#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mhw s ILE 17 N 0.00 4.56 0.00 1.39 -1.09 0.12 -4.11 121.20 122.07 3mhw s ILE 17 Ca 0.00 1.84 0.00 0.00 -2.23 0.00 0.00 60.65 60.26 3mhw s ILE 17 Cb 0.00 -4.18 0.00 0.00 -1.58 0.00 0.00 42.46 36.70 3mhw s ILE 17 CO 0.00 0.13 0.00 0.61 -1.23 0.00 0.00 174.94 174.45 3mhw n GLY 18 N 3.03 1.15 7.00 6.18 0.00 -1.26 -2.39 105.19 118.90 3mhw n GLY 18 Ca 0.07 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.38 3mhw n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mhw n GLY 19 N 0.00 1.16 3.15 -0.02 0.00 -1.26 -4.91 105.19 103.31 3mhw n GLY 19 Ca 0.00 -0.63 -0.12 0.00 0.00 0.00 0.00 46.02 45.28 3mhw n GLY 19 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3mhw s GLU 20 N 0.00 0.56 0.59 1.61 -1.05 0.01 -5.00 118.70 115.42 3mhw s GLU 20 Ca 0.00 -0.39 -0.19 0.00 -0.15 0.00 0.00 54.97 54.25 3mhw s GLU 20 Cb 0.00 0.24 -0.04 0.00 -0.44 0.00 0.00 34.13 33.89 3mhw s GLU 20 CO 0.00 -0.14 1.17 -0.06 0.95 0.00 0.00 175.26 177.18 3mhw s PHE 21 N -1.56 2.48 0.31 4.83 0.40 -1.26 -0.91 117.98 122.28 3mhw s PHE 21 Ca -0.13 1.53 0.02 0.00 -0.60 0.00 0.00 56.93 57.75 3mhw s PHE 21 Cb -0.06 -3.39 -0.01 0.00 0.51 0.00 0.00 43.02 40.07 3mhw s PHE 21 CO 0.01 -1.98 0.37 -2.37 0.70 0.00 0.00 175.22 171.96 3mhw n THR 22 N -1.61 0.00 -4.38 0.64 5.66 0.02 -4.79 114.28 109.82 3mhw n THR 22 Ca 0.13 -1.83 -0.19 0.00 -3.05 0.00 0.00 64.05 59.11 3mhw n THR 22 Cb 0.50 1.03 -0.10 0.00 -1.55 0.00 0.00 70.33 70.21 3mhw n THR 22 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3mhw s THR 23 N -2.94 0.87 0.38 1.09 -4.23 -1.26 -4.21 115.64 105.34 3mhw s THR 23 Ca 0.30 -2.00 0.33 0.00 -1.18 0.00 0.00 61.69 59.14 3mhw s THR 23 Cb 0.00 -2.71 0.35 0.00 1.34 0.00 0.00 72.50 71.49 3mhw s THR 23 CO 0.21 -0.01 2.11 -0.29 -0.54 0.00 0.00 174.62 176.11 3mhw h ILE 24 N 2.26 0.28 0.00 2.99 6.09 -1.89 -1.51 117.51 125.73 3mhw h ILE 24 Ca -0.39 -0.42 -0.00 0.00 -1.37 0.00 0.00 64.86 62.67 3mhw h ILE 24 Cb 1.25 1.32 -0.00 0.00 0.47 0.00 0.00 36.82 39.86 3mhw h ILE 24 CO 0.65 0.06 -0.02 -0.33 -3.07 0.00 0.00 178.15 175.45 3mhw h GLU 25 N 0.00 0.00 -0.01 2.19 3.07 -1.86 -1.00 114.58 116.97 3mhw h GLU 25 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3mhw h GLU 25 Cb 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.23 3mhw h GLU 25 CO 0.01 0.02 -0.13 0.09 -1.40 0.00 0.00 179.01 177.60 3mhw n ASN 26 N -3.89 1.24 -2.82 1.42 3.02 -0.57 -4.38 115.26 109.28 3mhw n ASN 26 Ca -0.03 -1.18 -0.11 0.00 -0.03 0.00 0.00 54.58 53.23 3mhw n ASN 26 Cb 0.10 0.06 0.05 0.00 -0.61 0.00 0.00 39.78 39.38 3mhw n ASN 26 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 3mhw n GLN 27 N -0.26 0.89 0.00 3.52 -0.06 -0.47 -5.04 117.38 115.97 3mhw n GLN 27 Ca 0.16 -2.11 0.12 0.00 -2.00 0.00 0.00 57.00 53.17 3mhw n GLN 27 Cb 0.35 -1.29 0.63 0.00 -4.06 0.00 0.00 30.24 25.87 3mhw n GLN 27 CO 0.00 0.00 0.00 -0.35 -0.20 0.00 0.00 177.06 176.51 3mhw n PRO 28 N 0.97 0.46 0.00 3.69 -0.04 -0.65 -1.14 135.00 138.29 3mhw n PRO 28 Ca 0.10 0.05 0.14 0.00 -0.04 0.00 0.00 63.50 63.75 3mhw n PRO 28 Cb 0.65 -1.50 0.52 0.00 -0.04 0.00 0.00 33.50 33.13 3mhw n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 3mhw n TRP 29 N -1.20 0.00 -2.25 0.54 2.14 -1.12 -1.56 117.44 113.99 3mhw n TRP 29 Ca 0.13 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.28 3mhw n TRP 29 Cb 0.16 -0.18 -0.03 0.00 -0.81 0.00 0.00 31.31 30.44 3mhw n TRP 29 CO 0.00 0.00 0.00 0.12 2.07 0.00 0.00 177.69 179.88 3mhw s PHE 30 N -2.54 3.29 -0.10 -2.67 2.19 -0.29 -0.36 117.98 117.51 3mhw s PHE 30 Ca 0.26 1.05 0.01 0.00 0.33 0.00 0.00 56.93 58.58 3mhw s PHE 30 Cb 0.20 -3.60 -0.02 0.00 -1.31 0.00 0.00 43.02 38.28 3mhw s PHE 30 CO 0.50 -2.05 -0.10 0.00 1.83 0.00 0.00 175.22 175.40 3mhw s ALA 31 N 1.13 2.78 -0.26 11.12 0.00 -0.03 -4.35 121.76 132.16 3mhw s ALA 31 Ca 0.63 -0.90 -0.09 0.00 0.00 0.00 0.00 51.96 51.60 3mhw s ALA 31 Cb -0.34 -1.20 -0.04 0.00 0.00 0.00 0.00 23.12 21.54 3mhw s ALA 31 CO 0.30 0.41 0.11 0.00 0.00 0.00 0.00 175.76 176.58 3mhw s ALA 32 N -0.24 3.30 -0.14 0.00 0.00 -0.40 -1.23 121.76 123.05 3mhw s ALA 32 Ca 0.02 -1.09 -0.01 0.00 0.00 0.00 0.00 51.96 50.88 3mhw s ALA 32 Cb -0.13 -2.20 -0.01 0.00 0.00 0.00 0.00 23.12 20.78 3mhw s ALA 32 CO 0.03 -0.47 -0.12 0.42 0.00 0.00 0.00 175.76 175.63 3mhw s ILE 33 N 1.58 3.12 0.19 0.00 1.01 -0.49 -0.80 121.20 125.81 3mhw s ILE 33 Ca 0.06 -0.63 0.09 0.00 0.00 0.00 0.00 60.65 60.18 3mhw s ILE 33 Cb -0.15 -2.33 -0.04 0.00 0.01 0.00 0.00 42.46 39.95 3mhw s ILE 33 CO 0.06 0.51 -0.18 -0.31 0.00 0.00 0.00 174.94 175.02 3mhw s TYR 34 N 0.52 1.90 -0.06 3.97 2.02 0.37 -0.42 117.35 125.64 3mhw s TYR 34 Ca -0.08 -0.46 0.05 0.00 -0.37 0.00 0.00 57.07 56.21 3mhw s TYR 34 Cb -0.15 -0.91 -0.01 0.00 -0.40 0.00 0.00 41.96 40.48 3mhw s TYR 34 CO 0.04 0.40 -0.23 0.50 -1.57 0.00 0.00 175.55 174.69 3mhw s ARG 35 N -3.07 2.51 -0.08 -0.62 3.52 0.37 -0.81 118.95 120.77 3mhw s ARG 35 Ca 0.20 -0.85 -0.22 0.00 -0.13 0.00 0.00 55.73 54.73 3mhw s ARG 35 Cb -0.05 -2.08 -0.04 0.00 -1.56 0.00 0.00 34.95 31.22 3mhw s ARG 35 CO 0.08 0.32 0.63 -0.98 -0.81 0.00 0.00 175.30 174.54 3mhw s ARG 36 N -0.03 4.41 0.35 5.12 1.70 0.12 -1.37 118.95 129.25 3mhw s ARG 36 Ca -0.07 0.75 -0.02 0.00 -0.47 0.00 0.00 55.73 55.92 3mhw s ARG 36 Cb -0.14 -3.44 -0.04 0.00 -0.57 0.00 0.00 34.95 30.76 3mhw s ARG 36 CO 0.04 0.10 0.59 -1.01 -1.08 0.00 0.00 175.30 173.94 3mhw s HIS 37 N 0.72 3.50 -0.54 5.89 3.76 0.94 -4.87 115.29 124.68 3mhw s HIS 37 Ca 0.34 0.51 -0.29 0.00 -0.15 0.00 0.00 55.06 55.47 3mhw s HIS 37 Cb -0.17 -2.02 -0.31 0.00 1.11 0.00 0.00 32.58 31.19 3mhw s HIS 37 CO 0.16 0.08 1.85 2.89 -0.85 0.00 0.00 174.74 178.87 3mhw n ARG 37 N -1.58 0.07 0.00 1.40 0.00 -1.26 -4.00 116.66 111.29 3mhw n ARG 37 Ca -0.03 -1.36 0.12 0.00 -0.00 0.00 0.00 57.85 56.58 3mhw n ARG 37 Cb 0.55 -3.22 0.28 0.00 -0.00 0.00 0.00 32.46 30.07 3mhw n ARG 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3mhw n GLY 37 N 5.55 -1.26 3.77 2.89 0.00 -1.26 -5.13 105.19 109.75 3mhw n GLY 37 Ca 0.44 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 3mhw n GLY 37 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3mhw s SER 37 N -2.99 6.79 -0.12 1.61 1.04 -1.26 -4.99 113.70 113.77 3mhw s SER 37 Ca 0.11 2.68 0.01 0.00 0.48 0.00 0.00 55.95 59.23 3mhw s SER 37 Cb 0.18 -2.65 -0.01 0.00 0.10 0.00 0.00 66.02 63.64 3mhw s SER 37 CO 0.69 -0.52 -0.16 -0.69 0.98 0.00 0.00 173.24 173.54 3mhw s VAL 38 N -1.14 2.83 0.11 5.02 1.01 -1.26 -0.04 120.40 126.93 3mhw s VAL 38 Ca 0.49 -0.74 0.06 0.00 0.00 0.00 0.00 61.98 61.78 3mhw s VAL 38 Cb -0.40 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 3mhw s VAL 38 CO 0.53 0.53 -0.14 0.42 0.00 0.00 0.00 175.10 176.43 3mhw s THR 39 N 0.32 1.32 0.25 3.92 -4.23 -0.47 -4.95 115.64 111.80 3mhw s THR 39 Ca -0.12 -1.65 -0.30 0.00 -1.18 0.00 0.00 61.69 58.44 3mhw s THR 39 Cb -0.16 -1.47 -0.09 0.00 1.34 0.00 0.00 72.50 72.12 3mhw s THR 39 CO 0.06 -0.37 1.19 -0.47 -0.54 0.00 0.00 174.62 174.50 3mhw s TYR 40 N -1.96 3.40 -0.04 3.99 5.04 -1.26 -0.48 117.35 126.03 3mhw s TYR 40 Ca 0.07 1.50 -0.05 0.00 -2.44 0.00 0.00 57.07 56.15 3mhw s TYR 40 Cb -0.06 -3.44 -0.02 0.00 0.35 0.00 0.00 41.96 38.80 3mhw s TYR 40 CO 0.03 -1.15 -0.10 0.28 -1.34 0.00 0.00 175.55 173.27 3mhw n VAL 41 N 1.73 0.52 -3.79 3.14 0.31 0.43 -4.85 118.33 115.82 3mhw n VAL 41 Ca 0.02 0.32 -0.05 0.00 -0.01 0.00 0.00 64.34 64.63 3mhw n VAL 41 Cb 0.44 -1.68 -0.01 0.00 -0.91 0.00 0.00 33.84 31.67 3mhw n VAL 41 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3mhw s GLY 43 N -2.94 1.77 0.25 0.00 0.00 -0.50 -1.40 107.32 104.50 3mhw s GLY 43 Ca 0.12 -1.55 -0.15 0.00 0.00 0.00 0.00 44.72 43.14 3mhw s GLY 43 CO 0.04 -1.06 0.75 0.61 0.00 0.00 0.00 173.10 173.44 3mhw n GLY 44 N -2.74 0.95 2.85 0.20 0.00 -0.36 -3.68 105.19 102.41 3mhw n GLY 44 Ca 0.13 -1.17 -0.16 0.00 0.00 0.00 0.00 46.02 44.81 3mhw n GLY 44 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3mhw s SER 45 N -2.86 0.43 -0.31 1.61 0.01 -0.10 -0.85 113.70 111.64 3mhw s SER 45 Ca 0.16 -0.04 -0.29 0.00 1.31 0.00 0.00 55.95 57.09 3mhw s SER 45 Cb -0.03 -0.19 0.00 0.00 0.21 0.00 0.00 66.02 66.01 3mhw s SER 45 CO 0.07 -0.06 1.29 -0.22 0.41 0.00 0.00 173.24 174.73 3mhw s LEU 46 N 0.75 3.87 -0.01 2.44 2.96 0.52 -0.56 118.68 128.65 3mhw s LEU 46 Ca -0.08 1.17 0.15 0.00 -0.22 0.00 0.00 54.13 55.16 3mhw s LEU 46 Cb -0.11 -3.54 -0.20 0.00 0.50 0.00 0.00 46.19 42.84 3mhw s LEU 46 CO -0.01 -1.08 0.51 2.30 -1.32 0.00 0.00 176.35 176.74 3mhw n ILE 47 N 6.23 0.00 -3.69 6.68 -5.35 -0.23 -1.39 119.36 121.61 3mhw n ILE 47 Ca 0.15 -0.24 -0.09 0.00 -0.27 0.00 0.00 62.75 62.29 3mhw n ILE 47 Cb 0.47 0.61 -0.02 0.00 -1.74 0.00 0.00 39.64 38.95 3mhw n ILE 47 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3mhw s SER 48 N -3.06 -0.37 0.49 7.28 1.04 -1.18 -4.70 113.70 113.21 3mhw s SER 48 Ca 0.00 -0.38 0.26 0.00 0.48 0.00 0.00 55.95 56.32 3mhw s SER 48 Cb 0.11 0.66 1.33 0.00 0.10 0.00 0.00 66.02 68.22 3mhw s SER 48 CO 0.64 -1.17 1.88 -0.65 0.98 0.00 0.00 173.24 174.92 3mhw h PRO 49 N 2.03 0.15 -0.02 4.02 0.11 -1.95 -1.94 132.00 134.40 3mhw h PRO 49 Ca -0.26 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3mhw h PRO 49 Cb 1.27 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3mhw h PRO 49 CO 0.31 0.10 -0.02 0.00 -0.21 0.00 0.00 178.00 178.17 3mhw s TRP 51 N -1.49 1.51 -0.12 0.00 0.52 -0.73 -0.77 118.94 117.86 3mhw s TRP 51 Ca 0.20 -0.64 -0.01 0.00 0.02 0.00 0.00 56.10 55.67 3mhw s TRP 51 Cb 0.15 -1.15 -0.02 0.00 -1.15 0.00 0.00 33.47 31.29 3mhw s TRP 51 CO 0.23 -0.37 -0.08 0.08 0.02 0.00 0.00 176.95 176.83 3mhw s VAL 52 N 1.00 3.53 -0.09 4.03 1.01 -0.22 -1.06 120.40 128.59 3mhw s VAL 52 Ca -0.08 -0.50 -0.03 0.00 0.00 0.00 0.00 61.98 61.37 3mhw s VAL 52 Cb -0.15 -2.50 -0.03 0.00 0.00 0.00 0.00 36.38 33.70 3mhw s VAL 52 CO -0.00 0.53 0.02 -0.51 0.00 0.00 0.00 175.10 175.14 3mhw s ILE 53 N 0.07 4.48 0.00 2.22 2.07 0.28 -0.05 121.20 130.26 3mhw s ILE 53 Ca -0.02 -0.18 0.00 0.00 -1.41 0.00 0.00 60.65 59.03 3mhw s ILE 53 Cb -0.14 -2.90 0.00 0.00 0.13 0.00 0.00 42.46 39.55 3mhw s ILE 53 CO 0.03 0.60 0.00 -0.24 -1.91 0.00 0.00 174.94 173.43 3mhw n SER 54 N 2.18 0.00 -4.49 4.50 2.88 -0.11 -0.92 113.62 117.66 3mhw n SER 54 Ca -0.19 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.02 3mhw n SER 54 Cb 0.54 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.87 3mhw n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3mhw s ALA 55 N -1.46 2.80 0.38 -1.46 0.00 -1.26 -0.99 121.76 119.77 3mhw s ALA 55 Ca 0.00 -0.90 0.08 0.00 0.00 0.00 0.00 51.96 51.13 3mhw s ALA 55 Cb 0.00 -1.20 0.81 0.00 0.00 0.00 0.00 23.12 22.73 3mhw s ALA 55 CO 0.00 0.43 1.97 1.15 0.00 0.00 0.00 175.76 179.31 3mhw h THR 56 N 4.71 1.00 0.00 0.00 2.02 -1.74 -2.76 112.91 116.14 3mhw h THR 56 Ca -0.39 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 66.55 3mhw h THR 56 Cb 1.18 0.27 -0.00 0.00 -1.74 0.00 0.00 68.15 67.86 3mhw h THR 56 CO 0.54 0.12 -0.01 1.12 0.37 0.00 0.00 175.52 177.66 3mhw h HIS 57 N 0.67 0.00 0.00 3.16 2.07 -1.92 -0.35 115.15 118.78 3mhw h HIS 57 Ca 0.30 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.80 3mhw h HIS 57 Cb 0.30 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.28 3mhw h HIS 57 CO -0.00 0.01 -0.06 0.00 -3.07 0.00 0.00 177.93 174.81 3mhw n PHE 59 N -3.22 0.00 0.12 0.00 3.72 -0.19 -4.82 117.46 113.06 3mhw n PHE 59 Ca -0.00 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.44 3mhw n PHE 59 Cb 0.30 0.00 0.46 0.00 -0.94 0.00 0.00 39.48 39.30 3mhw n PHE 59 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 3mhw h ILE 60 N 0.00 1.11 0.00 4.37 6.09 -1.52 -1.20 117.51 126.35 3mhw h ILE 60 Ca 0.00 -0.40 -0.02 0.00 -1.37 0.00 0.00 64.86 63.07 3mhw h ILE 60 Cb 0.00 0.94 -0.00 0.00 0.47 0.00 0.00 36.82 38.22 3mhw h ILE 60 CO 0.00 0.14 -0.07 0.44 -3.07 0.00 0.00 178.15 175.58 3mhw h ASP 60 N 0.27 0.00 -2.22 2.19 3.32 -1.88 -3.37 116.42 114.74 3mhw h ASP 60 Ca 0.07 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.54 3mhw h ASP 60 Cb 0.14 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 39.30 3mhw h ASP 60 CO -0.00 0.07 -0.96 -1.22 -1.72 0.00 0.00 179.24 175.41 3mhw n TYR 60 N -3.13 0.22 1.69 4.55 4.02 -0.48 -5.01 117.16 119.02 3mhw n TYR 60 Ca 0.03 -3.61 0.11 0.00 -0.01 0.00 0.00 57.90 54.42 3mhw n TYR 60 Cb 0.51 -0.20 0.66 0.00 -0.02 0.00 0.00 39.34 40.28 3mhw n TYR 60 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 3mhw n PRO 60 N 1.83 0.84 -2.76 -0.72 -0.04 -1.03 -4.81 135.00 128.32 3mhw n PRO 60 Ca 0.25 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.28 3mhw n PRO 60 Cb 0.49 -1.41 -0.03 0.00 -0.04 0.00 0.00 33.50 32.51 3mhw n PRO 60 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 3mhw s LYS 61 N -2.00 4.25 0.52 0.54 2.20 -1.26 -4.92 119.74 119.07 3mhw s LYS 61 Ca 0.33 1.20 0.18 0.00 -0.36 0.00 0.00 55.97 57.32 3mhw s LYS 61 Cb 0.15 -3.63 1.31 0.00 -1.51 0.00 0.00 37.83 34.15 3mhw s LYS 61 CO 0.26 -0.55 2.13 1.57 -0.36 0.00 0.00 175.35 178.40 3mhw h LYS 62 N 7.50 0.00 0.00 4.03 2.10 -1.89 -2.43 116.57 125.88 3mhw h LYS 62 Ca -0.22 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.43 3mhw h LYS 62 Cb 1.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.41 3mhw h LYS 62 CO 0.93 0.04 0.00 0.93 -2.00 0.00 0.00 179.45 179.35 3mhw h GLU 62 N 0.00 0.00 0.00 0.07 3.07 -1.92 -2.91 114.58 112.89 3mhw h GLU 62 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3mhw h GLU 62 Cb 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 3mhw h GLU 62 CO 0.01 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.37 3mhw n ASP 63 N -2.51 0.35 -4.58 1.42 8.00 -0.91 -4.93 116.55 113.40 3mhw n ASP 63 Ca 0.00 0.55 -0.30 0.00 0.71 0.00 0.00 54.79 55.75 3mhw n ASP 63 Cb 0.16 -0.64 -0.10 0.00 -0.02 0.00 0.00 41.12 40.53 3mhw n ASP 63 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3mhw s TYR 64 N -3.07 2.76 -0.04 1.24 1.51 -1.10 0.12 117.35 118.77 3mhw s TYR 64 Ca 0.11 -0.14 0.03 0.00 -1.01 0.00 0.00 57.07 56.06 3mhw s TYR 64 Cb 0.14 -1.46 0.00 0.00 -0.11 0.00 0.00 41.96 40.54 3mhw s TYR 64 CO 0.50 0.41 -0.12 0.42 -1.11 0.00 0.00 175.55 175.65 3mhw s ILE 65 N -1.18 1.08 -0.11 2.71 1.01 0.01 -4.14 121.20 120.58 3mhw s ILE 65 Ca 0.21 -0.51 0.03 0.00 0.00 0.00 0.00 60.65 60.38 3mhw s ILE 65 Cb -0.11 -0.96 -0.00 0.00 0.01 0.00 0.00 42.46 41.40 3mhw s ILE 65 CO 0.13 0.33 -0.20 -0.69 0.00 0.00 0.00 174.94 174.50 3mhw s VAL 66 N 0.25 2.37 -0.05 2.92 1.01 -0.58 -0.48 120.40 125.84 3mhw s VAL 66 Ca -0.06 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.02 3mhw s VAL 66 Cb -0.11 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.30 3mhw s VAL 66 CO 0.02 0.55 -0.05 -0.31 0.00 0.00 0.00 175.10 175.31 3mhw s TYR 67 N 0.37 2.98 0.17 5.22 2.02 0.02 -0.36 117.35 127.78 3mhw s TYR 67 Ca -0.16 0.05 0.10 0.00 -0.37 0.00 0.00 57.07 56.68 3mhw s TYR 67 Cb -0.17 -1.70 -0.04 0.00 -0.40 0.00 0.00 41.96 39.65 3mhw s TYR 67 CO 0.07 0.38 -0.14 -0.51 -1.57 0.00 0.00 175.55 173.78 3mhw s LEU 68 N -1.04 2.80 -1.01 -1.29 1.43 -0.43 -1.28 118.68 117.86 3mhw s LEU 68 Ca 0.14 -0.65 0.00 0.00 -1.03 0.00 0.00 54.13 52.60 3mhw s LEU 68 Cb -0.11 -1.52 0.00 0.00 0.03 0.00 0.00 46.19 44.59 3mhw s LEU 68 CO 0.04 0.12 0.00 0.61 0.23 0.00 0.00 176.35 177.35 3mhw n GLY 69 N 0.21 0.36 3.43 -3.19 0.00 -1.24 -1.34 105.19 103.41 3mhw n GLY 69 Ca -0.12 -0.46 -0.34 0.00 0.00 0.00 0.00 46.02 45.10 3mhw n GLY 69 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3mhw s ARG 70 N -4.00 3.54 -0.01 1.61 3.52 -1.26 -4.14 118.95 118.22 3mhw s ARG 70 Ca 0.00 -0.58 0.15 0.00 -0.13 0.00 0.00 55.73 55.17 3mhw s ARG 70 Cb 0.00 -2.87 -0.18 0.00 -1.56 0.00 0.00 34.95 30.34 3mhw s ARG 70 CO 0.00 0.15 0.56 0.43 -0.81 0.00 0.00 175.30 175.63 3mhw n SER 71 N 3.79 0.90 -4.27 -2.12 7.64 -1.26 -4.68 113.62 113.62 3mhw n SER 71 Ca -0.18 -0.64 -0.24 0.00 1.01 0.00 0.00 58.87 58.82 3mhw n SER 71 Cb 0.52 1.17 -0.13 0.00 -1.01 0.00 0.00 64.21 64.76 3mhw n SER 71 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3mhw s ARG 72 N -2.57 1.22 0.02 1.43 0.52 -1.26 -1.72 118.95 116.60 3mhw s ARG 72 Ca 0.03 -1.05 -0.19 0.00 -0.52 0.00 0.00 55.73 53.99 3mhw s ARG 72 Cb 0.11 -1.42 -0.19 0.00 0.52 0.00 0.00 34.95 33.97 3mhw s ARG 72 CO 0.62 0.34 1.19 1.25 0.02 0.00 0.00 175.30 178.72 3mhw h LEU 73 N 4.44 0.52 -2.75 2.53 6.46 -1.03 -3.37 115.31 122.10 3mhw h LEU 73 Ca -0.44 -0.67 0.00 0.00 -0.12 0.00 0.00 57.88 56.65 3mhw h LEU 73 Cb 1.17 -0.15 0.00 0.00 -0.73 0.00 0.00 40.66 40.95 3mhw h LEU 73 CO 0.41 1.10 -0.10 0.59 -0.62 0.00 0.00 178.44 179.82 3mhw n ASN 74 N -4.30 1.78 -4.06 1.25 3.02 -1.26 -5.00 115.26 106.68 3mhw n ASN 74 Ca -0.09 -2.74 -0.10 0.00 -0.03 0.00 0.00 54.58 51.62 3mhw n ASN 74 Cb 0.58 -0.34 -0.11 0.00 -0.61 0.00 0.00 39.78 39.30 3mhw n ASN 74 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3mhw s SER 75 N -2.29 0.64 0.40 6.41 1.04 -1.26 -5.14 113.70 113.50 3mhw s SER 75 Ca 0.22 -0.70 -0.24 0.00 0.48 0.00 0.00 55.95 55.71 3mhw s SER 75 Cb 0.20 0.10 -0.09 0.00 0.10 0.00 0.00 66.02 66.33 3mhw s SER 75 CO 0.02 -0.36 1.07 0.20 0.98 0.00 0.00 173.24 175.16 3mhw s ASN 76 N -2.06 6.68 -0.14 7.02 0.01 -1.26 -4.46 114.94 120.73 3mhw s ASN 76 Ca -0.05 2.10 -0.05 0.00 -0.71 0.00 0.00 52.86 54.16 3mhw s ASN 76 Cb -0.04 -2.59 -0.03 0.00 0.41 0.00 0.00 41.25 39.00 3mhw s ASN 76 CO -0.03 -0.55 0.02 -0.89 -1.51 0.00 0.00 177.10 174.14 3mhw s THR 77 N -1.62 4.46 0.21 1.60 2.01 -1.26 -4.94 115.64 116.10 3mhw s THR 77 Ca 0.58 -0.17 -0.32 0.00 0.31 0.00 0.00 61.69 62.09 3mhw s THR 77 Cb -0.24 -2.95 -0.13 0.00 0.01 0.00 0.00 72.50 69.20 3mhw s THR 77 CO 0.30 0.53 1.60 1.67 -0.69 0.00 0.00 174.62 178.03 3mhw n GLN 78 N 2.93 2.40 -0.34 4.92 7.27 -1.26 -1.62 117.38 131.68 3mhw n GLN 78 Ca -0.18 0.86 0.00 0.00 0.07 0.00 0.00 57.00 57.76 3mhw n GLN 78 Cb 0.53 -2.64 0.00 0.00 2.41 0.00 0.00 30.24 30.54 3mhw n GLN 78 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3mhw n GLY 79 N 3.23 1.05 3.74 1.69 0.00 -1.26 -5.03 105.19 108.62 3mhw n GLY 79 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 3mhw n GLY 79 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3mhw s GLU 80 N -0.47 2.15 -0.02 1.61 -1.05 -0.64 -4.89 118.70 115.39 3mhw s GLU 80 Ca 0.00 1.40 0.07 0.00 -0.15 0.00 0.00 54.97 56.28 3mhw s GLU 80 Cb 0.00 -1.87 -0.02 0.00 -0.44 0.00 0.00 34.13 31.81 3mhw s GLU 80 CO 0.00 -1.76 -0.22 -1.64 0.95 0.00 0.00 175.26 172.59 3mhw s MET 81 N -4.47 1.89 -0.12 -4.83 -1.94 -0.45 -5.00 119.30 104.39 3mhw s MET 81 Ca 0.66 -0.79 -0.02 0.00 -1.71 0.00 0.00 55.69 53.82 3mhw s MET 81 Cb -0.21 -1.78 -0.03 0.00 2.01 0.00 0.00 34.83 34.82 3mhw s MET 81 CO 0.51 0.45 -0.02 0.21 -0.01 0.00 0.00 175.02 176.15 3mhw s LYS 82 N -0.43 3.28 0.06 2.03 2.20 -1.26 -1.32 119.74 124.30 3mhw s LYS 82 Ca 0.06 -0.48 0.04 0.00 -0.36 0.00 0.00 55.97 55.23 3mhw s LYS 82 Cb -0.09 -2.83 -0.03 0.00 -1.51 0.00 0.00 37.83 33.37 3mhw s LYS 82 CO -0.00 0.48 -0.11 -0.06 -0.36 0.00 0.00 175.35 175.30 3mhw s PHE 83 N -0.28 0.95 0.59 4.03 0.08 0.51 -4.57 117.98 119.29 3mhw s PHE 83 Ca 0.05 -0.48 -0.05 0.00 0.12 0.00 0.00 56.93 56.58 3mhw s PHE 83 Cb -0.12 -0.55 0.02 0.00 -0.57 0.00 0.00 43.02 41.80 3mhw s PHE 83 CO 0.02 -0.01 0.88 -1.21 -0.10 0.00 0.00 175.22 174.80 3mhw s GLU 84 N -1.65 2.76 -0.40 0.44 2.02 0.58 -1.52 118.70 120.93 3mhw s GLU 84 Ca -0.06 -0.19 -0.13 0.00 0.02 0.00 0.00 54.97 54.61 3mhw s GLU 84 Cb -0.10 -2.31 0.03 0.00 0.10 0.00 0.00 34.13 31.85 3mhw s GLU 84 CO 0.01 -0.75 0.27 0.08 0.02 0.00 0.00 175.26 174.90 3mhw s VAL 85 N -2.96 4.99 0.18 2.63 1.01 -1.26 -1.29 120.40 123.70 3mhw s VAL 85 Ca 0.55 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.74 3mhw s VAL 85 Cb -0.10 -3.81 -0.10 0.00 0.00 0.00 0.00 36.38 32.36 3mhw s VAL 85 CO 0.43 -0.31 1.44 -0.08 0.00 0.00 0.00 175.10 176.58 3mhw h GLU 86 N 8.57 0.32 -2.85 2.72 4.81 -0.87 -3.42 114.58 123.86 3mhw h GLU 86 Ca -0.26 -0.27 -0.14 0.00 -0.13 0.00 0.00 59.36 58.55 3mhw h GLU 86 Cb 1.11 0.06 -0.26 0.00 0.63 0.00 0.00 28.75 30.30 3mhw h GLU 86 CO 0.72 0.93 -0.32 -0.80 -0.73 0.00 0.00 179.01 178.81 3mhw s ASN 87 N -6.95 -0.39 -0.29 1.04 -0.87 -1.19 -4.98 114.94 101.31 3mhw s ASN 87 Ca -0.05 0.73 0.01 0.00 -1.57 0.00 0.00 52.86 51.98 3mhw s ASN 87 Cb 0.11 0.70 0.07 0.00 -0.02 0.00 0.00 41.25 42.10 3mhw s ASN 87 CO 0.83 -0.14 -0.03 -0.22 -2.57 0.00 0.00 177.10 174.96 3mhw s LEU 88 N 0.55 3.89 -0.28 0.60 2.96 -1.26 -1.11 118.68 124.03 3mhw s LEU 88 Ca -0.03 -1.50 -0.06 0.00 -0.22 0.00 0.00 54.13 52.32 3mhw s LEU 88 Cb -0.04 -1.63 0.01 0.00 0.50 0.00 0.00 46.19 45.03 3mhw s LEU 88 CO -0.03 -0.26 0.04 -0.63 -1.32 0.00 0.00 176.35 174.15 3mhw s ILE 89 N 1.12 3.73 0.15 6.68 1.01 0.15 -4.97 121.20 129.07 3mhw s ILE 89 Ca -0.04 -0.72 0.05 0.00 0.00 0.00 0.00 60.65 59.94 3mhw s ILE 89 Cb -0.20 -2.90 -0.04 0.00 0.01 0.00 0.00 42.46 39.33 3mhw s ILE 89 CO -0.04 0.13 0.12 -0.76 0.00 0.00 0.00 174.94 174.39 3mhw s LEU 90 N 1.47 3.77 -0.06 2.97 1.43 -1.26 -0.67 118.68 126.32 3mhw s LEU 90 Ca 0.02 -0.13 -0.30 0.00 -1.03 0.00 0.00 54.13 52.69 3mhw s LEU 90 Cb -0.17 -2.39 -0.02 0.00 0.03 0.00 0.00 46.19 43.64 3mhw s LEU 90 CO 0.01 0.08 1.04 -2.28 0.23 0.00 0.00 176.35 175.43 3mhw s HIS 91 N -1.70 3.50 0.06 0.29 5.65 -1.18 -4.91 115.29 117.01 3mhw s HIS 91 Ca 0.30 1.55 0.33 0.00 0.25 0.00 0.00 55.06 57.50 3mhw s HIS 91 Cb -0.10 -3.22 1.43 0.00 -1.18 0.00 0.00 32.58 29.51 3mhw s HIS 91 CO 0.23 -0.37 1.98 0.87 -0.65 0.00 0.00 174.74 176.79 3mhw h LYS 92 N 7.06 0.00 -0.64 2.88 1.57 -1.93 -1.72 116.57 123.78 3mhw h LYS 92 Ca -0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 3mhw h LYS 92 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 3mhw h LYS 92 CO 0.83 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 179.46 3mhw n ASP 93 N -2.92 4.21 -4.65 0.86 8.00 -1.26 -4.97 116.55 115.82 3mhw n ASP 93 Ca 0.00 -2.36 -0.44 0.00 0.71 0.00 0.00 54.79 52.70 3mhw n ASP 93 Cb 0.26 -0.54 -0.02 0.00 -0.02 0.00 0.00 41.12 40.80 3mhw n ASP 93 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3mhw n TYR 94 N 1.01 1.84 -3.80 1.24 9.36 -0.65 -4.62 117.16 121.54 3mhw n TYR 94 Ca 0.23 0.59 -0.11 0.00 3.32 0.00 0.00 57.90 61.93 3mhw n TYR 94 Cb 0.78 -2.36 -0.08 0.00 -0.63 0.00 0.00 39.34 37.06 3mhw n TYR 94 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 3mhw s SER 95 N -0.26 -0.05 -0.05 2.98 1.04 -1.06 -4.98 113.70 111.31 3mhw s SER 95 Ca 0.60 -0.24 0.03 0.00 0.48 0.00 0.00 55.95 56.82 3mhw s SER 95 Cb -0.65 0.31 0.01 0.00 0.10 0.00 0.00 66.02 65.79 3mhw s SER 95 CO 0.58 -0.55 -0.12 0.00 0.98 0.00 0.00 173.24 174.13 3mhw s ALA 96 N -2.34 1.18 0.00 5.32 0.00 -1.26 -0.93 121.76 123.73 3mhw s ALA 96 Ca -0.07 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 51.47 3mhw s ALA 96 Cb -0.02 -0.49 0.00 0.00 0.00 0.00 0.00 23.12 22.62 3mhw s ALA 96 CO -0.02 0.15 0.00 -0.40 0.00 0.00 0.00 175.76 175.48 3mhw n ASP 97 N 3.57 0.00 -0.18 0.00 5.75 -1.26 -5.04 116.55 119.39 3mhw n ASP 97 Ca -0.21 0.00 -0.00 0.00 -0.01 0.00 0.00 54.79 54.57 3mhw n ASP 97 Cb 0.52 -0.06 0.02 0.00 -1.03 0.00 0.00 41.12 40.58 3mhw n ASP 97 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 3mhw n LEU 97 N -1.68 -0.31 -4.75 -2.12 7.94 -1.26 -4.81 117.00 110.01 3mhw n LEU 97 Ca 0.00 0.84 -0.41 0.00 -1.11 0.00 0.00 56.01 55.33 3mhw n LEU 97 Cb 0.00 -0.19 -0.04 0.00 0.53 0.00 0.00 43.42 43.72 3mhw n LEU 97 CO 0.00 -0.75 0.79 0.00 -1.11 0.00 0.00 177.39 176.32 3mhw s ALA 98 N -5.46 3.39 -0.24 1.96 0.00 -1.26 -4.81 121.76 115.34 3mhw s ALA 98 Ca -0.07 0.85 -0.07 0.00 0.00 0.00 0.00 51.96 52.68 3mhw s ALA 98 Cb 0.10 -3.34 -0.03 0.00 0.00 0.00 0.00 23.12 19.85 3mhw s ALA 98 CO 0.34 -0.18 0.06 -1.01 0.00 0.00 0.00 175.76 174.97 3mhw s HIS 99 N -0.68 3.09 0.12 0.00 3.76 -1.26 -4.42 115.29 115.90 3mhw s HIS 99 Ca 0.47 -0.40 -0.12 0.00 -0.15 0.00 0.00 55.06 54.85 3mhw s HIS 99 Cb -0.31 -2.22 -0.06 0.00 1.11 0.00 0.00 32.58 31.10 3mhw s HIS 99 CO 0.38 -0.32 0.49 -1.01 -0.85 0.00 0.00 174.74 173.43 3mhw s HIS 100 N 1.50 3.59 -1.37 1.40 3.76 -0.10 -4.32 115.29 119.74 3mhw s HIS 100 Ca 0.06 0.95 -0.04 0.00 -0.15 0.00 0.00 55.06 55.88 3mhw s HIS 100 Cb -0.15 -2.29 0.02 0.00 1.11 0.00 0.00 32.58 31.28 3mhw s HIS 100 CO 0.03 0.46 0.75 0.09 -0.85 0.00 0.00 174.74 175.22 3mhw n ASN 101 N 0.80 -2.03 -4.47 1.40 3.02 -1.26 -2.58 115.26 110.14 3mhw n ASN 101 Ca -0.06 -0.82 -0.44 0.00 -0.03 0.00 0.00 54.58 53.23 3mhw n ASN 101 Cb 0.52 -3.93 -0.00 0.00 -0.61 0.00 0.00 39.78 35.76 3mhw n ASN 101 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3mhw s ASP 102 N -4.09 7.05 -0.16 6.41 2.15 -1.26 -4.41 116.67 122.36 3mhw s ASP 102 Ca 0.17 -2.94 -0.15 0.00 0.43 0.00 0.00 52.55 50.06 3mhw s ASP 102 Cb -0.09 -2.42 0.04 0.00 -0.30 0.00 0.00 42.92 40.16 3mhw s ASP 102 CO 0.82 -0.79 0.44 -0.51 -0.17 0.00 0.00 175.17 174.96 3mhw s ILE 103 N 1.82 0.00 0.03 4.11 2.07 -1.26 -4.24 121.20 123.73 3mhw s ILE 103 Ca 0.44 -0.02 -0.11 0.00 -1.41 0.00 0.00 60.65 59.54 3mhw s ILE 103 Cb -0.02 -0.62 0.01 0.00 0.13 0.00 0.00 42.46 41.96 3mhw s ILE 103 CO 0.01 -0.01 0.23 0.00 -1.91 0.00 0.00 174.94 173.26 3mhw s ALA 104 N 0.15 -0.51 -0.05 1.50 0.00 -0.16 -3.07 121.76 119.61 3mhw s ALA 104 Ca -0.01 -0.08 0.05 0.00 0.00 0.00 0.00 51.96 51.92 3mhw s ALA 104 Cb -0.03 0.23 -0.01 0.00 0.00 0.00 0.00 23.12 23.31 3mhw s ALA 104 CO 0.01 -0.34 -0.21 -0.51 0.00 0.00 0.00 175.76 174.72 3mhw s LEU 105 N -1.85 1.98 -0.20 0.00 1.43 0.15 -0.93 118.68 119.25 3mhw s LEU 105 Ca -0.08 -0.43 -0.00 0.00 -1.03 0.00 0.00 54.13 52.59 3mhw s LEU 105 Cb -0.03 -1.15 0.02 0.00 0.03 0.00 0.00 46.19 45.06 3mhw s LEU 105 CO -0.02 0.19 -0.14 -0.76 0.23 0.00 0.00 176.35 175.85 3mhw s LEU 106 N -0.02 2.52 -0.19 1.79 1.02 0.92 -0.68 118.68 124.04 3mhw s LEU 106 Ca -0.04 -0.69 -0.25 0.00 0.02 0.00 0.00 54.13 53.17 3mhw s LEU 106 Cb -0.13 -1.56 -0.01 0.00 0.02 0.00 0.00 46.19 44.51 3mhw s LEU 106 CO 0.03 -0.04 0.83 -0.75 0.02 0.00 0.00 176.35 176.44 3mhw s LYS 107 N 1.32 4.26 -0.01 1.70 2.20 -0.26 -1.05 119.74 127.90 3mhw s LYS 107 Ca 0.03 0.99 -0.02 0.00 -0.36 0.00 0.00 55.97 56.61 3mhw s LYS 107 Cb -0.14 -3.59 -0.04 0.00 -1.51 0.00 0.00 37.83 32.55 3mhw s LYS 107 CO -0.09 -0.38 0.14 0.96 -0.36 0.00 0.00 175.35 175.62 3mhw s ILE 108 N 2.33 5.18 -0.17 5.43 -4.36 0.05 -0.15 121.20 129.50 3mhw s ILE 108 Ca 0.37 -0.24 -0.07 0.00 -0.26 0.00 0.00 60.65 60.45 3mhw s ILE 108 Cb -0.16 -3.40 0.08 0.00 1.25 0.00 0.00 42.46 40.23 3mhw s ILE 108 CO 0.11 0.34 0.37 -0.13 0.24 0.00 0.00 174.94 175.87 3mhw s ARG 109 N -1.84 0.29 0.86 0.37 1.81 -0.41 -4.63 118.95 115.39 3mhw s ARG 109 Ca 0.25 0.90 -0.12 0.00 -1.72 0.00 0.00 55.73 55.04 3mhw s ARG 109 Cb -0.12 0.16 0.11 0.00 -0.45 0.00 0.00 34.95 34.64 3mhw s ARG 109 CO 0.17 -0.24 1.12 -1.54 -0.68 0.00 0.00 175.30 174.12 3mhw s SER 110 N 2.28 3.97 0.62 0.23 1.04 -0.12 -0.31 113.70 121.41 3mhw s SER 110 Ca -0.03 1.15 0.37 0.00 0.48 0.00 0.00 55.95 57.92 3mhw s SER 110 Cb -0.11 -1.80 2.06 0.00 0.10 0.00 0.00 66.02 66.26 3mhw s SER 110 CO -0.12 -2.28 2.28 0.11 0.98 0.00 0.00 173.24 174.22 3mhw h LYS 110 N -1.31 0.00 -0.02 4.02 1.57 -1.90 0.70 116.57 119.63 3mhw h LYS 110 Ca -0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 3mhw h LYS 110 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 3mhw h LYS 110 CO 0.60 0.01 0.00 0.39 -0.57 0.00 0.00 179.45 179.89 3mhw n GLU 110 N -3.40 1.64 -0.80 3.15 4.71 -1.26 -4.95 120.64 119.73 3mhw n GLU 110 Ca -0.03 -0.93 0.00 0.00 -0.01 0.00 0.00 57.16 56.20 3mhw n GLU 110 Cb 0.11 -1.47 0.00 0.00 -1.01 0.00 0.00 31.44 29.06 3mhw n GLU 110 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3mhw n GLY 110 N 1.16 0.52 3.73 0.62 0.00 0.24 -5.07 105.19 106.39 3mhw n GLY 110 Ca 0.19 -0.73 -0.23 0.00 0.00 0.00 0.00 46.02 45.25 3mhw n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mhw s ARG 110 N -1.36 2.54 0.00 1.61 0.52 -1.26 -4.80 118.95 116.20 3mhw s ARG 110 Ca 0.00 -1.30 0.00 0.00 -0.52 0.00 0.00 55.73 53.91 3mhw s ARG 110 Cb 0.00 -2.32 0.00 0.00 0.52 0.00 0.00 34.95 33.15 3mhw s ARG 110 CO 0.00 0.33 0.00 0.00 0.02 0.00 0.00 175.30 175.65 3mhw s ALA 112 N -2.40 3.56 -0.28 0.00 0.00 0.02 -4.90 121.76 117.76 3mhw s ALA 112 Ca 0.00 1.36 -0.06 0.00 0.00 0.00 0.00 51.96 53.26 3mhw s ALA 112 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.59 3mhw s ALA 112 CO 0.00 -0.77 0.06 -1.14 0.00 0.00 0.00 175.76 173.90 3mhw s GLN 113 N -1.45 3.16 0.41 0.00 2.00 -1.26 -4.80 119.66 117.72 3mhw s GLN 113 Ca 0.53 -0.80 -0.26 0.00 -2.00 0.00 0.00 55.36 52.83 3mhw s GLN 113 Cb -0.42 -3.30 -0.10 0.00 0.80 0.00 0.00 33.01 29.99 3mhw s GLN 113 CO 0.53 -0.39 1.33 -2.30 -0.50 0.00 0.00 175.29 173.96 3mhw n PRO 114 N 4.85 2.12 -2.20 1.67 -0.02 -1.26 -4.83 135.00 135.33 3mhw n PRO 114 Ca -0.15 0.75 -0.04 0.00 -2.02 0.00 0.00 63.50 62.04 3mhw n PRO 114 Cb 0.49 -2.46 -0.00 0.00 -0.02 0.00 0.00 33.50 31.50 3mhw n PRO 114 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3mhw n SER 115 N 0.24 -0.58 0.09 2.55 3.41 -0.05 -4.95 113.62 114.33 3mhw n SER 115 Ca 0.05 -1.60 0.17 0.00 -0.26 0.00 0.00 58.87 57.24 3mhw n SER 115 Cb 0.39 1.02 0.70 0.00 -0.26 0.00 0.00 64.21 66.06 3mhw n SER 115 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3mhw h ARG 116 N 0.00 0.00 -0.02 4.33 2.43 -2.00 -2.97 114.38 116.15 3mhw h ARG 116 Ca -0.10 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 3mhw h ARG 116 Cb 0.40 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 3mhw h ARG 116 CO 0.13 0.00 0.00 0.25 -1.51 0.00 0.00 179.97 178.84 3mhw n THR 117 N -4.31 0.00 -3.67 0.20 -2.24 -1.26 -4.70 114.28 98.30 3mhw n THR 117 Ca 0.06 -0.50 -0.25 0.00 -2.27 0.00 0.00 64.05 61.09 3mhw n THR 117 Cb 0.45 1.27 -0.17 0.00 -2.10 0.00 0.00 70.33 69.78 3mhw n THR 117 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3mhw s ILE 118 N -1.10 0.07 0.07 2.28 1.01 -1.12 -3.69 121.20 118.73 3mhw s ILE 118 Ca 0.15 -0.07 -0.10 0.00 0.00 0.00 0.00 60.65 60.63 3mhw s ILE 118 Cb 0.11 -0.56 0.01 0.00 0.01 0.00 0.00 42.46 42.03 3mhw s ILE 118 CO 0.17 -0.10 0.23 -1.10 0.00 0.00 0.00 174.94 174.13 3mhw s GLN 119 N 2.07 0.82 0.39 2.79 -1.52 -0.60 -0.88 119.66 122.73 3mhw s GLN 119 Ca 0.02 -0.77 -0.05 0.00 -1.95 0.00 0.00 55.36 52.61 3mhw s GLN 119 Cb -0.15 0.34 -0.05 0.00 -0.22 0.00 0.00 33.01 32.94 3mhw s GLN 119 CO -0.07 -0.26 0.68 0.95 -0.25 0.00 0.00 175.29 176.34 3mhw s THR 120 N -3.29 4.95 -0.09 -0.19 -4.23 -1.26 -2.78 115.64 108.74 3mhw s THR 120 Ca 0.00 0.15 -0.01 0.00 -1.18 0.00 0.00 61.69 60.65 3mhw s THR 120 Cb 0.02 -3.80 -0.03 0.00 1.34 0.00 0.00 72.50 70.03 3mhw s THR 120 CO -0.08 -0.58 -0.05 -0.51 -0.54 0.00 0.00 174.62 172.86 3mhw s ILE 121 N -2.40 3.81 0.36 2.99 1.10 -0.49 -4.85 121.20 121.73 3mhw s ILE 121 Ca 0.46 -0.42 -0.27 0.00 -0.51 0.00 0.00 60.65 59.91 3mhw s ILE 121 Cb -0.10 -2.59 -0.09 0.00 0.15 0.00 0.00 42.46 39.82 3mhw s ILE 121 CO 0.36 0.57 1.21 -0.44 -2.11 0.00 0.00 174.94 174.54 3mhw s SER 122 N -0.51 6.68 0.47 4.50 0.01 -1.26 -4.61 113.70 118.98 3mhw s SER 122 Ca 0.08 2.46 -0.16 0.00 1.31 0.00 0.00 55.95 59.64 3mhw s SER 122 Cb -0.12 -2.63 -0.08 0.00 0.21 0.00 0.00 66.02 63.40 3mhw s SER 122 CO 0.02 -0.58 0.93 -0.76 0.41 0.00 0.00 173.24 173.27 3mhw s LEU 123 N -2.14 3.75 0.81 2.44 1.43 -1.26 -1.07 118.68 122.64 3mhw s LEU 123 Ca 0.53 1.51 -0.11 0.00 -1.03 0.00 0.00 54.13 55.03 3mhw s LEU 123 Cb -0.34 -4.42 0.08 0.00 0.03 0.00 0.00 46.19 41.54 3mhw s LEU 123 CO 0.44 -0.49 1.09 -2.16 0.23 0.00 0.00 176.35 175.46 3mhw s PRO 124 N -3.79 1.93 0.64 1.29 0.04 -1.26 -4.84 135.00 129.02 3mhw s PRO 124 Ca 0.58 0.99 -0.11 0.00 0.04 0.00 0.00 61.00 62.50 3mhw s PRO 124 Cb -0.10 -1.87 -0.03 0.00 0.04 0.00 0.00 34.50 32.54 3mhw s PRO 124 CO 0.27 -1.82 1.04 -1.54 0.04 0.00 0.00 177.00 174.99 3mhw s SER 125 N -3.47 6.01 0.36 6.66 1.04 -1.26 -4.92 113.70 118.11 3mhw s SER 125 Ca 0.62 1.43 -0.29 0.00 0.48 0.00 0.00 55.95 58.19 3mhw s SER 125 Cb -0.17 -2.43 -0.11 0.00 0.10 0.00 0.00 66.02 63.41 3mhw s SER 125 CO 0.56 -1.01 1.53 1.15 0.98 0.00 0.00 173.24 176.45 3mhw n MET 126 N -2.84 2.72 -2.62 4.02 0.00 -1.26 -2.23 117.12 114.91 3mhw n MET 126 Ca 0.06 0.96 -0.14 0.00 0.00 0.00 0.00 57.70 58.58 3mhw n MET 126 Cb 0.54 -2.71 -0.00 0.00 0.00 0.00 0.00 33.22 31.05 3mhw n MET 126 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 3mhw n TYR 127 N 0.91 -1.51 -4.04 3.17 4.01 -0.67 -4.91 117.16 114.12 3mhw n TYR 127 Ca 0.03 0.10 -0.32 0.00 -0.16 0.00 0.00 57.90 57.55 3mhw n TYR 127 Cb 0.38 -2.81 -0.15 0.00 -0.31 0.00 0.00 39.34 36.46 3mhw n TYR 127 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 3mhw s ASN 128 N -2.17 4.62 0.15 7.72 2.47 -0.95 -5.10 114.94 121.69 3mhw s ASN 128 Ca 0.08 -1.77 0.06 0.00 0.42 0.00 0.00 52.86 51.65 3mhw s ASN 128 Cb -0.04 -1.59 -0.04 0.00 -1.45 0.00 0.00 41.25 38.12 3mhw s ASN 128 CO 0.10 -0.29 -0.13 -1.81 -3.72 0.00 0.00 177.10 171.25 3mhw s ASP 129 N 1.02 2.07 0.77 -4.21 1.01 -1.26 -4.61 116.67 111.46 3mhw s ASP 129 Ca 0.01 -0.93 -0.12 0.00 0.71 0.00 0.00 52.55 52.21 3mhw s ASP 129 Cb -0.20 -0.07 0.06 0.00 1.01 0.00 0.00 42.92 43.73 3mhw s ASP 129 CO -0.06 -0.22 1.13 -2.84 0.21 0.00 0.00 175.17 173.39 3mhw s PRO 130 N -3.29 2.07 0.65 8.23 0.02 -1.26 -5.00 135.00 136.42 3mhw s PRO 130 Ca 0.15 1.43 -0.14 0.00 0.02 0.00 0.00 61.00 62.46 3mhw s PRO 130 Cb -0.01 -1.86 -0.01 0.00 0.02 0.00 0.00 34.50 32.64 3mhw s PRO 130 CO 0.03 -1.83 1.09 1.14 -0.33 0.00 0.00 177.00 177.10 3mhw s GLN 131 N -4.45 2.93 0.61 5.54 -2.07 -1.26 -4.94 119.66 116.03 3mhw s GLN 131 Ca 0.67 1.27 -0.19 0.00 -1.82 0.00 0.00 55.36 55.29 3mhw s GLN 131 Cb -0.22 -1.98 -0.03 0.00 -1.09 0.00 0.00 33.01 29.69 3mhw s GLN 131 CO 0.51 -1.13 1.17 1.97 -1.32 0.00 0.00 175.29 176.49 3mhw n PHE 132 N -2.45 1.53 0.00 9.60 1.16 -1.26 -2.16 117.46 123.88 3mhw n PHE 132 Ca 0.09 0.43 0.00 0.00 -1.87 0.00 0.00 57.45 56.10 3mhw n PHE 132 Cb 0.52 -2.23 0.00 0.00 -1.61 0.00 0.00 39.48 36.17 3mhw n PHE 132 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3mhw n GLY 133 N 1.05 2.32 3.76 4.97 0.00 0.53 -4.96 105.19 112.86 3mhw n GLY 133 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 3mhw n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mhw s THR 134 N -2.31 2.56 -0.03 2.61 2.01 -0.92 -4.63 115.64 114.94 3mhw s THR 134 Ca 0.00 0.53 -0.25 0.00 0.31 0.00 0.00 61.69 62.28 3mhw s THR 134 Cb 0.00 -3.34 -0.04 0.00 0.01 0.00 0.00 72.50 69.13 3mhw s THR 134 CO 0.00 0.11 0.77 -0.44 -0.69 0.00 0.00 174.62 174.37 3mhw s SER 135 N -0.12 7.11 0.22 3.53 0.01 -1.26 -1.15 113.70 122.04 3mhw s SER 135 Ca 0.53 1.33 0.03 0.00 1.31 0.00 0.00 55.95 59.16 3mhw s SER 135 Cb -0.42 -2.45 -0.05 0.00 0.21 0.00 0.00 66.02 63.31 3mhw s SER 135 CO 0.51 -0.11 0.00 0.00 0.41 0.00 0.00 173.24 174.05 3mhw s GLU 137 N -3.88 2.47 0.09 0.00 -1.05 -0.14 -1.02 118.70 115.17 3mhw s GLU 137 Ca 0.28 -0.78 0.08 0.00 -0.15 0.00 0.00 54.97 54.40 3mhw s GLU 137 Cb 0.06 -2.46 -0.03 0.00 -0.44 0.00 0.00 34.13 31.25 3mhw s GLU 137 CO 0.08 0.58 -0.20 0.96 0.95 0.00 0.00 175.26 177.63 3mhw s ILE 138 N -1.04 1.65 -0.00 1.83 -4.36 -0.45 -0.69 121.20 118.14 3mhw s ILE 138 Ca 0.18 -1.44 0.01 0.00 -0.26 0.00 0.00 60.65 59.14 3mhw s ILE 138 Cb -0.11 -1.49 -0.00 0.00 1.25 0.00 0.00 42.46 42.11 3mhw s ILE 138 CO 0.09 -0.01 -0.03 -0.89 0.24 0.00 0.00 174.94 174.34 3mhw s THR 139 N -1.08 0.25 0.00 8.37 2.01 -1.20 -1.46 115.64 122.52 3mhw s THR 139 Ca 0.06 -0.13 0.00 0.00 0.31 0.00 0.00 61.69 61.93 3mhw s THR 139 Cb -0.10 -0.22 0.00 0.00 0.01 0.00 0.00 72.50 72.20 3mhw s THR 139 CO 0.03 0.07 0.00 0.61 -0.69 0.00 0.00 174.62 174.65 3mhw n GLY 140 N 3.03 -0.18 1.51 4.40 0.00 -0.59 -4.36 105.19 109.00 3mhw n GLY 140 Ca -0.13 -0.99 0.09 0.00 0.00 0.00 0.00 46.02 44.99 3mhw n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3mhw n PHE 141 N -0.23 1.47 -1.23 1.61 3.72 -1.26 -2.13 117.46 119.41 3mhw n PHE 141 Ca 0.00 -0.65 -0.30 0.00 -0.05 0.00 0.00 57.45 56.45 3mhw n PHE 141 Cb 0.00 -0.28 0.21 0.00 -0.94 0.00 0.00 39.48 38.47 3mhw n PHE 141 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3mhw s GLY 142 N -1.01 1.60 0.53 1.37 0.00 -1.24 -4.06 107.32 104.51 3mhw s GLY 142 Ca 0.49 -0.80 -0.21 0.00 0.00 0.00 0.00 44.72 44.21 3mhw s GLY 142 CO 0.21 -0.02 1.03 0.28 0.00 0.00 0.00 173.10 174.60 3mhw n LYS 143 N -4.43 1.17 0.06 2.90 5.02 0.29 -2.31 118.16 120.86 3mhw n LYS 143 Ca 0.11 0.44 0.12 0.00 -2.02 0.00 0.00 58.31 56.95 3mhw n LYS 143 Cb 0.59 -2.18 0.04 0.00 -0.02 0.00 0.00 35.03 33.46 3mhw n LYS 143 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3mhw n GLU 144 N -0.60 0.44 -3.80 1.97 1.02 -1.26 -1.37 120.64 117.04 3mhw n GLU 144 Ca 0.12 0.06 -0.12 0.00 -0.02 0.00 0.00 57.16 57.19 3mhw n GLU 144 Cb 0.44 -1.71 -0.11 0.00 -0.02 0.00 0.00 31.44 30.05 3mhw n GLU 144 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 3mhw s ASN 145 N -4.61 -0.19 0.45 1.62 -0.87 -1.26 -4.20 114.94 105.87 3mhw s ASN 145 Ca 0.02 0.31 0.14 0.00 -1.57 0.00 0.00 52.86 51.75 3mhw s ASN 145 Cb 0.12 0.41 1.05 0.00 -0.02 0.00 0.00 41.25 42.82 3mhw s ASN 145 CO 0.78 -0.17 2.02 0.28 -2.57 0.00 0.00 177.10 177.43 3mhw h SER 146 N 5.29 0.31 0.59 -1.22 0.02 -1.91 -1.53 113.55 115.10 3mhw h SER 146 Ca -0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 3mhw h SER 146 Cb 1.19 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.67 3mhw h SER 146 CO 0.37 0.20 -0.15 0.35 -1.14 0.00 0.00 176.83 176.47 3mhw n THR 147 N -4.47 0.00 -1.84 -2.27 -2.24 -1.26 -4.91 114.28 97.29 3mhw n THR 147 Ca 0.07 -0.03 -0.35 0.00 -2.27 0.00 0.00 64.05 61.47 3mhw n THR 147 Cb 0.29 -0.17 0.05 0.00 -2.10 0.00 0.00 70.33 68.40 3mhw n THR 147 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3mhw s ASP 148 N -2.74 4.91 -0.20 3.42 1.01 -0.58 -4.96 116.67 117.53 3mhw s ASP 148 Ca 0.21 2.37 -0.05 0.00 0.71 0.00 0.00 52.55 55.80 3mhw s ASP 148 Cb 0.19 -2.59 -0.20 0.00 1.01 0.00 0.00 42.92 41.33 3mhw s ASP 148 CO 0.53 -1.78 0.02 0.00 0.21 0.00 0.00 175.17 174.16 3mhw n TYR 149 N -1.93 0.57 -2.71 4.23 9.36 -1.26 -4.99 117.16 120.43 3mhw n TYR 149 Ca 0.14 0.14 -0.30 0.00 3.32 0.00 0.00 57.90 61.19 3mhw n TYR 149 Cb 0.50 -1.07 -0.03 0.00 -0.63 0.00 0.00 39.34 38.11 3mhw n TYR 149 CO 0.00 0.00 0.00 -0.51 0.22 0.00 0.00 176.86 176.57 3mhw s LEU 150 N -6.93 3.75 0.25 2.98 2.01 -1.26 -5.09 118.68 114.38 3mhw s LEU 150 Ca -0.30 1.19 -0.04 0.00 0.01 0.00 0.00 54.13 54.99 3mhw s LEU 150 Cb 0.08 -4.10 -0.05 0.00 0.01 0.00 0.00 46.19 42.14 3mhw s LEU 150 CO 0.65 -0.47 0.50 -0.31 1.01 0.00 0.00 176.35 177.73 3mhw s TYR 151 N -2.49 3.48 0.54 0.29 2.02 -1.26 -4.68 117.35 115.24 3mhw s TYR 151 Ca 0.52 0.56 -0.21 0.00 -0.37 0.00 0.00 57.07 57.58 3mhw s TYR 151 Cb -0.10 -2.04 -0.05 0.00 -0.40 0.00 0.00 41.96 39.37 3mhw s TYR 151 CO 0.34 0.25 1.25 -1.25 -1.57 0.00 0.00 175.55 174.57 3mhw s PRO 152 N -3.39 3.24 0.39 -1.71 0.04 -1.26 -4.93 135.00 127.38 3mhw s PRO 152 Ca 0.42 1.97 0.22 0.00 0.04 0.00 0.00 61.00 63.65 3mhw s PRO 152 Cb -0.11 -2.18 0.26 0.00 0.04 0.00 0.00 34.50 32.51 3mhw s PRO 152 CO 0.29 -1.03 1.52 1.49 0.04 0.00 0.00 177.00 179.31 3mhw h GLU 153 N 1.40 0.00 -6.22 4.56 4.57 -1.97 -3.43 114.58 113.50 3mhw h GLU 153 Ca -0.50 0.00 -0.69 0.00 -1.18 0.00 0.00 59.36 56.99 3mhw h GLU 153 Cb 1.29 0.00 -0.22 0.00 -0.16 0.00 0.00 28.75 29.66 3mhw h GLU 153 CO 0.57 0.09 -0.74 -1.14 -1.18 0.00 0.00 179.01 176.61 3mhw s GLN 154 N -3.18 2.63 0.52 1.92 2.00 -1.26 -0.45 119.66 121.84 3mhw s GLN 154 Ca 0.06 -0.64 -0.22 0.00 -2.00 0.00 0.00 55.36 52.55 3mhw s GLN 154 Cb 0.06 -2.47 -0.06 0.00 0.80 0.00 0.00 33.01 31.34 3mhw s GLN 154 CO 0.69 0.62 1.29 -0.11 -0.50 0.00 0.00 175.29 177.29 3mhw n LEU 155 N 2.33 4.92 -4.33 3.68 7.94 -0.70 -4.87 117.00 125.98 3mhw n LEU 155 Ca -0.17 1.00 -0.19 0.00 -1.11 0.00 0.00 56.01 55.53 3mhw n LEU 155 Cb 0.52 -1.54 -0.10 0.00 0.53 0.00 0.00 43.42 42.83 3mhw n LEU 155 CO 0.26 -0.74 -0.45 -0.54 -1.11 0.00 0.00 177.39 174.82 3mhw s LYS 156 N -2.68 1.27 0.06 1.96 1.02 -0.91 -0.80 119.74 119.67 3mhw s LYS 156 Ca 0.69 -1.50 -0.04 0.00 0.02 0.00 0.00 55.97 55.14 3mhw s LYS 156 Cb -0.44 -1.13 -0.02 0.00 -0.52 0.00 0.00 37.83 35.72 3mhw s LYS 156 CO 0.51 0.20 0.06 0.00 -0.92 0.00 0.00 175.35 175.21 3mhw s MET 157 N -3.33 0.69 0.33 1.68 0.23 -0.09 -1.54 119.30 117.28 3mhw s MET 157 Ca 0.19 -1.07 -0.04 0.00 -1.03 0.00 0.00 55.69 53.74 3mhw s MET 157 Cb -0.02 0.26 0.00 0.00 -1.53 0.00 0.00 34.83 33.54 3mhw s MET 157 CO 0.06 -0.17 0.48 -0.08 -2.03 0.00 0.00 175.02 173.28 3mhw s THR 158 N -3.74 0.00 -0.10 3.16 -1.32 -0.54 -0.81 115.64 112.29 3mhw s THR 158 Ca 0.05 -1.57 0.03 0.00 -1.21 0.00 0.00 61.69 58.99 3mhw s THR 158 Cb 0.06 -2.60 -0.01 0.00 -1.51 0.00 0.00 72.50 68.43 3mhw s THR 158 CO -0.10 0.00 -0.18 -0.69 -2.21 0.00 0.00 174.62 171.44 3mhw s VAL 159 N -3.15 2.61 0.17 5.08 1.01 -1.26 -1.34 120.40 123.52 3mhw s VAL 159 Ca 0.29 -0.84 0.06 0.00 0.00 0.00 0.00 61.98 61.49 3mhw s VAL 159 Cb -0.00 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 3mhw s VAL 159 CO 0.19 0.55 -0.12 0.68 0.00 0.00 0.00 175.10 176.39 3mhw s VAL 160 N 0.10 1.42 -0.08 2.92 -7.23 -0.18 -4.79 120.40 112.55 3mhw s VAL 160 Ca -0.08 -2.07 -0.00 0.00 -1.81 0.00 0.00 61.98 58.01 3mhw s VAL 160 Cb -0.15 -1.88 -0.03 0.00 0.56 0.00 0.00 36.38 34.87 3mhw s VAL 160 CO 0.05 -0.64 -0.04 -0.54 -0.31 0.00 0.00 175.10 173.62 3mhw s LYS 161 N -3.55 2.91 0.30 4.82 1.02 -0.30 -0.36 119.74 124.58 3mhw s LYS 161 Ca 0.18 -0.50 -0.29 0.00 0.02 0.00 0.00 55.97 55.38 3mhw s LYS 161 Cb 0.00 -2.69 -0.10 0.00 -0.52 0.00 0.00 37.83 34.52 3mhw s LYS 161 CO 0.03 0.64 1.38 -0.51 -0.92 0.00 0.00 175.35 175.98 3mhw s LEU 162 N -0.73 4.40 -0.07 3.17 1.02 -0.30 -1.47 118.68 124.70 3mhw s LEU 162 Ca 0.11 2.73 0.02 0.00 0.02 0.00 0.00 54.13 57.01 3mhw s LEU 162 Cb -0.11 -3.64 -0.03 0.00 0.02 0.00 0.00 46.19 42.43 3mhw s LEU 162 CO 0.02 -0.65 -0.11 -0.63 0.02 0.00 0.00 176.35 175.00 3mhw s ILE 163 N -0.69 3.33 0.65 -0.59 1.01 -0.18 -0.35 121.20 124.39 3mhw s ILE 163 Ca 0.54 -0.61 -0.17 0.00 0.00 0.00 0.00 60.65 60.41 3mhw s ILE 163 Cb -0.41 -2.35 -0.00 0.00 0.01 0.00 0.00 42.46 39.70 3mhw s ILE 163 CO 0.50 0.58 1.19 -0.94 0.00 0.00 0.00 174.94 176.28 3mhw s SER 164 N -0.55 4.82 0.31 3.58 1.04 -1.26 -4.26 113.70 117.38 3mhw s SER 164 Ca 0.08 2.31 0.00 0.00 0.48 0.00 0.00 55.95 58.83 3mhw s SER 164 Cb -0.12 -2.59 0.53 0.00 0.10 0.00 0.00 66.02 63.94 3mhw s SER 164 CO 0.02 -1.84 1.95 -0.74 0.98 0.00 0.00 173.24 173.61 3mhw h HIS 165 N 0.33 0.98 -0.73 5.02 2.76 -1.96 -1.28 115.15 120.27 3mhw h HIS 165 Ca -0.49 0.02 0.06 0.00 -2.20 0.00 0.00 60.37 57.76 3mhw h HIS 165 Cb 1.29 -0.33 -0.06 0.00 1.55 0.00 0.00 27.41 29.86 3mhw h HIS 165 CO 0.48 0.57 0.43 -0.09 -1.30 0.00 0.00 177.93 178.02 3mhw h ARG 166 N 1.02 0.77 -0.16 5.26 1.12 -1.98 -0.53 114.38 119.87 3mhw h ARG 166 Ca 0.33 -0.05 -0.14 0.00 -1.11 0.00 0.00 59.98 59.01 3mhw h ARG 166 Cb 0.03 -0.17 0.00 0.00 -0.01 0.00 0.00 29.97 29.82 3mhw h ARG 166 CO -0.10 0.51 -0.44 1.49 -3.11 0.00 0.00 179.97 178.32 3mhw h GLU 167 N 0.79 0.59 0.00 0.20 4.81 -1.80 -3.26 114.58 115.91 3mhw h GLU 167 Ca 0.32 -0.41 -0.05 0.00 -0.13 0.00 0.00 59.36 59.08 3mhw h GLU 167 Cb 0.16 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 3mhw h GLU 167 CO -0.17 1.03 -0.26 0.00 -0.73 0.00 0.00 179.01 178.89 3mhw n GLN 169 N -3.69 0.08 -1.68 0.00 6.02 -0.23 -1.75 117.38 116.13 3mhw n GLN 169 Ca -0.01 0.06 -0.41 0.00 -0.01 0.00 0.00 57.00 56.63 3mhw n GLN 169 Cb 0.37 -1.59 0.01 0.00 1.02 0.00 0.00 30.24 30.05 3mhw n GLN 169 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3mhw n GLN 170 N -1.72 1.84 -0.27 -1.09 1.13 -1.06 -3.10 117.38 113.11 3mhw n GLN 170 Ca 0.06 0.66 0.17 0.00 -1.94 0.00 0.00 57.00 55.95 3mhw n GLN 170 Cb 0.37 -2.31 0.45 0.00 0.11 0.00 0.00 30.24 28.86 3mhw n GLN 170 CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 3mhw h PRO 170 N 2.05 0.51 0.00 -1.09 0.11 -1.91 -0.82 132.00 130.84 3mhw h PRO 170 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3mhw h PRO 170 Cb 1.30 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3mhw h PRO 170 CO 0.60 0.33 0.00 0.45 -0.21 0.00 0.00 178.00 179.17 3mhw h HIS 170 N 0.52 0.00 0.00 0.65 3.86 -1.94 -3.38 115.15 114.86 3mhw h HIS 170 Ca 0.49 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.70 3mhw h HIS 170 Cb 1.06 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.53 3mhw h HIS 170 CO -0.00 0.00 0.00 0.66 0.86 0.00 0.00 177.93 179.45 3mhw n TYR 171 N -2.46 0.00 0.10 2.45 4.02 -0.43 -4.83 117.16 116.01 3mhw n TYR 171 Ca 0.04 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 57.94 3mhw n TYR 171 Cb 0.36 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.69 3mhw n TYR 171 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3mhw n TYR 172 N 0.00 0.00 -1.22 -0.72 4.01 -0.72 -4.90 117.16 113.61 3mhw n TYR 172 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3mhw n TYR 172 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 3mhw n TYR 172 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3mhw n GLY 173 N 0.25 3.15 0.06 2.72 0.00 -0.55 -2.16 105.19 108.66 3mhw n GLY 173 Ca 0.01 -0.16 0.15 0.00 0.00 0.00 0.00 46.02 46.03 3mhw n GLY 173 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3mhw n SER 174 N 2.94 0.19 0.23 1.61 7.64 -1.26 -3.54 113.62 121.43 3mhw n SER 174 Ca 0.00 -0.78 0.06 0.00 1.01 0.00 0.00 58.87 59.16 3mhw n SER 174 Cb 0.00 -0.08 0.53 0.00 -1.01 0.00 0.00 64.21 63.65 3mhw n SER 174 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 3mhw h GLU 175 N 0.28 0.00 -5.56 1.43 5.08 -1.83 -3.41 114.58 110.57 3mhw h GLU 175 Ca 0.00 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.77 3mhw h GLU 175 Cb 0.16 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.31 3mhw h GLU 175 CO 0.00 0.16 -0.15 0.54 -1.00 0.00 0.00 179.01 178.56 3mhw s VAL 176 N -4.68 5.18 0.49 3.13 0.11 -1.23 -4.82 120.40 118.58 3mhw s VAL 176 Ca -0.04 0.84 0.07 0.00 -2.93 0.00 0.00 61.98 59.92 3mhw s VAL 176 Cb 0.16 -3.78 0.01 0.00 -1.53 0.00 0.00 36.38 31.24 3mhw s VAL 176 CO 0.69 0.27 0.39 0.42 -3.33 0.00 0.00 175.10 173.54 3mhw s THR 177 N 1.11 2.08 -0.84 5.04 -4.23 -1.26 -4.93 115.64 112.61 3mhw s THR 177 Ca 0.22 -1.44 0.17 0.00 -1.18 0.00 0.00 61.69 59.47 3mhw s THR 177 Cb -0.15 -2.52 0.15 0.00 1.34 0.00 0.00 72.50 71.33 3mhw s THR 177 CO 0.09 0.00 1.53 0.35 -0.54 0.00 0.00 174.62 176.04 3mhw n THR 178 N -1.66 0.98 0.64 3.99 -2.24 -1.26 -1.76 114.28 112.97 3mhw n THR 178 Ca 0.01 0.26 0.07 0.00 -2.27 0.00 0.00 64.05 62.12 3mhw n THR 178 Cb 0.63 -1.07 0.20 0.00 -2.10 0.00 0.00 70.33 68.00 3mhw n THR 178 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3mhw n LYS 179 N -1.72 2.00 -4.38 -0.78 5.02 -1.26 -4.88 118.16 112.16 3mhw n LYS 179 Ca 0.03 -1.55 -0.22 0.00 -2.02 0.00 0.00 58.31 54.55 3mhw n LYS 179 Cb 0.18 -1.34 -0.11 0.00 -0.02 0.00 0.00 35.03 33.74 3mhw n LYS 179 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3mhw s MET 180 N -1.44 1.41 -0.03 1.97 -1.94 -0.72 -1.13 119.30 117.42 3mhw s MET 180 Ca 0.29 -1.55 0.03 0.00 -1.71 0.00 0.00 55.69 52.75 3mhw s MET 180 Cb 0.15 -1.42 -0.00 0.00 2.01 0.00 0.00 34.83 35.57 3mhw s MET 180 CO 0.20 0.27 -0.13 -0.51 -0.01 0.00 0.00 175.02 174.85 3mhw s LEU 181 N -3.04 1.86 -0.01 -0.03 1.43 0.45 -4.77 118.68 114.56 3mhw s LEU 181 Ca 0.21 -0.25 -0.02 0.00 -1.03 0.00 0.00 54.13 53.04 3mhw s LEU 181 Cb -0.04 -0.72 -0.04 0.00 0.03 0.00 0.00 46.19 45.42 3mhw s LEU 181 CO 0.09 0.11 0.14 0.00 0.23 0.00 0.00 176.35 176.92 3mhw s ALA 183 N -1.26 -0.75 0.25 0.00 0.00 -0.47 -1.01 121.76 118.52 3mhw s ALA 183 Ca 0.25 0.63 -0.21 0.00 0.00 0.00 0.00 51.96 52.63 3mhw s ALA 183 Cb -0.12 -0.28 0.03 0.00 0.00 0.00 0.00 23.12 22.75 3mhw s ALA 183 CO 0.16 -0.19 0.68 0.00 0.00 0.00 0.00 175.76 176.41 3mhw s ALA 184 N -0.44 -1.27 0.16 0.00 0.00 -0.54 -1.37 121.76 118.31 3mhw s ALA 184 Ca -0.06 -0.15 -0.19 0.00 0.00 0.00 0.00 51.96 51.57 3mhw s ALA 184 Cb -0.04 0.86 -0.08 0.00 0.00 0.00 0.00 23.12 23.87 3mhw s ALA 184 CO 0.02 -0.97 0.65 0.34 0.00 0.00 0.00 175.76 175.80 3mhw s ASP 185 N -2.88 7.04 0.54 0.00 2.15 -1.26 -1.15 116.67 121.10 3mhw s ASP 185 Ca 0.09 1.32 0.22 0.00 0.43 0.00 0.00 52.55 54.61 3mhw s ASP 185 Cb -0.05 -2.38 1.39 0.00 -0.30 0.00 0.00 42.92 41.58 3mhw s ASP 185 CO 0.02 0.13 2.08 -0.65 -0.17 0.00 0.00 175.17 176.58 3mhw h PRO 185 N 3.82 0.00 -0.24 4.34 0.11 -1.95 0.26 132.00 138.33 3mhw h PRO 185 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3mhw h PRO 185 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3mhw h PRO 185 CO 0.65 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.48 3mhw n GLN 185 N -4.36 2.27 -2.06 1.05 1.13 -1.26 -4.96 117.38 109.19 3mhw n GLN 185 Ca 0.03 -1.90 -0.20 0.00 -1.94 0.00 0.00 57.00 52.99 3mhw n GLN 185 Cb 0.33 -1.48 -0.04 0.00 0.11 0.00 0.00 30.24 29.16 3mhw n GLN 185 CO 0.00 0.00 0.00 0.91 -1.44 0.00 0.00 177.06 176.53 3mhw n TRP 186 N 1.16 -0.63 1.02 1.08 7.02 0.08 -4.87 117.44 122.29 3mhw n TRP 186 Ca 0.17 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.76 3mhw n TRP 186 Cb 0.54 -3.65 0.01 0.00 -2.42 0.00 0.00 31.31 25.79 3mhw n TRP 186 CO 0.00 0.00 0.00 0.36 -2.02 0.00 0.00 177.69 176.03 3mhw n LYS 187 N -2.71 0.29 -3.90 -0.99 2.85 -1.26 -4.20 118.16 108.24 3mhw n LYS 187 Ca -0.22 -0.22 -0.11 0.00 -1.05 0.00 0.00 58.31 56.71 3mhw n LYS 187 Cb 0.67 -1.50 -0.11 0.00 -0.65 0.00 0.00 35.03 33.44 3mhw n LYS 187 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 3mhw s THR 188 N -2.87 0.07 -0.06 0.58 -1.32 -1.26 -4.38 115.64 106.40 3mhw s THR 188 Ca 0.12 -0.56 -0.31 0.00 -1.21 0.00 0.00 61.69 59.73 3mhw s THR 188 Cb 0.17 -0.28 0.12 0.00 -1.51 0.00 0.00 72.50 71.00 3mhw s THR 188 CO 0.76 -0.31 1.22 -0.62 -2.21 0.00 0.00 174.62 173.46 3mhw s ASP 189 N -0.98 -0.10 0.71 8.08 -1.08 -1.01 -4.05 116.67 118.25 3mhw s ASP 189 Ca -0.11 -0.11 -0.11 0.00 -0.52 0.00 0.00 52.55 51.71 3mhw s ASP 189 Cb -0.06 0.19 0.02 0.00 -1.46 0.00 0.00 42.92 41.61 3mhw s ASP 189 CO 0.00 -0.34 1.07 -0.94 0.52 0.00 0.00 175.17 175.47 3mhw s SER 190 N -2.70 5.22 0.27 -0.34 1.04 -1.26 -0.71 113.70 115.22 3mhw s SER 190 Ca 0.12 1.62 -0.02 0.00 0.48 0.00 0.00 55.95 58.15 3mhw s SER 190 Cb 0.02 -2.47 0.01 0.00 0.10 0.00 0.00 66.02 63.68 3mhw s SER 190 CO -0.04 -1.55 0.40 0.00 0.98 0.00 0.00 173.24 173.03 3mhw n GLN 192 N -0.44 1.49 0.00 0.00 7.27 -1.26 -1.02 117.38 123.42 3mhw n GLN 192 Ca -0.00 0.54 0.00 0.00 0.07 0.00 0.00 57.00 57.61 3mhw n GLN 192 Cb 0.45 -2.23 0.00 0.00 2.41 0.00 0.00 30.24 30.87 3mhw n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3mhw n GLY 193 N 2.97 1.35 0.03 1.69 0.00 -1.26 -0.55 105.19 109.42 3mhw n GLY 193 Ca 0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.33 3mhw n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3mhw n ASP 194 N 0.00 0.50 -4.66 1.61 8.00 -0.19 -3.68 116.55 118.12 3mhw n ASP 194 Ca 0.00 -0.24 -0.40 0.00 0.71 0.00 0.00 54.79 54.85 3mhw n ASP 194 Cb 0.00 0.13 0.02 0.00 -0.02 0.00 0.00 41.12 41.25 3mhw n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3mhw n SER 195 N -1.37 1.87 0.00 -2.24 7.64 -1.26 -2.21 113.62 116.04 3mhw n SER 195 Ca 0.07 1.02 0.00 0.00 1.01 0.00 0.00 58.87 60.97 3mhw n SER 195 Cb 0.33 -1.45 0.00 0.00 -1.01 0.00 0.00 64.21 62.09 3mhw n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mhw n GLY 196 N 1.00 3.09 3.84 0.23 0.00 -0.01 -1.41 105.19 111.93 3mhw n GLY 196 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 3mhw n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3mhw s GLY 197 N -1.92 1.64 0.12 -0.02 0.00 -0.94 -3.46 107.32 102.74 3mhw s GLY 197 Ca 0.00 -0.81 -0.27 0.00 0.00 0.00 0.00 44.72 43.64 3mhw s GLY 197 CO 0.00 -0.17 0.83 2.56 0.00 0.00 0.00 173.10 176.32 3mhw s PRO 198 N -5.56 4.61 -0.32 2.90 0.04 -1.26 -1.05 135.00 134.36 3mhw s PRO 198 Ca 0.67 1.23 -0.10 0.00 0.04 0.00 0.00 61.00 62.85 3mhw s PRO 198 Cb -0.10 -3.32 -0.01 0.00 0.04 0.00 0.00 34.50 31.11 3mhw s PRO 198 CO 0.52 0.39 0.17 -1.17 0.04 0.00 0.00 177.00 176.94 3mhw s LEU 199 N -0.52 4.19 -0.11 -3.56 2.96 -0.08 -3.27 118.68 118.29 3mhw s LEU 199 Ca 0.40 -0.54 0.02 0.00 -0.22 0.00 0.00 54.13 53.79 3mhw s LEU 199 Cb -0.23 -2.02 -0.01 0.00 0.50 0.00 0.00 46.19 44.44 3mhw s LEU 199 CO 0.27 -0.21 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.21 3mhw s VAL 200 N 1.62 2.60 0.13 1.68 1.01 0.14 -1.29 120.40 126.30 3mhw s VAL 200 Ca 0.05 -0.83 0.06 0.00 0.00 0.00 0.00 61.98 61.26 3mhw s VAL 200 Cb -0.17 -2.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 3mhw s VAL 200 CO 0.07 0.54 -0.14 0.00 0.00 0.00 0.00 175.10 175.57 3mhw s SER 202 N -2.53 6.39 -0.32 0.00 0.15 -1.26 -0.84 113.70 115.30 3mhw s SER 202 Ca 0.10 0.10 0.02 0.00 0.70 0.00 0.00 55.95 56.88 3mhw s SER 202 Cb -0.05 -2.30 0.08 0.00 -1.71 0.00 0.00 66.02 62.04 3mhw s SER 202 CO 0.03 -0.54 0.01 -0.22 1.20 0.00 0.00 173.24 173.73 3mhw s LEU 203 N 2.57 4.30 -1.35 3.45 2.96 0.52 -4.67 118.68 126.45 3mhw s LEU 203 Ca 0.22 -1.79 -0.05 0.00 -0.22 0.00 0.00 54.13 52.29 3mhw s LEU 203 Cb -0.15 -1.64 0.02 0.00 0.50 0.00 0.00 46.19 44.92 3mhw s LEU 203 CO 0.14 -0.32 0.95 0.00 -1.32 0.00 0.00 176.35 175.79 3mhw n GLN 204 N 4.40 -6.15 -0.30 1.98 3.00 -1.26 -2.48 117.38 116.56 3mhw n GLN 204 Ca -0.05 0.72 0.00 0.00 -0.01 0.00 0.00 57.00 57.66 3mhw n GLN 204 Cb 0.42 -5.57 0.00 0.00 0.00 0.00 0.00 30.24 25.09 3mhw n GLN 204 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3mhw n GLY 205 N -1.60 1.93 3.52 1.08 0.00 -1.26 -5.02 105.19 103.84 3mhw n GLY 205 Ca -0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 3mhw n GLY 205 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3mhw s ARG 206 N -0.17 3.51 0.09 1.61 3.52 -1.04 -5.08 118.95 121.40 3mhw s ARG 206 Ca 0.00 -0.52 -0.31 0.00 -0.13 0.00 0.00 55.73 54.77 3mhw s ARG 206 Cb 0.00 -2.86 -0.08 0.00 -1.56 0.00 0.00 34.95 30.46 3mhw s ARG 206 CO 0.00 0.32 1.41 -1.64 -0.81 0.00 0.00 175.30 174.59 3mhw s MET 207 N 0.13 4.30 -0.01 5.12 -1.94 -1.26 -0.36 119.30 125.29 3mhw s MET 207 Ca -0.01 2.08 0.01 0.00 -1.71 0.00 0.00 55.69 56.06 3mhw s MET 207 Cb -0.14 -3.33 0.00 0.00 2.01 0.00 0.00 34.83 33.38 3mhw s MET 207 CO 0.03 -0.49 -0.03 0.99 -0.01 0.00 0.00 175.02 175.51 3mhw s THR 208 N 1.45 0.29 -1.01 2.05 2.01 -0.02 -4.04 115.64 116.36 3mhw s THR 208 Ca 0.65 -0.12 -0.23 0.00 0.31 0.00 0.00 61.69 62.30 3mhw s THR 208 Cb -0.36 -0.27 0.03 0.00 0.01 0.00 0.00 72.50 71.91 3mhw s THR 208 CO 0.30 0.10 1.58 -0.22 -0.69 0.00 0.00 174.62 175.68 3mhw s LEU 209 N 0.14 3.44 0.08 4.42 2.96 -0.23 -1.82 118.68 127.66 3mhw s LEU 209 Ca -0.01 -1.33 -0.07 0.00 -0.22 0.00 0.00 54.13 52.49 3mhw s LEU 209 Cb -0.04 -2.57 -0.24 0.00 0.50 0.00 0.00 46.19 43.84 3mhw s LEU 209 CO -0.00 -1.78 1.16 0.74 -1.32 0.00 0.00 176.35 175.15 3mhw h THR 210 N 6.83 1.42 -3.96 3.68 2.02 -1.52 -3.39 112.91 117.99 3mhw h THR 210 Ca 0.19 -2.77 -0.12 0.00 0.77 0.00 0.00 66.41 64.48 3mhw h THR 210 Cb 1.00 2.78 -0.12 0.00 -1.74 0.00 0.00 68.15 70.07 3mhw h THR 210 CO 1.38 0.82 -0.33 -0.83 0.37 0.00 0.00 175.52 176.93 3mhw s GLY 211 N -4.56 0.65 -0.09 2.16 0.00 -0.76 -2.22 107.32 102.50 3mhw s GLY 211 Ca -0.06 -1.02 0.02 0.00 0.00 0.00 0.00 44.72 43.66 3mhw s GLY 211 CO 0.89 -0.89 -0.16 -0.42 0.00 0.00 0.00 173.10 172.52 3mhw s ILE 212 N -4.01 1.47 0.03 0.90 1.01 -1.00 -0.91 121.20 118.69 3mhw s ILE 212 Ca 0.22 -0.65 -0.34 0.00 0.00 0.00 0.00 60.65 59.88 3mhw s ILE 212 Cb 0.03 -1.33 -0.12 0.00 0.01 0.00 0.00 42.46 41.05 3mhw s ILE 212 CO 0.04 0.43 1.77 0.52 0.00 0.00 0.00 174.94 177.70 3mhw n VAL 213 N 3.98 0.36 0.06 2.92 0.31 -0.21 -0.86 118.33 124.89 3mhw n VAL 213 Ca -0.20 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 3mhw n VAL 213 Cb 0.52 -1.79 0.00 0.00 -0.91 0.00 0.00 33.84 31.66 3mhw n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 3mhw n SER 214 N 5.41 0.86 -3.84 4.52 2.88 -0.61 -0.83 113.62 122.02 3mhw n SER 214 Ca 0.20 0.19 -0.08 0.00 -1.33 0.00 0.00 58.87 57.85 3mhw n SER 214 Cb 0.30 -0.20 -0.03 0.00 -0.75 0.00 0.00 64.21 63.54 3mhw n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 3mhw s TRP 215 N -2.00 -0.12 -0.28 0.66 1.48 -0.83 -4.93 118.94 112.91 3mhw s TRP 215 Ca 0.00 -0.29 -0.38 0.00 -1.06 0.00 0.00 56.10 54.37 3mhw s TRP 215 Cb 0.00 0.59 0.16 0.00 -1.16 0.00 0.00 33.47 33.06 3mhw s TRP 215 CO 0.00 -1.14 1.37 0.20 -4.06 0.00 0.00 176.95 173.31 3mhw s GLY 216 N -2.92 -0.18 -0.44 3.67 0.00 -1.26 -0.50 107.32 105.68 3mhw s GLY 216 Ca 0.12 1.97 -0.22 0.00 0.00 0.00 0.00 44.72 46.59 3mhw s GLY 216 CO 0.05 0.67 0.71 -1.60 0.00 0.00 0.00 173.10 172.93 3mhw s ARG 217 N -1.99 3.34 3.13 2.90 6.06 -1.26 -4.90 118.95 126.24 3mhw s ARG 217 Ca 0.11 -0.24 0.00 0.00 -2.50 0.00 0.00 55.73 53.10 3mhw s ARG 217 Cb -0.01 -3.95 0.00 0.00 0.06 0.00 0.00 34.95 31.05 3mhw s ARG 217 CO -0.03 -1.07 0.00 0.41 -2.50 0.00 0.00 175.30 172.12 3mhw n GLY 219 N 5.01 0.75 3.14 8.12 0.00 -1.26 -4.76 105.19 116.19 3mhw n GLY 219 Ca 0.00 -0.83 -0.12 0.00 0.00 0.00 0.00 46.02 45.08 3mhw n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mhw n ALA 221 N 3.65 -1.74 -2.64 0.00 0.00 -1.26 -4.92 120.51 113.60 3mhw n ALA 221 Ca -0.19 -0.04 -0.34 0.00 0.00 0.00 0.00 53.44 52.86 3mhw n ALA 221 Cb 0.56 -2.84 -0.12 0.00 0.00 0.00 0.00 19.45 17.05 3mhw n ALA 221 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3mhw s LEU 222 N -6.94 3.14 0.18 0.00 1.43 -1.26 -4.75 118.68 110.48 3mhw s LEU 222 Ca 0.26 -0.05 -0.33 0.00 -1.03 0.00 0.00 54.13 52.97 3mhw s LEU 222 Cb -0.13 -1.69 -0.14 0.00 0.03 0.00 0.00 46.19 44.26 3mhw s LEU 222 CO 0.83 0.33 1.48 1.17 0.23 0.00 0.00 176.35 180.39 3mhw n LYS 223 N 2.42 1.95 -1.34 1.70 4.81 -1.26 -1.95 118.16 124.48 3mhw n LYS 223 Ca -0.18 0.70 -0.12 0.00 -0.87 0.00 0.00 58.31 57.84 3mhw n LYS 223 Cb 0.53 -2.41 -0.05 0.00 0.02 0.00 0.00 35.03 33.12 3mhw n LYS 223 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3mhw n ASP 223 N 2.87 -4.77 -3.62 3.14 8.00 -1.26 -4.94 116.55 115.96 3mhw n ASP 223 Ca 0.15 0.29 -0.27 0.00 0.71 0.00 0.00 54.79 55.67 3mhw n ASP 223 Cb 0.28 -3.32 -0.11 0.00 -0.02 0.00 0.00 41.12 37.96 3mhw n ASP 223 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3mhw s LYS 224 N -2.89 1.59 0.98 -1.24 -0.14 -0.82 -4.26 119.74 112.96 3mhw s LYS 224 Ca 0.00 -2.65 -0.12 0.00 -1.36 0.00 0.00 55.97 51.84 3mhw s LYS 224 Cb 0.00 -2.31 0.18 0.00 -1.68 0.00 0.00 37.83 34.02 3mhw s LYS 224 CO 0.00 -1.34 1.08 -2.14 -0.76 0.00 0.00 175.35 172.19 3mhw s PRO 225 N -0.61 0.57 0.43 -1.68 0.02 -1.26 -4.44 135.00 128.04 3mhw s PRO 225 Ca 0.29 0.86 -0.23 0.00 0.02 0.00 0.00 61.00 61.94 3mhw s PRO 225 Cb -0.00 -1.73 -0.08 0.00 0.02 0.00 0.00 34.50 32.71 3mhw s PRO 225 CO -0.18 -2.72 1.08 0.20 -0.33 0.00 0.00 177.00 175.05 3mhw s GLY 226 N -3.13 2.72 -0.04 0.52 0.00 -0.47 -4.52 107.32 102.40 3mhw s GLY 226 Ca 0.65 0.76 0.06 0.00 0.00 0.00 0.00 44.72 46.20 3mhw s GLY 226 CO 0.59 1.18 -0.23 0.14 0.00 0.00 0.00 173.10 174.78 3mhw s VAL 227 N -1.66 2.24 -0.00 1.40 1.01 0.35 -1.37 120.40 122.36 3mhw s VAL 227 Ca 0.61 -1.02 0.04 0.00 0.00 0.00 0.00 61.98 61.61 3mhw s VAL 227 Cb -0.23 -1.81 -0.01 0.00 0.00 0.00 0.00 36.38 34.33 3mhw s VAL 227 CO 0.29 0.58 -0.13 -0.31 0.00 0.00 0.00 175.10 175.52 3mhw s TYR 228 N -0.41 1.20 0.16 5.22 1.51 0.45 -1.57 117.35 123.91 3mhw s TYR 228 Ca 0.04 -0.25 -0.31 0.00 -1.01 0.00 0.00 57.07 55.54 3mhw s TYR 228 Cb -0.12 -0.77 -0.09 0.00 -0.11 0.00 0.00 41.96 40.87 3mhw s TYR 228 CO 0.01 -0.01 1.49 0.99 -1.11 0.00 0.00 175.55 176.93 3mhw s THR 229 N -0.40 2.85 -0.86 -0.71 2.01 -0.04 -0.41 115.64 118.09 3mhw s THR 229 Ca 0.05 0.62 -0.22 0.00 0.31 0.00 0.00 61.69 62.45 3mhw s THR 229 Cb -0.06 -3.40 0.08 0.00 0.01 0.00 0.00 72.50 69.13 3mhw s THR 229 CO -0.00 0.05 1.21 -0.60 -0.69 0.00 0.00 174.62 174.59 3mhw s ARG 230 N 0.98 3.42 0.35 4.92 3.52 -0.28 -2.36 118.95 129.49 3mhw s ARG 230 Ca 0.67 -1.11 0.09 0.00 -0.13 0.00 0.00 55.73 55.25 3mhw s ARG 230 Cb -0.41 -4.78 0.81 0.00 -1.56 0.00 0.00 34.95 29.01 3mhw s ARG 230 CO 0.32 -1.98 1.85 0.28 -0.81 0.00 0.00 175.30 174.96 3mhw h VAL 231 N 6.19 0.80 0.00 7.11 2.07 -1.72 -1.16 116.25 129.54 3mhw h VAL 231 Ca -0.00 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.28 3mhw h VAL 231 Cb 1.03 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 3mhw h VAL 231 CO 1.25 0.13 0.00 -1.54 0.02 0.00 0.00 177.57 177.43 3mhw n SER 232 N -4.59 0.00 -1.10 0.57 3.41 -1.26 -1.08 113.62 109.56 3mhw n SER 232 Ca 0.19 0.46 0.12 0.00 -0.26 0.00 0.00 58.87 59.38 3mhw n SER 232 Cb 0.51 -0.47 0.20 0.00 -0.26 0.00 0.00 64.21 64.18 3mhw n SER 232 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3mhw n HIS 233 N -1.47 0.39 -1.03 7.33 8.25 -0.44 -1.67 115.22 126.57 3mhw n HIS 233 Ca 0.02 -0.19 0.07 0.00 -0.26 0.00 0.00 57.72 57.35 3mhw n HIS 233 Cb 0.09 0.00 0.09 0.00 1.12 0.00 0.00 29.99 31.29 3mhw n HIS 233 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3mhw n PHE 234 N 1.43 0.00 -0.28 4.41 3.01 -0.24 -4.86 117.46 120.92 3mhw n PHE 234 Ca 0.18 -0.74 -0.03 0.00 1.01 0.00 0.00 57.45 57.87 3mhw n PHE 234 Cb 0.60 -0.11 0.12 0.00 -0.01 0.00 0.00 39.48 40.08 3mhw n PHE 234 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 3mhw h LEU 235 N 0.00 1.04 -0.69 4.37 3.38 -1.78 -0.93 115.31 120.70 3mhw h LEU 235 Ca 0.00 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.76 3mhw h LEU 235 Cb 0.98 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 3mhw h LEU 235 CO 0.00 0.86 -0.06 -0.65 0.09 0.00 0.00 178.44 178.68 3mhw h PRO 236 N 1.15 0.95 -0.37 1.13 0.11 -1.95 0.92 132.00 133.95 3mhw h PRO 236 Ca 0.28 -0.32 0.01 0.00 0.11 0.00 0.00 66.00 66.09 3mhw h PRO 236 Cb 0.09 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.09 3mhw h PRO 236 CO -0.04 0.98 0.23 2.35 -0.21 0.00 0.00 178.00 181.31 3mhw h TRP 237 N 0.86 0.43 -0.43 0.65 7.01 -1.83 -0.89 115.95 121.76 3mhw h TRP 237 Ca 0.15 0.01 -0.04 0.00 2.11 0.00 0.00 58.89 61.12 3mhw h TRP 237 Cb 0.59 -0.14 -0.02 0.00 -2.10 0.00 0.00 29.16 27.49 3mhw h TRP 237 CO 0.04 0.26 0.10 0.82 -2.79 0.00 0.00 178.44 176.87 3mhw h ILE 238 N 0.47 1.23 -0.62 2.65 2.04 -0.88 -1.93 117.51 120.47 3mhw h ILE 238 Ca 0.14 -0.82 -0.05 0.00 1.00 0.00 0.00 64.86 65.13 3mhw h ILE 238 Cb -0.02 0.95 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 3mhw h ILE 238 CO -0.05 0.29 0.18 0.03 0.00 0.00 0.00 178.15 178.59 3mhw h ARG 239 N 0.56 0.98 -0.14 2.37 3.08 -0.61 -1.81 114.38 118.81 3mhw h ARG 239 Ca 0.13 -0.22 -0.03 0.00 0.07 0.00 0.00 59.98 59.93 3mhw h ARG 239 Cb 0.33 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.24 3mhw h ARG 239 CO 0.00 0.88 -0.04 0.66 -1.07 0.00 0.00 179.97 180.40 3mhw h SER 240 N 0.91 0.28 1.31 7.04 4.64 -1.09 -3.28 113.55 123.36 3mhw h SER 240 Ca 0.20 -0.38 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 3mhw h SER 240 Cb 0.32 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 3mhw h SER 240 CO -0.00 0.59 0.00 0.45 -0.87 0.00 0.00 176.83 177.00 3mhw h HIS 241 N -0.03 0.00 -0.00 4.77 3.86 -1.24 -2.86 115.15 119.64 3mhw h HIS 241 Ca 0.04 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.25 3mhw h HIS 241 Cb 0.47 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.94 3mhw h HIS 241 CO 0.05 0.00 -0.00 0.25 0.86 0.00 0.00 177.93 179.09 3mhw n THR 242 N -2.47 0.00 -1.36 2.45 -2.24 -0.69 -2.65 114.28 107.32 3mhw n THR 242 Ca 0.04 -0.05 -0.30 0.00 -2.27 0.00 0.00 64.05 61.47 3mhw n THR 242 Cb 0.38 -0.31 0.10 0.00 -2.10 0.00 0.00 70.33 68.41 3mhw n THR 242 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3mhw n LYS 243 N -0.80 2.62 0.00 -0.78 5.02 -1.08 -5.09 118.16 118.05 3mhw n LYS 243 Ca 0.22 -3.28 0.00 0.00 -2.02 0.00 0.00 58.31 53.23 3mhw n LYS 243 Cb 0.16 -2.24 0.00 0.00 -0.02 0.00 0.00 35.03 32.93 3mhw n LYS 243 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27