#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mkw n GLU 1 N 0.00 0.00 -0.38 1.61 4.07 -1.26 -5.04 120.64 119.64 1mkw n GLU 1 Ca 0.00 0.08 -0.10 0.00 -0.06 0.00 0.00 57.16 57.08 1mkw n GLU 1 Cb 0.00 -0.30 -0.09 0.00 -0.06 0.00 0.00 31.44 31.00 1mkw n GLU 1 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1mkw n ALA 1 N -0.21 -0.57 -1.38 4.31 0.00 -1.26 -3.01 120.51 118.38 1mkw n ALA 1 Ca 0.00 0.76 -0.14 0.00 0.00 0.00 0.00 53.44 54.06 1mkw n ALA 1 Cb 0.10 -0.11 0.18 0.00 0.00 0.00 0.00 19.45 19.62 1mkw n ALA 1 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1mkw n ASP 1 N -5.08 3.28 -4.66 0.00 2.03 -1.26 -5.07 116.55 105.79 1mkw n ASP 1 Ca 0.02 -3.73 -0.34 0.00 0.52 0.00 0.00 54.79 51.27 1mkw n ASP 1 Cb 0.23 -0.73 0.13 0.00 -0.72 0.00 0.00 41.12 40.03 1mkw n ASP 1 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1mkw n GLY 2 N 0.66 0.07 3.20 0.00 0.00 -0.45 -4.73 105.19 103.93 1mkw n GLY 2 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 1mkw n GLY 2 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mkw s LEU 3 N 0.00 5.12 0.08 0.99 1.43 -1.24 -1.62 118.68 123.43 1mkw s LEU 3 Ca 0.00 -1.71 -0.31 0.00 -1.03 0.00 0.00 54.13 51.08 1mkw s LEU 3 Cb 0.00 -1.91 -0.07 0.00 0.03 0.00 0.00 46.19 44.24 1mkw s LEU 3 CO 0.00 -0.53 1.39 -0.13 0.23 0.00 0.00 176.35 177.31 1mkw s ARG 4 N 1.30 4.31 0.01 1.70 0.52 -1.26 -4.82 118.95 120.72 1mkw s ARG 4 Ca 0.04 2.03 0.14 0.00 -0.52 0.00 0.00 55.73 57.42 1mkw s ARG 4 Cb -0.23 -3.37 0.58 0.00 0.52 0.00 0.00 34.95 32.46 1mkw s ARG 4 CO -0.01 -0.47 1.43 -0.35 0.02 0.00 0.00 175.30 175.92 1mkw n PRO 5 N 4.43 0.01 0.00 3.54 -0.04 -1.26 -1.05 135.00 140.62 1mkw n PRO 5 Ca 0.12 0.28 0.09 0.00 -0.04 0.00 0.00 63.50 63.95 1mkw n PRO 5 Cb 0.43 -1.52 0.04 0.00 -0.04 0.00 0.00 33.50 32.41 1mkw n PRO 5 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1mkw n LEU 6 N -1.54 2.16 0.00 1.53 4.32 -1.26 -3.81 117.00 118.40 1mkw n LEU 6 Ca 0.03 -0.87 0.00 0.00 -0.02 0.00 0.00 56.01 55.15 1mkw n LEU 6 Cb 0.16 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.96 1mkw n LEU 6 CO 0.13 0.39 0.00 0.49 -1.22 0.00 0.00 177.39 177.17 1mkw n PHE 7 N 0.45 0.00 -0.34 -1.77 3.72 -1.08 -4.65 117.46 113.80 1mkw n PHE 7 Ca 0.09 0.00 0.23 0.00 -0.05 0.00 0.00 57.45 57.73 1mkw n PHE 7 Cb 0.43 0.00 0.47 0.00 -0.94 0.00 0.00 39.48 39.44 1mkw n PHE 7 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1mkw h GLU 8 N 0.00 0.34 0.00 -1.08 3.07 -1.47 0.59 114.58 116.03 1mkw h GLU 8 Ca 0.00 -0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 58.81 1mkw h GLU 8 Cb 0.00 -0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 27.83 1mkw h GLU 8 CO 0.00 0.22 -0.23 0.87 -1.40 0.00 0.00 179.01 178.48 1mkw h LYS 9 N 0.35 0.00 -0.97 2.33 1.57 -1.31 -2.84 116.57 115.70 1mkw h LYS 9 Ca 0.73 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 59.02 1mkw h LYS 9 Cb 1.64 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 33.66 1mkw h LYS 9 CO -0.59 0.13 0.61 1.63 -0.57 0.00 0.00 179.45 180.66 1mkw n LYS 10 N -3.09 2.41 -3.79 3.15 5.02 0.19 -4.90 118.16 117.14 1mkw n LYS 10 Ca 0.03 -3.02 -0.22 0.00 -2.02 0.00 0.00 58.31 53.07 1mkw n LYS 10 Cb 0.59 -2.18 -0.07 0.00 -0.02 0.00 0.00 35.03 33.35 1mkw n LYS 10 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1mkw n GLN 11 N -1.04 -0.94 -4.35 1.97 7.27 -0.39 -4.89 117.38 115.02 1mkw n GLN 11 Ca 0.58 0.06 -0.18 0.00 0.07 0.00 0.00 57.00 57.52 1mkw n GLN 11 Cb 1.65 -2.48 -0.14 0.00 2.41 0.00 0.00 30.24 31.67 1mkw n GLN 11 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1mkw s VAL 12 N -3.98 0.77 -0.05 1.69 0.11 -0.12 -4.98 120.40 113.85 1mkw s VAL 12 Ca 0.02 -0.55 -0.03 0.00 -2.93 0.00 0.00 61.98 58.48 1mkw s VAL 12 Cb -0.01 -0.67 -0.04 0.00 -1.53 0.00 0.00 36.38 34.13 1mkw s VAL 12 CO 0.71 0.12 0.10 0.00 -3.33 0.00 0.00 175.10 172.70 1mkw s GLN 13 N -0.49 3.22 0.63 1.54 -2.07 -1.26 -3.13 119.66 118.10 1mkw s GLN 13 Ca 0.02 -0.35 -0.16 0.00 -1.82 0.00 0.00 55.36 53.06 1mkw s GLN 13 Cb -0.05 -2.98 -0.02 0.00 -1.09 0.00 0.00 33.01 28.88 1mkw s GLN 13 CO -0.00 0.70 1.10 0.16 -1.32 0.00 0.00 175.29 175.93 1mkw s ASP 14 N -1.44 5.33 0.00 12.60 1.47 -1.26 -4.89 116.67 128.48 1mkw s ASP 14 Ca 0.20 1.99 0.01 0.00 1.18 0.00 0.00 52.55 55.93 1mkw s ASP 14 Cb -0.12 -2.55 0.06 0.00 -0.34 0.00 0.00 42.92 39.96 1mkw s ASP 14 CO 0.10 -1.48 0.29 0.00 0.68 0.00 0.00 175.17 174.76 1mkw n GLN 14 N -2.17 0.19 0.00 2.11 3.00 -1.26 -2.99 117.38 116.26 1mkw n GLN 14 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.09 1mkw n GLN 14 Cb 0.52 -1.08 0.00 0.00 0.00 0.00 0.00 30.24 29.68 1mkw n GLN 14 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.06 179.47 1mkw n THR 14 N -0.58 0.00 0.32 5.09 -1.04 -1.26 -4.84 114.28 111.98 1mkw n THR 14 Ca 0.01 -0.04 0.21 0.00 -2.04 0.00 0.00 64.05 62.18 1mkw n THR 14 Cb 0.00 0.63 1.09 0.00 -1.82 0.00 0.00 70.33 70.23 1mkw n THR 14 CO 0.00 0.00 0.00 1.05 -0.64 0.00 0.00 175.07 175.48 1mkw h GLU 14 N 0.00 0.00 -0.07 -2.82 4.11 -1.92 -1.10 114.58 112.78 1mkw h GLU 14 Ca 0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.37 1mkw h GLU 14 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1mkw h GLU 14 CO 0.00 0.01 -0.24 1.57 0.07 0.00 0.00 179.01 180.42 1mkw h LYS 14 N 0.00 0.12 0.00 1.06 2.10 -1.88 -1.70 116.57 116.27 1mkw h LYS 14 Ca -0.00 -0.03 -0.00 0.00 -2.00 0.00 0.00 60.65 58.61 1mkw h LYS 14 Cb 0.08 -0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 31.40 1mkw h LYS 14 CO 0.00 0.36 -0.02 1.49 -2.00 0.00 0.00 179.45 179.28 1mkw h GLU 14 N 0.11 0.00 0.21 0.07 4.81 -1.56 -1.40 114.58 116.82 1mkw h GLU 14 Ca 0.02 0.00 -0.33 0.00 -0.13 0.00 0.00 59.36 58.92 1mkw h GLU 14 Cb 0.49 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.89 1mkw h GLU 14 CO 0.03 0.02 -1.57 -0.07 -0.73 0.00 0.00 179.01 176.70 1mkw h LEU 14 N 0.00 0.71 -0.57 1.64 4.07 -1.45 -3.23 115.31 116.48 1mkw h LEU 14 Ca -0.00 -0.93 -0.05 0.00 0.08 0.00 0.00 57.88 56.98 1mkw h LEU 14 Cb 0.05 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.54 1mkw h LEU 14 CO 0.00 1.73 0.15 -0.26 -1.08 0.00 0.00 178.44 178.98 1mkw h PHE 14 N 0.08 0.94 0.04 1.13 0.04 -1.13 -2.86 116.94 115.18 1mkw h PHE 14 Ca -0.29 -0.11 0.03 0.00 2.80 0.00 0.00 57.97 60.40 1mkw h PHE 14 Cb 2.09 -0.27 -0.05 0.00 2.20 0.00 0.00 35.95 39.93 1mkw h PHE 14 CO 0.12 0.81 -0.33 0.93 -0.60 0.00 0.00 178.31 179.23 1mkw h GLU 14 N 0.81 -0.49 -0.95 1.51 5.08 -1.41 -0.25 114.58 118.88 1mkw h GLU 14 Ca 0.18 0.03 0.28 0.00 -1.00 0.00 0.00 59.36 58.85 1mkw h GLU 14 Cb 0.33 0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.65 1mkw h GLU 14 CO -0.00 -0.33 0.80 0.66 -1.00 0.00 0.00 179.01 179.14 1mkw h SER 14 N -0.51 0.00 0.62 1.42 4.64 -1.35 1.11 113.55 119.48 1mkw h SER 14 Ca 0.05 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.18 1mkw h SER 14 Cb 0.58 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.65 1mkw h SER 14 CO -0.25 0.00 -0.85 1.88 -0.87 0.00 0.00 176.83 176.74 1mkw h TYR 14 N 0.00 0.23 -0.64 4.77 0.05 -0.83 -2.79 116.97 117.76 1mkw h TYR 14 Ca 0.45 -0.12 -0.33 0.00 0.05 0.00 0.00 58.73 58.78 1mkw h TYR 14 Cb 2.05 -0.03 -0.20 0.00 1.01 0.00 0.00 36.73 39.57 1mkw h TYR 14 CO 0.00 0.93 0.42 0.44 -1.05 0.00 0.00 178.16 178.89 1mkw n ILE 14 N -3.65 2.40 0.00 -2.88 -5.35 0.38 -4.98 119.36 105.29 1mkw n ILE 14 Ca -0.03 -1.22 0.00 0.00 -0.27 0.00 0.00 62.75 61.23 1mkw n ILE 14 Cb 0.79 -0.66 0.00 0.00 -1.74 0.00 0.00 39.64 38.03 1mkw n ILE 14 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1mkw n GLU 14 N -0.54 0.00 -1.05 6.28 1.02 -1.05 -5.06 120.64 120.23 1mkw n GLU 14 Ca 0.38 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 57.17 1mkw n GLU 14 Cb 1.25 0.00 0.02 0.00 -0.02 0.00 0.00 31.44 32.69 1mkw n GLU 14 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1mkw n GLY 14 N 0.00 -3.67 1.60 0.62 0.00 -1.26 -4.61 105.19 97.86 1mkw n GLY 14 Ca 0.00 -0.45 -0.04 0.00 0.00 0.00 0.00 46.02 45.53 1mkw n GLY 14 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1mkw n ARG 15 N 1.86 0.48 0.00 1.61 1.85 -1.26 -2.82 116.66 118.38 1mkw n ARG 15 Ca 0.03 -0.95 0.00 0.00 -1.00 0.00 0.00 57.85 55.92 1mkw n ARG 15 Cb 0.48 1.18 0.00 0.00 -1.05 0.00 0.00 32.46 33.07 1mkw n ARG 15 CO 0.00 0.00 0.00 0.44 -0.01 0.00 0.00 177.63 178.06 1mkw n ILE 16 N -0.23 -0.42 -1.17 8.89 -5.35 -1.26 -5.09 119.36 114.73 1mkw n ILE 16 Ca -0.04 0.00 0.12 0.00 -0.27 0.00 0.00 62.75 62.57 1mkw n ILE 16 Cb 0.25 0.00 -0.06 0.00 -1.74 0.00 0.00 39.64 38.09 1mkw n ILE 16 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 1mkw n VAL 17 N 0.06 -0.50 0.00 7.28 0.24 -1.26 -5.15 118.33 119.00 1mkw n VAL 17 Ca 0.00 0.59 0.00 0.00 -2.04 0.00 0.00 64.34 62.89 1mkw n VAL 17 Cb 0.00 -0.93 0.00 0.00 -1.47 0.00 0.00 33.84 31.44 1mkw n VAL 17 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 1mkw n GLU 18 N -3.87 0.00 -4.08 7.34 0.28 -1.25 -4.99 120.64 114.06 1mkw n GLU 18 Ca -0.06 0.00 -0.16 0.00 -0.16 0.00 0.00 57.16 56.78 1mkw n GLU 18 Cb 0.52 0.00 -0.15 0.00 1.43 0.00 0.00 31.44 33.25 1mkw n GLU 18 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1mkw s GLY 19 N -0.96 0.23 0.00 -1.84 0.00 -1.26 -4.26 107.32 99.23 1mkw s GLY 19 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 44.72 44.61 1mkw s GLY 19 CO 0.00 0.02 0.00 -1.06 0.00 0.00 0.00 173.10 172.06 1mkw n GLN 20 N 3.25 0.00 -2.08 2.90 3.00 -1.08 -5.02 117.38 118.35 1mkw n GLN 20 Ca -0.16 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.42 1mkw n GLN 20 Cb 0.57 0.00 -0.02 0.00 0.00 0.00 0.00 30.24 30.79 1mkw n GLN 20 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1mkw s ASP 21 N -0.80 6.66 0.04 1.08 1.01 -1.26 -1.81 116.67 121.59 1mkw s ASP 21 Ca 0.00 2.71 -0.21 0.00 0.71 0.00 0.00 52.55 55.76 1mkw s ASP 21 Cb 0.00 -2.65 -0.06 0.00 1.01 0.00 0.00 42.92 41.22 1mkw s ASP 21 CO 0.00 -0.61 0.61 0.00 0.21 0.00 0.00 175.17 175.38 1mkw s ALA 22 N -1.16 3.51 0.68 5.23 0.00 -0.66 -4.77 121.76 124.59 1mkw s ALA 22 Ca 0.51 0.07 -0.12 0.00 0.00 0.00 0.00 51.96 52.42 1mkw s ALA 22 Cb -0.40 -2.74 0.00 0.00 0.00 0.00 0.00 23.12 19.98 1mkw s ALA 22 CO 0.53 0.24 1.06 -1.83 0.00 0.00 0.00 175.76 175.76 1mkw s GLU 23 N -0.55 2.99 0.27 0.00 -1.05 -1.26 -4.81 118.70 114.28 1mkw s GLU 23 Ca 0.31 1.00 -0.30 0.00 -0.15 0.00 0.00 54.97 55.84 1mkw s GLU 23 Cb -0.19 -2.00 -0.13 0.00 -0.44 0.00 0.00 34.13 31.37 1mkw s GLU 23 CO 0.19 -1.06 1.29 0.28 0.95 0.00 0.00 175.26 176.91 1mkw n VAL 24 N -2.95 1.38 -0.92 1.83 0.31 -1.26 -2.19 118.33 114.53 1mkw n VAL 24 Ca 0.08 -0.35 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 1mkw n VAL 24 Cb 0.53 -1.36 0.00 0.00 -0.91 0.00 0.00 33.84 32.10 1mkw n VAL 24 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1mkw n GLY 25 N 1.63 0.33 0.34 2.92 0.00 -1.26 -4.90 105.19 104.24 1mkw n GLY 25 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.11 1mkw n GLY 25 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1mkw h LEU 26 N 0.00 0.85 -6.09 0.99 5.85 -1.81 -3.35 115.31 111.74 1mkw h LEU 26 Ca 0.00 -0.06 -0.58 0.00 0.84 0.00 0.00 57.88 58.08 1mkw h LEU 26 Cb 0.34 -0.22 -0.40 0.00 0.37 0.00 0.00 40.66 40.76 1mkw h LEU 26 CO 0.00 0.68 -0.90 -0.24 -0.34 0.00 0.00 178.44 177.64 1mkw n SER 27 N -4.37 1.60 0.00 1.25 2.88 -1.26 -4.95 113.62 108.77 1mkw n SER 27 Ca 0.07 -2.99 0.04 0.00 -1.33 0.00 0.00 58.87 54.66 1mkw n SER 27 Cb 0.09 -0.65 0.23 0.00 -0.75 0.00 0.00 64.21 63.13 1mkw n SER 27 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1mkw n PRO 28 N 1.22 0.22 -0.13 -1.46 -0.04 -1.26 -0.84 135.00 132.71 1mkw n PRO 28 Ca 0.25 0.04 0.08 0.00 -0.04 0.00 0.00 63.50 63.83 1mkw n PRO 28 Cb 0.48 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.58 1mkw n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1mkw n TRP 29 N -1.06 0.34 -2.30 0.54 2.14 -1.14 -0.29 117.44 115.67 1mkw n TRP 29 Ca 0.06 -0.26 -0.42 0.00 2.07 0.00 0.00 57.50 58.95 1mkw n TRP 29 Cb 0.03 -0.01 -0.03 0.00 -0.81 0.00 0.00 31.31 30.50 1mkw n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1mkw s GLN 30 N -1.15 4.39 0.07 -2.67 2.00 -0.02 0.93 119.66 123.21 1mkw s GLN 30 Ca 0.26 1.93 0.07 0.00 -2.00 0.00 0.00 55.36 55.61 1mkw s GLN 30 Cb 0.15 -3.29 -0.03 0.00 0.80 0.00 0.00 33.01 30.65 1mkw s GLN 30 CO 0.21 -0.32 -0.18 0.08 -0.50 0.00 0.00 175.29 174.58 1mkw s VAL 31 N 0.92 1.45 -0.15 1.34 1.01 -0.71 -4.31 120.40 119.95 1mkw s VAL 31 Ca 0.61 -1.28 -0.03 0.00 0.00 0.00 0.00 61.98 61.28 1mkw s VAL 31 Cb -0.33 -1.31 -0.02 0.00 0.00 0.00 0.00 36.38 34.72 1mkw s VAL 31 CO 0.31 -0.00 -0.06 -0.04 0.00 0.00 0.00 175.10 175.30 1mkw s MET 32 N -1.50 3.61 -0.45 2.72 1.00 0.12 -0.98 119.30 123.81 1mkw s MET 32 Ca 0.04 -0.56 -0.17 0.00 0.00 0.00 0.00 55.69 55.00 1mkw s MET 32 Cb -0.09 -2.85 0.04 0.00 0.00 0.00 0.00 34.83 31.93 1mkw s MET 32 CO 0.03 0.24 0.48 -1.17 0.00 0.00 0.00 175.02 174.59 1mkw s LEU 33 N 0.35 5.04 0.06 -0.03 0.20 -0.46 -0.72 118.68 123.11 1mkw s LEU 33 Ca -0.06 -0.86 0.01 0.00 0.69 0.00 0.00 54.13 53.91 1mkw s LEU 33 Cb -0.15 -2.36 -0.04 0.00 -0.43 0.00 0.00 46.19 43.21 1mkw s LEU 33 CO 0.04 -0.68 0.13 -0.36 -0.29 0.00 0.00 176.35 175.19 1mkw s PHE 34 N 2.17 3.33 -0.24 5.38 0.40 0.15 -0.14 117.98 129.03 1mkw s PHE 34 Ca 0.11 0.16 -0.26 0.00 -0.60 0.00 0.00 56.93 56.35 1mkw s PHE 34 Cb -0.19 -1.69 0.00 0.00 0.51 0.00 0.00 43.02 41.65 1mkw s PHE 34 CO 0.12 0.55 0.89 0.50 0.70 0.00 0.00 175.22 177.99 1mkw s ARG 35 N -2.37 4.19 0.18 0.44 3.52 0.27 -1.23 118.95 123.95 1mkw s ARG 35 Ca 0.31 1.05 -0.25 0.00 -0.13 0.00 0.00 55.73 56.71 1mkw s ARG 35 Cb -0.12 -3.65 0.05 0.00 -1.56 0.00 0.00 34.95 29.67 1mkw s ARG 35 CO 0.24 -0.57 1.56 -0.22 -0.81 0.00 0.00 175.30 175.50 1mkw h LYS 36 N 7.65 -0.17 -2.30 5.12 3.64 -0.91 -3.03 116.57 126.57 1mkw h LYS 36 Ca -0.22 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.14 1mkw h LYS 36 Cb 1.08 0.04 -0.24 0.00 -0.41 0.00 0.00 32.23 32.70 1mkw h LYS 36 CO 0.91 -0.12 -0.17 0.45 -2.27 0.00 0.00 179.45 178.25 1mkw s SER 36 N -5.21 -0.73 0.21 4.20 0.15 -1.26 -3.71 113.70 107.35 1mkw s SER 36 Ca -0.14 1.23 -0.30 0.00 0.70 0.00 0.00 55.95 57.45 1mkw s SER 36 Cb 0.14 1.30 -0.08 0.00 -1.71 0.00 0.00 66.02 65.66 1mkw s SER 36 CO 0.66 -0.22 1.23 -2.16 1.20 0.00 0.00 173.24 173.95 1mkw s PRO 37 N 1.88 4.47 0.25 5.44 0.04 -1.26 -5.05 135.00 140.77 1mkw s PRO 37 Ca -0.08 1.94 -0.31 0.00 0.04 0.00 0.00 61.00 62.59 1mkw s PRO 37 Cb -0.08 -3.21 -0.12 0.00 0.04 0.00 0.00 34.50 31.12 1mkw s PRO 37 CO -0.16 -0.11 1.57 1.04 0.04 0.00 0.00 177.00 179.38 1mkw n GLN 38 N 2.31 2.51 -3.61 4.56 6.02 -1.24 -4.77 117.38 123.16 1mkw n GLN 38 Ca 0.04 0.89 -0.12 0.00 -0.01 0.00 0.00 57.00 57.81 1mkw n GLN 38 Cb 0.44 -2.66 -0.06 0.00 1.02 0.00 0.00 30.24 28.98 1mkw n GLN 38 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 1mkw s GLU 39 N -0.08 0.66 0.22 -1.09 -1.05 -1.14 -4.95 118.70 111.26 1mkw s GLU 39 Ca 0.68 0.52 -0.30 0.00 -0.15 0.00 0.00 54.97 55.72 1mkw s GLU 39 Cb -0.55 0.32 -0.09 0.00 -0.44 0.00 0.00 34.13 33.37 1mkw s GLU 39 CO 0.45 -0.13 1.35 -1.17 0.95 0.00 0.00 175.26 176.70 1mkw s LEU 40 N -0.25 4.41 -0.21 1.83 2.96 -1.26 -0.57 118.68 125.59 1mkw s LEU 40 Ca -0.00 2.48 -0.10 0.00 -0.22 0.00 0.00 54.13 56.29 1mkw s LEU 40 Cb -0.03 -3.61 -0.09 0.00 0.50 0.00 0.00 46.19 42.95 1mkw s LEU 40 CO -0.01 -0.58 -0.27 0.18 -1.32 0.00 0.00 176.35 174.36 1mkw n LEU 41 N 2.52 1.51 0.00 -0.68 4.32 0.80 -4.87 117.00 120.60 1mkw n LEU 41 Ca 0.06 0.24 -0.08 0.00 -0.02 0.00 0.00 56.01 56.22 1mkw n LEU 41 Cb 0.42 -0.62 0.03 0.00 -1.62 0.00 0.00 43.42 41.63 1mkw n LEU 41 CO 0.59 0.45 0.51 0.00 -1.22 0.00 0.00 177.39 177.71 1mkw s GLY 43 N -2.95 1.88 0.00 0.00 0.00 0.21 -1.36 107.32 105.10 1mkw s GLY 43 Ca 0.15 -1.79 0.00 0.00 0.00 0.00 0.00 44.72 43.08 1mkw s GLY 43 CO 0.11 -1.52 0.00 0.00 0.00 0.00 0.00 173.10 171.69 1mkw n ALA 44 N -2.00 0.00 -3.25 3.20 0.00 -0.15 -3.66 120.51 114.65 1mkw n ALA 44 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.41 1mkw n ALA 44 Cb 0.60 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.96 1mkw n ALA 44 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1mkw s SER 45 N 0.05 -0.25 -0.35 0.00 0.01 -0.33 -1.74 113.70 111.10 1mkw s SER 45 Ca 0.00 0.26 -0.17 0.00 1.31 0.00 0.00 55.95 57.35 1mkw s SER 45 Cb 0.00 0.42 -0.01 0.00 0.21 0.00 0.00 66.02 66.64 1mkw s SER 45 CO 0.00 -0.37 0.46 -0.22 0.41 0.00 0.00 173.24 173.52 1mkw s LEU 46 N -0.95 4.39 -0.01 2.44 0.20 0.27 -0.75 118.68 124.27 1mkw s LEU 46 Ca -0.10 -0.11 0.16 0.00 0.69 0.00 0.00 54.13 54.77 1mkw s LEU 46 Cb -0.04 -2.50 -0.20 0.00 -0.43 0.00 0.00 46.19 43.02 1mkw s LEU 46 CO 0.03 -0.44 0.55 2.30 -0.29 0.00 0.00 176.35 178.51 1mkw n ILE 47 N 5.36 0.00 -3.75 6.68 -5.35 -1.14 -1.17 119.36 120.00 1mkw n ILE 47 Ca -0.06 -0.22 -0.09 0.00 -0.27 0.00 0.00 62.75 62.11 1mkw n ILE 47 Cb 0.49 0.66 0.03 0.00 -1.74 0.00 0.00 39.64 39.08 1mkw n ILE 47 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1mkw n SER 48 N -1.64 -2.12 0.00 7.28 3.41 -1.24 -4.55 113.62 114.75 1mkw n SER 48 Ca 0.01 -2.50 0.03 0.00 -0.26 0.00 0.00 58.87 56.14 1mkw n SER 48 Cb 0.31 3.55 0.16 0.00 -0.26 0.00 0.00 64.21 67.97 1mkw n SER 48 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1mkw n ASP 49 N -1.51 0.00 0.00 4.04 5.75 -1.26 -4.10 116.55 119.47 1mkw n ASP 49 Ca -0.08 -1.58 0.00 0.00 -0.01 0.00 0.00 54.79 53.12 1mkw n ASP 49 Cb 0.56 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.65 1mkw n ASP 49 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1mkw n ARG 50 N -0.60 0.00 -4.44 0.11 1.85 -1.26 -0.39 116.66 111.93 1mkw n ARG 50 Ca 0.04 0.00 -0.31 0.00 -1.00 0.00 0.00 57.85 56.58 1mkw n ARG 50 Cb 0.02 -0.06 -0.11 0.00 -1.05 0.00 0.00 32.46 31.26 1mkw n ARG 50 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 1mkw s TRP 51 N 0.00 2.71 -0.01 2.89 0.52 -1.26 -0.46 118.94 123.33 1mkw s TRP 51 Ca 0.00 -0.16 0.02 0.00 0.02 0.00 0.00 56.10 55.98 1mkw s TRP 51 Cb 0.00 -1.49 0.00 0.00 -1.15 0.00 0.00 33.47 30.83 1mkw s TRP 51 CO 0.00 0.35 -0.07 0.08 0.02 0.00 0.00 176.95 177.33 1mkw s VAL 52 N -1.05 0.55 -0.10 4.03 1.01 -0.66 -2.87 120.40 121.30 1mkw s VAL 52 Ca 0.18 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 61.89 1mkw s VAL 52 Cb -0.11 -0.49 -0.02 0.00 0.00 0.00 0.00 36.38 35.76 1mkw s VAL 52 CO 0.09 0.17 -0.10 -0.22 0.00 0.00 0.00 175.10 175.04 1mkw s LEU 53 N 0.04 2.92 0.00 3.92 2.96 0.07 -0.93 118.68 127.67 1mkw s LEU 53 Ca -0.00 -0.19 -0.03 0.00 -0.22 0.00 0.00 54.13 53.69 1mkw s LEU 53 Cb -0.05 -1.65 0.01 0.00 0.50 0.00 0.00 46.19 45.01 1mkw s LEU 53 CO -0.00 0.25 0.41 1.07 -1.32 0.00 0.00 176.35 176.76 1mkw n THR 54 N 2.94 0.00 -3.18 3.68 5.66 -0.34 -1.18 114.28 121.86 1mkw n THR 54 Ca -0.18 -1.23 -0.39 0.00 -3.05 0.00 0.00 64.05 59.20 1mkw n THR 54 Cb 0.53 0.81 -0.06 0.00 -1.55 0.00 0.00 70.33 70.06 1mkw n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1mkw s ALA 55 N -2.36 3.46 0.43 1.79 0.00 -1.26 -0.43 121.76 123.40 1mkw s ALA 55 Ca 0.20 0.04 0.11 0.00 0.00 0.00 0.00 51.96 52.32 1mkw s ALA 55 Cb -0.01 -2.77 0.97 0.00 0.00 0.00 0.00 23.12 21.31 1mkw s ALA 55 CO 0.14 0.13 2.01 0.00 0.00 0.00 0.00 175.76 178.04 1mkw h ALA 56 N 5.81 1.91 0.00 0.00 0.00 -1.71 -2.20 119.26 123.06 1mkw h ALA 56 Ca -0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1mkw h ALA 56 Cb 1.20 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1mkw h ALA 56 CO 0.71 -0.01 0.00 1.12 0.00 0.00 0.00 179.25 181.07 1mkw h HIS 57 N 0.46 0.00 0.00 0.00 2.07 -1.90 0.33 115.15 116.12 1mkw h HIS 57 Ca 0.24 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.74 1mkw h HIS 57 Cb 0.34 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.32 1mkw h HIS 57 CO -0.00 0.00 -0.05 0.00 -3.07 0.00 0.00 177.93 174.81 1mkw n LEU 59 N -3.13 2.04 -3.88 0.00 4.77 -0.10 -4.90 117.00 111.81 1mkw n LEU 59 Ca 0.02 0.22 -0.29 0.00 -0.03 0.00 0.00 56.01 55.93 1mkw n LEU 59 Cb 0.46 -0.77 -0.16 0.00 -2.33 0.00 0.00 43.42 40.62 1mkw n LEU 59 CO 0.32 0.61 -0.41 -0.22 -1.33 0.00 0.00 177.39 176.36 1mkw s LEU 60 N -7.18 1.97 0.13 2.23 2.96 -0.09 -1.43 118.68 117.27 1mkw s LEU 60 Ca -0.35 -0.94 -0.04 0.00 -0.22 0.00 0.00 54.13 52.58 1mkw s LEU 60 Cb 0.13 -0.97 -0.03 0.00 0.50 0.00 0.00 46.19 45.82 1mkw s LEU 60 CO 0.47 -0.23 0.14 -0.47 -1.32 0.00 0.00 176.35 174.94 1mkw s TYR 60 N 1.57 0.60 0.00 5.38 5.04 -0.77 -4.23 117.35 124.93 1mkw s TYR 60 Ca -0.03 -0.99 0.00 0.00 -2.44 0.00 0.00 57.07 53.61 1mkw s TYR 60 Cb -0.17 -0.28 0.00 0.00 0.35 0.00 0.00 41.96 41.85 1mkw s TYR 60 CO -0.07 -0.58 0.00 -2.30 -1.34 0.00 0.00 175.55 171.26 1mkw n PRO 60 N -0.11 0.00 -0.51 4.97 -0.02 -1.26 -2.49 135.00 135.58 1mkw n PRO 60 Ca -0.08 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.49 1mkw n PRO 60 Cb 0.63 -0.26 0.31 0.00 -0.02 0.00 0.00 33.50 34.16 1mkw n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1mkw n TRP 60 N 0.00 1.22 -3.47 6.00 8.01 -1.26 -4.95 117.44 123.00 1mkw n TRP 60 Ca 0.00 -0.62 -0.19 0.00 -1.31 0.00 0.00 57.50 55.38 1mkw n TRP 60 Cb 0.00 -0.20 0.08 0.00 -2.01 0.00 0.00 31.31 29.19 1mkw n TRP 60 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 1mkw n ASP 60 N 0.88 -3.76 -4.32 -0.99 2.03 -1.20 -4.98 116.55 104.21 1mkw n ASP 60 Ca 0.23 -0.57 -0.33 0.00 0.52 0.00 0.00 54.79 54.63 1mkw n ASP 60 Cb 0.80 -4.99 -0.15 0.00 -0.72 0.00 0.00 41.12 36.06 1mkw n ASP 60 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1mkw s LYS 60 N -5.72 3.32 -0.47 -0.67 2.20 -1.04 -5.02 119.74 112.35 1mkw s LYS 60 Ca 0.23 -0.70 0.05 0.00 -0.36 0.00 0.00 55.97 55.19 1mkw s LYS 60 Cb -0.10 -2.69 0.24 0.00 -1.51 0.00 0.00 37.83 33.76 1mkw s LYS 60 CO 0.71 0.07 0.91 -1.71 -0.36 0.00 0.00 175.35 174.98 1mkw n ASN 60 N 3.94 -2.76 -4.75 1.43 5.15 -1.21 -1.85 115.26 115.20 1mkw n ASN 60 Ca -0.18 -3.02 -0.41 0.00 -0.60 0.00 0.00 54.58 50.36 1mkw n ASN 60 Cb 0.52 1.67 -0.02 0.00 -0.53 0.00 0.00 39.78 41.42 1mkw n ASN 60 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1mkw s PHE 60 N 0.66 2.97 0.46 1.20 0.08 -0.51 -5.00 117.98 117.84 1mkw s PHE 60 Ca 0.31 1.05 0.07 0.00 0.12 0.00 0.00 56.93 58.48 1mkw s PHE 60 Cb 0.19 -3.84 0.00 0.00 -0.57 0.00 0.00 43.02 38.80 1mkw s PHE 60 CO -0.20 -2.69 0.40 0.95 -0.10 0.00 0.00 175.22 173.57 1mkw s THR 60 N -0.17 2.30 0.44 0.64 -4.23 -1.26 -4.90 115.64 108.46 1mkw s THR 60 Ca 0.58 -1.39 0.35 0.00 -1.18 0.00 0.00 61.69 60.05 1mkw s THR 60 Cb -0.42 -2.69 0.37 0.00 1.34 0.00 0.00 72.50 71.10 1mkw s THR 60 CO 0.46 0.00 2.17 1.62 -0.54 0.00 0.00 174.62 178.33 1mkw h VAL 61 N 0.92 0.24 0.00 2.29 3.04 -1.94 -0.98 116.25 119.82 1mkw h VAL 61 Ca -0.39 -0.31 0.00 0.00 -1.01 0.00 0.00 66.70 64.99 1mkw h VAL 61 Cb 1.28 1.24 0.00 0.00 -2.01 0.00 0.00 31.29 31.80 1mkw h VAL 61 CO 0.57 0.04 0.00 0.47 -1.01 0.00 0.00 177.57 177.64 1mkw n ASP 62 N -3.34 0.00 0.03 3.17 8.00 -1.26 -3.35 116.55 119.79 1mkw n ASP 62 Ca -0.02 0.08 0.11 0.00 0.71 0.00 0.00 54.79 55.68 1mkw n ASP 62 Cb 0.18 -0.36 -0.09 0.00 -0.02 0.00 0.00 41.12 40.84 1mkw n ASP 62 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1mkw n ASP 63 N -1.36 0.40 -4.48 -2.24 8.00 -0.38 -4.90 116.55 111.60 1mkw n ASP 63 Ca 0.11 -0.03 -0.27 0.00 0.71 0.00 0.00 54.79 55.31 1mkw n ASP 63 Cb 0.27 1.30 -0.11 0.00 -0.02 0.00 0.00 41.12 42.56 1mkw n ASP 63 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1mkw s LEU 64 N -4.49 2.66 0.07 0.64 1.43 -1.21 -0.22 118.68 117.55 1mkw s LEU 64 Ca -0.03 -0.74 0.02 0.00 -1.03 0.00 0.00 54.13 52.36 1mkw s LEU 64 Cb 0.13 -1.38 -0.03 0.00 0.03 0.00 0.00 46.19 44.94 1mkw s LEU 64 CO 0.86 0.12 -0.08 -0.22 0.23 0.00 0.00 176.35 177.25 1mkw s LEU 65 N -2.70 2.38 0.01 1.79 2.96 -0.36 -4.47 118.68 118.28 1mkw s LEU 65 Ca 0.22 -0.77 0.09 0.00 -0.22 0.00 0.00 54.13 53.45 1mkw s LEU 65 Cb -0.08 -0.16 -0.02 0.00 0.50 0.00 0.00 46.19 46.43 1mkw s LEU 65 CO 0.12 -0.31 -0.26 0.68 -1.32 0.00 0.00 176.35 175.25 1mkw s VAL 66 N -2.42 2.10 -0.15 1.68 -7.23 -0.26 0.30 120.40 114.42 1mkw s VAL 66 Ca 0.01 -1.23 -0.01 0.00 -1.81 0.00 0.00 61.98 58.94 1mkw s VAL 66 Cb -0.03 -1.76 -0.01 0.00 0.56 0.00 0.00 36.38 35.14 1mkw s VAL 66 CO -0.02 0.48 -0.12 -0.13 -0.31 0.00 0.00 175.10 175.00 1mkw s ARG 67 N -0.90 3.33 0.16 4.82 0.52 0.10 -1.21 118.95 125.78 1mkw s ARG 67 Ca 0.11 -0.70 0.10 0.00 -0.52 0.00 0.00 55.73 54.72 1mkw s ARG 67 Cb -0.10 -2.69 -0.04 0.00 0.52 0.00 0.00 34.95 32.64 1mkw s ARG 67 CO 0.00 0.08 -0.21 0.42 0.02 0.00 0.00 175.30 175.61 1mkw s ILE 68 N 0.70 2.02 0.00 1.52 1.01 0.05 -0.71 121.20 125.79 1mkw s ILE 68 Ca -0.06 -1.88 0.00 0.00 0.00 0.00 0.00 60.65 58.71 1mkw s ILE 68 Cb -0.15 -1.90 0.00 0.00 0.01 0.00 0.00 42.46 40.41 1mkw s ILE 68 CO 0.02 -0.16 0.00 0.61 0.00 0.00 0.00 174.94 175.40 1mkw n GLY 69 N 0.48 0.48 3.29 6.18 0.00 -1.26 0.11 105.19 114.47 1mkw n GLY 69 Ca -0.14 -0.91 -0.23 0.00 0.00 0.00 0.00 46.02 44.73 1mkw n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mkw s LYS 70 N -2.49 1.13 -0.14 1.61 -0.14 -1.26 -4.47 119.74 113.98 1mkw s LYS 70 Ca 0.00 -1.19 0.14 0.00 -1.36 0.00 0.00 55.97 53.56 1mkw s LYS 70 Cb 0.00 -1.33 0.35 0.00 -1.68 0.00 0.00 37.83 35.17 1mkw s LYS 70 CO 0.00 0.30 1.18 1.58 -0.76 0.00 0.00 175.35 177.65 1mkw n HIS 71 N 0.95 0.00 -3.59 3.18 -0.00 -1.26 -4.94 115.22 109.56 1mkw n HIS 71 Ca -0.18 -1.10 -0.04 0.00 0.46 0.00 0.00 57.72 56.85 1mkw n HIS 71 Cb 0.54 -0.19 -0.02 0.00 -0.12 0.00 0.00 29.99 30.20 1mkw n HIS 71 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1mkw s SER 72 N -2.79 -0.20 0.00 0.26 0.15 -1.26 -1.00 113.70 108.86 1mkw s SER 72 Ca 0.33 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.90 1mkw s SER 72 Cb 0.32 0.27 0.00 0.00 -1.71 0.00 0.00 66.02 64.89 1mkw s SER 72 CO -0.05 -0.45 0.00 -2.11 1.20 0.00 0.00 173.24 171.83 1mkw n ARG 73 N -0.26 3.58 0.00 5.44 1.85 0.54 -4.85 116.66 122.96 1mkw n ARG 73 Ca -0.05 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.80 1mkw n ARG 73 Cb 0.60 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.01 1mkw n ARG 73 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1mkw n THR 74 N 0.00 0.00 -1.95 8.89 -2.24 -1.26 -4.84 114.28 112.88 1mkw n THR 74 Ca 0.00 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.49 1mkw n THR 74 Cb 0.00 0.00 0.09 0.00 -2.10 0.00 0.00 70.33 68.32 1mkw n THR 74 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1mkw s ARG 75 N 0.00 1.92 -0.31 -0.78 1.81 -1.26 -5.06 118.95 115.27 1mkw s ARG 75 Ca 0.00 0.03 0.03 0.00 -1.72 0.00 0.00 55.73 54.07 1mkw s ARG 75 Cb 0.00 -1.98 0.08 0.00 -0.45 0.00 0.00 34.95 32.61 1mkw s ARG 75 CO 0.00 -1.59 -0.00 -0.47 -0.68 0.00 0.00 175.30 172.56 1mkw s TYR 76 N -3.55 3.56 -0.50 -0.53 6.14 -1.26 -5.05 117.35 116.15 1mkw s TYR 76 Ca 0.62 -2.68 -0.26 0.00 0.64 0.00 0.00 57.07 55.39 1mkw s TYR 76 Cb -0.11 -2.55 -0.07 0.00 0.42 0.00 0.00 41.96 39.66 1mkw s TYR 76 CO 0.49 -0.92 2.39 -1.21 0.64 0.00 0.00 175.55 176.94 1mkw s GLU 77 N 1.00 2.10 -0.03 4.97 2.02 -1.26 -4.90 118.70 122.60 1mkw s GLU 77 Ca 0.03 1.37 -0.30 0.00 0.02 0.00 0.00 54.97 56.09 1mkw s GLU 77 Cb -0.20 -4.58 -0.05 0.00 0.10 0.00 0.00 34.13 29.40 1mkw s GLU 77 CO -0.06 -3.28 1.51 0.50 0.02 0.00 0.00 175.26 173.94 1mkw s ARG 77 N 8.24 4.23 -0.75 1.61 3.52 -1.26 -0.23 118.95 134.31 1mkw s ARG 77 Ca 0.96 2.07 0.00 0.00 -0.13 0.00 0.00 55.73 58.63 1mkw s ARG 77 Cb -0.17 -3.74 0.00 0.00 -1.56 0.00 0.00 34.95 29.48 1mkw s ARG 77 CO 0.26 -0.71 0.00 1.17 -0.81 0.00 0.00 175.30 175.20 1mkw n LYS 78 N 6.17 -0.62 0.00 5.12 4.81 -1.26 -4.77 118.16 127.61 1mkw n LYS 78 Ca 0.15 0.70 0.00 0.00 -0.87 0.00 0.00 58.31 58.29 1mkw n LYS 78 Cb 0.43 -4.52 0.00 0.00 0.02 0.00 0.00 35.03 30.96 1mkw n LYS 78 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 1mkw n VAL 79 N -2.73 0.00 -2.68 3.15 0.24 -0.86 -5.09 118.33 110.36 1mkw n VAL 79 Ca -0.07 0.00 -0.38 0.00 -2.04 0.00 0.00 64.34 61.85 1mkw n VAL 79 Cb 0.26 0.00 -0.06 0.00 -1.47 0.00 0.00 33.84 32.58 1mkw n VAL 79 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1mkw s GLU 80 N -1.00 4.56 -0.16 7.34 2.12 0.69 -4.62 118.70 127.63 1mkw s GLU 80 Ca 0.00 1.47 0.01 0.00 0.36 0.00 0.00 54.97 56.80 1mkw s GLU 80 Cb 0.00 -2.89 0.02 0.00 0.26 0.00 0.00 34.13 31.52 1mkw s GLU 80 CO 0.00 0.23 -0.16 0.21 -0.54 0.00 0.00 175.26 175.00 1mkw s LYS 81 N -1.89 2.52 -0.11 4.30 2.47 0.12 -4.92 119.74 122.22 1mkw s LYS 81 Ca 0.49 -0.65 -0.04 0.00 -1.56 0.00 0.00 55.97 54.21 1mkw s LYS 81 Cb -0.23 -2.25 -0.04 0.00 -1.46 0.00 0.00 37.83 33.86 1mkw s LYS 81 CO 0.29 -0.22 0.04 0.42 0.16 0.00 0.00 175.35 176.03 1mkw s ILE 82 N 1.40 4.59 0.06 5.43 1.01 -1.26 -0.77 121.20 131.65 1mkw s ILE 82 Ca 0.04 -0.13 -0.05 0.00 0.00 0.00 0.00 60.65 60.52 1mkw s ILE 82 Cb -0.13 -2.98 -0.02 0.00 0.01 0.00 0.00 42.46 39.34 1mkw s ILE 82 CO -0.11 0.57 0.07 -0.55 0.00 0.00 0.00 174.94 174.92 1mkw s SER 83 N -0.58 0.30 -0.03 3.58 0.15 -0.35 -5.00 113.70 111.77 1mkw s SER 83 Ca 0.10 -0.79 -0.00 0.00 0.70 0.00 0.00 55.95 55.96 1mkw s SER 83 Cb -0.12 0.25 -0.04 0.00 -1.71 0.00 0.00 66.02 64.41 1mkw s SER 83 CO 0.02 -0.63 0.03 -0.04 1.20 0.00 0.00 173.24 173.82 1mkw s MET 84 N -3.65 2.95 0.78 5.44 -1.94 -1.26 -1.10 119.30 120.52 1mkw s MET 84 Ca 0.04 -0.49 -0.10 0.00 -1.71 0.00 0.00 55.69 53.42 1mkw s MET 84 Cb 0.05 -2.78 0.07 0.00 2.01 0.00 0.00 34.83 34.18 1mkw s MET 84 CO -0.09 0.66 1.13 -0.51 -0.01 0.00 0.00 175.02 176.20 1mkw s LEU 85 N -1.39 2.59 0.00 -0.03 2.01 -1.26 0.21 118.68 120.82 1mkw s LEU 85 Ca 0.18 0.69 0.00 0.00 0.01 0.00 0.00 54.13 55.01 1mkw s LEU 85 Cb -0.12 -3.23 0.00 0.00 0.01 0.00 0.00 46.19 42.86 1mkw s LEU 85 CO 0.09 -1.82 0.00 -0.67 1.01 0.00 0.00 176.35 174.96 1mkw n ASP 86 N -3.20 1.65 -4.14 2.29 -0.08 -0.34 -4.39 116.55 108.34 1mkw n ASP 86 Ca 0.08 0.00 -0.09 0.00 -1.51 0.00 0.00 54.79 53.27 1mkw n ASP 86 Cb 0.61 0.00 -0.10 0.00 2.34 0.00 0.00 41.12 43.97 1mkw n ASP 86 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1mkw s LYS 87 N -1.78 0.77 -0.05 -0.67 -0.14 -1.24 -5.00 119.74 111.63 1mkw s LYS 87 Ca 0.00 -1.31 -0.02 0.00 -1.36 0.00 0.00 55.97 53.28 1mkw s LYS 87 Cb 0.00 -0.01 0.04 0.00 -1.68 0.00 0.00 37.83 36.17 1mkw s LYS 87 CO 0.00 -0.08 0.09 0.42 -0.76 0.00 0.00 175.35 175.02 1mkw s ILE 88 N -3.77 -0.14 -0.11 2.17 1.01 -1.26 -1.77 121.20 117.33 1mkw s ILE 88 Ca 0.12 0.37 0.04 0.00 0.00 0.00 0.00 60.65 61.17 1mkw s ILE 88 Cb 0.07 -0.19 -0.00 0.00 0.01 0.00 0.00 42.46 42.35 1mkw s ILE 88 CO -0.06 0.15 -0.23 -0.31 0.00 0.00 0.00 174.94 174.50 1mkw s TYR 89 N 2.02 2.59 -0.03 3.97 1.51 -0.56 -5.00 117.35 121.85 1mkw s TYR 89 Ca 0.02 -1.04 0.05 0.00 -1.01 0.00 0.00 57.07 55.09 1mkw s TYR 89 Cb -0.12 -1.73 -0.03 0.00 -0.11 0.00 0.00 41.96 39.98 1mkw s TYR 89 CO -0.04 -0.42 -0.17 0.42 -1.11 0.00 0.00 175.55 174.23 1mkw s ILE 90 N 0.38 2.85 -0.13 2.71 1.01 -1.26 -0.77 121.20 125.99 1mkw s ILE 90 Ca -0.18 -0.86 -0.36 0.00 0.00 0.00 0.00 60.65 59.25 1mkw s ILE 90 Cb -0.18 -2.11 -0.13 0.00 0.01 0.00 0.00 42.46 40.05 1mkw s ILE 90 CO 0.08 0.55 1.80 1.57 0.00 0.00 0.00 174.94 178.94 1mkw n HIS 91 N 2.21 2.22 0.27 3.97 -0.00 -0.61 -4.78 115.22 118.48 1mkw n HIS 91 Ca -0.17 0.20 0.15 0.00 -0.00 0.00 0.00 57.72 57.90 1mkw n HIS 91 Cb 0.52 -2.58 0.82 0.00 -0.00 0.00 0.00 29.99 28.74 1mkw n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1mkw h PRO 92 N 8.25 0.00 -0.27 1.57 0.13 -1.94 -0.39 132.00 139.35 1mkw h PRO 92 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1mkw h PRO 92 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1mkw h PRO 92 CO 0.94 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 179.25 1mkw n ARG 93 N -2.65 2.26 -1.48 0.86 1.74 -1.26 -5.00 116.66 111.12 1mkw n ARG 93 Ca -0.02 -2.06 -0.44 0.00 -0.77 0.00 0.00 57.85 54.55 1mkw n ARG 93 Cb 0.18 -1.45 -0.01 0.00 -1.02 0.00 0.00 32.46 30.16 1mkw n ARG 93 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 1mkw n TYR 94 N 1.29 0.09 -3.63 -1.55 9.36 -0.16 -4.79 117.16 117.76 1mkw n TYR 94 Ca 0.16 0.74 -0.29 0.00 3.32 0.00 0.00 57.90 61.83 1mkw n TYR 94 Cb 0.55 -2.07 -0.13 0.00 -0.63 0.00 0.00 39.34 37.07 1mkw n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1mkw s ASN 95 N -0.83 3.46 0.17 2.98 3.84 0.50 -4.91 114.94 120.16 1mkw s ASN 95 Ca 0.62 -2.37 0.26 0.00 0.21 0.00 0.00 52.86 51.58 1mkw s ASN 95 Cb -0.73 -0.80 0.68 0.00 -0.55 0.00 0.00 41.25 39.85 1mkw s ASN 95 CO 0.58 -0.30 1.63 -2.67 -2.79 0.00 0.00 177.10 173.56 1mkw n TRP 96 N 3.86 0.76 -0.10 0.43 4.27 -1.26 0.13 117.44 125.52 1mkw n TRP 96 Ca 0.08 0.22 -0.13 0.00 -3.89 0.00 0.00 57.50 53.78 1mkw n TRP 96 Cb 0.36 -0.82 -0.02 0.00 -1.36 0.00 0.00 31.31 29.47 1mkw n TRP 96 CO 0.00 0.00 0.00 -0.22 -2.29 0.00 0.00 177.69 175.18 1mkw h LYS 97 N 0.00 0.90 0.00 -2.67 3.64 -1.99 -3.40 116.57 113.04 1mkw h LYS 97 Ca 0.00 -0.51 -0.08 0.00 -1.27 0.00 0.00 60.65 58.79 1mkw h LYS 97 Cb 0.72 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.56 1mkw h LYS 97 CO 0.00 1.15 -1.31 -0.85 -2.27 0.00 0.00 179.45 176.17 1mkw n GLU 97 N -4.04 1.29 -0.41 1.90 0.28 -1.24 -4.96 120.64 113.46 1mkw n GLU 97 Ca -0.03 0.02 0.00 0.00 -0.16 0.00 0.00 57.16 56.99 1mkw n GLU 97 Cb 0.57 -1.11 0.00 0.00 1.43 0.00 0.00 31.44 32.33 1mkw n GLU 97 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 1mkw n ASN 98 N -2.48 0.00 -3.75 -1.84 0.23 -1.09 -4.85 115.26 101.47 1mkw n ASN 98 Ca -0.09 -1.12 -0.26 0.00 -0.53 0.00 0.00 54.58 52.58 1mkw n ASN 98 Cb 0.62 -0.02 0.05 0.00 -2.08 0.00 0.00 39.78 38.35 1mkw n ASN 98 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1mkw n LEU 99 N 0.00 -3.00 -4.77 -4.53 4.77 0.34 -4.95 117.00 104.86 1mkw n LEU 99 Ca 0.00 -0.69 -0.39 0.00 -0.03 0.00 0.00 56.01 54.90 1mkw n LEU 99 Cb 0.52 -2.78 -0.03 0.00 -2.33 0.00 0.00 43.42 38.80 1mkw n LEU 99 CO 0.00 0.53 0.83 -0.62 -1.33 0.00 0.00 177.39 176.80 1mkw s ASP 100 N -3.46 6.92 -1.28 -1.43 2.15 -1.05 -3.21 116.67 115.31 1mkw s ASP 100 Ca 0.54 2.34 -0.02 0.00 0.43 0.00 0.00 52.55 55.84 1mkw s ASP 100 Cb -0.26 -2.62 0.01 0.00 -0.30 0.00 0.00 42.92 39.75 1mkw s ASP 100 CO 0.79 -0.39 0.92 0.54 -0.17 0.00 0.00 175.17 176.85 1mkw n ARG 101 N 0.68 -6.13 -1.83 4.34 1.74 -1.26 -0.37 116.66 113.83 1mkw n ARG 101 Ca 0.01 0.75 -0.41 0.00 -0.77 0.00 0.00 57.85 57.43 1mkw n ARG 101 Cb 0.45 -5.61 -0.02 0.00 -1.02 0.00 0.00 32.46 26.27 1mkw n ARG 101 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1mkw n ASP 102 N -3.07 3.79 -3.85 0.55 2.03 -1.20 -4.17 116.55 110.63 1mkw n ASP 102 Ca -0.23 -2.82 -0.12 0.00 0.52 0.00 0.00 54.79 52.14 1mkw n ASP 102 Cb 0.65 -1.58 -0.13 0.00 -0.72 0.00 0.00 41.12 39.34 1mkw n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1mkw s ILE 103 N 4.33 0.00 -0.09 5.18 2.07 -1.26 -3.76 121.20 127.67 1mkw s ILE 103 Ca 0.52 -0.02 -0.10 0.00 -1.41 0.00 0.00 60.65 59.65 1mkw s ILE 103 Cb 0.11 -0.12 0.03 0.00 0.13 0.00 0.00 42.46 42.61 1mkw s ILE 103 CO 0.00 -0.01 0.27 0.00 -1.91 0.00 0.00 174.94 173.29 1mkw s ALA 104 N 0.01 -0.66 -0.18 1.50 0.00 0.43 -1.58 121.76 121.28 1mkw s ALA 104 Ca -0.00 0.71 -0.02 0.00 0.00 0.00 0.00 51.96 52.65 1mkw s ALA 104 Cb -0.01 -0.40 -0.01 0.00 0.00 0.00 0.00 23.12 22.70 1mkw s ALA 104 CO 0.00 -0.14 -0.09 -0.51 0.00 0.00 0.00 175.76 175.03 1mkw s LEU 105 N 0.03 2.77 -0.24 0.00 1.43 0.05 -1.19 118.68 121.53 1mkw s LEU 105 Ca -0.01 -0.38 -0.06 0.00 -1.03 0.00 0.00 54.13 52.64 1mkw s LEU 105 Cb -0.02 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.50 1mkw s LEU 105 CO 0.01 0.05 0.04 -0.76 0.23 0.00 0.00 176.35 175.92 1mkw s LEU 106 N 1.02 3.30 0.01 1.79 1.43 -0.10 -1.49 118.68 124.63 1mkw s LEU 106 Ca -0.00 -0.25 -0.20 0.00 -1.03 0.00 0.00 54.13 52.65 1mkw s LEU 106 Cb -0.15 -1.87 -0.06 0.00 0.03 0.00 0.00 46.19 44.14 1mkw s LEU 106 CO -0.01 -0.03 0.58 -0.75 0.23 0.00 0.00 176.35 176.38 1mkw s LYS 107 N 1.55 4.29 0.53 1.70 2.20 -0.73 -1.66 119.74 127.61 1mkw s LYS 107 Ca 0.06 0.72 -0.18 0.00 -0.36 0.00 0.00 55.97 56.21 1mkw s LYS 107 Cb -0.15 -3.32 -0.07 0.00 -1.51 0.00 0.00 37.83 32.78 1mkw s LYS 107 CO 0.02 0.42 1.04 -0.51 -0.36 0.00 0.00 175.35 175.95 1mkw s LEU 108 N -0.34 3.70 0.42 5.43 1.43 0.39 -1.20 118.68 128.51 1mkw s LEU 108 Ca 0.30 1.84 0.08 0.00 -1.03 0.00 0.00 54.13 55.32 1mkw s LEU 108 Cb -0.18 -4.54 0.88 0.00 0.03 0.00 0.00 46.19 42.37 1mkw s LEU 108 CO 0.17 -0.88 2.06 0.50 0.23 0.00 0.00 176.35 178.43 1mkw h LYS 109 N 1.10 0.52 -2.42 1.70 3.11 -0.44 -3.40 116.57 116.74 1mkw h LYS 109 Ca -0.48 -0.03 -0.08 0.00 -2.81 0.00 0.00 60.65 57.24 1mkw h LYS 109 Cb 1.21 -0.12 -0.20 0.00 -1.00 0.00 0.00 32.23 32.13 1mkw h LYS 109 CO 0.59 0.34 -0.01 0.50 -2.81 0.00 0.00 179.45 178.06 1mkw s ARG 110 N -5.48 0.87 0.51 1.90 6.06 -1.26 -4.95 118.95 116.61 1mkw s ARG 110 Ca -0.08 0.17 -0.21 0.00 -2.50 0.00 0.00 55.73 53.11 1mkw s ARG 110 Cb 0.17 0.40 -0.08 0.00 0.06 0.00 0.00 34.95 35.51 1mkw s ARG 110 CO 0.73 -0.24 0.99 -2.30 -2.50 0.00 0.00 175.30 171.98 1mkw n PRO 111 N 1.30 1.16 -4.09 5.12 -0.02 -1.26 -4.90 135.00 132.30 1mkw n PRO 111 Ca -0.19 0.43 -0.25 0.00 -2.02 0.00 0.00 63.50 61.47 1mkw n PRO 111 Cb 0.57 -2.12 -0.05 0.00 -0.02 0.00 0.00 33.50 31.87 1mkw n PRO 111 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 1mkw s ILE 112 N -1.41 4.47 -0.24 4.25 -5.25 0.48 -5.02 121.20 118.48 1mkw s ILE 112 Ca 0.69 -1.18 -0.13 0.00 -0.99 0.00 0.00 60.65 59.04 1mkw s ILE 112 Cb -0.48 -3.32 -0.04 0.00 2.95 0.00 0.00 42.46 41.57 1mkw s ILE 112 CO 0.52 -0.18 0.28 -1.61 -1.79 0.00 0.00 174.94 172.16 1mkw s GLU 113 N -3.32 4.06 1.14 0.37 2.02 -1.26 -4.85 118.70 116.87 1mkw s GLU 113 Ca 0.31 -0.08 -0.17 0.00 0.02 0.00 0.00 54.97 55.06 1mkw s GLU 113 Cb -0.09 -3.59 0.26 0.00 0.10 0.00 0.00 34.13 30.80 1mkw s GLU 113 CO 0.24 -0.10 1.10 -0.51 0.02 0.00 0.00 175.26 176.02 1mkw s LEU 114 N 1.51 0.96 0.00 1.80 1.43 -1.26 -4.93 118.68 118.19 1mkw s LEU 114 Ca 0.12 0.80 -0.19 0.00 -1.03 0.00 0.00 54.13 53.83 1mkw s LEU 114 Cb -0.15 -2.67 0.06 0.00 0.03 0.00 0.00 46.19 43.46 1mkw s LEU 114 CO 0.08 -3.83 0.87 -1.54 0.23 0.00 0.00 176.35 172.16 1mkw n SER 115 N -4.59 -0.69 0.25 2.29 3.41 -0.60 -4.87 113.62 108.82 1mkw n SER 115 Ca 0.10 -1.06 0.12 0.00 -0.26 0.00 0.00 58.87 57.78 1mkw n SER 115 Cb 0.59 1.05 0.64 0.00 -0.26 0.00 0.00 64.21 66.23 1mkw n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1mkw h ASP 116 N 1.29 0.00 0.00 4.04 3.32 -1.97 -2.13 116.42 120.97 1mkw h ASP 116 Ca -0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.92 1mkw h ASP 116 Cb 0.76 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.31 1mkw h ASP 116 CO 0.19 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.49 1mkw n TYR 117 N -2.50 0.00 -3.49 4.55 4.01 -1.26 -4.65 117.16 113.82 1mkw n TYR 117 Ca -0.02 -0.34 -0.23 0.00 -0.16 0.00 0.00 57.90 57.16 1mkw n TYR 117 Cb 0.29 -0.03 -0.13 0.00 -0.31 0.00 0.00 39.34 39.15 1mkw n TYR 117 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1mkw s ILE 118 N -0.67 -0.24 -0.03 -0.72 1.01 -0.80 -4.06 121.20 115.69 1mkw s ILE 118 Ca 0.00 -0.49 -0.01 0.00 0.00 0.00 0.00 60.65 60.16 1mkw s ILE 118 Cb 0.00 -0.89 0.03 0.00 0.01 0.00 0.00 42.46 41.61 1mkw s ILE 118 CO 0.00 -0.50 0.03 -2.28 0.00 0.00 0.00 174.94 172.20 1mkw s HIS 119 N 2.24 0.11 0.52 3.97 2.46 0.60 -1.56 115.29 123.63 1mkw s HIS 119 Ca 0.08 0.14 -0.22 0.00 0.47 0.00 0.00 55.06 55.53 1mkw s HIS 119 Cb -0.15 -0.36 -0.05 0.00 -0.13 0.00 0.00 32.58 31.88 1mkw s HIS 119 CO -0.28 -0.14 1.28 -1.25 -2.47 0.00 0.00 174.74 171.88 1mkw s PRO 120 N 1.44 3.32 0.60 2.88 0.04 -1.26 -2.88 135.00 139.15 1mkw s PRO 120 Ca -0.04 2.05 -0.00 0.00 0.04 0.00 0.00 61.00 63.04 1mkw s PRO 120 Cb -0.13 -2.27 0.06 0.00 0.04 0.00 0.00 34.50 32.20 1mkw s PRO 120 CO -0.03 -0.99 0.85 0.54 0.04 0.00 0.00 177.00 177.41 1mkw s VAL 121 N -1.41 2.51 0.10 -0.36 0.11 -0.31 -1.34 120.40 119.69 1mkw s VAL 121 Ca 0.70 -0.60 0.01 0.00 -2.93 0.00 0.00 61.98 59.16 1mkw s VAL 121 Cb -0.36 -2.91 -0.04 0.00 -1.53 0.00 0.00 36.38 31.55 1mkw s VAL 121 CO 0.42 0.00 0.22 0.00 -3.33 0.00 0.00 175.10 172.42 1mkw s LEU 123 N -2.78 4.31 0.74 0.00 1.43 -1.26 0.07 118.68 121.18 1mkw s LEU 123 Ca 0.34 0.37 -0.15 0.00 -1.03 0.00 0.00 54.13 53.67 1mkw s LEU 123 Cb -0.12 -2.09 0.04 0.00 0.03 0.00 0.00 46.19 44.05 1mkw s LEU 123 CO 0.28 0.30 1.20 -2.16 0.23 0.00 0.00 176.35 176.20 1mkw s PRO 124 N -0.40 2.11 0.38 1.29 0.04 -1.26 -4.92 135.00 132.25 1mkw s PRO 124 Ca 0.12 1.73 0.08 0.00 0.04 0.00 0.00 61.00 62.97 1mkw s PRO 124 Cb -0.12 -1.83 -0.06 0.00 0.04 0.00 0.00 34.50 32.53 1mkw s PRO 124 CO 0.02 -1.85 0.07 0.16 0.04 0.00 0.00 177.00 175.43 1mkw s ASP 125 N -2.09 4.19 0.41 6.66 1.47 -1.26 -4.92 116.67 121.14 1mkw s ASP 125 Ca 0.74 -1.12 0.22 0.00 1.18 0.00 0.00 52.55 53.57 1mkw s ASP 125 Cb -0.28 -0.48 1.21 0.00 -0.34 0.00 0.00 42.92 43.02 1mkw s ASP 125 CO 0.46 -0.40 1.73 0.07 0.68 0.00 0.00 175.17 177.71 1mkw h LYS 126 N 1.66 0.29 0.15 2.11 -0.00 -1.98 -2.49 116.57 116.31 1mkw h LYS 126 Ca -0.43 -0.02 -0.31 0.00 -0.00 0.00 0.00 60.65 59.89 1mkw h LYS 126 Cb 1.25 -0.06 0.01 0.00 -0.00 0.00 0.00 32.23 33.42 1mkw h LYS 126 CO 0.71 0.19 -1.47 1.96 -0.00 0.00 0.00 179.45 180.84 1mkw h GLN 127 N 0.30 0.32 -1.40 0.07 7.50 -2.04 -2.98 115.11 116.87 1mkw h GLN 127 Ca 0.65 -0.55 0.00 0.00 0.50 0.00 0.00 58.65 59.25 1mkw h GLN 127 Cb 1.81 0.20 0.00 0.00 0.05 0.00 0.00 27.48 29.55 1mkw h GLN 127 CO -0.32 1.22 0.00 2.41 -1.50 0.00 0.00 178.83 180.64 1mkw n THR 128 N -3.53 0.07 0.00 -0.54 -1.04 -0.94 -0.09 114.28 108.21 1mkw n THR 128 Ca -0.15 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.86 1mkw n THR 128 Cb 1.05 -0.41 0.00 0.00 -1.82 0.00 0.00 70.33 69.16 1mkw n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1mkw n ALA 129 N 0.81 0.00 0.09 2.41 0.00 -1.13 0.74 120.51 123.43 1mkw n ALA 129 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1mkw n ALA 129 Cb 0.04 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.41 1mkw n ALA 129 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1mkw h LYS 129 N 0.00 0.21 0.05 0.00 3.64 -0.79 -3.39 116.57 116.29 1mkw h LYS 129 Ca 0.00 -0.29 -0.37 0.00 -1.27 0.00 0.00 60.65 58.72 1mkw h LYS 129 Cb 0.00 0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 31.87 1mkw h LYS 129 CO 0.00 1.07 -2.20 1.28 -2.27 0.00 0.00 179.45 177.33 1mkw n LEU 129 N -3.57 2.33 -4.57 5.20 4.77 0.23 -4.80 117.00 116.59 1mkw n LEU 129 Ca -0.05 0.07 -0.40 0.00 -0.03 0.00 0.00 56.01 55.60 1mkw n LEU 129 Cb 0.91 -0.74 -0.02 0.00 -2.33 0.00 0.00 43.42 41.24 1mkw n LEU 129 CO 0.50 0.81 1.68 -0.76 -1.33 0.00 0.00 177.39 178.28 1mkw s LEU 130 N -6.58 3.58 -0.00 2.23 1.43 -1.26 -4.87 118.68 113.21 1mkw s LEU 130 Ca -0.24 -1.82 -0.00 0.00 -1.03 0.00 0.00 54.13 51.04 1mkw s LEU 130 Cb 0.08 -2.57 -0.00 0.00 0.03 0.00 0.00 46.19 43.72 1mkw s LEU 130 CO 0.71 -1.60 0.01 -1.00 0.23 0.00 0.00 176.35 174.70 1mkw s HIS 131 N 5.57 0.02 0.29 0.29 3.76 -1.26 -4.92 115.29 119.03 1mkw s HIS 131 Ca 0.53 -0.03 -0.30 0.00 -0.15 0.00 0.00 55.06 55.11 1mkw s HIS 131 Cb 0.01 -0.01 -0.12 0.00 1.11 0.00 0.00 32.58 33.57 1mkw s HIS 131 CO 0.00 -0.02 1.53 0.00 -0.85 0.00 0.00 174.74 175.40 1mkw n ALA 132 N 2.93 2.19 0.00 -1.40 0.00 -1.26 -0.96 120.51 122.02 1mkw n ALA 132 Ca -0.13 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1mkw n ALA 132 Cb 0.59 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.63 1mkw n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mkw n GLY 133 N 1.91 2.80 3.75 0.00 0.00 -0.61 -4.96 105.19 108.08 1mkw n GLY 133 Ca 0.08 -0.43 -0.41 0.00 0.00 0.00 0.00 46.02 45.26 1mkw n GLY 133 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1mkw s PHE 134 N -1.80 3.11 0.01 1.61 0.40 -0.13 -4.66 117.98 116.52 1mkw s PHE 134 Ca 0.00 1.21 -0.11 0.00 -0.60 0.00 0.00 56.93 57.43 1mkw s PHE 134 Cb 0.00 -3.70 -0.05 0.00 0.51 0.00 0.00 43.02 39.78 1mkw s PHE 134 CO 0.00 -2.15 0.34 0.15 0.70 0.00 0.00 175.22 174.27 1mkw s LYS 135 N -0.72 3.74 0.47 0.44 1.02 -1.26 -1.04 119.74 122.40 1mkw s LYS 135 Ca 0.55 0.18 0.05 0.00 0.02 0.00 0.00 55.97 56.76 1mkw s LYS 135 Cb -0.39 -3.12 -0.03 0.00 -0.52 0.00 0.00 37.83 33.77 1mkw s LYS 135 CO 0.44 0.66 0.12 0.20 -0.92 0.00 0.00 175.35 175.85 1mkw s GLY 136 N -1.40 2.64 -0.05 -3.33 0.00 0.18 -4.87 107.32 100.50 1mkw s GLY 136 Ca 0.26 -1.34 0.05 0.00 0.00 0.00 0.00 44.72 43.69 1mkw s GLY 136 CO 0.14 -2.07 -0.21 -1.60 0.00 0.00 0.00 173.10 169.37 1mkw s ARG 137 N -3.92 2.17 -0.03 2.90 3.52 0.24 -1.43 118.95 122.39 1mkw s ARG 137 Ca 0.25 -0.75 0.06 0.00 -0.13 0.00 0.00 55.73 55.17 1mkw s ARG 137 Cb 0.03 -1.85 -0.01 0.00 -1.56 0.00 0.00 34.95 31.56 1mkw s ARG 137 CO 0.14 0.30 -0.22 0.14 -0.81 0.00 0.00 175.30 174.85 1mkw s VAL 138 N -0.03 1.74 0.01 7.11 -7.23 0.11 -1.00 120.40 121.10 1mkw s VAL 138 Ca -0.04 -0.93 0.06 0.00 -1.81 0.00 0.00 61.98 59.26 1mkw s VAL 138 Cb -0.13 -1.45 -0.02 0.00 0.56 0.00 0.00 36.38 35.34 1mkw s VAL 138 CO 0.03 0.49 -0.20 0.42 -0.31 0.00 0.00 175.10 175.54 1mkw s THR 139 N -0.38 1.56 0.26 5.32 -4.23 -1.25 0.55 115.64 117.45 1mkw s THR 139 Ca 0.05 -0.95 -0.15 0.00 -1.18 0.00 0.00 61.69 59.46 1mkw s THR 139 Cb -0.10 -1.32 0.00 0.00 1.34 0.00 0.00 72.50 72.43 1mkw s THR 139 CO 0.00 0.35 0.54 -0.83 -0.54 0.00 0.00 174.62 174.14 1mkw s GLY 140 N -0.71 0.38 -0.49 3.99 0.00 -0.95 -4.09 107.32 105.45 1mkw s GLY 140 Ca 0.07 -0.73 0.07 0.00 0.00 0.00 0.00 44.72 44.13 1mkw s GLY 140 CO 0.00 -0.49 0.56 0.79 0.00 0.00 0.00 173.10 173.96 1mkw n TRP 141 N -0.40 0.94 -2.97 1.90 8.01 -1.16 -3.62 117.44 120.14 1mkw n TRP 141 Ca -0.02 -3.75 0.00 0.00 -1.31 0.00 0.00 57.50 52.42 1mkw n TRP 141 Cb 0.61 -0.34 0.00 0.00 -2.01 0.00 0.00 31.31 29.57 1mkw n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1mkw n GLY 142 N 1.49 -1.75 0.00 6.99 0.00 -0.35 -4.64 105.19 106.93 1mkw n GLY 142 Ca 0.25 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.74 1mkw n GLY 142 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1mkw n ASN 143 N 0.28 0.00 -3.71 1.61 3.02 -1.26 -1.66 115.26 113.53 1mkw n ASN 143 Ca 0.00 0.00 -0.24 0.00 -0.03 0.00 0.00 54.58 54.31 1mkw n ASN 143 Cb 0.00 0.00 0.04 0.00 -0.61 0.00 0.00 39.78 39.21 1mkw n ASN 143 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 1mkw n ARG 144 N -1.81 -5.67 -0.52 3.52 0.63 -1.26 -4.15 116.66 107.41 1mkw n ARG 144 Ca 0.00 0.67 -0.02 0.00 -0.92 0.00 0.00 57.85 57.58 1mkw n ARG 144 Cb 0.00 -5.44 -0.02 0.00 0.45 0.00 0.00 32.46 27.46 1mkw n ARG 144 CO 0.00 0.00 0.00 2.89 -2.51 0.00 0.00 177.63 178.01 1mkw n ARG 145 N -4.46 0.00 -2.07 -0.14 1.85 -1.26 -4.57 116.66 106.01 1mkw n ARG 145 Ca -0.17 -0.25 -0.42 0.00 -1.00 0.00 0.00 57.85 56.02 1mkw n ARG 145 Cb 0.62 0.18 -0.03 0.00 -1.05 0.00 0.00 32.46 32.19 1mkw n ARG 145 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 1mkw s GLU 146 N 0.00 4.27 0.01 2.89 8.01 -1.26 -4.99 118.70 127.62 1mkw s GLU 146 Ca 0.00 2.20 -0.29 0.00 0.01 0.00 0.00 54.97 56.89 1mkw s GLU 146 Cb 0.00 -3.25 0.10 0.00 -4.31 0.00 0.00 34.13 26.67 1mkw s GLU 146 CO 0.00 -0.53 1.02 -0.08 0.01 0.00 0.00 175.26 175.68 1mkw s THR 147 N 1.27 0.00 -0.58 3.63 -1.32 -1.26 -5.11 115.64 112.27 1mkw s THR 147 Ca 0.67 -0.21 -0.03 0.00 -1.21 0.00 0.00 61.69 60.91 1mkw s THR 147 Cb -0.39 -1.41 0.20 0.00 -1.51 0.00 0.00 72.50 69.39 1mkw s THR 147 CO 0.31 0.00 2.41 0.79 -2.21 0.00 0.00 174.62 175.92 1mkw n TRP 148 N -0.31 2.15 0.00 9.09 8.01 -1.26 -5.03 117.44 130.09 1mkw n TRP 148 Ca -0.06 -2.15 0.00 0.00 -1.31 0.00 0.00 57.50 53.98 1mkw n TRP 148 Cb 0.61 -1.29 0.00 0.00 -2.01 0.00 0.00 31.31 28.62 1mkw n TRP 148 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.69 174.31 1mkw n THR 149 N 0.24 0.00 0.05 -0.99 5.66 -1.26 -5.20 114.28 112.78 1mkw n THR 149 Ca 0.50 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.50 1mkw n THR 149 Cb 0.46 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.24 1mkw n THR 149 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1mkw n SER 149 N 0.00 -0.68 -0.26 1.09 7.64 -1.26 -5.17 113.62 114.98 1mkw n SER 149 Ca 0.00 0.18 0.00 0.00 1.01 0.00 0.00 58.87 60.06 1mkw n SER 149 Cb 0.00 0.91 0.00 0.00 -1.01 0.00 0.00 64.21 64.11 1mkw n SER 149 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1mkw n VAL 149 N -2.72 0.00 0.00 0.44 0.24 -1.26 -5.09 118.33 109.95 1mkw n VAL 149 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1mkw n VAL 149 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1mkw n VAL 149 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1mkw n ALA 149 N -0.06 0.00 0.00 2.33 0.00 -1.26 -5.04 120.51 116.49 1mkw n ALA 149 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1mkw n ALA 149 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1mkw n ALA 149 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1mkw n GLU 149 N 0.00 0.00 0.00 0.00 2.13 -1.26 -5.06 120.64 116.45 1mkw n GLU 149 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1mkw n GLU 149 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1mkw n GLU 149 CO 0.00 0.00 0.00 1.55 -0.41 0.00 0.00 177.13 178.27 1mkw n VAL 150 N -0.06 0.00 -2.60 6.31 3.14 -1.26 -5.14 118.33 118.71 1mkw n VAL 150 Ca 0.00 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 60.96 1mkw n VAL 150 Cb 0.00 0.00 -0.04 0.00 -1.06 0.00 0.00 33.84 32.74 1mkw n VAL 150 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 1mkw s GLN 151 N 0.00 4.57 -0.85 1.45 -1.52 -1.26 -4.89 119.66 117.17 1mkw s GLN 151 Ca 0.00 1.58 -0.29 0.00 -1.95 0.00 0.00 55.36 54.70 1mkw s GLN 151 Cb 0.00 -3.37 -0.18 0.00 -0.22 0.00 0.00 33.01 29.24 1mkw s GLN 151 CO 0.00 -0.00 2.60 -2.30 -0.25 0.00 0.00 175.29 175.34 1mkw n PRO 152 N 3.25 0.31 -0.10 2.91 -0.02 -1.26 -4.71 135.00 135.38 1mkw n PRO 152 Ca 0.05 -0.01 -0.14 0.00 -2.02 0.00 0.00 63.50 61.37 1mkw n PRO 152 Cb 0.48 -2.09 -0.05 0.00 -0.02 0.00 0.00 33.50 31.82 1mkw n PRO 152 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1mkw n SER 153 N 12.09 1.94 -4.87 2.55 7.64 -1.26 -4.80 113.62 126.90 1mkw n SER 153 Ca 0.57 0.35 -0.32 0.00 1.01 0.00 0.00 58.87 60.48 1mkw n SER 153 Cb 0.19 -0.77 -0.05 0.00 -1.01 0.00 0.00 64.21 62.57 1mkw n SER 153 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1mkw s VAL 154 N -2.78 4.93 0.24 0.44 1.01 -1.26 -0.34 120.40 122.65 1mkw s VAL 154 Ca -0.31 0.49 -0.31 0.00 0.00 0.00 0.00 61.98 61.85 1mkw s VAL 154 Cb 0.07 -3.62 -0.11 0.00 0.00 0.00 0.00 36.38 32.71 1mkw s VAL 154 CO 0.44 -0.05 1.57 -0.22 0.00 0.00 0.00 175.10 176.84 1mkw s LEU 155 N -2.75 4.36 0.15 3.92 2.96 -0.17 -4.86 118.68 122.30 1mkw s LEU 155 Ca 0.47 2.80 0.05 0.00 -0.22 0.00 0.00 54.13 57.22 1mkw s LEU 155 Cb -0.11 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 1mkw s LEU 155 CO 0.21 -0.85 0.10 -1.10 -1.32 0.00 0.00 176.35 173.39 1mkw s GLN 156 N 0.11 2.78 -0.07 1.98 -1.52 -1.24 -1.65 119.66 120.06 1mkw s GLN 156 Ca 0.65 -0.89 0.03 0.00 -1.95 0.00 0.00 55.36 53.21 1mkw s GLN 156 Cb -0.46 -2.60 0.01 0.00 -0.22 0.00 0.00 33.01 29.74 1mkw s GLN 156 CO 0.41 0.49 -0.17 0.54 -0.25 0.00 0.00 175.29 176.31 1mkw s VAL 157 N -1.67 1.52 -0.02 1.09 0.11 -0.75 -2.23 120.40 118.44 1mkw s VAL 157 Ca 0.30 -0.72 -0.00 0.00 -2.93 0.00 0.00 61.98 58.63 1mkw s VAL 157 Cb -0.10 -1.34 0.03 0.00 -1.53 0.00 0.00 36.38 33.43 1mkw s VAL 157 CO 0.22 0.44 0.02 0.54 -3.33 0.00 0.00 175.10 173.00 1mkw s VAL 158 N 0.43 -0.00 -0.15 2.04 0.11 0.19 -2.64 120.40 120.37 1mkw s VAL 158 Ca -0.14 0.20 -0.06 0.00 -2.93 0.00 0.00 61.98 59.05 1mkw s VAL 158 Cb -0.16 -0.13 -0.04 0.00 -1.53 0.00 0.00 36.38 34.52 1mkw s VAL 158 CO 0.05 0.11 0.08 0.20 -3.33 0.00 0.00 175.10 172.21 1mkw s ASN 159 N 1.15 5.80 0.03 3.54 0.01 -1.26 0.07 114.94 124.28 1mkw s ASN 159 Ca -0.08 0.21 -0.07 0.00 -0.71 0.00 0.00 52.86 52.21 1mkw s ASN 159 Cb -0.13 -1.90 -0.00 0.00 0.41 0.00 0.00 41.25 39.63 1mkw s ASN 159 CO -0.03 0.28 0.13 -1.48 -1.51 0.00 0.00 177.10 174.50 1mkw s LEU 160 N -0.27 1.62 0.22 0.60 0.05 -0.52 -4.78 118.68 115.60 1mkw s LEU 160 Ca 0.09 -0.43 -0.26 0.00 0.05 0.00 0.00 54.13 53.57 1mkw s LEU 160 Cb -0.12 0.73 -0.09 0.00 -2.05 0.00 0.00 46.19 44.66 1mkw s LEU 160 CO 0.01 -0.50 0.85 -2.16 -0.55 0.00 0.00 176.35 174.00 1mkw s PRO 161 N -2.41 4.64 0.27 1.48 0.04 -1.26 -0.64 135.00 137.11 1mkw s PRO 161 Ca -0.06 1.26 -0.30 0.00 0.04 0.00 0.00 61.00 61.94 1mkw s PRO 161 Cb -0.02 -3.16 -0.10 0.00 0.04 0.00 0.00 34.50 31.26 1mkw s PRO 161 CO -0.03 0.49 1.47 -0.51 0.04 0.00 0.00 177.00 178.46 1mkw s LEU 162 N -1.38 4.37 0.12 -3.56 1.43 -0.21 -0.58 118.68 118.88 1mkw s LEU 162 Ca 0.40 2.76 0.04 0.00 -1.03 0.00 0.00 54.13 56.30 1mkw s LEU 162 Cb -0.23 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.32 1mkw s LEU 162 CO 0.27 -0.75 0.11 -0.69 0.23 0.00 0.00 176.35 175.52 1mkw s VAL 163 N -0.14 4.53 0.30 -1.59 1.01 -0.85 -1.57 120.40 122.08 1mkw s VAL 163 Ca 0.59 -0.91 -0.29 0.00 0.00 0.00 0.00 61.98 61.37 1mkw s VAL 163 Cb -0.43 -3.25 -0.10 0.00 0.00 0.00 0.00 36.38 32.60 1mkw s VAL 163 CO 0.46 0.01 1.31 -1.61 0.00 0.00 0.00 175.10 175.27 1mkw s GLU 164 N -2.73 4.37 0.20 2.72 8.01 -1.26 -4.59 118.70 125.42 1mkw s GLU 164 Ca 0.30 2.17 -0.15 0.00 0.01 0.00 0.00 54.97 57.30 1mkw s GLU 164 Cb -0.11 -3.11 0.20 0.00 -4.31 0.00 0.00 34.13 26.81 1mkw s GLU 164 CO 0.23 -0.19 1.63 -0.09 0.01 0.00 0.00 175.26 176.85 1mkw h ARG 165 N 3.94 -0.01 -1.00 1.61 2.43 -1.98 0.22 114.38 119.59 1mkw h ARG 165 Ca -0.48 0.00 0.14 0.00 -0.81 0.00 0.00 59.98 58.84 1mkw h ARG 165 Cb 1.22 0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 30.68 1mkw h ARG 165 CO 0.69 -0.01 0.62 -1.35 -1.51 0.00 0.00 179.97 178.41 1mkw h PRO 166 N -0.01 0.88 0.04 0.20 0.11 -1.98 0.43 132.00 131.66 1mkw h PRO 166 Ca 0.28 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.33 1mkw h PRO 166 Cb 0.44 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.35 1mkw h PRO 166 CO -0.61 0.58 -0.02 0.28 -0.21 0.00 0.00 178.00 178.03 1mkw h VAL 167 N 0.90 1.15 -0.04 3.15 2.07 -1.39 0.38 116.25 122.47 1mkw h VAL 167 Ca 0.52 -0.60 0.01 0.00 0.82 0.00 0.00 66.70 67.45 1mkw h VAL 167 Cb 0.63 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.95 1mkw h VAL 167 CO -0.31 0.15 0.00 0.00 0.02 0.00 0.00 177.57 177.44 1mkw h LYS 169 N 0.02 -0.41 0.00 0.00 1.57 -0.01 -2.89 116.57 114.85 1mkw h LYS 169 Ca 0.02 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1mkw h LYS 169 Cb 0.02 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1mkw h LYS 169 CO -0.03 -0.27 0.00 0.00 -0.57 0.00 0.00 179.45 178.58 1mkw n ALA 170 N -2.61 1.28 1.54 3.86 0.00 0.13 -2.50 120.51 122.22 1mkw n ALA 170 Ca -0.06 0.15 0.14 0.00 0.00 0.00 0.00 53.44 53.67 1mkw n ALA 170 Cb 0.28 -1.33 0.59 0.00 0.00 0.00 0.00 19.45 18.99 1mkw n ALA 170 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1mkw n SER 171 N -2.21 1.05 -4.03 0.00 3.41 -0.94 -4.89 113.62 106.00 1mkw n SER 171 Ca 0.00 -1.22 -0.08 0.00 -0.26 0.00 0.00 58.87 57.31 1mkw n SER 171 Cb 0.11 0.01 -0.09 0.00 -0.26 0.00 0.00 64.21 63.98 1mkw n SER 171 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1mkw s THR 172 N -2.12 0.15 -2.63 6.66 -1.32 -1.04 -4.91 115.64 110.43 1mkw s THR 172 Ca 0.37 -1.64 0.22 0.00 -1.21 0.00 0.00 61.69 59.43 1mkw s THR 172 Cb 0.21 -1.64 0.15 0.00 -1.51 0.00 0.00 72.50 69.71 1mkw s THR 172 CO 0.38 -0.70 1.17 0.54 -2.21 0.00 0.00 174.62 173.80 1mkw n ARG 173 N -0.02 1.95 -2.74 7.08 1.74 -1.26 -4.94 116.66 118.47 1mkw n ARG 173 Ca -0.11 -1.71 -0.39 0.00 -0.77 0.00 0.00 57.85 54.87 1mkw n ARG 173 Cb 0.62 -1.42 -0.06 0.00 -1.02 0.00 0.00 32.46 30.59 1mkw n ARG 173 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1mkw s ILE 174 N -1.85 4.07 -0.58 0.55 -1.09 -1.26 -4.99 121.20 116.05 1mkw s ILE 174 Ca 0.24 2.00 -0.28 0.00 -2.23 0.00 0.00 60.65 60.38 1mkw s ILE 174 Cb 0.18 -4.23 0.03 0.00 -1.58 0.00 0.00 42.46 36.86 1mkw s ILE 174 CO 0.30 0.41 1.18 -0.60 -1.23 0.00 0.00 174.94 174.99 1mkw s ARG 175 N -1.40 3.50 0.35 2.79 3.52 -1.26 -5.00 118.95 121.45 1mkw s ARG 175 Ca 0.43 0.22 -0.18 0.00 -0.13 0.00 0.00 55.73 56.08 1mkw s ARG 175 Cb -0.25 -4.02 -0.10 0.00 -1.56 0.00 0.00 34.95 29.03 1mkw s ARG 175 CO 0.31 -1.67 0.81 0.96 -0.81 0.00 0.00 175.30 174.90 1mkw s ILE 176 N 4.89 4.56 0.50 4.11 -4.36 -1.26 -4.89 121.20 124.75 1mkw s ILE 176 Ca 0.42 1.18 0.02 0.00 -0.26 0.00 0.00 60.65 62.01 1mkw s ILE 176 Cb -0.08 -3.63 0.02 0.00 1.25 0.00 0.00 42.46 40.02 1mkw s ILE 176 CO 0.25 -0.20 0.15 0.35 0.24 0.00 0.00 174.94 175.73 1mkw n THR 177 N -0.36 0.00 0.32 8.37 -2.24 -1.26 -5.02 114.28 114.09 1mkw n THR 177 Ca 0.04 -2.23 0.15 0.00 -2.27 0.00 0.00 64.05 59.75 1mkw n THR 177 Cb 0.53 0.27 0.59 0.00 -2.10 0.00 0.00 70.33 69.62 1mkw n THR 177 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1mkw h ASP 178 N 0.97 0.00 -0.24 3.42 3.32 -2.03 -2.75 116.42 119.11 1mkw h ASP 178 Ca -0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.67 1mkw h ASP 178 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 1mkw h ASP 178 CO 0.62 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.73 1mkw n ASN 179 N -2.80 2.14 -3.96 6.45 3.02 -1.26 -4.87 115.26 113.98 1mkw n ASN 179 Ca 0.01 -2.18 -0.09 0.00 -0.03 0.00 0.00 54.58 52.30 1mkw n ASN 179 Cb 0.30 -0.39 -0.09 0.00 -0.61 0.00 0.00 39.78 38.99 1mkw n ASN 179 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1mkw s MET 180 N -1.64 0.65 0.11 3.52 0.23 -1.04 -2.05 119.30 119.07 1mkw s MET 180 Ca 0.19 -0.92 -0.07 0.00 -1.03 0.00 0.00 55.69 53.86 1mkw s MET 180 Cb 0.13 0.25 -0.01 0.00 -1.53 0.00 0.00 34.83 33.66 1mkw s MET 180 CO 0.09 -0.16 0.17 -0.59 -2.03 0.00 0.00 175.02 172.50 1mkw s PHE 181 N -3.23 0.31 0.29 3.16 -0.12 -0.71 -4.80 117.98 112.88 1mkw s PHE 181 Ca 0.00 -0.74 0.11 0.00 -0.05 0.00 0.00 56.93 56.25 1mkw s PHE 181 Cb 0.03 -0.13 -0.05 0.00 -0.63 0.00 0.00 43.02 42.23 1mkw s PHE 181 CO -0.07 -0.56 -0.16 0.00 -0.05 0.00 0.00 175.22 174.37 1mkw s ALA 183 N -2.59 -0.75 0.00 0.00 0.00 -0.58 -2.02 121.76 115.82 1mkw s ALA 183 Ca 0.30 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.35 1mkw s ALA 183 Cb -0.02 0.31 0.00 0.00 0.00 0.00 0.00 23.12 23.41 1mkw s ALA 183 CO 0.15 -0.41 0.00 0.41 0.00 0.00 0.00 175.76 175.91 1mkw n GLY 184 N 0.61 4.32 3.70 0.00 0.00 0.26 -2.07 105.19 111.99 1mkw n GLY 184 Ca -0.19 -1.50 -0.42 0.00 0.00 0.00 0.00 46.02 43.91 1mkw n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mkw s TYR 184 N -2.10 2.89 0.84 1.61 2.02 -1.26 -4.63 117.35 116.71 1mkw s TYR 184 Ca 0.00 0.75 -0.12 0.00 -0.37 0.00 0.00 57.07 57.33 1mkw s TYR 184 Cb 0.00 -3.74 0.10 0.00 -0.40 0.00 0.00 41.96 37.92 1mkw s TYR 184 CO 0.00 -2.77 1.17 0.15 -1.57 0.00 0.00 175.55 172.52 1mkw s LYS 185 N 1.99 1.52 0.45 -0.62 1.02 -1.26 -4.93 119.74 117.90 1mkw s LYS 185 Ca 0.66 1.61 -0.25 0.00 0.02 0.00 0.00 55.97 58.01 1mkw s LYS 185 Cb -0.35 -1.78 -0.09 0.00 -0.52 0.00 0.00 37.83 35.09 1mkw s LYS 185 CO 0.29 -2.27 1.36 -0.35 -0.92 0.00 0.00 175.35 173.46 1mkw n PRO 186 N -3.63 2.09 0.00 -1.68 -0.04 -1.26 -4.79 135.00 125.68 1mkw n PRO 186 Ca 0.12 0.74 0.00 0.00 -0.04 0.00 0.00 63.50 64.33 1mkw n PRO 186 Cb 0.51 -2.53 0.00 0.00 -0.04 0.00 0.00 33.50 31.44 1mkw n PRO 186 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1mkw n GLY 186 N 0.69 -1.12 0.00 0.55 0.00 -1.26 -5.01 105.19 99.03 1mkw n GLY 186 Ca 0.06 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1mkw n GLY 186 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1mkw n GLU 186 N -0.88 0.00 -3.50 1.61 0.00 -1.26 -5.03 120.64 111.57 1mkw n GLU 186 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 57.16 56.88 1mkw n GLU 186 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 31.44 31.33 1mkw n GLU 186 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 1mkw s GLY 186 N 0.00 1.38 -0.38 8.31 0.00 -1.26 -4.94 107.32 110.43 1mkw s GLY 186 Ca 0.00 -2.52 0.11 0.00 0.00 0.00 0.00 44.72 42.31 1mkw s GLY 186 CO 0.00 1.94 0.71 0.28 0.00 0.00 0.00 173.10 176.03 1mkw n LYS 186 N 3.04 0.93 -1.23 2.90 4.76 -1.26 -5.04 118.16 122.25 1mkw n LYS 186 Ca 0.23 -3.31 -0.41 0.00 -2.87 0.00 0.00 58.31 51.95 1mkw n LYS 186 Cb 0.43 -1.61 -0.04 0.00 -1.84 0.00 0.00 35.03 31.96 1mkw n LYS 186 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 1mkw n ARG 187 N 0.47 1.84 -2.16 1.97 0.63 -1.26 -4.29 116.66 113.86 1mkw n ARG 187 Ca 0.24 -1.96 -0.02 0.00 -0.92 0.00 0.00 57.85 55.18 1mkw n ARG 187 Cb 0.64 -2.95 0.05 0.00 0.45 0.00 0.00 32.46 30.65 1mkw n ARG 187 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1mkw n GLY 188 N 4.37 1.49 3.89 5.14 0.00 -1.26 -3.96 105.19 114.86 1mkw n GLY 188 Ca 0.50 -0.42 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 1mkw n GLY 188 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1mkw s ASP 189 N -1.81 5.86 -0.52 1.61 -4.77 -1.26 -4.78 116.67 110.99 1mkw s ASP 189 Ca 0.14 1.04 0.05 0.00 -3.30 0.00 0.00 52.55 50.48 1mkw s ASP 189 Cb 0.31 -2.06 0.38 0.00 -1.09 0.00 0.00 42.92 40.45 1mkw s ASP 189 CO -0.08 -0.98 1.03 0.00 0.70 0.00 0.00 175.17 175.84 1mkw n ALA 190 N -2.66 4.88 1.95 2.11 0.00 -1.26 -4.62 120.51 120.91 1mkw n ALA 190 Ca 0.05 -4.54 0.14 0.00 0.00 0.00 0.00 53.44 49.09 1mkw n ALA 190 Cb 0.56 -0.66 0.81 0.00 0.00 0.00 0.00 19.45 20.15 1mkw n ALA 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mkw h GLU 192 N 0.20 0.18 -6.11 0.00 3.07 -1.80 -3.37 114.58 106.75 1mkw h GLU 192 Ca 0.00 -0.30 -0.57 0.00 -0.50 0.00 0.00 59.36 57.98 1mkw h GLU 192 Cb 0.04 0.11 0.01 0.00 -0.84 0.00 0.00 28.75 28.07 1mkw h GLU 192 CO 0.00 1.15 1.41 0.41 -1.40 0.00 0.00 179.01 180.57 1mkw n GLY 193 N 1.74 1.29 3.68 -3.84 0.00 -0.37 -1.22 105.19 106.48 1mkw n GLY 193 Ca -0.30 0.80 -0.45 0.00 0.00 0.00 0.00 46.02 46.07 1mkw n GLY 193 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1mkw n ASP 194 N 10.29 3.41 -4.71 1.61 5.68 -0.67 -4.53 116.55 127.63 1mkw n ASP 194 Ca 0.27 1.07 -0.40 0.00 -0.50 0.00 0.00 54.79 55.23 1mkw n ASP 194 Cb 0.43 -1.47 0.03 0.00 -1.14 0.00 0.00 41.12 38.97 1mkw n ASP 194 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 1mkw n SER 195 N 3.84 2.41 0.00 -1.12 2.88 -1.26 -0.17 113.62 120.20 1mkw n SER 195 Ca 0.17 1.02 0.00 0.00 -1.33 0.00 0.00 58.87 58.73 1mkw n SER 195 Cb 0.31 -1.52 0.00 0.00 -0.75 0.00 0.00 64.21 62.25 1mkw n SER 195 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1mkw n GLY 196 N 0.84 3.00 3.53 0.46 0.00 0.36 -0.62 105.19 112.76 1mkw n GLY 196 Ca 0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 1mkw n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mkw s GLY 197 N -1.19 1.54 0.12 -0.02 0.00 0.76 -3.73 107.32 104.80 1mkw s GLY 197 Ca 0.00 -0.22 -0.14 0.00 0.00 0.00 0.00 44.72 44.36 1mkw s GLY 197 CO 0.00 0.49 0.52 2.56 0.00 0.00 0.00 173.10 176.67 1mkw s PRO 198 N -4.58 3.97 -0.37 2.90 0.04 -1.26 -1.19 135.00 134.51 1mkw s PRO 198 Ca 0.68 0.48 -0.06 0.00 0.04 0.00 0.00 61.00 62.13 1mkw s PRO 198 Cb -0.23 -3.00 0.07 0.00 0.04 0.00 0.00 34.50 31.37 1mkw s PRO 198 CO 0.63 0.52 0.16 0.12 0.04 0.00 0.00 177.00 178.47 1mkw s PHE 199 N -1.39 3.35 0.16 0.56 5.36 -1.05 -4.24 117.98 120.74 1mkw s PHE 199 Ca 0.35 -1.72 0.07 0.00 -0.96 0.00 0.00 56.93 54.67 1mkw s PHE 199 Cb -0.16 -2.65 -0.04 0.00 -0.34 0.00 0.00 43.02 39.83 1mkw s PHE 199 CO 0.19 -0.83 -0.01 0.14 -1.46 0.00 0.00 175.22 173.25 1mkw s VAL 200 N 1.34 3.73 -0.01 3.12 -7.23 -0.17 0.76 120.40 121.94 1mkw s VAL 200 Ca 0.01 -1.38 0.03 0.00 -1.81 0.00 0.00 61.98 58.83 1mkw s VAL 200 Cb -0.21 -2.86 -0.01 0.00 0.56 0.00 0.00 36.38 33.86 1mkw s VAL 200 CO 0.01 -0.08 -0.09 -0.04 -0.31 0.00 0.00 175.10 174.59 1mkw s MET 201 N -2.84 0.75 -0.15 4.82 -1.94 0.13 0.80 119.30 120.87 1mkw s MET 201 Ca 0.27 -0.35 -0.12 0.00 -1.71 0.00 0.00 55.69 53.77 1mkw s MET 201 Cb -0.10 -0.73 -0.05 0.00 2.01 0.00 0.00 34.83 35.97 1mkw s MET 201 CO 0.18 0.20 0.26 0.21 -0.01 0.00 0.00 175.02 175.86 1mkw s LYS 202 N -0.26 4.12 -0.01 2.03 2.20 -1.26 0.15 119.74 126.71 1mkw s LYS 202 Ca 0.03 0.04 -0.28 0.00 -0.36 0.00 0.00 55.97 55.41 1mkw s LYS 202 Cb -0.04 -3.38 -0.03 0.00 -1.51 0.00 0.00 37.83 32.87 1mkw s LYS 202 CO -0.00 0.35 0.90 0.45 -0.36 0.00 0.00 175.35 176.68 1mkw s SER 203 N 0.15 7.27 0.12 1.43 0.15 0.17 -4.97 113.70 118.02 1mkw s SER 203 Ca 0.15 1.54 -0.05 0.00 0.70 0.00 0.00 55.95 58.29 1mkw s SER 203 Cb -0.13 -2.53 -0.12 0.00 -1.71 0.00 0.00 66.02 61.54 1mkw s SER 203 CO 0.04 -0.20 1.28 1.55 1.20 0.00 0.00 173.24 177.11 1mkw h PRO 204 N 6.67 0.40 -0.58 5.44 0.13 -1.96 -1.46 132.00 140.64 1mkw h PRO 204 Ca -0.41 -0.45 0.03 0.00 -0.87 0.00 0.00 66.00 64.30 1mkw h PRO 204 Cb 1.21 0.13 -0.03 0.00 0.13 0.00 0.00 31.00 32.45 1mkw h PRO 204 CO 0.75 1.13 0.39 -0.92 -0.23 0.00 0.00 178.00 179.11 1mkw h TYR 204 N 0.21 0.65 0.00 1.56 3.20 -1.97 -3.30 116.97 117.32 1mkw h TYR 204 Ca -0.09 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.80 1mkw h TYR 204 Cb 1.63 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 39.68 1mkw h TYR 204 CO 0.06 0.38 0.00 0.27 -1.64 0.00 0.00 178.16 177.23 1mkw n ASN 204 N -4.47 0.48 0.00 -2.11 2.04 -1.25 -5.01 115.26 104.94 1mkw n ASN 204 Ca 0.07 -1.11 0.00 0.00 -0.44 0.00 0.00 54.58 53.10 1mkw n ASN 204 Cb 0.14 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.39 1mkw n ASN 204 CO 0.00 0.00 0.00 -3.20 -0.44 0.00 0.00 177.26 173.62 1mkw n ASN 205 N -0.05 0.00 -4.83 0.53 5.15 -0.55 -4.98 115.26 110.53 1mkw n ASN 205 Ca 0.00 0.00 -0.34 0.00 -0.60 0.00 0.00 54.58 53.64 1mkw n ASN 205 Cb 0.23 -1.47 -0.06 0.00 -0.53 0.00 0.00 39.78 37.94 1mkw n ASN 205 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1mkw s ARG 206 N -0.57 4.16 0.07 1.20 0.52 -1.26 -4.78 118.95 118.29 1mkw s ARG 206 Ca 0.00 0.85 -0.19 0.00 -0.52 0.00 0.00 55.73 55.87 1mkw s ARG 206 Cb 0.00 -2.55 -0.07 0.00 0.52 0.00 0.00 34.95 32.85 1mkw s ARG 206 CO 0.00 0.21 0.57 -1.58 0.02 0.00 0.00 175.30 174.52 1mkw s TRP 207 N -1.85 3.81 0.05 -0.53 0.52 -0.64 -0.66 118.94 119.64 1mkw s TRP 207 Ca 0.52 1.27 0.07 0.00 0.02 0.00 0.00 56.10 57.99 1mkw s TRP 207 Cb -0.13 -2.50 -0.03 0.00 -1.15 0.00 0.00 33.47 29.67 1mkw s TRP 207 CO 0.18 0.58 -0.20 0.71 0.02 0.00 0.00 176.95 178.24 1mkw s TYR 208 N -1.08 1.78 -0.38 -1.98 1.51 0.12 -2.44 117.35 114.89 1mkw s TYR 208 Ca 0.29 -0.38 -0.20 0.00 -1.01 0.00 0.00 57.07 55.77 1mkw s TYR 208 Cb -0.19 -1.05 0.01 0.00 -0.11 0.00 0.00 41.96 40.61 1mkw s TYR 208 CO 0.19 0.11 0.60 -1.14 -1.11 0.00 0.00 175.55 174.20 1mkw s GLN 209 N -1.29 3.54 -0.07 -0.62 0.74 0.11 -0.69 119.66 121.37 1mkw s GLN 209 Ca 0.07 -0.14 0.16 0.00 0.05 0.00 0.00 55.36 55.50 1mkw s GLN 209 Cb -0.09 -3.85 -0.22 0.00 1.10 0.00 0.00 33.01 29.95 1mkw s GLN 209 CO 0.02 -0.79 0.48 -1.33 -0.55 0.00 0.00 175.29 173.12 1mkw n MET 210 N 6.02 0.65 -3.77 1.67 2.81 0.23 -4.38 117.12 120.34 1mkw n MET 210 Ca -0.02 0.13 -0.15 0.00 -1.81 0.00 0.00 57.70 55.84 1mkw n MET 210 Cb 0.48 -1.68 -0.05 0.00 -0.71 0.00 0.00 33.22 31.26 1mkw n MET 210 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1mkw n GLY 211 N 1.56 2.84 2.72 3.03 0.00 -0.40 -2.31 105.19 112.62 1mkw n GLY 211 Ca -0.20 -1.77 -0.21 0.00 0.00 0.00 0.00 46.02 43.85 1mkw n GLY 211 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mkw s ILE 212 N -3.01 0.09 -0.35 -0.61 1.01 -0.99 -2.54 121.20 114.81 1mkw s ILE 212 Ca 0.30 0.29 -0.36 0.00 0.00 0.00 0.00 60.65 60.88 1mkw s ILE 212 Cb 0.01 -0.30 -0.12 0.00 0.01 0.00 0.00 42.46 42.06 1mkw s ILE 212 CO 0.22 0.21 2.16 0.52 0.00 0.00 0.00 174.94 178.04 1mkw n VAL 213 N 5.15 0.19 0.00 2.92 0.31 -0.33 -1.75 118.33 124.81 1mkw n VAL 213 Ca -0.07 -0.23 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 1mkw n VAL 213 Cb 0.50 -1.57 0.00 0.00 -0.91 0.00 0.00 33.84 31.86 1mkw n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1mkw n SER 214 N 9.43 0.00 -0.34 4.52 2.88 -0.58 -0.48 113.62 129.05 1mkw n SER 214 Ca 0.41 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.95 1mkw n SER 214 Cb 0.21 -0.36 0.00 0.00 -0.75 0.00 0.00 64.21 63.31 1mkw n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1mkw n TRP 215 N -2.43 0.00 0.00 0.66 4.27 -1.12 -4.83 117.44 113.99 1mkw n TRP 215 Ca 0.00 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.61 1mkw n TRP 215 Cb 0.00 -0.03 0.00 0.00 -1.36 0.00 0.00 31.31 29.92 1mkw n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1mkw n GLY 216 N 0.00 0.00 0.00 -1.67 0.00 -1.23 -4.62 105.19 97.67 1mkw n GLY 216 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1mkw n GLY 216 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1mkw n GLU 217 N 0.00 1.15 -1.06 1.61 0.28 0.12 -4.42 120.64 118.31 1mkw n GLU 217 Ca 0.00 0.00 -0.02 0.00 -0.16 0.00 0.00 57.16 56.98 1mkw n GLU 217 Cb 0.00 0.00 -0.01 0.00 1.43 0.00 0.00 31.44 32.86 1mkw n GLU 217 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1mkw n GLY 219 N 4.45 0.48 1.64 -1.84 0.00 -1.24 -3.60 105.19 105.10 1mkw n GLY 219 Ca 0.00 -0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.74 1mkw n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mkw n ASP 221 N -1.90 0.00 0.00 0.00 2.03 -1.26 -2.55 116.55 112.87 1mkw n ASP 221 Ca -0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.30 1mkw n ASP 221 Cb 0.27 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.67 1mkw n ASP 221 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1mkw n ARG 221 N 0.00 0.00 -3.68 -0.67 5.12 -1.26 -5.17 116.66 111.00 1mkw n ARG 221 Ca 0.00 0.00 -0.11 0.00 -1.93 0.00 0.00 57.85 55.81 1mkw n ARG 221 Cb 0.00 0.00 -0.11 0.00 -1.16 0.00 0.00 32.46 31.19 1mkw n ARG 221 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1mkw s ASP 222 N 0.00 -0.14 -0.85 0.55 2.15 -1.06 -5.06 116.67 112.26 1mkw s ASP 222 Ca 0.00 0.78 -0.17 0.00 0.43 0.00 0.00 52.55 53.60 1mkw s ASP 222 Cb 0.00 0.88 -0.12 0.00 -0.30 0.00 0.00 42.92 43.38 1mkw s ASP 222 CO 0.00 -0.21 1.99 0.61 -0.17 0.00 0.00 175.17 177.39 1mkw n GLY 223 N 4.93 2.83 0.00 2.66 0.00 -1.26 -3.91 105.19 110.43 1mkw n GLY 223 Ca -0.14 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.72 1mkw n GLY 223 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1mkw n LYS 224 N 6.13 2.84 -3.98 1.61 4.76 -1.26 -4.88 118.16 123.36 1mkw n LYS 224 Ca 0.48 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.83 1mkw n LYS 224 Cb 0.32 0.00 -0.07 0.00 -1.84 0.00 0.00 35.03 33.44 1mkw n LYS 224 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1mkw s TYR 225 N 3.25 0.46 -0.04 2.13 2.02 -1.25 -4.53 117.35 119.38 1mkw s TYR 225 Ca 0.00 -0.81 -0.13 0.00 -0.37 0.00 0.00 57.07 55.75 1mkw s TYR 225 Cb 0.00 -0.09 -0.05 0.00 -0.40 0.00 0.00 41.96 41.41 1mkw s TYR 225 CO 0.00 -0.71 0.34 0.20 -1.57 0.00 0.00 175.55 173.81 1mkw s GLY 226 N -2.98 2.38 0.03 0.71 0.00 -0.88 0.10 107.32 106.69 1mkw s GLY 226 Ca 0.19 -0.33 0.02 0.00 0.00 0.00 0.00 44.72 44.59 1mkw s GLY 226 CO 0.01 0.08 0.04 -1.36 0.00 0.00 0.00 173.10 171.86 1mkw s PHE 227 N -0.87 3.13 0.04 1.90 0.40 -1.26 -1.52 117.98 119.80 1mkw s PHE 227 Ca 0.21 0.09 0.02 0.00 -0.60 0.00 0.00 56.93 56.65 1mkw s PHE 227 Cb -0.15 -1.65 -0.02 0.00 0.51 0.00 0.00 43.02 41.71 1mkw s PHE 227 CO 0.10 0.50 -0.06 0.71 0.70 0.00 0.00 175.22 177.17 1mkw s TYR 228 N -1.22 0.57 -0.14 0.36 1.51 -0.12 -1.53 117.35 116.78 1mkw s TYR 228 Ca 0.24 -0.54 -0.28 0.00 -1.01 0.00 0.00 57.07 55.48 1mkw s TYR 228 Cb -0.12 -0.35 -0.01 0.00 -0.11 0.00 0.00 41.96 41.37 1mkw s TYR 228 CO 0.15 -0.12 0.96 0.99 -1.11 0.00 0.00 175.55 176.43 1mkw s THR 229 N -1.56 4.80 -0.79 -0.71 2.01 -0.72 -1.74 115.64 116.93 1mkw s THR 229 Ca -0.10 1.93 -0.25 0.00 0.31 0.00 0.00 61.69 63.58 1mkw s THR 229 Cb -0.09 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 68.13 1mkw s THR 229 CO -0.00 -0.01 1.85 -2.28 -0.69 0.00 0.00 174.62 173.49 1mkw s HIS 230 N 2.17 1.82 0.23 4.92 2.46 -0.87 -2.35 115.29 123.66 1mkw s HIS 230 Ca 0.45 0.57 -0.08 0.00 0.47 0.00 0.00 55.06 56.47 1mkw s HIS 230 Cb -0.17 -4.13 0.20 0.00 -0.13 0.00 0.00 32.58 28.35 1mkw s HIS 230 CO 0.15 -1.99 1.89 0.28 -2.47 0.00 0.00 174.74 172.60 1mkw h VAL 231 N 7.04 1.23 -0.41 0.89 2.07 -1.77 -2.86 116.25 122.44 1mkw h VAL 231 Ca -0.05 -0.45 0.02 0.00 0.82 0.00 0.00 66.70 67.05 1mkw h VAL 231 Cb 1.07 -0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 1mkw h VAL 231 CO 1.23 0.23 0.23 0.15 0.02 0.00 0.00 177.57 179.42 1mkw h PHE 232 N 1.17 0.42 -0.09 1.57 3.57 -1.86 -2.11 116.94 119.61 1mkw h PHE 232 Ca 0.31 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.85 1mkw h PHE 232 Cb -0.10 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 38.50 1mkw h PHE 232 CO -0.01 0.23 0.16 0.00 -2.23 0.00 0.00 178.31 176.47 1mkw h ARG 233 N 0.46 0.00 -0.35 1.11 2.47 -1.88 -2.67 114.38 113.52 1mkw h ARG 233 Ca 0.17 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.84 1mkw h ARG 233 Cb 0.04 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.33 1mkw h ARG 233 CO -0.10 0.00 0.02 1.28 0.56 0.00 0.00 179.97 181.74 1mkw n LEU 234 N -3.43 4.30 0.15 3.04 4.77 -0.82 -4.75 117.00 120.26 1mkw n LEU 234 Ca -0.01 -3.14 0.00 0.00 -0.03 0.00 0.00 56.01 52.83 1mkw n LEU 234 Cb 0.25 -0.59 0.22 0.00 -2.33 0.00 0.00 43.42 40.97 1mkw n LEU 234 CO 0.23 0.77 0.55 0.50 -1.33 0.00 0.00 177.39 178.10 1mkw h LYS 235 N 1.94 0.00 -0.21 3.23 3.11 -1.22 -2.77 116.57 120.64 1mkw h LYS 235 Ca 0.06 0.00 -0.20 0.00 -2.81 0.00 0.00 60.65 57.70 1mkw h LYS 235 Cb 1.62 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.85 1mkw h LYS 235 CO 0.32 0.56 -0.65 -0.22 -2.81 0.00 0.00 179.45 176.65 1mkw h LYS 236 N 0.00 0.78 0.03 1.90 1.63 -1.85 -2.11 116.57 116.95 1mkw h LYS 236 Ca -0.01 -0.56 -0.00 0.00 -0.85 0.00 0.00 60.65 59.24 1mkw h LYS 236 Cb 1.01 0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.73 1mkw h LYS 236 CO 0.07 1.18 -0.02 2.35 -3.45 0.00 0.00 179.45 179.58 1mkw h TRP 237 N 0.57 -0.04 -0.53 1.91 7.01 -1.92 0.19 115.95 123.15 1mkw h TRP 237 Ca -0.01 -0.00 0.11 0.00 2.11 0.00 0.00 58.89 61.09 1mkw h TRP 237 Cb 1.26 0.01 -0.10 0.00 -2.10 0.00 0.00 29.16 28.23 1mkw h TRP 237 CO 0.07 0.31 -0.17 0.82 -2.79 0.00 0.00 178.44 176.68 1mkw h ILE 238 N -0.40 0.40 -0.54 2.65 2.04 -1.53 0.11 117.51 120.24 1mkw h ILE 238 Ca -0.00 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.88 1mkw h ILE 238 Cb 0.37 0.40 -0.04 0.00 -0.74 0.00 0.00 36.82 36.82 1mkw h ILE 238 CO 0.01 0.00 0.32 1.56 0.00 0.00 0.00 178.15 180.04 1mkw h GLN 239 N -0.05 0.62 0.50 2.37 4.20 -1.21 -1.32 115.11 120.23 1mkw h GLN 239 Ca 0.25 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.91 1mkw h GLN 239 Cb 0.43 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 1mkw h GLN 239 CO -0.57 0.41 -0.46 -0.22 -0.67 0.00 0.00 178.83 177.32 1mkw h LYS 240 N 0.64 -0.91 -0.62 1.46 3.64 0.86 -1.30 116.57 120.34 1mkw h LYS 240 Ca 0.22 0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.61 1mkw h LYS 240 Cb 0.03 0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 1mkw h LYS 240 CO -0.10 -0.61 0.20 -0.39 -2.27 0.00 0.00 179.45 176.29 1mkw h VAL 241 N -0.95 1.23 0.52 2.00 -1.51 -0.80 -3.01 116.25 113.74 1mkw h VAL 241 Ca -0.06 -0.78 -0.03 0.00 -1.23 0.00 0.00 66.70 64.60 1mkw h VAL 241 Cb 0.81 0.54 0.01 0.00 -2.13 0.00 0.00 31.29 30.52 1mkw h VAL 241 CO -0.03 0.30 -0.25 0.40 -1.23 0.00 0.00 177.57 176.76 1mkw h ILE 242 N 0.90 0.32 -0.03 7.19 2.04 -1.23 -3.52 117.51 123.18 1mkw h ILE 242 Ca 0.20 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.64 1mkw h ILE 242 Cb 0.24 0.44 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 1mkw h ILE 242 CO -0.01 0.05 0.00 -0.90 0.00 0.00 0.00 178.15 177.29