#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1umd s LEU 3 N 0.00 4.52 0.11 0.00 1.02 -1.26 -1.80 118.68 121.27 1umd s LEU 3 Ca 0.00 1.68 -0.10 0.00 0.02 0.00 0.00 54.13 55.73 1umd s LEU 3 Cb 0.00 -3.42 0.00 0.00 0.02 0.00 0.00 46.19 42.79 1umd s LEU 3 CO 0.00 0.05 0.23 0.00 0.02 0.00 0.00 176.35 176.65 1umd s MET 4 N -0.42 0.93 0.80 1.70 0.23 -0.05 -4.84 119.30 117.65 1umd s MET 4 Ca 0.41 -0.97 -0.10 0.00 -1.03 0.00 0.00 55.69 54.00 1umd s MET 4 Cb -0.23 0.36 0.10 0.00 -1.53 0.00 0.00 34.83 33.54 1umd s MET 4 CO 0.27 -0.31 1.14 0.95 -2.03 0.00 0.00 175.02 175.04 1umd s THR 5 N -3.87 2.10 0.22 3.16 -4.23 -1.26 -1.70 115.64 110.06 1umd s THR 5 Ca 0.07 -0.13 -0.07 0.00 -1.18 0.00 0.00 61.69 60.38 1umd s THR 5 Cb 0.04 -2.97 0.16 0.00 1.34 0.00 0.00 72.50 71.07 1umd s THR 5 CO -0.09 0.00 1.78 -0.03 -0.54 0.00 0.00 174.62 175.74 1umd h MET 6 N -0.99 1.19 -0.47 3.99 4.05 -1.66 -1.45 114.93 119.58 1umd h MET 6 Ca -0.45 -0.22 0.03 0.00 -0.28 0.00 0.00 59.70 58.78 1umd h MET 6 Cb 1.30 -0.19 -0.04 0.00 -0.80 0.00 0.00 31.60 31.88 1umd h MET 6 CO 0.57 0.97 0.26 0.28 0.23 0.00 0.00 176.91 179.22 1umd h VAL 7 N 1.16 1.01 -0.67 -5.77 2.07 -1.68 -0.14 116.25 112.23 1umd h VAL 7 Ca 0.26 -0.18 -0.07 0.00 0.82 0.00 0.00 66.70 67.53 1umd h VAL 7 Cb 0.23 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 1umd h VAL 7 CO -0.02 0.10 0.13 1.56 0.02 0.00 0.00 177.57 179.35 1umd h GLN 8 N 0.52 1.08 -0.59 1.57 4.20 -1.76 -0.89 115.11 119.24 1umd h GLN 8 Ca 0.20 -0.27 -0.09 0.00 0.06 0.00 0.00 58.65 58.54 1umd h GLN 8 Cb 0.06 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 1umd h GLN 8 CO -0.11 0.98 -0.00 0.00 -0.67 0.00 0.00 178.83 179.03 1umd h ALA 9 N 1.11 0.79 -0.34 3.87 0.00 -0.83 -0.12 119.26 123.73 1umd h ALA 9 Ca 0.21 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1umd h ALA 9 Cb 0.41 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1umd h ALA 9 CO 0.01 0.63 0.03 -0.07 0.00 0.00 0.00 179.25 179.85 1umd h LEU 10 N 0.93 0.57 -0.63 0.00 3.38 -0.83 -0.66 115.31 118.08 1umd h LEU 10 Ca 0.17 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1umd h LEU 10 Cb 0.56 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1umd h LEU 10 CO 0.03 0.71 0.39 -1.13 0.09 0.00 0.00 178.44 178.53 1umd h ASN 11 N 0.41 0.74 -0.57 -0.43 -0.73 -1.02 -1.45 115.58 112.53 1umd h ASN 11 Ca 0.10 -0.05 -0.01 0.00 1.87 0.00 0.00 56.30 58.22 1umd h ASN 11 Cb 0.40 -0.19 -0.03 0.00 0.27 0.00 0.00 38.32 38.77 1umd h ASN 11 CO 0.01 0.57 0.32 -0.09 -0.37 0.00 0.00 177.43 177.87 1umd h ARG 12 N 0.85 0.79 -0.56 6.67 9.65 -0.79 0.12 114.38 131.11 1umd h ARG 12 Ca 0.23 -0.09 0.02 0.00 -1.10 0.00 0.00 59.98 59.04 1umd h ARG 12 Cb -0.05 -0.16 -0.03 0.00 -1.39 0.00 0.00 29.97 28.34 1umd h ARG 12 CO -0.04 0.60 0.35 0.00 2.80 0.00 0.00 179.97 183.67 1umd h ALA 13 N 1.15 0.71 -0.08 2.80 0.00 -0.70 0.53 119.26 123.67 1umd h ALA 13 Ca 0.20 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1umd h ALA 13 Cb 0.03 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1umd h ALA 13 CO -0.03 0.10 0.02 -0.07 0.00 0.00 0.00 179.25 179.26 1umd h LEU 14 N 0.70 0.11 -0.33 0.00 3.38 -0.84 -1.57 115.31 116.77 1umd h LEU 14 Ca 0.21 -0.21 0.05 0.00 0.09 0.00 0.00 57.88 58.02 1umd h LEU 14 Cb -0.03 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 1umd h LEU 14 CO -0.07 0.30 0.03 -0.78 0.09 0.00 0.00 178.44 178.01 1umd h ASP 15 N -0.07 -0.06 -0.19 -0.43 1.82 -0.74 -0.48 116.42 116.26 1umd h ASP 15 Ca 0.02 0.06 0.01 0.00 -0.39 0.00 0.00 57.03 56.74 1umd h ASP 15 Cb 0.23 0.10 -0.01 0.00 0.68 0.00 0.00 39.33 40.33 1umd h ASP 15 CO -0.00 0.00 0.10 -0.33 -1.61 0.00 0.00 179.24 177.41 1umd h GLU 16 N 0.14 0.21 -0.28 0.28 5.08 -0.79 -1.52 114.58 117.71 1umd h GLU 16 Ca 0.16 -0.01 -0.11 0.00 -1.00 0.00 0.00 59.36 58.40 1umd h GLU 16 Cb 0.20 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1umd h GLU 16 CO -0.24 0.14 -0.29 0.93 -1.00 0.00 0.00 179.01 178.55 1umd h GLU 17 N 0.22 0.56 -0.11 2.33 4.39 -1.03 -2.24 114.58 118.70 1umd h GLU 17 Ca 0.08 -0.23 -0.11 0.00 0.34 0.00 0.00 59.36 59.44 1umd h GLU 17 Cb 0.01 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 1umd h GLU 17 CO -0.05 0.79 -0.41 0.52 -1.16 0.00 0.00 179.01 178.71 1umd h MET 18 N 0.49 0.24 -0.05 2.33 2.86 -0.91 -0.53 114.93 119.36 1umd h MET 18 Ca 0.06 -0.11 -0.15 0.00 -2.06 0.00 0.00 59.70 57.45 1umd h MET 18 Cb 0.75 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.39 1umd h MET 18 CO 0.06 0.61 -0.63 0.00 1.06 0.00 0.00 176.91 178.01 1umd h ALA 19 N 1.38 0.86 0.10 6.32 0.00 -1.05 -3.25 119.26 123.62 1umd h ALA 19 Ca 0.02 -0.56 -0.26 0.00 0.00 0.00 0.00 54.91 54.11 1umd h ALA 19 Cb 0.81 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1umd h ALA 19 CO 0.06 0.75 -1.19 0.87 0.00 0.00 0.00 179.25 179.75 1umd h LYS 20 N 0.13 0.22 -3.68 0.00 1.57 -1.03 -3.44 116.57 110.33 1umd h LYS 20 Ca -0.01 -0.37 -0.49 0.00 -1.87 0.00 0.00 60.65 57.91 1umd h LYS 20 Cb 1.13 0.14 -0.39 0.00 0.08 0.00 0.00 32.23 33.19 1umd h LYS 20 CO 0.09 1.17 -0.77 0.34 -0.57 0.00 0.00 179.45 179.72 1umd s ASP 21 N -7.06 2.36 0.63 0.86 -1.08 -0.24 -5.01 116.67 107.13 1umd s ASP 21 Ca -0.03 -0.50 0.38 0.00 -0.52 0.00 0.00 52.55 51.88 1umd s ASP 21 Cb 0.08 -0.57 2.13 0.00 -1.46 0.00 0.00 42.92 43.10 1umd s ASP 21 CO 0.87 -0.25 2.30 -0.65 0.52 0.00 0.00 175.17 177.97 1umd h PRO 22 N 8.26 0.00 0.00 4.34 0.11 -1.86 -2.12 132.00 140.74 1umd h PRO 22 Ca -0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.92 1umd h PRO 22 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1umd h PRO 22 CO 0.32 0.01 0.00 0.00 -0.21 0.00 0.00 178.00 178.11 1umd h ARG 23 N 0.00 0.00 -6.17 1.05 3.08 -1.91 -3.43 114.38 107.00 1umd h ARG 23 Ca -0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.49 1umd h ARG 23 Cb 0.04 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.05 1umd h ARG 23 CO 0.00 0.00 0.93 0.08 -1.07 0.00 0.00 179.97 179.91 1umd s VAL 24 N -3.57 4.16 0.08 2.04 1.01 -0.80 -0.69 120.40 122.64 1umd s VAL 24 Ca 0.02 1.41 0.05 0.00 0.00 0.00 0.00 61.98 63.47 1umd s VAL 24 Cb 0.08 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 1umd s VAL 24 CO 0.56 -0.12 -0.14 0.68 0.00 0.00 0.00 175.10 176.07 1umd s VAL 25 N 3.57 1.18 -0.09 2.92 -7.23 -1.02 -4.85 120.40 114.88 1umd s VAL 25 Ca 0.58 -1.41 0.02 0.00 -1.81 0.00 0.00 61.98 59.35 1umd s VAL 25 Cb -0.24 -1.20 -0.02 0.00 0.56 0.00 0.00 36.38 35.48 1umd s VAL 25 CO 0.17 -0.27 -0.13 -0.69 -0.31 0.00 0.00 175.10 173.88 1umd s VAL 26 N -1.49 3.14 -0.02 1.32 1.01 0.90 -0.08 120.40 125.18 1umd s VAL 26 Ca 0.01 -0.66 -0.08 0.00 0.00 0.00 0.00 61.98 61.24 1umd s VAL 26 Cb -0.09 -2.28 0.01 0.00 0.00 0.00 0.00 36.38 34.03 1umd s VAL 26 CO 0.02 0.56 0.18 -1.48 0.00 0.00 0.00 175.10 174.38 1umd s LEU 27 N -0.24 1.37 0.00 3.92 2.34 -1.06 -0.73 118.68 124.28 1umd s LEU 27 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 54.13 54.21 1umd s LEU 27 Cb -0.13 0.75 0.00 0.00 -0.56 0.00 0.00 46.19 46.25 1umd s LEU 27 CO 0.03 -0.30 0.00 0.61 -1.06 0.00 0.00 176.35 175.63 1umd n GLY 28 N 1.85 -2.85 3.68 -3.48 0.00 -0.99 -1.04 105.19 102.35 1umd n GLY 28 Ca -0.20 -1.34 -0.43 0.00 0.00 0.00 0.00 46.02 44.05 1umd n GLY 28 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1umd s GLU 29 N -1.98 4.31 -1.71 1.61 2.02 -1.26 -1.45 118.70 120.24 1umd s GLU 29 Ca 0.00 1.66 0.00 0.00 0.02 0.00 0.00 54.97 56.65 1umd s GLU 29 Cb 0.00 -3.63 0.00 0.00 0.10 0.00 0.00 34.13 30.60 1umd s GLU 29 CO 0.00 -0.54 0.00 -0.25 0.02 0.00 0.00 175.26 174.49 1umd n ASP 30 N 5.69 -5.61 0.09 -0.19 8.00 -1.26 -4.80 116.55 118.46 1umd n ASP 30 Ca 0.12 0.02 0.12 0.00 0.71 0.00 0.00 54.79 55.76 1umd n ASP 30 Cb 0.46 -4.66 0.11 0.00 -0.02 0.00 0.00 41.12 37.01 1umd n ASP 30 CO 0.00 0.00 0.00 -0.37 -0.39 0.00 0.00 177.20 176.44 1umd h VAL 31 N 0.00 0.00 0.00 2.53 -1.51 -1.88 0.55 116.25 115.94 1umd h VAL 31 Ca -0.46 -0.74 0.00 0.00 -1.23 0.00 0.00 66.70 64.27 1umd h VAL 31 Cb 1.34 1.34 0.00 0.00 -2.13 0.00 0.00 31.29 31.84 1umd h VAL 31 CO 0.55 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.50 1umd n GLY 32 N 1.25 1.68 0.28 5.19 0.00 -1.26 -3.70 105.19 108.63 1umd n GLY 32 Ca 0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.11 1umd n GLY 32 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1umd h LYS 33 N 0.00 0.27 0.00 1.61 3.11 -1.93 0.10 116.57 119.73 1umd h LYS 33 Ca 0.00 -0.02 -0.05 0.00 -2.81 0.00 0.00 60.65 57.77 1umd h LYS 33 Cb 0.00 -0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 31.16 1umd h LYS 33 CO 0.00 0.18 -0.23 0.00 -2.81 0.00 0.00 179.45 176.58 1umd h ARG 34 N 0.28 0.00 -0.17 1.90 3.08 -1.85 -3.47 114.38 114.14 1umd h ARG 34 Ca 0.44 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.41 1umd h ARG 34 Cb 0.77 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.79 1umd h ARG 34 CO -0.53 0.23 -0.07 0.41 -1.07 0.00 0.00 179.97 178.95 1umd n GLY 35 N 0.03 0.66 0.00 0.04 0.00 0.35 -4.81 105.19 101.45 1umd n GLY 35 Ca -0.00 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.13 1umd n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umd n GLY 36 N -2.54 -0.56 0.06 -0.02 0.00 0.19 -2.12 105.19 100.20 1umd n GLY 36 Ca -0.04 -1.41 0.07 0.00 0.00 0.00 0.00 46.02 44.65 1umd n GLY 36 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1umd n VAL 37 N 0.30 1.18 -0.20 1.61 0.24 -1.26 -1.12 118.33 119.07 1umd n VAL 37 Ca 0.00 0.38 0.01 0.00 -2.04 0.00 0.00 64.34 62.69 1umd n VAL 37 Cb 0.00 -1.28 0.01 0.00 -1.47 0.00 0.00 33.84 31.11 1umd n VAL 37 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1umd n PHE 38 N -1.83 0.00 -1.44 6.34 3.72 -1.26 -5.00 117.46 117.98 1umd n PHE 38 Ca 0.02 -0.50 -0.15 0.00 -0.05 0.00 0.00 57.45 56.76 1umd n PHE 38 Cb 0.13 -0.06 -0.07 0.00 -0.94 0.00 0.00 39.48 38.55 1umd n PHE 38 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1umd n LEU 39 N -0.55 -0.94 0.09 4.37 4.77 -0.27 -4.89 117.00 119.58 1umd n LEU 39 Ca 0.02 0.38 0.02 0.00 -0.03 0.00 0.00 56.01 56.40 1umd n LEU 39 Cb 0.31 -2.59 0.38 0.00 -2.33 0.00 0.00 43.42 39.20 1umd n LEU 39 CO 0.00 -0.98 0.93 0.58 -1.33 0.00 0.00 177.39 176.59 1umd h VAL 40 N 0.00 1.17 -0.56 4.08 2.07 -1.80 -2.63 116.25 118.57 1umd h VAL 40 Ca -0.31 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 66.51 1umd h VAL 40 Cb 1.17 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 1umd h VAL 40 CO 0.46 0.23 0.00 0.35 0.02 0.00 0.00 177.57 178.63 1umd n THR 41 N -4.30 2.07 -1.64 2.57 -2.24 -1.00 -3.86 114.28 105.88 1umd n THR 41 Ca 0.00 -1.33 -0.48 0.00 -2.27 0.00 0.00 64.05 59.97 1umd n THR 41 Cb 0.24 0.01 -0.05 0.00 -2.10 0.00 0.00 70.33 68.43 1umd n THR 41 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1umd n GLU 42 N 0.76 1.75 0.00 -0.78 2.13 -0.90 -2.13 120.64 121.47 1umd n GLU 42 Ca 0.25 0.63 0.00 0.00 0.66 0.00 0.00 57.16 58.70 1umd n GLU 42 Cb 0.94 -2.33 0.00 0.00 0.27 0.00 0.00 31.44 30.31 1umd n GLU 42 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1umd n GLY 43 N 2.95 2.71 0.27 8.31 0.00 -1.26 -4.88 105.19 113.29 1umd n GLY 43 Ca 0.17 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.12 1umd n GLY 43 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1umd h LEU 44 N 0.00 0.79 -0.34 0.99 3.38 -1.77 -2.18 115.31 116.17 1umd h LEU 44 Ca 0.00 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 1umd h LEU 44 Cb 0.00 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1umd h LEU 44 CO 0.00 0.94 0.03 0.25 0.09 0.00 0.00 178.44 179.76 1umd h LEU 45 N 0.70 0.57 -1.01 1.67 5.85 -1.83 0.18 115.31 121.44 1umd h LEU 45 Ca 0.11 -0.28 0.05 0.00 0.84 0.00 0.00 57.88 58.60 1umd h LEU 45 Cb 0.65 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.46 1umd h LEU 45 CO 0.05 0.70 0.66 -0.61 -0.34 0.00 0.00 178.44 178.90 1umd h GLN 46 N 0.41 1.19 0.15 1.25 4.15 -1.89 0.22 115.11 120.59 1umd h GLN 46 Ca 0.10 -0.07 -0.31 0.00 0.77 0.00 0.00 58.65 59.14 1umd h GLN 46 Cb 0.39 -0.27 0.00 0.00 0.21 0.00 0.00 27.48 27.82 1umd h GLN 46 CO 0.01 0.79 -1.46 -0.22 -1.93 0.00 0.00 178.83 176.02 1umd h LYS 47 N 1.23 0.31 0.00 1.69 3.64 -1.13 -3.40 116.57 118.91 1umd h LYS 47 Ca 0.42 -0.53 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1umd h LYS 47 Cb 0.09 0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 1umd h LYS 47 CO -0.15 1.21 -0.93 0.66 -2.27 0.00 0.00 179.45 177.97 1umd n TYR 48 N -3.52 0.00 0.00 1.91 4.01 0.60 -5.10 117.16 115.06 1umd n TYR 48 Ca -0.15 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.59 1umd n TYR 48 Cb 1.05 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 39.98 1umd n TYR 48 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1umd n GLY 49 N 1.47 -0.00 0.20 2.72 0.00 0.77 -4.36 105.19 105.99 1umd n GLY 49 Ca 0.01 -1.72 0.14 0.00 0.00 0.00 0.00 46.02 44.45 1umd n GLY 49 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1umd h PRO 50 N 0.00 0.00 -0.01 1.61 0.13 -1.79 -1.27 132.00 130.67 1umd h PRO 50 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1umd h PRO 50 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1umd h PRO 50 CO 0.00 0.00 -0.05 -0.25 -0.23 0.00 0.00 178.00 177.47 1umd n ASP 51 N -2.49 1.08 0.00 1.44 8.00 -1.26 -3.99 116.55 119.33 1umd n ASP 51 Ca -0.01 -1.23 0.00 0.00 0.71 0.00 0.00 54.79 54.26 1umd n ASP 51 Cb 0.10 0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 1umd n ASP 51 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1umd n ARG 52 N -0.25 2.44 -3.79 -1.24 5.12 -0.56 -4.97 116.66 113.42 1umd n ARG 52 Ca 0.18 0.00 -0.28 0.00 -1.93 0.00 0.00 57.85 55.82 1umd n ARG 52 Cb 0.31 -0.96 -0.16 0.00 -1.16 0.00 0.00 32.46 30.48 1umd n ARG 52 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1umd s VAL 53 N -1.89 0.78 -0.07 1.55 1.01 -0.75 -0.07 120.40 120.95 1umd s VAL 53 Ca 0.00 -0.74 0.02 0.00 0.00 0.00 0.00 61.98 61.26 1umd s VAL 53 Cb 0.00 -1.23 0.01 0.00 0.00 0.00 0.00 36.38 35.16 1umd s VAL 53 CO 0.00 -0.19 -0.12 0.00 0.00 0.00 0.00 175.10 174.78 1umd s MET 54 N 1.74 1.77 0.28 2.72 0.23 0.09 -4.36 119.30 121.76 1umd s MET 54 Ca -0.02 -0.42 -0.29 0.00 -1.03 0.00 0.00 55.69 53.92 1umd s MET 54 Cb -0.18 -1.48 -0.10 0.00 -1.53 0.00 0.00 34.83 31.54 1umd s MET 54 CO -0.08 -0.00 1.22 -0.51 -2.03 0.00 0.00 175.02 173.62 1umd s ASP 55 N 0.77 7.00 0.37 -1.18 1.01 -1.26 -2.35 116.67 121.04 1umd s ASP 55 Ca -0.12 2.44 0.08 0.00 0.71 0.00 0.00 52.55 55.66 1umd s ASP 55 Cb -0.16 -2.63 -0.05 0.00 1.01 0.00 0.00 42.92 41.09 1umd s ASP 55 CO 0.02 -0.38 0.10 0.42 0.21 0.00 0.00 175.17 175.55 1umd s THR 56 N -0.83 2.55 1.10 -1.27 -4.23 -0.53 -4.86 115.64 107.57 1umd s THR 56 Ca 0.49 -1.81 -0.13 0.00 -1.18 0.00 0.00 61.69 59.06 1umd s THR 56 Cb -0.36 -2.92 0.25 0.00 1.34 0.00 0.00 72.50 70.81 1umd s THR 56 CO 0.45 -0.11 1.06 -2.84 -0.54 0.00 0.00 174.62 172.64 1umd s PRO 57 N -3.82 -0.40 -1.29 3.99 0.02 -1.26 -4.59 135.00 127.65 1umd s PRO 57 Ca 0.38 0.61 -0.15 0.00 0.02 0.00 0.00 61.00 61.85 1umd s PRO 57 Cb 0.02 -1.63 0.11 0.00 0.02 0.00 0.00 34.50 33.01 1umd s PRO 57 CO 0.21 -3.31 1.73 -0.11 -0.33 0.00 0.00 177.00 175.19 1umd n LEU 58 N -4.60 5.47 -3.42 -5.54 0.00 -1.26 -4.77 117.00 102.88 1umd n LEU 58 Ca 0.04 -4.19 -0.07 0.00 0.00 0.00 0.00 56.01 51.79 1umd n LEU 58 Cb 0.56 -1.67 -0.08 0.00 0.00 0.00 0.00 43.42 42.24 1umd n LEU 58 CO 0.57 0.58 0.00 -0.55 0.00 0.00 0.00 177.39 178.00 1umd s SER 59 N 3.32 -0.13 0.37 1.96 0.15 -1.26 -5.02 113.70 113.09 1umd s SER 59 Ca 0.48 0.56 0.17 0.00 0.70 0.00 0.00 55.95 57.86 1umd s SER 59 Cb 0.04 1.34 0.70 0.00 -1.71 0.00 0.00 66.02 66.39 1umd s SER 59 CO 0.03 -0.27 1.76 -0.33 1.20 0.00 0.00 173.24 175.63 1umd h GLU 60 N 8.15 0.00 -0.40 5.44 3.07 -1.88 -1.31 114.58 127.66 1umd h GLU 60 Ca -0.19 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.57 1umd h GLU 60 Cb 1.14 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.04 1umd h GLU 60 CO 0.22 0.40 -0.15 0.00 -1.40 0.00 0.00 179.01 178.08 1umd h ALA 61 N 1.60 0.56 -0.61 3.43 0.00 -1.86 -1.12 119.26 121.26 1umd h ALA 61 Ca -0.00 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.48 1umd h ALA 61 Cb 0.82 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1umd h ALA 61 CO 0.05 0.47 0.06 0.00 0.00 0.00 0.00 179.25 179.83 1umd h ALA 62 N 0.82 0.81 0.41 0.00 0.00 -1.85 -0.26 119.26 119.20 1umd h ALA 62 Ca 0.09 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1umd h ALA 62 Cb 0.70 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1umd h ALA 62 CO 0.05 0.61 -0.20 0.82 0.00 0.00 0.00 179.25 180.53 1umd h ILE 63 N 0.94 0.53 -0.29 0.00 2.04 -1.11 0.03 117.51 119.65 1umd h ILE 63 Ca 0.18 -0.45 -0.02 0.00 1.00 0.00 0.00 64.86 65.57 1umd h ILE 63 Cb 0.48 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1umd h ILE 63 CO 0.02 0.08 0.11 0.58 0.00 0.00 0.00 178.15 178.93 1umd h VAL 64 N -0.84 1.19 -0.48 1.67 2.07 -1.25 -0.90 116.25 117.71 1umd h VAL 64 Ca -0.06 -0.58 -0.09 0.00 0.82 0.00 0.00 66.70 66.79 1umd h VAL 64 Cb 0.55 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 1umd h VAL 64 CO 0.09 0.20 -0.05 1.23 0.02 0.00 0.00 177.57 179.06 1umd h GLY 65 N 0.32 0.95 1.05 2.17 0.00 -1.11 -1.38 103.07 105.07 1umd h GLY 65 Ca 0.10 -0.74 -0.08 0.00 0.00 0.00 0.00 47.33 46.61 1umd h GLY 65 CO -0.01 0.68 0.09 0.00 0.00 0.00 0.00 176.54 177.31 1umd h ALA 66 N 0.90 0.83 -0.88 3.60 0.00 -0.96 -1.60 119.26 121.15 1umd h ALA 66 Ca 0.13 -0.27 0.05 0.00 0.00 0.00 0.00 54.91 54.82 1umd h ALA 66 Cb 0.59 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 1umd h ALA 66 CO 0.04 0.59 0.56 0.00 0.00 0.00 0.00 179.25 180.44 1umd h ALA 67 N 1.02 1.20 -0.38 0.00 0.00 -0.91 0.68 119.26 120.87 1umd h ALA 67 Ca 0.19 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1umd h ALA 67 Cb 0.44 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1umd h ALA 67 CO 0.01 0.35 0.20 1.25 0.00 0.00 0.00 179.25 181.07 1umd h LEU 68 N 1.05 0.48 -0.67 0.00 7.12 -0.67 0.00 115.31 122.63 1umd h LEU 68 Ca 0.37 -0.10 -0.06 0.00 0.13 0.00 0.00 57.88 58.23 1umd h LEU 68 Cb 0.11 -0.12 -0.03 0.00 -0.53 0.00 0.00 40.66 40.09 1umd h LEU 68 CO -0.15 0.44 0.18 1.23 -0.13 0.00 0.00 178.44 180.01 1umd h GLY 69 N 0.49 1.14 0.98 3.75 0.00 -0.58 -0.16 103.07 108.68 1umd h GLY 69 Ca 0.13 -0.70 -0.02 0.00 0.00 0.00 0.00 47.33 46.74 1umd h GLY 69 CO -0.02 0.66 0.25 -0.33 0.00 0.00 0.00 176.54 177.10 1umd h MET 70 N 0.99 0.73 -0.57 4.80 2.86 -0.62 -1.42 114.93 121.70 1umd h MET 70 Ca 0.21 -0.10 -0.09 0.00 -2.06 0.00 0.00 59.70 57.66 1umd h MET 70 Cb 0.34 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.85 1umd h MET 70 CO -0.00 0.60 -0.02 0.00 1.06 0.00 0.00 176.91 178.54 1umd h ALA 71 N 1.09 0.89 -0.09 6.32 0.00 -0.73 0.31 119.26 127.06 1umd h ALA 71 Ca 0.18 -0.31 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 1umd h ALA 71 Cb 0.10 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1umd h ALA 71 CO -0.02 0.65 -0.43 0.00 0.00 0.00 0.00 179.25 179.45 1umd h ALA 72 N 1.06 1.11 0.00 0.00 0.00 -0.81 -3.35 119.26 117.27 1umd h ALA 72 Ca 0.16 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.59 1umd h ALA 72 Cb 0.56 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1umd h ALA 72 CO 0.03 0.59 -0.38 1.25 0.00 0.00 0.00 179.25 180.74 1umd h HIS 73 N 0.17 0.00 0.00 0.00 6.17 -1.03 -3.45 115.15 117.02 1umd h HIS 73 Ca 0.01 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.09 1umd h HIS 73 Cb 0.83 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.76 1umd h HIS 73 CO 0.01 0.91 0.00 0.41 0.71 0.00 0.00 177.93 179.98 1umd n GLY 74 N 1.59 0.00 3.78 5.26 0.00 -0.32 -5.11 105.19 110.39 1umd n GLY 74 Ca -0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.62 1umd n GLY 74 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1umd s LEU 75 N 0.00 2.93 -0.59 0.99 1.43 -0.05 -4.91 118.68 118.47 1umd s LEU 75 Ca 0.00 -1.18 0.05 0.00 -1.03 0.00 0.00 54.13 51.97 1umd s LEU 75 Cb 0.00 -1.30 0.18 0.00 0.03 0.00 0.00 46.19 45.10 1umd s LEU 75 CO 0.00 -0.70 0.48 0.54 0.23 0.00 0.00 176.35 176.89 1umd n ARG 76 N -1.36 1.34 -2.48 1.70 1.74 0.14 -4.04 116.66 113.70 1umd n ARG 76 Ca -0.03 -4.03 -0.39 0.00 -0.77 0.00 0.00 57.85 52.62 1umd n ARG 76 Cb 0.65 -2.03 -0.04 0.00 -1.02 0.00 0.00 32.46 30.02 1umd n ARG 76 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1umd s PRO 77 N -1.10 4.51 -0.41 5.56 0.04 -1.26 -2.44 135.00 139.90 1umd s PRO 77 Ca 0.30 1.75 0.03 0.00 0.04 0.00 0.00 61.00 63.12 1umd s PRO 77 Cb 0.02 -3.03 0.11 0.00 0.04 0.00 0.00 34.50 31.64 1umd s PRO 77 CO -0.16 0.11 0.14 0.08 0.04 0.00 0.00 177.00 177.20 1umd s VAL 78 N -1.28 2.50 0.21 -0.36 1.01 0.88 -1.51 120.40 121.85 1umd s VAL 78 Ca 0.48 -2.62 -0.15 0.00 0.00 0.00 0.00 61.98 59.68 1umd s VAL 78 Cb -0.30 -2.79 -0.08 0.00 0.00 0.00 0.00 36.38 33.21 1umd s VAL 78 CO 0.38 -0.67 0.63 0.00 0.00 0.00 0.00 175.10 175.44 1umd s ALA 79 N 0.55 3.49 -0.09 5.51 0.00 0.75 -2.57 121.76 129.40 1umd s ALA 79 Ca 0.13 -0.03 0.03 0.00 0.00 0.00 0.00 51.96 52.09 1umd s ALA 79 Cb -0.21 -2.64 -0.01 0.00 0.00 0.00 0.00 23.12 20.25 1umd s ALA 79 CO -0.05 0.40 -0.19 -2.00 0.00 0.00 0.00 175.76 173.92 1umd s GLU 80 N -2.22 2.91 -0.23 0.00 2.12 -0.21 -0.81 118.70 120.27 1umd s GLU 80 Ca 0.43 -0.79 -0.06 0.00 0.36 0.00 0.00 54.97 54.92 1umd s GLU 80 Cb -0.14 -2.38 -0.02 0.00 0.26 0.00 0.00 34.13 31.84 1umd s GLU 80 CO 0.20 0.34 0.01 0.42 -0.54 0.00 0.00 175.26 175.69 1umd s ILE 81 N -0.01 3.90 0.35 -3.70 -1.09 -0.63 -4.39 121.20 115.62 1umd s ILE 81 Ca -0.06 -0.32 0.13 0.00 -2.23 0.00 0.00 60.65 58.18 1umd s ILE 81 Cb -0.15 -2.79 0.34 0.00 -1.58 0.00 0.00 42.46 38.28 1umd s ILE 81 CO 0.05 0.39 1.73 -0.61 -1.23 0.00 0.00 174.94 175.27 1umd h GLN 82 N 7.98 0.47 -3.18 2.79 4.15 -1.91 -3.38 115.11 122.04 1umd h GLN 82 Ca -0.39 -0.03 -0.17 0.00 0.77 0.00 0.00 58.65 58.84 1umd h GLN 82 Cb 1.17 -0.11 -0.26 0.00 0.21 0.00 0.00 27.48 28.50 1umd h GLN 82 CO 0.60 0.31 -0.45 -0.06 -1.93 0.00 0.00 178.83 177.30 1umd s PHE 83 N -5.67 -0.25 0.52 3.99 0.40 -1.26 -4.34 117.98 111.37 1umd s PHE 83 Ca -0.10 0.61 0.29 0.00 -0.60 0.00 0.00 56.93 57.13 1umd s PHE 83 Cb 0.27 0.09 1.43 0.00 0.51 0.00 0.00 43.02 45.32 1umd s PHE 83 CO 0.80 -0.12 1.91 0.00 0.70 0.00 0.00 175.22 178.50 1umd h ALA 84 N 5.79 2.72 0.00 5.36 0.00 -0.90 0.23 119.26 132.45 1umd h ALA 84 Ca -0.26 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 1umd h ALA 84 Cb 1.19 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 1umd h ALA 84 CO 0.36 -0.95 -0.00 -0.44 0.00 0.00 0.00 179.25 178.22 1umd h ASP 85 N 0.04 0.00 -0.62 0.00 5.19 -1.82 -2.42 116.42 116.79 1umd h ASP 85 Ca 0.39 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.80 1umd h ASP 85 Cb 1.52 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.03 1umd h ASP 85 CO -0.02 0.00 0.00 -1.22 -3.12 0.00 0.00 179.24 174.88 1umd n TYR 86 N -3.52 1.85 0.14 4.55 4.01 0.80 -4.30 117.16 120.69 1umd n TYR 86 Ca -0.03 -0.68 0.00 0.00 -0.16 0.00 0.00 57.90 57.04 1umd n TYR 86 Cb 0.08 -0.40 0.17 0.00 -0.31 0.00 0.00 39.34 38.88 1umd n TYR 86 CO 0.00 0.00 0.00 0.97 -0.46 0.00 0.00 176.86 177.37 1umd h ILE 87 N 4.09 1.26 -0.98 -0.72 6.09 -1.55 -3.34 117.51 122.36 1umd h ILE 87 Ca 0.00 -2.11 0.16 0.00 -1.37 0.00 0.00 64.86 61.54 1umd h ILE 87 Cb 1.77 2.19 -0.09 0.00 0.47 0.00 0.00 36.82 41.16 1umd h ILE 87 CO 0.38 0.57 0.61 -0.26 -3.07 0.00 0.00 178.15 176.39 1umd h PHE 88 N 0.00 1.00 0.00 2.19 0.04 -1.82 0.82 116.94 119.18 1umd h PHE 88 Ca -0.01 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.79 1umd h PHE 88 Cb 1.14 -0.31 0.00 0.00 2.20 0.00 0.00 35.95 38.98 1umd h PHE 88 CO 0.00 0.31 0.00 -1.35 -0.60 0.00 0.00 178.31 176.67 1umd h PRO 89 N 0.79 0.00 -0.25 1.51 0.11 -1.92 -1.00 132.00 131.25 1umd h PRO 89 Ca 0.52 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.59 1umd h PRO 89 Cb 0.77 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.85 1umd h PRO 89 CO -0.29 0.00 -0.02 0.41 -0.21 0.00 0.00 178.00 177.89 1umd n GLY 90 N -0.60 4.37 0.29 -0.55 0.00 0.22 -4.03 105.19 104.89 1umd n GLY 90 Ca -0.01 -1.10 -0.06 0.00 0.00 0.00 0.00 46.02 44.84 1umd n GLY 90 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1umd h PHE 91 N 1.36 0.97 -0.51 1.61 3.57 -0.50 -2.16 116.94 121.28 1umd h PHE 91 Ca 0.05 -0.04 -0.08 0.00 3.53 0.00 0.00 57.97 61.44 1umd h PHE 91 Cb 1.44 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.85 1umd h PHE 91 CO 0.55 0.70 0.01 0.22 -2.23 0.00 0.00 178.31 177.56 1umd h ASP 92 N 0.95 0.82 -0.70 0.41 3.58 -1.85 -0.13 116.42 119.51 1umd h ASP 92 Ca 0.24 -0.20 0.01 0.00 0.42 0.00 0.00 57.03 57.50 1umd h ASP 92 Cb 0.08 -0.22 -0.04 0.00 1.72 0.00 0.00 39.33 40.87 1umd h ASP 92 CO -0.03 0.88 0.45 1.56 -2.88 0.00 0.00 179.24 179.22 1umd h GLN 93 N 0.79 0.89 0.06 0.28 1.08 -1.83 0.23 115.11 116.61 1umd h GLN 93 Ca 0.15 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.30 1umd h GLN 93 Cb 0.47 -0.20 0.00 0.00 -0.05 0.00 0.00 27.48 27.70 1umd h GLN 93 CO 0.02 0.59 -0.03 1.25 -0.95 0.00 0.00 178.83 179.71 1umd h LEU 94 N 0.92 -0.07 0.01 1.46 5.85 -0.76 -0.10 115.31 122.62 1umd h LEU 94 Ca 0.26 -0.30 -0.26 0.00 0.84 0.00 0.00 57.88 58.42 1umd h LEU 94 Cb -0.07 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 1umd h LEU 94 CO -0.07 0.27 -1.41 -0.37 -0.34 0.00 0.00 178.44 176.52 1umd h VAL 95 N -0.41 1.22 0.01 1.05 -1.51 -0.99 -1.08 116.25 114.54 1umd h VAL 95 Ca -0.01 -3.00 -0.32 0.00 -1.23 0.00 0.00 66.70 62.13 1umd h VAL 95 Cb 0.36 2.62 -0.06 0.00 -2.13 0.00 0.00 31.29 32.08 1umd h VAL 95 CO 0.01 0.71 -1.97 -1.20 -1.23 0.00 0.00 177.57 173.90 1umd n SER 96 N -3.20 0.68 -0.08 4.19 7.64 0.79 -4.18 113.62 119.47 1umd n SER 96 Ca -0.10 0.25 -0.10 0.00 1.01 0.00 0.00 58.87 59.93 1umd n SER 96 Cb 1.01 0.23 -0.03 0.00 -1.01 0.00 0.00 64.21 64.41 1umd n SER 96 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1umd n GLN 97 N -2.98 0.48 0.45 1.43 1.13 -0.86 -4.45 117.38 112.58 1umd n GLN 97 Ca -0.24 0.19 -0.19 0.00 -1.94 0.00 0.00 57.00 54.83 1umd n GLN 97 Cb 1.09 -1.35 -0.09 0.00 0.11 0.00 0.00 30.24 30.00 1umd n GLN 97 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1umd h VAL 98 N -0.90 0.10 -0.82 5.09 2.07 -1.03 -2.39 116.25 118.35 1umd h VAL 98 Ca -0.07 -0.08 0.06 0.00 0.82 0.00 0.00 66.70 67.43 1umd h VAL 98 Cb 0.97 0.11 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 1umd h VAL 98 CO -0.04 0.00 0.54 0.00 0.02 0.00 0.00 177.57 178.09 1umd h ALA 99 N -1.13 1.59 -0.07 1.67 0.00 -1.39 -3.11 119.26 116.83 1umd h ALA 99 Ca -0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1umd h ALA 99 Cb 0.89 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1umd h ALA 99 CO 0.19 0.28 0.00 1.63 0.00 0.00 0.00 179.25 181.36 1umd n LYS 100 N -4.48 2.32 0.12 0.00 5.02 -1.24 -4.34 118.16 115.57 1umd n LYS 100 Ca 0.12 -1.93 -0.13 0.00 -2.02 0.00 0.00 58.31 54.36 1umd n LYS 100 Cb 0.21 -1.47 -0.06 0.00 -0.02 0.00 0.00 35.03 33.69 1umd n LYS 100 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1umd h LEU 101 N 4.58 -0.80 -0.32 -0.35 5.85 -1.35 0.11 115.31 123.03 1umd h LEU 101 Ca 0.00 0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 1umd h LEU 101 Cb 0.98 0.30 -0.02 0.00 0.37 0.00 0.00 40.66 42.29 1umd h LEU 101 CO 0.00 -0.38 0.20 -0.09 -0.34 0.00 0.00 178.44 177.84 1umd h ARG 102 N -0.51 0.44 0.51 1.25 2.43 -1.81 -2.28 114.38 114.40 1umd h ARG 102 Ca 0.03 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 1umd h ARG 102 Cb 0.53 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.99 1umd h ARG 102 CO -0.15 0.32 -0.24 -0.92 -1.51 0.00 0.00 179.97 177.47 1umd h TYR 103 N 0.42 -0.63 0.00 2.20 3.20 -1.80 0.15 116.97 120.51 1umd h TYR 103 Ca 0.12 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 1umd h TYR 103 Cb -0.01 0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.47 1umd h TYR 103 CO -0.04 -0.34 -0.05 0.07 -1.64 0.00 0.00 178.16 176.15 1umd h ARG 104 N -0.80 0.00 -0.54 1.82 0.11 -0.79 -2.28 114.38 111.89 1umd h ARG 104 Ca -0.07 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.01 1umd h ARG 104 Cb 0.57 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.65 1umd h ARG 104 CO 0.11 0.05 0.00 -1.13 0.10 0.00 0.00 179.97 179.11 1umd n SER 105 N -3.37 3.38 -1.71 0.08 3.41 -0.86 -4.92 113.62 109.61 1umd n SER 105 Ca -0.02 -1.98 -0.18 0.00 -0.26 0.00 0.00 58.87 56.44 1umd n SER 105 Cb 0.19 -0.36 -0.04 0.00 -0.26 0.00 0.00 64.21 63.75 1umd n SER 105 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1umd n GLY 106 N 1.51 0.59 1.80 5.00 0.00 -0.86 -1.81 105.19 111.42 1umd n GLY 106 Ca 0.21 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1umd n GLY 106 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umd n GLY 107 N -0.92 0.79 0.22 -0.02 0.00 0.49 -4.94 105.19 100.81 1umd n GLY 107 Ca -0.19 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.78 1umd n GLY 107 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1umd h GLN 108 N 3.33 0.44 -6.37 1.61 4.20 -1.59 -3.43 115.11 113.30 1umd h GLN 108 Ca 0.00 -0.21 -0.66 0.00 0.06 0.00 0.00 58.65 57.84 1umd h GLN 108 Cb 0.00 -0.00 -0.29 0.00 0.30 0.00 0.00 27.48 27.48 1umd h GLN 108 CO 0.00 0.76 -0.87 -0.06 -0.67 0.00 0.00 178.83 177.98 1umd s PHE 109 N -4.24 2.12 0.25 2.96 0.08 -1.26 -5.13 117.98 112.76 1umd s PHE 109 Ca -0.06 -0.40 0.08 0.00 0.12 0.00 0.00 56.93 56.66 1umd s PHE 109 Cb 0.13 -1.35 -0.05 0.00 -0.57 0.00 0.00 43.02 41.17 1umd s PHE 109 CO 0.80 -0.02 -0.10 0.95 -0.10 0.00 0.00 175.22 176.75 1umd s THR 110 N -0.58 1.77 -0.58 0.64 -4.23 -1.26 -3.33 115.64 108.07 1umd s THR 110 Ca 0.09 -2.18 0.06 0.00 -1.18 0.00 0.00 61.69 58.48 1umd s THR 110 Cb -0.09 -2.29 0.25 0.00 1.34 0.00 0.00 72.50 71.70 1umd s THR 110 CO -0.01 -0.41 0.68 0.00 -0.54 0.00 0.00 174.62 174.34 1umd n ALA 111 N -0.52 3.64 -1.82 3.99 0.00 -1.26 -3.64 120.51 120.89 1umd n ALA 111 Ca -0.06 -4.41 -0.39 0.00 0.00 0.00 0.00 53.44 48.57 1umd n ALA 111 Cb 0.62 -0.88 -0.03 0.00 0.00 0.00 0.00 19.45 19.15 1umd n ALA 111 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1umd n PRO 112 N 1.06 2.20 -4.19 0.00 -0.04 -1.12 -2.89 135.00 130.02 1umd n PRO 112 Ca 0.27 -2.48 -0.14 0.00 -0.04 0.00 0.00 63.50 61.11 1umd n PRO 112 Cb 0.44 -3.33 -0.11 0.00 -0.04 0.00 0.00 33.50 30.46 1umd n PRO 112 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 1umd s LEU 113 N 4.52 2.44 -0.05 1.53 0.05 -1.26 -4.12 118.68 121.80 1umd s LEU 113 Ca 0.57 -0.87 0.05 0.00 0.05 0.00 0.00 54.13 53.92 1umd s LEU 113 Cb 0.08 -0.28 -0.01 0.00 -2.05 0.00 0.00 46.19 43.94 1umd s LEU 113 CO 0.07 -0.30 -0.19 -0.69 -0.55 0.00 0.00 176.35 174.68 1umd s VAL 114 N -2.76 1.59 -0.32 1.48 1.01 -0.57 -1.68 120.40 119.15 1umd s VAL 114 Ca 0.08 -0.81 0.03 0.00 0.00 0.00 0.00 61.98 61.28 1umd s VAL 114 Cb -0.01 -1.36 0.09 0.00 0.00 0.00 0.00 36.38 35.10 1umd s VAL 114 CO -0.01 0.45 0.01 -0.69 0.00 0.00 0.00 175.10 174.87 1umd s VAL 115 N -0.04 2.34 0.15 2.92 1.01 -0.05 -0.18 120.40 126.56 1umd s VAL 115 Ca -0.03 -2.09 -0.02 0.00 0.00 0.00 0.00 61.98 59.84 1umd s VAL 115 Cb -0.12 -2.61 -0.05 0.00 0.00 0.00 0.00 36.38 33.60 1umd s VAL 115 CO 0.02 -0.43 0.34 0.00 0.00 0.00 0.00 175.10 175.04 1umd s ARG 116 N 0.99 3.53 -0.27 2.72 1.70 0.01 -0.32 118.95 127.31 1umd s ARG 116 Ca 0.05 -0.30 -0.24 0.00 -0.47 0.00 0.00 55.73 54.76 1umd s ARG 116 Cb -0.20 -2.89 0.08 0.00 -0.57 0.00 0.00 34.95 31.37 1umd s ARG 116 CO -0.07 0.47 0.76 0.00 -1.08 0.00 0.00 175.30 175.38 1umd s MET 117 N -2.95 0.79 0.46 3.89 0.23 -0.29 -1.60 119.30 119.82 1umd s MET 117 Ca 0.38 0.97 -0.22 0.00 -1.03 0.00 0.00 55.69 55.79 1umd s MET 117 Cb -0.12 0.37 -0.08 0.00 -1.53 0.00 0.00 34.83 33.47 1umd s MET 117 CO 0.27 -0.10 1.07 -2.14 -2.03 0.00 0.00 175.02 172.09 1umd s PRO 118 N 0.47 3.88 0.34 3.16 0.02 -1.26 -0.92 135.00 140.70 1umd s PRO 118 Ca -0.00 1.49 -0.05 0.00 0.02 0.00 0.00 61.00 62.45 1umd s PRO 118 Cb -0.05 -2.28 0.02 0.00 0.02 0.00 0.00 34.50 32.21 1umd s PRO 118 CO -0.02 -0.38 0.54 -1.13 -0.33 0.00 0.00 177.00 175.68 1umd n SER 119 N -0.63 -1.52 0.00 2.53 3.41 0.05 -0.33 113.62 117.13 1umd n SER 119 Ca 0.08 -2.72 0.00 0.00 -0.26 0.00 0.00 58.87 55.97 1umd n SER 119 Cb 0.51 2.73 0.00 0.00 -0.26 0.00 0.00 64.21 67.19 1umd n SER 119 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1umd n GLY 120 N -0.54 -2.44 0.00 5.00 0.00 -0.71 -1.20 105.19 105.31 1umd n GLY 120 Ca -0.02 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.54 1umd n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umd n GLY 121 N -1.86 1.51 2.05 -0.02 0.00 -0.95 -4.24 105.19 101.67 1umd n GLY 121 Ca 0.00 -1.82 -0.00 0.00 0.00 0.00 0.00 46.02 44.20 1umd n GLY 121 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umd n GLY 122 N 5.00 0.47 0.12 -0.02 0.00 -1.26 -4.55 105.19 104.94 1umd n GLY 122 Ca 0.00 -0.35 0.03 0.00 0.00 0.00 0.00 46.02 45.69 1umd n GLY 122 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1umd n VAL 123 N -2.95 0.78 -3.43 1.61 0.24 -1.26 -4.93 118.33 108.39 1umd n VAL 123 Ca -0.00 -0.88 -0.24 0.00 -2.04 0.00 0.00 64.34 61.18 1umd n VAL 123 Cb 0.03 0.44 0.06 0.00 -1.47 0.00 0.00 33.84 32.90 1umd n VAL 123 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1umd n ARG 124 N -0.51 -6.87 0.00 7.34 1.74 -1.26 -4.91 116.66 112.19 1umd n ARG 124 Ca 0.04 0.84 0.14 0.00 -0.77 0.00 0.00 57.85 58.10 1umd n ARG 124 Cb 0.50 -5.83 0.55 0.00 -1.02 0.00 0.00 32.46 26.65 1umd n ARG 124 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1umd n GLY 125 N -1.84 -0.32 7.00 -0.13 0.00 -1.26 -5.02 105.19 103.61 1umd n GLY 125 Ca -0.03 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.60 1umd n GLY 125 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umd n GLY 126 N 1.20 0.52 0.36 -0.02 0.00 -1.26 -2.42 105.19 103.57 1umd n GLY 126 Ca 0.18 -0.82 -0.01 0.00 0.00 0.00 0.00 46.02 45.36 1umd n GLY 126 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1umd h HIS 127 N 0.00 1.08 -0.05 1.61 3.86 -1.78 -3.33 115.15 116.54 1umd h HIS 127 Ca 0.00 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 1umd h HIS 127 Cb 0.00 -0.36 -0.01 0.00 1.06 0.00 0.00 27.41 28.10 1umd h HIS 127 CO 0.00 0.71 -0.25 0.72 0.86 0.00 0.00 177.93 179.97 1umd n HIS 128 N -4.39 0.15 -2.26 2.45 8.25 -1.25 -4.47 115.22 113.71 1umd n HIS 128 Ca 0.09 -1.29 0.03 0.00 -0.26 0.00 0.00 57.72 56.29 1umd n HIS 128 Cb 0.05 -0.24 0.02 0.00 1.12 0.00 0.00 29.99 30.94 1umd n HIS 128 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1umd n HIS 129 N -1.21 0.00 -0.18 4.41 -0.00 -1.02 -4.63 115.22 112.59 1umd n HIS 129 Ca 0.19 -0.34 0.00 0.00 -0.00 0.00 0.00 57.72 57.58 1umd n HIS 129 Cb 0.71 -0.11 0.00 0.00 -0.00 0.00 0.00 29.99 30.59 1umd n HIS 129 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 1umd n SER 130 N 0.23 0.00 -4.64 0.41 7.64 -1.25 -4.29 113.62 111.72 1umd n SER 130 Ca 0.04 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.56 1umd n SER 130 Cb 0.95 0.00 0.08 0.00 -1.01 0.00 0.00 64.21 64.23 1umd n SER 130 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1umd n GLN 131 N 0.00 0.72 -3.67 1.43 6.02 -1.26 -2.25 117.38 118.38 1umd n GLN 131 Ca 0.00 0.30 -0.29 0.00 -0.01 0.00 0.00 57.00 57.00 1umd n GLN 131 Cb 0.00 -2.28 -0.12 0.00 1.02 0.00 0.00 30.24 28.85 1umd n GLN 131 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1umd s SER 132 N -1.50 3.40 -0.05 1.08 0.01 -1.26 -1.74 113.70 113.64 1umd s SER 132 Ca 0.76 -2.83 0.07 0.00 1.31 0.00 0.00 55.95 55.27 1umd s SER 132 Cb -0.37 -0.97 0.30 0.00 0.21 0.00 0.00 66.02 65.19 1umd s SER 132 CO 0.47 -0.23 1.09 -0.81 0.41 0.00 0.00 173.24 174.17 1umd n PRO 133 N 3.26 2.17 -0.25 12.44 -0.04 -1.26 -4.61 135.00 146.71 1umd n PRO 133 Ca 0.14 -1.16 0.24 0.00 -0.04 0.00 0.00 63.50 62.67 1umd n PRO 133 Cb 0.37 -1.56 0.59 0.00 -0.04 0.00 0.00 33.50 32.86 1umd n PRO 133 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1umd h GLU 134 N 1.63 0.25 -0.93 0.54 9.09 -1.99 -1.20 114.58 121.97 1umd h GLU 134 Ca 0.00 -0.02 0.07 0.00 0.05 0.00 0.00 59.36 59.47 1umd h GLU 134 Cb 0.79 -0.06 -0.07 0.00 -1.65 0.00 0.00 28.75 27.76 1umd h GLU 134 CO 0.11 0.17 0.59 0.00 0.05 0.00 0.00 179.01 179.92 1umd h ALA 135 N 1.58 1.31 -0.66 1.06 0.00 -1.91 0.12 119.26 120.77 1umd h ALA 135 Ca 0.49 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.45 1umd h ALA 135 Cb 1.47 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.97 1umd h ALA 135 CO -0.14 0.32 0.44 0.45 0.00 0.00 0.00 179.25 180.32 1umd h HIS 136 N 1.04 0.67 0.17 0.00 3.86 -1.57 -0.48 115.15 118.85 1umd h HIS 136 Ca 0.42 0.02 -0.23 0.00 -1.16 0.00 0.00 60.37 59.41 1umd h HIS 136 Cb 0.22 -0.22 0.02 0.00 1.06 0.00 0.00 27.41 28.50 1umd h HIS 136 CO -0.02 0.36 -1.01 0.74 0.86 0.00 0.00 177.93 178.86 1umd h PHE 137 N 0.67 0.64 -0.46 2.45 0.04 -1.19 -3.24 116.94 115.84 1umd h PHE 137 Ca 0.28 -0.47 -0.02 0.00 2.80 0.00 0.00 57.97 60.57 1umd h PHE 137 Cb 0.26 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.36 1umd h PHE 137 CO -0.00 1.39 0.20 0.28 -0.60 0.00 0.00 178.31 179.58 1umd h VAL 138 N -0.25 1.17 0.00 -0.55 2.07 -0.76 -1.49 116.25 116.44 1umd h VAL 138 Ca -0.18 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 66.84 1umd h VAL 138 Cb 1.77 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 1umd h VAL 138 CO 0.17 0.20 0.00 -0.74 0.02 0.00 0.00 177.57 177.22 1umd h HIS 139 N 0.65 0.00 -3.26 1.57 -0.00 -1.18 -3.41 115.15 109.53 1umd h HIS 139 Ca 0.16 0.00 -0.71 0.00 -0.00 0.00 0.00 60.37 59.83 1umd h HIS 139 Cb 0.10 0.00 -0.20 0.00 -0.00 0.00 0.00 27.41 27.32 1umd h HIS 139 CO 0.01 0.00 -0.09 0.99 -0.00 0.00 0.00 177.93 178.84 1umd s THR 140 N -3.48 5.01 0.27 6.26 2.01 -0.56 -5.04 115.64 120.10 1umd s THR 140 Ca 0.03 -0.73 -0.30 0.00 0.31 0.00 0.00 61.69 61.00 1umd s THR 140 Cb 0.09 -4.24 -0.13 0.00 0.01 0.00 0.00 72.50 68.23 1umd s THR 140 CO 0.48 -0.74 1.47 0.00 -0.69 0.00 0.00 174.62 175.14 1umd n ALA 141 N 5.82 1.72 0.00 7.40 0.00 -1.26 -3.12 120.51 131.06 1umd n ALA 141 Ca -0.09 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1umd n ALA 141 Cb 0.45 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.55 1umd n ALA 141 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1umd n GLY 142 N 1.98 0.65 3.31 0.00 0.00 -1.26 -4.57 105.19 105.30 1umd n GLY 142 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1umd n GLY 142 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1umd s LEU 143 N 0.00 2.53 0.25 0.99 1.43 -1.18 -4.53 118.68 118.17 1umd s LEU 143 Ca 0.00 -0.42 -0.16 0.00 -1.03 0.00 0.00 54.13 52.52 1umd s LEU 143 Cb 0.00 -1.56 -0.08 0.00 0.03 0.00 0.00 46.19 44.58 1umd s LEU 143 CO 0.00 0.13 0.69 -0.54 0.23 0.00 0.00 176.35 176.87 1umd s LYS 144 N 0.52 4.08 -0.06 1.70 1.02 -0.61 -4.85 119.74 121.54 1umd s LYS 144 Ca -0.10 0.69 0.01 0.00 0.02 0.00 0.00 55.97 56.59 1umd s LYS 144 Cb -0.16 -2.69 0.02 0.00 -0.52 0.00 0.00 37.83 34.48 1umd s LYS 144 CO 0.04 0.30 -0.07 0.08 -0.92 0.00 0.00 175.35 174.78 1umd s VAL 145 N -1.73 0.79 -0.03 3.17 1.01 -0.41 -0.81 120.40 122.40 1umd s VAL 145 Ca 0.47 -0.26 0.03 0.00 0.00 0.00 0.00 61.98 62.22 1umd s VAL 145 Cb -0.13 -0.77 0.00 0.00 0.00 0.00 0.00 36.38 35.48 1umd s VAL 145 CO 0.19 0.28 -0.09 -0.69 0.00 0.00 0.00 175.10 174.79 1umd s VAL 146 N 0.91 0.81 -0.14 2.92 1.01 -0.33 -0.21 120.40 125.37 1umd s VAL 146 Ca -0.11 -0.38 -0.01 0.00 0.00 0.00 0.00 61.98 61.48 1umd s VAL 146 Cb -0.15 -0.72 0.04 0.00 0.00 0.00 0.00 36.38 35.55 1umd s VAL 146 CO 0.01 0.25 -0.03 0.00 0.00 0.00 0.00 175.10 175.33 1umd s ALA 147 N 0.17 1.21 0.34 5.51 0.00 0.51 0.04 121.76 129.53 1umd s ALA 147 Ca -0.03 -0.61 0.01 0.00 0.00 0.00 0.00 51.96 51.33 1umd s ALA 147 Cb -0.08 -1.02 -0.03 0.00 0.00 0.00 0.00 23.12 21.99 1umd s ALA 147 CO 0.01 -0.72 0.53 0.14 0.00 0.00 0.00 175.76 175.72 1umd s VAL 148 N 1.76 5.07 0.00 0.00 -7.23 -1.06 -4.25 120.40 114.68 1umd s VAL 148 Ca 0.02 -0.52 0.00 0.00 -1.81 0.00 0.00 61.98 59.67 1umd s VAL 148 Cb -0.14 -3.84 0.00 0.00 0.56 0.00 0.00 36.38 32.95 1umd s VAL 148 CO -0.07 -0.53 0.01 -1.54 -0.31 0.00 0.00 175.10 172.67 1umd n SER 149 N -1.76 0.03 -4.05 4.85 3.41 -1.26 -4.33 113.62 110.51 1umd n SER 149 Ca -0.05 -0.98 -0.09 0.00 -0.26 0.00 0.00 58.87 57.48 1umd n SER 149 Cb 0.56 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.41 1umd n SER 149 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1umd s THR 150 N -0.00 0.30 0.23 6.66 -4.23 -1.26 -5.02 115.64 112.31 1umd s THR 150 Ca 0.00 -1.35 -0.08 0.00 -1.18 0.00 0.00 61.69 59.08 1umd s THR 150 Cb 0.00 -0.90 0.19 0.00 1.34 0.00 0.00 72.50 73.13 1umd s THR 150 CO 0.00 -0.68 1.88 -0.65 -0.54 0.00 0.00 174.62 174.63 1umd h PRO 151 N 3.94 1.02 -0.38 3.99 0.11 -1.88 -0.17 132.00 138.63 1umd h PRO 151 Ca -0.34 -0.06 0.03 0.00 0.11 0.00 0.00 66.00 65.74 1umd h PRO 151 Cb 1.18 -0.23 -0.03 0.00 0.11 0.00 0.00 31.00 32.03 1umd h PRO 151 CO 0.52 0.67 0.19 -0.92 -0.21 0.00 0.00 178.00 178.25 1umd h TYR 152 N 1.05 0.35 -0.40 0.65 3.20 -1.90 -2.26 116.97 117.67 1umd h TYR 152 Ca 0.32 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 62.07 1umd h TYR 152 Cb -0.02 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.13 1umd h TYR 152 CO -0.02 0.19 -0.29 -0.44 -1.64 0.00 0.00 178.16 175.96 1umd h ASP 153 N 0.39 0.89 -0.19 -2.11 3.32 -1.90 -2.54 116.42 114.28 1umd h ASP 153 Ca 0.16 -0.36 0.05 0.00 0.02 0.00 0.00 57.03 56.91 1umd h ASP 153 Cb 0.07 -0.25 -0.06 0.00 0.22 0.00 0.00 39.33 39.32 1umd h ASP 153 CO -0.11 1.11 -0.17 0.00 -1.72 0.00 0.00 179.24 178.34 1umd h ALA 154 N 0.94 -0.05 0.12 3.45 0.00 -0.61 0.23 119.26 123.33 1umd h ALA 154 Ca 0.08 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1umd h ALA 154 Cb 0.84 0.37 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1umd h ALA 154 CO 0.07 -0.61 -0.06 -0.22 0.00 0.00 0.00 179.25 178.44 1umd h LYS 155 N -0.19 -0.15 -0.74 0.00 3.64 -1.42 -1.68 116.57 116.04 1umd h LYS 155 Ca 0.12 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.53 1umd h LYS 155 Cb 0.36 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.18 1umd h LYS 155 CO -0.30 0.15 0.48 0.78 -2.27 0.00 0.00 179.45 178.29 1umd h GLY 156 N -0.46 1.06 1.87 5.01 0.00 -1.28 -2.27 103.07 106.99 1umd h GLY 156 Ca -0.02 -0.37 -0.23 0.00 0.00 0.00 0.00 47.33 46.71 1umd h GLY 156 CO 0.03 0.34 -1.08 1.41 0.00 0.00 0.00 176.54 177.24 1umd h LEU 157 N 0.96 0.16 -0.70 3.11 3.38 -0.61 -2.35 115.31 119.26 1umd h LEU 157 Ca 0.28 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 57.97 1umd h LEU 157 Cb -0.05 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1umd h LEU 157 CO -0.08 1.12 -0.24 0.25 0.09 0.00 0.00 178.44 179.57 1umd h LEU 158 N 0.03 0.75 -0.57 1.67 5.85 -1.23 0.12 115.31 121.93 1umd h LEU 158 Ca -0.05 -0.28 -0.07 0.00 0.84 0.00 0.00 57.88 58.32 1umd h LEU 158 Cb 1.83 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.63 1umd h LEU 158 CO 0.16 0.97 0.09 0.11 -0.34 0.00 0.00 178.44 179.42 1umd h LYS 159 N 0.64 0.95 -0.71 1.25 1.57 -1.44 -1.35 116.57 117.48 1umd h LYS 159 Ca 0.09 -0.26 -0.04 0.00 -1.87 0.00 0.00 60.65 58.56 1umd h LYS 159 Cb 0.75 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.92 1umd h LYS 159 CO 0.06 0.91 0.27 0.00 -0.57 0.00 0.00 179.45 180.12 1umd h ALA 160 N 1.00 0.92 -0.47 3.86 0.00 -1.04 -2.32 119.26 121.22 1umd h ALA 160 Ca 0.17 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1umd h ALA 160 Cb 0.42 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1umd h ALA 160 CO 0.01 0.55 0.25 0.00 0.00 0.00 0.00 179.25 180.07 1umd h ALA 161 N 1.13 0.61 -0.25 0.00 0.00 -0.44 0.13 119.26 120.43 1umd h ALA 161 Ca 0.24 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1umd h ALA 161 Cb 0.22 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1umd h ALA 161 CO -0.02 0.14 0.04 0.82 0.00 0.00 0.00 179.25 180.23 1umd h ILE 162 N 0.62 1.14 0.00 0.00 2.04 -1.03 -2.19 117.51 118.08 1umd h ILE 162 Ca 0.17 -0.50 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 1umd h ILE 162 Cb 0.07 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1umd h ILE 162 CO -0.03 0.17 -0.46 0.03 0.00 0.00 0.00 178.15 177.86 1umd h ARG 163 N 0.36 0.00 -6.69 2.37 3.08 -0.94 -3.46 114.38 109.10 1umd h ARG 163 Ca 0.09 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.62 1umd h ARG 163 Cb 0.18 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.25 1umd h ARG 163 CO -0.00 0.11 0.58 0.34 -1.07 0.00 0.00 179.97 179.92 1umd s ASP 164 N -5.99 7.03 0.43 7.04 -1.08 -0.01 -4.94 116.67 119.15 1umd s ASP 164 Ca 0.04 2.30 0.22 0.00 -0.52 0.00 0.00 52.55 54.60 1umd s ASP 164 Cb 0.07 -2.61 0.32 0.00 -1.46 0.00 0.00 42.92 39.24 1umd s ASP 164 CO 0.73 -0.40 1.59 -0.33 0.52 0.00 0.00 175.17 177.28 1umd h GLU 165 N 5.06 0.00 -6.82 4.34 4.39 -1.88 -3.43 114.58 116.24 1umd h GLU 165 Ca -0.45 0.00 -0.48 0.00 0.34 0.00 0.00 59.36 58.77 1umd h GLU 165 Cb 1.21 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.84 1umd h GLU 165 CO 0.74 0.03 0.28 -0.51 -1.16 0.00 0.00 179.01 178.39 1umd s ASP 166 N -6.22 7.22 0.34 1.42 1.01 -1.26 -2.78 116.67 116.40 1umd s ASP 166 Ca 0.07 1.71 -0.29 0.00 0.71 0.00 0.00 52.55 54.74 1umd s ASP 166 Cb 0.05 -2.53 -0.11 0.00 1.01 0.00 0.00 42.92 41.34 1umd s ASP 166 CO 0.68 -0.07 1.51 -2.84 0.21 0.00 0.00 175.17 174.66 1umd s PRO 167 N -2.16 4.13 -0.07 8.23 0.02 -1.14 -4.55 135.00 139.46 1umd s PRO 167 Ca 0.50 2.54 0.02 0.00 0.02 0.00 0.00 61.00 64.08 1umd s PRO 167 Cb -0.17 -3.00 0.02 0.00 0.02 0.00 0.00 34.50 31.37 1umd s PRO 167 CO 0.22 -0.55 -0.11 0.08 -0.33 0.00 0.00 177.00 176.31 1umd s VAL 168 N -0.67 1.09 -0.25 3.83 1.01 -0.68 -1.57 120.40 123.16 1umd s VAL 168 Ca 0.57 -0.43 -0.14 0.00 0.00 0.00 0.00 61.98 61.98 1umd s VAL 168 Cb -0.46 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 1umd s VAL 168 CO 0.56 0.35 0.31 -0.69 0.00 0.00 0.00 175.10 175.64 1umd s VAL 169 N 0.84 5.24 -0.31 2.92 1.01 0.01 -0.88 120.40 129.24 1umd s VAL 169 Ca -0.11 0.47 -0.04 0.00 0.00 0.00 0.00 61.98 62.30 1umd s VAL 169 Cb -0.15 -3.64 0.04 0.00 0.00 0.00 0.00 36.38 32.63 1umd s VAL 169 CO 0.02 0.23 0.04 0.12 0.00 0.00 0.00 175.10 175.51 1umd s PHE 170 N 1.62 3.25 -0.19 5.22 5.36 0.57 -1.18 117.98 132.62 1umd s PHE 170 Ca 0.13 -1.67 -0.12 0.00 -0.96 0.00 0.00 56.93 54.32 1umd s PHE 170 Cb -0.15 -2.17 -0.05 0.00 -0.34 0.00 0.00 43.02 40.31 1umd s PHE 170 CO 0.08 -0.77 0.20 -0.51 -1.46 0.00 0.00 175.22 172.77 1umd s LEU 171 N 1.32 4.21 -0.34 6.12 1.02 0.11 -1.14 118.68 129.98 1umd s LEU 171 Ca -0.04 0.32 -0.00 0.00 0.02 0.00 0.00 54.13 54.44 1umd s LEU 171 Cb -0.19 -2.21 0.08 0.00 0.02 0.00 0.00 46.19 43.89 1umd s LEU 171 CO 0.00 0.13 0.06 -1.61 0.02 0.00 0.00 176.35 174.95 1umd s GLU 172 N 0.52 2.06 -0.21 1.70 2.02 -0.09 -2.57 118.70 122.13 1umd s GLU 172 Ca 0.11 -1.58 -0.29 0.00 0.02 0.00 0.00 54.97 53.23 1umd s GLU 172 Cb -0.12 -3.28 -0.06 0.00 0.10 0.00 0.00 34.13 30.77 1umd s GLU 172 CO 0.01 -0.83 2.21 -2.30 0.02 0.00 0.00 175.26 174.37 1umd n PRO 173 N 4.51 1.97 0.12 0.39 -0.02 -1.26 -0.77 135.00 139.94 1umd n PRO 173 Ca -0.06 0.55 0.13 0.00 -2.02 0.00 0.00 63.50 62.10 1umd n PRO 173 Cb 0.42 -3.18 0.64 0.00 -0.02 0.00 0.00 33.50 31.36 1umd n PRO 173 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 1umd h LYS 174 N 14.65 0.05 0.00 -0.52 2.10 -1.45 0.26 116.57 131.66 1umd h LYS 174 Ca -0.41 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.24 1umd h LYS 174 Cb 1.25 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1umd h LYS 174 CO 0.96 0.04 0.00 0.07 -2.00 0.00 0.00 179.45 178.52 1umd h ARG 175 N 0.06 0.00 -0.11 0.07 0.11 -1.80 -2.23 114.38 110.47 1umd h ARG 175 Ca 0.12 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.20 1umd h ARG 175 Cb 0.42 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.50 1umd h ARG 175 CO -0.01 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.34 1umd n LEU 176 N -2.89 2.93 -0.28 0.08 4.77 0.07 -4.20 117.00 117.48 1umd n LEU 176 Ca -0.01 -1.06 0.07 0.00 -0.03 0.00 0.00 56.01 54.99 1umd n LEU 176 Cb 0.19 -0.06 0.30 0.00 -2.33 0.00 0.00 43.42 41.52 1umd n LEU 176 CO 0.22 0.53 1.23 1.88 -1.33 0.00 0.00 177.39 179.92 1umd h TYR 177 N 4.38 0.95 0.00 -1.77 0.05 -1.38 -3.26 116.97 115.94 1umd h TYR 177 Ca 0.00 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.81 1umd h TYR 177 Cb 0.94 -0.31 0.00 0.00 1.01 0.00 0.00 36.73 38.37 1umd h TYR 177 CO 0.06 0.43 -0.42 0.54 -1.05 0.00 0.00 178.16 177.72 1umd n ARG 178 N -4.53 0.08 0.29 4.88 1.74 -1.26 -1.88 116.66 115.98 1umd n ARG 178 Ca 0.15 -1.03 0.19 0.00 -0.77 0.00 0.00 57.85 56.39 1umd n ARG 178 Cb 0.32 -0.55 0.82 0.00 -1.02 0.00 0.00 32.46 32.03 1umd n ARG 178 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1umd h SER 179 N 0.00 0.00 -4.46 0.55 4.64 -1.73 -3.45 113.55 109.11 1umd h SER 179 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1umd h SER 179 Cb 1.33 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 63.21 1umd h SER 179 CO 0.00 0.01 0.27 0.54 -0.87 0.00 0.00 176.83 176.78 1umd s VAL 180 N -3.81 0.00 -0.37 0.95 0.11 -1.26 -5.11 120.40 110.91 1umd s VAL 180 Ca -0.01 0.00 -0.08 0.00 -2.93 0.00 0.00 61.98 58.96 1umd s VAL 180 Cb 0.10 -1.00 0.05 0.00 -1.53 0.00 0.00 36.38 34.00 1umd s VAL 180 CO 0.51 0.00 0.18 -0.54 -3.33 0.00 0.00 175.10 171.92 1umd s LYS 181 N -0.72 2.65 0.26 1.54 1.02 -1.26 -4.23 119.74 119.00 1umd s LYS 181 Ca -0.06 -1.26 0.09 0.00 0.02 0.00 0.00 55.97 54.77 1umd s LYS 181 Cb -0.02 -3.63 -0.04 0.00 -0.52 0.00 0.00 37.83 33.63 1umd s LYS 181 CO 0.05 -0.77 0.01 -2.00 -0.92 0.00 0.00 175.35 171.72 1umd s GLU 182 N 1.44 2.34 0.01 1.68 2.12 -0.69 -4.64 118.70 120.96 1umd s GLU 182 Ca 0.01 -1.39 -0.30 0.00 0.36 0.00 0.00 54.97 53.64 1umd s GLU 182 Cb -0.21 -2.19 -0.07 0.00 0.26 0.00 0.00 34.13 31.93 1umd s GLU 182 CO 0.03 0.37 1.66 -2.00 -0.54 0.00 0.00 175.26 174.78 1umd s GLU 183 N -3.68 4.19 -0.22 4.30 2.56 -1.26 -0.87 118.70 123.72 1umd s GLU 183 Ca 0.31 2.27 -0.02 0.00 0.00 0.00 0.00 54.97 57.54 1umd s GLU 183 Cb -0.07 -3.81 0.07 0.00 2.00 0.00 0.00 34.13 32.33 1umd s GLU 183 CO 0.20 -0.79 0.03 0.08 -0.56 0.00 0.00 175.26 174.23 1umd s VAL 184 N 3.35 0.75 0.39 3.70 1.01 -0.75 -4.63 120.40 124.23 1umd s VAL 184 Ca 0.74 -0.82 -0.26 0.00 0.00 0.00 0.00 61.98 61.64 1umd s VAL 184 Cb -0.37 -1.27 -0.11 0.00 0.00 0.00 0.00 36.38 34.63 1umd s VAL 184 CO 0.32 -0.27 1.18 -2.65 0.00 0.00 0.00 175.10 173.67 1umd n PRO 185 N 4.95 1.77 0.15 2.72 -0.02 -1.26 -4.22 135.00 139.08 1umd n PRO 185 Ca -0.08 0.63 0.09 0.00 -2.02 0.00 0.00 63.50 62.11 1umd n PRO 185 Cb 0.46 -2.23 0.06 0.00 -0.02 0.00 0.00 33.50 31.76 1umd n PRO 185 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1umd h GLU 186 N 2.03 0.00 -7.19 -0.52 4.57 -2.00 -3.46 114.58 108.01 1umd h GLU 186 Ca -0.46 0.00 -0.53 0.00 -1.18 0.00 0.00 59.36 57.19 1umd h GLU 186 Cb 1.31 0.00 0.15 0.00 -0.16 0.00 0.00 28.75 30.05 1umd h GLU 186 CO 0.60 0.11 0.38 -1.83 -1.18 0.00 0.00 179.01 177.09 1umd s GLU 187 N -3.19 2.15 -0.17 1.92 -1.05 -1.26 -4.91 118.70 112.19 1umd s GLU 187 Ca 0.03 1.69 -0.29 0.00 -0.15 0.00 0.00 54.97 56.24 1umd s GLU 187 Cb 0.07 -1.84 -0.03 0.00 -0.44 0.00 0.00 34.13 31.89 1umd s GLU 187 CO 0.74 -1.81 1.52 0.34 0.95 0.00 0.00 175.26 177.00 1umd s ASP 188 N -2.18 6.61 0.03 0.83 2.15 -1.26 -4.98 116.67 117.86 1umd s ASP 188 Ca 0.73 1.77 -0.11 0.00 0.43 0.00 0.00 52.55 55.36 1umd s ASP 188 Cb -0.27 -2.53 0.01 0.00 -0.30 0.00 0.00 42.92 39.82 1umd s ASP 188 CO 0.46 -1.04 0.23 -0.72 -0.17 0.00 0.00 175.17 173.93 1umd s TYR 189 N 4.43 -0.03 0.28 -5.34 -0.85 -1.26 -5.17 117.35 109.41 1umd s TYR 189 Ca 0.67 -0.10 0.03 0.00 -0.52 0.00 0.00 57.07 57.15 1umd s TYR 189 Cb -0.26 0.02 -0.06 0.00 0.38 0.00 0.00 41.96 42.05 1umd s TYR 189 CO 0.25 -0.42 0.05 0.95 -1.52 0.00 0.00 175.55 174.86 1umd s THR 190 N -2.17 1.01 0.12 -3.49 -4.23 -1.26 -4.54 115.64 101.07 1umd s THR 190 Ca -0.08 -2.01 0.08 0.00 -1.18 0.00 0.00 61.69 58.49 1umd s THR 190 Cb -0.03 -2.64 -0.04 0.00 1.34 0.00 0.00 72.50 71.14 1umd s THR 190 CO -0.01 -0.09 -0.18 -0.76 -0.54 0.00 0.00 174.62 173.04 1umd s LEU 191 N -3.40 2.36 -0.05 4.79 1.43 -0.93 -4.95 118.68 117.94 1umd s LEU 191 Ca 0.35 -0.76 -0.30 0.00 -1.03 0.00 0.00 54.13 52.39 1umd s LEU 191 Cb 0.08 -0.76 -0.03 0.00 0.03 0.00 0.00 46.19 45.50 1umd s LEU 191 CO 0.13 -0.03 1.19 -2.16 0.23 0.00 0.00 176.35 175.71 1umd s PRO 192 N -2.34 4.37 0.11 1.29 0.04 -1.26 -4.64 135.00 132.57 1umd s PRO 192 Ca 0.09 1.66 -0.30 0.00 0.04 0.00 0.00 61.00 62.49 1umd s PRO 192 Cb -0.08 -3.54 -0.06 0.00 0.04 0.00 0.00 34.50 30.87 1umd s PRO 192 CO 0.05 -0.42 0.99 0.42 0.04 0.00 0.00 177.00 178.08 1umd s ILE 193 N 2.09 4.43 0.00 0.56 1.01 -1.26 -3.31 121.20 124.72 1umd s ILE 193 Ca 0.56 1.99 0.00 0.00 0.00 0.00 0.00 60.65 63.20 1umd s ILE 193 Cb -0.25 -4.27 0.00 0.00 0.01 0.00 0.00 42.46 37.95 1umd s ILE 193 CO 0.22 0.29 0.00 0.61 0.00 0.00 0.00 174.94 176.07 1umd n GLY 194 N 2.31 0.73 3.19 6.18 0.00 -1.26 -5.00 105.19 111.34 1umd n GLY 194 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 1umd n GLY 194 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1umd s LYS 195 N -0.97 2.45 0.74 1.61 3.01 -1.21 -3.62 119.74 121.75 1umd s LYS 195 Ca 0.00 -0.76 -0.11 0.00 -1.01 0.00 0.00 55.97 54.08 1umd s LYS 195 Cb 0.00 -1.98 0.04 0.00 -1.01 0.00 0.00 37.83 34.88 1umd s LYS 195 CO 0.00 0.23 1.12 0.00 0.51 0.00 0.00 175.35 177.21 1umd s ALA 196 N 0.19 2.82 -0.08 5.17 0.00 -1.23 -4.47 121.76 124.15 1umd s ALA 196 Ca -0.11 -0.47 0.04 0.00 0.00 0.00 0.00 51.96 51.42 1umd s ALA 196 Cb -0.15 -2.99 0.00 0.00 0.00 0.00 0.00 23.12 19.98 1umd s ALA 196 CO 0.05 -1.33 -0.21 0.00 0.00 0.00 0.00 175.76 174.27 1umd s ALA 197 N -3.43 1.92 -0.56 0.00 0.00 0.83 -4.98 121.76 115.54 1umd s ALA 197 Ca 0.60 -0.84 -0.25 0.00 0.00 0.00 0.00 51.96 51.46 1umd s ALA 197 Cb -0.11 -0.71 0.04 0.00 0.00 0.00 0.00 23.12 22.33 1umd s ALA 197 CO 0.50 0.27 1.01 -1.17 0.00 0.00 0.00 175.76 176.37 1umd s LEU 198 N 0.31 3.93 0.11 0.00 1.98 -1.26 -0.87 118.68 122.88 1umd s LEU 198 Ca -0.15 -0.23 -0.03 0.00 -2.89 0.00 0.00 54.13 50.84 1umd s LEU 198 Cb -0.16 -2.92 -0.17 0.00 0.66 0.00 0.00 46.19 43.60 1umd s LEU 198 CO 0.07 -1.30 1.24 0.03 -1.89 0.00 0.00 176.35 174.50 1umd h ARG 199 N 9.38 0.28 -2.32 1.98 2.47 -1.40 -3.46 114.38 121.30 1umd h ARG 199 Ca -0.26 -0.39 -0.05 0.00 -1.26 0.00 0.00 59.98 58.02 1umd h ARG 199 Cb 1.07 0.13 -0.23 0.00 -1.65 0.00 0.00 29.97 29.28 1umd h ARG 199 CO 1.11 1.12 -0.12 0.50 0.56 0.00 0.00 179.97 183.15 1umd s ARG 200 N -2.94 0.58 0.24 0.04 3.52 -1.17 -4.95 118.95 114.25 1umd s ARG 200 Ca -0.04 0.97 -0.20 0.00 -0.13 0.00 0.00 55.73 56.33 1umd s ARG 200 Cb 0.08 0.11 -0.08 0.00 -1.56 0.00 0.00 34.95 33.50 1umd s ARG 200 CO 0.87 -0.14 0.75 -1.21 -0.81 0.00 0.00 175.30 174.75 1umd s GLU 201 N 1.29 4.27 0.27 5.12 2.02 -1.26 -0.78 118.70 129.63 1umd s GLU 201 Ca -0.08 0.90 -0.21 0.00 0.02 0.00 0.00 54.97 55.60 1umd s GLU 201 Cb -0.06 -2.84 0.03 0.00 0.10 0.00 0.00 34.13 31.35 1umd s GLU 201 CO -0.13 0.37 0.75 0.20 0.02 0.00 0.00 175.26 176.47 1umd s GLY 202 N -1.69 -0.07 0.00 -1.39 0.00 -1.25 -4.62 107.32 98.30 1umd s GLY 202 Ca 0.44 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.87 1umd s GLY 202 CO 0.21 -0.08 0.10 0.58 0.00 0.00 0.00 173.10 173.91 1umd n LYS 203 N -0.47 0.39 -0.05 2.90 2.85 -1.07 -4.50 118.16 118.22 1umd n LYS 203 Ca -0.05 -0.10 -0.02 0.00 -1.05 0.00 0.00 58.31 57.10 1umd n LYS 203 Cb 0.59 -0.48 -0.15 0.00 -0.65 0.00 0.00 35.03 34.34 1umd n LYS 203 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1umd n ASP 204 N -0.08 0.18 -3.67 -5.58 8.00 -0.39 -4.25 116.55 110.76 1umd n ASP 204 Ca 0.00 0.08 -0.14 0.00 0.71 0.00 0.00 54.79 55.44 1umd n ASP 204 Cb 0.13 1.12 -0.08 0.00 -0.02 0.00 0.00 41.12 42.27 1umd n ASP 204 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1umd s LEU 205 N -5.26 -0.14 -0.19 0.64 0.20 -1.13 -4.64 118.68 108.16 1umd s LEU 205 Ca -0.08 0.99 -0.06 0.00 0.69 0.00 0.00 54.13 55.67 1umd s LEU 205 Cb 0.09 1.96 -0.04 0.00 -0.43 0.00 0.00 46.19 47.77 1umd s LEU 205 CO 0.85 -0.27 0.04 -0.89 -0.29 0.00 0.00 176.35 175.79 1umd s THR 206 N -0.05 4.49 -0.37 3.68 2.01 0.19 0.70 115.64 126.30 1umd s THR 206 Ca -0.03 -0.14 -0.03 0.00 0.31 0.00 0.00 61.69 61.81 1umd s THR 206 Cb -0.04 -3.02 0.08 0.00 0.01 0.00 0.00 72.50 69.53 1umd s THR 206 CO 0.02 0.45 0.13 -0.76 -0.69 0.00 0.00 174.62 173.77 1umd s LEU 207 N 0.55 4.72 -0.14 4.42 1.43 0.13 -1.37 118.68 128.43 1umd s LEU 207 Ca 0.02 -1.69 -0.20 0.00 -1.03 0.00 0.00 54.13 51.22 1umd s LEU 207 Cb -0.13 -1.79 -0.04 0.00 0.03 0.00 0.00 46.19 44.26 1umd s LEU 207 CO 0.02 -0.43 0.56 -0.63 0.23 0.00 0.00 176.35 176.10 1umd s ILE 208 N 1.20 5.11 0.22 -0.59 1.01 -0.45 -1.25 121.20 126.46 1umd s ILE 208 Ca 0.03 1.11 -0.09 0.00 0.00 0.00 0.00 60.65 61.70 1umd s ILE 208 Cb -0.21 -3.90 0.04 0.00 0.01 0.00 0.00 42.46 38.40 1umd s ILE 208 CO -0.02 0.24 0.47 0.00 0.00 0.00 0.00 174.94 175.63 1umd s TYR 210 N -4.94 -0.03 0.00 0.00 -0.85 -1.26 -0.98 117.35 109.30 1umd s TYR 210 Ca 0.09 0.01 0.00 0.00 -0.52 0.00 0.00 57.07 56.65 1umd s TYR 210 Cb -0.03 0.51 0.00 0.00 0.38 0.00 0.00 41.96 42.82 1umd s TYR 210 CO 0.07 -0.07 0.00 0.41 -1.52 0.00 0.00 175.55 174.44 1umd n GLY 211 N -0.23 2.88 0.34 5.49 0.00 -1.26 -3.58 105.19 108.84 1umd n GLY 211 Ca -0.02 -0.02 0.19 0.00 0.00 0.00 0.00 46.02 46.18 1umd n GLY 211 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1umd n THR 212 N 0.00 -0.42 1.36 2.61 -1.04 -1.26 -1.86 114.28 113.68 1umd n THR 212 Ca 0.00 2.13 0.15 0.00 -2.04 0.00 0.00 64.05 64.29 1umd n THR 212 Cb 0.00 -3.20 0.71 0.00 -1.82 0.00 0.00 70.33 66.02 1umd n THR 212 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1umd n VAL 213 N -5.42 0.00 -0.29 12.58 0.24 -1.23 -4.40 118.33 119.81 1umd n VAL 213 Ca 0.27 -0.01 0.12 0.00 -2.04 0.00 0.00 64.34 62.68 1umd n VAL 213 Cb 0.90 -0.43 0.27 0.00 -1.47 0.00 0.00 33.84 33.11 1umd n VAL 213 CO 0.00 0.00 0.00 0.24 -2.14 0.00 0.00 176.83 174.93 1umd h MET 214 N 0.07 0.21 -0.19 7.34 2.86 -1.55 -1.89 114.93 121.78 1umd h MET 214 Ca 0.00 -0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.67 1umd h MET 214 Cb 0.33 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 31.90 1umd h MET 214 CO 0.00 0.14 -0.09 -1.35 1.06 0.00 0.00 176.91 176.67 1umd h PRO 215 N 0.22 -0.06 -0.45 -0.22 0.11 -1.84 -0.24 132.00 129.51 1umd h PRO 215 Ca 0.53 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.53 1umd h PRO 215 Cb 1.04 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1umd h PRO 215 CO -0.64 -0.04 -0.16 0.93 -0.21 0.00 0.00 178.00 177.88 1umd h GLU 216 N -0.07 0.87 -0.46 1.05 3.07 -1.72 -2.03 114.58 115.30 1umd h GLU 216 Ca 0.10 -0.33 -0.03 0.00 -0.50 0.00 0.00 59.36 58.60 1umd h GLU 216 Cb 0.22 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.06 1umd h GLU 216 CO -0.23 0.97 0.16 0.28 -1.40 0.00 0.00 179.01 178.79 1umd h VAL 217 N 0.77 1.22 -0.69 3.13 2.07 -1.06 -0.20 116.25 121.49 1umd h VAL 217 Ca 0.12 -0.70 -0.06 0.00 0.82 0.00 0.00 66.70 66.88 1umd h VAL 217 Cb 0.69 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 1umd h VAL 217 CO 0.05 0.26 0.19 -0.07 0.02 0.00 0.00 177.57 178.02 1umd h LEU 218 N 0.61 1.02 -0.79 2.57 3.38 -0.95 -1.43 115.31 119.72 1umd h LEU 218 Ca 0.15 -0.22 -0.12 0.00 0.09 0.00 0.00 57.88 57.78 1umd h LEU 218 Cb 0.24 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1umd h LEU 218 CO -0.01 0.97 -0.39 -0.61 0.09 0.00 0.00 178.44 178.49 1umd h GLN 219 N 1.02 0.45 -0.73 1.13 5.75 -1.21 -1.79 115.11 119.72 1umd h GLN 219 Ca 0.22 -0.22 -0.02 0.00 -0.15 0.00 0.00 58.65 58.48 1umd h GLN 219 Cb 0.33 -0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.85 1umd h GLN 219 CO -0.00 0.77 0.37 0.00 -2.65 0.00 0.00 178.83 177.31 1umd h ALA 220 N 1.21 0.95 -0.42 3.38 0.00 -0.63 0.69 119.26 124.43 1umd h ALA 220 Ca 0.04 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1umd h ALA 220 Cb 0.85 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1umd h ALA 220 CO 0.07 0.50 0.04 0.00 0.00 0.00 0.00 179.25 179.86 1umd h ALA 221 N 1.18 1.28 -0.49 0.00 0.00 -0.94 -0.75 119.26 119.54 1umd h ALA 221 Ca 0.25 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1umd h ALA 221 Cb 0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1umd h ALA 221 CO -0.03 0.49 0.03 0.00 0.00 0.00 0.00 179.25 179.74 1umd h ALA 222 N 1.42 0.66 -0.56 0.00 0.00 -0.40 -0.83 119.26 119.54 1umd h ALA 222 Ca 0.14 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1umd h ALA 222 Cb 0.34 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1umd h ALA 222 CO 0.01 0.43 0.20 0.93 0.00 0.00 0.00 179.25 180.83 1umd h GLU 223 N 0.71 0.85 -0.82 0.00 4.39 -0.43 -2.56 114.58 116.72 1umd h GLU 223 Ca 0.14 -0.17 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 1umd h GLU 223 Cb 0.47 -0.13 -0.04 0.00 -0.10 0.00 0.00 28.75 28.94 1umd h GLU 223 CO 0.02 0.75 0.46 -0.07 -1.16 0.00 0.00 179.01 179.02 1umd h LEU 224 N 0.78 1.01 -1.65 1.33 3.38 -0.92 -2.13 115.31 117.10 1umd h LEU 224 Ca 0.18 -0.09 0.05 0.00 0.09 0.00 0.00 57.88 58.11 1umd h LEU 224 Cb 0.23 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1umd h LEU 224 CO -0.01 0.81 0.31 0.00 0.09 0.00 0.00 178.44 179.63 1umd h ALA 225 N 1.25 1.87 0.00 1.53 0.00 -0.76 0.48 119.26 123.63 1umd h ALA 225 Ca 0.29 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1umd h ALA 225 Cb 0.01 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1umd h ALA 225 CO -0.05 0.06 -0.09 0.87 0.00 0.00 0.00 179.25 180.05 1umd h LYS 226 N 0.45 0.00 -0.57 0.00 1.57 -1.06 -1.19 116.57 115.77 1umd h LYS 226 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1umd h LYS 226 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1umd h LYS 226 CO -0.05 0.09 0.00 0.00 -0.57 0.00 0.00 179.45 178.92 1umd n ALA 227 N -2.49 2.51 -0.96 3.86 0.00 0.07 -4.92 120.51 118.59 1umd n ALA 227 Ca -0.03 -1.02 0.00 0.00 0.00 0.00 0.00 53.44 52.40 1umd n ALA 227 Cb 0.17 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.65 1umd n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1umd n GLY 228 N 1.31 0.51 3.63 0.00 0.00 -0.45 -5.02 105.19 105.17 1umd n GLY 228 Ca 0.19 -0.08 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 1umd n GLY 228 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1umd s VAL 229 N -2.00 5.29 -0.40 1.61 1.01 -0.68 -4.98 120.40 120.25 1umd s VAL 229 Ca 0.00 0.32 -0.17 0.00 0.00 0.00 0.00 61.98 62.14 1umd s VAL 229 Cb 0.00 -3.58 0.01 0.00 0.00 0.00 0.00 36.38 32.82 1umd s VAL 229 CO 0.00 0.27 0.42 -0.94 0.00 0.00 0.00 175.10 174.85 1umd s SER 230 N 1.34 6.19 -0.11 3.32 1.04 -1.26 -2.59 113.70 121.63 1umd s SER 230 Ca 0.10 -0.55 -0.10 0.00 0.48 0.00 0.00 55.95 55.88 1umd s SER 230 Cb -0.15 -2.22 -0.05 0.00 0.10 0.00 0.00 66.02 63.71 1umd s SER 230 CO 0.08 -0.52 0.23 0.00 0.98 0.00 0.00 173.24 174.01 1umd s ALA 231 N 2.11 3.76 -0.28 5.32 0.00 -1.26 -1.26 121.76 130.15 1umd s ALA 231 Ca 0.12 -0.51 -0.13 0.00 0.00 0.00 0.00 51.96 51.44 1umd s ALA 231 Cb -0.17 -2.17 -0.04 0.00 0.00 0.00 0.00 23.12 20.74 1umd s ALA 231 CO 0.13 0.44 0.27 -2.00 0.00 0.00 0.00 175.76 174.60 1umd s GLU 232 N -0.63 3.92 -0.29 0.00 2.12 0.22 -3.91 118.70 120.14 1umd s GLU 232 Ca 0.17 -0.22 -0.11 0.00 0.36 0.00 0.00 54.97 55.17 1umd s GLU 232 Cb -0.13 -3.68 -0.04 0.00 0.26 0.00 0.00 34.13 30.54 1umd s GLU 232 CO 0.06 -0.26 0.18 0.08 -0.54 0.00 0.00 175.26 174.78 1umd s VAL 233 N 1.89 5.18 -0.28 3.70 1.01 0.04 0.22 120.40 132.16 1umd s VAL 233 Ca 0.10 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.14 1umd s VAL 233 Cb -0.16 -3.50 0.05 0.00 0.00 0.00 0.00 36.38 32.77 1umd s VAL 233 CO 0.11 0.22 -0.05 -0.22 0.00 0.00 0.00 175.10 175.15 1umd s LEU 234 N 1.74 3.66 -0.50 3.92 2.96 -0.38 -0.90 118.68 129.17 1umd s LEU 234 Ca 0.07 -1.29 -0.24 0.00 -0.22 0.00 0.00 54.13 52.45 1umd s LEU 234 Cb -0.16 -1.64 0.03 0.00 0.50 0.00 0.00 46.19 44.92 1umd s LEU 234 CO 0.10 -0.22 0.89 -0.62 -1.32 0.00 0.00 176.35 175.17 1umd s ASP 235 N 1.20 6.40 0.26 3.68 -1.08 -0.05 -1.91 116.67 125.17 1umd s ASP 235 Ca -0.06 -0.18 -0.04 0.00 -0.52 0.00 0.00 52.55 51.75 1umd s ASP 235 Cb -0.20 -2.42 0.35 0.00 -1.46 0.00 0.00 42.92 39.19 1umd s ASP 235 CO -0.03 -1.08 1.92 -0.07 0.52 0.00 0.00 175.17 176.42 1umd h LEU 236 N 10.60 1.08 0.00 -1.34 3.38 -1.34 0.24 115.31 127.93 1umd h LEU 236 Ca -0.25 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1umd h LEU 236 Cb 1.08 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1umd h LEU 236 CO 1.03 0.75 0.00 0.54 0.09 0.00 0.00 178.44 180.85 1umd n ARG 237 N -4.43 0.00 -3.33 1.13 1.74 -1.26 -3.54 116.66 106.97 1umd n ARG 237 Ca 0.13 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.83 1umd n ARG 237 Cb 0.09 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.45 1umd n ARG 237 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1umd s THR 238 N 0.00 5.16 -0.15 0.55 2.01 -1.26 -0.37 115.64 121.58 1umd s THR 238 Ca 0.00 0.80 0.20 0.00 0.31 0.00 0.00 61.69 63.00 1umd s THR 238 Cb 0.00 -3.77 -0.14 0.00 0.01 0.00 0.00 72.50 68.60 1umd s THR 238 CO 0.00 0.22 0.78 0.18 -0.69 0.00 0.00 174.62 175.11 1umd n LEU 239 N 4.60 0.62 -3.37 4.42 4.77 0.70 -4.11 117.00 124.64 1umd n LEU 239 Ca -0.07 0.26 -0.07 0.00 -0.03 0.00 0.00 56.01 56.10 1umd n LEU 239 Cb 0.51 0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.57 1umd n LEU 239 CO 0.41 0.02 -0.00 -0.32 -1.33 0.00 0.00 177.39 176.16 1umd s MET 240 N -3.17 0.38 -0.00 3.23 0.00 -1.06 -3.32 119.30 115.37 1umd s MET 240 Ca -0.04 0.69 -0.27 0.00 0.00 0.00 0.00 55.69 56.08 1umd s MET 240 Cb 0.10 -0.18 -0.04 0.00 0.00 0.00 0.00 34.83 34.70 1umd s MET 240 CO 0.82 -0.58 0.84 -1.25 0.00 0.00 0.00 175.02 174.85 1umd s PRO 241 N 2.61 4.52 0.62 4.11 0.04 -1.26 -1.29 135.00 144.35 1umd s PRO 241 Ca 0.12 1.16 -0.12 0.00 0.04 0.00 0.00 61.00 62.20 1umd s PRO 241 Cb -0.15 -3.42 -0.04 0.00 0.04 0.00 0.00 34.50 30.93 1umd s PRO 241 CO -0.16 0.09 1.03 1.67 0.04 0.00 0.00 177.00 179.67 1umd s TRP 242 N 0.59 3.51 -1.24 0.56 1.48 -1.21 -4.25 118.94 118.39 1umd s TRP 242 Ca 0.44 1.34 -0.20 0.00 -1.06 0.00 0.00 56.10 56.61 1umd s TRP 242 Cb -0.20 -2.76 -0.01 0.00 -1.16 0.00 0.00 33.47 29.34 1umd s TRP 242 CO 0.24 -0.75 1.85 -3.47 -4.06 0.00 0.00 176.95 170.76 1umd n ASP 243 N -2.66 4.00 -0.11 -2.66 -0.08 -1.24 -4.82 116.55 108.99 1umd n ASP 243 Ca 0.06 -2.81 -0.05 0.00 -1.51 0.00 0.00 54.79 50.48 1umd n ASP 243 Cb 0.54 -1.71 0.01 0.00 2.34 0.00 0.00 41.12 42.29 1umd n ASP 243 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 1umd h TYR 244 N 8.39 -0.25 -0.25 -0.67 3.20 -1.92 -2.36 116.97 123.11 1umd h TYR 244 Ca 0.36 0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.30 1umd h TYR 244 Cb 0.88 0.17 -0.03 0.00 1.54 0.00 0.00 36.73 39.28 1umd h TYR 244 CO 1.33 -0.18 0.05 0.93 -1.64 0.00 0.00 178.16 178.65 1umd h GLU 245 N -0.03 0.15 -0.69 1.82 4.39 -1.98 -0.86 114.58 117.38 1umd h GLU 245 Ca 0.18 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.87 1umd h GLU 245 Cb 0.30 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.88 1umd h GLU 245 CO -0.39 0.10 0.45 0.00 -1.16 0.00 0.00 179.01 178.00 1umd h ALA 246 N 1.18 0.88 0.21 3.43 0.00 -1.92 0.28 119.26 123.32 1umd h ALA 246 Ca 0.11 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1umd h ALA 246 Cb 0.11 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1umd h ALA 246 CO -0.15 0.32 -0.10 0.28 0.00 0.00 0.00 179.25 179.60 1umd h VAL 247 N 0.94 0.84 -0.31 0.00 2.07 -1.14 -2.10 116.25 116.56 1umd h VAL 247 Ca 0.25 -0.24 -0.08 0.00 0.82 0.00 0.00 66.70 67.45 1umd h VAL 247 Cb -0.09 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 1umd h VAL 247 CO -0.05 0.06 -0.16 0.24 0.02 0.00 0.00 177.57 177.68 1umd h MET 248 N -0.39 0.55 -0.59 1.57 2.07 -1.01 -1.56 114.93 115.55 1umd h MET 248 Ca -0.03 -0.17 -0.08 0.00 -2.07 0.00 0.00 59.70 57.35 1umd h MET 248 Cb 0.30 -0.05 -0.02 0.00 -1.87 0.00 0.00 31.60 29.96 1umd h MET 248 CO 0.05 0.69 0.05 -0.91 1.07 0.00 0.00 176.91 177.85 1umd h ASN 249 N 0.50 0.96 -0.04 1.22 2.35 -0.89 -0.03 115.58 119.65 1umd h ASN 249 Ca 0.09 -0.24 -0.02 0.00 -0.55 0.00 0.00 56.30 55.58 1umd h ASN 249 Cb 0.56 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.67 1umd h ASN 249 CO 0.04 0.99 -0.04 -1.28 -1.65 0.00 0.00 177.43 175.48 1umd h SER 250 N 0.92 0.11 -0.25 5.81 0.87 -1.09 -2.67 113.55 117.25 1umd h SER 250 Ca 0.18 -0.49 -0.05 0.00 -1.23 0.00 0.00 61.79 60.20 1umd h SER 250 Cb 0.47 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.39 1umd h SER 250 CO 0.02 0.58 0.01 0.58 -0.53 0.00 0.00 176.83 177.49 1umd h VAL 251 N -0.36 1.20 -0.65 2.23 2.07 -1.25 -1.21 116.25 118.27 1umd h VAL 251 Ca 0.01 -0.78 -0.06 0.00 0.82 0.00 0.00 66.70 66.68 1umd h VAL 251 Cb 0.55 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 1umd h VAL 251 CO 0.01 0.27 0.17 0.00 0.02 0.00 0.00 177.57 178.05 1umd h ALA 252 N 1.49 1.08 0.26 1.67 0.00 -0.99 0.33 119.26 123.09 1umd h ALA 252 Ca 0.11 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1umd h ALA 252 Cb 0.33 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1umd h ALA 252 CO 0.01 0.62 -0.13 -0.22 0.00 0.00 0.00 179.25 179.53 1umd h LYS 253 N 0.97 -0.34 0.07 0.00 3.64 -1.02 -3.35 116.57 116.54 1umd h LYS 253 Ca 0.21 0.02 -0.24 0.00 -1.27 0.00 0.00 60.65 59.37 1umd h LYS 253 Cb 0.32 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1umd h LYS 253 CO -0.00 0.01 -1.13 1.79 -2.27 0.00 0.00 179.45 177.85 1umd h THR 254 N -0.79 1.60 0.00 1.00 1.35 -1.25 -3.48 112.91 111.34 1umd h THR 254 Ca -0.04 -3.22 0.00 0.00 -0.55 0.00 0.00 66.41 62.60 1umd h THR 254 Cb 0.51 2.89 0.00 0.00 -1.73 0.00 0.00 68.15 69.82 1umd h THR 254 CO 0.06 0.93 0.00 0.61 -0.25 0.00 0.00 175.52 176.87 1umd n GLY 255 N 1.44 1.63 3.00 5.82 0.00 0.12 -4.72 105.19 112.48 1umd n GLY 255 Ca -0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 1umd n GLY 255 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1umd s ARG 256 N -0.03 0.15 -0.01 1.61 3.03 -1.26 0.48 118.95 122.92 1umd s ARG 256 Ca 0.00 0.25 -0.01 0.00 2.03 0.00 0.00 55.73 57.99 1umd s ARG 256 Cb 0.00 0.02 -0.00 0.00 -1.03 0.00 0.00 34.95 33.94 1umd s ARG 256 CO 0.00 -0.06 0.03 0.54 -1.13 0.00 0.00 175.30 174.69 1umd s VAL 257 N 0.35 0.02 -0.09 4.99 0.11 -1.26 -0.64 120.40 123.89 1umd s VAL 257 Ca -0.02 -0.18 0.02 0.00 -2.93 0.00 0.00 61.98 58.87 1umd s VAL 257 Cb -0.04 -0.11 0.01 0.00 -1.53 0.00 0.00 36.38 34.71 1umd s VAL 257 CO -0.01 -0.10 -0.16 -0.69 -3.33 0.00 0.00 175.10 170.80 1umd s VAL 258 N -0.29 1.49 -0.14 2.04 1.01 -0.47 -2.01 120.40 122.02 1umd s VAL 258 Ca -0.03 -0.67 -0.04 0.00 0.00 0.00 0.00 61.98 61.24 1umd s VAL 258 Cb -0.02 -1.34 -0.03 0.00 0.00 0.00 0.00 36.38 34.99 1umd s VAL 258 CO -0.00 0.44 -0.01 -0.76 0.00 0.00 0.00 175.10 174.76 1umd s LEU 259 N 0.71 3.41 -0.02 3.92 1.02 0.64 -1.34 118.68 127.02 1umd s LEU 259 Ca -0.13 -0.04 0.05 0.00 0.02 0.00 0.00 54.13 54.04 1umd s LEU 259 Cb -0.16 -1.82 -0.01 0.00 0.02 0.00 0.00 46.19 44.22 1umd s LEU 259 CO 0.03 0.21 -0.18 -0.69 0.02 0.00 0.00 176.35 175.74 1umd s VAL 260 N 0.10 1.43 -0.01 -1.59 1.01 0.21 0.07 120.40 121.62 1umd s VAL 260 Ca 0.01 -0.76 -0.28 0.00 0.00 0.00 0.00 61.98 60.94 1umd s VAL 260 Cb -0.13 -1.20 0.09 0.00 0.00 0.00 0.00 36.38 35.14 1umd s VAL 260 CO 0.02 0.41 0.81 -0.55 0.00 0.00 0.00 175.10 175.79 1umd s SER 261 N -0.31 -0.47 0.00 3.32 0.15 -0.71 -4.18 113.70 111.50 1umd s SER 261 Ca 0.04 0.24 0.25 0.00 0.70 0.00 0.00 55.95 57.19 1umd s SER 261 Cb -0.08 0.44 0.49 0.00 -1.71 0.00 0.00 66.02 65.17 1umd s SER 261 CO 0.00 -0.63 1.43 -0.90 1.20 0.00 0.00 173.24 174.34 1umd n ASP 262 N 0.19 2.43 -4.79 5.45 5.75 -1.26 -2.80 116.55 121.52 1umd n ASP 262 Ca -0.13 -1.80 -0.34 0.00 -0.01 0.00 0.00 54.79 52.51 1umd n ASP 262 Cb 0.61 0.01 -0.00 0.00 -1.03 0.00 0.00 41.12 40.70 1umd n ASP 262 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1umd s ALA 263 N -2.02 2.74 0.52 2.12 0.00 -1.26 -3.59 121.76 120.26 1umd s ALA 263 Ca 0.31 0.65 -0.21 0.00 0.00 0.00 0.00 51.96 52.71 1umd s ALA 263 Cb 0.20 -3.30 -0.08 0.00 0.00 0.00 0.00 23.12 19.95 1umd s ALA 263 CO 0.32 -0.68 0.95 -2.30 0.00 0.00 0.00 175.76 174.06 1umd n PRO 264 N -1.43 1.09 0.42 0.00 -0.02 -1.26 -1.09 135.00 132.70 1umd n PRO 264 Ca 0.10 0.40 -0.18 0.00 -2.02 0.00 0.00 63.50 61.80 1umd n PRO 264 Cb 0.52 -2.08 -0.09 0.00 -0.02 0.00 0.00 33.50 31.83 1umd n PRO 264 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1umd h ARG 265 N 0.96 -1.10 -6.30 -0.52 2.43 -1.64 -3.39 114.38 104.82 1umd h ARG 265 Ca -0.47 0.08 -0.62 0.00 -0.81 0.00 0.00 59.98 58.16 1umd h ARG 265 Cb 1.35 0.25 0.02 0.00 -0.42 0.00 0.00 29.97 31.18 1umd h ARG 265 CO 0.53 -0.74 1.04 0.72 -1.51 0.00 0.00 179.97 180.02 1umd n HIS 266 N -5.32 2.31 -3.06 2.20 8.25 -1.26 -2.05 115.22 116.29 1umd n HIS 266 Ca -0.14 0.06 -0.22 0.00 -0.26 0.00 0.00 57.72 57.15 1umd n HIS 266 Cb 0.47 -2.64 0.03 0.00 1.12 0.00 0.00 29.99 28.97 1umd n HIS 266 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1umd n ALA 267 N 6.09 -0.98 -1.93 -1.41 0.00 -1.26 -4.98 120.51 116.03 1umd n ALA 267 Ca 0.22 0.24 -0.26 0.00 0.00 0.00 0.00 53.44 53.64 1umd n ALA 267 Cb 0.29 -3.58 0.07 0.00 0.00 0.00 0.00 19.45 16.22 1umd n ALA 267 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1umd s SER 268 N -2.68 4.79 0.17 0.00 1.04 -0.87 -4.90 113.70 111.25 1umd s SER 268 Ca 0.31 0.46 -0.12 0.00 0.48 0.00 0.00 55.95 57.09 1umd s SER 268 Cb -0.14 -1.10 0.06 0.00 0.10 0.00 0.00 66.02 64.93 1umd s SER 268 CO 0.38 -1.62 1.69 0.15 0.98 0.00 0.00 173.24 174.82 1umd h PHE 269 N -0.62 0.95 0.00 5.02 3.57 -1.89 -2.18 116.94 121.79 1umd h PHE 269 Ca -0.44 -0.11 -0.01 0.00 3.53 0.00 0.00 57.97 60.94 1umd h PHE 269 Cb 1.32 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.78 1umd h PHE 269 CO 0.32 0.80 -0.07 -0.39 -2.23 0.00 0.00 178.31 176.75 1umd h VAL 270 N 0.82 0.35 -0.17 1.41 -1.51 -1.94 -0.28 116.25 114.92 1umd h VAL 270 Ca 0.18 -0.41 -0.13 0.00 -1.23 0.00 0.00 66.70 65.12 1umd h VAL 270 Cb 0.32 1.30 -0.01 0.00 -2.13 0.00 0.00 31.29 30.76 1umd h VAL 270 CO -0.00 0.07 -0.44 0.28 -1.23 0.00 0.00 177.57 176.24 1umd h SER 271 N 0.00 0.45 -0.23 4.19 0.02 -1.70 -0.43 113.55 115.84 1umd h SER 271 Ca -0.00 -0.21 -0.04 0.00 -0.84 0.00 0.00 61.79 60.70 1umd h SER 271 Cb 0.29 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 1umd h SER 271 CO 0.01 0.83 -0.02 -0.08 -1.14 0.00 0.00 176.83 176.43 1umd h GLU 272 N 0.34 0.43 -0.49 3.45 4.57 -0.81 -0.29 114.58 121.79 1umd h GLU 272 Ca 0.02 -0.15 -0.04 0.00 -1.18 0.00 0.00 59.36 58.01 1umd h GLU 272 Cb 0.92 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.45 1umd h GLU 272 CO 0.08 0.63 0.13 0.28 -1.18 0.00 0.00 179.01 178.95 1umd h VAL 273 N 0.19 1.24 -0.32 0.32 2.07 -1.29 -1.36 116.25 117.08 1umd h VAL 273 Ca 0.06 -0.81 0.01 0.00 0.82 0.00 0.00 66.70 66.78 1umd h VAL 273 Cb 0.45 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 1umd h VAL 273 CO 0.02 0.29 0.20 0.00 0.02 0.00 0.00 177.57 178.10 1umd h ALA 274 N 1.00 0.41 -0.32 1.67 0.00 -0.96 0.14 119.26 121.20 1umd h ALA 274 Ca 0.16 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1umd h ALA 274 Cb 0.31 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1umd h ALA 274 CO -0.00 -0.16 0.05 0.00 0.00 0.00 0.00 179.25 179.14 1umd h ALA 275 N 1.14 1.49 -0.14 0.00 0.00 -0.89 -1.98 119.26 118.87 1umd h ALA 275 Ca 0.13 -0.15 -0.18 0.00 0.00 0.00 0.00 54.91 54.71 1umd h ALA 275 Cb -0.01 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.64 1umd h ALA 275 CO -0.05 0.37 -0.60 1.15 0.00 0.00 0.00 179.25 180.12 1umd h THR 276 N 0.46 1.32 -0.67 0.00 2.02 -0.63 -1.76 112.91 113.66 1umd h THR 276 Ca 0.11 -1.86 0.02 0.00 0.77 0.00 0.00 66.41 65.44 1umd h THR 276 Cb 0.23 2.07 -0.04 0.00 -1.74 0.00 0.00 68.15 68.67 1umd h THR 276 CO 0.00 0.58 0.43 0.40 0.37 0.00 0.00 175.52 177.30 1umd h ILE 277 N 0.32 1.13 -0.56 3.11 2.04 -0.73 -0.86 117.51 121.96 1umd h ILE 277 Ca -0.04 -0.29 -0.07 0.00 1.00 0.00 0.00 64.86 65.46 1umd h ILE 277 Cb 1.24 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 1umd h ILE 277 CO 0.13 0.16 0.08 0.00 0.00 0.00 0.00 178.15 178.51 1umd h ALA 278 N 1.26 0.74 -0.20 1.87 0.00 -1.34 0.39 119.26 121.99 1umd h ALA 278 Ca 0.25 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 1umd h ALA 278 Cb -0.05 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1umd h ALA 278 CO -0.08 0.50 -0.39 1.49 0.00 0.00 0.00 179.25 180.77 1umd h GLU 279 N 0.82 0.45 0.00 0.00 4.81 -0.98 -3.10 114.58 116.58 1umd h GLU 279 Ca 0.17 -0.22 -0.14 0.00 -0.13 0.00 0.00 59.36 59.04 1umd h GLU 279 Cb 0.43 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 1umd h GLU 279 CO 0.01 0.77 -2.01 -0.25 -0.73 0.00 0.00 179.01 176.80 1umd n ASP 280 N -4.04 0.66 -0.61 1.04 8.00 -0.36 -4.68 116.55 116.57 1umd n ASP 280 Ca -0.01 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.55 1umd n ASP 280 Cb 0.49 1.46 0.15 0.00 -0.02 0.00 0.00 41.12 43.20 1umd n ASP 280 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1umd n LEU 281 N -2.37 2.13 -0.29 0.64 4.77 0.13 -4.83 117.00 117.19 1umd n LEU 281 Ca -0.14 -3.17 0.11 0.00 -0.03 0.00 0.00 56.01 52.77 1umd n LEU 281 Cb 0.75 -0.38 0.27 0.00 -2.33 0.00 0.00 43.42 41.73 1umd n LEU 281 CO 0.39 1.00 1.01 0.25 -1.33 0.00 0.00 177.39 178.71 1umd h LEU 282 N 0.68 0.24 -1.75 2.23 5.85 -1.62 0.18 115.31 121.13 1umd h LEU 282 Ca -0.04 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1umd h LEU 282 Cb 1.18 0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.36 1umd h LEU 282 CO 0.02 -0.01 0.00 -2.24 -0.34 0.00 0.00 178.44 175.86 1umd h ASP 283 N 0.36 0.00 -0.00 1.25 2.03 -1.90 -2.41 116.42 115.76 1umd h ASP 283 Ca 0.52 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.82 1umd h ASP 283 Cb 0.96 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.46 1umd h ASP 283 CO -0.53 0.00 -0.66 0.23 -1.03 0.00 0.00 179.24 177.25 1umd n MET 284 N -2.68 0.76 -2.88 4.15 2.81 0.62 -4.95 117.12 114.95 1umd n MET 284 Ca -0.01 -0.63 -0.41 0.00 -1.81 0.00 0.00 57.70 54.84 1umd n MET 284 Cb 0.14 -1.49 -0.04 0.00 -0.71 0.00 0.00 33.22 31.13 1umd n MET 284 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1umd s LEU 285 N -2.67 4.21 0.00 4.03 1.43 -0.91 -4.30 118.68 120.47 1umd s LEU 285 Ca 0.15 1.24 0.23 0.00 -1.03 0.00 0.00 54.13 54.72 1umd s LEU 285 Cb 0.17 -3.27 0.03 0.00 0.03 0.00 0.00 46.19 43.16 1umd s LEU 285 CO 0.68 -0.36 1.09 0.18 0.23 0.00 0.00 176.35 178.18 1umd n LEU 286 N 4.94 1.30 -3.53 1.79 4.77 0.18 -4.95 117.00 121.50 1umd n LEU 286 Ca 0.04 -0.51 -0.12 0.00 -0.03 0.00 0.00 56.01 55.40 1umd n LEU 286 Cb 0.49 -0.04 -0.04 0.00 -2.33 0.00 0.00 43.42 41.50 1umd n LEU 286 CO 0.49 0.27 0.28 0.00 -1.33 0.00 0.00 177.39 177.10 1umd s ALA 287 N -2.77 -1.27 0.48 -1.18 0.00 -1.21 -4.88 121.76 110.92 1umd s ALA 287 Ca 0.14 0.27 -0.23 0.00 0.00 0.00 0.00 51.96 52.13 1umd s ALA 287 Cb 0.17 0.74 -0.07 0.00 0.00 0.00 0.00 23.12 23.97 1umd s ALA 287 CO 0.71 -0.68 1.21 -2.14 0.00 0.00 0.00 175.76 174.86 1umd s PRO 288 N -3.62 3.63 -0.16 0.00 0.02 -1.26 -4.75 135.00 128.86 1umd s PRO 288 Ca 0.01 1.88 -0.29 0.00 0.02 0.00 0.00 61.00 62.62 1umd s PRO 288 Cb 0.00 -2.38 -0.02 0.00 0.02 0.00 0.00 34.50 32.11 1umd s PRO 288 CO -0.11 -0.68 1.42 -1.25 -0.33 0.00 0.00 177.00 176.04 1umd s PRO 289 N -2.73 4.12 -0.18 5.54 0.04 -1.26 -4.67 135.00 135.86 1umd s PRO 289 Ca 0.65 1.75 -0.08 0.00 0.04 0.00 0.00 61.00 63.36 1umd s PRO 289 Cb -0.31 -3.88 -0.04 0.00 0.04 0.00 0.00 34.50 30.31 1umd s PRO 289 CO 0.38 -0.88 0.08 0.42 0.04 0.00 0.00 177.00 177.04 1umd s ILE 290 N 3.99 4.97 -0.20 0.56 1.01 -0.85 -4.99 121.20 125.68 1umd s ILE 290 Ca 0.62 0.03 -0.06 0.00 0.00 0.00 0.00 60.65 61.24 1umd s ILE 290 Cb -0.25 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 38.96 1umd s ILE 290 CO 0.22 0.48 0.04 -0.13 0.00 0.00 0.00 174.94 175.54 1umd s ARG 291 N 0.17 3.76 -0.34 2.79 0.52 -1.26 -0.26 118.95 124.33 1umd s ARG 291 Ca 0.06 -0.45 -0.05 0.00 -0.52 0.00 0.00 55.73 54.77 1umd s ARG 291 Cb -0.12 -3.19 0.05 0.00 0.52 0.00 0.00 34.95 32.22 1umd s ARG 291 CO 0.00 0.06 0.09 0.08 0.02 0.00 0.00 175.30 175.55 1umd s VAL 292 N 0.92 3.51 0.35 3.52 1.01 0.11 -4.95 120.40 124.87 1umd s VAL 292 Ca 0.03 -1.31 0.04 0.00 0.00 0.00 0.00 61.98 60.74 1umd s VAL 292 Cb -0.14 -3.05 -0.02 0.00 0.00 0.00 0.00 36.38 33.18 1umd s VAL 292 CO 0.02 -0.22 0.16 0.35 0.00 0.00 0.00 175.10 175.41 1umd n THR 293 N 4.74 0.00 -1.51 3.92 -2.24 -1.25 -1.73 114.28 116.21 1umd n THR 293 Ca -0.12 -2.15 -0.31 0.00 -2.27 0.00 0.00 64.05 59.20 1umd n THR 293 Cb 0.44 0.83 0.06 0.00 -2.10 0.00 0.00 70.33 69.56 1umd n THR 293 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1umd s GLY 294 N -3.22 1.74 0.67 3.38 0.00 -0.25 -4.76 107.32 104.88 1umd s GLY 294 Ca 0.22 0.21 -0.11 0.00 0.00 0.00 0.00 44.72 45.04 1umd s GLY 294 CO 0.16 0.54 1.05 -1.36 0.00 0.00 0.00 173.10 173.49 1umd s PHE 295 N -2.89 3.37 -1.55 1.90 0.08 -1.26 -2.14 117.98 115.49 1umd s PHE 295 Ca 0.60 1.28 -0.10 0.00 0.12 0.00 0.00 56.93 58.83 1umd s PHE 295 Cb -0.16 -2.85 -0.03 0.00 -0.57 0.00 0.00 43.02 39.41 1umd s PHE 295 CO 0.53 -1.01 2.71 -0.25 -0.10 0.00 0.00 175.22 177.10 1umd n ASP 296 N -2.96 7.57 -4.05 1.36 8.00 -1.26 -4.42 116.55 120.80 1umd n ASP 296 Ca 0.07 -2.71 -0.09 0.00 0.71 0.00 0.00 54.79 52.76 1umd n ASP 296 Cb 0.54 -1.55 -0.09 0.00 -0.02 0.00 0.00 41.12 40.00 1umd n ASP 296 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1umd s THR 297 N 1.93 0.10 0.91 -3.53 -4.23 -1.26 -5.07 115.64 104.49 1umd s THR 297 Ca 0.62 -1.64 -0.11 0.00 -1.18 0.00 0.00 61.69 59.38 1umd s THR 297 Cb 0.17 -1.86 0.14 0.00 1.34 0.00 0.00 72.50 72.28 1umd s THR 297 CO -0.07 -0.46 1.09 -2.84 -0.54 0.00 0.00 174.62 171.81 1umd s PRO 298 N -3.99 1.13 -0.20 3.99 0.02 -1.26 -4.87 135.00 129.81 1umd s PRO 298 Ca 0.18 1.04 -0.29 0.00 0.02 0.00 0.00 61.00 61.95 1umd s PRO 298 Cb 0.06 -1.78 -0.02 0.00 0.02 0.00 0.00 34.50 32.78 1umd s PRO 298 CO -0.01 -2.39 1.46 -0.47 -0.33 0.00 0.00 177.00 175.26 1umd s TYR 299 N -2.81 2.40 0.30 6.54 6.14 -1.26 -4.98 117.35 123.68 1umd s TYR 299 Ca 0.64 0.68 -0.27 0.00 0.64 0.00 0.00 57.07 58.76 1umd s TYR 299 Cb -0.20 -3.84 -0.10 0.00 0.42 0.00 0.00 41.96 38.25 1umd s TYR 299 CO 0.58 -2.50 0.96 -1.25 0.64 0.00 0.00 175.55 173.98 1umd s PRO 300 N 4.17 4.64 -0.10 4.97 0.04 -1.26 -2.23 135.00 145.23 1umd s PRO 300 Ca 0.64 1.42 -0.01 0.00 0.04 0.00 0.00 61.00 63.09 1umd s PRO 300 Cb -0.23 -2.95 -0.00 0.00 0.04 0.00 0.00 34.50 31.36 1umd s PRO 300 CO 0.24 0.32 -0.02 -0.92 0.04 0.00 0.00 177.00 176.66 1umd h TYR 301 N 3.45 0.00 -0.81 0.56 3.20 -1.94 -3.08 116.97 118.35 1umd h TYR 301 Ca -0.46 0.00 0.14 0.00 3.14 0.00 0.00 58.73 61.54 1umd h TYR 301 Cb 1.20 0.00 -0.09 0.00 1.54 0.00 0.00 36.73 39.38 1umd h TYR 301 CO 0.61 0.00 0.40 0.00 -1.64 0.00 0.00 178.16 177.53 1umd h ALA 302 N -1.05 1.19 -0.77 1.82 0.00 -1.98 -2.08 119.26 116.39 1umd h ALA 302 Ca 0.00 0.08 -0.25 0.00 0.00 0.00 0.00 54.91 54.74 1umd h ALA 302 Cb 0.05 -0.00 -0.15 0.00 0.00 0.00 0.00 17.79 17.69 1umd h ALA 302 CO 0.00 -0.10 0.31 1.04 0.00 0.00 0.00 179.25 180.50 1umd n GLN 303 N -4.89 3.54 -0.24 0.00 3.00 -1.26 -4.66 117.38 112.86 1umd n GLN 303 Ca 0.16 -3.09 0.02 0.00 -0.01 0.00 0.00 57.00 54.07 1umd n GLN 303 Cb 0.40 -2.21 0.10 0.00 0.00 0.00 0.00 30.24 28.53 1umd n GLN 303 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.06 177.28 1umd h ASP 304 N 2.46 -0.54 -0.21 1.08 1.82 -1.27 0.62 116.42 120.37 1umd h ASP 304 Ca 0.31 0.20 0.06 0.00 -0.39 0.00 0.00 57.03 57.21 1umd h ASP 304 Cb 2.40 0.39 -0.01 0.00 0.68 0.00 0.00 39.33 42.79 1umd h ASP 304 CO 0.78 -0.21 0.19 0.11 -1.61 0.00 0.00 179.24 178.51 1umd h LYS 305 N 0.03 0.00 0.00 0.28 1.57 -1.85 -2.58 116.57 114.03 1umd h LYS 305 Ca 0.35 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.95 1umd h LYS 305 Cb 0.57 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 1umd h LYS 305 CO -0.68 0.00 -1.92 1.28 -0.57 0.00 0.00 179.45 177.55 1umd n LEU 306 N -4.05 0.30 0.03 2.94 4.77 0.08 -4.43 117.00 116.64 1umd n LEU 306 Ca 0.02 0.13 -0.13 0.00 -0.03 0.00 0.00 56.01 56.00 1umd n LEU 306 Cb 0.33 0.20 -0.09 0.00 -2.33 0.00 0.00 43.42 41.52 1umd n LEU 306 CO 0.30 0.22 0.61 0.22 -1.33 0.00 0.00 177.39 177.41 1umd h TYR 307 N 0.00 -0.10 -2.56 -1.77 5.03 -0.82 -3.43 116.97 113.33 1umd h TYR 307 Ca -0.24 -0.00 -0.53 0.00 2.58 0.00 0.00 58.73 60.54 1umd h TYR 307 Cb 1.62 0.03 0.04 0.00 1.55 0.00 0.00 36.73 39.97 1umd h TYR 307 CO 0.00 0.33 1.09 -1.17 -1.32 0.00 0.00 178.16 177.09 1umd s LEU 308 N -9.32 4.39 0.09 2.82 2.96 -1.10 -4.55 118.68 113.98 1umd s LEU 308 Ca -0.15 2.72 -0.36 0.00 -0.22 0.00 0.00 54.13 56.12 1umd s LEU 308 Cb 0.02 -3.57 -0.17 0.00 0.50 0.00 0.00 46.19 42.97 1umd s LEU 308 CO 0.63 -0.99 1.23 -2.65 -1.32 0.00 0.00 176.35 173.25 1umd n PRO 309 N 5.63 0.91 -3.21 0.98 -0.02 -1.26 -4.95 135.00 133.07 1umd n PRO 309 Ca 0.17 0.33 -0.21 0.00 -2.02 0.00 0.00 63.50 61.77 1umd n PRO 309 Cb 0.38 -1.89 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 1umd n PRO 309 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1umd s THR 310 N 0.19 4.07 0.23 3.45 -4.23 -1.26 -4.90 115.64 113.19 1umd s THR 310 Ca 0.82 -0.71 -0.07 0.00 -1.18 0.00 0.00 61.69 60.55 1umd s THR 310 Cb -0.99 -3.46 0.19 0.00 1.34 0.00 0.00 72.50 69.58 1umd s THR 310 CO 0.50 -0.26 1.86 0.58 -0.54 0.00 0.00 174.62 176.76 1umd h VAL 311 N 0.62 1.08 -0.55 2.29 2.07 -1.93 -1.61 116.25 118.23 1umd h VAL 311 Ca -0.46 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 1umd h VAL 311 Cb 1.25 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 1umd h VAL 311 CO 0.56 0.18 0.32 0.74 0.02 0.00 0.00 177.57 179.39 1umd h THR 312 N 0.97 1.17 -0.79 2.57 2.02 -1.94 -0.28 112.91 116.63 1umd h THR 312 Ca 0.34 -0.41 -0.05 0.00 0.77 0.00 0.00 66.41 67.07 1umd h THR 312 Cb 0.08 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 66.89 1umd h THR 312 CO -0.14 0.18 0.31 -0.09 0.37 0.00 0.00 175.52 176.15 1umd h ARG 313 N 0.75 1.19 -0.32 6.66 2.43 -1.78 -0.22 114.38 123.08 1umd h ARG 313 Ca 0.20 -0.22 -0.08 0.00 -0.81 0.00 0.00 59.98 59.07 1umd h ARG 313 Cb 0.01 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 1umd h ARG 313 CO -0.04 0.96 -0.10 0.82 -1.51 0.00 0.00 179.97 180.11 1umd h ILE 314 N 1.15 1.28 -0.61 1.20 2.04 -1.05 -2.72 117.51 118.81 1umd h ILE 314 Ca 0.26 -1.16 -0.05 0.00 1.00 0.00 0.00 64.86 64.91 1umd h ILE 314 Cb 0.23 1.37 -0.03 0.00 -0.74 0.00 0.00 36.82 37.65 1umd h ILE 314 CO -0.02 0.38 0.18 -0.07 0.00 0.00 0.00 178.15 178.61 1umd h LEU 315 N 0.41 0.87 -1.17 1.44 3.38 -0.76 -0.58 115.31 118.90 1umd h LEU 315 Ca 0.08 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 1umd h LEU 315 Cb 0.60 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1umd h LEU 315 CO 0.04 0.82 0.13 0.78 0.09 0.00 0.00 178.44 180.30 1umd h ASN 316 N 0.90 0.66 0.07 -0.43 2.35 -0.95 0.27 115.58 118.45 1umd h ASN 316 Ca 0.20 -0.10 -0.19 0.00 -0.55 0.00 0.00 56.30 55.66 1umd h ASN 316 Cb 0.28 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.48 1umd h ASN 316 CO -0.01 0.65 -0.68 0.00 -1.65 0.00 0.00 177.43 175.74 1umd h ALA 317 N 1.45 0.55 -0.52 -0.83 0.00 -1.10 -2.38 119.26 116.42 1umd h ALA 317 Ca 0.16 -0.57 -0.04 0.00 0.00 0.00 0.00 54.91 54.45 1umd h ALA 317 Cb 0.24 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1umd h ALA 317 CO -0.01 0.72 0.15 0.00 0.00 0.00 0.00 179.25 180.12 1umd h ALA 318 N 0.84 0.69 -0.74 0.00 0.00 -0.44 -1.68 119.26 117.93 1umd h ALA 318 Ca -0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1umd h ALA 318 Cb 1.26 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 1umd h ALA 318 CO 0.13 0.35 0.40 -0.22 0.00 0.00 0.00 179.25 179.92 1umd h LYS 319 N 0.72 1.03 -0.40 0.00 3.64 -0.93 0.11 116.57 120.75 1umd h LYS 319 Ca 0.17 -0.12 0.04 0.00 -1.27 0.00 0.00 60.65 59.46 1umd h LYS 319 Cb 0.29 -0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 31.87 1umd h LYS 319 CO -0.00 0.76 0.18 -0.09 -2.27 0.00 0.00 179.45 178.03 1umd h ARG 320 N 1.02 0.36 -0.50 1.90 2.43 -1.10 0.27 114.38 118.76 1umd h ARG 320 Ca 0.26 -0.02 -0.13 0.00 -0.81 0.00 0.00 59.98 59.28 1umd h ARG 320 Cb 0.03 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 1umd h ARG 320 CO -0.04 0.24 -0.19 0.00 -1.51 0.00 0.00 179.97 178.46 1umd h ALA 321 N 1.22 0.71 -0.39 2.80 0.00 -0.84 -2.70 119.26 120.06 1umd h ALA 321 Ca 0.17 -0.39 -0.13 0.00 0.00 0.00 0.00 54.91 54.56 1umd h ALA 321 Cb 0.10 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1umd h ALA 321 CO -0.14 0.68 -0.28 -0.07 0.00 0.00 0.00 179.25 179.44 1umd h LEU 322 N 0.88 0.92 -0.32 0.00 3.38 -0.30 -3.16 115.31 116.71 1umd h LEU 322 Ca 0.12 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1umd h LEU 322 Cb 0.77 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1umd h LEU 322 CO 0.06 1.16 -0.03 0.47 0.09 0.00 0.00 178.44 180.20 1umd n ASP 323 N -4.16 0.52 0.00 -0.43 8.00 0.91 -5.08 116.55 116.31 1umd n ASP 323 Ca -0.02 -1.00 0.08 0.00 0.71 0.00 0.00 54.79 54.55 1umd n ASP 323 Cb 0.48 -0.03 0.46 0.00 -0.02 0.00 0.00 41.12 42.01 1umd n ASP 323 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81