#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kli h ASP 32 N 0.00 -0.10 -0.11 1.96 2.03 -2.00 -2.75 116.42 115.45 2kli h ASP 32 Ca 0.00 -0.14 -0.00 0.00 -0.73 0.00 0.00 57.03 56.16 2kli h ASP 32 Cb 0.00 0.03 -0.01 0.00 -0.83 0.00 0.00 39.33 38.52 2kli h ASP 32 CO 0.00 0.07 0.06 1.56 -1.03 0.00 0.00 179.24 179.91 2kli h GLN 33 N -0.27 0.15 -0.85 4.15 4.20 -2.02 -3.03 115.11 117.44 2kli h GLN 33 Ca -0.01 -0.02 0.06 0.00 0.06 0.00 0.00 58.65 58.74 2kli h GLN 33 Cb 0.23 -0.03 -0.05 0.00 0.30 0.00 0.00 27.48 27.93 2kli h GLN 33 CO 0.02 0.17 0.55 0.82 -0.67 0.00 0.00 178.83 179.72 2kli h ILE 34 N 0.09 1.07 0.00 2.54 1.08 -1.96 -1.79 117.51 118.54 2kli h ILE 34 Ca 0.04 -0.33 -0.04 0.00 -0.39 0.00 0.00 64.86 64.14 2kli h ILE 34 Cb 0.06 0.02 -0.01 0.00 -3.07 0.00 0.00 36.82 33.82 2kli h ILE 34 CO -0.01 0.18 -0.19 -0.07 -0.69 0.00 0.00 178.15 177.37 2kli h LEU 35 N 0.97 0.00 -0.53 1.44 3.38 -1.37 -2.72 115.31 116.47 2kli h LEU 35 Ca 0.36 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.27 2kli h LEU 35 Cb 0.17 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2kli h LEU 35 CO -0.12 0.19 0.10 0.03 0.09 0.00 0.00 178.44 178.73 2kli h ARG 36 N 0.00 0.87 -0.00 1.13 3.08 -1.21 0.36 114.38 118.60 2kli h ARG 36 Ca -0.00 -0.23 -0.14 0.00 0.07 0.00 0.00 59.98 59.68 2kli h ARG 36 Cb 0.71 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.64 2kli h ARG 36 CO 0.02 0.84 -0.67 0.00 -1.07 0.00 0.00 179.97 179.10 2kli h ALA 37 N 0.99 0.89 -0.14 0.04 0.00 -1.53 -2.97 119.26 116.55 2kli h ALA 37 Ca 0.16 -0.61 -0.05 0.00 0.00 0.00 0.00 54.91 54.42 2kli h ALA 37 Cb 0.38 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2kli h ALA 37 CO 0.01 0.83 -0.12 1.79 0.00 0.00 0.00 179.25 181.76 2kli h THR 38 N 0.01 1.34 -0.86 0.00 1.35 -1.17 -2.74 112.91 110.85 2kli h THR 38 Ca -0.01 -1.24 0.12 0.00 -0.55 0.00 0.00 66.41 64.73 2kli h THR 38 Cb 1.18 1.86 -0.06 0.00 -1.73 0.00 0.00 68.15 69.39 2kli h THR 38 CO 0.09 0.36 0.56 0.58 -0.25 0.00 0.00 175.52 176.86 2kli h VAL 39 N -0.05 0.90 -0.47 6.82 2.07 -0.91 -0.97 116.25 123.65 2kli h VAL 39 Ca 0.02 -0.26 -0.11 0.00 0.82 0.00 0.00 66.70 67.18 2kli h VAL 39 Cb 0.63 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 2kli h VAL 39 CO 0.03 0.14 -0.16 -0.33 0.02 0.00 0.00 177.57 177.27 2kli h GLU 40 N 0.75 0.91 -0.72 1.57 5.08 -1.43 -2.74 114.58 118.00 2kli h GLU 40 Ca 0.41 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 2kli h GLU 40 Cb 0.56 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 2kli h GLU 40 CO -0.18 1.00 0.35 0.93 -1.00 0.00 0.00 179.01 180.11 2kli h GLU 41 N 0.80 1.02 -0.45 2.33 4.39 -0.88 -2.29 114.58 119.50 2kli h GLU 41 Ca 0.12 -0.14 -0.12 0.00 0.34 0.00 0.00 59.36 59.56 2kli h GLU 41 Cb 0.69 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 2kli h GLU 41 CO 0.05 0.80 -0.18 0.28 -1.16 0.00 0.00 179.01 178.80 2kli h VAL 42 N 1.00 1.27 -0.09 3.13 2.07 -1.39 -2.60 116.25 119.65 2kli h VAL 42 Ca 0.25 -1.32 0.02 0.00 0.82 0.00 0.00 66.70 66.47 2kli h VAL 42 Cb 0.10 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 2kli h VAL 42 CO -0.03 0.45 -0.03 -0.09 0.02 0.00 0.00 177.57 177.89 2kli h ARG 43 N 0.76 -0.02 -0.99 1.57 1.12 -1.28 1.28 114.38 116.83 2kli h ARG 43 Ca 0.11 0.00 0.01 0.00 -1.11 0.00 0.00 59.98 58.99 2kli h ARG 43 Cb 0.74 0.00 -0.05 0.00 -0.01 0.00 0.00 29.97 30.66 2kli h ARG 43 CO 0.06 -0.01 0.65 0.00 -3.11 0.00 0.00 179.97 177.56 2kli h ALA 44 N 1.07 1.30 0.04 2.80 0.00 -1.40 1.84 119.26 124.90 2kli h ALA 44 Ca 0.05 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2kli h ALA 44 Cb 0.09 -0.40 0.00 0.00 0.00 0.00 0.00 17.79 17.48 2kli h ALA 44 CO -0.10 0.65 -0.02 0.35 0.00 0.00 0.00 179.25 180.13 2kli h PHE 45 N 1.34 -0.05 0.00 0.00 3.57 -1.04 -3.23 116.94 117.53 2kli h PHE 45 Ca 0.36 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.86 2kli h PHE 45 Cb -0.15 0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.60 2kli h PHE 45 CO -0.00 0.59 0.00 -0.11 -2.23 0.00 0.00 178.31 176.56 2kli n LEU 46 N -4.73 0.00 -0.85 0.59 7.94 0.44 -4.85 117.00 115.54 2kli n LEU 46 Ca -0.07 0.18 -0.05 0.00 -1.11 0.00 0.00 56.01 54.96 2kli n LEU 46 Cb 0.32 -0.18 -0.02 0.00 0.53 0.00 0.00 43.42 44.07 2kli n LEU 46 CO 0.26 -0.03 -0.04 0.61 -1.11 0.00 0.00 177.39 177.07 2kli n GLY 47 N 0.79 0.44 3.80 -3.96 0.00 0.62 -4.88 105.19 102.01 2kli n GLY 47 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 2kli n GLY 47 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2kli s THR 48 N -1.20 4.07 -0.81 2.61 -1.32 -1.16 -4.94 115.64 112.89 2kli s THR 48 Ca 0.00 1.46 0.17 0.00 -1.21 0.00 0.00 61.69 62.11 2kli s THR 48 Cb 0.00 -3.70 0.15 0.00 -1.51 0.00 0.00 72.50 67.45 2kli s THR 48 CO 0.00 -0.11 1.52 -0.90 -2.21 0.00 0.00 174.62 172.92 2kli n ASP 49 N -0.25 0.23 -3.57 8.08 5.75 -1.26 -4.68 116.55 120.84 2kli n ASP 49 Ca 0.06 0.56 -0.01 0.00 -0.01 0.00 0.00 54.79 55.38 2kli n ASP 49 Cb 0.52 -0.61 -0.05 0.00 -1.03 0.00 0.00 41.12 39.95 2kli n ASP 49 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 2kli s ARG 50 N -3.12 0.49 -0.01 0.11 3.52 -1.18 0.35 118.95 119.11 2kli s ARG 50 Ca 0.05 1.15 0.00 0.00 -0.13 0.00 0.00 55.73 56.80 2kli s ARG 50 Cb 0.09 0.60 0.02 0.00 -1.56 0.00 0.00 34.95 34.09 2kli s ARG 50 CO 0.29 -0.15 0.02 0.14 -0.81 0.00 0.00 175.30 174.78 2kli s VAL 51 N 2.49 -0.04 0.08 7.11 -7.23 -1.19 -0.78 120.40 120.84 2kli s VAL 51 Ca -0.06 0.15 -0.07 0.00 -1.81 0.00 0.00 61.98 60.19 2kli s VAL 51 Cb -0.09 -0.06 -0.01 0.00 0.56 0.00 0.00 36.38 36.78 2kli s VAL 51 CO -0.18 0.06 0.14 -1.59 -0.31 0.00 0.00 175.10 173.22 2kli s LYS 52 N 0.72 0.78 -0.15 4.82 -2.85 -1.07 -2.01 119.74 119.99 2kli s LYS 52 Ca -0.06 -1.00 -0.09 0.00 -1.00 0.00 0.00 55.97 53.83 2kli s LYS 52 Cb -0.09 0.31 -0.04 0.00 -2.06 0.00 0.00 37.83 35.95 2kli s LYS 52 CO -0.02 -0.23 0.15 0.08 0.10 0.00 0.00 175.35 175.43 2kli s VAL 53 N -3.79 5.45 -0.20 1.79 1.01 -1.22 -3.01 120.40 120.43 2kli s VAL 53 Ca 0.05 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.26 2kli s VAL 53 Cb 0.05 -3.44 0.02 0.00 0.00 0.00 0.00 36.38 33.01 2kli s VAL 53 CO -0.10 0.54 -0.15 -0.47 0.00 0.00 0.00 175.10 174.92 2kli s TYR 54 N -0.45 2.89 0.38 5.22 5.04 0.15 -3.82 117.35 126.77 2kli s TYR 54 Ca 0.13 -1.62 0.06 0.00 -2.44 0.00 0.00 57.07 53.20 2kli s TYR 54 Cb -0.12 -1.96 -0.00 0.00 0.35 0.00 0.00 41.96 40.23 2kli s TYR 54 CO 0.02 -0.77 0.53 0.50 -1.34 0.00 0.00 175.55 174.49 2kli s ARG 55 N 1.30 2.99 -0.03 4.97 3.52 -1.08 0.20 118.95 130.82 2kli s ARG 55 Ca 0.03 -1.04 0.02 0.00 -0.13 0.00 0.00 55.73 54.61 2kli s ARG 55 Cb -0.14 -2.77 0.01 0.00 -1.56 0.00 0.00 34.95 30.49 2kli s ARG 55 CO -0.10 -0.10 -0.09 0.12 -0.81 0.00 0.00 175.30 174.32 2kli s PHE 56 N -2.28 0.97 -0.19 5.12 5.36 -1.16 -3.37 117.98 122.43 2kli s PHE 56 Ca 0.49 -0.27 -0.08 0.00 -0.96 0.00 0.00 56.93 56.11 2kli s PHE 56 Cb -0.10 -0.72 -0.04 0.00 -0.34 0.00 0.00 43.02 41.82 2kli s PHE 56 CO 0.32 -0.14 0.09 0.34 -1.46 0.00 0.00 175.22 174.38 2kli s ASP 57 N 0.37 5.82 0.58 6.13 -1.08 0.69 -4.97 116.67 124.21 2kli s ASP 57 Ca -0.06 0.12 0.33 0.00 -0.52 0.00 0.00 52.55 52.42 2kli s ASP 57 Cb -0.10 -2.01 1.31 0.00 -1.46 0.00 0.00 42.92 40.66 2kli s ASP 57 CO 0.01 0.17 1.59 -0.65 0.52 0.00 0.00 175.17 176.81 2kli h PRO 58 N 6.75 0.00 0.00 4.34 0.11 -2.01 0.91 132.00 142.10 2kli h PRO 58 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2kli h PRO 58 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2kli h PRO 58 CO 0.72 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.90 2kli n GLU 59 N -3.63 0.18 0.00 1.05 1.02 -1.26 -4.87 120.64 113.12 2kli n GLU 59 Ca 0.23 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.44 2kli n GLU 59 Cb 1.32 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 31.24 2kli n GLU 59 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2kli n GLY 60 N 0.86 0.91 3.82 0.62 0.00 0.32 -5.07 105.19 106.65 2kli n GLY 60 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 2kli n GLY 60 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2kli s HIS 61 N -2.11 3.71 0.00 1.61 3.76 -1.22 -0.31 115.29 120.73 2kli s HIS 61 Ca 0.00 1.25 0.07 0.00 -0.15 0.00 0.00 55.06 56.24 2kli s HIS 61 Cb 0.00 -2.50 -0.02 0.00 1.11 0.00 0.00 32.58 31.17 2kli s HIS 61 CO 0.00 0.47 -0.23 0.20 -0.85 0.00 0.00 174.74 174.33 2kli s GLY 62 N -1.45 1.17 0.05 -2.22 0.00 0.69 -0.23 107.32 105.34 2kli s GLY 62 Ca 0.36 -1.05 0.06 0.00 0.00 0.00 0.00 44.72 44.09 2kli s GLY 62 CO 0.20 -0.90 -0.18 -0.51 0.00 0.00 0.00 173.10 171.71 2kli s THR 63 N -0.63 1.43 -0.29 0.90 -4.23 -1.22 0.28 115.64 111.89 2kli s THR 63 Ca 0.09 -1.20 -0.15 0.00 -1.18 0.00 0.00 61.69 59.25 2kli s THR 63 Cb -0.09 -1.28 -0.03 0.00 1.34 0.00 0.00 72.50 72.44 2kli s THR 63 CO 0.00 0.05 0.38 -0.69 -0.54 0.00 0.00 174.62 173.82 2kli s VAL 64 N -0.92 5.16 -1.74 2.29 1.01 -1.22 -2.63 120.40 122.35 2kli s VAL 64 Ca 0.04 0.47 0.15 0.00 0.00 0.00 0.00 61.98 62.64 2kli s VAL 64 Cb -0.09 -3.74 0.08 0.00 0.00 0.00 0.00 36.38 32.63 2kli s VAL 64 CO 0.02 0.09 0.93 1.33 0.00 0.00 0.00 175.10 177.46 2kli n VAL 65 N 5.16 0.00 -3.55 2.92 0.24 -1.25 -3.34 118.33 118.51 2kli n VAL 65 Ca -0.08 -0.45 -0.17 0.00 -2.04 0.00 0.00 64.34 61.60 2kli n VAL 65 Cb 0.50 1.27 -0.06 0.00 -1.47 0.00 0.00 33.84 34.08 2kli n VAL 65 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2kli s ALA 66 N -1.46 -1.61 -0.29 2.33 0.00 -1.26 -4.55 121.76 114.93 2kli s ALA 66 Ca 0.16 1.12 -0.17 0.00 0.00 0.00 0.00 51.96 53.07 2kli s ALA 66 Cb 0.13 0.05 0.14 0.00 0.00 0.00 0.00 23.12 23.44 2kli s ALA 66 CO 0.25 -0.37 0.97 -1.83 0.00 0.00 0.00 175.76 174.78 2kli s GLU 67 N -1.34 0.41 0.03 0.00 1.03 -1.26 -3.42 118.70 114.15 2kli s GLU 67 Ca -0.11 0.68 0.06 0.00 0.03 0.00 0.00 54.97 55.63 2kli s GLU 67 Cb -0.01 0.10 -0.03 0.00 -0.80 0.00 0.00 34.13 33.39 2kli s GLU 67 CO 0.08 -0.08 -0.14 0.00 -1.33 0.00 0.00 175.26 173.79 2kli s ALA 68 N 1.21 2.73 0.02 -0.84 0.00 -0.85 -4.98 121.76 119.05 2kli s ALA 68 Ca -0.07 -1.14 0.03 0.00 0.00 0.00 0.00 51.96 50.78 2kli s ALA 68 Cb -0.04 -0.86 -0.02 0.00 0.00 0.00 0.00 23.12 22.20 2kli s ALA 68 CO -0.14 0.59 -0.10 -0.98 0.00 0.00 0.00 175.76 175.13 2kli s ARG 69 N -1.44 0.70 -0.39 0.00 1.70 -1.26 -3.18 118.95 115.08 2kli s ARG 69 Ca 0.16 -0.56 -0.23 0.00 -0.47 0.00 0.00 55.73 54.63 2kli s ARG 69 Cb -0.11 -0.63 0.01 0.00 -0.57 0.00 0.00 34.95 33.65 2kli s ARG 69 CO 0.06 0.16 0.77 0.20 -1.08 0.00 0.00 175.30 175.41 2kli s GLY 70 N -0.86 1.65 -0.46 3.88 0.00 1.09 -4.11 107.32 108.49 2kli s GLY 70 Ca -0.01 -0.77 0.00 0.00 0.00 0.00 0.00 44.72 43.94 2kli s GLY 70 CO 0.00 1.74 0.00 0.61 0.00 0.00 0.00 173.10 175.45 2kli n GLY 71 N 4.68 0.42 2.24 0.20 0.00 -1.26 0.17 105.19 111.63 2kli n GLY 71 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.93 2kli n GLY 71 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2kli n GLU 72 N -1.18 -0.93 0.25 1.61 2.13 -1.26 -4.92 120.64 116.34 2kli n GLU 72 Ca -0.04 0.61 -0.16 0.00 0.66 0.00 0.00 57.16 58.23 2kli n GLU 72 Cb 0.15 -4.76 -0.08 0.00 0.27 0.00 0.00 31.44 27.03 2kli n GLU 72 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 2kli h ARG 73 N 0.00 -0.66 -6.17 5.31 2.43 0.14 -3.41 114.38 112.02 2kli h ARG 73 Ca -0.28 0.05 -0.58 0.00 -0.81 0.00 0.00 59.98 58.36 2kli h ARG 73 Cb 1.16 0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 30.83 2kli h ARG 73 CO 0.34 -0.44 -0.31 -0.51 -1.51 0.00 0.00 179.97 177.54 2kli s LEU 74 N -10.15 4.27 0.94 3.80 1.43 -1.26 -5.07 118.68 112.64 2kli s LEU 74 Ca -0.17 0.60 -0.12 0.00 -1.03 0.00 0.00 54.13 53.41 2kli s LEU 74 Cb 0.05 -3.31 0.16 0.00 0.03 0.00 0.00 46.19 43.12 2kli s LEU 74 CO 0.63 0.05 1.12 -2.16 0.23 0.00 0.00 176.35 176.23 2kli s PRO 75 N -2.64 0.87 -0.13 1.29 0.04 -1.26 -4.81 135.00 128.35 2kli s PRO 75 Ca 0.41 0.35 -0.20 0.00 0.04 0.00 0.00 61.00 61.60 2kli s PRO 75 Cb -0.12 -1.80 -0.04 0.00 0.04 0.00 0.00 34.50 32.58 2kli s PRO 75 CO 0.24 -2.39 0.57 0.45 0.04 0.00 0.00 177.00 175.91 2kli s SER 76 N -3.84 6.74 0.00 6.66 0.15 -1.26 -4.94 113.70 117.20 2kli s SER 76 Ca 0.64 0.89 0.24 0.00 0.70 0.00 0.00 55.95 58.42 2kli s SER 76 Cb -0.16 -2.33 0.23 0.00 -1.71 0.00 0.00 66.02 62.05 2kli s SER 76 CO 0.55 -0.12 1.27 0.18 1.20 0.00 0.00 173.24 176.32 2kli n LEU 77 N 4.17 2.58 -4.75 3.45 4.77 -1.26 -4.98 117.00 120.98 2kli n LEU 77 Ca -0.04 -0.88 -0.41 0.00 -0.03 0.00 0.00 56.01 54.65 2kli n LEU 77 Cb 0.51 -0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.58 2kli n LEU 77 CO 0.44 0.44 1.22 -0.22 -1.33 0.00 0.00 177.39 177.94 2kli s LEU 78 N -2.13 4.35 0.00 2.23 2.96 -1.26 -1.93 118.68 122.90 2kli s LEU 78 Ca 0.26 2.90 0.00 0.00 -0.22 0.00 0.00 54.13 57.08 2kli s LEU 78 Cb 0.20 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 43.25 2kli s LEU 78 CO 0.38 -0.88 0.00 0.61 -1.32 0.00 0.00 176.35 175.14 2kli n GLY 79 N 2.11 0.90 3.75 7.98 0.00 -1.21 -5.04 105.19 113.67 2kli n GLY 79 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 2kli n GLY 79 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2kli s LEU 80 N 0.00 4.26 -0.24 0.99 1.02 -0.81 -4.99 118.68 118.91 2kli s LEU 80 Ca 0.00 0.41 -0.19 0.00 0.02 0.00 0.00 54.13 54.36 2kli s LEU 80 Cb 0.00 -2.23 -0.02 0.00 0.02 0.00 0.00 46.19 43.96 2kli s LEU 80 CO 0.00 0.18 0.59 -0.89 0.02 0.00 0.00 176.35 176.25 2kli s THR 81 N 0.16 5.02 -0.12 5.49 2.01 -1.26 -3.42 115.64 123.52 2kli s THR 81 Ca 0.13 1.05 -0.04 0.00 0.31 0.00 0.00 61.69 63.14 2kli s THR 81 Cb -0.12 -3.90 -0.03 0.00 0.01 0.00 0.00 72.50 68.46 2kli s THR 81 CO 0.02 0.07 0.01 -0.36 -0.69 0.00 0.00 174.62 173.67 2kli s PHE 82 N 2.29 3.17 0.52 4.92 0.40 0.82 -4.86 117.98 125.24 2kli s PHE 82 Ca 0.25 0.08 -0.17 0.00 -0.60 0.00 0.00 56.93 56.49 2kli s PHE 82 Cb -0.16 -1.89 -0.08 0.00 0.51 0.00 0.00 43.02 41.40 2kli s PHE 82 CO 0.09 0.31 0.99 -1.25 0.70 0.00 0.00 175.22 176.06 2kli s PRO 83 N -0.36 3.91 0.46 0.24 0.04 -1.26 0.25 135.00 138.28 2kli s PRO 83 Ca 0.07 0.98 0.24 0.00 0.04 0.00 0.00 61.00 62.34 2kli s PRO 83 Cb -0.12 -2.13 1.06 0.00 0.04 0.00 0.00 34.50 33.35 2kli s PRO 83 CO 0.02 -0.30 1.89 0.00 0.04 0.00 0.00 177.00 178.65 2kli h ALA 84 N 0.93 1.10 -0.01 8.56 0.00 -0.98 -3.03 119.26 125.82 2kli h ALA 84 Ca -0.47 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.25 2kli h ALA 84 Cb 1.19 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 2kli h ALA 84 CO 0.61 0.26 0.77 0.78 0.00 0.00 0.00 179.25 181.68 2kli h GLY 85 N 1.68 0.00 1.63 0.00 0.00 -1.93 0.65 103.07 105.10 2kli h GLY 85 Ca -0.00 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.37 2kli h GLY 85 CO 0.03 0.00 0.15 -0.55 0.00 0.00 0.00 176.54 176.17 2kli h ASP 86 N 0.00 0.08 -3.45 0.19 3.32 -1.94 -3.40 116.42 111.23 2kli h ASP 86 Ca 0.01 -0.00 -0.66 0.00 0.02 0.00 0.00 57.03 56.40 2kli h ASP 86 Cb 1.55 -0.02 -0.23 0.00 0.22 0.00 0.00 39.33 40.85 2kli h ASP 86 CO -0.00 0.06 -0.72 -0.63 -1.72 0.00 0.00 179.24 176.22 2kli s ILE 87 N -5.13 3.42 0.00 0.35 1.01 0.23 -5.06 121.20 116.02 2kli s ILE 87 Ca -0.06 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 60.05 2kli s ILE 87 Cb 0.18 -2.44 0.00 0.00 0.01 0.00 0.00 42.46 40.21 2kli s ILE 87 CO 0.70 0.53 0.00 -0.81 0.00 0.00 0.00 174.94 175.36 2kli n PRO 88 N 3.17 0.00 0.08 2.79 -0.04 -1.26 -5.01 135.00 134.73 2kli n PRO 88 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 2kli n PRO 88 Cb 0.53 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.99 2kli n PRO 88 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2kli n GLU 89 N 0.00 0.00 -0.31 0.54 0.00 -1.26 -4.87 120.64 114.74 2kli n GLU 89 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 57.16 57.32 2kli n GLU 89 Cb 0.00 0.00 0.34 0.00 0.00 0.00 0.00 31.44 31.78 2kli n GLU 89 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.13 178.18 2kli h GLU 90 N 0.00 0.19 -0.53 5.31 4.11 -2.00 0.35 114.58 122.01 2kli h GLU 90 Ca 0.00 -0.01 -0.03 0.00 0.07 0.00 0.00 59.36 59.39 2kli h GLU 90 Cb 0.00 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 2kli h GLU 90 CO 0.00 0.13 0.22 0.00 0.07 0.00 0.00 179.01 179.42 2kli h ALA 91 N 1.83 0.69 0.00 1.06 0.00 -1.99 -2.54 119.26 118.31 2kli h ALA 91 Ca 0.60 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.32 2kli h ALA 91 Cb 1.28 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2kli h ALA 91 CO -0.68 0.30 -0.17 -0.09 0.00 0.00 0.00 179.25 178.61 2kli h ARG 92 N 0.72 0.00 -0.17 0.00 2.43 -0.70 -3.04 114.38 113.63 2kli h ARG 92 Ca 0.18 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.38 2kli h ARG 92 Cb 0.20 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.72 2kli h ARG 92 CO -0.01 0.17 -0.03 0.00 -1.51 0.00 0.00 179.97 178.59 2kli h ARG 93 N 0.00 0.02 -0.95 0.20 3.08 -0.70 -1.61 114.38 114.42 2kli h ARG 93 Ca -0.00 -0.00 0.16 0.00 0.07 0.00 0.00 59.98 60.21 2kli h ARG 93 Cb 0.35 -0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.31 2kli h ARG 93 CO 0.02 0.01 0.60 -0.07 -1.07 0.00 0.00 179.97 179.47 2kli h LEU 94 N 0.02 0.70 -1.59 3.04 3.38 -1.59 0.83 115.31 120.11 2kli h LEU 94 Ca 0.08 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 2kli h LEU 94 Cb 0.11 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2kli h LEU 94 CO -0.16 0.32 -0.21 -0.26 0.09 0.00 0.00 178.44 178.22 2kli h PHE 95 N 0.72 0.00 0.00 1.13 -1.00 -1.41 2.16 116.94 118.54 2kli h PHE 95 Ca 0.50 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.28 2kli h PHE 95 Cb 0.80 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.36 2kli h PHE 95 CO -0.00 0.21 -0.70 0.54 -1.61 0.00 0.00 178.31 176.74 2kli n ARG 96 N -4.27 0.22 -0.08 1.51 1.74 0.21 -3.12 116.66 112.87 2kli n ARG 96 Ca -0.02 0.04 -0.13 0.00 -0.77 0.00 0.00 57.85 56.97 2kli n ARG 96 Cb 0.27 -1.62 -0.07 0.00 -1.02 0.00 0.00 32.46 30.02 2kli n ARG 96 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2kli n LEU 97 N -1.93 2.30 -0.19 0.55 4.32 0.23 -4.79 117.00 117.48 2kli n LEU 97 Ca 0.03 0.02 0.04 0.00 -0.02 0.00 0.00 56.01 56.08 2kli n LEU 97 Cb 0.41 -0.52 0.01 0.00 -1.62 0.00 0.00 43.42 41.70 2kli n LEU 97 CO 0.37 0.60 0.23 0.00 -1.22 0.00 0.00 177.39 177.37 2kli n ALA 98 N -3.25 2.64 -2.90 -1.18 0.00 0.72 -4.97 120.51 111.57 2kli n ALA 98 Ca -0.29 -0.42 -0.09 0.00 0.00 0.00 0.00 53.44 52.63 2kli n ALA 98 Cb 0.77 -0.26 0.00 0.00 0.00 0.00 0.00 19.45 19.96 2kli n ALA 98 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2kli n GLN 99 N -0.16 -0.57 -0.05 0.00 6.02 -0.93 -4.81 117.38 116.87 2kli n GLN 99 Ca 0.03 0.28 -0.10 0.00 -0.01 0.00 0.00 57.00 57.20 2kli n GLN 99 Cb 0.16 -0.79 -0.04 0.00 1.02 0.00 0.00 30.24 30.59 2kli n GLN 99 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.06 177.60 2kli n VAL 100 N -1.20 0.56 -2.72 5.09 3.14 -1.26 -5.09 118.33 116.86 2kli n VAL 100 Ca -0.11 -0.15 -0.03 0.00 -2.96 0.00 0.00 64.34 61.08 2kli n VAL 100 Cb 0.25 -1.51 0.00 0.00 -1.06 0.00 0.00 33.84 31.53 2kli n VAL 100 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2kli n ARG 101 N -3.35 -1.48 -3.71 1.45 1.74 -1.26 -4.96 116.66 105.09 2kli n ARG 101 Ca -0.20 1.56 -0.12 0.00 -0.77 0.00 0.00 57.85 58.32 2kli n ARG 101 Cb 0.65 -5.01 -0.10 0.00 -1.02 0.00 0.00 32.46 26.98 2kli n ARG 101 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2kli s VAL 102 N -2.71 -0.01 -0.19 1.55 0.11 -1.26 -3.13 120.40 114.76 2kli s VAL 102 Ca 0.09 0.04 -0.05 0.00 -2.93 0.00 0.00 61.98 59.12 2kli s VAL 102 Cb -0.03 -0.64 -0.03 0.00 -1.53 0.00 0.00 36.38 34.16 2kli s VAL 102 CO 0.63 0.01 0.01 -0.63 -3.33 0.00 0.00 175.10 171.79 2kli s ILE 103 N 0.77 4.07 0.69 7.04 1.01 -0.83 -3.72 121.20 130.22 2kli s ILE 103 Ca -0.04 -0.28 -0.09 0.00 0.00 0.00 0.00 60.65 60.24 2kli s ILE 103 Cb -0.05 -2.83 0.03 0.00 0.01 0.00 0.00 42.46 39.61 2kli s ILE 103 CO -0.06 0.44 1.04 0.54 0.00 0.00 0.00 174.94 176.90 2kli s VAL 104 N 0.85 3.12 -0.11 2.92 0.11 -1.21 -3.57 120.40 122.51 2kli s VAL 104 Ca 0.01 0.14 -0.35 0.00 -2.93 0.00 0.00 61.98 58.85 2kli s VAL 104 Cb -0.14 -3.32 -0.12 0.00 -1.53 0.00 0.00 36.38 31.26 2kli s VAL 104 CO 0.02 -0.38 1.86 -0.67 -3.33 0.00 0.00 175.10 172.60 2kli n ASP 105 N -2.91 3.33 0.00 3.54 -0.08 -1.26 -4.77 116.55 114.41 2kli n ASP 105 Ca 0.06 0.98 0.00 0.00 -1.51 0.00 0.00 54.79 54.33 2kli n ASP 105 Cb 0.58 -1.35 0.00 0.00 2.34 0.00 0.00 41.12 42.70 2kli n ASP 105 CO 0.00 0.00 0.00 1.33 0.12 0.00 0.00 177.20 178.65 2kli n VAL 106 N 5.07 1.58 0.03 5.18 0.24 -0.54 -0.65 118.33 129.23 2kli n VAL 106 Ca 0.23 0.47 -0.16 0.00 -2.04 0.00 0.00 64.34 62.84 2kli n VAL 106 Cb 0.28 -1.47 -0.14 0.00 -1.47 0.00 0.00 33.84 31.03 2kli n VAL 106 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 2kli h GLU 107 N 0.00 0.20 0.00 7.34 -0.00 -1.87 -3.29 114.58 116.96 2kli h GLU 107 Ca 0.00 -0.35 0.00 0.00 -0.00 0.00 0.00 59.36 59.01 2kli h GLU 107 Cb 0.15 0.13 0.00 0.00 -0.00 0.00 0.00 28.75 29.03 2kli h GLU 107 CO 0.00 1.02 0.00 0.00 -0.00 0.00 0.00 179.01 180.03 2kli h ALA 108 N 0.47 1.00 -6.22 1.06 0.00 -1.25 -3.46 119.26 110.86 2kli h ALA 108 Ca -0.31 0.00 -0.44 0.00 0.00 0.00 0.00 54.91 54.16 2kli h ALA 108 Cb 2.02 0.00 0.04 0.00 0.00 0.00 0.00 17.79 19.85 2kli h ALA 108 CO 0.12 0.00 -0.88 1.04 0.00 0.00 0.00 179.25 179.54 2kli n GLN 109 N -2.58 -3.32 -3.44 0.00 6.02 -1.23 -4.98 117.38 107.85 2kli n GLN 109 Ca -0.02 0.52 -0.38 0.00 -0.01 0.00 0.00 57.00 57.12 2kli n GLN 109 Cb 0.08 -4.73 -0.06 0.00 1.02 0.00 0.00 30.24 26.55 2kli n GLN 109 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2kli s SER 110 N -4.09 6.73 0.01 1.08 0.01 -1.26 -5.07 113.70 111.11 2kli s SER 110 Ca 0.15 0.87 0.05 0.00 1.31 0.00 0.00 55.95 58.32 2kli s SER 110 Cb -0.05 -2.26 -0.02 0.00 0.21 0.00 0.00 66.02 63.91 2kli s SER 110 CO 0.85 0.19 -0.14 -0.13 0.41 0.00 0.00 173.24 174.42 2kli s ARG 111 N -0.35 1.05 0.14 12.44 0.52 -1.26 -3.57 118.95 127.91 2kli s ARG 111 Ca 0.24 -0.63 0.03 0.00 -0.52 0.00 0.00 55.73 54.84 2kli s ARG 111 Cb -0.16 -1.04 -0.04 0.00 0.52 0.00 0.00 34.95 34.24 2kli s ARG 111 CO 0.11 0.27 0.23 -1.54 0.02 0.00 0.00 175.30 174.40 2kli s SER 112 N -0.73 6.14 0.10 0.23 1.04 -1.25 -4.73 113.70 114.50 2kli s SER 112 Ca 0.04 0.11 -0.18 0.00 0.48 0.00 0.00 55.95 56.40 2kli s SER 112 Cb -0.07 -1.80 0.04 0.00 0.10 0.00 0.00 66.02 64.30 2kli s SER 112 CO 0.00 0.08 0.45 0.27 0.98 0.00 0.00 173.24 175.02 2kli s ILE 113 N -1.70 0.05 0.66 -1.02 -4.36 -1.26 -3.81 121.20 109.77 2kli s ILE 113 Ca 0.34 -0.42 -0.03 0.00 -0.26 0.00 0.00 60.65 60.28 2kli s ILE 113 Cb -0.11 -1.08 0.07 0.00 1.25 0.00 0.00 42.46 42.60 2kli s ILE 113 CO 0.27 -0.23 0.94 -0.94 0.24 0.00 0.00 174.94 175.21 2kli s SER 114 N -2.53 4.78 0.01 4.36 1.04 -1.26 -5.11 113.70 115.00 2kli s SER 114 Ca -0.00 0.07 -0.04 0.00 0.48 0.00 0.00 55.95 56.46 2kli s SER 114 Cb 0.01 -0.71 -0.01 0.00 0.10 0.00 0.00 66.02 65.41 2kli s SER 114 CO -0.09 -1.55 0.06 -1.10 0.98 0.00 0.00 173.24 171.53 2kli s GLN 115 N -5.07 0.40 0.00 4.02 -0.21 -1.26 -5.06 119.66 112.48 2kli s GLN 115 Ca 0.61 -0.51 0.00 0.00 0.02 0.00 0.00 55.36 55.48 2kli s GLN 115 Cb -0.09 0.16 0.00 0.00 1.00 0.00 0.00 33.01 34.08 2kli s GLN 115 CO 0.43 -0.08 0.63 -2.30 -2.12 0.00 0.00 175.29 171.84 2kli n PRO 116 N 1.50 0.00 -0.00 2.91 -0.02 -1.26 -3.25 135.00 134.88 2kli n PRO 116 Ca -0.23 0.63 -0.21 0.00 -2.02 0.00 0.00 63.50 61.66 2kli n PRO 116 Cb 0.55 -1.03 -0.14 0.00 -0.02 0.00 0.00 33.50 32.87 2kli n PRO 116 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2kli h GLU 117 N 0.00 0.22 -4.80 -0.52 4.22 -2.06 -3.50 114.58 108.13 2kli h GLU 117 Ca 0.00 -0.37 0.00 0.00 0.08 0.00 0.00 59.36 59.07 2kli h GLU 117 Cb 0.00 0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 2kli h GLU 117 CO 0.00 1.18 -1.14 0.45 -2.18 0.00 0.00 179.01 177.32 2kli n SER 118 N -3.97 -7.63 -1.77 1.04 2.88 -1.20 -5.08 113.62 97.89 2kli n SER 118 Ca -0.25 1.78 -0.07 0.00 -1.33 0.00 0.00 58.87 59.00 2kli n SER 118 Cb 0.88 -5.29 -0.03 0.00 -0.75 0.00 0.00 64.21 59.02 2kli n SER 118 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 2kli n TRP 119 N 1.83 -0.25 -0.09 0.66 2.14 -1.26 -4.91 117.44 115.56 2kli n TRP 119 Ca -0.10 -0.93 0.00 0.00 2.07 0.00 0.00 57.50 58.54 2kli n TRP 119 Cb 0.15 0.09 0.00 0.00 -0.81 0.00 0.00 31.31 30.74 2kli n TRP 119 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 2kli n GLY 120 N -0.14 0.66 0.08 -1.67 0.00 -1.26 -4.96 105.19 97.90 2kli n GLY 120 Ca 0.02 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.87 2kli n GLY 120 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2kli h LEU 121 N 0.00 0.00 -1.71 0.99 4.07 -1.97 -3.34 115.31 113.35 2kli h LEU 121 Ca 0.00 -0.80 -0.03 0.00 0.08 0.00 0.00 57.88 57.13 2kli h LEU 121 Cb 0.00 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.74 2kli h LEU 121 CO 0.00 1.19 -0.17 0.28 -1.08 0.00 0.00 178.44 178.66 2kli h SER 122 N -1.00 0.00 0.00 -0.43 0.02 -1.99 -1.93 113.55 108.22 2kli h SER 122 Ca -0.14 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 2kli h SER 122 Cb 1.11 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.65 2kli h SER 122 CO -0.08 0.17 0.00 0.00 -1.14 0.00 0.00 176.83 175.77 2kli n ALA 123 N -2.47 1.56 -2.40 3.77 0.00 -1.25 -4.87 120.51 114.86 2kli n ALA 123 Ca -0.02 -0.01 -0.04 0.00 0.00 0.00 0.00 53.44 53.37 2kli n ALA 123 Cb 0.24 -1.02 -0.03 0.00 0.00 0.00 0.00 19.45 18.63 2kli n ALA 123 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2kli n ARG 124 N -0.95 -4.28 -3.35 0.00 0.63 -0.73 -4.95 116.66 103.03 2kli n ARG 124 Ca 0.01 3.24 -0.38 0.00 -0.92 0.00 0.00 57.85 59.80 2kli n ARG 124 Cb 0.01 -4.54 -0.07 0.00 0.45 0.00 0.00 32.46 28.31 2kli n ARG 124 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2kli s VAL 125 N -0.58 5.18 1.06 5.15 0.11 -1.26 -5.06 120.40 125.00 2kli s VAL 125 Ca -0.19 0.82 -0.17 0.00 -2.93 0.00 0.00 61.98 59.51 2kli s VAL 125 Cb 0.01 -3.77 0.24 0.00 -1.53 0.00 0.00 36.38 31.33 2kli s VAL 125 CO 0.51 0.27 1.26 -2.16 -3.33 0.00 0.00 175.10 171.65 2kli s PRO 126 N 1.12 -0.10 0.00 1.54 0.04 -1.26 -4.92 135.00 131.42 2kli s PRO 126 Ca 0.22 -0.33 0.00 0.00 0.04 0.00 0.00 61.00 60.93 2kli s PRO 126 Cb -0.15 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.64 2kli s PRO 126 CO 0.09 -2.92 0.38 1.28 0.04 0.00 0.00 177.00 175.87 2kli n LEU 127 N -4.14 0.00 -3.27 -3.56 4.77 -1.26 -4.60 117.00 104.93 2kli n LEU 127 Ca 0.15 0.38 -0.17 0.00 -0.03 0.00 0.00 56.01 56.34 2kli n LEU 127 Cb 0.59 -0.17 -0.03 0.00 -2.33 0.00 0.00 43.42 41.49 2kli n LEU 127 CO 0.45 -0.17 -0.06 0.61 -1.33 0.00 0.00 177.39 176.89 2kli n GLY 128 N -0.94 -0.46 3.02 -0.72 0.00 -1.26 -4.84 105.19 99.98 2kli n GLY 128 Ca 0.00 0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 2kli n GLY 128 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2kli s GLU 129 N -5.86 2.69 0.80 1.61 -1.05 -1.26 -5.09 118.70 110.54 2kli s GLU 129 Ca 0.32 -3.06 -0.08 0.00 -0.15 0.00 0.00 54.97 52.00 2kli s GLU 129 Cb -0.19 -3.65 0.10 0.00 -0.44 0.00 0.00 34.13 29.95 2kli s GLU 129 CO 0.40 -1.23 0.16 -2.30 0.95 0.00 0.00 175.26 173.24 2kli n PRO 130 N 2.56 -1.35 0.00 -4.83 -0.02 -1.26 -4.70 135.00 125.40 2kli n PRO 130 Ca 0.16 -0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.24 2kli n PRO 130 Cb 0.36 -1.27 0.00 0.00 -0.02 0.00 0.00 33.50 32.57 2kli n PRO 130 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2kli n LEU 131 N 0.55 0.47 -3.73 2.45 4.77 -1.26 -4.77 117.00 115.48 2kli n LEU 131 Ca 0.04 -0.24 -0.05 0.00 -0.03 0.00 0.00 56.01 55.73 2kli n LEU 131 Cb 0.21 -0.24 -0.02 0.00 -2.33 0.00 0.00 43.42 41.05 2kli n LEU 131 CO 0.14 0.12 0.64 0.00 -1.33 0.00 0.00 177.39 176.96 2kli s GLN 132 N -1.32 1.30 -0.07 3.23 -2.07 -1.26 -4.83 119.66 114.64 2kli s GLN 132 Ca 0.00 -0.69 -0.04 0.00 -1.82 0.00 0.00 55.36 52.82 2kli s GLN 132 Cb 0.00 0.46 0.03 0.00 -1.09 0.00 0.00 33.01 32.41 2kli s GLN 132 CO 0.00 -0.59 0.15 0.50 -1.32 0.00 0.00 175.29 174.03 2kli s ARG 133 N -3.44 0.12 0.27 9.60 3.52 -1.24 -5.01 118.95 122.77 2kli s ARG 133 Ca 0.11 0.34 -0.27 0.00 -0.13 0.00 0.00 55.73 55.78 2kli s ARG 133 Cb -0.02 -0.11 -0.09 0.00 -1.56 0.00 0.00 34.95 33.16 2kli s ARG 133 CO 0.01 -0.13 0.91 -1.25 -0.81 0.00 0.00 175.30 174.03 2kli s PRO 134 N 0.92 4.64 -0.01 5.12 0.04 -1.26 -3.35 135.00 141.09 2kli s PRO 134 Ca -0.07 1.32 0.03 0.00 0.04 0.00 0.00 61.00 62.32 2kli s PRO 134 Cb -0.09 -3.00 -0.01 0.00 0.04 0.00 0.00 34.50 31.45 2kli s PRO 134 CO -0.05 0.39 -0.09 0.08 0.04 0.00 0.00 177.00 177.38 2kli s VAL 135 N -1.43 0.68 0.80 -0.36 1.01 -1.23 -4.15 120.40 115.72 2kli s VAL 135 Ca 0.45 -0.38 -0.17 0.00 0.00 0.00 0.00 61.98 61.88 2kli s VAL 135 Cb -0.21 -0.57 -0.15 0.00 0.00 0.00 0.00 36.38 35.45 2kli s VAL 135 CO 0.26 0.19 -0.54 0.47 0.00 0.00 0.00 175.10 175.48 2kli n ASP 136 N 2.85 -5.07 0.00 3.32 9.92 -1.25 -3.83 116.55 122.49 2kli n ASP 136 Ca -0.13 0.36 0.00 0.00 -0.53 0.00 0.00 54.79 54.49 2kli n ASP 136 Cb 0.57 -0.78 0.00 0.00 -0.64 0.00 0.00 41.12 40.26 2kli n ASP 136 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 2kli n PRO 137 N 2.09 0.00 0.03 -0.24 -0.04 -1.26 -1.97 135.00 133.61 2kli n PRO 137 Ca 0.02 0.35 -0.10 0.00 -0.04 0.00 0.00 63.50 63.73 2kli n PRO 137 Cb 0.52 -1.51 -0.04 0.00 -0.04 0.00 0.00 33.50 32.42 2kli n PRO 137 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kli h HIS 139 N -0.17 0.00 0.42 0.00 2.07 -1.68 -1.83 115.15 113.96 2kli h HIS 139 Ca 0.06 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.56 2kli h HIS 139 Cb 0.25 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.22 2kli h HIS 139 CO -0.20 0.34 -0.30 0.28 -3.07 0.00 0.00 177.93 174.98 2kli h VAL 140 N 0.00 0.00 0.04 6.12 2.07 -1.42 -0.86 116.25 122.21 2kli h VAL 140 Ca -0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 2kli h VAL 140 Cb 0.84 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.61 2kli h VAL 140 CO 0.04 0.00 -0.02 -0.74 0.02 0.00 0.00 177.57 176.88 2kli h HIS 141 N -0.68 -0.05 -0.89 1.57 6.17 -1.54 -0.89 115.15 118.83 2kli h HIS 141 Ca -0.05 -0.00 0.21 0.00 0.71 0.00 0.00 60.37 61.23 2kli h HIS 141 Cb 0.56 0.02 -0.16 0.00 2.52 0.00 0.00 27.41 30.34 2kli h HIS 141 CO -0.07 0.40 -0.07 -0.92 0.71 0.00 0.00 177.93 177.98 2kli h TYR 142 N -0.51 -0.20 -0.07 5.26 3.20 -1.38 2.39 116.97 125.66 2kli h TYR 142 Ca -0.01 0.07 -0.11 0.00 3.14 0.00 0.00 58.73 61.83 2kli h TYR 142 Cb 0.47 0.23 0.01 0.00 1.54 0.00 0.00 36.73 38.97 2kli h TYR 142 CO 0.08 -0.36 -0.37 -0.07 -1.64 0.00 0.00 178.16 175.80 2kli h LEU 143 N 0.04 0.45 -0.83 2.82 3.38 -1.15 -3.16 115.31 116.86 2kli h LEU 143 Ca 0.49 -0.66 0.01 0.00 0.09 0.00 0.00 57.88 57.81 2kli h LEU 143 Cb 0.88 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.46 2kli h LEU 143 CO -0.85 1.03 0.54 0.50 0.09 0.00 0.00 178.44 179.75 2kli h LYS 144 N -0.11 1.10 -0.70 1.13 1.63 0.86 0.11 116.57 120.60 2kli h LYS 144 Ca -0.03 -0.07 0.19 0.00 -0.85 0.00 0.00 60.65 59.89 2kli h LYS 144 Cb 1.03 -0.24 -0.03 0.00 -0.60 0.00 0.00 32.23 32.38 2kli h LYS 144 CO 0.08 0.74 0.49 0.77 -3.45 0.00 0.00 179.45 178.07 2kli h SER 145 N 1.13 0.10 0.09 4.20 0.02 0.38 2.75 113.55 122.22 2kli h SER 145 Ca 0.30 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.26 2kli h SER 145 Cb -0.11 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.41 2kli h SER 145 CO -0.06 0.05 -0.10 0.23 -1.14 0.00 0.00 176.83 175.80 2kli n MET 146 N -4.38 1.32 -1.78 3.45 2.81 0.06 -4.92 117.12 113.67 2kli n MET 146 Ca 0.14 -0.75 -0.07 0.00 -1.81 0.00 0.00 57.70 55.20 2kli n MET 146 Cb 0.70 -1.48 -0.01 0.00 -0.71 0.00 0.00 33.22 31.71 2kli n MET 146 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2kli n GLY 147 N 1.24 0.40 3.45 3.03 0.00 0.92 -5.02 105.19 109.21 2kli n GLY 147 Ca 0.16 -0.64 -0.36 0.00 0.00 0.00 0.00 46.02 45.18 2kli n GLY 147 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2kli s VAL 148 N -2.33 4.28 0.06 1.61 1.01 0.15 -4.59 120.40 120.60 2kli s VAL 148 Ca 0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 61.98 61.77 2kli s VAL 148 Cb 0.00 -2.99 -0.27 0.00 0.00 0.00 0.00 36.38 33.11 2kli s VAL 148 CO 0.00 0.35 1.09 0.00 0.00 0.00 0.00 175.10 176.54 2kli h ALA 149 N 8.12 0.17 -2.35 5.51 0.00 -1.81 -3.27 119.26 125.63 2kli h ALA 149 Ca -0.38 -0.95 -0.34 0.00 0.00 0.00 0.00 54.91 53.24 2kli h ALA 149 Cb 1.17 0.06 -0.14 0.00 0.00 0.00 0.00 17.79 18.88 2kli h ALA 149 CO 0.58 1.05 -0.61 0.45 0.00 0.00 0.00 179.25 180.72 2kli s SER 150 N -7.04 1.10 -0.28 0.00 0.15 -1.21 -1.47 113.70 104.95 2kli s SER 150 Ca -0.04 -1.39 -0.25 0.00 0.70 0.00 0.00 55.95 54.97 2kli s SER 150 Cb 0.07 0.18 0.09 0.00 -1.71 0.00 0.00 66.02 64.66 2kli s SER 150 CO 0.87 -0.74 0.86 -0.44 1.20 0.00 0.00 173.24 174.99 2kli s SER 151 N -3.30 -0.62 -0.06 5.45 0.01 -1.23 -3.44 113.70 110.52 2kli s SER 151 Ca 0.38 1.18 0.03 0.00 1.31 0.00 0.00 55.95 58.86 2kli s SER 151 Cb 0.08 1.20 -0.03 0.00 0.21 0.00 0.00 66.02 67.48 2kli s SER 151 CO 0.14 -0.20 -0.14 -0.22 0.41 0.00 0.00 173.24 173.22 2kli s LEU 152 N 0.33 2.75 0.11 2.44 2.96 -0.96 -1.97 118.68 124.35 2kli s LEU 152 Ca 0.01 -0.20 0.04 0.00 -0.22 0.00 0.00 54.13 53.76 2kli s LEU 152 Cb -0.05 -1.56 -0.04 0.00 0.50 0.00 0.00 46.19 45.04 2kli s LEU 152 CO -0.03 0.33 -0.10 0.68 -1.32 0.00 0.00 176.35 175.91 2kli s VAL 153 N -0.66 1.02 -0.38 1.68 -7.23 -1.18 0.84 120.40 114.49 2kli s VAL 153 Ca 0.10 -1.78 0.06 0.00 -1.81 0.00 0.00 61.98 58.55 2kli s VAL 153 Cb -0.11 -1.53 0.18 0.00 0.56 0.00 0.00 36.38 35.48 2kli s VAL 153 CO 0.01 -0.61 0.56 -0.69 -0.31 0.00 0.00 175.10 174.05 2kli s VAL 154 N -2.72 -0.83 0.15 1.32 1.01 -0.87 -4.50 120.40 113.96 2kli s VAL 154 Ca 0.09 -0.25 -0.34 0.00 0.00 0.00 0.00 61.98 61.48 2kli s VAL 154 Cb -0.01 -0.31 -0.15 0.00 0.00 0.00 0.00 36.38 35.92 2kli s VAL 154 CO 0.00 -0.15 1.49 -2.65 0.00 0.00 0.00 175.10 173.80 2kli n PRO 155 N 4.53 1.88 -2.85 2.72 -0.02 -1.26 -2.90 135.00 137.09 2kli n PRO 155 Ca 0.10 0.68 -0.43 0.00 -2.02 0.00 0.00 63.50 61.83 2kli n PRO 155 Cb 0.54 -2.40 -0.04 0.00 -0.02 0.00 0.00 33.50 31.58 2kli n PRO 155 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2kli s LEU 156 N 0.72 4.17 0.05 2.45 1.43 -1.13 -4.88 118.68 121.50 2kli s LEU 156 Ca 0.79 -0.48 0.09 0.00 -1.03 0.00 0.00 54.13 53.50 2kli s LEU 156 Cb -0.74 -2.74 -0.03 0.00 0.03 0.00 0.00 46.19 42.70 2kli s LEU 156 CO 0.41 -1.25 -0.25 -0.04 0.23 0.00 0.00 176.35 175.46 2kli s MET 157 N 3.92 1.85 -0.21 1.70 -1.94 -1.26 -2.09 119.30 121.27 2kli s MET 157 Ca 0.28 -1.09 0.01 0.00 -1.71 0.00 0.00 55.69 53.18 2kli s MET 157 Cb -0.13 -2.02 0.05 0.00 2.01 0.00 0.00 34.83 34.73 2kli s MET 157 CO 0.17 0.52 -0.09 -1.58 -0.01 0.00 0.00 175.02 174.03 2kli s HIS 158 N -0.84 2.41 0.00 -0.03 2.46 0.11 -4.80 115.29 114.61 2kli s HIS 158 Ca 0.12 -1.64 0.00 0.00 0.47 0.00 0.00 55.06 54.02 2kli s HIS 158 Cb -0.10 -1.62 0.00 0.00 -0.13 0.00 0.00 32.58 30.73 2kli s HIS 158 CO 0.03 -0.75 0.00 1.58 -2.47 0.00 0.00 174.74 173.13 2kli n HIS 159 N 4.68 0.00 0.05 3.88 -0.00 -1.26 -1.85 115.22 120.73 2kli n HIS 159 Ca -0.14 0.00 0.08 0.00 -0.00 0.00 0.00 57.72 57.66 2kli n HIS 159 Cb 0.46 0.00 0.26 0.00 -0.00 0.00 0.00 29.99 30.71 2kli n HIS 159 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 2kli n GLN 160 N 13.48 2.68 -4.44 1.57 1.13 -1.26 -4.95 117.38 125.60 2kli n GLN 160 Ca 0.00 -2.12 -0.25 0.00 -1.94 0.00 0.00 57.00 52.69 2kli n GLN 160 Cb 0.00 -1.58 -0.11 0.00 0.11 0.00 0.00 30.24 28.66 2kli n GLN 160 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2kli s GLU 161 N -1.49 1.57 -0.27 -1.09 0.41 -0.77 -5.12 118.70 111.94 2kli s GLU 161 Ca 0.39 -1.64 -0.05 0.00 -0.41 0.00 0.00 54.97 53.26 2kli s GLU 161 Cb 0.22 -1.73 0.01 0.00 -1.78 0.00 0.00 34.13 30.86 2kli s GLU 161 CO 0.23 0.34 0.02 -0.51 -0.49 0.00 0.00 175.26 174.85 2kli s LEU 162 N -3.12 3.53 -0.00 1.80 1.02 -1.26 -0.71 118.68 119.93 2kli s LEU 162 Ca 0.25 -0.72 0.18 0.00 0.02 0.00 0.00 54.13 53.85 2kli s LEU 162 Cb -0.06 -1.79 -0.19 0.00 0.02 0.00 0.00 46.19 44.17 2kli s LEU 162 CO 0.12 -0.15 0.63 0.79 0.02 0.00 0.00 176.35 177.76 2kli n TRP 163 N 4.79 0.66 -2.87 0.29 7.02 -0.89 -4.95 117.44 121.49 2kli n TRP 163 Ca -0.16 0.22 0.00 0.00 -1.02 0.00 0.00 57.50 56.54 2kli n TRP 163 Cb 0.48 -0.99 0.00 0.00 -2.42 0.00 0.00 31.31 28.38 2kli n TRP 163 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2kli n GLY 164 N 1.45 2.06 2.95 6.99 0.00 -1.16 -3.00 105.19 114.48 2kli n GLY 164 Ca -0.13 -0.94 -0.13 0.00 0.00 0.00 0.00 46.02 44.81 2kli n GLY 164 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2kli s LEU 165 N 0.00 0.63 -0.03 0.99 2.96 0.54 -2.82 118.68 120.95 2kli s LEU 165 Ca 0.00 0.35 -0.15 0.00 -0.22 0.00 0.00 54.13 54.12 2kli s LEU 165 Cb 0.00 0.45 -0.05 0.00 0.50 0.00 0.00 46.19 47.08 2kli s LEU 165 CO 0.00 -0.16 0.40 -0.22 -1.32 0.00 0.00 176.35 175.05 2kli s LEU 166 N 1.22 4.44 -0.15 -0.68 2.96 -1.14 -0.68 118.68 124.65 2kli s LEU 166 Ca -0.09 0.90 -0.10 0.00 -0.22 0.00 0.00 54.13 54.63 2kli s LEU 166 Cb -0.11 -2.57 0.05 0.00 0.50 0.00 0.00 46.19 44.06 2kli s LEU 166 CO -0.07 0.28 0.37 0.54 -1.32 0.00 0.00 176.35 176.16 2kli s VAL 167 N -0.80 -0.02 -0.00 1.68 0.11 -1.16 -2.06 120.40 118.15 2kli s VAL 167 Ca 0.23 0.07 0.05 0.00 -2.93 0.00 0.00 61.98 59.40 2kli s VAL 167 Cb -0.16 -0.54 -0.03 0.00 -1.53 0.00 0.00 36.38 34.12 2kli s VAL 167 CO 0.12 0.03 -0.15 -0.94 -3.33 0.00 0.00 175.10 170.83 2kli s SER 168 N 0.97 4.03 -0.01 3.54 1.04 0.25 -2.59 113.70 120.93 2kli s SER 168 Ca -0.06 -0.29 0.02 0.00 0.48 0.00 0.00 55.95 56.11 2kli s SER 168 Cb -0.07 -0.78 -0.00 0.00 0.10 0.00 0.00 66.02 65.26 2kli s SER 168 CO -0.08 0.30 -0.08 -1.00 0.98 0.00 0.00 173.24 173.36 2kli s HIS 169 N -0.86 0.71 0.05 5.02 3.76 0.04 -2.26 115.29 121.75 2kli s HIS 169 Ca 0.14 -0.14 -0.22 0.00 -0.15 0.00 0.00 55.06 54.69 2kli s HIS 169 Cb -0.11 -0.47 0.05 0.00 1.11 0.00 0.00 32.58 33.17 2kli s HIS 169 CO 0.04 -0.02 0.51 -3.38 -0.85 0.00 0.00 174.74 171.04 2kli s HIS 170 N -0.13 -0.41 -1.33 1.40 -3.43 -1.22 -3.10 115.29 107.07 2kli s HIS 170 Ca 0.02 0.43 -0.10 0.00 -0.80 0.00 0.00 55.06 54.61 2kli s HIS 170 Cb -0.04 0.33 0.13 0.00 -1.43 0.00 0.00 32.58 31.58 2kli s HIS 170 CO -0.00 -0.64 1.99 0.00 -2.00 0.00 0.00 174.74 174.08 2kli n ALA 171 N 0.37 5.50 0.00 -1.38 0.00 -1.26 -2.94 120.51 120.80 2kli n ALA 171 Ca -0.18 -4.20 0.00 0.00 0.00 0.00 0.00 53.44 49.06 2kli n ALA 171 Cb 0.60 -3.10 0.00 0.00 0.00 0.00 0.00 19.45 16.95 2kli n ALA 171 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2kli n GLU 172 N 4.26 0.00 -0.22 0.00 0.28 -1.26 -4.88 120.64 118.82 2kli n GLU 172 Ca 0.44 0.00 -0.11 0.00 -0.16 0.00 0.00 57.16 57.33 2kli n GLU 172 Cb 0.36 0.00 -0.07 0.00 1.43 0.00 0.00 31.44 33.16 2kli n GLU 172 CO 0.00 0.00 0.00 -1.35 -0.16 0.00 0.00 177.13 175.62 2kli h PRO 173 N 0.00 -0.25 -6.47 3.44 0.11 -1.89 -3.25 132.00 123.69 2kli h PRO 173 Ca 0.00 0.02 -0.39 0.00 0.11 0.00 0.00 66.00 65.74 2kli h PRO 173 Cb 0.00 0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.17 2kli h PRO 173 CO 0.00 -0.17 -0.96 -2.13 -0.21 0.00 0.00 178.00 174.54 2kli n ARG 174 N -5.37 -1.63 -1.98 1.05 0.63 -1.26 -4.65 116.66 103.45 2kli n ARG 174 Ca -0.00 1.04 -0.36 0.00 -0.92 0.00 0.00 57.85 57.61 2kli n ARG 174 Cb 0.33 -2.83 0.03 0.00 0.45 0.00 0.00 32.46 30.45 2kli n ARG 174 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 2kli s PRO 175 N -4.10 3.00 -0.02 -0.14 0.02 -1.26 -4.94 135.00 127.55 2kli s PRO 175 Ca 0.09 1.89 0.04 0.00 0.02 0.00 0.00 61.00 63.04 2kli s PRO 175 Cb -0.01 -1.98 -0.03 0.00 0.02 0.00 0.00 34.50 32.50 2kli s PRO 175 CO 0.87 -1.20 -0.15 0.71 -0.33 0.00 0.00 177.00 176.91 2kli s TYR 176 N -1.54 2.68 0.09 6.54 2.02 -1.26 -5.12 117.35 120.76 2kli s TYR 176 Ca 0.77 -0.17 -0.00 0.00 -0.37 0.00 0.00 57.07 57.29 2kli s TYR 176 Cb -0.32 -1.59 -0.04 0.00 -0.40 0.00 0.00 41.96 39.61 2kli s TYR 176 CO 0.35 0.22 0.25 0.45 -1.57 0.00 0.00 175.55 175.25 2kli s SER 177 N -0.95 6.38 0.21 2.29 0.15 -1.26 -5.01 113.70 115.51 2kli s SER 177 Ca 0.13 0.31 -0.06 0.00 0.70 0.00 0.00 55.95 57.02 2kli s SER 177 Cb -0.11 -1.97 0.17 0.00 -1.71 0.00 0.00 66.02 62.40 2kli s SER 177 CO 0.02 0.13 1.69 1.56 1.20 0.00 0.00 173.24 177.84 2kli h GLN 178 N 2.86 0.97 0.39 5.44 4.20 -1.98 0.44 115.11 127.43 2kli h GLN 178 Ca -0.46 -0.29 -0.02 0.00 0.06 0.00 0.00 58.65 57.94 2kli h GLN 178 Cb 1.17 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.85 2kli h GLN 178 CO 0.74 0.95 -0.19 0.93 -0.67 0.00 0.00 178.83 180.60 2kli h GLU 179 N 0.89 -0.51 -0.28 1.46 3.07 -2.00 -1.35 114.58 115.86 2kli h GLU 179 Ca 0.16 0.03 -0.07 0.00 -0.50 0.00 0.00 59.36 58.99 2kli h GLU 179 Cb 0.52 0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 28.53 2kli h GLU 179 CO 0.03 -0.21 -0.13 0.93 -1.40 0.00 0.00 179.01 178.23 2kli h GLU 180 N -0.81 0.47 -0.72 2.33 5.08 -1.98 -2.84 114.58 116.10 2kli h GLU 180 Ca -0.05 -0.13 -0.06 0.00 -1.00 0.00 0.00 59.36 58.11 2kli h GLU 180 Cb 0.53 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 2kli h GLU 180 CO 0.09 0.60 0.23 1.25 -1.00 0.00 0.00 179.01 180.17 2kli h LEU 181 N 0.44 1.04 0.29 1.33 5.85 -0.85 -3.15 115.31 120.25 2kli h LEU 181 Ca 0.08 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 2kli h LEU 181 Cb 0.49 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 2kli h LEU 181 CO 0.03 0.97 -0.19 -0.61 -0.34 0.00 0.00 178.44 178.30 2kli h GLN 182 N 1.07 -0.45 -0.81 1.25 4.15 -0.99 1.06 115.11 120.39 2kli h GLN 182 Ca 0.23 0.03 0.20 0.00 0.77 0.00 0.00 58.65 59.88 2kli h GLN 182 Cb 0.30 0.10 -0.13 0.00 0.21 0.00 0.00 27.48 27.96 2kli h GLN 182 CO -0.01 -0.30 0.13 0.28 -1.93 0.00 0.00 178.83 177.00 2kli h VAL 183 N -0.47 0.35 -0.06 2.39 2.07 -1.54 0.36 116.25 119.35 2kli h VAL 183 Ca -0.02 -0.06 -0.23 0.00 0.82 0.00 0.00 66.70 67.21 2kli h VAL 183 Cb 0.40 0.16 0.01 0.00 -1.52 0.00 0.00 31.29 30.34 2kli h VAL 183 CO 0.02 0.03 -0.88 0.58 0.02 0.00 0.00 177.57 177.33 2kli h VAL 184 N 0.18 1.33 -1.10 2.57 2.07 -1.42 -2.61 116.25 117.26 2kli h VAL 184 Ca 0.48 -2.20 0.30 0.00 0.82 0.00 0.00 66.70 66.10 2kli h VAL 184 Cb 0.89 2.22 -0.09 0.00 -1.52 0.00 0.00 31.29 32.79 2kli h VAL 184 CO -0.64 0.68 0.72 -0.61 0.02 0.00 0.00 177.57 177.74 2kli h GLN 185 N 0.37 0.28 -0.16 1.57 5.75 0.50 1.65 115.11 125.08 2kli h GLN 185 Ca -0.08 -0.02 -0.22 0.00 -0.15 0.00 0.00 58.65 58.18 2kli h GLN 185 Cb 1.51 -0.06 0.01 0.00 1.07 0.00 0.00 27.48 30.01 2kli h GLN 185 CO 0.17 0.18 -0.77 1.25 -2.65 0.00 0.00 178.83 177.01 2kli h LEU 186 N 0.29 0.95 -1.82 -2.39 5.85 -0.67 -2.76 115.31 114.76 2kli h LEU 186 Ca 0.62 -0.63 0.14 0.00 0.84 0.00 0.00 57.88 58.85 2kli h LEU 186 Cb 1.78 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 42.50 2kli h LEU 186 CO -0.27 1.42 0.41 0.25 -0.34 0.00 0.00 178.44 179.91 2kli h LEU 187 N 0.54 0.17 -0.18 2.25 5.85 0.27 0.17 115.31 124.38 2kli h LEU 187 Ca -0.05 0.01 -0.23 0.00 0.84 0.00 0.00 57.88 58.45 2kli h LEU 187 Cb 1.41 -0.03 0.01 0.00 0.37 0.00 0.00 40.66 42.42 2kli h LEU 187 CO 0.16 0.09 -0.86 0.00 -0.34 0.00 0.00 178.44 177.49 2kli h ALA 188 N 1.71 0.34 -0.98 1.25 0.00 -0.69 -3.11 119.26 117.77 2kli h ALA 188 Ca 0.28 -0.65 0.10 0.00 0.00 0.00 0.00 54.91 54.65 2kli h ALA 188 Cb 0.85 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.56 2kli h ALA 188 CO -0.05 0.73 0.63 -0.44 0.00 0.00 0.00 179.25 180.12 2kli h ASP 189 N 0.39 0.93 -0.25 0.00 3.32 -0.41 -0.21 116.42 120.19 2kli h ASP 189 Ca -0.07 0.03 0.06 0.00 0.02 0.00 0.00 57.03 57.07 2kli h ASP 189 Cb 1.49 -0.16 -0.07 0.00 0.22 0.00 0.00 39.33 40.81 2kli h ASP 189 CO 0.16 0.53 -0.20 1.56 -1.72 0.00 0.00 179.24 179.57 2kli h GLN 190 N 1.01 -0.19 -0.90 3.56 1.08 -1.31 0.77 115.11 119.13 2kli h GLN 190 Ca 0.46 0.01 0.05 0.00 -1.45 0.00 0.00 58.65 57.72 2kli h GLN 190 Cb 0.40 0.04 -0.06 0.00 -0.05 0.00 0.00 27.48 27.82 2kli h GLN 190 CO -0.22 -0.13 0.58 0.28 -0.95 0.00 0.00 178.83 178.39 2kli h VAL 191 N -0.20 1.11 -0.91 -0.54 2.07 -1.20 0.18 116.25 116.76 2kli h VAL 191 Ca 0.14 -0.37 0.19 0.00 0.82 0.00 0.00 66.70 67.47 2kli h VAL 191 Cb 0.41 -0.08 -0.07 0.00 -1.52 0.00 0.00 31.29 30.03 2kli h VAL 191 CO -0.37 0.20 0.59 0.28 0.02 0.00 0.00 177.57 178.30 2kli h SER 192 N 1.09 0.52 0.15 0.57 0.02 0.75 1.41 113.55 118.06 2kli h SER 192 Ca 0.37 0.05 -0.27 0.00 -0.84 0.00 0.00 61.79 61.10 2kli h SER 192 Cb 0.07 -0.05 0.03 0.00 0.14 0.00 0.00 62.40 62.59 2kli h SER 192 CO -0.14 0.22 -1.13 0.40 -1.14 0.00 0.00 176.83 175.04 2kli h ILE 193 N 0.53 1.35 -0.18 3.27 5.03 0.22 -2.92 117.51 124.80 2kli h ILE 193 Ca 0.48 -2.49 -0.02 0.00 -0.12 0.00 0.00 64.86 62.70 2kli h ILE 193 Cb 1.01 2.89 -0.01 0.00 -3.03 0.00 0.00 36.82 37.68 2kli h ILE 193 CO -0.21 0.74 0.02 0.00 -0.68 0.00 0.00 178.15 178.02 2kli h ALA 194 N 0.21 0.25 -0.54 1.87 0.00 0.19 0.59 119.26 121.83 2kli h ALA 194 Ca -0.18 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 2kli h ALA 194 Cb 1.85 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.55 2kli h ALA 194 CO 0.22 -0.08 0.27 0.97 0.00 0.00 0.00 179.25 180.63 2kli h ILE 195 N 0.09 1.18 0.16 0.00 6.09 0.16 0.39 117.51 125.58 2kli h ILE 195 Ca 0.06 -0.48 -0.01 0.00 -1.37 0.00 0.00 64.86 63.06 2kli h ILE 195 Cb 0.33 0.48 0.00 0.00 0.47 0.00 0.00 36.82 38.10 2kli h ILE 195 CO 0.01 0.20 -0.08 0.00 -3.07 0.00 0.00 178.15 175.21 2kli h ALA 196 N 1.55 -0.21 -0.28 0.18 0.00 -1.29 -2.85 119.26 116.36 2kli h ALA 196 Ca 0.19 -0.23 0.08 0.00 0.00 0.00 0.00 54.91 54.95 2kli h ALA 196 Cb 0.06 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2kli h ALA 196 CO -0.03 -0.32 0.28 1.96 0.00 0.00 0.00 179.25 181.14 2kli h GLN 197 N -0.82 0.00 0.02 0.00 4.20 0.41 -0.37 115.11 118.55 2kli h GLN 197 Ca -0.02 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.46 2kli h GLN 197 Cb 0.53 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.31 2kli h GLN 197 CO 0.04 0.00 -0.96 0.00 -0.67 0.00 0.00 178.83 177.24 2kli h ALA 198 N 1.71 0.37 -0.93 3.87 0.00 -0.87 -3.21 119.26 120.20 2kli h ALA 198 Ca 0.13 -0.73 0.06 0.00 0.00 0.00 0.00 54.91 54.37 2kli h ALA 198 Cb 0.69 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.39 2kli h ALA 198 CO -0.00 0.86 0.61 0.93 0.00 0.00 0.00 179.25 181.64 2kli h GLU 199 N 0.18 1.06 0.56 0.00 5.08 -0.82 -1.23 114.58 119.41 2kli h GLU 199 Ca -0.08 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.19 2kli h GLU 199 Cb 1.60 -0.24 0.01 0.00 0.50 0.00 0.00 28.75 30.62 2kli h GLU 199 CO 0.16 0.70 -0.27 -0.07 -1.00 0.00 0.00 179.01 178.53 2kli h LEU 200 N 1.09 -0.64 -0.96 1.33 4.07 -1.58 -3.14 115.31 115.49 2kli h LEU 200 Ca 0.39 -0.03 0.19 0.00 0.08 0.00 0.00 57.88 58.51 2kli h LEU 200 Cb 0.15 0.16 -0.11 0.00 1.08 0.00 0.00 40.66 41.94 2kli h LEU 200 CO -0.14 -0.25 0.55 -1.28 -1.08 0.00 0.00 178.44 176.23 2kli h SER 201 N -1.10 0.66 -0.02 -0.43 0.87 -1.54 -3.53 113.55 108.46 2kli h SER 201 Ca -0.08 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 2kli h SER 201 Cb 0.63 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.59 2kli h SER 201 CO 0.13 0.20 0.00 0.18 -0.53 0.00 0.00 176.83 176.81