#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gpw n LEU 2 N 0.00 4.76 -4.90 -0.89 4.32 -1.26 -5.00 117.00 114.02 1gpw n LEU 2 Ca 0.00 1.15 -0.29 0.00 -0.02 0.00 0.00 56.01 56.85 1gpw n LEU 2 Cb 0.00 -1.58 -0.04 0.00 -1.62 0.00 0.00 43.42 40.18 1gpw n LEU 2 CO 0.00 -0.19 0.12 0.00 -1.22 0.00 0.00 177.39 176.10 1gpw s ALA 3 N -1.17 3.71 0.09 -1.18 0.00 -1.26 -4.94 121.76 117.01 1gpw s ALA 3 Ca 0.59 -0.59 -0.30 0.00 0.00 0.00 0.00 51.96 51.65 1gpw s ALA 3 Cb -0.47 -2.20 -0.05 0.00 0.00 0.00 0.00 23.12 20.40 1gpw s ALA 3 CO 0.59 0.43 0.99 0.15 0.00 0.00 0.00 175.76 177.92 1gpw s LYS 4 N -3.18 4.65 0.03 0.00 -0.14 0.12 -4.92 119.74 116.30 1gpw s LYS 4 Ca 0.42 1.48 -0.13 0.00 -1.36 0.00 0.00 55.97 56.38 1gpw s LYS 4 Cb -0.11 -3.38 -0.06 0.00 -1.68 0.00 0.00 37.83 32.60 1gpw s LYS 4 CO 0.27 0.13 0.41 1.03 -0.76 0.00 0.00 175.35 176.43 1gpw s ARG 5 N 0.22 3.87 -0.27 1.68 0.52 -1.03 -4.05 118.95 119.89 1gpw s ARG 5 Ca 0.49 0.34 -0.08 0.00 -0.52 0.00 0.00 55.73 55.96 1gpw s ARG 5 Cb -0.24 -3.14 -0.02 0.00 0.52 0.00 0.00 34.95 32.07 1gpw s ARG 5 CO 0.30 0.65 0.11 0.42 0.02 0.00 0.00 175.30 176.79 1gpw s ILE 6 N -1.19 4.49 -0.01 1.52 -1.09 -1.26 -1.27 121.20 122.39 1gpw s ILE 6 Ca 0.27 -0.22 0.08 0.00 -2.23 0.00 0.00 60.65 58.55 1gpw s ILE 6 Cb -0.16 -3.17 -0.02 0.00 -1.58 0.00 0.00 42.46 37.53 1gpw s ILE 6 CO 0.15 0.25 -0.25 -0.63 -1.23 0.00 0.00 174.94 173.23 1gpw s ILE 7 N 1.63 2.17 -0.16 2.92 1.01 -0.31 -1.15 121.20 127.30 1gpw s ILE 7 Ca 0.06 -1.12 -0.07 0.00 0.00 0.00 0.00 60.65 59.52 1gpw s ILE 7 Cb -0.16 -1.77 -0.04 0.00 0.01 0.00 0.00 42.46 40.50 1gpw s ILE 7 CO 0.05 0.54 0.06 0.00 0.00 0.00 0.00 174.94 175.60 1gpw s ALA 8 N -0.66 3.45 -0.18 9.38 0.00 -0.80 -1.18 121.76 131.77 1gpw s ALA 8 Ca 0.10 -0.74 -0.05 0.00 0.00 0.00 0.00 51.96 51.27 1gpw s ALA 8 Cb -0.10 -1.88 -0.03 0.00 0.00 0.00 0.00 23.12 21.11 1gpw s ALA 8 CO -0.00 0.28 0.01 0.00 0.00 0.00 0.00 175.76 176.04 1gpw s LEU 10 N 0.67 3.54 -0.08 0.00 1.43 0.11 -4.38 118.68 119.97 1gpw s LEU 10 Ca 0.00 -0.87 -0.26 0.00 -1.03 0.00 0.00 54.13 51.97 1gpw s LEU 10 Cb -0.14 -1.75 -0.03 0.00 0.03 0.00 0.00 46.19 44.30 1gpw s LEU 10 CO 0.02 -0.17 0.84 0.20 0.23 0.00 0.00 176.35 177.47 1gpw s ASN 11 N 1.38 7.11 0.10 2.29 0.01 -1.26 -1.42 114.94 123.15 1gpw s ASN 11 Ca 0.00 1.35 0.05 0.00 -0.71 0.00 0.00 52.86 53.55 1gpw s ASN 11 Cb -0.17 -2.48 -0.03 0.00 0.41 0.00 0.00 41.25 38.97 1gpw s ASN 11 CO -0.01 -0.26 -0.12 0.68 -1.51 0.00 0.00 177.10 175.88 1gpw s VAL 12 N 1.30 1.09 -0.15 1.60 -7.23 0.14 -0.90 120.40 116.26 1gpw s VAL 12 Ca 0.43 -1.57 -0.09 0.00 -1.81 0.00 0.00 61.98 58.95 1gpw s VAL 12 Cb -0.18 -1.32 0.05 0.00 0.56 0.00 0.00 36.38 35.49 1gpw s VAL 12 CO 0.20 -0.43 0.36 -0.75 -0.31 0.00 0.00 175.10 174.17 1gpw s LYS 13 N -2.46 0.35 -1.60 4.82 2.20 0.05 -0.92 119.74 122.18 1gpw s LYS 13 Ca 0.04 0.67 -0.06 0.00 -0.36 0.00 0.00 55.97 56.26 1gpw s LYS 13 Cb -0.05 -0.01 0.06 0.00 -1.51 0.00 0.00 37.83 36.31 1gpw s LYS 13 CO 0.02 -0.14 0.28 -0.25 -0.36 0.00 0.00 175.35 174.89 1gpw n ASP 14 N 4.03 -0.25 0.00 1.43 8.00 -1.26 -1.12 116.55 127.38 1gpw n ASP 14 Ca -0.22 -1.19 0.00 0.00 0.71 0.00 0.00 54.79 54.09 1gpw n ASP 14 Cb 0.55 -2.01 0.00 0.00 -0.02 0.00 0.00 41.12 39.64 1gpw n ASP 14 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1gpw n GLY 15 N -2.06 0.84 3.36 0.44 0.00 -1.26 -5.05 105.19 101.46 1gpw n GLY 15 Ca -0.20 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.64 1gpw n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gpw s ARG 16 N -0.28 1.40 -0.82 1.61 0.52 -0.28 -4.60 118.95 116.52 1gpw s ARG 16 Ca 0.00 -1.72 -0.22 0.00 -0.52 0.00 0.00 55.73 53.27 1gpw s ARG 16 Cb 0.00 -0.73 0.08 0.00 0.52 0.00 0.00 34.95 34.81 1gpw s ARG 16 CO 0.00 -0.08 1.15 0.08 0.02 0.00 0.00 175.30 176.47 1gpw s VAL 17 N -3.34 4.27 0.00 3.52 1.01 -1.16 -0.77 120.40 123.94 1gpw s VAL 17 Ca 0.29 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.61 1gpw s VAL 17 Cb 0.06 -4.82 0.00 0.00 0.00 0.00 0.00 36.38 31.62 1gpw s VAL 17 CO 0.10 -1.63 0.00 1.33 0.00 0.00 0.00 175.10 174.90 1gpw n VAL 18 N 6.06 0.00 0.00 2.92 0.24 -0.07 -0.61 118.33 126.86 1gpw n VAL 18 Ca 0.12 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.42 1gpw n VAL 18 Cb 0.48 -0.39 0.00 0.00 -1.47 0.00 0.00 33.84 32.46 1gpw n VAL 18 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 1gpw n LYS 19 N 0.00 0.00 0.00 7.34 2.85 -1.26 -4.41 118.16 122.68 1gpw n LYS 19 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1gpw n LYS 19 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1gpw n LYS 19 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1gpw n GLY 20 N 0.00 1.29 2.41 2.58 0.00 -1.26 -4.32 105.19 105.88 1gpw n GLY 20 Ca 0.00 -1.48 -0.29 0.00 0.00 0.00 0.00 46.02 44.26 1gpw n GLY 20 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1gpw n THR 21 N 0.00 2.70 -3.23 2.61 -1.04 -1.26 -4.89 114.28 109.17 1gpw n THR 21 Ca 0.00 -4.49 -0.17 0.00 -2.04 0.00 0.00 64.05 57.35 1gpw n THR 21 Cb 0.00 -1.22 0.01 0.00 -1.82 0.00 0.00 70.33 67.30 1gpw n THR 21 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1gpw n ASN 22 N -0.59 -6.77 0.00 8.00 4.13 -1.26 -2.10 115.26 116.68 1gpw n ASN 22 Ca 0.44 -0.03 0.00 0.00 1.68 0.00 0.00 54.58 56.67 1gpw n ASN 22 Cb 0.68 -3.78 0.00 0.00 -1.54 0.00 0.00 39.78 35.14 1gpw n ASN 22 CO 0.00 0.00 0.00 2.22 0.28 0.00 0.00 177.26 179.76 1gpw n PHE 23 N -0.99 0.00 0.01 3.10 -1.74 -1.26 -4.79 117.46 111.79 1gpw n PHE 23 Ca -0.04 0.00 -0.08 0.00 -0.56 0.00 0.00 57.45 56.77 1gpw n PHE 23 Cb 0.57 -1.05 0.10 0.00 1.52 0.00 0.00 39.48 40.62 1gpw n PHE 23 CO 0.00 0.00 0.00 0.39 -0.56 0.00 0.00 176.76 176.59 1gpw n GLU 24 N -1.35 1.79 -1.22 3.97 4.71 -0.89 -4.81 120.64 122.85 1gpw n GLU 24 Ca 0.00 -1.38 0.00 0.00 -0.01 0.00 0.00 57.16 55.77 1gpw n GLU 24 Cb 0.14 -1.59 0.00 0.00 -1.01 0.00 0.00 31.44 28.97 1gpw n GLU 24 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1gpw n ASN 25 N -0.15 -1.63 -4.48 1.62 4.13 -1.26 -4.53 115.26 108.95 1gpw n ASN 25 Ca 0.25 0.00 -0.28 0.00 1.68 0.00 0.00 54.58 56.22 1gpw n ASN 25 Cb 0.97 -0.81 0.26 0.00 -1.54 0.00 0.00 39.78 38.66 1gpw n ASN 25 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1gpw s LEU 26 N -0.26 0.78 0.00 3.41 1.02 -1.26 -4.22 118.68 118.15 1gpw s LEU 26 Ca 0.00 1.52 0.00 0.00 0.02 0.00 0.00 54.13 55.67 1gpw s LEU 26 Cb 0.00 -3.41 0.00 0.00 0.02 0.00 0.00 46.19 42.80 1gpw s LEU 26 CO 0.00 -4.27 0.00 0.54 0.02 0.00 0.00 176.35 172.64 1gpw n ARG 27 N -4.97 0.00 0.00 1.70 1.74 -1.26 -4.80 116.66 109.08 1gpw n ARG 27 Ca 0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 1gpw n ARG 27 Cb 0.54 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.98 1gpw n ARG 27 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1gpw n ASP 28 N 0.00 0.00 -3.75 0.55 -0.08 -1.26 -4.75 116.55 107.26 1gpw n ASP 28 Ca 0.00 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.16 1gpw n ASP 28 Cb 0.00 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 43.39 1gpw n ASP 28 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 1gpw s SER 29 N 0.00 -0.13 0.00 1.67 0.15 0.22 -4.97 113.70 110.64 1gpw s SER 29 Ca 0.00 -0.18 0.00 0.00 0.70 0.00 0.00 55.95 56.47 1gpw s SER 29 Cb 0.00 0.36 0.00 0.00 -1.71 0.00 0.00 66.02 64.67 1gpw s SER 29 CO 0.00 -0.61 0.00 0.61 1.20 0.00 0.00 173.24 174.44 1gpw n GLY 30 N 0.59 0.00 3.68 9.45 0.00 -1.26 -2.97 105.19 114.69 1gpw n GLY 30 Ca -0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 1gpw n GLY 30 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gpw s ASP 31 N 0.00 6.02 0.56 1.61 2.15 -1.26 -3.53 116.67 122.21 1gpw s ASP 31 Ca 0.00 0.15 0.33 0.00 0.43 0.00 0.00 52.55 53.46 1gpw s ASP 31 Cb 0.00 -2.06 1.47 0.00 -0.30 0.00 0.00 42.92 42.03 1gpw s ASP 31 CO 0.00 0.14 1.80 1.55 -0.17 0.00 0.00 175.17 178.50 1gpw h PRO 32 N 6.93 0.00 0.10 4.34 0.13 -1.87 -1.18 132.00 140.44 1gpw h PRO 32 Ca -0.39 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.56 1gpw h PRO 32 Cb 1.16 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.31 1gpw h PRO 32 CO 0.72 0.00 -0.75 0.28 -0.23 0.00 0.00 178.00 178.01 1gpw h VAL 33 N 0.00 1.48 0.00 1.56 2.07 -1.94 -2.77 116.25 116.66 1gpw h VAL 33 Ca 0.44 -2.39 -0.14 0.00 0.82 0.00 0.00 66.70 65.43 1gpw h VAL 33 Cb 1.94 3.01 -0.02 0.00 -1.52 0.00 0.00 31.29 34.70 1gpw h VAL 33 CO -0.00 0.68 -0.69 -0.33 0.02 0.00 0.00 177.57 177.25 1gpw h GLU 34 N -0.28 0.00 -0.08 1.57 3.07 -1.86 -2.00 114.58 115.01 1gpw h GLU 34 Ca -0.12 0.00 -0.15 0.00 -0.50 0.00 0.00 59.36 58.58 1gpw h GLU 34 Cb 1.54 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.44 1gpw h GLU 34 CO 0.14 0.69 -0.62 1.25 -1.40 0.00 0.00 179.01 179.07 1gpw h LEU 35 N 0.00 0.33 -0.23 1.33 5.85 -1.35 -1.23 115.31 120.01 1gpw h LEU 35 Ca -0.01 -0.19 -0.22 0.00 0.84 0.00 0.00 57.88 58.31 1gpw h LEU 35 Cb 1.33 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.27 1gpw h LEU 35 CO 0.09 0.87 -0.86 1.23 -0.34 0.00 0.00 178.44 179.43 1gpw h GLY 36 N 1.43 0.57 1.83 3.75 0.00 -1.39 -2.17 103.07 107.09 1gpw h GLY 36 Ca -0.01 -0.89 -0.08 0.00 0.00 0.00 0.00 47.33 46.34 1gpw h GLY 36 CO 0.10 0.79 -0.32 0.50 0.00 0.00 0.00 176.54 177.61 1gpw h LYS 37 N 0.32 0.20 -0.09 4.80 1.57 -1.22 -2.05 116.57 120.10 1gpw h LYS 37 Ca -0.06 -0.08 -0.08 0.00 -1.87 0.00 0.00 60.65 58.56 1gpw h LYS 37 Cb 1.47 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.77 1gpw h LYS 37 CO 0.16 0.51 -0.26 0.35 -0.57 0.00 0.00 179.45 179.63 1gpw h PHE 38 N 0.18 0.45 -0.26 -1.35 3.57 -1.16 -2.33 116.94 116.04 1gpw h PHE 38 Ca 0.02 -0.18 -0.02 0.00 3.53 0.00 0.00 57.97 61.33 1gpw h PHE 38 Cb 0.66 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.31 1gpw h PHE 38 CO 0.01 0.88 0.09 1.88 -2.23 0.00 0.00 178.31 178.93 1gpw h TYR 39 N -0.11 0.36 0.02 0.41 0.05 -1.17 -1.04 116.97 115.48 1gpw h TYR 39 Ca -0.01 -0.01 -0.23 0.00 0.05 0.00 0.00 58.73 58.53 1gpw h TYR 39 Cb 0.88 -0.11 0.00 0.00 1.01 0.00 0.00 36.73 38.51 1gpw h TYR 39 CO 0.12 0.30 -0.99 1.03 -1.05 0.00 0.00 178.16 177.56 1gpw h SER 40 N 0.36 0.51 -0.48 3.88 0.87 -1.39 -0.33 113.55 116.96 1gpw h SER 40 Ca 0.09 -0.43 -0.04 0.00 -1.23 0.00 0.00 61.79 60.18 1gpw h SER 40 Cb 0.11 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 61.89 1gpw h SER 40 CO -0.01 1.25 0.15 -0.33 -0.53 0.00 0.00 176.83 177.36 1gpw h GLU 41 N 0.20 0.76 0.00 2.24 5.08 -0.75 -3.02 114.58 119.09 1gpw h GLU 41 Ca -0.09 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1gpw h GLU 41 Cb 1.65 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.79 1gpw h GLU 41 CO 0.17 0.72 0.00 0.44 -1.00 0.00 0.00 179.01 179.34 1gpw n ILE 42 N -4.51 0.66 0.00 3.13 -5.35 -0.48 -4.90 119.36 107.92 1gpw n ILE 42 Ca 0.01 0.06 0.00 0.00 -0.27 0.00 0.00 62.75 62.55 1gpw n ILE 42 Cb 0.20 -0.86 0.00 0.00 -1.74 0.00 0.00 39.64 37.23 1gpw n ILE 42 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1gpw n GLY 43 N 0.60 1.43 3.76 3.28 0.00 -1.14 -4.31 105.19 108.81 1gpw n GLY 43 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 1gpw n GLY 43 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gpw s ILE 44 N -2.00 2.51 -0.07 -0.61 -1.09 -0.15 -4.95 121.20 114.85 1gpw s ILE 44 Ca 0.00 0.43 0.06 0.00 -2.23 0.00 0.00 60.65 58.91 1gpw s ILE 44 Cb 0.00 -3.24 -0.24 0.00 -1.58 0.00 0.00 42.46 37.39 1gpw s ILE 44 CO 0.00 0.04 0.57 0.47 -1.23 0.00 0.00 174.94 174.79 1gpw n ASP 45 N -0.21 1.31 -3.90 3.58 8.00 -0.30 -4.69 116.55 120.34 1gpw n ASP 45 Ca 0.06 0.35 -0.09 0.00 0.71 0.00 0.00 54.79 55.81 1gpw n ASP 45 Cb 0.44 -0.35 -0.07 0.00 -0.02 0.00 0.00 41.12 41.13 1gpw n ASP 45 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1gpw s GLU 46 N -2.59 1.05 0.13 -1.24 2.02 -1.22 -4.39 118.70 112.46 1gpw s GLU 46 Ca -0.11 -1.06 0.08 0.00 0.02 0.00 0.00 54.97 53.90 1gpw s GLU 46 Cb 0.07 0.38 -0.04 0.00 0.10 0.00 0.00 34.13 34.64 1gpw s GLU 46 CO 0.81 -0.37 -0.18 -0.51 0.02 0.00 0.00 175.26 175.02 1gpw s LEU 47 N -2.92 2.37 -0.07 1.80 1.43 -0.84 -1.91 118.68 118.54 1gpw s LEU 47 Ca 0.12 -0.77 -0.03 0.00 -1.03 0.00 0.00 54.13 52.42 1gpw s LEU 47 Cb 0.04 -0.78 0.04 0.00 0.03 0.00 0.00 46.19 45.51 1gpw s LEU 47 CO -0.05 -0.02 0.09 -0.69 0.23 0.00 0.00 176.35 175.91 1gpw s VAL 48 N -1.66 -0.14 -0.16 -1.59 1.01 -0.56 -0.65 120.40 116.64 1gpw s VAL 48 Ca 0.10 0.30 -0.06 0.00 0.00 0.00 0.00 61.98 62.31 1gpw s VAL 48 Cb -0.08 -0.26 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 1gpw s VAL 48 CO 0.05 0.08 0.05 -0.36 0.00 0.00 0.00 175.10 174.92 1gpw s PHE 49 N 2.19 3.25 -0.21 5.22 0.08 0.10 0.10 117.98 128.71 1gpw s PHE 49 Ca 0.04 0.10 0.01 0.00 0.12 0.00 0.00 56.93 57.20 1gpw s PHE 49 Cb -0.13 -2.00 0.05 0.00 -0.57 0.00 0.00 43.02 40.37 1gpw s PHE 49 CO -0.05 0.25 -0.07 -0.51 -0.10 0.00 0.00 175.22 174.74 1gpw s LEU 50 N 0.02 2.34 -0.01 -0.37 1.02 -0.51 -2.05 118.68 119.12 1gpw s LEU 50 Ca 0.05 -0.99 -0.14 0.00 0.02 0.00 0.00 54.13 53.06 1gpw s LEU 50 Cb -0.12 -1.17 -0.06 0.00 0.02 0.00 0.00 46.19 44.86 1gpw s LEU 50 CO 0.01 -0.19 0.39 -0.62 0.02 0.00 0.00 176.35 175.96 1gpw s ASP 51 N 1.42 6.78 -0.06 2.29 -1.08 -0.89 0.26 116.67 125.40 1gpw s ASP 51 Ca -0.03 0.93 0.13 0.00 -0.52 0.00 0.00 52.55 53.05 1gpw s ASP 51 Cb -0.17 -2.24 0.24 0.00 -1.46 0.00 0.00 42.92 39.29 1gpw s ASP 51 CO -0.07 0.32 1.11 2.30 0.52 0.00 0.00 175.17 179.35 1gpw n ILE 52 N 1.91 0.70 -0.52 4.11 -5.35 -0.10 -4.54 119.36 115.57 1gpw n ILE 52 Ca -0.14 -1.22 -0.29 0.00 -0.27 0.00 0.00 62.75 60.83 1gpw n ILE 52 Cb 0.52 0.39 0.24 0.00 -1.74 0.00 0.00 39.64 39.05 1gpw n ILE 52 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 1gpw n THR 53 N -0.30 0.00 -0.40 7.28 -1.04 -1.26 -4.89 114.28 113.67 1gpw n THR 53 Ca 0.08 -0.40 -0.22 0.00 -2.04 0.00 0.00 64.05 61.47 1gpw n THR 53 Cb 0.82 -0.92 0.21 0.00 -1.82 0.00 0.00 70.33 68.61 1gpw n THR 53 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1gpw n ALA 54 N -4.84 -2.34 -1.34 2.41 0.00 -1.26 -4.87 120.51 108.27 1gpw n ALA 54 Ca 0.03 -1.39 -0.10 0.00 0.00 0.00 0.00 53.44 51.98 1gpw n ALA 54 Cb 0.55 -1.15 0.20 0.00 0.00 0.00 0.00 19.45 19.05 1gpw n ALA 54 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1gpw n SER 55 N -3.14 3.09 0.00 0.00 3.41 -1.26 -3.59 113.62 112.13 1gpw n SER 55 Ca 0.09 -3.66 0.00 0.00 -0.26 0.00 0.00 58.87 55.05 1gpw n SER 55 Cb 0.44 -0.70 0.00 0.00 -0.26 0.00 0.00 64.21 63.68 1gpw n SER 55 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1gpw n VAL 56 N -1.04 0.00 0.40 -3.33 0.31 -1.26 -4.73 118.33 108.68 1gpw n VAL 56 Ca 0.42 -0.01 0.06 0.00 -0.01 0.00 0.00 64.34 64.80 1gpw n VAL 56 Cb 1.26 0.24 0.06 0.00 -0.91 0.00 0.00 33.84 34.49 1gpw n VAL 56 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1gpw n GLU 57 N -0.12 0.87 0.08 5.55 -0.58 -1.26 -4.74 120.64 120.44 1gpw n GLU 57 Ca 0.00 -1.29 -0.03 0.00 -0.42 0.00 0.00 57.16 55.42 1gpw n GLU 57 Cb 0.00 -1.23 -0.02 0.00 -0.57 0.00 0.00 31.44 29.63 1gpw n GLU 57 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 1gpw h LYS 58 N 2.22 -0.22 -0.31 3.49 3.64 -1.85 -0.35 116.57 123.19 1gpw h LYS 58 Ca 0.00 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.49 1gpw h LYS 58 Cb 0.51 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.37 1gpw h LYS 58 CO 0.00 -0.15 0.75 -0.09 -2.27 0.00 0.00 179.45 177.70 1gpw h ARG 59 N -0.44 0.00 0.02 1.90 2.43 -1.89 0.92 114.38 117.33 1gpw h ARG 59 Ca -0.02 0.00 -0.37 0.00 -0.81 0.00 0.00 59.98 58.77 1gpw h ARG 59 Cb 0.17 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.67 1gpw h ARG 59 CO 0.04 0.00 -2.12 1.17 -1.51 0.00 0.00 179.97 177.54 1gpw n LYS 60 N -3.01 0.63 0.15 0.20 0.00 -1.24 -3.78 118.16 111.11 1gpw n LYS 60 Ca 0.06 0.31 0.09 0.00 0.00 0.00 0.00 58.31 58.77 1gpw n LYS 60 Cb 0.87 -1.60 0.60 0.00 0.00 0.00 0.00 35.03 34.89 1gpw n LYS 60 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 1gpw h THR 61 N -0.55 0.97 0.00 3.15 2.02 0.79 0.30 112.91 119.60 1gpw h THR 61 Ca -0.54 -0.05 -0.18 0.00 0.77 0.00 0.00 66.41 66.41 1gpw h THR 61 Cb 1.69 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 68.91 1gpw h THR 61 CO -0.19 0.02 -0.85 0.24 0.37 0.00 0.00 175.52 175.11 1gpw h MET 62 N 0.13 0.08 0.03 6.66 2.86 -1.09 -0.62 114.93 122.97 1gpw h MET 62 Ca 0.09 -0.09 -0.22 0.00 -2.06 0.00 0.00 59.70 57.42 1gpw h MET 62 Cb 0.18 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.85 1gpw h MET 62 CO -0.01 0.88 -0.99 -0.07 1.06 0.00 0.00 176.91 177.78 1gpw h LEU 63 N 0.04 0.18 0.14 1.22 3.38 -1.37 -1.67 115.31 117.24 1gpw h LEU 63 Ca -0.02 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 1gpw h LEU 63 Cb 1.49 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.18 1gpw h LEU 63 CO 0.12 1.06 -0.07 -0.08 0.09 0.00 0.00 178.44 179.57 1gpw h GLU 64 N 0.05 -0.18 -0.36 1.13 4.81 -0.33 -2.66 114.58 117.05 1gpw h GLU 64 Ca -0.05 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1gpw h GLU 64 Cb 1.69 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 31.08 1gpw h GLU 64 CO 0.15 0.03 0.20 1.25 -0.73 0.00 0.00 179.01 179.90 1gpw h LEU 65 N -0.36 0.31 0.18 1.64 5.85 -1.12 -2.12 115.31 119.69 1gpw h LEU 65 Ca -0.02 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.72 1gpw h LEU 65 Cb 0.29 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 1gpw h LEU 65 CO 0.03 0.22 -0.26 0.58 -0.34 0.00 0.00 178.44 178.67 1gpw h VAL 66 N 0.40 0.43 -0.66 1.05 2.07 -1.29 -1.48 116.25 116.77 1gpw h VAL 66 Ca 0.15 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.78 1gpw h VAL 66 Cb 0.03 0.43 -0.08 0.00 -1.52 0.00 0.00 31.29 30.15 1gpw h VAL 66 CO -0.08 0.00 0.24 -0.08 0.02 0.00 0.00 177.57 177.67 1gpw h GLU 67 N -0.51 0.39 -0.67 1.57 4.81 -1.32 0.38 114.58 119.23 1gpw h GLU 67 Ca 0.01 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.17 1gpw h GLU 67 Cb 0.51 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 1gpw h GLU 67 CO -0.11 0.26 0.23 0.87 -0.73 0.00 0.00 179.01 179.53 1gpw h LYS 68 N 0.40 1.01 0.02 1.92 6.56 -1.05 -2.47 116.57 122.96 1gpw h LYS 68 Ca 0.35 -0.19 -0.06 0.00 -1.06 0.00 0.00 60.65 59.68 1gpw h LYS 68 Cb 0.48 -0.16 0.01 0.00 -0.57 0.00 0.00 32.23 31.98 1gpw h LYS 68 CO -0.36 0.85 -0.25 0.28 -2.06 0.00 0.00 179.45 177.92 1gpw h VAL 69 N 0.98 1.61 -0.22 0.50 2.07 -0.51 -3.31 116.25 117.37 1gpw h VAL 69 Ca 0.22 -2.11 0.06 0.00 0.82 0.00 0.00 66.70 65.69 1gpw h VAL 69 Cb 0.25 2.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.99 1gpw h VAL 69 CO -0.01 0.57 0.20 0.00 0.02 0.00 0.00 177.57 178.35 1gpw h ALA 70 N 0.17 1.95 -0.00 1.67 0.00 -0.23 -0.36 119.26 122.45 1gpw h ALA 70 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1gpw h ALA 70 Cb 1.08 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1gpw h ALA 70 CO 0.05 -0.31 -0.17 -0.85 0.00 0.00 0.00 179.25 177.97 1gpw n GLU 71 N -4.00 0.54 0.00 0.00 0.28 -0.93 -4.47 120.64 112.06 1gpw n GLU 71 Ca 0.02 -0.21 0.00 0.00 -0.16 0.00 0.00 57.16 56.81 1gpw n GLU 71 Cb 0.34 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.71 1gpw n GLU 71 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1gpw n GLN 72 N -1.05 2.97 -2.96 3.44 6.02 -0.29 -5.09 117.38 120.43 1gpw n GLN 72 Ca 0.12 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.79 1gpw n GLN 72 Cb 0.30 -0.73 -0.06 0.00 1.02 0.00 0.00 30.24 30.77 1gpw n GLN 72 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 1gpw s ILE 73 N -1.03 4.63 -0.19 5.09 -5.25 -0.38 -5.00 121.20 119.07 1gpw s ILE 73 Ca 0.00 1.02 0.13 0.00 -0.99 0.00 0.00 60.65 60.81 1gpw s ILE 73 Cb 0.00 -3.64 0.39 0.00 2.95 0.00 0.00 42.46 42.16 1gpw s ILE 73 CO 0.00 -0.32 1.21 -0.90 -1.79 0.00 0.00 174.94 173.15 1gpw n ASP 74 N -0.70 1.91 -4.03 4.36 5.75 -1.26 -4.92 116.55 117.65 1gpw n ASP 74 Ca 0.04 -3.70 -0.07 0.00 -0.01 0.00 0.00 54.79 51.05 1gpw n ASP 74 Cb 0.54 -0.51 -0.09 0.00 -1.03 0.00 0.00 41.12 40.02 1gpw n ASP 74 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 1gpw s ILE 75 N -3.15 0.20 0.34 2.12 -4.36 -1.26 -5.14 121.20 109.95 1gpw s ILE 75 Ca 0.37 -1.65 -0.28 0.00 -0.26 0.00 0.00 60.65 58.82 1gpw s ILE 75 Cb 0.35 -1.47 -0.12 0.00 1.25 0.00 0.00 42.46 42.47 1gpw s ILE 75 CO -0.04 -0.91 1.38 -2.65 0.24 0.00 0.00 174.94 172.95 1gpw n PRO 76 N 0.07 2.33 -3.99 0.37 -0.02 -1.26 -4.90 135.00 127.60 1gpw n PRO 76 Ca -0.14 0.82 -0.09 0.00 -2.02 0.00 0.00 63.50 62.07 1gpw n PRO 76 Cb 0.61 -2.46 -0.10 0.00 -0.02 0.00 0.00 33.50 31.54 1gpw n PRO 76 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1gpw s PHE 77 N -0.98 0.31 0.10 6.00 -0.71 -1.26 -1.98 117.98 119.47 1gpw s PHE 77 Ca 0.56 -0.69 0.08 0.00 -1.04 0.00 0.00 56.93 55.83 1gpw s PHE 77 Cb -0.54 -0.23 -0.03 0.00 -1.21 0.00 0.00 43.02 41.01 1gpw s PHE 77 CO 0.61 -0.34 -0.20 0.99 -1.34 0.00 0.00 175.22 174.95 1gpw s THR 78 N -2.84 1.62 -0.02 -4.49 2.01 0.17 -3.14 115.64 108.95 1gpw s THR 78 Ca -0.03 -1.54 0.02 0.00 0.31 0.00 0.00 61.69 60.45 1gpw s THR 78 Cb 0.00 -1.51 0.00 0.00 0.01 0.00 0.00 72.50 71.01 1gpw s THR 78 CO -0.06 -0.11 -0.08 0.68 -0.69 0.00 0.00 174.62 174.36 1gpw s VAL 79 N -1.27 0.71 0.36 3.82 -7.23 -0.99 0.02 120.40 115.82 1gpw s VAL 79 Ca 0.06 -0.32 -0.09 0.00 -1.81 0.00 0.00 61.98 59.82 1gpw s VAL 79 Cb -0.10 -0.64 0.03 0.00 0.56 0.00 0.00 36.38 36.23 1gpw s VAL 79 CO 0.04 0.23 0.64 -0.83 -0.31 0.00 0.00 175.10 174.87 1gpw s GLY 80 N 0.23 0.91 0.00 2.32 0.00 -0.87 -1.28 107.32 108.62 1gpw s GLY 80 Ca -0.03 -1.12 0.00 0.00 0.00 0.00 0.00 44.72 43.57 1gpw s GLY 80 CO 0.00 -0.64 0.00 0.61 0.00 0.00 0.00 173.10 173.07 1gpw n GLY 81 N -0.55 1.40 2.68 0.20 0.00 -1.24 -2.09 105.19 105.60 1gpw n GLY 81 Ca -0.04 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.89 1gpw n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gpw n GLY 82 N 2.50 0.40 3.57 -0.02 0.00 -1.26 -4.73 105.19 105.64 1gpw n GLY 82 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1gpw n GLY 82 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gpw s ILE 83 N -1.97 3.91 -0.16 -0.61 1.01 -1.26 -4.82 121.20 117.29 1gpw s ILE 83 Ca 0.00 0.75 0.22 0.00 0.00 0.00 0.00 60.65 61.61 1gpw s ILE 83 Cb 0.00 -4.73 -0.32 0.00 0.01 0.00 0.00 42.46 37.42 1gpw s ILE 83 CO 0.00 -1.45 0.53 1.41 0.00 0.00 0.00 174.94 175.43 1gpw n HIS 84 N 8.86 0.00 -4.15 3.97 8.25 -1.26 -4.49 115.22 126.40 1gpw n HIS 84 Ca 0.08 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.42 1gpw n HIS 84 Cb 0.49 -0.43 -0.08 0.00 1.12 0.00 0.00 29.99 31.09 1gpw n HIS 84 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 1gpw s ASP 85 N -4.28 0.28 0.39 0.41 1.47 -1.26 -4.86 116.67 108.81 1gpw s ASP 85 Ca -0.06 -1.31 0.07 0.00 1.18 0.00 0.00 52.55 52.43 1gpw s ASP 85 Cb 0.14 0.47 0.80 0.00 -0.34 0.00 0.00 42.92 43.99 1gpw s ASP 85 CO 0.89 -0.97 2.00 0.15 0.68 0.00 0.00 175.17 177.92 1gpw h PHE 86 N 2.45 0.48 -0.59 2.11 3.57 -1.96 -2.22 116.94 120.77 1gpw h PHE 86 Ca -0.32 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.12 1gpw h PHE 86 Cb 1.25 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.81 1gpw h PHE 86 CO 0.56 0.37 0.19 0.93 -2.23 0.00 0.00 178.31 178.13 1gpw h GLU 87 N 0.49 0.92 -0.18 1.11 3.07 -1.99 -0.08 114.58 117.91 1gpw h GLU 87 Ca 0.12 -0.20 -0.12 0.00 -0.50 0.00 0.00 59.36 58.67 1gpw h GLU 87 Cb 0.09 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 27.86 1gpw h GLU 87 CO -0.01 0.82 -0.35 1.15 -1.40 0.00 0.00 179.01 179.22 1gpw h THR 88 N 0.84 1.34 -0.01 1.13 2.02 -1.91 -2.37 112.91 113.95 1gpw h THR 88 Ca 0.19 -1.59 0.03 0.00 0.77 0.00 0.00 66.41 65.82 1gpw h THR 88 Cb 0.28 1.91 -0.05 0.00 -1.74 0.00 0.00 68.15 68.55 1gpw h THR 88 CO -0.01 0.49 -0.30 0.00 0.37 0.00 0.00 175.52 176.07 1gpw h ALA 89 N 0.58 -0.41 -0.46 6.16 0.00 -1.22 -2.20 119.26 121.71 1gpw h ALA 89 Ca 0.01 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.98 1gpw h ALA 89 Cb 0.94 0.53 -0.06 0.00 0.00 0.00 0.00 17.79 19.20 1gpw h ALA 89 CO 0.08 -0.80 0.10 1.03 0.00 0.00 0.00 179.25 179.65 1gpw h SER 90 N -0.44 0.01 0.24 0.00 0.87 -1.04 -1.41 113.55 111.79 1gpw h SER 90 Ca 0.07 0.08 0.01 0.00 -1.23 0.00 0.00 61.79 60.71 1gpw h SER 90 Cb 0.53 0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 62.56 1gpw h SER 90 CO -0.26 0.04 -0.37 -0.33 -0.53 0.00 0.00 176.83 175.38 1gpw h GLU 91 N 0.23 -0.66 -0.94 2.24 5.08 -1.05 -1.53 114.58 117.96 1gpw h GLU 91 Ca 0.23 0.04 0.17 0.00 -1.00 0.00 0.00 59.36 58.80 1gpw h GLU 91 Cb 0.29 0.15 -0.10 0.00 0.50 0.00 0.00 28.75 29.59 1gpw h GLU 91 CO -0.29 -0.44 0.53 -0.07 -1.00 0.00 0.00 179.01 177.74 1gpw h LEU 92 N -0.68 0.66 -0.17 1.33 3.38 -1.01 0.45 115.31 119.27 1gpw h LEU 92 Ca 0.00 0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 1gpw h LEU 92 Cb 0.66 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 1gpw h LEU 92 CO -0.14 0.25 -0.24 0.40 0.09 0.00 0.00 178.44 178.80 1gpw h ILE 93 N 0.70 1.35 0.00 1.22 2.04 -0.97 -2.50 117.51 119.35 1gpw h ILE 93 Ca 0.53 -1.44 -0.02 0.00 1.00 0.00 0.00 64.86 64.92 1gpw h ILE 93 Cb 0.79 1.88 -0.00 0.00 -0.74 0.00 0.00 36.82 38.76 1gpw h ILE 93 CO -0.38 0.43 -0.09 -0.07 0.00 0.00 0.00 178.15 178.04 1gpw h LEU 94 N 0.10 0.00 0.00 1.44 3.38 -0.56 -1.00 115.31 118.67 1gpw h LEU 94 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1gpw h LEU 94 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 1gpw h LEU 94 CO 0.06 0.09 0.00 -1.14 0.09 0.00 0.00 178.44 177.54 1gpw n ARG 95 N -4.29 0.58 0.00 1.13 3.00 0.08 -4.87 116.66 112.29 1gpw n ARG 95 Ca -0.03 0.02 0.00 0.00 -0.00 0.00 0.00 57.85 57.84 1gpw n ARG 95 Cb 0.17 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.13 1gpw n ARG 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1gpw n GLY 96 N 0.97 1.12 3.74 5.14 0.00 -0.39 -4.13 105.19 111.64 1gpw n GLY 96 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1gpw n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gpw s ALA 97 N -1.17 3.37 0.00 4.61 0.00 -0.96 -4.84 121.76 122.78 1gpw s ALA 97 Ca 0.00 0.81 0.11 0.00 0.00 0.00 0.00 51.96 52.87 1gpw s ALA 97 Cb 0.00 -3.35 -0.12 0.00 0.00 0.00 0.00 23.12 19.65 1gpw s ALA 97 CO 0.00 -0.19 1.24 -0.44 0.00 0.00 0.00 175.76 176.37 1gpw h ASP 98 N 5.02 0.00 -5.02 0.00 3.32 -1.86 -3.41 116.42 114.48 1gpw h ASP 98 Ca -0.44 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.49 1gpw h ASP 98 Cb 1.21 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.57 1gpw h ASP 98 CO 0.72 0.82 -0.29 -0.54 -1.72 0.00 0.00 179.24 178.23 1gpw s LYS 99 N -2.79 0.70 0.07 3.56 1.02 -1.19 -4.46 119.74 116.66 1gpw s LYS 99 Ca 0.01 -0.34 0.08 0.00 0.02 0.00 0.00 55.97 55.75 1gpw s LYS 99 Cb 0.09 0.30 -0.03 0.00 -0.52 0.00 0.00 37.83 37.67 1gpw s LYS 99 CO 0.80 -0.20 -0.23 0.14 -0.92 0.00 0.00 175.35 174.94 1gpw s VAL 100 N -1.80 1.85 -0.18 3.17 -7.23 -0.42 -2.35 120.40 113.46 1gpw s VAL 100 Ca -0.10 -1.42 -0.00 0.00 -1.81 0.00 0.00 61.98 58.65 1gpw s VAL 100 Cb -0.04 -1.63 0.01 0.00 0.56 0.00 0.00 36.38 35.28 1gpw s VAL 100 CO 0.01 0.14 -0.16 -0.55 -0.31 0.00 0.00 175.10 174.23 1gpw s SER 101 N -1.53 3.53 -0.08 4.85 0.15 -0.41 -1.50 113.70 118.70 1gpw s SER 101 Ca 0.09 -0.54 0.03 0.00 0.70 0.00 0.00 55.95 56.23 1gpw s SER 101 Cb -0.10 -1.55 -0.02 0.00 -1.71 0.00 0.00 66.02 62.64 1gpw s SER 101 CO 0.03 0.03 -0.17 0.27 1.20 0.00 0.00 173.24 174.60 1gpw s ILE 102 N 1.13 2.72 0.00 6.45 -4.36 -0.63 -3.67 121.20 122.84 1gpw s ILE 102 Ca 0.01 -0.81 0.00 0.00 -0.26 0.00 0.00 60.65 59.58 1gpw s ILE 102 Cb -0.14 -2.08 0.00 0.00 1.25 0.00 0.00 42.46 41.49 1gpw s ILE 102 CO -0.06 0.56 0.00 -3.20 0.24 0.00 0.00 174.94 172.48 1gpw n ASN 103 N 2.99 0.00 -0.15 4.36 4.05 -1.26 -2.41 115.26 122.84 1gpw n ASN 103 Ca -0.18 0.00 -0.05 0.00 0.45 0.00 0.00 54.58 54.80 1gpw n ASN 103 Cb 0.52 0.00 0.04 0.00 1.23 0.00 0.00 39.78 41.58 1gpw n ASN 103 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 177.26 174.95 1gpw h THR 104 N 0.00 0.96 -0.87 -0.44 2.02 -1.92 -1.46 112.91 111.20 1gpw h THR 104 Ca 0.00 -0.16 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 1gpw h THR 104 Cb 0.00 0.45 -0.04 0.00 -1.74 0.00 0.00 68.15 66.82 1gpw h THR 104 CO 0.00 0.09 0.52 0.00 0.37 0.00 0.00 175.52 176.50 1gpw h ALA 105 N 1.26 1.11 -0.69 6.16 0.00 -1.89 -1.42 119.26 123.78 1gpw h ALA 105 Ca 0.21 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1gpw h ALA 105 Cb 0.12 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1gpw h ALA 105 CO -0.15 0.58 0.29 0.00 0.00 0.00 0.00 179.25 179.97 1gpw h ALA 106 N 1.29 1.21 -0.20 0.00 0.00 -1.62 -1.94 119.26 117.99 1gpw h ALA 106 Ca 0.31 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 1gpw h ALA 106 Cb -0.05 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 1gpw h ALA 106 CO -0.06 0.58 -0.11 0.28 0.00 0.00 0.00 179.25 179.94 1gpw h VAL 107 N 0.99 1.31 -0.11 0.00 2.07 -0.79 -1.98 116.25 117.75 1gpw h VAL 107 Ca 0.23 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.56 1gpw h VAL 107 Cb 0.17 1.66 0.00 0.00 -1.52 0.00 0.00 31.29 31.60 1gpw h VAL 107 CO -0.02 0.36 0.00 -0.62 0.02 0.00 0.00 177.57 177.31 1gpw n GLU 108 N -4.54 1.41 -2.66 1.57 1.02 -0.58 -4.36 120.64 112.50 1gpw n GLU 108 Ca -0.05 -0.46 -0.04 0.00 -0.02 0.00 0.00 57.16 56.60 1gpw n GLU 108 Cb 0.34 -1.29 0.05 0.00 -0.02 0.00 0.00 31.44 30.52 1gpw n GLU 108 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1gpw n ASN 109 N -0.06 -1.14 -0.27 1.62 4.05 -0.74 -5.04 115.26 113.68 1gpw n ASN 109 Ca 0.04 -1.04 0.16 0.00 0.45 0.00 0.00 54.58 54.19 1gpw n ASN 109 Cb 0.21 0.58 0.44 0.00 1.23 0.00 0.00 39.78 42.25 1gpw n ASN 109 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 177.26 173.56 1gpw h PRO 110 N 3.66 0.52 -0.15 1.20 0.11 -1.56 -2.02 132.00 133.76 1gpw h PRO 110 Ca -0.11 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 66.01 1gpw h PRO 110 Cb 1.20 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1gpw h PRO 110 CO -0.18 0.35 0.24 0.77 -0.21 0.00 0.00 178.00 178.97 1gpw h SER 111 N 0.54 0.00 -0.49 -2.05 0.02 -1.95 -1.25 113.55 108.38 1gpw h SER 111 Ca 0.48 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 61.45 1gpw h SER 111 Cb 1.01 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.53 1gpw h SER 111 CO -0.22 0.00 0.33 0.25 -1.14 0.00 0.00 176.83 176.04 1gpw h LEU 112 N 0.00 0.51 0.70 5.07 5.85 -1.71 0.00 115.31 125.75 1gpw h LEU 112 Ca 0.07 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 1gpw h LEU 112 Cb 0.55 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 1gpw h LEU 112 CO -0.00 0.36 -0.44 0.40 -0.34 0.00 0.00 178.44 178.42 1gpw h ILE 113 N 0.60 0.11 -0.21 4.05 2.04 -1.43 -0.39 117.51 122.28 1gpw h ILE 113 Ca 0.19 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.09 1gpw h ILE 113 Cb 0.02 0.11 -0.03 0.00 -0.74 0.00 0.00 36.82 36.18 1gpw h ILE 113 CO -0.05 0.00 -0.00 0.74 0.00 0.00 0.00 178.15 178.84 1gpw h THR 114 N -1.08 0.85 -0.45 -0.27 2.02 -1.03 0.09 112.91 113.04 1gpw h THR 114 Ca -0.09 -0.02 0.09 0.00 0.77 0.00 0.00 66.41 67.16 1gpw h THR 114 Cb 0.88 0.78 -0.09 0.00 -1.74 0.00 0.00 68.15 67.98 1gpw h THR 114 CO 0.09 0.01 -0.13 -0.61 0.37 0.00 0.00 175.52 175.25 1gpw h GLN 115 N 0.06 -0.02 -0.17 6.66 4.15 -0.83 0.91 115.11 125.86 1gpw h GLN 115 Ca 0.10 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.44 1gpw h GLN 115 Cb 0.13 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.81 1gpw h GLN 115 CO -0.17 -0.01 -0.23 0.82 -1.93 0.00 0.00 178.83 177.31 1gpw h ILE 116 N -0.02 1.24 -0.00 2.39 2.04 -0.57 -2.41 117.51 120.18 1gpw h ILE 116 Ca 0.22 -1.10 -0.14 0.00 1.00 0.00 0.00 64.86 64.83 1gpw h ILE 116 Cb 0.35 1.36 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 1gpw h ILE 116 CO -0.47 0.34 -0.67 0.00 0.00 0.00 0.00 178.15 177.35 1gpw h ALA 117 N 1.49 0.90 -0.43 1.87 0.00 0.10 -1.81 119.26 121.37 1gpw h ALA 117 Ca 0.05 -0.61 -0.08 0.00 0.00 0.00 0.00 54.91 54.27 1gpw h ALA 117 Cb 0.56 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1gpw h ALA 117 CO 0.04 0.83 -0.05 1.96 0.00 0.00 0.00 179.25 182.03 1gpw h GLN 118 N 0.00 0.74 0.01 0.00 4.20 0.13 0.29 115.11 120.48 1gpw h GLN 118 Ca -0.01 -0.21 -0.36 0.00 0.06 0.00 0.00 58.65 58.13 1gpw h GLN 118 Cb 1.18 -0.08 -0.06 0.00 0.30 0.00 0.00 27.48 28.82 1gpw h GLN 118 CO 0.09 0.79 -2.21 2.41 -0.67 0.00 0.00 178.83 179.24 1gpw n THR 119 N -4.20 1.50 0.31 -0.54 -1.04 -1.17 -4.64 114.28 104.50 1gpw n THR 119 Ca 0.02 -0.77 0.05 0.00 -2.04 0.00 0.00 64.05 61.31 1gpw n THR 119 Cb 0.32 -0.92 -0.07 0.00 -1.82 0.00 0.00 70.33 67.84 1gpw n THR 119 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1gpw n PHE 120 N -3.00 0.00 0.00 -1.42 3.72 -0.68 -5.12 117.46 110.96 1gpw n PHE 120 Ca -0.32 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.08 1gpw n PHE 120 Cb 1.09 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 39.54 1gpw n PHE 120 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1gpw n GLY 121 N 1.48 1.03 0.37 1.37 0.00 0.10 -4.37 105.19 105.17 1gpw n GLY 121 Ca 0.01 -1.73 0.12 0.00 0.00 0.00 0.00 46.02 44.42 1gpw n GLY 121 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1gpw h SER 122 N 0.00 0.47 -0.12 1.61 0.02 -1.79 -2.10 113.55 111.64 1gpw h SER 122 Ca 0.00 0.02 0.03 0.00 -0.84 0.00 0.00 61.79 61.00 1gpw h SER 122 Cb 0.00 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.46 1gpw h SER 122 CO 0.00 0.27 0.13 0.06 -1.14 0.00 0.00 176.83 176.15 1gpw h GLN 123 N 0.51 0.00 -0.00 3.45 -0.00 -1.90 -1.01 115.11 116.16 1gpw h GLN 123 Ca 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.00 1gpw h GLN 123 Cb 0.65 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.13 1gpw h GLN 123 CO -0.12 0.00 -0.14 0.00 -0.00 0.00 0.00 178.83 178.57 1gpw n ALA 124 N -2.34 2.68 -3.61 0.06 0.00 -0.79 -4.75 120.51 111.76 1gpw n ALA 124 Ca 0.00 -0.17 -0.34 0.00 0.00 0.00 0.00 53.44 52.92 1gpw n ALA 124 Cb 0.24 -1.37 -0.14 0.00 0.00 0.00 0.00 19.45 18.18 1gpw n ALA 124 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1gpw s VAL 125 N -2.98 3.08 -0.13 0.00 1.01 -0.41 -1.30 120.40 119.67 1gpw s VAL 125 Ca 0.14 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.53 1gpw s VAL 125 Cb 0.19 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 1gpw s VAL 125 CO 0.57 0.45 -0.16 -0.69 0.00 0.00 0.00 175.10 175.27 1gpw s VAL 126 N 1.38 2.67 -0.34 2.92 1.01 -0.56 -1.60 120.40 125.88 1gpw s VAL 126 Ca 0.05 -0.79 -0.10 0.00 0.00 0.00 0.00 61.98 61.14 1gpw s VAL 126 Cb -0.14 -2.11 0.01 0.00 0.00 0.00 0.00 36.38 34.14 1gpw s VAL 126 CO -0.05 0.53 0.18 -0.69 0.00 0.00 0.00 175.10 175.07 1gpw s VAL 127 N 0.55 4.61 -0.16 2.92 1.01 -0.66 -1.61 120.40 127.06 1gpw s VAL 127 Ca -0.10 -0.62 -0.23 0.00 0.00 0.00 0.00 61.98 61.03 1gpw s VAL 127 Cb -0.16 -3.46 -0.02 0.00 0.00 0.00 0.00 36.38 32.74 1gpw s VAL 127 CO 0.04 -0.08 0.72 0.00 0.00 0.00 0.00 175.10 175.78 1gpw s ALA 128 N 1.59 3.50 -0.27 5.51 0.00 -1.01 -1.66 121.76 129.41 1gpw s ALA 128 Ca 0.03 -0.08 0.01 0.00 0.00 0.00 0.00 51.96 51.92 1gpw s ALA 128 Cb -0.18 -3.07 0.05 0.00 0.00 0.00 0.00 23.12 19.92 1gpw s ALA 128 CO 0.07 -0.51 -0.07 0.42 0.00 0.00 0.00 175.76 175.67 1gpw s ILE 129 N 1.80 2.54 -0.19 0.00 1.01 0.20 -4.36 121.20 122.20 1gpw s ILE 129 Ca 0.34 -1.45 -0.18 0.00 0.00 0.00 0.00 60.65 59.36 1gpw s ILE 129 Cb -0.16 -2.44 -0.04 0.00 0.01 0.00 0.00 42.46 39.83 1gpw s ILE 129 CO 0.12 -0.01 0.48 -1.81 0.00 0.00 0.00 174.94 173.72 1gpw s ASP 130 N 1.19 6.55 0.04 3.58 1.01 -1.26 -1.11 116.67 126.66 1gpw s ASP 130 Ca -0.06 0.66 0.02 0.00 0.71 0.00 0.00 52.55 53.88 1gpw s ASP 130 Cb -0.19 -2.28 -0.02 0.00 1.01 0.00 0.00 42.92 41.44 1gpw s ASP 130 CO -0.04 -0.12 -0.08 0.00 0.21 0.00 0.00 175.17 175.15 1gpw s ALA 131 N 1.37 0.56 0.05 5.23 0.00 -0.25 -0.78 121.76 127.93 1gpw s ALA 131 Ca 0.23 -0.68 -0.03 0.00 0.00 0.00 0.00 51.96 51.48 1gpw s ALA 131 Cb -0.15 0.02 -0.03 0.00 0.00 0.00 0.00 23.12 22.96 1gpw s ALA 131 CO 0.09 0.00 0.02 0.21 0.00 0.00 0.00 175.76 176.09 1gpw s LYS 132 N -1.35 0.60 -0.12 0.00 2.20 -1.07 -1.56 119.74 118.45 1gpw s LYS 132 Ca -0.08 -1.03 -0.27 0.00 -0.36 0.00 0.00 55.97 54.23 1gpw s LYS 132 Cb -0.09 0.22 -0.02 0.00 -1.51 0.00 0.00 37.83 36.44 1gpw s LYS 132 CO 0.00 -0.13 0.90 1.03 -0.36 0.00 0.00 175.35 176.79 1gpw s ARG 133 N -3.38 4.39 -0.07 4.03 0.52 -1.26 -2.04 118.95 121.13 1gpw s ARG 133 Ca 0.02 1.19 -0.00 0.00 -0.52 0.00 0.00 55.73 56.41 1gpw s ARG 133 Cb 0.04 -3.54 0.02 0.00 0.52 0.00 0.00 34.95 32.00 1gpw s ARG 133 CO -0.08 -0.25 -0.03 0.08 0.02 0.00 0.00 175.30 175.03 1gpw s VAL 134 N 1.84 0.59 -1.49 3.52 1.01 0.53 -4.83 120.40 121.57 1gpw s VAL 134 Ca 0.43 -0.06 -0.09 0.00 0.00 0.00 0.00 61.98 62.27 1gpw s VAL 134 Cb -0.18 -0.68 0.06 0.00 0.00 0.00 0.00 36.38 35.59 1gpw s VAL 134 CO 0.17 0.28 0.75 0.47 0.00 0.00 0.00 175.10 176.76 1gpw n ASP 135 N 4.77 -2.66 0.00 3.32 8.00 -1.26 -0.95 116.55 127.77 1gpw n ASP 135 Ca -0.13 -0.89 0.00 0.00 0.71 0.00 0.00 54.79 54.47 1gpw n ASP 135 Cb 0.50 -3.49 0.00 0.00 -0.02 0.00 0.00 41.12 38.12 1gpw n ASP 135 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1gpw n GLY 136 N -1.68 0.47 3.24 0.44 0.00 -1.26 -5.01 105.19 101.39 1gpw n GLY 136 Ca -0.11 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.71 1gpw n GLY 136 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gpw s GLU 137 N -0.53 1.00 -0.37 1.61 2.02 -0.13 -5.11 118.70 117.20 1gpw s GLU 137 Ca 0.00 -1.14 -0.25 0.00 0.02 0.00 0.00 54.97 53.60 1gpw s GLU 137 Cb 0.00 -1.03 0.01 0.00 0.10 0.00 0.00 34.13 33.21 1gpw s GLU 137 CO 0.00 0.22 0.88 -0.06 0.02 0.00 0.00 175.26 176.33 1gpw s PHE 138 N -1.62 3.08 0.08 1.61 0.08 -1.26 -0.35 117.98 119.61 1gpw s PHE 138 Ca 0.05 0.69 0.06 0.00 0.12 0.00 0.00 56.93 57.86 1gpw s PHE 138 Cb -0.08 -3.59 -0.04 0.00 -0.57 0.00 0.00 43.02 38.74 1gpw s PHE 138 CO 0.03 -0.81 -0.09 -1.64 -0.10 0.00 0.00 175.22 172.62 1gpw s MET 139 N 3.38 2.25 0.07 0.44 -1.94 -0.87 -1.20 119.30 121.43 1gpw s MET 139 Ca 0.36 -0.95 -0.23 0.00 -1.71 0.00 0.00 55.69 53.16 1gpw s MET 139 Cb -0.12 -2.36 -0.06 0.00 2.01 0.00 0.00 34.83 34.29 1gpw s MET 139 CO 0.18 0.53 0.68 0.08 -0.01 0.00 0.00 175.02 176.48 1gpw s VAL 140 N -1.18 4.69 0.02 -6.03 1.01 -0.38 -2.59 120.40 115.94 1gpw s VAL 140 Ca 0.21 1.46 0.08 0.00 0.00 0.00 0.00 61.98 63.72 1gpw s VAL 140 Cb -0.11 -4.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 1gpw s VAL 140 CO 0.13 0.46 -0.22 -0.36 0.00 0.00 0.00 175.10 175.11 1gpw s PHE 141 N -0.60 2.44 0.29 5.22 0.40 0.04 -2.13 117.98 123.64 1gpw s PHE 141 Ca 0.34 -0.34 0.00 0.00 -0.60 0.00 0.00 56.93 56.33 1gpw s PHE 141 Cb -0.20 -1.46 0.00 0.00 0.51 0.00 0.00 43.02 41.87 1gpw s PHE 141 CO 0.21 0.14 0.03 0.25 0.70 0.00 0.00 175.22 176.56 1gpw n THR 142 N 1.90 0.00 -3.92 0.64 -2.24 -0.27 -4.32 114.28 106.07 1gpw n THR 142 Ca -0.17 -1.35 -0.26 0.00 -2.27 0.00 0.00 64.05 60.00 1gpw n THR 142 Cb 0.52 0.20 -0.00 0.00 -2.10 0.00 0.00 70.33 68.95 1gpw n THR 142 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1gpw n TYR 143 N -0.80 -1.81 -3.41 4.78 4.01 -1.26 -1.93 117.16 116.74 1gpw n TYR 143 Ca -0.10 0.80 -0.19 0.00 -0.16 0.00 0.00 57.90 58.25 1gpw n TYR 143 Cb 0.37 -3.85 0.08 0.00 -0.31 0.00 0.00 39.34 35.63 1gpw n TYR 143 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1gpw n SER 144 N -2.95 -4.02 -0.28 7.72 7.64 -1.26 -2.64 113.62 117.83 1gpw n SER 144 Ca -0.22 -0.53 -0.04 0.00 1.01 0.00 0.00 58.87 59.09 1gpw n SER 144 Cb 0.64 -4.69 -0.02 0.00 -1.01 0.00 0.00 64.21 59.13 1gpw n SER 144 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1gpw n GLY 145 N -1.50 0.62 1.13 0.23 0.00 -0.82 -4.90 105.19 99.95 1gpw n GLY 145 Ca -0.13 -0.31 0.10 0.00 0.00 0.00 0.00 46.02 45.68 1gpw n GLY 145 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gpw n LYS 146 N -2.05 2.77 -3.66 1.61 5.02 -0.81 -4.90 118.16 116.13 1gpw n LYS 146 Ca -0.04 -2.47 -0.16 0.00 -2.02 0.00 0.00 58.31 53.62 1gpw n LYS 146 Cb 0.22 -1.48 -0.15 0.00 -0.02 0.00 0.00 35.03 33.61 1gpw n LYS 146 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1gpw s LYS 147 N -1.01 0.07 -0.46 1.97 2.20 -1.02 -4.99 119.74 116.51 1gpw s LYS 147 Ca 0.41 0.60 -0.28 0.00 -0.36 0.00 0.00 55.97 56.35 1gpw s LYS 147 Cb 0.21 -0.24 0.03 0.00 -1.51 0.00 0.00 37.83 36.32 1gpw s LYS 147 CO 0.28 -0.32 1.05 1.21 -0.36 0.00 0.00 175.35 177.21 1gpw s ASN 148 N 2.33 6.60 0.46 1.43 3.04 -1.26 -1.11 114.94 126.43 1gpw s ASN 148 Ca 0.03 0.38 0.24 0.00 0.04 0.00 0.00 52.86 53.55 1gpw s ASN 148 Cb -0.12 -2.51 1.07 0.00 -1.54 0.00 0.00 41.25 38.15 1gpw s ASN 148 CO -0.07 -1.14 1.90 0.71 -3.04 0.00 0.00 177.10 175.47 1gpw h THR 149 N 6.13 0.66 0.00 -5.21 1.35 -1.80 -3.46 112.91 110.57 1gpw h THR 149 Ca -0.23 -0.98 0.00 0.00 -0.55 0.00 0.00 66.41 64.65 1gpw h THR 149 Cb 1.07 1.63 0.00 0.00 -1.73 0.00 0.00 68.15 69.11 1gpw h THR 149 CO 1.08 0.22 0.00 0.61 -0.25 0.00 0.00 175.52 177.17 1gpw n GLY 150 N -0.19 0.87 3.70 5.82 0.00 -1.26 -5.02 105.19 109.11 1gpw n GLY 150 Ca -0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 1gpw n GLY 150 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gpw s ILE 151 N -3.25 5.15 0.34 -0.61 1.01 -1.26 -4.98 121.20 117.59 1gpw s ILE 151 Ca 0.00 1.00 -0.29 0.00 0.00 0.00 0.00 60.65 61.36 1gpw s ILE 151 Cb 0.00 -3.84 -0.10 0.00 0.01 0.00 0.00 42.46 38.52 1gpw s ILE 151 CO 0.00 0.27 1.33 -0.76 0.00 0.00 0.00 174.94 175.78 1gpw s LEU 152 N 0.97 4.41 0.27 2.97 1.43 -1.26 -1.25 118.68 126.22 1gpw s LEU 152 Ca 0.26 2.73 -0.04 0.00 -1.03 0.00 0.00 54.13 56.05 1gpw s LEU 152 Cb -0.15 -3.66 0.33 0.00 0.03 0.00 0.00 46.19 42.74 1gpw s LEU 152 CO 0.11 -0.58 1.91 0.25 0.23 0.00 0.00 176.35 178.26 1gpw h LEU 153 N 3.31 1.03 -1.45 1.79 5.85 -1.46 -2.10 115.31 122.28 1gpw h LEU 153 Ca -0.49 -0.06 0.11 0.00 0.84 0.00 0.00 57.88 58.28 1gpw h LEU 153 Cb 1.23 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 41.95 1gpw h LEU 153 CO 0.65 0.79 0.49 -0.09 -0.34 0.00 0.00 178.44 179.95 1gpw h ARG 154 N 1.19 0.58 0.00 1.25 2.43 -1.91 -1.48 114.38 116.44 1gpw h ARG 154 Ca 0.31 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.41 1gpw h ARG 154 Cb -0.05 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.37 1gpw h ARG 154 CO -0.06 0.38 -0.18 -0.44 -1.51 0.00 0.00 179.97 178.17 1gpw h ASP 155 N 0.60 0.00 -0.82 -3.80 3.32 -1.82 -3.36 116.42 110.53 1gpw h ASP 155 Ca 0.35 -0.93 0.16 0.00 0.02 0.00 0.00 57.03 56.63 1gpw h ASP 155 Cb 0.56 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.05 1gpw h ASP 155 CO -0.13 1.07 0.54 -0.25 -1.72 0.00 0.00 179.24 178.75 1gpw h TRP 156 N -1.00 0.60 -0.46 4.55 -0.00 -1.13 -1.50 115.95 117.01 1gpw h TRP 156 Ca -0.05 0.02 -0.10 0.00 -0.00 0.00 0.00 58.89 58.75 1gpw h TRP 156 Cb 1.04 -0.19 -0.02 0.00 -0.00 0.00 0.00 29.16 30.00 1gpw h TRP 156 CO 0.25 0.22 -0.13 0.28 -0.00 0.00 0.00 178.44 179.06 1gpw h VAL 157 N 0.50 1.26 -0.29 2.65 2.07 -1.43 -1.45 116.25 119.56 1gpw h VAL 157 Ca 0.41 -1.23 -0.08 0.00 0.82 0.00 0.00 66.70 66.63 1gpw h VAL 157 Cb 0.86 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 1gpw h VAL 157 CO -0.16 0.42 -0.12 0.58 0.02 0.00 0.00 177.57 178.32 1gpw h VAL 158 N 0.77 1.29 -0.85 2.57 2.07 -1.44 -2.62 116.25 118.04 1gpw h VAL 158 Ca 0.12 -1.19 0.03 0.00 0.82 0.00 0.00 66.70 66.48 1gpw h VAL 158 Cb 0.64 1.46 -0.05 0.00 -1.52 0.00 0.00 31.29 31.83 1gpw h VAL 158 CO 0.04 0.38 0.56 -0.08 0.02 0.00 0.00 177.57 178.50 1gpw h GLU 159 N 0.34 1.06 -0.34 1.57 4.57 -1.26 -0.99 114.58 119.53 1gpw h GLU 159 Ca 0.07 -0.06 -0.13 0.00 -1.18 0.00 0.00 59.36 58.05 1gpw h GLU 159 Cb 0.63 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 28.97 1gpw h GLU 159 CO 0.04 0.70 -0.29 0.28 -1.18 0.00 0.00 179.01 178.55 1gpw h VAL 160 N 1.09 1.29 -0.37 0.32 2.07 -1.16 -0.71 116.25 118.77 1gpw h VAL 160 Ca 0.33 -1.46 -0.11 0.00 0.82 0.00 0.00 66.70 66.29 1gpw h VAL 160 Cb -0.02 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 1gpw h VAL 160 CO -0.09 0.48 -0.21 -0.08 0.02 0.00 0.00 177.57 177.68 1gpw h GLU 161 N 0.57 0.71 -0.20 1.57 4.81 -1.08 -2.34 114.58 118.62 1gpw h GLU 161 Ca 0.06 -0.28 -0.09 0.00 -0.13 0.00 0.00 59.36 58.93 1gpw h GLU 161 Cb 0.87 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 1gpw h GLU 161 CO 0.07 0.87 -0.25 -0.22 -0.73 0.00 0.00 179.01 178.75 1gpw h LYS 162 N 0.63 0.37 0.00 1.92 3.64 -1.07 -2.70 116.57 119.36 1gpw h LYS 162 Ca 0.09 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1gpw h LYS 162 Cb 0.70 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.49 1gpw h LYS 162 CO 0.05 0.60 0.00 0.54 -2.27 0.00 0.00 179.45 178.37 1gpw n ARG 163 N -4.14 0.36 -0.32 1.90 5.12 -0.28 -4.89 116.66 114.42 1gpw n ARG 163 Ca -0.01 0.06 0.00 0.00 -1.93 0.00 0.00 57.85 55.97 1gpw n ARG 163 Cb 0.39 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.19 1gpw n ARG 163 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1gpw n GLY 164 N 0.72 1.01 3.77 -0.13 0.00 -1.02 -2.21 105.19 107.32 1gpw n GLY 164 Ca 0.12 -0.28 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 1gpw n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gpw s ALA 165 N -2.00 2.91 -0.19 4.61 0.00 -0.90 -4.50 121.76 121.68 1gpw s ALA 165 Ca 0.00 0.99 0.22 0.00 0.00 0.00 0.00 51.96 53.17 1gpw s ALA 165 Cb 0.00 -3.41 -0.19 0.00 0.00 0.00 0.00 23.12 19.52 1gpw s ALA 165 CO 0.00 -0.80 0.73 0.41 0.00 0.00 0.00 175.76 176.09 1gpw n GLY 166 N 0.47 -1.16 3.54 0.00 0.00 -0.63 -4.84 105.19 102.57 1gpw n GLY 166 Ca 0.08 -0.42 -0.14 0.00 0.00 0.00 0.00 46.02 45.54 1gpw n GLY 166 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1gpw s GLU 167 N -3.42 0.85 -0.12 1.61 2.12 -1.12 -4.36 118.70 114.25 1gpw s GLU 167 Ca -0.04 0.15 0.02 0.00 0.36 0.00 0.00 54.97 55.47 1gpw s GLU 167 Cb 0.13 0.40 -0.00 0.00 0.26 0.00 0.00 34.13 34.91 1gpw s GLU 167 CO 0.86 -0.27 -0.20 0.42 -0.54 0.00 0.00 175.26 175.53 1gpw s ILE 168 N -1.34 2.44 -0.42 -3.70 1.01 -0.59 -1.66 121.20 116.94 1gpw s ILE 168 Ca -0.06 -0.88 -0.13 0.00 0.00 0.00 0.00 60.65 59.59 1gpw s ILE 168 Cb -0.00 -1.98 0.05 0.00 0.01 0.00 0.00 42.46 40.55 1gpw s ILE 168 CO 0.04 0.54 0.30 -0.22 0.00 0.00 0.00 174.94 175.60 1gpw s LEU 169 N 0.39 5.18 -0.47 2.97 0.20 -0.66 -0.52 118.68 125.76 1gpw s LEU 169 Ca -0.15 -1.22 -0.14 0.00 0.69 0.00 0.00 54.13 53.31 1gpw s LEU 169 Cb -0.17 -2.09 0.09 0.00 -0.43 0.00 0.00 46.19 43.59 1gpw s LEU 169 CO 0.07 -0.52 0.38 -0.22 -0.29 0.00 0.00 176.35 175.77 1gpw s LEU 170 N 1.57 5.63 -0.16 -0.68 2.96 -0.32 0.58 118.68 128.25 1gpw s LEU 170 Ca 0.03 -1.48 -0.06 0.00 -0.22 0.00 0.00 54.13 52.40 1gpw s LEU 170 Cb -0.22 -2.14 -0.04 0.00 0.50 0.00 0.00 46.19 44.30 1gpw s LEU 170 CO 0.06 -0.66 0.05 -0.89 -1.32 0.00 0.00 176.35 173.59 1gpw s THR 171 N 1.57 4.73 -0.44 3.68 2.01 -0.27 -2.25 115.64 124.67 1gpw s THR 171 Ca 0.04 -0.06 -0.18 0.00 0.31 0.00 0.00 61.69 61.79 1gpw s THR 171 Cb -0.25 -3.10 0.03 0.00 0.01 0.00 0.00 72.50 69.19 1gpw s THR 171 CO 0.05 0.50 0.52 -0.55 -0.69 0.00 0.00 174.62 174.44 1gpw s SER 172 N 0.03 6.23 0.28 3.53 0.15 -1.17 -1.09 113.70 121.65 1gpw s SER 172 Ca 0.05 -0.68 -0.02 0.00 0.70 0.00 0.00 55.95 56.00 1gpw s SER 172 Cb -0.12 -2.26 0.42 0.00 -1.71 0.00 0.00 66.02 62.35 1gpw s SER 172 CO 0.01 -0.69 1.92 0.40 1.20 0.00 0.00 173.24 176.08 1gpw h ILE 173 N 5.79 1.14 -0.72 6.45 2.04 -1.65 0.01 117.51 130.57 1gpw h ILE 173 Ca -0.26 -0.40 0.11 0.00 1.00 0.00 0.00 64.86 65.30 1gpw h ILE 173 Cb 1.10 -0.13 -0.08 0.00 -0.74 0.00 0.00 36.82 36.97 1gpw h ILE 173 CO 0.85 0.21 0.32 0.44 0.00 0.00 0.00 178.15 179.98 1gpw h ASP 174 N 1.17 0.38 0.25 1.72 3.32 -1.92 -3.20 116.42 118.14 1gpw h ASP 174 Ca 0.38 0.08 -0.34 0.00 0.02 0.00 0.00 57.03 57.17 1gpw h ASP 174 Cb 0.05 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 1gpw h ASP 174 CO -0.12 0.20 -1.84 0.03 -1.72 0.00 0.00 179.24 175.78 1gpw h ARG 175 N 0.53 0.23 -5.02 3.56 2.47 -1.73 -3.47 114.38 110.95 1gpw h ARG 175 Ca 0.37 -0.40 -0.72 0.00 -1.26 0.00 0.00 59.98 57.97 1gpw h ARG 175 Cb 0.46 0.15 0.00 0.00 -1.65 0.00 0.00 29.97 28.93 1gpw h ARG 175 CO -0.32 1.08 0.67 -3.47 0.56 0.00 0.00 179.97 178.49 1gpw n ASP 176 N -3.41 0.95 0.00 7.04 2.03 -0.07 -0.63 116.55 122.46 1gpw n ASP 176 Ca -0.26 0.92 0.00 0.00 0.52 0.00 0.00 54.79 55.98 1gpw n ASP 176 Cb 1.05 -0.74 0.00 0.00 -0.72 0.00 0.00 41.12 40.71 1gpw n ASP 176 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1gpw n GLY 177 N 3.86 0.65 0.06 0.27 0.00 -1.26 -4.86 105.19 103.91 1gpw n GLY 177 Ca 0.29 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.32 1gpw n GLY 177 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gpw n THR 178 N -2.67 0.79 -1.33 2.61 -2.24 0.20 -4.98 114.28 106.65 1gpw n THR 178 Ca 0.00 -0.68 -0.11 0.00 -2.27 0.00 0.00 64.05 60.99 1gpw n THR 178 Cb 0.00 -0.34 -0.05 0.00 -2.10 0.00 0.00 70.33 67.84 1gpw n THR 178 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1gpw n LYS 179 N -2.59 -0.85 0.00 -0.78 5.02 -1.14 -4.86 118.16 112.97 1gpw n LYS 179 Ca -0.16 0.90 0.11 0.00 -2.02 0.00 0.00 58.31 57.14 1gpw n LYS 179 Cb 0.85 -4.90 0.09 0.00 -0.02 0.00 0.00 35.03 31.05 1gpw n LYS 179 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1gpw n SER 180 N 0.04 1.02 0.00 4.39 3.41 -1.02 -4.21 113.62 117.25 1gpw n SER 180 Ca -0.11 -0.84 0.00 0.00 -0.26 0.00 0.00 58.87 57.66 1gpw n SER 180 Cb 0.39 0.55 0.00 0.00 -0.26 0.00 0.00 64.21 64.89 1gpw n SER 180 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gpw n GLY 181 N 1.46 3.43 3.69 5.00 0.00 0.36 -4.97 105.19 114.16 1gpw n GLY 181 Ca 0.07 -1.83 -0.30 0.00 0.00 0.00 0.00 46.02 43.95 1gpw n GLY 181 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1gpw s TYR 182 N -2.52 2.09 -1.31 1.61 2.02 -1.26 -4.30 117.35 113.69 1gpw s TYR 182 Ca 0.00 1.49 -0.12 0.00 -0.37 0.00 0.00 57.07 58.08 1gpw s TYR 182 Cb 0.00 -3.17 0.14 0.00 -0.40 0.00 0.00 41.96 38.52 1gpw s TYR 182 CO 0.00 -2.50 1.87 -3.47 -1.57 0.00 0.00 175.55 169.88 1gpw n ASP 183 N -3.99 4.85 -0.16 2.29 -0.08 -1.26 -4.79 116.55 113.41 1gpw n ASP 183 Ca 0.09 -3.02 0.16 0.00 -1.51 0.00 0.00 54.79 50.51 1gpw n ASP 183 Cb 0.54 -1.55 0.53 0.00 2.34 0.00 0.00 41.12 42.97 1gpw n ASP 183 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 1gpw h THR 184 N 4.06 0.78 -0.32 5.18 1.35 -1.91 0.72 112.91 122.75 1gpw h THR 184 Ca 0.42 -0.13 0.00 0.00 -0.55 0.00 0.00 66.41 66.16 1gpw h THR 184 Cb 0.69 0.37 -0.02 0.00 -1.73 0.00 0.00 68.15 67.46 1gpw h THR 184 CO 1.61 0.07 0.21 -0.08 -0.25 0.00 0.00 175.52 177.07 1gpw h GLU 185 N 0.37 0.43 -0.55 4.72 4.81 -1.99 0.11 114.58 122.49 1gpw h GLU 185 Ca 0.37 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.48 1gpw h GLU 185 Cb 0.91 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.17 1gpw h GLU 185 CO -0.11 0.31 0.00 1.98 -0.73 0.00 0.00 179.01 180.46 1gpw h MET 186 N 0.43 0.93 -0.20 1.92 4.05 -1.32 -1.04 114.93 119.69 1gpw h MET 186 Ca 0.12 -0.27 -0.01 0.00 -0.28 0.00 0.00 59.70 59.25 1gpw h MET 186 Cb -0.02 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.67 1gpw h MET 186 CO -0.02 0.92 0.08 0.82 0.23 0.00 0.00 176.91 178.94 1gpw h ILE 187 N 0.86 1.17 0.00 1.77 2.04 -0.86 -2.63 117.51 119.86 1gpw h ILE 187 Ca 0.16 -0.51 -0.04 0.00 1.00 0.00 0.00 64.86 65.47 1gpw h ILE 187 Cb 0.51 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 1gpw h ILE 187 CO 0.02 0.16 -0.17 0.03 0.00 0.00 0.00 178.15 178.20 1gpw h ARG 188 N 0.17 0.00 -0.59 2.37 3.08 -0.58 -0.80 114.38 118.03 1gpw h ARG 188 Ca 0.07 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.02 1gpw h ARG 188 Cb 0.19 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1gpw h ARG 188 CO -0.00 0.17 -0.03 0.35 -1.07 0.00 0.00 179.97 179.39 1gpw h PHE 189 N 0.00 1.15 0.13 3.04 3.57 -0.87 -3.30 116.94 120.66 1gpw h PHE 189 Ca -0.00 -0.21 -0.31 0.00 3.53 0.00 0.00 57.97 60.98 1gpw h PHE 189 Cb 0.31 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.75 1gpw h PHE 189 CO 0.00 1.03 -1.58 0.28 -2.23 0.00 0.00 178.31 175.81 1gpw h VAL 190 N 0.96 1.10 -0.98 1.41 2.07 -1.10 -3.41 116.25 116.30 1gpw h VAL 190 Ca 0.16 -2.74 0.22 0.00 0.82 0.00 0.00 66.70 65.17 1gpw h VAL 190 Cb 0.59 2.75 -0.18 0.00 -1.52 0.00 0.00 31.29 32.92 1gpw h VAL 190 CO 0.03 0.82 -0.16 -0.09 0.02 0.00 0.00 177.57 178.19 1gpw h ARG 191 N 0.07 0.00 0.00 1.57 9.65 -1.24 0.40 114.38 124.84 1gpw h ARG 191 Ca -0.26 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.62 1gpw h ARG 191 Cb 2.03 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.61 1gpw h ARG 191 CO 0.16 0.00 0.00 -1.00 2.80 0.00 0.00 179.97 181.93 1gpw h PRO 192 N 0.00 0.00 0.00 0.20 0.13 -1.78 -3.29 132.00 127.25 1gpw h PRO 192 Ca 0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.64 1gpw h PRO 192 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1gpw h PRO 192 CO -0.98 0.00 0.00 -0.07 -0.23 0.00 0.00 178.00 176.72 1gpw h LEU 193 N 0.00 0.00 -8.07 1.56 3.38 -1.14 -3.46 115.31 107.58 1gpw h LEU 193 Ca 0.00 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 1gpw h LEU 193 Cb 0.86 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.47 1gpw h LEU 193 CO 0.00 0.00 -0.53 0.28 0.09 0.00 0.00 178.44 178.28 1gpw s THR 194 N -3.31 0.17 -0.72 0.22 -1.32 -1.20 -4.66 115.64 104.82 1gpw s THR 194 Ca 0.06 -1.54 0.12 0.00 -1.21 0.00 0.00 61.69 59.12 1gpw s THR 194 Cb 0.09 -1.49 -0.10 0.00 -1.51 0.00 0.00 72.50 69.49 1gpw s THR 194 CO 0.53 -0.79 0.57 0.35 -2.21 0.00 0.00 174.62 173.07 1gpw n THR 195 N 0.01 0.00 -1.60 5.08 -2.24 -1.26 -4.89 114.28 109.38 1gpw n THR 195 Ca -0.14 -0.25 -0.33 0.00 -2.27 0.00 0.00 64.05 61.07 1gpw n THR 195 Cb 0.62 1.04 0.06 0.00 -2.10 0.00 0.00 70.33 69.95 1gpw n THR 195 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1gpw s LEU 196 N -2.40 3.31 0.28 3.22 1.43 -1.26 -4.96 118.68 118.30 1gpw s LEU 196 Ca 0.06 2.04 -0.30 0.00 -1.03 0.00 0.00 54.13 54.90 1gpw s LEU 196 Cb 0.09 -4.55 -0.11 0.00 0.03 0.00 0.00 46.19 41.66 1gpw s LEU 196 CO 0.46 -1.84 1.49 -2.84 0.23 0.00 0.00 176.35 173.85 1gpw s PRO 197 N -4.20 4.21 -0.13 1.29 0.02 -1.26 -4.85 135.00 130.07 1gpw s PRO 197 Ca 0.67 2.42 -0.02 0.00 0.02 0.00 0.00 61.00 64.09 1gpw s PRO 197 Cb -0.21 -3.07 -0.03 0.00 0.02 0.00 0.00 34.50 31.21 1gpw s PRO 197 CO 0.45 -0.49 -0.06 0.42 -0.33 0.00 0.00 177.00 176.99 1gpw s ILE 198 N -0.16 3.73 -0.32 2.83 1.01 -1.26 -1.54 121.20 125.49 1gpw s ILE 198 Ca 0.60 -0.43 -0.07 0.00 0.00 0.00 0.00 60.65 60.75 1gpw s ILE 198 Cb -0.44 -2.60 0.02 0.00 0.01 0.00 0.00 42.46 39.45 1gpw s ILE 198 CO 0.47 0.52 0.11 -0.63 0.00 0.00 0.00 174.94 175.41 1gpw s ILE 199 N 0.11 3.99 0.04 2.92 1.01 0.32 -0.66 121.20 128.93 1gpw s ILE 199 Ca -0.02 -0.88 -0.30 0.00 0.00 0.00 0.00 60.65 59.44 1gpw s ILE 199 Cb -0.14 -3.16 -0.04 0.00 0.01 0.00 0.00 42.46 39.13 1gpw s ILE 199 CO 0.03 -0.07 1.06 0.00 0.00 0.00 0.00 174.94 175.96 1gpw s ALA 200 N 1.47 3.25 0.01 9.38 0.00 0.06 -1.18 121.76 134.75 1gpw s ALA 200 Ca 0.01 0.66 0.01 0.00 0.00 0.00 0.00 51.96 52.64 1gpw s ALA 200 Cb -0.18 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 19.56 1gpw s ALA 200 CO 0.03 -0.28 -0.04 0.45 0.00 0.00 0.00 175.76 175.91 1gpw s SER 201 N 0.90 0.50 0.00 0.00 0.15 -0.96 0.40 113.70 114.69 1gpw s SER 201 Ca 0.54 -0.22 0.00 0.00 0.70 0.00 0.00 55.95 56.97 1gpw s SER 201 Cb -0.24 -0.01 0.00 0.00 -1.71 0.00 0.00 66.02 64.05 1gpw s SER 201 CO 0.29 -0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.29 1gpw n GLY 202 N 2.51 -0.02 0.00 9.45 0.00 -1.26 -3.02 105.19 112.85 1gpw n GLY 202 Ca -0.16 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 44.87 1gpw n GLY 202 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gpw n GLY 203 N 2.25 1.93 3.67 -0.02 0.00 -1.24 -4.03 105.19 107.75 1gpw n GLY 203 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 46.02 45.44 1gpw n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gpw n ALA 204 N -0.25 -0.10 0.00 4.61 0.00 -1.26 -0.49 120.51 123.02 1gpw n ALA 204 Ca 0.00 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.78 1gpw n ALA 204 Cb 0.00 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.22 1gpw n ALA 204 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gpw n GLY 205 N 4.60 0.13 3.61 0.00 0.00 -1.26 -4.32 105.19 107.95 1gpw n GLY 205 Ca 0.30 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.24 1gpw n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gpw s LYS 206 N -1.06 1.16 0.20 1.61 -2.85 -1.26 -4.99 119.74 112.55 1gpw s LYS 206 Ca 0.00 -0.54 -0.12 0.00 -1.00 0.00 0.00 55.97 54.31 1gpw s LYS 206 Cb 0.00 0.46 0.25 0.00 -2.06 0.00 0.00 37.83 36.49 1gpw s LYS 206 CO 0.00 -0.52 1.66 0.52 0.10 0.00 0.00 175.35 177.11 1gpw h MET 207 N 2.00 0.09 -0.38 1.78 2.86 -1.99 -1.03 114.93 118.26 1gpw h MET 207 Ca -0.25 -0.01 0.11 0.00 -2.06 0.00 0.00 59.70 57.50 1gpw h MET 207 Cb 1.25 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.88 1gpw h MET 207 CO 0.30 0.06 0.32 0.93 1.06 0.00 0.00 176.91 179.58 1gpw h GLU 208 N 0.10 0.00 -0.07 1.72 3.07 -1.99 0.10 114.58 117.50 1gpw h GLU 208 Ca 0.30 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 59.10 1gpw h GLU 208 Cb 0.47 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.37 1gpw h GLU 208 CO -0.51 0.00 -0.20 0.45 -1.40 0.00 0.00 179.01 177.35 1gpw h HIS 209 N 0.00 0.13 -0.36 4.33 3.86 -1.60 -2.41 115.15 119.10 1gpw h HIS 209 Ca 0.18 -0.02 -0.15 0.00 -1.16 0.00 0.00 60.37 59.22 1gpw h HIS 209 Cb 0.82 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 29.25 1gpw h HIS 209 CO 0.00 0.32 -0.38 0.74 0.86 0.00 0.00 177.93 179.46 1gpw h PHE 210 N 0.11 1.02 -0.45 2.45 -1.00 -0.85 -2.63 116.94 115.59 1gpw h PHE 210 Ca 0.02 -0.30 -0.04 0.00 2.81 0.00 0.00 57.97 60.46 1gpw h PHE 210 Cb 0.42 -0.22 -0.02 0.00 3.61 0.00 0.00 35.95 39.75 1gpw h PHE 210 CO 0.00 1.10 0.13 1.25 -1.61 0.00 0.00 178.31 179.18 1gpw h LEU 211 N 0.70 0.67 -1.50 1.54 5.85 -1.44 -2.44 115.31 118.68 1gpw h LEU 211 Ca 0.06 -0.22 0.05 0.00 0.84 0.00 0.00 57.88 58.61 1gpw h LEU 211 Cb 0.96 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.78 1gpw h LEU 211 CO 0.09 0.71 0.39 -0.33 -0.34 0.00 0.00 178.44 178.96 1gpw h GLU 212 N 0.60 0.62 -0.26 1.25 5.08 -1.36 -0.56 114.58 119.94 1gpw h GLU 212 Ca 0.14 -0.04 -0.13 0.00 -1.00 0.00 0.00 59.36 58.34 1gpw h GLU 212 Cb 0.29 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 1gpw h GLU 212 CO -0.00 0.41 -0.32 0.00 -1.00 0.00 0.00 179.01 178.09 1gpw h ALA 213 N 1.67 0.39 -0.18 3.43 0.00 -1.07 -2.17 119.26 121.33 1gpw h ALA 213 Ca 0.25 -0.42 -0.13 0.00 0.00 0.00 0.00 54.91 54.61 1gpw h ALA 213 Cb 0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1gpw h ALA 213 CO -0.07 0.44 -0.44 0.74 0.00 0.00 0.00 179.25 179.92 1gpw h PHE 214 N 0.41 0.52 -0.03 0.00 0.04 -1.07 -2.27 116.94 114.55 1gpw h PHE 214 Ca 0.03 -0.15 -0.04 0.00 2.80 0.00 0.00 57.97 60.61 1gpw h PHE 214 Cb 0.90 -0.11 -0.01 0.00 2.20 0.00 0.00 35.95 38.94 1gpw h PHE 214 CO 0.08 0.80 -0.16 -0.07 -0.60 0.00 0.00 178.31 178.35 1gpw h LEU 215 N 0.35 0.04 -0.16 1.54 3.38 -1.03 0.03 115.31 119.46 1gpw h LEU 215 Ca 0.03 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1gpw h LEU 215 Cb 0.92 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1gpw h LEU 215 CO 0.08 0.21 -0.01 0.00 0.09 0.00 0.00 178.44 178.80 1gpw n ALA 216 N -2.50 2.66 0.00 1.53 0.00 -0.82 -4.91 120.51 116.45 1gpw n ALA 216 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1gpw n ALA 216 Cb 0.24 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.24 1gpw n ALA 216 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gpw n GLY 217 N 1.09 1.04 3.78 0.00 0.00 -0.00 -3.90 105.19 107.19 1gpw n GLY 217 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 1gpw n GLY 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gpw s ALA 218 N -2.00 3.13 -0.15 4.61 0.00 -0.89 -4.84 121.76 121.62 1gpw s ALA 218 Ca 0.00 0.74 0.18 0.00 0.00 0.00 0.00 51.96 52.89 1gpw s ALA 218 Cb 0.00 -3.29 -0.10 0.00 0.00 0.00 0.00 23.12 19.73 1gpw s ALA 218 CO 0.00 -0.23 0.88 -0.25 0.00 0.00 0.00 175.76 176.16 1gpw n ASP 219 N 0.11 0.86 -3.85 0.00 8.00 0.16 -4.58 116.55 117.25 1gpw n ASP 219 Ca 0.04 0.37 -0.09 0.00 0.71 0.00 0.00 54.79 55.81 1gpw n ASP 219 Cb 0.49 0.23 -0.08 0.00 -0.02 0.00 0.00 41.12 41.74 1gpw n ASP 219 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gpw s ALA 220 N -3.03 -0.28 -0.20 2.24 0.00 -0.66 -2.45 121.76 117.38 1gpw s ALA 220 Ca -0.02 -0.50 0.01 0.00 0.00 0.00 0.00 51.96 51.44 1gpw s ALA 220 Cb 0.09 0.42 0.04 0.00 0.00 0.00 0.00 23.12 23.67 1gpw s ALA 220 CO 0.81 -0.46 -0.09 0.00 0.00 0.00 0.00 175.76 176.01 1gpw s ALA 221 N -3.44 1.91 -0.01 0.00 0.00 -0.40 -0.76 121.76 119.06 1gpw s ALA 221 Ca 0.02 -1.16 -0.06 0.00 0.00 0.00 0.00 51.96 50.75 1gpw s ALA 221 Cb 0.03 -1.27 -0.05 0.00 0.00 0.00 0.00 23.12 21.84 1gpw s ALA 221 CO -0.09 -0.85 0.24 -1.17 0.00 0.00 0.00 175.76 173.90 1gpw s LEU 222 N 1.43 4.38 0.17 0.00 2.96 0.16 -1.16 118.68 126.62 1gpw s LEU 222 Ca -0.01 0.53 -0.21 0.00 -0.22 0.00 0.00 54.13 54.22 1gpw s LEU 222 Cb -0.16 -2.58 0.05 0.00 0.50 0.00 0.00 46.19 44.00 1gpw s LEU 222 CO -0.08 0.28 0.56 0.00 -1.32 0.00 0.00 176.35 175.79 1gpw s ALA 223 N -1.26 -1.34 0.00 5.97 0.00 -0.32 -4.21 121.76 120.60 1gpw s ALA 223 Ca 0.26 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.43 1gpw s ALA 223 Cb -0.13 0.84 0.00 0.00 0.00 0.00 0.00 23.12 23.83 1gpw s ALA 223 CO 0.15 -0.77 0.00 0.00 0.00 0.00 0.00 175.76 175.13 1gpw n ALA 224 N -0.35 2.97 -0.24 0.00 0.00 -1.26 0.24 120.51 121.87 1gpw n ALA 224 Ca -0.15 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.23 1gpw n ALA 224 Cb 0.64 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.03 1gpw n ALA 224 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1gpw n SER 225 N -2.45 -0.60 0.28 0.00 7.64 -1.26 -0.28 113.62 116.95 1gpw n SER 225 Ca 0.00 1.10 0.14 0.00 1.01 0.00 0.00 58.87 61.13 1gpw n SER 225 Cb 0.00 -0.18 0.83 0.00 -1.01 0.00 0.00 64.21 63.85 1gpw n SER 225 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 1gpw h VAL 226 N 0.00 0.52 0.07 0.44 -1.51 -1.92 0.24 116.25 114.08 1gpw h VAL 226 Ca 0.09 -0.29 -0.35 0.00 -1.23 0.00 0.00 66.70 64.92 1gpw h VAL 226 Cb 0.23 1.19 -0.04 0.00 -2.13 0.00 0.00 31.29 30.54 1gpw h VAL 226 CO -0.53 0.06 -2.00 0.49 -1.23 0.00 0.00 177.57 174.36 1gpw n PHE 227 N -3.69 0.96 0.48 5.19 3.72 0.08 -0.96 117.46 123.24 1gpw n PHE 227 Ca -0.02 0.25 -0.19 0.00 -0.05 0.00 0.00 57.45 57.44 1gpw n PHE 227 Cb 0.17 -1.14 -0.09 0.00 -0.94 0.00 0.00 39.48 37.48 1gpw n PHE 227 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1gpw h HIS 228 N 0.04 -1.13 0.00 1.38 3.86 -0.35 -1.77 115.15 117.17 1gpw h HIS 228 Ca -0.41 -0.03 0.00 0.00 -1.16 0.00 0.00 60.37 58.77 1gpw h HIS 228 Cb 2.03 0.37 0.00 0.00 1.06 0.00 0.00 27.41 30.87 1gpw h HIS 228 CO 0.04 -0.71 0.06 0.74 0.86 0.00 0.00 177.93 178.93 1gpw h PHE 229 N -1.24 0.00 -1.75 2.45 -1.00 -0.70 -3.45 116.94 111.26 1gpw h PHE 229 Ca -0.12 0.00 -0.24 0.00 2.81 0.00 0.00 57.97 60.42 1gpw h PHE 229 Cb 0.94 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.49 1gpw h PHE 229 CO 0.02 0.00 -0.31 -2.13 -1.61 0.00 0.00 178.31 174.28 1gpw n ARG 230 N -2.54 -1.02 0.21 1.51 3.00 -0.67 -4.91 116.66 112.24 1gpw n ARG 230 Ca -0.02 0.58 0.13 0.00 -0.00 0.00 0.00 57.85 58.54 1gpw n ARG 230 Cb 0.11 -4.74 0.30 0.00 0.00 0.00 0.00 32.46 28.12 1gpw n ARG 230 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1gpw h GLU 231 N -0.03 0.00 -4.68 -0.14 5.08 -1.31 -3.44 114.58 110.06 1gpw h GLU 231 Ca -0.29 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.58 1gpw h GLU 231 Cb 1.21 0.00 -0.32 0.00 0.50 0.00 0.00 28.75 30.14 1gpw h GLU 231 CO 0.34 0.00 -0.81 0.42 -1.00 0.00 0.00 179.01 177.96 1gpw s ILE 232 N -3.28 1.04 -0.13 3.13 1.01 -1.10 -5.02 121.20 116.85 1gpw s ILE 232 Ca 0.06 -0.47 -0.21 0.00 0.00 0.00 0.00 60.65 60.04 1gpw s ILE 232 Cb 0.07 -0.94 -0.03 0.00 0.01 0.00 0.00 42.46 41.57 1gpw s ILE 232 CO 0.63 0.32 0.61 -0.62 0.00 0.00 0.00 174.94 175.89 1gpw s ASP 233 N 0.41 6.79 0.24 3.58 2.15 -1.26 -4.80 116.67 123.76 1gpw s ASP 233 Ca -0.09 0.95 -0.05 0.00 0.43 0.00 0.00 52.55 53.79 1gpw s ASP 233 Cb -0.13 -2.35 0.25 0.00 -0.30 0.00 0.00 42.92 40.39 1gpw s ASP 233 CO 0.02 -0.15 1.78 0.58 -0.17 0.00 0.00 175.17 177.23 1gpw h VAL 234 N 4.92 1.25 -0.37 1.11 2.07 -1.99 -1.83 116.25 121.41 1gpw h VAL 234 Ca -0.37 -0.88 -0.03 0.00 0.82 0.00 0.00 66.70 66.24 1gpw h VAL 234 Cb 1.17 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 1gpw h VAL 234 CO 0.76 0.34 0.12 0.03 0.02 0.00 0.00 177.57 178.84 1gpw h ARG 235 N 0.97 0.57 -0.17 1.57 2.47 -1.94 -1.41 114.38 116.43 1gpw h ARG 235 Ca 0.21 -0.12 0.03 0.00 -1.26 0.00 0.00 59.98 58.84 1gpw h ARG 235 Cb 0.31 -0.08 -0.03 0.00 -1.65 0.00 0.00 29.97 28.52 1gpw h ARG 235 CO -0.00 0.58 -0.00 0.93 0.56 0.00 0.00 179.97 182.03 1gpw h GLU 236 N 0.44 0.05 -0.16 0.04 5.08 -1.93 -0.98 114.58 117.12 1gpw h GLU 236 Ca 0.12 -0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.51 1gpw h GLU 236 Cb 0.25 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1gpw h GLU 236 CO -0.00 0.03 -0.06 1.25 -1.00 0.00 0.00 179.01 179.23 1gpw h LEU 237 N 0.05 -0.21 -0.94 1.33 5.85 -1.14 -0.41 115.31 119.84 1gpw h LEU 237 Ca 0.08 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 1gpw h LEU 237 Cb 0.10 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 1gpw h LEU 237 CO -0.14 -0.08 0.27 0.11 -0.34 0.00 0.00 178.44 178.25 1gpw h LYS 238 N -0.04 1.04 0.08 1.25 1.57 -1.11 -0.13 116.57 119.23 1gpw h LYS 238 Ca 0.08 -0.18 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1gpw h LYS 238 Cb 0.16 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1gpw h LYS 238 CO -0.18 0.85 -0.04 0.93 -0.57 0.00 0.00 179.45 180.44 1gpw h GLU 239 N 1.01 -0.11 -0.29 3.15 4.39 -0.75 -1.24 114.58 120.74 1gpw h GLU 239 Ca 0.23 0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.99 1gpw h GLU 239 Cb 0.21 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.84 1gpw h GLU 239 CO -0.02 -0.07 0.01 -0.92 -1.16 0.00 0.00 179.01 176.85 1gpw h TYR 240 N -0.11 0.01 -0.69 4.33 3.20 -0.73 -0.37 116.97 122.61 1gpw h TYR 240 Ca -0.01 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.80 1gpw h TYR 240 Cb 0.09 0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 1gpw h TYR 240 CO -0.08 -0.03 0.13 -0.07 -1.64 0.00 0.00 178.16 176.47 1gpw h LEU 241 N 0.10 1.08 -0.35 2.82 3.38 -0.89 -2.24 115.31 119.22 1gpw h LEU 241 Ca 0.14 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1gpw h LEU 241 Cb 0.17 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1gpw h LEU 241 CO -0.22 1.06 0.18 0.50 0.09 0.00 0.00 178.44 180.05 1gpw h LYS 242 N 1.06 0.50 -0.71 1.13 1.63 -0.98 -0.16 116.57 119.04 1gpw h LYS 242 Ca 0.21 -0.06 0.13 0.00 -0.85 0.00 0.00 60.65 60.08 1gpw h LYS 242 Cb 0.42 -0.09 -0.05 0.00 -0.60 0.00 0.00 32.23 31.91 1gpw h LYS 242 CO 0.01 0.43 0.47 -0.22 -3.45 0.00 0.00 179.45 176.69 1gpw h LYS 243 N 0.44 0.43 -0.84 1.90 3.64 -0.75 -2.33 116.57 119.06 1gpw h LYS 243 Ca 0.12 -0.03 -0.53 0.00 -1.27 0.00 0.00 60.65 58.94 1gpw h LYS 243 Cb 0.08 -0.10 -0.29 0.00 -0.41 0.00 0.00 32.23 31.52 1gpw h LYS 243 CO -0.02 0.28 0.36 0.72 -2.27 0.00 0.00 179.45 178.53 1gpw n HIS 244 N -4.48 2.73 0.00 1.91 8.25 -0.82 -4.94 115.22 117.87 1gpw n HIS 244 Ca 0.13 -2.38 0.00 0.00 -0.26 0.00 0.00 57.72 55.21 1gpw n HIS 244 Cb 0.46 -0.98 0.00 0.00 1.12 0.00 0.00 29.99 30.59 1gpw n HIS 244 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1gpw n GLY 245 N -0.97 2.05 3.70 -1.41 0.00 -0.87 -5.01 105.19 102.66 1gpw n GLY 245 Ca 0.54 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.14 1gpw n GLY 245 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gpw s VAL 246 N -2.32 4.83 -1.17 1.61 1.01 -0.14 -4.97 120.40 119.25 1gpw s VAL 246 Ca 0.00 2.03 -0.20 0.00 0.00 0.00 0.00 61.98 63.81 1gpw s VAL 246 Cb 0.00 -4.31 0.07 0.00 0.00 0.00 0.00 36.38 32.14 1gpw s VAL 246 CO 0.00 0.07 1.59 0.21 0.00 0.00 0.00 175.10 176.97 1gpw s ASN 247 N 1.06 6.71 0.59 3.32 2.47 -1.26 -3.65 114.94 124.18 1gpw s ASN 247 Ca 0.49 -2.06 0.03 0.00 0.42 0.00 0.00 52.86 51.74 1gpw s ASN 247 Cb -0.19 -2.56 0.07 0.00 -1.45 0.00 0.00 41.25 37.12 1gpw s ASN 247 CO 0.22 -1.28 0.82 0.68 -3.72 0.00 0.00 177.10 173.82 1gpw s VAL 248 N 4.34 2.45 -0.84 -5.21 -7.23 -1.26 0.15 120.40 112.80 1gpw s VAL 248 Ca 0.49 -0.74 -0.20 0.00 -1.81 0.00 0.00 61.98 59.73 1gpw s VAL 248 Cb 0.02 -2.71 0.11 0.00 0.56 0.00 0.00 36.38 34.35 1gpw s VAL 248 CO -0.00 0.00 1.07 -0.60 -0.31 0.00 0.00 175.10 175.26 1gpw s ARG 249 N -4.82 3.43 -0.08 4.82 3.00 -1.26 -4.79 118.95 119.25 1gpw s ARG 249 Ca 0.61 -1.44 -0.14 0.00 -1.00 0.00 0.00 55.73 53.76 1gpw s ARG 249 Cb -0.08 -4.70 -0.05 0.00 0.00 0.00 0.00 34.95 30.12 1gpw s ARG 249 CO 0.40 -1.79 0.37 -0.51 0.00 0.00 0.00 175.30 173.76 1gpw s LEU 250 N 3.19 4.36 0.77 -0.88 1.43 -1.26 -5.06 118.68 121.23 1gpw s LEU 250 Ca 0.29 0.77 -0.03 0.00 -1.03 0.00 0.00 54.13 54.12 1gpw s LEU 250 Cb -0.09 -2.50 0.15 0.00 0.03 0.00 0.00 46.19 43.77 1gpw s LEU 250 CO -0.03 0.21 1.06 -1.61 0.23 0.00 0.00 176.35 176.21 1gpw s GLU 251 N -0.31 1.44 -0.07 1.70 8.01 -1.26 -5.10 118.70 123.11 1gpw s GLU 251 Ca 0.21 -1.04 0.02 0.00 0.01 0.00 0.00 54.97 54.17 1gpw s GLU 251 Cb -0.15 -2.25 0.02 0.00 -4.31 0.00 0.00 34.13 27.44 1gpw s GLU 251 CO 0.09 -1.66 -0.11 0.20 0.01 0.00 0.00 175.26 173.80 1gpw s GLY 252 N -4.79 0.77 0.00 -1.39 0.00 -1.26 -5.21 107.32 95.44 1gpw s GLY 252 Ca 0.68 -0.41 0.00 0.00 0.00 0.00 0.00 44.72 44.99 1gpw s GLY 252 CO 0.46 0.28 0.00 1.04 0.00 0.00 0.00 173.10 174.88