#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sbz s LEU 3 N 0.00 2.05 -0.06 -0.35 1.43 -0.16 0.79 118.68 122.38 1sbz s LEU 3 Ca 0.00 -0.53 -0.22 0.00 -1.03 0.00 0.00 54.13 52.36 1sbz s LEU 3 Cb 0.00 -1.35 -0.04 0.00 0.03 0.00 0.00 46.19 44.83 1sbz s LEU 3 CO 0.00 0.17 0.62 -0.63 0.23 0.00 0.00 176.35 176.75 1sbz s ILE 4 N 0.22 5.04 -0.22 -0.59 1.01 -0.09 -0.65 121.20 125.93 1sbz s ILE 4 Ca -0.14 1.29 0.01 0.00 0.00 0.00 0.00 60.65 61.80 1sbz s ILE 4 Cb -0.17 -3.96 0.03 0.00 0.01 0.00 0.00 42.46 38.37 1sbz s ILE 4 CO 0.07 0.31 -0.13 -0.69 0.00 0.00 0.00 174.94 174.50 1sbz s VAL 5 N 0.50 2.36 0.16 2.92 1.01 0.14 -0.53 120.40 126.97 1sbz s VAL 5 Ca 0.33 -1.12 0.02 0.00 0.00 0.00 0.00 61.98 61.22 1sbz s VAL 5 Cb -0.17 -2.15 0.02 0.00 0.00 0.00 0.00 36.38 34.08 1sbz s VAL 5 CO 0.16 0.30 0.20 0.61 0.00 0.00 0.00 175.10 176.38 1sbz n GLY 6 N 4.59 2.17 0.00 4.51 0.00 0.15 -0.93 105.19 115.68 1sbz n GLY 6 Ca -0.18 -2.17 0.00 0.00 0.00 0.00 0.00 46.02 43.67 1sbz n GLY 6 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1sbz n THR 8 N -1.25 0.00 -0.25 2.61 -1.04 -1.17 -0.81 114.28 112.36 1sbz n THR 8 Ca 0.03 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.04 1sbz n THR 8 Cb 0.17 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.68 1sbz n THR 8 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1sbz n GLY 9 N -0.52 2.47 3.88 3.41 0.00 -1.26 -4.47 105.19 108.69 1sbz n GLY 9 Ca 0.00 -0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 1sbz n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sbz s ALA 10 N -0.07 3.54 0.30 4.61 0.00 -1.26 -4.87 121.76 124.01 1sbz s ALA 10 Ca 0.01 -0.29 -0.30 0.00 0.00 0.00 0.00 51.96 51.39 1sbz s ALA 10 Cb 0.01 -2.46 -0.11 0.00 0.00 0.00 0.00 23.12 20.56 1sbz s ALA 10 CO 0.00 0.42 1.58 -0.08 0.00 0.00 0.00 175.76 177.68 1sbz s THR 11 N -1.91 2.07 0.00 0.00 -1.32 -1.26 -4.08 115.64 109.14 1sbz s THR 11 Ca 0.48 0.06 0.00 0.00 -1.21 0.00 0.00 61.69 61.02 1sbz s THR 11 Cb -0.11 -3.04 0.00 0.00 -1.51 0.00 0.00 72.50 67.84 1sbz s THR 11 CO 0.23 0.01 0.00 0.61 -2.21 0.00 0.00 174.62 173.26 1sbz n GLY 12 N 1.91 1.57 0.36 6.08 0.00 -1.26 -4.94 105.19 108.91 1sbz n GLY 12 Ca 0.07 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.20 1sbz n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sbz h ALA 13 N 0.00 1.67 -0.77 4.61 0.00 -1.84 -1.34 119.26 121.59 1sbz h ALA 13 Ca 0.00 0.05 0.22 0.00 0.00 0.00 0.00 54.91 55.18 1sbz h ALA 13 Cb 0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1sbz h ALA 13 CO 0.00 0.01 0.55 -1.35 0.00 0.00 0.00 179.25 178.46 1sbz h PRO 14 N 0.82 0.03 -0.45 0.00 0.11 -1.91 -1.47 132.00 129.14 1sbz h PRO 14 Ca 0.54 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.54 1sbz h PRO 14 Cb 0.77 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.86 1sbz h PRO 14 CO -0.32 0.02 -0.15 -0.07 -0.21 0.00 0.00 178.00 177.27 1sbz h LEU 15 N 0.03 0.91 -0.23 2.35 3.38 -1.62 -2.12 115.31 118.01 1sbz h LEU 15 Ca 0.37 -0.38 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 1sbz h LEU 15 Cb 1.42 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 1sbz h LEU 15 CO -0.02 1.08 -0.21 1.23 0.09 0.00 0.00 178.44 180.61 1sbz h GLY 16 N 0.73 0.61 0.84 0.83 0.00 -1.33 -2.54 103.07 102.21 1sbz h GLY 16 Ca 0.11 -0.61 0.02 0.00 0.00 0.00 0.00 47.33 46.85 1sbz h GLY 16 CO 0.05 0.55 0.18 -2.08 0.00 0.00 0.00 176.54 175.25 1sbz h VAL 17 N 0.26 0.99 0.00 4.60 2.07 -1.34 -1.88 116.25 120.94 1sbz h VAL 17 Ca 0.04 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 67.39 1sbz h VAL 17 Cb 0.76 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 1sbz h VAL 17 CO 0.05 0.07 -0.19 0.00 0.02 0.00 0.00 177.57 177.52 1sbz h ALA 18 N 1.18 1.51 -0.22 1.67 0.00 -1.40 -1.15 119.26 120.85 1sbz h ALA 18 Ca 0.15 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 1sbz h ALA 18 Cb 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1sbz h ALA 18 CO -0.10 0.24 -0.40 1.25 0.00 0.00 0.00 179.25 180.24 1sbz h LEU 19 N 0.00 0.73 -0.59 0.00 5.85 -0.99 -2.15 115.31 118.17 1sbz h LEU 19 Ca -0.00 -0.54 -0.07 0.00 0.84 0.00 0.00 57.88 58.11 1sbz h LEU 19 Cb 0.38 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 1sbz h LEU 19 CO 0.03 1.13 0.08 -0.07 -0.34 0.00 0.00 178.44 179.26 1sbz h LEU 20 N 0.36 0.95 -0.58 2.25 3.38 -0.94 -0.87 115.31 119.86 1sbz h LEU 20 Ca 0.01 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 1sbz h LEU 20 Cb 1.00 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.47 1sbz h LEU 20 CO 0.09 0.98 0.32 1.56 0.09 0.00 0.00 178.44 181.48 1sbz h GLN 21 N 0.88 0.81 -0.40 1.13 4.20 -1.25 1.00 115.11 121.48 1sbz h GLN 21 Ca 0.18 -0.09 -0.08 0.00 0.06 0.00 0.00 58.65 58.71 1sbz h GLN 21 Cb 0.45 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 1sbz h GLN 21 CO 0.02 0.62 -0.07 0.00 -0.67 0.00 0.00 178.83 178.72 1sbz h ALA 22 N 1.15 1.13 0.00 3.87 0.00 -1.21 -2.67 119.26 121.53 1sbz h ALA 22 Ca 0.20 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1sbz h ALA 22 Cb 0.04 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1sbz h ALA 22 CO -0.03 0.55 -0.53 -0.07 0.00 0.00 0.00 179.25 179.17 1sbz h LEU 23 N 0.63 0.00 -1.45 0.00 4.07 -0.88 -3.12 115.31 114.56 1sbz h LEU 23 Ca 0.12 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 58.02 1sbz h LEU 23 Cb 0.50 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.23 1sbz h LEU 23 CO 0.03 0.53 -0.27 -0.09 -1.08 0.00 0.00 178.44 177.55 1sbz h ARG 24 N 0.00 0.00 -3.02 1.13 9.65 -0.46 -3.43 114.38 118.25 1sbz h ARG 24 Ca -0.01 0.00 -0.66 0.00 -1.10 0.00 0.00 59.98 58.22 1sbz h ARG 24 Cb 1.16 0.00 0.03 0.00 -1.39 0.00 0.00 29.97 29.77 1sbz h ARG 24 CO 0.07 0.27 3.81 0.39 2.80 0.00 0.00 179.97 187.31 1sbz n GLU 25 N -3.95 3.64 0.00 0.20 -0.58 -1.12 -5.08 120.64 113.75 1sbz n GLU 25 Ca -0.02 -2.17 0.00 0.00 -0.42 0.00 0.00 57.16 54.56 1sbz n GLU 25 Cb 0.35 -2.78 0.00 0.00 -0.57 0.00 0.00 31.44 28.43 1sbz n GLU 25 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 1sbz n PRO 27 N 3.60 0.00 -0.47 3.49 -0.02 -1.26 -5.12 135.00 135.22 1sbz n PRO 27 Ca 0.77 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 62.19 1sbz n PRO 27 Cb 0.23 -0.43 0.10 0.00 -0.02 0.00 0.00 33.50 33.37 1sbz n PRO 27 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1sbz n ASN 28 N -1.45 3.23 -4.07 2.55 0.23 -1.26 -4.71 115.26 109.78 1sbz n ASN 28 Ca 0.00 -2.60 -0.32 0.00 -0.53 0.00 0.00 54.58 51.14 1sbz n ASN 28 Cb 0.00 -0.62 -0.16 0.00 -2.08 0.00 0.00 39.78 36.91 1sbz n ASN 28 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1sbz s VAL 29 N -1.44 1.83 -0.31 3.53 1.01 -1.26 -4.82 120.40 118.94 1sbz s VAL 29 Ca 0.23 -0.83 -0.13 0.00 0.00 0.00 0.00 61.98 61.25 1sbz s VAL 29 Cb 0.19 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 1sbz s VAL 29 CO 0.05 0.47 0.28 -0.70 0.00 0.00 0.00 175.10 175.20 1sbz s GLU 30 N 1.37 3.73 -0.14 2.72 2.12 -1.26 -4.97 118.70 122.27 1sbz s GLU 30 Ca 0.04 -0.37 -0.07 0.00 0.36 0.00 0.00 54.97 54.93 1sbz s GLU 30 Cb -0.13 -3.74 -0.04 0.00 0.26 0.00 0.00 34.13 30.47 1sbz s GLU 30 CO -0.12 -0.37 0.11 0.95 -0.54 0.00 0.00 175.26 175.30 1sbz s THR 31 N 1.88 5.29 -0.24 -1.70 -4.23 -1.26 -0.98 115.64 114.39 1sbz s THR 31 Ca 0.09 0.13 -0.01 0.00 -1.18 0.00 0.00 61.69 60.73 1sbz s THR 31 Cb -0.16 -3.33 0.03 0.00 1.34 0.00 0.00 72.50 70.37 1sbz s THR 31 CO 0.11 0.56 -0.08 -1.00 -0.54 0.00 0.00 174.62 173.66 1sbz s HIS 32 N -0.51 3.06 -0.09 3.99 3.76 0.18 -1.64 115.29 124.04 1sbz s HIS 32 Ca 0.12 -1.66 -0.09 0.00 -0.15 0.00 0.00 55.06 53.27 1sbz s HIS 32 Cb -0.12 -2.03 -0.05 0.00 1.11 0.00 0.00 32.58 31.50 1sbz s HIS 32 CO 0.02 -0.76 0.22 -1.17 -0.85 0.00 0.00 174.74 172.20 1sbz s LEU 33 N 1.29 4.41 0.39 0.89 2.96 0.14 0.27 118.68 129.03 1sbz s LEU 33 Ca -0.00 0.61 0.05 0.00 -0.22 0.00 0.00 54.13 54.56 1sbz s LEU 33 Cb -0.17 -2.22 -0.02 0.00 0.50 0.00 0.00 46.19 44.27 1sbz s LEU 33 CO -0.05 0.37 0.18 -0.69 -1.32 0.00 0.00 176.35 174.84 1sbz s VAL 34 N -0.98 0.37 0.12 1.68 1.01 -0.11 -0.29 120.40 122.20 1sbz s VAL 34 Ca 0.17 -2.00 0.04 0.00 0.00 0.00 0.00 61.98 60.19 1sbz s VAL 34 Cb -0.13 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.84 1sbz s VAL 34 CO 0.07 0.00 -0.10 -0.94 0.00 0.00 0.00 175.10 174.13 1sbz s SER 36 N -3.54 1.58 0.20 3.32 1.04 -1.26 -4.34 113.70 110.69 1sbz s SER 36 Ca 0.29 -0.92 -0.17 0.00 0.48 0.00 0.00 55.95 55.63 1sbz s SER 36 Cb 0.02 0.01 0.18 0.00 0.10 0.00 0.00 66.02 66.33 1sbz s SER 36 CO 0.19 -0.31 1.60 0.50 0.98 0.00 0.00 173.24 176.20 1sbz h LYS 37 N 3.18 -0.09 0.00 4.02 3.64 -2.01 -1.54 116.57 123.77 1sbz h LYS 37 Ca -0.37 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.01 1sbz h LYS 37 Cb 1.19 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1sbz h LYS 37 CO 0.58 -0.06 -0.02 -1.49 -2.27 0.00 0.00 179.45 176.19 1sbz h TRP 38 N -0.10 0.00 -0.45 1.91 4.06 -1.96 -2.80 115.95 116.61 1sbz h TRP 38 Ca 0.27 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 61.13 1sbz h TRP 38 Cb 0.52 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.66 1sbz h TRP 38 CO -0.57 0.02 -0.06 0.00 -3.56 0.00 0.00 178.44 174.26 1sbz h ALA 39 N 1.98 1.04 -0.82 1.49 0.00 -1.51 -2.00 119.26 119.44 1sbz h ALA 39 Ca -0.00 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 1sbz h ALA 39 Cb 0.71 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 1sbz h ALA 39 CO 0.00 0.59 0.50 0.87 0.00 0.00 0.00 179.25 181.21 1sbz h LYS 40 N 0.72 1.10 -0.44 0.00 1.57 -1.20 0.25 116.57 118.56 1sbz h LYS 40 Ca 0.13 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1sbz h LYS 40 Cb 0.53 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 1sbz h LYS 40 CO 0.03 0.76 0.07 1.15 -0.57 0.00 0.00 179.45 180.89 1sbz h THR 41 N 1.12 1.24 -0.35 -0.16 2.02 -1.52 -2.18 112.91 113.08 1sbz h THR 41 Ca 0.29 -0.89 -0.17 0.00 0.77 0.00 0.00 66.41 66.41 1sbz h THR 41 Cb -0.06 0.98 -0.00 0.00 -1.74 0.00 0.00 68.15 67.32 1sbz h THR 41 CO -0.06 0.31 -0.44 0.74 0.37 0.00 0.00 175.52 176.45 1sbz h THR 42 N 0.59 1.27 -0.05 3.16 2.02 -0.95 -1.66 112.91 117.28 1sbz h THR 42 Ca 0.13 -1.61 0.01 0.00 0.77 0.00 0.00 66.41 65.71 1sbz h THR 42 Cb 0.38 1.46 -0.01 0.00 -1.74 0.00 0.00 68.15 68.24 1sbz h THR 42 CO 0.01 0.54 -0.02 0.40 0.37 0.00 0.00 175.52 176.81 1sbz h ILE 43 N 0.73 0.93 -0.31 3.11 2.04 -0.47 -0.68 117.51 122.85 1sbz h ILE 43 Ca 0.05 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.79 1sbz h ILE 43 Cb 1.03 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 1sbz h ILE 43 CO 0.10 0.00 -0.27 -0.33 0.00 0.00 0.00 178.15 177.65 1sbz h GLU 44 N -0.01 0.63 -0.08 2.37 5.08 -1.34 0.31 114.58 121.53 1sbz h GLU 44 Ca 0.03 -0.26 -0.18 0.00 -1.00 0.00 0.00 59.36 57.95 1sbz h GLU 44 Cb 0.06 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1sbz h GLU 44 CO -0.06 0.84 -0.71 1.25 -1.00 0.00 0.00 179.01 179.33 1sbz h LEU 45 N 0.55 0.46 0.00 1.33 5.85 -1.25 -3.38 115.31 118.87 1sbz h LEU 45 Ca 0.07 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.49 1sbz h LEU 45 Cb 0.75 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.64 1sbz h LEU 45 CO 0.06 1.03 -1.21 -0.62 -0.34 0.00 0.00 178.44 177.35 1sbz n GLU 46 N -3.84 1.15 -4.45 1.25 1.02 -0.27 -5.00 120.64 110.50 1sbz n GLU 46 Ca -0.04 -0.07 -0.22 0.00 -0.02 0.00 0.00 57.16 56.81 1sbz n GLU 46 Cb 0.69 -1.32 -0.10 0.00 -0.02 0.00 0.00 31.44 30.69 1sbz n GLU 46 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1sbz s THR 47 N -2.80 1.60 -2.00 2.62 -4.23 0.08 -4.77 115.64 106.13 1sbz s THR 47 Ca 0.00 -2.10 0.28 0.00 -1.18 0.00 0.00 61.69 58.70 1sbz s THR 47 Cb 0.11 -2.55 0.80 0.00 1.34 0.00 0.00 72.50 72.20 1sbz s THR 47 CO 0.67 -0.22 2.06 -0.81 -0.54 0.00 0.00 174.62 175.78 1sbz n PRO 48 N -0.63 0.96 -3.88 3.99 -0.04 -1.26 -4.69 135.00 129.45 1sbz n PRO 48 Ca -0.05 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.15 1sbz n PRO 48 Cb 0.64 -1.46 -0.03 0.00 -0.04 0.00 0.00 33.50 32.61 1sbz n PRO 48 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1sbz s TYR 49 N -2.00 3.49 0.65 0.54 2.02 -1.26 -5.12 117.35 115.67 1sbz s TYR 49 Ca 0.42 0.18 0.01 0.00 -0.37 0.00 0.00 57.07 57.32 1sbz s TYR 49 Cb 0.19 -1.72 0.09 0.00 -0.40 0.00 0.00 41.96 40.13 1sbz s TYR 49 CO 0.33 0.48 0.90 -1.54 -1.57 0.00 0.00 175.55 174.15 1sbz s SER 50 N -3.18 4.71 0.15 2.29 1.04 -1.26 -4.19 113.70 113.26 1sbz s SER 50 Ca 0.36 -0.33 -0.16 0.00 0.48 0.00 0.00 55.95 56.29 1sbz s SER 50 Cb -0.11 -0.22 0.01 0.00 0.10 0.00 0.00 66.02 65.80 1sbz s SER 50 CO 0.29 -1.59 1.81 0.00 0.98 0.00 0.00 173.24 174.73 1sbz h ALA 51 N -0.26 0.49 -0.79 5.32 0.00 -1.96 -2.86 119.26 119.20 1sbz h ALA 51 Ca -0.37 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.47 1sbz h ALA 51 Cb 1.28 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.88 1sbz h ALA 51 CO 0.44 -0.06 0.33 0.00 0.00 0.00 0.00 179.25 179.95 1sbz h ARG 52 N 0.51 1.16 -0.29 0.00 3.08 -1.98 -1.31 114.38 115.56 1sbz h ARG 52 Ca 0.14 -0.20 0.06 0.00 0.07 0.00 0.00 59.98 60.06 1sbz h ARG 52 Cb -0.05 -0.19 -0.07 0.00 0.08 0.00 0.00 29.97 29.74 1sbz h ARG 52 CO -0.04 0.93 -0.15 -0.44 -1.07 0.00 0.00 179.97 179.21 1sbz h ASP 53 N 1.14 -0.49 -0.49 7.04 3.32 -1.92 -0.88 116.42 124.14 1sbz h ASP 53 Ca 0.26 0.11 -0.06 0.00 0.02 0.00 0.00 57.03 57.37 1sbz h ASP 53 Cb 0.19 0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.99 1sbz h ASP 53 CO -0.02 -0.18 0.08 0.58 -1.72 0.00 0.00 179.24 177.97 1sbz h VAL 54 N -0.11 1.25 -0.58 -1.35 2.07 -1.25 -2.62 116.25 113.66 1sbz h VAL 54 Ca 0.15 -0.93 0.06 0.00 0.82 0.00 0.00 66.70 66.80 1sbz h VAL 54 Cb 0.34 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 1sbz h VAL 54 CO -0.36 0.33 0.39 0.00 0.02 0.00 0.00 177.57 177.95 1sbz h ALA 55 N 0.96 1.82 0.00 1.67 0.00 -0.91 -1.09 119.26 121.71 1sbz h ALA 55 Ca 0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1sbz h ALA 55 Cb 0.40 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1sbz h ALA 55 CO 0.01 0.09 -0.03 0.00 0.00 0.00 0.00 179.25 179.32 1sbz h ALA 56 N 1.68 1.02 0.00 0.00 0.00 -0.78 -2.67 119.26 118.51 1sbz h ALA 56 Ca 0.25 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1sbz h ALA 56 Cb 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1sbz h ALA 56 CO -0.07 0.03 0.00 -0.07 0.00 0.00 0.00 179.25 179.14 1sbz h LEU 57 N 0.00 0.00 -9.51 0.00 4.07 -1.12 -3.45 115.31 105.30 1sbz h LEU 57 Ca -0.00 0.00 -0.63 0.00 0.08 0.00 0.00 57.88 57.33 1sbz h LEU 57 Cb 0.43 0.00 -0.11 0.00 1.08 0.00 0.00 40.66 42.06 1sbz h LEU 57 CO 0.00 0.00 -0.65 0.00 -1.08 0.00 0.00 178.44 176.71 1sbz s ALA 58 N -3.39 3.29 0.23 1.53 0.00 -1.01 -4.64 121.76 117.78 1sbz s ALA 58 Ca 0.04 -1.21 -0.06 0.00 0.00 0.00 0.00 51.96 50.74 1sbz s ALA 58 Cb 0.09 -1.15 0.23 0.00 0.00 0.00 0.00 23.12 22.29 1sbz s ALA 58 CO 0.51 0.61 1.79 -0.44 0.00 0.00 0.00 175.76 178.23 1sbz h ASP 59 N 3.09 1.01 -4.14 0.00 3.32 -1.78 -3.44 116.42 114.48 1sbz h ASP 59 Ca -0.47 -0.16 -0.36 0.00 0.02 0.00 0.00 57.03 56.05 1sbz h ASP 59 Cb 1.18 -0.26 -0.27 0.00 0.22 0.00 0.00 39.33 40.20 1sbz h ASP 59 CO 0.59 0.92 -0.77 -0.36 -1.72 0.00 0.00 179.24 177.90 1sbz s PHE 60 N -5.46 0.74 -0.15 4.55 0.40 -0.65 -5.02 117.98 112.39 1sbz s PHE 60 Ca -0.12 -0.21 -0.00 0.00 -0.60 0.00 0.00 56.93 56.00 1sbz s PHE 60 Cb 0.16 -0.46 0.03 0.00 0.51 0.00 0.00 43.02 43.26 1sbz s PHE 60 CO 0.83 -0.02 -0.09 0.45 0.70 0.00 0.00 175.22 177.10 1sbz s SER 61 N -0.51 2.68 -0.05 1.36 0.15 -1.26 0.24 113.70 116.31 1sbz s SER 61 Ca 0.01 -0.54 -0.01 0.00 0.70 0.00 0.00 55.95 56.10 1sbz s SER 61 Cb -0.05 -1.00 -0.04 0.00 -1.71 0.00 0.00 66.02 63.23 1sbz s SER 61 CO 0.00 -0.13 0.03 -1.00 1.20 0.00 0.00 173.24 173.34 1sbz s HIS 62 N 1.59 3.19 0.22 3.44 3.76 0.60 -4.96 115.29 123.13 1sbz s HIS 62 Ca 0.03 0.19 -0.31 0.00 -0.15 0.00 0.00 55.06 54.82 1sbz s HIS 62 Cb -0.14 -1.76 -0.10 0.00 1.11 0.00 0.00 32.58 31.69 1sbz s HIS 62 CO -0.09 0.50 1.52 1.21 -0.85 0.00 0.00 174.74 177.04 1sbz s ASN 63 N -1.23 6.58 0.38 1.40 3.84 -1.26 -4.48 114.94 120.17 1sbz s ASN 63 Ca 0.17 2.69 0.26 0.00 0.21 0.00 0.00 52.86 56.18 1sbz s ASN 63 Cb -0.12 -2.61 1.39 0.00 -0.55 0.00 0.00 41.25 39.36 1sbz s ASN 63 CO 0.07 -0.79 1.79 1.55 -2.79 0.00 0.00 177.10 176.93 1sbz h PRO 64 N 5.77 0.00 -0.19 0.43 0.13 -1.95 -1.20 132.00 134.99 1sbz h PRO 64 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1sbz h PRO 64 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1sbz h PRO 64 CO 0.84 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.61 1sbz n ALA 65 N -1.83 2.44 -3.03 -0.56 0.00 -1.26 -0.09 120.51 116.18 1sbz n ALA 65 Ca -0.02 -0.82 -0.45 0.00 0.00 0.00 0.00 53.44 52.15 1sbz n ALA 65 Cb 0.05 -0.79 -0.02 0.00 0.00 0.00 0.00 19.45 18.69 1sbz n ALA 65 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1sbz s ASP 66 N -1.67 6.70 0.00 0.00 2.15 -0.46 -4.81 116.67 118.58 1sbz s ASP 66 Ca 0.31 -2.29 0.29 0.00 0.43 0.00 0.00 52.55 51.30 1sbz s ASP 66 Cb 0.20 -2.35 1.73 0.00 -0.30 0.00 0.00 42.92 42.21 1sbz s ASP 66 CO 0.29 -0.91 2.09 0.00 -0.17 0.00 0.00 175.17 176.47 1sbz n GLN 67 N 5.79 0.87 -0.24 4.34 1.13 -1.26 -2.66 117.38 125.35 1sbz n GLN 67 Ca 0.22 0.00 0.10 0.00 -1.94 0.00 0.00 57.00 55.38 1sbz n GLN 67 Cb 0.48 -1.50 0.23 0.00 0.11 0.00 0.00 30.24 29.56 1sbz n GLN 67 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1sbz n ALA 68 N -1.03 2.35 -0.94 -1.58 0.00 -1.26 -4.80 120.51 113.25 1sbz n ALA 68 Ca 0.21 -1.12 -0.30 0.00 0.00 0.00 0.00 53.44 52.23 1sbz n ALA 68 Cb 0.11 -0.76 0.15 0.00 0.00 0.00 0.00 19.45 18.96 1sbz n ALA 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sbz s ALA 69 N -1.15 1.48 0.18 0.00 0.00 -1.09 -4.93 121.76 116.25 1sbz s ALA 69 Ca 0.37 0.28 -0.14 0.00 0.00 0.00 0.00 51.96 52.48 1sbz s ALA 69 Cb 0.20 -3.32 0.15 0.00 0.00 0.00 0.00 23.12 20.15 1sbz s ALA 69 CO 0.27 -2.52 1.74 1.79 0.00 0.00 0.00 175.76 177.04 1sbz h THR 70 N -1.68 0.81 0.00 0.00 1.35 -1.95 -2.49 112.91 108.95 1sbz h THR 70 Ca -0.47 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 65.29 1sbz h THR 70 Cb 1.27 0.49 0.00 0.00 -1.73 0.00 0.00 68.15 68.18 1sbz h THR 70 CO 0.48 0.05 0.00 2.30 -0.25 0.00 0.00 175.52 178.10 1sbz n ILE 71 N -5.05 0.24 1.33 6.82 -5.35 -1.26 -2.62 119.36 113.47 1sbz n ILE 71 Ca 0.04 0.06 0.14 0.00 -0.27 0.00 0.00 62.75 62.72 1sbz n ILE 71 Cb 0.20 -0.80 0.49 0.00 -1.74 0.00 0.00 39.64 37.79 1sbz n ILE 71 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1sbz n SER 72 N -1.12 0.77 -4.55 7.28 3.41 -0.94 -4.50 113.62 113.97 1sbz n SER 72 Ca 0.10 -0.76 -0.33 0.00 -0.26 0.00 0.00 58.87 57.63 1sbz n SER 72 Cb 0.09 0.03 -0.11 0.00 -0.26 0.00 0.00 64.21 63.95 1sbz n SER 72 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1sbz s SER 73 N -2.47 4.42 0.28 4.04 0.15 -1.08 -4.89 113.70 114.15 1sbz s SER 73 Ca 0.27 -0.15 0.26 0.00 0.70 0.00 0.00 55.95 57.03 1sbz s SER 73 Cb 0.20 -1.01 0.90 0.00 -1.71 0.00 0.00 66.02 64.40 1sbz s SER 73 CO 0.49 0.32 1.76 1.23 1.20 0.00 0.00 173.24 178.24 1sbz h GLY 74 N 4.91 0.00 2.00 9.45 0.00 -1.88 -2.99 103.07 114.55 1sbz h GLY 74 Ca -0.48 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.81 1sbz h GLY 74 CO 0.52 0.00 -0.17 1.48 0.00 0.00 0.00 176.54 178.37 1sbz h SER 75 N 0.00 0.00 -2.89 0.19 4.64 -1.95 -3.40 113.55 110.15 1sbz h SER 75 Ca 0.00 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.74 1sbz h SER 75 Cb 0.58 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.57 1sbz h SER 75 CO 0.00 0.17 0.78 0.12 -0.87 0.00 0.00 176.83 177.03 1sbz s PHE 76 N -3.52 2.60 0.08 4.77 5.36 -1.13 -5.00 117.98 121.13 1sbz s PHE 76 Ca 0.02 -0.03 -0.31 0.00 -0.96 0.00 0.00 56.93 55.65 1sbz s PHE 76 Cb 0.09 -4.35 -0.07 0.00 -0.34 0.00 0.00 43.02 38.34 1sbz s PHE 76 CO 0.63 -1.64 1.41 0.50 -1.46 0.00 0.00 175.22 174.66 1sbz s ARG 77 N 4.64 4.30 0.33 10.12 3.52 -1.26 -4.92 118.95 135.68 1sbz s ARG 77 Ca 0.33 2.06 0.03 0.00 -0.13 0.00 0.00 55.73 58.02 1sbz s ARG 77 Cb -0.11 -3.38 -0.04 0.00 -1.56 0.00 0.00 34.95 29.86 1sbz s ARG 77 CO 0.18 -0.50 0.11 0.95 -0.81 0.00 0.00 175.30 175.22 1sbz s THR 78 N 1.62 0.72 -2.91 4.11 -4.23 -1.26 -4.90 115.64 108.79 1sbz s THR 78 Ca 0.65 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 59.40 1sbz s THR 78 Cb -0.35 -2.57 0.24 0.00 1.34 0.00 0.00 72.50 71.15 1sbz s THR 78 CO 0.29 0.00 1.31 0.47 -0.54 0.00 0.00 174.62 176.15 1sbz n ASP 79 N -0.88 2.94 0.00 3.99 8.00 0.24 -4.93 116.55 125.91 1sbz n ASP 79 Ca -0.02 -1.96 0.00 0.00 0.71 0.00 0.00 54.79 53.51 1sbz n ASP 79 Cb 0.66 -0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.73 1sbz n ASP 79 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1sbz n GLY 80 N 1.35 0.34 3.54 0.44 0.00 -1.22 -4.04 105.19 105.60 1sbz n GLY 80 Ca 0.15 -1.45 -0.08 0.00 0.00 0.00 0.00 46.02 44.64 1sbz n GLY 80 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sbz s ILE 82 N -2.65 -0.01 -0.29 -0.61 1.01 0.31 -0.91 121.20 118.06 1sbz s ILE 82 Ca 0.00 0.02 -0.05 0.00 0.00 0.00 0.00 60.65 60.62 1sbz s ILE 82 Cb 0.00 -0.90 0.02 0.00 0.01 0.00 0.00 42.46 41.59 1sbz s ILE 82 CO 0.00 0.01 0.05 -0.69 0.00 0.00 0.00 174.94 174.31 1sbz s VAL 83 N 1.54 3.66 -0.14 2.92 1.01 -0.21 0.31 120.40 129.49 1sbz s VAL 83 Ca -0.10 -0.84 -0.04 0.00 0.00 0.00 0.00 61.98 61.01 1sbz s VAL 83 Cb -0.06 -2.90 0.07 0.00 0.00 0.00 0.00 36.38 33.48 1sbz s VAL 83 CO -0.17 0.08 0.22 -0.51 0.00 0.00 0.00 175.10 174.71 1sbz s ILE 84 N 1.44 -0.34 0.79 2.22 2.07 0.01 -0.29 121.20 127.10 1sbz s ILE 84 Ca 0.01 0.19 -0.12 0.00 -1.41 0.00 0.00 60.65 59.33 1sbz s ILE 84 Cb -0.17 -0.46 0.07 0.00 0.13 0.00 0.00 42.46 42.02 1sbz s ILE 84 CO 0.01 0.03 1.16 -2.16 -1.91 0.00 0.00 174.94 172.07 1sbz s PRO 85 N 2.35 2.12 -0.23 3.50 0.04 -1.26 -4.22 135.00 137.30 1sbz s PRO 85 Ca 0.04 0.19 -0.04 0.00 0.04 0.00 0.00 61.00 61.23 1sbz s PRO 85 Cb -0.13 -1.96 -0.00 0.00 0.04 0.00 0.00 34.50 32.45 1sbz s PRO 85 CO -0.09 -1.51 -0.04 0.00 0.04 0.00 0.00 177.00 175.41 1sbz n SER 87 N 4.78 0.00 0.00 0.00 3.41 -1.26 -2.07 113.62 118.48 1sbz n SER 87 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.43 1sbz n SER 87 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 1sbz n SER 87 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1sbz n LYS 89 N 0.00 0.00 -0.11 4.33 -0.00 -1.26 -1.02 118.16 120.10 1sbz n LYS 89 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.18 1sbz n LYS 89 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 35.03 35.00 1sbz n LYS 89 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 1sbz h THR 90 N 0.00 1.29 -0.75 0.58 2.02 -1.99 -1.10 112.91 112.95 1sbz h THR 90 Ca 0.00 -1.45 0.06 0.00 0.77 0.00 0.00 66.41 65.79 1sbz h THR 90 Cb 0.00 1.45 -0.06 0.00 -1.74 0.00 0.00 68.15 67.80 1sbz h THR 90 CO 0.00 0.48 0.44 0.25 0.37 0.00 0.00 175.52 177.06 1sbz h LEU 91 N 0.59 0.68 -0.53 2.58 7.12 -1.41 -1.63 115.31 122.71 1sbz h LEU 91 Ca 0.06 0.03 -0.13 0.00 0.13 0.00 0.00 57.88 57.97 1sbz h LEU 91 Cb 0.86 -0.11 -0.01 0.00 -0.53 0.00 0.00 40.66 40.87 1sbz h LEU 91 CO 0.07 0.43 -0.18 0.00 -0.13 0.00 0.00 178.44 178.63 1sbz h ALA 92 N 1.38 0.72 -0.56 1.25 0.00 -1.77 -2.06 119.26 118.22 1sbz h ALA 92 Ca 0.34 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1sbz h ALA 92 Cb 0.19 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1sbz h ALA 92 CO -0.18 0.67 0.33 0.78 0.00 0.00 0.00 179.25 180.85 1sbz h GLY 93 N 0.90 0.82 0.93 0.00 0.00 -0.88 -1.24 103.07 103.60 1sbz h GLY 93 Ca 0.12 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 1sbz h GLY 93 CO 0.06 0.34 0.12 -2.22 0.00 0.00 0.00 176.54 174.83 1sbz h ILE 94 N 0.75 1.21 -0.57 2.60 2.04 -1.24 -0.06 117.51 122.25 1sbz h ILE 94 Ca 0.20 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.37 1sbz h ILE 94 Cb 0.00 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 1sbz h ILE 94 CO -0.04 0.24 0.32 -0.09 0.00 0.00 0.00 178.15 178.58 1sbz h ARG 95 N 0.44 0.78 0.00 2.37 1.12 -1.20 -2.13 114.38 115.77 1sbz h ARG 95 Ca 0.12 -0.08 -0.07 0.00 -1.11 0.00 0.00 59.98 58.84 1sbz h ARG 95 Cb 0.25 -0.16 -0.01 0.00 -0.01 0.00 0.00 29.97 30.05 1sbz h ARG 95 CO -0.00 0.59 -0.32 0.00 -3.11 0.00 0.00 179.97 177.13 1sbz h ALA 96 N 1.15 1.02 0.00 2.80 0.00 -1.14 -3.47 119.26 119.61 1sbz h ALA 96 Ca 0.20 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1sbz h ALA 96 Cb 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1sbz h ALA 96 CO -0.03 0.39 0.00 0.41 0.00 0.00 0.00 179.25 180.02 1sbz n GLY 97 N 0.18 0.50 3.44 0.00 0.00 -0.17 -4.99 105.19 104.15 1sbz n GLY 97 Ca -0.00 -0.53 -0.43 0.00 0.00 0.00 0.00 46.02 45.06 1sbz n GLY 97 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1sbz n TYR 98 N -2.89 4.52 -2.00 1.61 9.36 -0.39 -4.88 117.16 122.50 1sbz n TYR 98 Ca 0.00 -2.91 -0.42 0.00 3.32 0.00 0.00 57.90 57.89 1sbz n TYR 98 Cb 0.00 -2.57 0.00 0.00 -0.63 0.00 0.00 39.34 36.14 1sbz n TYR 98 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1sbz n ALA 99 N 7.71 5.54 0.03 2.98 0.00 -1.26 -4.72 120.51 130.80 1sbz n ALA 99 Ca 0.48 -4.07 -0.08 0.00 0.00 0.00 0.00 53.44 49.77 1sbz n ALA 99 Cb 0.45 -3.27 0.08 0.00 0.00 0.00 0.00 19.45 16.71 1sbz n ALA 99 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1sbz h ASP 100 N 5.83 0.49 -3.72 0.00 3.58 -1.92 -3.40 116.42 117.28 1sbz h ASP 100 Ca 0.50 -0.27 -0.27 0.00 0.42 0.00 0.00 57.03 57.41 1sbz h ASP 100 Cb 0.62 -0.14 -0.06 0.00 1.72 0.00 0.00 39.33 41.47 1sbz h ASP 100 CO 1.76 0.95 -0.21 0.61 -2.88 0.00 0.00 179.24 179.47 1sbz n GLY 101 N 0.23 3.80 0.20 -0.78 0.00 -1.26 -5.02 105.19 102.36 1sbz n GLY 101 Ca -0.03 -2.12 -0.03 0.00 0.00 0.00 0.00 46.02 43.84 1sbz n GLY 101 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1sbz h LEU 102 N 0.00 0.32 0.29 0.99 5.85 -0.78 -0.92 115.31 121.06 1sbz h LEU 102 Ca -0.16 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.41 1sbz h LEU 102 Cb 0.56 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.51 1sbz h LEU 102 CO 0.27 0.70 -0.14 0.58 -0.34 0.00 0.00 178.44 179.50 1sbz h VAL 103 N 0.25 0.72 -0.54 1.05 2.07 -1.93 0.93 116.25 118.81 1sbz h VAL 103 Ca 0.02 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1sbz h VAL 103 Cb 0.83 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 31.30 1sbz h VAL 103 CO 0.07 0.00 0.35 1.23 0.02 0.00 0.00 177.57 179.24 1sbz h GLY 104 N -0.39 0.75 0.92 2.17 0.00 -1.90 -2.19 103.07 102.43 1sbz h GLY 104 Ca -0.04 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 1sbz h GLY 104 CO 0.06 0.28 -0.10 -0.09 0.00 0.00 0.00 176.54 176.69 1sbz h ARG 105 N 0.73 -0.27 -0.57 4.80 9.65 -0.97 0.81 114.38 128.55 1sbz h ARG 105 Ca 0.20 0.02 0.05 0.00 -1.10 0.00 0.00 59.98 59.15 1sbz h ARG 105 Cb -0.08 0.06 -0.05 0.00 -1.39 0.00 0.00 29.97 28.51 1sbz h ARG 105 CO -0.04 -0.12 0.30 0.00 2.80 0.00 0.00 179.97 182.91 1sbz h ALA 106 N 0.41 0.75 -0.48 2.80 0.00 -0.81 0.20 119.26 122.13 1sbz h ALA 106 Ca -0.03 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1sbz h ALA 106 Cb 0.28 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1sbz h ALA 106 CO 0.05 -0.05 0.27 0.00 0.00 0.00 0.00 179.25 179.52 1sbz h ALA 107 N 1.31 0.61 -0.72 0.00 0.00 -1.32 0.20 119.26 119.34 1sbz h ALA 107 Ca 0.26 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.11 1sbz h ALA 107 Cb 0.17 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1sbz h ALA 107 CO -0.18 0.11 0.47 0.22 0.00 0.00 0.00 179.25 179.88 1sbz h ASP 108 N 0.63 0.79 -0.06 0.00 3.58 0.04 -1.29 116.42 120.11 1sbz h ASP 108 Ca 0.17 -0.02 -0.04 0.00 0.42 0.00 0.00 57.03 57.57 1sbz h ASP 108 Cb 0.02 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 40.88 1sbz h ASP 108 CO -0.03 0.56 -0.11 0.58 -2.88 0.00 0.00 179.24 177.35 1sbz h VAL 109 N 0.92 1.42 -0.54 2.25 2.07 -0.04 -1.80 116.25 120.52 1sbz h VAL 109 Ca 0.27 -1.41 0.11 0.00 0.82 0.00 0.00 66.70 66.49 1sbz h VAL 109 Cb -0.03 2.21 -0.09 0.00 -1.52 0.00 0.00 31.29 31.86 1sbz h VAL 109 CO -0.07 0.39 0.02 0.58 0.02 0.00 0.00 177.57 178.51 1sbz h VAL 110 N -0.31 0.59 -0.25 2.57 2.07 -0.41 -1.31 116.25 119.20 1sbz h VAL 110 Ca 0.00 -0.05 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 1sbz h VAL 110 Cb 0.69 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 1sbz h VAL 110 CO 0.03 0.03 0.13 -0.07 0.02 0.00 0.00 177.57 177.70 1sbz h LEU 111 N 0.14 0.32 -1.51 2.57 3.38 -1.19 -0.95 115.31 118.07 1sbz h LEU 111 Ca 0.28 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 1sbz h LEU 111 Cb 0.43 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1sbz h LEU 111 CO -0.44 0.33 -0.25 0.07 0.09 0.00 0.00 178.44 178.24 1sbz h LYS 112 N 0.28 0.00 -0.00 1.13 2.10 -0.90 -2.11 116.57 117.07 1sbz h LYS 112 Ca 0.09 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.74 1sbz h LYS 112 Cb 0.09 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.42 1sbz h LYS 112 CO -0.01 0.25 -0.23 0.39 -2.00 0.00 0.00 179.45 177.85 1sbz n GLU 113 N -4.01 0.25 -1.66 0.07 -0.58 -0.53 -4.93 120.64 109.25 1sbz n GLU 113 Ca -0.02 -0.10 -0.03 0.00 -0.42 0.00 0.00 57.16 56.59 1sbz n GLU 113 Cb 0.32 -1.50 -0.01 0.00 -0.57 0.00 0.00 31.44 29.69 1sbz n GLU 113 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1sbz n GLY 114 N 1.43 0.40 3.96 0.62 0.00 -0.80 -5.05 105.19 105.75 1sbz n GLY 114 Ca 0.09 -0.82 -0.23 0.00 0.00 0.00 0.00 46.02 45.06 1sbz n GLY 114 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sbz s ARG 115 N -3.37 2.48 -0.26 1.61 0.52 -0.40 -5.04 118.95 114.48 1sbz s ARG 115 Ca 0.00 -0.60 -0.25 0.00 -0.52 0.00 0.00 55.73 54.36 1sbz s ARG 115 Cb 0.00 -2.39 -0.00 0.00 0.52 0.00 0.00 34.95 33.08 1sbz s ARG 115 CO 0.00 -0.85 0.86 0.21 0.02 0.00 0.00 175.30 175.55 1sbz s LYS 116 N -4.90 4.13 -0.21 3.54 2.20 -1.26 -4.50 119.74 118.74 1sbz s LYS 116 Ca 0.58 0.91 -0.07 0.00 -0.36 0.00 0.00 55.97 57.03 1sbz s LYS 116 Cb -0.10 -3.67 -0.03 0.00 -1.51 0.00 0.00 37.83 32.51 1sbz s LYS 116 CO 0.40 -0.60 0.05 -1.17 -0.36 0.00 0.00 175.35 173.67 1sbz s LEU 117 N 2.98 3.55 -0.16 5.43 2.96 -1.26 -4.38 118.68 127.80 1sbz s LEU 117 Ca 0.36 -0.08 0.02 0.00 -0.22 0.00 0.00 54.13 54.21 1sbz s LEU 117 Cb -0.15 -1.91 0.01 0.00 0.50 0.00 0.00 46.19 44.64 1sbz s LEU 117 CO 0.09 0.08 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.32 1sbz s VAL 118 N 0.90 2.17 -0.04 1.68 1.01 -1.26 -2.04 120.40 122.82 1sbz s VAL 118 Ca 0.03 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.09 1sbz s VAL 118 Cb -0.14 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.32 1sbz s VAL 118 CO 0.02 0.54 -0.04 -0.76 0.00 0.00 0.00 175.10 174.87 1sbz s LEU 119 N 0.97 3.34 -0.84 3.92 1.02 -0.15 -1.04 118.68 125.90 1sbz s LEU 119 Ca -0.03 -0.01 0.01 0.00 0.02 0.00 0.00 54.13 54.12 1sbz s LEU 119 Cb -0.15 -1.83 0.24 0.00 0.02 0.00 0.00 46.19 44.48 1sbz s LEU 119 CO -0.05 0.33 0.87 0.52 0.02 0.00 0.00 176.35 178.04 1sbz n VAL 120 N 1.86 3.09 -2.20 -1.59 0.31 0.60 -0.48 118.33 119.93 1sbz n VAL 120 Ca -0.17 -5.27 -0.42 0.00 -0.01 0.00 0.00 64.34 58.48 1sbz n VAL 120 Cb 0.53 -2.22 -0.03 0.00 -0.91 0.00 0.00 33.84 31.21 1sbz n VAL 120 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1sbz s PRO 121 N -1.97 4.36 -0.10 5.55 0.04 -1.26 0.20 135.00 141.83 1sbz s PRO 121 Ca 0.32 2.07 -0.02 0.00 0.04 0.00 0.00 61.00 63.40 1sbz s PRO 121 Cb 0.02 -3.21 0.04 0.00 0.04 0.00 0.00 34.50 31.39 1sbz s PRO 121 CO -0.06 -0.32 0.04 0.50 0.04 0.00 0.00 177.00 177.20 1sbz s ARG 122 N 0.29 0.31 0.14 4.56 3.00 -0.88 -4.17 118.95 122.21 1sbz s ARG 122 Ca 0.59 0.08 -0.23 0.00 -1.00 0.00 0.00 55.73 55.17 1sbz s ARG 122 Cb -0.37 -1.14 0.08 0.00 0.00 0.00 0.00 34.95 33.52 1sbz s ARG 122 CO 0.36 -0.42 1.10 -2.00 0.00 0.00 0.00 175.30 174.33 1sbz s GLU 123 N 2.04 1.11 1.09 5.12 2.56 -1.26 -4.72 118.70 124.63 1sbz s GLU 123 Ca 0.04 -0.72 -0.21 0.00 0.00 0.00 0.00 54.97 54.08 1sbz s GLU 123 Cb -0.13 0.31 0.03 0.00 2.00 0.00 0.00 34.13 36.33 1sbz s GLU 123 CO -0.06 -0.52 -0.36 -2.30 -0.56 0.00 0.00 175.26 171.47 1sbz n PRO 125 N -0.76 -1.21 -3.29 4.30 -0.02 -1.26 -5.04 135.00 127.73 1sbz n PRO 125 Ca -0.01 -0.34 -0.39 0.00 -2.02 0.00 0.00 63.50 60.74 1sbz n PRO 125 Cb 0.59 -1.53 -0.07 0.00 -0.02 0.00 0.00 33.50 32.46 1sbz n PRO 125 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1sbz s LEU 126 N 0.93 4.12 0.75 2.45 1.43 -1.26 -5.09 118.68 122.01 1sbz s LEU 126 Ca 0.51 0.58 -0.07 0.00 -1.03 0.00 0.00 54.13 54.13 1sbz s LEU 126 Cb -0.07 -2.64 0.10 0.00 0.03 0.00 0.00 46.19 43.62 1sbz s LEU 126 CO 0.66 -0.18 1.05 -0.94 0.23 0.00 0.00 176.35 177.18 1sbz s SER 127 N 1.23 4.42 0.27 2.29 1.04 -1.26 -4.90 113.70 116.80 1sbz s SER 127 Ca 0.22 0.22 -0.02 0.00 0.48 0.00 0.00 55.95 56.84 1sbz s SER 127 Cb -0.15 -0.71 0.41 0.00 0.10 0.00 0.00 66.02 65.67 1sbz s SER 127 CO 0.09 -1.84 1.90 0.74 0.98 0.00 0.00 173.24 175.11 1sbz h THR 128 N -0.74 1.11 -0.30 2.02 2.02 -1.99 -1.63 112.91 113.40 1sbz h THR 128 Ca -0.43 -0.40 -0.03 0.00 0.77 0.00 0.00 66.41 66.32 1sbz h THR 128 Cb 1.29 -0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 1sbz h THR 128 CO 0.51 0.22 0.06 0.40 0.37 0.00 0.00 175.52 177.08 1sbz h ILE 129 N 1.18 1.23 -0.28 3.11 2.04 -1.99 -1.28 117.51 121.52 1sbz h ILE 129 Ca 0.42 -0.77 0.06 0.00 1.00 0.00 0.00 64.86 65.57 1sbz h ILE 129 Cb 0.13 1.15 -0.06 0.00 -0.74 0.00 0.00 36.82 37.29 1sbz h ILE 129 CO -0.16 0.25 -0.11 0.45 0.00 0.00 0.00 178.15 178.59 1sbz h HIS 130 N 0.33 -0.26 -0.40 1.37 3.86 -1.82 -1.83 115.15 116.41 1sbz h HIS 130 Ca 0.09 0.03 -0.11 0.00 -1.16 0.00 0.00 60.37 59.22 1sbz h HIS 130 Cb 0.32 0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.93 1sbz h HIS 130 CO 0.02 -0.17 -0.21 -0.07 0.86 0.00 0.00 177.93 178.35 1sbz h LEU 131 N -0.06 0.79 0.07 2.43 3.38 -1.20 -2.95 115.31 117.77 1sbz h LEU 131 Ca 0.14 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 1sbz h LEU 131 Cb 0.28 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1sbz h LEU 131 CO -0.33 0.99 -0.03 -0.08 0.09 0.00 0.00 178.44 179.08 1sbz h GLU 132 N 0.68 -0.09 -0.32 1.13 4.81 -1.09 0.15 114.58 119.85 1sbz h GLU 132 Ca 0.10 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1sbz h GLU 132 Cb 0.72 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.13 1sbz h GLU 132 CO 0.06 -0.03 0.00 0.09 -0.73 0.00 0.00 179.01 178.39 1sbz n ASN 133 N -5.12 0.02 0.00 1.04 5.03 -0.70 -1.53 115.26 114.00 1sbz n ASN 133 Ca -0.08 -0.03 0.00 0.00 0.87 0.00 0.00 54.58 55.34 1sbz n ASN 133 Cb 0.08 -0.01 0.00 0.00 -1.02 0.00 0.00 39.78 38.83 1sbz n ASN 133 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 1sbz n LEU 135 N 0.57 0.00 -0.26 3.41 7.94 0.52 -2.43 117.00 126.75 1sbz n LEU 135 Ca 0.00 0.00 -0.06 0.00 -1.11 0.00 0.00 56.01 54.84 1sbz n LEU 135 Cb 0.01 0.00 0.05 0.00 0.53 0.00 0.00 43.42 44.01 1sbz n LEU 135 CO 0.00 0.00 1.09 0.00 -1.11 0.00 0.00 177.39 177.37 1sbz h ALA 136 N 0.00 0.92 -0.29 1.96 0.00 -1.52 -1.11 119.26 119.22 1sbz h ALA 136 Ca 0.00 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.62 1sbz h ALA 136 Cb 0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1sbz h ALA 136 CO 0.00 0.46 -0.45 -0.07 0.00 0.00 0.00 179.25 179.19 1sbz h LEU 137 N 1.00 0.82 -0.76 0.00 3.38 -1.75 -3.17 115.31 114.83 1sbz h LEU 137 Ca 0.25 -0.40 0.08 0.00 0.09 0.00 0.00 57.88 57.91 1sbz h LEU 137 Cb 0.07 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 40.52 1sbz h LEU 137 CO -0.04 1.15 0.42 -1.28 0.09 0.00 0.00 178.44 178.78 1sbz h SER 138 N 0.61 0.60 0.00 -0.43 0.87 -1.58 -2.27 113.55 111.34 1sbz h SER 138 Ca 0.04 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 1sbz h SER 138 Cb 1.02 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.91 1sbz h SER 138 CO 0.10 0.36 0.00 0.54 -0.53 0.00 0.00 176.83 177.29 1sbz n ARG 139 N -4.78 0.00 -0.04 2.24 1.74 -0.47 -3.84 116.66 111.52 1sbz n ARG 139 Ca 0.11 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.20 1sbz n ARG 139 Cb 0.24 -1.49 0.01 0.00 -1.02 0.00 0.00 32.46 30.20 1sbz n ARG 139 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1sbz n GLY 141 N 1.73 0.24 3.66 -0.13 0.00 -1.18 -5.12 105.19 104.39 1sbz n GLY 141 Ca 0.00 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 1sbz n GLY 141 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1sbz s VAL 142 N -0.60 4.47 0.00 1.61 1.01 -0.86 -4.75 120.40 121.28 1sbz s VAL 142 Ca 0.02 1.77 0.00 0.00 0.00 0.00 0.00 61.98 63.77 1sbz s VAL 142 Cb 0.02 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 32.25 1sbz s VAL 142 CO 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 175.10 174.96 1sbz n ALA 143 N 6.33 0.00 0.00 5.51 0.00 -0.86 -4.09 120.51 127.40 1sbz n ALA 143 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1sbz n ALA 143 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1sbz n ALA 143 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1sbz n VAL 145 N -1.95 0.00 -1.71 0.00 0.31 0.37 -0.98 118.33 114.38 1sbz n VAL 145 Ca 0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 63.97 1sbz n VAL 145 Cb 0.00 0.00 0.07 0.00 -0.91 0.00 0.00 33.84 33.00 1sbz n VAL 145 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1sbz s PRO 146 N 0.00 2.51 0.39 5.55 0.04 -1.26 -4.19 135.00 138.03 1sbz s PRO 146 Ca 0.00 1.96 -0.24 0.00 0.04 0.00 0.00 61.00 62.77 1sbz s PRO 146 Cb 0.00 -1.85 -0.10 0.00 0.04 0.00 0.00 34.50 32.59 1sbz s PRO 146 CO 0.00 -1.61 1.00 -1.25 0.04 0.00 0.00 177.00 175.19 1sbz s PRO 147 N -3.49 4.27 -0.02 0.56 0.04 -1.26 -4.95 135.00 130.15 1sbz s PRO 147 Ca 0.80 1.38 0.03 0.00 0.04 0.00 0.00 61.00 63.25 1sbz s PRO 147 Cb -0.35 -2.52 -0.00 0.00 0.04 0.00 0.00 34.50 31.67 1sbz s PRO 147 CO 0.40 -0.02 -0.11 -1.25 0.04 0.00 0.00 177.00 176.06 1sbz s PRO 149 N -2.54 1.03 0.00 0.56 0.04 -1.26 -5.07 135.00 127.76 1sbz s PRO 149 Ca 0.57 -0.38 -0.03 0.00 0.04 0.00 0.00 61.00 61.20 1sbz s PRO 149 Cb -0.18 -0.97 -0.04 0.00 0.04 0.00 0.00 34.50 33.35 1sbz s PRO 149 CO 0.23 0.18 0.19 0.00 0.04 0.00 0.00 177.00 177.65 1sbz s ALA 150 N -0.02 3.96 -0.02 8.56 0.00 -1.26 -5.03 121.76 127.95 1sbz s ALA 150 Ca 0.00 -0.76 0.01 0.00 0.00 0.00 0.00 51.96 51.21 1sbz s ALA 150 Cb -0.07 -1.89 -0.01 0.00 0.00 0.00 0.00 23.12 21.15 1sbz s ALA 150 CO 0.00 0.75 0.02 1.19 0.00 0.00 0.00 175.76 177.72 1sbz n PHE 151 N 0.87 0.00 0.25 0.00 3.01 -1.26 -4.66 117.46 115.67 1sbz n PHE 151 Ca -0.10 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.47 1sbz n PHE 151 Cb 0.52 -0.00 0.66 0.00 -0.01 0.00 0.00 39.48 40.65 1sbz n PHE 151 CO 0.00 0.00 0.00 0.10 1.01 0.00 0.00 176.76 177.87 1sbz h TYR 152 N 0.00 0.00 -0.58 1.38 -0.00 -2.01 -2.04 116.97 113.72 1sbz h TYR 152 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1sbz h TYR 152 Cb 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.74 1sbz h TYR 152 CO 0.00 0.15 0.00 0.27 -0.00 0.00 0.00 178.16 178.58 1sbz n ASN 153 N -3.77 4.21 -3.25 0.10 0.23 -1.26 -5.00 115.26 106.52 1sbz n ASN 153 Ca -0.02 -2.37 -0.10 0.00 -0.53 0.00 0.00 54.58 51.57 1sbz n ASN 153 Cb 0.26 -0.54 0.00 0.00 -2.08 0.00 0.00 39.78 37.42 1sbz n ASN 153 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1sbz n HIS 154 N 1.01 -2.79 -2.47 -2.53 8.25 -0.77 -4.99 115.22 110.92 1sbz n HIS 154 Ca 0.23 1.10 -0.33 0.00 -0.26 0.00 0.00 57.72 58.46 1sbz n HIS 154 Cb 0.79 -3.63 -0.04 0.00 1.12 0.00 0.00 29.99 28.23 1sbz n HIS 154 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1sbz s PRO 155 N -3.43 3.92 0.00 -0.41 0.04 -1.26 -5.00 135.00 128.87 1sbz s PRO 155 Ca 0.06 1.07 0.00 0.00 0.04 0.00 0.00 61.00 62.16 1sbz s PRO 155 Cb -0.01 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.40 1sbz s PRO 155 CO 0.80 -0.30 0.00 0.39 0.04 0.00 0.00 177.00 177.93 1sbz n GLU 156 N -1.34 0.00 -3.78 4.56 1.02 -1.26 -5.08 120.64 114.77 1sbz n GLU 156 Ca 0.07 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 57.00 1sbz n GLU 156 Cb 0.54 -0.94 -0.04 0.00 -0.02 0.00 0.00 31.44 30.98 1sbz n GLU 156 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1sbz s THR 157 N -1.92 2.97 0.23 2.62 -4.23 -1.26 -5.03 115.64 109.01 1sbz s THR 157 Ca 0.00 -1.44 -0.08 0.00 -1.18 0.00 0.00 61.69 59.00 1sbz s THR 157 Cb 0.00 -3.06 0.20 0.00 1.34 0.00 0.00 72.50 70.98 1sbz s THR 157 CO 0.00 -0.08 1.88 0.58 -0.54 0.00 0.00 174.62 176.45 1sbz h VAL 158 N 1.21 1.15 -0.91 2.29 2.07 -2.00 -2.77 116.25 117.29 1sbz h VAL 158 Ca -0.43 -0.37 0.15 0.00 0.82 0.00 0.00 66.70 66.87 1sbz h VAL 158 Cb 1.26 -0.01 -0.09 0.00 -1.52 0.00 0.00 31.29 30.92 1sbz h VAL 158 CO 0.60 0.20 0.52 0.44 0.02 0.00 0.00 177.57 179.34 1sbz h ASP 159 N 1.07 0.68 -0.35 0.57 5.19 -1.98 0.30 116.42 121.90 1sbz h ASP 159 Ca 0.33 0.08 0.05 0.00 -0.62 0.00 0.00 57.03 56.87 1sbz h ASP 159 Cb -0.02 -0.04 -0.05 0.00 0.18 0.00 0.00 39.33 39.40 1sbz h ASP 159 CO -0.11 0.31 0.07 0.44 -3.12 0.00 0.00 179.24 176.83 1sbz h ASP 160 N 0.75 0.01 0.05 6.45 3.32 -1.89 0.35 116.42 125.46 1sbz h ASP 160 Ca 0.49 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.59 1sbz h ASP 160 Cb 0.65 0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.27 1sbz h ASP 160 CO -0.34 0.04 -0.03 0.40 -1.72 0.00 0.00 179.24 177.60 1sbz h ILE 161 N 0.19 1.09 -0.38 0.35 2.04 -1.29 -2.50 117.51 117.01 1sbz h ILE 161 Ca 0.17 -0.47 0.07 0.00 1.00 0.00 0.00 64.86 65.63 1sbz h ILE 161 Cb 0.19 1.40 -0.06 0.00 -0.74 0.00 0.00 36.82 37.60 1sbz h ILE 161 CO -0.22 0.12 -0.02 0.58 0.00 0.00 0.00 178.15 178.61 1sbz h VAL 162 N -0.28 0.70 -0.14 1.67 2.07 -0.74 -1.70 116.25 117.83 1sbz h VAL 162 Ca -0.01 -0.03 -0.10 0.00 0.82 0.00 0.00 66.70 67.39 1sbz h VAL 162 Cb 0.25 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1sbz h VAL 162 CO 0.01 0.02 -0.35 0.45 0.02 0.00 0.00 177.57 177.72 1sbz h HIS 163 N 0.08 0.34 -0.18 1.57 3.86 -0.94 -1.40 115.15 118.49 1sbz h HIS 163 Ca 0.19 -0.08 -0.03 0.00 -1.16 0.00 0.00 60.37 59.28 1sbz h HIS 163 Cb 0.27 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.65 1sbz h HIS 163 CO -0.27 0.61 -0.01 1.25 0.86 0.00 0.00 177.93 180.36 1sbz h HIS 164 N 0.26 0.36 -0.13 2.45 6.17 -1.09 -1.29 115.15 121.88 1sbz h HIS 164 Ca 0.03 -0.07 0.04 0.00 0.71 0.00 0.00 60.37 61.09 1sbz h HIS 164 Cb 0.74 -0.09 -0.05 0.00 2.52 0.00 0.00 27.41 30.52 1sbz h HIS 164 CO 0.02 0.55 -0.18 0.28 0.71 0.00 0.00 177.93 179.31 1sbz h VAL 165 N 0.06 0.53 -0.46 5.26 2.07 -1.13 -1.83 116.25 120.77 1sbz h VAL 165 Ca 0.05 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.65 1sbz h VAL 165 Cb 0.42 0.53 -0.07 0.00 -1.52 0.00 0.00 31.29 30.66 1sbz h VAL 165 CO 0.01 0.00 0.07 0.58 0.02 0.00 0.00 177.57 178.26 1sbz h VAL 166 N -0.23 0.73 -0.79 2.57 2.07 -1.20 -0.75 116.25 118.65 1sbz h VAL 166 Ca 0.10 -0.07 0.10 0.00 0.82 0.00 0.00 66.70 67.65 1sbz h VAL 166 Cb 0.37 0.51 -0.07 0.00 -1.52 0.00 0.00 31.29 30.58 1sbz h VAL 166 CO -0.26 0.04 0.44 0.00 0.02 0.00 0.00 177.57 177.80 1sbz h ALA 167 N 1.36 1.13 0.00 1.67 0.00 -0.85 -0.04 119.26 122.53 1sbz h ALA 167 Ca 0.23 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.08 1sbz h ALA 167 Cb 0.30 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1sbz h ALA 167 CO -0.31 0.05 -0.45 0.00 0.00 0.00 0.00 179.25 178.54 1sbz h ARG 168 N 0.73 0.00 0.12 0.00 2.47 -0.49 -1.58 114.38 115.62 1sbz h ARG 168 Ca 0.39 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 59.10 1sbz h ARG 168 Cb 0.38 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.70 1sbz h ARG 168 CO -0.26 0.45 -0.06 0.28 0.56 0.00 0.00 179.97 180.94 1sbz h VAL 169 N 0.00 1.07 -0.89 2.04 2.07 -0.50 -3.25 116.25 116.79 1sbz h VAL 169 Ca -0.00 -1.13 0.18 0.00 0.82 0.00 0.00 66.70 66.56 1sbz h VAL 169 Cb 1.10 1.74 -0.07 0.00 -1.52 0.00 0.00 31.29 32.54 1sbz h VAL 169 CO 0.06 0.26 0.58 -0.07 0.02 0.00 0.00 177.57 178.41 1sbz h LEU 170 N -0.72 0.52 -1.59 2.57 4.07 -0.94 -1.05 115.31 118.16 1sbz h LEU 170 Ca -0.02 0.04 0.33 0.00 0.08 0.00 0.00 57.88 58.32 1sbz h LEU 170 Cb 0.54 -0.06 -0.08 0.00 1.08 0.00 0.00 40.66 42.14 1sbz h LEU 170 CO 0.03 0.23 0.79 0.44 -1.08 0.00 0.00 178.44 178.85 1sbz h ASP 171 N 0.54 0.25 0.25 -0.43 3.32 -1.32 0.50 116.42 119.54 1sbz h ASP 171 Ca 0.46 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.55 1sbz h ASP 171 Cb 0.95 0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.53 1sbz h ASP 171 CO -0.20 0.01 -0.11 1.56 -1.72 0.00 0.00 179.24 178.78 1sbz h GLN 172 N 0.20 0.00 -0.45 3.56 1.08 -1.32 -1.88 115.11 116.30 1sbz h GLN 172 Ca 0.64 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.84 1sbz h GLN 172 Cb 2.02 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.45 1sbz h GLN 172 CO -0.22 0.11 0.00 1.19 -0.95 0.00 0.00 178.83 178.96 1sbz n PHE 173 N -3.82 0.60 -1.16 2.96 3.01 0.14 -4.96 117.46 114.23 1sbz n PHE 173 Ca -0.02 -0.45 -0.05 0.00 1.01 0.00 0.00 57.45 57.94 1sbz n PHE 173 Cb 0.21 -0.01 -0.02 0.00 -0.01 0.00 0.00 39.48 39.64 1sbz n PHE 173 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1sbz n GLY 174 N 0.96 0.78 3.83 1.37 0.00 -0.71 -5.01 105.19 106.40 1sbz n GLY 174 Ca 0.16 -0.44 -0.37 0.00 0.00 0.00 0.00 46.02 45.37 1sbz n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sbz s LEU 175 N -1.25 4.42 -0.27 0.99 1.43 -1.03 -4.98 118.68 118.00 1sbz s LEU 175 Ca 0.00 1.16 -0.11 0.00 -1.03 0.00 0.00 54.13 54.16 1sbz s LEU 175 Cb 0.00 -3.09 -0.05 0.00 0.03 0.00 0.00 46.19 43.08 1sbz s LEU 175 CO 0.00 0.18 0.18 -0.70 0.23 0.00 0.00 176.35 176.24 1sbz s GLU 176 N -1.56 3.99 0.03 1.70 2.12 -1.26 -3.87 118.70 119.84 1sbz s GLU 176 Ca 0.34 -0.30 -0.25 0.00 0.36 0.00 0.00 54.97 55.11 1sbz s GLU 176 Cb -0.17 -3.61 -0.05 0.00 0.26 0.00 0.00 34.13 30.56 1sbz s GLU 176 CO 0.19 -0.10 0.78 -1.58 -0.54 0.00 0.00 175.26 174.01 1sbz s HIS 177 N 1.51 3.71 -0.35 5.30 5.65 -1.26 -5.13 115.29 124.72 1sbz s HIS 177 Ca 0.07 1.46 -0.26 0.00 0.25 0.00 0.00 55.06 56.59 1sbz s HIS 177 Cb -0.15 -2.85 -0.27 0.00 -1.18 0.00 0.00 32.58 28.13 1sbz s HIS 177 CO 0.09 0.22 1.73 -2.30 -0.65 0.00 0.00 174.74 173.83 1sbz n PRO 178 N 3.05 0.69 0.00 2.88 -0.02 -1.26 -5.04 135.00 135.29 1sbz n PRO 178 Ca -0.01 -1.36 0.00 0.00 -2.02 0.00 0.00 63.50 60.11 1sbz n PRO 178 Cb 0.50 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 1sbz n PRO 178 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1sbz n ARG 182 N 7.43 0.00 -3.09 -0.52 1.74 -1.26 -5.19 116.66 115.77 1sbz n ARG 182 Ca 0.47 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 57.16 1sbz n ARG 182 Cb 0.40 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.78 1sbz n ARG 182 CO 0.00 0.00 0.00 -0.46 -1.52 0.00 0.00 177.63 175.65 1sbz s TRP 183 N -2.00 3.87 0.00 -1.55 -0.11 -1.26 -5.00 118.94 112.89 1sbz s TRP 183 Ca 0.00 1.50 0.00 0.00 1.22 0.00 0.00 56.10 58.82 1sbz s TRP 183 Cb 0.00 -2.67 0.00 0.00 -1.50 0.00 0.00 33.47 29.30 1sbz s TRP 183 CO 0.00 0.54 0.00 1.04 -4.62 0.00 0.00 176.95 173.91 1sbz n GLN 184 N 1.65 0.00 -3.99 5.86 6.02 -1.26 -5.17 117.38 120.49 1sbz n GLN 184 Ca -0.07 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.65 1sbz n GLN 184 Cb 0.49 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.73 1sbz n GLN 184 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1sbz n GLY 185 N 2.62 3.08 0.00 1.08 0.00 -1.26 -5.31 105.19 105.40 1sbz n GLY 185 Ca 0.00 -2.32 0.00 0.00 0.00 0.00 0.00 46.02 43.70 1sbz n GLY 185 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22