#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x9s n LEU 3 N 0.00 -0.42 -3.24 2.45 7.94 -1.26 -5.07 117.00 117.41 2x9s n LEU 3 Ca 0.00 -1.08 0.03 0.00 -1.11 0.00 0.00 56.01 53.85 2x9s n LEU 3 Cb 0.00 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 43.91 2x9s n LEU 3 CO 0.00 1.04 0.83 1.51 -1.11 0.00 0.00 177.39 179.66 2x9s s ASP 4 N -0.42 -0.21 0.39 1.96 -4.77 -1.26 -5.08 116.67 107.29 2x9s s ASP 4 Ca 0.00 0.28 0.08 0.00 -3.30 0.00 0.00 52.55 49.60 2x9s s ASP 4 Cb 0.00 1.23 -0.06 0.00 -1.09 0.00 0.00 42.92 43.00 2x9s s ASP 4 CO 0.00 -0.04 0.09 -0.69 0.70 0.00 0.00 175.17 175.23 2x9s s VAL 5 N 2.19 2.34 0.00 2.11 1.01 -1.26 -5.01 120.40 121.78 2x9s s VAL 5 Ca -0.00 -1.85 0.00 0.00 0.00 0.00 0.00 61.98 60.13 2x9s s VAL 5 Cb -0.02 -2.94 0.00 0.00 0.00 0.00 0.00 36.38 33.42 2x9s s VAL 5 CO -0.16 -0.06 0.41 0.00 0.00 0.00 0.00 175.10 175.29 2x9s n ALA 6 N -1.09 0.00 0.00 5.51 0.00 -1.26 -1.05 120.51 122.63 2x9s n ALA 6 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2x9s n ALA 6 Cb 0.64 0.06 0.00 0.00 0.00 0.00 0.00 19.45 20.16 2x9s n ALA 6 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2x9s n LEU 7 N -0.54 0.00 -0.06 0.00 4.77 -1.26 -0.87 117.00 119.04 2x9s n LEU 7 Ca 0.00 0.11 -0.02 0.00 -0.03 0.00 0.00 56.01 56.07 2x9s n LEU 7 Cb 0.00 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 40.97 2x9s n LEU 7 CO 0.00 -0.11 -0.08 0.50 -1.33 0.00 0.00 177.39 176.37 2x9s h LYS 8 N 0.00 0.00 0.00 3.23 3.64 -1.82 -3.35 116.57 118.27 2x9s h LYS 8 Ca 0.00 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.33 2x9s h LYS 8 Cb 0.10 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 2x9s h LYS 8 CO 0.00 0.05 -0.24 -0.09 -2.27 0.00 0.00 179.45 176.90 2x9s h ARG 9 N -1.00 0.00 -1.98 1.90 2.43 0.70 -2.68 114.38 113.75 2x9s h ARG 9 Ca -0.01 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.09 2x9s h ARG 9 Cb 0.19 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.71 2x9s h ARG 9 CO -0.00 0.24 -0.08 1.63 -1.51 0.00 0.00 179.97 180.25 2x9s n LYS 10 N -4.11 1.32 0.00 0.20 5.02 -0.08 -3.33 118.16 117.17 2x9s n LYS 10 Ca -0.02 -0.36 0.00 0.00 -2.02 0.00 0.00 58.31 55.91 2x9s n LYS 10 Cb 0.31 -1.31 0.00 0.00 -0.02 0.00 0.00 35.03 34.01 2x9s n LYS 10 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 2x9s n TYR 11 N 1.71 -1.03 -0.21 2.13 9.36 -1.02 -4.52 117.16 123.59 2x9s n TYR 11 Ca 0.13 0.00 -0.08 0.00 3.32 0.00 0.00 57.90 61.28 2x9s n TYR 11 Cb 0.62 0.34 0.03 0.00 -0.63 0.00 0.00 39.34 39.69 2x9s n TYR 11 CO 0.00 0.00 0.00 1.88 0.22 0.00 0.00 176.86 178.96 2x9s h TYR 12 N 0.00 0.89 -0.72 2.98 -1.99 -1.55 -1.76 116.97 114.82 2x9s h TYR 12 Ca 0.00 -0.07 -0.41 0.00 2.00 0.00 0.00 58.73 60.25 2x9s h TYR 12 Cb 0.00 -0.27 -0.24 0.00 2.00 0.00 0.00 36.73 38.23 2x9s h TYR 12 CO 0.00 0.72 0.27 -0.85 -0.00 0.00 0.00 178.16 178.29 2x9s n GLU 13 N -4.48 2.26 0.00 4.88 0.28 -1.22 -4.64 120.64 117.72 2x9s n GLU 13 Ca 0.03 -3.23 0.00 0.00 -0.16 0.00 0.00 57.16 53.80 2x9s n GLU 13 Cb 0.16 -2.06 0.00 0.00 1.43 0.00 0.00 31.44 30.98 2x9s n GLU 13 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2x9s n GLU 14 N -1.07 0.00 0.25 3.44 1.02 -1.07 -4.98 120.64 118.23 2x9s n GLU 14 Ca 0.48 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.70 2x9s n GLU 14 Cb 1.20 0.00 0.61 0.00 -0.02 0.00 0.00 31.44 33.23 2x9s n GLU 14 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2x9s h VAL 15 N 0.00 1.02 -0.14 2.62 2.07 -1.78 -3.03 116.25 117.00 2x9s h VAL 15 Ca 0.00 -0.15 0.03 0.00 0.82 0.00 0.00 66.70 67.39 2x9s h VAL 15 Cb 0.00 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 2x9s h VAL 15 CO 0.00 0.04 -0.40 0.03 0.02 0.00 0.00 177.57 177.26 2x9s h ARG 16 N 0.00 -0.38 0.00 1.57 2.47 -1.59 -0.11 114.38 116.34 2x9s h ARG 16 Ca -0.00 0.03 -0.03 0.00 -1.26 0.00 0.00 59.98 58.71 2x9s h ARG 16 Cb 0.08 0.09 -0.00 0.00 -1.65 0.00 0.00 29.97 28.48 2x9s h ARG 16 CO 0.01 -0.25 -0.15 -1.00 0.56 0.00 0.00 179.97 179.13 2x9s h PRO 17 N -0.40 0.00 -0.26 0.04 0.13 -1.82 -3.05 132.00 126.65 2x9s h PRO 17 Ca 0.03 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 65.22 2x9s h PRO 17 Cb 0.48 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.54 2x9s h PRO 17 CO -0.35 0.15 -0.32 1.49 -0.23 0.00 0.00 178.00 178.74 2x9s h GLU 18 N 0.00 -0.31 -0.20 0.86 4.57 -0.91 0.18 114.58 118.76 2x9s h GLU 18 Ca -0.00 0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.15 2x9s h GLU 18 Cb 0.45 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.10 2x9s h GLU 18 CO 0.02 -0.21 -0.09 -0.07 -1.18 0.00 0.00 179.01 177.48 2x9s h LEU 19 N -0.32 0.30 0.00 1.64 3.38 -1.33 0.17 115.31 119.15 2x9s h LEU 19 Ca 0.13 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2x9s h LEU 19 Cb 0.54 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2x9s h LEU 19 CO -0.44 0.43 0.00 -0.38 0.09 0.00 0.00 178.44 178.15 2x9s n ILE 20 N -4.28 0.83 -0.08 1.22 5.41 0.50 -1.24 119.36 121.72 2x9s n ILE 20 Ca -0.00 0.21 -0.09 0.00 1.00 0.00 0.00 62.75 63.87 2x9s n ILE 20 Cb 0.26 -1.07 -0.13 0.00 -0.71 0.00 0.00 39.64 38.00 2x9s n ILE 20 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 2x9s n ARG 21 N -1.29 1.22 -0.06 0.38 0.63 0.55 -3.84 116.66 114.26 2x9s n ARG 21 Ca 0.04 0.00 -0.02 0.00 -0.92 0.00 0.00 57.85 56.96 2x9s n ARG 21 Cb 0.07 -1.43 -0.01 0.00 0.45 0.00 0.00 32.46 31.55 2x9s n ARG 21 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2x9s h ARG 22 N 0.00 0.00 0.03 -0.14 2.47 -0.54 -3.41 114.38 112.79 2x9s h ARG 22 Ca -0.45 0.00 -0.28 0.00 -1.26 0.00 0.00 59.98 57.99 2x9s h ARG 22 Cb 2.00 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 30.28 2x9s h ARG 22 CO 0.02 0.02 -1.50 0.74 0.56 0.00 0.00 179.97 179.80 2x9s h PHE 23 N -1.00 0.11 -3.27 3.04 0.05 -1.49 -3.50 116.94 110.88 2x9s h PHE 23 Ca -0.00 -0.08 0.00 0.00 3.82 0.00 0.00 57.97 61.71 2x9s h PHE 23 Cb 0.19 -0.00 -0.00 0.00 2.00 0.00 0.00 35.95 38.13 2x9s h PHE 23 CO -0.07 1.12 -0.15 0.41 -0.18 0.00 0.00 178.31 179.43 2x9s n GLY 24 N 1.55 -3.08 3.70 -1.45 0.00 -1.17 -5.02 105.19 99.71 2x9s n GLY 24 Ca -0.13 -0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 2x9s n GLY 24 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2x9s s TYR 25 N -0.18 3.40 -1.68 1.61 2.02 -1.26 -4.95 117.35 116.32 2x9s s TYR 25 Ca -0.01 0.48 0.00 0.00 -0.37 0.00 0.00 57.07 57.17 2x9s s TYR 25 Cb 0.00 -2.33 0.01 0.00 -0.40 0.00 0.00 41.96 39.24 2x9s s TYR 25 CO 0.10 0.16 0.86 1.04 -1.57 0.00 0.00 175.55 176.14 2x9s n GLN 26 N 3.89 1.05 0.00 -0.62 1.13 -1.26 -4.64 117.38 116.93 2x9s n GLN 26 Ca -0.13 -0.06 0.00 0.00 -1.94 0.00 0.00 57.00 54.88 2x9s n GLN 26 Cb 0.52 -1.17 0.00 0.00 0.11 0.00 0.00 30.24 29.70 2x9s n GLN 26 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 2x9s n ASN 27 N -0.31 0.00 0.27 1.08 2.85 -1.26 -4.98 115.26 112.91 2x9s n ASN 27 Ca 0.01 0.00 0.10 0.00 -0.11 0.00 0.00 54.58 54.58 2x9s n ASN 27 Cb 0.09 0.00 0.54 0.00 1.24 0.00 0.00 39.78 41.66 2x9s n ASN 27 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 2x9s h VAL 28 N 0.00 0.00 0.00 3.44 2.07 -1.97 0.80 116.25 120.59 2x9s h VAL 28 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2x9s h VAL 28 Cb 0.00 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.21 2x9s h VAL 28 CO 0.00 0.00 0.00 0.79 0.02 0.00 0.00 177.57 178.38 2x9s n TRP 29 N -2.53 0.00 0.17 1.57 5.03 -1.26 -0.85 117.44 119.57 2x9s n TRP 29 Ca -0.01 0.00 0.04 0.00 3.03 0.00 0.00 57.50 60.56 2x9s n TRP 29 Cb 0.44 -0.18 -0.06 0.00 -1.03 0.00 0.00 31.31 30.48 2x9s n TRP 29 CO 0.00 0.00 0.00 -1.91 -0.03 0.00 0.00 177.69 175.75 2x9s n GLU 30 N -1.18 2.02 -1.79 -0.99 2.13 0.28 -5.02 120.64 116.08 2x9s n GLU 30 Ca 0.06 -0.04 -0.35 0.00 0.66 0.00 0.00 57.16 57.49 2x9s n GLU 30 Cb 0.06 -1.06 0.05 0.00 0.27 0.00 0.00 31.44 30.76 2x9s n GLU 30 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2x9s s VAL 31 N -2.23 2.68 0.29 6.31 0.11 -0.03 -4.96 120.40 122.57 2x9s s VAL 31 Ca -0.00 0.37 -0.29 0.00 -2.93 0.00 0.00 61.98 59.12 2x9s s VAL 31 Cb 0.06 -3.01 -0.10 0.00 -1.53 0.00 0.00 36.38 31.79 2x9s s VAL 31 CO 0.34 -0.14 1.38 -2.16 -3.33 0.00 0.00 175.10 171.19 2x9s s PRO 32 N -3.67 4.30 0.00 1.54 0.04 -1.26 -4.87 135.00 131.08 2x9s s PRO 32 Ca 0.74 2.27 0.03 0.00 0.04 0.00 0.00 61.00 64.08 2x9s s PRO 32 Cb -0.28 -3.09 -0.01 0.00 0.04 0.00 0.00 34.50 31.17 2x9s s PRO 32 CO 0.38 -0.32 -0.10 1.03 0.04 0.00 0.00 177.00 178.03 2x9s s ARG 33 N -1.06 0.82 -1.08 4.56 3.00 -1.26 -4.92 118.95 119.01 2x9s s ARG 33 Ca 0.54 -0.43 -0.20 0.00 0.00 0.00 0.00 55.73 55.64 2x9s s ARG 33 Cb -0.41 -0.79 0.08 0.00 0.00 0.00 0.00 34.95 33.83 2x9s s ARG 33 CO 0.48 0.21 1.44 -0.51 0.00 0.00 0.00 175.30 176.93 2x9s s LEU 34 N -0.41 4.03 -0.07 2.53 1.02 -1.26 -3.04 118.68 121.48 2x9s s LEU 34 Ca 0.03 -1.92 -0.17 0.00 0.02 0.00 0.00 54.13 52.09 2x9s s LEU 34 Cb -0.05 -2.52 -0.13 0.00 0.02 0.00 0.00 46.19 43.51 2x9s s LEU 34 CO -0.00 -1.28 0.65 -0.08 0.02 0.00 0.00 176.35 175.66 2x9s h GLU 35 N 8.90 -0.18 -5.85 1.70 4.81 -1.93 -3.45 114.58 118.58 2x9s h GLU 35 Ca 0.25 0.01 -0.57 0.00 -0.13 0.00 0.00 59.36 58.93 2x9s h GLU 35 Cb 0.97 0.04 -0.29 0.00 0.63 0.00 0.00 28.75 30.11 2x9s h GLU 35 CO 1.35 0.21 -0.84 0.21 -0.73 0.00 0.00 179.01 179.21 2x9s s LYS 36 N -2.87 1.48 -0.37 1.92 2.20 -1.18 -4.63 119.74 116.29 2x9s s LYS 36 Ca -0.10 -0.72 0.01 0.00 -0.36 0.00 0.00 55.97 54.80 2x9s s LYS 36 Cb -0.00 -1.46 0.15 0.00 -1.51 0.00 0.00 37.83 35.01 2x9s s LYS 36 CO 0.38 0.40 0.26 0.08 -0.36 0.00 0.00 175.35 176.10 2x9s s VAL 37 N -0.52 0.25 0.08 4.02 1.01 -1.20 -1.07 120.40 122.96 2x9s s VAL 37 Ca 0.07 -2.06 0.03 0.00 0.00 0.00 0.00 61.98 60.03 2x9s s VAL 37 Cb -0.08 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 2x9s s VAL 37 CO -0.00 -1.07 0.06 -0.69 0.00 0.00 0.00 175.10 173.40 2x9s s VAL 38 N 0.70 4.41 0.51 2.92 1.01 -1.25 -3.47 120.40 125.23 2x9s s VAL 38 Ca 0.23 -0.80 0.07 0.00 0.00 0.00 0.00 61.98 61.49 2x9s s VAL 38 Cb -0.14 -3.11 0.07 0.00 0.00 0.00 0.00 36.38 33.20 2x9s s VAL 38 CO -0.06 0.14 0.59 2.30 0.00 0.00 0.00 175.10 178.07 2x9s n ILE 39 N 0.55 0.00 -3.62 2.22 -5.35 -1.14 0.50 119.36 112.52 2x9s n ILE 39 Ca -0.09 -1.79 -0.16 0.00 -0.27 0.00 0.00 62.75 60.44 2x9s n ILE 39 Cb 0.52 -0.40 -0.07 0.00 -1.74 0.00 0.00 39.64 37.94 2x9s n ILE 39 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 2x9s s ASN 40 N -4.08 -0.56 0.16 7.28 3.04 0.16 -4.10 114.94 116.84 2x9s s ASN 40 Ca 0.45 0.78 -0.14 0.00 0.04 0.00 0.00 52.86 53.99 2x9s s ASN 40 Cb -0.04 0.74 0.02 0.00 -1.54 0.00 0.00 41.25 40.44 2x9s s ASN 40 CO 0.29 -0.44 0.40 -1.10 -3.04 0.00 0.00 177.10 173.21 2x9s s GLN 41 N -0.69 1.21 0.26 0.43 -0.21 0.27 -2.30 119.66 118.63 2x9s s GLN 41 Ca -0.08 -0.93 0.00 0.00 0.02 0.00 0.00 55.36 54.38 2x9s s GLN 41 Cb -0.02 0.46 0.00 0.00 1.00 0.00 0.00 33.01 34.44 2x9s s GLN 41 CO 0.06 -0.48 0.00 0.41 -2.12 0.00 0.00 175.29 173.16 2x9s n GLY 42 N -0.26 -1.54 5.40 3.09 0.00 -1.26 -2.38 105.19 108.24 2x9s n GLY 42 Ca -0.11 0.43 0.00 0.00 0.00 0.00 0.00 46.02 46.34 2x9s n GLY 42 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2x9s n LEU 43 N -3.19 0.00 0.00 0.99 -0.00 -1.26 -4.32 117.00 109.22 2x9s n LEU 43 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2x9s n LEU 43 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2x9s n LEU 43 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.00 2x9s n GLY 44 N 0.00 0.55 3.47 -3.96 0.00 -1.26 -5.06 105.19 98.92 2x9s n GLY 44 Ca 0.00 -0.61 -0.44 0.00 0.00 0.00 0.00 46.02 44.97 2x9s n GLY 44 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2x9s s GLU 45 N -0.14 3.79 0.00 1.61 0.41 -1.26 -4.55 118.70 118.56 2x9s s GLU 45 Ca 0.00 -2.03 0.07 0.00 -0.41 0.00 0.00 54.97 52.60 2x9s s GLU 45 Cb 0.00 -5.02 0.11 0.00 -1.78 0.00 0.00 34.13 27.44 2x9s s GLU 45 CO 0.00 -1.82 0.93 0.00 -0.49 0.00 0.00 175.26 173.88 2x9s n ALA 46 N 6.44 2.41 -1.00 5.21 0.00 -1.26 -4.58 120.51 127.72 2x9s n ALA 46 Ca 0.30 -1.05 0.00 0.00 0.00 0.00 0.00 53.44 52.69 2x9s n ALA 46 Cb 0.47 -0.41 0.00 0.00 0.00 0.00 0.00 19.45 19.51 2x9s n ALA 46 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2x9s n LYS 47 N 0.13 0.00 -3.57 0.00 4.01 -1.26 -4.95 118.16 112.52 2x9s n LYS 47 Ca -0.03 0.00 -0.24 0.00 -0.51 0.00 0.00 58.31 57.52 2x9s n LYS 47 Cb 0.77 0.00 -0.16 0.00 -0.51 0.00 0.00 35.03 35.13 2x9s n LYS 47 CO 0.00 0.00 0.00 -2.00 -1.11 0.00 0.00 177.40 174.29 2x9s s GLU 48 N 0.00 0.11 0.00 1.97 2.12 -1.26 -4.82 118.70 116.82 2x9s s GLU 48 Ca 0.00 -0.04 0.00 0.00 0.36 0.00 0.00 54.97 55.29 2x9s s GLU 48 Cb 0.00 -1.59 0.00 0.00 0.26 0.00 0.00 34.13 32.80 2x9s s GLU 48 CO 0.00 -0.70 0.00 -3.47 -0.54 0.00 0.00 175.26 170.55 2x9s n ASP 49 N 5.29 0.00 -1.00 -1.70 2.03 -1.26 -5.01 116.55 114.91 2x9s n ASP 49 Ca -0.06 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.25 2x9s n ASP 49 Cb 0.49 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.89 2x9s n ASP 49 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2x9s n ALA 50 N 0.00 -1.21 -2.70 -1.67 0.00 -1.26 -5.00 120.51 108.67 2x9s n ALA 50 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 2x9s n ALA 50 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 2x9s n ALA 50 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2x9s s ARG 51 N -2.31 3.83 0.00 0.00 0.52 -1.26 -4.86 118.95 114.87 2x9s s ARG 51 Ca 0.00 -1.82 0.00 0.00 -0.52 0.00 0.00 55.73 53.39 2x9s s ARG 51 Cb 0.00 -5.30 0.00 0.00 0.52 0.00 0.00 34.95 30.17 2x9s s ARG 51 CO 0.00 -2.07 0.55 0.44 0.02 0.00 0.00 175.30 174.23 2x9s n ILE 52 N 6.05 0.00 -2.03 1.52 -0.00 -1.26 -4.71 119.36 118.93 2x9s n ILE 52 Ca 0.38 1.01 -0.02 0.00 -0.00 0.00 0.00 62.75 64.12 2x9s n ILE 52 Cb 0.47 -1.95 0.01 0.00 -0.00 0.00 0.00 39.64 38.18 2x9s n ILE 52 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 2x9s n LEU 53 N -1.75 -3.36 0.04 7.28 7.99 -1.26 -4.96 117.00 120.98 2x9s n LEU 53 Ca 0.00 -0.12 -0.04 0.00 -0.01 0.00 0.00 56.01 55.84 2x9s n LEU 53 Cb 0.00 -1.56 -0.09 0.00 -0.11 0.00 0.00 43.42 41.66 2x9s n LEU 53 CO 0.00 -0.17 -0.13 -0.33 -1.51 0.00 0.00 177.39 175.25 2x9s h GLU 54 N -0.09 0.00 0.42 3.23 3.07 -1.97 -2.97 114.58 116.27 2x9s h GLU 54 Ca -0.09 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.75 2x9s h GLU 54 Cb 1.05 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.95 2x9s h GLU 54 CO 0.12 0.54 -0.27 -0.22 -1.40 0.00 0.00 179.01 177.78 2x9s h LYS 55 N 0.00 -0.63 0.00 2.33 3.64 -1.98 0.36 116.57 120.29 2x9s h LYS 55 Ca -0.14 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 2x9s h LYS 55 Cb 1.71 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 33.68 2x9s h LYS 55 CO 0.08 -0.42 0.02 0.00 -2.27 0.00 0.00 179.45 176.86 2x9s n ALA 56 N -2.47 0.98 -0.07 5.00 0.00 -1.25 0.38 120.51 123.08 2x9s n ALA 56 Ca -0.08 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.25 2x9s n ALA 56 Cb 0.27 -0.96 -0.07 0.00 0.00 0.00 0.00 19.45 18.69 2x9s n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2x9s h ALA 57 N 1.93 0.06 0.00 0.00 0.00 -0.65 -3.38 119.26 117.22 2x9s h ALA 57 Ca 0.00 -0.55 -0.12 0.00 0.00 0.00 0.00 54.91 54.24 2x9s h ALA 57 Cb 0.03 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2x9s h ALA 57 CO 0.00 0.26 -1.55 0.00 0.00 0.00 0.00 179.25 177.96 2x9s n GLN 58 N -4.61 0.63 0.06 0.00 -0.00 0.10 -3.82 117.38 109.75 2x9s n GLN 58 Ca -0.12 0.09 0.05 0.00 -0.00 0.00 0.00 57.00 57.01 2x9s n GLN 58 Cb 0.37 -1.72 0.26 0.00 -0.00 0.00 0.00 30.24 29.15 2x9s n GLN 58 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 2x9s n GLU 59 N -2.69 0.06 0.04 2.61 2.13 0.16 0.99 120.64 123.94 2x9s n GLU 59 Ca -0.09 0.51 0.05 0.00 0.66 0.00 0.00 57.16 58.30 2x9s n GLU 59 Cb 0.75 -1.68 -0.07 0.00 0.27 0.00 0.00 31.44 30.72 2x9s n GLU 59 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 2x9s n LEU 60 N -1.80 0.67 -0.53 4.31 -0.00 -1.25 -3.84 117.00 114.57 2x9s n LEU 60 Ca 0.00 0.28 0.10 0.00 -0.00 0.00 0.00 56.01 56.39 2x9s n LEU 60 Cb 0.05 0.04 0.36 0.00 -0.00 0.00 0.00 43.42 43.87 2x9s n LEU 60 CO 0.06 0.02 0.76 0.00 -0.00 0.00 0.00 177.39 178.23 2x9s n ALA 61 N -2.32 2.52 0.12 1.96 0.00 0.28 -2.80 120.51 120.27 2x9s n ALA 61 Ca -0.07 -0.50 0.00 0.00 0.00 0.00 0.00 53.44 52.87 2x9s n ALA 61 Cb 0.71 -1.09 -0.01 0.00 0.00 0.00 0.00 19.45 19.06 2x9s n ALA 61 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2x9s h LEU 62 N 2.06 0.00 0.00 0.00 4.07 -1.59 0.09 115.31 119.93 2x9s h LEU 62 Ca 0.00 0.00 -0.25 0.00 0.08 0.00 0.00 57.88 57.71 2x9s h LEU 62 Cb 0.45 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.15 2x9s h LEU 62 CO 0.00 0.61 -1.96 2.30 -1.08 0.00 0.00 178.44 178.31 2x9s n ILE 63 N -3.23 0.96 0.18 1.22 -5.35 -1.23 -4.36 119.36 107.54 2x9s n ILE 63 Ca 0.01 -0.43 0.07 0.00 -0.27 0.00 0.00 62.75 62.12 2x9s n ILE 63 Cb 0.78 -0.97 0.09 0.00 -1.74 0.00 0.00 39.64 37.81 2x9s n ILE 63 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2x9s h THR 64 N 0.00 0.47 0.00 7.28 1.03 -1.68 -3.44 112.91 116.57 2x9s h THR 64 Ca -0.38 -1.66 0.00 0.00 -0.01 0.00 0.00 66.41 64.36 2x9s h THR 64 Cb 1.66 2.23 0.00 0.00 -1.07 0.00 0.00 68.15 70.97 2x9s h THR 64 CO -0.04 0.27 0.00 0.61 -0.01 0.00 0.00 175.52 176.35 2x9s n GLY 65 N 1.16 1.73 3.71 2.99 0.00 0.02 -4.92 105.19 109.88 2x9s n GLY 65 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 2x9s n GLY 65 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2x9s s GLN 66 N 0.00 4.27 -0.21 1.61 0.74 -1.25 -4.89 119.66 119.92 2x9s s GLN 66 Ca 0.00 0.29 -0.28 0.00 0.05 0.00 0.00 55.36 55.41 2x9s s GLN 66 Cb 0.00 -3.47 -0.05 0.00 1.10 0.00 0.00 33.01 30.60 2x9s s GLN 66 CO 0.00 0.11 2.11 0.15 -0.55 0.00 0.00 175.29 177.12 2x9s s LYS 67 N 0.81 3.28 0.00 1.67 3.01 -1.26 -4.40 119.74 122.86 2x9s s LYS 67 Ca 0.21 1.99 0.00 0.00 -1.01 0.00 0.00 55.97 57.16 2x9s s LYS 67 Cb -0.14 -4.32 0.00 0.00 -1.01 0.00 0.00 37.83 32.36 2x9s s LYS 67 CO 0.08 -1.93 0.00 -0.35 0.51 0.00 0.00 175.35 173.66 2x9s n PRO 68 N 8.55 -0.41 -3.55 -1.68 -0.04 -1.26 -5.02 135.00 131.60 2x9s n PRO 68 Ca 0.27 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.56 2x9s n PRO 68 Cb 0.45 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.78 2x9s n PRO 68 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2x9s s ALA 69 N -2.04 -0.31 0.15 0.55 0.00 -0.95 -4.99 121.76 114.17 2x9s s ALA 69 Ca 0.00 0.43 -0.32 0.00 0.00 0.00 0.00 51.96 52.06 2x9s s ALA 69 Cb 0.00 -1.20 -0.12 0.00 0.00 0.00 0.00 23.12 21.80 2x9s s ALA 69 CO 0.00 -1.01 1.73 1.33 0.00 0.00 0.00 175.76 177.81 2x9s n VAL 70 N 5.33 0.15 -4.67 0.00 0.24 -1.26 -2.53 118.33 115.59 2x9s n VAL 70 Ca -0.05 -0.03 -0.33 0.00 -2.04 0.00 0.00 64.34 61.89 2x9s n VAL 70 Cb 0.50 -1.91 -0.16 0.00 -1.47 0.00 0.00 33.84 30.80 2x9s n VAL 70 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2x9s s THR 71 N 1.78 2.35 0.73 3.34 -1.32 0.23 -4.92 115.64 117.82 2x9s s THR 71 Ca 0.79 -0.88 -0.00 0.00 -1.21 0.00 0.00 61.69 60.39 2x9s s THR 71 Cb -0.55 -1.96 0.13 0.00 -1.51 0.00 0.00 72.50 68.61 2x9s s THR 71 CO 0.36 0.53 1.00 -0.13 -2.21 0.00 0.00 174.62 174.18 2x9s s ARG 72 N 0.75 1.64 0.54 7.08 0.52 -1.26 -2.12 118.95 126.09 2x9s s ARG 72 Ca -0.08 -1.18 0.03 0.00 -0.52 0.00 0.00 55.73 53.99 2x9s s ARG 72 Cb -0.16 -2.34 0.03 0.00 0.52 0.00 0.00 34.95 33.01 2x9s s ARG 72 CO 0.00 -1.48 0.26 0.00 0.02 0.00 0.00 175.30 174.10 2x9s n ALA 73 N -2.84 0.70 -2.70 2.13 0.00 -1.26 -4.89 120.51 111.64 2x9s n ALA 73 Ca 0.16 -2.26 -0.06 0.00 0.00 0.00 0.00 53.44 51.27 2x9s n ALA 73 Cb 0.61 1.05 0.07 0.00 0.00 0.00 0.00 19.45 21.17 2x9s n ALA 73 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2x9s n LYS 74 N -1.61 1.27 0.00 0.00 -0.00 -1.21 -4.12 118.16 112.48 2x9s n LYS 74 Ca -0.09 -2.67 0.00 0.00 -0.00 0.00 0.00 58.31 55.54 2x9s n LYS 74 Cb 0.64 -0.78 0.00 0.00 -0.00 0.00 0.00 35.03 34.89 2x9s n LYS 74 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2x9s n LYS 75 N -0.44 0.00 -3.15 -1.58 4.76 -1.03 -4.99 118.16 111.74 2x9s n LYS 75 Ca 0.03 0.00 0.05 0.00 -2.87 0.00 0.00 58.31 55.52 2x9s n LYS 75 Cb 0.83 0.00 -0.01 0.00 -1.84 0.00 0.00 35.03 34.02 2x9s n LYS 75 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2x9s s SER 76 N 1.32 -0.70 -1.08 4.39 0.01 -1.26 -0.74 113.70 115.64 2x9s s SER 76 Ca 0.00 0.21 -0.22 0.00 1.31 0.00 0.00 55.95 57.24 2x9s s SER 76 Cb 0.00 1.50 0.03 0.00 0.21 0.00 0.00 66.02 67.75 2x9s s SER 76 CO 0.00 -0.13 1.64 -0.63 0.41 0.00 0.00 173.24 174.53 2x9s s ILE 77 N 2.93 3.86 0.14 1.44 1.01 -0.18 -4.72 121.20 125.67 2x9s s ILE 77 Ca 0.15 -0.97 -0.07 0.00 0.00 0.00 0.00 60.65 59.77 2x9s s ILE 77 Cb -0.07 -4.87 -0.13 0.00 0.01 0.00 0.00 42.46 37.40 2x9s s ILE 77 CO -0.20 -1.72 1.37 0.77 0.00 0.00 0.00 174.94 175.16 2x9s h SER 78 N 9.54 0.69 0.16 3.58 4.64 -1.77 -1.63 113.55 128.77 2x9s h SER 78 Ca 0.24 -0.46 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 2x9s h SER 78 Cb 0.97 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 2x9s h SER 78 CO 1.38 1.23 0.00 0.78 -0.87 0.00 0.00 176.83 179.36 2x9s h ASN 79 N 0.39 0.00 -0.12 4.97 4.21 -1.94 -3.27 115.58 119.82 2x9s h ASN 79 Ca -0.05 0.00 -0.24 0.00 1.21 0.00 0.00 56.30 57.22 2x9s h ASN 79 Cb 1.37 0.00 -0.17 0.00 -1.12 0.00 0.00 38.32 38.40 2x9s h ASN 79 CO 0.14 0.00 -0.45 0.33 -1.29 0.00 0.00 177.43 176.16 2x9s n PHE 80 N -2.41 -2.31 -1.27 1.19 -0.00 -1.17 -5.15 117.46 106.33 2x9s n PHE 80 Ca -0.01 -2.09 0.16 0.00 -0.00 0.00 0.00 57.45 55.51 2x9s n PHE 80 Cb 0.08 1.44 -0.06 0.00 -0.00 0.00 0.00 39.48 40.94 2x9s n PHE 80 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 2x9s n LYS 81 N -0.25 -2.79 -0.37 -4.13 5.02 -0.62 -4.93 118.16 110.09 2x9s n LYS 81 Ca 0.01 2.11 0.00 0.00 -2.02 0.00 0.00 58.31 58.42 2x9s n LYS 81 Cb 0.80 -3.32 0.00 0.00 -0.02 0.00 0.00 35.03 32.49 2x9s n LYS 81 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2x9s n LEU 82 N -4.10 -2.47 -4.32 -0.35 4.77 -1.24 -3.95 117.00 105.34 2x9s n LEU 82 Ca -0.04 0.35 -0.18 0.00 -0.03 0.00 0.00 56.01 56.12 2x9s n LEU 82 Cb 0.60 -0.08 -0.09 0.00 -2.33 0.00 0.00 43.42 41.51 2x9s n LEU 82 CO 0.03 -0.11 -0.21 -0.13 -1.33 0.00 0.00 177.39 175.63 2x9s s ARG 83 N -3.43 1.52 0.00 3.23 0.52 -1.26 -1.01 118.95 118.52 2x9s s ARG 83 Ca 0.00 -1.85 0.00 0.00 -0.52 0.00 0.00 55.73 53.36 2x9s s ARG 83 Cb 0.00 -0.09 0.00 0.00 0.52 0.00 0.00 34.95 35.38 2x9s s ARG 83 CO 0.00 -0.41 0.00 1.63 0.02 0.00 0.00 175.30 176.54 2x9s n LYS 84 N -0.52 0.00 -3.99 3.54 5.02 0.08 -4.58 118.16 117.71 2x9s n LYS 84 Ca 0.01 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.18 2x9s n LYS 84 Cb 0.65 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.64 2x9s n LYS 84 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2x9s s GLY 85 N 0.00 0.94 0.00 0.72 0.00 -1.26 -2.46 107.32 105.26 2x9s s GLY 85 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 44.72 43.58 2x9s s GLY 85 CO 0.00 -0.71 0.00 -0.13 0.00 0.00 0.00 173.10 172.26 2x9s n MET 86 N -0.51 0.00 0.00 2.90 0.00 -1.26 -4.91 117.12 113.34 2x9s n MET 86 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.68 2x9s n MET 86 Cb 0.61 -2.89 0.00 0.00 0.00 0.00 0.00 33.22 30.94 2x9s n MET 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 2x9s n PRO 87 N -0.70 0.13 -3.97 2.12 -0.04 -1.26 -4.95 135.00 126.33 2x9s n PRO 87 Ca 0.00 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.16 2x9s n PRO 87 Cb 0.50 0.00 -0.16 0.00 -0.04 0.00 0.00 33.50 33.80 2x9s n PRO 87 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2x9s s ILE 88 N 0.84 1.45 -0.23 0.52 -1.09 -1.26 -4.86 121.20 116.56 2x9s s ILE 88 Ca 0.00 -0.79 -0.26 0.00 -2.23 0.00 0.00 60.65 57.37 2x9s s ILE 88 Cb 0.00 -1.51 0.10 0.00 -1.58 0.00 0.00 42.46 39.47 2x9s s ILE 88 CO 0.00 0.23 0.86 -0.83 -1.23 0.00 0.00 174.94 173.97 2x9s s GLY 89 N 1.50 -0.37 -0.09 6.18 0.00 -0.90 -4.61 107.32 109.03 2x9s s GLY 89 Ca 0.01 2.17 -0.04 0.00 0.00 0.00 0.00 44.72 46.86 2x9s s GLY 89 CO -0.09 1.58 0.18 -2.27 0.00 0.00 0.00 173.10 172.50 2x9s s LEU 90 N -0.09 0.13 -0.08 0.66 2.96 -1.00 0.75 118.68 122.01 2x9s s LEU 90 Ca -0.01 0.38 -0.08 0.00 -0.22 0.00 0.00 54.13 54.21 2x9s s LEU 90 Cb -0.04 0.40 0.02 0.00 0.50 0.00 0.00 46.19 47.07 2x9s s LEU 90 CO -0.00 -0.21 0.22 -0.60 -1.32 0.00 0.00 176.35 174.43 2x9s s ARG 91 N 1.94 0.27 -0.09 1.98 3.00 -1.05 -0.56 118.95 124.43 2x9s s ARG 91 Ca -0.01 0.28 -0.04 0.00 -1.00 0.00 0.00 55.73 54.96 2x9s s ARG 91 Cb -0.12 0.13 0.05 0.00 0.00 0.00 0.00 34.95 35.01 2x9s s ARG 91 CO -0.06 -0.03 0.19 0.54 0.00 0.00 0.00 175.30 175.93 2x9s s VAL 92 N 0.06 -0.16 0.57 7.11 0.11 -1.26 -2.23 120.40 124.60 2x9s s VAL 92 Ca -0.01 0.24 -0.08 0.00 -2.93 0.00 0.00 61.98 59.20 2x9s s VAL 92 Cb -0.02 -0.32 -0.03 0.00 -1.53 0.00 0.00 36.38 34.49 2x9s s VAL 92 CO 0.00 0.10 0.92 -0.89 -3.33 0.00 0.00 175.10 171.91 2x9s s THR 93 N 1.68 4.49 0.05 5.04 2.01 -1.26 -2.89 115.64 124.76 2x9s s THR 93 Ca -0.04 0.44 -0.07 0.00 0.31 0.00 0.00 61.69 62.33 2x9s s THR 93 Cb -0.11 -3.76 -0.01 0.00 0.01 0.00 0.00 72.50 68.62 2x9s s THR 93 CO -0.07 -0.87 0.12 -0.76 -0.69 0.00 0.00 174.62 172.35 2x9s s LEU 94 N -5.00 1.70 -0.42 4.42 1.43 -1.23 -4.96 118.68 114.63 2x9s s LEU 94 Ca 0.52 -0.57 0.07 0.00 -1.03 0.00 0.00 54.13 53.11 2x9s s LEU 94 Cb -0.11 0.73 0.18 0.00 0.03 0.00 0.00 46.19 47.02 2x9s s LEU 94 CO 0.49 -0.58 0.58 -0.13 0.23 0.00 0.00 176.35 176.94 2x9s s ARG 95 N -3.01 0.83 0.92 1.70 0.52 -1.26 -3.28 118.95 115.37 2x9s s ARG 95 Ca -0.02 -0.62 0.00 0.00 -0.52 0.00 0.00 55.73 54.57 2x9s s ARG 95 Cb 0.01 -0.18 0.00 0.00 0.52 0.00 0.00 34.95 35.30 2x9s s ARG 95 CO -0.06 -1.22 0.00 -2.13 0.02 0.00 0.00 175.30 171.90 2x9s n ARG 96 N 4.05 -0.27 0.00 3.54 0.63 -1.26 -4.86 116.66 118.49 2x9s n ARG 96 Ca 0.13 0.18 0.00 0.00 -0.92 0.00 0.00 57.85 57.24 2x9s n ARG 96 Cb 0.54 -0.33 0.00 0.00 0.45 0.00 0.00 32.46 33.11 2x9s n ARG 96 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2x9s n ASP 97 N -0.73 0.00 0.00 6.15 9.92 -1.26 -0.21 116.55 130.41 2x9s n ASP 97 Ca 0.00 0.00 0.01 0.00 -0.53 0.00 0.00 54.79 54.27 2x9s n ASP 97 Cb 0.06 0.00 0.06 0.00 -0.64 0.00 0.00 41.12 40.60 2x9s n ASP 97 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2x9s n ARG 98 N 0.00 0.18 -0.09 -1.24 5.12 -1.26 -2.27 116.66 117.10 2x9s n ARG 98 Ca 0.00 0.00 -0.16 0.00 -1.93 0.00 0.00 57.85 55.76 2x9s n ARG 98 Cb 0.00 -1.17 -0.08 0.00 -1.16 0.00 0.00 32.46 30.05 2x9s n ARG 98 CO 0.00 0.00 0.00 -0.12 -1.93 0.00 0.00 177.63 175.58 2x9s n MET 99 N -0.67 0.53 -0.21 5.56 1.56 0.70 -4.20 117.12 120.39 2x9s n MET 99 Ca 0.02 0.56 -0.08 0.00 -0.27 0.00 0.00 57.70 57.92 2x9s n MET 99 Cb 0.01 -1.72 0.02 0.00 2.15 0.00 0.00 33.22 33.68 2x9s n MET 99 CO 0.00 0.00 0.00 -1.49 -0.73 0.00 0.00 175.97 173.75 2x9s h TRP 100 N -1.00 0.96 -1.27 1.12 4.06 -1.67 -2.41 115.95 115.74 2x9s h TRP 100 Ca -0.24 -0.10 0.43 0.00 2.06 0.00 0.00 58.89 61.04 2x9s h TRP 100 Cb 1.04 -0.27 -0.14 0.00 -1.00 0.00 0.00 29.16 28.79 2x9s h TRP 100 CO -0.01 0.81 0.80 0.82 -3.56 0.00 0.00 178.44 177.30 2x9s h ILE 101 N 0.83 0.11 0.19 1.49 2.04 -1.73 0.86 117.51 121.31 2x9s h ILE 101 Ca 0.19 -0.03 -0.01 0.00 1.00 0.00 0.00 64.86 66.01 2x9s h ILE 101 Cb 0.31 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.41 2x9s h ILE 101 CO -0.00 0.02 -0.09 0.15 0.00 0.00 0.00 178.15 178.22 2x9s h PHE 102 N 0.08 -0.24 -0.58 1.37 -0.00 -1.60 0.28 116.94 116.25 2x9s h PHE 102 Ca 0.83 -0.01 0.17 0.00 -0.00 0.00 0.00 57.97 58.96 2x9s h PHE 102 Cb 2.51 0.08 -0.02 0.00 -0.00 0.00 0.00 35.95 38.52 2x9s h PHE 102 CO -0.01 0.10 0.74 -0.07 -0.00 0.00 0.00 178.31 179.07 2x9s h LEU 103 N -0.97 0.00 0.00 0.59 3.38 0.20 0.23 115.31 118.75 2x9s h LEU 103 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2x9s h LEU 103 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2x9s h LEU 103 CO 0.04 0.00 -0.07 -0.08 0.09 0.00 0.00 178.44 178.42 2x9s h GLU 104 N 0.00 0.00 -1.19 1.13 4.57 0.59 -0.74 114.58 118.93 2x9s h GLU 104 Ca 0.27 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.45 2x9s h GLU 104 Cb 1.74 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.33 2x9s h GLU 104 CO -0.00 0.00 0.00 1.63 -1.18 0.00 0.00 179.01 179.46 2x9s n LYS 105 N -3.75 0.55 0.08 1.92 5.02 0.98 -2.73 118.16 120.23 2x9s n LYS 105 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 2x9s n LYS 105 Cb 0.04 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 33.81 2x9s n LYS 105 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2x9s n LEU 106 N 0.58 -0.50 0.00 -0.35 7.94 0.60 -3.97 117.00 121.31 2x9s n LEU 106 Ca 0.00 0.29 0.05 0.00 -1.11 0.00 0.00 56.01 55.24 2x9s n LEU 106 Cb 0.24 0.61 0.27 0.00 0.53 0.00 0.00 43.42 45.06 2x9s n LEU 106 CO 0.00 -0.54 0.51 0.18 -1.11 0.00 0.00 177.39 176.43 2x9s n LEU 107 N -2.99 0.00 0.00 -1.96 4.77 -0.29 -0.52 117.00 116.02 2x9s n LEU 107 Ca 0.00 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2x9s n LEU 107 Cb 0.00 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2x9s n LEU 107 CO 0.00 -0.02 -0.44 0.59 -1.33 0.00 0.00 177.39 176.19 2x9s n ASN 108 N -1.03 1.95 -0.12 -1.43 4.13 -1.11 -4.89 115.26 112.78 2x9s n ASN 108 Ca 0.07 0.00 -0.20 0.00 1.68 0.00 0.00 54.58 56.13 2x9s n ASN 108 Cb 0.04 0.00 -0.10 0.00 -1.54 0.00 0.00 39.78 38.18 2x9s n ASN 108 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 2x9s n VAL 109 N -2.63 1.30 0.00 2.41 0.31 -1.13 -4.62 118.33 113.96 2x9s n VAL 109 Ca 0.00 -0.43 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 2x9s n VAL 109 Cb 0.44 -1.51 0.00 0.00 -0.91 0.00 0.00 33.84 31.87 2x9s n VAL 109 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2x9s n ALA 110 N -3.52 0.00 -0.13 3.52 0.00 0.32 -0.67 120.51 120.03 2x9s n ALA 110 Ca -0.43 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.05 2x9s n ALA 110 Cb 0.89 0.00 0.08 0.00 0.00 0.00 0.00 19.45 20.42 2x9s n ALA 110 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2x9s n LEU 111 N -0.43 -0.09 0.17 0.00 4.77 -0.68 -1.52 117.00 119.21 2x9s n LEU 111 Ca 0.00 0.63 -0.16 0.00 -0.03 0.00 0.00 56.01 56.45 2x9s n LEU 111 Cb 0.00 -0.21 -0.09 0.00 -2.33 0.00 0.00 43.42 40.79 2x9s n LEU 111 CO 0.00 -0.62 0.52 -0.65 -1.33 0.00 0.00 177.39 175.30 2x9s h PRO 112 N 0.00 -0.77 -4.78 3.23 0.11 -1.82 -3.13 132.00 124.84 2x9s h PRO 112 Ca 0.20 0.05 -0.68 0.00 0.11 0.00 0.00 66.00 65.68 2x9s h PRO 112 Cb 0.36 0.18 -0.25 0.00 0.11 0.00 0.00 31.00 31.39 2x9s h PRO 112 CO -0.37 -0.52 -0.60 1.03 -0.21 0.00 0.00 178.00 177.34 2x9s s ARG 113 N -5.62 3.10 0.45 1.05 0.52 0.15 -4.47 118.95 114.13 2x9s s ARG 113 Ca -0.16 -0.86 -0.23 0.00 -0.52 0.00 0.00 55.73 53.96 2x9s s ARG 113 Cb 0.05 -3.43 -0.08 0.00 0.52 0.00 0.00 34.95 32.01 2x9s s ARG 113 CO 0.57 -0.46 1.15 0.42 0.02 0.00 0.00 175.30 176.99 2x9s s ILE 114 N 1.52 3.21 0.16 1.52 1.01 -0.58 -4.68 121.20 123.36 2x9s s ILE 114 Ca 0.03 0.92 -0.20 0.00 0.00 0.00 0.00 60.65 61.39 2x9s s ILE 114 Cb -0.17 -3.47 0.07 0.00 0.01 0.00 0.00 42.46 38.90 2x9s s ILE 114 CO 0.03 -0.00 1.29 0.54 0.00 0.00 0.00 174.94 176.80 2x9s n ARG 115 N -0.39 -0.28 0.00 2.79 1.74 -1.26 -4.58 116.66 114.68 2x9s n ARG 115 Ca 0.07 1.27 0.00 0.00 -0.77 0.00 0.00 57.85 58.42 2x9s n ARG 115 Cb 0.48 -1.88 0.00 0.00 -1.02 0.00 0.00 32.46 30.04 2x9s n ARG 115 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2x9s n ASP 116 N -5.14 0.00 -0.59 0.55 8.00 -1.26 -5.14 116.55 112.96 2x9s n ASP 116 Ca 0.05 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.55 2x9s n ASP 116 Cb 0.28 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.38 2x9s n ASP 116 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2x9s n PHE 117 N 0.00 0.00 -1.12 1.24 7.35 -1.26 -4.84 117.46 118.83 2x9s n PHE 117 Ca 0.00 0.00 -0.17 0.00 -0.76 0.00 0.00 57.45 56.52 2x9s n PHE 117 Cb 0.00 -0.59 -0.14 0.00 0.35 0.00 0.00 39.48 39.10 2x9s n PHE 117 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 2x9s n ARG 118 N -0.16 2.27 -0.81 -4.13 0.63 -1.26 -4.87 116.66 108.33 2x9s n ARG 118 Ca 0.00 -1.35 0.00 0.00 -0.92 0.00 0.00 57.85 55.58 2x9s n ARG 118 Cb 0.00 -2.11 0.00 0.00 0.45 0.00 0.00 32.46 30.80 2x9s n ARG 118 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2x9s n GLY 119 N 2.37 -3.58 3.04 5.14 0.00 -1.26 -3.53 105.19 107.36 2x9s n GLY 119 Ca 0.48 -1.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.23 2x9s n GLY 119 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2x9s n LEU 120 N -1.69 -2.14 -4.65 0.99 4.77 0.13 -3.59 117.00 110.82 2x9s n LEU 120 Ca 0.00 -0.16 -0.40 0.00 -0.03 0.00 0.00 56.01 55.42 2x9s n LEU 120 Cb 0.16 -0.70 -0.06 0.00 -2.33 0.00 0.00 43.42 40.49 2x9s n LEU 120 CO 0.00 -2.81 0.34 0.21 -1.33 0.00 0.00 177.39 173.79 2x9s s ASN 121 N -1.53 6.63 0.03 -1.43 3.84 -1.26 -0.68 114.94 120.53 2x9s s ASN 121 Ca 0.36 0.76 0.26 0.00 0.21 0.00 0.00 52.86 54.45 2x9s s ASN 121 Cb -0.02 -2.33 1.08 0.00 -0.55 0.00 0.00 41.25 39.43 2x9s s ASN 121 CO 0.45 -0.26 1.83 -0.81 -2.79 0.00 0.00 177.10 175.52 2x9s n PRO 122 N 5.09 0.04 -3.15 0.43 -0.04 -1.26 -3.97 135.00 132.14 2x9s n PRO 122 Ca -0.02 0.08 -0.29 0.00 -0.04 0.00 0.00 63.50 63.22 2x9s n PRO 122 Cb 0.50 -1.55 -0.05 0.00 -0.04 0.00 0.00 33.50 32.36 2x9s n PRO 122 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2x9s n ASN 123 N -1.61 4.54 0.00 3.54 0.23 -1.26 -4.57 115.26 116.13 2x9s n ASN 123 Ca 0.06 -3.55 0.00 0.00 -0.53 0.00 0.00 54.58 50.56 2x9s n ASN 123 Cb 0.32 -0.72 0.00 0.00 -2.08 0.00 0.00 39.78 37.30 2x9s n ASN 123 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 2x9s n SER 124 N 0.42 0.00 -0.12 0.53 7.64 -1.25 -4.82 113.62 116.01 2x9s n SER 124 Ca 0.31 -0.86 -0.26 0.00 1.01 0.00 0.00 58.87 59.07 2x9s n SER 124 Cb 0.38 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.48 2x9s n SER 124 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2x9s n PHE 125 N 0.00 0.40 0.00 1.43 3.01 -1.26 -4.01 117.46 117.03 2x9s n PHE 125 Ca 0.00 0.16 0.00 0.00 1.01 0.00 0.00 57.45 58.62 2x9s n PHE 125 Cb 0.22 -1.04 0.00 0.00 -0.01 0.00 0.00 39.48 38.64 2x9s n PHE 125 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2x9s n ASP 126 N -4.17 0.00 0.00 4.37 9.92 -1.26 -4.03 116.55 121.38 2x9s n ASP 126 Ca -0.46 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 53.80 2x9s n ASP 126 Cb 0.84 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.32 2x9s n ASP 126 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2x9s n GLY 127 N 0.00 2.96 3.55 0.44 0.00 -1.26 -4.61 105.19 106.27 2x9s n GLY 127 Ca 0.00 0.20 -0.52 0.00 0.00 0.00 0.00 46.02 45.70 2x9s n GLY 127 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x9s n ARG 128 N 7.83 1.29 0.00 1.61 5.12 -1.26 -3.95 116.66 127.30 2x9s n ARG 128 Ca 0.00 0.42 0.00 0.00 -1.93 0.00 0.00 57.85 56.34 2x9s n ARG 128 Cb 0.00 -2.40 0.00 0.00 -1.16 0.00 0.00 32.46 28.90 2x9s n ARG 128 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2x9s n GLY 129 N 5.57 -1.69 0.89 -0.13 0.00 -1.15 -4.81 105.19 103.87 2x9s n GLY 129 Ca 0.34 -0.57 0.11 0.00 0.00 0.00 0.00 46.02 45.90 2x9s n GLY 129 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2x9s n ASN 130 N -0.54 -5.16 -4.44 1.61 3.02 -1.26 -4.92 115.26 103.57 2x9s n ASN 130 Ca 0.00 0.73 -0.22 0.00 -0.03 0.00 0.00 54.58 55.07 2x9s n ASN 130 Cb 0.00 -2.95 -0.10 0.00 -0.61 0.00 0.00 39.78 36.12 2x9s n ASN 130 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2x9s s TYR 131 N -3.15 1.99 0.05 3.10 5.04 -1.26 -4.32 117.35 118.80 2x9s s TYR 131 Ca 0.00 -0.73 -0.27 0.00 -2.44 0.00 0.00 57.07 53.63 2x9s s TYR 131 Cb 0.00 -1.18 0.08 0.00 0.35 0.00 0.00 41.96 41.21 2x9s s TYR 131 CO 0.00 0.25 0.69 -0.80 -1.34 0.00 0.00 175.55 174.35 2x9s s ASN 132 N -3.47 -0.57 0.00 4.32 0.01 -1.26 -3.55 114.94 110.43 2x9s s ASN 132 Ca 0.31 0.29 0.00 0.00 -0.71 0.00 0.00 52.86 52.75 2x9s s ASN 132 Cb 0.05 0.54 0.00 0.00 0.41 0.00 0.00 41.25 42.24 2x9s s ASN 132 CO 0.13 -0.76 0.00 0.00 -1.51 0.00 0.00 177.10 174.96 2x9s n LEU 133 N 0.18 0.00 0.00 0.60 -0.00 -1.23 -4.93 117.00 111.62 2x9s n LEU 133 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.85 2x9s n LEU 133 Cb 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.03 2x9s n LEU 133 CO 0.16 0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.16 2x9s n GLY 134 N -0.55 3.94 1.07 1.47 0.00 -1.25 -0.01 105.19 109.86 2x9s n GLY 134 Ca 0.00 -1.14 -0.08 0.00 0.00 0.00 0.00 46.02 44.80 2x9s n GLY 134 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2x9s n LEU 135 N 0.00 0.00 0.00 0.99 4.32 -1.26 -4.79 117.00 116.26 2x9s n LEU 135 Ca 0.00 -1.00 0.00 0.00 -0.02 0.00 0.00 56.01 54.99 2x9s n LEU 135 Cb 0.00 0.36 0.00 0.00 -1.62 0.00 0.00 43.42 42.16 2x9s n LEU 135 CO 0.00 -0.16 -0.20 0.54 -1.22 0.00 0.00 177.39 176.35 2x9s n ARG 136 N -0.28 2.43 -3.72 3.23 1.74 -1.15 -3.49 116.66 115.42 2x9s n ARG 136 Ca -0.01 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.83 2x9s n ARG 136 Cb 0.20 -0.70 -0.02 0.00 -1.02 0.00 0.00 32.46 30.91 2x9s n ARG 136 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2x9s n GLU 137 N -0.90 0.90 0.00 5.56 1.02 -0.41 -2.76 120.64 124.06 2x9s n GLU 137 Ca 0.00 -2.88 0.00 0.00 -0.02 0.00 0.00 57.16 54.26 2x9s n GLU 137 Cb 0.12 0.51 0.00 0.00 -0.02 0.00 0.00 31.44 32.05 2x9s n GLU 137 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2x9s n GLN 138 N -1.32 3.43 0.23 3.49 10.64 -1.26 -4.41 117.38 128.18 2x9s n GLN 138 Ca -0.08 0.00 0.08 0.00 -1.83 0.00 0.00 57.00 55.17 2x9s n GLN 138 Cb 0.51 -0.29 0.54 0.00 -0.86 0.00 0.00 30.24 30.15 2x9s n GLN 138 CO 0.00 0.00 0.00 1.37 -1.83 0.00 0.00 177.06 176.60 2x9s h LEU 139 N 0.00 0.00 -1.62 2.61 8.10 -1.94 -2.82 115.31 119.65 2x9s h LEU 139 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.99 2x9s h LEU 139 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.22 2x9s h LEU 139 CO 0.00 0.23 0.38 0.16 -4.11 0.00 0.00 178.44 175.10 2x9s h ILE 140 N 0.00 0.00 -3.64 0.15 -0.00 -1.88 -3.36 117.51 108.78 2x9s h ILE 140 Ca -0.00 0.00 -0.60 0.00 -0.00 0.00 0.00 64.86 64.25 2x9s h ILE 140 Cb 0.51 0.54 -0.11 0.00 -0.00 0.00 0.00 36.82 37.76 2x9s h ILE 140 CO 0.03 0.00 0.56 -0.36 -0.00 0.00 0.00 178.15 178.38 2x9s s PHE 141 N -3.94 2.92 0.01 0.16 0.08 -1.07 -2.86 117.98 113.29 2x9s s PHE 141 Ca -0.03 0.34 -0.03 0.00 0.12 0.00 0.00 56.93 57.34 2x9s s PHE 141 Cb 0.07 -3.95 -0.01 0.00 -0.57 0.00 0.00 43.02 38.56 2x9s s PHE 141 CO 0.22 -1.11 0.78 -0.35 -0.10 0.00 0.00 175.22 174.67 2x9s n PRO 142 N 7.15 -0.04 0.00 0.24 -0.04 -1.26 -1.03 135.00 140.03 2x9s n PRO 142 Ca 0.06 0.78 0.00 0.00 -0.04 0.00 0.00 63.50 64.30 2x9s n PRO 142 Cb 0.48 -1.17 0.00 0.00 -0.04 0.00 0.00 33.50 32.78 2x9s n PRO 142 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2x9s n GLU 143 N -2.99 0.00 -4.26 0.54 0.00 -1.26 -4.65 120.64 108.02 2x9s n GLU 143 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 57.16 56.86 2x9s n GLU 143 Cb 0.02 -0.96 -0.09 0.00 0.00 0.00 0.00 31.44 30.41 2x9s n GLU 143 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.13 175.63 2x9s s ILE 144 N -1.20 3.69 0.00 3.84 1.10 -0.19 -4.84 121.20 123.60 2x9s s ILE 144 Ca 0.00 -1.01 0.00 0.00 -0.51 0.00 0.00 60.65 59.13 2x9s s ILE 144 Cb 0.00 -2.70 0.00 0.00 0.15 0.00 0.00 42.46 39.91 2x9s s ILE 144 CO 0.00 0.20 0.00 1.07 -2.11 0.00 0.00 174.94 174.10 2x9s n THR 145 N 0.93 0.00 0.00 4.00 5.66 -1.26 -4.98 114.28 118.62 2x9s n THR 145 Ca -0.13 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.87 2x9s n THR 145 Cb 0.52 -0.33 0.00 0.00 -1.55 0.00 0.00 70.33 68.97 2x9s n THR 145 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2x9s n TYR 146 N -0.21 0.00 -0.46 1.09 9.36 -1.26 -4.80 117.16 120.88 2x9s n TYR 146 Ca 0.00 0.00 -0.15 0.00 3.32 0.00 0.00 57.90 61.07 2x9s n TYR 146 Cb 0.00 0.00 0.08 0.00 -0.63 0.00 0.00 39.34 38.79 2x9s n TYR 146 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 2x9s n ASP 147 N 0.00 4.44 0.00 2.98 9.92 -1.26 -3.70 116.55 128.94 2x9s n ASP 147 Ca 0.00 -2.98 0.00 0.00 -0.53 0.00 0.00 54.79 51.28 2x9s n ASP 147 Cb 0.00 -0.80 0.00 0.00 -0.64 0.00 0.00 41.12 39.68 2x9s n ASP 147 CO 0.00 0.00 0.00 0.80 0.13 0.00 0.00 177.20 178.13 2x9s n MET 148 N -0.23 0.00 -4.89 -1.24 1.56 -1.26 -5.17 117.12 105.89 2x9s n MET 148 Ca 0.34 0.00 -0.29 0.00 -0.27 0.00 0.00 57.70 57.48 2x9s n MET 148 Cb 0.98 0.00 -0.15 0.00 2.15 0.00 0.00 33.22 36.20 2x9s n MET 148 CO 0.00 0.00 0.00 0.54 -0.73 0.00 0.00 175.97 175.78 2x9s s VAL 149 N 0.00 2.00 0.00 1.12 0.11 -1.24 -4.98 120.40 117.40 2x9s s VAL 149 Ca 0.00 -1.29 0.00 0.00 -2.93 0.00 0.00 61.98 57.76 2x9s s VAL 149 Cb 0.00 -1.71 0.00 0.00 -1.53 0.00 0.00 36.38 33.14 2x9s s VAL 149 CO 0.00 0.35 0.12 -0.90 -3.33 0.00 0.00 175.10 171.34 2x9s n ASP 150 N 1.90 0.00 -2.84 3.54 5.75 -1.26 -5.04 116.55 118.60 2x9s n ASP 150 Ca -0.17 -0.95 -0.10 0.00 -0.01 0.00 0.00 54.79 53.55 2x9s n ASP 150 Cb 0.52 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.63 2x9s n ASP 150 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2x9s n ALA 151 N 0.00 -0.78 -1.18 2.12 0.00 -1.26 -5.14 120.51 114.27 2x9s n ALA 151 Ca 0.00 -1.70 -0.32 0.00 0.00 0.00 0.00 53.44 51.41 2x9s n ALA 151 Cb 0.48 -1.26 0.10 0.00 0.00 0.00 0.00 19.45 18.77 2x9s n ALA 151 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 2x9s s LEU 152 N -0.55 3.13 0.00 0.00 2.34 -1.26 -5.00 118.68 117.34 2x9s s LEU 152 Ca 0.32 2.12 0.00 0.00 0.06 0.00 0.00 54.13 56.63 2x9s s LEU 152 Cb 0.19 -4.56 0.00 0.00 -0.56 0.00 0.00 46.19 41.26 2x9s s LEU 152 CO -0.20 -2.33 0.00 -2.11 -1.06 0.00 0.00 176.35 170.65 2x9s n ARG 153 N -3.27 0.00 -0.55 1.48 1.85 -1.11 -4.99 116.66 110.07 2x9s n ARG 153 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.96 2x9s n ARG 153 Cb 0.52 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.93 2x9s n ARG 153 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2x9s n GLY 154 N 0.00 5.22 3.21 2.89 0.00 -1.23 -1.29 105.19 113.99 2x9s n GLY 154 Ca 0.00 -1.59 0.04 0.00 0.00 0.00 0.00 46.02 44.47 2x9s n GLY 154 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2x9s s MET 155 N 0.18 0.14 0.04 1.61 0.23 -1.26 -4.74 119.30 115.51 2x9s s MET 155 Ca 0.00 0.30 -0.31 0.00 -1.03 0.00 0.00 55.69 54.66 2x9s s MET 155 Cb 0.00 0.17 -0.07 0.00 -1.53 0.00 0.00 34.83 33.41 2x9s s MET 155 CO 0.00 -0.11 1.50 -0.51 -2.03 0.00 0.00 175.02 173.87 2x9s s ASP 156 N 2.63 6.75 -0.17 -1.18 1.01 -0.97 -3.94 116.67 120.80 2x9s s ASP 156 Ca -0.02 2.29 0.01 0.00 0.71 0.00 0.00 52.55 55.53 2x9s s ASP 156 Cb -0.07 -2.57 0.01 0.00 1.01 0.00 0.00 42.92 41.31 2x9s s ASP 156 CO -0.13 -0.77 -0.19 -0.63 0.21 0.00 0.00 175.17 173.66 2x9s s ILE 157 N 2.29 2.23 0.30 0.77 1.01 0.98 0.36 121.20 129.13 2x9s s ILE 157 Ca 0.68 -0.90 -0.00 0.00 0.00 0.00 0.00 60.65 60.43 2x9s s ILE 157 Cb -0.35 -1.93 0.06 0.00 0.01 0.00 0.00 42.46 40.25 2x9s s ILE 157 CO 0.29 0.53 0.41 0.00 0.00 0.00 0.00 174.94 176.17 2x9s n ALA 158 N 4.42 0.06 -2.68 9.38 0.00 0.18 -3.53 120.51 128.34 2x9s n ALA 158 Ca -0.20 -0.79 -0.03 0.00 0.00 0.00 0.00 53.44 52.43 2x9s n ALA 158 Cb 0.51 0.13 0.03 0.00 0.00 0.00 0.00 19.45 20.11 2x9s n ALA 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2x9s s VAL 159 N -1.12 -0.17 0.46 0.00 0.11 -1.23 -3.83 120.40 114.61 2x9s s VAL 159 Ca 0.27 -0.15 -0.24 0.00 -2.93 0.00 0.00 61.98 58.93 2x9s s VAL 159 Cb -0.01 0.00 -0.07 0.00 -1.53 0.00 0.00 36.38 34.76 2x9s s VAL 159 CO 0.18 0.00 1.31 -0.69 -3.33 0.00 0.00 175.10 172.57 2x9s s VAL 160 N 1.11 2.46 0.22 2.04 1.01 -0.24 -3.99 120.40 123.01 2x9s s VAL 160 Ca 0.22 0.38 -0.05 0.00 0.00 0.00 0.00 61.98 62.54 2x9s s VAL 160 Cb 0.12 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.26 2x9s s VAL 160 CO -0.11 0.03 0.24 -0.89 0.00 0.00 0.00 175.10 174.37 2x9s s THR 161 N -1.31 0.00 -2.14 3.92 2.01 -1.26 -3.12 115.64 113.73 2x9s s THR 161 Ca 0.63 -1.81 0.21 0.00 0.31 0.00 0.00 61.69 61.02 2x9s s THR 161 Cb -0.38 -2.41 0.52 0.00 0.01 0.00 0.00 72.50 70.24 2x9s s THR 161 CO 0.47 0.00 1.67 0.41 -0.69 0.00 0.00 174.62 176.49 2x9s n THR 162 N -0.31 0.09 -3.14 -0.82 -1.04 -1.17 -4.83 114.28 103.06 2x9s n THR 162 Ca 0.01 -0.15 -0.39 0.00 -2.04 0.00 0.00 64.05 61.47 2x9s n THR 162 Cb 0.65 0.01 -0.05 0.00 -1.82 0.00 0.00 70.33 69.12 2x9s n THR 162 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2x9s s ALA 163 N -1.91 3.41 0.00 2.41 0.00 -1.26 -4.78 121.76 119.62 2x9s s ALA 163 Ca 0.31 0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.33 2x9s s ALA 163 Cb 0.16 -2.84 0.00 0.00 0.00 0.00 0.00 23.12 20.44 2x9s s ALA 163 CO 0.25 0.01 0.00 0.39 0.00 0.00 0.00 175.76 176.41 2x9s n GLU 164 N 3.36 0.00 -2.46 0.00 4.71 -1.26 -4.56 120.64 120.43 2x9s n GLU 164 Ca -0.04 0.23 -0.41 0.00 -0.01 0.00 0.00 57.16 56.93 2x9s n GLU 164 Cb 0.51 -0.68 -0.04 0.00 -1.01 0.00 0.00 31.44 30.22 2x9s n GLU 164 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 2x9s s THR 165 N -0.70 3.76 0.62 2.62 -4.23 -1.26 -2.93 115.64 113.52 2x9s s THR 165 Ca 0.00 1.50 0.30 0.00 -1.18 0.00 0.00 61.69 62.30 2x9s s THR 165 Cb 0.00 -3.96 0.35 0.00 1.34 0.00 0.00 72.50 70.24 2x9s s THR 165 CO 0.00 0.25 1.98 -2.24 -0.54 0.00 0.00 174.62 174.07 2x9s h ASP 166 N 5.19 0.00 0.38 3.99 2.03 -1.88 -1.89 116.42 124.25 2x9s h ASP 166 Ca -0.44 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 55.84 2x9s h ASP 166 Cb 1.21 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.72 2x9s h ASP 166 CO 0.73 0.00 -0.18 -0.33 -1.03 0.00 0.00 179.24 178.43 2x9s h GLU 167 N 0.00 -0.49 0.00 4.15 3.07 -1.94 1.24 114.58 120.61 2x9s h GLU 167 Ca 0.10 0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.99 2x9s h GLU 167 Cb 0.77 0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.79 2x9s h GLU 167 CO -0.00 -0.20 0.26 0.93 -1.40 0.00 0.00 179.01 178.60 2x9s h GLU 168 N -0.77 0.00 0.05 2.33 5.08 -1.74 0.43 114.58 119.96 2x9s h GLU 168 Ca -0.05 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 57.96 2x9s h GLU 168 Cb 0.52 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.73 2x9s h GLU 168 CO 0.09 0.00 -1.95 0.00 -1.00 0.00 0.00 179.01 176.15 2x9s n ALA 169 N -1.70 1.00 -0.33 3.43 0.00 -0.70 -4.11 120.51 118.10 2x9s n ALA 169 Ca -0.01 -0.73 0.23 0.00 0.00 0.00 0.00 53.44 52.93 2x9s n ALA 169 Cb 0.29 -0.42 0.44 0.00 0.00 0.00 0.00 19.45 19.75 2x9s n ALA 169 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2x9s h ARG 170 N -0.42 0.07 0.00 0.00 9.65 0.62 -2.09 114.38 122.20 2x9s h ARG 170 Ca -0.47 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.40 2x9s h ARG 170 Cb 1.73 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 30.30 2x9s h ARG 170 CO -0.11 0.05 0.00 0.00 2.80 0.00 0.00 179.97 182.71 2x9s n ALA 171 N -2.61 0.00 -0.10 2.80 0.00 -0.95 -1.90 120.51 117.74 2x9s n ALA 171 Ca 0.30 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.73 2x9s n ALA 171 Cb 0.99 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.44 2x9s n ALA 171 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2x9s n LEU 172 N 0.00 -0.21 0.02 0.00 0.00 -1.18 -0.13 117.00 115.49 2x9s n LEU 172 Ca 0.00 0.45 -0.13 0.00 0.00 0.00 0.00 56.01 56.34 2x9s n LEU 172 Cb 0.00 -0.09 -0.09 0.00 0.00 0.00 0.00 43.42 43.24 2x9s n LEU 172 CO 0.00 -0.39 0.65 -0.07 0.00 0.00 0.00 177.39 177.58 2x9s h LEU 173 N 0.00 -0.05 -1.84 -1.96 3.38 -1.55 -2.60 115.31 110.70 2x9s h LEU 173 Ca 0.07 -0.38 0.15 0.00 0.09 0.00 0.00 57.88 57.81 2x9s h LEU 173 Cb 0.13 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 2x9s h LEU 173 CO -0.25 0.36 0.43 -0.08 0.09 0.00 0.00 178.44 178.99 2x9s h GLU 174 N -0.46 0.16 -1.88 1.13 4.81 0.19 -0.08 114.58 118.44 2x9s h GLU 174 Ca -0.01 -0.01 -0.29 0.00 -0.13 0.00 0.00 59.36 58.93 2x9s h GLU 174 Cb 0.42 -0.04 -0.11 0.00 0.63 0.00 0.00 28.75 29.66 2x9s h GLU 174 CO 0.01 0.10 0.12 1.28 -0.73 0.00 0.00 179.01 179.79 2x9s n LEU 175 N -4.41 5.95 -0.11 1.64 4.77 0.68 -3.49 117.00 122.02 2x9s n LEU 175 Ca 0.12 -3.36 0.00 0.00 -0.03 0.00 0.00 56.01 52.73 2x9s n LEU 175 Cb 0.58 -1.23 0.00 0.00 -2.33 0.00 0.00 43.42 40.44 2x9s n LEU 175 CO 0.35 1.48 0.05 0.18 -1.33 0.00 0.00 177.39 178.13 2x9s n LEU 176 N 1.30 0.00 0.00 2.23 4.77 -0.04 -4.85 117.00 120.41 2x9s n LEU 176 Ca 0.35 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 2x9s n LEU 176 Cb 0.65 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 2x9s n LEU 176 CO 0.23 0.55 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 2x9s n GLY 177 N 0.00 0.70 2.66 -0.72 0.00 -1.23 -5.06 105.19 101.54 2x9s n GLY 177 Ca 0.00 -0.31 -0.29 0.00 0.00 0.00 0.00 46.02 45.42 2x9s n GLY 177 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2x9s s PHE 178 N -0.80 1.98 0.85 1.61 0.40 -1.25 -4.82 117.98 115.95 2x9s s PHE 178 Ca 0.00 -2.50 -0.12 0.00 -0.60 0.00 0.00 56.93 53.70 2x9s s PHE 178 Cb 0.00 -1.76 0.09 0.00 0.51 0.00 0.00 43.02 41.87 2x9s s PHE 178 CO 0.00 -0.75 1.10 -0.35 0.70 0.00 0.00 175.22 175.92 2x9s n PRO 179 N 3.17 -0.04 -4.04 0.24 -0.04 -1.26 -4.80 135.00 128.22 2x9s n PRO 179 Ca 0.15 0.06 -0.11 0.00 -0.04 0.00 0.00 63.50 63.56 2x9s n PRO 179 Cb 0.37 -2.35 -0.11 0.00 -0.04 0.00 0.00 33.50 31.37 2x9s n PRO 179 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2x9s s PHE 180 N -2.29 0.55 -0.37 0.54 0.40 -1.26 -0.69 117.98 114.86 2x9s s PHE 180 Ca 0.70 -0.55 0.07 0.00 -0.60 0.00 0.00 56.93 56.55 2x9s s PHE 180 Cb -0.27 -0.34 0.62 0.00 0.51 0.00 0.00 43.02 43.53 2x9s s PHE 180 CO 0.54 -0.13 1.73 -2.13 0.70 0.00 0.00 175.22 175.94 2x9s n ARG 181 N 1.38 2.29 0.00 0.44 0.63 0.14 -4.56 116.66 116.98 2x9s n ARG 181 Ca -0.22 -3.08 0.00 0.00 -0.92 0.00 0.00 57.85 53.63 2x9s n ARG 181 Cb 0.55 -2.05 0.00 0.00 0.45 0.00 0.00 32.46 31.42 2x9s n ARG 181 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75