#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bzg h VAL 18 N 0.00 0.74 -0.68 2.62 3.04 -2.01 -2.66 116.25 117.30 2bzg h VAL 18 Ca 0.00 -0.03 0.00 0.00 -1.01 0.00 0.00 66.70 65.66 2bzg h VAL 18 Cb 0.00 0.64 0.00 0.00 -2.01 0.00 0.00 31.29 29.92 2bzg h VAL 18 CO 0.00 0.02 0.00 0.00 -1.01 0.00 0.00 177.57 176.58 2bzg n GLN 19 N -5.18 2.59 0.27 4.17 6.02 -1.26 -4.66 117.38 119.32 2bzg n GLN 19 Ca 0.01 -2.47 0.10 0.00 -0.01 0.00 0.00 57.00 54.63 2bzg n GLN 19 Cb 0.18 -1.54 0.70 0.00 1.02 0.00 0.00 30.24 30.60 2bzg n GLN 19 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.06 177.62 2bzg h LYS 20 N 4.06 0.00 -0.62 -1.09 2.10 -1.87 -1.72 116.57 117.43 2bzg h LYS 20 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2bzg h LYS 20 Cb 0.93 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.26 2bzg h LYS 20 CO 0.00 0.01 0.00 0.09 -2.00 0.00 0.00 179.45 177.55 2bzg n ASN 21 N -4.36 3.63 -4.68 7.07 5.03 -1.26 -4.02 115.26 116.67 2bzg n ASN 21 Ca -0.03 -1.99 -0.42 0.00 0.87 0.00 0.00 54.58 53.01 2bzg n ASN 21 Cb 0.10 -0.41 -0.03 0.00 -1.02 0.00 0.00 39.78 38.42 2bzg n ASN 21 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 2bzg s GLN 22 N -1.18 4.27 -0.32 3.52 -1.52 -0.65 -4.98 119.66 118.79 2bzg s GLN 22 Ca 0.45 1.98 -0.00 0.00 -1.95 0.00 0.00 55.36 55.83 2bzg s GLN 22 Cb 0.24 -3.62 0.10 0.00 -0.22 0.00 0.00 33.01 29.51 2bzg s GLN 22 CO 0.32 -0.61 0.11 0.08 -0.25 0.00 0.00 175.29 174.93 2bzg s VAL 23 N 2.63 0.93 0.32 1.09 1.01 -1.26 -4.06 120.40 121.05 2bzg s VAL 23 Ca 0.64 -1.52 -0.12 0.00 0.00 0.00 0.00 61.98 60.98 2bzg s VAL 23 Cb -0.31 -1.70 -0.08 0.00 0.00 0.00 0.00 36.38 34.29 2bzg s VAL 23 CO 0.26 -0.70 0.70 -0.76 0.00 0.00 0.00 175.10 174.60 2bzg s LEU 24 N 1.49 4.03 0.20 3.92 1.43 -1.26 -5.09 118.68 123.39 2bzg s LEU 24 Ca 0.11 1.15 0.04 0.00 -1.03 0.00 0.00 54.13 54.40 2bzg s LEU 24 Cb -0.18 -3.97 -0.03 0.00 0.03 0.00 0.00 46.19 42.04 2bzg s LEU 24 CO -0.22 -0.22 0.28 0.42 0.23 0.00 0.00 176.35 176.83 2bzg s THR 25 N -2.04 5.08 0.35 5.49 -4.23 -1.26 -4.94 115.64 114.09 2bzg s THR 25 Ca 0.52 -0.94 0.03 0.00 -1.18 0.00 0.00 61.69 60.12 2bzg s THR 25 Cb -0.10 -3.68 0.22 0.00 1.34 0.00 0.00 72.50 70.28 2bzg s THR 25 CO 0.22 -0.21 1.97 -0.07 -0.54 0.00 0.00 174.62 175.98 2bzg h LEU 26 N 1.75 0.61 -0.68 4.79 3.38 -2.00 -2.49 115.31 120.68 2bzg h LEU 26 Ca -0.50 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.37 2bzg h LEU 26 Cb 1.21 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.78 2bzg h LEU 26 CO 0.64 0.52 0.20 -0.33 0.09 0.00 0.00 178.44 179.57 2bzg h GLU 27 N 0.69 1.06 -0.43 1.13 3.07 -1.98 -0.03 114.58 118.08 2bzg h GLU 27 Ca 0.17 -0.23 0.03 0.00 -0.50 0.00 0.00 59.36 58.84 2bzg h GLU 27 Cb 0.07 -0.15 -0.04 0.00 -0.84 0.00 0.00 28.75 27.79 2bzg h GLU 27 CO -0.02 0.92 0.22 0.93 -1.40 0.00 0.00 179.01 179.65 2bzg h GLU 28 N 0.99 0.42 -0.43 2.33 5.08 -1.86 0.21 114.58 121.32 2bzg h GLU 28 Ca 0.22 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 2bzg h GLU 28 Cb 0.31 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 2bzg h GLU 28 CO -0.01 0.28 0.21 -1.49 -1.00 0.00 0.00 179.01 177.00 2bzg h TRP 29 N 0.43 0.61 -0.86 4.33 4.06 -1.10 -2.09 115.95 121.34 2bzg h TRP 29 Ca 0.19 -0.03 -0.02 0.00 2.06 0.00 0.00 58.89 61.09 2bzg h TRP 29 Cb 0.09 -0.19 -0.04 0.00 -1.00 0.00 0.00 29.16 28.02 2bzg h TRP 29 CO -0.10 0.50 0.47 1.96 -3.56 0.00 0.00 178.44 177.70 2bzg h GLN 30 N 0.55 1.19 -0.91 0.49 4.20 -0.62 -2.51 115.11 117.50 2bzg h GLN 30 Ca 0.15 -0.14 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 2bzg h GLN 30 Cb 0.11 -0.23 -0.04 0.00 0.30 0.00 0.00 27.48 27.61 2bzg h GLN 30 CO -0.02 0.87 0.57 -0.44 -0.67 0.00 0.00 178.83 179.14 2bzg h ASP 31 N 1.20 1.08 -0.63 1.46 3.32 -0.40 -1.46 116.42 120.99 2bzg h ASP 31 Ca 0.30 -0.05 0.10 0.00 0.02 0.00 0.00 57.03 57.40 2bzg h ASP 31 Cb 0.03 -0.27 -0.08 0.00 0.22 0.00 0.00 39.33 39.23 2bzg h ASP 31 CO -0.05 0.81 0.24 0.11 -1.72 0.00 0.00 179.24 178.63 2bzg h LYS 32 N 1.25 0.40 -0.06 3.56 1.57 -0.93 0.17 116.57 122.53 2bzg h LYS 32 Ca 0.33 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 59.08 2bzg h LYS 32 Cb -0.08 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.13 2bzg h LYS 32 CO -0.07 0.27 0.02 -1.49 -0.57 0.00 0.00 179.45 177.62 2bzg h TRP 33 N 0.42 0.10 -0.99 -1.35 4.06 -1.23 0.22 115.95 117.17 2bzg h TRP 33 Ca 0.32 -0.01 0.12 0.00 2.06 0.00 0.00 58.89 61.38 2bzg h TRP 33 Cb 0.41 -0.03 -0.08 0.00 -1.00 0.00 0.00 29.16 28.46 2bzg h TRP 33 CO -0.17 0.22 0.62 0.28 -3.56 0.00 0.00 178.44 175.84 2bzg h VAL 34 N -0.06 0.92 -0.01 1.49 2.07 -0.85 -2.37 116.25 117.44 2bzg h VAL 34 Ca 0.02 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.20 2bzg h VAL 34 Cb 0.17 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 29.79 2bzg h VAL 34 CO -0.00 0.18 -0.14 0.59 0.02 0.00 0.00 177.57 178.22 2bzg n ASN 35 N -4.63 0.76 -0.25 0.57 3.02 0.55 -4.93 115.26 110.35 2bzg n ASN 35 Ca 0.19 -0.81 -0.03 0.00 -0.03 0.00 0.00 54.58 53.89 2bzg n ASN 35 Cb 0.35 0.01 -0.01 0.00 -0.61 0.00 0.00 39.78 39.51 2bzg n ASN 35 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bzg n GLY 36 N 1.27 0.64 3.09 7.41 0.00 -0.42 -4.95 105.19 112.24 2bzg n GLY 36 Ca 0.15 -0.68 -0.43 0.00 0.00 0.00 0.00 46.02 45.05 2bzg n GLY 36 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2bzg n LYS 37 N -2.73 3.73 -2.43 1.61 5.02 -0.07 -4.70 118.16 118.59 2bzg n LYS 37 Ca -0.03 -3.92 -0.13 0.00 -2.02 0.00 0.00 58.31 52.21 2bzg n LYS 37 Cb 0.13 -2.83 0.03 0.00 -0.02 0.00 0.00 35.03 32.35 2bzg n LYS 37 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2bzg n THR 38 N 3.16 1.89 0.29 -0.18 -2.24 -1.26 -4.65 114.28 111.29 2bzg n THR 38 Ca 0.35 -3.60 0.12 0.00 -2.27 0.00 0.00 64.05 58.64 2bzg n THR 38 Cb 0.37 0.05 0.54 0.00 -2.10 0.00 0.00 70.33 69.19 2bzg n THR 38 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bzg n ALA 39 N -0.63 1.37 0.30 6.98 0.00 -1.26 -1.45 120.51 125.82 2bzg n ALA 39 Ca 0.26 0.14 0.18 0.00 0.00 0.00 0.00 53.44 54.02 2bzg n ALA 39 Cb 0.88 -1.36 0.96 0.00 0.00 0.00 0.00 19.45 19.93 2bzg n ALA 39 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2bzg h PHE 40 N 0.00 0.00 -3.21 0.00 -5.15 -2.01 -3.44 116.94 103.13 2bzg h PHE 40 Ca 0.00 0.00 -0.53 0.00 -0.20 0.00 0.00 57.97 57.24 2bzg h PHE 40 Cb 0.20 0.00 0.01 0.00 0.22 0.00 0.00 35.95 36.38 2bzg h PHE 40 CO 0.00 0.03 0.61 -1.58 -2.00 0.00 0.00 178.31 175.37 2bzg s HIS 41 N -4.23 3.38 -0.44 6.09 2.46 -0.53 -4.99 115.29 117.03 2bzg s HIS 41 Ca -0.04 1.23 -0.06 0.00 0.47 0.00 0.00 55.06 56.67 2bzg s HIS 41 Cb 0.13 -3.50 0.12 0.00 -0.13 0.00 0.00 32.58 29.20 2bzg s HIS 41 CO 0.50 -1.57 0.27 -0.65 -2.47 0.00 0.00 174.74 170.83 2bzg s GLN 42 N 0.75 2.22 0.41 2.88 -0.21 -1.26 -4.98 119.66 119.46 2bzg s GLN 42 Ca 0.59 -1.82 0.10 0.00 0.02 0.00 0.00 55.36 54.25 2bzg s GLN 42 Cb -0.32 -3.73 0.91 0.00 1.00 0.00 0.00 33.01 30.86 2bzg s GLN 42 CO 0.31 -1.13 1.99 0.93 -2.12 0.00 0.00 175.29 175.27 2bzg h GLU 43 N 8.19 0.53 -0.01 2.91 3.07 -1.98 -0.55 114.58 126.74 2bzg h GLU 43 Ca -0.16 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.67 2bzg h GLU 43 Cb 1.06 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.85 2bzg h GLU 43 CO 0.77 0.35 -0.28 1.04 -1.40 0.00 0.00 179.01 179.49 2bzg n GLN 44 N -4.48 0.79 0.00 2.33 1.13 -1.26 -4.94 117.38 110.95 2bzg n GLN 44 Ca 0.09 -0.47 0.00 0.00 -1.94 0.00 0.00 57.00 54.68 2bzg n GLN 44 Cb 0.27 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.13 2bzg n GLN 44 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2bzg n GLY 45 N 1.35 -1.01 3.67 1.08 0.00 -0.22 -4.90 105.19 105.16 2bzg n GLY 45 Ca 0.12 -1.64 -0.43 0.00 0.00 0.00 0.00 46.02 44.07 2bzg n GLY 45 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2bzg s HIS 46 N -2.07 2.76 0.06 1.61 2.46 -1.26 -4.92 115.29 113.92 2bzg s HIS 46 Ca 0.00 0.87 0.14 0.00 0.47 0.00 0.00 55.06 56.54 2bzg s HIS 46 Cb 0.00 -3.59 0.24 0.00 -0.13 0.00 0.00 32.58 29.11 2bzg s HIS 46 CO 0.00 -2.13 1.52 1.96 -2.47 0.00 0.00 174.74 173.63 2bzg h GLN 47 N 8.23 0.00 -0.22 2.88 1.08 -1.99 -1.04 115.11 124.05 2bzg h GLN 47 Ca -0.32 0.00 -0.19 0.00 -1.45 0.00 0.00 58.65 56.69 2bzg h GLN 47 Cb 1.14 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.57 2bzg h GLN 47 CO 0.94 0.58 -0.62 -0.07 -0.95 0.00 0.00 178.83 178.71 2bzg h LEU 48 N 0.00 0.87 -0.53 1.46 3.38 -2.00 -1.80 115.31 116.69 2bzg h LEU 48 Ca -0.01 -0.50 -0.05 0.00 0.09 0.00 0.00 57.88 57.41 2bzg h LEU 48 Cb 1.27 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 2bzg h LEU 48 CO 0.08 1.28 0.12 0.25 0.09 0.00 0.00 178.44 180.26 2bzg h LEU 49 N 0.57 0.82 -0.43 1.67 5.85 -1.94 -2.23 115.31 119.62 2bzg h LEU 49 Ca -0.01 -0.24 0.05 0.00 0.84 0.00 0.00 57.88 58.53 2bzg h LEU 49 Cb 1.22 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.99 2bzg h LEU 49 CO 0.13 0.84 0.15 0.50 -0.34 0.00 0.00 178.44 179.72 2bzg h LYS 50 N 0.75 0.31 -0.55 1.25 3.64 -1.09 0.17 116.57 121.05 2bzg h LYS 50 Ca 0.17 -0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.60 2bzg h LYS 50 Cb 0.35 -0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 32.04 2bzg h LYS 50 CO 0.00 0.21 0.24 -0.22 -2.27 0.00 0.00 179.45 177.41 2bzg h LYS 51 N 0.32 0.44 -0.03 1.90 3.64 -1.09 -3.16 116.57 118.60 2bzg h LYS 51 Ca 0.20 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 2bzg h LYS 51 Cb 0.19 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 2bzg h LYS 51 CO -0.20 0.29 -0.06 0.72 -2.27 0.00 0.00 179.45 177.93 2bzg n HIS 52 N -4.94 0.00 -0.12 1.91 8.25 -0.86 -4.65 115.22 114.82 2bzg n HIS 52 Ca 0.06 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.48 2bzg n HIS 52 Cb 0.20 -0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.34 2bzg n HIS 52 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2bzg h LEU 53 N 4.07 -0.05 -0.91 2.41 5.85 -0.65 -0.80 115.31 125.23 2bzg h LEU 53 Ca 0.00 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 2bzg h LEU 53 Cb 0.90 0.12 -0.04 0.00 0.37 0.00 0.00 40.66 42.00 2bzg h LEU 53 CO 0.00 0.01 0.52 0.44 -0.34 0.00 0.00 178.44 179.07 2bzg h ASP 54 N 0.17 1.12 -0.05 1.25 3.32 -1.82 -1.15 116.42 119.25 2bzg h ASP 54 Ca 0.19 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 2bzg h ASP 54 Cb 0.25 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 2bzg h ASP 54 CO -0.28 0.88 0.03 0.74 -1.72 0.00 0.00 179.24 178.89 2bzg h THR 55 N 1.27 1.10 -0.63 0.35 2.02 -1.65 0.76 112.91 116.13 2bzg h THR 55 Ca 0.32 -0.30 0.03 0.00 0.77 0.00 0.00 66.41 67.24 2bzg h THR 55 Cb -0.01 1.21 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 2bzg h THR 55 CO -0.06 0.09 0.42 -0.26 0.37 0.00 0.00 175.52 176.08 2bzg h PHE 56 N -0.03 0.72 -0.02 3.16 0.04 -0.89 -2.59 116.94 117.32 2bzg h PHE 56 Ca 0.02 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.81 2bzg h PHE 56 Cb 0.12 -0.24 0.00 0.00 2.20 0.00 0.00 35.95 38.03 2bzg h PHE 56 CO -0.03 0.42 -0.05 1.28 -0.60 0.00 0.00 178.31 179.32 2bzg n LEU 57 N -4.46 2.34 -4.68 1.54 4.77 -0.46 -4.92 117.00 111.13 2bzg n LEU 57 Ca 0.08 -0.78 -0.48 0.00 -0.03 0.00 0.00 56.01 54.79 2bzg n LEU 57 Cb 0.14 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.18 2bzg n LEU 57 CO 0.35 0.39 1.42 1.17 -1.33 0.00 0.00 177.39 179.39 2bzg n LYS 58 N 0.76 2.13 -0.98 3.23 4.81 0.23 -0.99 118.16 127.35 2bzg n LYS 58 Ca 0.15 0.78 0.00 0.00 -0.87 0.00 0.00 58.31 58.37 2bzg n LYS 58 Cb 0.50 -2.60 0.00 0.00 0.02 0.00 0.00 35.03 32.94 2bzg n LYS 58 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2bzg n GLY 59 N 4.17 0.74 3.82 3.14 0.00 -1.26 -5.02 105.19 110.79 2bzg n GLY 59 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 2bzg n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bzg s LYS 60 N -0.10 3.38 -0.02 1.61 -0.14 -0.16 -5.11 119.74 119.20 2bzg s LYS 60 Ca 0.00 -0.20 0.00 0.00 -1.36 0.00 0.00 55.97 54.41 2bzg s LYS 60 Cb 0.00 -3.11 0.02 0.00 -1.68 0.00 0.00 37.83 33.07 2bzg s LYS 60 CO 0.00 0.73 0.02 0.45 -0.76 0.00 0.00 175.35 175.80 2bzg s SER 61 N -0.91 0.07 -1.34 2.83 0.15 -1.26 -4.91 113.70 108.32 2bzg s SER 61 Ca 0.14 0.03 -0.03 0.00 0.70 0.00 0.00 55.95 56.79 2bzg s SER 61 Cb -0.12 -0.06 0.02 0.00 -1.71 0.00 0.00 66.02 64.15 2bzg s SER 61 CO 0.03 -0.11 0.79 0.61 1.20 0.00 0.00 173.24 175.76 2bzg n GLY 62 N 3.99 -0.34 3.82 9.45 0.00 -1.25 -4.98 105.19 115.88 2bzg n GLY 62 Ca -0.25 0.14 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 2bzg n GLY 62 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bzg s LEU 63 N -6.78 3.23 -0.23 0.99 1.43 -1.26 -4.78 118.68 111.27 2bzg s LEU 63 Ca 0.14 1.63 -0.10 0.00 -1.03 0.00 0.00 54.13 54.77 2bzg s LEU 63 Cb -0.07 -4.50 -0.05 0.00 0.03 0.00 0.00 46.19 41.60 2bzg s LEU 63 CO 0.81 -1.31 0.14 -0.13 0.23 0.00 0.00 176.35 176.09 2bzg s ARG 64 N -4.85 4.06 -0.10 1.70 0.52 -1.26 -0.93 118.95 118.09 2bzg s ARG 64 Ca 0.59 -0.28 0.03 0.00 -0.52 0.00 0.00 55.73 55.55 2bzg s ARG 64 Cb -0.14 -3.48 0.01 0.00 0.52 0.00 0.00 34.95 31.86 2bzg s ARG 64 CO 0.51 0.11 -0.19 0.08 0.02 0.00 0.00 175.30 175.82 2bzg s VAL 65 N 0.89 1.74 -0.10 3.52 1.01 0.25 -0.92 120.40 126.80 2bzg s VAL 65 Ca 0.07 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.20 2bzg s VAL 65 Cb -0.13 -1.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.68 2bzg s VAL 65 CO 0.03 0.49 -0.01 0.12 0.00 0.00 0.00 175.10 175.73 2bzg s PHE 66 N 0.59 3.13 -0.45 5.22 5.36 -1.26 -1.20 117.98 129.37 2bzg s PHE 66 Ca -0.14 0.09 0.02 0.00 -0.96 0.00 0.00 56.93 55.94 2bzg s PHE 66 Cb -0.17 -1.83 0.12 0.00 -0.34 0.00 0.00 43.02 40.80 2bzg s PHE 66 CO 0.05 0.35 0.20 -0.06 -1.46 0.00 0.00 175.22 174.29 2bzg s PHE 67 N -0.57 3.48 0.41 10.12 0.40 0.11 -1.16 117.98 130.78 2bzg s PHE 67 Ca 0.09 -2.96 -0.26 0.00 -0.60 0.00 0.00 56.93 53.21 2bzg s PHE 67 Cb -0.12 -2.96 -0.09 0.00 0.51 0.00 0.00 43.02 40.36 2bzg s PHE 67 CO 0.02 -0.86 1.30 -1.25 0.70 0.00 0.00 175.22 175.13 2bzg s PRO 68 N 0.36 3.94 -1.26 0.24 0.04 -1.25 -2.32 135.00 134.75 2bzg s PRO 68 Ca 0.14 2.16 -0.08 0.00 0.04 0.00 0.00 61.00 63.26 2bzg s PRO 68 Cb -0.22 -2.74 -0.01 0.00 0.04 0.00 0.00 34.50 31.57 2bzg s PRO 68 CO -0.04 -0.51 0.67 1.28 0.04 0.00 0.00 177.00 178.44 2bzg n LEU 69 N 0.09 -2.94 0.14 -3.56 4.32 -0.13 -4.71 117.00 110.21 2bzg n LEU 69 Ca 0.04 -0.93 0.13 0.00 -0.02 0.00 0.00 56.01 55.23 2bzg n LEU 69 Cb 0.44 -2.49 0.39 0.00 -1.62 0.00 0.00 43.42 40.14 2bzg n LEU 69 CO 0.56 0.42 0.88 0.00 -1.22 0.00 0.00 177.39 178.02 2bzg n GLY 71 N 0.99 3.14 1.86 0.00 0.00 -1.26 -1.41 105.19 108.50 2bzg n GLY 71 Ca 0.04 -0.05 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 2bzg n GLY 71 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2bzg n LYS 72 N 14.00 3.23 -1.58 1.61 2.85 -1.26 -4.46 118.16 132.54 2bzg n LYS 72 Ca 0.00 -3.95 -0.56 0.00 -1.05 0.00 0.00 58.31 52.76 2bzg n LYS 72 Cb 0.00 -2.19 -0.08 0.00 -0.65 0.00 0.00 35.03 32.12 2bzg n LYS 72 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2bzg n ALA 73 N -0.79 0.25 0.31 0.58 0.00 -0.50 -4.81 120.51 115.54 2bzg n ALA 73 Ca 0.43 0.23 0.19 0.00 0.00 0.00 0.00 53.44 54.29 2bzg n ALA 73 Cb 0.91 -2.31 0.98 0.00 0.00 0.00 0.00 19.45 19.03 2bzg n ALA 73 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 2bzg h VAL 74 N 5.99 0.11 0.00 0.00 -1.51 -1.91 -3.40 116.25 115.53 2bzg h VAL 74 Ca -0.37 -0.24 -0.21 0.00 -1.23 0.00 0.00 66.70 64.66 2bzg h VAL 74 Cb 1.33 1.20 -0.01 0.00 -2.13 0.00 0.00 31.29 31.68 2bzg h VAL 74 CO 0.99 0.02 1.17 -0.62 -1.23 0.00 0.00 177.57 177.90 2bzg n GLU 75 N -3.21 1.41 0.00 5.19 4.71 -1.26 -3.44 120.64 124.04 2bzg n GLU 75 Ca -0.02 -0.90 0.00 0.00 -0.01 0.00 0.00 57.16 56.23 2bzg n GLU 75 Cb 0.17 -2.06 0.00 0.00 -1.01 0.00 0.00 31.44 28.54 2bzg n GLU 75 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 2bzg n LYS 77 N 3.47 0.00 -0.22 3.49 3.00 -1.26 -2.60 118.16 124.04 2bzg n LYS 77 Ca 0.30 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.57 2bzg n LYS 77 Cb 0.30 0.00 0.06 0.00 0.00 0.00 0.00 35.03 35.39 2bzg n LYS 77 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.40 175.91 2bzg h TRP 78 N 0.00 0.74 -0.13 5.64 4.06 -1.94 0.82 115.95 125.14 2bzg h TRP 78 Ca 0.00 0.02 -0.14 0.00 2.06 0.00 0.00 58.89 60.83 2bzg h TRP 78 Cb 0.00 -0.24 0.00 0.00 -1.00 0.00 0.00 29.16 27.92 2bzg h TRP 78 CO 0.00 0.43 -0.45 0.74 -3.56 0.00 0.00 178.44 175.60 2bzg h PHE 79 N 0.78 0.70 -0.92 0.49 0.04 -1.85 -3.05 116.94 113.14 2bzg h PHE 79 Ca 0.25 -0.29 0.02 0.00 2.80 0.00 0.00 57.97 60.74 2bzg h PHE 79 Cb -0.01 -0.12 -0.05 0.00 2.20 0.00 0.00 35.95 37.98 2bzg h PHE 79 CO -0.05 1.05 0.60 0.00 -0.60 0.00 0.00 178.31 179.32 2bzg h ALA 80 N 0.51 1.18 0.00 2.45 0.00 -1.64 -2.16 119.26 119.61 2bzg h ALA 80 Ca -0.02 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2bzg h ALA 80 Cb 1.08 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 2bzg h ALA 80 CO 0.10 0.53 -0.09 -0.44 0.00 0.00 0.00 179.25 179.34 2bzg h ASP 81 N 1.21 0.00 -0.54 0.00 3.32 -0.87 -2.21 116.42 117.33 2bzg h ASP 81 Ca 0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.40 2bzg h ASP 81 Cb -0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.45 2bzg h ASP 81 CO -0.09 0.09 0.00 0.54 -1.72 0.00 0.00 179.24 178.07 2bzg n ARG 82 N -3.62 2.34 -0.35 3.56 1.74 -0.87 -4.95 116.66 114.52 2bzg n ARG 82 Ca -0.02 -2.08 0.00 0.00 -0.77 0.00 0.00 57.85 54.98 2bzg n ARG 82 Cb 0.21 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.19 2bzg n ARG 82 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bzg n GLY 83 N 1.43 0.81 3.92 -0.13 0.00 -0.83 -4.81 105.19 105.58 2bzg n GLY 83 Ca 0.19 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 2bzg n GLY 83 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2bzg s HIS 84 N -2.09 3.48 -0.15 1.61 3.76 -0.87 -3.93 115.29 117.10 2bzg s HIS 84 Ca 0.00 0.39 -0.10 0.00 -0.15 0.00 0.00 55.06 55.21 2bzg s HIS 84 Cb 0.00 -1.89 -0.05 0.00 1.11 0.00 0.00 32.58 31.75 2bzg s HIS 84 CO 0.00 0.38 0.17 -1.54 -0.85 0.00 0.00 174.74 172.90 2bzg s SER 85 N -3.02 6.34 -0.08 1.40 1.04 -0.11 -3.91 113.70 115.37 2bzg s SER 85 Ca 0.39 0.40 0.03 0.00 0.48 0.00 0.00 55.95 57.25 2bzg s SER 85 Cb -0.11 -2.10 -0.01 0.00 0.10 0.00 0.00 66.02 63.89 2bzg s SER 85 CO 0.28 0.27 -0.19 -0.69 0.98 0.00 0.00 173.24 173.90 2bzg s VAL 86 N -0.26 2.62 -0.05 5.02 1.01 0.35 -0.58 120.40 128.51 2bzg s VAL 86 Ca 0.13 -0.85 0.04 0.00 0.00 0.00 0.00 61.98 61.30 2bzg s VAL 86 Cb -0.12 -2.03 -0.00 0.00 0.00 0.00 0.00 36.38 34.23 2bzg s VAL 86 CO 0.02 0.56 -0.17 -0.69 0.00 0.00 0.00 175.10 174.81 2bzg s VAL 87 N -0.09 1.47 0.23 2.92 1.01 -0.34 -1.52 120.40 124.07 2bzg s VAL 87 Ca -0.04 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 61.29 2bzg s VAL 87 Cb -0.14 -1.26 -0.05 0.00 0.00 0.00 0.00 36.38 34.93 2bzg s VAL 87 CO 0.04 0.42 -0.14 -0.83 0.00 0.00 0.00 175.10 174.59 2bzg s GLY 88 N 0.06 1.55 -0.06 4.51 0.00 -0.37 -0.71 107.32 112.30 2bzg s GLY 88 Ca -0.05 -1.72 0.02 0.00 0.00 0.00 0.00 44.72 42.97 2bzg s GLY 88 CO 0.02 -1.80 -0.12 0.54 0.00 0.00 0.00 173.10 171.74 2bzg s VAL 89 N -2.90 1.10 -0.17 1.40 0.11 -0.98 -0.48 120.40 118.48 2bzg s VAL 89 Ca 0.24 -0.47 -0.07 0.00 -2.93 0.00 0.00 61.98 58.76 2bzg s VAL 89 Cb -0.01 -1.01 0.07 0.00 -1.53 0.00 0.00 36.38 33.90 2bzg s VAL 89 CO 0.09 0.35 0.37 -0.70 -3.33 0.00 0.00 175.10 171.87 2bzg s GLU 90 N 0.62 0.30 0.40 1.54 2.56 -0.27 -0.95 118.70 122.90 2bzg s GLU 90 Ca -0.14 0.85 0.16 0.00 0.00 0.00 0.00 54.97 55.85 2bzg s GLU 90 Cb -0.15 0.10 0.84 0.00 2.00 0.00 0.00 34.13 36.92 2bzg s GLU 90 CO 0.03 -0.22 1.86 0.97 -0.56 0.00 0.00 175.26 177.34 2bzg h ILE 91 N 5.97 1.10 -3.56 -3.70 6.09 -1.82 -3.18 117.51 118.41 2bzg h ILE 91 Ca -0.24 -1.17 -0.61 0.00 -1.37 0.00 0.00 64.86 61.46 2bzg h ILE 91 Cb 1.14 1.66 -0.11 0.00 0.47 0.00 0.00 36.82 39.97 2bzg h ILE 91 CO 0.20 0.32 0.40 -0.55 -3.07 0.00 0.00 178.15 175.45 2bzg s SER 92 N -6.74 6.52 0.39 2.19 0.15 -1.26 -4.66 113.70 110.28 2bzg s SER 92 Ca -0.02 0.25 0.05 0.00 0.70 0.00 0.00 55.95 56.92 2bzg s SER 92 Cb 0.14 -2.40 0.77 0.00 -1.71 0.00 0.00 66.02 62.81 2bzg s SER 92 CO 0.70 -0.80 2.03 -0.08 1.20 0.00 0.00 173.24 176.29 2bzg h GLU 93 N 8.64 0.65 -0.46 5.44 4.81 -1.95 -2.37 114.58 129.33 2bzg h GLU 93 Ca -0.25 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 58.93 2bzg h GLU 93 Cb 1.09 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 30.30 2bzg h GLU 93 CO 0.93 0.44 0.24 1.25 -0.73 0.00 0.00 179.01 181.14 2bzg h LEU 94 N 0.66 0.59 -0.44 1.64 5.85 -1.96 -0.91 115.31 120.74 2bzg h LEU 94 Ca 0.18 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 2bzg h LEU 94 Cb -0.06 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 2bzg h LEU 94 CO -0.04 0.53 0.22 1.23 -0.34 0.00 0.00 178.44 180.04 2bzg h GLY 95 N 0.60 0.68 0.70 3.75 0.00 -1.86 0.66 103.07 107.59 2bzg h GLY 95 Ca 0.16 -0.33 0.05 0.00 0.00 0.00 0.00 47.33 47.21 2bzg h GLY 95 CO -0.02 0.31 0.23 -2.22 0.00 0.00 0.00 176.54 174.84 2bzg h ILE 96 N 0.57 0.93 -0.78 2.60 2.04 -1.26 -0.21 117.51 121.41 2bzg h ILE 96 Ca 0.15 -0.16 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 2bzg h ILE 96 Cb 0.10 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 36.59 2bzg h ILE 96 CO -0.02 0.08 0.32 1.56 0.00 0.00 0.00 178.15 180.10 2bzg h GLN 97 N 0.45 1.16 -0.70 2.37 4.20 -0.84 -2.20 115.11 119.55 2bzg h GLN 97 Ca 0.22 -0.20 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 2bzg h GLN 97 Cb 0.15 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.70 2bzg h GLN 97 CO -0.17 0.93 0.33 0.93 -0.67 0.00 0.00 178.83 180.18 2bzg h GLU 98 N 1.12 1.00 -0.01 1.46 5.08 -0.27 -0.82 114.58 122.15 2bzg h GLU 98 Ca 0.26 -0.14 0.03 0.00 -1.00 0.00 0.00 59.36 58.51 2bzg h GLU 98 Cb 0.20 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 2bzg h GLU 98 CO -0.02 0.78 -0.15 0.35 -1.00 0.00 0.00 179.01 178.96 2bzg h PHE 99 N 1.00 -0.40 -0.60 4.33 3.57 -0.44 0.89 116.94 125.28 2bzg h PHE 99 Ca 0.24 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.67 2bzg h PHE 99 Cb 0.11 0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 2bzg h PHE 99 CO 0.01 -0.23 0.03 0.74 -2.23 0.00 0.00 178.31 176.63 2bzg h PHE 100 N -0.25 1.12 -0.23 0.41 0.04 -1.19 -0.62 116.94 116.21 2bzg h PHE 100 Ca 0.05 -0.19 -0.00 0.00 2.80 0.00 0.00 57.97 60.63 2bzg h PHE 100 Cb 0.32 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.16 2bzg h PHE 100 CO -0.21 0.99 0.13 1.15 -0.60 0.00 0.00 178.31 179.77 2bzg h THR 101 N 0.94 1.11 -0.07 -1.55 2.02 -1.01 -0.56 112.91 113.78 2bzg h THR 101 Ca 0.17 -0.30 -0.14 0.00 0.77 0.00 0.00 66.41 66.92 2bzg h THR 101 Cb 0.52 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 2bzg h THR 101 CO 0.03 0.11 -0.57 -0.33 0.37 0.00 0.00 175.52 175.12 2bzg h GLU 102 N 0.27 0.22 -0.07 6.66 5.08 -0.50 -2.69 114.58 123.55 2bzg h GLU 102 Ca 0.08 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2bzg h GLU 102 Cb 0.06 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2bzg h GLU 102 CO -0.01 0.73 0.00 1.04 -1.00 0.00 0.00 179.01 179.77 2bzg n GLN 103 N -3.89 1.55 -3.75 2.33 1.13 -0.27 -4.95 117.38 109.53 2bzg n GLN 103 Ca -0.02 -0.81 -0.24 0.00 -1.94 0.00 0.00 57.00 53.98 2bzg n GLN 103 Cb 0.59 -1.43 0.02 0.00 0.11 0.00 0.00 30.24 29.53 2bzg n GLN 103 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 2bzg n ASN 104 N 0.01 -2.03 -4.22 1.08 5.15 -0.80 -4.99 115.26 109.45 2bzg n ASN 104 Ca 0.18 -0.92 -0.32 0.00 -0.60 0.00 0.00 54.58 52.92 2bzg n ASN 104 Cb 0.29 -3.65 -0.17 0.00 -0.53 0.00 0.00 39.78 35.72 2bzg n ASN 104 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2bzg s LEU 105 N -6.66 2.13 0.60 1.20 1.43 -0.29 -5.05 118.68 112.04 2bzg s LEU 105 Ca 0.12 -0.56 -0.16 0.00 -1.03 0.00 0.00 54.13 52.51 2bzg s LEU 105 Cb -0.04 -1.43 -0.03 0.00 0.03 0.00 0.00 46.19 44.72 2bzg s LEU 105 CO 0.84 0.14 1.06 -0.94 0.23 0.00 0.00 176.35 177.68 2bzg s SER 106 N 0.46 5.75 0.26 2.29 1.04 -1.26 -4.58 113.70 117.66 2bzg s SER 106 Ca -0.16 1.81 -0.12 0.00 0.48 0.00 0.00 55.95 57.97 2bzg s SER 106 Cb -0.17 -2.53 -0.00 0.00 0.10 0.00 0.00 66.02 63.41 2bzg s SER 106 CO 0.06 -1.19 0.49 -0.72 0.98 0.00 0.00 173.24 172.86 2bzg s TYR 107 N -2.47 0.41 0.26 5.02 -0.85 -1.26 -0.55 117.35 117.92 2bzg s TYR 107 Ca 0.63 -0.78 0.00 0.00 -0.52 0.00 0.00 57.07 56.41 2bzg s TYR 107 Cb -0.16 0.19 -0.03 0.00 0.38 0.00 0.00 41.96 42.34 2bzg s TYR 107 CO 0.38 -1.03 0.26 -1.54 -1.52 0.00 0.00 175.55 172.09 2bzg s SER 108 N -3.04 0.69 0.13 -0.18 1.04 -0.49 -4.85 113.70 107.00 2bzg s SER 108 Ca 0.23 -1.47 0.09 0.00 0.48 0.00 0.00 55.95 55.28 2bzg s SER 108 Cb -0.01 0.49 -0.04 0.00 0.10 0.00 0.00 66.02 66.57 2bzg s SER 108 CO 0.10 -1.00 -0.22 -1.61 0.98 0.00 0.00 173.24 171.49 2bzg s GLU 109 N -3.78 1.26 0.06 4.02 2.02 -1.26 -0.80 118.70 120.21 2bzg s GLU 109 Ca 0.37 -1.29 -0.00 0.00 0.02 0.00 0.00 54.97 54.06 2bzg s GLU 109 Cb 0.04 -1.53 -0.04 0.00 0.10 0.00 0.00 34.13 32.70 2bzg s GLU 109 CO 0.18 0.35 -0.04 -1.21 0.02 0.00 0.00 175.26 174.55 2bzg s GLU 110 N -2.22 0.64 0.51 1.61 2.02 -0.57 -4.99 118.70 115.70 2bzg s GLU 110 Ca 0.12 -1.17 -0.20 0.00 0.02 0.00 0.00 54.97 53.74 2bzg s GLU 110 Cb -0.09 0.07 -0.07 0.00 0.10 0.00 0.00 34.13 34.13 2bzg s GLU 110 CO 0.06 -0.07 1.08 -1.25 0.02 0.00 0.00 175.26 175.10 2bzg s PRO 111 N -3.54 3.63 -0.67 0.39 0.04 -1.26 -0.56 135.00 133.02 2bzg s PRO 111 Ca 0.05 1.49 -0.20 0.00 0.04 0.00 0.00 61.00 62.37 2bzg s PRO 111 Cb 0.05 -2.09 0.09 0.00 0.04 0.00 0.00 34.50 32.59 2bzg s PRO 111 CO -0.07 -0.60 0.88 0.42 0.04 0.00 0.00 177.00 177.67 2bzg s ILE 112 N -1.86 4.60 0.48 0.56 1.01 -0.72 -4.62 121.20 120.64 2bzg s ILE 112 Ca 0.69 -0.80 0.20 0.00 0.00 0.00 0.00 60.65 60.74 2bzg s ILE 112 Cb -0.20 -4.62 0.25 0.00 0.01 0.00 0.00 42.46 37.91 2bzg s ILE 112 CO 0.24 -1.33 2.09 0.71 0.00 0.00 0.00 174.94 176.65 2bzg h THR 113 N 5.91 0.88 0.00 2.92 1.35 -1.94 -1.82 112.91 120.21 2bzg h THR 113 Ca -0.23 -0.38 -0.00 0.00 -0.55 0.00 0.00 66.41 65.25 2bzg h THR 113 Cb 1.07 1.21 -0.00 0.00 -1.73 0.00 0.00 68.15 68.70 2bzg h THR 113 CO 1.13 0.10 -0.02 -0.33 -0.25 0.00 0.00 175.52 176.16 2bzg h GLU 114 N 0.00 0.00 -2.91 4.72 3.07 -1.91 -3.38 114.58 114.17 2bzg h GLU 114 Ca -0.00 0.00 -0.61 0.00 -0.50 0.00 0.00 59.36 58.25 2bzg h GLU 114 Cb 0.21 0.00 -0.40 0.00 -0.84 0.00 0.00 28.75 27.71 2bzg h GLU 114 CO 0.01 0.02 -0.73 0.42 -1.40 0.00 0.00 179.01 177.33 2bzg s ILE 115 N -3.50 1.72 0.28 3.13 -1.09 -0.69 -5.04 121.20 116.02 2bzg s ILE 115 Ca 0.03 -3.16 -0.29 0.00 -2.23 0.00 0.00 60.65 55.00 2bzg s ILE 115 Cb 0.08 -2.17 -0.14 0.00 -1.58 0.00 0.00 42.46 38.65 2bzg s ILE 115 CO 0.59 -0.99 1.14 -2.65 -1.23 0.00 0.00 174.94 171.80 2bzg n PRO 116 N 2.88 1.59 -0.23 2.79 -0.02 -1.26 -2.47 135.00 138.28 2bzg n PRO 116 Ca 0.16 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 2bzg n PRO 116 Cb 0.37 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 2bzg n PRO 116 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bzg n GLY 117 N 1.32 0.79 3.64 -1.23 0.00 -1.26 -5.05 105.19 103.39 2bzg n GLY 117 Ca 0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 2bzg n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bzg s THR 118 N -2.58 3.04 0.03 2.61 -4.23 -1.03 -5.08 115.64 108.41 2bzg s THR 118 Ca 0.00 -1.95 0.01 0.00 -1.18 0.00 0.00 61.69 58.57 2bzg s THR 118 Cb 0.00 -2.79 -0.02 0.00 1.34 0.00 0.00 72.50 71.02 2bzg s THR 118 CO 0.00 -0.30 -0.05 -0.54 -0.54 0.00 0.00 174.62 173.19 2bzg s LYS 119 N -3.70 0.44 -0.13 3.99 1.02 -1.26 -1.76 119.74 118.35 2bzg s LYS 119 Ca 0.33 -0.74 -0.05 0.00 0.02 0.00 0.00 55.97 55.53 2bzg s LYS 119 Cb -0.04 -0.06 -0.04 0.00 -0.52 0.00 0.00 37.83 37.17 2bzg s LYS 119 CO 0.20 -0.01 0.04 0.54 -0.92 0.00 0.00 175.35 175.20 2bzg s VAL 120 N -1.67 4.64 -0.26 3.17 0.11 0.27 -0.84 120.40 125.83 2bzg s VAL 120 Ca -0.11 -0.10 -0.09 0.00 -2.93 0.00 0.00 61.98 58.75 2bzg s VAL 120 Cb -0.08 -3.02 -0.04 0.00 -1.53 0.00 0.00 36.38 31.71 2bzg s VAL 120 CO -0.01 0.54 0.12 -0.36 -3.33 0.00 0.00 175.10 172.06 2bzg s PHE 121 N -0.32 3.14 -0.20 1.54 0.08 0.23 -1.51 117.98 120.94 2bzg s PHE 121 Ca 0.08 -0.20 -0.02 0.00 0.12 0.00 0.00 56.93 56.91 2bzg s PHE 121 Cb -0.12 -2.30 -0.00 0.00 -0.57 0.00 0.00 43.02 40.03 2bzg s PHE 121 CO 0.02 -0.28 -0.09 0.15 -0.10 0.00 0.00 175.22 174.92 2bzg s LYS 122 N 1.67 3.27 0.36 0.44 1.02 0.02 -0.30 119.74 126.23 2bzg s LYS 122 Ca 0.07 -0.69 -0.28 0.00 0.02 0.00 0.00 55.97 55.09 2bzg s LYS 122 Cb -0.15 -2.86 -0.12 0.00 -0.52 0.00 0.00 37.83 34.18 2bzg s LYS 122 CO 0.07 -0.17 1.35 -1.13 -0.92 0.00 0.00 175.35 174.55 2bzg n SER 123 N 4.65 3.05 0.16 2.83 3.41 0.46 -1.40 113.62 126.79 2bzg n SER 123 Ca -0.19 1.20 0.11 0.00 -0.26 0.00 0.00 58.87 59.73 2bzg n SER 123 Cb 0.51 -1.53 0.63 0.00 -0.26 0.00 0.00 64.21 63.56 2bzg n SER 123 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2bzg h SER 124 N 2.61 0.05 0.16 4.04 0.02 -1.15 -1.69 113.55 117.60 2bzg h SER 124 Ca -0.48 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2bzg h SER 124 Cb 1.27 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.80 2bzg h SER 124 CO 0.63 0.04 -0.01 0.77 -1.14 0.00 0.00 176.83 177.12 2bzg h SER 125 N 0.06 0.00 0.00 3.07 4.64 -1.89 -3.46 113.55 115.97 2bzg h SER 125 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2bzg h SER 125 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 2bzg h SER 125 CO -0.01 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2bzg n GLY 126 N -0.92 0.79 0.00 -0.77 0.00 -0.63 -4.92 105.19 98.74 2bzg n GLY 126 Ca -0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.07 2bzg n GLY 126 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2bzg n ASN 127 N 0.00 0.91 -3.81 1.61 5.03 -1.26 -4.93 115.26 112.81 2bzg n ASN 127 Ca 0.00 -0.62 -0.21 0.00 0.87 0.00 0.00 54.58 54.63 2bzg n ASN 127 Cb 0.00 1.20 -0.17 0.00 -1.02 0.00 0.00 39.78 39.79 2bzg n ASN 127 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2bzg s ILE 128 N -2.62 0.35 -0.11 2.41 1.01 -1.26 -0.50 121.20 120.49 2bzg s ILE 128 Ca 0.03 0.06 0.01 0.00 0.00 0.00 0.00 60.65 60.75 2bzg s ILE 128 Cb 0.11 -0.46 0.02 0.00 0.01 0.00 0.00 42.46 42.14 2bzg s ILE 128 CO 0.63 0.22 -0.14 -0.44 0.00 0.00 0.00 174.94 175.21 2bzg s SER 129 N 1.47 2.38 -0.26 3.58 0.01 -0.57 -0.40 113.70 119.91 2bzg s SER 129 Ca -0.03 -0.41 -0.03 0.00 1.31 0.00 0.00 55.95 56.80 2bzg s SER 129 Cb -0.13 -1.05 0.02 0.00 0.21 0.00 0.00 66.02 65.07 2bzg s SER 129 CO -0.03 -0.01 -0.03 -0.76 0.41 0.00 0.00 173.24 172.82 2bzg s LEU 130 N 1.12 3.32 -0.14 2.44 1.43 0.58 -1.24 118.68 126.19 2bzg s LEU 130 Ca -0.04 -0.84 -0.29 0.00 -1.03 0.00 0.00 54.13 51.93 2bzg s LEU 130 Cb -0.14 -1.70 -0.01 0.00 0.03 0.00 0.00 46.19 44.36 2bzg s LEU 130 CO -0.03 -0.14 0.99 -0.31 0.23 0.00 0.00 176.35 177.08 2bzg s TYR 131 N 1.36 3.47 -1.12 0.29 4.12 0.36 -0.60 117.35 125.23 2bzg s TYR 131 Ca 0.01 1.52 -0.08 0.00 0.02 0.00 0.00 57.07 58.53 2bzg s TYR 131 Cb -0.17 -3.18 0.28 0.00 -1.52 0.00 0.00 41.96 37.38 2bzg s TYR 131 CO -0.03 -0.28 1.17 0.00 0.02 0.00 0.00 175.55 176.43 2bzg s SER 134 N -2.17 6.98 0.50 0.00 0.15 -1.26 -3.41 113.70 114.49 2bzg s SER 134 Ca 0.09 1.71 0.20 0.00 0.70 0.00 0.00 55.95 58.64 2bzg s SER 134 Cb -0.03 -2.54 1.27 0.00 -1.71 0.00 0.00 66.02 63.00 2bzg s SER 134 CO 0.07 -0.33 2.04 -0.29 1.20 0.00 0.00 173.24 175.93 2bzg h ILE 135 N 1.98 0.86 0.00 6.45 6.09 -1.96 -1.49 117.51 129.43 2bzg h ILE 135 Ca -0.49 -0.03 0.00 0.00 -1.37 0.00 0.00 64.86 62.97 2bzg h ILE 135 Cb 1.18 0.75 0.00 0.00 0.47 0.00 0.00 36.82 39.22 2bzg h ILE 135 CO 0.61 0.02 0.00 0.49 -3.07 0.00 0.00 178.15 176.20 2bzg n PHE 136 N -4.45 0.00 0.21 2.19 3.72 -1.26 -2.11 117.46 115.76 2bzg n PHE 136 Ca 0.06 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.57 2bzg n PHE 136 Cb 0.39 -0.50 0.22 0.00 -0.94 0.00 0.00 39.48 38.65 2bzg n PHE 136 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2bzg h ASP 137 N 0.00 0.00 -0.31 4.37 3.32 -1.65 -3.40 116.42 118.75 2bzg h ASP 137 Ca 0.00 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 2bzg h ASP 137 Cb 0.39 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 2bzg h ASP 137 CO 0.00 0.09 0.04 -0.07 -1.72 0.00 0.00 179.24 177.59 2bzg h LEU 138 N 0.00 0.59 -2.65 1.55 3.38 -1.52 -2.36 115.31 114.30 2bzg h LEU 138 Ca -0.00 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2bzg h LEU 138 Cb 1.00 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.59 2bzg h LEU 138 CO 0.01 0.63 0.05 -0.65 0.09 0.00 0.00 178.44 178.57 2bzg h PRO 139 N 0.60 0.00 -0.07 1.13 0.11 -1.80 -0.71 132.00 131.27 2bzg h PRO 139 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 2bzg h PRO 139 Cb 0.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.43 2bzg h PRO 139 CO 0.01 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.34 2bzg n ARG 140 N -2.94 1.77 -3.38 1.05 1.74 -0.89 -4.93 116.66 109.09 2bzg n ARG 140 Ca -0.03 -1.14 -0.21 0.00 -0.77 0.00 0.00 57.85 55.71 2bzg n ARG 140 Cb 0.11 -1.46 0.01 0.00 -1.02 0.00 0.00 32.46 30.10 2bzg n ARG 140 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2bzg s THR 141 N -1.93 2.40 -0.61 0.55 -4.23 -0.27 -4.86 115.64 106.69 2bzg s THR 141 Ca 0.36 -1.21 -0.00 0.00 -1.18 0.00 0.00 61.69 59.65 2bzg s THR 141 Cb 0.20 -2.61 0.45 0.00 1.34 0.00 0.00 72.50 71.88 2bzg s THR 141 CO 0.31 0.00 1.89 0.59 -0.54 0.00 0.00 174.62 176.87 2bzg n ASN 142 N -1.83 7.23 0.26 3.99 5.03 -1.26 -4.68 115.26 124.00 2bzg n ASN 142 Ca 0.07 -3.78 0.12 0.00 0.87 0.00 0.00 54.58 51.85 2bzg n ASN 142 Cb 0.62 -0.87 0.78 0.00 -1.02 0.00 0.00 39.78 39.29 2bzg n ASN 142 CO 0.00 0.00 0.00 -0.29 -1.83 0.00 0.00 177.26 175.14 2bzg h ILE 143 N 1.24 0.74 0.00 2.41 2.10 -1.96 -3.48 117.51 118.56 2bzg h ILE 143 Ca 0.57 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.51 2bzg h ILE 143 Cb 0.91 0.98 0.00 0.00 -1.09 0.00 0.00 36.82 37.62 2bzg h ILE 143 CO 1.45 0.00 0.00 0.61 -1.08 0.00 0.00 178.15 179.13 2bzg n GLY 144 N -1.44 -0.88 3.58 8.18 0.00 -1.26 -4.96 105.19 108.41 2bzg n GLY 144 Ca -0.02 -1.29 -0.29 0.00 0.00 0.00 0.00 46.02 44.42 2bzg n GLY 144 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bzg s LYS 145 N 0.00 2.14 0.08 1.61 -0.14 -1.26 -4.65 119.74 117.52 2bzg s LYS 145 Ca 0.00 -1.07 0.06 0.00 -1.36 0.00 0.00 55.97 53.60 2bzg s LYS 145 Cb 0.00 -2.29 -0.03 0.00 -1.68 0.00 0.00 37.83 33.83 2bzg s LYS 145 CO 0.00 0.49 -0.16 -0.06 -0.76 0.00 0.00 175.35 174.86 2bzg s PHE 146 N -1.34 1.40 -1.47 3.18 0.08 0.13 -4.88 117.98 115.08 2bzg s PHE 146 Ca 0.22 -0.44 0.30 0.00 0.12 0.00 0.00 56.93 57.13 2bzg s PHE 146 Cb -0.11 -0.78 1.53 0.00 -0.57 0.00 0.00 43.02 43.10 2bzg s PHE 146 CO 0.14 0.10 2.05 -0.25 -0.10 0.00 0.00 175.22 177.17 2bzg n ASP 147 N 1.25 0.00 -3.67 1.36 8.00 -0.10 -1.90 116.55 121.49 2bzg n ASP 147 Ca -0.21 -0.20 -0.12 0.00 0.71 0.00 0.00 54.79 54.98 2bzg n ASP 147 Cb 0.54 -0.26 -0.08 0.00 -0.02 0.00 0.00 41.12 41.29 2bzg n ASP 147 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2bzg s ILE 149 N -2.53 -0.00 -0.26 0.53 1.01 -0.70 -1.49 121.20 117.76 2bzg s ILE 149 Ca 0.30 0.02 -0.05 0.00 0.00 0.00 0.00 60.65 60.91 2bzg s ILE 149 Cb 0.20 -0.83 0.00 0.00 0.01 0.00 0.00 42.46 41.84 2bzg s ILE 149 CO 0.45 0.01 0.03 0.86 0.00 0.00 0.00 174.94 176.28 2bzg s TRP 150 N 0.81 3.08 -0.33 3.97 -0.11 -0.31 -0.76 118.94 125.29 2bzg s TRP 150 Ca -0.04 -0.98 0.03 0.00 1.22 0.00 0.00 56.10 56.33 2bzg s TRP 150 Cb -0.05 -2.18 0.10 0.00 -1.50 0.00 0.00 33.47 29.83 2bzg s TRP 150 CO -0.06 -0.56 0.05 0.34 -4.62 0.00 0.00 176.95 172.10 2bzg s ASP 151 N 1.48 4.61 -0.07 5.86 -1.08 -0.24 -3.95 116.67 123.28 2bzg s ASP 151 Ca 0.04 -2.03 -0.04 0.00 -0.52 0.00 0.00 52.55 50.00 2bzg s ASP 151 Cb -0.16 -1.47 0.04 0.00 -1.46 0.00 0.00 42.92 39.86 2bzg s ASP 151 CO 0.00 -0.38 0.17 -0.60 0.52 0.00 0.00 175.17 174.88 2bzg s ARG 152 N 1.05 0.12 -1.49 4.34 3.00 -1.26 -0.87 118.95 123.84 2bzg s ARG 152 Ca 0.10 0.39 -0.00 0.00 -1.00 0.00 0.00 55.73 55.22 2bzg s ARG 152 Cb -0.19 -0.14 0.00 0.00 0.00 0.00 0.00 34.95 34.62 2bzg s ARG 152 CO -0.11 -0.15 0.04 0.41 0.00 0.00 0.00 175.30 175.48 2bzg n GLY 153 N 4.09 -0.50 0.69 8.12 0.00 -1.26 -4.87 105.19 111.46 2bzg n GLY 153 Ca -0.25 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2bzg n GLY 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bzg n ALA 154 N -2.20 2.63 -0.33 4.61 0.00 -1.26 -4.24 120.51 119.72 2bzg n ALA 154 Ca -0.20 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.38 2bzg n ALA 154 Cb 0.65 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.44 2bzg n ALA 154 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2bzg h LEU 155 N 0.00 0.63 -0.21 0.00 5.85 -1.89 0.14 115.31 119.83 2bzg h LEU 155 Ca 0.00 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.84 2bzg h LEU 155 Cb 0.00 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.06 2bzg h LEU 155 CO 0.00 0.15 0.00 1.33 -0.34 0.00 0.00 178.44 179.58 2bzg n VAL 156 N -4.88 0.62 0.02 1.05 0.24 -1.26 -3.30 118.33 110.82 2bzg n VAL 156 Ca 0.24 0.03 0.05 0.00 -2.04 0.00 0.00 64.34 62.62 2bzg n VAL 156 Cb 0.64 -0.81 -0.10 0.00 -1.47 0.00 0.00 33.84 32.10 2bzg n VAL 156 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2bzg n ALA 157 N -1.67 2.32 -1.78 2.33 0.00 0.42 0.52 120.51 122.65 2bzg n ALA 157 Ca 0.04 -0.54 -0.41 0.00 0.00 0.00 0.00 53.44 52.53 2bzg n ALA 157 Cb 0.30 -0.84 -0.01 0.00 0.00 0.00 0.00 19.45 18.90 2bzg n ALA 157 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2bzg s ILE 158 N -3.18 2.26 0.11 0.00 -1.09 -0.77 -4.91 121.20 113.63 2bzg s ILE 158 Ca -0.05 0.26 -0.36 0.00 -2.23 0.00 0.00 60.65 58.28 2bzg s ILE 158 Cb 0.10 -3.16 -0.16 0.00 -1.58 0.00 0.00 42.46 37.66 2bzg s ILE 158 CO 0.84 0.06 1.44 0.59 -1.23 0.00 0.00 174.94 176.64 2bzg n ASN 159 N 0.52 2.23 -0.32 3.58 3.02 -1.26 -4.86 115.26 118.16 2bzg n ASN 159 Ca 0.01 1.10 0.14 0.00 -0.03 0.00 0.00 54.58 55.80 2bzg n ASN 159 Cb 0.40 -1.28 0.33 0.00 -0.61 0.00 0.00 39.78 38.61 2bzg n ASN 159 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 2bzg h PRO 160 N 5.12 0.49 0.00 3.52 0.11 -1.84 0.14 132.00 139.55 2bzg h PRO 160 Ca -0.47 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 2bzg h PRO 160 Cb 1.30 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 2bzg h PRO 160 CO 0.82 0.32 -0.05 0.78 -0.21 0.00 0.00 178.00 179.67 2bzg h GLY 161 N 0.51 0.00 1.04 -0.55 0.00 -1.83 -2.60 103.07 99.64 2bzg h GLY 161 Ca 0.58 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.91 2bzg h GLY 161 CO -0.48 0.00 -0.10 1.22 0.00 0.00 0.00 176.54 177.17 2bzg n ASP 162 N -3.55 0.38 -0.31 0.19 8.00 0.49 -4.43 116.55 117.32 2bzg n ASP 162 Ca -0.02 -0.47 -0.04 0.00 0.71 0.00 0.00 54.79 54.96 2bzg n ASP 162 Cb 0.16 -0.11 0.09 0.00 -0.02 0.00 0.00 41.12 41.24 2bzg n ASP 162 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 2bzg h ARG 163 N 0.44 1.22 -0.23 -1.24 3.08 -1.47 0.92 114.38 117.10 2bzg h ARG 163 Ca 0.00 -0.17 -0.03 0.00 0.07 0.00 0.00 59.98 59.85 2bzg h ARG 163 Cb 0.35 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 2bzg h ARG 163 CO 0.00 0.93 0.02 -0.22 -1.07 0.00 0.00 179.97 179.64 2bzg h LYS 164 N 1.21 0.39 -0.65 0.04 3.64 -1.83 0.15 116.57 119.53 2bzg h LYS 164 Ca 0.29 -0.11 0.02 0.00 -1.27 0.00 0.00 60.65 59.59 2bzg h LYS 164 Cb 0.10 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.84 2bzg h LYS 164 CO -0.04 0.54 0.41 0.00 -2.27 0.00 0.00 179.45 178.09 2bzg h TYR 166 N 0.81 0.34 -0.27 0.00 3.20 -0.50 0.07 116.97 120.62 2bzg h TYR 166 Ca 0.25 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.14 2bzg h TYR 166 Cb -0.01 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 2bzg h TYR 166 CO -0.04 0.16 0.17 0.00 -1.64 0.00 0.00 178.16 176.81 2bzg h ALA 167 N 1.24 0.34 -0.68 1.82 0.00 -0.06 -2.21 119.26 119.71 2bzg h ALA 167 Ca 0.18 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2bzg h ALA 167 Cb 0.12 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2bzg h ALA 167 CO -0.15 -0.18 0.39 -0.44 0.00 0.00 0.00 179.25 178.87 2bzg h ASP 168 N 0.36 0.83 0.00 0.00 3.32 -0.71 -1.59 116.42 118.62 2bzg h ASP 168 Ca 0.10 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2bzg h ASP 168 Cb -0.02 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.32 2bzg h ASP 168 CO -0.02 0.66 0.00 0.41 -1.72 0.00 0.00 179.24 178.57 2bzg n THR 169 N -4.38 0.16 0.00 0.35 -1.04 -0.01 -1.75 114.28 107.60 2bzg n THR 169 Ca 0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 2bzg n THR 169 Cb 0.09 -0.47 0.00 0.00 -1.82 0.00 0.00 70.33 68.13 2bzg n THR 169 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 2bzg n PHE 171 N 0.75 0.00 0.30 -1.42 3.72 -0.60 -2.68 117.46 117.53 2bzg n PHE 171 Ca 0.00 0.00 0.17 0.00 -0.05 0.00 0.00 57.45 57.57 2bzg n PHE 171 Cb 0.09 0.00 0.68 0.00 -0.94 0.00 0.00 39.48 39.31 2bzg n PHE 171 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2bzg h SER 172 N 0.00 0.00 0.06 4.37 4.64 -1.62 -2.81 113.55 118.19 2bzg h SER 172 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2bzg h SER 172 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2bzg h SER 172 CO 0.00 0.00 -0.51 0.18 -0.87 0.00 0.00 176.83 175.63 2bzg n LEU 173 N -2.91 1.61 -4.82 5.97 4.77 -1.09 -4.87 117.00 115.66 2bzg n LEU 173 Ca 0.01 -0.59 -0.38 0.00 -0.03 0.00 0.00 56.01 55.02 2bzg n LEU 173 Cb 0.27 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 41.27 2bzg n LEU 173 CO 0.25 0.31 0.06 -0.76 -1.33 0.00 0.00 177.39 175.92 2bzg s LEU 174 N -2.58 4.43 1.13 2.23 1.43 -1.06 0.18 118.68 124.44 2bzg s LEU 174 Ca 0.18 0.84 -0.16 0.00 -1.03 0.00 0.00 54.13 53.97 2bzg s LEU 174 Cb 0.18 -2.50 0.25 0.00 0.03 0.00 0.00 46.19 44.15 2bzg s LEU 174 CO 0.61 0.29 1.08 -0.83 0.23 0.00 0.00 176.35 177.73 2bzg s GLY 175 N -0.80 1.55 0.28 -3.19 0.00 -0.80 -4.76 107.32 99.60 2bzg s GLY 175 Ca 0.22 -0.59 -0.03 0.00 0.00 0.00 0.00 44.72 44.33 2bzg s GLY 175 CO 0.11 0.17 1.93 0.50 0.00 0.00 0.00 173.10 175.81 2bzg h LYS 176 N -2.36 1.14 -5.92 2.90 6.56 -1.98 -3.39 116.57 113.52 2bzg h LYS 176 Ca -0.52 -0.07 -0.68 0.00 -1.06 0.00 0.00 60.65 58.32 2bzg h LYS 176 Cb 1.32 -0.26 -0.28 0.00 -0.57 0.00 0.00 32.23 32.45 2bzg h LYS 176 CO 0.47 0.76 -0.82 0.15 -2.06 0.00 0.00 179.45 177.95 2bzg s LYS 177 N -5.99 2.76 0.13 3.15 1.02 -1.26 -4.80 119.74 114.74 2bzg s LYS 177 Ca -0.12 -0.79 -0.20 0.00 0.02 0.00 0.00 55.97 54.88 2bzg s LYS 177 Cb 0.19 -2.35 0.05 0.00 -0.52 0.00 0.00 37.83 35.20 2bzg s LYS 177 CO 0.80 0.41 0.52 -0.59 -0.92 0.00 0.00 175.35 175.57 2bzg s PHE 178 N -0.19 -0.40 -0.21 3.18 -0.12 -1.26 -4.76 117.98 114.22 2bzg s PHE 178 Ca -0.01 0.19 0.01 0.00 -0.05 0.00 0.00 56.93 57.07 2bzg s PHE 178 Cb -0.13 0.42 0.04 0.00 -0.63 0.00 0.00 43.02 42.72 2bzg s PHE 178 CO 0.03 -0.76 -0.11 -0.65 -0.05 0.00 0.00 175.22 173.68 2bzg s GLN 179 N -3.57 2.13 -0.37 1.99 -0.21 -0.55 -3.99 119.66 115.09 2bzg s GLN 179 Ca 0.01 -0.92 -0.11 0.00 0.02 0.00 0.00 55.36 54.36 2bzg s GLN 179 Cb 0.00 -2.50 0.02 0.00 1.00 0.00 0.00 33.01 31.53 2bzg s GLN 179 CO -0.11 -0.43 0.20 -0.47 -2.12 0.00 0.00 175.29 172.36 2bzg s TYR 180 N 1.35 3.23 -0.23 0.91 6.04 0.83 -1.71 117.35 127.77 2bzg s TYR 180 Ca -0.02 -0.86 -0.14 0.00 0.04 0.00 0.00 57.07 56.09 2bzg s TYR 180 Cb -0.17 -2.43 -0.04 0.00 -1.04 0.00 0.00 41.96 38.28 2bzg s TYR 180 CO -0.08 -0.61 0.32 -0.51 -1.54 0.00 0.00 175.55 173.13 2bzg s LEU 181 N 1.57 4.11 -0.06 6.97 1.43 0.06 -0.27 118.68 132.49 2bzg s LEU 181 Ca 0.03 0.33 0.00 0.00 -1.03 0.00 0.00 54.13 53.46 2bzg s LEU 181 Cb -0.19 -2.36 0.02 0.00 0.03 0.00 0.00 46.19 43.69 2bzg s LEU 181 CO 0.07 -0.06 -0.05 -0.22 0.23 0.00 0.00 176.35 176.32 2bzg s LEU 182 N 1.43 1.16 -0.19 1.79 2.96 -0.42 -1.07 118.68 124.33 2bzg s LEU 182 Ca 0.14 -0.16 -0.06 0.00 -0.22 0.00 0.00 54.13 53.83 2bzg s LEU 182 Cb -0.15 -0.54 -0.03 0.00 0.50 0.00 0.00 46.19 45.97 2bzg s LEU 182 CO 0.08 -0.09 0.04 0.00 -1.32 0.00 0.00 176.35 175.05 2bzg s VAL 184 N 0.70 1.48 -0.06 0.00 -7.23 -0.57 -4.55 120.40 110.16 2bzg s VAL 184 Ca 0.02 -2.13 0.03 0.00 -1.81 0.00 0.00 61.98 58.08 2bzg s VAL 184 Cb -0.14 -2.14 -0.02 0.00 0.56 0.00 0.00 36.38 34.64 2bzg s VAL 184 CO 0.02 -0.52 -0.13 -0.76 -0.31 0.00 0.00 175.10 173.40 2bzg s LEU 185 N -3.31 2.81 -0.24 1.32 1.43 -1.26 -1.23 118.68 118.20 2bzg s LEU 185 Ca 0.24 -0.19 -0.02 0.00 -1.03 0.00 0.00 54.13 53.13 2bzg s LEU 185 Cb 0.02 -1.59 0.02 0.00 0.03 0.00 0.00 46.19 44.67 2bzg s LEU 185 CO 0.07 0.32 -0.06 -0.55 0.23 0.00 0.00 176.35 176.36 2bzg s SER 186 N -0.58 4.24 0.28 2.29 0.15 0.74 -4.16 113.70 116.66 2bzg s SER 186 Ca 0.08 -0.74 -0.17 0.00 0.70 0.00 0.00 55.95 55.82 2bzg s SER 186 Cb -0.11 -1.67 0.02 0.00 -1.71 0.00 0.00 66.02 62.54 2bzg s SER 186 CO 0.01 -0.10 0.64 -0.72 1.20 0.00 0.00 173.24 174.28 2bzg s TYR 187 N 1.36 0.06 -0.41 3.44 -0.85 -1.26 -1.78 117.35 117.91 2bzg s TYR 187 Ca 0.02 -0.50 -0.28 0.00 -0.52 0.00 0.00 57.07 55.79 2bzg s TYR 187 Cb -0.16 0.53 0.02 0.00 0.38 0.00 0.00 41.96 42.74 2bzg s TYR 187 CO -0.05 -1.19 1.06 0.34 -1.52 0.00 0.00 175.55 174.19 2bzg s ASP 188 N -2.98 6.71 0.00 -0.18 -1.08 -1.26 -4.90 116.67 112.99 2bzg s ASP 188 Ca 0.16 0.62 0.17 0.00 -0.52 0.00 0.00 52.55 52.97 2bzg s ASP 188 Cb -0.04 -2.52 0.80 0.00 -1.46 0.00 0.00 42.92 39.70 2bzg s ASP 188 CO 0.09 -1.06 1.52 -0.81 0.52 0.00 0.00 175.17 175.43 2bzg n PRO 189 N 7.30 0.14 0.01 4.34 -0.04 -1.26 -1.75 135.00 143.74 2bzg n PRO 189 Ca 0.10 0.16 0.13 0.00 -0.04 0.00 0.00 63.50 63.86 2bzg n PRO 189 Cb 0.48 -1.50 0.45 0.00 -0.04 0.00 0.00 33.50 32.89 2bzg n PRO 189 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2bzg n THR 190 N -1.38 0.05 -0.03 0.52 -2.24 -1.26 -3.94 114.28 106.00 2bzg n THR 190 Ca 0.06 -0.03 -0.01 0.00 -2.27 0.00 0.00 64.05 61.80 2bzg n THR 190 Cb 0.16 -0.21 -0.14 0.00 -2.10 0.00 0.00 70.33 68.04 2bzg n THR 190 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2bzg n LYS 191 N -1.58 0.66 -3.76 -0.78 4.76 -0.72 -4.90 118.16 111.85 2bzg n LYS 191 Ca 0.06 0.01 -0.15 0.00 -2.87 0.00 0.00 58.31 55.36 2bzg n LYS 191 Cb 0.35 -1.61 -0.16 0.00 -1.84 0.00 0.00 35.03 31.77 2bzg n LYS 191 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 2bzg s HIS 192 N -2.92 0.00 -1.84 2.13 2.46 -1.25 -4.58 115.29 109.31 2bzg s HIS 192 Ca -0.07 0.19 0.31 0.00 0.47 0.00 0.00 55.06 55.96 2bzg s HIS 192 Cb 0.09 -0.24 1.71 0.00 -0.13 0.00 0.00 32.58 34.01 2bzg s HIS 192 CO 0.85 -0.11 2.13 -0.35 -2.47 0.00 0.00 174.74 174.79 2bzg n PRO 193 N 4.31 0.85 0.00 2.88 -0.04 -1.26 -4.69 135.00 137.05 2bzg n PRO 193 Ca -0.25 -0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.15 2bzg n PRO 193 Cb 0.50 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 2bzg n PRO 193 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2bzg n GLY 194 N 1.11 -1.50 3.87 0.55 0.00 -1.26 -4.89 105.19 103.07 2bzg n GLY 194 Ca 0.20 -1.56 -0.30 0.00 0.00 0.00 0.00 46.02 44.36 2bzg n GLY 194 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bzg s PRO 195 N -1.87 2.97 0.58 1.61 0.04 -1.26 -4.96 135.00 132.10 2bzg s PRO 195 Ca 0.00 0.59 -0.18 0.00 0.04 0.00 0.00 61.00 61.45 2bzg s PRO 195 Cb 0.00 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.48 2bzg s PRO 195 CO 0.00 -0.99 1.12 -1.25 0.04 0.00 0.00 177.00 175.93 2bzg s PRO 196 N -5.27 3.18 0.50 0.56 0.04 -1.26 -5.14 135.00 127.61 2bzg s PRO 196 Ca 0.58 1.55 -0.05 0.00 0.04 0.00 0.00 61.00 63.11 2bzg s PRO 196 Cb -0.12 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.41 2bzg s PRO 196 CO 0.53 -0.98 0.81 -0.06 0.04 0.00 0.00 177.00 177.34 2bzg s PHE 197 N -1.94 3.47 -0.30 0.56 0.08 0.18 -4.98 117.98 115.06 2bzg s PHE 197 Ca 0.71 0.74 -0.20 0.00 0.12 0.00 0.00 56.93 58.30 2bzg s PHE 197 Cb -0.23 -2.40 -0.01 0.00 -0.57 0.00 0.00 43.02 39.81 2bzg s PHE 197 CO 0.31 -0.41 0.64 -0.47 -0.10 0.00 0.00 175.22 175.20 2bzg s TYR 198 N -2.79 3.22 -0.50 0.36 5.04 -1.26 -4.72 117.35 116.70 2bzg s TYR 198 Ca 0.49 0.63 0.00 0.00 -2.44 0.00 0.00 57.07 55.75 2bzg s TYR 198 Cb -0.10 -2.98 0.13 0.00 0.35 0.00 0.00 41.96 39.35 2bzg s TYR 198 CO 0.45 -0.46 0.27 0.08 -1.34 0.00 0.00 175.55 174.55 2bzg s VAL 199 N 2.62 3.03 0.73 3.14 1.01 -1.26 -5.06 120.40 124.61 2bzg s VAL 199 Ca 0.26 -2.80 -0.11 0.00 0.00 0.00 0.00 61.98 59.33 2bzg s VAL 199 Cb -0.15 -3.07 0.03 0.00 0.00 0.00 0.00 36.38 33.19 2bzg s VAL 199 CO 0.11 -0.77 1.09 -2.16 0.00 0.00 0.00 175.10 173.38 2bzg s PRO 200 N 0.26 2.69 0.25 2.72 0.04 -1.26 -4.72 135.00 134.98 2bzg s PRO 200 Ca 0.14 0.53 -0.03 0.00 0.04 0.00 0.00 61.00 61.68 2bzg s PRO 200 Cb -0.22 -2.00 0.50 0.00 0.04 0.00 0.00 34.50 32.82 2bzg s PRO 200 CO -0.03 -1.17 1.71 1.25 0.04 0.00 0.00 177.00 178.80 2bzg h HIS 201 N -0.76 0.47 -0.68 0.56 -0.00 -1.99 0.41 115.15 113.16 2bzg h HIS 201 Ca -0.45 0.04 0.10 0.00 -0.00 0.00 0.00 60.37 60.06 2bzg h HIS 201 Cb 1.25 -0.09 -0.04 0.00 -0.00 0.00 0.00 27.41 28.53 2bzg h HIS 201 CO 0.50 0.01 0.45 0.00 -0.00 0.00 0.00 177.93 178.89 2bzg h ALA 202 N 1.59 1.95 -0.31 5.26 0.00 -1.99 -0.25 119.26 125.51 2bzg h ALA 202 Ca 0.43 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.19 2bzg h ALA 202 Cb 0.71 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 2bzg h ALA 202 CO -0.45 -0.10 -0.37 1.49 0.00 0.00 0.00 179.25 179.82 2bzg h GLU 203 N 0.51 0.80 -0.50 0.00 4.57 -1.28 -0.26 114.58 118.41 2bzg h GLU 203 Ca 0.32 -0.44 0.05 0.00 -1.18 0.00 0.00 59.36 58.10 2bzg h GLU 203 Cb 0.55 0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 29.12 2bzg h GLU 203 CO -0.10 1.07 0.25 0.82 -1.18 0.00 0.00 179.01 179.87 2bzg h ILE 204 N 0.57 0.94 -0.63 2.32 2.04 -0.89 -1.27 117.51 120.59 2bzg h ILE 204 Ca 0.04 -0.16 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 2bzg h ILE 204 Cb 0.95 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 2bzg h ILE 204 CO 0.09 0.09 0.34 -0.33 0.00 0.00 0.00 178.15 178.34 2bzg h GLU 205 N 0.48 0.88 -0.24 2.37 5.08 -0.89 0.28 114.58 122.55 2bzg h GLU 205 Ca 0.22 -0.11 0.04 0.00 -1.00 0.00 0.00 59.36 58.51 2bzg h GLU 205 Cb 0.15 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 2bzg h GLU 205 CO -0.17 0.67 0.02 -0.09 -1.00 0.00 0.00 179.01 178.45 2bzg h ARG 206 N 0.86 0.10 0.10 2.33 2.43 -0.74 -0.27 114.38 119.19 2bzg h ARG 206 Ca 0.22 -0.01 -0.27 0.00 -0.81 0.00 0.00 59.98 59.11 2bzg h ARG 206 Cb 0.05 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 29.59 2bzg h ARG 206 CO -0.03 0.06 -1.18 -0.07 -1.51 0.00 0.00 179.97 177.24 2bzg h LEU 207 N 0.10 0.57 0.00 3.80 3.38 -1.07 -3.41 115.31 118.68 2bzg h LEU 207 Ca 0.11 -0.55 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2bzg h LEU 207 Cb 0.13 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2bzg h LEU 207 CO -0.17 1.39 -0.49 0.49 0.09 0.00 0.00 178.44 179.75 2bzg n PHE 208 N -3.65 0.00 0.14 1.13 3.72 0.07 -4.83 117.46 114.04 2bzg n PHE 208 Ca -0.10 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.34 2bzg n PHE 208 Cb 0.97 0.00 0.45 0.00 -0.94 0.00 0.00 39.48 39.97 2bzg n PHE 208 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 2bzg h GLY 209 N 0.00 0.23 1.73 1.37 0.00 -1.09 0.57 103.07 105.88 2bzg h GLY 209 Ca 0.00 -0.12 -0.10 0.00 0.00 0.00 0.00 47.33 47.11 2bzg h GLY 209 CO 0.00 0.11 -0.36 0.50 0.00 0.00 0.00 176.54 176.79 2bzg h LYS 210 N 0.21 0.30 0.00 4.80 1.57 -1.87 -3.31 116.57 118.27 2bzg h LYS 210 Ca 0.05 -0.13 -0.21 0.00 -1.87 0.00 0.00 60.65 58.48 2bzg h LYS 210 Cb 0.23 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.49 2bzg h LYS 210 CO 0.01 0.63 -2.13 -0.89 -0.57 0.00 0.00 179.45 176.50 2bzg n ILE 211 N -4.06 0.81 -4.79 1.86 5.41 -1.05 -4.99 119.36 112.55 2bzg n ILE 211 Ca -0.01 -0.66 -0.31 0.00 1.00 0.00 0.00 62.75 62.76 2bzg n ILE 211 Cb 0.45 -0.31 -0.13 0.00 -0.71 0.00 0.00 39.64 38.94 2bzg n ILE 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2bzg s ASN 213 N -1.15 7.08 -0.22 0.00 3.84 0.40 -4.55 114.94 120.34 2bzg s ASN 213 Ca 0.13 2.07 -0.03 0.00 0.21 0.00 0.00 52.86 55.24 2bzg s ASN 213 Cb -0.10 -2.59 -0.01 0.00 -0.55 0.00 0.00 41.25 38.01 2bzg s ASN 213 CO 0.03 -0.45 -0.06 -0.63 -2.79 0.00 0.00 177.10 173.21 2bzg s ILE 214 N 0.80 3.24 -0.10 -5.21 1.01 -1.26 -2.11 121.20 117.57 2bzg s ILE 214 Ca 0.57 -0.54 0.04 0.00 0.00 0.00 0.00 60.65 60.72 2bzg s ILE 214 Cb -0.30 -2.47 0.00 0.00 0.01 0.00 0.00 42.46 39.70 2bzg s ILE 214 CO 0.31 0.43 -0.22 -0.13 0.00 0.00 0.00 174.94 175.33 2bzg s ARG 215 N 1.46 2.84 -0.46 2.79 0.52 -0.63 -5.01 118.95 120.46 2bzg s ARG 215 Ca 0.06 -0.81 -0.15 0.00 -0.52 0.00 0.00 55.73 54.31 2bzg s ARG 215 Cb -0.14 -2.17 0.06 0.00 0.52 0.00 0.00 34.95 33.22 2bzg s ARG 215 CO -0.04 0.14 0.37 0.00 0.02 0.00 0.00 175.30 175.79 2bzg h LEU 217 N 8.71 0.00 -7.56 0.00 3.38 -0.89 -3.47 115.31 115.48 2bzg h LEU 217 Ca -0.28 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.55 2bzg h LEU 217 Cb 1.11 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.64 2bzg h LEU 217 CO 0.85 0.91 -0.38 -1.61 0.09 0.00 0.00 178.44 178.29 2bzg s GLU 218 N -2.73 0.49 -0.12 1.13 0.41 -1.15 -4.98 118.70 111.76 2bzg s GLU 218 Ca -0.00 -0.06 -0.04 0.00 -0.41 0.00 0.00 54.97 54.46 2bzg s GLU 218 Cb 0.09 0.22 0.05 0.00 -1.78 0.00 0.00 34.13 32.71 2bzg s GLU 218 CO 0.81 -0.11 0.12 0.21 -0.49 0.00 0.00 175.26 175.79 2bzg s LYS 219 N -0.85 0.03 0.06 1.61 2.20 -1.26 -1.65 119.74 119.88 2bzg s LYS 219 Ca -0.09 0.26 0.03 0.00 -0.36 0.00 0.00 55.97 55.80 2bzg s LYS 219 Cb -0.05 -0.97 -0.03 0.00 -1.51 0.00 0.00 37.83 35.28 2bzg s LYS 219 CO 0.02 -0.48 -0.09 0.14 -0.36 0.00 0.00 175.35 174.58 2bzg s VAL 220 N 2.21 0.73 0.06 4.02 -7.23 0.04 -4.95 120.40 115.28 2bzg s VAL 220 Ca 0.04 -1.25 -0.31 0.00 -1.81 0.00 0.00 61.98 58.65 2bzg s VAL 220 Cb -0.14 -0.87 -0.08 0.00 0.56 0.00 0.00 36.38 35.85 2bzg s VAL 220 CO -0.07 -0.40 1.68 -0.62 -0.31 0.00 0.00 175.10 175.38 2bzg s ASP 221 N -1.82 6.59 0.00 4.85 2.15 -1.26 -0.47 116.67 126.72 2bzg s ASP 221 Ca -0.05 2.48 0.04 0.00 0.43 0.00 0.00 52.55 55.46 2bzg s ASP 221 Cb -0.08 -2.56 0.07 0.00 -0.30 0.00 0.00 42.92 40.05 2bzg s ASP 221 CO 0.00 -0.90 0.83 0.00 -0.17 0.00 0.00 175.17 174.93 2bzg n ALA 222 N 5.86 2.32 -2.18 3.66 0.00 0.29 -4.83 120.51 125.62 2bzg n ALA 222 Ca 0.16 -0.75 -0.42 0.00 0.00 0.00 0.00 53.44 52.43 2bzg n ALA 222 Cb 0.41 -0.16 -0.03 0.00 0.00 0.00 0.00 19.45 19.67 2bzg n ALA 222 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2bzg s PHE 223 N -0.63 2.61 0.34 0.00 5.36 -1.08 -4.94 117.98 119.64 2bzg s PHE 223 Ca 0.07 0.67 0.08 0.00 -0.96 0.00 0.00 56.93 56.78 2bzg s PHE 223 Cb 0.04 -3.72 -0.07 0.00 -0.34 0.00 0.00 43.02 38.94 2bzg s PHE 223 CO 0.06 -2.75 -0.05 -1.21 -1.46 0.00 0.00 175.22 169.80 2bzg s GLU 224 N 2.98 1.78 0.26 10.12 2.02 -1.26 -5.02 118.70 129.58 2bzg s GLU 224 Ca 0.65 -1.95 -0.02 0.00 0.02 0.00 0.00 54.97 53.68 2bzg s GLU 224 Cb -0.31 -1.51 0.50 0.00 0.10 0.00 0.00 34.13 32.91 2bzg s GLU 224 CO 0.26 0.05 1.77 1.49 0.02 0.00 0.00 175.26 178.84 2bzg h GLU 225 N 2.02 0.61 -0.15 1.61 4.57 -2.04 -0.19 114.58 121.00 2bzg h GLU 225 Ca -0.42 -0.04 0.04 0.00 -1.18 0.00 0.00 59.36 57.77 2bzg h GLU 225 Cb 1.24 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 29.69 2bzg h GLU 225 CO 0.72 0.40 0.28 0.07 -1.18 0.00 0.00 179.01 179.30 2bzg h ARG 226 N 0.62 0.00 0.00 1.92 0.11 -2.00 -2.35 114.38 112.68 2bzg h ARG 226 Ca 0.44 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.52 2bzg h ARG 226 Cb 0.60 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.68 2bzg h ARG 226 CO -0.35 0.00 0.00 0.45 0.10 0.00 0.00 179.97 180.17 2bzg h HIS 227 N 0.00 0.00 -0.65 4.08 3.86 -1.41 -2.79 115.15 118.24 2bzg h HIS 227 Ca 0.07 0.00 0.18 0.00 -1.16 0.00 0.00 60.37 59.46 2bzg h HIS 227 Cb 0.63 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.07 2bzg h HIS 227 CO 0.00 0.00 0.46 0.87 0.86 0.00 0.00 177.93 180.12 2bzg h LYS 228 N 0.00 0.07 0.00 2.45 1.57 -1.56 -1.28 116.57 117.82 2bzg h LYS 228 Ca 0.00 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2bzg h LYS 228 Cb 0.70 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.99 2bzg h LYS 228 CO 0.00 0.04 0.00 -1.13 -0.57 0.00 0.00 179.45 177.79 2bzg n SER 229 N -4.37 0.46 -0.14 0.86 3.41 -1.05 -1.85 113.62 110.93 2bzg n SER 229 Ca 0.12 0.63 0.13 0.00 -0.26 0.00 0.00 58.87 59.49 2bzg n SER 229 Cb 0.67 -0.72 0.32 0.00 -0.26 0.00 0.00 64.21 64.23 2bzg n SER 229 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2bzg n TRP 230 N -2.02 0.00 -1.06 7.33 8.01 -0.48 -4.96 117.44 124.27 2bzg n TRP 230 Ca 0.02 0.00 -0.02 0.00 -1.31 0.00 0.00 57.50 56.19 2bzg n TRP 230 Cb 0.19 -0.17 -0.01 0.00 -2.01 0.00 0.00 31.31 29.30 2bzg n TRP 230 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2bzg n GLY 231 N 1.41 0.55 3.84 6.99 0.00 -0.77 -4.10 105.19 113.10 2bzg n GLY 231 Ca 0.09 -0.61 -0.22 0.00 0.00 0.00 0.00 46.02 45.29 2bzg n GLY 231 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2bzg s ILE 232 N -2.02 4.18 0.00 -0.61 -4.36 -1.26 -4.83 121.20 112.30 2bzg s ILE 232 Ca 0.00 -1.38 0.00 0.00 -0.26 0.00 0.00 60.65 59.01 2bzg s ILE 232 Cb 0.00 -3.34 0.00 0.00 1.25 0.00 0.00 42.46 40.37 2bzg s ILE 232 CO 0.00 -0.29 0.28 -0.90 0.24 0.00 0.00 174.94 174.27 2bzg n ASP 233 N -1.25 0.56 -3.95 4.36 5.68 -1.26 -4.40 116.55 116.29 2bzg n ASP 233 Ca -0.06 -0.98 -0.13 0.00 -0.50 0.00 0.00 54.79 53.12 2bzg n ASP 233 Cb 0.58 0.02 -0.13 0.00 -1.14 0.00 0.00 41.12 40.45 2bzg n ASP 233 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2bzg s LEU 235 N -0.57 -0.01 0.11 0.00 2.96 -1.26 -4.69 118.68 115.21 2bzg s LEU 235 Ca -0.04 0.79 0.10 0.00 -0.22 0.00 0.00 54.13 54.76 2bzg s LEU 235 Cb -0.04 1.16 -0.04 0.00 0.50 0.00 0.00 46.19 47.77 2bzg s LEU 235 CO -0.00 -0.19 -0.25 -0.36 -1.32 0.00 0.00 176.35 174.22 2bzg s PHE 236 N 1.50 2.17 -0.04 5.38 0.08 -0.73 -0.55 117.98 125.79 2bzg s PHE 236 Ca -0.08 -0.39 0.05 0.00 0.12 0.00 0.00 56.93 56.62 2bzg s PHE 236 Cb -0.09 -1.21 -0.02 0.00 -0.57 0.00 0.00 43.02 41.13 2bzg s PHE 236 CO -0.11 0.26 -0.18 -2.00 -0.10 0.00 0.00 175.22 173.08 2bzg s GLU 237 N -1.84 2.42 -0.03 0.44 2.12 0.38 -0.19 118.70 122.01 2bzg s GLU 237 Ca 0.12 -0.78 0.07 0.00 0.36 0.00 0.00 54.97 54.74 2bzg s GLU 237 Cb -0.10 -2.27 -0.02 0.00 0.26 0.00 0.00 34.13 32.00 2bzg s GLU 237 CO 0.05 0.57 -0.26 0.15 -0.54 0.00 0.00 175.26 175.24 2bzg s LYS 238 N -0.62 2.23 -0.22 4.30 1.02 -0.36 -0.78 119.74 125.32 2bzg s LYS 238 Ca 0.09 -0.92 -0.04 0.00 0.02 0.00 0.00 55.97 55.12 2bzg s LYS 238 Cb -0.11 -2.08 -0.01 0.00 -0.52 0.00 0.00 37.83 35.11 2bzg s LYS 238 CO 0.00 0.52 -0.03 -1.17 -0.92 0.00 0.00 175.35 173.75 2bzg s LEU 239 N -0.50 2.99 0.07 3.17 2.96 -0.66 -1.51 118.68 125.19 2bzg s LEU 239 Ca 0.07 -0.35 0.04 0.00 -0.22 0.00 0.00 54.13 53.67 2bzg s LEU 239 Cb -0.11 -1.76 -0.04 0.00 0.50 0.00 0.00 46.19 44.78 2bzg s LEU 239 CO 0.00 -0.00 -0.03 -0.31 -1.32 0.00 0.00 176.35 174.69 2bzg s TYR 240 N 1.38 2.94 -0.21 5.38 2.02 0.66 -0.14 117.35 129.40 2bzg s TYR 240 Ca 0.05 -0.03 0.01 0.00 -0.37 0.00 0.00 57.07 56.72 2bzg s TYR 240 Cb -0.14 -1.55 0.03 0.00 -0.40 0.00 0.00 41.96 39.89 2bzg s TYR 240 CO -0.02 0.45 -0.16 -1.17 -1.57 0.00 0.00 175.55 173.09 2bzg s LEU 241 N -2.04 2.56 -0.16 -1.29 2.96 0.34 -1.30 118.68 119.76 2bzg s LEU 241 Ca 0.23 -0.81 -0.03 0.00 -0.22 0.00 0.00 54.13 53.30 2bzg s LEU 241 Cb -0.11 -1.53 -0.02 0.00 0.50 0.00 0.00 46.19 45.02 2bzg s LEU 241 CO 0.15 -0.05 -0.05 -0.76 -1.32 0.00 0.00 176.35 174.31 2bzg s LEU 242 N 1.27 3.15 0.21 -0.68 1.43 0.63 -1.61 118.68 123.07 2bzg s LEU 242 Ca 0.02 -0.18 0.01 0.00 -1.03 0.00 0.00 54.13 52.95 2bzg s LEU 242 Cb -0.15 -1.75 -0.05 0.00 0.03 0.00 0.00 46.19 44.27 2bzg s LEU 242 CO -0.10 0.16 0.07 0.42 0.23 0.00 0.00 176.35 177.12 2bzg s THR 243 N 0.44 0.48 0.42 5.49 -4.23 -0.90 -0.12 115.64 117.22 2bzg s THR 243 Ca -0.05 -1.99 -0.27 0.00 -1.18 0.00 0.00 61.69 58.21 2bzg s THR 243 Cb -0.14 -2.40 -0.10 0.00 1.34 0.00 0.00 72.50 71.20 2bzg s THR 243 CO 0.03 -0.19 1.47 -1.83 -0.54 0.00 0.00 174.62 173.56 2bzg s GLU 244 N -4.02 3.87 0.00 3.99 1.03 -1.26 -0.45 118.70 121.87 2bzg s GLU 244 Ca 0.32 2.52 0.00 0.00 0.03 0.00 0.00 54.97 57.84 2bzg s GLU 244 Cb 0.07 -2.80 0.00 0.00 -0.80 0.00 0.00 34.13 30.60 2bzg s GLU 244 CO 0.09 -0.70 0.25 1.63 -1.33 0.00 0.00 175.26 175.20