#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kbx n ASP 2 N 0.00 -2.94 0.00 7.83 5.68 -1.26 -4.98 116.55 120.89 2kbx n ASP 2 Ca 0.00 -3.03 0.00 0.00 -0.50 0.00 0.00 54.79 51.26 2kbx n ASP 2 Cb 0.00 1.57 0.00 0.00 -1.14 0.00 0.00 41.12 41.55 2kbx n ASP 2 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2kbx n ASP 3 N 2.37 0.00 0.43 -1.12 5.75 -1.26 -2.27 116.55 120.45 2kbx n ASP 3 Ca 0.15 0.00 -0.17 0.00 -0.01 0.00 0.00 54.79 54.76 2kbx n ASP 3 Cb 0.58 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.59 2kbx n ASP 3 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 2kbx h ILE 4 N 0.00 0.00 -0.98 2.12 1.08 -1.99 -0.99 117.51 116.75 2kbx h ILE 4 Ca 0.00 -0.02 0.40 0.00 -0.39 0.00 0.00 64.86 64.85 2kbx h ILE 4 Cb 0.00 0.00 -0.18 0.00 -3.07 0.00 0.00 36.82 33.57 2kbx h ILE 4 CO 0.00 0.00 0.50 0.49 -0.69 0.00 0.00 178.15 178.45 2kbx n PHE 5 N -5.02 1.11 0.03 1.37 3.72 -0.96 0.11 117.46 117.81 2kbx n PHE 5 Ca -0.14 1.15 -0.02 0.00 -0.05 0.00 0.00 57.45 58.39 2kbx n PHE 5 Cb 0.43 -1.54 -0.01 0.00 -0.94 0.00 0.00 39.48 37.43 2kbx n PHE 5 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 2kbx h THR 6 N 0.00 0.00 0.00 4.37 2.02 -1.36 -3.01 112.91 114.93 2kbx h THR 6 Ca 0.82 -0.71 0.00 0.00 0.77 0.00 0.00 66.41 67.29 2kbx h THR 6 Cb 2.14 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.55 2kbx h THR 6 CO -0.76 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.13 2kbx n GLN 7 N -4.39 0.00 -0.12 6.66 1.13 -0.22 -2.37 117.38 118.07 2kbx n GLN 7 Ca -0.02 0.01 -0.21 0.00 -1.94 0.00 0.00 57.00 54.83 2kbx n GLN 7 Cb 0.06 -1.50 -0.08 0.00 0.11 0.00 0.00 30.24 28.83 2kbx n GLN 7 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2kbx n ARG 9 N -4.36 0.00 0.00 0.00 -4.01 -1.00 -1.84 116.66 105.45 2kbx n ARG 9 Ca -0.37 0.29 0.02 0.00 -1.04 0.00 0.00 57.85 56.75 2kbx n ARG 9 Cb 0.71 -1.52 0.10 0.00 -3.04 0.00 0.00 32.46 28.71 2kbx n ARG 9 CO 0.00 0.00 0.00 0.39 -3.04 0.00 0.00 177.63 174.98 2kbx n GLU 10 N -1.28 0.23 -0.31 2.89 1.02 -1.22 -4.65 120.64 117.32 2kbx n GLU 10 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2kbx n GLU 10 Cb 0.02 -1.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.21 2kbx n GLU 10 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2kbx n GLY 11 N -0.39 0.74 2.51 0.62 0.00 -0.77 -4.91 105.19 103.00 2kbx n GLY 11 Ca 0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 2kbx n GLY 11 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2kbx n ASN 12 N 0.00 4.80 0.20 1.61 3.02 -1.07 -4.56 115.26 119.27 2kbx n ASN 12 Ca 0.00 -2.29 0.08 0.00 -0.03 0.00 0.00 54.58 52.35 2kbx n ASN 12 Cb 0.00 -1.07 0.20 0.00 -0.61 0.00 0.00 39.78 38.30 2kbx n ASN 12 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kbx h ALA 13 N 5.83 2.16 0.10 5.41 0.00 -1.91 2.96 119.26 133.81 2kbx h ALA 13 Ca 0.44 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 55.08 2kbx h ALA 13 Cb 0.31 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2kbx h ALA 13 CO 1.25 -1.10 -1.18 -0.39 0.00 0.00 0.00 179.25 177.82 2kbx h VAL 14 N 0.00 1.50 -0.26 0.00 -1.51 -1.94 -2.96 116.25 111.09 2kbx h VAL 14 Ca 0.12 -3.01 -0.16 0.00 -1.23 0.00 0.00 66.70 62.42 2kbx h VAL 14 Cb 2.06 2.87 -0.01 0.00 -2.13 0.00 0.00 31.29 34.08 2kbx h VAL 14 CO -0.00 0.88 -0.48 0.00 -1.23 0.00 0.00 177.57 176.74 2kbx h ALA 15 N 0.64 0.66 -0.24 5.19 0.00 0.50 -0.25 119.26 125.75 2kbx h ALA 15 Ca -0.12 -0.48 -0.10 0.00 0.00 0.00 0.00 54.91 54.21 2kbx h ALA 15 Cb 1.90 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.59 2kbx h ALA 15 CO 0.19 0.68 -0.23 -0.24 0.00 0.00 0.00 179.25 179.65 2kbx h VAL 16 N 0.56 1.31 -0.53 0.00 3.04 -1.55 -2.95 116.25 116.14 2kbx h VAL 16 Ca 0.03 -1.38 -0.01 0.00 -1.01 0.00 0.00 66.70 64.32 2kbx h VAL 16 Cb 1.04 1.66 -0.02 0.00 -2.01 0.00 0.00 31.29 31.95 2kbx h VAL 16 CO 0.10 0.43 0.28 -0.09 -1.01 0.00 0.00 177.57 177.28 2kbx h ARG 17 N 0.29 0.75 -0.46 4.17 1.12 -1.47 -1.92 114.38 116.87 2kbx h ARG 17 Ca 0.04 -0.10 0.05 0.00 -1.11 0.00 0.00 59.98 58.86 2kbx h ARG 17 Cb 0.78 -0.14 -0.07 0.00 -0.01 0.00 0.00 29.97 30.53 2kbx h ARG 17 CO 0.06 0.60 -0.40 1.25 -3.11 0.00 0.00 179.97 178.36 2kbx h LEU 18 N 0.71 -1.41 -1.52 3.80 5.85 -0.87 0.39 115.31 122.26 2kbx h LEU 18 Ca 0.19 0.20 -0.02 0.00 0.84 0.00 0.00 57.88 59.08 2kbx h LEU 18 Cb 0.08 0.60 -0.00 0.00 0.37 0.00 0.00 40.66 41.70 2kbx h LEU 18 CO -0.03 -0.23 -0.09 4.11 -0.34 0.00 0.00 178.44 181.86 2kbx h TRP 19 N -0.16 0.00 -0.54 1.25 5.08 -1.45 -2.34 115.95 117.78 2kbx h TRP 19 Ca 0.08 0.00 -0.07 0.00 1.08 0.00 0.00 58.89 59.98 2kbx h TRP 19 Cb 0.37 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.50 2kbx h TRP 19 CO -0.82 0.09 0.07 1.25 -1.28 0.00 0.00 178.44 177.75 2kbx h LEU 20 N 0.00 0.83 -3.11 0.11 6.46 0.48 -2.37 115.31 117.71 2kbx h LEU 20 Ca -0.00 -0.18 -0.08 0.00 -0.12 0.00 0.00 57.88 57.49 2kbx h LEU 20 Cb 0.53 -0.22 -0.04 0.00 -0.73 0.00 0.00 40.66 40.20 2kbx h LEU 20 CO 0.01 0.86 0.11 -0.90 -0.62 0.00 0.00 178.44 177.89 2kbx n ASP 21 N -4.23 5.60 -4.72 1.25 5.68 0.34 -4.89 116.55 115.57 2kbx n ASP 21 Ca 0.03 -2.57 -0.41 0.00 -0.50 0.00 0.00 54.79 51.34 2kbx n ASP 21 Cb 0.27 -1.10 -0.04 0.00 -1.14 0.00 0.00 41.12 39.11 2kbx n ASP 21 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2kbx s ASN 22 N 1.53 7.32 0.00 -1.12 2.20 -0.90 -4.91 114.94 119.06 2kbx s ASN 22 Ca 0.08 1.59 0.29 0.00 -0.94 0.00 0.00 52.86 53.87 2kbx s ASN 22 Cb 0.06 -2.54 1.47 0.00 -2.00 0.00 0.00 41.25 38.24 2kbx s ASN 22 CO -0.00 -0.18 1.97 0.35 -2.94 0.00 0.00 177.10 176.30 2kbx n THR 23 N 3.60 0.01 -0.06 0.54 -2.24 -1.26 -3.48 114.28 111.39 2kbx n THR 23 Ca 0.04 -0.11 -0.06 0.00 -2.27 0.00 0.00 64.05 61.65 2kbx n THR 23 Cb 0.51 -0.08 -0.10 0.00 -2.10 0.00 0.00 70.33 68.55 2kbx n THR 23 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2kbx n GLU 24 N -0.50 1.88 -2.99 -0.78 4.71 -1.26 -5.07 120.64 116.64 2kbx n GLU 24 Ca 0.21 -0.01 -0.14 0.00 -0.01 0.00 0.00 57.16 57.21 2kbx n GLU 24 Cb 0.20 -1.32 0.02 0.00 -1.01 0.00 0.00 31.44 29.33 2kbx n GLU 24 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2kbx n ASN 25 N -2.44 -7.42 0.00 1.62 5.03 -1.23 -4.95 115.26 105.87 2kbx n ASN 25 Ca -0.19 0.47 0.00 0.00 0.87 0.00 0.00 54.58 55.73 2kbx n ASN 25 Cb 0.88 -4.51 0.00 0.00 -1.02 0.00 0.00 39.78 35.13 2kbx n ASN 25 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 2kbx n ASP 26 N -0.14 0.00 0.04 6.41 2.03 -1.26 -4.77 116.55 118.86 2kbx n ASP 26 Ca 0.06 0.00 0.02 0.00 0.52 0.00 0.00 54.79 55.39 2kbx n ASP 26 Cb 0.47 0.10 0.09 0.00 -0.72 0.00 0.00 41.12 41.06 2kbx n ASP 26 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2kbx n LEU 27 N -2.04 0.09 -0.49 -2.67 4.77 -1.26 0.97 117.00 116.37 2kbx n LEU 27 Ca 0.00 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 2kbx n LEU 27 Cb 0.00 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 2kbx n LEU 27 CO 0.00 -0.39 0.23 -3.20 -1.33 0.00 0.00 177.39 172.70 2kbx n ASN 28 N -1.49 0.88 -4.84 -1.43 4.05 -1.26 -4.80 115.26 106.36 2kbx n ASN 28 Ca -0.00 -1.80 -0.32 0.00 0.45 0.00 0.00 54.58 52.90 2kbx n ASN 28 Cb 0.23 -0.44 -0.03 0.00 1.23 0.00 0.00 39.78 40.77 2kbx n ASN 28 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2kbx s GLN 29 N -1.03 3.94 0.46 1.20 0.00 0.27 -4.87 119.66 119.63 2kbx s GLN 29 Ca 0.00 0.97 0.06 0.00 -0.00 0.00 0.00 55.36 56.39 2kbx s GLN 29 Cb 0.00 -2.13 -0.02 0.00 0.00 0.00 0.00 33.01 30.85 2kbx s GLN 29 CO 0.00 -0.28 0.21 0.20 0.00 0.00 0.00 175.29 175.42 2kbx s GLY 30 N -3.04 2.45 0.64 2.60 0.00 -1.26 -4.63 107.32 104.09 2kbx s GLY 30 Ca 0.59 -1.63 -0.14 0.00 0.00 0.00 0.00 44.72 43.54 2kbx s GLY 30 CO 0.31 -1.96 1.07 0.99 0.00 0.00 0.00 173.10 173.51 2kbx s ASP 31 N -4.00 5.49 0.00 1.64 1.11 -0.04 -4.81 116.67 116.06 2kbx s ASP 31 Ca 0.34 1.79 0.00 0.00 0.18 0.00 0.00 52.55 54.87 2kbx s ASP 31 Cb 0.02 -2.53 0.02 0.00 1.07 0.00 0.00 42.92 41.50 2kbx s ASP 31 CO 0.19 -1.37 1.01 -0.67 1.18 0.00 0.00 175.17 175.51 2kbx n ASP 32 N -2.47 0.00 0.05 0.27 2.03 -1.26 0.88 116.55 116.04 2kbx n ASP 32 Ca 0.09 0.49 0.12 0.00 0.52 0.00 0.00 54.79 56.00 2kbx n ASP 32 Cb 0.53 -0.49 0.06 0.00 -0.72 0.00 0.00 41.12 40.49 2kbx n ASP 32 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 2kbx n HIS 33 N -1.49 0.47 0.00 -0.67 8.25 -1.26 -4.94 115.22 115.58 2kbx n HIS 33 Ca 0.00 0.14 0.00 0.00 -0.26 0.00 0.00 57.72 57.60 2kbx n HIS 33 Cb 0.01 -0.60 0.00 0.00 1.12 0.00 0.00 29.99 30.51 2kbx n HIS 33 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2kbx n GLY 34 N 1.32 1.37 3.65 -1.41 0.00 0.25 -4.00 105.19 106.38 2kbx n GLY 34 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2kbx n GLY 34 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kbx s PHE 35 N -2.00 3.35 0.26 1.61 0.08 -1.24 -4.75 117.98 115.29 2kbx s PHE 35 Ca 0.00 1.17 0.05 0.00 0.12 0.00 0.00 56.93 58.27 2kbx s PHE 35 Cb 0.00 -3.03 -0.03 0.00 -0.57 0.00 0.00 43.02 39.40 2kbx s PHE 35 CO 0.00 -0.34 0.37 -1.54 -0.10 0.00 0.00 175.22 173.61 2kbx s SER 36 N 1.27 6.19 0.26 1.36 1.04 -1.26 -0.86 113.70 121.69 2kbx s SER 36 Ca 0.36 -0.00 -0.03 0.00 0.48 0.00 0.00 55.95 56.76 2kbx s SER 36 Cb -0.16 -1.71 0.42 0.00 0.10 0.00 0.00 66.02 64.67 2kbx s SER 36 CO 0.09 -0.13 1.84 -0.65 0.98 0.00 0.00 173.24 175.37 2kbx h PRO 37 N 1.15 0.93 -0.79 4.02 0.11 -1.90 -0.48 132.00 135.03 2kbx h PRO 37 Ca -0.51 -0.06 0.06 0.00 0.11 0.00 0.00 66.00 65.61 2kbx h PRO 37 Cb 1.24 -0.21 -0.06 0.00 0.11 0.00 0.00 31.00 32.08 2kbx h PRO 37 CO 0.60 0.61 0.48 1.25 -0.21 0.00 0.00 178.00 180.73 2kbx h LEU 38 N 0.96 0.75 0.10 2.35 7.12 -1.98 0.22 115.31 124.82 2kbx h LEU 38 Ca 0.42 0.02 0.02 0.00 0.13 0.00 0.00 57.88 58.47 2kbx h LEU 38 Cb 0.31 -0.14 -0.05 0.00 -0.53 0.00 0.00 40.66 40.26 2kbx h LEU 38 CO -0.22 0.48 -0.47 0.45 -0.13 0.00 0.00 178.44 178.55 2kbx h HIS 39 N 0.88 -1.34 -0.28 1.25 3.86 -1.47 0.28 115.15 118.32 2kbx h HIS 39 Ca 0.34 0.04 0.02 0.00 -1.16 0.00 0.00 60.37 59.61 2kbx h HIS 39 Cb 0.16 0.57 -0.02 0.00 1.06 0.00 0.00 27.41 29.18 2kbx h HIS 39 CO -0.05 -0.55 0.14 -1.49 0.86 0.00 0.00 177.93 176.84 2kbx h TRP 40 N -0.69 0.26 -0.36 2.45 4.06 -1.15 -2.07 115.95 118.46 2kbx h TRP 40 Ca 0.01 0.01 0.08 0.00 2.06 0.00 0.00 58.89 61.05 2kbx h TRP 40 Cb 0.72 -0.08 -0.08 0.00 -1.00 0.00 0.00 29.16 28.72 2kbx h TRP 40 CO -0.42 0.15 -0.18 0.00 -3.56 0.00 0.00 178.44 174.43 2kbx h ALA 41 N 1.14 0.09 -0.35 1.49 0.00 0.25 -0.78 119.26 121.10 2kbx h ALA 41 Ca 0.12 0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.21 2kbx h ALA 41 Cb 0.03 0.43 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 2kbx h ALA 41 CO -0.08 -0.55 0.07 0.00 0.00 0.00 0.00 179.25 178.68 2kbx h ARG 43 N 0.19 0.05 0.11 0.00 9.65 -0.50 -2.80 114.38 121.07 2kbx h ARG 43 Ca 0.17 -0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 59.04 2kbx h ARG 43 Cb 0.19 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.76 2kbx h ARG 43 CO -0.22 0.03 -0.05 1.49 2.80 0.00 0.00 179.97 184.02 2kbx h GLU 44 N 0.05 -0.15 0.00 0.20 4.22 0.38 -3.47 114.58 115.82 2kbx h GLU 44 Ca 0.27 0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.72 2kbx h GLU 44 Cb 1.02 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.30 2kbx h GLU 44 CO -0.02 -0.10 0.00 0.41 -2.18 0.00 0.00 179.01 177.13 2kbx n GLY 45 N 1.35 0.65 2.59 1.92 0.00 -0.38 -5.01 105.19 106.32 2kbx n GLY 45 Ca -0.02 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.79 2kbx n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kbx n ARG 46 N 0.00 2.07 -0.39 1.61 1.74 -1.25 -4.67 116.66 115.76 2kbx n ARG 46 Ca 0.00 -1.42 0.33 0.00 -0.77 0.00 0.00 57.85 55.98 2kbx n ARG 46 Cb 0.00 -2.42 0.54 0.00 -1.02 0.00 0.00 32.46 29.55 2kbx n ARG 46 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2kbx n SER 47 N 4.12 0.13 0.00 0.55 3.41 -1.26 -2.36 113.62 118.21 2kbx n SER 47 Ca 0.44 1.00 0.00 0.00 -0.26 0.00 0.00 58.87 60.05 2kbx n SER 47 Cb 0.15 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.61 2kbx n SER 47 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2kbx n ALA 48 N -2.57 0.00 -0.45 7.33 0.00 -1.26 -0.72 120.51 122.84 2kbx n ALA 48 Ca 0.31 0.00 0.40 0.00 0.00 0.00 0.00 53.44 54.16 2kbx n ALA 48 Cb 1.26 0.00 0.66 0.00 0.00 0.00 0.00 19.45 21.37 2kbx n ALA 48 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 2kbx h VAL 49 N 0.00 0.05 0.51 0.00 -1.51 -1.86 0.13 116.25 113.56 2kbx h VAL 49 Ca 0.00 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.45 2kbx h VAL 49 Cb 0.00 0.06 0.00 0.00 -2.13 0.00 0.00 31.29 29.22 2kbx h VAL 49 CO 0.00 0.00 -0.24 0.58 -1.23 0.00 0.00 177.57 176.68 2kbx h VAL 50 N 0.00 0.21 -0.99 7.19 2.07 -1.28 -2.74 116.25 120.70 2kbx h VAL 50 Ca 0.70 -0.50 0.21 0.00 0.82 0.00 0.00 66.70 67.93 2kbx h VAL 50 Cb 3.22 0.31 -0.10 0.00 -1.52 0.00 0.00 31.29 33.20 2kbx h VAL 50 CO -0.01 0.04 0.62 1.05 0.02 0.00 0.00 177.57 179.29 2kbx h GLU 51 N -1.09 0.60 -0.37 1.57 4.11 0.15 -0.45 114.58 119.10 2kbx h GLU 51 Ca -0.07 -0.04 -0.06 0.00 0.07 0.00 0.00 59.36 59.27 2kbx h GLU 51 Cb 0.58 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 2kbx h GLU 51 CO 0.11 0.40 0.01 0.52 0.07 0.00 0.00 179.01 180.12 2kbx h MET 52 N 0.62 0.64 -0.33 1.06 0.00 -1.50 -3.04 114.93 112.37 2kbx h MET 52 Ca 0.57 -0.20 -0.00 0.00 0.00 0.00 0.00 59.70 60.06 2kbx h MET 52 Cb 1.08 -0.06 -0.02 0.00 0.00 0.00 0.00 31.60 32.61 2kbx h MET 52 CO -0.33 0.74 0.19 1.25 0.00 0.00 0.00 176.91 178.75 2kbx h LEU 53 N 0.46 0.40 -1.40 1.22 7.12 -0.80 -2.39 115.31 119.91 2kbx h LEU 53 Ca 0.11 -0.07 0.28 0.00 0.13 0.00 0.00 57.88 58.33 2kbx h LEU 53 Cb 0.44 -0.10 -0.09 0.00 -0.53 0.00 0.00 40.66 40.38 2kbx h LEU 53 CO 0.02 0.35 0.69 0.40 -0.13 0.00 0.00 178.44 179.77 2kbx h ILE 54 N 0.42 0.49 0.00 4.05 2.04 -1.20 0.51 117.51 123.81 2kbx h ILE 54 Ca 0.12 -0.12 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 2kbx h ILE 54 Cb 0.03 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.22 2kbx h ILE 54 CO -0.02 0.06 -0.20 0.24 0.00 0.00 0.00 178.15 178.24 2kbx h MET 55 N 0.35 0.00 -0.18 2.37 2.86 -1.39 -3.12 114.93 115.81 2kbx h MET 55 Ca 0.61 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 58.24 2kbx h MET 55 Cb 1.62 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.27 2kbx h MET 55 CO -0.29 0.20 0.08 -0.09 1.06 0.00 0.00 176.91 177.86 2kbx h ARG 56 N 0.00 0.25 0.00 1.72 2.43 0.21 -3.44 114.38 115.55 2kbx h ARG 56 Ca -0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2kbx h ARG 56 Cb 1.09 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.59 2kbx h ARG 56 CO 0.03 0.21 0.00 0.41 -1.51 0.00 0.00 179.97 179.10 2kbx n GLY 57 N -1.39 -0.06 3.72 2.80 0.00 -1.18 -5.12 105.19 103.96 2kbx n GLY 57 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2kbx n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kbx s ALA 58 N 0.00 3.72 0.30 4.61 0.00 -1.23 -4.99 121.76 124.18 2kbx s ALA 58 Ca 0.00 1.29 -0.11 0.00 0.00 0.00 0.00 51.96 53.14 2kbx s ALA 58 Cb 0.00 -3.60 -0.07 0.00 0.00 0.00 0.00 23.12 19.45 2kbx s ALA 58 CO 0.00 -0.74 0.65 -0.98 0.00 0.00 0.00 175.76 174.69 2kbx s ARG 59 N 1.20 3.83 0.00 0.00 3.03 -1.26 -4.67 118.95 121.08 2kbx s ARG 59 Ca 0.69 0.39 0.30 0.00 2.03 0.00 0.00 55.73 59.13 2kbx s ARG 59 Cb -0.41 -2.53 1.66 0.00 -1.03 0.00 0.00 34.95 32.63 2kbx s ARG 59 CO 0.31 0.18 2.07 -0.89 -1.13 0.00 0.00 175.30 175.84 2kbx n ILE 60 N -0.56 0.03 0.75 4.99 2.08 -1.26 -3.12 119.36 122.27 2kbx n ILE 60 Ca 0.01 0.01 0.13 0.00 0.56 0.00 0.00 62.75 63.46 2kbx n ILE 60 Cb 0.53 -0.53 0.49 0.00 -0.75 0.00 0.00 39.64 39.38 2kbx n ILE 60 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 2kbx n ASN 61 N -1.12 0.44 -4.56 4.38 5.03 -1.26 -4.63 115.26 113.55 2kbx n ASN 61 Ca 0.19 0.55 -0.47 0.00 0.87 0.00 0.00 54.58 55.72 2kbx n ASN 61 Cb 0.15 -0.66 -0.03 0.00 -1.02 0.00 0.00 39.78 38.22 2kbx n ASN 61 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.26 176.76 2kbx n VAL 62 N -1.92 1.56 -3.72 2.41 0.24 -1.18 -4.97 118.33 110.75 2kbx n VAL 62 Ca 0.06 -0.39 -0.11 0.00 -2.04 0.00 0.00 64.34 61.86 2kbx n VAL 62 Cb 0.37 -0.81 -0.06 0.00 -1.47 0.00 0.00 33.84 31.87 2kbx n VAL 62 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2kbx s MET 63 N -1.03 0.90 0.27 7.34 0.23 -1.26 -4.21 119.30 121.54 2kbx s MET 63 Ca 0.65 -0.59 -0.17 0.00 -1.03 0.00 0.00 55.69 54.55 2kbx s MET 63 Cb -0.79 0.39 -0.09 0.00 -1.53 0.00 0.00 34.83 32.81 2kbx s MET 63 CO 0.57 -0.31 0.73 -0.80 -2.03 0.00 0.00 175.02 173.17 2kbx s ASN 64 N -2.35 6.91 0.34 -1.18 0.01 -1.03 -4.85 114.94 112.79 2kbx s ASN 64 Ca -0.02 1.34 0.13 0.00 -0.71 0.00 0.00 52.86 53.60 2kbx s ASN 64 Cb 0.01 -2.39 0.68 0.00 0.41 0.00 0.00 41.25 39.96 2kbx s ASN 64 CO -0.06 -0.09 1.27 0.08 -1.51 0.00 0.00 177.10 176.79 2kbx h ARG 65 N 2.82 0.00 -1.12 -0.60 0.11 -1.90 0.54 114.38 114.23 2kbx h ARG 65 Ca -0.48 0.00 -0.34 0.00 0.10 0.00 0.00 59.98 59.26 2kbx h ARG 65 Cb 1.18 0.00 -0.18 0.00 1.11 0.00 0.00 29.97 32.08 2kbx h ARG 65 CO 0.65 0.00 0.44 0.41 0.10 0.00 0.00 179.97 181.57 2kbx n GLY 66 N -1.27 3.82 3.27 0.08 0.00 -1.26 -4.91 105.19 104.92 2kbx n GLY 66 Ca -0.01 -0.88 -0.23 0.00 0.00 0.00 0.00 46.02 44.90 2kbx n GLY 66 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2kbx n ASP 67 N -0.34 -6.33 -3.31 1.61 5.75 0.19 -4.99 116.55 109.12 2kbx n ASP 67 Ca 0.37 0.19 -0.10 0.00 -0.01 0.00 0.00 54.79 55.24 2kbx n ASP 67 Cb 1.03 -2.56 -0.06 0.00 -1.03 0.00 0.00 41.12 38.50 2kbx n ASP 67 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 2kbx s ASP 68 N -1.58 0.52 0.40 -1.12 1.01 -1.23 -4.89 116.67 109.78 2kbx s ASP 68 Ca 0.26 -0.59 -0.02 0.00 0.71 0.00 0.00 52.55 52.90 2kbx s ASP 68 Cb -0.03 1.02 -0.04 0.00 1.01 0.00 0.00 42.92 44.88 2kbx s ASP 68 CO 0.67 -0.34 0.65 0.42 0.21 0.00 0.00 175.17 176.79 2kbx s THR 69 N 2.35 5.01 0.27 -1.27 -4.23 -1.26 -2.45 115.64 114.06 2kbx s THR 69 Ca 0.11 -0.13 0.01 0.00 -1.18 0.00 0.00 61.69 60.49 2kbx s THR 69 Cb -0.12 -3.85 0.26 0.00 1.34 0.00 0.00 72.50 70.12 2kbx s THR 69 CO -0.26 -0.67 1.76 -0.65 -0.54 0.00 0.00 174.62 174.26 2kbx h PRO 70 N 0.60 0.61 -0.11 3.99 0.10 -1.82 -1.71 132.00 133.66 2kbx h PRO 70 Ca -0.48 -0.04 0.04 0.00 0.10 0.00 0.00 66.00 65.62 2kbx h PRO 70 Cb 1.21 -0.14 -0.06 0.00 0.10 0.00 0.00 31.00 32.12 2kbx h PRO 70 CO 0.62 0.40 -0.26 -0.07 0.10 0.00 0.00 178.00 178.79 2kbx h LEU 71 N 0.62 -0.79 0.32 2.35 3.38 -1.93 1.98 115.31 121.25 2kbx h LEU 71 Ca 0.49 0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.57 2kbx h LEU 71 Cb 0.73 0.34 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 2kbx h LEU 71 CO -0.38 -0.31 -0.33 0.45 0.09 0.00 0.00 178.44 177.96 2kbx h HIS 72 N -0.33 -0.91 -0.87 1.13 3.86 -1.70 -0.77 115.15 115.56 2kbx h HIS 72 Ca 0.09 0.01 0.22 0.00 -1.16 0.00 0.00 60.37 59.54 2kbx h HIS 72 Cb 0.47 0.35 -0.13 0.00 1.06 0.00 0.00 27.41 29.16 2kbx h HIS 72 CO -0.34 -0.43 0.26 -0.07 0.86 0.00 0.00 177.93 178.20 2kbx h LEU 73 N -0.65 0.07 0.08 2.43 3.38 -0.84 0.63 115.31 120.41 2kbx h LEU 73 Ca -0.04 0.18 0.02 0.00 0.09 0.00 0.00 57.88 58.14 2kbx h LEU 73 Cb 0.56 0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.50 2kbx h LEU 73 CO -0.04 -0.11 -0.31 0.00 0.09 0.00 0.00 178.44 178.06 2kbx h ALA 74 N 1.75 -0.51 -0.21 1.53 0.00 0.40 0.30 119.26 122.52 2kbx h ALA 74 Ca 0.54 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.32 2kbx h ALA 74 Cb 1.07 0.53 -0.01 0.00 0.00 0.00 0.00 17.79 19.37 2kbx h ALA 74 CO -0.62 -0.85 -0.26 0.00 0.00 0.00 0.00 179.25 177.52 2kbx h ALA 75 N 0.17 1.16 0.00 0.00 0.00 0.34 -1.05 119.26 119.88 2kbx h ALA 75 Ca 0.04 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2kbx h ALA 75 Cb 0.56 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2kbx h ALA 75 CO -0.21 0.54 0.00 0.45 0.00 0.00 0.00 179.25 180.03 2kbx n SER 76 N -4.12 0.00 -0.09 0.00 2.88 0.20 -3.38 113.62 109.11 2kbx n SER 76 Ca -0.01 -0.24 -0.10 0.00 -1.33 0.00 0.00 58.87 57.19 2kbx n SER 76 Cb 0.40 -0.17 -0.04 0.00 -0.75 0.00 0.00 64.21 63.66 2kbx n SER 76 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 2kbx n HIS 77 N -1.17 0.17 0.00 0.66 -0.00 0.94 -5.00 115.22 110.82 2kbx n HIS 77 Ca 0.11 0.08 0.00 0.00 -0.00 0.00 0.00 57.72 57.91 2kbx n HIS 77 Cb 0.11 -0.60 0.00 0.00 -0.00 0.00 0.00 29.99 29.50 2kbx n HIS 77 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2kbx n GLY 78 N 1.47 1.21 3.37 1.57 0.00 -0.99 -5.06 105.19 106.76 2kbx n GLY 78 Ca -0.17 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.40 2kbx n GLY 78 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2kbx s HIS 79 N -2.00 3.73 0.39 1.61 5.04 -1.26 -4.90 115.29 117.90 2kbx s HIS 79 Ca 0.00 -2.06 0.25 0.00 -1.54 0.00 0.00 55.06 51.71 2kbx s HIS 79 Cb 0.00 -3.98 1.37 0.00 0.04 0.00 0.00 32.58 30.01 2kbx s HIS 79 CO 0.00 -1.14 1.52 -2.13 -2.34 0.00 0.00 174.74 170.66 2kbx n ARG 80 N 4.40 -0.05 -0.32 2.88 0.63 -1.26 0.11 116.66 123.06 2kbx n ARG 80 Ca 0.21 1.28 0.19 0.00 -0.92 0.00 0.00 57.85 58.62 2kbx n ARG 80 Cb 0.45 -2.40 0.46 0.00 0.45 0.00 0.00 32.46 31.42 2kbx n ARG 80 CO 0.00 0.00 0.00 0.22 -2.51 0.00 0.00 177.63 175.34 2kbx h ASP 81 N 0.00 0.54 0.06 6.15 3.58 -1.98 -0.56 116.42 124.21 2kbx h ASP 81 Ca 0.84 0.08 -0.00 0.00 0.42 0.00 0.00 57.03 58.37 2kbx h ASP 81 Cb 2.44 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 43.48 2kbx h ASP 81 CO -0.61 0.15 -0.03 0.40 -2.88 0.00 0.00 179.24 176.26 2kbx h ILE 82 N 0.50 1.21 -0.77 2.25 1.08 -0.70 -0.53 117.51 120.56 2kbx h ILE 82 Ca 0.57 -1.02 0.17 0.00 -0.39 0.00 0.00 64.86 64.19 2kbx h ILE 82 Cb 1.27 1.87 -0.14 0.00 -3.07 0.00 0.00 36.82 36.75 2kbx h ILE 82 CO -0.31 0.25 -0.06 0.58 -0.69 0.00 0.00 178.15 177.93 2kbx h VAL 83 N -0.55 0.29 -0.05 1.67 2.07 -1.18 0.32 116.25 118.82 2kbx h VAL 83 Ca -0.01 -0.02 -0.08 0.00 0.82 0.00 0.00 66.70 67.41 2kbx h VAL 83 Cb 0.47 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 2kbx h VAL 83 CO 0.01 0.01 -0.28 0.06 0.02 0.00 0.00 177.57 177.40 2kbx h GLN 84 N 0.06 0.28 -0.43 1.57 3.07 -1.35 -2.85 115.11 115.47 2kbx h GLN 84 Ca 0.41 -0.23 0.02 0.00 0.09 0.00 0.00 58.65 58.93 2kbx h GLN 84 Cb 0.69 0.05 -0.02 0.00 0.08 0.00 0.00 27.48 28.28 2kbx h GLN 84 CO -0.71 0.88 0.28 -0.22 0.09 0.00 0.00 178.83 179.15 2kbx h LYS 85 N -0.26 0.51 0.15 0.06 1.63 -0.03 -1.42 116.57 117.22 2kbx h LYS 85 Ca -0.02 -0.03 -0.29 0.00 -0.85 0.00 0.00 60.65 59.46 2kbx h LYS 85 Cb 0.94 -0.12 0.03 0.00 -0.60 0.00 0.00 32.23 32.48 2kbx h LYS 85 CO 0.06 0.34 -1.23 -0.07 -3.45 0.00 0.00 179.45 175.09 2kbx h LEU 86 N 0.53 0.83 -0.09 5.20 -0.00 -0.44 -3.29 115.31 118.06 2kbx h LEU 86 Ca 0.16 -0.85 0.00 0.00 -0.00 0.00 0.00 57.88 57.19 2kbx h LEU 86 Cb 0.01 -0.26 0.00 0.00 -0.00 0.00 0.00 40.66 40.40 2kbx h LEU 86 CO -0.04 1.60 0.00 0.17 -0.00 0.00 0.00 178.44 180.18 2kbx h LEU 87 N 0.18 0.00 -0.11 1.67 8.10 -1.33 -3.13 115.31 120.70 2kbx h LEU 87 Ca -0.20 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.79 2kbx h LEU 87 Cb 1.92 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 42.14 2kbx h LEU 87 CO 0.24 0.00 -0.01 0.00 -4.11 0.00 0.00 178.44 174.55 2kbx n GLN 88 N -2.68 0.86 -0.05 0.17 6.02 -0.55 -0.48 117.38 120.67 2kbx n GLN 88 Ca 0.05 -0.11 -0.16 0.00 -0.01 0.00 0.00 57.00 56.77 2kbx n GLN 88 Cb 0.46 -1.50 -0.14 0.00 1.02 0.00 0.00 30.24 30.09 2kbx n GLN 88 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2kbx n TYR 89 N -0.98 0.72 -1.75 1.08 4.02 -1.18 -4.78 117.16 114.29 2kbx n TYR 89 Ca 0.20 0.19 0.00 0.00 -0.01 0.00 0.00 57.90 58.28 2kbx n TYR 89 Cb 0.19 -1.11 0.00 0.00 -0.02 0.00 0.00 39.34 38.40 2kbx n TYR 89 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 176.86 176.21 2kbx n LYS 90 N -3.22 0.00 -3.39 -0.72 2.85 -1.23 -5.02 118.16 107.44 2kbx n LYS 90 Ca -0.32 -0.07 -0.19 0.00 -1.05 0.00 0.00 58.31 56.67 2kbx n LYS 90 Cb 1.05 -0.13 0.07 0.00 -0.65 0.00 0.00 35.03 35.37 2kbx n LYS 90 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2kbx n ALA 91 N 0.00 -1.08 0.83 0.58 0.00 0.37 -4.84 120.51 116.36 2kbx n ALA 91 Ca 0.00 0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.77 2kbx n ALA 91 Cb 0.40 -4.56 0.00 0.00 0.00 0.00 0.00 19.45 15.28 2kbx n ALA 91 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2kbx n ASP 92 N -2.19 1.48 0.10 0.00 5.75 -1.26 -3.57 116.55 116.87 2kbx n ASP 92 Ca 0.00 -1.65 -0.04 0.00 -0.01 0.00 0.00 54.79 53.08 2kbx n ASP 92 Cb 0.55 -0.41 0.08 0.00 -1.03 0.00 0.00 41.12 40.31 2kbx n ASP 92 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 2kbx h ILE 93 N 0.07 1.49 -0.00 2.12 -0.00 -1.90 -2.85 117.51 116.43 2kbx h ILE 93 Ca 0.00 -2.39 0.00 0.00 -0.00 0.00 0.00 64.86 62.47 2kbx h ILE 93 Cb 0.58 2.29 0.00 0.00 -0.00 0.00 0.00 36.82 39.69 2kbx h ILE 93 CO 0.00 0.69 -0.16 -0.46 -0.00 0.00 0.00 178.15 178.22 2kbx n ASN 94 N -3.72 0.34 -4.42 2.19 0.23 -1.23 -4.45 115.26 104.20 2kbx n ASN 94 Ca -0.02 -0.21 -0.44 0.00 -0.53 0.00 0.00 54.58 53.39 2kbx n ASN 94 Cb 0.70 -0.12 -0.04 0.00 -2.08 0.00 0.00 39.78 38.24 2kbx n ASN 94 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2kbx s ALA 95 N -2.73 3.26 1.03 -2.53 0.00 -1.08 -5.03 121.76 114.69 2kbx s ALA 95 Ca 0.21 -2.11 -0.11 0.00 0.00 0.00 0.00 51.96 49.95 2kbx s ALA 95 Cb 0.19 -3.76 0.15 0.00 0.00 0.00 0.00 23.12 19.70 2kbx s ALA 95 CO 0.54 -2.65 0.82 1.33 0.00 0.00 0.00 175.76 175.80 2kbx n VAL 96 N 5.71 0.00 0.00 0.00 0.24 -1.26 -4.97 118.33 118.04 2kbx n VAL 96 Ca -0.02 -0.56 0.00 0.00 -2.04 0.00 0.00 64.34 61.71 2kbx n VAL 96 Cb 0.45 -1.59 0.00 0.00 -1.47 0.00 0.00 33.84 31.22 2kbx n VAL 96 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 2kbx n ASN 97 N -3.66 0.00 -0.06 -1.34 2.04 -1.26 -4.93 115.26 106.05 2kbx n ASN 97 Ca 0.10 0.00 0.02 0.00 -0.44 0.00 0.00 54.58 54.27 2kbx n ASN 97 Cb 0.37 0.00 -0.01 0.00 -2.53 0.00 0.00 39.78 37.61 2kbx n ASN 97 CO 0.00 0.00 0.00 -1.84 -0.44 0.00 0.00 177.26 174.98 2kbx n GLU 98 N 0.00 3.72 -0.09 -3.83 0.28 -1.26 -4.59 120.64 114.87 2kbx n GLU 98 Ca 0.00 -0.25 -0.07 0.00 -0.16 0.00 0.00 57.16 56.68 2kbx n GLU 98 Cb 0.00 -0.83 -0.15 0.00 1.43 0.00 0.00 31.44 31.89 2kbx n GLU 98 CO 0.00 0.00 0.00 1.58 -0.16 0.00 0.00 177.13 178.55 2kbx n HIS 99 N -0.68 0.00 0.00 -1.84 -0.00 -1.26 -4.99 115.22 106.45 2kbx n HIS 99 Ca 0.02 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.20 2kbx n HIS 99 Cb 0.09 -0.89 0.00 0.00 -0.12 0.00 0.00 29.99 29.06 2kbx n HIS 99 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2kbx n GLY 100 N 1.77 1.64 3.55 1.57 0.00 -1.26 -4.66 105.19 107.81 2kbx n GLY 100 Ca -0.28 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.34 2kbx n GLY 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kbx s ASN 101 N -2.00 5.61 0.33 1.61 4.22 -1.26 -4.89 114.94 118.56 2kbx s ASN 101 Ca 0.00 0.05 -0.17 0.00 -2.14 0.00 0.00 52.86 50.59 2kbx s ASN 101 Cb 0.00 -2.54 -0.09 0.00 1.28 0.00 0.00 41.25 39.90 2kbx s ASN 101 CO 0.00 -2.17 0.79 -0.69 -2.04 0.00 0.00 177.10 172.99 2kbx s VAL 102 N 7.80 4.58 0.48 3.54 1.01 -1.26 -4.25 120.40 132.30 2kbx s VAL 102 Ca 0.55 1.15 0.29 0.00 0.00 0.00 0.00 61.98 63.97 2kbx s VAL 102 Cb -0.11 -3.66 0.48 0.00 0.00 0.00 0.00 36.38 33.09 2kbx s VAL 102 CO 0.19 -0.14 1.79 -0.65 0.00 0.00 0.00 175.10 176.29 2kbx h PRO 103 N 2.41 0.16 -0.13 2.72 0.11 -1.91 0.11 132.00 135.47 2kbx h PRO 103 Ca -0.48 -0.01 -0.20 0.00 0.11 0.00 0.00 66.00 65.42 2kbx h PRO 103 Cb 1.18 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2kbx h PRO 103 CO 0.64 0.11 -0.74 1.25 -0.21 0.00 0.00 178.00 179.05 2kbx h LEU 104 N 0.16 0.74 -0.91 2.35 5.85 -1.91 -2.59 115.31 119.01 2kbx h LEU 104 Ca 0.58 -0.48 0.14 0.00 0.84 0.00 0.00 57.88 58.97 2kbx h LEU 104 Cb 1.95 -0.22 -0.09 0.00 0.37 0.00 0.00 40.66 42.67 2kbx h LEU 104 CO -0.14 1.25 0.52 0.45 -0.34 0.00 0.00 178.44 180.17 2kbx h HIS 105 N 0.43 0.92 -0.04 1.25 3.86 -1.14 0.52 115.15 120.95 2kbx h HIS 105 Ca -0.04 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.19 2kbx h HIS 105 Cb 1.34 -0.27 -0.00 0.00 1.06 0.00 0.00 27.41 29.54 2kbx h HIS 105 CO 0.07 0.27 -0.03 1.88 0.86 0.00 0.00 177.93 180.98 2kbx h TYR 106 N 0.75 0.10 -0.98 2.45 -1.99 -1.42 -1.31 116.97 114.56 2kbx h TYR 106 Ca 0.49 -0.03 0.12 0.00 2.00 0.00 0.00 58.73 61.31 2kbx h TYR 106 Cb 0.64 -0.02 -0.09 0.00 2.00 0.00 0.00 36.73 39.26 2kbx h TYR 106 CO -0.05 0.51 0.61 0.00 -0.00 0.00 0.00 178.16 179.23 2kbx h ALA 107 N 0.57 1.49 -0.22 3.88 0.00 -0.85 -1.24 119.26 122.90 2kbx h ALA 107 Ca 0.01 0.03 -0.20 0.00 0.00 0.00 0.00 54.91 54.75 2kbx h ALA 107 Cb 0.49 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2kbx h ALA 107 CO 0.01 0.19 -0.64 0.00 0.00 0.00 0.00 179.25 178.81 2kbx h PHE 109 N 0.57 0.15 0.00 0.00 3.57 -0.03 -3.04 116.94 118.15 2kbx h PHE 109 Ca -0.01 0.00 -0.19 0.00 3.53 0.00 0.00 57.97 61.30 2kbx h PHE 109 Cb 1.24 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.91 2kbx h PHE 109 CO 0.07 0.06 -1.42 0.91 -2.23 0.00 0.00 178.31 175.70 2kbx n TRP 110 N -4.41 0.42 0.00 0.41 7.02 -0.95 -5.06 117.44 114.87 2kbx n TRP 110 Ca 0.11 0.18 0.00 0.00 -1.02 0.00 0.00 57.50 56.77 2kbx n TRP 110 Cb 0.56 -0.84 0.00 0.00 -2.42 0.00 0.00 31.31 28.61 2kbx n TRP 110 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2kbx n GLY 111 N 1.42 0.42 2.65 6.99 0.00 0.14 -5.12 105.19 111.69 2kbx n GLY 111 Ca -0.29 -0.63 -0.29 0.00 0.00 0.00 0.00 46.02 44.81 2kbx n GLY 111 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kbx s GLN 112 N 0.00 1.17 0.15 1.61 -1.52 -0.84 -5.00 119.66 115.24 2kbx s GLN 112 Ca 0.00 -1.95 -0.17 0.00 -1.95 0.00 0.00 55.36 51.30 2kbx s GLN 112 Cb 0.00 -2.12 0.07 0.00 -0.22 0.00 0.00 33.01 30.74 2kbx s GLN 112 CO 0.00 -1.19 1.73 0.22 -0.25 0.00 0.00 175.29 175.79 2kbx h ASP 113 N 6.64 -0.01 -0.88 5.90 3.58 -1.96 -0.95 116.42 128.73 2kbx h ASP 113 Ca 0.03 0.06 0.18 0.00 0.42 0.00 0.00 57.03 57.72 2kbx h ASP 113 Cb 0.93 0.08 -0.17 0.00 1.72 0.00 0.00 39.33 41.89 2kbx h ASP 113 CO 0.44 0.03 -0.21 0.06 -2.88 0.00 0.00 179.24 176.69 2kbx h GLN 114 N 0.18 0.00 0.14 0.28 3.07 -1.98 1.20 115.11 118.00 2kbx h GLN 114 Ca 0.16 -0.00 -0.26 0.00 0.09 0.00 0.00 58.65 58.64 2kbx h GLN 114 Cb 0.19 -0.00 0.01 0.00 0.08 0.00 0.00 27.48 27.76 2kbx h GLN 114 CO -0.22 0.00 -1.28 -0.39 0.09 0.00 0.00 178.83 177.03 2kbx h VAL 115 N 0.00 1.18 -0.23 1.86 -1.51 -1.93 -2.78 116.25 112.84 2kbx h VAL 115 Ca 0.43 -2.48 0.07 0.00 -1.23 0.00 0.00 66.70 63.49 2kbx h VAL 115 Cb 0.66 2.89 -0.01 0.00 -2.13 0.00 0.00 31.29 32.71 2kbx h VAL 115 CO -0.90 0.73 0.19 0.00 -1.23 0.00 0.00 177.57 176.36 2kbx h ALA 116 N 0.02 2.10 0.15 5.19 0.00 -0.36 -2.21 119.26 124.16 2kbx h ALA 116 Ca -0.26 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2kbx h ALA 116 Cb 1.80 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.61 2kbx h ALA 116 CO 0.12 -0.31 -0.07 1.49 0.00 0.00 0.00 179.25 180.48 2kbx h GLU 117 N 0.00 -0.19 -0.91 0.00 4.57 0.14 -2.98 114.58 115.20 2kbx h GLU 117 Ca 0.11 0.01 0.26 0.00 -1.18 0.00 0.00 59.36 58.57 2kbx h GLU 117 Cb 0.49 0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 29.08 2kbx h GLU 117 CO -0.00 -0.13 0.88 0.22 -1.18 0.00 0.00 179.01 178.80 2kbx h ASP 118 N -0.86 0.00 0.04 1.04 3.58 -1.19 0.65 116.42 119.68 2kbx h ASP 118 Ca -0.02 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.43 2kbx h ASP 118 Cb 0.15 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.20 2kbx h ASP 118 CO 0.03 0.00 -0.02 -0.07 -2.88 0.00 0.00 179.24 176.30 2kbx h LEU 119 N 0.00 -0.04 -0.19 2.28 3.38 -1.46 -3.25 115.31 116.03 2kbx h LEU 119 Ca 0.43 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2kbx h LEU 119 Cb 2.19 0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.96 2kbx h LEU 119 CO -0.00 0.63 0.00 0.55 0.09 0.00 0.00 178.44 179.71 2kbx n VAL 120 N -4.76 0.82 0.82 1.22 3.14 -0.48 -2.12 118.33 116.98 2kbx n VAL 120 Ca -0.05 0.19 0.12 0.00 -2.96 0.00 0.00 64.34 61.64 2kbx n VAL 120 Cb 0.21 -0.97 0.51 0.00 -1.06 0.00 0.00 33.84 32.53 2kbx n VAL 120 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kbx n ALA 121 N -1.59 2.09 -0.05 1.55 0.00 0.22 -3.17 120.51 119.56 2kbx n ALA 121 Ca 0.04 -0.08 -0.19 0.00 0.00 0.00 0.00 53.44 53.21 2kbx n ALA 121 Cb 0.22 -1.39 -0.13 0.00 0.00 0.00 0.00 19.45 18.15 2kbx n ALA 121 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2kbx n ASN 122 N -1.52 1.88 0.00 0.00 4.13 -0.90 -4.97 115.26 113.88 2kbx n ASN 122 Ca 0.06 0.08 0.00 0.00 1.68 0.00 0.00 54.58 56.40 2kbx n ASN 122 Cb 0.28 -0.55 0.00 0.00 -1.54 0.00 0.00 39.78 37.97 2kbx n ASN 122 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2kbx n GLY 123 N 2.05 -0.87 0.17 7.41 0.00 -1.19 -4.98 105.19 107.78 2kbx n GLY 123 Ca -0.36 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.71 2kbx n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kbx h ALA 124 N 0.00 1.27 -3.24 4.61 0.00 -1.76 -3.46 119.26 116.68 2kbx h ALA 124 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2kbx h ALA 124 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2kbx h ALA 124 CO 0.00 -0.27 -0.65 -0.11 0.00 0.00 0.00 179.25 178.22 2kbx n LEU 125 N -2.02 -4.81 0.02 0.00 -0.00 -1.26 -4.77 117.00 104.14 2kbx n LEU 125 Ca -0.01 2.24 0.13 0.00 -0.00 0.00 0.00 56.01 58.37 2kbx n LEU 125 Cb 0.41 -2.42 0.37 0.00 -0.00 0.00 0.00 43.42 41.78 2kbx n LEU 125 CO 0.05 -1.14 0.64 0.55 -0.00 0.00 0.00 177.39 177.49 2kbx n VAL 126 N 1.21 0.09 -0.44 1.96 3.14 -1.26 -3.73 118.33 119.30 2kbx n VAL 126 Ca 0.00 -0.06 -0.15 0.00 -2.96 0.00 0.00 64.34 61.17 2kbx n VAL 126 Cb 0.00 -0.11 0.10 0.00 -1.06 0.00 0.00 33.84 32.77 2kbx n VAL 126 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 2kbx n SER 127 N -1.64 3.93 0.14 6.55 3.41 -1.26 -4.47 113.62 120.28 2kbx n SER 127 Ca 0.06 -3.01 -0.14 0.00 -0.26 0.00 0.00 58.87 55.52 2kbx n SER 127 Cb 0.36 -0.75 -0.08 0.00 -0.26 0.00 0.00 64.21 63.47 2kbx n SER 127 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 2kbx h ILE 128 N 0.66 0.81 -1.48 -1.33 2.04 -1.86 -3.49 117.51 112.86 2kbx h ILE 128 Ca 0.38 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.79 2kbx h ILE 128 Cb 1.95 1.07 0.00 0.00 -0.74 0.00 0.00 36.82 39.11 2kbx h ILE 128 CO 0.71 0.10 0.00 0.00 0.00 0.00 0.00 178.15 178.96 2kbx n ASN 130 N 0.00 -2.97 0.28 0.00 4.05 -1.26 -4.33 115.26 111.02 2kbx n ASN 130 Ca 0.00 -0.37 0.13 0.00 0.45 0.00 0.00 54.58 54.79 2kbx n ASN 130 Cb 0.00 -0.81 0.62 0.00 1.23 0.00 0.00 39.78 40.82 2kbx n ASN 130 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 177.26 174.32 2kbx h LYS 131 N -2.62 0.00 0.00 1.20 1.79 -1.90 0.31 116.57 115.35 2kbx h LYS 131 Ca -0.31 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.16 2kbx h LYS 131 Cb 0.92 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.57 2kbx h LYS 131 CO 0.20 0.00 -0.20 0.98 -1.08 0.00 0.00 179.45 179.35 2kbx n TYR 132 N -2.93 0.00 -0.87 -1.35 9.36 -1.26 -4.95 117.16 115.16 2kbx n TYR 132 Ca 0.01 -0.38 0.00 0.00 3.32 0.00 0.00 57.90 60.85 2kbx n TYR 132 Cb 0.60 -0.07 0.00 0.00 -0.63 0.00 0.00 39.34 39.23 2kbx n TYR 132 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2kbx n GLY 133 N -0.51 0.58 3.57 2.98 0.00 0.11 -4.93 105.19 106.99 2kbx n GLY 133 Ca 0.05 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.89 2kbx n GLY 133 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kbx s GLU 134 N -0.13 1.67 0.31 1.61 2.02 -1.26 -4.35 118.70 118.58 2kbx s GLU 134 Ca 0.00 -0.32 0.08 0.00 0.02 0.00 0.00 54.97 54.75 2kbx s GLU 134 Cb 0.00 -4.99 -0.04 0.00 0.10 0.00 0.00 34.13 29.21 2kbx s GLU 134 CO 0.00 -4.74 0.18 -1.64 0.02 0.00 0.00 175.26 169.08 2kbx s MET 135 N 8.05 2.56 0.28 1.61 -1.94 -1.26 -4.09 119.30 124.51 2kbx s MET 135 Ca 0.81 -1.38 -0.03 0.00 -1.71 0.00 0.00 55.69 53.38 2kbx s MET 135 Cb -0.06 -2.33 0.39 0.00 2.01 0.00 0.00 34.83 34.83 2kbx s MET 135 CO 0.13 0.19 1.91 -1.00 -0.01 0.00 0.00 175.02 176.23 2kbx h PRO 136 N 1.49 1.06 -1.00 2.03 0.13 -1.90 -1.50 132.00 132.31 2kbx h PRO 136 Ca -0.45 -0.11 0.20 0.00 -0.87 0.00 0.00 66.00 64.77 2kbx h PRO 136 Cb 1.25 -0.21 -0.11 0.00 0.13 0.00 0.00 31.00 32.05 2kbx h PRO 136 CO 0.61 0.77 0.60 0.28 -0.23 0.00 0.00 178.00 180.03 2kbx h VAL 137 N 1.07 0.66 0.00 1.56 2.07 -1.95 1.92 116.25 121.58 2kbx h VAL 137 Ca 0.27 -0.25 -0.06 0.00 0.82 0.00 0.00 66.70 67.49 2kbx h VAL 137 Cb 0.01 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 29.66 2kbx h VAL 137 CO -0.05 0.13 -0.34 -2.24 0.02 0.00 0.00 177.57 175.10 2kbx h ASP 138 N 0.72 0.00 0.07 0.57 3.04 -1.77 -2.05 116.42 116.99 2kbx h ASP 138 Ca 0.59 -0.86 0.00 0.00 -3.24 0.00 0.00 57.03 53.52 2kbx h ASP 138 Cb 0.97 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.26 2kbx h ASP 138 CO -0.41 1.13 0.00 1.17 -2.04 0.00 0.00 179.24 179.09 2kbx n LYS 139 N -4.56 0.01 -0.04 4.15 3.00 -0.61 -1.14 118.16 118.96 2kbx n LYS 139 Ca -0.16 0.40 -0.18 0.00 -0.00 0.00 0.00 58.31 58.38 2kbx n LYS 139 Cb 0.53 -1.50 -0.14 0.00 0.00 0.00 0.00 35.03 33.92 2kbx n LYS 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2kbx n ALA 140 N -1.44 1.15 1.68 3.14 0.00 0.65 -3.99 120.51 121.69 2kbx n ALA 140 Ca 0.01 -0.79 0.15 0.00 0.00 0.00 0.00 53.44 52.81 2kbx n ALA 140 Cb 0.02 -0.54 0.72 0.00 0.00 0.00 0.00 19.45 19.66 2kbx n ALA 140 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2kbx n LYS 141 N -3.32 1.13 -0.09 0.00 2.85 -0.29 -1.94 118.16 116.50 2kbx n LYS 141 Ca -0.33 -0.38 -0.14 0.00 -1.05 0.00 0.00 58.31 56.41 2kbx n LYS 141 Cb 1.04 -1.49 -0.07 0.00 -0.65 0.00 0.00 35.03 33.86 2kbx n LYS 141 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2kbx n ALA 142 N -0.61 0.64 0.10 0.58 0.00 -0.54 -4.47 120.51 116.22 2kbx n ALA 142 Ca 0.20 -0.47 -0.12 0.00 0.00 0.00 0.00 53.44 53.05 2kbx n ALA 142 Cb 0.23 -0.28 -0.05 0.00 0.00 0.00 0.00 19.45 19.35 2kbx n ALA 142 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2kbx h PRO 143 N -1.00 -0.44 0.00 0.00 0.11 -1.71 -3.46 132.00 125.50 2kbx h PRO 143 Ca -0.19 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.94 2kbx h PRO 143 Cb 0.94 0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2kbx h PRO 143 CO -0.12 -0.29 0.00 1.28 -0.21 0.00 0.00 178.00 178.66 2kbx n LEU 144 N -5.38 0.00 0.08 2.35 4.77 -1.25 -5.07 117.00 112.51 2kbx n LEU 144 Ca -0.06 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.82 2kbx n LEU 144 Cb 0.29 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.32 2kbx n LEU 144 CO 0.24 0.00 0.33 0.03 -1.33 0.00 0.00 177.39 176.66 2kbx h ARG 145 N 0.00 -0.28 0.00 3.23 3.08 -1.79 -3.45 114.38 115.17 2kbx h ARG 145 Ca 0.00 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2kbx h ARG 145 Cb 0.00 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2kbx h ARG 145 CO 0.00 0.06 0.00 -0.85 -1.07 0.00 0.00 179.97 178.11 2kbx n GLU 146 N -4.97 -1.06 -0.06 0.04 0.00 -0.82 -4.52 120.64 109.24 2kbx n GLU 146 Ca -0.07 0.00 -0.07 0.00 0.00 0.00 0.00 57.16 57.02 2kbx n GLU 146 Cb 0.24 -1.64 -0.06 0.00 0.00 0.00 0.00 31.44 29.98 2kbx n GLU 146 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 2kbx h LEU 147 N 0.00 0.00 -2.33 -1.84 7.12 -1.87 -2.98 115.31 113.40 2kbx h LEU 147 Ca 0.00 -0.43 -0.01 0.00 0.13 0.00 0.00 57.88 57.57 2kbx h LEU 147 Cb 0.00 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.13 2kbx h LEU 147 CO 0.00 0.78 -0.03 0.17 -0.13 0.00 0.00 178.44 179.23 2kbx h LEU 148 N -1.00 0.00 0.01 2.25 8.10 -1.96 -2.11 115.31 120.60 2kbx h LEU 148 Ca -0.02 0.00 -0.00 0.00 0.11 0.00 0.00 57.88 57.97 2kbx h LEU 148 Cb 0.52 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.74 2kbx h LEU 148 CO -0.01 0.03 -0.00 -0.09 -4.11 0.00 0.00 178.44 174.25 2kbx h ARG 149 N 0.00 -0.01 -0.31 0.17 1.12 -1.88 -0.70 114.38 112.77 2kbx h ARG 149 Ca -0.00 0.00 0.03 0.00 -1.11 0.00 0.00 59.98 58.90 2kbx h ARG 149 Cb 0.20 0.00 -0.03 0.00 -0.01 0.00 0.00 29.97 30.13 2kbx h ARG 149 CO 0.00 0.22 0.14 0.93 -3.11 0.00 0.00 179.97 178.15 2kbx h GLU 150 N -0.24 0.28 -0.77 0.20 5.08 -1.23 1.94 114.58 119.85 2kbx h GLU 150 Ca -0.00 -0.02 0.11 0.00 -1.00 0.00 0.00 59.36 58.45 2kbx h GLU 150 Cb 0.24 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.37 2kbx h GLU 150 CO 0.00 0.19 0.50 -0.09 -1.00 0.00 0.00 179.01 178.61 2kbx h ARG 151 N 0.29 0.60 0.03 2.33 1.12 -1.34 1.33 114.38 118.73 2kbx h ARG 151 Ca 0.14 -0.04 -0.00 0.00 -1.11 0.00 0.00 59.98 58.97 2kbx h ARG 151 Cb 0.07 -0.14 0.00 0.00 -0.01 0.00 0.00 29.97 29.90 2kbx h ARG 151 CO -0.11 0.40 -0.01 0.00 -3.11 0.00 0.00 179.97 177.13 2kbx h ALA 152 N 1.62 -0.04 0.00 2.80 0.00 0.50 -3.09 119.26 121.05 2kbx h ALA 152 Ca 0.36 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2kbx h ALA 152 Cb 0.57 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2kbx h ALA 152 CO -0.13 -0.05 0.00 1.49 0.00 0.00 0.00 179.25 180.55 2kbx h GLU 153 N -0.98 0.00 -0.36 0.00 4.57 0.36 0.42 114.58 118.59 2kbx h GLU 153 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2kbx h GLU 153 Cb 0.52 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.11 2kbx h GLU 153 CO 0.01 0.00 0.00 1.17 -1.18 0.00 0.00 179.01 179.01 2kbx n LYS 154 N -2.93 2.30 0.19 1.92 4.81 0.45 -3.54 118.16 121.35 2kbx n LYS 154 Ca -0.02 -1.97 0.08 0.00 -0.87 0.00 0.00 58.31 55.53 2kbx n LYS 154 Cb 0.09 -1.48 0.12 0.00 0.02 0.00 0.00 35.03 33.78 2kbx n LYS 154 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2kbx h MET 155 N 3.78 0.00 0.00 1.64 -0.00 -0.82 -3.46 114.93 116.07 2kbx h MET 155 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2kbx h MET 155 Cb 0.84 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.44 2kbx h MET 155 CO 0.00 0.19 0.00 0.41 -0.00 0.00 0.00 176.91 177.51 2kbx n GLY 156 N 1.14 -0.88 0.22 -3.00 0.00 -1.26 -5.00 105.19 96.40 2kbx n GLY 156 Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.15 2kbx n GLY 156 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2kbx h GLN 157 N 0.00 0.00 0.00 1.61 5.75 -1.76 -3.35 115.11 117.36 2kbx h GLN 157 Ca 0.00 0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.45 2kbx h GLN 157 Cb 0.00 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.54 2kbx h GLN 157 CO 0.00 0.24 -1.20 0.09 -2.65 0.00 0.00 178.83 175.30 2kbx n ASN 158 N -3.42 3.74 -4.17 -0.69 4.13 -1.23 -4.80 115.26 108.82 2kbx n ASN 158 Ca -0.00 -0.02 -0.43 0.00 1.68 0.00 0.00 54.58 55.81 2kbx n ASN 158 Cb 0.43 -0.04 0.00 0.00 -1.54 0.00 0.00 39.78 38.64 2kbx n ASN 158 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2kbx n LEU 159 N -2.59 5.93 -4.45 3.41 -0.00 -1.26 -4.95 117.00 113.10 2kbx n LEU 159 Ca -0.06 -4.61 -0.42 0.00 -0.00 0.00 0.00 56.01 50.92 2kbx n LEU 159 Cb 0.57 -1.53 -0.10 0.00 -0.00 0.00 0.00 43.42 42.35 2kbx n LEU 159 CO 0.04 1.09 -0.11 0.54 -0.00 0.00 0.00 177.39 178.95 2kbx s ASN 160 N 1.65 5.99 0.88 1.45 2.20 -1.26 -4.66 114.94 121.19 2kbx s ASN 160 Ca 0.40 -0.83 -0.14 0.00 -0.94 0.00 0.00 52.86 51.35 2kbx s ASN 160 Cb 0.03 -2.12 -0.01 0.00 -2.00 0.00 0.00 41.25 37.15 2kbx s ASN 160 CO 0.01 -0.39 0.33 0.54 -2.94 0.00 0.00 177.10 174.64 2kbx n ARG 161 N 5.10 -0.07 -1.59 3.55 3.00 -1.26 -4.70 116.66 120.70 2kbx n ARG 161 Ca -0.12 0.02 -0.44 0.00 -0.01 0.00 0.00 57.85 57.30 2kbx n ARG 161 Cb 0.47 -1.76 -0.04 0.00 0.00 0.00 0.00 32.46 31.14 2kbx n ARG 161 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.63 178.07 2kbx n ILE 162 N -3.08 0.39 -1.65 0.55 -5.35 -1.26 -4.90 119.36 104.07 2kbx n ILE 162 Ca 0.07 -0.37 -0.38 0.00 -0.27 0.00 0.00 62.75 61.79 2kbx n ILE 162 Cb 0.52 -2.36 0.05 0.00 -1.74 0.00 0.00 39.64 36.11 2kbx n ILE 162 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 2kbx n PRO 163 N 8.40 1.11 -0.03 6.28 -0.02 -1.26 -4.85 135.00 144.63 2kbx n PRO 163 Ca 0.30 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 2kbx n PRO 163 Cb 0.40 -2.26 0.01 0.00 -0.02 0.00 0.00 33.50 31.64 2kbx n PRO 163 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 2kbx n TYR 164 N -1.48 0.07 -2.82 6.00 0.18 -1.26 -4.46 117.16 113.38 2kbx n TYR 164 Ca 0.13 -0.03 -0.01 0.00 1.88 0.00 0.00 57.90 59.87 2kbx n TYR 164 Cb 0.46 -0.10 0.00 0.00 -0.38 0.00 0.00 39.34 39.33 2kbx n TYR 164 CO 0.00 0.00 0.00 0.36 -2.08 0.00 0.00 176.86 175.14 2kbx n LYS 165 N -0.05 0.88 0.00 -3.48 2.85 -1.26 -4.41 118.16 112.68 2kbx n LYS 165 Ca 0.01 -0.17 0.00 0.00 -1.05 0.00 0.00 58.31 57.10 2kbx n LYS 165 Cb 0.24 -0.02 0.00 0.00 -0.65 0.00 0.00 35.03 34.60 2kbx n LYS 165 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2kbx n ASP 166 N -2.97 0.00 -2.47 -5.58 8.00 -1.26 -2.49 116.55 109.78 2kbx n ASP 166 Ca 0.01 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.50 2kbx n ASP 166 Cb 0.03 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.20 2kbx n ASP 166 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2kbx n THR 167 N 0.00 0.47 -2.24 -3.53 -2.24 -1.26 -4.95 114.28 100.53 2kbx n THR 167 Ca 0.00 -1.62 -0.39 0.00 -2.27 0.00 0.00 64.05 59.77 2kbx n THR 167 Cb 0.00 1.07 0.03 0.00 -2.10 0.00 0.00 70.33 69.32 2kbx n THR 167 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2kbx n PHE 168 N -0.88 2.95 -2.21 4.78 3.72 -1.04 -4.93 117.46 119.86 2kbx n PHE 168 Ca -0.08 -2.49 0.00 0.00 -0.05 0.00 0.00 57.45 54.83 2kbx n PHE 168 Cb 0.85 -1.13 0.00 0.00 -0.94 0.00 0.00 39.48 38.27 2kbx n PHE 168 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 176.76 177.62 2kbx n TRP 169 N -0.35 -4.00 0.00 1.38 7.02 -1.26 -4.62 117.44 115.61 2kbx n TRP 169 Ca 0.50 2.39 0.00 0.00 -1.02 0.00 0.00 57.50 59.37 2kbx n TRP 169 Cb 0.26 -3.24 0.00 0.00 -2.42 0.00 0.00 31.31 25.91 2kbx n TRP 169 CO 0.00 0.00 0.00 1.17 -2.02 0.00 0.00 177.69 176.84 2kbx n LYS 170 N 1.89 0.00 0.00 -0.99 4.81 -1.26 -4.55 118.16 118.06 2kbx n LYS 170 Ca 0.00 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.46 2kbx n LYS 170 Cb 0.00 0.00 0.11 0.00 0.02 0.00 0.00 35.03 35.16 2kbx n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98