#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p1u s THR 5 N 0.00 3.39 0.03 0.58 2.01 -1.26 -4.68 115.64 115.70 1p1u s THR 5 Ca 0.00 1.04 -0.30 0.00 0.31 0.00 0.00 61.69 62.74 1p1u s THR 5 Cb 0.00 -3.67 -0.04 0.00 0.01 0.00 0.00 72.50 68.80 1p1u s THR 5 CO 0.00 0.11 1.05 -0.69 -0.69 0.00 0.00 174.62 174.39 1p1u s VAL 6 N 0.76 4.57 -0.43 3.82 1.01 0.94 -4.89 120.40 126.18 1p1u s VAL 6 Ca 0.61 1.87 -0.23 0.00 0.00 0.00 0.00 61.98 64.23 1p1u s VAL 6 Cb -0.36 -4.20 0.02 0.00 0.00 0.00 0.00 36.38 31.85 1p1u s VAL 6 CO 0.33 0.16 0.75 -0.69 0.00 0.00 0.00 175.10 175.65 1p1u s VAL 7 N 0.93 4.70 -0.22 2.92 1.01 -1.26 -1.13 120.40 127.35 1p1u s VAL 7 Ca 0.54 0.46 -0.10 0.00 0.00 0.00 0.00 61.98 62.88 1p1u s VAL 7 Cb -0.24 -4.27 -0.05 0.00 0.00 0.00 0.00 36.38 31.82 1p1u s VAL 7 CO 0.29 -0.63 0.13 -0.69 0.00 0.00 0.00 175.10 174.20 1p1u s VAL 8 N 3.16 5.18 -0.12 2.92 1.01 -0.67 -0.92 120.40 130.95 1p1u s VAL 8 Ca 0.29 0.11 -0.05 0.00 0.00 0.00 0.00 61.98 62.33 1p1u s VAL 8 Cb -0.13 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 1p1u s VAL 8 CO 0.21 0.38 0.08 0.28 0.00 0.00 0.00 175.10 176.05 1p1u s THR 9 N 0.86 5.00 0.25 3.92 -1.32 -0.01 0.09 115.64 124.42 1p1u s THR 9 Ca 0.07 0.02 -0.01 0.00 -1.21 0.00 0.00 61.69 60.56 1p1u s THR 9 Cb -0.13 -3.17 0.00 0.00 -1.51 0.00 0.00 72.50 67.69 1p1u s THR 9 CO 0.03 0.58 0.33 1.07 -2.21 0.00 0.00 174.62 174.43 1p1u n THR 10 N 2.33 0.00 -3.98 5.08 5.66 0.03 -2.31 114.28 121.08 1p1u n THR 10 Ca -0.19 -1.30 -0.11 0.00 -3.05 0.00 0.00 64.05 59.40 1p1u n THR 10 Cb 0.54 0.78 -0.12 0.00 -1.55 0.00 0.00 70.33 69.98 1p1u n THR 10 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 1p1u s ILE 11 N -2.72 0.19 -0.42 1.09 2.07 -1.26 -0.99 121.20 119.16 1p1u s ILE 11 Ca 0.21 -0.64 -0.29 0.00 -1.41 0.00 0.00 60.65 58.53 1p1u s ILE 11 Cb -0.01 -0.27 0.02 0.00 0.13 0.00 0.00 42.46 42.34 1p1u s ILE 11 CO 0.15 -0.29 1.28 -0.76 -1.91 0.00 0.00 174.94 173.42 1p1u s LEU 12 N -0.97 3.66 -0.27 8.50 1.43 -1.26 -4.45 118.68 125.32 1p1u s LEU 12 Ca -0.09 0.76 -0.07 0.00 -1.03 0.00 0.00 54.13 53.70 1p1u s LEU 12 Cb -0.07 -3.54 0.13 0.00 0.03 0.00 0.00 46.19 42.74 1p1u s LEU 12 CO -0.00 -1.29 0.57 -0.70 0.23 0.00 0.00 176.35 175.15 1p1u s GLU 13 N 4.60 0.50 0.34 1.70 2.56 -0.41 -4.99 118.70 123.01 1p1u s GLU 13 Ca 0.55 1.22 -0.26 0.00 0.00 0.00 0.00 54.97 56.48 1p1u s GLU 13 Cb -0.12 0.61 -0.09 0.00 2.00 0.00 0.00 34.13 36.53 1p1u s GLU 13 CO 0.30 -0.32 1.03 -1.12 -0.56 0.00 0.00 175.26 174.60 1p1u s SER 14 N 2.80 7.07 -0.24 -1.70 0.01 -1.25 -0.79 113.70 119.61 1p1u s SER 14 Ca 0.01 2.05 0.10 0.00 1.31 0.00 0.00 55.95 59.43 1p1u s SER 14 Cb -0.13 -2.60 0.68 0.00 0.21 0.00 0.00 66.02 64.19 1p1u s SER 14 CO -0.18 -0.27 1.61 -0.81 0.41 0.00 0.00 173.24 174.00 1p1u n PRO 15 N 0.50 3.96 0.07 12.44 -0.04 -1.26 -4.92 135.00 145.75 1p1u n PRO 15 Ca 0.02 -2.68 -0.11 0.00 -0.04 0.00 0.00 63.50 60.69 1p1u n PRO 15 Cb 0.48 -2.14 -0.08 0.00 -0.04 0.00 0.00 33.50 31.73 1p1u n PRO 15 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1p1u h TYR 16 N 2.98 -0.23 -3.28 0.54 0.05 -1.29 -1.13 116.97 114.61 1p1u h TYR 16 Ca 0.09 -0.01 -0.28 0.00 0.05 0.00 0.00 58.73 58.59 1p1u h TYR 16 Cb 1.92 0.08 -0.34 0.00 1.01 0.00 0.00 36.73 39.39 1p1u h TYR 16 CO 1.02 0.18 -0.65 0.08 -1.05 0.00 0.00 178.16 177.74 1p1u s VAL 17 N -3.65 -0.11 -0.04 -2.88 1.01 -0.18 -0.70 120.40 113.85 1p1u s VAL 17 Ca -0.13 0.26 -0.12 0.00 0.00 0.00 0.00 61.98 62.00 1p1u s VAL 17 Cb 0.01 -0.21 0.02 0.00 0.00 0.00 0.00 36.38 36.20 1p1u s VAL 17 CO 0.49 0.11 0.27 -0.04 0.00 0.00 0.00 175.10 175.92 1p1u s MET 18 N 1.55 0.52 0.12 2.72 -1.94 0.57 -1.28 119.30 121.55 1p1u s MET 18 Ca -0.04 -0.04 -0.30 0.00 -1.71 0.00 0.00 55.69 53.60 1p1u s MET 18 Cb -0.12 0.23 -0.06 0.00 2.01 0.00 0.00 34.83 36.89 1p1u s MET 18 CO -0.05 -0.12 1.03 -1.64 -0.01 0.00 0.00 175.02 174.24 1p1u s MET 19 N -0.84 4.63 0.62 2.03 -1.94 -1.26 -0.06 119.30 122.48 1p1u s MET 19 Ca -0.09 1.58 -0.19 0.00 -1.71 0.00 0.00 55.69 55.27 1p1u s MET 19 Cb -0.05 -3.34 -0.02 0.00 2.01 0.00 0.00 34.83 33.43 1p1u s MET 19 CO 0.02 0.10 1.30 1.63 -0.01 0.00 0.00 175.02 178.07 1p1u n LYS 20 N 2.82 1.26 0.05 2.03 5.02 0.10 -4.86 118.16 124.57 1p1u n LYS 20 Ca 0.03 0.48 0.20 0.00 -2.02 0.00 0.00 58.31 57.01 1p1u n LYS 20 Cb 0.48 -2.54 0.73 0.00 -0.02 0.00 0.00 35.03 33.68 1p1u n LYS 20 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 1p1u h LYS 21 N 0.75 0.00 -0.49 1.97 5.09 -1.94 0.10 116.57 122.06 1p1u h LYS 21 Ca -0.51 0.00 -0.30 0.00 0.09 0.00 0.00 60.65 59.93 1p1u h LYS 21 Cb 1.33 0.00 -0.18 0.00 0.10 0.00 0.00 32.23 33.48 1p1u h LYS 21 CO 0.54 0.00 -0.13 0.27 -2.09 0.00 0.00 179.45 178.04 1p1u n ASN 22 N -4.07 3.39 -0.16 7.07 6.94 -1.26 -4.76 115.26 122.41 1p1u n ASN 22 Ca 0.08 -3.79 0.14 0.00 -0.02 0.00 0.00 54.58 50.99 1p1u n ASN 22 Cb 0.60 -0.62 0.48 0.00 -2.36 0.00 0.00 39.78 37.88 1p1u n ASN 22 CO 0.00 0.00 0.00 1.12 -1.03 0.00 0.00 177.26 177.35 1p1u h HIS 23 N 1.31 0.53 0.00 -2.53 2.07 -1.24 -0.45 115.15 114.84 1p1u h HIS 23 Ca 0.29 0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.82 1p1u h HIS 23 Cb 1.56 -0.17 0.00 0.00 2.57 0.00 0.00 27.41 31.37 1p1u h HIS 23 CO 1.06 0.22 0.00 0.39 -3.07 0.00 0.00 177.93 176.52 1p1u n GLU 24 N -4.48 0.13 -0.02 5.12 4.71 -1.26 -0.44 120.64 124.38 1p1u n GLU 24 Ca 0.14 0.62 0.10 0.00 -0.01 0.00 0.00 57.16 58.01 1p1u n GLU 24 Cb 0.47 -1.91 0.10 0.00 -1.01 0.00 0.00 31.44 29.09 1p1u n GLU 24 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1p1u n MET 25 N -2.18 1.83 -4.34 3.49 3.85 -0.18 -4.98 117.12 114.61 1p1u n MET 25 Ca -0.01 -1.74 -0.30 0.00 -1.00 0.00 0.00 57.70 54.65 1p1u n MET 25 Cb 0.03 -1.39 -0.05 0.00 -1.05 0.00 0.00 33.22 30.77 1p1u n MET 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1p1u s LEU 26 N -1.61 2.52 0.05 3.17 1.43 0.41 -5.13 118.68 119.51 1p1u s LEU 26 Ca 0.24 -1.44 -0.06 0.00 -1.03 0.00 0.00 54.13 51.84 1p1u s LEU 26 Cb 0.17 -0.97 -0.01 0.00 0.03 0.00 0.00 46.19 45.41 1p1u s LEU 26 CO 0.25 -0.95 0.11 -1.61 0.23 0.00 0.00 176.35 174.38 1p1u s GLU 27 N -4.06 0.64 5.16 1.70 8.01 -1.26 -4.84 118.70 124.06 1p1u s GLU 27 Ca 0.20 -0.82 0.00 0.00 0.01 0.00 0.00 54.97 54.36 1p1u s GLU 27 Cb 0.00 0.25 0.00 0.00 -4.31 0.00 0.00 34.13 30.07 1p1u s GLU 27 CO 0.12 -0.17 0.00 0.41 0.01 0.00 0.00 175.26 175.63 1p1u n GLY 28 N 0.56 2.75 0.30 -1.39 0.00 -1.26 -2.08 105.19 104.07 1p1u n GLY 28 Ca -0.18 -0.35 0.18 0.00 0.00 0.00 0.00 46.02 45.67 1p1u n GLY 28 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1p1u h ASN 29 N 8.63 0.00 0.35 1.61 2.35 -1.92 -2.66 115.58 123.94 1p1u h ASN 29 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1p1u h ASN 29 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1p1u h ASN 29 CO 0.00 0.04 0.00 -0.33 -1.65 0.00 0.00 177.43 175.49 1p1u h GLU 30 N 0.00 0.00 0.00 0.81 3.07 -1.83 -2.47 114.58 114.16 1p1u h GLU 30 Ca -0.00 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.81 1p1u h GLU 30 Cb 0.24 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.14 1p1u h GLU 30 CO 0.00 0.00 -0.25 0.00 -1.40 0.00 0.00 179.01 177.37 1p1u h ARG 31 N 0.00 0.00 -6.08 2.33 3.08 -1.56 -3.45 114.38 108.70 1p1u h ARG 31 Ca 0.00 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.53 1p1u h ARG 31 Cb 0.18 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.20 1p1u h ARG 31 CO 0.00 0.25 -0.45 0.71 -1.07 0.00 0.00 179.97 179.40 1p1u s TYR 32 N -3.80 3.48 0.08 3.04 2.02 -0.93 0.01 117.35 121.24 1p1u s TYR 32 Ca -0.01 0.09 -0.11 0.00 -0.37 0.00 0.00 57.07 56.68 1p1u s TYR 32 Cb 0.11 -1.65 0.01 0.00 -0.40 0.00 0.00 41.96 40.03 1p1u s TYR 32 CO 0.64 0.50 0.24 -1.83 -1.57 0.00 0.00 175.55 173.53 1p1u s GLU 33 N -3.39 0.86 0.00 -0.62 -1.05 0.91 -4.79 118.70 110.61 1p1u s GLU 33 Ca 0.34 -0.81 0.00 0.00 -0.15 0.00 0.00 54.97 54.35 1p1u s GLU 33 Cb -0.11 0.36 0.00 0.00 -0.44 0.00 0.00 34.13 33.94 1p1u s GLU 33 CO 0.29 -0.28 0.00 0.41 0.95 0.00 0.00 175.26 176.62 1p1u n GLY 34 N 0.10 2.11 0.17 -3.83 0.00 -1.26 -0.32 105.19 102.16 1p1u n GLY 34 Ca -0.16 -1.87 -0.11 0.00 0.00 0.00 0.00 46.02 43.88 1p1u n GLY 34 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1p1u h TYR 35 N 0.00 -0.32 0.00 1.61 5.03 -0.63 -1.30 116.97 121.36 1p1u h TYR 35 Ca 0.00 0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.28 1p1u h TYR 35 Cb 0.00 0.14 -0.01 0.00 1.55 0.00 0.00 36.73 38.42 1p1u h TYR 35 CO 0.00 -0.19 -0.19 0.00 -1.32 0.00 0.00 178.16 176.47 1p1u h VAL 37 N 0.00 1.37 -0.66 0.00 2.07 -1.44 -0.75 116.25 116.83 1p1u h VAL 37 Ca -0.00 -1.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.13 1p1u h VAL 37 Cb 0.60 2.02 -0.03 0.00 -1.52 0.00 0.00 31.29 32.36 1p1u h VAL 37 CO 0.02 0.40 0.39 0.44 0.02 0.00 0.00 177.57 178.84 1p1u h ASP 38 N -0.12 0.80 -0.38 0.57 3.45 -0.92 -2.29 116.42 117.54 1p1u h ASP 38 Ca 0.01 -0.07 0.01 0.00 0.43 0.00 0.00 57.03 57.41 1p1u h ASP 38 Cb 0.71 -0.20 -0.02 0.00 -0.56 0.00 0.00 39.33 39.26 1p1u h ASP 38 CO 0.04 0.64 0.25 0.25 -1.57 0.00 0.00 179.24 178.84 1p1u h LEU 39 N 0.90 0.42 -0.89 1.55 5.85 -0.92 -1.65 115.31 120.59 1p1u h LEU 39 Ca 0.24 -0.01 0.09 0.00 0.84 0.00 0.00 57.88 59.03 1p1u h LEU 39 Cb -0.01 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 40.84 1p1u h LEU 39 CO -0.04 0.31 0.54 0.00 -0.34 0.00 0.00 178.44 178.90 1p1u h ALA 40 N 1.14 1.27 -0.47 1.25 0.00 -0.83 -0.55 119.26 121.08 1p1u h ALA 40 Ca 0.14 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1p1u h ALA 40 Cb -0.05 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1p1u h ALA 40 CO -0.04 0.21 0.23 0.00 0.00 0.00 0.00 179.25 179.66 1p1u h ALA 41 N 1.46 0.60 -0.45 0.00 0.00 -0.81 -1.15 119.26 118.91 1p1u h ALA 41 Ca 0.41 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 1p1u h ALA 41 Cb 0.31 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1p1u h ALA 41 CO -0.22 0.16 0.16 0.93 0.00 0.00 0.00 179.25 180.28 1p1u h GLU 42 N 0.61 0.69 -0.21 0.00 4.39 -0.42 -2.04 114.58 117.61 1p1u h GLU 42 Ca 0.16 -0.14 -0.02 0.00 0.34 0.00 0.00 59.36 59.70 1p1u h GLU 42 Cb 0.11 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 1p1u h GLU 42 CO -0.02 0.65 0.05 0.82 -1.16 0.00 0.00 179.01 179.35 1p1u h ILE 43 N 0.59 1.20 -0.62 3.13 5.03 -1.00 -1.45 117.51 124.39 1p1u h ILE 43 Ca 0.15 -0.66 0.08 0.00 -0.12 0.00 0.00 64.86 64.31 1p1u h ILE 43 Cb 0.23 1.23 -0.06 0.00 -3.03 0.00 0.00 36.82 35.19 1p1u h ILE 43 CO -0.01 0.21 0.29 0.00 -0.68 0.00 0.00 178.15 177.96 1p1u h ALA 44 N 0.87 0.82 -0.24 1.87 0.00 -1.13 0.24 119.26 121.68 1p1u h ALA 44 Ca 0.07 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1p1u h ALA 44 Cb 0.27 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1p1u h ALA 44 CO 0.00 -0.10 0.14 -0.22 0.00 0.00 0.00 179.25 179.07 1p1u h LYS 45 N 0.52 0.33 -0.05 0.00 3.64 -1.21 0.72 116.57 120.53 1p1u h LYS 45 Ca 0.30 -0.04 -0.12 0.00 -1.27 0.00 0.00 60.65 59.53 1p1u h LYS 45 Cb 0.30 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 1p1u h LYS 45 CO -0.25 0.29 -0.51 0.45 -2.27 0.00 0.00 179.45 177.17 1p1u h HIS 46 N 0.28 0.14 0.00 1.91 3.86 -0.69 -3.04 115.15 117.62 1p1u h HIS 46 Ca 0.08 -0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.25 1p1u h HIS 46 Cb 0.05 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 28.49 1p1u h HIS 46 CO -0.04 0.60 -0.75 0.00 0.86 0.00 0.00 177.93 178.60 1p1u n GLY 48 N 1.44 0.10 3.15 0.00 0.00 0.24 -5.04 105.19 105.08 1p1u n GLY 48 Ca 0.04 -0.21 -0.14 0.00 0.00 0.00 0.00 46.02 45.71 1p1u n GLY 48 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1p1u s PHE 49 N -3.17 0.96 0.16 1.61 -0.12 -0.60 -5.04 117.98 111.78 1p1u s PHE 49 Ca 0.08 -0.63 -0.06 0.00 -0.05 0.00 0.00 56.93 56.26 1p1u s PHE 49 Cb -0.03 -0.54 -0.06 0.00 -0.63 0.00 0.00 43.02 41.76 1p1u s PHE 49 CO 0.35 -0.03 0.41 0.15 -0.05 0.00 0.00 175.22 176.05 1p1u s LYS 50 N -2.54 3.66 0.21 1.99 1.02 -1.26 -4.64 119.74 118.18 1p1u s LYS 50 Ca 0.02 -0.01 -0.13 0.00 0.02 0.00 0.00 55.97 55.87 1p1u s LYS 50 Cb -0.04 -2.82 0.00 0.00 -0.52 0.00 0.00 37.83 34.45 1p1u s LYS 50 CO -0.00 0.44 0.43 1.52 -0.92 0.00 0.00 175.35 176.82 1p1u s TYR 51 N -1.68 0.27 -0.07 3.18 1.13 -1.26 -0.04 117.35 118.87 1p1u s TYR 51 Ca 0.42 -0.62 -0.00 0.00 -1.41 0.00 0.00 57.07 55.45 1p1u s TYR 51 Cb -0.12 0.16 0.02 0.00 -1.10 0.00 0.00 41.96 40.93 1p1u s TYR 51 CO 0.24 -0.90 -0.04 0.21 -2.51 0.00 0.00 175.55 172.55 1p1u s LYS 52 N -3.97 0.95 -0.14 -3.49 2.20 -0.28 -4.86 119.74 110.15 1p1u s LYS 52 Ca 0.18 -0.07 -0.29 0.00 -0.36 0.00 0.00 55.97 55.43 1p1u s LYS 52 Cb 0.00 -1.11 -0.01 0.00 -1.51 0.00 0.00 37.83 35.21 1p1u s LYS 52 CO 0.04 -0.21 1.12 -0.51 -0.36 0.00 0.00 175.35 175.42 1p1u s LEU 53 N 1.54 4.20 0.05 5.43 1.43 -1.26 -1.68 118.68 128.39 1p1u s LEU 53 Ca -0.01 1.59 0.09 0.00 -1.03 0.00 0.00 54.13 54.77 1p1u s LEU 53 Cb -0.13 -3.55 -0.03 0.00 0.03 0.00 0.00 46.19 42.51 1p1u s LEU 53 CO -0.04 -0.61 -0.24 0.42 0.23 0.00 0.00 176.35 176.11 1p1u s THR 54 N 2.73 1.96 -0.23 5.49 -4.23 0.11 -4.91 115.64 116.57 1p1u s THR 54 Ca 0.50 -1.35 -0.16 0.00 -1.18 0.00 0.00 61.69 59.51 1p1u s THR 54 Cb -0.20 -1.69 -0.04 0.00 1.34 0.00 0.00 72.50 71.91 1p1u s THR 54 CO 0.15 0.28 0.40 -0.63 -0.54 0.00 0.00 174.62 174.28 1p1u s ILE 55 N -0.83 5.17 0.08 2.99 -1.09 -1.26 -0.79 121.20 125.47 1p1u s ILE 55 Ca 0.10 0.68 -0.37 0.00 -2.23 0.00 0.00 60.65 58.83 1p1u s ILE 55 Cb -0.10 -3.73 -0.17 0.00 -1.58 0.00 0.00 42.46 36.88 1p1u s ILE 55 CO 0.02 0.20 1.26 0.55 -1.23 0.00 0.00 174.94 175.74 1p1u n VAL 56 N 4.70 0.08 -0.26 2.92 3.14 -0.16 -4.88 118.33 123.86 1p1u n VAL 56 Ca -0.08 -0.02 -0.04 0.00 -2.96 0.00 0.00 64.34 61.24 1p1u n VAL 56 Cb 0.51 -0.64 0.07 0.00 -1.06 0.00 0.00 33.84 32.72 1p1u n VAL 56 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1p1u h GLY 57 N 4.11 1.05 -0.88 7.55 0.00 -1.94 -3.11 103.07 109.85 1p1u h GLY 57 Ca -0.48 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 46.48 1p1u h GLY 57 CO 0.74 0.34 0.00 2.09 0.00 0.00 0.00 176.54 179.72 1p1u n ASP 58 N -4.60 1.84 -1.81 0.19 3.85 -1.26 -4.94 116.55 109.81 1p1u n ASP 58 Ca 0.07 -1.67 -0.19 0.00 -0.71 0.00 0.00 54.79 52.29 1p1u n ASP 58 Cb 0.05 -0.07 -0.05 0.00 -1.35 0.00 0.00 41.12 39.69 1p1u n ASP 58 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1p1u n GLY 59 N 1.19 0.84 3.66 6.12 0.00 -1.18 -4.95 105.19 110.88 1p1u n GLY 59 Ca 0.17 -0.08 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 1p1u n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p1u s LYS 60 N -4.24 2.29 -0.16 1.61 1.02 -1.26 -5.05 119.74 113.95 1p1u s LYS 60 Ca 0.00 -1.47 -0.17 0.00 0.02 0.00 0.00 55.97 54.35 1p1u s LYS 60 Cb 0.00 -2.14 -0.14 0.00 -0.52 0.00 0.00 37.83 35.03 1p1u s LYS 60 CO 0.00 0.30 0.23 1.88 -0.92 0.00 0.00 175.35 176.83 1p1u h TYR 61 N 1.81 0.00 0.00 3.18 -1.99 -1.92 -2.66 116.97 115.39 1p1u h TYR 61 Ca -0.44 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.29 1p1u h TYR 61 Cb 1.25 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.98 1p1u h TYR 61 CO 0.67 0.80 0.00 0.41 -0.00 0.00 0.00 178.16 180.04 1p1u n GLY 62 N 1.57 0.17 3.02 3.88 0.00 -1.26 -1.42 105.19 111.16 1p1u n GLY 62 Ca -0.16 0.62 -0.10 0.00 0.00 0.00 0.00 46.02 46.37 1p1u n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p1u s ALA 63 N 0.00 -0.10 -0.24 4.61 0.00 -1.26 -4.94 121.76 119.84 1p1u s ALA 63 Ca 0.00 -0.27 -0.13 0.00 0.00 0.00 0.00 51.96 51.56 1p1u s ALA 63 Cb 0.00 0.08 -0.04 0.00 0.00 0.00 0.00 23.12 23.16 1p1u s ALA 63 CO 0.00 -0.15 0.28 0.50 0.00 0.00 0.00 175.76 176.38 1p1u s ARG 64 N -1.15 4.08 -0.03 0.00 3.52 -1.26 -1.06 118.95 123.06 1p1u s ARG 64 Ca -0.12 -0.07 -0.30 0.00 -0.13 0.00 0.00 55.73 55.11 1p1u s ARG 64 Cb -0.07 -3.57 -0.06 0.00 -1.56 0.00 0.00 34.95 29.69 1p1u s ARG 64 CO 0.00 -0.05 1.69 0.34 -0.81 0.00 0.00 175.30 176.47 1p1u s ASP 65 N 1.21 6.64 0.61 -2.12 -1.08 -0.14 -4.87 116.67 116.92 1p1u s ASP 65 Ca 0.12 2.32 0.30 0.00 -0.52 0.00 0.00 52.55 54.78 1p1u s ASP 65 Cb -0.14 -2.54 1.72 0.00 -1.46 0.00 0.00 42.92 40.50 1p1u s ASP 65 CO 0.07 -0.93 2.10 0.00 0.52 0.00 0.00 175.17 176.93 1p1u h ALA 66 N 9.47 1.70 0.00 3.66 0.00 -1.96 0.56 119.26 132.69 1p1u h ALA 66 Ca -0.41 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.35 1p1u h ALA 66 Cb 1.19 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 1p1u h ALA 66 CO 0.95 -0.29 -1.09 -0.25 0.00 0.00 0.00 179.25 178.57 1p1u n ASP 67 N -3.63 1.86 0.15 0.00 8.00 -1.26 -4.50 116.55 117.17 1p1u n ASP 67 Ca 0.01 0.49 0.12 0.00 0.71 0.00 0.00 54.79 56.12 1p1u n ASP 67 Cb 0.32 -0.89 0.23 0.00 -0.02 0.00 0.00 41.12 40.77 1p1u n ASP 67 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 1p1u h THR 68 N -1.00 0.00 -0.34 -3.53 1.35 -1.96 -3.47 112.91 103.96 1p1u h THR 68 Ca -0.21 -0.78 -0.15 0.00 -0.55 0.00 0.00 66.41 64.72 1p1u h THR 68 Cb 0.99 1.68 -0.06 0.00 -1.73 0.00 0.00 68.15 69.03 1p1u h THR 68 CO -0.13 0.00 -0.13 0.29 -0.25 0.00 0.00 175.52 175.30 1p1u n LYS 69 N -2.68 -1.05 -3.18 4.72 4.76 0.20 -4.98 118.16 115.95 1p1u n LYS 69 Ca 0.04 0.67 -0.39 0.00 -2.87 0.00 0.00 58.31 55.76 1p1u n LYS 69 Cb 0.49 -4.66 -0.06 0.00 -1.84 0.00 0.00 35.03 28.96 1p1u n LYS 69 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1p1u s ILE 70 N -1.99 4.72 -0.12 -0.18 1.01 -1.25 -4.71 121.20 118.68 1p1u s ILE 70 Ca 0.00 1.35 -0.20 0.00 0.00 0.00 0.00 60.65 61.80 1p1u s ILE 70 Cb 0.00 -3.97 -0.04 0.00 0.01 0.00 0.00 42.46 38.46 1p1u s ILE 70 CO 0.00 0.49 0.58 0.26 0.00 0.00 0.00 174.94 176.27 1p1u s TRP 71 N -0.75 3.50 0.17 3.97 0.52 -1.26 -0.96 118.94 124.13 1p1u s TRP 71 Ca 0.32 1.00 0.02 0.00 0.02 0.00 0.00 56.10 57.46 1p1u s TRP 71 Cb -0.20 -2.68 0.03 0.00 -1.15 0.00 0.00 33.47 29.47 1p1u s TRP 71 CO 0.20 0.06 0.24 0.27 0.02 0.00 0.00 176.95 177.74 1p1u n ASN 72 N 4.05 0.56 0.00 2.95 0.23 -0.22 -4.20 115.26 118.63 1p1u n ASN 72 Ca -0.04 -1.42 0.00 0.00 -0.53 0.00 0.00 54.58 52.59 1p1u n ASN 72 Cb 0.51 -0.13 0.00 0.00 -2.08 0.00 0.00 39.78 38.08 1p1u n ASN 72 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1p1u n GLY 73 N 2.96 0.93 0.26 4.83 0.00 -1.26 -0.90 105.19 112.03 1p1u n GLY 73 Ca 0.05 -0.73 -0.01 0.00 0.00 0.00 0.00 46.02 45.33 1p1u n GLY 73 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1p1u h MET 74 N 0.00 0.54 -0.60 1.61 2.86 -0.86 -1.80 114.93 116.68 1p1u h MET 74 Ca 0.00 -0.14 -0.08 0.00 -2.06 0.00 0.00 59.70 57.42 1p1u h MET 74 Cb 0.00 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.57 1p1u h MET 74 CO 0.00 0.61 0.05 0.28 1.06 0.00 0.00 176.91 178.91 1p1u h VAL 75 N 0.51 1.26 -0.56 -2.22 2.07 -1.50 -2.66 116.25 113.15 1p1u h VAL 75 Ca 0.10 -1.05 -0.02 0.00 0.82 0.00 0.00 66.70 66.55 1p1u h VAL 75 Cb 0.42 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 1p1u h VAL 75 CO 0.02 0.38 0.26 1.23 0.02 0.00 0.00 177.57 179.48 1p1u h GLY 76 N 1.02 0.86 1.70 2.17 0.00 -0.38 0.44 103.07 108.87 1p1u h GLY 76 Ca 0.18 -0.44 0.01 0.00 0.00 0.00 0.00 47.33 47.08 1p1u h GLY 76 CO 0.02 0.41 0.19 0.83 0.00 0.00 0.00 176.54 178.00 1p1u h GLU 77 N 0.75 0.36 0.03 4.80 5.08 -1.09 0.08 114.58 124.60 1p1u h GLU 77 Ca 0.19 -0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.45 1p1u h GLU 77 Cb 0.13 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.31 1p1u h GLU 77 CO -0.02 0.24 -0.32 -0.07 -1.00 0.00 0.00 179.01 177.84 1p1u h LEU 78 N 0.38 0.23 -0.71 1.33 3.38 -1.12 0.72 115.31 119.52 1p1u h LEU 78 Ca 0.11 -0.87 0.09 0.00 0.09 0.00 0.00 57.88 57.31 1p1u h LEU 78 Cb -0.01 -0.07 -0.07 0.00 0.09 0.00 0.00 40.66 40.59 1p1u h LEU 78 CO -0.02 1.07 0.35 0.58 0.09 0.00 0.00 178.44 180.51 1p1u h VAL 79 N -0.58 0.84 -0.29 1.22 2.07 -0.39 -1.76 116.25 117.37 1p1u h VAL 79 Ca -0.05 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.27 1p1u h VAL 79 Cb 1.15 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 1p1u h VAL 79 CO 0.06 0.11 0.00 -1.22 0.02 0.00 0.00 177.57 176.54 1p1u n TYR 80 N -4.87 0.38 -2.79 1.57 4.01 -0.03 -4.95 117.16 110.48 1p1u n TYR 80 Ca 0.11 -0.19 -0.13 0.00 -0.16 0.00 0.00 57.90 57.53 1p1u n TYR 80 Cb 0.27 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.33 1p1u n TYR 80 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1p1u n GLY 81 N 1.15 0.04 0.02 2.72 0.00 -0.66 -4.94 105.19 103.53 1p1u n GLY 81 Ca 0.15 -0.25 0.11 0.00 0.00 0.00 0.00 46.02 46.03 1p1u n GLY 81 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1p1u n LYS 82 N -2.68 0.51 -4.06 1.61 4.76 0.25 -4.95 118.16 113.60 1p1u n LYS 82 Ca -0.05 -0.11 -0.11 0.00 -2.87 0.00 0.00 58.31 55.18 1p1u n LYS 82 Cb 0.56 -1.56 -0.11 0.00 -1.84 0.00 0.00 35.03 32.08 1p1u n LYS 82 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1p1u s ALA 83 N -3.38 0.49 -0.12 7.82 0.00 -0.84 -5.00 121.76 120.72 1p1u s ALA 83 Ca -0.03 -0.86 0.17 0.00 0.00 0.00 0.00 51.96 51.24 1p1u s ALA 83 Cb 0.14 0.12 -0.16 0.00 0.00 0.00 0.00 23.12 23.22 1p1u s ALA 83 CO 0.88 -0.14 0.72 -0.25 0.00 0.00 0.00 175.76 176.97 1p1u n ASP 84 N 1.09 0.71 -3.58 0.00 8.00 -0.10 -4.45 116.55 118.21 1p1u n ASP 84 Ca -0.20 0.31 -0.16 0.00 0.71 0.00 0.00 54.79 55.44 1p1u n ASP 84 Cb 0.57 0.39 -0.07 0.00 -0.02 0.00 0.00 41.12 41.99 1p1u n ASP 84 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1p1u s ILE 85 N -2.93 0.01 -0.16 0.53 2.07 -1.02 -4.26 121.20 115.43 1p1u s ILE 85 Ca -0.04 -0.06 0.00 0.00 -1.41 0.00 0.00 60.65 59.14 1p1u s ILE 85 Cb 0.09 -0.93 0.00 0.00 0.13 0.00 0.00 42.46 41.75 1p1u s ILE 85 CO 0.82 -0.03 -0.15 0.00 -1.91 0.00 0.00 174.94 173.66 1p1u s ALA 86 N -0.84 2.48 -0.28 1.50 0.00 -0.15 -0.83 121.76 123.64 1p1u s ALA 86 Ca -0.09 -1.09 0.02 0.00 0.00 0.00 0.00 51.96 50.80 1p1u s ALA 86 Cb -0.02 -1.25 0.08 0.00 0.00 0.00 0.00 23.12 21.93 1p1u s ALA 86 CO 0.07 -0.13 -0.00 0.42 0.00 0.00 0.00 175.76 176.12 1p1u s ILE 87 N 0.97 1.67 0.07 0.00 1.01 -0.98 -2.24 121.20 121.69 1p1u s ILE 87 Ca -0.02 -1.60 -0.24 0.00 0.00 0.00 0.00 60.65 58.79 1p1u s ILE 87 Cb -0.15 -2.06 0.08 0.00 0.01 0.00 0.00 42.46 40.34 1p1u s ILE 87 CO -0.03 -0.34 1.09 0.00 0.00 0.00 0.00 174.94 175.67 1p1u n ALA 88 N 4.57 -2.99 -1.42 9.38 0.00 -1.26 -4.59 120.51 124.20 1p1u n ALA 88 Ca -0.06 -0.84 -0.40 0.00 0.00 0.00 0.00 53.44 52.14 1p1u n ALA 88 Cb 0.43 0.32 -0.02 0.00 0.00 0.00 0.00 19.45 20.17 1p1u n ALA 88 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1p1u n PRO 89 N -0.78 2.52 -3.67 0.00 -0.04 -1.26 -4.68 135.00 127.09 1p1u n PRO 89 Ca 0.01 -2.22 -0.38 0.00 -0.04 0.00 0.00 63.50 60.87 1p1u n PRO 89 Cb 0.54 -3.04 -0.12 0.00 -0.04 0.00 0.00 33.50 30.85 1p1u n PRO 89 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1p1u s LEU 90 N 1.43 4.04 0.24 1.53 2.96 -1.26 -5.03 118.68 122.58 1p1u s LEU 90 Ca 0.52 -0.52 -0.30 0.00 -0.22 0.00 0.00 54.13 53.62 1p1u s LEU 90 Cb 0.14 -1.99 -0.09 0.00 0.50 0.00 0.00 46.19 44.76 1p1u s LEU 90 CO -0.02 -0.18 1.07 -0.89 -1.32 0.00 0.00 176.35 175.01 1p1u s THR 91 N 1.60 3.72 -0.28 3.68 2.01 -1.26 -1.60 115.64 123.51 1p1u s THR 91 Ca 0.05 1.64 -0.29 0.00 0.31 0.00 0.00 61.69 63.40 1p1u s THR 91 Cb -0.17 -4.05 0.00 0.00 0.01 0.00 0.00 72.50 68.30 1p1u s THR 91 CO 0.06 0.35 1.22 -0.63 -0.69 0.00 0.00 174.62 174.93 1p1u s ILE 92 N -0.84 4.29 0.16 1.82 1.01 -0.34 -4.87 121.20 122.43 1p1u s ILE 92 Ca 0.46 1.49 0.06 0.00 0.00 0.00 0.00 60.65 62.65 1p1u s ILE 92 Cb -0.30 -4.20 -0.04 0.00 0.01 0.00 0.00 42.46 37.92 1p1u s ILE 92 CO 0.37 -0.40 -0.13 0.42 0.00 0.00 0.00 174.94 175.20 1p1u s THR 93 N 3.97 1.39 0.12 2.92 -4.23 -1.26 -4.71 115.64 113.84 1p1u s THR 93 Ca 0.53 -2.00 -0.26 0.00 -1.18 0.00 0.00 61.69 58.77 1p1u s THR 93 Cb -0.16 -1.81 -0.06 0.00 1.34 0.00 0.00 72.50 71.81 1p1u s THR 93 CO 0.19 -0.60 1.63 0.25 -0.54 0.00 0.00 174.62 175.55 1p1u h LEU 94 N 2.94 -0.77 -1.48 4.79 5.85 -1.98 0.45 115.31 125.11 1p1u h LEU 94 Ca -0.38 0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.49 1p1u h LEU 94 Cb 1.20 0.31 -0.04 0.00 0.37 0.00 0.00 40.66 42.50 1p1u h LEU 94 CO 0.59 -0.34 0.41 -0.37 -0.34 0.00 0.00 178.44 178.39 1p1u h VAL 95 N -0.43 1.03 -0.01 1.05 -1.51 -2.00 -2.10 116.25 112.29 1p1u h VAL 95 Ca 0.05 -0.22 -0.20 0.00 -1.23 0.00 0.00 66.70 65.10 1p1u h VAL 95 Cb 0.49 0.33 0.02 0.00 -2.13 0.00 0.00 31.29 29.99 1p1u h VAL 95 CO -0.20 0.12 -0.77 0.03 -1.23 0.00 0.00 177.57 175.52 1p1u h ARG 96 N 0.65 0.54 -0.01 5.19 3.08 -1.85 -3.14 114.38 118.83 1p1u h ARG 96 Ca 0.26 -0.57 0.00 0.00 0.07 0.00 0.00 59.98 59.74 1p1u h ARG 96 Cb 0.20 0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.41 1p1u h ARG 96 CO -0.08 1.19 0.03 1.49 -1.07 0.00 0.00 179.97 181.53 1p1u h GLU 97 N 0.12 0.00 0.00 0.04 4.57 -0.37 0.35 114.58 119.29 1p1u h GLU 97 Ca -0.09 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.07 1p1u h GLU 97 Cb 1.45 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 30.04 1p1u h GLU 97 CO 0.15 0.00 -0.10 0.93 -1.18 0.00 0.00 179.01 178.82 1p1u h GLU 98 N 0.00 0.00 0.00 1.92 5.08 -1.34 -3.35 114.58 116.89 1p1u h GLU 98 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1p1u h GLU 98 Cb 0.06 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 1p1u h GLU 98 CO -0.00 0.10 -1.29 1.33 -1.00 0.00 0.00 179.01 178.15 1p1u n VAL 99 N -3.16 0.06 -4.30 3.13 0.24 -0.10 -5.07 118.33 109.13 1p1u n VAL 99 Ca 0.02 -0.15 -0.17 0.00 -2.04 0.00 0.00 64.34 62.00 1p1u n VAL 99 Cb 0.47 0.15 -0.10 0.00 -1.47 0.00 0.00 33.84 32.90 1p1u n VAL 99 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1p1u s ILE 100 N -2.36 0.31 -0.11 1.34 -4.36 -0.08 -4.24 121.20 111.71 1p1u s ILE 100 Ca -0.02 -2.00 -0.05 0.00 -0.26 0.00 0.00 60.65 58.32 1p1u s ILE 100 Cb 0.03 -2.54 -0.04 0.00 1.25 0.00 0.00 42.46 41.16 1p1u s ILE 100 CO 0.24 0.00 0.08 -1.81 0.24 0.00 0.00 174.94 173.69 1p1u s ASP 101 N -3.32 5.87 -0.03 4.36 1.01 0.00 -4.34 116.67 120.23 1p1u s ASP 101 Ca 0.37 0.31 0.08 0.00 0.71 0.00 0.00 52.55 54.02 1p1u s ASP 101 Cb 0.06 -1.81 -0.02 0.00 1.01 0.00 0.00 42.92 42.16 1p1u s ASP 101 CO 0.16 0.38 -0.25 -0.36 0.21 0.00 0.00 175.17 175.31 1p1u s PHE 102 N -0.89 2.36 0.84 4.23 0.08 -1.26 -0.83 117.98 122.51 1p1u s PHE 102 Ca 0.14 -0.47 -0.12 0.00 0.12 0.00 0.00 56.93 56.60 1p1u s PHE 102 Cb -0.12 -1.52 0.10 0.00 -0.57 0.00 0.00 43.02 40.91 1p1u s PHE 102 CO 0.03 -0.06 1.15 -1.54 -0.10 0.00 0.00 175.22 174.70 1p1u s SER 103 N -0.55 4.18 0.72 1.36 1.04 -0.24 -4.96 113.70 115.26 1p1u s SER 103 Ca 0.08 0.94 -0.16 0.00 0.48 0.00 0.00 55.95 57.30 1p1u s SER 103 Cb -0.11 -1.52 0.03 0.00 0.10 0.00 0.00 66.02 64.52 1p1u s SER 103 CO -0.00 -2.13 1.24 -0.54 0.98 0.00 0.00 173.24 172.79 1p1u s LYS 104 N -5.39 2.15 0.33 4.02 -0.14 -1.26 -4.53 119.74 114.92 1p1u s LYS 104 Ca 0.62 1.88 -0.28 0.00 -1.36 0.00 0.00 55.97 56.83 1p1u s LYS 104 Cb -0.13 -1.82 -0.13 0.00 -1.68 0.00 0.00 37.83 34.08 1p1u s LYS 104 CO 0.52 -1.86 1.28 -0.35 -0.76 0.00 0.00 175.35 174.18 1p1u n PRO 105 N -2.56 2.06 0.00 -1.68 -0.04 -1.26 -4.68 135.00 126.84 1p1u n PRO 105 Ca 0.14 0.72 0.09 0.00 -0.04 0.00 0.00 63.50 64.42 1p1u n PRO 105 Cb 0.49 -2.29 -0.08 0.00 -0.04 0.00 0.00 33.50 31.58 1p1u n PRO 105 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 1p1u n PHE 106 N 0.48 0.00 -3.66 0.54 1.16 -0.35 -4.95 117.46 110.68 1p1u n PHE 106 Ca 0.06 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.52 1p1u n PHE 106 Cb 0.35 0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 38.14 1p1u n PHE 106 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 1p1u s MET 107 N -2.61 0.68 0.14 3.97 0.00 -1.25 -4.99 119.30 115.24 1p1u s MET 107 Ca 0.09 0.97 -0.04 0.00 0.00 0.00 0.00 55.69 56.71 1p1u s MET 107 Cb 0.14 0.24 -0.05 0.00 0.00 0.00 0.00 34.83 35.16 1p1u s MET 107 CO 0.69 -0.12 0.36 -1.12 0.00 0.00 0.00 175.02 174.83 1p1u s SER 108 N 0.87 6.46 0.29 1.11 0.01 -1.26 -1.54 113.70 119.63 1p1u s SER 108 Ca -0.04 0.53 -0.16 0.00 1.31 0.00 0.00 55.95 57.59 1p1u s SER 108 Cb -0.05 -2.07 0.06 0.00 0.21 0.00 0.00 66.02 64.17 1p1u s SER 108 CO -0.07 0.06 0.82 0.00 0.41 0.00 0.00 173.24 174.46 1p1u n LEU 109 N 0.03 0.00 -3.57 2.44 -0.00 -0.44 -4.83 117.00 110.63 1p1u n LEU 109 Ca -0.03 -1.97 -0.05 0.00 -0.00 0.00 0.00 56.01 53.96 1p1u n LEU 109 Cb 0.52 3.17 -0.02 0.00 -0.00 0.00 0.00 43.42 47.09 1p1u n LEU 109 CO 0.49 -0.66 0.90 -0.83 -0.00 0.00 0.00 177.39 177.29 1p1u s GLY 110 N -3.08 -0.35 0.30 1.47 0.00 -1.26 -1.29 107.32 103.11 1p1u s GLY 110 Ca 0.17 1.27 -0.29 0.00 0.00 0.00 0.00 44.72 45.88 1p1u s GLY 110 CO 0.09 0.41 1.36 -0.42 0.00 0.00 0.00 173.10 174.54 1p1u s ILE 111 N -2.68 2.68 0.18 0.90 1.01 -1.26 -0.01 121.20 122.02 1p1u s ILE 111 Ca 0.08 0.64 -0.01 0.00 0.00 0.00 0.00 60.65 61.37 1p1u s ILE 111 Cb -0.01 -3.41 -0.04 0.00 0.01 0.00 0.00 42.46 39.02 1p1u s ILE 111 CO -0.06 0.14 0.12 -0.94 0.00 0.00 0.00 174.94 174.20 1p1u s SER 112 N -0.18 0.18 -0.18 3.58 1.04 0.13 0.04 113.70 118.31 1p1u s SER 112 Ca 0.52 -1.33 -0.06 0.00 0.48 0.00 0.00 55.95 55.56 1p1u s SER 112 Cb -0.41 0.36 -0.04 0.00 0.10 0.00 0.00 66.02 66.04 1p1u s SER 112 CO 0.50 -0.82 0.04 -0.63 0.98 0.00 0.00 173.24 173.31 1p1u s ILE 113 N -4.13 4.52 -0.16 -1.02 1.01 -1.26 -1.48 121.20 118.68 1p1u s ILE 113 Ca 0.35 -0.13 -0.03 0.00 0.00 0.00 0.00 60.65 60.84 1p1u s ILE 113 Cb 0.07 -3.03 -0.02 0.00 0.01 0.00 0.00 42.46 39.49 1p1u s ILE 113 CO 0.09 0.46 -0.06 -0.32 0.00 0.00 0.00 174.94 175.11 1p1u s MET 114 N 0.45 3.54 0.23 2.79 -2.45 0.96 -2.03 119.30 122.79 1p1u s MET 114 Ca 0.01 -0.58 0.03 0.00 -1.25 0.00 0.00 55.69 53.90 1p1u s MET 114 Cb -0.13 -2.87 -0.05 0.00 1.25 0.00 0.00 34.83 33.03 1p1u s MET 114 CO 0.01 0.13 0.00 0.96 1.05 0.00 0.00 175.02 177.18 1p1u s ILE 115 N 0.62 0.97 0.16 10.11 -4.36 -0.74 -1.06 121.20 126.90 1p1u s ILE 115 Ca -0.04 -2.03 -0.29 0.00 -0.26 0.00 0.00 60.65 58.04 1p1u s ILE 115 Cb -0.15 -2.33 -0.07 0.00 1.25 0.00 0.00 42.46 41.16 1p1u s ILE 115 CO 0.03 -0.33 0.91 -0.75 0.24 0.00 0.00 174.94 175.04 1p1u s LYS 116 N -3.88 4.72 0.09 0.37 2.20 -1.26 -1.18 119.74 120.80 1p1u s LYS 116 Ca 0.28 1.39 -0.36 0.00 -0.36 0.00 0.00 55.97 56.92 1p1u s LYS 116 Cb 0.06 -3.33 -0.16 0.00 -1.51 0.00 0.00 37.83 32.89 1p1u s LYS 116 CO 0.08 0.37 1.39 1.63 -0.36 0.00 0.00 175.35 178.47 1p1u n LYS 117 N 2.19 1.32 0.00 4.03 5.02 -0.19 -2.01 118.16 128.53 1p1u n LYS 117 Ca -0.01 0.48 0.00 0.00 -2.02 0.00 0.00 58.31 56.76 1p1u n LYS 117 Cb 0.48 -2.14 0.00 0.00 -0.02 0.00 0.00 35.03 33.35 1p1u n LYS 117 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1p1u n GLY 118 N 2.71 2.56 3.75 0.72 0.00 -1.26 -5.01 105.19 108.67 1p1u n GLY 118 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1p1u n GLY 118 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1p1u s THR 119 N -2.51 3.62 -1.06 2.61 -4.23 -0.85 -4.93 115.64 108.29 1p1u s THR 119 Ca 0.00 1.56 -0.12 0.00 -1.18 0.00 0.00 61.69 61.94 1p1u s THR 119 Cb 0.00 -3.99 -0.08 0.00 1.34 0.00 0.00 72.50 69.77 1p1u s THR 119 CO 0.00 0.34 2.21 -2.65 -0.54 0.00 0.00 174.62 173.98 1p1u n PRO 120 N 1.55 2.27 -3.76 3.99 -0.02 -1.26 -4.85 135.00 132.92 1p1u n PRO 120 Ca -0.00 -1.83 -0.16 0.00 -2.02 0.00 0.00 63.50 59.49 1p1u n PRO 120 Cb 0.45 -2.75 -0.16 0.00 -0.02 0.00 0.00 33.50 31.02 1p1u n PRO 120 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1p1u s ILE 121 N 3.64 -0.06 0.00 4.25 -1.09 -1.26 -5.03 121.20 121.65 1p1u s ILE 121 Ca 0.50 0.24 0.00 0.00 -2.23 0.00 0.00 60.65 59.16 1p1u s ILE 121 Cb 0.13 -0.09 0.00 0.00 -1.58 0.00 0.00 42.46 40.92 1p1u s ILE 121 CO -0.00 0.10 0.47 -0.62 -1.23 0.00 0.00 174.94 173.66 1p1u n GLU 122 N 4.31 -0.17 -3.74 2.79 4.71 -1.26 -4.86 120.64 122.42 1p1u n GLU 122 Ca -0.25 -0.54 -0.01 0.00 -0.01 0.00 0.00 57.16 56.35 1p1u n GLU 122 Cb 0.50 -0.87 -0.00 0.00 -1.01 0.00 0.00 31.44 30.05 1p1u n GLU 122 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 1p1u s SER 123 N -0.14 -0.10 0.26 1.62 1.04 -1.26 -3.56 113.70 111.55 1p1u s SER 123 Ca 0.00 -0.34 0.05 0.00 0.48 0.00 0.00 55.95 56.14 1p1u s SER 123 Cb 0.00 0.36 0.32 0.00 0.10 0.00 0.00 66.02 66.81 1p1u s SER 123 CO 0.00 -0.68 1.61 0.00 0.98 0.00 0.00 173.24 175.15 1p1u h ALA 124 N 2.00 0.95 -0.39 5.32 0.00 -1.91 -2.82 119.26 122.41 1p1u h ALA 124 Ca -0.27 -0.49 0.02 0.00 0.00 0.00 0.00 54.91 54.17 1p1u h ALA 124 Cb 1.22 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 1p1u h ALA 124 CO 0.28 0.68 0.21 1.05 0.00 0.00 0.00 179.25 181.47 1p1u h GLU 125 N 0.19 0.42 -0.58 0.00 9.09 -1.96 -1.71 114.58 120.03 1p1u h GLU 125 Ca 0.00 -0.03 0.05 0.00 0.05 0.00 0.00 59.36 59.44 1p1u h GLU 125 Cb 0.99 -0.09 -0.05 0.00 -1.65 0.00 0.00 28.75 27.95 1p1u h GLU 125 CO 0.08 0.28 0.30 -0.44 0.05 0.00 0.00 179.01 179.28 1p1u h ASP 126 N 0.43 0.43 0.01 3.06 3.45 -1.90 -2.82 116.42 119.08 1p1u h ASP 126 Ca 0.16 0.03 -0.00 0.00 0.43 0.00 0.00 57.03 57.65 1p1u h ASP 126 Cb 0.04 -0.05 0.00 0.00 -0.56 0.00 0.00 39.33 38.76 1p1u h ASP 126 CO -0.09 0.29 -0.00 -0.07 -1.57 0.00 0.00 179.24 177.79 1p1u h LEU 127 N 0.57 -0.01 -2.42 1.55 3.38 -1.23 -2.92 115.31 114.23 1p1u h LEU 127 Ca 0.26 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.22 1p1u h LEU 127 Cb 0.18 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1p1u h LEU 127 CO -0.18 0.02 0.03 0.77 0.09 0.00 0.00 178.44 179.16 1p1u h SER 128 N -0.04 0.00 -0.05 -0.43 4.64 -1.15 -1.69 113.55 114.84 1p1u h SER 128 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1p1u h SER 128 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1p1u h SER 128 CO 0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 1p1u n LYS 129 N -3.87 1.45 -4.27 4.77 5.02 -1.08 -4.92 118.16 115.26 1p1u n LYS 129 Ca -0.02 -0.67 -0.17 0.00 -2.02 0.00 0.00 58.31 55.43 1p1u n LYS 129 Cb 0.11 -1.44 -0.09 0.00 -0.02 0.00 0.00 35.03 33.60 1p1u n LYS 129 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1p1u s GLN 130 N -1.95 1.57 0.00 1.97 -0.21 -0.64 -5.06 119.66 115.35 1p1u s GLN 130 Ca 0.37 -1.89 0.00 0.00 0.02 0.00 0.00 55.36 53.86 1p1u s GLN 130 Cb 0.19 0.22 0.00 0.00 1.00 0.00 0.00 33.01 34.42 1p1u s GLN 130 CO 0.31 -0.54 0.00 0.25 -2.12 0.00 0.00 175.29 173.19 1p1u n THR 131 N -0.52 0.00 -0.32 -0.19 -2.24 -1.26 -4.84 114.28 104.91 1p1u n THR 131 Ca 0.05 -0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.90 1p1u n THR 131 Cb 0.64 0.11 0.28 0.00 -2.10 0.00 0.00 70.33 69.26 1p1u n THR 131 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1p1u h GLU 132 N 0.00 0.88 -4.36 -0.78 3.07 -1.96 -3.29 114.58 108.13 1p1u h GLU 132 Ca 0.00 -0.05 -0.73 0.00 -0.50 0.00 0.00 59.36 58.08 1p1u h GLU 132 Cb 0.00 -0.20 -0.23 0.00 -0.84 0.00 0.00 28.75 27.48 1p1u h GLU 132 CO 0.00 0.58 -0.37 0.42 -1.40 0.00 0.00 179.01 178.24 1p1u s ILE 133 N -5.86 5.02 0.57 3.13 1.01 -1.26 -4.88 121.20 118.93 1p1u s ILE 133 Ca -0.11 -1.08 -0.18 0.00 0.00 0.00 0.00 60.65 59.29 1p1u s ILE 133 Cb 0.22 -3.98 -0.05 0.00 0.01 0.00 0.00 42.46 38.66 1p1u s ILE 133 CO 0.80 -0.52 1.08 0.00 0.00 0.00 0.00 174.94 176.30 1p1u s ALA 134 N 1.60 2.70 -0.04 9.38 0.00 -0.32 -4.82 121.76 130.26 1p1u s ALA 134 Ca 0.04 0.59 -0.13 0.00 0.00 0.00 0.00 51.96 52.45 1p1u s ALA 134 Cb -0.23 -3.29 0.02 0.00 0.00 0.00 0.00 23.12 19.62 1p1u s ALA 134 CO 0.06 -0.78 0.30 1.52 0.00 0.00 0.00 175.76 176.86 1p1u s TYR 135 N -2.14 -0.21 0.00 0.00 1.13 -1.26 -0.18 117.35 114.69 1p1u s TYR 135 Ca 0.68 0.39 0.00 0.00 -1.41 0.00 0.00 57.07 56.73 1p1u s TYR 135 Cb -0.19 0.09 0.00 0.00 -1.10 0.00 0.00 41.96 40.76 1p1u s TYR 135 CO 0.31 -0.33 0.00 0.41 -2.51 0.00 0.00 175.55 173.44 1p1u n GLY 136 N 1.71 2.41 3.32 5.49 0.00 -1.02 -4.79 105.19 112.32 1p1u n GLY 136 Ca -0.19 -0.90 -0.19 0.00 0.00 0.00 0.00 46.02 44.74 1p1u n GLY 136 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1p1u s THR 137 N -2.99 0.00 0.52 2.61 -4.23 -1.23 -1.44 115.64 108.88 1p1u s THR 137 Ca 0.00 -1.93 -0.21 0.00 -1.18 0.00 0.00 61.69 58.37 1p1u s THR 137 Cb 0.00 -2.53 -0.06 0.00 1.34 0.00 0.00 72.50 71.25 1p1u s THR 137 CO 0.00 0.00 1.19 -0.89 -0.54 0.00 0.00 174.62 174.38 1p1u s THR 138 N -3.35 2.86 -1.74 3.99 2.01 -1.26 -1.56 115.64 116.59 1p1u s THR 138 Ca 0.39 0.60 0.05 0.00 0.31 0.00 0.00 61.69 63.04 1p1u s THR 138 Cb 0.02 -3.28 0.12 0.00 0.01 0.00 0.00 72.50 69.37 1p1u s THR 138 CO 0.27 -0.06 0.87 -0.67 -0.69 0.00 0.00 174.62 174.34 1p1u n ASP 139 N -0.99 0.00 -3.76 3.53 -0.08 0.26 -4.59 116.55 110.92 1p1u n ASP 139 Ca 0.10 0.02 -0.09 0.00 -1.51 0.00 0.00 54.79 53.31 1p1u n ASP 139 Cb 0.49 -0.13 -0.03 0.00 2.34 0.00 0.00 41.12 43.78 1p1u n ASP 139 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 1p1u s SER 140 N -2.26 -0.30 0.00 1.67 1.04 -1.26 -5.05 113.70 107.54 1p1u s SER 140 Ca 0.06 -0.49 0.00 0.00 0.48 0.00 0.00 55.95 56.00 1p1u s SER 140 Cb 0.03 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.80 1p1u s SER 140 CO 0.07 -1.17 0.00 0.61 0.98 0.00 0.00 173.24 173.73 1p1u n GLY 141 N -0.40 1.48 0.25 7.32 0.00 -1.26 -4.67 105.19 107.91 1p1u n GLY 141 Ca -0.08 -2.15 0.04 0.00 0.00 0.00 0.00 46.02 43.84 1p1u n GLY 141 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1p1u h SER 142 N 0.00 0.16 -0.20 1.61 4.64 -1.98 -2.19 113.55 115.59 1p1u h SER 142 Ca 0.00 -0.02 -0.07 0.00 -0.47 0.00 0.00 61.79 61.23 1p1u h SER 142 Cb 0.00 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1p1u h SER 142 CO 0.00 0.26 -0.14 0.74 -0.87 0.00 0.00 176.83 176.82 1p1u h THR 143 N 0.17 1.32 -0.60 2.95 2.02 -1.95 -0.54 112.91 116.28 1p1u h THR 143 Ca 0.04 -1.25 -0.03 0.00 0.77 0.00 0.00 66.41 65.93 1p1u h THR 143 Cb 0.24 1.71 -0.03 0.00 -1.74 0.00 0.00 68.15 68.33 1p1u h THR 143 CO 0.01 0.38 0.25 0.50 0.37 0.00 0.00 175.52 177.03 1p1u h LYS 144 N 0.12 0.90 -0.28 6.66 3.64 -1.78 -2.26 116.57 123.57 1p1u h LYS 144 Ca 0.04 -0.16 -0.03 0.00 -1.27 0.00 0.00 60.65 59.23 1p1u h LYS 144 Cb 0.66 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.31 1p1u h LYS 144 CO 0.04 0.76 0.05 1.49 -2.27 0.00 0.00 179.45 179.51 1p1u h GLU 145 N 0.84 0.40 -0.05 1.90 4.57 -1.30 -0.64 114.58 120.30 1p1u h GLU 145 Ca 0.20 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.33 1p1u h GLU 145 Cb 0.19 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 1p1u h GLU 145 CO -0.02 0.39 0.01 0.35 -1.18 0.00 0.00 179.01 178.56 1p1u h PHE 146 N 0.40 0.01 -0.46 0.92 3.57 -0.50 -1.73 116.94 119.15 1p1u h PHE 146 Ca 0.09 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.47 1p1u h PHE 146 Cb 0.19 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 1p1u h PHE 146 CO 0.01 0.00 -0.22 0.74 -2.23 0.00 0.00 178.31 176.61 1p1u h PHE 147 N 0.03 1.08 -0.91 0.41 0.04 -1.21 -0.52 116.94 115.85 1p1u h PHE 147 Ca 0.02 -0.26 0.04 0.00 2.80 0.00 0.00 57.97 60.57 1p1u h PHE 147 Cb 0.02 -0.25 -0.05 0.00 2.20 0.00 0.00 35.95 37.86 1p1u h PHE 147 CO -0.10 1.06 0.59 -0.09 -0.60 0.00 0.00 178.31 179.18 1p1u h ARG 148 N 0.81 1.11 0.00 1.51 2.43 -0.90 -3.09 114.38 116.26 1p1u h ARG 148 Ca 0.11 -0.07 -0.13 0.00 -0.81 0.00 0.00 59.98 59.08 1p1u h ARG 148 Cb 0.79 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 1p1u h ARG 148 CO 0.07 0.73 -1.28 0.00 -1.51 0.00 0.00 179.97 177.98 1p1u h ARG 149 N 1.14 0.00 -6.40 0.20 3.08 -1.25 -3.48 114.38 107.67 1p1u h ARG 149 Ca 0.37 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.79 1p1u h ARG 149 Cb 0.02 0.00 0.07 0.00 0.08 0.00 0.00 29.97 30.14 1p1u h ARG 149 CO -0.12 0.25 0.49 0.45 -1.07 0.00 0.00 179.97 179.96 1p1u n SER 150 N -2.87 2.05 -0.18 7.04 2.88 -0.21 -4.90 113.62 117.42 1p1u n SER 150 Ca -0.07 1.12 0.09 0.00 -1.33 0.00 0.00 58.87 58.68 1p1u n SER 150 Cb 0.78 -1.29 -0.06 0.00 -0.75 0.00 0.00 64.21 62.89 1p1u n SER 150 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1p1u n LYS 151 N 2.35 1.09 -2.44 -1.46 0.00 -1.26 -4.42 118.16 112.01 1p1u n LYS 151 Ca 0.16 -0.37 -0.41 0.00 -0.00 0.00 0.00 58.31 57.68 1p1u n LYS 151 Cb 0.25 -1.38 -0.04 0.00 -0.00 0.00 0.00 35.03 33.86 1p1u n LYS 151 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.40 175.90 1p1u s ILE 152 N -2.54 3.68 0.10 0.58 -1.16 -1.26 -4.89 121.20 115.72 1p1u s ILE 152 Ca 0.11 1.46 -0.20 0.00 -0.51 0.00 0.00 60.65 61.51 1p1u s ILE 152 Cb 0.15 -3.93 -0.05 0.00 0.61 0.00 0.00 42.46 39.24 1p1u s ILE 152 CO 0.66 0.26 1.29 0.00 -2.81 0.00 0.00 174.94 174.33 1p1u n ALA 153 N 2.27 -0.42 -0.21 1.50 0.00 -1.26 -1.59 120.51 120.80 1p1u n ALA 153 Ca 0.03 0.55 -0.00 0.00 0.00 0.00 0.00 53.44 54.02 1p1u n ALA 153 Cb 0.45 0.05 0.11 0.00 0.00 0.00 0.00 19.45 20.06 1p1u n ALA 153 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1p1u h VAL 154 N 0.00 0.83 -0.07 0.00 2.07 -2.00 -1.94 116.25 115.14 1p1u h VAL 154 Ca 0.10 -0.17 -0.17 0.00 0.82 0.00 0.00 66.70 67.28 1p1u h VAL 154 Cb 0.27 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1p1u h VAL 154 CO -0.61 0.09 -0.68 -0.26 0.02 0.00 0.00 177.57 176.13 1p1u h PHE 155 N 0.50 0.42 -0.40 1.57 0.04 -1.84 -2.11 116.94 115.12 1p1u h PHE 155 Ca 0.31 -0.18 -0.09 0.00 2.80 0.00 0.00 57.97 60.81 1p1u h PHE 155 Cb 0.34 -0.07 -0.02 0.00 2.20 0.00 0.00 35.95 38.40 1p1u h PHE 155 CO -0.13 0.90 -0.14 0.22 -0.60 0.00 0.00 178.31 178.55 1p1u h ASP 156 N 0.22 0.72 -0.57 2.17 3.58 -1.00 0.15 116.42 121.69 1p1u h ASP 156 Ca -0.02 -0.22 -0.08 0.00 0.42 0.00 0.00 57.03 57.13 1p1u h ASP 156 Cb 1.23 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 42.07 1p1u h ASP 156 CO 0.11 0.87 0.06 0.11 -2.88 0.00 0.00 179.24 177.51 1p1u h LYS 157 N 0.65 0.96 -0.76 0.28 6.56 -1.23 -1.24 116.57 121.79 1p1u h LYS 157 Ca 0.11 -0.28 -0.06 0.00 -1.06 0.00 0.00 60.65 59.36 1p1u h LYS 157 Cb 0.61 -0.10 -0.03 0.00 -0.57 0.00 0.00 32.23 32.13 1p1u h LYS 157 CO 0.04 0.94 0.26 0.52 -2.06 0.00 0.00 179.45 179.15 1p1u h MET 158 N 0.85 1.17 -0.22 3.15 2.86 -0.97 -2.01 114.93 119.76 1p1u h MET 158 Ca 0.17 -0.24 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 1p1u h MET 158 Cb 0.47 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 1p1u h MET 158 CO 0.02 0.98 0.11 2.35 1.06 0.00 0.00 176.91 181.43 1p1u h TRP 159 N 1.13 0.32 -0.68 -0.22 2.91 -0.58 0.08 115.95 118.90 1p1u h TRP 159 Ca 0.25 -0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.24 1p1u h TRP 159 Cb 0.28 -0.10 -0.03 0.00 -0.51 0.00 0.00 29.16 28.80 1p1u h TRP 159 CO 0.02 0.32 0.37 1.15 -1.03 0.00 0.00 178.44 179.27 1p1u h THR 160 N 0.23 1.21 0.24 2.65 2.02 -1.11 0.36 112.91 118.50 1p1u h THR 160 Ca 0.08 -0.52 -0.01 0.00 0.77 0.00 0.00 66.41 66.73 1p1u h THR 160 Cb 0.12 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 66.81 1p1u h THR 160 CO -0.01 0.23 -0.11 0.22 0.37 0.00 0.00 175.52 176.22 1p1u h TYR 161 N 0.95 -0.29 -0.40 3.16 3.20 -1.08 -2.54 116.97 119.97 1p1u h TYR 161 Ca 0.24 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.16 1p1u h TYR 161 Cb 0.03 0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.35 1p1u h TYR 161 CO 0.01 0.02 0.12 0.52 -1.64 0.00 0.00 178.16 177.18 1p1u h MET 162 N -0.62 0.25 -0.05 1.82 2.86 -0.60 0.38 114.93 118.97 1p1u h MET 162 Ca -0.03 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 1p1u h MET 162 Cb 0.44 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.04 1p1u h MET 162 CO 0.05 0.17 -0.02 0.00 1.06 0.00 0.00 176.91 178.17 1p1u h ARG 163 N 0.26 0.07 0.00 1.72 -0.00 -0.96 -3.06 114.38 112.42 1p1u h ARG 163 Ca 0.19 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.98 59.65 1p1u h ARG 163 Cb 0.20 -0.01 -0.00 0.00 0.00 0.00 0.00 29.97 30.15 1p1u h ARG 163 CO -0.21 0.10 -1.74 0.43 0.00 0.00 0.00 179.97 178.55 1p1u n SER 164 N -4.47 0.23 -4.69 7.04 7.64 -0.69 -5.00 113.62 113.68 1p1u n SER 164 Ca -0.02 0.09 -0.42 0.00 1.01 0.00 0.00 58.87 59.53 1p1u n SER 164 Cb 0.13 1.55 0.00 0.00 -1.01 0.00 0.00 64.21 64.89 1p1u n SER 164 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1p1u n ALA 165 N -2.25 1.22 -3.71 -0.43 0.00 0.12 -5.03 120.51 110.43 1p1u n ALA 165 Ca -0.04 0.30 -0.14 0.00 0.00 0.00 0.00 53.44 53.57 1p1u n ALA 165 Cb 0.58 -2.25 -0.14 0.00 0.00 0.00 0.00 19.45 17.64 1p1u n ALA 165 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1p1u s GLU 166 N -2.06 0.09 0.80 0.00 2.56 -1.26 -3.81 118.70 115.02 1p1u s GLU 166 Ca 0.59 0.35 -0.14 0.00 0.00 0.00 0.00 54.97 55.78 1p1u s GLU 166 Cb -0.54 -0.17 0.08 0.00 2.00 0.00 0.00 34.13 35.50 1p1u s GLU 166 CO 0.60 -0.16 1.22 -2.14 -0.56 0.00 0.00 175.26 174.21 1p1u s PRO 167 N 1.12 1.69 0.24 4.30 0.02 -1.26 -5.06 135.00 136.05 1p1u s PRO 167 Ca -0.09 1.80 -0.30 0.00 0.02 0.00 0.00 61.00 62.43 1p1u s PRO 167 Cb -0.11 -1.78 -0.15 0.00 0.02 0.00 0.00 34.50 32.48 1p1u s PRO 167 CO -0.06 -2.19 1.04 0.45 -0.33 0.00 0.00 177.00 175.92 1p1u n SER 168 N -3.19 1.19 -0.94 2.53 2.88 -1.25 -4.88 113.62 109.95 1p1u n SER 168 Ca 0.14 1.16 0.12 0.00 -1.33 0.00 0.00 58.87 58.96 1p1u n SER 168 Cb 0.50 -1.25 0.22 0.00 -0.75 0.00 0.00 64.21 62.94 1p1u n SER 168 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1p1u n VAL 169 N 0.70 0.23 -3.33 2.46 0.24 -1.26 -4.94 118.33 112.43 1p1u n VAL 169 Ca 0.12 -0.56 -0.31 0.00 -2.04 0.00 0.00 64.34 61.55 1p1u n VAL 169 Cb 0.29 1.05 -0.05 0.00 -1.47 0.00 0.00 33.84 33.66 1p1u n VAL 169 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1p1u s PHE 170 N -1.77 3.44 0.11 6.34 0.08 -1.26 -3.55 117.98 121.37 1p1u s PHE 170 Ca 0.34 0.86 0.07 0.00 0.12 0.00 0.00 56.93 58.32 1p1u s PHE 170 Cb 0.21 -2.26 -0.04 0.00 -0.57 0.00 0.00 43.02 40.37 1p1u s PHE 170 CO 0.31 0.20 -0.18 0.14 -0.10 0.00 0.00 175.22 175.59 1p1u s VAL 171 N -1.94 1.54 0.17 -0.44 -7.23 -0.60 -4.84 120.40 107.07 1p1u s VAL 171 Ca 0.47 -1.62 -0.08 0.00 -1.81 0.00 0.00 61.98 58.94 1p1u s VAL 171 Cb -0.11 -1.52 0.00 0.00 0.56 0.00 0.00 36.38 35.31 1p1u s VAL 171 CO 0.24 -0.22 1.55 0.08 -0.31 0.00 0.00 175.10 176.44 1p1u h ARG 172 N 3.82 0.91 -4.56 4.82 -0.00 -1.95 0.76 114.38 118.17 1p1u h ARG 172 Ca -0.43 -0.41 -0.23 0.00 -0.00 0.00 0.00 59.98 58.91 1p1u h ARG 172 Cb 1.19 -0.02 -0.15 0.00 -0.00 0.00 0.00 29.97 30.99 1p1u h ARG 172 CO 0.44 1.06 -0.63 0.95 -0.00 0.00 0.00 179.97 181.79 1p1u s THR 173 N -4.56 0.10 0.16 0.08 -4.23 -1.26 -4.58 115.64 101.35 1p1u s THR 173 Ca -0.10 -1.97 -0.15 0.00 -1.18 0.00 0.00 61.69 58.28 1p1u s THR 173 Cb 0.12 -2.34 0.03 0.00 1.34 0.00 0.00 72.50 71.65 1p1u s THR 173 CO 0.86 -0.18 1.80 0.74 -0.54 0.00 0.00 174.62 177.31 1p1u h THR 174 N 2.69 1.05 -0.73 3.99 2.02 -1.99 -0.51 112.91 119.42 1p1u h THR 174 Ca -0.36 -0.18 0.08 0.00 0.77 0.00 0.00 66.41 66.72 1p1u h THR 174 Cb 1.23 0.48 -0.06 0.00 -1.74 0.00 0.00 68.15 68.06 1p1u h THR 174 CO 0.56 0.10 0.41 0.00 0.37 0.00 0.00 175.52 176.95 1p1u h ALA 175 N 1.19 1.01 -0.66 6.16 0.00 -1.99 0.13 119.26 125.10 1p1u h ALA 175 Ca 0.17 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1p1u h ALA 175 Cb 0.01 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1p1u h ALA 175 CO -0.08 0.06 0.30 1.49 0.00 0.00 0.00 179.25 181.02 1p1u h GLU 176 N 0.71 0.96 -0.30 0.00 4.81 -1.76 -0.39 114.58 118.61 1p1u h GLU 176 Ca 0.34 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.41 1p1u h GLU 176 Cb 0.27 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 1p1u h GLU 176 CO -0.22 0.78 0.16 0.78 -0.73 0.00 0.00 179.01 179.78 1p1u h GLY 177 N 0.91 0.45 1.35 1.92 0.00 0.34 -0.78 103.07 107.26 1p1u h GLY 177 Ca 0.22 -0.21 -0.11 0.00 0.00 0.00 0.00 47.33 47.24 1p1u h GLY 177 CO -0.02 0.20 -0.19 -2.08 0.00 0.00 0.00 176.54 174.45 1p1u h VAL 178 N 0.37 1.27 -0.53 4.60 2.07 -0.86 -2.20 116.25 120.96 1p1u h VAL 178 Ca 0.11 -1.28 -0.03 0.00 0.82 0.00 0.00 66.70 66.32 1p1u h VAL 178 Cb 0.07 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 1p1u h VAL 178 CO -0.02 0.43 0.23 0.00 0.02 0.00 0.00 177.57 178.23 1p1u h ALA 179 N 1.12 0.69 -0.88 1.67 0.00 -0.89 -1.81 119.26 119.17 1p1u h ALA 179 Ca 0.10 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1p1u h ALA 179 Cb 0.68 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 1p1u h ALA 179 CO 0.05 0.28 0.54 -0.09 0.00 0.00 0.00 179.25 180.03 1p1u h ARG 180 N 0.72 1.18 -0.08 0.00 2.43 -0.88 -0.89 114.38 116.86 1p1u h ARG 180 Ca 0.18 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1p1u h ARG 180 Cb 0.17 -0.25 -0.00 0.00 -0.42 0.00 0.00 29.97 29.46 1p1u h ARG 180 CO -0.02 0.82 0.06 0.28 -1.51 0.00 0.00 179.97 179.60 1p1u h VAL 181 N 1.20 1.03 0.00 0.20 2.07 -1.07 -1.16 116.25 118.53 1p1u h VAL 181 Ca 0.32 -0.05 -0.04 0.00 0.82 0.00 0.00 66.70 67.75 1p1u h VAL 181 Cb -0.07 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1p1u h VAL 181 CO -0.06 0.02 -0.17 0.03 0.02 0.00 0.00 177.57 177.41 1p1u h ARG 182 N 0.11 0.00 -0.01 1.57 3.08 -0.80 -3.04 114.38 115.29 1p1u h ARG 182 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1p1u h ARG 182 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.04 1p1u h ARG 182 CO -0.01 0.17 -0.65 1.63 -1.07 0.00 0.00 179.97 180.05 1p1u n LYS 183 N -4.14 0.86 -0.26 0.04 5.02 -0.39 -4.40 118.16 114.90 1p1u n LYS 183 Ca -0.02 -0.64 0.05 0.00 -2.02 0.00 0.00 58.31 55.68 1p1u n LYS 183 Cb 0.25 -1.47 0.17 0.00 -0.02 0.00 0.00 35.03 33.96 1p1u n LYS 183 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1p1u n SER 184 N -0.54 2.34 -4.37 4.39 7.64 -0.45 -4.92 113.62 117.71 1p1u n SER 184 Ca 0.07 -2.13 -0.38 0.00 1.01 0.00 0.00 58.87 57.45 1p1u n SER 184 Cb 0.41 -0.34 -0.06 0.00 -1.01 0.00 0.00 64.21 63.21 1p1u n SER 184 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1p1u n LYS 185 N 0.50 -1.71 -0.78 1.43 0.00 -1.26 0.21 118.16 116.55 1p1u n LYS 185 Ca 0.13 0.22 0.00 0.00 -0.00 0.00 0.00 58.31 58.66 1p1u n LYS 185 Cb 0.42 -4.64 0.00 0.00 -0.00 0.00 0.00 35.03 30.81 1p1u n LYS 185 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1p1u n GLY 186 N -1.48 0.80 0.91 2.58 0.00 -1.26 -4.92 105.19 101.81 1p1u n GLY 186 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1p1u n GLY 186 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1p1u n LYS 187 N -2.25 2.15 -3.72 1.61 0.00 0.13 -4.84 118.16 111.23 1p1u n LYS 187 Ca 0.00 -1.78 -0.14 0.00 -0.00 0.00 0.00 58.31 56.39 1p1u n LYS 187 Cb 0.00 -1.41 -0.14 0.00 -0.00 0.00 0.00 35.03 33.47 1p1u n LYS 187 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.40 176.93 1p1u s TYR 188 N -1.41 -0.19 -0.05 5.58 5.04 -1.25 -1.18 117.35 123.88 1p1u s TYR 188 Ca 0.34 0.56 0.02 0.00 -2.44 0.00 0.00 57.07 55.56 1p1u s TYR 188 Cb 0.18 -0.11 -0.03 0.00 0.35 0.00 0.00 41.96 42.36 1p1u s TYR 188 CO 0.25 -0.20 -0.10 0.00 -1.34 0.00 0.00 175.55 174.15 1p1u s ALA 189 N 1.47 2.85 -0.15 3.97 0.00 0.74 -4.58 121.76 126.07 1p1u s ALA 189 Ca -0.06 -0.95 -0.00 0.00 0.00 0.00 0.00 51.96 50.95 1p1u s ALA 189 Cb -0.12 -1.11 -0.01 0.00 0.00 0.00 0.00 23.12 21.89 1p1u s ALA 189 CO -0.06 0.57 -0.13 -0.47 0.00 0.00 0.00 175.76 175.67 1p1u s TYR 190 N -0.80 2.82 -0.24 0.00 5.04 -0.23 -2.44 117.35 121.51 1p1u s TYR 190 Ca 0.13 -0.79 -0.13 0.00 -2.44 0.00 0.00 57.07 53.84 1p1u s TYR 190 Cb -0.11 -1.89 -0.04 0.00 0.35 0.00 0.00 41.96 40.27 1p1u s TYR 190 CO 0.02 -0.32 0.27 -0.51 -1.34 0.00 0.00 175.55 173.66 1p1u s LEU 191 N 0.61 4.10 0.33 6.97 1.43 -0.52 -0.03 118.68 131.57 1p1u s LEU 191 Ca -0.07 0.24 -0.15 0.00 -1.03 0.00 0.00 54.13 53.11 1p1u s LEU 191 Cb -0.16 -2.28 0.03 0.00 0.03 0.00 0.00 46.19 43.82 1p1u s LEU 191 CO 0.03 -0.04 0.69 -1.48 0.23 0.00 0.00 176.35 175.78 1p1u s LEU 192 N 1.41 0.09 0.36 1.79 2.34 -0.55 -4.56 118.68 119.57 1p1u s LEU 192 Ca 0.12 -1.00 -0.28 0.00 0.06 0.00 0.00 54.13 53.03 1p1u s LEU 192 Cb -0.15 2.50 -0.11 0.00 -0.56 0.00 0.00 46.19 47.87 1p1u s LEU 192 CO 0.07 -1.47 1.51 -1.61 -1.06 0.00 0.00 176.35 173.80 1p1u s GLU 193 N -3.12 4.11 0.36 1.48 2.02 -1.26 0.22 118.70 122.51 1p1u s GLU 193 Ca 0.17 2.58 0.07 0.00 0.02 0.00 0.00 54.97 57.81 1p1u s GLU 193 Cb -0.04 -2.98 0.76 0.00 0.10 0.00 0.00 34.13 31.97 1p1u s GLU 193 CO 0.11 -0.56 1.93 0.66 0.02 0.00 0.00 175.26 177.42 1p1u h SER 194 N 3.35 0.67 -0.09 -0.19 4.64 -0.74 -1.70 113.55 119.49 1p1u h SER 194 Ca -0.50 0.01 0.02 0.00 -0.47 0.00 0.00 61.79 60.85 1p1u h SER 194 Cb 1.24 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 63.18 1p1u h SER 194 CO 0.67 0.40 -0.03 0.71 -0.87 0.00 0.00 176.83 177.71 1p1u h THR 195 N 0.74 0.89 -0.43 2.95 1.35 -1.88 0.21 112.91 116.74 1p1u h THR 195 Ca 0.36 0.00 -0.11 0.00 -0.55 0.00 0.00 66.41 66.11 1p1u h THR 195 Cb 0.41 0.89 -0.02 0.00 -1.73 0.00 0.00 68.15 67.71 1p1u h THR 195 CO -0.14 0.00 -0.17 0.24 -0.25 0.00 0.00 175.52 175.21 1p1u h MET 196 N -0.01 0.83 -0.07 4.72 2.86 -1.85 -1.64 114.93 119.78 1p1u h MET 196 Ca 0.05 -0.31 0.02 0.00 -2.06 0.00 0.00 59.70 57.39 1p1u h MET 196 Cb 0.08 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.67 1p1u h MET 196 CO -0.10 0.94 -0.04 -0.97 1.06 0.00 0.00 176.91 177.80 1p1u h ASN 197 N 0.73 -0.14 -0.78 1.22 -0.73 -0.86 -1.10 115.58 113.93 1p1u h ASN 197 Ca 0.11 0.03 -0.00 0.00 1.87 0.00 0.00 56.30 58.31 1p1u h ASN 197 Cb 0.69 0.07 -0.04 0.00 0.27 0.00 0.00 38.32 39.31 1p1u h ASN 197 CO 0.05 -0.06 0.48 -0.33 -0.37 0.00 0.00 177.43 177.20 1p1u h GLU 198 N -0.05 1.06 0.01 6.67 5.08 -0.43 -1.64 114.58 125.29 1p1u h GLU 198 Ca 0.04 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1p1u h GLU 198 Cb 0.11 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.13 1p1u h GLU 198 CO -0.10 0.74 -0.01 -0.92 -1.00 0.00 0.00 179.01 177.72 1p1u h TYR 199 N 1.08 -0.02 -0.43 4.33 3.20 -0.82 -3.02 116.97 121.30 1p1u h TYR 199 Ca 0.28 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.12 1p1u h TYR 199 Cb -0.05 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.20 1p1u h TYR 199 CO 0.00 0.20 0.11 0.82 -1.64 0.00 0.00 178.16 177.66 1p1u h ILE 200 N -0.23 1.19 0.00 1.81 1.08 -1.04 -2.14 117.51 118.17 1p1u h ILE 200 Ca -0.00 -0.65 -0.01 0.00 -0.39 0.00 0.00 64.86 63.80 1p1u h ILE 200 Cb 0.23 0.74 -0.00 0.00 -3.07 0.00 0.00 36.82 34.71 1p1u h ILE 200 CO 0.00 0.24 -0.07 -0.08 -0.69 0.00 0.00 178.15 177.56 1p1u h GLU 201 N 0.62 0.00 -0.40 2.37 4.81 -1.22 -1.92 114.58 118.84 1p1u h GLU 201 Ca 0.14 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1p1u h GLU 201 Cb 0.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.60 1p1u h GLU 201 CO -0.01 0.07 0.00 1.04 -0.73 0.00 0.00 179.01 179.38 1p1u n GLN 202 N -3.62 2.16 -4.37 1.92 1.13 -0.81 -4.83 117.38 108.95 1p1u n GLN 202 Ca -0.02 -1.77 -0.26 0.00 -1.94 0.00 0.00 57.00 53.01 1p1u n GLN 202 Cb 0.18 -1.43 -0.12 0.00 0.11 0.00 0.00 30.24 28.98 1p1u n GLN 202 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1p1u s ARG 203 N -1.48 1.35 0.63 -1.09 0.52 -0.72 -1.05 118.95 117.11 1p1u s ARG 203 Ca 0.35 -1.38 -0.18 0.00 -0.52 0.00 0.00 55.73 54.00 1p1u s ARG 203 Cb 0.19 -1.66 -0.03 0.00 0.52 0.00 0.00 34.95 33.97 1p1u s ARG 203 CO 0.26 0.37 1.08 1.63 0.02 0.00 0.00 175.30 178.67 1p1u n LYS 204 N 0.62 0.95 -0.04 3.54 5.02 -1.22 -1.53 118.16 125.50 1p1u n LYS 204 Ca -0.16 0.37 0.01 0.00 -2.02 0.00 0.00 58.31 56.51 1p1u n LYS 204 Cb 0.55 -2.31 0.02 0.00 -0.02 0.00 0.00 35.03 33.28 1p1u n LYS 204 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1p1u n PRO 205 N -1.40 1.17 -3.62 1.97 -0.04 -1.26 -4.95 135.00 126.88 1p1u n PRO 205 Ca 0.15 -0.19 -0.23 0.00 -0.04 0.00 0.00 63.50 63.18 1p1u n PRO 205 Cb 0.48 -1.23 0.07 0.00 -0.04 0.00 0.00 33.50 32.78 1p1u n PRO 205 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1p1u n ASP 207 N -3.02 2.83 -4.38 0.00 5.75 -1.26 -4.96 116.55 111.52 1p1u n ASP 207 Ca -0.05 -1.98 -0.20 0.00 -0.01 0.00 0.00 54.79 52.55 1p1u n ASP 207 Cb 0.58 -0.21 -0.10 0.00 -1.03 0.00 0.00 41.12 40.36 1p1u n ASP 207 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1p1u s THR 208 N -1.00 1.96 -0.01 2.12 -4.23 -1.26 -1.02 115.64 112.20 1p1u s THR 208 Ca 0.21 -2.25 -0.20 0.00 -1.18 0.00 0.00 61.69 58.27 1p1u s THR 208 Cb 0.11 -2.11 0.04 0.00 1.34 0.00 0.00 72.50 71.88 1p1u s THR 208 CO 0.15 -0.52 0.44 0.00 -0.54 0.00 0.00 174.62 174.15 1p1u s MET 209 N -3.55 0.84 -0.09 3.99 0.23 -0.32 -4.70 119.30 115.68 1p1u s MET 209 Ca 0.24 -0.09 -0.21 0.00 -1.03 0.00 0.00 55.69 54.60 1p1u s MET 209 Cb -0.02 0.38 -0.04 0.00 -1.53 0.00 0.00 34.83 33.62 1p1u s MET 209 CO 0.09 -0.25 0.60 0.21 -2.03 0.00 0.00 175.02 173.64 1p1u s LYS 210 N -1.51 4.39 -0.01 3.16 2.20 -1.26 -1.80 119.74 124.92 1p1u s LYS 210 Ca -0.11 0.69 0.05 0.00 -0.36 0.00 0.00 55.97 56.24 1p1u s LYS 210 Cb -0.03 -3.44 -0.01 0.00 -1.51 0.00 0.00 37.83 32.84 1p1u s LYS 210 CO 0.05 0.10 -0.17 0.14 -0.36 0.00 0.00 175.35 175.11 1p1u s VAL 211 N 0.73 1.35 0.00 4.02 -7.23 -0.86 -5.01 120.40 113.40 1p1u s VAL 211 Ca 0.32 -0.73 0.00 0.00 -1.81 0.00 0.00 61.98 59.77 1p1u s VAL 211 Cb -0.17 -1.12 0.00 0.00 0.56 0.00 0.00 36.38 35.65 1p1u s VAL 211 CO 0.15 0.38 0.00 0.61 -0.31 0.00 0.00 175.10 175.93 1p1u n GLY 212 N 2.68 -2.04 3.93 2.32 0.00 -1.23 -4.33 105.19 106.51 1p1u n GLY 212 Ca -0.15 -1.40 -0.26 0.00 0.00 0.00 0.00 46.02 44.21 1p1u n GLY 212 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1p1u s GLY 213 N -1.35 1.62 0.67 -0.02 0.00 -1.26 -4.98 107.32 102.00 1p1u s GLY 213 Ca 0.00 -0.82 -0.12 0.00 0.00 0.00 0.00 44.72 43.78 1p1u s GLY 213 CO 0.00 -0.54 1.06 -1.31 0.00 0.00 0.00 173.10 172.31 1p1u s ASN 214 N -4.32 5.50 0.35 1.64 0.01 -1.26 -4.81 114.94 112.04 1p1u s ASN 214 Ca 0.54 1.66 0.23 0.00 -0.71 0.00 0.00 52.86 54.58 1p1u s ASN 214 Cb -0.10 -2.50 0.32 0.00 0.41 0.00 0.00 41.25 39.38 1p1u s ASN 214 CO 0.44 -1.36 1.50 -0.07 -1.51 0.00 0.00 177.10 176.09 1p1u h LEU 215 N -0.44 0.00 -8.25 0.60 4.07 -0.71 -3.48 115.31 107.10 1p1u h LEU 215 Ca -0.44 -0.01 -0.10 0.00 0.08 0.00 0.00 57.88 57.41 1p1u h LEU 215 Cb 1.21 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 42.88 1p1u h LEU 215 CO 0.57 0.00 -0.03 1.51 -1.08 0.00 0.00 178.44 179.41 1p1u s ASP 216 N -5.76 0.18 -0.06 -0.43 -4.77 -1.26 -4.92 116.67 99.65 1p1u s ASP 216 Ca 0.06 -1.09 0.01 0.00 -3.30 0.00 0.00 52.55 48.23 1p1u s ASP 216 Cb 0.07 0.67 0.02 0.00 -1.09 0.00 0.00 42.92 42.59 1p1u s ASP 216 CO 0.69 -1.30 -0.07 -0.44 0.70 0.00 0.00 175.17 174.75 1p1u s SER 217 N -3.08 1.44 0.18 2.11 0.01 -1.26 -4.10 113.70 109.00 1p1u s SER 217 Ca 0.22 -0.20 -0.06 0.00 1.31 0.00 0.00 55.95 57.22 1p1u s SER 217 Cb -0.02 -0.62 0.02 0.00 0.21 0.00 0.00 66.02 65.62 1p1u s SER 217 CO 0.12 -0.05 0.35 2.29 0.41 0.00 0.00 173.24 176.36 1p1u n LYS 218 N 4.22 0.50 -3.70 12.44 2.85 -0.41 -5.01 118.16 129.05 1p1u n LYS 218 Ca -0.21 -1.11 -0.11 0.00 -1.05 0.00 0.00 58.31 55.83 1p1u n LYS 218 Cb 0.51 1.31 -0.06 0.00 -0.65 0.00 0.00 35.03 36.14 1p1u n LYS 218 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 1p1u s GLY 219 N -1.99 -0.19 0.23 2.58 0.00 -1.26 -1.33 107.32 105.36 1p1u s GLY 219 Ca 0.09 0.03 -0.16 0.00 0.00 0.00 0.00 44.72 44.67 1p1u s GLY 219 CO 0.06 -0.21 0.67 -0.19 0.00 0.00 0.00 173.10 173.43 1p1u s TYR 220 N -3.01 3.55 0.04 1.90 2.02 -0.59 -1.20 117.35 120.06 1p1u s TYR 220 Ca -0.02 1.22 -0.02 0.00 -0.37 0.00 0.00 57.07 57.89 1p1u s TYR 220 Cb 0.01 -2.51 -0.03 0.00 -0.40 0.00 0.00 41.96 39.03 1p1u s TYR 220 CO -0.06 0.29 -0.01 0.20 -1.57 0.00 0.00 175.55 174.40 1p1u s GLY 221 N -1.88 0.35 -0.00 0.71 0.00 -0.63 -1.22 107.32 104.65 1p1u s GLY 221 Ca 0.45 -0.92 -0.27 0.00 0.00 0.00 0.00 44.72 43.98 1p1u s GLY 221 CO 0.20 -1.02 0.85 -0.42 0.00 0.00 0.00 173.10 172.71 1p1u s ILE 222 N -3.01 4.87 0.09 0.90 1.01 -1.26 -4.61 121.20 119.19 1p1u s ILE 222 Ca -0.02 1.78 0.06 0.00 0.00 0.00 0.00 60.65 62.48 1p1u s ILE 222 Cb 0.01 -4.19 -0.04 0.00 0.01 0.00 0.00 42.46 38.25 1p1u s ILE 222 CO -0.07 0.24 -0.08 0.00 0.00 0.00 0.00 174.94 175.04 1p1u s ALA 223 N 0.66 3.03 0.05 9.38 0.00 -0.95 -1.07 121.76 132.85 1p1u s ALA 223 Ca 0.44 -1.19 -0.03 0.00 0.00 0.00 0.00 51.96 51.18 1p1u s ALA 223 Cb -0.20 -0.98 -0.03 0.00 0.00 0.00 0.00 23.12 21.91 1p1u s ALA 223 CO 0.24 0.65 0.03 0.95 0.00 0.00 0.00 175.76 177.63 1p1u s THR 224 N -1.21 0.18 0.75 0.00 -4.23 -0.01 -0.98 115.64 110.14 1p1u s THR 224 Ca 0.22 -1.50 -0.14 0.00 -1.18 0.00 0.00 61.69 59.09 1p1u s THR 224 Cb -0.11 -1.28 0.05 0.00 1.34 0.00 0.00 72.50 72.50 1p1u s THR 224 CO 0.14 -0.83 1.20 -2.16 -0.54 0.00 0.00 174.62 172.43 1p1u s PRO 225 N -3.48 2.03 0.23 3.99 0.04 -1.26 -0.82 135.00 135.72 1p1u s PRO 225 Ca 0.03 1.72 -0.32 0.00 0.04 0.00 0.00 61.00 62.47 1p1u s PRO 225 Cb 0.04 -1.82 -0.13 0.00 0.04 0.00 0.00 34.50 32.63 1p1u s PRO 225 CO -0.09 -1.91 1.54 1.17 0.04 0.00 0.00 177.00 177.75 1p1u n LYS 226 N -2.90 2.31 -1.05 4.56 3.00 -1.26 -1.53 118.16 121.29 1p1u n LYS 226 Ca 0.13 0.83 -0.02 0.00 -0.00 0.00 0.00 58.31 59.25 1p1u n LYS 226 Cb 0.50 -2.57 -0.01 0.00 0.00 0.00 0.00 35.03 32.96 1p1u n LYS 226 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1p1u n GLY 227 N 2.71 0.44 3.75 3.14 0.00 -1.26 -4.98 105.19 109.00 1p1u n GLY 227 Ca 0.13 -0.13 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1p1u n GLY 227 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1p1u s SER 228 N -2.18 6.69 0.51 1.61 0.15 -0.58 -4.90 113.70 114.99 1p1u s SER 228 Ca 0.00 2.68 0.27 0.00 0.70 0.00 0.00 55.95 59.60 1p1u s SER 228 Cb 0.00 -2.63 1.38 0.00 -1.71 0.00 0.00 66.02 63.06 1p1u s SER 228 CO 0.00 -0.65 2.04 0.77 1.20 0.00 0.00 173.24 176.60 1p1u h SER 229 N 4.43 0.00 0.98 5.45 4.64 -1.93 -2.55 113.55 124.57 1p1u h SER 229 Ca -0.47 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.76 1p1u h SER 229 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 1p1u h SER 229 CO 0.73 0.13 -0.41 -0.07 -0.87 0.00 0.00 176.83 176.34 1p1u h LEU 230 N 0.00 0.00 -0.58 5.97 3.38 -1.96 -3.36 115.31 118.77 1p1u h LEU 230 Ca -0.00 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.06 1p1u h LEU 230 Cb 0.38 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.02 1p1u h LEU 230 CO 0.02 0.41 -0.40 1.23 0.09 0.00 0.00 178.44 179.79 1p1u h GLY 231 N 2.37 -0.34 0.46 0.83 0.00 -1.81 -1.84 103.07 102.74 1p1u h GLY 231 Ca -0.00 0.52 0.03 0.00 0.00 0.00 0.00 47.33 47.88 1p1u h GLY 231 CO 0.05 -0.18 -0.22 -0.57 0.00 0.00 0.00 176.54 175.62 1p1u h ASN 232 N -0.21 -0.66 -0.53 0.19 -1.24 -1.78 -1.69 115.58 109.67 1p1u h ASN 232 Ca 0.20 0.09 0.01 0.00 0.71 0.00 0.00 56.30 57.31 1p1u h ASN 232 Cb 0.56 0.28 -0.03 0.00 0.73 0.00 0.00 38.32 39.86 1p1u h ASN 232 CO -0.68 -0.29 0.34 0.00 -1.29 0.00 0.00 177.43 175.51 1p1u h ALA 233 N 0.54 0.67 -0.88 1.57 0.00 -1.74 -1.66 119.26 117.77 1p1u h ALA 233 Ca 0.07 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1p1u h ALA 233 Cb 0.43 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1p1u h ALA 233 CO -0.22 0.08 0.51 0.28 0.00 0.00 0.00 179.25 179.91 1p1u h VAL 234 N 0.69 1.25 -0.19 0.00 2.07 -1.15 0.12 116.25 119.04 1p1u h VAL 234 Ca 0.20 -0.56 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 1p1u h VAL 234 Cb -0.05 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 29.74 1p1u h VAL 234 CO -0.06 0.27 0.06 -1.13 0.02 0.00 0.00 177.57 176.73 1p1u h ASN 235 N 1.22 0.27 -0.30 0.57 -1.24 -0.94 -1.59 115.58 113.56 1p1u h ASN 235 Ca 0.31 -0.20 -0.04 0.00 0.71 0.00 0.00 56.30 57.09 1p1u h ASN 235 Cb -0.02 -0.07 -0.02 0.00 0.73 0.00 0.00 38.32 38.94 1p1u h ASN 235 CO -0.06 0.39 0.08 -0.07 -1.29 0.00 0.00 177.43 176.49 1p1u h LEU 236 N 0.13 0.53 -0.64 0.34 3.38 -0.94 -2.38 115.31 115.73 1p1u h LEU 236 Ca 0.06 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1p1u h LEU 236 Cb 0.22 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1p1u h LEU 236 CO -0.00 0.54 0.22 0.00 0.09 0.00 0.00 178.44 179.28 1p1u h ALA 237 N 1.53 0.84 -0.17 1.53 0.00 -0.37 -1.07 119.26 121.56 1p1u h ALA 237 Ca 0.13 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1p1u h ALA 237 Cb 0.24 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1p1u h ALA 237 CO -0.00 0.50 0.08 0.28 0.00 0.00 0.00 179.25 180.11 1p1u h VAL 238 N 0.92 1.13 -0.51 0.00 2.07 -0.87 0.11 116.25 119.11 1p1u h VAL 238 Ca 0.21 -0.39 0.04 0.00 0.82 0.00 0.00 66.70 67.38 1p1u h VAL 238 Cb 0.27 1.09 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 1p1u h VAL 238 CO -0.01 0.13 0.27 -0.07 0.02 0.00 0.00 177.57 177.91 1p1u h LEU 239 N 0.13 0.41 -0.21 2.57 3.38 -1.26 -0.48 115.31 119.85 1p1u h LEU 239 Ca 0.06 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1p1u h LEU 239 Cb 0.13 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1p1u h LEU 239 CO -0.01 0.28 0.10 0.50 0.09 0.00 0.00 178.44 179.41 1p1u h LYS 240 N 0.53 0.30 -0.75 1.13 3.64 -0.93 0.25 116.57 120.75 1p1u h LYS 240 Ca 0.22 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.58 1p1u h LYS 240 Cb 0.10 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.82 1p1u h LYS 240 CO -0.14 0.32 0.49 -0.07 -2.27 0.00 0.00 179.45 177.79 1p1u h LEU 241 N 0.20 0.81 -0.04 5.20 3.38 -0.43 -1.17 115.31 123.27 1p1u h LEU 241 Ca 0.07 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1p1u h LEU 241 Cb 0.12 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1p1u h LEU 241 CO -0.01 0.57 -0.04 -1.13 0.09 0.00 0.00 178.44 177.92 1p1u h ASN 242 N 0.95 0.11 0.01 -0.43 -1.24 -0.67 -1.50 115.58 112.81 1p1u h ASN 242 Ca 0.29 -0.47 -0.00 0.00 0.71 0.00 0.00 56.30 56.82 1p1u h ASN 242 Cb -0.02 -0.03 -0.00 0.00 0.73 0.00 0.00 38.32 39.00 1p1u h ASN 242 CO -0.08 0.56 -0.01 -0.33 -1.29 0.00 0.00 177.43 176.29 1p1u h GLU 243 N -0.34 0.00 -0.08 6.67 5.08 -0.52 -0.23 114.58 125.16 1p1u h GLU 243 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1p1u h GLU 243 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1p1u h GLU 243 CO 0.01 0.01 0.00 1.04 -1.00 0.00 0.00 179.01 179.07 1p1u n GLN 244 N -4.42 1.37 -0.94 2.33 6.02 -0.48 -4.88 117.38 116.38 1p1u n GLN 244 Ca -0.03 -0.55 0.00 0.00 -0.01 0.00 0.00 57.00 56.41 1p1u n GLN 244 Cb 0.09 -1.35 0.00 0.00 1.02 0.00 0.00 30.24 30.00 1p1u n GLN 244 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1p1u n GLY 245 N 0.97 0.60 0.28 1.08 0.00 -0.10 -4.90 105.19 103.12 1p1u n GLY 245 Ca 0.15 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.12 1p1u n GLY 245 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1p1u h LEU 246 N 0.00 0.78 -0.63 0.99 5.85 -1.46 -2.15 115.31 118.69 1p1u h LEU 246 Ca 0.00 -0.21 -0.10 0.00 0.84 0.00 0.00 57.88 58.41 1p1u h LEU 246 Cb 0.10 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1p1u h LEU 246 CO 0.00 0.88 -0.05 -0.07 -0.34 0.00 0.00 178.44 178.85 1p1u h LEU 247 N 0.74 1.01 -0.70 2.25 3.38 -1.80 -0.85 115.31 119.33 1p1u h LEU 247 Ca 0.13 -0.30 -0.09 0.00 0.09 0.00 0.00 57.88 57.71 1p1u h LEU 247 Cb 0.52 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1p1u h LEU 247 CO 0.03 1.09 0.05 0.44 0.09 0.00 0.00 178.44 180.14 1p1u h ASP 248 N 0.92 1.02 -0.73 -0.43 3.32 -1.85 -1.97 116.42 116.70 1p1u h ASP 248 Ca 0.16 -0.26 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 1p1u h ASP 248 Cb 0.60 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 1p1u h ASP 248 CO 0.04 1.04 0.34 0.11 -1.72 0.00 0.00 179.24 179.04 1p1u h LYS 249 N 0.98 1.06 -0.62 3.56 6.56 -1.09 -1.78 116.57 125.24 1p1u h LYS 249 Ca 0.18 -0.16 -0.02 0.00 -1.06 0.00 0.00 60.65 59.59 1p1u h LYS 249 Cb 0.49 -0.19 -0.03 0.00 -0.57 0.00 0.00 32.23 31.93 1p1u h LYS 249 CO 0.02 0.84 0.30 -0.07 -2.06 0.00 0.00 179.45 178.48 1p1u h LEU 250 N 1.03 0.81 -0.44 2.94 3.38 -0.80 -0.06 115.31 122.17 1p1u h LEU 250 Ca 0.25 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1p1u h LEU 250 Cb 0.14 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1p1u h LEU 250 CO -0.03 0.72 0.17 0.50 0.09 0.00 0.00 178.44 179.88 1p1u h LYS 251 N 0.85 0.66 -0.74 1.13 1.63 -1.17 -2.11 116.57 116.83 1p1u h LYS 251 Ca 0.21 -0.12 -0.02 0.00 -0.85 0.00 0.00 60.65 59.87 1p1u h LYS 251 Cb 0.12 -0.10 -0.04 0.00 -0.60 0.00 0.00 32.23 31.61 1p1u h LYS 251 CO -0.03 0.61 0.37 -0.91 -3.45 0.00 0.00 179.45 176.05 1p1u h ASN 252 N 0.56 0.94 0.11 4.20 2.35 -0.96 0.30 115.58 123.09 1p1u h ASN 252 Ca 0.14 -0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 1p1u h ASN 252 Cb 0.21 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.34 1p1u h ASN 252 CO -0.01 0.79 -0.05 0.50 -1.65 0.00 0.00 177.43 177.01 1p1u h LYS 253 N 1.05 -0.14 0.00 0.81 3.64 -0.67 0.71 116.57 121.96 1p1u h LYS 253 Ca 0.26 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.65 1p1u h LYS 253 Cb 0.08 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1p1u h LYS 253 CO -0.04 -0.06 -0.44 -1.49 -2.27 0.00 0.00 179.45 175.16 1p1u h TRP 254 N -0.18 0.00 0.00 1.91 4.06 -1.13 -3.29 115.95 117.32 1p1u h TRP 254 Ca -0.01 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 60.87 1p1u h TRP 254 Cb 0.14 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.29 1p1u h TRP 254 CO -0.06 0.00 -0.84 0.91 -3.56 0.00 0.00 178.44 174.89 1p1u n TRP 255 N -2.36 0.00 -0.06 0.49 8.01 0.10 -4.81 117.44 118.82 1p1u n TRP 255 Ca 0.03 0.00 -0.09 0.00 -1.31 0.00 0.00 57.50 56.13 1p1u n TRP 255 Cb 0.46 -0.32 -0.15 0.00 -2.01 0.00 0.00 31.31 29.30 1p1u n TRP 255 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 1p1u n TYR 256 N -3.88 0.54 0.05 -5.99 4.01 -0.65 -3.31 117.16 107.91 1p1u n TYR 256 Ca -0.12 0.19 -0.14 0.00 -0.16 0.00 0.00 57.90 57.67 1p1u n TYR 256 Cb 0.37 -1.10 -0.04 0.00 -0.31 0.00 0.00 39.34 38.27 1p1u n TYR 256 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1p1u h ASP 257 N 0.00 0.63 -0.01 7.72 3.32 0.22 -3.20 116.42 125.11 1p1u h ASP 257 Ca -0.41 -0.47 0.00 0.00 0.02 0.00 0.00 57.03 56.17 1p1u h ASP 257 Cb 2.12 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 41.48 1p1u h ASP 257 CO 0.06 1.25 -0.01 2.29 -1.72 0.00 0.00 179.24 181.10 1p1u n LYS 258 N -3.81 1.72 -1.52 3.56 0.00 -1.24 -4.89 118.16 111.97 1p1u n LYS 258 Ca -0.07 -1.07 -0.38 0.00 -0.00 0.00 0.00 58.31 56.79 1p1u n LYS 258 Cb 0.79 -1.48 -0.10 0.00 -0.00 0.00 0.00 35.03 34.25 1p1u n LYS 258 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1p1u n GLY 259 N 1.21 -0.18 1.35 2.58 0.00 -1.21 -4.76 105.19 104.17 1p1u n GLY 259 Ca 0.18 0.89 0.00 0.00 0.00 0.00 0.00 46.02 47.09 1p1u n GLY 259 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1p1u n GLU 260 N 8.68 0.65 0.00 1.61 0.28 -0.21 -4.91 120.64 126.73 1p1u n GLU 260 Ca 0.53 0.00 0.01 0.00 -0.16 0.00 0.00 57.16 57.54 1p1u n GLU 260 Cb 0.28 -1.18 0.01 0.00 1.43 0.00 0.00 31.44 31.98 1p1u n GLU 260 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97