#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u3f s ASP 2 N 0.00 6.81 0.03 7.83 -1.08 -1.26 -3.69 116.67 125.31 1u3f s ASP 2 Ca 0.00 2.41 -0.17 0.00 -0.52 0.00 0.00 52.55 54.26 1u3f s ASP 2 Cb 0.00 -2.63 -0.09 0.00 -1.46 0.00 0.00 42.92 38.74 1u3f s ASP 2 CO 0.00 -0.48 1.27 0.11 0.52 0.00 0.00 175.17 176.59 1u3f h LYS 3 N 3.17 -0.56 -0.30 4.34 1.57 -1.96 -2.52 116.57 120.31 1u3f h LYS 3 Ca -0.48 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1u3f h LYS 3 Cb 1.23 0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.66 1u3f h LYS 3 CO 0.65 -0.37 0.00 -1.71 -0.57 0.00 0.00 179.45 177.44 1u3f n ASN 4 N -3.75 0.30 -0.10 0.86 5.15 -1.26 -2.24 115.26 114.22 1u3f n ASN 4 Ca -0.07 -0.79 -0.15 0.00 -0.60 0.00 0.00 54.58 52.96 1u3f n ASN 4 Cb 0.24 -0.15 -0.06 0.00 -0.53 0.00 0.00 39.78 39.28 1u3f n ASN 4 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1u3f n ALA 5 N 0.10 0.86 0.31 5.20 0.00 -0.96 -4.27 120.51 121.76 1u3f n ALA 5 Ca 0.00 -0.77 0.16 0.00 0.00 0.00 0.00 53.44 52.83 1u3f n ALA 5 Cb 0.07 -0.02 0.72 0.00 0.00 0.00 0.00 19.45 20.22 1u3f n ALA 5 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1u3f h LEU 6 N -1.00 0.00 -0.60 0.00 3.38 -1.39 -1.03 115.31 114.67 1u3f h LEU 6 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1u3f h LEU 6 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1u3f h LEU 6 CO -0.14 0.00 0.00 0.54 0.09 0.00 0.00 178.44 178.93 1u3f n ARG 7 N -2.68 0.12 -0.03 1.13 1.74 -1.12 -0.87 116.66 114.96 1u3f n ARG 7 Ca -0.00 0.43 -0.04 0.00 -0.77 0.00 0.00 57.85 57.46 1u3f n ARG 7 Cb 0.19 -1.77 -0.01 0.00 -1.02 0.00 0.00 32.46 29.85 1u3f n ARG 7 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1u3f n LYS 8 N -2.00 0.26 -0.36 5.56 4.01 -0.45 -3.49 118.16 121.69 1u3f n LYS 8 Ca 0.02 0.10 0.37 0.00 -0.51 0.00 0.00 58.31 58.29 1u3f n LYS 8 Cb 0.16 -0.92 0.73 0.00 -0.51 0.00 0.00 35.03 34.49 1u3f n LYS 8 CO 0.00 0.00 0.00 1.96 -1.11 0.00 0.00 177.40 178.25 1u3f h GLN 9 N -0.50 0.00 0.00 1.97 4.20 -1.41 0.60 115.11 119.98 1u3f h GLN 9 Ca 0.00 0.00 -0.43 0.00 0.06 0.00 0.00 58.65 58.28 1u3f h GLN 9 Cb 0.50 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.21 1u3f h GLN 9 CO 0.00 0.00 -2.51 -0.89 -0.67 0.00 0.00 178.83 174.76 1u3f n ILE 10 N -3.96 1.51 0.42 2.54 5.41 -0.05 -3.98 119.36 121.26 1u3f n ILE 10 Ca 0.28 -0.47 0.04 0.00 1.00 0.00 0.00 62.75 63.59 1u3f n ILE 10 Cb 1.40 -1.66 0.21 0.00 -0.71 0.00 0.00 39.64 38.88 1u3f n ILE 10 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 1u3f n LEU 11 N -3.78 0.00 0.00 1.39 7.94 -0.65 -2.01 117.00 119.89 1u3f n LEU 11 Ca -0.50 0.13 0.00 0.00 -1.11 0.00 0.00 56.01 54.52 1u3f n LEU 11 Cb 0.94 -0.13 0.00 0.00 0.53 0.00 0.00 43.42 44.76 1u3f n LEU 11 CO 0.14 -0.10 0.06 1.67 -1.11 0.00 0.00 177.39 178.05 1u3f n GLN 12 N -1.13 0.00 -0.20 1.96 -0.06 0.20 -3.60 117.38 114.55 1u3f n GLN 12 Ca 0.05 0.49 0.11 0.00 -2.00 0.00 0.00 57.00 55.65 1u3f n GLN 12 Cb 0.04 -1.05 0.40 0.00 -4.06 0.00 0.00 30.24 25.57 1u3f n GLN 12 CO 0.00 0.00 0.00 0.87 -0.20 0.00 0.00 177.06 177.73 1u3f h LYS 13 N 0.00 0.62 0.01 3.69 1.57 -1.58 -2.95 116.57 117.93 1u3f h LYS 13 Ca 0.00 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1u3f h LYS 13 Cb 0.00 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.17 1u3f h LYS 13 CO 0.00 0.41 -0.00 -0.09 -0.57 0.00 0.00 179.45 179.20 1u3f h ARG 14 N 0.64 -0.01 -0.10 3.15 2.43 -1.58 -2.61 114.38 116.30 1u3f h ARG 14 Ca 0.37 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.51 1u3f h ARG 14 Cb 0.57 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 1u3f h ARG 14 CO -0.14 0.36 -0.08 0.52 -1.51 0.00 0.00 179.97 179.12 1u3f h MET 15 N -0.37 0.14 0.00 0.20 2.86 -1.60 -2.23 114.93 113.93 1u3f h MET 15 Ca -0.00 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 1u3f h MET 15 Cb 0.37 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.00 1u3f h MET 15 CO 0.00 0.23 -0.07 0.00 1.06 0.00 0.00 176.91 178.13 1u3f h ALA 16 N 1.79 0.99 -1.38 6.32 0.00 -1.43 -3.47 119.26 122.07 1u3f h ALA 16 Ca 0.03 -0.07 -0.60 0.00 0.00 0.00 0.00 54.91 54.27 1u3f h ALA 16 Cb 0.23 -0.01 0.13 0.00 0.00 0.00 0.00 17.79 18.14 1u3f h ALA 16 CO 0.01 0.09 -0.77 1.28 0.00 0.00 0.00 179.25 179.86 1u3f n LEU 17 N -3.17 -2.22 -4.74 0.00 4.77 -0.84 -4.93 117.00 105.87 1u3f n LEU 17 Ca 0.01 0.87 -0.29 0.00 -0.03 0.00 0.00 56.01 56.57 1u3f n LEU 17 Cb 0.41 -0.86 0.14 0.00 -2.33 0.00 0.00 43.42 40.78 1u3f n LEU 17 CO 0.31 -3.61 0.68 -0.55 -1.33 0.00 0.00 177.39 172.89 1u3f s SER 18 N -0.95 3.43 0.15 -1.43 0.15 -1.26 -4.86 113.70 108.93 1u3f s SER 18 Ca 0.58 1.25 0.02 0.00 0.70 0.00 0.00 55.95 58.50 1u3f s SER 18 Cb -0.70 -1.92 -0.07 0.00 -1.71 0.00 0.00 66.02 61.62 1u3f s SER 18 CO 0.57 -2.63 1.33 0.74 1.20 0.00 0.00 173.24 174.45 1u3f h THR 19 N -1.55 1.52 0.09 6.45 2.02 -2.00 -2.25 112.91 117.20 1u3f h THR 19 Ca -0.51 -2.77 -0.14 0.00 0.77 0.00 0.00 66.41 63.77 1u3f h THR 19 Cb 1.30 2.57 0.02 0.00 -1.74 0.00 0.00 68.15 70.30 1u3f h THR 19 CO 0.58 0.80 -0.61 0.40 0.37 0.00 0.00 175.52 177.06 1u3f h ILE 20 N 0.09 1.56 -0.12 3.11 2.04 -2.00 -3.20 117.51 118.99 1u3f h ILE 20 Ca -0.05 -2.41 0.01 0.00 1.00 0.00 0.00 64.86 63.40 1u3f h ILE 20 Cb 1.60 3.14 -0.01 0.00 -0.74 0.00 0.00 36.82 40.81 1u3f h ILE 20 CO 0.14 0.67 0.03 -0.08 0.00 0.00 0.00 178.15 178.92 1u3f h GLU 21 N -0.46 0.08 0.03 2.37 4.57 -1.94 -2.07 114.58 117.17 1u3f h GLU 21 Ca -0.10 -0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.09 1u3f h GLU 21 Cb 1.45 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 30.00 1u3f h GLU 21 CO 0.12 0.06 -0.12 -0.22 -1.18 0.00 0.00 179.01 177.66 1u3f h LYS 22 N 0.09 -0.21 -0.31 1.92 3.64 -1.55 -2.34 116.57 117.81 1u3f h LYS 22 Ca 0.05 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1u3f h LYS 22 Cb 0.04 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 1u3f h LYS 22 CO -0.06 -0.14 0.13 0.66 -2.27 0.00 0.00 179.45 177.77 1u3f h SER 23 N -0.22 0.38 -0.25 4.20 4.64 -1.53 0.16 113.55 120.93 1u3f h SER 23 Ca 0.03 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 1u3f h SER 23 Cb 0.26 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 1u3f h SER 23 CO -0.10 0.35 -0.01 -0.74 -0.87 0.00 0.00 176.83 175.46 1u3f h HIS 24 N 0.43 0.48 -0.54 4.77 -0.00 -1.03 -2.48 115.15 116.78 1u3f h HIS 24 Ca 0.11 -0.08 -0.11 0.00 -0.00 0.00 0.00 60.37 60.28 1u3f h HIS 24 Cb 0.08 -0.12 -0.02 0.00 -0.00 0.00 0.00 27.41 27.35 1u3f h HIS 24 CO 0.00 0.61 -0.10 -0.07 -0.00 0.00 0.00 177.93 178.37 1u3f h LEU 25 N 0.21 1.00 -1.35 0.26 4.07 -1.00 -2.90 115.31 115.61 1u3f h LEU 25 Ca 0.07 -0.32 0.03 0.00 0.08 0.00 0.00 57.88 57.73 1u3f h LEU 25 Cb 0.42 -0.27 -0.04 0.00 1.08 0.00 0.00 40.66 41.85 1u3f h LEU 25 CO 0.01 1.11 0.46 0.44 -1.08 0.00 0.00 178.44 179.38 1u3f h ASP 26 N 0.90 0.74 -0.03 -0.43 3.45 -0.90 -1.03 116.42 119.11 1u3f h ASP 26 Ca 0.14 -0.01 -0.00 0.00 0.43 0.00 0.00 57.03 57.59 1u3f h ASP 26 Cb 0.66 -0.17 -0.00 0.00 -0.56 0.00 0.00 39.33 39.25 1u3f h ASP 26 CO 0.05 0.51 0.00 1.56 -1.57 0.00 0.00 179.24 179.79 1u3f h GLN 27 N 0.86 0.04 -0.38 3.56 1.08 -1.25 0.57 115.11 119.60 1u3f h GLN 27 Ca 0.27 -0.01 0.07 0.00 -1.45 0.00 0.00 58.65 57.53 1u3f h GLN 27 Cb 0.03 -0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 27.40 1u3f h GLN 27 CO -0.07 0.31 0.00 0.87 -0.95 0.00 0.00 178.83 178.99 1u3f h LYS 28 N -0.23 0.10 -0.18 1.46 1.79 -1.23 -1.14 116.57 117.14 1u3f h LYS 28 Ca 0.01 -0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 1u3f h LYS 28 Cb 0.29 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.91 1u3f h LYS 28 CO 0.00 0.07 0.07 0.82 -1.08 0.00 0.00 179.45 179.33 1u3f h ILE 29 N 0.10 1.17 0.00 1.86 2.04 -1.13 -2.64 117.51 118.91 1u3f h ILE 29 Ca 0.18 -0.51 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 1u3f h ILE 29 Cb 0.26 1.17 -0.00 0.00 -0.74 0.00 0.00 36.82 37.50 1u3f h ILE 29 CO -0.31 0.16 -0.05 0.78 0.00 0.00 0.00 178.15 178.74 1u3f h ASN 30 N 0.13 0.00 -0.37 1.72 4.21 -0.51 -0.71 115.58 120.04 1u3f h ASN 30 Ca 0.06 0.00 -0.13 0.00 1.21 0.00 0.00 56.30 57.44 1u3f h ASN 30 Cb 0.19 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.38 1u3f h ASN 30 CO -0.00 0.05 -0.25 1.56 -1.29 0.00 0.00 177.43 177.49 1u3f h GLN 31 N 0.00 0.88 -0.46 0.81 4.20 -0.89 -2.58 115.11 117.08 1u3f h GLN 31 Ca -0.00 -0.39 -0.05 0.00 0.06 0.00 0.00 58.65 58.27 1u3f h GLN 31 Cb 0.09 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 1u3f h GLN 31 CO 0.01 1.03 0.09 0.87 -0.67 0.00 0.00 178.83 180.16 1u3f h LYS 32 N 0.76 0.75 -0.22 1.46 1.57 -0.82 -1.49 116.57 118.58 1u3f h LYS 32 Ca 0.09 -0.19 0.06 0.00 -1.87 0.00 0.00 60.65 58.74 1u3f h LYS 32 Cb 0.81 -0.09 -0.07 0.00 0.08 0.00 0.00 32.23 32.96 1u3f h LYS 32 CO 0.07 0.76 -0.23 -0.07 -0.57 0.00 0.00 179.45 179.41 1u3f h LEU 33 N 0.62 -0.73 -1.02 2.94 4.07 -1.18 0.66 115.31 120.66 1u3f h LEU 33 Ca 0.14 0.13 0.07 0.00 0.08 0.00 0.00 57.88 58.30 1u3f h LEU 33 Cb 0.36 0.35 -0.07 0.00 1.08 0.00 0.00 40.66 42.38 1u3f h LEU 33 CO 0.01 -0.27 0.65 0.58 -1.08 0.00 0.00 178.44 178.32 1u3f h VAL 34 N -0.24 1.08 -0.63 1.22 2.07 -1.31 -0.28 116.25 118.16 1u3f h VAL 34 Ca 0.13 -0.40 -0.09 0.00 0.82 0.00 0.00 66.70 67.16 1u3f h VAL 34 Cb 0.44 -0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.01 1u3f h VAL 34 CO -0.37 0.21 0.04 0.00 0.02 0.00 0.00 177.57 177.48 1u3f h ALA 35 N 1.46 0.85 -0.72 1.67 0.00 0.11 -2.06 119.26 120.57 1u3f h ALA 35 Ca 0.43 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1u3f h ALA 35 Cb 0.17 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1u3f h ALA 35 CO -0.17 0.66 0.21 0.35 0.00 0.00 0.00 179.25 180.30 1u3f h PHE 36 N 1.00 1.16 0.00 0.00 3.57 0.17 -3.22 116.94 119.61 1u3f h PHE 36 Ca 0.18 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1u3f h PHE 36 Cb 0.51 -0.34 0.00 0.00 2.79 0.00 0.00 35.95 38.92 1u3f h PHE 36 CO 0.04 0.92 -0.60 -0.07 -2.23 0.00 0.00 178.31 176.37 1u3f h LEU 37 N 1.07 0.00 0.04 0.59 3.38 -1.03 -3.39 115.31 115.98 1u3f h LEU 37 Ca 0.23 -0.13 0.02 0.00 0.09 0.00 0.00 57.88 58.09 1u3f h LEU 37 Cb 0.32 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 1u3f h LEU 37 CO -0.01 0.07 -0.18 0.74 0.09 0.00 0.00 178.44 179.15 1u3f h THR 38 N 0.00 0.58 -0.01 0.22 2.02 -1.38 -2.50 112.91 111.84 1u3f h THR 38 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1u3f h THR 38 Cb 0.82 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1u3f h THR 38 CO 0.00 0.00 0.00 -0.81 0.37 0.00 0.00 175.52 175.08 1u3f n PRO 39 N -5.31 1.03 -3.56 6.66 -0.04 -1.26 -4.39 135.00 128.12 1u3f n PRO 39 Ca -0.06 -0.04 -0.27 0.00 -0.04 0.00 0.00 63.50 63.09 1u3f n PRO 39 Cb 0.22 -1.06 -0.09 0.00 -0.04 0.00 0.00 33.50 32.53 1u3f n PRO 39 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1u3f n LYS 40 N -0.42 2.31 0.03 0.54 5.02 -0.94 -4.92 118.16 119.79 1u3f n LYS 40 Ca 0.00 -4.61 0.06 0.00 -2.02 0.00 0.00 58.31 51.74 1u3f n LYS 40 Cb 0.04 -2.26 0.27 0.00 -0.02 0.00 0.00 35.03 33.05 1u3f n LYS 40 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1u3f n PRO 41 N 1.18 0.04 0.00 1.97 -0.04 -1.26 -2.39 135.00 134.50 1u3f n PRO 41 Ca 0.27 0.39 0.14 0.00 -0.04 0.00 0.00 63.50 64.25 1u3f n PRO 41 Cb 0.39 -1.59 0.58 0.00 -0.04 0.00 0.00 33.50 32.84 1u3f n PRO 41 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1u3f s ILE 43 N -3.00 3.95 -0.08 0.00 1.01 -1.01 -4.78 121.20 117.29 1u3f s ILE 43 Ca 0.14 0.08 0.15 0.00 0.00 0.00 0.00 60.65 61.02 1u3f s ILE 43 Cb 0.19 -4.84 -0.22 0.00 0.01 0.00 0.00 42.46 37.59 1u3f s ILE 43 CO 0.55 -1.72 0.22 0.29 0.00 0.00 0.00 174.94 174.27 1u3f n LYS 44 N 8.76 0.97 -3.96 2.79 5.02 -1.26 -4.84 118.16 125.63 1u3f n LYS 44 Ca 0.02 -0.08 -0.28 0.00 -2.02 0.00 0.00 58.31 55.94 1u3f n LYS 44 Cb 0.48 -1.38 -0.17 0.00 -0.02 0.00 0.00 35.03 33.94 1u3f n LYS 44 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1u3f s THR 45 N -2.78 1.29 -0.02 -0.18 2.01 -1.26 -0.44 115.64 114.26 1u3f s THR 45 Ca -0.07 -0.49 0.06 0.00 0.31 0.00 0.00 61.69 61.51 1u3f s THR 45 Cb 0.08 -1.27 -0.01 0.00 0.01 0.00 0.00 72.50 71.30 1u3f s THR 45 CO 0.64 0.38 -0.22 -0.51 -0.69 0.00 0.00 174.62 174.22 1u3f s ILE 46 N 1.60 1.72 -0.12 1.82 2.07 0.64 -0.12 121.20 128.81 1u3f s ILE 46 Ca 0.04 -0.92 -0.17 0.00 -1.41 0.00 0.00 60.65 58.20 1u3f s ILE 46 Cb -0.13 -1.43 -0.04 0.00 0.13 0.00 0.00 42.46 40.98 1u3f s ILE 46 CO -0.09 0.49 0.42 0.00 -1.91 0.00 0.00 174.94 173.85 1u3f s ALA 47 N -0.42 3.52 0.00 1.50 0.00 0.22 -0.88 121.76 125.69 1u3f s ALA 47 Ca 0.06 -0.26 0.00 0.00 0.00 0.00 0.00 51.96 51.76 1u3f s ALA 47 Cb -0.09 -2.57 0.00 0.00 0.00 0.00 0.00 23.12 20.46 1u3f s ALA 47 CO -0.00 0.05 0.00 1.28 0.00 0.00 0.00 175.76 177.09 1u3f n LEU 48 N 3.55 0.00 -3.71 0.00 4.77 -0.29 -1.37 117.00 119.95 1u3f n LEU 48 Ca -0.09 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.83 1u3f n LEU 48 Cb 0.52 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.59 1u3f n LEU 48 CO 0.42 0.00 0.60 -0.72 -1.33 0.00 0.00 177.39 176.36 1u3f s TYR 49 N 1.53 -0.23 -0.40 -1.77 -0.85 -1.26 -4.36 117.35 110.00 1u3f s TYR 49 Ca 0.00 -0.09 -0.12 0.00 -0.52 0.00 0.00 57.07 56.34 1u3f s TYR 49 Cb 0.00 0.64 0.04 0.00 0.38 0.00 0.00 41.96 43.02 1u3f s TYR 49 CO 0.00 -0.91 0.26 -1.21 -1.52 0.00 0.00 175.55 172.17 1u3f s GLU 50 N -3.50 2.83 -0.01 -3.49 2.02 -1.26 -4.95 118.70 110.34 1u3f s GLU 50 Ca 0.09 -1.17 -0.39 0.00 0.02 0.00 0.00 54.97 53.53 1u3f s GLU 50 Cb -0.03 -3.85 -0.18 0.00 0.10 0.00 0.00 34.13 30.18 1u3f s GLU 50 CO 0.00 -0.80 1.31 -2.30 0.02 0.00 0.00 175.26 173.49 1u3f n PRO 51 N 5.05 0.72 0.00 0.39 -0.02 -1.26 -4.92 135.00 134.96 1u3f n PRO 51 Ca -0.11 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 1u3f n PRO 51 Cb 0.45 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 1u3f n PRO 51 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 1u3f n ILE 52 N 2.49 0.00 -1.25 4.25 3.06 -1.26 -4.92 119.36 121.74 1u3f n ILE 52 Ca 0.20 0.00 -0.35 0.00 -2.50 0.00 0.00 62.75 60.11 1u3f n ILE 52 Cb 0.14 -0.01 -0.05 0.00 0.54 0.00 0.00 39.64 40.26 1u3f n ILE 52 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 1u3f n LYS 53 N 0.00 3.42 -2.45 9.51 5.02 -1.26 -4.45 118.16 127.95 1u3f n LYS 53 Ca 0.00 -2.00 -0.10 0.00 -2.02 0.00 0.00 58.31 54.19 1u3f n LYS 53 Cb 0.00 -2.67 0.01 0.00 -0.02 0.00 0.00 35.03 32.35 1u3f n LYS 53 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1u3f n ASN 54 N 3.44 -3.43 -4.87 4.39 4.05 -1.26 -4.57 115.26 113.01 1u3f n ASN 54 Ca 0.73 -0.09 -0.31 0.00 0.45 0.00 0.00 54.58 55.36 1u3f n ASN 54 Cb 0.33 -2.47 0.03 0.00 1.23 0.00 0.00 39.78 38.90 1u3f n ASN 54 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 1u3f s GLU 55 N -4.84 3.27 0.33 1.20 2.02 -1.26 -4.78 118.70 114.64 1u3f s GLU 55 Ca 0.09 0.69 -0.27 0.00 0.02 0.00 0.00 54.97 55.49 1u3f s GLU 55 Cb -0.04 -2.05 -0.13 0.00 0.10 0.00 0.00 34.13 32.01 1u3f s GLU 55 CO 0.11 -0.79 1.03 0.28 0.02 0.00 0.00 175.26 175.91 1u3f n VAL 56 N -2.88 2.07 -4.21 2.63 0.31 -1.26 -4.79 118.33 110.20 1u3f n VAL 56 Ca 0.06 -0.50 -0.32 0.00 -0.01 0.00 0.00 64.34 63.57 1u3f n VAL 56 Cb 0.55 -1.09 -0.08 0.00 -0.91 0.00 0.00 33.84 32.31 1u3f n VAL 56 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1u3f s THR 57 N -1.12 4.24 -0.36 2.52 2.01 -1.26 -4.69 115.64 116.98 1u3f s THR 57 Ca 0.59 -0.66 -0.20 0.00 0.31 0.00 0.00 61.69 61.73 1u3f s THR 57 Cb -0.65 -2.93 0.00 0.00 0.01 0.00 0.00 72.50 68.93 1u3f s THR 57 CO 0.60 0.31 0.63 -0.36 -0.69 0.00 0.00 174.62 175.10 1u3f s PHE 58 N -1.16 3.15 0.72 4.92 0.40 -1.26 -4.87 117.98 119.87 1u3f s PHE 58 Ca 0.22 0.32 -0.08 0.00 -0.60 0.00 0.00 56.93 56.79 1u3f s PHE 58 Cb -0.12 -3.14 0.06 0.00 0.51 0.00 0.00 43.02 40.33 1u3f s PHE 58 CO 0.13 -0.63 1.05 0.54 0.70 0.00 0.00 175.22 177.00 1u3f s VAL 59 N 2.70 2.44 0.19 -0.44 0.11 -1.26 -4.94 120.40 119.20 1u3f s VAL 59 Ca 0.24 -0.12 -0.12 0.00 -2.93 0.00 0.00 61.98 59.05 1u3f s VAL 59 Cb -0.14 -3.08 0.12 0.00 -1.53 0.00 0.00 36.38 31.74 1u3f s VAL 59 CO 0.15 -0.10 1.72 -2.24 -3.33 0.00 0.00 175.10 171.30 1u3f h ASP 60 N -0.66 0.05 0.60 3.54 2.03 -2.00 -2.18 116.42 117.80 1u3f h ASP 60 Ca -0.45 0.09 0.00 0.00 -0.73 0.00 0.00 57.03 55.94 1u3f h ASP 60 Cb 1.31 0.11 0.00 0.00 -0.83 0.00 0.00 39.33 39.92 1u3f h ASP 60 CO 0.62 0.05 0.00 2.22 -1.03 0.00 0.00 179.24 181.10 1u3f n PHE 61 N -5.09 0.30 -0.06 4.15 1.16 -1.26 -1.74 117.46 114.91 1u3f n PHE 61 Ca 0.06 0.12 -0.11 0.00 -1.87 0.00 0.00 57.45 55.65 1u3f n PHE 61 Cb 0.26 -0.69 -0.10 0.00 -1.61 0.00 0.00 39.48 37.34 1u3f n PHE 61 CO 0.00 0.00 0.00 0.35 -1.87 0.00 0.00 176.76 175.24 1u3f h PHE 62 N 0.00 -0.01 0.00 2.97 3.57 -1.75 -2.95 116.94 118.78 1u3f h PHE 62 Ca 0.00 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 1u3f h PHE 62 Cb 0.30 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.04 1u3f h PHE 62 CO 0.00 0.77 -0.02 0.74 -2.23 0.00 0.00 178.31 177.57 1u3f h PHE 63 N -0.98 0.00 -0.09 0.41 -1.00 -1.32 -0.87 116.94 113.10 1u3f h PHE 63 Ca -0.00 0.00 -0.19 0.00 2.81 0.00 0.00 57.97 60.59 1u3f h PHE 63 Cb 0.78 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.34 1u3f h PHE 63 CO 0.22 0.02 -0.74 1.49 -1.61 0.00 0.00 178.31 177.68 1u3f h GLU 64 N 0.00 0.48 -0.40 1.51 4.57 -1.40 -1.28 114.58 118.06 1u3f h GLU 64 Ca -0.00 -0.39 -0.00 0.00 -1.18 0.00 0.00 59.36 57.78 1u3f h GLU 64 Cb 0.05 0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 1u3f h GLU 64 CO 0.00 1.03 0.23 0.35 -1.18 0.00 0.00 179.01 179.44 1u3f h PHE 65 N 0.32 0.53 -0.48 0.92 3.57 -0.99 0.12 116.94 120.93 1u3f h PHE 65 Ca -0.04 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.43 1u3f h PHE 65 Cb 1.33 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.88 1u3f h PHE 65 CO 0.05 0.39 0.20 -0.07 -2.23 0.00 0.00 178.31 176.65 1u3f h LEU 66 N 0.52 0.66 -0.23 0.59 3.38 -1.33 -2.22 115.31 116.68 1u3f h LEU 66 Ca 0.14 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1u3f h LEU 66 Cb 0.02 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1u3f h LEU 66 CO -0.03 0.65 0.14 0.50 0.09 0.00 0.00 178.44 179.79 1u3f h LYS 67 N 0.64 0.31 0.00 1.13 3.64 -0.84 -0.44 116.57 121.01 1u3f h LYS 67 Ca 0.16 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.49 1u3f h LYS 67 Cb 0.19 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1u3f h LYS 67 CO -0.01 0.24 -0.12 0.97 -2.27 0.00 0.00 179.45 178.25 1u3f h ILE 68 N 0.29 0.31 -0.63 2.00 2.10 -0.89 -2.79 117.51 117.90 1u3f h ILE 68 Ca 0.08 -0.81 0.00 0.00 1.08 0.00 0.00 64.86 65.21 1u3f h ILE 68 Cb 0.00 1.63 0.00 0.00 -1.09 0.00 0.00 36.82 37.36 1u3f h ILE 68 CO -0.02 0.12 0.00 0.59 -1.08 0.00 0.00 178.15 177.76 1u3f n ASN 69 N -3.27 4.10 -3.84 2.19 4.13 -0.84 -4.96 115.26 112.77 1u3f n ASN 69 Ca 0.00 -2.20 -0.28 0.00 1.68 0.00 0.00 54.58 53.79 1u3f n ASN 69 Cb 0.36 -0.49 0.04 0.00 -1.54 0.00 0.00 39.78 38.15 1u3f n ASN 69 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1u3f n GLN 70 N 1.22 -5.79 -3.51 3.52 6.02 -0.79 -4.96 117.38 113.10 1u3f n GLN 70 Ca 0.23 0.64 -0.40 0.00 -0.01 0.00 0.00 57.00 57.46 1u3f n GLN 70 Cb 0.70 -5.50 -0.10 0.00 1.02 0.00 0.00 30.24 26.36 1u3f n GLN 70 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1u3f s ILE 71 N -3.36 5.26 0.12 5.09 1.01 -0.24 -4.93 121.20 124.15 1u3f s ILE 71 Ca 0.55 0.03 -0.30 0.00 0.00 0.00 0.00 60.65 60.93 1u3f s ILE 71 Cb -0.27 -3.68 -0.06 0.00 0.01 0.00 0.00 42.46 38.45 1u3f s ILE 71 CO 0.81 0.06 1.02 -0.60 0.00 0.00 0.00 174.94 176.24 1u3f s ARG 72 N 1.83 4.64 -0.13 2.79 3.52 0.42 -4.56 118.95 127.46 1u3f s ARG 72 Ca 0.08 1.56 -0.08 0.00 -0.13 0.00 0.00 55.73 57.16 1u3f s ARG 72 Cb -0.17 -3.35 -0.04 0.00 -1.56 0.00 0.00 34.95 29.84 1u3f s ARG 72 CO 0.11 0.12 0.15 0.00 -0.81 0.00 0.00 175.30 174.88 1u3f s ALA 73 N 0.04 3.83 0.12 6.12 0.00 -1.26 -0.26 121.76 130.34 1u3f s ALA 73 Ca 0.49 -0.63 0.07 0.00 0.00 0.00 0.00 51.96 51.89 1u3f s ALA 73 Cb -0.26 -2.04 -0.04 0.00 0.00 0.00 0.00 23.12 20.79 1u3f s ALA 73 CO 0.31 0.51 -0.18 0.14 0.00 0.00 0.00 175.76 176.54 1u3f s VAL 74 N -0.72 1.59 0.13 0.00 -7.23 -0.06 -4.37 120.40 109.75 1u3f s VAL 74 Ca 0.14 -1.64 0.06 0.00 -1.81 0.00 0.00 61.98 58.72 1u3f s VAL 74 Cb -0.12 -1.56 -0.04 0.00 0.56 0.00 0.00 36.38 35.22 1u3f s VAL 74 CO 0.03 -0.21 -0.13 -0.31 -0.31 0.00 0.00 175.10 174.17 1u3f s TYR 75 N -1.58 1.37 0.41 2.82 1.51 0.62 -1.14 117.35 121.36 1u3f s TYR 75 Ca 0.08 -0.60 -0.21 0.00 -1.01 0.00 0.00 57.07 55.32 1u3f s TYR 75 Cb -0.08 -0.70 -0.11 0.00 -0.11 0.00 0.00 41.96 40.96 1u3f s TYR 75 CO 0.04 0.14 0.94 -1.25 -1.11 0.00 0.00 175.55 174.31 1u3f s PRO 76 N -2.97 4.25 -0.07 -1.71 0.04 -1.26 -1.17 135.00 132.11 1u3f s PRO 76 Ca 0.11 1.12 -0.03 0.00 0.04 0.00 0.00 61.00 62.24 1u3f s PRO 76 Cb -0.03 -2.25 0.04 0.00 0.04 0.00 0.00 34.50 32.30 1u3f s PRO 76 CO 0.03 0.01 0.17 0.15 0.04 0.00 0.00 177.00 177.39 1u3f s LYS 77 N -3.06 0.11 0.14 4.56 -0.14 0.07 -4.95 119.74 116.48 1u3f s LYS 77 Ca 0.60 0.41 -0.27 0.00 -1.36 0.00 0.00 55.97 55.35 1u3f s LYS 77 Cb -0.10 -0.17 -0.07 0.00 -1.68 0.00 0.00 37.83 35.81 1u3f s LYS 77 CO 0.14 -0.17 0.85 0.54 -0.76 0.00 0.00 175.35 175.95 1u3f s VAL 78 N 1.23 4.42 -0.06 3.17 0.11 -1.26 -1.00 120.40 127.02 1u3f s VAL 78 Ca -0.09 1.85 0.04 0.00 -2.93 0.00 0.00 61.98 60.85 1u3f s VAL 78 Cb -0.11 -4.21 -0.07 0.00 -1.53 0.00 0.00 36.38 30.46 1u3f s VAL 78 CO -0.06 0.44 0.01 -0.38 -3.33 0.00 0.00 175.10 171.77 1u3f n ILE 79 N 2.12 0.39 -4.11 7.04 5.41 -0.78 -4.97 119.36 124.47 1u3f n ILE 79 Ca -0.02 -0.23 -0.07 0.00 1.00 0.00 0.00 62.75 63.43 1u3f n ILE 79 Cb 0.49 -0.84 -0.03 0.00 -0.71 0.00 0.00 39.64 38.55 1u3f n ILE 79 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1u3f n SER 80 N -2.28 -0.08 -0.05 4.38 3.41 -1.21 -4.97 113.62 112.81 1u3f n SER 80 Ca -0.10 -1.75 0.10 0.00 -0.26 0.00 0.00 58.87 56.86 1u3f n SER 80 Cb 0.68 0.55 0.57 0.00 -0.26 0.00 0.00 64.21 65.75 1u3f n SER 80 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1u3f n ASP 81 N -2.46 0.16 0.00 4.04 5.68 -1.26 -3.78 116.55 118.92 1u3f n ASP 81 Ca 0.02 -1.41 0.00 0.00 -0.50 0.00 0.00 54.79 52.90 1u3f n ASP 81 Cb 0.21 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.18 1u3f n ASP 81 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1u3f n THR 82 N -0.70 0.00 -4.23 2.12 -2.24 -1.26 -4.97 114.28 103.00 1u3f n THR 82 Ca 0.15 -0.03 -0.29 0.00 -2.27 0.00 0.00 64.05 61.61 1u3f n THR 82 Cb 0.09 0.57 -0.10 0.00 -2.10 0.00 0.00 70.33 68.80 1u3f n THR 82 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1u3f s GLU 83 N -0.17 2.15 -0.01 -0.78 2.02 -1.25 -4.67 118.70 116.00 1u3f s GLU 83 Ca 0.00 -1.05 -0.03 0.00 0.02 0.00 0.00 54.97 53.91 1u3f s GLU 83 Cb 0.00 -2.30 0.00 0.00 0.10 0.00 0.00 34.13 31.93 1u3f s GLU 83 CO 0.00 0.50 0.07 -1.50 0.02 0.00 0.00 175.26 174.34 1u3f s ILE 84 N -1.32 0.04 0.35 -1.63 2.07 -1.26 -1.86 121.20 117.58 1u3f s ILE 84 Ca 0.22 -0.32 0.04 0.00 -1.41 0.00 0.00 60.65 59.18 1u3f s ILE 84 Cb -0.11 -0.21 -0.06 0.00 0.13 0.00 0.00 42.46 42.22 1u3f s ILE 84 CO 0.14 -0.18 0.06 0.27 -1.91 0.00 0.00 174.94 173.33 1u3f s ILE 85 N -0.54 1.20 -0.01 2.00 -4.36 -0.17 -4.93 121.20 114.40 1u3f s ILE 85 Ca -0.06 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.41 1u3f s ILE 85 Cb -0.04 -2.75 -0.02 0.00 1.25 0.00 0.00 42.46 40.90 1u3f s ILE 85 CO 0.00 0.00 -0.25 -0.36 0.24 0.00 0.00 174.94 174.57 1u3f s PHE 86 N -3.22 2.21 0.08 1.37 0.40 -1.26 -0.75 117.98 116.82 1u3f s PHE 86 Ca 0.34 -0.42 0.01 0.00 -0.60 0.00 0.00 56.93 56.26 1u3f s PHE 86 Cb 0.08 -1.42 -0.04 0.00 0.51 0.00 0.00 43.02 42.15 1u3f s PHE 86 CO 0.15 -0.03 -0.05 0.96 0.70 0.00 0.00 175.22 176.96 1u3f s ILE 87 N -0.60 0.52 0.43 0.64 -5.25 -0.32 -0.79 121.20 115.83 1u3f s ILE 87 Ca 0.10 -1.89 0.04 0.00 -0.99 0.00 0.00 60.65 57.91 1u3f s ILE 87 Cb -0.10 -1.63 0.08 0.00 2.95 0.00 0.00 42.46 43.76 1u3f s ILE 87 CO -0.01 -0.92 0.59 -0.90 -1.79 0.00 0.00 174.94 171.92 1u3f n ASP 88 N 0.01 1.27 -0.32 4.36 3.85 -0.30 -0.28 116.55 125.15 1u3f n ASP 88 Ca -0.13 -1.96 0.08 0.00 -0.71 0.00 0.00 54.79 52.07 1u3f n ASP 88 Cb 0.61 -0.34 0.28 0.00 -1.35 0.00 0.00 41.12 40.32 1u3f n ASP 88 CO 0.00 0.00 0.00 0.06 -1.01 0.00 0.00 177.20 176.25 1u3f h GLN 89 N 0.00 0.89 -0.99 0.11 3.07 -1.91 -0.41 115.11 115.87 1u3f h GLN 89 Ca -0.20 -0.05 -0.07 0.00 0.09 0.00 0.00 58.65 58.42 1u3f h GLN 89 Cb 0.85 -0.20 -0.04 0.00 0.08 0.00 0.00 27.48 28.16 1u3f h GLN 89 CO 0.26 0.59 0.09 0.39 0.09 0.00 0.00 178.83 180.25 1u3f n GLU 90 N -4.57 1.29 -0.76 0.06 4.71 -1.26 -4.83 120.64 115.28 1u3f n GLU 90 Ca 0.17 -0.51 0.00 0.00 -0.01 0.00 0.00 57.16 56.82 1u3f n GLU 90 Cb 0.35 -1.28 0.00 0.00 -1.01 0.00 0.00 31.44 29.51 1u3f n GLU 90 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1u3f n THR 91 N 0.20 0.00 -2.26 2.62 -2.24 -0.16 -4.93 114.28 107.52 1u3f n THR 91 Ca 0.09 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.45 1u3f n THR 91 Cb 0.64 -0.76 -0.03 0.00 -2.10 0.00 0.00 70.33 68.09 1u3f n THR 91 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1u3f s ASN 92 N -1.58 6.90 0.06 3.42 0.01 -1.26 -4.69 114.94 117.81 1u3f s ASN 92 Ca 0.00 2.17 -0.29 0.00 -0.71 0.00 0.00 52.86 54.04 1u3f s ASN 92 Cb 0.00 -2.58 -0.05 0.00 0.41 0.00 0.00 41.25 39.03 1u3f s ASN 92 CO 0.00 -0.62 0.91 -0.89 -1.51 0.00 0.00 177.10 174.99 1u3f s THR 93 N 1.48 4.66 -0.12 1.60 2.01 -1.26 -1.15 115.64 122.86 1u3f s THR 93 Ca 0.63 1.94 -0.01 0.00 0.31 0.00 0.00 61.69 64.56 1u3f s THR 93 Cb -0.33 -4.26 -0.02 0.00 0.01 0.00 0.00 72.50 67.89 1u3f s THR 93 CO 0.29 0.29 -0.08 -0.36 -0.69 0.00 0.00 174.62 174.06 1u3f s PHE 94 N 0.26 2.92 0.65 4.92 0.40 0.03 -4.98 117.98 122.17 1u3f s PHE 94 Ca 0.46 -0.33 -0.12 0.00 -0.60 0.00 0.00 56.93 56.33 1u3f s PHE 94 Cb -0.22 -1.85 -0.02 0.00 0.51 0.00 0.00 43.02 41.45 1u3f s PHE 94 CO 0.27 0.00 1.05 -1.21 0.70 0.00 0.00 175.22 176.04 1u3f s GLU 95 N 0.03 3.20 0.27 0.44 0.41 -1.26 -4.29 118.70 117.49 1u3f s GLU 95 Ca -0.02 0.99 -0.06 0.00 -0.41 0.00 0.00 54.97 55.46 1u3f s GLU 95 Cb -0.14 -2.02 0.48 0.00 -1.78 0.00 0.00 34.13 30.67 1u3f s GLU 95 CO 0.03 -0.89 1.59 -1.35 -0.49 0.00 0.00 175.26 174.15 1u3f h PRO 96 N -0.26 0.03 -0.89 0.39 0.11 -1.95 0.26 132.00 129.69 1u3f h PRO 96 Ca -0.45 -0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.53 1u3f h PRO 96 Cb 1.21 -0.01 -0.08 0.00 0.11 0.00 0.00 31.00 32.23 1u3f h PRO 96 CO 0.58 0.02 0.16 0.09 -0.21 0.00 0.00 178.00 178.64 1u3f n ASN 97 N -5.49 3.43 -0.00 -2.05 3.02 -1.26 -2.87 115.26 110.05 1u3f n ASN 97 Ca 0.16 -2.65 0.06 0.00 -0.03 0.00 0.00 54.58 52.12 1u3f n ASN 97 Cb 0.52 -0.64 -0.08 0.00 -0.61 0.00 0.00 39.78 38.97 1u3f n ASN 97 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1u3f n GLN 98 N -0.00 2.11 -3.93 3.52 6.02 0.08 -4.93 117.38 120.23 1u3f n GLN 98 Ca 0.22 -0.03 -0.37 0.00 -0.01 0.00 0.00 57.00 56.82 1u3f n GLN 98 Cb 0.92 -1.17 -0.06 0.00 1.02 0.00 0.00 30.24 30.95 1u3f n GLN 98 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1u3f s ILE 99 N -2.41 5.38 -0.58 5.09 1.01 -1.14 -4.69 121.20 123.85 1u3f s ILE 99 Ca 0.03 0.16 0.19 0.00 0.00 0.00 0.00 60.65 61.02 1u3f s ILE 99 Cb 0.10 -3.34 -0.23 0.00 0.01 0.00 0.00 42.46 39.00 1u3f s ILE 99 CO 0.55 0.62 0.66 0.47 0.00 0.00 0.00 174.94 177.23 1u3f n ASP 100 N 1.99 0.80 -3.59 3.58 8.00 0.84 -4.95 116.55 123.22 1u3f n ASP 100 Ca -0.20 -0.62 -0.16 0.00 0.71 0.00 0.00 54.79 54.52 1u3f n ASP 100 Cb 0.55 1.29 -0.07 0.00 -0.02 0.00 0.00 41.12 42.88 1u3f n ASP 100 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1u3f s PHE 102 N -0.88 1.61 -0.38 0.00 0.40 -0.73 -0.61 117.98 117.39 1u3f s PHE 102 Ca -0.09 -0.86 -0.13 0.00 -0.60 0.00 0.00 56.93 55.25 1u3f s PHE 102 Cb -0.02 -1.29 0.02 0.00 0.51 0.00 0.00 43.02 42.23 1u3f s PHE 102 CO 0.07 -0.55 0.26 -0.51 0.70 0.00 0.00 175.22 175.19 1u3f s LEU 103 N 1.67 4.86 -0.18 -0.37 1.43 -0.47 -0.10 118.68 125.51 1u3f s LEU 103 Ca 0.04 -0.84 -0.07 0.00 -1.03 0.00 0.00 54.13 52.23 1u3f s LEU 103 Cb -0.13 -2.11 -0.04 0.00 0.03 0.00 0.00 46.19 43.94 1u3f s LEU 103 CO -0.08 -0.39 0.05 -0.63 0.23 0.00 0.00 176.35 175.53 1u3f s ILE 104 N 1.64 4.64 0.50 -0.59 1.01 0.14 -4.43 121.20 124.12 1u3f s ILE 104 Ca 0.04 -0.09 -0.19 0.00 0.00 0.00 0.00 60.65 60.42 1u3f s ILE 104 Cb -0.19 -3.09 -0.08 0.00 0.01 0.00 0.00 42.46 39.11 1u3f s ILE 104 CO 0.09 0.46 1.01 -2.16 0.00 0.00 0.00 174.94 174.34 1u3f s PRO 105 N 0.44 3.82 0.27 2.79 0.04 -1.26 -0.80 135.00 140.30 1u3f s PRO 105 Ca 0.02 1.20 -0.13 0.00 0.04 0.00 0.00 61.00 62.13 1u3f s PRO 105 Cb -0.13 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.31 1u3f s PRO 105 CO 0.01 -0.40 0.53 -0.48 0.04 0.00 0.00 177.00 176.70 1u3f s LEU 106 N -3.75 0.28 -0.03 -3.56 0.05 -1.26 -4.90 118.68 105.51 1u3f s LEU 106 Ca 0.64 -0.95 0.08 0.00 0.05 0.00 0.00 54.13 53.96 1u3f s LEU 106 Cb -0.13 1.94 -0.13 0.00 -2.05 0.00 0.00 46.19 45.82 1u3f s LEU 106 CO 0.24 -1.22 0.14 0.52 -0.55 0.00 0.00 176.35 175.49 1u3f n VAL 107 N -0.42 0.16 -3.56 1.48 0.31 0.35 -4.99 118.33 111.67 1u3f n VAL 107 Ca -0.02 -0.24 -0.08 0.00 -0.01 0.00 0.00 64.34 63.98 1u3f n VAL 107 Cb 0.61 -0.01 -0.03 0.00 -0.91 0.00 0.00 33.84 33.50 1u3f n VAL 107 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1u3f s GLY 108 N -3.30 -0.33 -0.04 2.92 0.00 -1.05 -4.69 107.32 100.84 1u3f s GLY 108 Ca -0.03 1.61 -0.09 0.00 0.00 0.00 0.00 44.72 46.20 1u3f s GLY 108 CO 0.36 0.68 0.21 -0.11 0.00 0.00 0.00 173.10 174.24 1u3f s PHE 109 N -2.09 -0.12 0.24 1.90 -0.71 -0.96 0.16 117.98 116.40 1u3f s PHE 109 Ca 0.03 0.25 0.03 0.00 -1.04 0.00 0.00 56.93 56.20 1u3f s PHE 109 Cb -0.01 0.03 0.03 0.00 -1.21 0.00 0.00 43.02 41.87 1u3f s PHE 109 CO -0.04 -0.24 0.29 0.27 -1.34 0.00 0.00 175.22 174.16 1u3f n ASN 110 N 2.03 1.15 0.20 1.98 0.23 -0.67 -0.54 115.26 119.64 1u3f n ASN 110 Ca -0.18 -1.69 0.14 0.00 -0.53 0.00 0.00 54.58 52.32 1u3f n ASN 110 Cb 0.57 -0.13 0.70 0.00 -2.08 0.00 0.00 39.78 38.83 1u3f n ASN 110 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 1u3f h LYS 111 N 0.00 0.00 -0.46 -3.83 2.10 -1.91 -2.29 116.57 110.18 1u3f h LYS 111 Ca -0.12 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.53 1u3f h LYS 111 Cb 0.53 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.86 1u3f h LYS 111 CO 0.18 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.38 1u3f n ASP 112 N -2.53 4.32 -0.16 7.07 9.92 -1.26 -4.96 116.55 128.95 1u3f n ASP 112 Ca -0.00 -2.62 -0.02 0.00 -0.53 0.00 0.00 54.79 51.62 1u3f n ASP 112 Cb 0.14 -0.52 -0.01 0.00 -0.64 0.00 0.00 41.12 40.09 1u3f n ASP 112 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1u3f n ASN 113 N 0.43 -3.92 -4.83 -2.24 3.02 -0.86 -4.96 115.26 101.90 1u3f n ASN 113 Ca 0.22 0.05 -0.33 0.00 -0.03 0.00 0.00 54.58 54.50 1u3f n ASN 113 Cb 0.86 -1.60 -0.04 0.00 -0.61 0.00 0.00 39.78 38.38 1u3f n ASN 113 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1u3f s TYR 114 N -1.85 3.32 0.31 3.10 1.51 -1.23 -4.21 117.35 118.29 1u3f s TYR 114 Ca 0.00 1.53 0.10 0.00 -1.01 0.00 0.00 57.07 57.69 1u3f s TYR 114 Cb 0.00 -2.86 -0.06 0.00 -0.11 0.00 0.00 41.96 38.94 1u3f s TYR 114 CO 0.00 -0.41 -0.11 -0.98 -1.11 0.00 0.00 175.55 172.94 1u3f s ARG 115 N -3.71 1.84 -0.10 -0.62 1.70 -1.26 -1.67 118.95 115.13 1u3f s ARG 115 Ca 0.61 -1.80 0.04 0.00 -0.47 0.00 0.00 55.73 54.11 1u3f s ARG 115 Cb -0.11 -1.80 0.00 0.00 -0.57 0.00 0.00 34.95 32.47 1u3f s ARG 115 CO 0.25 0.23 -0.24 -1.17 -1.08 0.00 0.00 175.30 173.30 1u3f s LEU 116 N -3.59 2.07 0.00 -1.89 2.96 0.43 -4.93 118.68 113.73 1u3f s LEU 116 Ca 0.32 -0.55 0.00 0.00 -0.22 0.00 0.00 54.13 53.68 1u3f s LEU 116 Cb -0.02 -1.39 0.00 0.00 0.50 0.00 0.00 46.19 45.29 1u3f s LEU 116 CO 0.17 0.16 0.00 0.61 -1.32 0.00 0.00 176.35 175.96 1u3f n GLY 117 N 3.53 4.57 0.45 7.98 0.00 -1.26 -0.50 105.19 119.95 1u3f n GLY 117 Ca -0.19 -1.88 0.10 0.00 0.00 0.00 0.00 46.02 44.06 1u3f n GLY 117 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1u3f n PHE 118 N 0.00 0.16 0.00 1.61 3.01 -1.26 -4.76 117.46 116.22 1u3f n PHE 118 Ca 0.00 -0.08 0.00 0.00 1.01 0.00 0.00 57.45 58.38 1u3f n PHE 118 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 1u3f n PHE 118 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1u3f n GLY 119 N 1.07 2.18 0.22 1.37 0.00 -1.26 -4.92 105.19 103.85 1u3f n GLY 119 Ca 0.16 -0.17 0.07 0.00 0.00 0.00 0.00 46.02 46.08 1u3f n GLY 119 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u3f h LYS 120 N 0.00 0.00 -0.52 1.61 6.56 -1.94 -3.47 116.57 118.81 1u3f h LYS 120 Ca 0.00 0.00 -0.08 0.00 -1.06 0.00 0.00 60.65 59.51 1u3f h LYS 120 Cb 0.00 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.65 1u3f h LYS 120 CO 0.00 0.23 -0.10 0.41 -2.06 0.00 0.00 179.45 177.93 1u3f n GLY 121 N -0.64 0.26 0.21 3.86 0.00 -1.26 -4.94 105.19 102.68 1u3f n GLY 121 Ca -0.02 -0.74 -0.04 0.00 0.00 0.00 0.00 46.02 45.22 1u3f n GLY 121 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1u3f h TYR 122 N 0.00 0.46 -0.35 1.61 -1.99 -1.91 -2.64 116.97 112.15 1u3f h TYR 122 Ca -0.09 0.02 -0.10 0.00 2.00 0.00 0.00 58.73 60.56 1u3f h TYR 122 Cb 0.98 -0.13 -0.01 0.00 2.00 0.00 0.00 36.73 39.57 1u3f h TYR 122 CO 0.11 0.21 -0.18 1.88 -0.00 0.00 0.00 178.16 180.18 1u3f h TYR 123 N 0.49 0.85 -0.68 4.88 -1.99 -1.93 -0.35 116.97 118.24 1u3f h TYR 123 Ca 0.24 -0.21 0.08 0.00 2.00 0.00 0.00 58.73 60.83 1u3f h TYR 123 Cb 0.17 -0.19 -0.07 0.00 2.00 0.00 0.00 36.73 38.64 1u3f h TYR 123 CO -0.11 0.94 0.34 -0.44 -0.00 0.00 0.00 178.16 178.89 1u3f h ASP 124 N 0.51 0.45 -0.03 3.88 3.32 -1.85 0.47 116.42 123.17 1u3f h ASP 124 Ca 0.08 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 1u3f h ASP 124 Cb 0.72 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.25 1u3f h ASP 124 CO 0.05 0.27 -0.01 0.03 -1.72 0.00 0.00 179.24 177.87 1u3f h ARG 125 N 0.59 0.06 0.58 3.56 3.08 -1.41 -3.20 114.38 117.65 1u3f h ARG 125 Ca 0.33 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.32 1u3f h ARG 125 Cb 0.31 -0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.37 1u3f h ARG 125 CO -0.25 0.41 -0.28 -0.92 -1.07 0.00 0.00 179.97 177.87 1u3f h TYR 126 N -0.30 -0.73 -0.15 3.04 3.20 -0.39 -3.19 116.97 118.46 1u3f h TYR 126 Ca 0.01 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.90 1u3f h TYR 126 Cb 0.39 0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.90 1u3f h TYR 126 CO 0.05 -0.39 0.37 -0.07 -1.64 0.00 0.00 178.16 176.48 1u3f h LEU 127 N -0.98 0.00 -1.70 2.82 3.38 -0.21 -0.85 115.31 117.78 1u3f h LEU 127 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1u3f h LEU 127 Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1u3f h LEU 127 CO 0.13 0.00 0.00 -0.03 0.09 0.00 0.00 178.44 178.63 1u3f h MET 128 N 0.00 0.00 -0.00 1.13 4.05 -1.54 -2.51 114.93 116.05 1u3f h MET 128 Ca 0.07 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.49 1u3f h MET 128 Cb 0.82 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.62 1u3f h MET 128 CO -0.00 0.00 -0.13 1.04 0.23 0.00 0.00 176.91 178.05 1u3f n GLN 129 N -2.63 0.15 -2.21 0.39 6.02 -0.32 -4.89 117.38 113.89 1u3f n GLN 129 Ca -0.01 -0.04 -0.42 0.00 -0.01 0.00 0.00 57.00 56.53 1u3f n GLN 129 Cb 0.14 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 29.87 1u3f n GLN 129 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1u3f s LEU 130 N -2.87 4.36 0.00 1.08 1.43 -0.95 -4.81 118.68 116.92 1u3f s LEU 130 Ca 0.17 2.24 0.00 0.00 -1.03 0.00 0.00 54.13 55.51 1u3f s LEU 130 Cb 0.19 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.83 1u3f s LEU 130 CO 0.55 -0.65 0.54 0.35 0.23 0.00 0.00 176.35 177.37 1u3f n THR 131 N 4.14 0.29 -0.87 5.49 -2.24 -1.26 -4.73 114.28 115.09 1u3f n THR 131 Ca 0.12 -0.44 0.08 0.00 -2.27 0.00 0.00 64.05 61.54 1u3f n THR 131 Cb 0.43 1.06 0.27 0.00 -2.10 0.00 0.00 70.33 69.99 1u3f n THR 131 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1u3f n ARG 132 N -0.15 3.17 -2.13 -0.78 1.74 -1.26 -4.94 116.66 112.31 1u3f n ARG 132 Ca 0.00 -2.79 -0.20 0.00 -0.77 0.00 0.00 57.85 54.10 1u3f n ARG 132 Cb 0.23 -1.83 -0.03 0.00 -1.02 0.00 0.00 32.46 29.81 1u3f n ARG 132 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1u3f n GLN 133 N -0.20 -1.50 -1.79 5.56 3.00 -1.26 -4.92 117.38 116.26 1u3f n GLN 133 Ca 0.21 1.02 -0.41 0.00 -0.01 0.00 0.00 57.00 57.81 1u3f n GLN 133 Cb 0.87 -5.54 -0.01 0.00 0.00 0.00 0.00 30.24 25.56 1u3f n GLN 133 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 1u3f s GLN 134 N -4.58 4.13 0.23 -1.09 1.11 -1.26 -4.90 119.66 113.30 1u3f s GLN 134 Ca 0.00 2.57 -0.32 0.00 0.01 0.00 0.00 55.36 57.62 1u3f s GLN 134 Cb 0.00 -3.02 -0.13 0.00 -1.01 0.00 0.00 33.01 28.85 1u3f s GLN 134 CO 0.00 -0.61 1.59 -2.30 0.01 0.00 0.00 175.29 173.98 1u3f n PRO 135 N 2.00 2.49 -3.71 2.91 -0.02 -1.25 -4.87 135.00 132.55 1u3f n PRO 135 Ca 0.07 0.89 -0.38 0.00 -2.02 0.00 0.00 63.50 62.07 1u3f n PRO 135 Cb 0.38 -2.67 -0.11 0.00 -0.02 0.00 0.00 33.50 31.08 1u3f n PRO 135 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1u3f s LYS 136 N 0.26 2.28 -0.27 -0.52 1.02 -1.26 -1.77 119.74 119.48 1u3f s LYS 136 Ca 0.71 -1.66 -0.04 0.00 0.02 0.00 0.00 55.97 54.99 1u3f s LYS 136 Cb -0.56 -3.65 0.02 0.00 -0.52 0.00 0.00 37.83 33.11 1u3f s LYS 136 CO 0.42 -1.02 0.01 0.42 -0.92 0.00 0.00 175.35 174.26 1u3f s ILE 137 N 1.26 3.42 0.28 2.17 1.01 0.86 0.22 121.20 130.42 1u3f s ILE 137 Ca 0.05 -0.84 -0.28 0.00 0.00 0.00 0.00 60.65 59.58 1u3f s ILE 137 Cb -0.23 -2.74 -0.09 0.00 0.01 0.00 0.00 42.46 39.40 1u3f s ILE 137 CO -0.02 0.15 0.95 -0.83 0.00 0.00 0.00 174.94 175.19 1u3f s GLY 138 N 1.42 2.99 -0.23 6.18 0.00 -0.41 0.27 107.32 117.53 1u3f s GLY 138 Ca 0.02 0.59 -0.05 0.00 0.00 0.00 0.00 44.72 45.28 1u3f s GLY 138 CO -0.01 1.11 0.00 -0.42 0.00 0.00 0.00 173.10 173.78 1u3f s ILE 139 N -1.35 3.72 0.29 0.90 -1.09 0.02 -1.10 121.20 122.58 1u3f s ILE 139 Ca 0.45 -0.39 -0.15 0.00 -2.23 0.00 0.00 60.65 58.33 1u3f s ILE 139 Cb -0.23 -2.72 0.01 0.00 -1.58 0.00 0.00 42.46 37.94 1u3f s ILE 139 CO 0.29 0.38 0.62 0.00 -1.23 0.00 0.00 174.94 175.00 1u3f s ALA 140 N 1.53 -0.60 -0.02 9.38 0.00 -0.63 -4.15 121.76 127.26 1u3f s ALA 140 Ca 0.06 -0.70 -0.10 0.00 0.00 0.00 0.00 51.96 51.22 1u3f s ALA 140 Cb -0.15 0.93 -0.05 0.00 0.00 0.00 0.00 23.12 23.86 1u3f s ALA 140 CO -0.01 -0.94 0.29 0.71 0.00 0.00 0.00 175.76 175.81 1u3f s TYR 141 N -3.63 3.64 0.45 0.00 1.51 -1.26 -3.79 117.35 114.26 1u3f s TYR 141 Ca 0.18 0.72 0.27 0.00 -1.01 0.00 0.00 57.07 57.23 1u3f s TYR 141 Cb -0.03 -2.09 1.31 0.00 -0.11 0.00 0.00 41.96 41.04 1u3f s TYR 141 CO 0.10 0.65 1.73 1.03 -1.11 0.00 0.00 175.55 177.94 1u3f h SER 142 N 4.48 0.28 0.00 2.29 0.87 -1.95 0.11 113.55 119.63 1u3f h SER 142 Ca -0.52 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.12 1u3f h SER 142 Cb 1.21 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.21 1u3f h SER 142 CO 0.62 -0.01 0.00 2.22 -0.53 0.00 0.00 176.83 179.13 1u3f n PHE 143 N -4.52 0.00 1.36 2.24 -1.74 -1.26 -3.16 117.46 110.37 1u3f n PHE 143 Ca 0.29 0.00 0.09 0.00 -0.56 0.00 0.00 57.45 57.28 1u3f n PHE 143 Cb 1.16 0.00 0.37 0.00 1.52 0.00 0.00 39.48 42.53 1u3f n PHE 143 CO 0.00 0.00 0.00 1.04 -0.56 0.00 0.00 176.76 177.24 1u3f n GLN 144 N -0.85 1.58 -2.26 3.97 6.02 0.37 -4.86 117.38 121.36 1u3f n GLN 144 Ca 0.15 -0.88 -0.37 0.00 -0.01 0.00 0.00 57.00 55.90 1u3f n GLN 144 Cb 0.07 -1.35 -0.01 0.00 1.02 0.00 0.00 30.24 29.97 1u3f n GLN 144 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1u3f s LYS 145 N -1.81 3.69 0.16 -1.09 2.20 -1.19 -2.27 119.74 119.44 1u3f s LYS 145 Ca 0.30 1.75 -0.18 0.00 -0.36 0.00 0.00 55.97 57.48 1u3f s LYS 145 Cb 0.15 -2.35 0.04 0.00 -1.51 0.00 0.00 37.83 34.16 1u3f s LYS 145 CO 0.23 -0.60 0.48 0.20 -0.36 0.00 0.00 175.35 175.31 1u3f s GLY 146 N -1.42 -0.22 -0.94 5.54 0.00 0.30 -4.83 107.32 105.75 1u3f s GLY 146 Ca 0.65 -0.08 -0.02 0.00 0.00 0.00 0.00 44.72 45.27 1u3f s GLY 146 CO 0.34 -0.23 1.05 1.34 0.00 0.00 0.00 173.10 175.60 1u3f n ASP 147 N -0.30 5.04 -4.52 1.64 4.64 -1.26 -3.89 116.55 117.90 1u3f n ASP 147 Ca -0.13 -3.27 -0.24 0.00 -1.38 0.00 0.00 54.79 49.77 1u3f n ASP 147 Cb 0.63 -1.10 -0.09 0.00 -1.04 0.00 0.00 41.12 39.52 1u3f n ASP 147 CO 0.00 0.00 0.00 0.72 -0.82 0.00 0.00 177.20 177.10 1u3f s PHE 148 N -2.03 2.40 -0.12 -0.67 -0.71 -1.26 -4.18 117.98 111.41 1u3f s PHE 148 Ca 0.32 -0.30 -0.05 0.00 -1.04 0.00 0.00 56.93 55.85 1u3f s PHE 148 Cb 0.00 -1.06 -0.04 0.00 -1.21 0.00 0.00 43.02 40.72 1u3f s PHE 148 CO -0.02 0.69 0.08 -0.51 -1.34 0.00 0.00 175.22 174.11 1u3f s LEU 149 N -3.56 4.01 0.16 -1.99 1.43 -1.24 -4.86 118.68 112.63 1u3f s LEU 149 Ca 0.30 0.30 -0.30 0.00 -1.03 0.00 0.00 54.13 53.40 1u3f s LEU 149 Cb -0.05 -1.96 -0.08 0.00 0.03 0.00 0.00 46.19 44.13 1u3f s LEU 149 CO 0.16 0.37 1.21 0.00 0.23 0.00 0.00 176.35 178.32 1u3f s ALA 150 N -0.78 3.44 0.68 4.21 0.00 -1.26 -4.94 121.76 123.11 1u3f s ALA 150 Ca 0.13 0.95 -0.11 0.00 0.00 0.00 0.00 51.96 52.93 1u3f s ALA 150 Cb -0.12 -3.43 -0.00 0.00 0.00 0.00 0.00 23.12 19.57 1u3f s ALA 150 CO 0.03 -0.40 1.07 -0.51 0.00 0.00 0.00 175.76 175.94 1u3f s ASP 151 N 0.34 5.67 0.62 0.00 1.01 -1.26 -4.96 116.67 118.09 1u3f s ASP 151 Ca 0.55 1.30 0.33 0.00 0.71 0.00 0.00 52.55 55.44 1u3f s ASP 151 Cb -0.33 -2.20 1.91 0.00 1.01 0.00 0.00 42.92 43.31 1u3f s ASP 151 CO 0.35 -1.21 2.20 -0.65 0.21 0.00 0.00 175.17 176.07 1u3f h PRO 152 N -0.56 0.00 -0.27 8.23 0.11 -2.06 -2.32 132.00 135.12 1u3f h PRO 152 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1u3f h PRO 152 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1u3f h PRO 152 CO 0.62 0.00 0.00 -2.67 -0.21 0.00 0.00 178.00 175.74 1u3f n TRP 153 N -3.55 0.35 -2.78 0.65 2.14 -1.26 -4.93 117.44 108.06 1u3f n TRP 153 Ca -0.01 -0.17 -0.42 0.00 2.07 0.00 0.00 57.50 58.97 1u3f n TRP 153 Cb 0.19 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.66 1u3f n TRP 153 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1u3f s ASP 154 N -1.52 7.25 -0.14 -0.67 -0.00 -0.88 -4.82 116.67 115.89 1u3f s ASP 154 Ca 0.35 1.52 -0.25 0.00 -0.00 0.00 0.00 52.55 54.17 1u3f s ASP 154 Cb 0.20 -2.53 -0.02 0.00 -0.00 0.00 0.00 42.92 40.57 1u3f s ASP 154 CO 0.29 -0.28 0.81 -0.69 -0.00 0.00 0.00 175.17 175.29 1u3f s VAL 155 N 1.22 4.92 0.48 -1.27 1.01 -1.26 -4.96 120.40 120.54 1u3f s VAL 155 Ca 0.48 1.60 0.18 0.00 0.00 0.00 0.00 61.98 64.24 1u3f s VAL 155 Cb -0.20 -4.12 0.24 0.00 0.00 0.00 0.00 36.38 32.30 1u3f s VAL 155 CO 0.23 0.08 2.07 -0.61 0.00 0.00 0.00 175.10 176.88 1u3f h GLN 156 N 7.19 0.00 -1.61 2.72 4.15 -1.95 -3.41 115.11 122.20 1u3f h GLN 156 Ca -0.32 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.10 1u3f h GLN 156 Cb 1.15 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.84 1u3f h GLN 156 CO 0.81 0.11 -0.39 1.28 -1.93 0.00 0.00 178.83 178.71 1u3f n LEU 157 N -4.23 -2.28 0.12 -2.39 4.77 -1.26 -3.58 117.00 108.15 1u3f n LEU 157 Ca -0.03 1.32 0.12 0.00 -0.03 0.00 0.00 56.01 57.39 1u3f n LEU 157 Cb 0.19 -0.70 0.16 0.00 -2.33 0.00 0.00 43.42 40.74 1u3f n LEU 157 CO 0.34 0.04 0.46 0.44 -1.33 0.00 0.00 177.39 177.34 1u3f h ASP 158 N 0.88 0.00 -3.76 -1.43 3.32 -0.55 -3.46 116.42 111.42 1u3f h ASP 158 Ca 0.00 -0.07 0.16 0.00 0.02 0.00 0.00 57.03 57.14 1u3f h ASP 158 Cb 0.00 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 39.31 1u3f h ASP 158 CO 0.00 0.03 0.73 -0.22 -1.72 0.00 0.00 179.24 178.06 1u3f s LEU 159 N -5.07 -0.22 -0.29 1.55 2.96 -1.18 -5.00 118.68 111.44 1u3f s LEU 159 Ca 0.05 0.21 0.03 0.00 -0.22 0.00 0.00 54.13 54.20 1u3f s LEU 159 Cb 0.10 1.52 0.07 0.00 0.50 0.00 0.00 46.19 48.38 1u3f s LEU 159 CO 0.71 -0.22 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.83 1u3f s ILE 160 N -1.26 2.29 -0.20 6.68 -1.09 -1.26 -1.29 121.20 125.07 1u3f s ILE 160 Ca 0.04 -1.80 -0.21 0.00 -2.23 0.00 0.00 60.65 56.44 1u3f s ILE 160 Cb -0.01 -2.44 -0.02 0.00 -1.58 0.00 0.00 42.46 38.41 1u3f s ILE 160 CO -0.03 -0.19 0.66 -0.63 -1.23 0.00 0.00 174.94 173.52 1u3f s ILE 161 N 1.06 5.00 0.33 2.92 1.01 -0.26 -4.97 121.20 126.28 1u3f s ILE 161 Ca -0.03 1.25 0.01 0.00 0.00 0.00 0.00 60.65 61.88 1u3f s ILE 161 Cb -0.20 -3.97 -0.01 0.00 0.01 0.00 0.00 42.46 38.29 1u3f s ILE 161 CO -0.05 0.09 0.39 0.54 0.00 0.00 0.00 174.94 175.90 1u3f s ASN 162 N 1.21 1.15 0.45 3.58 4.22 -1.26 -1.60 114.94 122.70 1u3f s ASN 162 Ca 0.30 -1.58 0.14 0.00 -2.14 0.00 0.00 52.86 49.59 1u3f s ASN 162 Cb -0.16 0.61 1.02 0.00 1.28 0.00 0.00 41.25 44.01 1u3f s ASN 162 CO 0.10 -1.19 2.01 -2.24 -2.04 0.00 0.00 177.10 173.74 1u3f h ASP 163 N 2.14 0.01 0.00 3.54 3.04 -1.87 -3.45 116.42 119.84 1u3f h ASP 163 Ca -0.27 -0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.52 1u3f h ASP 163 Cb 1.24 -0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.52 1u3f h ASP 163 CO 0.38 0.17 0.00 -0.62 -2.04 0.00 0.00 179.24 177.13