#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s5n n TYR 2 N 0.00 -2.57 -3.23 0.66 4.02 -1.26 -4.94 117.16 109.84 1s5n n TYR 2 Ca 0.00 0.97 -0.43 0.00 -0.01 0.00 0.00 57.90 58.43 1s5n n TYR 2 Cb 0.00 -4.77 -0.08 0.00 -0.02 0.00 0.00 39.34 34.47 1s5n n TYR 2 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 1s5n s GLN 3 N -6.19 3.16 0.55 -0.72 -0.21 -1.26 -4.61 119.66 110.38 1s5n s GLN 3 Ca 0.46 -0.65 -0.20 0.00 0.02 0.00 0.00 55.36 54.98 1s5n s GLN 3 Cb -0.21 -3.98 -0.05 0.00 1.00 0.00 0.00 33.01 29.77 1s5n s GLN 3 CO 0.76 -0.96 1.20 -1.25 -2.12 0.00 0.00 175.29 172.92 1s5n s PRO 4 N 2.43 3.21 0.18 2.91 0.04 -1.26 -5.05 135.00 137.46 1s5n s PRO 4 Ca 0.16 1.81 0.00 0.00 0.04 0.00 0.00 61.00 63.02 1s5n s PRO 4 Cb -0.16 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.27 1s5n s PRO 4 CO 0.15 -1.01 0.06 0.95 0.04 0.00 0.00 177.00 177.19 1s5n s THR 5 N -1.59 0.35 0.56 1.26 -4.23 -1.24 -4.45 115.64 106.30 1s5n s THR 5 Ca 0.73 -1.97 0.24 0.00 -1.18 0.00 0.00 61.69 59.52 1s5n s THR 5 Cb -0.30 -2.28 0.34 0.00 1.34 0.00 0.00 72.50 71.60 1s5n s THR 5 CO 0.33 -0.28 2.14 -0.65 -0.54 0.00 0.00 174.62 175.62 1s5n h PRO 6 N 2.67 0.00 -0.00 3.99 0.11 -1.76 0.42 132.00 137.43 1s5n h PRO 6 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1s5n h PRO 6 Cb 1.22 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1s5n h PRO 6 CO 0.59 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.32 1s5n h GLU 7 N 0.00 0.00 0.00 1.05 4.39 -1.94 -2.29 114.58 115.79 1s5n h GLU 7 Ca 0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1s5n h GLU 7 Cb 0.30 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 1s5n h GLU 7 CO -0.00 0.00 0.00 -0.25 -1.16 0.00 0.00 179.01 177.60 1s5n n ASP 8 N -3.18 0.00 -1.29 1.42 8.00 0.14 -4.94 116.55 116.70 1s5n n ASP 8 Ca -0.03 0.02 -0.13 0.00 0.71 0.00 0.00 54.79 55.36 1s5n n ASP 8 Cb 0.07 -0.32 -0.03 0.00 -0.02 0.00 0.00 41.12 40.82 1s5n n ASP 8 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1s5n n ARG 9 N -1.32 -0.99 -2.62 -1.24 1.74 -0.86 -4.70 116.66 106.66 1s5n n ARG 9 Ca 0.11 0.78 -0.41 0.00 -0.77 0.00 0.00 57.85 57.56 1s5n n ARG 9 Cb 0.22 -4.94 -0.04 0.00 -1.02 0.00 0.00 32.46 26.69 1s5n n ARG 9 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1s5n s PHE 10 N -2.59 3.66 0.12 -1.55 0.08 -1.26 -1.27 117.98 115.18 1s5n s PHE 10 Ca 0.00 1.65 0.03 0.00 0.12 0.00 0.00 56.93 58.73 1s5n s PHE 10 Cb 0.00 -3.18 -0.04 0.00 -0.57 0.00 0.00 43.02 39.22 1s5n s PHE 10 CO 0.00 -0.29 -0.08 0.95 -0.10 0.00 0.00 175.22 175.70 1s5n s THR 11 N 0.35 0.94 -0.02 0.64 -4.23 -0.57 -0.03 115.64 112.71 1s5n s THR 11 Ca 0.51 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.98 1s5n s THR 11 Cb -0.25 -1.78 0.00 0.00 1.34 0.00 0.00 72.50 71.81 1s5n s THR 11 CO 0.31 -0.80 0.08 -0.36 -0.54 0.00 0.00 174.62 173.30 1s5n s PHE 12 N -3.47 -0.02 0.46 3.99 0.40 -1.06 -0.65 117.98 117.63 1s5n s PHE 12 Ca 0.15 0.05 -0.22 0.00 -0.60 0.00 0.00 56.93 56.31 1s5n s PHE 12 Cb 0.04 -0.02 -0.08 0.00 0.51 0.00 0.00 43.02 43.48 1s5n s PHE 12 CO -0.02 -0.11 1.10 0.20 0.70 0.00 0.00 175.22 177.09 1s5n s GLY 13 N -0.42 2.68 0.42 4.36 0.00 -1.24 -1.40 107.32 111.72 1s5n s GLY 13 Ca -0.05 0.77 0.13 0.00 0.00 0.00 0.00 44.72 45.57 1s5n s GLY 13 CO 0.00 1.17 1.95 1.41 0.00 0.00 0.00 173.10 177.63 1s5n h LEU 14 N 1.93 0.44 0.00 0.66 3.38 -1.35 -1.83 115.31 118.53 1s5n h LEU 14 Ca -0.49 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1s5n h LEU 14 Cb 1.23 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1s5n h LEU 14 CO 0.60 0.25 0.00 -2.67 0.09 0.00 0.00 178.44 176.71 1s5n n TRP 15 N -4.48 0.00 0.00 1.13 2.14 -1.26 -1.87 117.44 113.10 1s5n n TRP 15 Ca 0.12 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.69 1s5n n TRP 15 Cb 0.41 -0.15 0.00 0.00 -0.81 0.00 0.00 31.31 30.76 1s5n n TRP 15 CO 0.00 0.00 0.00 0.25 2.07 0.00 0.00 177.69 180.01 1s5n n THR 16 N -1.15 0.00 0.29 -1.67 -2.24 -0.69 -2.83 114.28 106.00 1s5n n THR 16 Ca 0.17 0.18 0.14 0.00 -2.27 0.00 0.00 64.05 62.27 1s5n n THR 16 Cb 0.16 -0.72 0.88 0.00 -2.10 0.00 0.00 70.33 68.56 1s5n n THR 16 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 1s5n h VAL 17 N 0.00 0.58 -0.06 2.28 -1.51 -1.73 -1.40 116.25 114.41 1s5n h VAL 17 Ca 0.00 -0.03 0.00 0.00 -1.23 0.00 0.00 66.70 65.44 1s5n h VAL 17 Cb 0.00 1.02 0.00 0.00 -2.13 0.00 0.00 31.29 30.18 1s5n h VAL 17 CO 0.00 0.01 0.00 0.61 -1.23 0.00 0.00 177.57 176.96 1s5n n GLY 18 N -1.31 -0.39 3.68 5.19 0.00 -0.78 -4.88 105.19 106.69 1s5n n GLY 18 Ca -0.03 -0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 1s5n n GLY 18 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1s5n s TRP 19 N -1.93 2.15 -1.37 1.61 -0.00 -0.53 -4.60 118.94 114.27 1s5n s TRP 19 Ca 0.35 0.10 0.30 0.00 -0.00 0.00 0.00 56.10 56.84 1s5n s TRP 19 Cb 0.17 -4.07 1.47 0.00 -0.00 0.00 0.00 33.47 31.05 1s5n s TRP 19 CO 0.28 -4.41 2.03 1.04 -0.00 0.00 0.00 176.95 175.89 1s5n n GLN 20 N 5.99 0.38 -0.16 5.86 6.02 -1.26 -4.86 117.38 129.35 1s5n n GLN 20 Ca 0.17 -0.01 0.00 0.00 -0.01 0.00 0.00 57.00 57.15 1s5n n GLN 20 Cb 0.40 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.16 1s5n n GLN 20 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1s5n n GLY 21 N 1.32 0.86 3.74 1.08 0.00 -1.26 -0.52 105.19 110.41 1s5n n GLY 21 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1s5n n GLY 21 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s5n s ARG 22 N -0.84 4.38 0.35 1.61 0.52 -1.26 -4.45 118.95 119.26 1s5n s ARG 22 Ca 0.00 2.07 0.06 0.00 -0.52 0.00 0.00 55.73 57.34 1s5n s ARG 22 Cb 0.00 -3.18 -0.03 0.00 0.52 0.00 0.00 34.95 32.26 1s5n s ARG 22 CO 0.00 -0.26 0.23 0.16 0.02 0.00 0.00 175.30 175.45 1s5n s ASP 23 N 0.31 1.96 0.53 0.23 1.47 -0.76 -4.98 116.67 115.43 1s5n s ASP 23 Ca 0.56 -1.72 0.36 0.00 1.18 0.00 0.00 52.55 52.93 1s5n s ASP 23 Cb -0.37 0.54 1.93 0.00 -0.34 0.00 0.00 42.92 44.68 1s5n s ASP 23 CO 0.39 -1.02 2.10 -0.65 0.68 0.00 0.00 175.17 176.67 1s5n h PRO 24 N 2.05 0.00 0.00 2.11 0.11 -2.02 -2.62 132.00 131.63 1s5n h PRO 24 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1s5n h PRO 24 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1s5n h PRO 24 CO 0.43 0.00 -0.10 1.19 -0.21 0.00 0.00 178.00 179.31 1s5n n PHE 25 N -2.77 0.00 -3.71 0.65 3.72 -1.26 -5.08 117.46 109.01 1s5n n PHE 25 Ca -0.02 -0.67 -0.13 0.00 -0.05 0.00 0.00 57.45 56.57 1s5n n PHE 25 Cb 0.07 -0.11 -0.09 0.00 -0.94 0.00 0.00 39.48 38.41 1s5n n PHE 25 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1s5n s GLY 26 N -2.08 -0.36 0.78 1.37 0.00 -0.99 -5.16 107.32 100.88 1s5n s GLY 26 Ca 0.19 1.35 -0.10 0.00 0.00 0.00 0.00 44.72 46.16 1s5n s GLY 26 CO 0.02 1.19 1.13 0.99 0.00 0.00 0.00 173.10 176.42 1s5n s ASP 27 N 0.31 4.61 0.42 1.64 1.01 -1.26 -1.82 116.67 121.58 1s5n s ASP 27 Ca -0.00 0.69 -0.26 0.00 0.71 0.00 0.00 52.55 53.69 1s5n s ASP 27 Cb -0.04 -1.24 -0.09 0.00 1.01 0.00 0.00 42.92 42.57 1s5n s ASP 27 CO -0.00 -1.81 1.41 0.00 0.21 0.00 0.00 175.17 174.99 1s5n s ALA 28 N -3.48 3.34 -0.93 5.23 0.00 -1.26 -4.24 121.76 120.42 1s5n s ALA 28 Ca 0.61 1.44 0.13 0.00 0.00 0.00 0.00 51.96 54.15 1s5n s ALA 28 Cb -0.11 -3.57 -0.07 0.00 0.00 0.00 0.00 23.12 19.37 1s5n s ALA 28 CO 0.48 -1.06 0.66 0.25 0.00 0.00 0.00 175.76 176.08 1s5n n THR 29 N 0.08 0.00 -4.09 0.00 -2.24 0.33 -4.93 114.28 103.44 1s5n n THR 29 Ca 0.03 -0.28 -0.11 0.00 -2.27 0.00 0.00 64.05 61.43 1s5n n THR 29 Cb 0.41 1.08 -0.11 0.00 -2.10 0.00 0.00 70.33 69.62 1s5n n THR 29 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1s5n s ARG 30 N -1.95 0.60 0.68 -0.78 0.52 -0.62 -4.97 118.95 112.43 1s5n s ARG 30 Ca 0.08 -0.97 -0.12 0.00 -0.52 0.00 0.00 55.73 54.21 1s5n s ARG 30 Cb 0.10 -0.14 0.00 0.00 0.52 0.00 0.00 34.95 35.43 1s5n s ARG 30 CO 0.44 -0.01 1.06 -1.25 0.02 0.00 0.00 175.30 175.56 1s5n s PRO 31 N -2.54 3.00 0.53 3.54 0.04 -1.26 -4.65 135.00 133.65 1s5n s PRO 31 Ca -0.02 1.01 -0.22 0.00 0.04 0.00 0.00 61.00 61.80 1s5n s PRO 31 Cb -0.03 -2.00 -0.06 0.00 0.04 0.00 0.00 34.50 32.46 1s5n s PRO 31 CO -0.03 -1.05 1.34 0.00 0.04 0.00 0.00 177.00 177.30 1s5n n ALA 32 N -2.93 1.55 -2.83 8.56 0.00 -1.26 -4.83 120.51 118.77 1s5n n ALA 32 Ca 0.08 0.15 -0.36 0.00 0.00 0.00 0.00 53.44 53.30 1s5n n ALA 32 Cb 0.53 -2.34 -0.07 0.00 0.00 0.00 0.00 19.45 17.57 1s5n n ALA 32 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1s5n s LEU 33 N -3.12 4.22 0.09 0.00 1.43 -1.26 -5.08 118.68 114.96 1s5n s LEU 33 Ca 0.70 0.37 -0.31 0.00 -1.03 0.00 0.00 54.13 53.86 1s5n s LEU 33 Cb -0.43 -2.03 -0.07 0.00 0.03 0.00 0.00 46.19 43.69 1s5n s LEU 33 CO 0.51 0.37 1.40 -0.62 0.23 0.00 0.00 176.35 178.23 1s5n s ASP 34 N -0.78 6.83 0.46 2.29 -1.08 -1.26 -4.91 116.67 118.22 1s5n s ASP 34 Ca 0.13 2.28 0.21 0.00 -0.52 0.00 0.00 52.55 54.65 1s5n s ASP 34 Cb -0.12 -2.58 1.20 0.00 -1.46 0.00 0.00 42.92 39.96 1s5n s ASP 34 CO 0.03 -0.67 1.89 -0.65 0.52 0.00 0.00 175.17 176.29 1s5n h PRO 35 N 7.09 0.26 -0.45 4.34 0.11 -1.96 0.23 132.00 141.62 1s5n h PRO 35 Ca -0.41 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.69 1s5n h PRO 35 Cb 1.20 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 1s5n h PRO 35 CO 0.87 0.17 0.30 0.28 -0.21 0.00 0.00 178.00 179.42 1s5n h VAL 36 N 0.27 1.11 -0.46 3.15 2.07 -1.91 -0.88 116.25 119.61 1s5n h VAL 36 Ca 0.42 -0.21 0.02 0.00 0.82 0.00 0.00 66.70 67.74 1s5n h VAL 36 Cb 1.21 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 1s5n h VAL 36 CO -0.11 0.11 0.28 -0.08 0.02 0.00 0.00 177.57 177.79 1s5n h GLU 37 N 0.61 0.55 -0.57 1.57 4.57 -1.36 -1.90 114.58 118.05 1s5n h GLU 37 Ca 0.17 -0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.34 1s5n h GLU 37 Cb -0.07 -0.12 -0.04 0.00 -0.16 0.00 0.00 28.75 28.36 1s5n h GLU 37 CO -0.04 0.37 0.35 1.15 -1.18 0.00 0.00 179.01 179.66 1s5n h THR 38 N 0.57 1.08 -0.37 0.32 2.02 -1.09 0.44 112.91 115.87 1s5n h THR 38 Ca 0.18 -0.24 0.01 0.00 0.77 0.00 0.00 66.41 67.13 1s5n h THR 38 Cb -0.01 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 66.69 1s5n h THR 38 CO -0.07 0.13 0.24 0.58 0.37 0.00 0.00 175.52 176.77 1s5n h VAL 39 N 0.70 1.08 -0.22 3.16 2.07 -0.93 -0.43 116.25 121.68 1s5n h VAL 39 Ca 0.23 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.58 1s5n h VAL 39 Cb 0.01 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1s5n h VAL 39 CO -0.09 0.09 0.12 -0.61 0.02 0.00 0.00 177.57 177.10 1s5n h GLN 40 N 0.49 0.31 -0.44 1.57 5.75 -0.98 -1.19 115.11 120.62 1s5n h GLN 40 Ca 0.14 -0.04 -0.09 0.00 -0.15 0.00 0.00 58.65 58.51 1s5n h GLN 40 Cb -0.04 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.43 1s5n h GLN 40 CO -0.04 0.30 -0.06 0.00 -2.65 0.00 0.00 178.83 176.38 1s5n h ARG 41 N 0.25 0.82 -0.63 1.69 2.47 -0.70 -1.61 114.38 116.67 1s5n h ARG 41 Ca 0.08 -0.29 -0.09 0.00 -1.26 0.00 0.00 59.98 58.42 1s5n h ARG 41 Cb 0.08 -0.06 -0.02 0.00 -1.65 0.00 0.00 29.97 28.32 1s5n h ARG 41 CO -0.01 0.91 0.06 -0.07 0.56 0.00 0.00 179.97 181.42 1s5n h LEU 42 N 0.65 1.03 -0.55 3.04 3.38 -1.04 -2.07 115.31 119.75 1s5n h LEU 42 Ca 0.12 -0.26 0.03 0.00 0.09 0.00 0.00 57.88 57.86 1s5n h LEU 42 Cb 0.59 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 1s5n h LEU 42 CO 0.04 1.04 0.32 0.00 0.09 0.00 0.00 178.44 179.93 1s5n h ALA 43 N 1.07 0.71 0.00 1.53 0.00 -0.99 -1.41 119.26 120.16 1s5n h ALA 43 Ca 0.19 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1s5n h ALA 43 Cb 0.48 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1s5n h ALA 43 CO 0.02 0.02 -0.13 1.49 0.00 0.00 0.00 179.25 180.65 1s5n h GLU 44 N 0.63 0.00 -0.00 0.00 4.81 -0.97 -1.47 114.58 117.57 1s5n h GLU 44 Ca 0.23 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 1s5n h GLU 44 Cb 0.05 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.43 1s5n h GLU 44 CO -0.11 0.13 -0.18 1.28 -0.73 0.00 0.00 179.01 179.40 1s5n n LEU 45 N -3.75 0.28 0.00 1.64 4.77 -0.78 -4.94 117.00 114.22 1s5n n LEU 45 Ca -0.02 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 1s5n n LEU 45 Cb 0.24 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1s5n n LEU 45 CO 0.31 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 1s5n n GLY 46 N 1.43 1.04 3.75 -0.72 0.00 -0.55 -4.64 105.19 105.49 1s5n n GLY 46 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 1s5n n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s5n s ALA 47 N -2.00 2.13 -0.10 4.61 0.00 -0.60 -3.19 121.76 122.61 1s5n s ALA 47 Ca 0.00 0.39 0.06 0.00 0.00 0.00 0.00 51.96 52.41 1s5n s ALA 47 Cb 0.00 -3.32 -0.24 0.00 0.00 0.00 0.00 23.12 19.56 1s5n s ALA 47 CO 0.00 -1.89 0.42 1.58 0.00 0.00 0.00 175.76 175.87 1s5n n HIS 48 N -3.47 0.90 -3.75 0.00 -0.00 0.95 -4.42 115.22 105.42 1s5n n HIS 48 Ca 0.10 0.26 -0.00 0.00 -0.00 0.00 0.00 57.72 58.07 1s5n n HIS 48 Cb 0.53 -1.14 0.01 0.00 -0.00 0.00 0.00 29.99 29.38 1s5n n HIS 48 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1s5n n GLY 49 N 1.78 0.78 2.98 1.57 0.00 -1.08 -1.77 105.19 109.45 1s5n n GLY 49 Ca -0.26 -1.00 -0.09 0.00 0.00 0.00 0.00 46.02 44.67 1s5n n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s5n s VAL 50 N -2.24 0.10 0.31 1.61 0.11 0.22 -2.56 120.40 117.95 1s5n s VAL 50 Ca 0.12 -0.87 0.06 0.00 -2.93 0.00 0.00 61.98 58.37 1s5n s VAL 50 Cb -0.01 -0.26 -0.06 0.00 -1.53 0.00 0.00 36.38 34.52 1s5n s VAL 50 CO 0.02 -0.48 -0.02 0.42 -3.33 0.00 0.00 175.10 171.71 1s5n s THR 51 N -1.40 1.56 -0.02 5.04 -4.23 -0.49 -4.09 115.64 112.01 1s5n s THR 51 Ca -0.15 -2.08 -0.22 0.00 -1.18 0.00 0.00 61.69 58.06 1s5n s THR 51 Cb -0.10 -2.61 0.04 0.00 1.34 0.00 0.00 72.50 71.18 1s5n s THR 51 CO -0.01 -0.18 0.48 0.72 -0.54 0.00 0.00 174.62 175.09 1s5n s PHE 52 N -3.05 -0.40 0.36 3.99 -0.71 -1.25 -0.79 117.98 116.13 1s5n s PHE 52 Ca 0.32 0.64 -0.18 0.00 -1.04 0.00 0.00 56.93 56.67 1s5n s PHE 52 Cb 0.06 0.25 -0.10 0.00 -1.21 0.00 0.00 43.02 42.02 1s5n s PHE 52 CO 0.14 -0.50 0.83 -1.01 -1.34 0.00 0.00 175.22 173.33 1s5n s HIS 53 N -1.38 3.37 0.20 3.49 3.76 -1.26 -1.10 115.29 122.37 1s5n s HIS 53 Ca -0.12 1.41 -0.15 0.00 -0.15 0.00 0.00 55.06 56.06 1s5n s HIS 53 Cb -0.03 -2.68 0.21 0.00 1.11 0.00 0.00 32.58 31.19 1s5n s HIS 53 CO 0.06 0.02 1.33 -0.40 -0.85 0.00 0.00 174.74 174.90 1s5n n ASP 54 N -0.40 -0.55 -0.11 1.40 5.75 -0.73 -0.93 116.55 120.97 1s5n n ASP 54 Ca 0.05 1.49 0.15 0.00 -0.01 0.00 0.00 54.79 56.47 1s5n n ASP 54 Cb 0.53 -0.35 0.77 0.00 -1.03 0.00 0.00 41.12 41.04 1s5n n ASP 54 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1s5n n ASP 55 N -5.27 0.37 0.08 -1.12 8.00 -1.26 -1.28 116.55 116.08 1s5n n ASP 55 Ca 0.09 -0.87 -0.13 0.00 0.71 0.00 0.00 54.79 54.59 1s5n n ASP 55 Cb 0.35 -0.06 -0.13 0.00 -0.02 0.00 0.00 41.12 41.25 1s5n n ASP 55 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1s5n h ASP 56 N 0.54 0.29 0.15 -2.24 3.32 -1.43 -3.39 116.42 113.67 1s5n h ASP 56 Ca 0.00 -0.33 -0.36 0.00 0.02 0.00 0.00 57.03 56.36 1s5n h ASP 56 Cb 0.21 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 1s5n h ASP 56 CO 0.00 1.26 -1.89 0.25 -1.72 0.00 0.00 179.24 177.14 1s5n h LEU 57 N 0.05 0.50 -7.87 1.55 5.85 -1.24 -3.45 115.31 110.70 1s5n h LEU 57 Ca -0.12 -0.95 -0.62 0.00 0.84 0.00 0.00 57.88 57.03 1s5n h LEU 57 Cb 1.93 -0.16 -0.36 0.00 0.37 0.00 0.00 40.66 42.43 1s5n h LEU 57 CO 0.17 1.83 -0.83 -0.63 -0.34 0.00 0.00 178.44 178.65 1s5n s ILE 58 N -2.57 1.67 0.32 4.05 1.01 -0.40 -4.78 121.20 120.50 1s5n s ILE 58 Ca -0.20 -0.84 -0.28 0.00 0.00 0.00 0.00 60.65 59.33 1s5n s ILE 58 Cb 0.06 -1.64 -0.13 0.00 0.01 0.00 0.00 42.46 40.76 1s5n s ILE 58 CO 0.81 0.34 1.17 -2.65 0.00 0.00 0.00 174.94 174.61 1s5n n PRO 59 N 4.71 1.80 -1.63 2.79 -0.02 -1.26 -4.13 135.00 137.26 1s5n n PRO 59 Ca -0.16 0.63 -0.45 0.00 -2.02 0.00 0.00 63.50 61.50 1s5n n PRO 59 Cb 0.48 -2.12 -0.02 0.00 -0.02 0.00 0.00 33.50 31.82 1s5n n PRO 59 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1s5n n PHE 60 N 0.30 1.73 -0.88 6.00 -0.00 -1.26 -2.03 117.46 121.31 1s5n n PHE 60 Ca 0.07 0.60 0.00 0.00 -0.00 0.00 0.00 57.45 58.11 1s5n n PHE 60 Cb 0.34 -2.35 0.00 0.00 -0.00 0.00 0.00 39.48 37.48 1s5n n PHE 60 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1s5n n GLY 61 N 1.52 0.77 3.71 7.13 0.00 -1.26 -5.02 105.19 112.04 1s5n n GLY 61 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 1s5n n GLY 61 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1s5n n SER 62 N 0.00 2.30 -4.77 1.61 7.64 -0.86 -5.00 113.62 114.55 1s5n n SER 62 Ca 0.00 0.96 -0.30 0.00 1.01 0.00 0.00 58.87 60.55 1s5n n SER 62 Cb 0.00 -1.53 0.12 0.00 -1.01 0.00 0.00 64.21 61.79 1s5n n SER 62 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1s5n s SER 63 N -0.93 3.86 0.23 6.43 1.04 -1.26 -4.76 113.70 118.31 1s5n s SER 63 Ca 0.71 1.28 -0.08 0.00 0.48 0.00 0.00 55.95 58.35 1s5n s SER 63 Cb -0.43 -1.97 0.21 0.00 0.10 0.00 0.00 66.02 63.93 1s5n s SER 63 CO 0.50 -2.37 1.88 0.44 0.98 0.00 0.00 173.24 174.67 1s5n h ASP 64 N -1.36 1.06 0.09 7.02 3.32 -1.99 0.21 116.42 124.76 1s5n h ASP 64 Ca -0.49 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 56.50 1s5n h ASP 64 Cb 1.29 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 40.57 1s5n h ASP 64 CO 0.58 0.80 -0.07 0.74 -1.72 0.00 0.00 179.24 179.58 1s5n h THR 65 N 1.22 0.85 -0.71 0.35 2.02 -1.99 -1.42 112.91 113.22 1s5n h THR 65 Ca 0.32 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.49 1s5n h THR 65 Cb -0.07 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.16 1s5n h THR 65 CO -0.06 0.00 0.39 -0.33 0.37 0.00 0.00 175.52 175.89 1s5n h GLU 66 N -0.16 0.99 -0.30 6.66 5.08 -1.77 -1.96 114.58 123.12 1s5n h GLU 66 Ca -0.00 -0.11 0.04 0.00 -1.00 0.00 0.00 59.36 58.29 1s5n h GLU 66 Cb 0.14 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.16 1s5n h GLU 66 CO -0.00 0.74 0.06 -0.09 -1.00 0.00 0.00 179.01 178.71 1s5n h ARG 67 N 0.98 0.16 -0.55 2.33 2.43 -0.37 -1.35 114.38 118.02 1s5n h ARG 67 Ca 0.25 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.34 1s5n h ARG 67 Cb 0.03 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1s5n h ARG 67 CO -0.04 0.11 0.05 1.49 -1.51 0.00 0.00 179.97 180.07 1s5n h GLU 68 N 0.16 0.90 -0.49 0.20 4.22 -0.93 -1.16 114.58 117.47 1s5n h GLU 68 Ca 0.14 -0.23 -0.03 0.00 0.08 0.00 0.00 59.36 59.31 1s5n h GLU 68 Cb 0.15 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 1s5n h GLU 68 CO -0.19 0.86 0.17 1.03 -2.18 0.00 0.00 179.01 178.70 1s5n h SER 69 N 0.84 0.70 -0.52 1.04 0.87 -0.93 -0.19 113.55 115.36 1s5n h SER 69 Ca 0.17 -0.19 -0.05 0.00 -1.23 0.00 0.00 61.79 60.48 1s5n h SER 69 Cb 0.43 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.18 1s5n h SER 69 CO 0.01 0.71 0.12 0.45 -0.53 0.00 0.00 176.83 177.59 1s5n h HIS 70 N 0.66 0.89 -0.27 2.24 3.86 -0.78 -2.08 115.15 119.67 1s5n h HIS 70 Ca 0.16 -0.11 -0.01 0.00 -1.16 0.00 0.00 60.37 59.26 1s5n h HIS 70 Cb 0.24 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.45 1s5n h HIS 70 CO 0.01 0.78 0.14 0.82 0.86 0.00 0.00 177.93 180.55 1s5n h ILE 71 N 0.73 1.12 -0.42 2.45 2.04 -1.06 -2.59 117.51 119.78 1s5n h ILE 71 Ca 0.16 -0.33 0.06 0.00 1.00 0.00 0.00 64.86 65.75 1s5n h ILE 71 Cb 0.35 0.86 -0.05 0.00 -0.74 0.00 0.00 36.82 37.24 1s5n h ILE 71 CO 0.00 0.12 0.13 0.50 0.00 0.00 0.00 178.15 178.91 1s5n h LYS 72 N 0.32 0.28 -0.82 2.37 3.64 -0.88 0.51 116.57 121.99 1s5n h LYS 72 Ca 0.09 -0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.55 1s5n h LYS 72 Cb 0.07 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 31.75 1s5n h LYS 72 CO -0.01 0.19 0.47 0.00 -2.27 0.00 0.00 179.45 177.82 1s5n h ARG 73 N 0.29 0.76 -0.04 1.90 3.08 -1.36 -0.42 114.38 118.59 1s5n h ARG 73 Ca 0.20 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.18 1s5n h ARG 73 Cb 0.21 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.09 1s5n h ARG 73 CO -0.22 0.50 -0.09 0.35 -1.07 0.00 0.00 179.97 179.44 1s5n h PHE 74 N 0.78 0.16 -0.98 3.04 3.57 -0.99 -2.27 116.94 120.24 1s5n h PHE 74 Ca 0.40 -0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.88 1s5n h PHE 74 Cb 0.37 -0.03 -0.06 0.00 2.79 0.00 0.00 35.95 39.02 1s5n h PHE 74 CO -0.06 0.69 0.64 -0.09 -2.23 0.00 0.00 178.31 177.26 1s5n h ARG 75 N -0.41 1.18 -0.62 1.11 2.43 -0.67 -0.40 114.38 117.00 1s5n h ARG 75 Ca -0.00 -0.07 -0.08 0.00 -0.81 0.00 0.00 59.98 59.01 1s5n h ARG 75 Cb 0.69 -0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 29.94 1s5n h ARG 75 CO 0.02 0.78 0.06 1.96 -1.51 0.00 0.00 179.97 181.28 1s5n h GLN 76 N 1.21 1.05 -0.55 0.20 4.20 -1.00 0.12 115.11 120.35 1s5n h GLN 76 Ca 0.40 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 1s5n h GLN 76 Cb 0.06 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.70 1s5n h GLN 76 CO -0.14 0.99 0.29 0.00 -0.67 0.00 0.00 178.83 179.31 1s5n h ALA 77 N 1.07 0.71 -0.41 3.87 0.00 -0.74 0.19 119.26 123.96 1s5n h ALA 77 Ca 0.19 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1s5n h ALA 77 Cb 0.48 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1s5n h ALA 77 CO 0.02 0.24 0.25 -0.07 0.00 0.00 0.00 179.25 179.68 1s5n h LEU 78 N 0.74 0.40 -0.86 0.00 3.38 -0.86 -2.29 115.31 115.83 1s5n h LEU 78 Ca 0.19 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.09 1s5n h LEU 78 Cb 0.07 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1s5n h LEU 78 CO -0.03 0.29 0.01 0.44 0.09 0.00 0.00 178.44 179.24 1s5n h ASP 79 N 0.50 0.83 -0.26 -0.43 3.32 -0.44 -0.63 116.42 119.31 1s5n h ASP 79 Ca 0.16 -0.20 -0.11 0.00 0.02 0.00 0.00 57.03 56.90 1s5n h ASP 79 Cb -0.00 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 1s5n h ASP 79 CO -0.07 0.89 -0.20 0.00 -1.72 0.00 0.00 179.24 178.13 1s5n h ALA 80 N 1.21 0.94 0.00 3.45 0.00 -0.75 -3.25 119.26 120.85 1s5n h ALA 80 Ca 0.15 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1s5n h ALA 80 Cb 0.47 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1s5n h ALA 80 CO 0.02 0.61 -1.43 0.25 0.00 0.00 0.00 179.25 178.70 1s5n n THR 81 N -4.12 0.45 -0.96 0.00 -2.24 -0.88 -5.00 114.28 101.52 1s5n n THR 81 Ca 0.00 -0.55 0.00 0.00 -2.27 0.00 0.00 64.05 61.23 1s5n n THR 81 Cb 0.41 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 1s5n n THR 81 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1s5n n GLY 82 N 1.24 0.43 3.67 3.38 0.00 -0.25 -5.03 105.19 108.63 1s5n n GLY 82 Ca -0.03 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.53 1s5n n GLY 82 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1s5n n MET 83 N -1.80 2.23 -3.02 1.61 2.81 -1.23 -4.96 117.12 112.76 1s5n n MET 83 Ca 0.00 0.80 -0.17 0.00 -1.81 0.00 0.00 57.70 56.52 1s5n n MET 83 Cb 0.12 -2.59 0.01 0.00 -0.71 0.00 0.00 33.22 30.05 1s5n n MET 83 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1s5n s THR 84 N 1.23 2.98 -0.47 2.03 -4.23 -0.73 -4.66 115.64 111.78 1s5n s THR 84 Ca 0.80 -1.01 0.03 0.00 -1.18 0.00 0.00 61.69 60.33 1s5n s THR 84 Cb -0.66 -2.98 0.14 0.00 1.34 0.00 0.00 72.50 70.34 1s5n s THR 84 CO 0.38 0.00 0.27 -0.69 -0.54 0.00 0.00 174.62 174.05 1s5n s VAL 85 N -2.36 1.60 -0.71 2.29 1.01 -1.26 -0.61 120.40 120.36 1s5n s VAL 85 Ca 0.55 -2.82 0.26 0.00 0.00 0.00 0.00 61.98 59.97 1s5n s VAL 85 Cb -0.10 -2.11 0.22 0.00 0.00 0.00 0.00 36.38 34.40 1s5n s VAL 85 CO 0.33 -0.92 1.66 -2.65 0.00 0.00 0.00 175.10 173.51 1s5n n PRO 86 N 3.29 0.27 -3.72 2.72 -0.02 -1.26 -2.04 135.00 134.24 1s5n n PRO 86 Ca 0.11 0.18 -0.14 0.00 -2.02 0.00 0.00 63.50 61.63 1s5n n PRO 86 Cb 0.35 -1.77 -0.09 0.00 -0.02 0.00 0.00 33.50 31.97 1s5n n PRO 86 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1s5n s MET 87 N -3.12 0.68 0.26 -0.52 -2.45 -1.26 -1.87 119.30 111.03 1s5n s MET 87 Ca 0.09 0.04 -0.03 0.00 -1.25 0.00 0.00 55.69 54.54 1s5n s MET 87 Cb 0.13 0.31 -0.02 0.00 1.25 0.00 0.00 34.83 36.50 1s5n s MET 87 CO 0.63 -0.18 0.31 0.00 1.05 0.00 0.00 175.02 176.84 1s5n s ALA 88 N -0.97 0.81 0.31 4.11 0.00 -1.10 -3.89 121.76 121.02 1s5n s ALA 88 Ca -0.10 -1.50 -0.15 0.00 0.00 0.00 0.00 51.96 50.21 1s5n s ALA 88 Cb -0.04 1.27 0.02 0.00 0.00 0.00 0.00 23.12 24.37 1s5n s ALA 88 CO 0.04 -0.71 0.64 -0.08 0.00 0.00 0.00 175.76 175.65 1s5n s THR 89 N -3.80 0.00 -0.02 0.00 -1.32 -0.25 -1.30 115.64 108.95 1s5n s THR 89 Ca 0.33 -1.19 0.02 0.00 -1.21 0.00 0.00 61.69 59.64 1s5n s THR 89 Cb 0.03 -2.37 -0.03 0.00 -1.51 0.00 0.00 72.50 68.62 1s5n s THR 89 CO 0.15 0.00 -0.03 -0.89 -2.21 0.00 0.00 174.62 171.64 1s5n s THR 90 N -3.41 3.98 -0.64 5.08 2.01 -1.26 -1.78 115.64 119.61 1s5n s THR 90 Ca 0.18 -0.60 -0.23 0.00 0.31 0.00 0.00 61.69 61.35 1s5n s THR 90 Cb -0.04 -2.73 0.06 0.00 0.01 0.00 0.00 72.50 69.80 1s5n s THR 90 CO 0.10 0.43 0.96 0.21 -0.69 0.00 0.00 174.62 175.64 1s5n s ASN 91 N -1.36 6.20 -0.37 3.53 3.84 -1.26 -4.84 114.94 120.68 1s5n s ASN 91 Ca 0.17 -0.87 0.06 0.00 0.21 0.00 0.00 52.86 52.43 1s5n s ASN 91 Cb -0.11 -2.42 0.51 0.00 -0.55 0.00 0.00 41.25 38.67 1s5n s ASN 91 CO 0.08 -1.40 1.56 0.18 -2.79 0.00 0.00 177.10 174.72 1s5n n LEU 92 N 7.68 5.16 0.00 3.21 4.77 -1.26 -4.70 117.00 131.85 1s5n n LEU 92 Ca -0.03 -4.04 0.00 0.00 -0.03 0.00 0.00 56.01 51.91 1s5n n LEU 92 Cb 0.46 -0.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1s5n n LEU 92 CO 0.64 1.45 -0.03 2.22 -1.33 0.00 0.00 177.39 180.33 1s5n n PHE 93 N -1.02 0.00 -0.01 -1.77 1.16 -1.26 -4.35 117.46 110.21 1s5n n PHE 93 Ca 0.43 0.00 -0.16 0.00 -1.87 0.00 0.00 57.45 55.85 1s5n n PHE 93 Cb 1.03 0.00 -0.13 0.00 -1.61 0.00 0.00 39.48 38.78 1s5n n PHE 93 CO 0.00 0.00 0.00 1.15 -1.87 0.00 0.00 176.76 176.04 1s5n h THR 94 N 0.00 1.58 -3.92 1.97 2.02 -1.94 -3.46 112.91 109.15 1s5n h THR 94 Ca 0.00 -2.20 -0.53 0.00 0.77 0.00 0.00 66.41 64.45 1s5n h THR 94 Cb 0.06 2.99 0.08 0.00 -1.74 0.00 0.00 68.15 69.54 1s5n h THR 94 CO 0.00 0.61 0.65 -2.28 0.37 0.00 0.00 175.52 174.86 1s5n s HIS 95 N -2.77 2.88 0.61 3.16 2.46 -1.26 -4.88 115.29 115.49 1s5n s HIS 95 Ca -0.16 1.38 0.30 0.00 0.47 0.00 0.00 55.06 57.05 1s5n s HIS 95 Cb 0.00 -3.72 1.68 0.00 -0.13 0.00 0.00 32.58 30.41 1s5n s HIS 95 CO 0.76 -2.12 2.06 -1.35 -2.47 0.00 0.00 174.74 171.62 1s5n h PRO 96 N 3.01 0.00 -0.38 2.88 0.10 -2.02 -0.70 132.00 134.89 1s5n h PRO 96 Ca -0.49 0.00 0.07 0.00 0.10 0.00 0.00 66.00 65.67 1s5n h PRO 96 Cb 1.24 0.00 -0.02 0.00 0.10 0.00 0.00 31.00 32.32 1s5n h PRO 96 CO 0.64 0.00 0.26 -0.24 0.10 0.00 0.00 178.00 178.76 1s5n h VAL 97 N 0.00 0.92 -0.26 3.15 3.04 -1.96 -1.61 116.25 119.52 1s5n h VAL 97 Ca 0.09 -0.07 0.00 0.00 -1.01 0.00 0.00 66.70 65.71 1s5n h VAL 97 Cb 0.61 0.68 0.00 0.00 -2.01 0.00 0.00 31.29 30.57 1s5n h VAL 97 CO -0.00 0.04 0.00 0.49 -1.01 0.00 0.00 177.57 177.09 1s5n n PHE 98 N -4.47 0.82 0.29 3.17 3.72 -0.27 -4.53 117.46 116.19 1s5n n PHE 98 Ca 0.05 -0.29 0.14 0.00 -0.05 0.00 0.00 57.45 57.30 1s5n n PHE 98 Cb 0.30 -0.23 0.88 0.00 -0.94 0.00 0.00 39.48 39.49 1s5n n PHE 98 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1s5n h LYS 99 N 1.72 0.00 -0.33 -1.08 2.10 -1.45 -0.43 116.57 117.11 1s5n h LYS 99 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1s5n h LYS 99 Cb 1.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.35 1s5n h LYS 99 CO 0.18 0.01 0.00 -3.47 -2.00 0.00 0.00 179.45 174.17 1s5n n ASP 100 N -3.90 3.28 0.00 7.07 2.03 -1.26 -5.03 116.55 118.75 1s5n n ASP 100 Ca -0.03 -2.34 0.00 0.00 0.52 0.00 0.00 54.79 52.94 1s5n n ASP 100 Cb 0.09 -0.34 0.00 0.00 -0.72 0.00 0.00 41.12 40.15 1s5n n ASP 100 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1s5n n GLY 101 N 0.19 2.99 0.00 0.27 0.00 -0.17 -3.75 105.19 104.72 1s5n n GLY 101 Ca 0.15 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 44.19 1s5n n GLY 101 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s5n n GLY 102 N -1.25 -0.28 0.30 -0.02 0.00 -1.26 -4.18 105.19 98.49 1s5n n GLY 102 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.21 1s5n n GLY 102 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1s5n h PHE 103 N 0.00 0.00 -0.01 1.61 0.04 -1.89 -2.72 116.94 113.98 1s5n h PHE 103 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1s5n h PHE 103 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 1s5n h PHE 103 CO 0.00 0.01 0.00 0.25 -0.60 0.00 0.00 178.31 177.97 1s5n n THR 104 N -3.12 1.81 -1.63 -1.55 -2.24 -1.26 -4.42 114.28 101.87 1s5n n THR 104 Ca -0.01 -2.12 -0.41 0.00 -2.27 0.00 0.00 64.05 59.24 1s5n n THR 104 Cb 0.22 -0.16 0.02 0.00 -2.10 0.00 0.00 70.33 68.30 1s5n n THR 104 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1s5n n ALA 105 N -1.30 0.38 0.08 6.98 0.00 -1.02 -4.81 120.51 120.82 1s5n n ALA 105 Ca 0.15 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.80 1s5n n ALA 105 Cb 0.61 -2.12 0.32 0.00 0.00 0.00 0.00 19.45 18.26 1s5n n ALA 105 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1s5n h ASN 106 N 1.52 0.30 -3.01 0.00 2.35 -1.92 -3.41 115.58 111.42 1s5n h ASN 106 Ca -0.45 -0.08 -0.56 0.00 -0.55 0.00 0.00 56.30 54.65 1s5n h ASN 106 Cb 1.33 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 39.58 1s5n h ASN 106 CO 0.57 0.50 0.81 -1.81 -1.65 0.00 0.00 177.43 175.85 1s5n s ASP 107 N -6.85 7.02 0.24 5.81 1.01 -1.26 -4.93 116.67 117.71 1s5n s ASP 107 Ca -0.06 1.67 -0.07 0.00 0.71 0.00 0.00 52.55 54.81 1s5n s ASP 107 Cb 0.15 -2.55 0.23 0.00 1.01 0.00 0.00 42.92 41.77 1s5n s ASP 107 CO 0.75 -0.68 1.90 -0.09 0.21 0.00 0.00 175.17 177.26 1s5n h ARG 108 N 7.81 1.27 -0.39 8.23 2.43 -2.00 -2.35 114.38 129.39 1s5n h ARG 108 Ca -0.28 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 58.77 1s5n h ARG 108 Cb 1.12 -0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 30.37 1s5n h ARG 108 CO 0.94 0.87 0.16 0.38 -1.51 0.00 0.00 179.97 180.81 1s5n h ASP 109 N 1.30 0.49 -0.51 -3.80 3.04 -1.95 -1.71 116.42 113.28 1s5n h ASP 109 Ca 0.34 -0.05 -0.09 0.00 -3.24 0.00 0.00 57.03 54.00 1s5n h ASP 109 Cb -0.10 -0.12 -0.02 0.00 -1.04 0.00 0.00 39.33 38.05 1s5n h ASP 109 CO -0.07 0.44 -0.02 0.58 -2.04 0.00 0.00 179.24 178.13 1s5n h VAL 110 N 0.54 1.27 -0.58 4.15 2.07 -1.80 -1.80 116.25 120.10 1s5n h VAL 110 Ca 0.14 -1.12 0.03 0.00 0.82 0.00 0.00 66.70 66.56 1s5n h VAL 110 Cb 0.10 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 1s5n h VAL 110 CO -0.01 0.40 0.35 0.03 0.02 0.00 0.00 177.57 178.35 1s5n h ARG 111 N 0.78 0.68 -0.53 1.57 3.08 -0.98 0.61 114.38 119.59 1s5n h ARG 111 Ca 0.14 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.11 1s5n h ARG 111 Cb 0.55 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 1s5n h ARG 111 CO 0.03 0.45 0.17 0.00 -1.07 0.00 0.00 179.97 179.55 1s5n h ARG 112 N 0.70 0.82 -0.54 0.04 3.08 -1.22 -2.19 114.38 115.07 1s5n h ARG 112 Ca 0.24 -0.17 0.01 0.00 0.07 0.00 0.00 59.98 60.12 1s5n h ARG 112 Cb 0.02 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 29.93 1s5n h ARG 112 CO -0.10 0.75 0.34 -0.92 -1.07 0.00 0.00 179.97 178.97 1s5n h TYR 113 N 0.73 0.65 -0.61 3.04 3.20 -0.98 -1.40 116.97 121.59 1s5n h TYR 113 Ca 0.17 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.12 1s5n h TYR 113 Cb 0.27 -0.22 -0.05 0.00 1.54 0.00 0.00 36.73 38.27 1s5n h TYR 113 CO 0.01 0.39 0.32 0.00 -1.64 0.00 0.00 178.16 177.25 1s5n h ALA 114 N 1.21 0.81 -0.56 1.82 0.00 -0.66 0.39 119.26 122.26 1s5n h ALA 114 Ca 0.20 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1s5n h ALA 114 Cb -0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1s5n h ALA 114 CO -0.06 -0.02 0.26 -0.07 0.00 0.00 0.00 179.25 179.36 1s5n h LEU 115 N 0.60 0.74 -0.76 0.00 3.38 -1.01 -1.17 115.31 117.10 1s5n h LEU 115 Ca 0.28 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 1s5n h LEU 115 Cb 0.19 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1s5n h LEU 115 CO -0.19 0.67 0.25 0.03 0.09 0.00 0.00 178.44 179.30 1s5n h ARG 116 N 0.76 1.17 -0.49 1.13 2.47 -0.64 -0.25 114.38 118.54 1s5n h ARG 116 Ca 0.19 -0.24 -0.03 0.00 -1.26 0.00 0.00 59.98 58.64 1s5n h ARG 116 Cb 0.14 -0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.26 1s5n h ARG 116 CO -0.02 0.98 0.20 -0.22 0.56 0.00 0.00 179.97 181.47 1s5n h LYS 117 N 1.12 0.72 0.04 0.04 3.64 -0.78 -1.61 116.57 119.74 1s5n h LYS 117 Ca 0.25 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1s5n h LYS 117 Cb 0.29 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1s5n h LYS 117 CO -0.01 0.64 -0.02 1.15 -2.27 0.00 0.00 179.45 178.94 1s5n h THR 118 N 0.64 0.97 -0.70 1.00 2.02 -0.94 -2.86 112.91 113.04 1s5n h THR 118 Ca 0.16 -0.01 0.03 0.00 0.77 0.00 0.00 66.41 67.35 1s5n h THR 118 Cb 0.19 0.98 -0.04 0.00 -1.74 0.00 0.00 68.15 67.53 1s5n h THR 118 CO -0.01 0.00 0.44 0.40 0.37 0.00 0.00 175.52 176.72 1s5n h ILE 119 N -0.06 1.10 -0.80 3.11 2.04 -0.85 0.74 117.51 122.80 1s5n h ILE 119 Ca -0.01 -0.30 0.09 0.00 1.00 0.00 0.00 64.86 65.65 1s5n h ILE 119 Cb 0.05 0.17 -0.07 0.00 -0.74 0.00 0.00 36.82 36.22 1s5n h ILE 119 CO 0.01 0.16 0.45 -0.09 0.00 0.00 0.00 178.15 178.68 1s5n h ARG 120 N 0.86 0.75 0.00 2.37 2.43 -1.24 -2.30 114.38 117.25 1s5n h ARG 120 Ca 0.28 -0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 59.27 1s5n h ARG 120 Cb 0.00 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.36 1s5n h ARG 120 CO -0.10 0.50 -0.60 -0.97 -1.51 0.00 0.00 179.97 177.28 1s5n h ASN 121 N 0.77 0.00 -0.58 -3.80 -1.24 -1.09 -3.01 115.58 106.64 1s5n h ASN 121 Ca 0.38 0.00 0.07 0.00 0.71 0.00 0.00 56.30 57.46 1s5n h ASN 121 Cb 0.34 0.00 -0.06 0.00 0.73 0.00 0.00 38.32 39.33 1s5n h ASN 121 CO -0.24 0.60 0.27 0.40 -1.29 0.00 0.00 177.43 177.18 1s5n h ILE 122 N 0.00 0.89 -0.64 2.57 2.04 -0.38 0.11 117.51 122.10 1s5n h ILE 122 Ca -0.01 -0.17 0.01 0.00 1.00 0.00 0.00 64.86 65.69 1s5n h ILE 122 Cb 1.43 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.82 1s5n h ILE 122 CO 0.08 0.09 0.43 0.44 0.00 0.00 0.00 178.15 179.19 1s5n h ASP 123 N 0.50 0.73 -0.42 1.72 3.32 -1.31 -0.72 116.42 120.25 1s5n h ASP 123 Ca 0.27 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.24 1s5n h ASP 123 Cb 0.24 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 1s5n h ASP 123 CO -0.22 0.53 0.02 0.25 -1.72 0.00 0.00 179.24 178.10 1s5n h LEU 124 N 0.87 0.71 -0.45 1.55 5.85 -1.35 -2.60 115.31 119.89 1s5n h LEU 124 Ca 0.24 -0.30 0.06 0.00 0.84 0.00 0.00 57.88 58.72 1s5n h LEU 124 Cb -0.09 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.69 1s5n h LEU 124 CO -0.06 0.83 0.13 0.00 -0.34 0.00 0.00 178.44 179.01 1s5n h ALA 125 N 0.90 0.53 -0.47 1.25 0.00 -0.37 -1.56 119.26 119.54 1s5n h ALA 125 Ca 0.12 0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.12 1s5n h ALA 125 Cb 0.46 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1s5n h ALA 125 CO 0.02 -0.26 0.28 0.28 0.00 0.00 0.00 179.25 179.57 1s5n h VAL 126 N 0.29 1.06 -1.00 0.00 2.07 -1.08 -0.08 116.25 117.51 1s5n h VAL 126 Ca 0.22 -0.19 0.02 0.00 0.82 0.00 0.00 66.70 67.56 1s5n h VAL 126 Cb 0.24 0.44 -0.05 0.00 -1.52 0.00 0.00 31.29 30.40 1s5n h VAL 126 CO -0.24 0.10 0.66 -0.33 0.02 0.00 0.00 177.57 177.78 1s5n h GLU 127 N 0.56 1.29 0.00 1.57 5.08 -0.99 -1.84 114.58 120.25 1s5n h GLU 127 Ca 0.18 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1s5n h GLU 127 Cb 0.00 -0.29 0.00 0.00 0.50 0.00 0.00 28.75 28.96 1s5n h GLU 127 CO -0.08 0.85 0.00 1.28 -1.00 0.00 0.00 179.01 180.06 1s5n n LEU 128 N -4.40 0.00 0.00 1.33 4.77 -0.65 -4.91 117.00 113.14 1s5n n LEU 128 Ca 0.12 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 1s5n n LEU 128 Cb 0.03 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 40.78 1s5n n LEU 128 CO 0.36 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 1s5n n GLY 129 N 1.09 0.82 3.74 -0.72 0.00 -0.69 -4.31 105.19 105.11 1s5n n GLY 129 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1s5n n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s5n s ALA 130 N -2.00 3.70 -0.97 4.61 0.00 -0.12 -4.67 121.76 122.31 1s5n s ALA 130 Ca 0.00 1.38 0.20 0.00 0.00 0.00 0.00 51.96 53.53 1s5n s ALA 130 Cb 0.00 -3.59 -0.20 0.00 0.00 0.00 0.00 23.12 19.32 1s5n s ALA 130 CO 0.00 -0.79 0.84 1.63 0.00 0.00 0.00 175.76 177.44 1s5n n LYS 131 N 2.94 0.55 -4.65 0.00 4.76 -0.78 -4.57 118.16 116.41 1s5n n LYS 131 Ca 0.10 -0.04 -0.22 0.00 -2.87 0.00 0.00 58.31 55.27 1s5n n LYS 131 Cb 0.39 -1.43 -0.15 0.00 -1.84 0.00 0.00 35.03 32.00 1s5n n LYS 131 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1s5n s THR 132 N -2.83 1.11 -0.25 -0.18 2.01 -1.11 -2.09 115.64 112.29 1s5n s THR 132 Ca 0.08 -0.59 0.03 0.00 0.31 0.00 0.00 61.69 61.51 1s5n s THR 132 Cb 0.15 -0.93 0.06 0.00 0.01 0.00 0.00 72.50 71.78 1s5n s THR 132 CO 0.79 0.32 -0.11 -0.47 -0.69 0.00 0.00 174.62 174.46 1s5n s TYR 133 N -0.26 3.22 0.32 4.92 5.04 0.53 -2.70 117.35 128.41 1s5n s TYR 133 Ca 0.04 -2.24 -0.22 0.00 -2.44 0.00 0.00 57.07 52.21 1s5n s TYR 133 Cb -0.06 -1.94 -0.10 0.00 0.35 0.00 0.00 41.96 40.22 1s5n s TYR 133 CO -0.00 -0.87 0.87 0.08 -1.34 0.00 0.00 175.55 174.29 1s5n s VAL 134 N 1.13 4.38 -0.21 3.14 1.01 -0.42 -1.19 120.40 128.25 1s5n s VAL 134 Ca -0.07 1.54 -0.01 0.00 0.00 0.00 0.00 61.98 63.43 1s5n s VAL 134 Cb -0.19 -3.86 0.06 0.00 0.00 0.00 0.00 36.38 32.39 1s5n s VAL 134 CO -0.06 0.04 -0.01 0.00 0.00 0.00 0.00 175.10 175.08 1s5n s ALA 135 N -1.73 1.44 -0.40 5.51 0.00 -0.20 -4.20 121.76 122.18 1s5n s ALA 135 Ca 0.51 -0.97 -0.06 0.00 0.00 0.00 0.00 51.96 51.43 1s5n s ALA 135 Cb -0.15 -1.27 0.08 0.00 0.00 0.00 0.00 23.12 21.77 1s5n s ALA 135 CO 0.20 -1.14 0.21 -0.46 0.00 0.00 0.00 175.76 174.57 1s5n s TRP 136 N 1.65 3.39 -1.47 0.00 -0.00 -1.26 -1.26 118.94 119.99 1s5n s TRP 136 Ca -0.03 -1.81 -0.10 0.00 -0.00 0.00 0.00 56.10 54.16 1s5n s TRP 136 Cb -0.18 -2.90 0.03 0.00 -0.00 0.00 0.00 33.47 30.42 1s5n s TRP 136 CO -0.07 -0.87 2.46 0.41 -0.00 0.00 0.00 176.95 178.87 1s5n n GLY 137 N 4.79 4.55 0.27 5.86 0.00 -1.26 -4.73 105.19 114.67 1s5n n GLY 137 Ca -0.08 -1.72 0.14 0.00 0.00 0.00 0.00 46.02 44.36 1s5n n GLY 137 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1s5n h GLY 138 N 7.85 0.00 -1.62 -0.02 0.00 -1.92 -2.03 103.07 105.33 1s5n h GLY 138 Ca 0.67 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.00 1s5n h GLY 138 CO 1.74 0.00 0.00 0.54 0.00 0.00 0.00 176.54 178.82 1s5n n ARG 139 N -3.47 2.18 -2.82 4.80 5.12 -1.26 -3.86 116.66 117.34 1s5n n ARG 139 Ca -0.01 -1.74 -0.43 0.00 -1.93 0.00 0.00 57.85 53.74 1s5n n ARG 139 Cb 0.25 -1.47 -0.04 0.00 -1.16 0.00 0.00 32.46 30.04 1s5n n ARG 139 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1s5n s GLU 140 N -1.82 3.76 0.00 5.56 0.41 -0.76 -2.84 118.70 123.01 1s5n s GLU 140 Ca 0.34 0.46 0.00 0.00 -0.41 0.00 0.00 54.97 55.35 1s5n s GLU 140 Cb 0.21 -3.83 0.00 0.00 -1.78 0.00 0.00 34.13 28.72 1s5n s GLU 140 CO 0.31 -1.01 0.00 0.41 -0.49 0.00 0.00 175.26 174.48 1s5n n GLY 141 N 4.53 -0.05 3.50 -1.39 0.00 -1.26 -0.97 105.19 109.54 1s5n n GLY 141 Ca 0.07 -1.02 -0.10 0.00 0.00 0.00 0.00 46.02 44.97 1s5n n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s5n s ALA 142 N -1.00 -1.79 -0.37 4.61 0.00 -0.77 -4.81 121.76 117.63 1s5n s ALA 142 Ca 0.00 1.00 0.18 0.00 0.00 0.00 0.00 51.96 53.14 1s5n s ALA 142 Cb 0.00 0.37 -0.25 0.00 0.00 0.00 0.00 23.12 23.24 1s5n s ALA 142 CO 0.00 -0.65 0.56 0.39 0.00 0.00 0.00 175.76 176.06 1s5n n GLU 143 N -0.12 0.76 -4.03 0.00 4.71 -1.26 -1.45 120.64 119.25 1s5n n GLU 143 Ca -0.11 -0.10 -0.08 0.00 -0.01 0.00 0.00 57.16 56.87 1s5n n GLU 143 Cb 0.62 -1.40 -0.10 0.00 -1.01 0.00 0.00 31.44 29.55 1s5n n GLU 143 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 1s5n s SER 144 N -3.54 0.38 0.16 1.62 1.04 -1.26 -4.94 113.70 107.16 1s5n s SER 144 Ca -0.01 -0.86 -0.03 0.00 0.48 0.00 0.00 55.95 55.53 1s5n s SER 144 Cb 0.13 0.21 0.02 0.00 0.10 0.00 0.00 66.02 66.48 1s5n s SER 144 CO 0.76 -0.58 1.41 1.23 0.98 0.00 0.00 173.24 177.04 1s5n h GLY 145 N 3.28 0.50 0.74 7.32 0.00 -1.96 -3.15 103.07 109.80 1s5n h GLY 145 Ca -0.34 -0.72 0.00 0.00 0.00 0.00 0.00 47.33 46.28 1s5n h GLY 145 CO 0.61 0.64 -0.35 0.00 0.00 0.00 0.00 176.54 177.43 1s5n n ALA 146 N -2.52 3.25 0.21 3.60 0.00 -1.26 -4.10 120.51 119.69 1s5n n ALA 146 Ca -0.05 -0.35 0.06 0.00 0.00 0.00 0.00 53.44 53.09 1s5n n ALA 146 Cb 0.72 -1.16 0.48 0.00 0.00 0.00 0.00 19.45 19.49 1s5n n ALA 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1s5n h ALA 147 N 3.32 1.46 -3.26 0.00 0.00 -1.97 -3.41 119.26 115.39 1s5n h ALA 147 Ca 0.00 -0.23 -0.40 0.00 0.00 0.00 0.00 54.91 54.28 1s5n h ALA 147 Cb 0.49 -0.04 -0.39 0.00 0.00 0.00 0.00 17.79 17.85 1s5n h ALA 147 CO 0.00 0.32 -0.75 0.21 0.00 0.00 0.00 179.25 179.03 1s5n s LYS 148 N -4.33 0.11 -0.55 0.00 2.47 -1.26 -4.98 119.74 111.20 1s5n s LYS 148 Ca -0.03 0.23 -0.25 0.00 -1.56 0.00 0.00 55.97 54.36 1s5n s LYS 148 Cb 0.14 -0.84 0.04 0.00 -1.46 0.00 0.00 37.83 35.72 1s5n s LYS 148 CO 0.69 -0.38 0.98 0.34 0.16 0.00 0.00 175.35 177.14 1s5n s ASP 149 N 2.11 6.37 0.26 1.43 -1.08 -1.26 -4.93 116.67 119.57 1s5n s ASP 149 Ca 0.04 -0.24 0.02 0.00 -0.52 0.00 0.00 52.55 51.85 1s5n s ASP 149 Cb -0.13 -2.46 0.33 0.00 -1.46 0.00 0.00 42.92 39.20 1s5n s ASP 149 CO -0.04 -1.26 1.65 0.58 0.52 0.00 0.00 175.17 176.62 1s5n h VAL 150 N 6.05 1.30 -0.57 1.11 2.07 -1.98 0.96 116.25 125.19 1s5n h VAL 150 Ca -0.26 -1.49 0.00 0.00 0.82 0.00 0.00 66.70 65.78 1s5n h VAL 150 Cb 1.07 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 32.35 1s5n h VAL 150 CO 1.10 0.46 0.37 0.03 0.02 0.00 0.00 177.57 179.55 1s5n h ARG 151 N 0.38 0.76 -0.38 1.57 3.08 -1.99 0.65 114.38 118.45 1s5n h ARG 151 Ca 0.04 -0.05 -0.16 0.00 0.07 0.00 0.00 59.98 59.88 1s5n h ARG 151 Cb 0.82 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 1s5n h ARG 151 CO 0.07 0.51 -0.37 0.28 -1.07 0.00 0.00 179.97 179.39 1s5n h VAL 152 N 0.77 1.27 -0.86 2.04 2.07 -1.87 -1.66 116.25 118.02 1s5n h VAL 152 Ca 0.21 -1.55 0.02 0.00 0.82 0.00 0.00 66.70 66.20 1s5n h VAL 152 Cb -0.07 1.38 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 1s5n h VAL 152 CO -0.04 0.52 0.56 0.00 0.02 0.00 0.00 177.57 178.63 1s5n h ALA 153 N 0.82 1.12 -0.44 1.67 0.00 -0.51 -0.81 119.26 121.11 1s5n h ALA 153 Ca 0.06 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1s5n h ALA 153 Cb 0.96 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1s5n h ALA 153 CO 0.09 0.44 0.01 -0.07 0.00 0.00 0.00 179.25 179.72 1s5n h LEU 154 N 1.12 0.67 -0.39 0.00 3.38 -0.63 0.19 115.31 119.65 1s5n h LEU 154 Ca 0.33 -0.15 0.05 0.00 0.09 0.00 0.00 57.88 58.20 1s5n h LEU 154 Cb -0.06 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.47 1s5n h LEU 154 CO -0.09 0.73 0.14 0.44 0.09 0.00 0.00 178.44 179.75 1s5n h ASP 155 N 0.67 0.15 -0.51 -0.43 3.32 -0.48 0.31 116.42 119.46 1s5n h ASP 155 Ca 0.14 0.04 -0.08 0.00 0.02 0.00 0.00 57.03 57.15 1s5n h ASP 155 Cb 0.40 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 1s5n h ASP 155 CO 0.01 0.12 0.02 0.03 -1.72 0.00 0.00 179.24 177.71 1s5n h ARG 156 N 0.30 0.93 -0.11 3.56 2.47 -0.49 -0.59 114.38 120.45 1s5n h ARG 156 Ca 0.18 -0.26 -0.00 0.00 -1.26 0.00 0.00 59.98 58.63 1s5n h ARG 156 Cb 0.16 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 28.37 1s5n h ARG 156 CO -0.18 0.91 0.05 1.98 0.56 0.00 0.00 179.97 183.29 1s5n h MET 157 N 0.86 0.16 -0.54 0.04 4.05 -0.28 -1.28 114.93 117.95 1s5n h MET 157 Ca 0.16 -0.03 0.04 0.00 -0.28 0.00 0.00 59.70 59.60 1s5n h MET 157 Cb 0.48 -0.03 -0.04 0.00 -0.80 0.00 0.00 31.60 31.21 1s5n h MET 157 CO 0.02 0.24 0.29 -0.22 0.23 0.00 0.00 176.91 177.47 1s5n h LYS 158 N 0.05 0.56 -0.51 0.39 3.64 -0.86 -1.01 116.57 118.82 1s5n h LYS 158 Ca 0.04 -0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.44 1s5n h LYS 158 Cb 0.13 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 31.77 1s5n h LYS 158 CO -0.00 0.37 0.22 1.49 -2.27 0.00 0.00 179.45 179.26 1s5n h GLU 159 N 0.57 0.42 0.18 1.90 4.81 -0.86 0.11 114.58 121.71 1s5n h GLU 159 Ca 0.23 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.43 1s5n h GLU 159 Cb 0.11 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.39 1s5n h GLU 159 CO -0.14 0.28 -0.09 0.00 -0.73 0.00 0.00 179.01 178.33 1s5n h ALA 160 N 1.31 -0.24 -0.34 2.92 0.00 -0.89 -0.90 119.26 121.11 1s5n h ALA 160 Ca 0.24 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1s5n h ALA 160 Cb 0.21 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1s5n h ALA 160 CO -0.21 -0.53 -0.05 0.74 0.00 0.00 0.00 179.25 179.20 1s5n h PHE 161 N -0.44 0.59 -0.52 0.00 0.04 -0.98 -1.29 116.94 114.34 1s5n h PHE 161 Ca -0.02 -0.07 -0.04 0.00 2.80 0.00 0.00 57.97 60.63 1s5n h PHE 161 Cb 0.34 -0.16 -0.02 0.00 2.20 0.00 0.00 35.95 38.31 1s5n h PHE 161 CO -0.01 0.60 0.15 -0.44 -0.60 0.00 0.00 178.31 178.02 1s5n h ASP 162 N 0.53 0.77 -0.61 2.17 3.32 -0.66 -0.93 116.42 121.01 1s5n h ASP 162 Ca 0.11 -0.22 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 1s5n h ASP 162 Cb 0.41 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.73 1s5n h ASP 162 CO 0.02 0.78 0.27 0.25 -1.72 0.00 0.00 179.24 178.84 1s5n h LEU 163 N 0.71 0.81 -1.14 1.55 6.46 -0.74 -0.25 115.31 122.72 1s5n h LEU 163 Ca 0.17 -0.15 0.07 0.00 -0.12 0.00 0.00 57.88 57.85 1s5n h LEU 163 Cb 0.30 -0.21 -0.06 0.00 -0.73 0.00 0.00 40.66 39.96 1s5n h LEU 163 CO -0.00 0.73 0.59 -0.07 -0.62 0.00 0.00 178.44 179.07 1s5n h LEU 164 N 0.83 0.90 -0.64 2.25 3.38 -0.96 0.11 115.31 121.18 1s5n h LEU 164 Ca 0.21 0.01 -0.11 0.00 0.09 0.00 0.00 57.88 58.08 1s5n h LEU 164 Cb 0.15 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1s5n h LEU 164 CO -0.02 0.56 -0.11 1.23 0.09 0.00 0.00 178.44 180.19 1s5n h GLY 165 N 1.01 1.03 1.01 0.83 0.00 -0.65 -0.77 103.07 105.54 1s5n h GLY 165 Ca 0.40 -0.81 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 1s5n h GLY 165 CO -0.16 0.74 0.38 -2.09 0.00 0.00 0.00 176.54 175.42 1s5n h GLU 166 N 0.85 1.04 0.29 4.80 4.57 0.12 -1.45 114.58 124.81 1s5n h GLU 166 Ca 0.14 -0.14 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1s5n h GLU 166 Cb 0.65 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.04 1s5n h GLU 166 CO 0.04 0.79 -0.14 -0.92 -1.18 0.00 0.00 179.01 177.61 1s5n h TYR 167 N 1.02 -0.36 -0.41 0.92 3.20 -0.53 0.22 116.97 121.03 1s5n h TYR 167 Ca 0.26 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.20 1s5n h TYR 167 Cb 0.07 0.12 -0.08 0.00 1.54 0.00 0.00 36.73 38.38 1s5n h TYR 167 CO 0.00 -0.17 -0.10 0.28 -1.64 0.00 0.00 178.16 176.54 1s5n h VAL 168 N -0.47 0.60 -0.11 1.81 2.07 -1.08 -1.58 116.25 117.50 1s5n h VAL 168 Ca -0.04 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.48 1s5n h VAL 168 Cb 0.35 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 1s5n h VAL 168 CO 0.07 0.00 0.07 0.74 0.02 0.00 0.00 177.57 178.47 1s5n h THR 169 N 0.01 1.03 0.00 2.57 2.02 -1.14 -1.67 112.91 115.74 1s5n h THR 169 Ca 0.20 -0.06 -0.04 0.00 0.77 0.00 0.00 66.41 67.27 1s5n h THR 169 Cb 0.30 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 1s5n h THR 169 CO -0.42 0.03 -0.19 0.77 0.37 0.00 0.00 175.52 176.08 1s5n h SER 170 N 0.14 0.00 0.84 4.18 4.64 -0.47 -1.51 113.55 121.37 1s5n h SER 170 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1s5n h SER 170 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1s5n h SER 170 CO -0.01 0.19 -0.38 0.00 -0.87 0.00 0.00 176.83 175.76 1s5n n GLN 171 N -3.90 0.13 -1.13 4.77 1.13 -0.64 -4.94 117.38 112.80 1s5n n GLN 171 Ca -0.02 0.06 -0.05 0.00 -1.94 0.00 0.00 57.00 55.05 1s5n n GLN 171 Cb 0.28 -1.60 -0.02 0.00 0.11 0.00 0.00 30.24 29.01 1s5n n GLN 171 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1s5n n GLY 172 N 1.42 0.73 3.76 1.08 0.00 -0.57 -4.98 105.19 106.62 1s5n n GLY 172 Ca 0.05 -0.62 -0.40 0.00 0.00 0.00 0.00 46.02 45.05 1s5n n GLY 172 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1s5n s TYR 173 N -2.11 3.59 -0.83 1.61 2.02 -0.82 -4.96 117.35 115.84 1s5n s TYR 173 Ca 0.00 1.71 -0.10 0.00 -0.37 0.00 0.00 57.07 58.31 1s5n s TYR 173 Cb 0.00 -3.25 0.22 0.00 -0.40 0.00 0.00 41.96 38.52 1s5n s TYR 173 CO 0.00 -0.49 0.75 -0.51 -1.57 0.00 0.00 175.55 173.73 1s5n s ASP 174 N -0.94 6.45 0.02 2.29 -0.00 -1.26 -4.80 116.67 118.43 1s5n s ASP 174 Ca 0.45 -2.94 -0.06 0.00 -0.00 0.00 0.00 52.55 49.99 1s5n s ASP 174 Cb -0.31 -2.11 -0.00 0.00 -0.00 0.00 0.00 42.92 40.50 1s5n s ASP 174 CO 0.40 -0.46 0.12 -0.51 -0.00 0.00 0.00 175.17 174.72 1s5n s ILE 175 N -0.22 0.11 0.21 0.77 2.07 -1.26 -4.68 121.20 118.20 1s5n s ILE 175 Ca 0.20 -0.90 0.01 0.00 -1.41 0.00 0.00 60.65 58.55 1s5n s ILE 175 Cb -0.12 -0.69 -0.05 0.00 0.13 0.00 0.00 42.46 41.74 1s5n s ILE 175 CO -0.08 -0.50 0.07 0.00 -1.91 0.00 0.00 174.94 172.52 1s5n s ARG 176 N -2.07 1.25 0.04 3.50 1.70 -0.89 -5.00 118.95 117.49 1s5n s ARG 176 Ca -0.09 -1.65 0.01 0.00 -0.47 0.00 0.00 55.73 53.53 1s5n s ARG 176 Cb -0.04 -0.17 -0.04 0.00 -0.57 0.00 0.00 34.95 34.13 1s5n s ARG 176 CO -0.02 -0.25 0.10 -0.06 -1.08 0.00 0.00 175.30 174.00 1s5n s PHE 177 N -3.79 3.29 -0.18 5.89 0.08 0.02 -0.35 117.98 122.93 1s5n s PHE 177 Ca 0.32 0.16 -0.02 0.00 0.12 0.00 0.00 56.93 57.52 1s5n s PHE 177 Cb 0.07 -1.69 0.05 0.00 -0.57 0.00 0.00 43.02 40.88 1s5n s PHE 177 CO 0.09 0.55 0.00 0.00 -0.10 0.00 0.00 175.22 175.76 1s5n s ALA 178 N -1.34 1.22 -0.06 5.36 0.00 -0.33 -0.76 121.76 125.86 1s5n s ALA 178 Ca 0.28 -0.78 -0.25 0.00 0.00 0.00 0.00 51.96 51.21 1s5n s ALA 178 Cb -0.12 -1.17 -0.03 0.00 0.00 0.00 0.00 23.12 21.79 1s5n s ALA 178 CO 0.20 -1.03 0.76 0.42 0.00 0.00 0.00 175.76 176.11 1s5n s ILE 179 N 1.75 5.01 -0.38 0.00 1.01 0.08 -1.03 121.20 127.64 1s5n s ILE 179 Ca -0.01 1.58 -0.12 0.00 0.00 0.00 0.00 60.65 62.10 1s5n s ILE 179 Cb -0.17 -4.10 0.03 0.00 0.01 0.00 0.00 42.46 38.23 1s5n s ILE 179 CO -0.07 0.23 0.22 -0.70 0.00 0.00 0.00 174.94 174.61 1s5n s GLU 180 N 0.89 2.85 0.61 2.79 2.12 -0.39 -1.10 118.70 126.47 1s5n s GLU 180 Ca 0.41 -1.07 -0.13 0.00 0.36 0.00 0.00 54.97 54.53 1s5n s GLU 180 Cb -0.18 -3.77 -0.03 0.00 0.26 0.00 0.00 34.13 30.41 1s5n s GLU 180 CO 0.20 -0.71 1.03 -1.25 -0.54 0.00 0.00 175.26 174.00 1s5n s PRO 181 N 1.57 3.43 -0.24 4.30 0.04 -1.26 -4.38 135.00 138.46 1s5n s PRO 181 Ca 0.02 0.97 -0.24 0.00 0.04 0.00 0.00 61.00 61.79 1s5n s PRO 181 Cb -0.19 -2.06 0.07 0.00 0.04 0.00 0.00 34.50 32.36 1s5n s PRO 181 CO 0.07 -0.71 0.68 0.21 0.04 0.00 0.00 177.00 177.30 1s5n s LYS 182 N -4.61 0.82 0.12 4.56 2.20 -1.20 -4.71 119.74 116.92 1s5n s LYS 182 Ca 0.59 0.88 0.00 0.00 -0.36 0.00 0.00 55.97 57.08 1s5n s LYS 182 Cb -0.13 0.40 -0.17 0.00 -1.51 0.00 0.00 37.83 36.42 1s5n s LYS 182 CO 0.45 -0.12 1.25 -1.00 -0.36 0.00 0.00 175.35 175.57 1s5n h PRO 183 N 4.85 0.20 -2.53 4.03 0.13 -1.67 -3.38 132.00 133.64 1s5n h PRO 183 Ca -0.29 -0.29 0.13 0.00 -0.87 0.00 0.00 66.00 64.69 1s5n h PRO 183 Cb 1.16 0.10 -0.09 0.00 0.13 0.00 0.00 31.00 32.30 1s5n h PRO 183 CO 0.10 1.08 0.41 0.54 -0.23 0.00 0.00 178.00 179.91 1s5n s ASN 184 N -6.98 -0.25 0.00 1.44 4.22 -1.26 -1.58 114.94 110.53 1s5n s ASN 184 Ca -0.03 -0.37 0.00 0.00 -2.14 0.00 0.00 52.86 50.32 1s5n s ASN 184 Cb 0.09 0.54 0.00 0.00 1.28 0.00 0.00 41.25 43.15 1s5n s ASN 184 CO 0.85 -0.97 0.00 1.21 -2.04 0.00 0.00 177.10 176.15 1s5n n GLU 185 N -0.43 0.00 0.00 3.55 2.13 -1.26 -4.84 120.64 119.79 1s5n n GLU 185 Ca -0.07 0.48 0.12 0.00 0.66 0.00 0.00 57.16 58.36 1s5n n GLU 185 Cb 0.61 -0.82 0.22 0.00 0.27 0.00 0.00 31.44 31.71 1s5n n GLU 185 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 1s5n n PRO 186 N 0.05 0.69 -3.01 5.31 -0.04 -1.25 -5.02 135.00 131.74 1s5n n PRO 186 Ca 0.00 -0.47 -0.29 0.00 -0.04 0.00 0.00 63.50 62.69 1s5n n PRO 186 Cb 0.00 -1.49 -0.03 0.00 -0.04 0.00 0.00 33.50 31.94 1s5n n PRO 186 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1s5n s ARG 187 N -2.63 3.71 0.23 0.54 1.81 -1.25 -5.00 118.95 116.36 1s5n s ARG 187 Ca 0.19 0.29 -0.07 0.00 -1.72 0.00 0.00 55.73 54.42 1s5n s ARG 187 Cb 0.18 -2.48 0.30 0.00 -0.45 0.00 0.00 34.95 32.51 1s5n s ARG 187 CO 0.60 0.04 1.82 0.78 -0.68 0.00 0.00 175.30 177.86 1s5n h GLY 188 N 1.33 1.15 -5.77 -3.53 0.00 -1.85 -3.39 103.07 90.99 1s5n h GLY 188 Ca -0.47 -0.32 -0.34 0.00 0.00 0.00 0.00 47.33 46.20 1s5n h GLY 188 CO 0.64 0.19 -0.75 0.99 0.00 0.00 0.00 176.54 177.61 1s5n s ASP 189 N -5.66 0.58 -0.08 0.19 1.01 -0.53 -4.68 116.67 107.50 1s5n s ASP 189 Ca -0.13 -0.08 -0.05 0.00 0.71 0.00 0.00 52.55 53.00 1s5n s ASP 189 Cb 0.17 -0.17 -0.04 0.00 1.01 0.00 0.00 42.92 43.90 1s5n s ASP 189 CO 0.77 0.00 0.15 -0.63 0.21 0.00 0.00 175.17 175.68 1s5n s ILE 190 N 0.34 5.45 0.41 0.77 1.01 -0.61 -1.84 121.20 126.72 1s5n s ILE 190 Ca -0.04 0.05 -0.24 0.00 0.00 0.00 0.00 60.65 60.42 1s5n s ILE 190 Cb -0.07 -3.44 -0.08 0.00 0.01 0.00 0.00 42.46 38.88 1s5n s ILE 190 CO -0.00 0.50 1.13 -0.76 0.00 0.00 0.00 174.94 175.81 1s5n s LEU 191 N -1.38 4.13 -0.90 2.97 1.43 -0.14 -3.64 118.68 121.15 1s5n s LEU 191 Ca 0.20 2.23 -0.04 0.00 -1.03 0.00 0.00 54.13 55.49 1s5n s LEU 191 Cb -0.12 -4.13 -0.04 0.00 0.03 0.00 0.00 46.19 41.92 1s5n s LEU 191 CO 0.10 -0.67 0.80 0.18 0.23 0.00 0.00 176.35 176.99 1s5n n LEU 192 N -0.10 -5.81 0.13 1.79 4.77 -1.26 -4.76 117.00 111.76 1s5n n LEU 192 Ca 0.05 -0.48 0.13 0.00 -0.03 0.00 0.00 56.01 55.68 1s5n n LEU 192 Cb 0.48 -3.11 0.43 0.00 -2.33 0.00 0.00 43.42 38.89 1s5n n LEU 192 CO 0.48 -0.28 0.88 1.55 -1.33 0.00 0.00 177.39 178.69 1s5n h PRO 193 N -0.55 0.00 -4.52 3.23 0.13 -1.73 -3.17 132.00 125.39 1s5n h PRO 193 Ca -0.39 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.51 1s5n h PRO 193 Cb 1.20 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.18 1s5n h PRO 193 CO 0.37 0.00 -0.59 0.95 -0.23 0.00 0.00 178.00 178.50 1s5n s THR 194 N -3.20 0.01 0.23 1.56 -4.23 -1.26 -2.23 115.64 106.51 1s5n s THR 194 Ca 0.08 -1.96 -0.07 0.00 -1.18 0.00 0.00 61.69 58.56 1s5n s THR 194 Cb 0.11 -2.45 0.20 0.00 1.34 0.00 0.00 72.50 71.70 1s5n s THR 194 CO 0.54 -0.03 1.70 0.58 -0.54 0.00 0.00 174.62 176.87 1s5n h VAL 195 N 2.61 0.58 -0.33 2.29 2.07 -1.91 -1.75 116.25 119.81 1s5n h VAL 195 Ca -0.35 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.07 1s5n h VAL 195 Cb 1.25 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1s5n h VAL 195 CO 0.52 0.05 0.22 1.23 0.02 0.00 0.00 177.57 179.61 1s5n h GLY 196 N 0.29 0.46 1.00 2.17 0.00 -1.96 -0.27 103.07 104.76 1s5n h GLY 196 Ca 0.38 -0.17 0.01 0.00 0.00 0.00 0.00 47.33 47.54 1s5n h GLY 196 CO -0.46 0.17 0.63 0.45 0.00 0.00 0.00 176.54 177.34 1s5n h HIS 197 N 0.45 1.20 -0.30 5.60 -0.00 -1.72 -0.36 115.15 120.01 1s5n h HIS 197 Ca 0.12 0.03 -0.04 0.00 -0.00 0.00 0.00 60.37 60.48 1s5n h HIS 197 Cb -0.05 -0.41 -0.01 0.00 -0.00 0.00 0.00 27.41 26.94 1s5n h HIS 197 CO -0.05 0.75 0.02 0.00 -0.00 0.00 0.00 177.93 178.65 1s5n h ALA 198 N 1.35 0.40 -0.81 2.45 0.00 -1.10 -1.49 119.26 120.06 1s5n h ALA 198 Ca 0.35 -0.22 0.07 0.00 0.00 0.00 0.00 54.91 55.12 1s5n h ALA 198 Cb -0.14 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.47 1s5n h ALA 198 CO -0.08 0.13 0.49 -0.07 0.00 0.00 0.00 179.25 179.72 1s5n h LEU 199 N 0.32 0.74 -0.45 0.00 3.38 -0.76 -1.72 115.31 116.83 1s5n h LEU 199 Ca 0.09 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 58.01 1s5n h LEU 199 Cb 0.40 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1s5n h LEU 199 CO 0.01 0.45 -0.01 0.00 0.09 0.00 0.00 178.44 178.98 1s5n h ALA 200 N 1.41 0.61 -0.78 1.53 0.00 -0.91 -3.03 119.26 118.09 1s5n h ALA 200 Ca 0.37 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1s5n h ALA 200 Cb 0.24 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1s5n h ALA 200 CO -0.20 0.41 0.50 0.35 0.00 0.00 0.00 179.25 180.31 1s5n h PHE 201 N 0.64 1.00 -0.57 0.00 3.57 -0.94 -2.56 116.94 118.07 1s5n h PHE 201 Ca 0.13 0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.72 1s5n h PHE 201 Cb 0.52 -0.33 -0.03 0.00 2.79 0.00 0.00 35.95 38.89 1s5n h PHE 201 CO 0.04 0.64 0.38 0.82 -2.23 0.00 0.00 178.31 177.97 1s5n h ILE 202 N 1.06 0.93 0.00 1.41 2.04 -1.20 -0.98 117.51 120.78 1s5n h ILE 202 Ca 0.28 -0.15 -0.01 0.00 1.00 0.00 0.00 64.86 65.98 1s5n h ILE 202 Cb -0.09 0.45 -0.00 0.00 -0.74 0.00 0.00 36.82 36.43 1s5n h ILE 202 CO -0.06 0.08 -0.03 -0.33 0.00 0.00 0.00 178.15 177.81 1s5n h GLU 203 N 0.45 0.00 -0.05 2.37 4.39 -1.42 -1.67 114.58 118.65 1s5n h GLU 203 Ca 0.26 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.96 1s5n h GLU 203 Cb 0.44 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 1s5n h GLU 203 CO -0.07 0.03 0.00 0.54 -1.16 0.00 0.00 179.01 178.35 1s5n n ARG 204 N -3.21 1.87 -1.79 2.33 5.12 -0.37 -4.93 116.66 115.68 1s5n n ARG 204 Ca -0.01 -1.26 -0.32 0.00 -1.93 0.00 0.00 57.85 54.33 1s5n n ARG 204 Cb 0.22 -1.47 0.03 0.00 -1.16 0.00 0.00 32.46 30.08 1s5n n ARG 204 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1s5n s LEU 205 N -1.94 3.28 0.31 0.55 1.43 -0.63 -4.96 118.68 116.72 1s5n s LEU 205 Ca 0.35 1.65 0.06 0.00 -1.03 0.00 0.00 54.13 55.16 1s5n s LEU 205 Cb 0.20 -4.50 0.52 0.00 0.03 0.00 0.00 46.19 42.44 1s5n s LEU 205 CO 0.32 -1.25 1.76 -0.08 0.23 0.00 0.00 176.35 177.33 1s5n h GLU 206 N -0.24 0.29 -2.19 1.70 4.57 -1.91 -3.33 114.58 113.46 1s5n h GLU 206 Ca -0.45 -0.11 -0.59 0.00 -1.18 0.00 0.00 59.36 57.03 1s5n h GLU 206 Cb 1.21 -0.02 -0.41 0.00 -0.16 0.00 0.00 28.75 29.37 1s5n h GLU 206 CO 0.58 0.58 -0.75 0.54 -1.18 0.00 0.00 179.01 178.78 1s5n n ARG 207 N -4.10 1.93 0.27 1.92 1.74 -1.26 -4.97 116.66 112.18 1s5n n ARG 207 Ca -0.01 -4.22 0.16 0.00 -0.77 0.00 0.00 57.85 53.01 1s5n n ARG 207 Cb 0.41 -1.95 0.90 0.00 -1.02 0.00 0.00 32.46 30.80 1s5n n ARG 207 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 1s5n h PRO 208 N 4.22 0.00 0.00 5.56 0.11 -1.80 -1.50 132.00 138.59 1s5n h PRO 208 Ca 0.16 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.27 1s5n h PRO 208 Cb 0.73 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.84 1s5n h PRO 208 CO 0.71 0.00 -0.01 1.05 -0.21 0.00 0.00 178.00 179.55 1s5n h GLU 209 N 0.00 0.00 -0.00 1.05 9.09 -1.93 -2.06 114.58 120.73 1s5n h GLU 209 Ca 0.03 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.44 1s5n h GLU 209 Cb 0.21 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.31 1s5n h GLU 209 CO -0.00 0.01 -0.05 1.28 0.05 0.00 0.00 179.01 180.30 1s5n n LEU 210 N -3.26 0.45 -4.05 3.06 4.77 -0.56 -4.86 117.00 112.55 1s5n n LEU 210 Ca -0.03 -0.05 -0.22 0.00 -0.03 0.00 0.00 56.01 55.69 1s5n n LEU 210 Cb 0.10 -0.11 -0.15 0.00 -2.33 0.00 0.00 43.42 40.92 1s5n n LEU 210 CO 0.22 0.08 -0.46 -0.31 -1.33 0.00 0.00 177.39 175.60 1s5n s TYR 211 N -2.26 1.15 0.00 -1.77 1.51 -0.77 -0.80 117.35 114.40 1s5n s TYR 211 Ca 0.36 -0.28 0.00 0.00 -1.01 0.00 0.00 57.07 56.14 1s5n s TYR 211 Cb 0.21 -0.78 0.00 0.00 -0.11 0.00 0.00 41.96 41.27 1s5n s TYR 211 CO 0.42 -0.09 0.00 0.41 -1.11 0.00 0.00 175.55 175.18 1s5n n GLY 212 N 3.12 4.87 3.68 0.71 0.00 0.06 -4.98 105.19 112.65 1s5n n GLY 212 Ca -0.17 -1.62 -0.27 0.00 0.00 0.00 0.00 46.02 43.96 1s5n n GLY 212 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1s5n s VAL 213 N -1.24 3.84 -0.68 1.61 -7.23 -0.25 -0.74 120.40 115.72 1s5n s VAL 213 Ca 0.00 -1.31 0.05 0.00 -1.81 0.00 0.00 61.98 58.91 1s5n s VAL 213 Cb 0.00 -2.92 0.19 0.00 0.56 0.00 0.00 36.38 34.22 1s5n s VAL 213 CO 0.00 -0.07 0.57 -3.20 -0.31 0.00 0.00 175.10 172.10 1s5n n ASN 214 N -0.01 3.17 -4.79 4.85 5.15 -0.25 -2.85 115.26 120.54 1s5n n ASN 214 Ca -0.10 -3.27 -0.34 0.00 -0.60 0.00 0.00 54.58 50.27 1s5n n ASN 214 Cb 0.54 -0.73 -0.01 0.00 -0.53 0.00 0.00 39.78 39.05 1s5n n ASN 214 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 1s5n s PRO 215 N -1.76 3.53 -0.08 1.20 0.02 -1.26 -4.34 135.00 132.32 1s5n s PRO 215 Ca 0.30 1.48 0.05 0.00 0.02 0.00 0.00 61.00 62.85 1s5n s PRO 215 Cb 0.02 -2.04 -0.01 0.00 0.02 0.00 0.00 34.50 32.49 1s5n s PRO 215 CO -0.12 -0.68 -0.24 -2.00 -0.33 0.00 0.00 177.00 173.63 1s5n s GLU 216 N -3.32 2.71 0.15 5.54 2.12 -1.26 -0.84 118.70 123.81 1s5n s GLU 216 Ca 0.70 -0.87 -0.28 0.00 0.36 0.00 0.00 54.97 54.87 1s5n s GLU 216 Cb -0.20 -2.18 -0.02 0.00 0.26 0.00 0.00 34.13 31.99 1s5n s GLU 216 CO 0.25 0.28 1.56 0.28 -0.54 0.00 0.00 175.26 177.09 1s5n h VAL 217 N 5.37 0.07 -0.10 3.70 2.07 -1.69 -1.49 116.25 124.18 1s5n h VAL 217 Ca -0.26 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.20 1s5n h VAL 217 Cb 1.20 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 1s5n h VAL 217 CO 0.47 0.00 -0.22 1.23 0.02 0.00 0.00 177.57 179.07 1s5n h GLY 218 N -0.31 0.18 0.85 2.17 0.00 -1.86 -2.78 103.07 101.31 1s5n h GLY 218 Ca 0.13 -0.12 -0.00 0.00 0.00 0.00 0.00 47.33 47.34 1s5n h GLY 218 CO -0.63 0.11 0.02 0.45 0.00 0.00 0.00 176.54 176.50 1s5n h HIS 219 N 0.15 0.09 -0.28 5.60 3.86 -1.63 -0.47 115.15 122.47 1s5n h HIS 219 Ca 0.03 -0.01 -0.06 0.00 -1.16 0.00 0.00 60.37 59.17 1s5n h HIS 219 Cb 0.48 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.91 1s5n h HIS 219 CO 0.01 0.22 -0.08 0.93 0.86 0.00 0.00 177.93 179.87 1s5n h GLU 220 N -0.07 0.44 0.00 2.45 4.39 -1.41 -1.85 114.58 118.53 1s5n h GLU 220 Ca 0.02 -0.11 -0.01 0.00 0.34 0.00 0.00 59.36 59.60 1s5n h GLU 220 Cb 0.17 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 28.76 1s5n h GLU 220 CO -0.00 0.53 -0.06 1.96 -1.16 0.00 0.00 179.01 180.28 1s5n h GLN 221 N 0.42 0.00 0.00 2.33 4.20 -1.20 -1.66 115.11 119.20 1s5n h GLN 221 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1s5n h GLN 221 Cb 0.40 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.18 1s5n h GLN 221 CO 0.02 0.06 0.00 -1.33 -0.67 0.00 0.00 178.83 176.91 1s5n n MET 222 N -3.21 0.06 -0.23 1.46 2.81 -0.21 -1.12 117.12 116.67 1s5n n MET 222 Ca -0.00 0.32 0.08 0.00 -1.81 0.00 0.00 57.70 56.29 1s5n n MET 222 Cb 0.31 -1.62 0.21 0.00 -0.71 0.00 0.00 33.22 31.41 1s5n n MET 222 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1s5n n ALA 223 N -1.59 2.27 -1.32 3.04 0.00 -0.69 -4.73 120.51 117.49 1s5n n ALA 223 Ca 0.03 -1.16 -0.11 0.00 0.00 0.00 0.00 53.44 52.20 1s5n n ALA 223 Cb 0.18 -0.62 -0.05 0.00 0.00 0.00 0.00 19.45 18.96 1s5n n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s5n n GLY 224 N 0.96 1.19 3.93 0.00 0.00 -0.27 -5.00 105.19 105.99 1s5n n GLY 224 Ca 0.16 -0.38 -0.26 0.00 0.00 0.00 0.00 46.02 45.55 1s5n n GLY 224 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s5n s LEU 225 N -2.47 3.34 -0.49 0.99 1.43 -0.79 -4.98 118.68 115.71 1s5n s LEU 225 Ca 0.00 0.60 -0.24 0.00 -1.03 0.00 0.00 54.13 53.47 1s5n s LEU 225 Cb 0.00 -3.45 0.03 0.00 0.03 0.00 0.00 46.19 42.81 1s5n s LEU 225 CO 0.00 -0.97 0.86 0.21 0.23 0.00 0.00 176.35 176.68 1s5n s ASN 226 N -4.28 6.39 0.07 2.29 3.84 -1.26 -4.32 114.94 117.67 1s5n s ASN 226 Ca 0.52 -0.21 -0.22 0.00 0.21 0.00 0.00 52.86 53.17 1s5n s ASN 226 Cb -0.10 -2.41 -0.12 0.00 -0.55 0.00 0.00 41.25 38.06 1s5n s ASN 226 CO 0.43 -1.05 1.57 0.15 -2.79 0.00 0.00 177.10 175.41 1s5n h PHE 227 N 9.12 0.20 -0.96 0.43 3.57 -1.92 -1.86 116.94 125.52 1s5n h PHE 227 Ca -0.25 -0.02 0.17 0.00 3.53 0.00 0.00 57.97 61.39 1s5n h PHE 227 Cb 1.08 -0.06 -0.10 0.00 2.79 0.00 0.00 35.95 39.66 1s5n h PHE 227 CO 0.85 0.33 0.57 -1.35 -2.23 0.00 0.00 178.31 176.48 1s5n h PRO 228 N 0.00 0.74 -0.58 6.41 0.11 -1.92 -0.09 132.00 136.68 1s5n h PRO 228 Ca 0.04 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.07 1s5n h PRO 228 Cb 0.23 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 31.15 1s5n h PRO 228 CO -0.00 0.49 0.22 0.45 -0.21 0.00 0.00 178.00 178.95 1s5n h HIS 229 N 0.76 0.88 -0.66 0.65 3.86 -1.87 0.09 115.15 118.86 1s5n h HIS 229 Ca 0.54 -0.07 -0.06 0.00 -1.16 0.00 0.00 60.37 59.61 1s5n h HIS 229 Cb 0.77 -0.26 -0.03 0.00 1.06 0.00 0.00 27.41 28.95 1s5n h HIS 229 CO -0.03 0.72 0.16 0.78 0.86 0.00 0.00 177.93 180.42 1s5n h GLY 230 N 0.80 1.13 1.04 2.45 0.00 -0.49 -1.23 103.07 106.77 1s5n h GLY 230 Ca 0.19 -0.69 -0.03 0.00 0.00 0.00 0.00 47.33 46.80 1s5n h GLY 230 CO -0.01 0.64 0.39 -2.22 0.00 0.00 0.00 176.54 175.34 1s5n h ILE 231 N 1.00 1.26 -0.79 2.60 1.08 -0.87 -1.02 117.51 120.78 1s5n h ILE 231 Ca 0.21 -0.74 0.02 0.00 -0.39 0.00 0.00 64.86 63.96 1s5n h ILE 231 Cb 0.35 0.20 -0.04 0.00 -3.07 0.00 0.00 36.82 34.26 1s5n h ILE 231 CO 0.00 0.32 0.51 0.00 -0.69 0.00 0.00 178.15 178.29 1s5n h ALA 232 N 1.21 1.02 -0.64 1.87 0.00 -0.46 0.11 119.26 122.37 1s5n h ALA 232 Ca 0.29 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 1s5n h ALA 232 Cb 0.13 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1s5n h ALA 232 CO -0.03 0.36 0.08 0.37 0.00 0.00 0.00 179.25 180.03 1s5n h GLN 233 N 1.02 1.08 -0.56 0.00 4.15 -0.80 0.59 115.11 120.59 1s5n h GLN 233 Ca 0.30 -0.30 -0.02 0.00 0.77 0.00 0.00 58.65 59.40 1s5n h GLN 233 Cb -0.05 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.49 1s5n h GLN 233 CO -0.09 1.01 0.28 0.00 -1.93 0.00 0.00 178.83 178.10 1s5n h ALA 234 N 1.03 0.72 -0.61 3.38 0.00 -0.69 -1.46 119.26 121.62 1s5n h ALA 234 Ca 0.19 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1s5n h ALA 234 Cb 0.47 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1s5n h ALA 234 CO 0.02 0.27 0.28 -0.07 0.00 0.00 0.00 179.25 179.75 1s5n h LEU 235 N 0.76 0.81 -1.30 0.00 3.38 -0.57 -0.42 115.31 117.98 1s5n h LEU 235 Ca 0.19 -0.14 0.06 0.00 0.09 0.00 0.00 57.88 58.08 1s5n h LEU 235 Cb 0.10 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.59 1s5n h LEU 235 CO -0.03 0.73 0.51 -0.25 0.09 0.00 0.00 178.44 179.50 1s5n h TRP 236 N 0.84 0.86 -0.00 1.13 7.01 -0.57 -1.04 115.95 124.18 1s5n h TRP 236 Ca 0.21 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.23 1s5n h TRP 236 Cb 0.14 -0.29 0.00 0.00 -2.10 0.00 0.00 29.16 26.92 1s5n h TRP 236 CO 0.00 0.46 -0.08 0.00 -2.79 0.00 0.00 178.44 176.03 1s5n n ALA 237 N -2.43 2.60 -2.19 2.65 0.00 -0.58 -4.93 120.51 115.64 1s5n n ALA 237 Ca 0.11 -0.17 -0.07 0.00 0.00 0.00 0.00 53.44 53.31 1s5n n ALA 237 Cb 0.21 -1.41 -0.00 0.00 0.00 0.00 0.00 19.45 18.25 1s5n n ALA 237 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s5n n GLY 238 N 1.40 0.11 0.03 0.00 0.00 -0.40 -4.95 105.19 101.39 1s5n n GLY 238 Ca 0.10 -0.58 0.02 0.00 0.00 0.00 0.00 46.02 45.56 1s5n n GLY 238 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1s5n n LYS 239 N -1.69 2.10 -2.76 1.61 4.76 -0.23 -4.90 118.16 117.04 1s5n n LYS 239 Ca -0.08 -1.52 -0.43 0.00 -2.87 0.00 0.00 58.31 53.41 1s5n n LYS 239 Cb 0.56 -0.99 -0.01 0.00 -1.84 0.00 0.00 35.03 32.75 1s5n n LYS 239 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1s5n s LEU 240 N -1.15 4.41 0.26 -0.35 2.96 -1.24 -1.09 118.68 122.49 1s5n s LEU 240 Ca 0.06 -2.35 0.19 0.00 -0.22 0.00 0.00 54.13 51.81 1s5n s LEU 240 Cb 0.05 -2.48 0.08 0.00 0.50 0.00 0.00 46.19 44.34 1s5n s LEU 240 CO 0.01 -1.08 1.28 -0.26 -1.32 0.00 0.00 176.35 174.97 1s5n h PHE 241 N 8.12 0.00 -2.49 5.38 -1.00 -1.87 -3.48 116.94 121.60 1s5n h PHE 241 Ca 0.30 0.00 0.13 0.00 2.81 0.00 0.00 57.97 61.21 1s5n h PHE 241 Cb 0.93 0.00 -0.10 0.00 3.61 0.00 0.00 35.95 40.39 1s5n h PHE 241 CO 1.24 0.29 0.42 -1.58 -1.61 0.00 0.00 178.31 177.07 1s5n s HIS 242 N -3.10 -0.23 -0.03 -0.55 2.46 -1.21 -4.86 115.29 107.77 1s5n s HIS 242 Ca 0.02 -0.05 -0.14 0.00 0.47 0.00 0.00 55.06 55.36 1s5n s HIS 242 Cb 0.08 0.62 0.02 0.00 -0.13 0.00 0.00 32.58 33.17 1s5n s HIS 242 CO 0.75 -0.83 0.30 -1.50 -2.47 0.00 0.00 174.74 171.00 1s5n s ILE 243 N -3.39 0.05 -0.22 0.89 2.07 -1.26 -4.02 121.20 115.31 1s5n s ILE 243 Ca 0.09 -0.41 -0.04 0.00 -1.41 0.00 0.00 60.65 58.89 1s5n s ILE 243 Cb -0.02 -0.58 -0.01 0.00 0.13 0.00 0.00 42.46 41.99 1s5n s ILE 243 CO -0.01 -0.22 -0.04 -1.81 -1.91 0.00 0.00 174.94 170.94 1s5n s ASP 244 N -1.07 4.29 -0.15 4.50 1.01 -0.02 -3.63 116.67 121.59 1s5n s ASP 244 Ca -0.11 -0.41 -0.05 0.00 0.71 0.00 0.00 52.55 52.68 1s5n s ASP 244 Cb -0.05 -1.73 -0.04 0.00 1.01 0.00 0.00 42.92 42.11 1s5n s ASP 244 CO 0.03 -0.02 0.03 -0.76 0.21 0.00 0.00 175.17 174.66 1s5n s LEU 245 N 1.47 3.68 0.00 1.23 1.43 0.87 -1.90 118.68 125.47 1s5n s LEU 245 Ca 0.06 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.23 1s5n s LEU 245 Cb -0.14 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.18 1s5n s LEU 245 CO -0.03 0.23 0.00 -0.46 0.23 0.00 0.00 176.35 176.32 1s5n n ASN 246 N 3.12 0.00 -4.28 2.29 0.23 -1.26 -2.31 115.26 113.05 1s5n n ASN 246 Ca -0.17 -0.87 -0.18 0.00 -0.53 0.00 0.00 54.58 52.82 1s5n n ASN 246 Cb 0.53 0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 38.12 1s5n n ASN 246 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1s5n s GLY 247 N -1.79 1.19 -0.20 4.83 0.00 0.20 -4.42 107.32 107.13 1s5n s GLY 247 Ca 0.00 -1.42 -0.11 0.00 0.00 0.00 0.00 44.72 43.19 1s5n s GLY 247 CO 0.00 -1.49 0.48 1.62 0.00 0.00 0.00 173.10 173.71 1s5n s GLN 248 N -3.02 0.47 -0.44 2.90 2.00 -1.26 -1.09 119.66 119.21 1s5n s GLN 248 Ca 0.14 0.92 -0.03 0.00 -2.00 0.00 0.00 55.36 54.39 1s5n s GLN 248 Cb -0.03 0.05 0.16 0.00 0.80 0.00 0.00 33.01 33.99 1s5n s GLN 248 CO 0.04 -0.16 2.41 0.43 -0.50 0.00 0.00 175.29 177.50 1s5n n SER 249 N 4.37 6.62 0.00 6.67 7.64 -1.26 -3.27 113.62 134.38 1s5n n SER 249 Ca -0.21 -3.23 0.00 0.00 1.01 0.00 0.00 58.87 56.44 1s5n n SER 249 Cb 0.56 -1.14 0.00 0.00 -1.01 0.00 0.00 64.21 62.61 1s5n n SER 249 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1s5n n GLY 250 N 0.48 -1.59 3.50 0.23 0.00 -1.26 -4.89 105.19 101.65 1s5n n GLY 250 Ca 0.43 -2.05 -0.42 0.00 0.00 0.00 0.00 46.02 43.98 1s5n n GLY 250 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s5n s ILE 251 N 0.00 4.13 0.09 -0.61 1.01 -1.26 -4.51 121.20 120.05 1s5n s ILE 251 Ca 0.00 0.03 -0.14 0.00 0.00 0.00 0.00 60.65 60.54 1s5n s ILE 251 Cb 0.00 -4.74 0.05 0.00 0.01 0.00 0.00 42.46 37.78 1s5n s ILE 251 CO 0.00 -1.53 0.67 2.29 0.00 0.00 0.00 174.94 176.36 1s5n n LYS 252 N 8.24 0.35 -1.27 2.79 2.85 -1.26 -5.09 118.16 124.78 1s5n n LYS 252 Ca -0.00 -0.84 -0.37 0.00 -1.05 0.00 0.00 58.31 56.04 1s5n n LYS 252 Cb 0.47 1.17 0.05 0.00 -0.65 0.00 0.00 35.03 36.07 1s5n n LYS 252 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 177.40 179.83 1s5n n TYR 253 N -0.47 -1.59 -2.70 5.58 4.11 -1.26 -4.84 117.16 116.00 1s5n n TYR 253 Ca -0.01 0.35 -0.43 0.00 -0.00 0.00 0.00 57.90 57.82 1s5n n TYR 253 Cb 0.36 -1.83 -0.02 0.00 -0.00 0.00 0.00 39.34 37.84 1s5n n TYR 253 CO 0.00 0.00 0.00 0.16 -0.00 0.00 0.00 176.86 177.02 1s5n s ASP 254 N -1.29 7.07 -0.07 9.48 -4.77 -1.26 -4.87 116.67 120.96 1s5n s ASP 254 Ca 0.62 1.34 0.05 0.00 -3.30 0.00 0.00 52.55 51.26 1s5n s ASP 254 Cb -0.38 -2.52 -0.24 0.00 -1.09 0.00 0.00 42.92 38.68 1s5n s ASP 254 CO 0.61 -0.63 0.57 1.56 0.70 0.00 0.00 175.17 177.98 1s5n h GLN 255 N 7.46 0.11 -6.01 2.11 4.20 -1.88 -3.49 115.11 117.62 1s5n h GLN 255 Ca -0.20 -0.18 -0.42 0.00 0.06 0.00 0.00 58.65 57.90 1s5n h GLN 255 Cb 1.07 0.07 0.08 0.00 0.30 0.00 0.00 27.48 28.99 1s5n h GLN 255 CO 0.96 0.79 -0.72 -0.25 -0.67 0.00 0.00 178.83 178.93 1s5n n ASP 256 N -3.22 -5.27 -4.68 1.46 9.92 -1.23 -4.67 116.55 108.86 1s5n n ASP 256 Ca -0.22 -0.64 -0.31 0.00 -0.53 0.00 0.00 54.79 53.09 1s5n n ASP 256 Cb 1.05 -4.59 0.16 0.00 -0.64 0.00 0.00 41.12 37.10 1s5n n ASP 256 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1s5n s LEU 257 N -7.21 2.70 0.71 0.64 1.43 -0.25 -0.25 118.68 116.45 1s5n s LEU 257 Ca 0.54 2.06 -0.16 0.00 -1.03 0.00 0.00 54.13 55.54 1s5n s LEU 257 Cb -0.25 -4.45 0.03 0.00 0.03 0.00 0.00 46.19 41.54 1s5n s LEU 257 CO 0.77 -3.01 1.24 0.00 0.23 0.00 0.00 176.35 175.58 1s5n s ARG 258 N -4.69 2.22 0.33 1.70 1.70 -1.26 -0.62 118.95 118.34 1s5n s ARG 258 Ca 0.66 1.88 -0.29 0.00 -0.47 0.00 0.00 55.73 57.51 1s5n s ARG 258 Cb -0.22 -1.83 -0.11 0.00 -0.57 0.00 0.00 34.95 32.22 1s5n s ARG 258 CO 0.58 -1.80 1.52 0.12 -1.08 0.00 0.00 175.30 174.64 1s5n s PHE 259 N -1.77 2.70 0.00 5.89 5.36 -1.26 -1.65 117.98 127.25 1s5n s PHE 259 Ca 0.77 1.02 0.00 0.00 -0.96 0.00 0.00 56.93 57.77 1s5n s PHE 259 Cb -0.32 -4.01 0.00 0.00 -0.34 0.00 0.00 43.02 38.35 1s5n s PHE 259 CO 0.44 -3.15 0.00 0.41 -1.46 0.00 0.00 175.22 171.46 1s5n n GLY 260 N 1.24 2.98 3.69 13.12 0.00 -1.26 -4.41 105.19 120.54 1s5n n GLY 260 Ca 0.04 -0.40 -0.29 0.00 0.00 0.00 0.00 46.02 45.38 1s5n n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s5n s ALA 261 N -2.03 1.04 0.00 4.61 0.00 -0.66 -4.13 121.76 120.59 1s5n s ALA 261 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 51.50 1s5n s ALA 261 Cb 0.00 -3.08 0.00 0.00 0.00 0.00 0.00 23.12 20.04 1s5n s ALA 261 CO 0.00 -2.83 0.00 0.41 0.00 0.00 0.00 175.76 173.34 1s5n n GLY 262 N -1.31 1.85 3.51 0.00 0.00 -1.26 -4.04 105.19 103.94 1s5n n GLY 262 Ca 0.06 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 1s5n n GLY 262 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1s5n s ASP 263 N -4.00 6.51 0.17 1.61 -1.08 -1.20 -4.87 116.67 113.80 1s5n s ASP 263 Ca 0.00 -1.58 -0.12 0.00 -0.52 0.00 0.00 52.55 50.32 1s5n s ASP 263 Cb 0.00 -2.49 0.07 0.00 -1.46 0.00 0.00 42.92 39.03 1s5n s ASP 263 CO 0.00 -1.36 1.73 0.25 0.52 0.00 0.00 175.17 176.32 1s5n h LEU 264 N 11.80 0.77 -0.86 -1.34 5.85 -1.80 -1.67 115.31 128.07 1s5n h LEU 264 Ca 0.12 -0.16 -0.10 0.00 0.84 0.00 0.00 57.88 58.58 1s5n h LEU 264 Cb 1.02 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 1s5n h LEU 264 CO 1.28 0.72 -0.28 0.03 -0.34 0.00 0.00 178.44 179.85 1s5n h ARG 265 N 0.78 0.52 -0.44 1.25 3.08 -1.91 -0.96 114.38 116.70 1s5n h ARG 265 Ca 0.19 -0.21 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 1s5n h ARG 265 Cb 0.17 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 1s5n h ARG 265 CO -0.02 0.75 0.20 0.00 -1.07 0.00 0.00 179.97 179.83 1s5n h ALA 266 N 1.25 1.52 -0.49 0.04 0.00 -1.89 0.28 119.26 119.97 1s5n h ALA 266 Ca 0.06 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1s5n h ALA 266 Cb 0.72 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1s5n h ALA 266 CO 0.06 0.38 0.22 0.00 0.00 0.00 0.00 179.25 179.90 1s5n h ALA 267 N 1.60 0.63 -0.08 0.00 0.00 -0.37 -0.31 119.26 120.74 1s5n h ALA 267 Ca 0.15 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1s5n h ALA 267 Cb 0.09 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1s5n h ALA 267 CO -0.02 0.22 -0.05 0.35 0.00 0.00 0.00 179.25 179.75 1s5n h PHE 268 N 0.65 -0.12 0.00 0.00 3.57 -0.56 -1.24 116.94 119.24 1s5n h PHE 268 Ca 0.17 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.61 1s5n h PHE 268 Cb 0.16 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 1s5n h PHE 268 CO -0.00 -0.08 -0.33 -1.49 -2.23 0.00 0.00 178.31 174.18 1s5n h TRP 269 N -0.05 0.00 -0.08 0.41 -0.00 -0.83 -0.61 115.95 114.78 1s5n h TRP 269 Ca 0.05 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 58.93 1s5n h TRP 269 Cb 0.13 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 29.28 1s5n h TRP 269 CO -0.16 0.33 0.02 1.25 -0.00 0.00 0.00 178.44 179.88 1s5n h LEU 270 N 0.00 0.13 -0.56 -4.49 5.85 -0.76 -1.74 115.31 113.74 1s5n h LEU 270 Ca -0.00 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.47 1s5n h LEU 270 Cb 0.60 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.57 1s5n h LEU 270 CO 0.04 0.33 0.31 0.58 -0.34 0.00 0.00 178.44 179.36 1s5n h VAL 271 N -0.08 1.18 -0.61 1.05 2.07 -0.88 0.35 116.25 119.32 1s5n h VAL 271 Ca 0.03 -0.45 0.12 0.00 0.82 0.00 0.00 66.70 67.21 1s5n h VAL 271 Cb 0.25 0.47 -0.09 0.00 -1.52 0.00 0.00 31.29 30.40 1s5n h VAL 271 CO 0.00 0.19 0.12 -0.78 0.02 0.00 0.00 177.57 177.12 1s5n h ASP 272 N 0.75 -0.03 -0.10 0.57 3.58 -1.06 -0.56 116.42 119.56 1s5n h ASP 272 Ca 0.20 0.12 -0.03 0.00 0.42 0.00 0.00 57.03 57.74 1s5n h ASP 272 Cb 0.03 0.17 -0.00 0.00 1.72 0.00 0.00 39.33 41.25 1s5n h ASP 272 CO -0.03 -0.01 -0.06 0.25 -2.88 0.00 0.00 179.24 176.51 1s5n h LEU 273 N 0.24 0.23 -0.74 2.28 5.85 -0.74 -0.47 115.31 121.96 1s5n h LEU 273 Ca 0.33 -0.42 0.01 0.00 0.84 0.00 0.00 57.88 58.63 1s5n h LEU 273 Cb 0.50 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 1s5n h LEU 273 CO -0.43 0.61 0.49 -0.07 -0.34 0.00 0.00 178.44 178.69 1s5n h LEU 274 N -0.14 0.84 -0.21 2.25 3.38 -0.63 0.10 115.31 120.90 1s5n h LEU 274 Ca 0.02 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 1s5n h LEU 274 Cb 0.52 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1s5n h LEU 274 CO 0.02 0.60 -0.37 -0.33 0.09 0.00 0.00 178.44 178.44 1s5n h GLU 275 N 0.99 0.62 -0.87 1.13 4.39 -1.08 -1.49 114.58 118.28 1s5n h GLU 275 Ca 0.28 -0.39 -0.01 0.00 0.34 0.00 0.00 59.36 59.58 1s5n h GLU 275 Cb -0.08 0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.57 1s5n h GLU 275 CO -0.07 1.00 0.49 0.77 -1.16 0.00 0.00 179.01 180.04 1s5n h SER 276 N 0.31 1.06 1.32 1.42 0.02 -0.80 -2.63 113.55 114.25 1s5n h SER 276 Ca 0.01 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1s5n h SER 276 Cb 0.97 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.24 1s5n h SER 276 CO 0.08 0.84 0.00 0.00 -1.14 0.00 0.00 176.83 176.61 1s5n n ALA 277 N -2.41 2.19 -2.73 3.77 0.00 -0.00 -4.93 120.51 116.40 1s5n n ALA 277 Ca 0.09 -0.02 -0.11 0.00 0.00 0.00 0.00 53.44 53.41 1s5n n ALA 277 Cb 0.08 -1.46 0.02 0.00 0.00 0.00 0.00 19.45 18.10 1s5n n ALA 277 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s5n n GLY 278 N 1.13 0.12 3.69 0.00 0.00 -0.83 -4.95 105.19 104.34 1s5n n GLY 278 Ca 0.05 -0.31 -0.45 0.00 0.00 0.00 0.00 46.02 45.32 1s5n n GLY 278 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1s5n n TYR 279 N -3.83 2.46 -0.26 1.61 9.36 -0.62 -4.88 117.16 120.99 1s5n n TYR 279 Ca -0.04 0.16 0.03 0.00 3.32 0.00 0.00 57.90 61.37 1s5n n TYR 279 Cb 0.55 -2.60 0.06 0.00 -0.63 0.00 0.00 39.34 36.72 1s5n n TYR 279 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 1s5n n GLU 280 N 3.79 2.67 -1.18 2.98 1.02 -1.26 -4.94 120.64 123.71 1s5n n GLU 280 Ca 0.17 -1.84 -0.30 0.00 -0.02 0.00 0.00 57.16 55.17 1s5n n GLU 280 Cb 0.31 -1.17 0.24 0.00 -0.02 0.00 0.00 31.44 30.80 1s5n n GLU 280 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1s5n s GLY 281 N -1.38 1.61 0.49 0.62 0.00 -1.26 -4.99 107.32 102.42 1s5n s GLY 281 Ca 0.11 -1.05 -0.23 0.00 0.00 0.00 0.00 44.72 43.55 1s5n s GLY 281 CO 0.03 -0.15 1.32 -4.14 0.00 0.00 0.00 173.10 170.17 1s5n s PRO 282 N -5.52 3.49 -0.84 2.90 0.02 -1.26 -4.94 135.00 128.85 1s5n s PRO 282 Ca 0.72 2.16 -0.15 0.00 0.02 0.00 0.00 61.00 63.75 1s5n s PRO 282 Cb -0.08 -2.44 0.19 0.00 0.02 0.00 0.00 34.50 32.20 1s5n s PRO 282 CO 0.55 -0.88 0.85 1.03 -0.33 0.00 0.00 177.00 178.22 1s5n s ARG 283 N -2.68 3.57 -0.14 5.54 3.00 -0.40 -4.42 118.95 123.43 1s5n s ARG 283 Ca 0.66 -2.23 -0.17 0.00 0.00 0.00 0.00 55.73 53.99 1s5n s ARG 283 Cb -0.38 -4.54 -0.04 0.00 0.00 0.00 0.00 34.95 29.98 1s5n s ARG 283 CO 0.47 -1.42 0.41 -1.58 0.00 0.00 0.00 175.30 173.18 1s5n s HIS 284 N 0.91 3.48 -0.32 -0.53 2.46 -1.24 -1.51 115.29 118.53 1s5n s HIS 284 Ca 0.21 0.76 -0.13 0.00 0.47 0.00 0.00 55.06 56.37 1s5n s HIS 284 Cb -0.10 -2.48 -0.02 0.00 -0.13 0.00 0.00 32.58 29.85 1s5n s HIS 284 CO -0.08 0.17 0.28 -0.06 -2.47 0.00 0.00 174.74 172.58 1s5n s PHE 285 N 0.65 3.22 -0.80 3.88 0.08 0.17 -0.09 117.98 125.10 1s5n s PHE 285 Ca 0.22 -0.04 -0.06 0.00 0.12 0.00 0.00 56.93 57.18 1s5n s PHE 285 Cb -0.14 -2.53 0.20 0.00 -0.57 0.00 0.00 43.02 39.98 1s5n s PHE 285 CO 0.08 -0.34 0.68 0.34 -0.10 0.00 0.00 175.22 175.88 1s5n s ASP 286 N 1.73 6.00 0.22 1.36 -1.08 -0.98 -3.58 116.67 120.34 1s5n s ASP 286 Ca 0.09 -3.14 -0.00 0.00 -0.52 0.00 0.00 52.55 48.98 1s5n s ASP 286 Cb -0.17 -1.99 -0.04 0.00 -1.46 0.00 0.00 42.92 39.26 1s5n s ASP 286 CO 0.11 -0.35 0.11 0.72 0.52 0.00 0.00 175.17 176.28 1s5n s PHE 287 N -0.50 1.27 -0.11 -5.34 -0.71 -1.26 -4.57 117.98 106.77 1s5n s PHE 287 Ca 0.21 -1.30 -0.01 0.00 -1.04 0.00 0.00 56.93 54.79 1s5n s PHE 287 Cb -0.13 -0.67 0.03 0.00 -1.21 0.00 0.00 43.02 41.04 1s5n s PHE 287 CO -0.08 -0.53 -0.04 0.15 -1.34 0.00 0.00 175.22 173.38 1s5n s LYS 288 N -4.11 1.18 0.16 1.99 1.02 0.65 -4.35 119.74 116.28 1s5n s LYS 288 Ca 0.38 -0.17 -0.33 0.00 0.02 0.00 0.00 55.97 55.88 1s5n s LYS 288 Cb 0.07 -1.45 -0.12 0.00 -0.52 0.00 0.00 37.83 35.81 1s5n s LYS 288 CO 0.12 -0.31 1.72 -2.30 -0.92 0.00 0.00 175.35 173.66 1s5n n PRO 289 N 5.01 2.56 -1.54 -1.68 -0.02 -1.26 -4.63 135.00 133.43 1s5n n PRO 289 Ca -0.10 0.93 -0.38 0.00 -2.02 0.00 0.00 63.50 61.92 1s5n n PRO 289 Cb 0.50 -2.76 0.05 0.00 -0.02 0.00 0.00 33.50 31.27 1s5n n PRO 289 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1s5n n PRO 290 N 4.35 0.69 0.00 0.52 -0.02 -1.26 -4.83 135.00 134.45 1s5n n PRO 290 Ca 0.17 0.27 0.09 0.00 -2.02 0.00 0.00 63.50 62.01 1s5n n PRO 290 Cb 0.33 -1.97 0.41 0.00 -0.02 0.00 0.00 33.50 32.25 1s5n n PRO 290 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1s5n n ARG 291 N -0.67 0.09 0.32 -0.52 1.85 -1.26 -1.11 116.66 115.35 1s5n n ARG 291 Ca 0.13 0.16 0.19 0.00 -1.00 0.00 0.00 57.85 57.34 1s5n n ARG 291 Cb 0.48 -1.50 1.08 0.00 -1.05 0.00 0.00 32.46 31.47 1s5n n ARG 291 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 1s5n h THR 292 N 0.00 0.25 -3.36 8.89 1.35 -1.97 -3.45 112.91 114.62 1s5n h THR 292 Ca 0.00 -0.00 -0.55 0.00 -0.55 0.00 0.00 66.41 65.30 1s5n h THR 292 Cb 0.26 1.00 -0.03 0.00 -1.73 0.00 0.00 68.15 67.65 1s5n h THR 292 CO 0.00 0.00 -0.13 -1.61 -0.25 0.00 0.00 175.52 173.53 1s5n s GLU 293 N -4.38 3.84 0.57 4.72 0.41 -0.27 -5.10 118.70 118.49 1s5n s GLU 293 Ca -0.05 0.30 -0.03 0.00 -0.41 0.00 0.00 54.97 54.78 1s5n s GLU 293 Cb 0.14 -2.77 0.12 0.00 -1.78 0.00 0.00 34.13 29.84 1s5n s GLU 293 CO 0.48 0.40 0.78 -0.40 -0.49 0.00 0.00 175.26 176.02 1s5n n ASP 294 N 0.24 0.73 0.04 -0.19 5.68 -1.26 -4.84 116.55 116.95 1s5n n ASP 294 Ca -0.02 -1.69 0.04 0.00 -0.50 0.00 0.00 54.79 52.62 1s5n n ASP 294 Cb 0.52 -0.53 0.45 0.00 -1.14 0.00 0.00 41.12 40.42 1s5n n ASP 294 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 1s5n h ILE 295 N -0.81 1.09 -0.42 2.12 6.09 -1.99 -0.38 117.51 123.22 1s5n h ILE 295 Ca -0.26 -0.19 -0.07 0.00 -1.37 0.00 0.00 64.86 62.97 1s5n h ILE 295 Cb 0.87 0.60 -0.02 0.00 0.47 0.00 0.00 36.82 38.74 1s5n h ILE 295 CO 0.24 0.09 -0.04 0.44 -3.07 0.00 0.00 178.15 175.82 1s5n h ASP 296 N 0.47 0.67 0.30 2.19 3.32 -2.00 -2.40 116.42 118.96 1s5n h ASP 296 Ca 0.12 -0.16 -0.09 0.00 0.02 0.00 0.00 57.03 56.92 1s5n h ASP 296 Cb -0.03 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 1s5n h ASP 296 CO -0.03 0.77 -0.40 1.23 -1.72 0.00 0.00 179.24 179.09 1s5n h GLY 297 N 0.95 0.14 0.58 2.75 0.00 -1.48 -1.44 103.07 104.57 1s5n h GLY 297 Ca 0.12 -0.13 0.03 0.00 0.00 0.00 0.00 47.33 47.36 1s5n h GLY 297 CO 0.02 0.12 -0.15 -2.08 0.00 0.00 0.00 176.54 174.45 1s5n h VAL 298 N 0.11 0.62 -0.08 4.60 2.07 -0.69 -0.01 116.25 122.87 1s5n h VAL 298 Ca 0.01 0.00 -0.14 0.00 0.82 0.00 0.00 66.70 67.39 1s5n h VAL 298 Cb 0.75 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1s5n h VAL 298 CO 0.06 0.00 -0.57 -0.50 0.02 0.00 0.00 177.57 176.58 1s5n h TRP 299 N -0.23 0.31 -0.65 1.57 -0.00 -1.22 -1.32 115.95 114.41 1s5n h TRP 299 Ca 0.06 -0.11 -0.02 0.00 -0.00 0.00 0.00 58.89 58.83 1s5n h TRP 299 Cb 0.32 -0.06 -0.03 0.00 -0.00 0.00 0.00 29.16 29.39 1s5n h TRP 299 CO -0.22 0.75 0.34 0.00 -0.00 0.00 0.00 178.44 179.31 1s5n h ALA 300 N 1.22 0.83 -0.51 1.49 0.00 -1.09 -0.30 119.26 120.91 1s5n h ALA 300 Ca -0.00 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 1s5n h ALA 300 Cb 1.05 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 1s5n h ALA 300 CO 0.09 0.37 -0.00 1.03 0.00 0.00 0.00 179.25 180.73 1s5n h SER 301 N 0.89 0.88 -0.49 0.00 0.87 -0.68 -0.31 113.55 114.70 1s5n h SER 301 Ca 0.23 -0.31 -0.01 0.00 -1.23 0.00 0.00 61.79 60.46 1s5n h SER 301 Cb 0.07 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 61.78 1s5n h SER 301 CO -0.03 0.97 0.25 0.00 -0.53 0.00 0.00 176.83 177.49 1s5n h ALA 302 N 0.94 0.62 -0.77 6.23 0.00 -1.09 -1.76 119.26 123.44 1s5n h ALA 302 Ca 0.14 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1s5n h ALA 302 Cb 0.52 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1s5n h ALA 302 CO 0.03 0.17 0.47 0.00 0.00 0.00 0.00 179.25 179.92 1s5n h ALA 303 N 1.09 1.38 -0.54 0.00 0.00 -0.84 -2.46 119.26 117.90 1s5n h ALA 303 Ca 0.17 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1s5n h ALA 303 Cb 0.08 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1s5n h ALA 303 CO -0.02 0.54 0.17 0.78 0.00 0.00 0.00 179.25 180.71 1s5n h GLY 304 N 1.08 0.87 0.13 0.00 0.00 -0.48 -0.41 103.07 104.26 1s5n h GLY 304 Ca 0.28 -0.47 0.07 0.00 0.00 0.00 0.00 47.33 47.21 1s5n h GLY 304 CO -0.05 0.44 -0.22 0.00 0.00 0.00 0.00 176.54 176.71 1s5n h MET 306 N -0.20 0.63 -0.51 0.00 2.86 -1.39 -2.42 114.93 113.90 1s5n h MET 306 Ca 0.15 -0.28 0.04 0.00 -2.06 0.00 0.00 59.70 57.55 1s5n h MET 306 Cb 0.43 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.04 1s5n h MET 306 CO -0.41 0.87 0.27 -0.09 1.06 0.00 0.00 176.91 178.61 1s5n h ARG 307 N 0.38 0.52 -0.64 1.72 2.43 -0.92 -1.35 114.38 116.52 1s5n h ARG 307 Ca 0.06 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.11 1s5n h ARG 307 Cb 0.69 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.10 1s5n h ARG 307 CO 0.05 0.34 0.05 -0.91 -1.51 0.00 0.00 179.97 177.99 1s5n h ASN 308 N 0.53 1.07 -0.37 -3.80 -0.26 -0.99 0.38 115.58 112.14 1s5n h ASN 308 Ca 0.22 -0.29 0.05 0.00 -0.56 0.00 0.00 56.30 55.72 1s5n h ASN 308 Cb 0.10 -0.29 -0.04 0.00 -1.06 0.00 0.00 38.32 37.03 1s5n h ASN 308 CO -0.14 1.09 0.12 0.22 -1.06 0.00 0.00 177.43 177.66 1s5n h TYR 309 N 1.01 0.21 -0.46 1.19 5.03 -1.03 -0.86 116.97 122.06 1s5n h TYR 309 Ca 0.19 0.02 -0.10 0.00 2.58 0.00 0.00 58.73 61.42 1s5n h TYR 309 Cb 0.52 -0.04 -0.02 0.00 1.55 0.00 0.00 36.73 38.74 1s5n h TYR 309 CO 0.04 0.08 -0.10 -0.07 -1.32 0.00 0.00 178.16 176.78 1s5n h LEU 310 N 0.26 0.82 0.04 2.82 3.38 -0.66 0.42 115.31 122.40 1s5n h LEU 310 Ca 0.17 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1s5n h LEU 310 Cb 0.16 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1s5n h LEU 310 CO -0.19 0.94 -0.02 0.40 0.09 0.00 0.00 178.44 179.67 1s5n h ILE 311 N 0.75 1.01 -0.62 1.22 2.04 -0.75 -2.07 117.51 119.08 1s5n h ILE 311 Ca 0.13 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 1s5n h ILE 311 Cb 0.60 1.11 -0.03 0.00 -0.74 0.00 0.00 36.82 37.75 1s5n h ILE 311 CO 0.04 0.04 0.32 -0.07 0.00 0.00 0.00 178.15 178.47 1s5n h LEU 312 N -0.12 0.78 -0.48 1.44 3.38 -0.93 -0.67 115.31 118.71 1s5n h LEU 312 Ca -0.01 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 57.91 1s5n h LEU 312 Cb 0.10 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1s5n h LEU 312 CO 0.01 0.65 0.29 0.50 0.09 0.00 0.00 178.44 179.98 1s5n h LYS 313 N 0.87 0.57 -0.23 1.13 3.64 -0.75 0.62 116.57 122.43 1s5n h LYS 313 Ca 0.22 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.56 1s5n h LYS 313 Cb 0.06 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 1s5n h LYS 313 CO -0.03 0.38 0.12 1.49 -2.27 0.00 0.00 179.45 179.14 1s5n h GLU 314 N 0.59 0.32 -0.61 1.90 4.81 -0.69 -1.15 114.58 119.76 1s5n h GLU 314 Ca 0.19 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.31 1s5n h GLU 314 Cb -0.01 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1s5n h GLU 314 CO -0.07 0.30 0.14 0.00 -0.73 0.00 0.00 179.01 178.65 1s5n h ARG 315 N 0.26 0.98 -0.58 1.92 2.47 -0.85 -0.94 114.38 117.64 1s5n h ARG 315 Ca 0.08 -0.24 -0.10 0.00 -1.26 0.00 0.00 59.98 58.46 1s5n h ARG 315 Cb 0.08 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 28.25 1s5n h ARG 315 CO -0.01 0.91 -0.02 0.00 0.56 0.00 0.00 179.97 181.40 1s5n h ALA 316 N 1.04 0.79 -0.65 0.04 0.00 -0.79 -0.46 119.26 119.23 1s5n h ALA 316 Ca 0.19 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 1s5n h ALA 316 Cb 0.37 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1s5n h ALA 316 CO 0.00 0.64 0.12 0.00 0.00 0.00 0.00 179.25 180.02 1s5n h ALA 317 N 0.97 0.86 -0.55 0.00 0.00 -1.02 -1.29 119.26 118.22 1s5n h ALA 317 Ca 0.16 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1s5n h ALA 317 Cb 0.58 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1s5n h ALA 317 CO 0.03 0.60 0.25 0.00 0.00 0.00 0.00 179.25 180.14 1s5n h ALA 318 N 1.05 0.71 0.02 0.00 0.00 -0.97 -0.95 119.26 119.11 1s5n h ALA 318 Ca 0.20 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1s5n h ALA 318 Cb 0.41 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1s5n h ALA 318 CO 0.01 0.28 -0.20 0.35 0.00 0.00 0.00 179.25 179.69 1s5n h PHE 319 N 0.74 -0.53 -0.09 0.00 3.57 -0.83 -1.79 116.94 118.01 1s5n h PHE 319 Ca 0.19 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.62 1s5n h PHE 319 Cb 0.14 0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.10 1s5n h PHE 319 CO -0.00 -0.29 -0.32 0.00 -2.23 0.00 0.00 178.31 175.47 1s5n h ARG 320 N -0.34 0.17 0.00 1.11 2.47 -1.01 -2.71 114.38 114.07 1s5n h ARG 320 Ca 0.05 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 1s5n h ARG 320 Cb 0.40 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.71 1s5n h ARG 320 CO -0.17 0.48 0.00 0.00 0.56 0.00 0.00 179.97 180.84 1s5n h ALA 321 N 1.52 1.00 -2.26 0.04 0.00 -1.00 -3.43 119.26 115.13 1s5n h ALA 321 Ca 0.02 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.38 1s5n h ALA 321 Cb 0.65 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1s5n h ALA 321 CO 0.05 0.00 0.97 0.34 0.00 0.00 0.00 179.25 180.61 1s5n s ASP 322 N -5.52 6.79 0.48 0.00 -1.08 -0.69 -4.88 116.67 111.77 1s5n s ASP 322 Ca 0.07 2.06 0.21 0.00 -0.52 0.00 0.00 52.55 54.37 1s5n s ASP 322 Cb 0.08 -2.54 1.23 0.00 -1.46 0.00 0.00 42.92 40.23 1s5n s ASP 322 CO 0.61 -0.83 1.94 -0.65 0.52 0.00 0.00 175.17 176.76 1s5n h PRO 323 N 8.70 0.20 -0.02 4.34 0.11 -1.89 -0.48 132.00 142.96 1s5n h PRO 323 Ca -0.35 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 65.63 1s5n h PRO 323 Cb 1.16 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 1s5n h PRO 323 CO 0.94 0.14 -0.54 0.93 -0.21 0.00 0.00 178.00 179.26 1s5n h GLU 324 N 0.21 0.05 -0.25 1.05 5.08 -1.94 -1.00 114.58 117.78 1s5n h GLU 324 Ca 0.33 -0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.56 1s5n h GLU 324 Cb 1.01 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 1s5n h GLU 324 CO -0.07 0.58 -0.26 0.28 -1.00 0.00 0.00 179.01 178.55 1s5n h VAL 325 N 0.04 1.31 -0.88 3.13 2.07 -1.41 -0.91 116.25 119.60 1s5n h VAL 325 Ca -0.00 -1.43 0.04 0.00 0.82 0.00 0.00 66.70 66.13 1s5n h VAL 325 Cb 0.97 1.67 -0.05 0.00 -1.52 0.00 0.00 31.29 32.36 1s5n h VAL 325 CO 0.07 0.45 0.58 1.56 0.02 0.00 0.00 177.57 180.25 1s5n h GLN 326 N 0.32 1.06 -0.38 1.57 4.20 -0.90 0.83 115.11 121.82 1s5n h GLN 326 Ca 0.04 -0.06 -0.09 0.00 0.06 0.00 0.00 58.65 58.59 1s5n h GLN 326 Cb 0.82 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 1s5n h GLN 326 CO 0.06 0.70 -0.13 1.49 -0.67 0.00 0.00 178.83 180.29 1s5n h GLU 327 N 1.10 0.75 -0.61 1.46 4.57 -1.13 -2.56 114.58 118.16 1s5n h GLU 327 Ca 0.35 -0.30 -0.03 0.00 -1.18 0.00 0.00 59.36 58.19 1s5n h GLU 327 Cb 0.03 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.55 1s5n h GLU 327 CO -0.11 0.91 0.24 0.00 -1.18 0.00 0.00 179.01 178.88 1s5n h ALA 328 N 0.82 1.29 -0.70 2.92 0.00 -0.33 0.76 119.26 124.02 1s5n h ALA 328 Ca 0.09 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1s5n h ALA 328 Cb 0.65 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1s5n h ALA 328 CO 0.04 0.53 0.35 -0.07 0.00 0.00 0.00 179.25 180.10 1s5n h LEU 329 N 0.87 0.90 -0.63 0.00 3.38 -0.72 -0.85 115.31 118.26 1s5n h LEU 329 Ca 0.21 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 1s5n h LEU 329 Cb 0.17 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 1s5n h LEU 329 CO -0.02 0.77 0.21 0.03 0.09 0.00 0.00 178.44 179.52 1s5n h ARG 330 N 0.97 0.97 -0.29 1.13 3.08 -0.99 -1.04 114.38 118.22 1s5n h ARG 330 Ca 0.24 -0.20 0.02 0.00 0.07 0.00 0.00 59.98 60.10 1s5n h ARG 330 Cb 0.09 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 1s5n h ARG 330 CO -0.03 0.85 0.19 0.00 -1.07 0.00 0.00 179.97 179.91 1s5n h ALA 331 N 1.08 1.86 -0.10 0.04 0.00 -0.33 -1.21 119.26 120.60 1s5n h ALA 331 Ca 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1s5n h ALA 331 Cb 0.27 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1s5n h ALA 331 CO -0.01 0.11 0.00 0.43 0.00 0.00 0.00 179.25 179.78 1s5n n SER 332 N -4.49 1.70 -1.70 0.00 7.64 -0.37 -4.73 113.62 111.66 1s5n n SER 332 Ca 0.02 -1.63 -0.14 0.00 1.01 0.00 0.00 58.87 58.13 1s5n n SER 332 Cb 0.11 -0.06 -0.00 0.00 -1.01 0.00 0.00 64.21 63.26 1s5n n SER 332 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1s5n n ARG 333 N 0.33 -1.57 0.22 1.43 3.00 -0.46 -4.90 116.66 114.71 1s5n n ARG 333 Ca 0.18 0.66 0.07 0.00 -0.01 0.00 0.00 57.85 58.76 1s5n n ARG 333 Cb 0.36 -4.93 0.52 0.00 0.00 0.00 0.00 32.46 28.40 1s5n n ARG 333 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 1s5n h LEU 334 N -0.20 0.00 -0.38 0.55 -0.00 -1.46 -1.91 115.31 111.91 1s5n h LEU 334 Ca -0.34 0.00 -0.11 0.00 -0.00 0.00 0.00 57.88 57.43 1s5n h LEU 334 Cb 1.25 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.90 1s5n h LEU 334 CO 0.39 0.25 -0.20 -2.24 -0.00 0.00 0.00 178.44 176.64 1s5n h ASP 335 N 0.00 0.84 0.60 -0.43 2.03 -1.88 -3.10 116.42 114.48 1s5n h ASP 335 Ca -0.00 -0.41 -0.06 0.00 -0.73 0.00 0.00 57.03 55.83 1s5n h ASP 335 Cb 0.54 -0.23 -0.01 0.00 -0.83 0.00 0.00 39.33 38.80 1s5n h ASP 335 CO 0.03 1.06 -0.27 -0.08 -1.03 0.00 0.00 179.24 178.95 1s5n h GLU 336 N 0.61 0.00 -0.07 4.15 4.81 -1.81 -1.95 114.58 120.32 1s5n h GLU 336 Ca 0.08 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1s5n h GLU 336 Cb 0.75 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.13 1s5n h GLU 336 CO 0.06 0.27 0.05 1.25 -0.73 0.00 0.00 179.01 179.91 1s5n h LEU 337 N 0.00 0.08 -0.04 1.64 5.85 -1.28 -1.70 115.31 119.87 1s5n h LEU 337 Ca -0.00 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1s5n h LEU 337 Cb 0.65 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.66 1s5n h LEU 337 CO 0.04 0.06 0.00 0.00 -0.34 0.00 0.00 178.44 178.20 1s5n n ALA 338 N -2.53 2.25 -2.04 1.25 0.00 -0.73 -4.80 120.51 113.91 1s5n n ALA 338 Ca -0.02 -0.04 -0.41 0.00 0.00 0.00 0.00 53.44 52.97 1s5n n ALA 338 Cb 0.09 -1.46 -0.03 0.00 0.00 0.00 0.00 19.45 18.04 1s5n n ALA 338 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1s5n s GLN 339 N -3.09 4.49 0.33 0.00 -0.21 -0.64 -4.98 119.66 115.56 1s5n s GLN 339 Ca 0.11 1.88 -0.28 0.00 0.02 0.00 0.00 55.36 57.09 1s5n s GLN 339 Cb 0.14 -3.24 -0.12 0.00 1.00 0.00 0.00 33.01 30.79 1s5n s GLN 339 CO 0.56 -0.08 1.31 -2.30 -2.12 0.00 0.00 175.29 172.66 1s5n n PRO 340 N 2.44 2.14 -0.20 2.91 -0.02 -1.26 -4.89 135.00 136.12 1s5n n PRO 340 Ca 0.04 0.75 -0.08 0.00 -2.02 0.00 0.00 63.50 62.19 1s5n n PRO 340 Cb 0.45 -2.35 0.02 0.00 -0.02 0.00 0.00 33.50 31.60 1s5n n PRO 340 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1s5n h THR 341 N 2.62 1.24 -0.62 3.45 2.02 -1.93 -3.40 112.91 116.28 1s5n h THR 341 Ca -0.46 -0.80 -0.32 0.00 0.77 0.00 0.00 66.41 65.60 1s5n h THR 341 Cb 1.28 0.68 -0.23 0.00 -1.74 0.00 0.00 68.15 68.14 1s5n h THR 341 CO 0.64 0.30 -0.68 0.00 0.37 0.00 0.00 175.52 176.16 1s5n n ALA 342 N -2.39 0.07 0.29 6.16 0.00 -1.26 -4.96 120.51 118.42 1s5n n ALA 342 Ca 0.03 -2.06 0.18 0.00 0.00 0.00 0.00 53.44 51.58 1s5n n ALA 342 Cb 0.20 -1.09 0.89 0.00 0.00 0.00 0.00 19.45 19.45 1s5n n ALA 342 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1s5n h ALA 343 N 3.04 1.00 -0.00 0.00 0.00 -1.99 -1.49 119.26 119.82 1s5n h ALA 343 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1s5n h ALA 343 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1s5n h ALA 343 CO 0.25 0.00 -0.43 -0.25 0.00 0.00 0.00 179.25 178.82 1s5n n ASP 344 N -2.77 0.45 0.00 0.00 8.00 -1.26 -5.01 116.55 115.96 1s5n n ASP 344 Ca -0.01 -0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.32 1s5n n ASP 344 Cb 0.12 0.16 0.00 0.00 -0.02 0.00 0.00 41.12 41.37 1s5n n ASP 344 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1s5n n GLY 345 N 1.50 0.67 0.13 0.44 0.00 -0.56 -4.50 105.19 102.86 1s5n n GLY 345 Ca 0.06 -2.18 -0.11 0.00 0.00 0.00 0.00 46.02 43.79 1s5n n GLY 345 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1s5n h VAL 346 N 0.00 1.25 -0.47 1.61 2.07 -1.95 -1.75 116.25 117.02 1s5n h VAL 346 Ca 0.00 -0.83 -0.10 0.00 0.82 0.00 0.00 66.70 66.59 1s5n h VAL 346 Cb 0.00 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 1s5n h VAL 346 CO 0.00 0.25 -0.08 1.56 0.02 0.00 0.00 177.57 179.32 1s5n h GLN 347 N 0.09 0.88 -0.16 1.57 1.08 -1.99 0.51 115.11 117.10 1s5n h GLN 347 Ca 0.05 -0.32 0.02 0.00 -1.45 0.00 0.00 58.65 56.96 1s5n h GLN 347 Cb 0.37 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.72 1s5n h GLN 347 CO 0.01 0.96 0.01 1.49 -0.95 0.00 0.00 178.83 180.35 1s5n h GLU 348 N 0.72 0.06 -0.66 1.46 4.22 -1.77 -2.00 114.58 116.62 1s5n h GLU 348 Ca 0.12 -0.00 0.08 0.00 0.08 0.00 0.00 59.36 59.64 1s5n h GLU 348 Cb 0.62 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.79 1s5n h GLU 348 CO 0.04 0.04 0.32 1.25 -2.18 0.00 0.00 179.01 178.48 1s5n h LEU 349 N 0.06 0.42 -1.45 1.64 5.85 -0.70 -1.09 115.31 120.04 1s5n h LEU 349 Ca 0.07 0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.79 1s5n h LEU 349 Cb 0.08 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 1s5n h LEU 349 CO -0.11 0.26 -0.27 -0.07 -0.34 0.00 0.00 178.44 177.90 1s5n h LEU 350 N 0.57 0.00 -0.70 2.25 3.38 -0.70 -2.39 115.31 117.71 1s5n h LEU 350 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 1s5n h LEU 350 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1s5n h LEU 350 CO -0.25 0.27 -0.16 0.00 0.09 0.00 0.00 178.44 178.40 1s5n n ALA 351 N -2.42 2.89 -2.88 1.53 0.00 -0.65 -4.82 120.51 114.17 1s5n n ALA 351 Ca -0.02 -0.43 -0.43 0.00 0.00 0.00 0.00 53.44 52.56 1s5n n ALA 351 Cb 0.34 -1.13 -0.04 0.00 0.00 0.00 0.00 19.45 18.62 1s5n n ALA 351 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1s5n s ASP 352 N -2.31 6.19 0.62 0.00 2.15 -0.50 -4.89 116.67 117.92 1s5n s ASP 352 Ca 0.29 -1.00 0.39 0.00 0.43 0.00 0.00 52.55 52.66 1s5n s ASP 352 Cb 0.20 -2.39 2.03 0.00 -0.30 0.00 0.00 42.92 42.46 1s5n s ASP 352 CO 0.45 -1.34 2.24 0.03 -0.17 0.00 0.00 175.17 176.38 1s5n h ARG 353 N 9.46 0.00 0.00 4.34 3.08 -1.87 -1.48 114.38 127.90 1s5n h ARG 353 Ca -0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.76 1s5n h ARG 353 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.12 1s5n h ARG 353 CO 1.15 0.01 0.00 0.25 -1.07 0.00 0.00 179.97 180.32 1s5n n THR 354 N -3.22 0.87 1.01 2.04 -2.24 -1.26 -0.39 114.28 111.08 1s5n n THR 354 Ca -0.02 0.21 0.12 0.00 -2.27 0.00 0.00 64.05 62.09 1s5n n THR 354 Cb 0.14 -1.05 0.23 0.00 -2.10 0.00 0.00 70.33 67.55 1s5n n THR 354 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1s5n n ALA 355 N -1.66 3.61 -0.66 6.98 0.00 -0.56 -4.08 120.51 124.16 1s5n n ALA 355 Ca 0.03 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1s5n n ALA 355 Cb 0.22 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.57 1s5n n ALA 355 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1s5n n PHE 356 N -1.47 -0.55 -0.30 0.00 7.35 -0.92 -4.85 117.46 116.72 1s5n n PHE 356 Ca 0.06 0.00 0.03 0.00 -0.76 0.00 0.00 57.45 56.78 1s5n n PHE 356 Cb 0.34 0.17 0.18 0.00 0.35 0.00 0.00 39.48 40.51 1s5n n PHE 356 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 1s5n h GLU 357 N 0.00 0.79 -0.22 -4.13 3.07 -1.77 -2.14 114.58 110.19 1s5n h GLU 357 Ca 0.00 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1s5n h GLU 357 Cb 0.00 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 27.73 1s5n h GLU 357 CO 0.00 0.53 0.00 -0.25 -1.40 0.00 0.00 179.01 177.89 1s5n n ASP 358 N -4.73 3.35 -4.68 1.42 8.00 0.48 -4.99 116.55 115.41 1s5n n ASP 358 Ca 0.14 -2.79 -0.41 0.00 0.71 0.00 0.00 54.79 52.43 1s5n n ASP 358 Cb 0.28 -0.44 -0.04 0.00 -0.02 0.00 0.00 41.12 40.91 1s5n n ASP 358 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1s5n s PHE 359 N -2.41 3.47 -1.00 1.24 5.36 -0.81 -4.79 117.98 119.05 1s5n s PHE 359 Ca 0.35 1.35 -0.20 0.00 -0.96 0.00 0.00 56.93 57.47 1s5n s PHE 359 Cb 0.27 -3.03 0.11 0.00 -0.34 0.00 0.00 43.02 40.03 1s5n s PHE 359 CO 0.09 -0.18 1.28 0.34 -1.46 0.00 0.00 175.22 175.28 1s5n s ASP 360 N 1.09 6.64 0.40 6.13 -1.08 -1.26 -4.85 116.67 123.73 1s5n s ASP 360 Ca 0.41 -1.96 0.10 0.00 -0.52 0.00 0.00 52.55 50.58 1s5n s ASP 360 Cb -0.17 -2.46 0.82 0.00 -1.46 0.00 0.00 42.92 39.65 1s5n s ASP 360 CO 0.15 -1.18 1.93 -0.37 0.52 0.00 0.00 175.17 176.22 1s5n h VAL 361 N 6.01 1.17 -0.17 1.11 -1.51 -1.95 -2.22 116.25 118.70 1s5n h VAL 361 Ca 0.20 -0.77 -0.21 0.00 -1.23 0.00 0.00 66.70 64.69 1s5n h VAL 361 Cb 1.00 1.24 0.01 0.00 -2.13 0.00 0.00 31.29 31.41 1s5n h VAL 361 CO 1.23 0.24 -0.74 0.44 -1.23 0.00 0.00 177.57 177.51 1s5n h ASP 362 N 0.18 0.90 -0.48 4.19 3.32 -1.98 0.22 116.42 122.77 1s5n h ASP 362 Ca 0.04 -0.57 -0.13 0.00 0.02 0.00 0.00 57.03 56.39 1s5n h ASP 362 Cb 0.37 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 1s5n h ASP 362 CO 0.02 1.36 -0.18 0.00 -1.72 0.00 0.00 179.24 178.72 1s5n h ALA 363 N 0.63 0.74 -0.35 3.45 0.00 -1.92 -1.35 119.26 120.45 1s5n h ALA 363 Ca -0.04 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 1s5n h ALA 363 Cb 1.36 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 1s5n h ALA 363 CO 0.15 0.67 0.12 0.00 0.00 0.00 0.00 179.25 180.19 1s5n h ALA 364 N 0.92 0.46 -0.68 0.00 0.00 -1.35 -2.96 119.26 115.64 1s5n h ALA 364 Ca 0.12 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1s5n h ALA 364 Cb 0.75 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 1s5n h ALA 364 CO 0.06 0.09 0.45 0.00 0.00 0.00 0.00 179.25 179.85 1s5n h ALA 365 N 0.96 1.55 0.00 0.00 0.00 -0.69 -2.41 119.26 118.67 1s5n h ALA 365 Ca 0.12 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1s5n h ALA 365 Cb 0.23 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1s5n h ALA 365 CO -0.01 0.41 0.00 0.00 0.00 0.00 0.00 179.25 179.65 1s5n h ALA 366 N 1.58 1.00 -1.73 0.00 0.00 -1.08 -3.43 119.26 115.61 1s5n h ALA 366 Ca 0.26 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.61 1s5n h ALA 366 Cb -0.05 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 1s5n h ALA 366 CO -0.06 0.00 1.15 1.03 0.00 0.00 0.00 179.25 181.37 1s5n s ARG 367 N -3.49 3.36 0.71 0.00 0.52 -0.91 -4.99 118.95 114.15 1s5n s ARG 367 Ca 0.03 0.90 -0.15 0.00 -0.52 0.00 0.00 55.73 55.99 1s5n s ARG 367 Cb 0.09 -4.12 0.03 0.00 0.52 0.00 0.00 34.95 31.47 1s5n s ARG 367 CO 0.50 -1.83 1.18 0.20 0.02 0.00 0.00 175.30 175.36 1s5n s GLY 368 N 4.93 2.30 0.21 -3.53 0.00 -1.26 -4.93 107.32 105.05 1s5n s GLY 368 Ca 0.64 0.79 0.25 0.00 0.00 0.00 0.00 44.72 46.40 1s5n s GLY 368 CO 0.30 1.18 1.59 -0.33 0.00 0.00 0.00 173.10 175.84 1s5n h MET 369 N -0.18 0.00 -2.51 2.90 0.00 -1.94 -3.48 114.93 109.72 1s5n h MET 369 Ca -0.47 0.00 -0.40 0.00 0.00 0.00 0.00 59.70 58.83 1s5n h MET 369 Cb 1.28 0.00 -0.04 0.00 0.00 0.00 0.00 31.60 32.84 1s5n h MET 369 CO 0.51 0.00 -0.49 0.00 0.00 0.00 0.00 176.91 176.93 1s5n n ALA 370 N -1.86 -0.54 0.15 6.32 0.00 -1.26 -3.98 120.51 119.35 1s5n n ALA 370 Ca 0.04 0.19 0.02 0.00 0.00 0.00 0.00 53.44 53.69 1s5n n ALA 370 Cb 0.45 -2.10 0.21 0.00 0.00 0.00 0.00 19.45 18.01 1s5n n ALA 370 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1s5n h PHE 371 N 0.00 0.00 -0.33 0.00 0.04 -1.95 -2.98 116.94 111.72 1s5n h PHE 371 Ca -0.46 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.19 1s5n h PHE 371 Cb 1.34 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.49 1s5n h PHE 371 CO 0.54 0.53 -0.27 0.93 -0.60 0.00 0.00 178.31 179.44 1s5n h GLU 372 N 0.00 0.77 -0.53 1.51 4.39 -1.98 0.28 114.58 119.02 1s5n h GLU 372 Ca -0.01 -0.38 -0.01 0.00 0.34 0.00 0.00 59.36 59.30 1s5n h GLU 372 Cb 1.09 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.72 1s5n h GLU 372 CO 0.07 1.01 0.30 -0.09 -1.16 0.00 0.00 179.01 179.14 1s5n h ARG 373 N 0.54 0.73 -0.34 2.33 2.43 -1.97 0.08 114.38 118.18 1s5n h ARG 373 Ca 0.06 -0.08 0.03 0.00 -0.81 0.00 0.00 59.98 59.18 1s5n h ARG 373 Cb 0.84 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.21 1s5n h ARG 373 CO 0.07 0.56 0.15 1.25 -1.51 0.00 0.00 179.97 180.49 1s5n h LEU 374 N 0.71 0.21 -1.10 3.80 5.85 -1.40 -1.53 115.31 121.86 1s5n h LEU 374 Ca 0.19 0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.84 1s5n h LEU 374 Cb 0.03 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 1s5n h LEU 374 CO -0.03 0.16 -0.42 -0.78 -0.34 0.00 0.00 178.44 177.02 1s5n h ASP 375 N 0.32 0.00 0.51 1.25 3.58 -0.58 -1.84 116.42 119.66 1s5n h ASP 375 Ca 0.15 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.42 1s5n h ASP 375 Cb 0.08 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.12 1s5n h ASP 375 CO -0.12 0.42 -0.75 -0.61 -2.88 0.00 0.00 179.24 175.30 1s5n h GLN 376 N 0.00 0.20 -0.88 0.28 5.75 -0.71 0.25 115.11 119.99 1s5n h GLN 376 Ca -0.00 -0.18 0.02 0.00 -0.15 0.00 0.00 58.65 58.34 1s5n h GLN 376 Cb 0.81 0.04 -0.05 0.00 1.07 0.00 0.00 27.48 29.35 1s5n h GLN 376 CO 0.06 0.86 0.58 -0.07 -2.65 0.00 0.00 178.83 177.60 1s5n h LEU 377 N 0.13 0.99 -0.56 -2.39 3.38 -0.91 0.46 115.31 116.41 1s5n h LEU 377 Ca -0.03 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 1s5n h LEU 377 Cb 1.33 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.82 1s5n h LEU 377 CO 0.11 0.70 0.12 0.00 0.09 0.00 0.00 178.44 179.46 1s5n h ALA 378 N 1.34 0.74 -0.36 1.53 0.00 -0.90 -0.93 119.26 120.67 1s5n h ALA 378 Ca 0.34 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1s5n h ALA 378 Cb -0.08 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1s5n h ALA 378 CO -0.09 0.46 0.22 1.98 0.00 0.00 0.00 179.25 181.82 1s5n h MET 379 N 0.80 0.49 -0.74 0.00 1.85 -0.68 -0.88 114.93 115.76 1s5n h MET 379 Ca 0.17 -0.04 0.01 0.00 -0.61 0.00 0.00 59.70 59.23 1s5n h MET 379 Cb 0.37 -0.10 -0.04 0.00 0.43 0.00 0.00 31.60 32.26 1s5n h MET 379 CO 0.01 0.35 0.48 -0.44 -0.40 0.00 0.00 176.91 176.91 1s5n h ASP 380 N 0.48 0.86 -0.39 1.39 3.32 -0.69 -1.13 116.42 120.26 1s5n h ASP 380 Ca 0.13 -0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 1s5n h ASP 380 Cb -0.01 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 1s5n h ASP 380 CO -0.03 0.63 0.12 0.45 -1.72 0.00 0.00 179.24 178.70 1s5n h HIS 381 N 1.01 0.63 -0.79 4.55 3.86 -0.99 0.68 115.15 124.10 1s5n h HIS 381 Ca 0.27 -0.06 0.04 0.00 -1.16 0.00 0.00 60.37 59.46 1s5n h HIS 381 Cb -0.10 -0.18 -0.05 0.00 1.06 0.00 0.00 27.41 28.14 1s5n h HIS 381 CO -0.02 0.59 0.50 1.25 0.86 0.00 0.00 177.93 181.11 1s5n h LEU 382 N 0.48 0.81 -0.33 2.43 5.85 -0.71 -2.28 115.31 121.56 1s5n h LEU 382 Ca 0.13 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1s5n h LEU 382 Cb 0.26 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.12 1s5n h LEU 382 CO -0.00 0.55 -0.03 0.18 -0.34 0.00 0.00 178.44 178.79 1s5n n LEU 383 N -4.62 0.55 -2.01 2.25 4.77 -0.47 -4.92 117.00 112.56 1s5n n LEU 383 Ca 0.10 -0.12 -0.15 0.00 -0.03 0.00 0.00 56.01 55.80 1s5n n LEU 383 Cb 0.11 -0.07 0.02 0.00 -2.33 0.00 0.00 43.42 41.15 1s5n n LEU 383 CO 0.33 0.10 -0.06 0.61 -1.33 0.00 0.00 177.39 177.04 1s5n n GLY 384 N 1.14 -0.18 2.68 -0.72 0.00 -0.59 -4.95 105.19 102.58 1s5n n GLY 384 Ca 0.19 -0.19 -0.27 0.00 0.00 0.00 0.00 46.02 45.76 1s5n n GLY 384 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s5n n ALA 385 N -2.61 4.85 -1.03 4.61 0.00 0.13 -5.03 120.51 121.43 1s5n n ALA 385 Ca -0.11 -4.46 0.00 0.00 0.00 0.00 0.00 53.44 48.87 1s5n n ALA 385 Cb 0.60 -0.63 0.00 0.00 0.00 0.00 0.00 19.45 19.42 1s5n n ALA 385 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04