#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sbq n ASP 2 N 0.00 -2.46 0.21 6.12 3.85 -1.26 -3.93 116.55 119.07 1sbq n ASP 2 Ca 0.00 -0.06 0.14 0.00 -0.71 0.00 0.00 54.79 54.15 1sbq n ASP 2 Cb 0.00 -0.93 0.37 0.00 -1.35 0.00 0.00 41.12 39.21 1sbq n ASP 2 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.20 176.26 1sbq h LYS 3 N -1.90 0.00 -0.53 0.11 2.10 -1.90 -3.28 116.57 111.16 1sbq h LYS 3 Ca -0.51 0.00 0.10 0.00 -2.00 0.00 0.00 60.65 58.24 1sbq h LYS 3 Cb 1.36 0.00 -0.09 0.00 -0.90 0.00 0.00 32.23 32.60 1sbq h LYS 3 CO 0.36 0.00 0.02 -0.91 -2.00 0.00 0.00 179.45 176.92 1sbq h ASN 4 N 0.00 -0.19 0.33 7.07 -0.26 -1.98 0.28 115.58 120.82 1sbq h ASN 4 Ca 0.00 0.12 -0.00 0.00 -0.56 0.00 0.00 56.30 55.86 1sbq h ASN 4 Cb 0.78 0.21 -0.02 0.00 -1.06 0.00 0.00 38.32 38.24 1sbq h ASN 4 CO 0.00 -0.07 -0.28 0.00 -1.06 0.00 0.00 177.43 176.03 1sbq h ALA 5 N 1.47 -0.61 -0.78 -0.83 0.00 -1.93 -2.83 119.26 113.74 1sbq h ALA 5 Ca 0.27 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1sbq h ALA 5 Cb 0.41 0.38 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 1sbq h ALA 5 CO -0.43 -0.87 0.51 -0.07 0.00 0.00 0.00 179.25 178.38 1sbq h LEU 6 N -0.62 0.85 -1.04 0.00 4.07 -1.60 0.17 115.31 117.15 1sbq h LEU 6 Ca -0.02 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.93 1sbq h LEU 6 Cb 0.55 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 42.09 1sbq h LEU 6 CO -0.02 0.60 0.35 -0.09 -1.08 0.00 0.00 178.44 178.19 1sbq h ARG 7 N 1.00 0.00 0.00 1.13 9.65 -0.21 -0.17 114.38 125.79 1sbq h ARG 7 Ca 0.30 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 59.16 1sbq h ARG 7 Cb -0.04 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.53 1sbq h ARG 7 CO -0.09 0.00 -1.06 1.63 2.80 0.00 0.00 179.97 183.24 1sbq n LYS 8 N -2.23 0.03 0.02 0.20 5.02 -0.57 -4.09 118.16 116.54 1sbq n LYS 8 Ca -0.01 0.01 0.05 0.00 -2.02 0.00 0.00 58.31 56.33 1sbq n LYS 8 Cb 0.37 -0.86 0.20 0.00 -0.02 0.00 0.00 35.03 34.73 1sbq n LYS 8 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1sbq n GLN 9 N -2.71 0.03 -0.07 1.97 10.64 0.51 0.41 117.38 128.16 1sbq n GLN 9 Ca -0.02 0.41 -0.06 0.00 -1.83 0.00 0.00 57.00 55.49 1sbq n GLN 9 Cb 0.52 -1.56 -0.15 0.00 -0.86 0.00 0.00 30.24 28.18 1sbq n GLN 9 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.06 174.34 1sbq n ILE 10 N -1.61 1.23 1.07 -0.39 5.41 -0.10 -4.14 119.36 120.83 1sbq n ILE 10 Ca 0.01 -0.79 0.12 0.00 1.00 0.00 0.00 62.75 63.09 1sbq n ILE 10 Cb 0.09 -0.50 0.15 0.00 -0.71 0.00 0.00 39.64 38.66 1sbq n ILE 10 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1sbq n LEU 11 N -2.74 1.15 -0.67 1.39 4.77 0.14 -2.20 117.00 118.84 1sbq n LEU 11 Ca -0.25 -0.37 0.12 0.00 -0.03 0.00 0.00 56.01 55.47 1sbq n LEU 11 Cb 1.05 -0.10 0.07 0.00 -2.33 0.00 0.00 43.42 42.11 1sbq n LEU 11 CO 0.44 0.24 0.46 1.67 -1.33 0.00 0.00 177.39 178.86 1sbq n GLN 12 N -0.88 1.64 0.00 3.23 -0.06 0.17 -3.99 117.38 117.48 1sbq n GLN 12 Ca 0.08 -1.34 0.00 0.00 -2.00 0.00 0.00 57.00 53.74 1sbq n GLN 12 Cb 0.37 -1.47 0.00 0.00 -4.06 0.00 0.00 30.24 25.08 1sbq n GLN 12 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 1sbq n LYS 13 N 0.49 2.53 -0.11 3.69 4.76 -1.25 -4.17 118.16 124.10 1sbq n LYS 13 Ca 0.11 0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.44 1sbq n LYS 13 Cb 0.51 -0.74 -0.03 0.00 -1.84 0.00 0.00 35.03 32.93 1sbq n LYS 13 CO 0.00 0.00 0.00 -0.09 -1.37 0.00 0.00 177.40 175.94 1sbq h ARG 14 N 0.00 0.66 0.00 1.97 2.43 -1.59 -2.63 114.38 115.23 1sbq h ARG 14 Ca 0.00 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1sbq h ARG 14 Cb 0.00 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1sbq h ARG 14 CO 0.00 0.87 -0.57 0.52 -1.51 0.00 0.00 179.97 179.28 1sbq h MET 15 N 0.43 0.00 0.00 0.20 2.86 -1.84 -3.21 114.93 113.38 1sbq h MET 15 Ca 0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 1sbq h MET 15 Cb 0.66 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.32 1sbq h MET 15 CO 0.04 0.00 0.00 0.00 1.06 0.00 0.00 176.91 178.01 1sbq n ALA 16 N -2.09 2.51 -2.30 6.32 0.00 -1.06 -4.81 120.51 119.07 1sbq n ALA 16 Ca 0.02 -0.06 -0.40 0.00 0.00 0.00 0.00 53.44 53.01 1sbq n ALA 16 Cb 0.52 -1.15 -0.05 0.00 0.00 0.00 0.00 19.45 18.77 1sbq n ALA 16 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1sbq s LEU 17 N -1.30 4.48 0.12 0.00 2.96 -1.02 -4.98 118.68 118.95 1sbq s LEU 17 Ca 0.14 1.47 -0.32 0.00 -0.22 0.00 0.00 54.13 55.20 1sbq s LEU 17 Cb 0.06 -3.22 -0.11 0.00 0.50 0.00 0.00 46.19 43.42 1sbq s LEU 17 CO 0.11 0.07 1.80 -1.20 -1.32 0.00 0.00 176.35 175.81 1sbq n SER 18 N 2.48 3.89 -0.39 3.68 7.64 -1.26 -4.76 113.62 124.90 1sbq n SER 18 Ca -0.04 1.00 0.34 0.00 1.01 0.00 0.00 58.87 61.19 1sbq n SER 18 Cb 0.50 -1.52 0.67 0.00 -1.01 0.00 0.00 64.21 62.85 1sbq n SER 18 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1sbq h THR 19 N 4.52 0.35 0.11 0.44 1.03 -1.94 1.36 112.91 118.77 1sbq h THR 19 Ca -0.46 -0.04 -0.16 0.00 -0.01 0.00 0.00 66.41 65.74 1sbq h THR 19 Cb 1.23 0.21 0.02 0.00 -1.07 0.00 0.00 68.15 68.53 1sbq h THR 19 CO 0.94 0.02 -0.68 0.40 -0.01 0.00 0.00 175.52 176.20 1sbq h ILE 20 N 0.13 1.54 0.00 0.00 1.08 -2.01 -3.20 117.51 115.05 1sbq h ILE 20 Ca 0.66 -2.45 -0.01 0.00 -0.39 0.00 0.00 64.86 62.67 1sbq h ILE 20 Cb 2.27 3.16 -0.00 0.00 -3.07 0.00 0.00 36.82 39.18 1sbq h ILE 20 CO -0.16 0.69 -0.03 -0.08 -0.69 0.00 0.00 178.15 177.88 1sbq h GLU 21 N -0.43 0.00 -0.31 2.37 4.57 -0.22 -1.81 114.58 118.77 1sbq h GLU 21 Ca -0.12 0.00 -0.16 0.00 -1.18 0.00 0.00 59.36 57.90 1sbq h GLU 21 Cb 1.51 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 30.10 1sbq h GLU 21 CO 0.13 0.03 -0.46 -0.22 -1.18 0.00 0.00 179.01 177.31 1sbq h LYS 22 N 0.00 0.81 0.00 1.92 3.11 0.15 -2.51 116.57 120.04 1sbq h LYS 22 Ca -0.00 -0.46 -0.18 0.00 -2.81 0.00 0.00 60.65 57.20 1sbq h LYS 22 Cb 0.35 0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.59 1sbq h LYS 22 CO 0.00 1.09 -0.84 0.77 -2.81 0.00 0.00 179.45 177.66 1sbq h SER 23 N 0.64 0.03 -0.31 4.20 0.02 -1.35 -2.18 113.55 114.60 1sbq h SER 23 Ca 0.04 -0.03 -0.15 0.00 -0.84 0.00 0.00 61.79 60.81 1sbq h SER 23 Cb 1.03 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.56 1sbq h SER 23 CO 0.10 0.86 -0.37 -0.74 -1.14 0.00 0.00 176.83 175.54 1sbq h HIS 24 N 0.01 1.02 -0.33 3.45 -0.00 -1.35 -0.50 115.15 117.45 1sbq h HIS 24 Ca -0.01 -0.29 -0.16 0.00 -0.00 0.00 0.00 60.37 59.90 1sbq h HIS 24 Cb 1.48 -0.22 -0.01 0.00 -0.00 0.00 0.00 27.41 28.67 1sbq h HIS 24 CO 0.00 1.09 -0.43 -0.07 -0.00 0.00 0.00 177.93 178.52 1sbq h LEU 25 N 0.71 0.90 -0.23 0.26 3.38 -1.46 -2.61 115.31 116.25 1sbq h LEU 25 Ca 0.06 -0.43 -0.01 0.00 0.09 0.00 0.00 57.88 57.60 1sbq h LEU 25 Cb 0.94 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1sbq h LEU 25 CO 0.09 1.20 0.12 0.44 0.09 0.00 0.00 178.44 180.39 1sbq h ASP 26 N 0.68 0.29 -0.25 -0.43 3.45 -1.22 -1.69 116.42 117.25 1sbq h ASP 26 Ca 0.05 -0.09 0.06 0.00 0.43 0.00 0.00 57.03 57.47 1sbq h ASP 26 Cb 1.01 -0.07 -0.07 0.00 -0.56 0.00 0.00 39.33 39.64 1sbq h ASP 26 CO 0.10 0.30 -0.23 1.56 -1.57 0.00 0.00 179.24 179.40 1sbq h GLN 27 N 0.26 -0.22 -0.42 3.56 1.08 -1.02 -0.05 115.11 118.30 1sbq h GLN 27 Ca 0.08 0.01 0.06 0.00 -1.45 0.00 0.00 58.65 57.36 1sbq h GLN 27 Cb 0.08 0.05 -0.05 0.00 -0.05 0.00 0.00 27.48 27.50 1sbq h GLN 27 CO -0.01 -0.15 0.10 0.87 -0.95 0.00 0.00 178.83 178.69 1sbq h LYS 28 N -0.23 0.23 -0.50 1.46 1.79 -1.28 -1.16 116.57 116.87 1sbq h LYS 28 Ca 0.14 -0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.55 1sbq h LYS 28 Cb 0.44 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 31.02 1sbq h LYS 28 CO -0.38 0.15 0.15 0.82 -1.08 0.00 0.00 179.45 179.11 1sbq h ILE 29 N 0.24 1.23 -0.06 1.86 2.04 -0.64 -0.67 117.51 121.52 1sbq h ILE 29 Ca 0.20 -0.79 -0.09 0.00 1.00 0.00 0.00 64.86 65.18 1sbq h ILE 29 Cb 0.24 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1sbq h ILE 29 CO -0.25 0.29 -0.40 0.78 0.00 0.00 0.00 178.15 178.57 1sbq h ASN 30 N 0.69 0.12 0.23 1.72 4.21 -0.83 0.86 115.58 122.57 1sbq h ASN 30 Ca 0.16 -0.05 -0.01 0.00 1.21 0.00 0.00 56.30 57.61 1sbq h ASN 30 Cb 0.29 -0.03 0.00 0.00 -1.12 0.00 0.00 38.32 37.46 1sbq h ASN 30 CO -0.00 0.51 -0.11 1.56 -1.29 0.00 0.00 177.43 178.10 1sbq h GLN 31 N 0.10 -0.30 -0.26 0.81 4.20 -0.84 0.16 115.11 118.98 1sbq h GLN 31 Ca 0.01 0.02 0.06 0.00 0.06 0.00 0.00 58.65 58.80 1sbq h GLN 31 Cb 0.75 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.59 1sbq h GLN 31 CO 0.06 -0.09 0.18 0.87 -0.67 0.00 0.00 178.83 179.18 1sbq h LYS 32 N -0.46 0.07 0.58 1.46 1.57 -0.76 0.17 116.57 119.20 1sbq h LYS 32 Ca -0.03 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 1sbq h LYS 32 Cb 0.34 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.65 1sbq h LYS 32 CO 0.05 0.04 -0.28 -0.07 -0.57 0.00 0.00 179.45 178.63 1sbq h LEU 33 N 0.07 -0.66 -1.45 2.94 3.38 0.22 0.61 115.31 120.42 1sbq h LEU 33 Ca 0.12 -0.04 0.11 0.00 0.09 0.00 0.00 57.88 58.16 1sbq h LEU 33 Cb 0.39 0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.26 1sbq h LEU 33 CO -0.01 -0.30 0.49 0.58 0.09 0.00 0.00 178.44 179.29 1sbq h VAL 34 N -1.06 0.91 -0.55 1.22 2.07 -0.09 0.19 116.25 118.93 1sbq h VAL 34 Ca -0.08 -0.21 -0.10 0.00 0.82 0.00 0.00 66.70 67.13 1sbq h VAL 34 Cb 0.66 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 1sbq h VAL 34 CO 0.13 0.11 -0.06 0.00 0.02 0.00 0.00 177.57 177.77 1sbq h ALA 35 N 1.63 0.83 -0.67 1.67 0.00 -0.82 -1.08 119.26 120.83 1sbq h ALA 35 Ca 0.35 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1sbq h ALA 35 Cb 0.54 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1sbq h ALA 35 CO -0.12 0.66 0.19 0.35 0.00 0.00 0.00 179.25 180.33 1sbq h PHE 36 N 0.91 1.09 0.06 0.00 3.57 0.11 -3.29 116.94 119.39 1sbq h PHE 36 Ca 0.15 -0.12 -0.25 0.00 3.53 0.00 0.00 57.97 61.29 1sbq h PHE 36 Cb 0.62 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 1sbq h PHE 36 CO 0.04 0.89 -1.18 -0.07 -2.23 0.00 0.00 178.31 175.76 1sbq h LEU 37 N 0.98 0.20 -0.61 0.59 3.38 -1.12 -3.39 115.31 115.34 1sbq h LEU 37 Ca 0.21 -0.22 0.13 0.00 0.09 0.00 0.00 57.88 58.09 1sbq h LEU 37 Cb 0.32 -0.06 -0.11 0.00 0.09 0.00 0.00 40.66 40.90 1sbq h LEU 37 CO -0.00 1.18 -0.03 0.74 0.09 0.00 0.00 178.44 180.41 1sbq h THR 38 N 0.03 0.47 -0.03 0.22 2.02 -1.26 -0.83 112.91 113.52 1sbq h THR 38 Ca -0.09 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.06 1sbq h THR 38 Cb 1.88 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 68.66 1sbq h THR 38 CO 0.16 0.02 0.00 -0.81 0.37 0.00 0.00 175.52 175.25 1sbq n PRO 39 N -5.31 1.09 -3.82 6.66 -0.04 -1.26 -4.57 135.00 127.75 1sbq n PRO 39 Ca 0.09 -0.14 -0.33 0.00 -0.04 0.00 0.00 63.50 63.08 1sbq n PRO 39 Cb 0.35 -1.11 -0.11 0.00 -0.04 0.00 0.00 33.50 32.59 1sbq n PRO 39 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1sbq s LYS 40 N -1.96 2.42 0.55 0.54 1.02 -0.32 -4.95 119.74 117.05 1sbq s LYS 40 Ca 0.10 -2.76 0.24 0.00 0.02 0.00 0.00 55.97 53.58 1sbq s LYS 40 Cb 0.05 -3.57 1.55 0.00 -0.52 0.00 0.00 37.83 35.34 1sbq s LYS 40 CO 0.08 -1.18 2.18 -1.35 -0.92 0.00 0.00 175.35 174.16 1sbq h PRO 41 N 6.50 0.00 0.00 -1.68 0.11 -1.81 -2.91 132.00 132.21 1sbq h PRO 41 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1sbq h PRO 41 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1sbq h PRO 41 CO 0.72 0.04 0.00 0.00 -0.21 0.00 0.00 178.00 178.55 1sbq s ILE 43 N -2.28 4.62 -0.14 0.00 -1.09 -1.10 -4.77 121.20 116.43 1sbq s ILE 43 Ca 0.37 -1.02 0.19 0.00 -2.23 0.00 0.00 60.65 57.97 1sbq s ILE 43 Cb 0.21 -4.67 -0.28 0.00 -1.58 0.00 0.00 42.46 36.13 1sbq s ILE 43 CO 0.40 -1.39 0.21 0.29 -1.23 0.00 0.00 174.94 173.22 1sbq n LYS 44 N 6.87 0.70 -4.00 2.79 5.02 -1.26 -4.85 118.16 123.42 1sbq n LYS 44 Ca 0.06 -0.08 -0.25 0.00 -2.02 0.00 0.00 58.31 56.03 1sbq n LYS 44 Cb 0.46 -1.52 -0.17 0.00 -0.02 0.00 0.00 35.03 33.79 1sbq n LYS 44 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1sbq s THR 45 N -2.84 0.84 -0.03 -0.18 2.01 -1.26 -0.33 115.64 113.84 1sbq s THR 45 Ca -0.09 -0.20 0.07 0.00 0.31 0.00 0.00 61.69 61.77 1sbq s THR 45 Cb 0.09 -0.87 -0.02 0.00 0.01 0.00 0.00 72.50 71.70 1sbq s THR 45 CO 0.85 0.33 -0.23 -0.51 -0.69 0.00 0.00 174.62 174.36 1sbq s ILE 46 N 1.52 2.28 -0.19 1.82 2.07 0.18 -1.60 121.20 127.28 1sbq s ILE 46 Ca 0.00 -1.02 -0.17 0.00 -1.41 0.00 0.00 60.65 58.05 1sbq s ILE 46 Cb -0.13 -1.82 -0.04 0.00 0.13 0.00 0.00 42.46 40.61 1sbq s ILE 46 CO -0.05 0.58 0.46 0.00 -1.91 0.00 0.00 174.94 174.02 1sbq s ALA 47 N -0.57 3.54 0.00 1.50 0.00 -0.30 -0.32 121.76 125.62 1sbq s ALA 47 Ca 0.08 -0.43 0.00 0.00 0.00 0.00 0.00 51.96 51.62 1sbq s ALA 47 Cb -0.11 -2.71 0.00 0.00 0.00 0.00 0.00 23.12 20.31 1sbq s ALA 47 CO -0.00 -0.31 0.00 1.28 0.00 0.00 0.00 175.76 176.73 1sbq n LEU 48 N 4.48 0.00 -3.50 0.00 4.77 0.92 -1.02 117.00 122.64 1sbq n LEU 48 Ca -0.07 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.78 1sbq n LEU 48 Cb 0.51 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.56 1sbq n LEU 48 CO 0.41 -0.01 0.34 -0.72 -1.33 0.00 0.00 177.39 176.08 1sbq s TYR 49 N 1.01 -0.47 -0.32 -1.77 -0.85 -1.26 -4.21 117.35 109.48 1sbq s TYR 49 Ca 0.00 0.38 -0.24 0.00 -0.52 0.00 0.00 57.07 56.69 1sbq s TYR 49 Cb 0.00 0.44 0.00 0.00 0.38 0.00 0.00 41.96 42.78 1sbq s TYR 49 CO 0.00 -0.75 0.80 -1.21 -1.52 0.00 0.00 175.55 172.87 1sbq s GLU 50 N -3.17 3.92 0.34 -3.49 2.02 -1.26 -4.94 118.70 112.12 1sbq s GLU 50 Ca -0.01 0.54 -0.29 0.00 0.02 0.00 0.00 54.97 55.23 1sbq s GLU 50 Cb -0.00 -3.74 -0.11 0.00 0.10 0.00 0.00 34.13 30.37 1sbq s GLU 50 CO -0.08 -0.72 1.51 -2.14 0.02 0.00 0.00 175.26 173.86 1sbq s PRO 51 N 3.01 4.13 0.03 0.39 0.02 -1.26 -5.02 135.00 136.31 1sbq s PRO 51 Ca 0.33 2.55 0.05 0.00 0.02 0.00 0.00 61.00 63.94 1sbq s PRO 51 Cb -0.14 -3.00 -0.03 0.00 0.02 0.00 0.00 34.50 31.35 1sbq s PRO 51 CO 0.14 -0.55 -0.09 0.42 -0.33 0.00 0.00 177.00 176.58 1sbq s ILE 52 N -0.67 3.43 0.07 2.83 1.01 -1.26 -5.01 121.20 121.59 1sbq s ILE 52 Ca 0.57 -0.96 -0.17 0.00 0.00 0.00 0.00 60.65 60.09 1sbq s ILE 52 Cb -0.46 -2.51 -0.09 0.00 0.01 0.00 0.00 42.46 39.40 1sbq s ILE 52 CO 0.56 0.32 0.37 1.17 0.00 0.00 0.00 174.94 177.36 1sbq n LYS 53 N 1.36 0.00 0.00 2.79 4.81 -1.26 -0.67 118.16 125.18 1sbq n LYS 53 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.29 1sbq n LYS 53 Cb 0.52 -0.61 0.00 0.00 0.02 0.00 0.00 35.03 34.96 1sbq n LYS 53 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1sbq n ASN 54 N 0.97 0.00 -4.70 3.14 5.03 -1.26 -5.00 115.26 113.44 1sbq n ASN 54 Ca 0.10 0.00 -0.36 0.00 0.87 0.00 0.00 54.58 55.18 1sbq n ASN 54 Cb 0.10 0.00 0.08 0.00 -1.02 0.00 0.00 39.78 38.94 1sbq n ASN 54 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1sbq n GLU 55 N 0.00 0.88 -1.82 3.52 1.02 0.15 -4.89 120.64 119.51 1sbq n GLU 55 Ca 0.00 0.36 -0.42 0.00 -0.02 0.00 0.00 57.16 57.08 1sbq n GLU 55 Cb 0.00 -2.46 -0.03 0.00 -0.02 0.00 0.00 31.44 28.93 1sbq n GLU 55 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1sbq s VAL 56 N -1.56 2.43 0.16 2.62 1.01 -1.26 -4.78 120.40 119.02 1sbq s VAL 56 Ca 0.80 0.22 -0.04 0.00 0.00 0.00 0.00 61.98 62.96 1sbq s VAL 56 Cb -0.36 -3.14 -0.05 0.00 0.00 0.00 0.00 36.38 32.82 1sbq s VAL 56 CO 0.43 0.01 0.38 0.42 0.00 0.00 0.00 175.10 176.35 1sbq s THR 57 N 1.62 5.17 -0.34 3.92 -4.23 -1.26 -4.78 115.64 115.74 1sbq s THR 57 Ca 0.74 -0.03 -0.20 0.00 -1.18 0.00 0.00 61.69 61.02 1sbq s THR 57 Cb -0.46 -3.64 -0.00 0.00 1.34 0.00 0.00 72.50 69.74 1sbq s THR 57 CO 0.33 -0.01 0.64 -0.36 -0.54 0.00 0.00 174.62 174.68 1sbq s PHE 58 N -1.71 3.17 0.81 3.99 0.40 -1.26 -4.91 117.98 118.47 1sbq s PHE 58 Ca 0.41 0.43 -0.12 0.00 -0.60 0.00 0.00 56.93 57.05 1sbq s PHE 58 Cb -0.12 -3.10 0.08 0.00 0.51 0.00 0.00 43.02 40.39 1sbq s PHE 58 CO 0.26 -0.58 1.18 0.14 0.70 0.00 0.00 175.22 176.91 1sbq s VAL 59 N 2.69 2.03 0.14 -0.44 -7.23 -1.26 -4.93 120.40 111.41 1sbq s VAL 59 Ca 0.25 0.01 -0.21 0.00 -1.81 0.00 0.00 61.98 60.22 1sbq s VAL 59 Cb -0.15 -3.01 -0.00 0.00 0.56 0.00 0.00 36.38 33.78 1sbq s VAL 59 CO 0.14 -0.01 1.67 -2.24 -0.31 0.00 0.00 175.10 174.35 1sbq h ASP 60 N -1.05 -0.42 0.37 4.85 2.03 -2.00 -2.35 116.42 117.85 1sbq h ASP 60 Ca -0.46 0.09 0.00 0.00 -0.73 0.00 0.00 57.03 55.93 1sbq h ASP 60 Cb 1.33 0.22 0.00 0.00 -0.83 0.00 0.00 39.33 40.05 1sbq h ASP 60 CO 0.66 -0.17 0.00 2.19 -1.03 0.00 0.00 179.24 180.89 1sbq h PHE 61 N -0.12 0.00 0.00 4.15 -5.15 -1.98 -1.02 116.94 112.82 1sbq h PHE 61 Ca 0.11 0.00 -0.06 0.00 -0.20 0.00 0.00 57.97 57.82 1sbq h PHE 61 Cb 0.29 0.00 0.01 0.00 0.22 0.00 0.00 35.95 36.47 1sbq h PHE 61 CO -0.28 0.00 -0.25 0.35 -2.00 0.00 0.00 178.31 176.13 1sbq h PHE 62 N 0.00 0.24 -0.03 6.09 3.57 -1.79 -0.92 116.94 124.10 1sbq h PHE 62 Ca 0.00 -0.13 -0.08 0.00 3.53 0.00 0.00 57.97 61.28 1sbq h PHE 62 Cb 0.19 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 1sbq h PHE 62 CO 0.00 0.95 -0.38 0.74 -2.23 0.00 0.00 178.31 177.39 1sbq h PHE 63 N -0.54 0.07 -0.21 0.41 -1.00 -1.24 -1.91 116.94 112.51 1sbq h PHE 63 Ca -0.03 -0.02 -0.03 0.00 2.81 0.00 0.00 57.97 60.71 1sbq h PHE 63 Cb 1.02 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 40.56 1sbq h PHE 63 CO 0.19 0.43 0.03 1.49 -1.61 0.00 0.00 178.31 178.84 1sbq h GLU 64 N 0.05 0.36 -0.28 1.51 4.57 -1.23 -2.36 114.58 117.21 1sbq h GLU 64 Ca 0.00 -0.10 0.06 0.00 -1.18 0.00 0.00 59.36 58.15 1sbq h GLU 64 Cb 0.70 -0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 29.18 1sbq h GLU 64 CO 0.05 0.51 -0.14 0.35 -1.18 0.00 0.00 179.01 178.60 1sbq h PHE 65 N 0.15 -0.35 -0.09 0.92 3.57 -0.62 -1.70 116.94 118.82 1sbq h PHE 65 Ca 0.06 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.62 1sbq h PHE 65 Cb 0.33 0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.24 1sbq h PHE 65 CO 0.02 -0.21 -0.04 -0.07 -2.23 0.00 0.00 178.31 175.78 1sbq h LEU 66 N -0.11 -0.15 -0.26 0.59 3.38 -1.26 -1.74 115.31 115.77 1sbq h LEU 66 Ca 0.15 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1sbq h LEU 66 Cb 0.33 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1sbq h LEU 66 CO -0.35 -0.06 0.16 0.50 0.09 0.00 0.00 178.44 178.79 1sbq h LYS 67 N -0.04 0.35 0.00 1.13 3.11 -1.26 -0.39 116.57 119.47 1sbq h LYS 67 Ca 0.05 -0.03 -0.01 0.00 -2.81 0.00 0.00 60.65 57.85 1sbq h LYS 67 Cb 0.11 -0.08 -0.00 0.00 -1.00 0.00 0.00 32.23 31.27 1sbq h LYS 67 CO -0.11 0.26 -0.06 0.82 -2.81 0.00 0.00 179.45 177.55 1sbq h ILE 68 N 0.34 0.23 -0.37 2.00 5.03 -1.19 -2.60 117.51 120.94 1sbq h ILE 68 Ca 0.09 -0.45 0.00 0.00 -0.12 0.00 0.00 64.86 64.38 1sbq h ILE 68 Cb -0.01 1.36 0.00 0.00 -3.03 0.00 0.00 36.82 35.14 1sbq h ILE 68 CO -0.02 0.06 0.00 0.59 -0.68 0.00 0.00 178.15 178.10 1sbq n ASN 69 N -3.30 3.76 -3.73 1.72 3.02 -0.67 -4.99 115.26 111.07 1sbq n ASN 69 Ca -0.01 -2.54 -0.22 0.00 -0.03 0.00 0.00 54.58 51.78 1sbq n ASN 69 Cb 0.24 -0.44 0.03 0.00 -0.61 0.00 0.00 39.78 38.99 1sbq n ASN 69 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sbq n GLN 70 N 0.20 -4.69 -3.88 3.52 1.13 -0.82 -4.98 117.38 107.85 1sbq n GLN 70 Ca 0.19 0.59 -0.35 0.00 -1.94 0.00 0.00 57.00 55.48 1sbq n GLN 70 Cb 0.73 -5.09 -0.14 0.00 0.11 0.00 0.00 30.24 25.86 1sbq n GLN 70 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1sbq s ILE 71 N -3.71 3.17 0.14 5.09 1.01 -0.22 -4.88 121.20 121.81 1sbq s ILE 71 Ca 0.00 -1.21 -0.30 0.00 0.00 0.00 0.00 60.65 59.14 1sbq s ILE 71 Cb -0.00 -2.76 -0.07 0.00 0.01 0.00 0.00 42.46 39.65 1sbq s ILE 71 CO 0.82 -0.04 1.11 -0.60 0.00 0.00 0.00 174.94 176.24 1sbq s ARG 72 N 1.31 4.56 -0.13 2.79 3.52 0.55 -4.48 118.95 127.08 1sbq s ARG 72 Ca -0.03 1.71 -0.07 0.00 -0.13 0.00 0.00 55.73 57.22 1sbq s ARG 72 Cb -0.19 -3.30 -0.04 0.00 -1.56 0.00 0.00 34.95 29.86 1sbq s ARG 72 CO -0.01 -0.00 0.12 0.00 -0.81 0.00 0.00 175.30 174.59 1sbq s ALA 73 N 0.11 3.76 0.08 6.12 0.00 -1.26 0.49 121.76 131.06 1sbq s ALA 73 Ca 0.51 -0.67 0.06 0.00 0.00 0.00 0.00 51.96 51.86 1sbq s ALA 73 Cb -0.29 -1.92 -0.03 0.00 0.00 0.00 0.00 23.12 20.88 1sbq s ALA 73 CO 0.33 0.55 -0.16 0.14 0.00 0.00 0.00 175.76 176.61 1sbq s VAL 74 N -0.79 1.32 0.07 0.00 -7.23 0.56 -4.58 120.40 109.75 1sbq s VAL 74 Ca 0.13 -1.40 0.08 0.00 -1.81 0.00 0.00 61.98 58.99 1sbq s VAL 74 Cb -0.12 -1.25 -0.03 0.00 0.56 0.00 0.00 36.38 35.54 1sbq s VAL 74 CO 0.03 -0.18 -0.22 -0.31 -0.31 0.00 0.00 175.10 174.11 1sbq s TYR 75 N -1.27 1.95 0.45 2.82 1.51 0.14 -0.06 117.35 122.89 1sbq s TYR 75 Ca 0.01 -0.39 -0.23 0.00 -1.01 0.00 0.00 57.07 55.45 1sbq s TYR 75 Cb -0.10 -1.12 -0.08 0.00 -0.11 0.00 0.00 41.96 40.55 1sbq s TYR 75 CO 0.03 0.16 1.17 -1.25 -1.11 0.00 0.00 175.55 174.55 1sbq s PRO 76 N -1.49 3.80 -0.06 -1.71 0.04 -1.26 -1.42 135.00 132.90 1sbq s PRO 76 Ca 0.09 1.79 -0.01 0.00 0.04 0.00 0.00 61.00 62.91 1sbq s PRO 76 Cb -0.09 -2.45 0.03 0.00 0.04 0.00 0.00 34.50 32.03 1sbq s PRO 76 CO 0.03 -0.52 0.01 0.21 0.04 0.00 0.00 177.00 176.77 1sbq s LYS 77 N -2.64 0.47 -0.02 4.56 2.20 0.37 -4.91 119.74 119.78 1sbq s LYS 77 Ca 0.63 0.14 -0.30 0.00 -0.36 0.00 0.00 55.97 56.07 1sbq s LYS 77 Cb -0.29 -0.83 -0.05 0.00 -1.51 0.00 0.00 37.83 35.14 1sbq s LYS 77 CO 0.35 -0.28 1.44 0.08 -0.36 0.00 0.00 175.35 176.59 1sbq s VAL 78 N 1.84 3.71 -0.09 4.02 1.01 -1.26 -0.78 120.40 128.85 1sbq s VAL 78 Ca 0.02 1.05 0.15 0.00 0.00 0.00 0.00 61.98 63.20 1sbq s VAL 78 Cb -0.12 -3.67 -0.22 0.00 0.00 0.00 0.00 36.38 32.37 1sbq s VAL 78 CO -0.04 -0.03 0.19 -0.38 0.00 0.00 0.00 175.10 174.84 1sbq n ILE 79 N 4.86 0.59 -3.08 2.22 2.08 -0.08 -4.96 119.36 120.99 1sbq n ILE 79 Ca 0.14 -0.53 0.00 0.00 0.56 0.00 0.00 62.75 62.92 1sbq n ILE 79 Cb 0.43 -0.28 0.00 0.00 -0.75 0.00 0.00 39.64 39.04 1sbq n ILE 79 CO 0.00 0.00 0.00 -1.54 0.56 0.00 0.00 176.55 175.57 1sbq n SER 80 N -2.35 0.00 0.18 4.38 3.41 -1.15 -4.93 113.62 113.16 1sbq n SER 80 Ca -0.15 -0.96 0.14 0.00 -0.26 0.00 0.00 58.87 57.64 1sbq n SER 80 Cb 0.75 0.00 0.57 0.00 -0.26 0.00 0.00 64.21 65.26 1sbq n SER 80 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1sbq h ASP 81 N 0.00 0.00 0.00 4.04 3.32 -2.02 -3.33 116.42 118.43 1sbq h ASP 81 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1sbq h ASP 81 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1sbq h ASP 81 CO 0.00 0.00 -0.59 0.35 -1.72 0.00 0.00 179.24 177.28 1sbq n THR 82 N -2.53 0.00 -4.09 0.35 -2.24 -1.26 -4.95 114.28 99.55 1sbq n THR 82 Ca 0.01 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.47 1sbq n THR 82 Cb 0.25 0.24 -0.07 0.00 -2.10 0.00 0.00 70.33 68.65 1sbq n THR 82 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1sbq s GLU 83 N -1.20 3.02 0.09 -0.78 2.02 -1.25 -4.64 118.70 115.95 1sbq s GLU 83 Ca 0.00 -0.54 0.08 0.00 0.02 0.00 0.00 54.97 54.53 1sbq s GLU 83 Cb 0.00 -2.82 -0.03 0.00 0.10 0.00 0.00 34.13 31.38 1sbq s GLU 83 CO 0.00 0.63 -0.20 -1.50 0.02 0.00 0.00 175.26 174.21 1sbq s ILE 84 N -1.24 1.63 0.17 -1.63 1.10 -1.26 -0.90 121.20 119.06 1sbq s ILE 84 Ca 0.25 -1.47 0.03 0.00 -0.51 0.00 0.00 60.65 58.94 1sbq s ILE 84 Cb -0.12 -1.48 -0.05 0.00 0.15 0.00 0.00 42.46 40.96 1sbq s ILE 84 CO 0.16 -0.06 -0.03 -0.51 -2.11 0.00 0.00 174.94 172.40 1sbq s ILE 85 N -1.14 0.84 -0.06 2.00 1.10 0.04 -4.91 121.20 119.08 1sbq s ILE 85 Ca 0.05 -2.00 0.05 0.00 -0.51 0.00 0.00 60.65 58.25 1sbq s ILE 85 Cb -0.10 -2.05 -0.01 0.00 0.15 0.00 0.00 42.46 40.45 1sbq s ILE 85 CO 0.04 -0.55 -0.22 -0.36 -2.11 0.00 0.00 174.94 171.73 1sbq s PHE 86 N -3.55 2.22 0.15 3.50 0.40 -1.26 0.14 117.98 119.58 1sbq s PHE 86 Ca 0.22 -0.68 -0.00 0.00 -0.60 0.00 0.00 56.93 55.86 1sbq s PHE 86 Cb 0.05 -1.47 -0.04 0.00 0.51 0.00 0.00 43.02 42.07 1sbq s PHE 86 CO 0.03 -0.22 0.05 0.96 0.70 0.00 0.00 175.22 176.74 1sbq s ILE 87 N -0.04 0.22 0.00 0.64 -0.00 -0.51 -0.81 121.20 120.70 1sbq s ILE 87 Ca -0.05 -1.93 0.00 0.00 -0.00 0.00 0.00 60.65 58.66 1sbq s ILE 87 Cb -0.14 -2.12 0.00 0.00 -0.00 0.00 0.00 42.46 40.20 1sbq s ILE 87 CO 0.04 -0.41 0.00 -0.90 -0.00 0.00 0.00 174.94 173.67 1sbq n ASP 88 N -0.15 0.00 0.13 4.36 5.68 -0.76 -0.68 116.55 125.13 1sbq n ASP 88 Ca -0.05 -0.16 0.02 0.00 -0.50 0.00 0.00 54.79 54.10 1sbq n ASP 88 Cb 0.64 0.00 0.02 0.00 -1.14 0.00 0.00 41.12 40.64 1sbq n ASP 88 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1sbq h GLN 89 N 0.00 0.00 0.00 0.11 4.20 -1.90 -3.07 115.11 114.44 1sbq h GLN 89 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1sbq h GLN 89 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1sbq h GLN 89 CO 0.00 0.55 0.00 0.39 -0.67 0.00 0.00 178.83 179.10 1sbq n GLU 90 N -3.25 0.05 -0.62 1.46 4.71 -1.26 -4.84 120.64 116.89 1sbq n GLU 90 Ca 0.02 0.21 0.00 0.00 -0.01 0.00 0.00 57.16 57.38 1sbq n GLU 90 Cb 0.75 -1.57 0.00 0.00 -1.01 0.00 0.00 31.44 29.61 1sbq n GLU 90 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 1sbq n THR 91 N -1.66 0.00 -2.42 2.62 -1.04 -1.16 -5.04 114.28 105.58 1sbq n THR 91 Ca 0.04 0.00 -0.40 0.00 -2.04 0.00 0.00 64.05 61.65 1sbq n THR 91 Cb 0.24 -0.11 -0.04 0.00 -1.82 0.00 0.00 70.33 68.60 1sbq n THR 91 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1sbq s ASN 92 N -2.22 7.19 -0.08 8.00 0.01 -1.26 -4.81 114.94 121.77 1sbq s ASN 92 Ca 0.00 2.31 -0.17 0.00 -0.71 0.00 0.00 52.86 54.30 1sbq s ASN 92 Cb 0.00 -2.63 -0.05 0.00 0.41 0.00 0.00 41.25 38.98 1sbq s ASN 92 CO 0.00 -0.22 0.44 -0.89 -1.51 0.00 0.00 177.10 174.93 1sbq s THR 93 N -1.02 5.13 -0.18 1.60 2.01 -1.26 -1.82 115.64 120.10 1sbq s THR 93 Ca 0.46 0.89 -0.01 0.00 0.31 0.00 0.00 61.69 63.34 1sbq s THR 93 Cb -0.33 -3.77 0.00 0.00 0.01 0.00 0.00 72.50 68.41 1sbq s THR 93 CO 0.42 0.42 -0.13 -0.36 -0.69 0.00 0.00 174.62 174.28 1sbq s PHE 94 N 0.04 2.84 0.75 4.92 0.40 0.01 -5.00 117.98 121.95 1sbq s PHE 94 Ca 0.24 -1.14 -0.12 0.00 -0.60 0.00 0.00 56.93 55.32 1sbq s PHE 94 Cb -0.16 -1.97 0.05 0.00 0.51 0.00 0.00 43.02 41.46 1sbq s PHE 94 CO 0.11 -0.57 1.10 -1.21 0.70 0.00 0.00 175.22 175.35 1sbq s GLU 95 N 1.12 2.31 0.25 0.44 0.41 -1.26 -4.21 118.70 117.77 1sbq s GLU 95 Ca 0.01 1.25 -0.03 0.00 -0.41 0.00 0.00 54.97 55.78 1sbq s GLU 95 Cb -0.14 -1.90 0.50 0.00 -1.78 0.00 0.00 34.13 30.80 1sbq s GLU 95 CO -0.04 -1.61 1.71 -1.35 -0.49 0.00 0.00 175.26 173.48 1sbq h PRO 96 N -0.89 0.35 0.00 0.39 0.11 -1.97 -1.08 132.00 128.90 1sbq h PRO 96 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1sbq h PRO 96 Cb 1.24 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1sbq h PRO 96 CO 0.51 0.23 0.00 0.09 -0.21 0.00 0.00 178.00 178.63 1sbq n ASN 97 N -5.08 0.00 -0.52 -2.05 3.02 -1.26 -1.64 115.26 107.73 1sbq n ASN 97 Ca 0.15 0.50 0.13 0.00 -0.03 0.00 0.00 54.58 55.34 1sbq n ASN 97 Cb 0.47 -0.50 0.41 0.00 -0.61 0.00 0.00 39.78 39.55 1sbq n ASN 97 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sbq n GLN 98 N -1.50 1.63 -4.33 3.52 6.02 -0.41 -4.83 117.38 117.47 1sbq n GLN 98 Ca 0.03 -1.05 -0.34 0.00 -0.01 0.00 0.00 57.00 55.62 1sbq n GLN 98 Cb 0.12 -1.48 -0.11 0.00 1.02 0.00 0.00 30.24 29.79 1sbq n GLN 98 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1sbq s ILE 99 N -2.10 4.14 -0.26 5.09 -1.09 -0.65 -4.70 121.20 121.63 1sbq s ILE 99 Ca 0.33 -0.28 0.22 0.00 -2.23 0.00 0.00 60.65 58.70 1sbq s ILE 99 Cb 0.20 -2.80 -0.22 0.00 -1.58 0.00 0.00 42.46 38.07 1sbq s ILE 99 CO 0.37 0.52 0.74 0.47 -1.23 0.00 0.00 174.94 175.80 1sbq n ASP 100 N 3.18 0.38 -3.62 3.58 8.00 -0.63 -4.91 116.55 122.54 1sbq n ASP 100 Ca -0.17 -0.05 -0.16 0.00 0.71 0.00 0.00 54.79 55.12 1sbq n ASP 100 Cb 0.53 1.36 -0.07 0.00 -0.02 0.00 0.00 41.12 42.91 1sbq n ASP 100 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1sbq s PHE 102 N -0.66 2.09 -0.44 0.00 0.40 -0.61 -1.14 117.98 117.62 1sbq s PHE 102 Ca -0.07 -1.03 -0.15 0.00 -0.60 0.00 0.00 56.93 55.07 1sbq s PHE 102 Cb -0.02 -1.50 0.05 0.00 0.51 0.00 0.00 43.02 42.05 1sbq s PHE 102 CO 0.06 -0.53 0.36 -0.51 0.70 0.00 0.00 175.22 175.30 1sbq s LEU 103 N 1.05 5.34 -0.27 -0.37 1.43 -0.19 -1.04 118.68 124.63 1sbq s LEU 103 Ca -0.05 -1.09 -0.10 0.00 -1.03 0.00 0.00 54.13 51.86 1sbq s LEU 103 Cb -0.15 -2.19 -0.05 0.00 0.03 0.00 0.00 46.19 43.84 1sbq s LEU 103 CO -0.03 -0.56 0.16 -0.63 0.23 0.00 0.00 176.35 175.52 1sbq s ILE 104 N 1.71 5.14 0.66 -0.59 1.01 0.48 -4.57 121.20 125.03 1sbq s ILE 104 Ca 0.05 0.11 -0.14 0.00 0.00 0.00 0.00 60.65 60.68 1sbq s ILE 104 Cb -0.21 -3.43 -0.01 0.00 0.01 0.00 0.00 42.46 38.82 1sbq s ILE 104 CO 0.09 0.28 1.07 -2.16 0.00 0.00 0.00 174.94 174.22 1sbq s PRO 105 N 1.61 2.97 0.22 2.79 0.04 -1.26 -1.88 135.00 139.49 1sbq s PRO 105 Ca 0.07 1.19 -0.22 0.00 0.04 0.00 0.00 61.00 62.07 1sbq s PRO 105 Cb -0.15 -1.99 0.04 0.00 0.04 0.00 0.00 34.50 32.44 1sbq s PRO 105 CO 0.09 -1.09 0.68 -0.48 0.04 0.00 0.00 177.00 176.24 1sbq s LEU 106 N -5.01 -0.39 -0.23 -3.56 0.05 -1.26 -4.91 118.68 103.37 1sbq s LEU 106 Ca 0.63 -0.33 -0.08 0.00 0.05 0.00 0.00 54.13 54.40 1sbq s LEU 106 Cb -0.17 2.64 -0.18 0.00 -2.05 0.00 0.00 46.19 46.43 1sbq s LEU 106 CO 0.45 -1.15 -0.06 0.52 -0.55 0.00 0.00 176.35 175.55 1sbq n VAL 107 N -0.42 1.57 -3.95 1.48 0.31 -0.95 -4.98 118.33 111.39 1sbq n VAL 107 Ca -0.10 -0.46 -0.09 0.00 -0.01 0.00 0.00 64.34 63.68 1sbq n VAL 107 Cb 0.62 -1.71 -0.06 0.00 -0.91 0.00 0.00 33.84 31.78 1sbq n VAL 107 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1sbq s GLY 108 N -5.79 0.44 -0.01 2.92 0.00 -1.13 -4.80 107.32 98.97 1sbq s GLY 108 Ca -0.32 -0.80 -0.16 0.00 0.00 0.00 0.00 44.72 43.43 1sbq s GLY 108 CO 0.61 -0.67 0.35 -0.11 0.00 0.00 0.00 173.10 173.28 1sbq s PHE 109 N -3.98 -0.22 0.53 1.90 -0.71 -0.77 0.23 117.98 114.96 1sbq s PHE 109 Ca 0.19 0.30 0.04 0.00 -1.04 0.00 0.00 56.93 56.42 1sbq s PHE 109 Cb 0.01 0.13 0.02 0.00 -1.21 0.00 0.00 43.02 41.97 1sbq s PHE 109 CO 0.04 -0.44 0.24 0.54 -1.34 0.00 0.00 175.22 174.26 1sbq s ASN 110 N -1.45 4.43 0.36 1.98 4.22 -0.63 -0.93 114.94 122.91 1sbq s ASN 110 Ca -0.12 -1.40 0.19 0.00 -2.14 0.00 0.00 52.86 49.39 1sbq s ASN 110 Cb -0.04 0.43 1.26 0.00 1.28 0.00 0.00 41.25 44.18 1sbq s ASN 110 CO 0.03 -0.99 1.61 0.50 -2.04 0.00 0.00 177.10 176.22 1sbq h LYS 111 N 1.01 0.13 -0.82 3.55 3.64 -1.92 0.27 116.57 122.44 1sbq h LYS 111 Ca -0.40 -0.01 -0.24 0.00 -1.27 0.00 0.00 60.65 58.73 1sbq h LYS 111 Cb 1.31 -0.03 -0.15 0.00 -0.41 0.00 0.00 32.23 32.95 1sbq h LYS 111 CO 0.64 0.08 0.31 -0.25 -2.27 0.00 0.00 179.45 177.97 1sbq n ASP 112 N -5.14 4.48 0.00 4.20 9.92 -1.26 -4.91 116.55 123.84 1sbq n ASP 112 Ca 0.36 -3.17 0.00 0.00 -0.53 0.00 0.00 54.79 51.45 1sbq n ASP 112 Cb 1.19 -0.74 0.00 0.00 -0.64 0.00 0.00 41.12 40.92 1sbq n ASP 112 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1sbq n ASN 113 N -0.24 0.00 -4.74 -2.24 5.03 0.97 -4.92 115.26 109.11 1sbq n ASN 113 Ca 0.40 0.00 -0.42 0.00 0.87 0.00 0.00 54.58 55.44 1sbq n ASN 113 Cb 1.35 -0.73 -0.00 0.00 -1.02 0.00 0.00 39.78 39.38 1sbq n ASN 113 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1sbq n TYR 114 N -2.00 2.68 -3.73 3.10 4.02 -1.20 -4.15 117.16 115.88 1sbq n TYR 114 Ca 0.00 0.49 -0.35 0.00 -0.01 0.00 0.00 57.90 58.02 1sbq n TYR 114 Cb 0.00 -2.48 -0.08 0.00 -0.02 0.00 0.00 39.34 36.76 1sbq n TYR 114 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 176.86 176.35 1sbq s ARG 115 N -1.93 4.09 -0.77 -0.72 3.52 -0.17 -1.61 118.95 121.36 1sbq s ARG 115 Ca 0.55 -0.18 -0.19 0.00 -0.13 0.00 0.00 55.73 55.78 1sbq s ARG 115 Cb -0.52 -3.39 0.13 0.00 -1.56 0.00 0.00 34.95 29.61 1sbq s ARG 115 CO 0.63 0.36 0.92 -1.17 -0.81 0.00 0.00 175.30 175.22 1sbq s LEU 116 N 0.17 5.31 0.00 -0.88 2.96 0.14 -4.38 118.68 121.99 1sbq s LEU 116 Ca 0.10 -1.78 0.00 0.00 -0.22 0.00 0.00 54.13 52.22 1sbq s LEU 116 Cb -0.11 -2.34 0.00 0.00 0.50 0.00 0.00 46.19 44.23 1sbq s LEU 116 CO -0.01 -1.07 0.00 0.61 -1.32 0.00 0.00 176.35 174.57 1sbq n GLY 117 N 5.17 -2.72 1.43 7.98 0.00 -1.26 -2.23 105.19 113.56 1sbq n GLY 117 Ca 0.08 -1.36 0.07 0.00 0.00 0.00 0.00 46.02 44.80 1sbq n GLY 117 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1sbq n PHE 118 N -1.89 1.35 -1.10 1.61 3.01 -1.26 -4.56 117.46 114.63 1sbq n PHE 118 Ca 0.00 -0.51 -0.03 0.00 1.01 0.00 0.00 57.45 57.91 1sbq n PHE 118 Cb 0.00 -0.28 -0.01 0.00 -0.01 0.00 0.00 39.48 39.18 1sbq n PHE 118 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1sbq n GLY 119 N 0.84 0.50 0.07 1.37 0.00 -1.26 -4.86 105.19 101.86 1sbq n GLY 119 Ca 0.21 -0.12 -0.03 0.00 0.00 0.00 0.00 46.02 46.08 1sbq n GLY 119 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1sbq n LYS 120 N -1.15 0.94 -0.23 1.61 4.76 -1.26 -5.02 118.16 117.81 1sbq n LYS 120 Ca -0.03 -0.06 0.00 0.00 -2.87 0.00 0.00 58.31 55.35 1sbq n LYS 120 Cb 0.33 -1.46 0.00 0.00 -1.84 0.00 0.00 35.03 32.06 1sbq n LYS 120 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1sbq n GLY 121 N 1.76 0.83 0.18 0.72 0.00 -1.26 -4.98 105.19 102.44 1sbq n GLY 121 Ca -0.22 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.69 1sbq n GLY 121 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1sbq h TYR 122 N 0.00 -0.36 -0.33 1.61 -1.99 -1.93 -1.99 116.97 111.98 1sbq h TYR 122 Ca 0.00 0.01 -0.15 0.00 2.00 0.00 0.00 58.73 60.59 1sbq h TYR 122 Cb 0.00 0.15 -0.01 0.00 2.00 0.00 0.00 36.73 38.88 1sbq h TYR 122 CO 0.00 -0.21 -0.40 1.88 -0.00 0.00 0.00 178.16 179.43 1sbq h TYR 123 N -0.26 0.97 -0.65 4.88 -1.99 -1.93 -2.51 116.97 115.48 1sbq h TYR 123 Ca 0.03 -0.29 0.05 0.00 2.00 0.00 0.00 58.73 60.52 1sbq h TYR 123 Cb 0.29 -0.20 -0.05 0.00 2.00 0.00 0.00 36.73 38.77 1sbq h TYR 123 CO -0.17 1.07 0.37 -0.44 -0.00 0.00 0.00 178.16 178.99 1sbq h ASP 124 N 0.66 0.57 0.46 3.88 3.32 -1.84 -0.93 116.42 122.53 1sbq h ASP 124 Ca 0.05 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1sbq h ASP 124 Cb 0.96 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.42 1sbq h ASP 124 CO 0.09 0.38 -0.22 -0.09 -1.72 0.00 0.00 179.24 177.68 1sbq h ARG 125 N 0.70 -0.59 -0.29 3.56 2.43 -1.32 -2.97 114.38 115.89 1sbq h ARG 125 Ca 0.28 0.04 0.06 0.00 -0.81 0.00 0.00 59.98 59.55 1sbq h ARG 125 Cb 0.13 0.13 -0.06 0.00 -0.42 0.00 0.00 29.97 29.75 1sbq h ARG 125 CO -0.16 -0.28 -0.09 -0.92 -1.51 0.00 0.00 179.97 177.01 1sbq h TYR 126 N -0.96 -0.21 -0.55 2.20 3.20 -1.34 -3.09 116.97 116.22 1sbq h TYR 126 Ca -0.06 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.72 1sbq h TYR 126 Cb 0.58 0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.97 1sbq h TYR 126 CO 0.01 -0.15 -0.11 -0.07 -1.64 0.00 0.00 178.16 176.20 1sbq h LEU 127 N -0.03 1.03 0.00 2.82 3.38 -1.29 -2.28 115.31 118.95 1sbq h LEU 127 Ca 0.15 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1sbq h LEU 127 Cb 0.25 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1sbq h LEU 127 CO -0.32 1.14 0.00 0.23 0.09 0.00 0.00 178.44 179.58 1sbq n MET 128 N -4.14 0.07 0.00 1.13 2.81 -1.12 -1.55 117.12 114.33 1sbq n MET 128 Ca 0.02 0.26 0.11 0.00 -1.81 0.00 0.00 57.70 56.27 1sbq n MET 128 Cb 0.40 -1.50 0.03 0.00 -0.71 0.00 0.00 33.22 31.44 1sbq n MET 128 CO 0.00 0.00 0.00 0.94 1.51 0.00 0.00 175.97 178.42 1sbq n GLN 129 N -1.33 0.07 -1.74 0.03 7.27 -0.86 -4.98 117.38 115.84 1sbq n GLN 129 Ca 0.03 -0.01 -0.41 0.00 0.07 0.00 0.00 57.00 56.69 1sbq n GLN 129 Cb 0.06 -1.52 0.01 0.00 2.41 0.00 0.00 30.24 31.20 1sbq n GLN 129 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1sbq n LEU 130 N -1.61 4.65 -0.44 1.69 4.77 -0.59 -4.96 117.00 120.52 1sbq n LEU 130 Ca 0.04 1.14 0.03 0.00 -0.03 0.00 0.00 56.01 57.19 1sbq n LEU 130 Cb 0.36 -1.57 0.05 0.00 -2.33 0.00 0.00 43.42 39.92 1sbq n LEU 130 CO 0.40 -0.25 0.33 0.35 -1.33 0.00 0.00 177.39 176.89 1sbq n THR 131 N -0.05 0.60 -1.39 -5.08 -2.24 -1.26 -4.75 114.28 100.11 1sbq n THR 131 Ca 0.05 -0.79 0.06 0.00 -2.27 0.00 0.00 64.05 61.09 1sbq n THR 131 Cb 0.40 0.30 0.08 0.00 -2.10 0.00 0.00 70.33 69.01 1sbq n THR 131 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1sbq n ARG 132 N -0.41 0.83 -3.26 -0.78 1.74 -1.26 -4.98 116.66 108.53 1sbq n ARG 132 Ca 0.05 -1.95 -0.24 0.00 -0.77 0.00 0.00 57.85 54.95 1sbq n ARG 132 Cb 0.71 -1.11 0.03 0.00 -1.02 0.00 0.00 32.46 31.06 1sbq n ARG 132 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1sbq n GLN 133 N -0.87 -4.71 -2.03 5.56 3.00 -1.26 -4.91 117.38 112.15 1sbq n GLN 133 Ca 0.10 0.73 -0.41 0.00 -0.01 0.00 0.00 57.00 57.41 1sbq n GLN 133 Cb 0.65 -5.56 -0.02 0.00 0.00 0.00 0.00 30.24 25.31 1sbq n GLN 133 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 1sbq s GLN 134 N -5.94 4.28 0.33 -1.09 1.11 -1.26 -4.93 119.66 112.16 1sbq s GLN 134 Ca 0.39 2.29 -0.29 0.00 0.01 0.00 0.00 55.36 57.76 1sbq s GLN 134 Cb -0.19 -3.09 -0.11 0.00 -1.01 0.00 0.00 33.01 28.61 1sbq s GLN 134 CO 0.48 -0.36 1.46 -2.14 0.01 0.00 0.00 175.29 174.75 1sbq s PRO 135 N -0.87 4.19 -0.46 2.91 0.02 -1.25 -4.88 135.00 134.65 1sbq s PRO 135 Ca 0.56 2.45 -0.02 0.00 0.02 0.00 0.00 61.00 64.01 1sbq s PRO 135 Cb -0.41 -3.03 0.12 0.00 0.02 0.00 0.00 34.50 31.20 1sbq s PRO 135 CO 0.47 -0.46 0.26 0.15 -0.33 0.00 0.00 177.00 177.09 1sbq s LYS 136 N -1.39 2.12 -0.26 5.54 1.02 -1.26 -1.57 119.74 123.94 1sbq s LYS 136 Ca 0.55 -2.04 -0.07 0.00 0.02 0.00 0.00 55.97 54.44 1sbq s LYS 136 Cb -0.45 -3.59 -0.01 0.00 -0.52 0.00 0.00 37.83 33.26 1sbq s LYS 136 CO 0.54 -1.09 0.07 0.42 -0.92 0.00 0.00 175.35 174.37 1sbq s ILE 137 N 0.76 4.14 0.42 2.17 -1.09 -0.21 -1.19 121.20 126.20 1sbq s ILE 137 Ca 0.11 -0.36 -0.22 0.00 -2.23 0.00 0.00 60.65 57.95 1sbq s ILE 137 Cb -0.22 -3.00 -0.11 0.00 -1.58 0.00 0.00 42.46 37.56 1sbq s ILE 137 CO -0.04 0.26 0.95 -0.83 -1.23 0.00 0.00 174.94 174.05 1sbq s GLY 138 N 1.57 2.46 -0.28 6.18 0.00 0.95 -0.39 107.32 117.81 1sbq s GLY 138 Ca 0.05 0.43 0.02 0.00 0.00 0.00 0.00 44.72 45.22 1sbq s GLY 138 CO 0.03 0.74 -0.01 -0.42 0.00 0.00 0.00 173.10 173.43 1sbq s ILE 139 N -2.08 1.77 0.27 0.90 -1.09 -0.79 0.27 121.20 120.45 1sbq s ILE 139 Ca 0.60 -1.66 -0.02 0.00 -2.23 0.00 0.00 60.65 57.35 1sbq s ILE 139 Cb -0.11 -2.13 0.01 0.00 -1.58 0.00 0.00 42.46 38.65 1sbq s ILE 139 CO 0.15 -0.33 0.38 0.00 -1.23 0.00 0.00 174.94 173.92 1sbq n ALA 140 N 4.53 -0.29 -2.50 9.38 0.00 -0.78 -4.45 120.51 126.40 1sbq n ALA 140 Ca -0.06 -1.25 -0.19 0.00 0.00 0.00 0.00 53.44 51.94 1sbq n ALA 140 Cb 0.43 1.01 -0.01 0.00 0.00 0.00 0.00 19.45 20.88 1sbq n ALA 140 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1sbq s TYR 141 N -3.40 3.12 0.31 0.00 1.51 -1.26 -3.80 117.35 113.83 1sbq s TYR 141 Ca 0.22 -0.21 -0.00 0.00 -1.01 0.00 0.00 57.07 56.07 1sbq s TYR 141 Cb -0.01 -1.96 0.51 0.00 -0.11 0.00 0.00 41.96 40.40 1sbq s TYR 141 CO 0.16 0.03 1.96 0.77 -1.11 0.00 0.00 175.55 177.35 1sbq h SER 142 N 0.93 0.89 0.00 2.29 0.02 -1.94 -2.35 113.55 113.39 1sbq h SER 142 Ca -0.46 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 1sbq h SER 142 Cb 1.25 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.59 1sbq h SER 142 CO 0.53 0.62 0.00 2.22 -1.14 0.00 0.00 176.83 179.06 1sbq n PHE 143 N -4.44 0.00 0.19 3.45 -1.74 -1.26 -2.45 117.46 111.21 1sbq n PHE 143 Ca 0.10 -0.09 0.03 0.00 -0.56 0.00 0.00 57.45 56.93 1sbq n PHE 143 Cb 0.09 -0.11 -0.03 0.00 1.52 0.00 0.00 39.48 40.95 1sbq n PHE 143 CO 0.00 0.00 0.00 1.04 -0.56 0.00 0.00 176.76 177.24 1sbq n GLN 144 N 0.21 4.07 -2.64 3.97 6.02 -0.88 -4.63 117.38 123.50 1sbq n GLN 144 Ca 0.00 -0.01 -0.42 0.00 -0.01 0.00 0.00 57.00 56.56 1sbq n GLN 144 Cb 0.25 -0.84 -0.03 0.00 1.02 0.00 0.00 30.24 30.64 1sbq n GLN 144 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1sbq s LYS 145 N -1.71 4.54 0.24 -1.09 2.20 -1.03 -1.84 119.74 121.06 1sbq s LYS 145 Ca 0.01 1.52 -0.19 0.00 -0.36 0.00 0.00 55.97 56.95 1sbq s LYS 145 Cb 0.04 -3.42 0.02 0.00 -1.51 0.00 0.00 37.83 32.96 1sbq s LYS 145 CO 0.22 -0.07 0.63 0.20 -0.36 0.00 0.00 175.35 175.97 1sbq s GLY 146 N 0.88 -0.05 -0.19 5.54 0.00 -0.11 -4.93 107.32 108.46 1sbq s GLY 146 Ca 0.53 -0.30 -0.18 0.00 0.00 0.00 0.00 44.72 44.78 1sbq s GLY 146 CO 0.29 -0.18 0.48 0.99 0.00 0.00 0.00 173.10 174.67 1sbq s ASP 147 N -2.91 6.53 -0.28 1.64 1.01 -1.26 -3.95 116.67 117.45 1sbq s ASP 147 Ca 0.11 0.64 -0.25 0.00 0.71 0.00 0.00 52.55 53.76 1sbq s ASP 147 Cb -0.04 -2.27 0.13 0.00 1.01 0.00 0.00 42.92 41.75 1sbq s ASP 147 CO 0.03 -0.13 1.07 0.72 0.21 0.00 0.00 175.17 177.07 1sbq s PHE 148 N 1.45 -0.43 0.09 4.23 -0.71 -1.25 -4.66 117.98 116.70 1sbq s PHE 148 Ca 0.23 1.04 -0.30 0.00 -1.04 0.00 0.00 56.93 56.85 1sbq s PHE 148 Cb -0.15 0.38 -0.05 0.00 -1.21 0.00 0.00 43.02 41.98 1sbq s PHE 148 CO 0.09 -0.21 1.04 -0.51 -1.34 0.00 0.00 175.22 174.29 1sbq s LEU 149 N 0.16 4.44 0.41 -1.99 2.01 -1.26 -4.91 118.68 117.55 1sbq s LEU 149 Ca 0.03 1.87 -0.23 0.00 0.01 0.00 0.00 54.13 55.82 1sbq s LEU 149 Cb -0.05 -3.59 -0.10 0.00 0.01 0.00 0.00 46.19 42.47 1sbq s LEU 149 CO -0.07 -0.22 1.00 0.00 1.01 0.00 0.00 176.35 178.07 1sbq s ALA 150 N 0.38 3.05 0.66 4.21 0.00 -1.26 -4.91 121.76 123.89 1sbq s ALA 150 Ca 0.51 0.56 -0.04 0.00 0.00 0.00 0.00 51.96 52.99 1sbq s ALA 150 Cb -0.25 -3.21 0.06 0.00 0.00 0.00 0.00 23.12 19.71 1sbq s ALA 150 CO 0.30 -0.06 0.94 -0.51 0.00 0.00 0.00 175.76 176.44 1sbq s ASP 151 N -1.85 4.92 0.00 0.00 1.01 -1.26 -4.94 116.67 114.55 1sbq s ASP 151 Ca 0.60 0.26 0.00 0.00 0.71 0.00 0.00 52.55 54.12 1sbq s ASP 151 Cb -0.16 -0.97 0.00 0.00 1.01 0.00 0.00 42.92 42.80 1sbq s ASP 151 CO 0.21 -1.48 0.97 -2.65 0.21 0.00 0.00 175.17 172.43 1sbq n PRO 152 N -2.74 0.00 0.00 8.23 -0.02 -1.26 -1.92 135.00 137.29 1sbq n PRO 152 Ca 0.08 0.46 0.05 0.00 -2.02 0.00 0.00 63.50 62.08 1sbq n PRO 152 Cb 0.60 -1.54 0.03 0.00 -0.02 0.00 0.00 33.50 32.57 1sbq n PRO 152 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 1sbq n TRP 153 N -1.47 0.00 -2.60 6.00 2.14 -1.26 -4.98 117.44 115.28 1sbq n TRP 153 Ca -0.00 0.00 -0.43 0.00 2.07 0.00 0.00 57.50 59.14 1sbq n TRP 153 Cb 0.04 0.00 -0.02 0.00 -0.81 0.00 0.00 31.31 30.51 1sbq n TRP 153 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1sbq s ASP 154 N -1.09 7.13 0.58 -0.67 1.01 -0.81 -4.80 116.67 118.03 1sbq s ASP 154 Ca 0.11 1.58 -0.19 0.00 0.71 0.00 0.00 52.55 54.76 1sbq s ASP 154 Cb 0.09 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.43 1sbq s ASP 154 CO 0.18 -0.56 1.19 -0.69 0.21 0.00 0.00 175.17 175.50 1sbq s VAL 155 N 2.49 2.75 0.00 -1.27 1.01 -1.26 -4.74 120.40 119.38 1sbq s VAL 155 Ca 0.50 0.46 0.03 0.00 0.00 0.00 0.00 61.98 62.97 1sbq s VAL 155 Cb -0.19 -3.18 -0.25 0.00 0.00 0.00 0.00 36.38 32.76 1sbq s VAL 155 CO 0.16 -0.10 0.84 -0.61 0.00 0.00 0.00 175.10 175.38 1sbq h GLN 156 N 0.94 0.13 -3.49 2.72 4.15 -1.93 -0.42 115.11 117.21 1sbq h GLN 156 Ca -0.50 -0.22 0.00 0.00 0.77 0.00 0.00 58.65 58.70 1sbq h GLN 156 Cb 1.29 0.08 0.00 0.00 0.21 0.00 0.00 27.48 29.06 1sbq h GLN 156 CO 0.55 0.91 -0.74 1.28 -1.93 0.00 0.00 178.83 178.90 1sbq n LEU 157 N -3.31 -5.26 0.26 -2.39 4.77 -1.26 -3.23 117.00 106.58 1sbq n LEU 157 Ca -0.15 2.55 0.15 0.00 -0.03 0.00 0.00 56.01 58.54 1sbq n LEU 157 Cb 1.03 -2.56 0.61 0.00 -2.33 0.00 0.00 43.42 40.17 1sbq n LEU 157 CO 0.47 -1.13 0.93 0.44 -1.33 0.00 0.00 177.39 176.77 1sbq h ASP 158 N 3.10 0.00 -3.15 -1.43 3.32 -1.50 -3.45 116.42 113.31 1sbq h ASP 158 Ca 0.00 0.00 0.07 0.00 0.02 0.00 0.00 57.03 57.12 1sbq h ASP 158 Cb 0.00 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 39.28 1sbq h ASP 158 CO 0.00 0.07 0.48 -0.22 -1.72 0.00 0.00 179.24 177.85 1sbq s LEU 159 N -6.40 -0.42 -0.30 1.55 2.96 -1.20 -5.03 118.68 109.83 1sbq s LEU 159 Ca 0.01 0.81 -0.03 0.00 -0.22 0.00 0.00 54.13 54.70 1sbq s LEU 159 Cb 0.09 1.83 0.04 0.00 0.50 0.00 0.00 46.19 48.66 1sbq s LEU 159 CO 0.57 -0.14 0.02 -0.63 -1.32 0.00 0.00 176.35 174.85 1sbq s ILE 160 N 0.19 3.25 -0.30 6.68 1.09 -1.26 -0.04 121.20 130.81 1sbq s ILE 160 Ca 0.03 -1.20 -0.21 0.00 -1.10 0.00 0.00 60.65 58.17 1sbq s ILE 160 Cb -0.05 -2.81 -0.01 0.00 -1.06 0.00 0.00 42.46 38.54 1sbq s ILE 160 CO -0.07 -0.06 0.68 -0.63 -0.10 0.00 0.00 174.94 174.76 1sbq s ILE 161 N 1.32 4.90 0.38 2.92 1.01 0.14 -4.92 121.20 126.95 1sbq s ILE 161 Ca -0.03 1.00 0.05 0.00 0.00 0.00 0.00 60.65 61.67 1sbq s ILE 161 Cb -0.19 -4.03 -0.03 0.00 0.01 0.00 0.00 42.46 38.22 1sbq s ILE 161 CO -0.00 -0.14 0.18 0.54 0.00 0.00 0.00 174.94 175.51 1sbq s ASN 162 N 1.60 2.38 0.27 3.58 4.22 -1.25 -1.86 114.94 123.88 1sbq s ASN 162 Ca 0.27 -1.70 0.25 0.00 -2.14 0.00 0.00 52.86 49.54 1sbq s ASN 162 Cb -0.15 0.53 0.97 0.00 1.28 0.00 0.00 41.25 43.88 1sbq s ASN 162 CO 0.11 -0.98 1.74 -2.24 -2.04 0.00 0.00 177.10 173.70 1sbq h ASP 163 N 1.91 0.00 0.00 3.54 2.03 -1.87 -3.45 116.42 118.59 1sbq h ASP 163 Ca -0.32 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.98 1sbq h ASP 163 Cb 1.26 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.76 1sbq h ASP 163 CO 0.50 0.00 0.00 -0.62 -1.03 0.00 0.00 179.24 178.09