#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mna s GLY 10 N 0.00 1.52 0.19 0.00 0.00 -1.26 -5.00 107.32 102.78 1mna s GLY 10 Ca 0.00 -0.84 -0.09 0.00 0.00 0.00 0.00 44.72 43.80 1mna s GLY 10 CO 0.00 -0.66 1.69 1.98 0.00 0.00 0.00 173.10 176.11 1mna h MET 11 N 0.29 1.12 -0.78 2.90 -1.53 -1.99 -2.27 114.93 112.67 1mna h MET 11 Ca -0.47 -0.30 0.01 0.00 -3.44 0.00 0.00 59.70 55.50 1mna h MET 11 Cb 1.24 -0.13 -0.04 0.00 -0.55 0.00 0.00 31.60 32.12 1mna h MET 11 CO 0.60 1.02 0.51 0.74 0.14 0.00 0.00 176.91 179.92 1mna h PHE 12 N 1.04 0.98 -0.51 1.39 -1.00 -1.95 0.13 116.94 117.01 1mna h PHE 12 Ca 0.21 0.02 -0.01 0.00 2.81 0.00 0.00 57.97 61.00 1mna h PHE 12 Cb 0.45 -0.33 -0.02 0.00 3.61 0.00 0.00 35.95 39.65 1mna h PHE 12 CO 0.03 0.62 0.29 -0.09 -1.61 0.00 0.00 178.31 177.55 1mna h ARG 13 N 1.05 0.71 -0.39 1.51 2.43 -1.80 0.10 114.38 117.98 1mna h ARG 13 Ca 0.28 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 1mna h ARG 13 Cb -0.12 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.27 1mna h ARG 13 CO -0.06 0.54 0.26 0.00 -1.51 0.00 0.00 179.97 179.20 1mna h ALA 14 N 1.13 0.50 -0.74 2.80 0.00 -0.79 0.02 119.26 122.17 1mna h ALA 14 Ca 0.18 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1mna h ALA 14 Cb 0.03 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1mna h ALA 14 CO -0.03 -0.04 0.27 -0.07 0.00 0.00 0.00 179.25 179.38 1mna h LEU 15 N 0.53 1.04 -0.81 0.00 3.38 -0.42 -2.40 115.31 116.64 1mna h LEU 15 Ca 0.14 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 1mna h LEU 15 Cb -0.06 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.39 1mna h LEU 15 CO -0.03 0.95 0.18 0.15 0.09 0.00 0.00 178.44 179.78 1mna h PHE 16 N 1.08 1.12 -0.31 1.13 3.57 -0.40 0.33 116.94 123.45 1mna h PHE 16 Ca 0.24 -0.12 0.03 0.00 3.53 0.00 0.00 57.97 61.66 1mna h PHE 16 Cb 0.25 -0.32 -0.03 0.00 2.79 0.00 0.00 35.95 38.63 1mna h PHE 16 CO 0.02 0.90 0.11 -0.09 -2.23 0.00 0.00 178.31 177.03 1mna h ARG 17 N 1.03 0.24 -0.64 1.11 9.65 -0.61 -0.70 114.38 124.46 1mna h ARG 17 Ca 0.22 -0.01 -0.08 0.00 -1.10 0.00 0.00 59.98 59.00 1mna h ARG 17 Cb 0.34 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.84 1mna h ARG 17 CO -0.00 0.16 0.07 0.37 2.80 0.00 0.00 179.97 183.37 1mna h GLN 18 N 0.25 1.08 -0.68 0.20 5.75 -1.07 -1.65 115.11 119.00 1mna h GLN 18 Ca 0.14 -0.31 0.03 0.00 -0.15 0.00 0.00 58.65 58.36 1mna h GLN 18 Cb 0.11 -0.12 -0.04 0.00 1.07 0.00 0.00 27.48 28.50 1mna h GLN 18 CO -0.14 1.02 0.42 0.00 -2.65 0.00 0.00 178.83 177.48 1mna h ALA 19 N 1.02 0.88 -0.35 3.38 0.00 -0.32 0.26 119.26 124.13 1mna h ALA 19 Ca 0.19 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1mna h ALA 19 Cb 0.48 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1mna h ALA 19 CO 0.02 0.20 0.10 0.28 0.00 0.00 0.00 179.25 179.84 1mna h VAL 20 N 0.83 1.22 -0.77 0.00 2.07 -0.92 0.38 116.25 119.06 1mna h VAL 20 Ca 0.27 -0.73 0.10 0.00 0.82 0.00 0.00 66.70 67.16 1mna h VAL 20 Cb 0.01 1.02 -0.07 0.00 -1.52 0.00 0.00 31.29 30.73 1mna h VAL 20 CO -0.10 0.25 0.41 -0.33 0.02 0.00 0.00 177.57 177.82 1mna h GLU 21 N 0.42 0.67 -0.21 1.57 5.08 -0.64 -0.29 114.58 121.18 1mna h GLU 21 Ca 0.11 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1mna h GLU 21 Cb 0.28 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1mna h GLU 21 CO -0.00 0.44 0.00 -0.25 -1.00 0.00 0.00 179.01 178.20 1mna n ASP 22 N -4.81 1.14 -3.62 1.42 10.43 0.02 -4.92 116.55 116.21 1mna n ASP 22 Ca 0.13 -1.99 -0.21 0.00 2.57 0.00 0.00 54.79 55.29 1mna n ASP 22 Cb 0.28 -0.14 0.05 0.00 1.84 0.00 0.00 41.12 43.16 1mna n ASP 22 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 1mna n ASP 23 N 0.12 -1.86 -2.46 -2.24 2.03 -0.12 -4.93 116.55 107.08 1mna n ASP 23 Ca 0.07 -0.74 -0.15 0.00 0.52 0.00 0.00 54.79 54.49 1mna n ASP 23 Cb 0.18 -4.43 0.03 0.00 -0.72 0.00 0.00 41.12 36.18 1mna n ASP 23 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1mna n ARG 24 N -4.28 2.59 0.11 -0.67 1.74 0.12 -4.90 116.66 111.37 1mna n ARG 24 Ca -0.26 -3.88 -0.12 0.00 -0.77 0.00 0.00 57.85 52.81 1mna n ARG 24 Cb 0.66 -1.90 -0.06 0.00 -1.02 0.00 0.00 32.46 30.15 1mna n ARG 24 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 1mna h TYR 25 N 2.53 -0.49 -0.50 -1.55 5.03 -1.90 -1.97 116.97 118.11 1mna h TYR 25 Ca 0.12 0.01 0.06 0.00 2.58 0.00 0.00 58.73 61.51 1mna h TYR 25 Cb 1.28 0.20 -0.06 0.00 1.55 0.00 0.00 36.73 39.70 1mna h TYR 25 CO 0.68 -0.28 0.20 0.78 -1.32 0.00 0.00 178.16 178.22 1mna h GLY 26 N -0.36 0.68 1.00 1.82 0.00 -1.93 -0.51 103.07 103.76 1mna h GLY 26 Ca 0.02 -0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.24 1mna h GLY 26 CO -0.10 0.03 0.34 0.83 0.00 0.00 0.00 176.54 177.64 1mna h GLU 27 N 0.39 0.75 -0.24 4.80 5.08 -1.92 -2.29 114.58 121.15 1mna h GLU 27 Ca 0.24 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.42 1mna h GLU 27 Cb 0.24 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1mna h GLU 27 CO -0.23 0.54 -0.35 0.35 -1.00 0.00 0.00 179.01 178.32 1mna h PHE 28 N 0.75 0.60 -0.45 4.33 3.57 -0.78 -2.12 116.94 122.84 1mna h PHE 28 Ca 0.20 -0.16 0.01 0.00 3.53 0.00 0.00 57.97 61.55 1mna h PHE 28 Cb -0.03 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.55 1mna h PHE 28 CO -0.03 0.80 0.30 -0.07 -2.23 0.00 0.00 178.31 177.08 1mna h LEU 29 N 0.44 0.50 -0.56 0.59 -0.00 -0.79 0.12 115.31 115.61 1mna h LEU 29 Ca 0.05 -0.01 -0.09 0.00 -0.00 0.00 0.00 57.88 57.82 1mna h LEU 29 Cb 0.82 -0.12 -0.02 0.00 -0.00 0.00 0.00 40.66 41.33 1mna h LEU 29 CO 0.07 0.36 -0.02 0.44 -0.00 0.00 0.00 178.44 179.29 1mna h ASP 30 N 0.59 0.99 -0.48 -0.43 3.45 -0.84 -1.40 116.42 118.30 1mna h ASP 30 Ca 0.17 -0.32 -0.02 0.00 0.43 0.00 0.00 57.03 57.30 1mna h ASP 30 Cb -0.03 -0.27 -0.02 0.00 -0.56 0.00 0.00 39.33 38.45 1mna h ASP 30 CO -0.04 1.06 0.24 0.58 -1.57 0.00 0.00 179.24 179.52 1mna h VAL 31 N 0.89 1.18 -0.72 -1.35 2.07 -0.48 -1.28 116.25 116.55 1mna h VAL 31 Ca 0.16 -0.50 0.03 0.00 0.82 0.00 0.00 66.70 67.21 1mna h VAL 31 Cb 0.57 0.63 -0.05 0.00 -1.52 0.00 0.00 31.29 30.92 1mna h VAL 31 CO 0.03 0.20 0.45 -0.07 0.02 0.00 0.00 177.57 178.20 1mna h LEU 32 N 0.64 0.74 -0.43 2.57 3.38 -0.53 0.29 115.31 121.96 1mna h LEU 32 Ca 0.17 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.11 1mna h LEU 32 Cb 0.10 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1mna h LEU 32 CO -0.02 0.51 0.16 0.00 0.09 0.00 0.00 178.44 179.17 1mna h ALA 33 N 1.31 0.57 -0.61 1.53 0.00 -0.94 -0.15 119.26 120.96 1mna h ALA 33 Ca 0.29 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1mna h ALA 33 Cb 0.03 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1mna h ALA 33 CO -0.12 0.19 0.18 0.93 0.00 0.00 0.00 179.25 180.43 1mna h GLU 34 N 0.56 0.96 -0.24 0.00 4.39 -0.80 -2.82 114.58 116.63 1mna h GLU 34 Ca 0.14 -0.22 -0.10 0.00 0.34 0.00 0.00 59.36 59.53 1mna h GLU 34 Cb 0.22 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 1mna h GLU 34 CO -0.01 0.86 -0.28 0.00 -1.16 0.00 0.00 179.01 178.43 1mna h ALA 35 N 1.06 1.08 -0.01 3.43 0.00 -0.77 -2.91 119.26 121.15 1mna h ALA 35 Ca 0.20 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1mna h ALA 35 Cb 0.31 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1mna h ALA 35 CO -0.00 0.57 0.09 0.66 0.00 0.00 0.00 179.25 180.57 1mna h SER 36 N 0.41 0.00 0.45 0.00 4.64 -0.75 -1.57 113.55 116.73 1mna h SER 36 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1mna h SER 36 Cb 0.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 1mna h SER 36 CO 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.01 1mna h ALA 37 N 1.82 1.00 -0.65 5.18 0.00 -1.57 -2.33 119.26 122.72 1mna h ALA 37 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1mna h ALA 37 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1mna h ALA 37 CO -0.00 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.44 1mna n PHE 38 N -2.78 1.67 -4.03 0.00 3.72 -0.59 -4.91 117.46 110.54 1mna n PHE 38 Ca -0.01 -0.64 -0.34 0.00 -0.05 0.00 0.00 57.45 56.41 1mna n PHE 38 Cb 0.17 -0.32 -0.06 0.00 -0.94 0.00 0.00 39.48 38.33 1mna n PHE 38 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1mna s ARG 39 N -2.08 3.25 0.42 -1.08 1.81 -0.88 -5.07 118.95 115.32 1mna s ARG 39 Ca 0.53 -0.34 -0.26 0.00 -1.72 0.00 0.00 55.73 53.94 1mna s ARG 39 Cb 0.36 -3.00 -0.10 0.00 -0.45 0.00 0.00 34.95 31.76 1mna s ARG 39 CO 0.23 0.70 1.40 -2.30 -0.68 0.00 0.00 175.30 174.64 1mna n PRO 40 N 1.44 2.26 -4.23 3.54 -0.02 -1.26 -4.83 135.00 131.90 1mna n PRO 40 Ca -0.15 0.80 -0.13 0.00 -2.02 0.00 0.00 63.50 62.00 1mna n PRO 40 Cb 0.53 -2.56 -0.10 0.00 -0.02 0.00 0.00 33.50 31.35 1mna n PRO 40 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1mna s GLN 41 N -2.28 1.23 -0.13 -0.52 -2.07 -1.26 -1.94 119.66 112.68 1mna s GLN 41 Ca 0.59 -1.64 -0.01 0.00 -1.82 0.00 0.00 55.36 52.47 1mna s GLN 41 Cb -0.48 0.08 -0.02 0.00 -1.09 0.00 0.00 33.01 31.50 1mna s GLN 41 CO 0.59 -0.33 -0.09 -0.59 -1.32 0.00 0.00 175.29 173.55 1mna s PHE 42 N -4.00 2.90 -1.85 9.60 -0.12 -0.35 -4.84 117.98 119.32 1mna s PHE 42 Ca 0.36 -0.46 0.20 0.00 -0.05 0.00 0.00 56.93 56.98 1mna s PHE 42 Cb 0.07 -1.87 0.00 0.00 -0.63 0.00 0.00 43.02 40.59 1mna s PHE 42 CO 0.11 -0.10 1.00 0.00 -0.05 0.00 0.00 175.22 176.18 1mna n ALA 43 N 3.41 3.35 -3.08 1.99 0.00 -1.26 -0.98 120.51 123.94 1mna n ALA 43 Ca -0.18 -0.60 -0.23 0.00 0.00 0.00 0.00 53.44 52.43 1mna n ALA 43 Cb 0.53 -0.70 -0.16 0.00 0.00 0.00 0.00 19.45 19.12 1mna n ALA 43 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1mna s SER 44 N -2.21 1.66 0.43 0.00 0.15 -1.26 -4.93 113.70 107.54 1mna s SER 44 Ca 0.17 -0.27 0.11 0.00 0.70 0.00 0.00 55.95 56.66 1mna s SER 44 Cb 0.16 -0.52 0.98 0.00 -1.71 0.00 0.00 66.02 64.93 1mna s SER 44 CO 0.49 0.09 2.03 1.55 1.20 0.00 0.00 173.24 178.60 1mna h PRO 45 N 6.47 0.42 0.00 5.44 0.13 -1.91 0.43 132.00 142.98 1mna h PRO 45 Ca -0.33 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1mna h PRO 45 Cb 1.17 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1mna h PRO 45 CO 0.48 0.28 0.00 0.93 -0.23 0.00 0.00 178.00 179.46 1mna h GLU 46 N 0.43 0.00 -0.31 0.86 5.08 -1.95 -1.63 114.58 117.06 1mna h GLU 46 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1mna h GLU 46 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1mna h GLU 46 CO -0.05 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 177.96 1mna n ALA 47 N -1.85 2.45 -0.97 3.43 0.00 0.15 -4.99 120.51 118.73 1mna n ALA 47 Ca 0.02 -0.85 -0.33 0.00 0.00 0.00 0.00 53.44 52.27 1mna n ALA 47 Cb 0.24 -0.93 0.12 0.00 0.00 0.00 0.00 19.45 18.88 1mna n ALA 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mna n SER 49 N -2.13 0.00 -4.56 0.00 2.88 -1.26 -5.01 113.62 103.53 1mna n SER 49 Ca 0.10 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.36 1mna n SER 49 Cb 0.52 0.00 0.22 0.00 -0.75 0.00 0.00 64.21 64.20 1mna n SER 49 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 1mna s GLU 50 N 0.02 -0.39 -0.15 -1.46 1.03 -1.26 -4.97 118.70 111.51 1mna s GLU 50 Ca 0.00 0.78 -0.29 0.00 0.03 0.00 0.00 54.97 55.48 1mna s GLU 50 Cb 0.00 -1.62 -0.00 0.00 -0.80 0.00 0.00 34.13 31.70 1mna s GLU 50 CO 0.00 -3.35 1.03 1.03 -1.33 0.00 0.00 175.26 172.64 1mna s ARG 51 N -4.63 4.35 -0.15 -4.83 1.81 -1.26 -4.92 118.95 109.32 1mna s ARG 51 Ca 0.67 1.40 0.14 0.00 -1.72 0.00 0.00 55.73 56.22 1mna s ARG 51 Cb -0.23 -3.59 0.66 0.00 -0.45 0.00 0.00 34.95 31.34 1mna s ARG 51 CO 0.62 -0.45 1.53 1.28 -0.68 0.00 0.00 175.30 177.60 1mna n LEU 52 N 5.56 4.55 -4.67 2.53 4.77 -1.26 -4.95 117.00 123.52 1mna n LEU 52 Ca 0.10 -2.30 -0.49 0.00 -0.03 0.00 0.00 56.01 53.29 1mna n LEU 52 Cb 0.47 -0.59 -0.05 0.00 -2.33 0.00 0.00 43.42 40.92 1mna n LEU 52 CO 0.52 0.64 1.52 0.47 -1.33 0.00 0.00 177.39 179.21 1mna n ASP 53 N 0.75 3.34 -4.76 -1.43 9.92 -1.26 -4.49 116.55 118.62 1mna n ASP 53 Ca 0.23 0.92 -0.39 0.00 -0.53 0.00 0.00 54.79 55.02 1mna n ASP 53 Cb 0.91 -1.36 0.03 0.00 -0.64 0.00 0.00 41.12 40.05 1mna n ASP 53 CO 0.00 0.00 0.00 -2.84 0.13 0.00 0.00 177.20 174.49 1mna s PRO 54 N 4.27 3.40 -0.15 -0.24 0.02 -1.26 -4.80 135.00 136.24 1mna s PRO 54 Ca 0.94 2.31 -0.09 0.00 0.02 0.00 0.00 61.00 64.18 1mna s PRO 54 Cb -0.70 -2.44 -0.05 0.00 0.02 0.00 0.00 34.50 31.33 1mna s PRO 54 CO 0.52 -1.01 0.17 0.08 -0.33 0.00 0.00 177.00 176.43 1mna s VAL 55 N -1.26 5.42 -0.43 3.83 1.01 -0.07 -4.83 120.40 124.07 1mna s VAL 55 Ca 0.67 0.27 -0.25 0.00 0.00 0.00 0.00 61.98 62.67 1mna s VAL 55 Cb -0.42 -3.47 0.02 0.00 0.00 0.00 0.00 36.38 32.52 1mna s VAL 55 CO 0.51 0.52 0.92 -0.22 0.00 0.00 0.00 175.10 176.83 1mna s LEU 56 N -0.32 4.01 -0.02 3.92 2.96 -1.26 -0.45 118.68 127.52 1mna s LEU 56 Ca 0.13 0.24 0.20 0.00 -0.22 0.00 0.00 54.13 54.49 1mna s LEU 56 Cb -0.12 -3.20 -0.28 0.00 0.50 0.00 0.00 46.19 43.09 1mna s LEU 56 CO 0.02 -0.99 0.62 0.18 -1.32 0.00 0.00 176.35 174.86 1mna n LEU 57 N 7.03 0.39 -3.72 -0.68 4.77 0.11 -4.97 117.00 119.93 1mna n LEU 57 Ca 0.06 -0.21 -0.14 0.00 -0.03 0.00 0.00 56.01 55.70 1mna n LEU 57 Cb 0.48 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.48 1mna n LEU 57 CO 0.62 0.10 0.10 0.00 -1.33 0.00 0.00 177.39 176.88 1mna s ALA 58 N -3.22 -1.01 -0.07 -1.18 0.00 -1.17 -4.79 121.76 110.31 1mna s ALA 58 Ca -0.01 0.84 0.03 0.00 0.00 0.00 0.00 51.96 52.81 1mna s ALA 58 Cb 0.14 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.94 1mna s ALA 58 CO 0.85 -0.24 -0.14 0.20 0.00 0.00 0.00 175.76 176.42 1mna s GLY 59 N -0.58 1.52 0.77 0.00 0.00 -1.26 -1.38 107.32 106.40 1mna s GLY 59 Ca -0.07 -0.95 -0.04 0.00 0.00 0.00 0.00 44.72 43.66 1mna s GLY 59 CO 0.03 -0.58 1.06 -0.32 0.00 0.00 0.00 173.10 173.29 1mna s GLY 60 N -0.37 1.76 0.47 0.20 0.00 -1.23 -0.08 107.32 108.08 1mna s GLY 60 Ca 0.04 -1.60 -0.24 0.00 0.00 0.00 0.00 44.72 42.91 1mna s GLY 60 CO 0.02 -0.99 1.38 -1.05 0.00 0.00 0.00 173.10 172.46 1mna n PRO 61 N -3.03 2.03 0.20 2.90 -0.02 -1.26 -4.75 135.00 131.07 1mna n PRO 61 Ca 0.15 0.73 0.10 0.00 -2.02 0.00 0.00 63.50 62.46 1mna n PRO 61 Cb 0.60 -2.56 0.16 0.00 -0.02 0.00 0.00 33.50 31.68 1mna n PRO 61 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1mna h THR 62 N 2.01 0.21 -0.20 3.45 2.02 -1.96 -3.26 112.91 115.17 1mna h THR 62 Ca -0.50 -1.26 0.06 0.00 0.77 0.00 0.00 66.41 65.47 1mna h THR 62 Cb 1.28 2.08 -0.01 0.00 -1.74 0.00 0.00 68.15 69.76 1mna h THR 62 CO 0.60 0.12 0.36 0.44 0.37 0.00 0.00 175.52 177.40 1mna h ASP 63 N 0.00 0.00 -3.40 4.18 3.32 -2.03 -3.38 116.42 115.11 1mna h ASP 63 Ca -0.00 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.70 1mna h ASP 63 Cb 1.07 0.00 -0.37 0.00 0.22 0.00 0.00 39.33 40.25 1mna h ASP 63 CO 0.02 0.00 -0.74 -0.13 -1.72 0.00 0.00 179.24 176.67 1mna s ARG 64 N -4.38 -0.01 -0.45 3.56 1.81 -1.23 -5.06 118.95 113.18 1mna s ARG 64 Ca -0.04 0.28 0.07 0.00 -1.72 0.00 0.00 55.73 54.32 1mna s ARG 64 Cb 0.12 -0.43 0.27 0.00 -0.45 0.00 0.00 34.95 34.47 1mna s ARG 64 CO 0.43 -0.26 0.85 0.00 -0.68 0.00 0.00 175.30 175.64 1mna n ALA 65 N 4.79 -0.14 0.00 2.13 0.00 -1.26 -4.78 120.51 121.26 1mna n ALA 65 Ca -0.14 -2.03 0.00 0.00 0.00 0.00 0.00 53.44 51.27 1mna n ALA 65 Cb 0.50 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.80 1mna n ALA 65 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1mna n GLU 66 N 1.18 0.00 -0.00 0.00 0.00 -1.26 -4.99 120.64 115.56 1mna n GLU 66 Ca 0.12 0.00 0.05 0.00 0.00 0.00 0.00 57.16 57.33 1mna n GLU 66 Cb 0.63 0.00 -0.07 0.00 0.00 0.00 0.00 31.44 32.00 1mna n GLU 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1mna n GLY 67 N -1.39 -0.42 3.72 -1.84 0.00 -1.26 -4.51 105.19 99.50 1mna n GLY 67 Ca 0.00 -0.22 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 1mna n GLY 67 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mna s ARG 68 N -2.64 4.26 0.45 1.61 0.52 -1.26 -4.56 118.95 117.33 1mna s ARG 68 Ca -0.03 2.26 -0.23 0.00 -0.52 0.00 0.00 55.73 57.20 1mna s ARG 68 Cb 0.06 -3.17 -0.08 0.00 0.52 0.00 0.00 34.95 32.28 1mna s ARG 68 CO 0.38 -0.51 1.16 0.00 0.02 0.00 0.00 175.30 176.36 1mna s ALA 69 N 0.87 3.01 0.00 2.13 0.00 -1.26 -4.23 121.76 122.28 1mna s ALA 69 Ca 0.66 0.94 0.01 0.00 0.00 0.00 0.00 51.96 53.56 1mna s ALA 69 Cb -0.41 -3.38 -0.04 0.00 0.00 0.00 0.00 23.12 19.29 1mna s ALA 69 CO 0.34 -0.62 0.04 0.14 0.00 0.00 0.00 175.76 175.65 1mna s VAL 70 N -1.52 4.42 0.03 0.00 -7.23 0.42 -4.72 120.40 111.79 1mna s VAL 70 Ca 0.62 -0.53 -0.21 0.00 -1.81 0.00 0.00 61.98 60.05 1mna s VAL 70 Cb -0.29 -3.00 -0.06 0.00 0.56 0.00 0.00 36.38 33.59 1mna s VAL 70 CO 0.35 0.35 0.63 -0.76 -0.31 0.00 0.00 175.10 175.36 1mna s LEU 71 N -1.69 4.46 -0.23 1.32 1.43 -0.45 -1.42 118.68 122.10 1mna s LEU 71 Ca 0.22 1.26 0.01 0.00 -1.03 0.00 0.00 54.13 54.59 1mna s LEU 71 Cb -0.12 -2.99 0.06 0.00 0.03 0.00 0.00 46.19 43.17 1mna s LEU 71 CO 0.12 0.13 -0.08 -0.69 0.23 0.00 0.00 176.35 176.07 1mna s VAL 72 N -0.44 1.74 -0.13 -1.59 1.01 -0.09 -0.20 120.40 120.70 1mna s VAL 72 Ca 0.32 -1.28 -0.29 0.00 0.00 0.00 0.00 61.98 60.72 1mna s VAL 72 Cb -0.19 -1.91 -0.01 0.00 0.00 0.00 0.00 36.38 34.27 1mna s VAL 72 CO 0.19 -0.01 1.07 -0.83 0.00 0.00 0.00 175.10 175.52 1mna s GLY 73 N 1.31 2.11 -0.50 4.51 0.00 0.24 -0.81 107.32 114.18 1mna s GLY 73 Ca -0.06 0.39 -0.18 0.00 0.00 0.00 0.00 44.72 44.87 1mna s GLY 73 CO -0.06 2.08 0.58 0.00 0.00 0.00 0.00 173.10 175.70 1mna n THR 75 N 5.52 0.80 -1.44 0.00 -1.04 -1.14 -4.58 114.28 112.39 1mna n THR 75 Ca -0.08 -0.20 -0.19 0.00 -2.04 0.00 0.00 64.05 61.54 1mna n THR 75 Cb 0.45 -1.13 0.14 0.00 -1.82 0.00 0.00 70.33 67.97 1mna n THR 75 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1mna n GLY 76 N 2.19 -1.66 0.04 3.41 0.00 -1.26 -4.69 105.19 103.23 1mna n GLY 76 Ca 0.14 -1.65 0.12 0.00 0.00 0.00 0.00 46.02 44.63 1mna n GLY 76 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1mna n THR 77 N -3.39 0.23 -1.65 2.61 -2.24 -1.26 -4.89 114.28 103.69 1mna n THR 77 Ca 0.11 -0.16 -0.59 0.00 -2.27 0.00 0.00 64.05 61.14 1mna n THR 77 Cb 0.38 -0.12 -0.08 0.00 -2.10 0.00 0.00 70.33 68.42 1mna n THR 77 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mna n ALA 78 N -1.69 -1.32 0.36 6.98 0.00 -1.26 -4.40 120.51 119.19 1mna n ALA 78 Ca 0.05 0.49 0.11 0.00 0.00 0.00 0.00 53.44 54.08 1mna n ALA 78 Cb 0.40 -2.03 0.48 0.00 0.00 0.00 0.00 19.45 18.29 1mna n ALA 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mna n ALA 79 N 3.60 1.55 1.01 0.00 0.00 -1.26 -1.58 120.51 123.83 1mna n ALA 79 Ca 0.24 0.09 0.12 0.00 0.00 0.00 0.00 53.44 53.89 1mna n ALA 79 Cb 0.09 -1.35 0.12 0.00 0.00 0.00 0.00 19.45 18.31 1mna n ALA 79 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1mna n ASN 80 N -2.15 2.95 -1.52 0.00 6.94 -1.26 -4.68 115.26 115.55 1mna n ASN 80 Ca 0.02 -1.98 0.00 0.00 -0.02 0.00 0.00 54.58 52.59 1mna n ASN 80 Cb 0.19 -0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.60 1mna n ASN 80 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1mna n GLY 81 N 1.35 0.59 0.00 4.83 0.00 -0.61 -4.72 105.19 106.62 1mna n GLY 81 Ca 0.14 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.33 1mna n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mna n GLY 82 N 5.00 0.49 0.34 -0.02 0.00 -1.26 -4.86 105.19 104.87 1mna n GLY 82 Ca 0.00 -1.32 0.18 0.00 0.00 0.00 0.00 46.02 44.89 1mna n GLY 82 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1mna h PRO 83 N 0.00 0.00 0.00 1.61 0.11 -1.99 -2.29 132.00 129.44 1mna h PRO 83 Ca 0.00 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.98 1mna h PRO 83 Cb 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.09 1mna h PRO 83 CO 0.00 0.00 -0.63 0.45 -0.21 0.00 0.00 178.00 177.61 1mna h HIS 84 N 0.00 0.00 -0.91 0.65 3.86 -1.97 -3.40 115.15 113.38 1mna h HIS 84 Ca 0.03 0.00 0.14 0.00 -1.16 0.00 0.00 60.37 59.39 1mna h HIS 84 Cb 0.44 0.00 -0.15 0.00 1.06 0.00 0.00 27.41 28.76 1mna h HIS 84 CO 0.00 0.63 -0.38 1.49 0.86 0.00 0.00 177.93 180.53 1mna h GLU 85 N 0.00 -0.03 -0.60 2.45 4.81 -1.78 -2.18 114.58 117.24 1mna h GLU 85 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1mna h GLU 85 Cb 1.29 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.68 1mna h GLU 85 CO 0.08 -0.02 0.00 1.19 -0.73 0.00 0.00 179.01 179.53 1mna n PHE 86 N -5.46 0.91 0.18 0.92 3.72 -1.26 -4.60 117.46 111.88 1mna n PHE 86 Ca 0.09 -0.42 -0.14 0.00 -0.05 0.00 0.00 57.45 56.92 1mna n PHE 86 Cb 0.39 -0.06 -0.07 0.00 -0.94 0.00 0.00 39.48 38.80 1mna n PHE 86 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1mna h LEU 87 N 3.38 -0.86 -0.23 4.37 4.07 -1.64 0.12 115.31 124.52 1mna h LEU 87 Ca 0.00 0.08 0.01 0.00 0.08 0.00 0.00 57.88 58.05 1mna h LEU 87 Cb 0.92 0.30 -0.01 0.00 1.08 0.00 0.00 40.66 42.94 1mna h LEU 87 CO 0.06 -0.44 0.13 -0.09 -1.08 0.00 0.00 178.44 177.03 1mna h ARG 88 N -0.63 0.27 -0.36 1.13 2.43 -1.81 -2.92 114.38 112.50 1mna h ARG 88 Ca -0.00 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1mna h ARG 88 Cb 0.59 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 1mna h ARG 88 CO -0.09 0.18 0.21 1.25 -1.51 0.00 0.00 179.97 180.00 1mna h LEU 89 N 0.28 0.44 -1.85 3.80 5.85 -1.78 -3.00 115.31 119.04 1mna h LEU 89 Ca 0.09 -0.07 0.16 0.00 0.84 0.00 0.00 57.88 58.90 1mna h LEU 89 Cb -0.01 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 1mna h LEU 89 CO -0.04 0.38 0.45 0.77 -0.34 0.00 0.00 178.44 179.66 1mna h SER 90 N 0.46 0.14 -0.99 1.25 4.64 -0.58 -1.85 113.55 116.62 1mna h SER 90 Ca 0.13 0.01 0.18 0.00 -0.47 0.00 0.00 61.79 61.64 1mna h SER 90 Cb 0.03 -0.02 -0.10 0.00 -0.31 0.00 0.00 62.40 62.00 1mna h SER 90 CO -0.02 0.07 0.60 0.74 -0.87 0.00 0.00 176.83 177.35 1mna h THR 91 N 0.15 0.72 0.00 2.95 2.02 -1.40 0.27 112.91 117.62 1mna h THR 91 Ca 0.31 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 67.23 1mna h THR 91 Cb 1.02 -0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.32 1mna h THR 91 CO -0.05 0.14 0.00 -1.20 0.37 0.00 0.00 175.52 174.79 1mna n SER 92 N -4.77 0.00 0.00 4.18 7.64 -0.70 -2.75 113.62 117.23 1mna n SER 92 Ca 0.22 0.36 0.11 0.00 1.01 0.00 0.00 58.87 60.57 1mna n SER 92 Cb 0.54 -0.44 -0.03 0.00 -1.01 0.00 0.00 64.21 63.27 1mna n SER 92 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1mna n PHE 93 N -1.44 0.03 -1.69 1.43 3.72 0.08 -4.83 117.46 114.76 1mna n PHE 93 Ca 0.06 0.01 -0.44 0.00 -0.05 0.00 0.00 57.45 57.03 1mna n PHE 93 Cb 0.21 -0.12 -0.04 0.00 -0.94 0.00 0.00 39.48 38.59 1mna n PHE 93 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 176.76 177.65 1mna n GLN 94 N -1.59 2.55 -0.99 -1.08 -0.06 -1.11 0.10 117.38 115.20 1mna n GLN 94 Ca 0.04 0.92 0.00 0.00 -2.00 0.00 0.00 57.00 55.96 1mna n GLN 94 Cb 0.36 -2.76 0.00 0.00 -4.06 0.00 0.00 30.24 23.78 1mna n GLN 94 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25 1mna n GLU 95 N 4.52 -0.12 0.01 3.69 -0.58 0.89 -4.82 120.64 124.23 1mna n GLU 95 Ca 0.17 0.03 0.00 0.00 -0.42 0.00 0.00 57.16 56.94 1mna n GLU 95 Cb 0.33 -3.01 0.00 0.00 -0.57 0.00 0.00 31.44 28.19 1mna n GLU 95 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1mna n GLU 96 N -2.45 0.00 -3.73 3.49 -0.58 0.11 -4.13 120.64 113.35 1mna n GLU 96 Ca 0.00 0.00 -0.14 0.00 -0.42 0.00 0.00 57.16 56.60 1mna n GLU 96 Cb 0.03 -0.46 -0.08 0.00 -0.57 0.00 0.00 31.44 30.36 1mna n GLU 96 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1mna s ARG 97 N -2.00 0.70 0.28 3.49 1.81 -0.26 -4.42 118.95 118.56 1mna s ARG 97 Ca 0.00 -0.06 -0.29 0.00 -1.72 0.00 0.00 55.73 53.65 1mna s ARG 97 Cb 0.00 0.32 -0.10 0.00 -0.45 0.00 0.00 34.95 34.72 1mna s ARG 97 CO 0.00 -0.19 1.22 -0.51 -0.68 0.00 0.00 175.30 175.14 1mna s ASP 98 N -1.17 7.00 -0.17 0.23 1.01 -1.26 -3.54 116.67 118.77 1mna s ASP 98 Ca -0.12 2.46 -0.00 0.00 0.71 0.00 0.00 52.55 55.60 1mna s ASP 98 Cb -0.04 -2.63 0.04 0.00 1.01 0.00 0.00 42.92 41.30 1mna s ASP 98 CO 0.05 -0.38 -0.06 0.12 0.21 0.00 0.00 175.17 175.11 1mna s PHE 99 N -0.87 1.83 -0.10 4.23 5.36 -0.48 -1.34 117.98 126.61 1mna s PHE 99 Ca 0.49 -1.17 -0.02 0.00 -0.96 0.00 0.00 56.93 55.27 1mna s PHE 99 Cb -0.36 -1.37 -0.03 0.00 -0.34 0.00 0.00 43.02 40.92 1mna s PHE 99 CO 0.45 -0.64 -0.02 -0.51 -1.46 0.00 0.00 175.22 173.04 1mna s LEU 100 N 1.59 3.41 -0.19 6.12 1.43 0.72 -0.71 118.68 131.04 1mna s LEU 100 Ca 0.01 0.04 -0.04 0.00 -1.03 0.00 0.00 54.13 53.10 1mna s LEU 100 Cb -0.15 -1.78 -0.02 0.00 0.03 0.00 0.00 46.19 44.26 1mna s LEU 100 CO -0.08 0.32 -0.03 0.00 0.23 0.00 0.00 176.35 176.79 1mna s ALA 101 N -0.53 2.93 -0.17 4.21 0.00 0.40 0.82 121.76 129.42 1mna s ALA 101 Ca 0.09 -1.00 -0.07 0.00 0.00 0.00 0.00 51.96 50.98 1mna s ALA 101 Cb -0.12 -1.67 -0.04 0.00 0.00 0.00 0.00 23.12 21.29 1mna s ALA 101 CO 0.02 -0.13 0.05 0.14 0.00 0.00 0.00 175.76 175.84 1mna s VAL 102 N 0.97 4.70 0.65 0.00 -7.23 -0.48 -0.89 120.40 118.13 1mna s VAL 102 Ca 0.01 -0.07 -0.16 0.00 -1.81 0.00 0.00 61.98 59.95 1mna s VAL 102 Cb -0.14 -3.11 -0.01 0.00 0.56 0.00 0.00 36.38 33.68 1mna s VAL 102 CO 0.01 0.48 1.14 -2.84 -0.31 0.00 0.00 175.10 173.58 1mna s PRO 103 N 0.26 2.79 -0.26 4.82 0.02 -1.26 -2.88 135.00 138.49 1mna s PRO 103 Ca 0.03 1.54 -0.14 0.00 0.02 0.00 0.00 61.00 62.45 1mna s PRO 103 Cb -0.12 -1.94 -0.04 0.00 0.02 0.00 0.00 34.50 32.42 1mna s PRO 103 CO 0.01 -1.29 0.32 -1.17 -0.33 0.00 0.00 177.00 174.53 1mna s LEU 104 N -4.66 4.06 0.20 -5.54 2.96 -1.26 -4.85 118.68 109.59 1mna s LEU 104 Ca 0.70 0.25 -0.33 0.00 -0.22 0.00 0.00 54.13 54.54 1mna s LEU 104 Cb -0.24 -2.34 -0.14 0.00 0.50 0.00 0.00 46.19 43.97 1mna s LEU 104 CO 0.39 -0.11 1.42 -2.65 -1.32 0.00 0.00 176.35 174.08 1mna n PRO 105 N 5.00 1.91 0.00 0.98 -0.02 -1.26 -3.45 135.00 138.15 1mna n PRO 105 Ca -0.10 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1mna n PRO 105 Cb 0.51 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 1mna n PRO 105 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mna n GLY 106 N 2.52 0.93 3.69 -1.23 0.00 -1.25 -4.62 105.19 105.23 1mna n GLY 106 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 1mna n GLY 106 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mna s TYR 107 N -2.01 3.35 0.00 1.61 2.02 -1.22 -4.79 117.35 116.30 1mna s TYR 107 Ca 0.00 0.23 0.00 0.00 -0.37 0.00 0.00 57.07 56.93 1mna s TYR 107 Cb 0.00 -2.14 0.00 0.00 -0.40 0.00 0.00 41.96 39.42 1mna s TYR 107 CO 0.00 0.22 0.00 0.41 -1.57 0.00 0.00 175.55 174.61 1mna n GLY 108 N 3.59 0.00 0.00 0.71 0.00 -1.26 -4.94 105.19 103.28 1mna n GLY 108 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1mna n GLY 108 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mna n GLY 114 N 1.82 -3.01 5.25 -0.02 0.00 -1.26 -4.79 105.19 103.18 1mna n GLY 114 Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.37 1mna n GLY 114 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1mna n THR 115 N -1.89 0.00 -1.70 2.61 -1.04 -1.26 -4.93 114.28 106.07 1mna n THR 115 Ca 0.00 0.00 -0.54 0.00 -2.04 0.00 0.00 64.05 61.47 1mna n THR 115 Cb 0.00 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.45 1mna n THR 115 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1mna n ALA 116 N 0.02 0.19 -1.77 2.41 0.00 -1.26 -4.91 120.51 115.19 1mna n ALA 116 Ca 0.00 0.35 -0.39 0.00 0.00 0.00 0.00 53.44 53.40 1mna n ALA 116 Cb 0.00 -2.32 -0.01 0.00 0.00 0.00 0.00 19.45 17.12 1mna n ALA 116 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1mna s LEU 117 N 3.70 4.24 0.11 0.00 1.43 -1.26 -4.83 118.68 122.07 1mna s LEU 117 Ca 0.96 2.57 -0.13 0.00 -1.03 0.00 0.00 54.13 56.50 1mna s LEU 117 Cb -0.93 -3.90 -0.06 0.00 0.03 0.00 0.00 46.19 41.32 1mna s LEU 117 CO 0.60 -0.76 0.49 -0.76 0.23 0.00 0.00 176.35 176.15 1mna s LEU 118 N -2.36 4.36 0.44 1.79 1.43 -0.82 -3.78 118.68 119.74 1mna s LEU 118 Ca 0.56 0.97 -0.25 0.00 -1.03 0.00 0.00 54.13 54.38 1mna s LEU 118 Cb -0.36 -3.11 -0.08 0.00 0.03 0.00 0.00 46.19 42.67 1mna s LEU 118 CO 0.46 0.15 1.30 -2.16 0.23 0.00 0.00 176.35 176.33 1mna s PRO 119 N -1.86 3.81 0.18 1.29 0.04 -1.26 -1.22 135.00 135.98 1mna s PRO 119 Ca 0.35 2.13 -0.10 0.00 0.04 0.00 0.00 61.00 63.42 1mna s PRO 119 Cb -0.15 -2.63 0.09 0.00 0.04 0.00 0.00 34.50 31.85 1mna s PRO 119 CO 0.18 -0.62 1.71 0.00 0.04 0.00 0.00 177.00 178.31 1mna h ALA 120 N 2.40 0.86 -2.73 8.56 0.00 -1.42 -3.45 119.26 123.48 1mna h ALA 120 Ca -0.50 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.07 1mna h ALA 120 Cb 1.25 -0.25 -0.11 0.00 0.00 0.00 0.00 17.79 18.68 1mna h ALA 120 CO 0.61 0.55 -0.30 0.16 0.00 0.00 0.00 179.25 180.28 1mna s ASP 121 N -6.32 0.00 0.13 0.00 1.47 -1.26 -5.07 116.67 105.62 1mna s ASP 121 Ca -0.12 -1.04 -0.18 0.00 1.18 0.00 0.00 52.55 52.38 1mna s ASP 121 Cb 0.14 0.50 -0.03 0.00 -0.34 0.00 0.00 42.92 43.18 1mna s ASP 121 CO 0.83 -1.01 1.78 0.25 0.68 0.00 0.00 175.17 177.71 1mna h LEU 122 N 2.41 0.34 -1.20 2.11 6.46 -1.95 -2.76 115.31 120.73 1mna h LEU 122 Ca -0.30 -0.02 0.16 0.00 -0.12 0.00 0.00 57.88 57.60 1mna h LEU 122 Cb 1.25 -0.09 -0.08 0.00 -0.73 0.00 0.00 40.66 41.01 1mna h LEU 122 CO 0.43 0.26 0.60 0.44 -0.62 0.00 0.00 178.44 179.55 1mna h ASP 123 N 0.39 0.71 -0.51 1.25 3.32 -1.98 0.56 116.42 120.16 1mna h ASP 123 Ca 0.11 0.05 -0.04 0.00 0.02 0.00 0.00 57.03 57.17 1mna h ASP 123 Cb -0.03 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 1mna h ASP 123 CO -0.02 0.33 0.17 0.74 -1.72 0.00 0.00 179.24 178.74 1mna h THR 124 N 0.74 1.23 -0.43 0.35 2.02 -1.86 0.84 112.91 115.79 1mna h THR 124 Ca 0.49 -0.75 -0.05 0.00 0.77 0.00 0.00 66.41 66.86 1mna h THR 124 Cb 0.77 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.92 1mna h THR 124 CO -0.25 0.28 0.06 0.00 0.37 0.00 0.00 175.52 175.97 1mna h ALA 125 N 1.02 0.57 -0.75 6.16 0.00 -1.19 -2.37 119.26 122.70 1mna h ALA 125 Ca 0.17 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1mna h ALA 125 Cb 0.26 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1mna h ALA 125 CO -0.01 0.30 0.49 -0.07 0.00 0.00 0.00 179.25 179.96 1mna h LEU 126 N 0.57 0.84 -0.86 0.00 4.07 -0.61 -1.29 115.31 118.01 1mna h LEU 126 Ca 0.13 -0.01 -0.05 0.00 0.08 0.00 0.00 57.88 58.02 1mna h LEU 126 Cb 0.39 -0.20 -0.03 0.00 1.08 0.00 0.00 40.66 41.90 1mna h LEU 126 CO 0.01 0.60 0.26 0.44 -1.08 0.00 0.00 178.44 178.66 1mna h ASP 127 N 0.99 1.01 -0.52 -0.43 3.32 -0.67 0.13 116.42 120.25 1mna h ASP 127 Ca 0.29 -0.17 -0.03 0.00 0.02 0.00 0.00 57.03 57.14 1mna h ASP 127 Cb -0.07 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.19 1mna h ASP 127 CO -0.08 0.92 0.21 0.00 -1.72 0.00 0.00 179.24 178.58 1mna h ALA 128 N 1.22 0.68 -0.49 3.45 0.00 -0.89 -2.11 119.26 121.11 1mna h ALA 128 Ca 0.24 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1mna h ALA 128 Cb 0.25 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1mna h ALA 128 CO -0.01 0.28 0.03 1.96 0.00 0.00 0.00 179.25 181.51 1mna h GLN 129 N 0.71 0.86 -0.13 0.00 4.20 -0.74 -2.80 115.11 117.20 1mna h GLN 129 Ca 0.18 -0.26 0.04 0.00 0.06 0.00 0.00 58.65 58.66 1mna h GLN 129 Cb 0.19 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.85 1mna h GLN 129 CO -0.02 0.88 -0.09 0.00 -0.67 0.00 0.00 178.83 178.93 1mna h ALA 130 N 0.94 0.01 -0.54 3.87 0.00 -0.52 0.03 119.26 123.05 1mna h ALA 130 Ca 0.14 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.17 1mna h ALA 130 Cb 0.48 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.42 1mna h ALA 130 CO 0.02 -0.54 0.25 -0.09 0.00 0.00 0.00 179.25 178.89 1mna h ARG 131 N -0.10 0.46 -0.62 0.00 2.43 -1.36 -0.09 114.38 115.10 1mna h ARG 131 Ca 0.08 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.17 1mna h ARG 131 Cb 0.22 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.64 1mna h ARG 131 CO -0.19 0.30 0.16 0.00 -1.51 0.00 0.00 179.97 178.73 1mna h ALA 132 N 1.32 0.82 -0.32 2.80 0.00 -1.18 -2.42 119.26 120.29 1mna h ALA 132 Ca 0.25 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1mna h ALA 132 Cb 0.21 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1mna h ALA 132 CO -0.21 0.53 -0.10 0.82 0.00 0.00 0.00 179.25 180.29 1mna h ILE 133 N 0.91 1.28 -0.24 0.00 2.04 -0.45 -2.15 117.51 118.90 1mna h ILE 133 Ca 0.20 -1.17 -0.07 0.00 1.00 0.00 0.00 64.86 64.82 1mna h ILE 133 Cb 0.35 1.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 1mna h ILE 133 CO 0.00 0.38 -0.14 -0.07 0.00 0.00 0.00 178.15 178.32 1mna h LEU 134 N 0.40 0.38 -0.45 1.44 3.38 -1.01 0.12 115.31 119.58 1mna h LEU 134 Ca 0.08 -0.09 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 1mna h LEU 134 Cb 0.61 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1mna h LEU 134 CO 0.04 0.55 -0.31 -0.09 0.09 0.00 0.00 178.44 178.72 1mna h ARG 135 N 0.37 0.96 0.06 1.13 2.43 -1.33 -2.94 114.38 115.06 1mna h ARG 135 Ca 0.07 -0.46 -0.24 0.00 -0.81 0.00 0.00 59.98 58.54 1mna h ARG 135 Cb 0.46 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.00 1mna h ARG 135 CO 0.03 1.13 -1.07 0.00 -1.51 0.00 0.00 179.97 178.55 1mna h ALA 136 N 0.83 0.28 0.00 2.80 0.00 -0.95 -3.32 119.26 118.89 1mna h ALA 136 Ca 0.08 -0.81 -0.15 0.00 0.00 0.00 0.00 54.91 54.03 1mna h ALA 136 Cb 0.89 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1mna h ALA 136 CO 0.08 0.96 -0.69 0.00 0.00 0.00 0.00 179.25 179.60 1mna h ALA 137 N 0.76 0.84 -0.33 0.00 0.00 -0.83 -3.49 119.26 116.21 1mna h ALA 137 Ca -0.09 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.19 1mna h ALA 137 Cb 1.76 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.44 1mna h ALA 137 CO 0.17 0.87 0.00 0.41 0.00 0.00 0.00 179.25 180.70 1mna n GLY 138 N 0.50 1.91 1.00 0.00 0.00 -1.11 -2.49 105.19 104.99 1mna n GLY 138 Ca -0.01 -0.42 0.11 0.00 0.00 0.00 0.00 46.02 45.70 1mna n GLY 138 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1mna n ASP 139 N 7.26 3.17 -4.74 1.61 5.75 -1.26 -4.94 116.55 123.39 1mna n ASP 139 Ca 0.00 -1.94 -0.41 0.00 -0.01 0.00 0.00 54.79 52.44 1mna n ASP 139 Cb 0.00 -0.17 -0.04 0.00 -1.03 0.00 0.00 41.12 39.88 1mna n ASP 139 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1mna s ALA 140 N -1.50 3.37 0.75 2.12 0.00 -1.04 -4.92 121.76 120.53 1mna s ALA 140 Ca 0.32 0.79 -0.14 0.00 0.00 0.00 0.00 51.96 52.94 1mna s ALA 140 Cb 0.20 -3.32 0.05 0.00 0.00 0.00 0.00 23.12 20.05 1mna s ALA 140 CO 0.28 -0.12 1.15 -2.14 0.00 0.00 0.00 175.76 174.94 1mna s PRO 141 N -0.74 2.16 -0.01 0.00 0.02 -1.26 -4.78 135.00 130.38 1mna s PRO 141 Ca 0.47 1.54 0.07 0.00 0.02 0.00 0.00 61.00 63.10 1mna s PRO 141 Cb -0.29 -1.86 -0.02 0.00 0.02 0.00 0.00 34.50 32.35 1mna s PRO 141 CO 0.36 -1.77 -0.24 0.08 -0.33 0.00 0.00 177.00 175.09 1mna s VAL 142 N -2.32 1.90 -0.18 3.83 1.01 -1.26 -0.44 120.40 122.94 1mna s VAL 142 Ca 0.69 -1.05 0.01 0.00 0.00 0.00 0.00 61.98 61.63 1mna s VAL 142 Cb -0.24 -1.58 0.03 0.00 0.00 0.00 0.00 36.38 34.59 1mna s VAL 142 CO 0.48 0.52 -0.15 0.54 0.00 0.00 0.00 175.10 176.49 1mna s VAL 143 N -0.58 1.80 0.22 2.92 0.11 -0.51 0.01 120.40 124.37 1mna s VAL 143 Ca 0.09 -0.90 -0.27 0.00 -2.93 0.00 0.00 61.98 57.98 1mna s VAL 143 Cb -0.09 -1.73 -0.09 0.00 -1.53 0.00 0.00 36.38 32.95 1mna s VAL 143 CO -0.01 0.38 0.85 -0.76 -3.33 0.00 0.00 175.10 172.24 1mna s LEU 144 N 1.37 4.56 -0.02 2.54 1.02 -0.88 -0.91 118.68 126.36 1mna s LEU 144 Ca 0.02 1.76 0.01 0.00 0.02 0.00 0.00 54.13 55.94 1mna s LEU 144 Cb -0.14 -3.52 0.01 0.00 0.02 0.00 0.00 46.19 42.56 1mna s LEU 144 CO -0.10 0.14 -0.03 -0.22 0.02 0.00 0.00 176.35 176.16 1mna s LEU 145 N -1.34 1.58 0.05 1.79 0.20 0.01 0.46 118.68 121.43 1mna s LEU 145 Ca 0.40 -0.08 -0.13 0.00 0.69 0.00 0.00 54.13 55.01 1mna s LEU 145 Cb -0.23 -0.30 0.02 0.00 -0.43 0.00 0.00 46.19 45.25 1mna s LEU 145 CO 0.27 -0.02 0.30 -0.83 -0.29 0.00 0.00 176.35 175.79 1mna s GLY 146 N 0.49 -0.11 -0.14 7.98 0.00 -0.87 0.49 107.32 115.17 1mna s GLY 146 Ca -0.05 -0.05 0.02 0.00 0.00 0.00 0.00 44.72 44.64 1mna s GLY 146 CO -0.00 -0.27 -0.20 -1.58 0.00 0.00 0.00 173.10 171.05 1mna s HIS 147 N -2.72 2.69 0.00 1.90 2.46 -1.26 -0.77 115.29 117.59 1mna s HIS 147 Ca -0.04 -1.14 0.00 0.00 0.47 0.00 0.00 55.06 54.35 1mna s HIS 147 Cb -0.00 -1.82 0.00 0.00 -0.13 0.00 0.00 32.58 30.63 1mna s HIS 147 CO -0.04 -0.50 0.00 0.45 -2.47 0.00 0.00 174.74 172.17 1mna n SER 148 N 3.91 0.00 -0.25 9.88 2.88 0.17 -0.48 113.62 129.73 1mna n SER 148 Ca -0.19 0.00 0.10 0.00 -1.33 0.00 0.00 58.87 57.45 1mna n SER 148 Cb 0.52 0.00 0.36 0.00 -0.75 0.00 0.00 64.21 64.34 1mna n SER 148 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1mna h GLY 149 N 0.00 1.16 2.00 0.46 0.00 -1.91 0.27 103.07 105.05 1mna h GLY 149 Ca 0.00 -0.31 -0.04 0.00 0.00 0.00 0.00 47.33 46.98 1mna h GLY 149 CO 0.00 0.14 -0.19 -1.33 0.00 0.00 0.00 176.54 175.16 1mna h GLY 150 N 0.74 0.00 0.91 4.60 0.00 -1.05 -0.66 103.07 107.60 1mna h GLY 150 Ca 0.41 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.63 1mna h GLY 150 CO -0.18 0.00 -0.27 0.00 0.00 0.00 0.00 176.54 176.09 1mna h ALA 151 N 1.81 0.35 -0.49 3.60 0.00 -0.47 0.14 119.26 124.21 1mna h ALA 151 Ca -0.00 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 1mna h ALA 151 Cb 0.38 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1mna h ALA 151 CO 0.03 0.35 0.27 -0.07 0.00 0.00 0.00 179.25 179.82 1mna h LEU 152 N 0.31 0.61 -1.11 0.00 3.38 -0.85 -2.13 115.31 115.53 1mna h LEU 152 Ca 0.03 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1mna h LEU 152 Cb 0.84 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 1mna h LEU 152 CO 0.07 0.53 0.32 -0.07 0.09 0.00 0.00 178.44 179.38 1mna h LEU 153 N 0.65 0.86 -0.66 1.67 3.38 -0.99 -1.32 115.31 118.89 1mna h LEU 153 Ca 0.17 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1mna h LEU 153 Cb 0.06 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 1mna h LEU 153 CO -0.03 0.73 0.37 0.00 0.09 0.00 0.00 178.44 179.60 1mna h ALA 154 N 1.41 0.84 -0.40 1.53 0.00 -0.14 0.43 119.26 122.92 1mna h ALA 154 Ca 0.23 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 1mna h ALA 154 Cb 0.10 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1mna h ALA 154 CO -0.03 0.35 -0.28 1.25 0.00 0.00 0.00 179.25 180.54 1mna h HIS 155 N 0.90 1.06 -0.75 0.00 -0.00 -0.95 -0.79 115.15 114.62 1mna h HIS 155 Ca 0.23 -0.29 -0.02 0.00 -0.00 0.00 0.00 60.37 60.29 1mna h HIS 155 Cb 0.03 -0.23 -0.04 0.00 -0.00 0.00 0.00 27.41 27.17 1mna h HIS 155 CO -0.01 1.09 0.37 0.93 -0.00 0.00 0.00 177.93 180.31 1mna h GLU 156 N 0.72 1.06 -0.46 5.26 4.39 -0.95 -1.33 114.58 123.27 1mna h GLU 156 Ca 0.08 -0.14 -0.04 0.00 0.34 0.00 0.00 59.36 59.60 1mna h GLU 156 Cb 0.86 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 29.29 1mna h GLU 156 CO 0.08 0.81 0.15 1.25 -1.16 0.00 0.00 179.01 180.14 1mna h LEU 157 N 1.06 0.67 -0.52 1.33 5.85 -0.71 -1.85 115.31 121.14 1mna h LEU 157 Ca 0.26 -0.20 0.04 0.00 0.84 0.00 0.00 57.88 58.82 1mna h LEU 157 Cb 0.09 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 1mna h LEU 157 CO -0.04 0.69 0.28 0.00 -0.34 0.00 0.00 178.44 179.04 1mna h ALA 158 N 1.00 0.67 -0.48 1.25 0.00 -0.56 0.12 119.26 121.26 1mna h ALA 158 Ca 0.15 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1mna h ALA 158 Cb 0.26 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1mna h ALA 158 CO -0.01 -0.04 0.22 0.35 0.00 0.00 0.00 179.25 179.78 1mna h PHE 159 N 0.56 0.70 -0.75 0.00 3.04 -1.07 -1.75 116.94 117.65 1mna h PHE 159 Ca 0.22 -0.04 -0.04 0.00 3.98 0.00 0.00 57.97 62.09 1mna h PHE 159 Cb 0.09 -0.21 -0.03 0.00 2.56 0.00 0.00 35.95 38.35 1mna h PHE 159 CO -0.09 0.56 0.30 -0.09 -2.02 0.00 0.00 178.31 176.98 1mna h ARG 160 N 0.63 1.13 -0.63 1.11 9.65 -0.76 0.15 114.38 125.66 1mna h ARG 160 Ca 0.16 -0.21 0.04 0.00 -1.10 0.00 0.00 59.98 58.88 1mna h ARG 160 Cb 0.13 -0.18 -0.05 0.00 -1.39 0.00 0.00 29.97 28.48 1mna h ARG 160 CO -0.02 0.92 0.37 -0.07 2.80 0.00 0.00 179.97 183.97 1mna h LEU 161 N 1.09 0.58 -0.08 3.80 4.07 -0.50 0.23 115.31 124.50 1mna h LEU 161 Ca 0.25 0.01 -0.06 0.00 0.08 0.00 0.00 57.88 58.16 1mna h LEU 161 Cb 0.22 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 41.85 1mna h LEU 161 CO -0.02 0.39 -0.19 -0.08 -1.08 0.00 0.00 178.44 177.46 1mna h GLU 162 N 0.71 0.28 0.05 1.13 4.81 -0.86 -1.39 114.58 119.30 1mna h GLU 162 Ca 0.26 -0.19 -0.23 0.00 -0.13 0.00 0.00 59.36 59.07 1mna h GLU 162 Cb 0.09 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.49 1mna h GLU 162 CO -0.13 0.79 -1.04 -0.09 -0.73 0.00 0.00 179.01 177.81 1mna h ARG 163 N -0.19 0.26 -0.00 1.92 9.65 -0.59 -3.26 114.38 122.16 1mna h ARG 163 Ca -0.00 -0.34 0.00 0.00 -1.10 0.00 0.00 59.98 58.54 1mna h ARG 163 Cb 0.79 0.11 0.00 0.00 -1.39 0.00 0.00 29.97 29.48 1mna h ARG 163 CO 0.04 1.09 -0.01 0.00 2.80 0.00 0.00 179.97 183.89 1mna n ALA 164 N -2.50 2.44 -0.47 2.80 0.00 0.81 -4.67 120.51 118.93 1mna n ALA 164 Ca -0.06 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 52.96 1mna n ALA 164 Cb 0.90 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 20.29 1mna n ALA 164 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1mna n HIS 165 N -0.12 0.00 -3.34 0.00 8.25 -0.62 -5.00 115.22 114.39 1mna n HIS 165 Ca 0.01 -0.28 -0.22 0.00 -0.26 0.00 0.00 57.72 56.98 1mna n HIS 165 Cb 0.04 -0.03 -0.01 0.00 1.12 0.00 0.00 29.99 31.11 1mna n HIS 165 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1mna n GLY 166 N -0.28 -0.48 2.51 -1.41 0.00 -0.90 -4.90 105.19 99.73 1mna n GLY 166 Ca 0.00 0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.90 1mna n GLY 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mna n ALA 167 N -3.35 1.07 -1.76 4.61 0.00 -0.63 -4.98 120.51 115.47 1mna n ALA 167 Ca -0.00 -2.38 -0.38 0.00 0.00 0.00 0.00 53.44 50.67 1mna n ALA 167 Cb 0.53 -1.03 0.02 0.00 0.00 0.00 0.00 19.45 18.97 1mna n ALA 167 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1mna s PRO 168 N 0.22 3.48 0.90 0.00 0.04 -1.26 -4.04 135.00 134.34 1mna s PRO 168 Ca 0.32 2.12 -0.12 0.00 0.04 0.00 0.00 61.00 63.36 1mna s PRO 168 Cb 0.05 -2.41 0.13 0.00 0.04 0.00 0.00 34.50 32.32 1mna s PRO 168 CO -0.15 -0.88 1.10 -1.25 0.04 0.00 0.00 177.00 175.86 1mna s PRO 169 N -2.71 1.22 0.43 0.56 0.04 -1.26 -4.93 135.00 128.35 1mna s PRO 169 Ca 0.66 0.70 0.28 0.00 0.04 0.00 0.00 61.00 62.68 1mna s PRO 169 Cb -0.37 -1.81 0.90 0.00 0.04 0.00 0.00 34.50 33.25 1mna s PRO 169 CO 0.45 -2.24 1.80 0.00 0.04 0.00 0.00 177.00 177.05 1mna h ALA 170 N -1.54 1.00 -1.40 8.56 0.00 -0.78 -3.43 119.26 121.67 1mna h ALA 170 Ca -0.50 0.00 0.36 0.00 0.00 0.00 0.00 54.91 54.76 1mna h ALA 170 Cb 1.29 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.96 1mna h ALA 170 CO 0.56 0.00 0.90 0.20 0.00 0.00 0.00 179.25 180.91 1mna s GLY 171 N -4.04 -0.41 -0.02 0.00 0.00 -1.24 -4.34 107.32 97.28 1mna s GLY 171 Ca 0.05 0.69 0.00 0.00 0.00 0.00 0.00 44.72 45.46 1mna s GLY 171 CO 0.57 1.01 0.02 -0.42 0.00 0.00 0.00 173.10 174.28 1mna s ILE 172 N -2.23 -0.01 -0.31 0.90 1.01 -0.40 -2.07 121.20 118.10 1mna s ILE 172 Ca 0.17 0.20 -0.09 0.00 0.00 0.00 0.00 60.65 60.93 1mna s ILE 172 Cb 0.05 -0.13 0.00 0.00 0.01 0.00 0.00 42.46 42.40 1mna s ILE 172 CO -0.05 0.11 0.13 -0.69 0.00 0.00 0.00 174.94 174.44 1mna s VAL 173 N 1.11 4.37 -0.39 2.92 1.01 0.17 -1.16 120.40 128.43 1mna s VAL 173 Ca -0.09 -0.57 -0.10 0.00 0.00 0.00 0.00 61.98 61.22 1mna s VAL 173 Cb -0.13 -3.26 0.05 0.00 0.00 0.00 0.00 36.38 33.03 1mna s VAL 173 CO -0.03 0.03 0.21 -0.76 0.00 0.00 0.00 175.10 174.56 1mna s LEU 174 N 1.56 4.82 -0.49 3.92 1.43 0.15 -2.04 118.68 128.03 1mna s LEU 174 Ca 0.04 -1.21 -0.19 0.00 -1.03 0.00 0.00 54.13 51.73 1mna s LEU 174 Cb -0.17 -1.99 0.05 0.00 0.03 0.00 0.00 46.19 44.11 1mna s LEU 174 CO 0.05 -0.44 0.62 -0.69 0.23 0.00 0.00 176.35 176.12 1mna s VAL 175 N 1.48 4.88 -1.20 -1.59 1.01 0.05 -1.12 120.40 123.91 1mna s VAL 175 Ca 0.02 -0.39 -0.05 0.00 0.00 0.00 0.00 61.98 61.56 1mna s VAL 175 Cb -0.21 -4.27 -0.02 0.00 0.00 0.00 0.00 36.38 31.88 1mna s VAL 175 CO 0.04 -0.76 0.82 -0.67 0.00 0.00 0.00 175.10 174.54 1mna n ASP 176 N 6.16 -3.24 -4.78 3.32 2.03 0.81 -0.66 116.55 120.18 1mna n ASP 176 Ca -0.06 -0.79 -0.37 0.00 0.52 0.00 0.00 54.79 54.10 1mna n ASP 176 Cb 0.46 -4.43 -0.06 0.00 -0.72 0.00 0.00 41.12 36.37 1mna n ASP 176 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1mna s PRO 177 N -5.49 4.58 -0.60 -0.67 0.04 -1.26 -3.84 135.00 127.76 1mna s PRO 177 Ca 0.18 1.32 0.05 0.00 0.04 0.00 0.00 61.00 62.59 1mna s PRO 177 Cb -0.04 -2.80 0.17 0.00 0.04 0.00 0.00 34.50 31.87 1mna s PRO 177 CO 0.79 0.28 0.45 0.66 0.04 0.00 0.00 177.00 179.22 1mna n TYR 178 N 0.56 1.77 -1.32 0.56 4.02 -1.26 -1.51 117.16 119.98 1mna n TYR 178 Ca 0.02 -3.95 -0.31 0.00 -0.01 0.00 0.00 57.90 53.65 1mna n TYR 178 Cb 0.50 -0.31 0.08 0.00 -0.02 0.00 0.00 39.34 39.59 1mna n TYR 178 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 1mna s PRO 179 N -0.99 2.37 0.24 -0.72 0.04 -1.26 -4.56 135.00 130.12 1mna s PRO 179 Ca 0.28 1.16 -0.30 0.00 0.04 0.00 0.00 61.00 62.18 1mna s PRO 179 Cb -0.00 -1.91 -0.15 0.00 0.04 0.00 0.00 34.50 32.48 1mna s PRO 179 CO -0.17 -1.56 1.06 -2.30 0.04 0.00 0.00 177.00 174.07 1mna n PRO 180 N -3.41 1.24 0.00 0.56 -0.02 -1.26 -0.81 135.00 131.30 1mna n PRO 180 Ca 0.09 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1mna n PRO 180 Cb 0.53 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 1mna n PRO 180 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mna n GLY 181 N 1.61 1.67 1.08 -1.23 0.00 -1.26 -4.81 105.19 102.25 1mna n GLY 181 Ca 0.12 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.17 1mna n GLY 181 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1mna n HIS 182 N -2.00 0.00 -0.52 1.61 8.25 0.01 -4.89 115.22 117.68 1mna n HIS 182 Ca 0.00 -0.45 0.09 0.00 -0.26 0.00 0.00 57.72 57.10 1mna n HIS 182 Cb 0.00 -0.13 0.30 0.00 1.12 0.00 0.00 29.99 31.28 1mna n HIS 182 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1mna n GLN 183 N 0.16 3.29 -0.18 -0.41 10.64 -1.20 -4.58 117.38 125.09 1mna n GLN 183 Ca 0.06 -2.68 -0.03 0.00 -1.83 0.00 0.00 57.00 52.52 1mna n GLN 183 Cb 0.96 -1.70 0.07 0.00 -0.86 0.00 0.00 30.24 28.71 1mna n GLN 183 CO 0.00 0.00 0.00 1.49 -1.83 0.00 0.00 177.06 176.72 1mna h GLU 184 N 3.52 0.48 -0.49 2.61 4.81 -1.92 -0.97 114.58 122.62 1mna h GLU 184 Ca 0.00 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.25 1mna h GLU 184 Cb 1.22 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 30.45 1mna h GLU 184 CO 0.14 0.32 0.24 -1.35 -0.73 0.00 0.00 179.01 177.62 1mna h PRO 185 N 0.49 0.46 0.00 0.92 0.11 -1.86 0.11 132.00 132.23 1mna h PRO 185 Ca 0.25 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.32 1mna h PRO 185 Cb 0.20 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.21 1mna h PRO 185 CO -0.20 0.30 -0.07 0.97 -0.21 0.00 0.00 178.00 178.79 1mna h ILE 186 N 0.47 0.19 0.20 4.15 6.09 -1.78 -0.66 117.51 126.17 1mna h ILE 186 Ca 0.22 -0.73 -0.32 0.00 -1.37 0.00 0.00 64.86 62.66 1mna h ILE 186 Cb 0.14 1.61 0.02 0.00 0.47 0.00 0.00 36.82 39.06 1mna h ILE 186 CO -0.16 0.07 -1.49 -0.33 -3.07 0.00 0.00 178.15 173.17 1mna h GLU 187 N 0.00 0.41 -0.55 2.19 5.08 -0.33 -2.69 114.58 118.70 1mna h GLU 187 Ca -0.00 -0.71 -0.07 0.00 -1.00 0.00 0.00 59.36 57.58 1mna h GLU 187 Cb 0.61 0.26 -0.02 0.00 0.50 0.00 0.00 28.75 30.10 1mna h GLU 187 CO 0.01 1.32 0.06 0.28 -1.00 0.00 0.00 179.01 179.68 1mna h VAL 188 N 0.11 1.25 -0.44 3.13 2.07 -0.49 -2.20 116.25 119.68 1mna h VAL 188 Ca -0.25 -0.98 -0.10 0.00 0.82 0.00 0.00 66.70 66.19 1mna h VAL 188 Cb 2.09 0.76 -0.06 0.00 -1.52 0.00 0.00 31.29 32.56 1mna h VAL 188 CO 0.23 0.36 0.13 0.79 0.02 0.00 0.00 177.57 179.09 1mna n TRP 189 N -4.23 1.49 -0.16 1.57 8.01 -0.28 -4.51 117.44 119.33 1mna n TRP 189 Ca 0.03 -0.74 0.07 0.00 -1.31 0.00 0.00 57.50 55.55 1mna n TRP 189 Cb 0.28 -0.46 0.37 0.00 -2.01 0.00 0.00 31.31 29.49 1mna n TRP 189 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 1mna h SER 190 N 1.87 0.62 -0.54 -0.99 4.64 -1.04 -2.05 113.55 116.07 1mna h SER 190 Ca 0.13 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.48 1mna h SER 190 Cb 1.66 -0.13 -0.04 0.00 -0.31 0.00 0.00 62.40 63.58 1mna h SER 190 CO 0.43 0.41 0.31 -0.09 -0.87 0.00 0.00 176.83 177.02 1mna h ARG 191 N 0.71 0.59 0.00 4.77 2.43 -1.84 -0.64 114.38 120.40 1mna h ARG 191 Ca 0.29 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.36 1mna h ARG 191 Cb 0.25 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 1mna h ARG 191 CO -0.09 0.39 -0.31 -0.56 -1.51 0.00 0.00 179.97 177.89 1mna h GLN 192 N 0.61 0.00 -0.26 0.20 -0.00 -1.74 0.43 115.11 114.35 1mna h GLN 192 Ca 0.23 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.85 1mna h GLN 192 Cb 0.06 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.53 1mna h GLN 192 CO -0.12 0.31 0.05 -0.07 -0.00 0.00 0.00 178.83 179.00 1mna h LEU 193 N 0.00 0.41 -0.61 0.06 3.38 -0.91 0.92 115.31 118.56 1mna h LEU 193 Ca -0.00 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 1mna h LEU 193 Cb 0.58 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 1mna h LEU 193 CO 0.04 0.56 0.24 1.23 0.09 0.00 0.00 178.44 180.61 1mna h GLY 194 N 0.25 0.98 1.79 0.83 0.00 -0.54 -1.84 103.07 104.54 1mna h GLY 194 Ca 0.08 -0.53 -0.08 0.00 0.00 0.00 0.00 47.33 46.80 1mna h GLY 194 CO 0.00 0.50 -0.29 0.83 0.00 0.00 0.00 176.54 177.58 1mna h GLU 195 N 0.85 0.24 -0.33 4.80 5.08 -0.79 -2.50 114.58 121.94 1mna h GLU 195 Ca 0.20 -0.09 -0.09 0.00 -1.00 0.00 0.00 59.36 58.39 1mna h GLU 195 Cb 0.20 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1mna h GLU 195 CO -0.02 0.52 -0.16 0.78 -1.00 0.00 0.00 179.01 179.13 1mna h GLY 196 N 1.02 0.63 0.89 -3.84 0.00 -0.34 0.11 103.07 101.54 1mna h GLY 196 Ca 0.03 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 46.88 1mna h GLY 196 CO 0.05 0.43 0.08 1.41 0.00 0.00 0.00 176.54 178.51 1mna h LEU 197 N 0.53 0.28 -0.28 3.11 3.38 -0.90 -2.03 115.31 119.39 1mna h LEU 197 Ca 0.09 -0.17 -0.19 0.00 0.09 0.00 0.00 57.88 57.70 1mna h LEU 197 Cb 0.58 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1mna h LEU 197 CO 0.04 0.37 -0.61 -0.26 0.09 0.00 0.00 178.44 178.07 1mna h PHE 198 N 0.17 1.06 0.00 1.13 -1.00 -1.36 -2.88 116.94 114.06 1mna h PHE 198 Ca 0.07 -0.40 0.00 0.00 2.81 0.00 0.00 57.97 60.44 1mna h PHE 198 Cb 0.18 -0.19 0.00 0.00 3.61 0.00 0.00 35.95 39.55 1mna h PHE 198 CO -0.01 1.23 0.00 0.00 -1.61 0.00 0.00 178.31 177.92 1mna n ALA 199 N -2.57 2.18 -0.63 2.45 0.00 0.37 -2.72 120.51 119.58 1mna n ALA 199 Ca -0.05 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1mna n ALA 199 Cb 0.66 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.10 1mna n ALA 199 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mna n GLY 200 N 0.18 -0.41 3.76 0.00 0.00 -0.77 -4.99 105.19 102.96 1mna n GLY 200 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1mna n GLY 200 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1mna s GLU 201 N -0.20 4.76 0.00 1.61 -1.05 -1.10 -4.91 118.70 117.81 1mna s GLU 201 Ca 0.00 1.41 0.22 0.00 -0.15 0.00 0.00 54.97 56.45 1mna s GLU 201 Cb 0.00 -3.15 0.06 0.00 -0.44 0.00 0.00 34.13 30.59 1mna s GLU 201 CO 0.00 0.46 1.10 1.28 0.95 0.00 0.00 175.26 179.05 1mna n LEU 202 N 1.25 2.28 -3.53 1.83 4.77 -1.26 -4.93 117.00 117.42 1mna n LEU 202 Ca -0.01 -0.85 -0.09 0.00 -0.03 0.00 0.00 56.01 55.03 1mna n LEU 202 Cb 0.48 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 1mna n LEU 202 CO 0.48 0.41 0.73 -1.83 -1.33 0.00 0.00 177.39 175.85 1mna s GLU 203 N -2.19 0.73 0.24 3.23 -1.05 -1.26 -5.13 118.70 113.27 1mna s GLU 203 Ca 0.21 -0.17 -0.31 0.00 -0.15 0.00 0.00 54.97 54.55 1mna s GLU 203 Cb 0.18 0.34 -0.11 0.00 -0.44 0.00 0.00 34.13 34.09 1mna s GLU 203 CO 0.45 -0.30 1.56 -1.25 0.95 0.00 0.00 175.26 176.67 1mna s PRO 204 N -2.56 4.18 0.11 -4.83 0.04 -1.26 -4.89 135.00 125.78 1mna s PRO 204 Ca 0.04 2.46 -0.31 0.00 0.04 0.00 0.00 61.00 63.23 1mna s PRO 204 Cb -0.01 -3.08 -0.10 0.00 0.04 0.00 0.00 34.50 31.35 1mna s PRO 204 CO -0.06 -0.59 1.88 -1.33 0.04 0.00 0.00 177.00 176.94 1mna n MET 205 N 2.84 2.85 -2.23 4.56 2.81 -1.26 -4.95 117.12 121.74 1mna n MET 205 Ca 0.10 1.04 -0.34 0.00 -1.81 0.00 0.00 57.70 56.68 1mna n MET 205 Cb 0.38 -2.95 0.00 0.00 -0.71 0.00 0.00 33.22 29.94 1mna n MET 205 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1mna s SER 206 N 3.14 5.77 0.43 7.83 1.04 -1.26 -4.74 113.70 125.91 1mna s SER 206 Ca 0.83 2.07 0.10 0.00 0.48 0.00 0.00 55.95 59.44 1mna s SER 206 Cb -0.46 -2.57 0.94 0.00 0.10 0.00 0.00 66.02 64.03 1mna s SER 206 CO 0.38 -1.18 2.03 0.44 0.98 0.00 0.00 173.24 175.89 1mna h ASP 207 N 1.05 0.26 -0.63 7.02 3.45 -1.93 -1.69 116.42 123.95 1mna h ASP 207 Ca -0.49 -0.02 -0.01 0.00 0.43 0.00 0.00 57.03 56.94 1mna h ASP 207 Cb 1.25 -0.07 -0.03 0.00 -0.56 0.00 0.00 39.33 39.92 1mna h ASP 207 CO 0.57 0.26 0.36 0.00 -1.57 0.00 0.00 179.24 178.87 1mna h ALA 208 N 1.78 0.80 0.00 3.45 0.00 -1.95 -0.89 119.26 122.45 1mna h ALA 208 Ca 0.07 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1mna h ALA 208 Cb 0.11 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1mna h ALA 208 CO -0.00 0.29 -0.68 0.00 0.00 0.00 0.00 179.25 178.86 1mna h ARG 209 N 0.85 0.00 -0.31 0.00 3.08 -1.74 -1.86 114.38 114.40 1mna h ARG 209 Ca 0.22 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.15 1mna h ARG 209 Cb 0.01 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 1mna h ARG 209 CO -0.04 0.68 -0.31 -0.07 -1.07 0.00 0.00 179.97 179.16 1mna h LEU 210 N 0.00 0.67 -0.42 3.04 3.38 -0.98 -0.03 115.31 120.98 1mna h LEU 210 Ca -0.01 -0.27 -0.11 0.00 0.09 0.00 0.00 57.88 57.59 1mna h LEU 210 Cb 1.23 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1mna h LEU 210 CO 0.09 0.94 -0.16 -0.07 0.09 0.00 0.00 178.44 179.32 1mna h LEU 211 N 0.56 0.87 -0.59 1.67 3.38 -0.97 -1.19 115.31 119.04 1mna h LEU 211 Ca 0.07 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 1mna h LEU 211 Cb 0.80 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 1mna h LEU 211 CO 0.07 1.06 0.33 0.00 0.09 0.00 0.00 178.44 179.99 1mna h ALA 212 N 0.83 0.75 -0.80 1.53 0.00 -1.12 -0.21 119.26 120.25 1mna h ALA 212 Ca 0.10 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1mna h ALA 212 Cb 0.71 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1mna h ALA 212 CO 0.05 0.25 0.49 1.98 0.00 0.00 0.00 179.25 182.03 1mna h MET 213 N 0.79 1.08 -0.54 0.00 1.85 -0.78 -1.10 114.93 116.23 1mna h MET 213 Ca 0.21 -0.09 -0.10 0.00 -0.61 0.00 0.00 59.70 59.11 1mna h MET 213 Cb 0.02 -0.23 -0.02 0.00 0.43 0.00 0.00 31.60 31.80 1mna h MET 213 CO -0.04 0.75 -0.04 0.78 -0.40 0.00 0.00 176.91 177.96 1mna h GLY 214 N 1.09 1.04 0.91 1.39 0.00 -0.70 -1.55 103.07 105.25 1mna h GLY 214 Ca 0.29 -0.77 -0.04 0.00 0.00 0.00 0.00 47.33 46.81 1mna h GLY 214 CO -0.06 0.71 0.07 -0.09 0.00 0.00 0.00 176.54 177.17 1mna h ARG 215 N 0.87 0.57 -0.52 4.80 2.43 -0.45 -1.99 114.38 120.09 1mna h ARG 215 Ca 0.15 -0.15 -0.09 0.00 -0.81 0.00 0.00 59.98 59.08 1mna h ARG 215 Cb 0.57 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 1mna h ARG 215 CO 0.03 0.63 -0.05 1.88 -1.51 0.00 0.00 179.97 180.96 1mna h TYR 216 N 0.41 1.00 -0.74 2.20 -1.99 -1.15 -1.20 116.97 115.50 1mna h TYR 216 Ca 0.11 -0.17 0.05 0.00 2.00 0.00 0.00 58.73 60.71 1mna h TYR 216 Cb 0.33 -0.26 -0.05 0.00 2.00 0.00 0.00 36.73 38.75 1mna h TYR 216 CO 0.02 0.92 0.44 0.00 -0.00 0.00 0.00 178.16 179.55 1mna h ALA 217 N 1.10 0.99 -0.57 3.88 0.00 -1.11 0.39 119.26 123.94 1mna h ALA 217 Ca 0.15 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1mna h ALA 217 Cb 0.56 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1mna h ALA 217 CO 0.03 0.17 0.15 -0.09 0.00 0.00 0.00 179.25 179.51 1mna h ARG 218 N 0.83 0.91 -0.40 0.00 9.65 -1.02 -2.48 114.38 121.87 1mna h ARG 218 Ca 0.32 -0.22 0.04 0.00 -1.10 0.00 0.00 59.98 59.02 1mna h ARG 218 Cb 0.13 -0.12 -0.04 0.00 -1.39 0.00 0.00 29.97 28.55 1mna h ARG 218 CO -0.16 0.84 0.16 0.74 2.80 0.00 0.00 179.97 184.36 1mna h PHE 219 N 0.82 0.29 0.00 2.20 0.04 0.03 -2.19 116.94 118.13 1mna h PHE 219 Ca 0.18 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.97 1mna h PHE 219 Cb 0.34 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 38.41 1mna h PHE 219 CO 0.02 0.13 0.00 -0.07 -0.60 0.00 0.00 178.31 177.79 1mna h LEU 220 N 0.34 0.00 0.00 1.54 -0.00 -0.78 -2.14 115.31 114.27 1mna h LEU 220 Ca 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.06 1mna h LEU 220 Cb 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.80 1mna h LEU 220 CO -0.17 0.00 -0.62 0.00 -0.00 0.00 0.00 178.44 177.65 1mna n ALA 221 N -1.87 3.33 -1.50 1.53 0.00 -0.85 -4.82 120.51 116.33 1mna n ALA 221 Ca 0.02 -0.33 -0.29 0.00 0.00 0.00 0.00 53.44 52.84 1mna n ALA 221 Cb 0.25 -1.11 0.12 0.00 0.00 0.00 0.00 19.45 18.70 1mna n ALA 221 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1mna s GLY 222 N -3.31 1.60 -0.08 0.00 0.00 -0.80 -4.97 107.32 99.75 1mna s GLY 222 Ca 0.08 -0.34 -0.30 0.00 0.00 0.00 0.00 44.72 44.16 1mna s GLY 222 CO 0.72 0.15 1.51 -4.14 0.00 0.00 0.00 173.10 171.34 1mna s PRO 223 N -5.18 4.21 -0.42 2.90 0.02 -1.26 -4.95 135.00 130.31 1mna s PRO 223 Ca 0.62 2.00 0.05 0.00 0.02 0.00 0.00 61.00 63.69 1mna s PRO 223 Cb -0.15 -3.87 0.18 0.00 0.02 0.00 0.00 34.50 30.67 1mna s PRO 223 CO 0.54 -0.78 0.40 0.54 -0.33 0.00 0.00 177.00 177.38 1mna n ARG 224 N 6.79 0.25 0.26 5.54 1.74 -1.26 -5.02 116.66 124.98 1mna n ARG 224 Ca 0.16 -3.01 0.13 0.00 -0.77 0.00 0.00 57.85 54.35 1mna n ARG 224 Cb 0.43 -1.62 0.73 0.00 -1.02 0.00 0.00 32.46 30.98 1mna n ARG 224 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1mna h PRO 225 N 5.47 0.00 -6.51 5.56 0.13 -2.05 -3.45 132.00 131.15 1mna h PRO 225 Ca 0.23 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.83 1mna h PRO 225 Cb 0.94 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.10 1mna h PRO 225 CO 0.33 0.11 1.06 0.20 -0.23 0.00 0.00 178.00 179.47 1mna s GLY 226 N -4.19 1.40 -0.15 1.56 0.00 -1.26 -5.00 107.32 99.68 1mna s GLY 226 Ca -0.03 1.38 -0.03 0.00 0.00 0.00 0.00 44.72 46.05 1mna s GLY 226 CO 0.58 3.03 -0.07 0.50 0.00 0.00 0.00 173.10 177.15 1mna s ARG 227 N 2.54 3.58 0.52 2.90 1.81 -1.26 -4.94 118.95 124.09 1mna s ARG 227 Ca 0.78 -0.57 -0.21 0.00 -1.72 0.00 0.00 55.73 54.01 1mna s ARG 227 Cb -0.44 -2.83 -0.06 0.00 -0.45 0.00 0.00 34.95 31.17 1mna s ARG 227 CO 0.35 0.24 1.16 0.45 -0.68 0.00 0.00 175.30 176.81 1mna s SER 228 N 0.34 5.83 0.00 0.23 0.15 -1.26 -4.93 113.70 114.06 1mna s SER 228 Ca -0.06 2.26 0.27 0.00 0.70 0.00 0.00 55.95 59.12 1mna s SER 228 Cb -0.15 -2.59 0.86 0.00 -1.71 0.00 0.00 66.02 62.43 1mna s SER 228 CO 0.04 -1.15 1.63 -1.54 1.20 0.00 0.00 173.24 173.42 1mna n SER 229 N -1.01 0.99 -4.77 5.45 3.41 -1.26 -4.92 113.62 111.51 1mna n SER 229 Ca 0.10 -0.90 -0.40 0.00 -0.26 0.00 0.00 58.87 57.41 1mna n SER 229 Cb 0.50 0.09 -0.01 0.00 -0.26 0.00 0.00 64.21 64.52 1mna n SER 229 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mna s ALA 230 N -2.45 3.32 0.51 7.33 0.00 -1.26 -4.97 121.76 124.25 1mna s ALA 230 Ca 0.26 1.18 -0.22 0.00 0.00 0.00 0.00 51.96 53.19 1mna s ALA 230 Cb 0.20 -3.46 -0.06 0.00 0.00 0.00 0.00 23.12 19.80 1mna s ALA 230 CO 0.49 -0.69 1.28 -1.25 0.00 0.00 0.00 175.76 175.59 1mna s PRO 231 N -2.08 3.37 -0.09 0.00 0.04 -1.26 -4.76 135.00 130.22 1mna s PRO 231 Ca 0.54 2.04 0.03 0.00 0.04 0.00 0.00 61.00 63.65 1mna s PRO 231 Cb -0.37 -2.30 -0.01 0.00 0.04 0.00 0.00 34.50 31.86 1mna s PRO 231 CO 0.48 -0.94 -0.21 0.08 0.04 0.00 0.00 177.00 176.45 1mna s VAL 232 N -1.41 2.40 -0.26 -0.36 1.01 -1.26 -1.27 120.40 119.25 1mna s VAL 232 Ca 0.69 -0.91 -0.08 0.00 0.00 0.00 0.00 61.98 61.67 1mna s VAL 232 Cb -0.35 -1.93 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 1mna s VAL 232 CO 0.42 0.56 0.09 -0.22 0.00 0.00 0.00 175.10 175.95 1mna s LEU 233 N 0.13 3.58 -0.31 3.92 2.96 -0.31 -0.40 118.68 128.25 1mna s LEU 233 Ca -0.10 -0.24 -0.11 0.00 -0.22 0.00 0.00 54.13 53.45 1mna s LEU 233 Cb -0.16 -1.95 -0.03 0.00 0.50 0.00 0.00 46.19 44.55 1mna s LEU 233 CO 0.06 -0.06 0.20 -0.22 -1.32 0.00 0.00 176.35 175.01 1mna s LEU 234 N 1.62 4.20 -0.22 -0.68 2.96 0.43 -0.67 118.68 126.31 1mna s LEU 234 Ca 0.06 -0.25 -0.07 0.00 -0.22 0.00 0.00 54.13 53.66 1mna s LEU 234 Cb -0.15 -2.10 -0.03 0.00 0.50 0.00 0.00 46.19 44.40 1mna s LEU 234 CO 0.05 -0.14 0.05 -0.69 -1.32 0.00 0.00 176.35 174.30 1mna s VAL 235 N 1.72 4.32 -0.02 1.68 1.01 -0.28 -0.16 120.40 128.68 1mna s VAL 235 Ca 0.06 -0.18 0.07 0.00 0.00 0.00 0.00 61.98 61.93 1mna s VAL 235 Cb -0.17 -2.99 -0.02 0.00 0.00 0.00 0.00 36.38 33.20 1mna s VAL 235 CO 0.10 0.39 -0.22 -0.13 0.00 0.00 0.00 175.10 175.23 1mna s ARG 236 N 1.18 2.19 0.61 2.72 0.52 0.42 -0.14 118.95 126.45 1mna s ARG 236 Ca 0.04 -0.88 -0.17 0.00 -0.52 0.00 0.00 55.73 54.20 1mna s ARG 236 Cb -0.14 -2.14 -0.03 0.00 0.52 0.00 0.00 34.95 33.16 1mna s ARG 236 CO 0.03 0.57 1.11 0.00 0.02 0.00 0.00 175.30 177.03 1mna s ALA 237 N -0.68 2.58 -0.55 2.13 0.00 -1.26 -1.28 121.76 122.70 1mna s ALA 237 Ca 0.11 0.63 0.18 0.00 0.00 0.00 0.00 51.96 52.88 1mna s ALA 237 Cb -0.10 -3.32 -0.23 0.00 0.00 0.00 0.00 23.12 19.47 1mna s ALA 237 CO 0.00 -1.03 0.63 0.43 0.00 0.00 0.00 175.76 175.79 1mna n SER 238 N -1.95 0.83 -4.46 0.00 7.64 -0.68 -4.79 113.62 110.21 1mna n SER 238 Ca 0.11 -0.60 -0.33 0.00 1.01 0.00 0.00 58.87 59.06 1mna n SER 238 Cb 0.52 1.30 -0.13 0.00 -1.01 0.00 0.00 64.21 64.88 1mna n SER 238 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1mna s GLU 239 N -2.89 2.60 0.42 1.43 0.41 -0.46 -4.96 118.70 115.25 1mna s GLU 239 Ca 0.02 -0.70 -0.25 0.00 -0.41 0.00 0.00 54.97 53.63 1mna s GLU 239 Cb 0.13 -2.40 -0.08 0.00 -1.78 0.00 0.00 34.13 30.00 1mna s GLU 239 CO 0.74 0.57 1.22 -2.14 -0.49 0.00 0.00 175.26 175.16 1mna s PRO 240 N -0.59 3.94 0.23 0.39 0.02 -1.26 -4.16 135.00 133.58 1mna s PRO 240 Ca 0.08 1.94 0.11 0.00 0.02 0.00 0.00 61.00 63.16 1mna s PRO 240 Cb -0.11 -2.64 0.14 0.00 0.02 0.00 0.00 34.50 31.90 1mna s PRO 240 CO 0.01 -0.44 1.47 1.25 -0.33 0.00 0.00 177.00 178.96 1mna h LEU 241 N 2.51 0.00 0.00 -5.54 5.85 -1.97 -3.47 115.31 112.69 1mna h LEU 241 Ca -0.49 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.23 1mna h LEU 241 Cb 1.24 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.27 1mna h LEU 241 CO 0.62 0.70 0.00 0.61 -0.34 0.00 0.00 178.44 180.03 1mna n GLY 242 N 0.86 4.46 3.78 3.75 0.00 -1.26 -5.05 105.19 111.72 1mna n GLY 242 Ca 0.00 -1.29 -0.37 0.00 0.00 0.00 0.00 46.02 44.36 1mna n GLY 242 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1mna s ASP 243 N 0.89 6.46 0.08 1.61 2.15 -1.26 -4.96 116.67 121.64 1mna s ASP 243 Ca 0.00 2.18 0.00 0.00 0.43 0.00 0.00 52.55 55.16 1mna s ASP 243 Cb 0.00 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 40.03 1mna s ASP 243 CO 0.00 -0.71 0.00 1.87 -0.17 0.00 0.00 175.17 176.16 1mna n TRP 244 N -0.27 -0.64 -1.50 -5.34 -0.00 -1.26 -4.98 117.44 103.46 1mna n TRP 244 Ca 0.06 0.11 -0.00 0.00 -0.00 0.00 0.00 57.50 57.67 1mna n TRP 244 Cb 0.49 0.47 -0.00 0.00 -0.00 0.00 0.00 31.31 32.27 1mna n TRP 244 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 177.69 178.63 1mna n GLN 245 N -2.80 -0.14 0.15 5.87 7.27 -1.26 -4.61 117.38 121.85 1mna n GLN 245 Ca 0.00 0.59 0.05 0.00 0.07 0.00 0.00 57.00 57.71 1mna n GLN 245 Cb 0.04 -1.09 0.26 0.00 2.41 0.00 0.00 30.24 31.86 1mna n GLN 245 CO 0.00 0.00 0.00 -0.85 0.07 0.00 0.00 177.06 176.28 1mna n GLU 246 N 0.05 0.07 0.20 3.69 -0.00 -1.26 -0.34 120.64 123.05 1mna n GLU 246 Ca -0.01 0.53 0.06 0.00 -0.00 0.00 0.00 57.16 57.73 1mna n GLU 246 Cb 0.02 -2.11 0.42 0.00 -0.00 0.00 0.00 31.44 29.77 1mna n GLU 246 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1mna h GLU 247 N 0.00 0.00 0.00 3.44 5.08 -2.05 -2.95 114.58 118.09 1mna h GLU 247 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1mna h GLU 247 Cb 0.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1mna h GLU 247 CO 0.00 0.33 0.00 -0.09 -1.00 0.00 0.00 179.01 178.25 1mna h ARG 248 N 0.00 0.00 0.00 2.33 9.65 -0.94 -3.49 114.38 121.93 1mna h ARG 248 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1mna h ARG 248 Cb 0.71 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.29 1mna h ARG 248 CO 0.04 0.00 0.00 0.41 2.80 0.00 0.00 179.97 183.22 1mna n GLY 249 N 0.38 -0.56 3.72 2.80 0.00 -1.12 -4.99 105.19 105.43 1mna n GLY 249 Ca 0.02 -2.19 -0.41 0.00 0.00 0.00 0.00 46.02 43.44 1mna n GLY 249 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1mna s ASP 250 N -4.00 7.46 0.02 1.61 -1.08 -1.26 -4.78 116.67 114.64 1mna s ASP 250 Ca 0.00 1.77 0.23 0.00 -0.52 0.00 0.00 52.55 54.03 1mna s ASP 250 Cb 0.00 -2.58 0.09 0.00 -1.46 0.00 0.00 42.92 38.96 1mna s ASP 250 CO 0.00 -0.12 1.09 -2.67 0.52 0.00 0.00 175.17 173.99 1mna n TRP 251 N 3.04 0.09 -0.93 -5.34 4.27 -1.26 -4.96 117.44 112.35 1mna n TRP 251 Ca 0.03 0.03 -0.33 0.00 -3.89 0.00 0.00 57.50 53.34 1mna n TRP 251 Cb 0.49 -0.24 0.14 0.00 -1.36 0.00 0.00 31.31 30.35 1mna n TRP 251 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 1mna n ARG 252 N -1.68 -0.08 -1.33 -2.67 1.74 -1.26 -4.78 116.66 106.60 1mna n ARG 252 Ca 0.04 0.05 -0.33 0.00 -0.77 0.00 0.00 57.85 56.83 1mna n ARG 252 Cb 0.37 -2.38 0.10 0.00 -1.02 0.00 0.00 32.46 29.54 1mna n ARG 252 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1mna s ALA 253 N -2.32 2.05 0.03 7.54 0.00 -1.26 -5.04 121.76 122.76 1mna s ALA 253 Ca 0.70 0.77 -0.03 0.00 0.00 0.00 0.00 51.96 53.40 1mna s ALA 253 Cb -0.27 -3.44 -0.02 0.00 0.00 0.00 0.00 23.12 19.39 1mna s ALA 253 CO 0.54 -1.96 0.03 -1.58 0.00 0.00 0.00 175.76 172.79 1mna s HIS 254 N -2.18 0.25 -0.18 0.00 2.46 -0.57 -4.92 115.29 110.14 1mna s HIS 254 Ca 0.72 -0.54 -0.19 0.00 0.47 0.00 0.00 55.06 55.52 1mna s HIS 254 Cb -0.27 -0.18 0.05 0.00 -0.13 0.00 0.00 32.58 32.05 1mna s HIS 254 CO 0.48 -0.27 0.52 -0.46 -2.47 0.00 0.00 174.74 172.54 1mna s TRP 255 N -2.06 -0.56 0.05 3.88 -0.11 -1.26 -4.45 118.94 114.42 1mna s TRP 255 Ca -0.10 1.35 -0.31 0.00 1.22 0.00 0.00 56.10 58.27 1mna s TRP 255 Cb -0.05 0.20 -0.06 0.00 -1.50 0.00 0.00 33.47 32.06 1mna s TRP 255 CO -0.03 -0.29 1.32 -0.51 -4.62 0.00 0.00 176.95 172.82 1mna s ASP 256 N 0.16 6.93 -0.92 5.86 1.01 -1.26 -4.22 116.67 124.22 1mna s ASP 256 Ca -0.01 2.13 -0.17 0.00 0.71 0.00 0.00 52.55 55.21 1mna s ASP 256 Cb -0.04 -2.57 0.02 0.00 1.01 0.00 0.00 42.92 41.34 1mna s ASP 256 CO 0.01 -0.61 0.57 0.18 0.21 0.00 0.00 175.17 175.53 1mna n LEU 257 N 4.45 -0.76 -4.78 1.23 4.77 -1.26 -4.92 117.00 115.73 1mna n LEU 257 Ca 0.11 -1.03 -0.32 0.00 -0.03 0.00 0.00 56.01 54.74 1mna n LEU 257 Cb 0.44 -1.40 0.05 0.00 -2.33 0.00 0.00 43.42 40.18 1mna n LEU 257 CO 0.57 0.57 0.72 -2.16 -1.33 0.00 0.00 177.39 175.77 1mna s PRO 258 N -6.04 2.85 0.16 3.23 0.04 -1.26 -4.92 135.00 129.06 1mna s PRO 258 Ca 0.24 1.25 -0.11 0.00 0.04 0.00 0.00 61.00 62.42 1mna s PRO 258 Cb -0.13 -1.97 0.03 0.00 0.04 0.00 0.00 34.50 32.47 1mna s PRO 258 CO 0.83 -1.19 1.60 1.25 0.04 0.00 0.00 177.00 179.53 1mna h HIS 259 N -0.16 1.08 -3.35 0.56 -0.00 -1.08 -3.45 115.15 108.75 1mna h HIS 259 Ca -0.46 -0.21 -0.15 0.00 -0.00 0.00 0.00 60.37 59.56 1mna h HIS 259 Cb 1.23 -0.27 -0.22 0.00 -0.00 0.00 0.00 27.41 28.15 1mna h HIS 259 CO 0.57 1.00 -0.45 0.99 -0.00 0.00 0.00 177.93 180.04 1mna s THR 260 N -4.92 0.06 -0.03 6.26 2.01 -0.91 -5.02 115.64 113.08 1mna s THR 260 Ca -0.12 -0.46 0.07 0.00 0.31 0.00 0.00 61.69 61.49 1mna s THR 260 Cb 0.12 -0.42 -0.02 0.00 0.01 0.00 0.00 72.50 72.19 1mna s THR 260 CO 0.85 -0.25 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.60 1mna s VAL 261 N -0.95 1.87 -0.04 3.82 1.01 -1.26 -0.43 120.40 124.42 1mna s VAL 261 Ca -0.10 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 60.89 1mna s VAL 261 Cb -0.05 -1.56 0.02 0.00 0.00 0.00 0.00 36.38 34.78 1mna s VAL 261 CO 0.02 0.53 -0.04 0.00 0.00 0.00 0.00 175.10 175.60 1mna s ALA 262 N -0.44 0.63 -0.17 5.51 0.00 0.78 -4.94 121.76 123.13 1mna s ALA 262 Ca 0.06 -0.05 -0.07 0.00 0.00 0.00 0.00 51.96 51.89 1mna s ALA 262 Cb -0.10 -0.38 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 1mna s ALA 262 CO 0.00 0.01 0.07 -0.51 0.00 0.00 0.00 175.76 175.33 1mna s ASP 263 N 0.80 5.72 0.22 0.00 1.11 -1.26 -0.44 116.67 122.82 1mna s ASP 263 Ca -0.10 0.13 0.09 0.00 0.18 0.00 0.00 52.55 52.85 1mna s ASP 263 Cb -0.13 -1.95 -0.05 0.00 1.07 0.00 0.00 42.92 41.86 1mna s ASP 263 CO 0.00 0.21 -0.16 0.68 1.18 0.00 0.00 175.17 177.08 1mna s VAL 264 N 0.17 1.94 0.83 -1.27 -7.23 -0.40 -4.95 120.40 109.49 1mna s VAL 264 Ca 0.05 -2.24 -0.10 0.00 -1.81 0.00 0.00 61.98 57.88 1mna s VAL 264 Cb -0.12 -2.09 0.09 0.00 0.56 0.00 0.00 36.38 34.82 1mna s VAL 264 CO 0.00 -0.52 1.11 -2.84 -0.31 0.00 0.00 175.10 172.54 1mna s PRO 265 N -3.53 1.72 0.00 4.82 0.02 -1.26 -1.75 135.00 135.02 1mna s PRO 265 Ca 0.24 1.28 0.00 0.00 0.02 0.00 0.00 61.00 62.54 1mna s PRO 265 Cb -0.02 -1.83 0.00 0.00 0.02 0.00 0.00 34.50 32.67 1mna s PRO 265 CO 0.09 -2.05 0.00 0.41 -0.33 0.00 0.00 177.00 175.12 1mna n GLY 266 N -0.67 -0.03 1.45 0.52 0.00 -1.26 -4.27 105.19 100.92 1mna n GLY 266 Ca 0.10 -1.89 -0.08 0.00 0.00 0.00 0.00 46.02 44.14 1mna n GLY 266 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1mna n ASP 267 N -0.50 1.20 -0.33 1.61 5.68 -1.26 -1.36 116.55 121.60 1mna n ASP 267 Ca 0.00 -1.64 0.28 0.00 -0.50 0.00 0.00 54.79 52.93 1mna n ASP 267 Cb 0.00 -0.09 0.53 0.00 -1.14 0.00 0.00 41.12 40.42 1mna n ASP 267 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 1mna h HIS 268 N 0.29 0.85 0.01 2.11 -0.00 -1.92 -1.62 115.15 114.88 1mna h HIS 268 Ca -0.12 0.04 -0.36 0.00 -0.00 0.00 0.00 60.37 59.93 1mna h HIS 268 Cb 0.47 -0.20 -0.05 0.00 -0.00 0.00 0.00 27.41 27.63 1mna h HIS 268 CO 0.00 -0.34 -2.03 1.19 -0.00 0.00 0.00 177.93 176.75 1mna n PHE 269 N -5.17 0.51 0.29 5.26 0.99 -1.26 -4.48 117.46 113.59 1mna n PHE 269 Ca 0.35 0.19 0.17 0.00 -0.00 0.00 0.00 57.45 58.15 1mna n PHE 269 Cb 1.14 -1.05 0.88 0.00 -1.00 0.00 0.00 39.48 39.45 1mna n PHE 269 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.76 178.55 1mna h THR 270 N -0.75 0.29 0.00 4.37 1.35 -1.87 -2.45 112.91 113.86 1mna h THR 270 Ca -0.53 -0.32 -0.01 0.00 -0.55 0.00 0.00 66.41 65.00 1mna h THR 270 Cb 1.59 1.24 -0.00 0.00 -1.73 0.00 0.00 68.15 69.25 1mna h THR 270 CO -0.25 0.05 -0.04 0.00 -0.25 0.00 0.00 175.52 175.03 1mna h MET 271 N 0.00 0.00 -0.02 4.72 -0.00 -1.48 -1.65 114.93 116.50 1mna h MET 271 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1mna h MET 271 Cb 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.84 1mna h MET 271 CO 0.01 0.04 -0.05 -0.12 -0.00 0.00 0.00 176.91 176.79 1mna n MET 272 N -4.17 1.94 0.00 -0.10 0.00 -0.92 -2.61 117.12 111.27 1mna n MET 272 Ca -0.03 -1.45 0.00 0.00 0.00 0.00 0.00 57.70 56.22 1mna n MET 272 Cb 0.13 -1.47 0.00 0.00 0.00 0.00 0.00 33.22 31.88 1mna n MET 272 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1mna n ARG 273 N 0.74 0.00 -0.34 2.12 1.74 -0.68 -4.48 116.66 115.77 1mna n ARG 273 Ca 0.15 0.00 0.16 0.00 -0.77 0.00 0.00 57.85 57.40 1mna n ARG 273 Cb 0.49 0.00 0.38 0.00 -1.02 0.00 0.00 32.46 32.31 1mna n ARG 273 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1mna h ASP 274 N 0.00 0.68 -0.48 0.55 3.32 -1.78 -2.08 116.42 116.64 1mna h ASP 274 Ca 0.00 0.11 -0.21 0.00 0.02 0.00 0.00 57.03 56.95 1mna h ASP 274 Cb 0.00 -0.01 -0.12 0.00 0.22 0.00 0.00 39.33 39.42 1mna h ASP 274 CO 0.00 0.18 0.09 1.41 -1.72 0.00 0.00 179.24 179.21 1mna n HIS 275 N -4.78 1.53 -0.26 4.55 8.25 -0.86 -4.67 115.22 118.98 1mna n HIS 275 Ca 0.25 -1.48 0.01 0.00 -0.26 0.00 0.00 57.72 56.24 1mna n HIS 275 Cb 0.68 -0.56 0.23 0.00 1.12 0.00 0.00 29.99 31.47 1mna n HIS 275 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1mna h ALA 276 N 1.30 1.47 -0.83 -1.41 0.00 -1.11 -2.18 119.26 116.49 1mna h ALA 276 Ca 0.26 -0.05 0.11 0.00 0.00 0.00 0.00 54.91 55.24 1mna h ALA 276 Cb 1.89 -0.30 -0.06 0.00 0.00 0.00 0.00 17.79 19.32 1mna h ALA 276 CO 0.51 0.46 0.54 -1.35 0.00 0.00 0.00 179.25 179.42 1mna h PRO 277 N 1.05 0.69 -0.61 0.00 0.11 -1.83 -0.59 132.00 130.81 1mna h PRO 277 Ca 0.32 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.31 1mna h PRO 277 Cb -0.02 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 30.91 1mna h PRO 277 CO -0.09 0.45 0.07 0.00 -0.21 0.00 0.00 178.00 178.22 1mna h ALA 278 N 1.60 0.96 0.10 -0.75 0.00 -1.74 -0.12 119.26 119.31 1mna h ALA 278 Ca 0.39 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1mna h ALA 278 Cb 0.55 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1mna h ALA 278 CO -0.16 0.64 -0.05 0.28 0.00 0.00 0.00 179.25 179.96 1mna h VAL 279 N 0.95 1.02 -0.99 0.00 2.07 -1.09 -2.12 116.25 116.08 1mna h VAL 279 Ca 0.18 -0.47 0.07 0.00 0.82 0.00 0.00 66.70 67.30 1mna h VAL 279 Cb 0.46 1.33 -0.07 0.00 -1.52 0.00 0.00 31.29 31.48 1mna h VAL 279 CO 0.02 0.12 0.64 0.00 0.02 0.00 0.00 177.57 178.36 1mna h ALA 280 N 0.52 1.39 -0.59 1.67 0.00 -1.00 -0.95 119.26 120.30 1mna h ALA 280 Ca -0.01 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1mna h ALA 280 Cb 0.29 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1mna h ALA 280 CO 0.02 0.40 0.38 1.49 0.00 0.00 0.00 179.25 181.55 1mna h GLU 281 N 1.14 0.74 -0.63 0.00 4.81 -0.85 0.12 114.58 119.92 1mna h GLU 281 Ca 0.44 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.54 1mna h GLU 281 Cb 0.21 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 1mna h GLU 281 CO -0.19 0.49 0.07 0.00 -0.73 0.00 0.00 179.01 178.65 1mna h ALA 282 N 1.23 0.92 0.24 2.92 0.00 -0.64 -1.84 119.26 122.09 1mna h ALA 282 Ca 0.23 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1mna h ALA 282 Cb -0.05 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1mna h ALA 282 CO -0.07 0.66 -0.11 0.28 0.00 0.00 0.00 179.25 180.00 1mna h VAL 283 N 0.98 0.83 -0.59 0.00 2.07 -0.53 -1.47 116.25 117.54 1mna h VAL 283 Ca 0.19 -0.50 0.08 0.00 0.82 0.00 0.00 66.70 67.28 1mna h VAL 283 Cb 0.47 1.12 -0.06 0.00 -1.52 0.00 0.00 31.29 31.30 1mna h VAL 283 CO 0.02 0.11 0.26 -0.07 0.02 0.00 0.00 177.57 177.90 1mna h LEU 284 N -0.58 0.31 -0.91 2.57 3.38 -0.75 0.40 115.31 119.73 1mna h LEU 284 Ca -0.03 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.03 1mna h LEU 284 Cb 0.42 0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.14 1mna h LEU 284 CO 0.05 0.19 0.59 -1.28 0.09 0.00 0.00 178.44 178.09 1mna h SER 285 N 0.47 1.00 -0.28 -0.43 0.87 -1.30 -2.43 113.55 111.45 1mna h SER 285 Ca 0.29 -0.01 -0.13 0.00 -1.23 0.00 0.00 61.79 60.71 1mna h SER 285 Cb 0.30 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 62.02 1mna h SER 285 CO -0.25 0.69 -0.32 -0.25 -0.53 0.00 0.00 176.83 176.17 1mna h TRP 286 N 1.17 0.86 -0.81 2.24 7.01 -0.19 -2.82 115.95 123.41 1mna h TRP 286 Ca 0.36 -0.27 0.05 0.00 2.11 0.00 0.00 58.89 61.13 1mna h TRP 286 Cb -0.03 -0.18 -0.05 0.00 -2.10 0.00 0.00 29.16 26.81 1mna h TRP 286 CO -0.01 1.02 0.53 -0.07 -2.79 0.00 0.00 178.44 177.12 1mna h LEU 287 N 0.45 0.83 -0.28 0.65 3.38 -0.69 0.14 115.31 119.79 1mna h LEU 287 Ca 0.04 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1mna h LEU 287 Cb 0.90 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 1mna h LEU 287 CO 0.08 0.56 0.04 0.44 0.09 0.00 0.00 178.44 179.64 1mna h ASP 288 N 0.95 0.45 -0.16 -0.43 3.45 -1.38 -0.44 116.42 118.85 1mna h ASP 288 Ca 0.33 -0.27 -0.09 0.00 0.43 0.00 0.00 57.03 57.43 1mna h ASP 288 Cb 0.11 -0.12 -0.02 0.00 -0.56 0.00 0.00 39.33 38.74 1mna h ASP 288 CO -0.10 0.60 -0.18 0.00 -1.57 0.00 0.00 179.24 177.98 1mna h ALA 289 N 0.86 1.10 0.00 3.45 0.00 -1.13 -2.81 119.26 120.73 1mna h ALA 289 Ca 0.08 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 1mna h ALA 289 Cb 0.35 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1mna h ALA 289 CO 0.01 0.56 -0.55 0.97 0.00 0.00 0.00 179.25 180.24 1mna h ILE 290 N 0.52 1.14 -0.02 0.00 6.09 -0.59 -3.51 117.51 121.13 1mna h ILE 290 Ca 0.08 -2.06 0.00 0.00 -1.37 0.00 0.00 64.86 61.52 1mna h ILE 290 Cb 0.61 2.20 0.00 0.00 0.47 0.00 0.00 36.82 40.09 1mna h ILE 290 CO 0.04 0.53 0.00 -0.62 -3.07 0.00 0.00 178.15 175.04