f3j h ILE 91 CO 0.11 0.00 -0.10 -0.61 -3.07 0.00 0.00 178.15 174.47 2f3j h GLN 92 N 0.00 0.42 -0.44 2.19 4.15 -1.56 -1.83 115.11 118.04 2f3j h GLN 92 Ca 0.11 -0.19 -0.07 0.00 0.77 0.00 0.00 58.65 59.27 2f3j h GLN 92 Cb 0.47 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.13 2f3j h GLN 92 CO -0.00 0.72 -0.01 0.93 -1.93 0.00 0.00 178.83 178.54 2f3j h GLU 93 N 0.12 0.71 0.40 1.69 4.39 0.43 -1.02 114.58 121.30 2f3j h GLU 93 Ca 0.04 -0.18 -0.02 0.00 0.34 0.00 0.00 59.36 59.54 2f3j h GLU 93 Cb 0.59 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 2f3j h GLU 93 CO 0.03 0.73 -0.19 -0.07 -1.16 0.00 0.00 179.01 178.35 2f3j h LEU 94 N 0.67 -0.45 -2.00 1.33 4.07 -0.72 0.43 115.31 118.64 2f3j h LEU 94 Ca 0.13 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.11 2f3j h LEU 94 Cb 0.43 0.12 0.00 0.00 1.08 0.00 0.00 40.66 42.28 2f3j h LEU 94 CO 0.02 -0.32 0.01 -0.26 -1.08 0.00 0.00 178.44 176.80 2f3j h PHE 95 N -0.54 0.00 -0.09 1.13 0.04 -1.38 0.28 116.94 116.39 2f3j h PHE 95 Ca -0.05 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.59 2f3j h PHE 95 Cb 0.41 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.56 2f3j h PHE 95 CO 0.14 0.00 -0.42 0.00 -0.60 0.00 0.00 178.31 177.42 2f3j h ALA 96 N 1.98 0.17 -0.98 2.45 0.00 -0.83 -2.14 119.26 119.91 2f3j h ALA 96 Ca 0.00 -0.48 0.06 0.00 0.00 0.00 0.00 54.91 54.49 2f3j h ALA 96 Cb 0.01 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 2f3j h ALA 96 CO 0.00 0.30 0.63 1.49 0.00 0.00 0.00 179.25 181.67 2f3j h GLU 97 N 0.00 1.13 0.00 0.00 4.22 0.81 -0.18 114.58 120.56 2f3j h GLU 97 Ca -0.03 -0.07 0.00 0.00 0.08 0.00 0.00 59.36 59.34 2f3j h GLU 97 Cb 1.07 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.07 2f3j h GLU 97 CO 0.09 0.75 0.00 0.34 -2.18 0.00 0.00 179.01 178.00 2f3j n PHE 98 N -4.51 0.00 0.00 0.92 -0.00 0.81 -4.94 117.46 109.74 2f3j n PHE 98 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.60 2f3j n PHE 98 Cb 0.17 -0.08 0.00 0.00 -0.00 0.00 0.00 39.48 39.57 2f3j n PHE 98 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2f3j n GLY 99 N -0.47 1.16 2.95 7.13 0.00 -0.08 -5.00 105.19 110.88 2f3j n GLY 99 Ca 0.06 -0.65 -0.28 0.00 0.00 0.00 0.00 46.02 45.15 2f3j n GLY 99 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2f3j s THR 100 N 0.00 1.19 -0.34 2.61 -4.23 -1.21 -4.57 115.64 109.09 2f3j s THR 100 Ca 0.00 -0.40 0.01 0.00 -1.18 0.00 0.00 61.69 60.12 2f3j s THR 100 Cb 0.00 -1.17 0.09 0.00 1.34 0.00 0.00 72.50 72.76 2f3j s THR 100 CO 0.00 0.39 0.06 -0.22 -0.54 0.00 0.00 174.62 174.31 2f3j s LEU 101 N 1.57 4.54 0.01 4.79 2.96 -1.26 -4.86 118.68 126.43 2f3j s LEU 101 Ca 0.03 -1.83 -0.12 0.00 -0.22 0.00 0.00 54.13 52.00 2f3j s LEU 101 Cb -0.13 -1.69 -0.06 0.00 0.50 0.00 0.00 46.19 44.81 2f3j s LEU 101 CO -0.08 -0.37 0.97 0.11 -1.32 0.00 0.00 176.35 175.65 2f3j h LYS 102 N 7.84 -0.40 -5.46 1.98 1.79 -1.97 -3.46 116.57 116.88 2f3j h LYS 102 Ca -0.12 0.03 -0.53 0.00 -2.18 0.00 0.00 60.65 57.85 2f3j h LYS 102 Cb 1.04 0.09 -0.30 0.00 -1.58 0.00 0.00 32.23 31.48 2f3j h LYS 102 CO 0.56 -0.27 -0.83 -1.59 -1.08 0.00 0.00 179.45 176.25 2f3j s LYS 103 N -3.55 1.38 -0.00 3.15 -2.85 -0.68 -5.00 119.74 112.20 2f3j s LYS 103 Ca -0.06 -0.58 -0.20 0.00 -1.00 0.00 0.00 55.97 54.14 2f3j s LYS 103 Cb 0.01 -1.31 0.04 0.00 -2.06 0.00 0.00 37.83 34.51 2f3j s LYS 103 CO 0.18 0.32 0.43 0.00 0.10 0.00 0.00 175.35 176.39 2f3j s ALA 104 N -0.29 -1.09 -0.11 0.59 0.00 -1.26 0.14 121.76 119.74 2f3j s ALA 104 Ca 0.04 0.54 -0.30 0.00 0.00 0.00 0.00 51.96 52.24 2f3j s ALA 104 Cb -0.07 0.16 0.10 0.00 0.00 0.00 0.00 23.12 23.31 2f3j s ALA 104 CO -0.00 -0.36 0.87 0.00 0.00 0.00 0.00 175.76 176.27 2f3j s ALA 105 N -1.71 -1.86 0.39 0.00 0.00 -0.42 -4.95 121.76 113.21 2f3j s ALA 105 Ca -0.10 1.46 0.08 0.00 0.00 0.00 0.00 51.96 53.39 2f3j s ALA 105 Cb -0.02 -0.39 -0.00 0.00 0.00 0.00 0.00 23.12 22.70 2f3j s ALA 105 CO 0.03 -0.35 0.49 0.14 0.00 0.00 0.00 175.76 176.08 2f3j s VAL 106 N -1.21 3.26 0.16 0.00 -7.23 -1.26 0.47 120.40 114.58 2f3j s VAL 106 Ca -0.05 -1.08 -0.04 0.00 -1.81 0.00 0.00 61.98 58.99 2f3j s VAL 106 Cb -0.00 -3.12 -0.03 0.00 0.56 0.00 0.00 36.38 33.79 2f3j s VAL 106 CO 0.05 -0.05 0.17 -0.62 -0.31 0.00 0.00 175.10 174.33 2f3j s ASP 107 N -4.24 0.17 0.35 4.85 -1.08 0.32 -4.85 116.67 112.19 2f3j s ASP 107 Ca 0.50 -1.11 -0.06 0.00 -0.52 0.00 0.00 52.55 51.36 2f3j s ASP 107 Cb -0.08 0.37 0.02 0.00 -1.46 0.00 0.00 42.92 41.77 2f3j s ASP 107 CO 0.31 -0.83 0.56 -0.31 0.52 0.00 0.00 175.17 175.43 2f3j s TYR 108 N -4.04 0.80 0.48 -5.34 2.02 -1.26 -1.26 117.35 108.75 2f3j s TYR 108 Ca 0.24 -1.15 -0.05 0.00 -0.37 0.00 0.00 57.07 55.74 2f3j s TYR 108 Cb 0.06 0.17 -0.04 0.00 -0.40 0.00 0.00 41.96 41.75 2f3j s TYR 108 CO 0.03 -1.26 0.79 0.34 -1.57 0.00 0.00 175.55 173.88 2f3j s ASP 109 N -3.19 6.26 0.19 2.29 -1.08 -1.26 -4.95 116.67 114.93 2f3j s ASP 109 Ca 0.26 0.93 -0.13 0.00 -0.52 0.00 0.00 52.55 53.09 2f3j s ASP 109 Cb -0.02 -2.25 0.20 0.00 -1.46 0.00 0.00 42.92 39.39 2f3j s ASP 109 CO 0.18 -0.58 1.69 0.03 0.52 0.00 0.00 175.17 177.01 2f3j h ARG 110 N 0.23 0.13 -0.14 4.34 -0.00 -2.02 -0.20 114.38 116.72 2f3j h ARG 110 Ca -0.47 -0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.00 2f3j h ARG 110 Cb 1.20 -0.03 0.00 0.00 0.00 0.00 0.00 29.97 31.15 2f3j h ARG 110 CO 0.62 0.09 0.00 -1.13 0.00 0.00 0.00 179.97 179.54 2f3j n SER 111 N -5.21 2.04 -2.33 7.04 3.41 -1.26 -4.94 113.62 112.36 2f3j n SER 111 Ca 0.06 -1.72 -0.06 0.00 -0.26 0.00 0.00 58.87 56.88 2f3j n SER 111 Cb 0.27 -0.08 0.03 0.00 -0.26 0.00 0.00 64.21 64.17 2f3j n SER 111 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2f3j n GLY 112 N 1.23 -0.18 0.00 5.00 0.00 -0.09 -5.03 105.19 106.12 2f3j n GLY 112 Ca 0.17 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.33 2f3j n GLY 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f3j n ARG 113 N -2.21 0.00 0.00 1.61 1.74 -1.26 -4.92 116.66 111.62 2f3j n ARG 113 Ca -0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 2f3j n ARG 113 Cb 0.55 -0.62 0.00 0.00 -1.02 0.00 0.00 32.46 31.37 2f3j n ARG 113 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2f3j n SER 114 N -0.33 0.00 0.00 0.55 7.64 -1.26 -5.04 113.62 115.18 2f3j n SER 114 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2f3j n SER 114 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2f3j n SER 114 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2f3j n LEU 115 N 0.00 0.00 -0.82 -3.43 -0.00 -1.26 -4.72 117.00 106.77 2f3j n LEU 115 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2f3j n LEU 115 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2f3j n LEU 115 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.00 2f3j n GLY 116 N 0.00 0.89 3.78 1.47 0.00 -1.26 -1.19 105.19 108.88 2f3j n GLY 116 Ca 0.00 -0.51 -0.31 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.53 3.48 -0.17 2.61 2.01 -0.39 -3.81 115.64 116.84 2f3j s THR 117 Ca 0.00 0.48 -0.24 0.00 0.31 0.00 0.00 61.69 62.24 2f3j s THR 117 Cb 0.00 -3.02 0.06 0.00 0.01 0.00 0.00 72.50 69.55 2f3j s THR 117 CO 0.00 -0.63 0.62 0.00 -0.69 0.00 0.00 174.62 173.92 2f3j s ALA 118 N -2.94 -1.55 -0.33 7.40 0.00 0.76 0.12 121.76 125.22 2f3j s ALA 118 Ca 0.60 1.54 -0.05 0.00 0.00 0.00 0.00 51.96 54.06 2f3j s ALA 118 Cb -0.16 -0.68 0.05 0.00 0.00 0.00 0.00 23.12 22.33 2f3j s ALA 118 CO 0.56 -0.31 0.08 0.34 0.00 0.00 0.00 175.76 176.42 2f3j s ASP 119 N -0.20 5.18 0.05 0.00 -1.08 0.18 -1.36 116.67 119.42 2f3j s ASP 119 Ca -0.04 -1.25 0.05 0.00 -0.52 0.00 0.00 52.55 50.79 2f3j s ASP 119 Cb -0.03 -1.82 -0.04 0.00 -1.46 0.00 0.00 42.92 39.58 2f3j s ASP 119 CO 0.04 -0.32 -0.10 0.68 0.52 0.00 0.00 175.17 175.98 2f3j s VAL 120 N 1.34 3.41 -0.12 1.11 -7.23 -0.41 -1.30 120.40 117.20 2f3j s VAL 120 Ca -0.02 -1.02 -0.00 0.00 -1.81 0.00 0.00 61.98 59.13 2f3j s VAL 120 Cb -0.20 -2.52 0.02 0.00 0.56 0.00 0.00 36.38 34.25 2f3j s VAL 120 CO 0.01 0.28 -0.08 -1.00 -0.31 0.00 0.00 175.10 174.00 2f3j s HIS 121 N -1.06 1.55 0.16 2.82 3.76 0.36 -0.23 115.29 122.65 2f3j s HIS 121 Ca 0.18 -0.79 0.04 0.00 -0.15 0.00 0.00 55.06 54.35 2f3j s HIS 121 Cb -0.11 -1.27 -0.04 0.00 1.11 0.00 0.00 32.58 32.27 2f3j s HIS 121 CO 0.09 -0.53 0.17 -0.06 -0.85 0.00 0.00 174.74 173.56 2f3j s PHE 122 N 1.68 3.22 -0.44 1.40 0.08 -0.45 -1.69 117.98 121.78 2f3j s PHE 122 Ca 0.05 0.01 0.24 0.00 0.12 0.00 0.00 56.93 57.35 2f3j s PHE 122 Cb -0.13 -1.55 0.43 0.00 -0.57 0.00 0.00 43.02 41.20 2f3j s PHE 122 CO -0.08 0.52 1.64 0.93 -0.10 0.00 0.00 175.22 178.13 2f3j h GLU 123 N 2.38 0.00 -5.46 0.44 4.39 -1.90 0.45 114.58 114.88 2f3j h GLU 123 Ca -0.48 0.00 -0.63 0.00 0.34 0.00 0.00 59.36 58.59 2f3j h GLU 123 Cb 1.20 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 29.71 2f3j h GLU 123 CO 0.64 0.00 -0.55 1.03 -1.16 0.00 0.00 179.01 178.97 2f3j s ARG 124 N -3.22 3.74 0.18 2.33 0.52 -1.26 -4.59 118.95 116.64 2f3j s ARG 124 Ca 0.07 -0.31 -0.02 0.00 -0.52 0.00 0.00 55.73 54.95 2f3j s ARG 124 Cb 0.06 -3.16 0.07 0.00 0.52 0.00 0.00 34.95 32.44 2f3j s ARG 124 CO 0.66 0.44 1.45 0.07 0.02 0.00 0.00 175.30 177.94 2f3j h ARG 125 N 6.13 0.46 -0.31 3.54 0.11 -1.87 -3.02 114.38 119.43 2f3j h ARG 125 Ca -0.43 -0.35 -0.01 0.00 0.10 0.00 0.00 59.98 59.29 2f3j h ARG 125 Cb 1.18 0.06 -0.02 0.00 1.11 0.00 0.00 29.97 32.31 2f3j h ARG 125 CO 0.66 0.97 0.14 0.00 0.10 0.00 0.00 179.97 181.85 2f3j h ALA 126 N 0.93 1.68 -0.92 0.08 0.00 -1.94 0.19 119.26 119.28 2f3j h ALA 126 Ca -0.02 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 54.91 2f3j h ALA 126 Cb 1.25 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 18.83 2f3j h ALA 126 CO 0.12 0.26 0.56 0.22 0.00 0.00 0.00 179.25 180.42 2f3j h ASP 127 N 0.42 0.85 0.64 0.00 1.82 -1.95 0.98 116.42 119.18 2f3j h ASP 127 Ca 0.11 0.04 -0.27 0.00 -0.39 0.00 0.00 57.03 56.51 2f3j h ASP 127 Cb 0.05 -0.14 -0.01 0.00 0.68 0.00 0.00 39.33 39.91 2f3j h ASP 127 CO -0.02 0.50 -1.33 0.00 -1.61 0.00 0.00 179.24 176.78 2f3j h ALA 128 N 1.47 0.26 -0.00 -0.78 0.00 -1.17 -2.41 119.26 116.64 2f3j h ALA 128 Ca 0.43 -1.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.33 2f3j h ALA 128 Cb 0.33 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2f3j h ALA 128 CO -0.23 1.14 0.00 1.25 0.00 0.00 0.00 179.25 181.41 2f3j h LEU 129 N 0.05 0.00 -0.95 0.00 6.46 -0.22 0.48 115.31 121.13 2f3j h LEU 129 Ca -0.16 -0.07 -0.07 0.00 -0.12 0.00 0.00 57.88 57.46 2f3j h LEU 129 Cb 1.95 -0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 41.86 2f3j h LEU 129 CO 0.16 0.08 -0.02 0.50 -0.62 0.00 0.00 178.44 178.54 2f3j h LYS 130 N -0.07 0.74 -0.12 1.25 3.64 -0.90 0.06 116.57 121.17 2f3j h LYS 130 Ca 0.00 -0.20 -0.12 0.00 -1.27 0.00 0.00 60.65 59.06 2f3j h LYS 130 Cb 0.07 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 2f3j h LYS 130 CO -0.00 0.77 -0.44 0.00 -2.27 0.00 0.00 179.45 177.50 2f3j h ALA 131 N 1.29 1.01 0.00 5.00 0.00 -1.08 0.21 119.26 125.69 2f3j h ALA 131 Ca 0.13 -0.44 -0.11 0.00 0.00 0.00 0.00 54.91 54.49 2f3j h ALA 131 Cb 0.46 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2f3j h ALA 131 CO 0.02 0.62 -0.52 0.00 0.00 0.00 0.00 179.25 179.37 2f3j h MET 132 N 0.24 0.00 0.01 0.00 -0.00 0.42 0.21 114.93 115.82 2f3j h MET 132 Ca 0.02 0.00 -0.00 0.00 -0.00 0.00 0.00 59.70 59.72 2f3j h MET 132 Cb 0.88 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.48 2f3j h MET 132 CO 0.07 0.52 -0.00 0.87 -0.00 0.00 0.00 176.91 178.37 2f3j h LYS 133 N 0.00 -0.01 0.00 -0.10 6.56 -0.63 -3.31 116.57 119.08 2f3j h LYS 133 Ca -0.01 0.00 -0.10 0.00 -1.06 0.00 0.00 60.65 59.48 2f3j h LYS 133 Cb 1.30 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.95 2f3j h LYS 133 CO 0.07 0.85 -0.79 1.96 -2.06 0.00 0.00 179.45 179.48 2f3j h GLN 134 N -0.94 0.00 0.43 3.15 7.50 -0.66 -3.42 115.11 121.17 2f3j h GLN 134 Ca -0.00 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 59.13 2f3j h GLN 134 Cb 0.86 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.40 2f3j h GLN 134 CO 0.00 0.49 -0.21 -0.92 -1.50 0.00 0.00 178.83 176.69 2f3j h TYR 135 N -1.00 -0.54 -1.68 2.96 3.20 -0.98 -3.43 116.97 115.50 2f3j h TYR 135 Ca -0.16 -0.01 -0.63 0.00 3.14 0.00 0.00 58.73 61.07 2f3j h TYR 135 Cb 0.85 0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.31 2f3j h TYR 135 CO -0.04 -0.34 1.28 1.17 -1.64 0.00 0.00 178.16 178.59 2f3j n LYS 136 N -4.47 1.72 0.00 1.82 0.00 0.49 -2.26 118.16 115.46 2f3j n LYS 136 Ca -0.07 0.56 0.00 0.00 0.00 0.00 0.00 58.31 58.80 2f3j n LYS 136 Cb 0.23 -2.69 0.00 0.00 0.00 0.00 0.00 35.03 32.57 2f3j n LYS 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2f3j n GLY 137 N 5.40 1.22 3.34 3.14 0.00 -1.26 -4.64 105.19 112.39 2f3j n GLY 137 Ca 0.31 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.87 2f3j n GLY 137 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2f3j n VAL 138 N 0.00 0.00 -3.60 1.61 0.31 -0.96 -4.87 118.33 110.82 2f3j n VAL 138 Ca 0.00 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 63.95 2f3j n VAL 138 Cb 0.00 -0.49 -0.06 0.00 -0.91 0.00 0.00 33.84 32.38 2f3j n VAL 138 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2f3j s PRO 139 N 7.91 3.80 -0.43 5.55 0.04 -1.26 -1.10 135.00 149.52 2f3j s PRO 139 Ca 1.28 0.26 0.04 0.00 0.04 0.00 0.00 61.00 62.63 2f3j s PRO 139 Cb -1.30 -3.22 0.17 0.00 0.04 0.00 0.00 34.50 30.19 2f3j s PRO 139 CO 0.53 0.70 0.45 -1.17 0.04 0.00 0.00 177.00 177.54 2f3j s LEU 140 N -1.01 0.24 -0.20 -3.56 0.20 0.87 -4.86 118.68 110.36 2f3j s LEU 140 Ca 0.21 -2.30 -0.02 0.00 0.69 0.00 0.00 54.13 52.72 2f3j s LEU 140 Cb -0.15 0.45 0.00 0.00 -0.43 0.00 0.00 46.19 46.06 2f3j s LEU 140 CO 0.11 -0.17 0.04 -0.67 -0.29 0.00 0.00 176.35 175.38 2f3j n ASP 141 N 3.28 -7.43 0.00 3.68 -0.08 -1.26 -2.76 116.55 111.97 2f3j n ASP 141 Ca 0.21 0.98 0.00 0.00 -1.51 0.00 0.00 54.79 54.47 2f3j n ASP 141 Cb 0.49 -3.85 0.00 0.00 2.34 0.00 0.00 41.12 40.10 2f3j n ASP 141 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2f3j n GLY 142 N 0.86 0.49 2.88 0.27 0.00 -1.26 -4.88 105.19 103.55 2f3j n GLY 142 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.51 0.38 -0.10 1.61 3.52 -1.11 -5.11 118.95 117.62 2f3j s ARG 143 Ca 0.00 0.16 -0.24 0.00 -0.13 0.00 0.00 55.73 55.52 2f3j s ARG 143 Cb 0.00 -0.42 -0.03 0.00 -1.56 0.00 0.00 34.95 32.94 2f3j s ARG 143 CO 0.00 -0.95 0.73 -1.25 -0.81 0.00 0.00 175.30 173.01 2f3j s PRO 144 N 2.51 4.39 0.94 5.12 0.04 -1.26 -0.09 135.00 146.65 2f3j s PRO 144 Ca 0.10 0.90 -0.12 0.00 0.04 0.00 0.00 61.00 61.92 2f3j s PRO 144 Cb -0.13 -3.49 0.16 0.00 0.04 0.00 0.00 34.50 31.08 2f3j s PRO 144 CO -0.28 -0.05 1.09 0.00 0.04 0.00 0.00 177.00 177.80 2f3j s MET 145 N 1.20 0.88 -0.32 4.56 0.23 -0.26 -4.94 119.30 120.65 2f3j s MET 145 Ca 0.37 0.71 -0.11 0.00 -1.03 0.00 0.00 55.69 55.63 2f3j s MET 145 Cb -0.17 -1.77 -0.01 0.00 -1.53 0.00 0.00 34.83 31.34 2f3j s MET 145 CO 0.16 -2.47 0.19 0.34 -2.03 0.00 0.00 175.02 171.21 2f3j s ASP 146 N -3.40 5.78 -0.05 -1.18 2.15 0.10 -4.70 116.67 115.37 2f3j s ASP 146 Ca 0.64 -0.45 0.01 0.00 0.43 0.00 0.00 52.55 53.18 2f3j s ASP 146 Cb -0.18 -2.06 0.02 0.00 -0.30 0.00 0.00 42.92 40.39 2f3j s ASP 146 CO 0.57 -0.20 -0.07 -0.63 -0.17 0.00 0.00 175.17 174.67 2f3j s ILE 147 N 1.67 0.74 -0.02 4.11 1.01 -1.26 0.87 121.20 128.32 2f3j s ILE 147 Ca 0.05 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.46 2f3j s ILE 147 Cb -0.17 -0.72 0.03 0.00 0.01 0.00 0.00 42.46 41.60 2f3j s ILE 147 CO 0.08 0.27 0.02 -1.58 0.00 0.00 0.00 174.94 173.73 2f3j s GLN 148 N 0.83 0.04 -0.13 2.79 -0.44 -0.24 -4.78 119.66 117.73 2f3j s GLN 148 Ca -0.12 0.16 0.01 0.00 -2.50 0.00 0.00 55.36 52.92 2f3j s GLN 148 Cb -0.15 -0.31 0.02 0.00 -1.64 0.00 0.00 33.01 30.93 2f3j s GLN 148 CO 0.01 -0.16 -0.16 -0.51 0.50 0.00 0.00 175.29 174.97 2f3j s LEU 149 N 1.07 1.80 -0.48 3.68 1.02 -1.26 0.34 118.68 124.86 2f3j s LEU 149 Ca -0.09 -0.49 -0.13 0.00 0.02 0.00 0.00 54.13 53.44 2f3j s LEU 149 Cb -0.13 -1.20 0.10 0.00 0.02 0.00 0.00 46.19 44.98 2f3j s LEU 149 CO -0.03 0.01 0.39 -0.69 0.02 0.00 0.00 176.35 176.05 2f3j s VAL 150 N 1.10 4.81 0.00 -1.59 1.01 0.22 -4.59 120.40 121.36 2f3j s VAL 150 Ca -0.03 -1.40 0.00 0.00 0.00 0.00 0.00 61.98 60.54 2f3j s VAL 150 Cb -0.14 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.23 2f3j s VAL 150 CO -0.05 -0.69 0.13 0.00 0.00 0.00 0.00 175.10 174.50 2f3j n ALA 151 N 5.10 -0.75 0.00 5.51 0.00 -1.26 -1.68 120.51 127.43 2f3j n ALA 151 Ca -0.11 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2f3j n ALA 151 Cb 0.42 -0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.62 2f3j n ALA 151 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2f3j n SER 152 N 0.00 0.29 -0.34 0.00 3.41 -1.26 -4.73 113.62 110.99 2f3j n SER 152 Ca -0.04 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 58.65 2f3j n SER 152 Cb 0.30 0.04 0.14 0.00 -0.26 0.00 0.00 64.21 64.43 2f3j n SER 152 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2f3j n GLN 153 N -0.41 1.16 0.00 4.33 1.13 -1.26 -4.75 117.38 117.58 2f3j n GLN 153 Ca 0.00 -2.58 0.05 0.00 -1.94 0.00 0.00 57.00 52.53 2f3j n GLN 153 Cb 0.02 -1.34 0.27 0.00 0.11 0.00 0.00 30.24 29.29 2f3j n GLN 153 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 2f3j n ILE 154 N -1.09 0.00 0.23 5.09 -5.35 -1.26 -3.62 119.36 113.37 2f3j n ILE 154 Ca 0.15 0.00 0.07 0.00 -0.27 0.00 0.00 62.75 62.69 2f3j n ILE 154 Cb 0.69 -0.14 0.56 0.00 -1.74 0.00 0.00 39.64 39.00 2f3j n ILE 154 CO 0.00 0.00 0.00 -0.78 -1.76 0.00 0.00 176.55 174.01 2f3j h ASP 155 N 0.00 0.00 0.19 7.28 3.58 -1.85 -0.57 116.42 125.05 2f3j h ASP 155 Ca 0.00 0.00 -0.35 0.00 0.42 0.00 0.00 57.03 57.10 2f3j h ASP 155 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 2f3j h ASP 155 CO 0.00 0.15 -1.80 -0.07 -2.88 0.00 0.00 179.24 174.63 2f3j h LEU 156 N 0.00 0.56 -0.97 2.28 3.38 -1.99 -3.30 115.31 115.27 2f3j h LEU 156 Ca -0.00 -0.92 0.05 0.00 0.09 0.00 0.00 57.88 57.10 2f3j h LEU 156 Cb 0.28 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 40.78 2f3j h LEU 156 CO 0.02 1.79 0.63 -0.33 0.09 0.00 0.00 178.44 180.64 2f3j h GLU 157 N 0.10 1.15 0.00 1.13 3.07 -1.72 -3.55 114.58 114.76 2f3j h GLU 157 Ca -0.36 -0.07 0.00 0.00 -0.50 0.00 0.00 59.36 58.43 2f3j h GLU 157 Cb 2.08 -0.26 0.00 0.00 -0.84 0.00 0.00 28.75 29.73 2f3j h GLU 157 CO 0.16 0.76 0.00 1.58 -1.40 0.00 0.00 179.01 180.11