#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p1n s THR 5 N 0.00 3.20 -0.04 0.00 2.01 -1.26 -4.75 115.64 114.80 1p1n s THR 5 Ca 0.00 0.79 -0.30 0.00 0.31 0.00 0.00 61.69 62.50 1p1n s THR 5 Cb 0.00 -3.51 -0.03 0.00 0.01 0.00 0.00 72.50 68.97 1p1n s THR 5 CO 0.00 0.04 1.19 -0.69 -0.69 0.00 0.00 174.62 174.47 1p1n s VAL 6 N 1.58 4.26 -0.42 3.82 1.01 0.13 -4.88 120.40 125.90 1p1n s VAL 6 Ca 0.67 1.59 -0.24 0.00 0.00 0.00 0.00 61.98 64.00 1p1n s VAL 6 Cb -0.38 -4.02 0.02 0.00 0.00 0.00 0.00 36.38 32.00 1p1n s VAL 6 CO 0.30 0.01 0.83 -0.69 0.00 0.00 0.00 175.10 175.56 1p1n s VAL 7 N 2.06 4.62 -0.22 2.92 1.01 -1.26 -1.20 120.40 128.33 1p1n s VAL 7 Ca 0.56 0.73 -0.11 0.00 0.00 0.00 0.00 61.98 63.16 1p1n s VAL 7 Cb -0.25 -4.32 -0.05 0.00 0.00 0.00 0.00 36.38 31.77 1p1n s VAL 7 CO 0.23 -0.64 0.18 -0.69 0.00 0.00 0.00 175.10 174.17 1p1n s VAL 8 N 3.37 5.36 -0.12 2.92 1.01 -0.51 -0.70 120.40 131.72 1p1n s VAL 8 Ca 0.33 0.24 -0.06 0.00 0.00 0.00 0.00 61.98 62.49 1p1n s VAL 8 Cb -0.12 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 1p1n s VAL 8 CO 0.21 0.37 0.09 0.28 0.00 0.00 0.00 175.10 176.05 1p1n s THR 9 N 0.86 5.03 0.14 3.92 -1.32 0.46 -0.75 115.64 123.98 1p1n s THR 9 Ca 0.09 0.03 0.00 0.00 -1.21 0.00 0.00 61.69 60.61 1p1n s THR 9 Cb -0.13 -3.19 -0.00 0.00 -1.51 0.00 0.00 72.50 67.67 1p1n s THR 9 CO 0.03 0.58 0.17 1.07 -2.21 0.00 0.00 174.62 174.26 1p1n n THR 10 N 2.38 0.00 -3.92 5.08 5.66 -0.15 -2.48 114.28 120.84 1p1n n THR 10 Ca -0.19 -0.79 -0.10 0.00 -3.05 0.00 0.00 64.05 59.92 1p1n n THR 10 Cb 0.54 0.45 -0.11 0.00 -1.55 0.00 0.00 70.33 69.66 1p1n n THR 10 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 1p1n s ILE 11 N -2.57 0.08 -0.62 1.09 2.07 -1.26 -0.75 121.20 119.24 1p1n s ILE 11 Ca 0.13 -0.69 -0.28 0.00 -1.41 0.00 0.00 60.65 58.40 1p1n s ILE 11 Cb -0.00 -0.29 0.02 0.00 0.13 0.00 0.00 42.46 42.32 1p1n s ILE 11 CO 0.09 -0.38 1.37 -0.76 -1.91 0.00 0.00 174.94 173.35 1p1n s LEU 12 N -1.20 3.33 -0.15 8.50 1.43 -1.26 -4.33 118.68 125.00 1p1n s LEU 12 Ca -0.13 0.03 -0.05 0.00 -1.03 0.00 0.00 54.13 52.95 1p1n s LEU 12 Cb -0.08 -2.88 0.07 0.00 0.03 0.00 0.00 46.19 43.33 1p1n s LEU 12 CO 0.00 -1.76 0.28 -0.70 0.23 0.00 0.00 176.35 174.40 1p1n s GLU 13 N 5.60 0.18 0.27 1.70 2.56 -0.91 -4.99 118.70 123.11 1p1n s GLU 13 Ca 0.46 0.74 -0.29 0.00 0.00 0.00 0.00 54.97 55.88 1p1n s GLU 13 Cb -0.09 -0.09 -0.09 0.00 2.00 0.00 0.00 34.13 35.85 1p1n s GLU 13 CO 0.22 -0.32 1.04 -1.12 -0.56 0.00 0.00 175.26 174.52 1p1n s SER 14 N 2.44 7.36 -0.37 -1.70 0.01 -1.26 -0.54 113.70 119.64 1p1n s SER 14 Ca 0.02 2.14 0.07 0.00 1.31 0.00 0.00 55.95 59.50 1p1n s SER 14 Cb -0.12 -2.62 0.68 0.00 0.21 0.00 0.00 66.02 64.17 1p1n s SER 14 CO -0.10 -0.06 1.81 -0.81 0.41 0.00 0.00 173.24 174.49 1p1n n PRO 15 N 1.20 2.83 0.01 12.44 -0.04 -1.26 -4.94 135.00 145.24 1p1n n PRO 15 Ca -0.01 -3.06 -0.12 0.00 -0.04 0.00 0.00 63.50 60.27 1p1n n PRO 15 Cb 0.46 -2.15 -0.09 0.00 -0.04 0.00 0.00 33.50 31.68 1p1n n PRO 15 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1p1n h TYR 16 N 1.70 -0.10 -3.23 0.54 0.05 -1.15 -0.14 116.97 114.64 1p1n h TYR 16 Ca 0.42 -0.00 -0.29 0.00 0.05 0.00 0.00 58.73 58.91 1p1n h TYR 16 Cb 2.48 0.03 -0.35 0.00 1.01 0.00 0.00 36.73 39.90 1p1n h TYR 16 CO 1.38 0.43 -0.66 0.08 -1.05 0.00 0.00 178.16 178.34 1p1n s VAL 17 N -3.56 -0.15 0.03 -2.88 1.01 -0.49 -0.66 120.40 113.71 1p1n s VAL 17 Ca -0.15 0.30 0.01 0.00 0.00 0.00 0.00 61.98 62.14 1p1n s VAL 17 Cb 0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 36.38 36.13 1p1n s VAL 17 CO 0.58 0.13 -0.05 -0.04 0.00 0.00 0.00 175.10 175.71 1p1n s MET 18 N 1.81 0.44 0.10 2.72 -1.94 0.47 -2.15 119.30 120.74 1p1n s MET 18 Ca -0.02 -0.75 -0.30 0.00 -1.71 0.00 0.00 55.69 52.91 1p1n s MET 18 Cb -0.12 -0.03 -0.06 0.00 2.01 0.00 0.00 34.83 36.63 1p1n s MET 18 CO -0.05 -0.02 1.04 -1.64 -0.01 0.00 0.00 175.02 174.34 1p1n s MET 19 N -1.84 4.61 0.50 2.03 -1.94 -1.26 -1.41 119.30 119.99 1p1n s MET 19 Ca -0.10 1.57 -0.22 0.00 -1.71 0.00 0.00 55.69 55.22 1p1n s MET 19 Cb -0.08 -3.36 -0.06 0.00 2.01 0.00 0.00 34.83 33.34 1p1n s MET 19 CO -0.02 0.07 1.22 0.15 -0.01 0.00 0.00 175.02 176.43 1p1n s LYS 20 N 0.21 3.48 0.34 2.03 1.02 -0.34 -4.88 119.74 121.60 1p1n s LYS 20 Ca 0.50 1.91 0.12 0.00 0.02 0.00 0.00 55.97 58.51 1p1n s LYS 20 Cb -0.25 -2.29 0.93 0.00 -0.52 0.00 0.00 37.83 35.69 1p1n s LYS 20 CO 0.31 -0.82 1.76 1.57 -0.92 0.00 0.00 175.35 177.25 1p1n h LYS 21 N 1.72 0.54 -0.90 1.68 5.09 -1.94 0.36 116.57 123.12 1p1n h LYS 21 Ca -0.50 -0.03 -0.48 0.00 0.09 0.00 0.00 60.65 59.72 1p1n h LYS 21 Cb 1.27 -0.12 -0.28 0.00 0.10 0.00 0.00 32.23 33.20 1p1n h LYS 21 CO 0.59 0.36 0.55 0.27 -2.09 0.00 0.00 179.45 179.12 1p1n n ASN 22 N -4.76 3.95 -0.06 7.07 6.94 -1.26 -4.68 115.26 122.46 1p1n n ASN 22 Ca 0.25 -3.66 0.11 0.00 -0.02 0.00 0.00 54.58 51.27 1p1n n ASN 22 Cb 0.74 -0.82 0.51 0.00 -2.36 0.00 0.00 39.78 37.85 1p1n n ASN 22 CO 0.00 0.00 0.00 1.12 -1.03 0.00 0.00 177.26 177.35 1p1n h HIS 23 N 1.11 0.40 0.00 -2.53 2.07 -1.19 -0.98 115.15 114.04 1p1n h HIS 23 Ca 0.57 0.01 -0.00 0.00 -2.85 0.00 0.00 60.37 58.10 1p1n h HIS 23 Cb 2.47 -0.13 -0.00 0.00 2.57 0.00 0.00 27.41 32.32 1p1n h HIS 23 CO 1.49 0.20 -0.00 0.93 -3.07 0.00 0.00 177.93 177.48 1p1n h GLU 24 N 0.39 0.00 -0.02 5.12 3.07 -1.84 -0.56 114.58 120.74 1p1n h GLU 24 Ca 0.25 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.11 1p1n h GLU 24 Cb 0.49 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.40 1p1n h GLU 24 CO -0.07 0.00 -0.21 -1.33 -1.40 0.00 0.00 179.01 176.01 1p1n n MET 25 N -3.12 1.73 -4.07 2.33 2.81 -0.37 -4.97 117.12 111.46 1p1n n MET 25 Ca -0.03 -1.39 -0.25 0.00 -1.81 0.00 0.00 57.70 54.23 1p1n n MET 25 Cb 0.08 -1.47 -0.06 0.00 -0.71 0.00 0.00 33.22 31.05 1p1n n MET 25 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1p1n s LEU 26 N -2.22 3.08 0.06 4.03 1.43 -0.22 -5.14 118.68 119.69 1p1n s LEU 26 Ca 0.25 -1.08 -0.01 0.00 -1.03 0.00 0.00 54.13 52.26 1p1n s LEU 26 Cb 0.19 -1.46 -0.04 0.00 0.03 0.00 0.00 46.19 44.92 1p1n s LEU 26 CO 0.43 -0.61 -0.04 -1.61 0.23 0.00 0.00 176.35 174.75 1p1n s GLU 27 N -3.96 0.63 3.66 1.70 2.02 -1.26 -4.85 118.70 116.64 1p1n s GLU 27 Ca 0.40 -1.21 0.00 0.00 0.02 0.00 0.00 54.97 54.18 1p1n s GLU 27 Cb 0.03 0.15 0.00 0.00 0.10 0.00 0.00 34.13 34.40 1p1n s GLU 27 CO 0.22 -0.09 0.00 0.41 0.02 0.00 0.00 175.26 175.82 1p1n n GLY 28 N 0.14 0.76 0.31 -1.39 0.00 -1.26 -3.15 105.19 100.60 1p1n n GLY 28 Ca -0.14 -0.72 0.18 0.00 0.00 0.00 0.00 46.02 45.33 1p1n n GLY 28 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1p1n h ASN 29 N 7.29 0.00 0.35 1.61 2.35 -1.92 -2.61 115.58 122.64 1p1n h ASN 29 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1p1n h ASN 29 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1p1n h ASN 29 CO 0.00 0.02 0.00 -0.62 -1.65 0.00 0.00 177.43 175.18 1p1n n GLU 30 N -3.50 0.06 0.24 0.81 4.71 -1.19 -2.35 120.64 119.42 1p1n n GLU 30 Ca -0.03 0.40 0.13 0.00 -0.01 0.00 0.00 57.16 57.65 1p1n n GLU 30 Cb 0.11 -1.63 0.46 0.00 -1.01 0.00 0.00 31.44 29.37 1p1n n GLU 30 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1p1n h ARG 31 N 0.00 0.00 -6.21 3.49 3.08 -1.61 -3.46 114.38 109.67 1p1n h ARG 31 Ca 0.00 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.51 1p1n h ARG 31 Cb 0.17 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.15 1p1n h ARG 31 CO 0.00 0.09 -0.59 0.71 -1.07 0.00 0.00 179.97 179.11 1p1n s TYR 32 N -3.51 2.90 0.08 3.04 2.02 -0.99 -1.20 117.35 119.69 1p1n s TYR 32 Ca 0.03 -0.16 -0.12 0.00 -0.37 0.00 0.00 57.07 56.44 1p1n s TYR 32 Cb 0.08 -1.31 0.02 0.00 -0.40 0.00 0.00 41.96 40.35 1p1n s TYR 32 CO 0.61 0.57 0.28 -1.83 -1.57 0.00 0.00 175.55 173.61 1p1n s GLU 33 N -3.67 0.88 0.00 -0.62 -1.05 -0.50 -4.83 118.70 108.92 1p1n s GLU 33 Ca 0.32 -0.73 0.00 0.00 -0.15 0.00 0.00 54.97 54.41 1p1n s GLU 33 Cb -0.07 0.37 0.00 0.00 -0.44 0.00 0.00 34.13 33.99 1p1n s GLU 33 CO 0.22 -0.30 0.00 0.41 0.95 0.00 0.00 175.26 176.54 1p1n n GLY 34 N 0.15 2.11 0.12 -3.83 0.00 -1.26 -0.40 105.19 102.08 1p1n n GLY 34 Ca -0.17 -1.87 -0.08 0.00 0.00 0.00 0.00 46.02 43.91 1p1n n GLY 34 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1p1n h TYR 35 N 0.00 0.02 0.00 1.61 5.03 -0.48 -1.74 116.97 121.41 1p1n h TYR 35 Ca 0.00 0.02 -0.06 0.00 2.58 0.00 0.00 58.73 61.27 1p1n h TYR 35 Cb 0.00 0.03 -0.01 0.00 1.55 0.00 0.00 36.73 38.30 1p1n h TYR 35 CO 0.00 -0.02 -0.28 0.00 -1.32 0.00 0.00 178.16 176.54 1p1n h VAL 37 N 0.00 1.30 -0.42 0.00 2.07 -1.41 0.26 116.25 118.05 1p1n h VAL 37 Ca -0.00 -1.19 -0.06 0.00 0.82 0.00 0.00 66.70 66.26 1p1n h VAL 37 Cb 0.80 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 32.13 1p1n h VAL 37 CO 0.04 0.37 0.01 0.44 0.02 0.00 0.00 177.57 178.45 1p1n h ASP 38 N 0.22 0.71 -0.75 0.57 3.45 -1.12 -2.61 116.42 116.89 1p1n h ASP 38 Ca 0.05 -0.30 -0.00 0.00 0.43 0.00 0.00 57.03 57.21 1p1n h ASP 38 Cb 0.62 -0.19 -0.04 0.00 -0.56 0.00 0.00 39.33 39.16 1p1n h ASP 38 CO 0.04 0.84 0.46 0.25 -1.57 0.00 0.00 179.24 179.25 1p1n h LEU 39 N 0.56 0.90 -0.80 1.55 5.85 -0.89 -1.61 115.31 120.88 1p1n h LEU 39 Ca 0.12 -0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.81 1p1n h LEU 39 Cb 0.47 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.22 1p1n h LEU 39 CO 0.02 0.70 0.51 0.00 -0.34 0.00 0.00 178.44 179.33 1p1n h ALA 40 N 1.24 1.04 -0.33 1.25 0.00 -0.81 0.12 119.26 121.77 1p1n h ALA 40 Ca 0.27 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1p1n h ALA 40 Cb -0.04 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 1p1n h ALA 40 CO -0.05 0.33 0.20 0.00 0.00 0.00 0.00 179.25 179.73 1p1n h ALA 41 N 1.33 0.43 -0.52 0.00 0.00 -1.03 -0.66 119.26 118.81 1p1n h ALA 41 Ca 0.32 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 1p1n h ALA 41 Cb -0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1p1n h ALA 41 CO -0.11 -0.07 0.19 0.93 0.00 0.00 0.00 179.25 180.18 1p1n h GLU 42 N 0.43 0.79 -0.22 0.00 4.39 -0.71 -0.63 114.58 118.63 1p1n h GLU 42 Ca 0.12 -0.16 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 1p1n h GLU 42 Cb 0.01 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.53 1p1n h GLU 42 CO -0.02 0.72 0.08 0.82 -1.16 0.00 0.00 179.01 179.44 1p1n h ILE 43 N 0.71 1.18 -0.78 3.13 1.08 -0.58 -0.55 117.51 121.69 1p1n h ILE 43 Ca 0.17 -0.56 -0.02 0.00 -0.39 0.00 0.00 64.86 64.05 1p1n h ILE 43 Cb 0.24 1.14 -0.04 0.00 -3.07 0.00 0.00 36.82 35.09 1p1n h ILE 43 CO -0.01 0.18 0.40 0.00 -0.69 0.00 0.00 178.15 178.03 1p1n h ALA 44 N 0.91 1.01 0.16 1.87 0.00 -1.05 0.30 119.26 122.46 1p1n h ALA 44 Ca 0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1p1n h ALA 44 Cb 0.21 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1p1n h ALA 44 CO -0.00 0.55 -0.08 1.57 0.00 0.00 0.00 179.25 181.29 1p1n h LYS 45 N 1.10 -0.21 0.00 0.00 5.09 -0.91 0.72 116.57 122.37 1p1n h LYS 45 Ca 0.27 0.01 0.00 0.00 0.09 0.00 0.00 60.65 61.03 1p1n h LYS 45 Cb 0.08 0.05 0.00 0.00 0.10 0.00 0.00 32.23 32.46 1p1n h LYS 45 CO -0.04 -0.07 0.00 0.45 -2.09 0.00 0.00 179.45 177.70 1p1n h HIS 46 N -0.30 0.00 -0.02 0.07 -0.00 -0.92 -2.96 115.15 111.02 1p1n h HIS 46 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.35 1p1n h HIS 46 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.64 1p1n h HIS 46 CO -0.04 0.00 -0.09 0.00 -0.00 0.00 0.00 177.93 177.80 1p1n n GLY 48 N 1.12 -0.28 3.16 0.00 0.00 0.18 -5.03 105.19 104.35 1p1n n GLY 48 Ca 0.10 0.07 -0.14 0.00 0.00 0.00 0.00 46.02 46.05 1p1n n GLY 48 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1p1n s PHE 49 N -3.28 1.01 0.11 1.61 -0.12 -0.78 -5.06 117.98 111.47 1p1n s PHE 49 Ca 0.30 -0.64 -0.10 0.00 -0.05 0.00 0.00 56.93 56.44 1p1n s PHE 49 Cb -0.13 -0.56 -0.06 0.00 -0.63 0.00 0.00 43.02 41.64 1p1n s PHE 49 CO 0.61 -0.02 0.44 -1.59 -0.05 0.00 0.00 175.22 174.61 1p1n s LYS 50 N -2.65 3.80 0.12 1.99 0.00 -1.26 -4.61 119.74 117.12 1p1n s LYS 50 Ca 0.03 0.23 -0.05 0.00 0.00 0.00 0.00 55.97 56.19 1p1n s LYS 50 Cb -0.04 -2.95 -0.02 0.00 0.00 0.00 0.00 37.83 34.82 1p1n s LYS 50 CO -0.00 0.52 0.13 1.52 0.00 0.00 0.00 175.35 177.52 1p1n s TYR 51 N -1.45 0.53 -0.10 1.78 1.13 -1.26 -0.69 117.35 117.29 1p1n s TYR 51 Ca 0.35 -0.94 -0.01 0.00 -1.41 0.00 0.00 57.07 55.06 1p1n s TYR 51 Cb -0.14 -0.26 0.03 0.00 -1.10 0.00 0.00 41.96 40.48 1p1n s TYR 51 CO 0.19 -0.55 -0.05 0.15 -2.51 0.00 0.00 175.55 172.78 1p1n s LYS 52 N -3.96 1.18 0.15 -3.49 -0.14 -0.34 -4.89 119.74 108.25 1p1n s LYS 52 Ca 0.15 -0.12 -0.30 0.00 -1.36 0.00 0.00 55.97 54.34 1p1n s LYS 52 Cb 0.06 -1.34 -0.07 0.00 -1.68 0.00 0.00 37.83 34.80 1p1n s LYS 52 CO -0.04 -0.27 1.01 -0.51 -0.76 0.00 0.00 175.35 174.79 1p1n s LEU 53 N 1.76 4.51 0.03 3.17 1.43 -1.26 -1.42 118.68 126.89 1p1n s LEU 53 Ca 0.04 1.92 0.02 0.00 -1.03 0.00 0.00 54.13 55.08 1p1n s LEU 53 Cb -0.13 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.48 1p1n s LEU 53 CO -0.07 -0.10 -0.06 0.42 0.23 0.00 0.00 176.35 176.77 1p1n s THR 54 N -0.22 0.43 -0.21 5.49 -4.23 0.07 -4.85 115.64 112.12 1p1n s THR 54 Ca 0.47 -0.86 -0.15 0.00 -1.18 0.00 0.00 61.69 59.97 1p1n s THR 54 Cb -0.26 -0.48 -0.04 0.00 1.34 0.00 0.00 72.50 73.06 1p1n s THR 54 CO 0.32 -0.30 0.37 -0.63 -0.54 0.00 0.00 174.62 173.83 1p1n s ILE 55 N -1.12 5.22 -0.15 2.99 -1.09 -1.26 -0.98 121.20 124.80 1p1n s ILE 55 Ca -0.09 0.63 -0.41 0.00 -2.23 0.00 0.00 60.65 58.56 1p1n s ILE 55 Cb -0.08 -3.70 -0.18 0.00 -1.58 0.00 0.00 42.46 36.92 1p1n s ILE 55 CO 0.00 0.25 1.39 0.55 -1.23 0.00 0.00 174.94 175.90 1p1n n VAL 56 N 4.41 0.06 -0.21 2.92 3.14 0.07 -4.85 118.33 123.86 1p1n n VAL 56 Ca -0.09 -0.01 0.00 0.00 -2.96 0.00 0.00 64.34 61.28 1p1n n VAL 56 Cb 0.51 -0.55 0.08 0.00 -1.06 0.00 0.00 33.84 32.82 1p1n n VAL 56 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1p1n h GLY 57 N 4.64 0.53 -0.65 7.55 0.00 -1.93 -2.00 103.07 111.20 1p1n h GLY 57 Ca -0.48 0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.03 1p1n h GLY 57 CO 0.82 -0.24 0.00 2.09 0.00 0.00 0.00 176.54 179.21 1p1n n ASP 58 N -5.39 1.57 -1.47 0.19 3.85 -1.26 -4.94 116.55 109.10 1p1n n ASP 58 Ca 0.08 -1.62 -0.16 0.00 -0.71 0.00 0.00 54.79 52.38 1p1n n ASP 58 Cb 0.35 -0.06 -0.05 0.00 -1.35 0.00 0.00 41.12 40.01 1p1n n ASP 58 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1p1n n GLY 59 N 1.15 0.92 3.62 6.12 0.00 -0.75 -4.96 105.19 111.28 1p1n n GLY 59 Ca 0.17 -0.23 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 1p1n n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p1n s LYS 60 N -3.91 2.12 -0.13 1.61 1.02 -1.26 -5.02 119.74 114.18 1p1n s LYS 60 Ca 0.00 -1.60 -0.18 0.00 0.02 0.00 0.00 55.97 54.21 1p1n s LYS 60 Cb 0.00 -2.02 -0.16 0.00 -0.52 0.00 0.00 37.83 35.13 1p1n s LYS 60 CO 0.00 0.26 0.47 1.88 -0.92 0.00 0.00 175.35 177.04 1p1n h TYR 61 N 1.90 0.00 0.00 3.18 -1.99 -1.92 -2.14 116.97 116.00 1p1n h TYR 61 Ca -0.43 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.30 1p1n h TYR 61 Cb 1.25 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.98 1p1n h TYR 61 CO 0.71 0.63 0.00 0.41 -0.00 0.00 0.00 178.16 179.91 1p1n n GLY 62 N 1.67 2.11 3.12 3.88 0.00 -1.26 -1.54 105.19 113.17 1p1n n GLY 62 Ca -0.07 0.06 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1p1n n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p1n s ALA 63 N 0.00 -0.13 -0.21 4.61 0.00 -1.25 -4.89 121.76 119.88 1p1n s ALA 63 Ca 0.00 -0.46 -0.10 0.00 0.00 0.00 0.00 51.96 51.40 1p1n s ALA 63 Cb 0.00 0.23 -0.05 0.00 0.00 0.00 0.00 23.12 23.30 1p1n s ALA 63 CO 0.00 -0.30 0.14 0.50 0.00 0.00 0.00 175.76 176.10 1p1n s ARG 64 N -2.41 4.15 0.19 0.00 3.52 -1.26 -1.36 118.95 121.78 1p1n s ARG 64 Ca -0.07 -0.24 -0.30 0.00 -0.13 0.00 0.00 55.73 55.00 1p1n s ARG 64 Cb -0.02 -3.46 -0.08 0.00 -1.56 0.00 0.00 34.95 29.83 1p1n s ARG 64 CO -0.04 0.21 1.10 0.34 -0.81 0.00 0.00 175.30 176.11 1p1n s ASP 65 N 0.62 7.26 0.36 -2.12 -1.08 -0.63 -4.93 116.67 116.16 1p1n s ASP 65 Ca 0.08 2.11 -0.25 0.00 -0.52 0.00 0.00 52.55 53.96 1p1n s ASP 65 Cb -0.12 -2.61 -0.09 0.00 -1.46 0.00 0.00 42.92 38.64 1p1n s ASP 65 CO 0.00 -0.22 1.02 0.00 0.52 0.00 0.00 175.17 176.50 1p1n s ALA 66 N -0.31 3.15 0.00 3.66 0.00 -1.26 0.27 121.76 127.27 1p1n s ALA 66 Ca 0.49 0.65 0.00 0.00 0.00 0.00 0.00 51.96 53.10 1p1n s ALA 66 Cb -0.30 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.58 1p1n s ALA 66 CO 0.35 -0.07 0.00 -0.25 0.00 0.00 0.00 175.76 175.79 1p1n n ASP 67 N 0.23 0.00 0.04 0.00 9.92 -1.26 -4.48 116.55 120.99 1p1n n ASP 67 Ca 0.03 0.00 -0.11 0.00 -0.53 0.00 0.00 54.79 54.19 1p1n n ASP 67 Cb 0.49 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.84 1p1n n ASP 67 CO 0.00 0.00 0.00 0.71 0.13 0.00 0.00 177.20 178.04 1p1n h THR 68 N 0.00 1.27 -0.32 -3.53 1.35 -1.99 -3.47 112.91 106.23 1p1n h THR 68 Ca 0.00 -3.01 -0.14 0.00 -0.55 0.00 0.00 66.41 62.71 1p1n h THR 68 Cb 0.00 2.69 -0.05 0.00 -1.73 0.00 0.00 68.15 69.05 1p1n h THR 68 CO 0.00 0.78 -0.12 2.29 -0.25 0.00 0.00 175.52 178.21 1p1n n LYS 69 N -3.29 -1.12 -3.19 4.72 0.00 0.14 -4.98 118.16 110.44 1p1n n LYS 69 Ca -0.10 0.65 -0.39 0.00 -0.00 0.00 0.00 58.31 58.46 1p1n n LYS 69 Cb 1.01 -4.67 -0.06 0.00 -0.00 0.00 0.00 35.03 31.31 1p1n n LYS 69 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1p1n s ILE 70 N -1.92 4.89 0.02 0.58 1.01 -1.25 -4.71 121.20 119.82 1p1n s ILE 70 Ca 0.00 1.28 -0.24 0.00 0.00 0.00 0.00 60.65 61.69 1p1n s ILE 70 Cb 0.00 -3.95 -0.05 0.00 0.01 0.00 0.00 42.46 38.47 1p1n s ILE 70 CO 0.00 0.42 0.73 0.26 0.00 0.00 0.00 174.94 176.35 1p1n s TRP 71 N -0.20 3.71 0.39 3.97 0.52 -1.26 -1.60 118.94 124.46 1p1n s TRP 71 Ca 0.32 1.40 0.05 0.00 0.02 0.00 0.00 56.10 57.88 1p1n s TRP 71 Cb -0.18 -2.78 0.05 0.00 -1.15 0.00 0.00 33.47 29.40 1p1n s TRP 71 CO 0.18 0.26 0.39 0.27 0.02 0.00 0.00 176.95 178.07 1p1n n ASN 72 N 2.91 1.94 0.00 2.95 0.23 -0.46 -4.31 115.26 118.52 1p1n n ASN 72 Ca -0.03 -2.22 0.00 0.00 -0.53 0.00 0.00 54.58 51.80 1p1n n ASN 72 Cb 0.50 -0.13 0.00 0.00 -2.08 0.00 0.00 39.78 38.08 1p1n n ASN 72 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1p1n n GLY 73 N 0.27 0.66 0.36 4.83 0.00 -1.26 -1.34 105.19 108.71 1p1n n GLY 73 Ca 0.03 -0.87 -0.04 0.00 0.00 0.00 0.00 46.02 45.14 1p1n n GLY 73 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1p1n h MET 74 N 0.00 1.24 -0.50 1.61 2.86 -0.57 -1.65 114.93 117.91 1p1n h MET 74 Ca 0.00 -0.16 0.01 0.00 -2.06 0.00 0.00 59.70 57.50 1p1n h MET 74 Cb 0.00 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 31.39 1p1n h MET 74 CO 0.00 0.92 0.32 0.28 1.06 0.00 0.00 176.91 179.49 1p1n h VAL 75 N 1.24 1.09 -0.85 -2.22 2.07 -1.52 -1.93 116.25 114.13 1p1n h VAL 75 Ca 0.31 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.60 1p1n h VAL 75 Cb 0.06 0.39 -0.04 0.00 -1.52 0.00 0.00 31.29 30.18 1p1n h VAL 75 CO -0.05 0.12 0.52 1.23 0.02 0.00 0.00 177.57 179.41 1p1n h GLY 76 N 0.64 1.24 1.53 2.17 0.00 -0.70 0.81 103.07 108.76 1p1n h GLY 76 Ca 0.19 -0.51 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 1p1n h GLY 76 CO -0.06 0.50 0.18 0.83 0.00 0.00 0.00 176.54 177.99 1p1n h GLU 77 N 1.17 0.61 -0.06 4.80 5.08 -0.67 -0.16 114.58 125.35 1p1n h GLU 77 Ca 0.31 -0.08 -0.12 0.00 -1.00 0.00 0.00 59.36 58.47 1p1n h GLU 77 Cb -0.05 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.09 1p1n h GLU 77 CO -0.06 0.50 -0.44 -0.07 -1.00 0.00 0.00 179.01 177.93 1p1n h LEU 78 N 0.61 0.50 -0.85 1.33 3.38 -0.65 0.57 115.31 120.19 1p1n h LEU 78 Ca 0.15 -0.68 0.04 0.00 0.09 0.00 0.00 57.88 57.48 1p1n h LEU 78 Cb 0.11 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.66 1p1n h LEU 78 CO -0.02 1.10 0.54 0.58 0.09 0.00 0.00 178.44 180.74 1p1n h VAL 79 N -0.07 1.13 -0.36 1.22 2.07 -0.42 -2.73 116.25 117.09 1p1n h VAL 79 Ca -0.04 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.12 1p1n h VAL 79 Cb 1.11 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1p1n h VAL 79 CO 0.09 0.19 0.00 -1.22 0.02 0.00 0.00 177.57 176.65 1p1n n TYR 80 N -4.56 0.46 -1.05 1.57 4.01 -0.11 -4.95 117.16 112.53 1p1n n TYR 80 Ca 0.11 -0.23 -0.02 0.00 -0.16 0.00 0.00 57.90 57.60 1p1n n TYR 80 Cb 0.10 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.12 1p1n n TYR 80 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1p1n n GLY 81 N 1.35 0.51 0.20 2.72 0.00 -0.97 -4.94 105.19 104.07 1p1n n GLY 81 Ca 0.18 -0.90 0.10 0.00 0.00 0.00 0.00 46.02 45.40 1p1n n GLY 81 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1p1n h LYS 82 N 0.10 0.00 -4.18 1.61 1.79 -0.13 -3.46 116.57 112.30 1p1n h LYS 82 Ca -0.03 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.32 1p1n h LYS 82 Cb 0.11 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 30.61 1p1n h LYS 82 CO 0.05 0.11 -0.62 0.00 -1.08 0.00 0.00 179.45 177.90 1p1n s ALA 83 N -3.16 0.41 -0.04 3.86 0.00 -0.88 -4.99 121.76 116.96 1p1n s ALA 83 Ca 0.06 -1.13 0.22 0.00 0.00 0.00 0.00 51.96 51.11 1p1n s ALA 83 Cb 0.06 0.35 -0.33 0.00 0.00 0.00 0.00 23.12 23.19 1p1n s ALA 83 CO 0.68 -0.40 0.47 -0.25 0.00 0.00 0.00 175.76 176.26 1p1n n ASP 84 N 0.07 0.01 -3.56 0.00 8.00 0.12 -4.45 116.55 116.74 1p1n n ASP 84 Ca -0.14 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.22 1p1n n ASP 84 Cb 0.61 1.95 -0.06 0.00 -0.02 0.00 0.00 41.12 43.61 1p1n n ASP 84 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1p1n s ILE 85 N -3.48 0.00 -0.15 0.53 2.07 -1.01 -4.34 121.20 114.82 1p1n s ILE 85 Ca -0.08 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.17 1p1n s ILE 85 Cb 0.14 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.73 1p1n s ILE 85 CO 0.91 0.00 -0.18 0.00 -1.91 0.00 0.00 174.94 173.75 1p1n s ALA 86 N -0.83 2.38 -0.34 1.50 0.00 0.98 -0.40 121.76 125.05 1p1n s ALA 86 Ca -0.06 -1.06 0.01 0.00 0.00 0.00 0.00 51.96 50.85 1p1n s ALA 86 Cb -0.01 -1.11 0.10 0.00 0.00 0.00 0.00 23.12 22.10 1p1n s ALA 86 CO 0.06 -0.02 0.10 0.42 0.00 0.00 0.00 175.76 176.32 1p1n s ILE 87 N 0.79 1.43 0.23 0.00 1.01 -1.04 -1.55 121.20 122.07 1p1n s ILE 87 Ca -0.07 -1.86 -0.21 0.00 0.00 0.00 0.00 60.65 58.52 1p1n s ILE 87 Cb -0.15 -2.06 0.07 0.00 0.01 0.00 0.00 42.46 40.32 1p1n s ILE 87 CO -0.00 -0.67 0.96 0.00 0.00 0.00 0.00 174.94 175.23 1p1n s ALA 88 N 1.23 -1.40 -1.38 9.38 0.00 -1.26 -4.65 121.76 123.67 1p1n s ALA 88 Ca 0.11 -0.36 -0.10 0.00 0.00 0.00 0.00 51.96 51.61 1p1n s ALA 88 Cb -0.19 0.73 -0.06 0.00 0.00 0.00 0.00 23.12 23.60 1p1n s ALA 88 CO -0.17 -1.04 2.58 -0.35 0.00 0.00 0.00 175.76 176.78 1p1n n PRO 89 N -0.62 3.05 -3.15 0.00 -0.04 -1.26 -4.69 135.00 128.28 1p1n n PRO 89 Ca -0.05 -2.07 -0.43 0.00 -0.04 0.00 0.00 63.50 60.91 1p1n n PRO 89 Cb 0.60 -2.81 -0.07 0.00 -0.04 0.00 0.00 33.50 31.18 1p1n n PRO 89 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1p1n s LEU 90 N 0.56 4.55 0.18 1.53 2.96 -1.26 -5.02 118.68 122.18 1p1n s LEU 90 Ca 0.58 -0.37 -0.31 0.00 -0.22 0.00 0.00 54.13 53.81 1p1n s LEU 90 Cb 0.15 -2.66 -0.09 0.00 0.50 0.00 0.00 46.19 44.08 1p1n s LEU 90 CO -0.05 -0.72 1.48 -0.89 -1.32 0.00 0.00 176.35 174.85 1p1n s THR 91 N 2.67 2.81 -0.22 3.68 2.01 -1.26 -2.20 115.64 123.13 1p1n s THR 91 Ca 0.21 0.61 -0.29 0.00 0.31 0.00 0.00 61.69 62.53 1p1n s THR 91 Cb -0.15 -3.39 -0.02 0.00 0.01 0.00 0.00 72.50 68.95 1p1n s THR 91 CO 0.18 0.06 1.47 -0.63 -0.69 0.00 0.00 174.62 175.01 1p1n s ILE 92 N 0.78 3.91 0.14 1.82 1.01 -0.43 -4.89 121.20 123.53 1p1n s ILE 92 Ca 0.65 1.04 0.04 0.00 0.00 0.00 0.00 60.65 62.38 1p1n s ILE 92 Cb -0.41 -3.87 -0.04 0.00 0.01 0.00 0.00 42.46 38.15 1p1n s ILE 92 CO 0.34 -0.31 -0.10 0.42 0.00 0.00 0.00 174.94 175.30 1p1n s THR 93 N 4.61 1.08 0.10 2.92 -4.23 -1.26 -4.77 115.64 114.09 1p1n s THR 93 Ca 0.64 -2.01 -0.27 0.00 -1.18 0.00 0.00 61.69 58.88 1p1n s THR 93 Cb -0.23 -1.78 -0.11 0.00 1.34 0.00 0.00 72.50 71.72 1p1n s THR 93 CO 0.25 -0.75 1.66 0.25 -0.54 0.00 0.00 174.62 175.49 1p1n h LEU 94 N 2.87 -0.60 -1.23 4.79 5.85 -1.98 0.35 115.31 125.36 1p1n h LEU 94 Ca -0.36 0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.44 1p1n h LEU 94 Cb 1.19 0.21 -0.04 0.00 0.37 0.00 0.00 40.66 42.38 1p1n h LEU 94 CO 0.63 -0.32 0.53 -0.37 -0.34 0.00 0.00 178.44 178.57 1p1n h VAL 95 N -0.46 1.14 -0.10 1.05 -1.51 -2.00 -2.26 116.25 112.11 1p1n h VAL 95 Ca 0.01 -0.35 -0.23 0.00 -1.23 0.00 0.00 66.70 64.90 1p1n h VAL 95 Cb 0.44 0.04 0.01 0.00 -2.13 0.00 0.00 31.29 29.66 1p1n h VAL 95 CO -0.07 0.18 -0.82 0.03 -1.23 0.00 0.00 177.57 175.67 1p1n h ARG 96 N 1.01 0.73 -0.03 5.19 3.08 -1.91 -3.16 114.38 119.29 1p1n h ARG 96 Ca 0.32 -0.65 0.01 0.00 0.07 0.00 0.00 59.98 59.72 1p1n h ARG 96 Cb 0.01 0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.21 1p1n h ARG 96 CO -0.09 1.25 0.03 1.49 -1.07 0.00 0.00 179.97 181.59 1p1n h GLU 97 N 0.43 0.00 0.00 0.04 4.57 -0.54 -1.06 114.58 118.02 1p1n h GLU 97 Ca -0.07 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.07 1p1n h GLU 97 Cb 1.46 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.05 1p1n h GLU 97 CO 0.17 0.00 -0.19 0.93 -1.18 0.00 0.00 179.01 178.74 1p1n h GLU 98 N 0.00 0.00 0.00 1.92 5.08 -1.38 -3.35 114.58 116.85 1p1n h GLU 98 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1p1n h GLU 98 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1p1n h GLU 98 CO -0.00 0.19 -1.15 1.33 -1.00 0.00 0.00 179.01 178.38 1p1n n VAL 99 N -3.23 0.00 -4.19 3.13 0.24 -0.52 -5.05 118.33 108.71 1p1n n VAL 99 Ca 0.02 -0.20 -0.11 0.00 -2.04 0.00 0.00 64.34 62.00 1p1n n VAL 99 Cb 0.50 0.46 -0.10 0.00 -1.47 0.00 0.00 33.84 33.23 1p1n n VAL 99 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1p1n s ILE 100 N -2.36 0.10 -0.07 1.34 -5.25 -0.52 -4.25 121.20 110.19 1p1n s ILE 100 Ca -0.02 -1.97 -0.08 0.00 -0.99 0.00 0.00 60.65 57.60 1p1n s ILE 100 Cb 0.05 -2.33 -0.04 0.00 2.95 0.00 0.00 42.46 43.09 1p1n s ILE 100 CO 0.31 -0.19 0.20 -1.81 -1.79 0.00 0.00 174.94 171.67 1p1n s ASP 101 N -3.13 6.47 -0.02 4.36 1.01 0.35 -4.36 116.67 121.35 1p1n s ASP 101 Ca 0.33 0.55 0.06 0.00 0.71 0.00 0.00 52.55 54.19 1p1n s ASP 101 Cb 0.07 -2.09 -0.03 0.00 1.01 0.00 0.00 42.92 41.88 1p1n s ASP 101 CO 0.08 0.36 -0.19 -0.36 0.21 0.00 0.00 175.17 175.27 1p1n s PHE 102 N -1.11 2.54 0.84 4.23 0.08 -1.26 -1.38 117.98 121.92 1p1n s PHE 102 Ca 0.19 -0.28 -0.12 0.00 0.12 0.00 0.00 56.93 56.84 1p1n s PHE 102 Cb -0.13 -1.54 0.10 0.00 -0.57 0.00 0.00 43.02 40.88 1p1n s PHE 102 CO 0.09 0.13 1.18 -1.54 -0.10 0.00 0.00 175.22 174.97 1p1n s SER 103 N -0.88 4.20 0.80 1.36 1.04 0.08 -4.93 113.70 115.37 1p1n s SER 103 Ca 0.12 0.80 -0.12 0.00 0.48 0.00 0.00 55.95 57.22 1p1n s SER 103 Cb -0.10 -1.28 0.08 0.00 0.10 0.00 0.00 66.02 64.81 1p1n s SER 103 CO 0.01 -2.10 1.14 -0.54 0.98 0.00 0.00 173.24 172.73 1p1n s LYS 104 N -5.53 1.88 0.19 4.02 -0.14 -1.26 -4.48 119.74 114.41 1p1n s LYS 104 Ca 0.63 1.45 -0.33 0.00 -1.36 0.00 0.00 55.97 56.36 1p1n s LYS 104 Cb -0.11 -1.83 -0.15 0.00 -1.68 0.00 0.00 37.83 34.06 1p1n s LYS 104 CO 0.50 -1.97 1.33 -2.30 -0.76 0.00 0.00 175.35 172.15 1p1n n PRO 105 N -3.46 1.61 -0.00 -1.68 -0.02 -1.26 -4.62 135.00 125.57 1p1n n PRO 105 Ca 0.11 0.58 0.10 0.00 -2.02 0.00 0.00 63.50 62.27 1p1n n PRO 105 Cb 0.52 -2.18 -0.13 0.00 -0.02 0.00 0.00 33.50 31.69 1p1n n PRO 105 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 1p1n n PHE 106 N 1.99 0.01 -3.74 6.00 1.16 -0.38 -4.92 117.46 117.58 1p1n n PHE 106 Ca 0.14 0.00 -0.13 0.00 -1.87 0.00 0.00 57.45 55.60 1p1n n PHE 106 Cb 0.27 -0.18 -0.11 0.00 -1.61 0.00 0.00 39.48 37.86 1p1n n PHE 106 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 1p1n s MET 107 N -3.17 0.41 -0.04 3.97 0.00 -1.25 -4.96 119.30 114.25 1p1n s MET 107 Ca 0.03 0.54 -0.01 0.00 0.00 0.00 0.00 55.69 56.25 1p1n s MET 107 Cb 0.15 0.16 -0.04 0.00 0.00 0.00 0.00 34.83 35.11 1p1n s MET 107 CO 0.88 -0.07 0.05 -1.12 0.00 0.00 0.00 175.02 174.76 1p1n s SER 108 N 0.41 5.55 0.39 1.11 0.01 -1.26 -1.38 113.70 118.53 1p1n s SER 108 Ca -0.02 0.16 -0.15 0.00 1.31 0.00 0.00 55.95 57.26 1p1n s SER 108 Cb -0.04 -1.59 0.05 0.00 0.21 0.00 0.00 66.02 64.66 1p1n s SER 108 CO -0.02 0.32 0.78 -1.48 0.41 0.00 0.00 173.24 173.25 1p1n s LEU 109 N -1.38 0.08 0.16 2.44 2.34 -0.37 -4.90 118.68 117.05 1p1n s LEU 109 Ca 0.19 -1.20 -0.22 0.00 0.06 0.00 0.00 54.13 52.96 1p1n s LEU 109 Cb -0.12 2.79 0.06 0.00 -0.56 0.00 0.00 46.19 48.36 1p1n s LEU 109 CO 0.09 -1.70 0.57 -0.83 -1.06 0.00 0.00 176.35 173.42 1p1n s GLY 110 N -3.09 -0.52 0.26 -3.48 0.00 -1.26 -0.47 107.32 98.76 1p1n s GLY 110 Ca 0.17 0.34 -0.30 0.00 0.00 0.00 0.00 44.72 44.93 1p1n s GLY 110 CO 0.12 0.06 1.39 -0.42 0.00 0.00 0.00 173.10 174.26 1p1n s ILE 111 N -3.77 2.73 0.29 0.90 1.01 -1.26 -0.36 121.20 120.74 1p1n s ILE 111 Ca 0.02 0.64 0.03 0.00 0.00 0.00 0.00 60.65 61.34 1p1n s ILE 111 Cb -0.01 -3.41 -0.04 0.00 0.01 0.00 0.00 42.46 39.01 1p1n s ILE 111 CO -0.11 0.11 0.15 -0.94 0.00 0.00 0.00 174.94 174.15 1p1n s SER 112 N 0.16 1.43 -0.14 3.58 1.04 0.11 -0.31 113.70 119.57 1p1n s SER 112 Ca 0.57 -1.52 -0.00 0.00 0.48 0.00 0.00 55.95 55.47 1p1n s SER 112 Cb -0.41 0.35 -0.01 0.00 0.10 0.00 0.00 66.02 66.05 1p1n s SER 112 CO 0.45 -0.86 -0.13 -0.63 0.98 0.00 0.00 173.24 173.05 1p1n s ILE 113 N -3.65 2.94 -0.16 -1.02 1.01 -1.26 -1.67 121.20 117.39 1p1n s ILE 113 Ca 0.36 -0.69 -0.03 0.00 0.00 0.00 0.00 60.65 60.29 1p1n s ILE 113 Cb 0.05 -2.24 -0.02 0.00 0.01 0.00 0.00 42.46 40.26 1p1n s ILE 113 CO 0.17 0.51 -0.05 -0.32 0.00 0.00 0.00 174.94 175.25 1p1n s MET 114 N 0.57 3.61 0.19 2.79 -2.45 0.53 -2.01 119.30 122.54 1p1n s MET 114 Ca -0.08 -0.55 0.05 0.00 -1.25 0.00 0.00 55.69 53.87 1p1n s MET 114 Cb -0.16 -2.90 -0.05 0.00 1.25 0.00 0.00 34.83 32.98 1p1n s MET 114 CO 0.03 0.20 -0.09 0.96 1.05 0.00 0.00 175.02 177.17 1p1n s ILE 115 N 0.47 1.35 0.13 10.11 -4.36 -0.70 -1.20 121.20 127.00 1p1n s ILE 115 Ca -0.04 -2.11 -0.26 0.00 -0.26 0.00 0.00 60.65 57.98 1p1n s ILE 115 Cb -0.14 -2.05 -0.07 0.00 1.25 0.00 0.00 42.46 41.44 1p1n s ILE 115 CO 0.03 -0.58 0.80 -0.75 0.24 0.00 0.00 174.94 174.68 1p1n s LYS 116 N -3.74 4.59 0.18 0.37 2.20 -1.26 -1.26 119.74 120.82 1p1n s LYS 116 Ca 0.22 1.19 -0.32 0.00 -0.36 0.00 0.00 55.97 56.69 1p1n s LYS 116 Cb 0.02 -3.30 -0.16 0.00 -1.51 0.00 0.00 37.83 32.89 1p1n s LYS 116 CO 0.05 0.46 1.13 1.63 -0.36 0.00 0.00 175.35 178.26 1p1n n LYS 117 N 2.02 1.15 0.00 4.03 5.02 0.02 -1.93 118.16 128.47 1p1n n LYS 117 Ca -0.04 0.41 0.00 0.00 -2.02 0.00 0.00 58.31 56.66 1p1n n LYS 117 Cb 0.49 -1.88 0.00 0.00 -0.02 0.00 0.00 35.03 33.62 1p1n n LYS 117 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1p1n n GLY 118 N 1.93 1.90 3.71 0.72 0.00 -1.26 -4.97 105.19 107.21 1p1n n GLY 118 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1p1n n GLY 118 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p1n s THR 119 N -2.53 2.85 -1.18 2.61 2.01 -0.81 -4.88 115.64 113.71 1p1n s THR 119 Ca 0.00 0.51 -0.08 0.00 0.31 0.00 0.00 61.69 62.43 1p1n s THR 119 Cb 0.00 -3.33 -0.07 0.00 0.01 0.00 0.00 72.50 69.11 1p1n s THR 119 CO 0.00 0.02 2.42 -0.81 -0.69 0.00 0.00 174.62 175.56 1p1n n PRO 120 N 4.61 2.67 -3.97 4.92 -0.04 -1.26 -4.80 135.00 137.14 1p1n n PRO 120 Ca 0.14 -1.76 -0.16 0.00 -0.04 0.00 0.00 63.50 61.68 1p1n n PRO 120 Cb 0.40 -2.61 -0.16 0.00 -0.04 0.00 0.00 33.50 31.09 1p1n n PRO 120 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1p1n s ILE 121 N 3.00 0.20 0.00 0.52 -1.09 -1.26 -5.02 121.20 117.56 1p1n s ILE 121 Ca 0.51 0.01 0.00 0.00 -2.23 0.00 0.00 60.65 58.95 1p1n s ILE 121 Cb 0.13 -0.26 0.00 0.00 -1.58 0.00 0.00 42.46 40.75 1p1n s ILE 121 CO -0.04 0.12 0.00 -0.62 -1.23 0.00 0.00 174.94 173.17 1p1n n GLU 122 N 3.78 3.70 -3.92 2.79 4.71 -1.26 -4.96 120.64 125.48 1p1n n GLU 122 Ca -0.23 0.00 -0.08 0.00 -0.01 0.00 0.00 57.16 56.84 1p1n n GLU 122 Cb 0.53 -0.53 -0.04 0.00 -1.01 0.00 0.00 31.44 30.39 1p1n n GLU 122 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 1p1n s SER 123 N -0.95 -0.17 0.33 1.62 1.04 -1.26 -2.86 113.70 111.45 1p1n s SER 123 Ca 0.00 -0.76 0.05 0.00 0.48 0.00 0.00 55.95 55.72 1p1n s SER 123 Cb 0.00 0.64 0.59 0.00 0.10 0.00 0.00 66.02 67.35 1p1n s SER 123 CO 0.00 -1.21 1.84 0.00 0.98 0.00 0.00 173.24 174.85 1p1n h ALA 124 N 2.15 1.33 -0.34 5.32 0.00 -1.95 -2.20 119.26 123.57 1p1n h ALA 124 Ca -0.24 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 54.48 1p1n h ALA 124 Cb 1.25 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.87 1p1n h ALA 124 CO 0.31 0.45 0.09 1.05 0.00 0.00 0.00 179.25 181.15 1p1n h GLU 125 N 0.42 0.21 -0.68 0.00 -0.00 -1.95 0.54 114.58 113.12 1p1n h GLU 125 Ca 0.08 -0.01 0.04 0.00 -0.00 0.00 0.00 59.36 59.47 1p1n h GLU 125 Cb 0.43 -0.05 -0.05 0.00 -0.00 0.00 0.00 28.75 29.09 1p1n h GLU 125 CO 0.02 0.14 0.41 -0.44 -0.00 0.00 0.00 179.01 179.14 1p1n h ASP 126 N 0.21 0.66 -0.16 3.06 3.32 -1.81 -2.35 116.42 119.36 1p1n h ASP 126 Ca 0.16 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1p1n h ASP 126 Cb 0.16 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1p1n h ASP 126 CO -0.19 0.45 0.10 -0.07 -1.72 0.00 0.00 179.24 177.82 1p1n h LEU 127 N 0.80 0.19 -0.84 1.55 3.38 -0.87 -3.10 115.31 116.42 1p1n h LEU 127 Ca 0.28 -0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.25 1p1n h LEU 127 Cb 0.06 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.71 1p1n h LEU 127 CO -0.12 0.16 0.54 0.77 0.09 0.00 0.00 178.44 179.88 1p1n h SER 128 N 0.20 0.89 -0.05 -0.43 4.64 -0.61 -2.76 113.55 115.43 1p1n h SER 128 Ca 0.06 -0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.35 1p1n h SER 128 Cb 0.00 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 61.88 1p1n h SER 128 CO -0.01 0.61 0.02 0.29 -0.87 0.00 0.00 176.83 176.88 1p1n n LYS 129 N -4.56 1.15 -3.75 4.77 5.02 -0.91 -4.86 118.16 115.02 1p1n n LYS 129 Ca 0.10 -0.19 -0.06 0.00 -2.02 0.00 0.00 58.31 56.14 1p1n n LYS 129 Cb 0.09 -1.26 -0.02 0.00 -0.02 0.00 0.00 35.03 33.82 1p1n n LYS 129 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1p1n s GLN 130 N -0.57 1.39 0.00 1.97 1.03 -1.04 -5.06 119.66 117.38 1p1n s GLN 130 Ca 0.04 -0.74 0.00 0.00 0.04 0.00 0.00 55.36 54.70 1p1n s GLN 130 Cb 0.03 0.50 0.00 0.00 0.03 0.00 0.00 33.01 33.56 1p1n s GLN 130 CO 0.01 -0.63 0.00 -2.37 -2.54 0.00 0.00 175.29 169.75 1p1n n THR 131 N -0.44 0.00 -0.20 3.63 5.66 -1.26 -4.85 114.28 116.82 1p1n n THR 131 Ca -0.06 -0.04 0.01 0.00 -3.05 0.00 0.00 64.05 60.91 1p1n n THR 131 Cb 0.60 0.63 0.10 0.00 -1.55 0.00 0.00 70.33 70.12 1p1n n THR 131 CO 0.00 0.00 0.00 1.05 -3.05 0.00 0.00 175.07 173.07 1p1n h GLU 132 N 0.00 0.13 -5.10 1.09 9.09 -1.97 -3.32 114.58 114.51 1p1n h GLU 132 Ca 0.00 -0.01 -0.67 0.00 0.05 0.00 0.00 59.36 58.74 1p1n h GLU 132 Cb 0.00 -0.03 -0.17 0.00 -1.65 0.00 0.00 28.75 26.90 1p1n h GLU 132 CO 0.00 0.09 -0.11 0.42 0.05 0.00 0.00 179.01 179.46 1p1n s ILE 133 N -6.14 5.03 0.58 -1.06 1.01 -1.26 -4.92 121.20 114.45 1p1n s ILE 133 Ca -0.13 0.03 -0.16 0.00 0.00 0.00 0.00 60.65 60.39 1p1n s ILE 133 Cb 0.19 -4.00 -0.04 0.00 0.01 0.00 0.00 42.46 38.61 1p1n s ILE 133 CO 0.74 -0.32 1.05 0.00 0.00 0.00 0.00 174.94 176.40 1p1n s ALA 134 N 2.32 2.77 -0.06 9.38 0.00 0.16 -4.85 121.76 131.48 1p1n s ALA 134 Ca 0.16 0.38 -0.20 0.00 0.00 0.00 0.00 51.96 52.29 1p1n s ALA 134 Cb -0.16 -3.22 0.04 0.00 0.00 0.00 0.00 23.12 19.78 1p1n s ALA 134 CO 0.14 -0.75 0.46 1.52 0.00 0.00 0.00 175.76 177.13 1p1n s TYR 135 N -2.46 -0.41 0.33 0.00 -0.85 -1.26 -0.72 117.35 111.98 1p1n s TYR 135 Ca 0.63 0.76 -0.13 0.00 -0.52 0.00 0.00 57.07 57.81 1p1n s TYR 135 Cb -0.15 0.21 0.05 0.00 0.38 0.00 0.00 41.96 42.45 1p1n s TYR 135 CO 0.36 -0.43 0.70 0.41 -1.52 0.00 0.00 175.55 175.08 1p1n n GLY 136 N 1.49 1.08 2.69 5.49 0.00 -1.10 -4.78 105.19 110.06 1p1n n GLY 136 Ca -0.19 -1.22 -0.22 0.00 0.00 0.00 0.00 46.02 44.39 1p1n n GLY 136 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1p1n n THR 137 N -0.48 0.00 -2.38 2.61 -2.24 -1.26 -1.17 114.28 109.37 1p1n n THR 137 Ca -0.07 -1.71 -0.37 0.00 -2.27 0.00 0.00 64.05 59.63 1p1n n THR 137 Cb 0.51 0.20 -0.02 0.00 -2.10 0.00 0.00 70.33 68.92 1p1n n THR 137 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1p1n s THR 138 N -2.23 3.36 -0.95 4.28 2.01 -1.26 -2.04 115.64 118.81 1p1n s THR 138 Ca 0.07 1.07 0.07 0.00 0.31 0.00 0.00 61.69 63.20 1p1n s THR 138 Cb -0.01 -3.56 0.06 0.00 0.01 0.00 0.00 72.50 69.00 1p1n s THR 138 CO 0.04 0.03 1.22 -0.67 -0.69 0.00 0.00 174.62 174.55 1p1n n ASP 139 N -0.16 0.04 -3.81 3.53 4.64 0.22 -4.53 116.55 116.49 1p1n n ASP 139 Ca 0.05 0.52 -0.10 0.00 -1.38 0.00 0.00 54.79 53.88 1p1n n ASP 139 Cb 0.48 -0.52 -0.07 0.00 -1.04 0.00 0.00 41.12 39.97 1p1n n ASP 139 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 1p1n s SER 140 N -3.08 0.00 0.00 1.67 1.04 -1.26 -5.05 113.70 107.02 1p1n s SER 140 Ca 0.03 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.03 1p1n s SER 140 Cb 0.04 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.50 1p1n s SER 140 CO 0.12 -0.67 0.00 0.61 0.98 0.00 0.00 173.24 174.28 1p1n n GLY 141 N 0.28 1.83 0.19 7.32 0.00 -1.26 -4.79 105.19 108.77 1p1n n GLY 141 Ca -0.17 -2.22 0.03 0.00 0.00 0.00 0.00 46.02 43.66 1p1n n GLY 141 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1p1n h SER 142 N 0.00 0.00 -0.32 1.61 4.64 -1.95 -3.02 113.55 114.51 1p1n h SER 142 Ca 0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 1p1n h SER 142 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1p1n h SER 142 CO 0.00 0.33 -0.05 0.74 -0.87 0.00 0.00 176.83 176.99 1p1n h THR 143 N 0.00 1.27 -0.63 2.95 2.02 -1.93 -1.48 112.91 115.11 1p1n h THR 143 Ca -0.00 -1.06 -0.01 0.00 0.77 0.00 0.00 66.41 66.11 1p1n h THR 143 Cb 0.59 1.32 -0.03 0.00 -1.74 0.00 0.00 68.15 68.30 1p1n h THR 143 CO 0.04 0.34 0.36 0.50 0.37 0.00 0.00 175.52 177.14 1p1n h LYS 144 N 0.37 0.86 -0.19 6.66 3.64 -1.78 -2.41 116.57 123.73 1p1n h LYS 144 Ca 0.08 -0.09 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 1p1n h LYS 144 Cb 0.52 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 1p1n h LYS 144 CO 0.03 0.64 -0.07 0.93 -2.27 0.00 0.00 179.45 178.71 1p1n h GLU 145 N 0.85 0.29 -0.18 1.90 4.39 -1.40 -2.03 114.58 118.40 1p1n h GLU 145 Ca 0.22 -0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.88 1p1n h GLU 145 Cb 0.01 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 1p1n h GLU 145 CO -0.04 0.37 0.10 0.35 -1.16 0.00 0.00 179.01 178.63 1p1n h PHE 146 N 0.28 0.18 -0.24 4.33 3.57 -0.75 -1.08 116.94 123.22 1p1n h PHE 146 Ca 0.06 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.44 1p1n h PHE 146 Cb 0.30 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 1p1n h PHE 146 CO 0.01 0.11 -0.40 0.74 -2.23 0.00 0.00 178.31 176.53 1p1n h PHE 147 N 0.20 0.68 -0.72 0.41 0.04 -1.39 -1.56 116.94 114.60 1p1n h PHE 147 Ca 0.07 -0.19 -0.06 0.00 2.80 0.00 0.00 57.97 60.59 1p1n h PHE 147 Cb 0.01 -0.15 -0.03 0.00 2.20 0.00 0.00 35.95 37.98 1p1n h PHE 147 CO -0.09 0.88 0.22 -0.09 -0.60 0.00 0.00 178.31 178.64 1p1n h ARG 148 N 0.47 1.12 -0.02 1.51 2.43 -1.10 -3.05 114.38 115.74 1p1n h ARG 148 Ca 0.04 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 58.97 1p1n h ARG 148 Cb 0.90 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.29 1p1n h ARG 148 CO 0.08 0.96 -0.05 -2.13 -1.51 0.00 0.00 179.97 177.32 1p1n n ARG 149 N -4.28 1.88 -2.13 0.20 3.00 -0.43 -4.96 116.66 109.94 1p1n n ARG 149 Ca 0.06 -1.37 -0.43 0.00 -0.00 0.00 0.00 57.85 56.11 1p1n n ARG 149 Cb 0.23 -1.47 -0.03 0.00 0.00 0.00 0.00 32.46 31.19 1p1n n ARG 149 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1p1n s SER 150 N -2.06 6.53 -0.04 6.15 0.15 -0.59 -4.93 113.70 118.90 1p1n s SER 150 Ca 0.31 1.78 -0.07 0.00 0.70 0.00 0.00 55.95 58.68 1p1n s SER 150 Cb 0.20 -2.53 -0.04 0.00 -1.71 0.00 0.00 66.02 61.94 1p1n s SER 150 CO 0.35 -1.11 0.38 0.07 1.20 0.00 0.00 173.24 174.13 1p1n h LYS 151 N 10.10 -0.25 0.00 5.44 -0.00 -1.90 -3.41 116.57 126.54 1p1n h LYS 151 Ca -0.34 0.02 0.00 0.00 -0.00 0.00 0.00 60.65 60.33 1p1n h LYS 151 Cb 1.15 0.06 0.00 0.00 -0.00 0.00 0.00 32.23 33.44 1p1n h LYS 151 CO 0.99 -0.17 0.00 -0.89 -0.00 0.00 0.00 179.45 179.38 1p1n n ILE 152 N -4.10 0.00 0.00 0.07 5.41 -1.26 -4.41 119.36 115.08 1p1n n ILE 152 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.72 1p1n n ILE 152 Cb 0.10 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.03 1p1n n ILE 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1p1n n ALA 153 N 0.00 0.00 -0.03 -1.39 0.00 -1.26 -3.39 120.51 114.45 1p1n n ALA 153 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.63 1p1n n ALA 153 Cb 0.00 0.00 0.64 0.00 0.00 0.00 0.00 19.45 20.09 1p1n n ALA 153 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1p1n h VAL 154 N 0.00 0.76 0.00 0.00 2.07 -1.99 0.15 116.25 117.24 1p1n h VAL 154 Ca 0.00 -0.03 -0.11 0.00 0.82 0.00 0.00 66.70 67.37 1p1n h VAL 154 Cb 0.00 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1p1n h VAL 154 CO 0.00 0.02 -0.53 -0.26 0.02 0.00 0.00 177.57 176.82 1p1n h PHE 155 N 0.10 0.00 -0.10 1.57 0.04 -1.87 -2.69 116.94 113.98 1p1n h PHE 155 Ca 0.27 0.00 -0.23 0.00 2.80 0.00 0.00 57.97 60.81 1p1n h PHE 155 Cb 0.93 0.00 0.01 0.00 2.20 0.00 0.00 35.95 39.09 1p1n h PHE 155 CO -0.00 0.53 -0.85 -0.44 -0.60 0.00 0.00 178.31 176.95 1p1n h ASP 156 N 0.00 0.88 0.02 2.17 5.19 -0.95 -1.01 116.42 122.73 1p1n h ASP 156 Ca -0.01 -0.61 -0.06 0.00 -0.62 0.00 0.00 57.03 55.73 1p1n h ASP 156 Cb 1.17 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 40.40 1p1n h ASP 156 CO 0.07 1.41 -0.18 0.07 -3.12 0.00 0.00 179.24 177.49 1p1n h LYS 157 N 0.47 0.30 -0.08 3.56 2.10 -1.35 -1.30 116.57 120.27 1p1n h LYS 157 Ca -0.07 -0.08 -0.04 0.00 -2.00 0.00 0.00 60.65 58.46 1p1n h LYS 157 Cb 1.48 -0.03 -0.00 0.00 -0.90 0.00 0.00 32.23 32.78 1p1n h LYS 157 CO 0.17 0.48 -0.10 0.52 -2.00 0.00 0.00 179.45 178.51 1p1n h MET 158 N 0.28 0.21 -0.45 0.07 2.07 -1.30 -2.06 114.93 113.75 1p1n h MET 158 Ca 0.05 -0.12 -0.02 0.00 -2.07 0.00 0.00 59.70 57.54 1p1n h MET 158 Cb 0.48 0.01 -0.02 0.00 -1.87 0.00 0.00 31.60 30.20 1p1n h MET 158 CO 0.03 0.67 0.19 2.35 1.07 0.00 0.00 176.91 181.22 1p1n h TRP 159 N -0.24 0.68 -0.64 -0.22 2.91 -1.02 0.14 115.95 117.56 1p1n h TRP 159 Ca 0.01 -0.05 0.03 0.00 1.13 0.00 0.00 58.89 60.01 1p1n h TRP 159 Cb 0.64 -0.20 -0.04 0.00 -0.51 0.00 0.00 29.16 29.05 1p1n h TRP 159 CO 0.10 0.57 0.40 1.15 -1.03 0.00 0.00 178.44 179.63 1p1n h THR 160 N 0.59 1.09 0.43 2.65 2.02 -1.29 0.05 112.91 118.45 1p1n h THR 160 Ca 0.15 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 67.04 1p1n h THR 160 Cb 0.17 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 66.82 1p1n h THR 160 CO -0.01 0.14 -0.21 0.22 0.37 0.00 0.00 175.52 176.03 1p1n h TYR 161 N 0.78 -0.53 -0.96 3.16 3.20 -1.07 -3.12 116.97 118.43 1p1n h TYR 161 Ca 0.25 -0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.22 1p1n h TYR 161 Cb 0.01 0.18 -0.08 0.00 1.54 0.00 0.00 36.73 38.37 1p1n h TYR 161 CO -0.05 -0.23 0.60 0.52 -1.64 0.00 0.00 178.16 177.36 1p1n h MET 162 N -0.80 0.95 -0.38 1.82 2.86 -0.54 0.21 114.93 119.05 1p1n h MET 162 Ca -0.06 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.49 1p1n h MET 162 Cb 0.54 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 31.97 1p1n h MET 162 CO 0.10 0.63 0.08 0.00 1.06 0.00 0.00 176.91 178.77 1p1n h ARG 163 N 0.98 0.56 -0.01 1.72 -0.00 -1.00 -3.11 114.38 113.52 1p1n h ARG 163 Ca 0.46 -0.10 0.00 0.00 -0.50 0.00 0.00 59.98 59.85 1p1n h ARG 163 Cb 0.41 -0.09 0.00 0.00 0.00 0.00 0.00 29.97 30.29 1p1n h ARG 163 CO -0.25 0.53 -0.63 -1.13 0.00 0.00 0.00 179.97 178.49 1p1n n SER 164 N -4.32 1.35 -4.72 7.04 3.41 -0.95 -5.00 113.62 110.43 1p1n n SER 164 Ca 0.02 -1.17 -0.43 0.00 -0.26 0.00 0.00 58.87 57.03 1p1n n SER 164 Cb 0.20 0.73 -0.01 0.00 -0.26 0.00 0.00 64.21 64.87 1p1n n SER 164 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1p1n n ALA 165 N -0.74 1.88 -3.64 7.33 0.00 0.02 -5.01 120.51 120.35 1p1n n ALA 165 Ca 0.06 0.38 -0.18 0.00 0.00 0.00 0.00 53.44 53.69 1p1n n ALA 165 Cb 0.34 -2.36 -0.16 0.00 0.00 0.00 0.00 19.45 17.27 1p1n n ALA 165 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1p1n s GLU 166 N -0.96 0.58 0.99 0.00 2.56 -1.26 -3.79 118.70 116.82 1p1n s GLU 166 Ca 0.62 -0.03 -0.12 0.00 0.00 0.00 0.00 54.97 55.44 1p1n s GLU 166 Cb -0.55 -0.65 0.19 0.00 2.00 0.00 0.00 34.13 35.11 1p1n s GLU 166 CO 0.54 -0.09 1.08 -1.25 -0.56 0.00 0.00 175.26 174.97 1p1n s PRO 167 N 0.91 0.45 0.26 4.30 0.04 -1.26 -5.07 135.00 134.63 1p1n s PRO 167 Ca -0.11 0.82 -0.29 0.00 0.04 0.00 0.00 61.00 61.46 1p1n s PRO 167 Cb -0.14 -1.72 -0.15 0.00 0.04 0.00 0.00 34.50 32.54 1p1n s PRO 167 CO -0.01 -2.79 1.01 0.45 0.04 0.00 0.00 177.00 175.70 1p1n n SER 168 N -4.26 1.13 -0.85 6.66 2.88 -1.25 -4.88 113.62 113.04 1p1n n SER 168 Ca 0.06 1.17 0.12 0.00 -1.33 0.00 0.00 58.87 58.88 1p1n n SER 168 Cb 0.55 -1.25 0.08 0.00 -0.75 0.00 0.00 64.21 62.84 1p1n n SER 168 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1p1n n VAL 169 N 0.48 0.00 -3.23 2.46 0.24 -1.26 -4.94 118.33 112.07 1p1n n VAL 169 Ca 0.11 -0.44 -0.36 0.00 -2.04 0.00 0.00 64.34 61.61 1p1n n VAL 169 Cb 0.30 1.44 -0.06 0.00 -1.47 0.00 0.00 33.84 34.05 1p1n n VAL 169 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1p1n s PHE 170 N -2.11 3.64 0.19 6.34 0.08 -1.26 -3.78 117.98 121.08 1p1n s PHE 170 Ca 0.26 1.23 0.10 0.00 0.12 0.00 0.00 56.93 58.64 1p1n s PHE 170 Cb 0.20 -2.50 -0.04 0.00 -0.57 0.00 0.00 43.02 40.10 1p1n s PHE 170 CO 0.36 0.40 -0.17 0.14 -0.10 0.00 0.00 175.22 175.85 1p1n s VAL 171 N -1.47 2.73 0.14 -0.44 -7.23 -0.87 -4.80 120.40 108.47 1p1n s VAL 171 Ca 0.40 -1.87 0.01 0.00 -1.81 0.00 0.00 61.98 58.70 1p1n s VAL 171 Cb -0.16 -2.33 -0.18 0.00 0.56 0.00 0.00 36.38 34.27 1p1n s VAL 171 CO 0.20 -0.12 1.33 -0.09 -0.31 0.00 0.00 175.10 176.11 1p1n h ARG 172 N 3.05 0.22 -4.14 4.82 2.43 -1.94 0.63 114.38 119.45 1p1n h ARG 172 Ca -0.46 -0.26 -0.18 0.00 -0.81 0.00 0.00 59.98 58.26 1p1n h ARG 172 Cb 1.21 0.08 -0.11 0.00 -0.42 0.00 0.00 29.97 30.73 1p1n h ARG 172 CO 0.51 1.01 -0.33 0.95 -1.51 0.00 0.00 179.97 180.60 1p1n s THR 173 N -3.10 0.00 0.15 0.20 -4.23 -1.26 -4.71 115.64 102.69 1p1n s THR 173 Ca -0.03 -1.69 -0.16 0.00 -1.18 0.00 0.00 61.69 58.63 1p1n s THR 173 Cb 0.09 -2.40 0.01 0.00 1.34 0.00 0.00 72.50 71.55 1p1n s THR 173 CO 0.84 0.00 1.77 0.74 -0.54 0.00 0.00 174.62 177.43 1p1n h THR 174 N 2.36 1.14 -0.91 3.99 2.02 -1.99 -1.39 112.91 118.14 1p1n h THR 174 Ca -0.30 -0.34 0.07 0.00 0.77 0.00 0.00 66.41 66.60 1p1n h THR 174 Cb 1.25 0.61 -0.06 0.00 -1.74 0.00 0.00 68.15 68.21 1p1n h THR 174 CO 0.42 0.15 0.59 0.00 0.37 0.00 0.00 175.52 177.05 1p1n h ALA 175 N 1.10 1.53 -0.32 6.16 0.00 -1.99 0.22 119.26 125.96 1p1n h ALA 175 Ca 0.15 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 1p1n h ALA 175 Cb 0.02 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1p1n h ALA 175 CO -0.03 0.33 -0.25 1.49 0.00 0.00 0.00 179.25 180.79 1p1n h GLU 176 N 1.01 0.74 -0.52 0.00 4.81 -1.84 -1.09 114.58 117.69 1p1n h GLU 176 Ca 0.39 -0.36 -0.05 0.00 -0.13 0.00 0.00 59.36 59.22 1p1n h GLU 176 Cb 0.23 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 1p1n h GLU 176 CO -0.15 0.98 0.15 0.78 -0.73 0.00 0.00 179.01 180.04 1p1n h GLY 177 N 0.50 0.88 1.02 1.92 0.00 -0.53 -0.58 103.07 106.28 1p1n h GLY 177 Ca 0.06 -0.53 -0.08 0.00 0.00 0.00 0.00 47.33 46.78 1p1n h GLY 177 CO 0.07 0.50 0.03 -2.08 0.00 0.00 0.00 176.54 175.05 1p1n h VAL 178 N 0.72 1.26 -0.55 4.60 2.07 -0.95 -1.29 116.25 122.11 1p1n h VAL 178 Ca 0.17 -1.05 -0.07 0.00 0.82 0.00 0.00 66.70 66.57 1p1n h VAL 178 Cb 0.30 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 1p1n h VAL 178 CO -0.00 0.37 0.08 0.00 0.02 0.00 0.00 177.57 178.04 1p1n h ALA 179 N 0.96 1.10 -0.47 1.67 0.00 -1.04 -1.09 119.26 120.38 1p1n h ALA 179 Ca 0.15 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1p1n h ALA 179 Cb 0.49 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1p1n h ALA 179 CO 0.02 0.59 -0.05 -0.09 0.00 0.00 0.00 179.25 179.71 1p1n h ARG 180 N 0.84 0.87 -0.12 0.00 2.43 -0.83 -0.63 114.38 116.93 1p1n h ARG 180 Ca 0.17 -0.31 -0.00 0.00 -0.81 0.00 0.00 59.98 59.03 1p1n h ARG 180 Cb 0.39 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.87 1p1n h ARG 180 CO 0.01 0.94 0.06 0.28 -1.51 0.00 0.00 179.97 179.75 1p1n h VAL 181 N 0.72 1.11 -0.21 0.20 2.07 -0.94 -1.72 116.25 117.48 1p1n h VAL 181 Ca 0.13 -0.31 -0.06 0.00 0.82 0.00 0.00 66.70 67.27 1p1n h VAL 181 Cb 0.58 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1p1n h VAL 181 CO 0.04 0.10 -0.14 0.03 0.02 0.00 0.00 177.57 177.61 1p1n h ARG 182 N 0.08 0.34 -0.04 1.57 3.08 -1.07 -3.17 114.38 115.18 1p1n h ARG 182 Ca 0.04 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1p1n h ARG 182 Cb 0.10 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1p1n h ARG 182 CO -0.01 0.49 0.00 1.63 -1.07 0.00 0.00 179.97 181.02 1p1n n LYS 183 N -4.23 2.25 -0.59 0.04 5.02 -0.26 -4.35 118.16 116.06 1p1n n LYS 183 Ca -0.00 -1.82 0.08 0.00 -2.02 0.00 0.00 58.31 54.55 1p1n n LYS 183 Cb 0.30 -1.46 0.32 0.00 -0.02 0.00 0.00 35.03 34.17 1p1n n LYS 183 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1p1n n SER 184 N 1.21 4.39 -4.26 4.39 7.64 -0.65 -4.95 113.62 121.38 1p1n n SER 184 Ca 0.15 -2.46 -0.35 0.00 1.01 0.00 0.00 58.87 57.22 1p1n n SER 184 Cb 0.57 -0.56 -0.05 0.00 -1.01 0.00 0.00 64.21 63.16 1p1n n SER 184 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1p1n n LYS 185 N 0.91 -2.21 -0.87 1.43 4.01 -1.26 -0.52 118.16 119.65 1p1n n LYS 185 Ca 0.23 0.27 0.00 0.00 -0.51 0.00 0.00 58.31 58.30 1p1n n LYS 185 Cb 0.84 -4.62 0.00 0.00 -0.51 0.00 0.00 35.03 30.75 1p1n n LYS 185 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1p1n n GLY 186 N -1.66 0.83 0.96 0.72 0.00 -1.26 -4.92 105.19 99.86 1p1n n GLY 186 Ca -0.07 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.05 1p1n n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1p1n n LYS 187 N -2.25 2.22 -3.76 1.61 4.76 0.32 -4.85 118.16 116.21 1p1n n LYS 187 Ca 0.00 -1.87 -0.15 0.00 -2.87 0.00 0.00 58.31 53.42 1p1n n LYS 187 Cb 0.00 -1.43 -0.16 0.00 -1.84 0.00 0.00 35.03 31.60 1p1n n LYS 187 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 1p1n s TYR 188 N -1.40 0.01 -0.05 2.13 5.04 -1.25 -0.66 117.35 121.17 1p1n s TYR 188 Ca 0.36 0.18 0.05 0.00 -2.44 0.00 0.00 57.07 55.22 1p1n s TYR 188 Cb 0.19 -0.24 -0.02 0.00 0.35 0.00 0.00 41.96 42.24 1p1n s TYR 188 CO 0.26 -0.11 -0.20 0.00 -1.34 0.00 0.00 175.55 174.17 1p1n s ALA 189 N 1.17 2.41 -0.17 3.97 0.00 0.11 -4.59 121.76 124.67 1p1n s ALA 189 Ca -0.08 -1.03 -0.03 0.00 0.00 0.00 0.00 51.96 50.82 1p1n s ALA 189 Cb -0.13 -0.80 -0.02 0.00 0.00 0.00 0.00 23.12 22.17 1p1n s ALA 189 CO -0.03 0.50 -0.05 -0.47 0.00 0.00 0.00 175.76 175.70 1p1n s TYR 190 N -0.51 2.96 -0.40 0.00 5.04 -0.34 -2.70 117.35 121.40 1p1n s TYR 190 Ca 0.07 -0.52 -0.19 0.00 -2.44 0.00 0.00 57.07 53.99 1p1n s TYR 190 Cb -0.11 -1.98 0.01 0.00 0.35 0.00 0.00 41.96 40.23 1p1n s TYR 190 CO 0.01 -0.20 0.55 -0.51 -1.34 0.00 0.00 175.55 174.06 1p1n s LEU 191 N 0.66 4.53 0.24 6.97 1.43 -0.31 -0.35 118.68 131.85 1p1n s LEU 191 Ca -0.03 -0.30 -0.06 0.00 -1.03 0.00 0.00 54.13 52.71 1p1n s LEU 191 Cb -0.15 -2.59 -0.02 0.00 0.03 0.00 0.00 46.19 43.46 1p1n s LEU 191 CO 0.02 -0.62 0.32 -1.48 0.23 0.00 0.00 176.35 174.83 1p1n s LEU 192 N 2.50 0.81 0.30 1.79 2.34 -0.67 -4.29 118.68 121.46 1p1n s LEU 192 Ca 0.19 -1.23 -0.29 0.00 0.06 0.00 0.00 54.13 52.86 1p1n s LEU 192 Cb -0.15 1.10 -0.10 0.00 -0.56 0.00 0.00 46.19 46.48 1p1n s LEU 192 CO 0.16 -1.03 1.34 -1.61 -1.06 0.00 0.00 176.35 174.14 1p1n s GLU 193 N -3.93 4.34 0.46 1.48 2.02 -1.26 0.06 118.70 121.87 1p1n s GLU 193 Ca 0.31 2.22 0.23 0.00 0.02 0.00 0.00 54.97 57.75 1p1n s GLU 193 Cb 0.03 -3.09 1.23 0.00 0.10 0.00 0.00 34.13 32.40 1p1n s GLU 193 CO 0.13 -0.25 1.87 0.66 0.02 0.00 0.00 175.26 177.68 1p1n h SER 194 N 3.98 0.26 0.26 -0.19 4.64 -1.01 -2.08 113.55 119.41 1p1n h SER 194 Ca -0.48 0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 60.86 1p1n h SER 194 Cb 1.22 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1p1n h SER 194 CO 0.70 0.09 -0.15 0.71 -0.87 0.00 0.00 176.83 177.31 1p1n h THR 195 N 0.25 0.69 -0.62 2.95 1.35 -1.91 0.17 112.91 115.80 1p1n h THR 195 Ca 0.46 0.00 -0.09 0.00 -0.55 0.00 0.00 66.41 66.22 1p1n h THR 195 Cb 1.37 0.69 -0.02 0.00 -1.73 0.00 0.00 68.15 68.46 1p1n h THR 195 CO -0.12 0.00 0.02 0.24 -0.25 0.00 0.00 175.52 175.41 1p1n h MET 196 N -0.39 1.07 0.11 4.72 2.86 -1.78 -2.00 114.93 119.53 1p1n h MET 196 Ca -0.03 -0.33 0.01 0.00 -2.06 0.00 0.00 59.70 57.29 1p1n h MET 196 Cb 0.32 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 1p1n h MET 196 CO 0.04 1.03 -0.12 -0.97 1.06 0.00 0.00 176.91 177.95 1p1n h ASN 197 N 0.97 -0.33 -0.87 1.22 -0.73 -1.23 -0.18 115.58 114.43 1p1n h ASN 197 Ca 0.18 0.03 0.01 0.00 1.87 0.00 0.00 56.30 58.39 1p1n h ASN 197 Cb 0.53 0.12 -0.04 0.00 0.27 0.00 0.00 38.32 39.20 1p1n h ASN 197 CO 0.03 -0.19 0.58 -0.33 -0.37 0.00 0.00 177.43 177.15 1p1n h GLU 198 N -0.27 1.13 0.32 6.67 5.08 -0.59 -0.97 114.58 125.96 1p1n h GLU 198 Ca 0.01 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1p1n h GLU 198 Cb 0.26 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1p1n h GLU 198 CO -0.04 0.75 -0.16 -0.92 -1.00 0.00 0.00 179.01 177.64 1p1n h TYR 199 N 1.17 -0.40 -0.31 4.33 3.20 -0.96 -3.13 116.97 120.87 1p1n h TYR 199 Ca 0.32 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.18 1p1n h TYR 199 Cb -0.11 0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 1p1n h TYR 199 CO -0.00 -0.13 0.18 0.82 -1.64 0.00 0.00 178.16 177.39 1p1n h ILE 200 N -0.64 1.09 0.00 1.81 1.08 -0.83 -1.77 117.51 118.25 1p1n h ILE 200 Ca -0.04 -0.21 -0.01 0.00 -0.39 0.00 0.00 64.86 64.21 1p1n h ILE 200 Cb 0.46 0.66 -0.00 0.00 -3.07 0.00 0.00 36.82 34.87 1p1n h ILE 200 CO 0.07 0.09 -0.04 -0.08 -0.69 0.00 0.00 178.15 177.50 1p1n h GLU 201 N 0.42 0.00 -0.65 2.37 4.81 -1.12 -1.91 114.58 118.50 1p1n h GLU 201 Ca 0.11 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 59.13 1p1n h GLU 201 Cb -0.01 0.00 -0.12 0.00 0.63 0.00 0.00 28.75 29.25 1p1n h GLU 201 CO -0.02 0.04 0.22 1.04 -0.73 0.00 0.00 179.01 179.56 1p1n n GLN 202 N -4.07 3.30 -5.17 1.92 1.13 -0.67 -4.79 117.38 109.04 1p1n n GLN 202 Ca -0.03 -3.07 -0.30 0.00 -1.94 0.00 0.00 57.00 51.66 1p1n n GLN 202 Cb 0.13 -2.12 -0.16 0.00 0.11 0.00 0.00 30.24 28.20 1p1n n GLN 202 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1p1n s ARG 203 N -3.03 1.98 0.69 -1.09 1.81 -0.72 0.45 118.95 119.04 1p1n s ARG 203 Ca 0.52 -0.96 -0.16 0.00 -1.72 0.00 0.00 55.73 53.41 1p1n s ARG 203 Cb 0.43 -1.98 0.02 0.00 -0.45 0.00 0.00 34.95 32.97 1p1n s ARG 203 CO 0.11 0.53 1.23 0.15 -0.68 0.00 0.00 175.30 176.64 1p1n s LYS 204 N -0.78 2.34 0.00 3.54 1.02 -1.26 -0.92 119.74 123.68 1p1n s LYS 204 Ca 0.10 1.85 0.06 0.00 0.02 0.00 0.00 55.97 58.00 1p1n s LYS 204 Cb -0.10 -1.85 0.35 0.00 -0.52 0.00 0.00 37.83 35.72 1p1n s LYS 204 CO -0.00 -1.70 0.75 -2.30 -0.92 0.00 0.00 175.35 171.18 1p1n n PRO 205 N -2.37 0.37 -3.76 -1.68 -0.02 -1.26 -4.95 135.00 121.32 1p1n n PRO 205 Ca 0.14 0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.35 1p1n n PRO 205 Cb 0.50 -1.25 0.05 0.00 -0.02 0.00 0.00 33.50 32.77 1p1n n PRO 205 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1p1n n ASP 207 N -2.93 2.79 -4.64 0.00 5.75 -1.26 -5.00 116.55 111.26 1p1n n ASP 207 Ca -0.01 -2.00 -0.24 0.00 -0.01 0.00 0.00 54.79 52.53 1p1n n ASP 207 Cb 0.56 -0.20 -0.08 0.00 -1.03 0.00 0.00 41.12 40.37 1p1n n ASP 207 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1p1n s THR 208 N -1.00 2.82 -0.15 2.12 -4.23 -1.26 -0.80 115.64 113.14 1p1n s THR 208 Ca 0.20 -1.94 -0.18 0.00 -1.18 0.00 0.00 61.69 58.58 1p1n s THR 208 Cb 0.10 -2.81 0.05 0.00 1.34 0.00 0.00 72.50 71.18 1p1n s THR 208 CO 0.13 -0.24 0.49 -0.32 -0.54 0.00 0.00 174.62 174.14 1p1n s MET 209 N -3.72 0.64 -0.15 3.99 1.75 -0.39 -4.75 119.30 116.67 1p1n s MET 209 Ca 0.34 0.52 -0.19 0.00 -1.25 0.00 0.00 55.69 55.11 1p1n s MET 209 Cb -0.02 0.31 -0.04 0.00 2.84 0.00 0.00 34.83 37.92 1p1n s MET 209 CO 0.20 -0.11 0.52 0.21 -0.65 0.00 0.00 175.02 175.18 1p1n s LYS 210 N -0.11 4.28 0.06 4.11 2.20 -1.26 -1.72 119.74 127.30 1p1n s LYS 210 Ca -0.03 0.48 0.09 0.00 -0.36 0.00 0.00 55.97 56.14 1p1n s LYS 210 Cb -0.03 -3.49 -0.03 0.00 -1.51 0.00 0.00 37.83 32.76 1p1n s LYS 210 CO 0.02 0.01 -0.25 0.14 -0.36 0.00 0.00 175.35 174.92 1p1n s VAL 211 N 1.10 2.00 0.07 4.02 -7.23 -0.85 -5.03 120.40 114.48 1p1n s VAL 211 Ca 0.26 -1.40 0.00 0.00 -1.81 0.00 0.00 61.98 59.03 1p1n s VAL 211 Cb -0.15 -1.73 0.00 0.00 0.56 0.00 0.00 36.38 35.05 1p1n s VAL 211 CO 0.11 0.26 0.00 0.61 -0.31 0.00 0.00 175.10 175.77 1p1n n GLY 212 N 1.64 -2.07 3.98 2.32 0.00 -1.14 -4.11 105.19 105.81 1p1n n GLY 212 Ca -0.17 -1.40 -0.20 0.00 0.00 0.00 0.00 46.02 44.25 1p1n n GLY 212 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1p1n s GLY 213 N -3.21 1.66 0.47 -0.02 0.00 -1.26 -4.94 107.32 100.02 1p1n s GLY 213 Ca 0.00 -1.37 -0.24 0.00 0.00 0.00 0.00 44.72 43.11 1p1n s GLY 213 CO 0.00 -1.23 1.37 -1.31 0.00 0.00 0.00 173.10 171.94 1p1n s ASN 214 N -4.24 5.81 0.35 1.64 0.01 -1.26 -4.86 114.94 112.39 1p1n s ASN 214 Ca 0.49 2.80 0.19 0.00 -0.71 0.00 0.00 52.86 55.62 1p1n s ASN 214 Cb -0.10 -2.64 0.21 0.00 0.41 0.00 0.00 41.25 39.13 1p1n s ASN 214 CO 0.34 -1.21 1.53 -0.07 -1.51 0.00 0.00 177.10 176.18 1p1n h LEU 215 N 2.15 0.00 0.00 0.60 3.38 -0.98 -3.47 115.31 116.99 1p1n h LEU 215 Ca -0.51 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.32 1p1n h LEU 215 Cb 1.27 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.99 1p1n h LEU 215 CO 0.60 0.28 0.05 -0.90 0.09 0.00 0.00 178.44 178.56 1p1n n ASP 216 N -3.18 -1.63 -3.96 -0.43 5.75 -1.26 -4.94 116.55 106.91 1p1n n ASP 216 Ca 0.03 -2.58 -0.27 0.00 -0.01 0.00 0.00 54.79 51.96 1p1n n ASP 216 Cb 0.64 2.84 -0.17 0.00 -1.03 0.00 0.00 41.12 43.40 1p1n n ASP 216 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1p1n s SER 217 N -2.91 2.20 0.12 -1.12 0.01 -1.26 -4.14 113.70 106.60 1p1n s SER 217 Ca 0.21 -0.34 0.01 0.00 1.31 0.00 0.00 55.95 57.13 1p1n s SER 217 Cb -0.03 -0.92 -0.00 0.00 0.21 0.00 0.00 66.02 65.28 1p1n s SER 217 CO 0.15 -0.06 0.15 2.29 0.41 0.00 0.00 173.24 176.18 1p1n n LYS 218 N 4.60 0.22 -3.79 12.44 2.85 0.38 -5.01 118.16 129.85 1p1n n LYS 218 Ca -0.16 -1.07 -0.10 0.00 -1.05 0.00 0.00 58.31 55.93 1p1n n LYS 218 Cb 0.50 0.98 -0.05 0.00 -0.65 0.00 0.00 35.03 35.81 1p1n n LYS 218 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 1p1n s GLY 219 N -1.80 0.04 -0.11 2.58 0.00 -1.26 -1.23 107.32 105.53 1p1n s GLY 219 Ca 0.12 -0.38 -0.07 0.00 0.00 0.00 0.00 44.72 44.39 1p1n s GLY 219 CO 0.08 -0.41 0.14 -0.19 0.00 0.00 0.00 173.10 172.72 1p1n s TYR 220 N -3.89 3.59 0.13 1.90 2.02 -0.48 -1.31 117.35 119.31 1p1n s TYR 220 Ca 0.11 0.51 0.05 0.00 -0.37 0.00 0.00 57.07 57.37 1p1n s TYR 220 Cb 0.00 -1.93 -0.04 0.00 -0.40 0.00 0.00 41.96 39.59 1p1n s TYR 220 CO -0.03 0.73 -0.12 0.20 -1.57 0.00 0.00 175.55 174.76 1p1n s GLY 221 N -1.10 1.03 0.03 0.71 0.00 -0.94 -1.25 107.32 105.81 1p1n s GLY 221 Ca 0.16 -1.33 -0.27 0.00 0.00 0.00 0.00 44.72 43.28 1p1n s GLY 221 CO 0.05 -1.41 0.84 -0.42 0.00 0.00 0.00 173.10 172.17 1p1n s ILE 222 N -2.55 4.75 0.00 0.90 1.01 -1.26 -4.57 121.20 119.47 1p1n s ILE 222 Ca 0.11 1.79 0.03 0.00 0.00 0.00 0.00 60.65 62.57 1p1n s ILE 222 Cb -0.02 -4.19 -0.03 0.00 0.01 0.00 0.00 42.46 38.22 1p1n s ILE 222 CO 0.02 0.30 -0.05 0.00 0.00 0.00 0.00 174.94 175.21 1p1n s ALA 223 N 0.29 3.10 0.05 9.38 0.00 -0.59 -0.74 121.76 133.23 1p1n s ALA 223 Ca 0.43 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 51.39 1p1n s ALA 223 Cb -0.21 -1.19 -0.03 0.00 0.00 0.00 0.00 23.12 21.69 1p1n s ALA 223 CO 0.25 0.62 -0.04 0.95 0.00 0.00 0.00 175.76 177.54 1p1n s THR 224 N -1.02 0.30 0.58 0.00 -4.23 -0.48 -0.01 115.64 110.78 1p1n s THR 224 Ca 0.18 -1.40 -0.19 0.00 -1.18 0.00 0.00 61.69 59.09 1p1n s THR 224 Cb -0.11 -0.97 -0.04 0.00 1.34 0.00 0.00 72.50 72.72 1p1n s THR 224 CO 0.08 -0.71 1.23 -2.16 -0.54 0.00 0.00 174.62 172.52 1p1n s PRO 225 N -2.69 3.04 0.29 3.99 0.04 -1.26 -0.50 135.00 137.91 1p1n s PRO 225 Ca -0.03 1.88 -0.29 0.00 0.04 0.00 0.00 61.00 62.60 1p1n s PRO 225 Cb -0.01 -2.00 -0.13 0.00 0.04 0.00 0.00 34.50 32.39 1p1n s PRO 225 CO -0.04 -1.17 1.28 1.63 0.04 0.00 0.00 177.00 178.74 1p1n n LYS 226 N -1.44 1.93 -1.52 4.56 5.02 -1.26 -1.67 118.16 123.79 1p1n n LYS 226 Ca 0.13 0.68 -0.10 0.00 -2.02 0.00 0.00 58.31 57.00 1p1n n LYS 226 Cb 0.49 -2.25 -0.03 0.00 -0.02 0.00 0.00 35.03 33.22 1p1n n LYS 226 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1p1n n GLY 227 N 1.38 0.82 3.75 0.72 0.00 -1.26 -4.99 105.19 105.60 1p1n n GLY 227 Ca 0.08 -0.57 -0.40 0.00 0.00 0.00 0.00 46.02 45.13 1p1n n GLY 227 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1p1n s SER 228 N -2.81 7.46 0.23 1.61 0.15 -0.67 -4.96 113.70 114.71 1p1n s SER 228 Ca 0.00 2.03 -0.08 0.00 0.70 0.00 0.00 55.95 58.60 1p1n s SER 228 Cb 0.00 -2.61 0.20 0.00 -1.71 0.00 0.00 66.02 61.90 1p1n s SER 228 CO 0.00 -0.02 1.88 -1.28 1.20 0.00 0.00 173.24 175.01 1p1n h SER 229 N 4.48 1.05 1.06 5.45 0.87 -1.94 -2.74 113.55 121.78 1p1n h SER 229 Ca -0.45 -0.06 -0.00 0.00 -1.23 0.00 0.00 61.79 60.05 1p1n h SER 229 Cb 1.21 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.90 1p1n h SER 229 CO 0.69 0.80 -0.01 -0.07 -0.53 0.00 0.00 176.83 177.72 1p1n h LEU 230 N 1.20 0.00 -0.42 2.23 4.07 -1.96 -3.36 115.31 117.08 1p1n h LEU 230 Ca 0.31 0.00 0.08 0.00 0.08 0.00 0.00 57.88 58.35 1p1n h LEU 230 Cb -0.06 0.00 -0.09 0.00 1.08 0.00 0.00 40.66 41.59 1p1n h LEU 230 CO -0.06 0.01 -0.38 1.23 -1.08 0.00 0.00 178.44 178.16 1p1n h GLY 231 N 2.12 -0.41 1.00 0.83 0.00 -1.85 -1.16 103.07 103.61 1p1n h GLY 231 Ca -0.00 0.49 0.00 0.00 0.00 0.00 0.00 47.33 47.82 1p1n h GLY 231 CO 0.00 -0.19 0.14 -0.57 0.00 0.00 0.00 176.54 175.92 1p1n h ASN 232 N -0.29 0.25 -0.88 0.19 -1.24 -1.78 -2.26 115.58 109.57 1p1n h ASN 232 Ca 0.16 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.16 1p1n h ASN 232 Cb 0.57 -0.06 -0.04 0.00 0.73 0.00 0.00 38.32 39.51 1p1n h ASN 232 CO -0.57 0.18 0.55 0.00 -1.29 0.00 0.00 177.43 176.30 1p1n h ALA 233 N 1.08 1.12 -0.53 1.57 0.00 -1.72 -2.42 119.26 118.35 1p1n h ALA 233 Ca 0.08 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1p1n h ALA 233 Cb -0.03 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.38 1p1n h ALA 233 CO -0.02 0.55 0.10 0.28 0.00 0.00 0.00 179.25 180.16 1p1n h VAL 234 N 1.20 1.25 -0.36 0.00 2.07 -1.05 -1.42 116.25 117.94 1p1n h VAL 234 Ca 0.32 -0.92 0.00 0.00 0.82 0.00 0.00 66.70 66.92 1p1n h VAL 234 Cb -0.09 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 1p1n h VAL 234 CO -0.06 0.33 0.22 -1.13 0.02 0.00 0.00 177.57 176.95 1p1n h ASN 235 N 0.75 0.42 -0.34 0.57 -1.24 -1.15 -1.10 115.58 113.49 1p1n h ASN 235 Ca 0.16 -0.03 -0.06 0.00 0.71 0.00 0.00 56.30 57.08 1p1n h ASN 235 Cb 0.38 -0.11 -0.02 0.00 0.73 0.00 0.00 38.32 39.31 1p1n h ASN 235 CO 0.01 0.33 0.01 -0.07 -1.29 0.00 0.00 177.43 176.42 1p1n h LEU 236 N 0.47 0.65 -0.60 0.34 3.38 -1.33 -2.58 115.31 115.65 1p1n h LEU 236 Ca 0.13 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1p1n h LEU 236 Cb -0.02 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 1p1n h LEU 236 CO -0.03 0.71 0.23 0.00 0.09 0.00 0.00 178.44 179.44 1p1n h ALA 237 N 1.37 0.78 -0.29 1.53 0.00 -0.70 -0.31 119.26 121.64 1p1n h ALA 237 Ca 0.13 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1p1n h ALA 237 Cb 0.39 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1p1n h ALA 237 CO 0.01 0.40 0.18 0.28 0.00 0.00 0.00 179.25 180.13 1p1n h VAL 238 N 0.83 1.09 -0.66 0.00 2.07 -0.90 0.34 116.25 119.01 1p1n h VAL 238 Ca 0.20 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 1p1n h VAL 238 Cb 0.22 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 1p1n h VAL 238 CO -0.01 0.09 0.32 -0.07 0.02 0.00 0.00 177.57 177.91 1p1n h LEU 239 N 0.38 0.87 -0.01 2.57 3.38 -1.23 -0.54 115.31 120.73 1p1n h LEU 239 Ca 0.10 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1p1n h LEU 239 Cb -0.02 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 1p1n h LEU 239 CO -0.02 0.76 0.00 0.50 0.09 0.00 0.00 178.44 179.77 1p1n h LYS 240 N 0.92 0.01 -0.61 1.13 3.64 -0.81 -0.90 116.57 119.95 1p1n h LYS 240 Ca 0.23 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.58 1p1n h LYS 240 Cb 0.12 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 1p1n h LYS 240 CO -0.03 0.14 0.27 -0.07 -2.27 0.00 0.00 179.45 177.49 1p1n h LEU 241 N -0.12 0.79 -0.26 5.20 3.38 -0.78 -1.92 115.31 121.60 1p1n h LEU 241 Ca 0.00 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 1p1n h LEU 241 Cb 0.13 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1p1n h LEU 241 CO -0.00 0.69 -0.17 -1.13 0.09 0.00 0.00 178.44 177.92 1p1n h ASN 242 N 0.87 0.60 0.00 -0.43 -1.24 -0.88 -0.42 115.58 114.08 1p1n h ASN 242 Ca 0.21 -0.43 -0.05 0.00 0.71 0.00 0.00 56.30 56.74 1p1n h ASN 242 Cb 0.13 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 39.00 1p1n h ASN 242 CO -0.02 0.90 -0.13 -0.33 -1.29 0.00 0.00 177.43 176.56 1p1n h GLU 243 N 0.30 0.27 -0.68 6.67 5.08 -0.95 -2.29 114.58 122.98 1p1n h GLU 243 Ca 0.05 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1p1n h GLU 243 Cb 0.69 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1p1n h GLU 243 CO 0.05 0.41 0.00 0.00 -1.00 0.00 0.00 179.01 178.47 1p1n n GLN 244 N -4.26 3.07 -0.81 2.33 10.64 -0.74 -4.93 117.38 122.69 1p1n n GLN 244 Ca -0.00 -1.86 0.00 0.00 -1.83 0.00 0.00 57.00 53.31 1p1n n GLN 244 Cb 0.28 -1.82 0.00 0.00 -0.86 0.00 0.00 30.24 27.83 1p1n n GLN 244 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1p1n n GLY 245 N 0.58 0.44 0.30 2.61 0.00 -0.86 -4.90 105.19 103.36 1p1n n GLY 245 Ca 0.17 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.16 1p1n n GLY 245 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1p1n h LEU 246 N 0.00 0.85 -0.42 0.99 6.46 -1.30 -2.43 115.31 119.46 1p1n h LEU 246 Ca 0.00 -0.01 -0.05 0.00 -0.12 0.00 0.00 57.88 57.70 1p1n h LEU 246 Cb 0.12 -0.20 -0.02 0.00 -0.73 0.00 0.00 40.66 39.84 1p1n h LEU 246 CO 0.00 0.60 0.08 -0.07 -0.62 0.00 0.00 178.44 178.43 1p1n h LEU 247 N 1.01 0.66 -0.85 2.25 3.38 -1.84 -0.30 115.31 119.62 1p1n h LEU 247 Ca 0.30 -0.25 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 1p1n h LEU 247 Cb -0.04 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1p1n h LEU 247 CO -0.09 0.75 -0.42 0.44 0.09 0.00 0.00 178.44 179.20 1p1n h ASP 248 N 0.56 0.34 -0.54 -0.43 3.32 -1.88 -0.91 116.42 116.88 1p1n h ASP 248 Ca 0.13 -0.15 -0.07 0.00 0.02 0.00 0.00 57.03 56.96 1p1n h ASP 248 Cb 0.36 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 1p1n h ASP 248 CO 0.01 0.73 0.07 0.50 -1.72 0.00 0.00 179.24 178.83 1p1n h LYS 249 N 0.27 0.90 -0.53 3.56 3.64 -1.28 -1.52 116.57 121.62 1p1n h LYS 249 Ca 0.02 -0.25 -0.09 0.00 -1.27 0.00 0.00 60.65 59.06 1p1n h LYS 249 Cb 0.86 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.56 1p1n h LYS 249 CO 0.07 0.89 -0.03 1.25 -2.27 0.00 0.00 179.45 179.35 1p1n h LEU 250 N 0.79 0.91 -0.32 5.20 5.85 -0.68 -1.90 115.31 125.15 1p1n h LEU 250 Ca 0.16 -0.25 -0.09 0.00 0.84 0.00 0.00 57.88 58.54 1p1n h LEU 250 Cb 0.43 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1p1n h LEU 250 CO 0.01 0.98 -0.16 0.50 -0.34 0.00 0.00 178.44 179.44 1p1n h LYS 251 N 0.85 0.68 -0.60 1.25 3.64 -0.92 -2.64 116.57 118.83 1p1n h LYS 251 Ca 0.15 -0.30 -0.04 0.00 -1.27 0.00 0.00 60.65 59.19 1p1n h LYS 251 Cb 0.55 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.32 1p1n h LYS 251 CO 0.03 0.89 0.21 -0.91 -2.27 0.00 0.00 179.45 177.40 1p1n h ASN 252 N 0.45 0.83 -0.31 4.20 2.35 -1.20 0.14 115.58 122.04 1p1n h ASN 252 Ca 0.07 -0.13 0.02 0.00 -0.55 0.00 0.00 56.30 55.71 1p1n h ASN 252 Cb 0.69 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.82 1p1n h ASN 252 CO 0.05 0.77 0.17 0.50 -1.65 0.00 0.00 177.43 177.26 1p1n h LYS 253 N 0.88 0.34 0.00 0.81 3.64 -1.20 0.24 116.57 121.27 1p1n h LYS 253 Ca 0.20 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 1p1n h LYS 253 Cb 0.22 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1p1n h LYS 253 CO -0.01 0.22 -0.71 0.91 -2.27 0.00 0.00 179.45 177.59 1p1n n TRP 254 N -4.93 0.11 -0.07 1.91 7.02 -1.01 -3.85 117.44 116.63 1p1n n TRP 254 Ca -0.01 0.03 -0.14 0.00 -1.02 0.00 0.00 57.50 56.37 1p1n n TRP 254 Cb 0.06 -0.29 -0.05 0.00 -2.42 0.00 0.00 31.31 28.62 1p1n n TRP 254 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 1p1n n TRP 255 N -1.66 0.00 -0.08 -5.99 8.01 0.47 -4.76 117.44 113.42 1p1n n TRP 255 Ca 0.04 0.00 -0.09 0.00 -1.31 0.00 0.00 57.50 56.14 1p1n n TRP 255 Cb 0.37 -0.51 -0.12 0.00 -2.01 0.00 0.00 31.31 29.04 1p1n n TRP 255 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 1p1n n TYR 256 N -3.93 0.00 0.07 -5.99 4.01 -0.93 -3.76 117.16 106.63 1p1n n TYR 256 Ca -0.24 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.53 1p1n n TYR 256 Cb 0.58 -0.80 0.43 0.00 -0.31 0.00 0.00 39.34 39.23 1p1n n TYR 256 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1p1n h ASP 257 N 0.00 0.33 -0.48 7.72 5.19 -0.70 -1.81 116.42 126.66 1p1n h ASP 257 Ca -0.45 -0.03 0.00 0.00 -0.62 0.00 0.00 57.03 55.93 1p1n h ASP 257 Cb 1.95 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 41.38 1p1n h ASP 257 CO 0.01 0.33 0.00 0.29 -3.12 0.00 0.00 179.24 176.74 1p1n n LYS 258 N -4.40 2.25 -1.62 3.56 4.76 -1.25 -4.98 118.16 116.48 1p1n n LYS 258 Ca 0.01 -1.93 -0.48 0.00 -2.87 0.00 0.00 58.31 53.04 1p1n n LYS 258 Cb 0.15 -1.44 -0.04 0.00 -1.84 0.00 0.00 35.03 31.86 1p1n n LYS 258 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1p1n n GLY 259 N 1.37 0.48 0.74 0.72 0.00 -0.68 -4.89 105.19 102.93 1p1n n GLY 259 Ca 0.18 0.56 0.07 0.00 0.00 0.00 0.00 46.02 46.83 1p1n n GLY 259 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1p1n n GLU 260 N 2.14 2.39 0.00 1.61 1.02 0.17 -5.03 120.64 122.94 1p1n n GLU 260 Ca 0.15 -1.99 0.02 0.00 -0.02 0.00 0.00 57.16 55.32 1p1n n GLU 260 Cb 0.27 -1.32 0.02 0.00 -0.02 0.00 0.00 31.44 30.38 1p1n n GLU 260 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31