#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b4j s ILE 2 N 0.00 4.50 0.01 2.41 1.09 -1.26 -4.97 121.20 122.98 1b4j s ILE 2 Ca 0.00 -1.50 -0.30 0.00 -1.10 0.00 0.00 60.65 57.75 1b4j s ILE 2 Cb 0.00 -4.90 -0.07 0.00 -1.06 0.00 0.00 42.46 36.43 1b4j s ILE 2 CO 0.00 -1.68 1.63 -0.69 -0.10 0.00 0.00 174.94 174.10 1b4j s VAL 3 N 3.29 3.36 -0.11 2.92 1.01 -1.26 -4.63 120.40 124.98 1b4j s VAL 3 Ca 0.39 0.65 -0.08 0.00 0.00 0.00 0.00 61.98 62.94 1b4j s VAL 3 Cb -0.03 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 1b4j s VAL 3 CO -0.07 -0.03 0.17 -0.04 0.00 0.00 0.00 175.10 175.13 1b4j s MET 4 N 3.25 3.49 -0.04 2.72 -1.94 -1.26 0.37 119.30 125.89 1b4j s MET 4 Ca 0.73 -0.07 0.01 0.00 -1.71 0.00 0.00 55.69 54.64 1b4j s MET 4 Cb -0.36 -3.19 0.02 0.00 2.01 0.00 0.00 34.83 33.31 1b4j s MET 4 CO 0.31 0.77 -0.04 0.99 -0.01 0.00 0.00 175.02 177.04 1b4j s THR 5 N -1.04 0.46 0.18 2.05 2.01 -0.75 -4.48 115.64 114.07 1b4j s THR 5 Ca 0.16 -0.08 0.05 0.00 0.31 0.00 0.00 61.69 62.13 1b4j s THR 5 Cb -0.13 -0.49 -0.04 0.00 0.01 0.00 0.00 72.50 71.85 1b4j s THR 5 CO 0.05 0.20 0.17 -1.10 -0.69 0.00 0.00 174.62 173.26 1b4j s GLN 6 N 0.91 2.99 -0.28 4.92 -0.21 -1.26 -1.09 119.66 125.63 1b4j s GLN 6 Ca -0.11 -0.87 -0.18 0.00 0.02 0.00 0.00 55.36 54.21 1b4j s GLN 6 Cb -0.14 -2.67 0.08 0.00 1.00 0.00 0.00 33.01 31.27 1b4j s GLN 6 CO -0.00 0.47 0.70 0.45 -2.12 0.00 0.00 175.29 174.78 1b4j s SER 7 N -3.30 -0.90 1.07 5.90 0.15 -0.93 -4.63 113.70 111.07 1b4j s SER 7 Ca 0.32 1.50 -0.13 0.00 0.70 0.00 0.00 55.95 58.33 1b4j s SER 7 Cb -0.10 1.41 0.18 0.00 -1.71 0.00 0.00 66.02 65.80 1b4j s SER 7 CO 0.24 -0.24 0.89 -0.81 1.20 0.00 0.00 173.24 174.52 1b4j n PRO 8 N 3.91 -1.55 0.10 5.44 -0.04 -1.26 0.14 135.00 141.74 1b4j n PRO 8 Ca -0.19 -1.39 -0.22 0.00 -0.04 0.00 0.00 63.50 61.67 1b4j n PRO 8 Cb 0.58 -1.06 -0.13 0.00 -0.04 0.00 0.00 33.50 32.85 1b4j n PRO 8 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1b4j h LYS 9 N 0.00 0.57 -2.59 0.54 3.11 -1.83 -3.42 116.57 112.95 1b4j h LYS 9 Ca -0.30 -0.80 -0.11 0.00 -2.81 0.00 0.00 60.65 56.63 1b4j h LYS 9 Cb 0.87 0.27 -0.27 0.00 -1.00 0.00 0.00 32.23 32.11 1b4j h LYS 9 CO 0.21 1.36 -0.32 0.45 -2.81 0.00 0.00 179.45 178.35 1b4j s SER 10 N -7.42 -0.42 0.01 4.20 0.15 -1.26 -2.10 113.70 106.86 1b4j s SER 10 Ca -0.09 0.94 0.07 0.00 0.70 0.00 0.00 55.95 57.57 1b4j s SER 10 Cb 0.06 0.98 -0.02 0.00 -1.71 0.00 0.00 66.02 65.33 1b4j s SER 10 CO 0.93 -0.21 -0.22 -0.32 1.20 0.00 0.00 173.24 174.62 1b4j s MET 11 N 1.84 1.63 -0.28 5.44 1.75 -0.99 -4.97 119.30 123.72 1b4j s MET 11 Ca -0.07 -0.88 -0.12 0.00 -1.25 0.00 0.00 55.69 53.37 1b4j s MET 11 Cb -0.10 -1.67 -0.05 0.00 2.84 0.00 0.00 34.83 35.86 1b4j s MET 11 CO -0.13 0.44 0.24 0.71 -0.65 0.00 0.00 175.02 175.63 1b4j s TYR 12 N -0.65 3.23 0.31 4.11 1.51 -1.25 -2.36 117.35 122.24 1b4j s TYR 12 Ca 0.08 0.20 0.11 0.00 -1.01 0.00 0.00 57.07 56.45 1b4j s TYR 12 Cb -0.09 -2.43 -0.06 0.00 -0.11 0.00 0.00 41.96 39.28 1b4j s TYR 12 CO 0.01 -0.17 -0.14 0.14 -1.11 0.00 0.00 175.55 174.27 1b4j s VAL 13 N 1.82 2.43 -0.12 0.71 -7.23 0.65 -4.71 120.40 113.94 1b4j s VAL 13 Ca 0.09 -2.30 -0.04 0.00 -1.81 0.00 0.00 61.98 57.92 1b4j s VAL 13 Cb -0.16 -2.47 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 1b4j s VAL 13 CO 0.11 -0.31 0.05 -0.44 -0.31 0.00 0.00 175.10 174.19 1b4j s SER 14 N -3.56 5.63 0.08 4.85 0.01 -1.26 -0.56 113.70 118.89 1b4j s SER 14 Ca 0.31 0.22 -0.37 0.00 1.31 0.00 0.00 55.95 57.42 1b4j s SER 14 Cb -0.02 -1.75 -0.17 0.00 0.21 0.00 0.00 66.02 64.29 1b4j s SER 14 CO 0.16 0.34 1.27 0.00 0.41 0.00 0.00 173.24 175.42 1b4j n ILE 15 N 2.42 0.13 -2.46 1.44 0.13 -1.26 -3.14 119.36 116.61 1b4j n ILE 15 Ca -0.19 -0.03 -0.03 0.00 -1.10 0.00 0.00 62.75 61.40 1b4j n ILE 15 Cb 0.54 -0.68 0.02 0.00 -0.84 0.00 0.00 39.64 38.67 1b4j n ILE 15 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1b4j n GLY 16 N 2.29 -0.66 3.54 4.50 0.00 -0.65 -4.90 105.19 109.31 1b4j n GLY 16 Ca 0.18 0.21 -0.09 0.00 0.00 0.00 0.00 46.02 46.32 1b4j n GLY 16 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1b4j s GLU 17 N -3.30 0.65 -0.06 1.61 -1.05 -1.19 -4.79 118.70 110.57 1b4j s GLU 17 Ca 0.10 1.06 -0.30 0.00 -0.15 0.00 0.00 54.97 55.68 1b4j s GLU 17 Cb -0.01 0.15 -0.06 0.00 -0.44 0.00 0.00 34.13 33.77 1b4j s GLU 17 CO 0.44 -0.14 1.73 0.50 0.95 0.00 0.00 175.26 178.74 1b4j s ARG 18 N 1.30 4.09 0.15 -4.83 3.52 -1.20 -2.48 118.95 119.50 1b4j s ARG 18 Ca -0.08 2.21 0.09 0.00 -0.13 0.00 0.00 55.73 57.82 1b4j s ARG 18 Cb -0.06 -4.04 -0.04 0.00 -1.56 0.00 0.00 34.95 29.25 1b4j s ARG 18 CO -0.14 -0.96 -0.16 0.54 -0.81 0.00 0.00 175.30 173.77 1b4j s VAL 19 N 4.40 2.91 -0.17 7.11 0.11 0.86 -4.95 120.40 130.66 1b4j s VAL 19 Ca 0.77 -1.61 -0.00 0.00 -2.93 0.00 0.00 61.98 58.21 1b4j s VAL 19 Cb -0.34 -2.38 0.04 0.00 -1.53 0.00 0.00 36.38 32.17 1b4j s VAL 19 CO 0.32 0.01 -0.07 -0.89 -3.33 0.00 0.00 175.10 171.14 1b4j s THR 20 N -1.39 1.28 0.08 5.04 2.01 -1.26 -1.74 115.64 119.66 1b4j s THR 20 Ca 0.21 -0.73 -0.04 0.00 0.31 0.00 0.00 61.69 61.44 1b4j s THR 20 Cb -0.10 -1.41 -0.05 0.00 0.01 0.00 0.00 72.50 70.95 1b4j s THR 20 CO 0.12 0.17 0.30 -0.76 -0.69 0.00 0.00 174.62 173.75 1b4j s LEU 21 N 1.56 4.33 0.22 4.42 1.02 -0.45 -4.85 118.68 124.92 1b4j s LEU 21 Ca 0.01 0.50 0.08 0.00 0.02 0.00 0.00 54.13 54.73 1b4j s LEU 21 Cb -0.15 -3.00 -0.04 0.00 0.02 0.00 0.00 46.19 43.01 1b4j s LEU 21 CO -0.08 0.15 0.01 -0.44 0.02 0.00 0.00 176.35 176.01 1b4j s SER 22 N -2.21 4.70 -0.22 2.29 0.01 0.12 -1.87 113.70 116.53 1b4j s SER 22 Ca 0.35 -0.50 -0.16 0.00 1.31 0.00 0.00 55.95 56.95 1b4j s SER 22 Cb -0.13 -0.96 0.06 0.00 0.21 0.00 0.00 66.02 65.21 1b4j s SER 22 CO 0.23 0.05 0.56 0.00 0.41 0.00 0.00 173.24 174.48 1b4j s LYS 24 N 0.91 0.32 0.74 0.00 3.01 -0.25 -0.33 119.74 124.14 1b4j s LYS 24 Ca -0.05 0.20 -0.11 0.00 -1.01 0.00 0.00 55.97 55.00 1b4j s LYS 24 Cb -0.05 -0.74 0.04 0.00 -1.01 0.00 0.00 37.83 36.07 1b4j s LYS 24 CO -0.08 -0.29 1.09 0.00 0.51 0.00 0.00 175.35 176.58 1b4j s ALA 25 N 1.90 2.35 0.02 5.17 0.00 0.41 -1.81 121.76 129.81 1b4j s ALA 25 Ca 0.03 0.28 -0.18 0.00 0.00 0.00 0.00 51.96 52.09 1b4j s ALA 25 Cb -0.12 -3.27 -0.26 0.00 0.00 0.00 0.00 23.12 19.47 1b4j s ALA 25 CO -0.04 -1.61 1.09 1.03 0.00 0.00 0.00 175.76 176.22 1b4j h SER 26 N -0.89 0.68 -3.28 0.00 0.87 -0.34 -3.46 113.55 107.12 1b4j h SER 26 Ca -0.44 -0.80 -0.44 0.00 -1.23 0.00 0.00 61.79 58.88 1b4j h SER 26 Cb 1.23 -0.21 -0.14 0.00 -0.44 0.00 0.00 62.40 62.84 1b4j h SER 26 CO 0.53 1.40 -0.70 -1.83 -0.53 0.00 0.00 176.83 175.69 1b4j s GLU 27 N -3.06 1.37 0.10 2.24 1.03 -1.26 -4.96 118.70 114.16 1b4j s GLU 27 Ca -0.12 -1.65 -0.34 0.00 0.03 0.00 0.00 54.97 52.89 1b4j s GLU 27 Cb 0.04 -1.02 -0.14 0.00 -0.80 0.00 0.00 34.13 32.22 1b4j s GLU 27 CO 0.87 0.09 1.62 0.09 -1.33 0.00 0.00 175.26 176.60 1b4j n ASN 28 N -0.43 3.03 -0.07 0.83 5.03 -1.26 -4.79 115.26 117.60 1b4j n ASN 28 Ca -0.07 1.07 0.06 0.00 0.87 0.00 0.00 54.58 56.51 1b4j n ASN 28 Cb 0.62 -1.39 0.09 0.00 -1.02 0.00 0.00 39.78 38.08 1b4j n ASN 28 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.26 176.76 1b4j n VAL 29 N 3.68 1.57 -1.91 2.41 0.24 -0.79 -5.03 118.33 118.50 1b4j n VAL 29 Ca 0.18 -1.79 -0.13 0.00 -2.04 0.00 0.00 64.34 60.57 1b4j n VAL 29 Cb 0.28 0.03 0.01 0.00 -1.47 0.00 0.00 33.84 32.70 1b4j n VAL 29 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1b4j n ASP 30 N -1.05 -2.26 -2.11 -1.34 2.03 -1.25 -1.80 116.55 108.77 1b4j n ASP 30 Ca 0.10 -0.02 -0.13 0.00 0.52 0.00 0.00 54.79 55.27 1b4j n ASP 30 Cb 0.50 -0.63 -0.02 0.00 -0.72 0.00 0.00 41.12 40.25 1b4j n ASP 30 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 1b4j n THR 31 N 0.11 -0.42 1.00 5.18 -1.04 -0.12 -4.82 114.28 114.18 1b4j n THR 31 Ca -0.03 0.00 0.10 0.00 -2.04 0.00 0.00 64.05 62.08 1b4j n THR 31 Cb 0.26 -1.62 -0.08 0.00 -1.82 0.00 0.00 70.33 67.07 1b4j n THR 31 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1b4j n TYR 32 N -2.93 0.00 -1.99 -1.42 4.01 -0.74 -2.41 117.16 111.68 1b4j n TYR 32 Ca -0.14 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.17 1b4j n TYR 32 Cb 0.55 -0.02 -0.03 0.00 -0.31 0.00 0.00 39.34 39.54 1b4j n TYR 32 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1b4j s VAL 33 N -2.92 3.39 0.33 -0.72 1.01 -1.26 -4.08 120.40 116.15 1b4j s VAL 33 Ca 0.10 0.65 0.08 0.00 0.00 0.00 0.00 61.98 62.81 1b4j s VAL 33 Cb 0.16 -3.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 1b4j s VAL 33 CO 0.82 -0.03 0.21 -0.94 0.00 0.00 0.00 175.10 175.16 1b4j s SER 34 N 2.86 4.98 -0.00 3.32 1.04 -1.24 -4.13 113.70 120.53 1b4j s SER 34 Ca 0.73 -0.63 0.08 0.00 0.48 0.00 0.00 55.95 56.61 1b4j s SER 34 Cb -0.36 -0.86 -0.02 0.00 0.10 0.00 0.00 66.02 64.88 1b4j s SER 34 CO 0.31 -0.31 -0.24 0.26 0.98 0.00 0.00 173.24 174.23 1b4j s TRP 35 N -2.36 2.11 -0.03 5.02 0.52 0.11 -0.85 118.94 123.46 1b4j s TRP 35 Ca 0.39 -0.40 0.04 0.00 0.02 0.00 0.00 56.10 56.15 1b4j s TRP 35 Cb -0.04 -1.34 -0.00 0.00 -1.15 0.00 0.00 33.47 30.94 1b4j s TRP 35 CO 0.24 -0.00 -0.16 0.71 0.02 0.00 0.00 176.95 177.77 1b4j s TYR 36 N -0.61 1.52 -0.15 -1.98 2.02 -0.88 -1.80 117.35 115.48 1b4j s TYR 36 Ca 0.09 -0.39 -0.04 0.00 -0.37 0.00 0.00 57.07 56.37 1b4j s TYR 36 Cb -0.09 -1.02 -0.03 0.00 -0.40 0.00 0.00 41.96 40.42 1b4j s TYR 36 CO -0.00 -0.12 -0.03 -1.14 -1.57 0.00 0.00 175.55 172.69 1b4j s GLN 37 N -0.05 3.59 -0.08 -0.62 0.74 0.96 -1.73 119.66 122.48 1b4j s GLN 37 Ca -0.01 -0.50 -0.03 0.00 0.05 0.00 0.00 55.36 54.88 1b4j s GLN 37 Cb -0.10 -2.91 0.04 0.00 1.10 0.00 0.00 33.01 31.14 1b4j s GLN 37 CO 0.01 0.31 0.09 -1.14 -0.55 0.00 0.00 175.29 174.01 1b4j s GLN 38 N 0.19 -0.02 0.26 1.67 0.74 0.48 -0.59 119.66 122.39 1b4j s GLN 38 Ca -0.01 0.35 -0.12 0.00 0.05 0.00 0.00 55.36 55.62 1b4j s GLN 38 Cb -0.14 -0.68 -0.08 0.00 1.10 0.00 0.00 33.01 33.21 1b4j s GLN 38 CO 0.03 -0.39 0.63 0.15 -0.55 0.00 0.00 175.29 175.16 1b4j s LYS 39 N 2.20 3.91 0.10 1.67 1.02 -1.26 -1.78 119.74 125.60 1b4j s LYS 39 Ca 0.04 0.48 -0.15 0.00 0.02 0.00 0.00 55.97 56.36 1b4j s LYS 39 Cb -0.13 -2.58 0.01 0.00 -0.52 0.00 0.00 37.83 34.61 1b4j s LYS 39 CO -0.05 0.26 0.85 -0.35 -0.92 0.00 0.00 175.35 175.14 1b4j n PRO 40 N -0.15 -0.21 -0.01 -1.68 -0.04 -1.26 -0.39 135.00 131.26 1b4j n PRO 40 Ca 0.01 0.84 -0.09 0.00 -0.04 0.00 0.00 63.50 64.22 1b4j n PRO 40 Cb 0.53 -1.23 0.07 0.00 -0.04 0.00 0.00 33.50 32.82 1b4j n PRO 40 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1b4j h GLU 41 N 0.00 0.58 -7.42 0.54 4.22 -2.06 -3.46 114.58 106.98 1b4j h GLU 41 Ca 0.12 -0.34 -0.49 0.00 0.08 0.00 0.00 59.36 58.73 1b4j h GLU 41 Cb 0.25 0.03 0.10 0.00 0.50 0.00 0.00 28.75 29.64 1b4j h GLU 41 CO -0.53 0.94 0.35 -0.65 -2.18 0.00 0.00 179.01 176.95 1b4j s GLN 42 N -4.09 2.27 0.29 1.92 1.11 0.48 -5.08 119.66 116.57 1b4j s GLN 42 Ca -0.08 0.61 -0.00 0.00 0.01 0.00 0.00 55.36 55.91 1b4j s GLN 42 Cb 0.12 -1.94 -0.04 0.00 -1.01 0.00 0.00 33.01 30.14 1b4j s GLN 42 CO 0.84 -1.48 0.49 -1.54 0.01 0.00 0.00 175.29 173.61 1b4j s SER 43 N -3.99 6.34 0.96 5.90 1.04 -1.26 -4.52 113.70 118.16 1b4j s SER 43 Ca 0.60 0.44 -0.15 0.00 0.48 0.00 0.00 55.95 57.32 1b4j s SER 43 Cb -0.14 -2.03 -0.05 0.00 0.10 0.00 0.00 66.02 63.90 1b4j s SER 43 CO 0.54 -0.20 -0.15 -2.65 0.98 0.00 0.00 173.24 171.76 1b4j n PRO 44 N -1.35 -0.13 -4.03 4.02 -0.02 -1.26 -4.73 135.00 127.49 1b4j n PRO 44 Ca -0.05 -0.02 -0.17 0.00 -2.02 0.00 0.00 63.50 61.25 1b4j n PRO 44 Cb 0.55 -1.45 -0.15 0.00 -0.02 0.00 0.00 33.50 32.43 1b4j n PRO 44 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1b4j s LYS 45 N -2.82 0.39 -0.24 -0.52 2.20 0.24 -4.91 119.74 114.09 1b4j s LYS 45 Ca 0.49 -0.04 -0.26 0.00 -0.36 0.00 0.00 55.97 55.81 1b4j s LYS 45 Cb -0.21 -0.46 -0.00 0.00 -1.51 0.00 0.00 37.83 35.65 1b4j s LYS 45 CO 0.74 -0.04 0.88 -1.17 -0.36 0.00 0.00 175.35 175.40 1b4j s LEU 46 N 0.55 4.09 -0.12 5.43 1.98 -1.26 -0.03 118.68 129.32 1b4j s LEU 46 Ca -0.06 1.12 0.02 0.00 -2.89 0.00 0.00 54.13 52.32 1b4j s LEU 46 Cb -0.09 -3.27 -0.08 0.00 0.66 0.00 0.00 46.19 43.40 1b4j s LEU 46 CO -0.01 -0.55 -0.09 0.18 -1.89 0.00 0.00 176.35 173.99 1b4j n LEU 47 N 6.05 2.68 -3.99 -0.68 4.77 -0.74 -4.79 117.00 120.30 1b4j n LEU 47 Ca 0.07 -0.06 -0.26 0.00 -0.03 0.00 0.00 56.01 55.73 1b4j n LEU 47 Cb 0.47 -0.36 -0.17 0.00 -2.33 0.00 0.00 43.42 41.03 1b4j n LEU 47 CO 0.48 0.66 -0.46 -0.63 -1.33 0.00 0.00 177.39 176.11 1b4j s ILE 48 N -2.24 1.14 0.41 -0.08 -1.09 -1.17 0.08 121.20 118.26 1b4j s ILE 48 Ca -0.15 -0.44 0.05 0.00 -2.23 0.00 0.00 60.65 57.87 1b4j s ILE 48 Cb 0.04 -1.08 -0.06 0.00 -1.58 0.00 0.00 42.46 39.79 1b4j s ILE 48 CO 0.30 0.37 0.03 -0.72 -1.23 0.00 0.00 174.94 173.69 1b4j s TYR 49 N 1.02 2.16 0.00 3.97 1.13 -0.89 0.07 117.35 124.81 1b4j s TYR 49 Ca -0.08 -0.87 0.00 0.00 -1.41 0.00 0.00 57.07 54.72 1b4j s TYR 49 Cb -0.15 -1.56 0.00 0.00 -1.10 0.00 0.00 41.96 39.15 1b4j s TYR 49 CO -0.01 0.22 0.00 0.41 -2.51 0.00 0.00 175.55 173.66 1b4j n GLY 50 N -0.96 1.28 0.11 5.49 0.00 -1.26 -2.47 105.19 107.38 1b4j n GLY 50 Ca -0.08 -0.62 -0.13 0.00 0.00 0.00 0.00 46.02 45.19 1b4j n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b4j n ALA 51 N 6.00 1.49 -3.30 4.61 0.00 -1.01 -3.90 120.51 124.39 1b4j n ALA 51 Ca 0.00 -1.19 -0.23 0.00 0.00 0.00 0.00 53.44 52.02 1b4j n ALA 51 Cb 0.00 -0.12 -0.08 0.00 0.00 0.00 0.00 19.45 19.24 1b4j n ALA 51 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1b4j s SER 52 N -5.91 1.09 -0.23 0.00 1.04 -1.24 -3.97 113.70 104.48 1b4j s SER 52 Ca -0.21 -2.74 -0.03 0.00 0.48 0.00 0.00 55.95 53.45 1b4j s SER 52 Cb 0.07 -0.04 0.10 0.00 0.10 0.00 0.00 66.02 66.25 1b4j s SER 52 CO 0.69 -0.17 0.23 0.20 0.98 0.00 0.00 173.24 175.18 1b4j s ASN 53 N 0.32 1.61 -0.95 7.02 0.01 -1.03 -4.87 114.94 117.05 1b4j s ASN 53 Ca 0.31 -0.43 -0.25 0.00 -0.71 0.00 0.00 52.86 51.78 1b4j s ASN 53 Cb 0.00 0.36 -0.10 0.00 0.41 0.00 0.00 41.25 41.92 1b4j s ASN 53 CO -0.15 -0.35 2.10 -0.13 -1.51 0.00 0.00 177.10 177.05 1b4j s ARG 54 N 2.32 2.09 0.27 -0.60 0.52 -1.26 -2.10 118.95 120.18 1b4j s ARG 54 Ca 0.08 -0.26 -0.26 0.00 -0.52 0.00 0.00 55.73 54.77 1b4j s ARG 54 Cb -0.15 -5.01 -0.16 0.00 0.52 0.00 0.00 34.95 30.15 1b4j s ARG 54 CO -0.19 -4.09 0.44 0.98 0.02 0.00 0.00 175.30 172.46 1b4j n TYR 55 N 16.16 -0.79 -1.20 -0.53 9.36 0.11 -4.52 117.16 135.75 1b4j n TYR 55 Ca 0.43 0.84 -0.55 0.00 3.32 0.00 0.00 57.90 61.93 1b4j n TYR 55 Cb 0.46 -1.93 -0.11 0.00 -0.63 0.00 0.00 39.34 37.13 1b4j n TYR 55 CO 0.00 0.00 0.00 2.41 0.22 0.00 0.00 176.86 179.49 1b4j n THR 56 N -0.31 0.00 -0.19 2.97 -1.04 -1.26 -0.85 114.28 113.60 1b4j n THR 56 Ca 0.15 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.16 1b4j n THR 56 Cb 0.30 -0.45 0.00 0.00 -1.82 0.00 0.00 70.33 68.36 1b4j n THR 56 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1b4j n GLY 57 N 6.29 0.89 3.85 3.41 0.00 -1.26 -5.09 105.19 113.28 1b4j n GLY 57 Ca 0.46 -0.18 -0.37 0.00 0.00 0.00 0.00 46.02 45.94 1b4j n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1b4j s VAL 58 N -2.00 5.45 0.44 1.61 1.01 -0.03 -5.07 120.40 121.82 1b4j s VAL 58 Ca 0.00 0.27 -0.23 0.00 0.00 0.00 0.00 61.98 62.01 1b4j s VAL 58 Cb 0.00 -3.44 -0.08 0.00 0.00 0.00 0.00 36.38 32.86 1b4j s VAL 58 CO 0.00 0.59 1.14 -2.16 0.00 0.00 0.00 175.10 174.67 1b4j s PRO 59 N -0.83 3.85 0.63 2.72 0.04 -1.26 -4.88 135.00 135.27 1b4j s PRO 59 Ca 0.15 1.72 0.30 0.00 0.04 0.00 0.00 61.00 63.21 1b4j s PRO 59 Cb -0.12 -2.45 1.62 0.00 0.04 0.00 0.00 34.50 33.60 1b4j s PRO 59 CO 0.04 -0.46 1.96 0.22 0.04 0.00 0.00 177.00 178.80 1b4j h ASP 60 N 2.16 0.00 -0.22 6.66 3.58 -1.99 -1.54 116.42 125.08 1b4j h ASP 60 Ca -0.49 0.00 0.06 0.00 0.42 0.00 0.00 57.03 57.02 1b4j h ASP 60 Cb 1.24 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.28 1b4j h ASP 60 CO 0.61 0.00 0.37 -0.09 -2.88 0.00 0.00 179.24 177.24 1b4j h ARG 61 N 0.00 0.00 -5.12 0.28 2.43 -1.97 -3.39 114.38 106.61 1b4j h ARG 61 Ca 0.08 0.00 -0.64 0.00 -0.81 0.00 0.00 59.98 58.60 1b4j h ARG 61 Cb 0.76 0.00 -0.23 0.00 -0.42 0.00 0.00 29.97 30.08 1b4j h ARG 61 CO -0.00 0.00 -0.66 -0.06 -1.51 0.00 0.00 179.97 177.74 1b4j s PHE 62 N -4.40 3.03 0.07 2.20 0.40 -0.58 -0.99 117.98 117.71 1b4j s PHE 62 Ca -0.04 -0.47 0.02 0.00 -0.60 0.00 0.00 56.93 55.84 1b4j s PHE 62 Cb 0.13 -2.08 -0.03 0.00 0.51 0.00 0.00 43.02 41.54 1b4j s PHE 62 CO 0.44 -0.25 -0.08 0.95 0.70 0.00 0.00 175.22 176.98 1b4j s THR 63 N 1.00 0.65 0.29 0.64 -4.23 -1.11 -4.86 115.64 108.02 1b4j s THR 63 Ca 0.02 -1.45 0.08 0.00 -1.18 0.00 0.00 61.69 59.16 1b4j s THR 63 Cb -0.14 -1.08 -0.06 0.00 1.34 0.00 0.00 72.50 72.56 1b4j s THR 63 CO 0.02 -0.57 -0.09 -0.83 -0.54 0.00 0.00 174.62 172.60 1b4j s GLY 64 N -2.20 1.90 -0.29 3.99 0.00 -1.26 -2.66 107.32 106.80 1b4j s GLY 64 Ca -0.00 -1.93 -0.23 0.00 0.00 0.00 0.00 44.72 42.55 1b4j s GLY 64 CO -0.01 -1.90 1.09 -1.35 0.00 0.00 0.00 173.10 170.92 1b4j s SER 65 N -3.48 -0.40 0.00 1.64 1.04 -1.23 -4.62 113.70 106.65 1b4j s SER 65 Ca 0.30 0.74 0.00 0.00 0.48 0.00 0.00 55.95 57.46 1b4j s SER 65 Cb 0.02 0.82 0.00 0.00 0.10 0.00 0.00 66.02 66.96 1b4j s SER 65 CO 0.13 -0.13 0.00 0.61 0.98 0.00 0.00 173.24 174.83 1b4j n GLY 66 N 2.38 1.72 1.88 7.32 0.00 -1.26 -2.67 105.19 114.56 1b4j n GLY 66 Ca -0.13 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.83 1b4j n GLY 66 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1b4j n SER 67 N 0.00 -0.00 -0.04 1.61 7.64 -1.18 -4.76 113.62 116.89 1b4j n SER 67 Ca 0.00 0.06 -0.05 0.00 1.01 0.00 0.00 58.87 59.89 1b4j n SER 67 Cb 0.00 0.04 -0.02 0.00 -1.01 0.00 0.00 64.21 63.22 1b4j n SER 67 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1b4j n ALA 68 N -2.62 1.39 0.00 -0.43 0.00 -1.26 -0.94 120.51 116.65 1b4j n ALA 68 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1b4j n ALA 68 Cb 0.00 0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.53 1b4j n ALA 68 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1b4j n THR 69 N -3.82 0.00 -4.75 0.00 -1.04 -1.26 -1.88 114.28 101.53 1b4j n THR 69 Ca -0.08 -0.45 -0.28 0.00 -2.04 0.00 0.00 64.05 61.20 1b4j n THR 69 Cb 0.29 0.95 -0.17 0.00 -1.82 0.00 0.00 70.33 69.58 1b4j n THR 69 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1b4j s ASP 70 N -1.08 2.40 0.23 8.00 2.15 -1.26 -0.44 116.67 126.67 1b4j s ASP 70 Ca 0.00 -0.42 0.04 0.00 0.43 0.00 0.00 52.55 52.59 1b4j s ASP 70 Cb 0.00 -1.10 -0.05 0.00 -0.30 0.00 0.00 42.92 41.47 1b4j s ASP 70 CO 0.00 0.07 0.00 -0.36 -0.17 0.00 0.00 175.17 174.71 1b4j s PHE 71 N 0.66 1.58 -0.22 -5.34 0.40 0.55 -3.07 117.98 112.53 1b4j s PHE 71 Ca -0.14 -0.93 -0.22 0.00 -0.60 0.00 0.00 56.93 55.05 1b4j s PHE 71 Cb -0.16 -0.92 0.06 0.00 0.51 0.00 0.00 43.02 42.51 1b4j s PHE 71 CO 0.04 -0.04 0.62 0.95 0.70 0.00 0.00 175.22 177.48 1b4j s THR 72 N -3.42 0.00 -0.18 0.64 -4.23 -1.09 -2.28 115.64 105.07 1b4j s THR 72 Ca 0.29 -0.01 -0.03 0.00 -1.18 0.00 0.00 61.69 60.76 1b4j s THR 72 Cb 0.06 -0.86 -0.02 0.00 1.34 0.00 0.00 72.50 73.02 1b4j s THR 72 CO 0.09 -0.00 -0.05 -0.22 -0.54 0.00 0.00 174.62 173.89 1b4j s LEU 73 N 0.26 2.98 -0.29 4.79 2.96 -0.78 -3.51 118.68 125.10 1b4j s LEU 73 Ca -0.00 -0.30 -0.01 0.00 -0.22 0.00 0.00 54.13 53.60 1b4j s LEU 73 Cb -0.04 -1.73 0.05 0.00 0.50 0.00 0.00 46.19 44.96 1b4j s LEU 73 CO 0.01 0.07 -0.03 0.28 -1.32 0.00 0.00 176.35 175.37 1b4j s THR 74 N 0.93 2.84 -0.30 3.68 -1.32 -1.09 -1.34 115.64 119.03 1b4j s THR 74 Ca -0.01 -1.38 -0.25 0.00 -1.21 0.00 0.00 61.69 58.84 1b4j s THR 74 Cb -0.15 -2.61 0.01 0.00 -1.51 0.00 0.00 72.50 68.24 1b4j s THR 74 CO 0.01 -0.05 0.89 -0.63 -2.21 0.00 0.00 174.62 172.63 1b4j s ILE 75 N 1.24 4.70 -0.60 5.08 1.01 -0.71 -2.74 121.20 129.18 1b4j s ILE 75 Ca -0.05 1.41 0.22 0.00 0.00 0.00 0.00 60.65 62.23 1b4j s ILE 75 Cb -0.19 -4.24 0.23 0.00 0.01 0.00 0.00 42.46 38.27 1b4j s ILE 75 CO -0.02 -0.31 1.67 -0.24 0.00 0.00 0.00 174.94 176.04 1b4j n SER 76 N 6.41 0.54 -3.15 3.58 2.88 -0.16 -0.10 113.62 123.62 1b4j n SER 76 Ca 0.07 0.63 0.05 0.00 -1.33 0.00 0.00 58.87 58.29 1b4j n SER 76 Cb 0.48 -0.74 -0.01 0.00 -0.75 0.00 0.00 64.21 63.18 1b4j n SER 76 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1b4j s SER 77 N -4.01 -0.38 1.03 -3.46 1.04 -1.26 -3.24 113.70 103.42 1b4j s SER 77 Ca 0.05 0.18 -0.11 0.00 0.48 0.00 0.00 55.95 56.55 1b4j s SER 77 Cb 0.10 1.29 0.21 0.00 0.10 0.00 0.00 66.02 67.72 1b4j s SER 77 CO 0.38 -0.07 1.08 1.33 0.98 0.00 0.00 173.24 176.94 1b4j n VAL 78 N 5.37 0.00 -3.83 5.02 0.24 -1.04 -4.72 118.33 119.38 1b4j n VAL 78 Ca -0.03 -0.19 -0.06 0.00 -2.04 0.00 0.00 64.34 62.02 1b4j n VAL 78 Cb 0.55 -0.99 -0.01 0.00 -1.47 0.00 0.00 33.84 31.92 1b4j n VAL 78 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1b4j s GLN 79 N -4.52 1.68 0.42 7.34 -0.44 -1.26 -1.64 119.66 121.25 1b4j s GLN 79 Ca 0.67 -0.97 0.19 0.00 -2.50 0.00 0.00 55.36 52.75 1b4j s GLN 79 Cb -0.24 0.55 1.12 0.00 -1.64 0.00 0.00 33.01 32.79 1b4j s GLN 79 CO 0.61 -0.77 1.85 0.00 0.50 0.00 0.00 175.29 177.47 1b4j h ALA 80 N 2.00 2.26 0.31 1.58 0.00 -1.97 -2.60 119.26 120.84 1b4j h ALA 80 Ca -0.23 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1b4j h ALA 80 Cb 1.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1b4j h ALA 80 CO 0.27 -0.56 -0.15 0.93 0.00 0.00 0.00 179.25 179.75 1b4j h GLU 81 N 0.38 -0.40 -1.89 0.00 5.08 -2.01 -3.33 114.58 112.41 1b4j h GLU 81 Ca 0.48 0.03 0.56 0.00 -1.00 0.00 0.00 59.36 59.43 1b4j h GLU 81 Cb 1.26 0.09 -0.09 0.00 0.50 0.00 0.00 28.75 30.51 1b4j h GLU 81 CO -0.18 -0.27 1.35 -0.25 -1.00 0.00 0.00 179.01 178.66 1b4j n ASP 82 N -4.29 0.03 -4.55 1.42 9.92 -0.99 -4.27 116.55 113.80 1b4j n ASP 82 Ca -0.05 1.03 -0.39 0.00 -0.53 0.00 0.00 54.79 54.84 1b4j n ASP 82 Cb 0.16 -0.51 -0.03 0.00 -0.64 0.00 0.00 41.12 40.10 1b4j n ASP 82 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1b4j s LEU 83 N -7.98 3.29 0.00 0.64 1.02 -1.12 -4.81 118.68 109.73 1b4j s LEU 83 Ca -0.05 0.29 0.00 0.00 0.02 0.00 0.00 54.13 54.39 1b4j s LEU 83 Cb 0.27 -2.61 0.00 0.00 0.02 0.00 0.00 46.19 43.87 1b4j s LEU 83 CO 0.87 -2.25 0.00 0.00 0.02 0.00 0.00 176.35 174.99 1b4j n ALA 84 N 12.09 0.00 -2.72 4.21 0.00 -1.25 -4.95 120.51 127.89 1b4j n ALA 84 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.28 1b4j n ALA 84 Cb 0.51 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.86 1b4j n ALA 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1b4j s ASP 85 N 2.00 4.92 -0.05 0.00 1.01 -0.73 -0.41 116.67 123.41 1b4j s ASP 85 Ca 0.00 0.01 0.06 0.00 0.71 0.00 0.00 52.55 53.33 1b4j s ASP 85 Cb 0.00 -1.46 -0.01 0.00 1.01 0.00 0.00 42.92 42.46 1b4j s ASP 85 CO 0.00 0.31 -0.24 -0.31 0.21 0.00 0.00 175.17 175.14 1b4j s TYR 86 N -0.50 2.35 0.03 4.23 2.02 -0.80 -0.39 117.35 124.29 1b4j s TYR 86 Ca 0.08 -0.67 0.07 0.00 -0.37 0.00 0.00 57.07 56.18 1b4j s TYR 86 Cb -0.12 -1.54 -0.02 0.00 -0.40 0.00 0.00 41.96 39.88 1b4j s TYR 86 CO 0.02 -0.19 -0.20 -1.01 -1.57 0.00 0.00 175.55 172.60 1b4j s HIS 87 N -0.20 1.75 -0.21 2.71 3.76 -0.71 -0.80 115.29 121.59 1b4j s HIS 87 Ca -0.02 -0.36 -0.08 0.00 -0.15 0.00 0.00 55.06 54.45 1b4j s HIS 87 Cb -0.13 -1.06 -0.04 0.00 1.11 0.00 0.00 32.58 32.46 1b4j s HIS 87 CO 0.03 0.05 0.08 0.00 -0.85 0.00 0.00 174.74 174.05 1b4j n GLY 89 N 4.15 3.69 3.55 0.00 0.00 -0.03 -0.78 105.19 115.77 1b4j n GLY 89 Ca -0.16 -2.13 -0.10 0.00 0.00 0.00 0.00 46.02 43.63 1b4j n GLY 89 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1b4j s GLN 90 N -0.70 0.67 -0.41 1.61 -0.44 -0.99 -3.66 119.66 115.75 1b4j s GLN 90 Ca 0.00 -0.00 0.00 0.00 -2.50 0.00 0.00 55.36 52.86 1b4j s GLN 90 Cb 0.00 0.31 0.23 0.00 -1.64 0.00 0.00 33.01 31.91 1b4j s GLN 90 CO 0.00 -0.24 1.01 -1.13 0.50 0.00 0.00 175.29 175.42 1b4j n SER 91 N 0.39 -2.19 0.00 6.67 3.41 -1.26 -3.85 113.62 116.79 1b4j n SER 91 Ca -0.10 -2.12 0.00 0.00 -0.26 0.00 0.00 58.87 56.39 1b4j n SER 91 Cb 0.59 1.20 0.00 0.00 -0.26 0.00 0.00 64.21 65.74 1b4j n SER 91 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1b4j n TYR 92 N 2.19 0.00 -3.65 7.33 9.36 -1.26 -4.97 117.16 126.16 1b4j n TYR 92 Ca 0.10 0.00 -0.08 0.00 3.32 0.00 0.00 57.90 61.24 1b4j n TYR 92 Cb 0.64 0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 39.28 1b4j n TYR 92 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1b4j s ASN 93 N 0.00 -0.90 0.02 2.98 3.84 -1.26 -5.13 114.94 114.49 1b4j s ASN 93 Ca 0.00 1.45 -0.30 0.00 0.21 0.00 0.00 52.86 54.22 1b4j s ASN 93 Cb 0.00 1.32 -0.04 0.00 -0.55 0.00 0.00 41.25 41.98 1b4j s ASN 93 CO 0.00 -0.23 1.07 -0.31 -2.79 0.00 0.00 177.10 174.84 1b4j s TYR 94 N 1.58 3.56 0.42 0.43 2.02 -1.26 -2.88 117.35 121.22 1b4j s TYR 94 Ca -0.10 1.53 -0.08 0.00 -0.37 0.00 0.00 57.07 58.05 1b4j s TYR 94 Cb -0.05 -3.25 -0.05 0.00 -0.40 0.00 0.00 41.96 38.20 1b4j s TYR 94 CO -0.19 -0.56 0.75 -1.25 -1.57 0.00 0.00 175.55 172.74 1b4j s PRO 95 N 1.08 3.68 0.79 -1.71 0.04 -1.26 -4.97 135.00 132.64 1b4j s PRO 95 Ca 0.55 0.32 -0.12 0.00 0.04 0.00 0.00 61.00 61.79 1b4j s PRO 95 Cb -0.24 -2.41 0.07 0.00 0.04 0.00 0.00 34.50 31.95 1b4j s PRO 95 CO 0.28 -0.07 1.14 -0.06 0.04 0.00 0.00 177.00 178.33 1b4j s PHE 96 N -2.47 2.15 0.01 0.56 0.08 -1.14 -4.74 117.98 112.43 1b4j s PHE 96 Ca 0.49 1.64 -0.10 0.00 0.12 0.00 0.00 56.93 59.09 1b4j s PHE 96 Cb -0.10 -3.27 0.01 0.00 -0.57 0.00 0.00 43.02 39.08 1b4j s PHE 96 CO 0.36 -2.31 0.19 0.95 -0.10 0.00 0.00 175.22 174.31 1b4j s THR 97 N -2.50 0.08 0.29 0.64 -4.23 -1.25 -4.98 115.64 103.69 1b4j s THR 97 Ca 0.67 -0.70 0.10 0.00 -1.18 0.00 0.00 61.69 60.59 1b4j s THR 97 Cb -0.22 -0.60 -0.05 0.00 1.34 0.00 0.00 72.50 72.97 1b4j s THR 97 CO 0.52 -0.38 -0.08 -0.36 -0.54 0.00 0.00 174.62 173.77 1b4j s PHE 98 N -1.68 2.50 0.40 3.99 0.40 -1.26 -2.33 117.98 120.00 1b4j s PHE 98 Ca -0.12 -0.32 0.00 0.00 -0.60 0.00 0.00 56.93 55.89 1b4j s PHE 98 Cb -0.05 -1.19 -0.02 0.00 0.51 0.00 0.00 43.02 42.27 1b4j s PHE 98 CO 0.01 0.62 0.61 0.20 0.70 0.00 0.00 175.22 177.37 1b4j s GLY 99 N -3.62 1.47 0.57 4.36 0.00 0.04 -4.60 107.32 105.53 1b4j s GLY 99 Ca 0.32 -0.99 0.29 0.00 0.00 0.00 0.00 44.72 44.33 1b4j s GLY 99 CO 0.18 -0.88 1.92 1.48 0.00 0.00 0.00 173.10 175.81 1b4j h SER 100 N 0.57 0.00 -5.00 1.64 4.64 -1.91 -3.41 113.55 110.07 1b4j h SER 100 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1b4j h SER 100 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1b4j h SER 100 CO 0.59 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.16 1b4j n GLY 101 N -1.57 1.22 3.32 -0.77 0.00 -1.26 -5.02 105.19 101.10 1b4j n GLY 101 Ca 0.10 -2.02 -0.05 0.00 0.00 0.00 0.00 46.02 44.06 1b4j n GLY 101 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1b4j s THR 102 N -1.87 -0.77 0.43 2.61 -1.32 0.02 -4.67 115.64 110.06 1b4j s THR 102 Ca 0.00 0.08 -0.23 0.00 -1.21 0.00 0.00 61.69 60.33 1b4j s THR 102 Cb 0.00 -0.81 -0.09 0.00 -1.51 0.00 0.00 72.50 70.10 1b4j s THR 102 CO 0.00 0.02 1.06 -0.75 -2.21 0.00 0.00 174.62 172.74 1b4j s LYS 103 N 2.71 4.02 -0.21 7.08 2.20 -0.89 -1.91 119.74 132.74 1b4j s LYS 103 Ca 0.01 1.49 -0.02 0.00 -0.36 0.00 0.00 55.97 57.09 1b4j s LYS 103 Cb -0.13 -2.40 -0.00 0.00 -1.51 0.00 0.00 37.83 33.79 1b4j s LYS 103 CO -0.16 -0.26 -0.09 -1.17 -0.36 0.00 0.00 175.35 173.32 1b4j s LEU 104 N -2.92 2.67 -0.02 5.43 2.96 0.46 -2.34 118.68 124.92 1b4j s LEU 104 Ca 0.61 -0.46 0.02 0.00 -0.22 0.00 0.00 54.13 54.08 1b4j s LEU 104 Cb -0.21 -1.66 0.00 0.00 0.50 0.00 0.00 46.19 44.82 1b4j s LEU 104 CO 0.26 -0.01 -0.09 -1.61 -1.32 0.00 0.00 176.35 173.58 1b4j s GLU 105 N 1.41 0.89 0.46 1.98 2.02 -1.00 -3.86 118.70 120.60 1b4j s GLU 105 Ca 0.05 -0.30 -0.25 0.00 0.02 0.00 0.00 54.97 54.50 1b4j s GLU 105 Cb -0.14 -0.84 -0.08 0.00 0.10 0.00 0.00 34.13 33.17 1b4j s GLU 105 CO -0.06 0.12 1.34 -1.50 0.02 0.00 0.00 175.26 175.18 1b4j s ILE 106 N 0.13 2.37 0.20 -1.63 2.07 -1.25 -0.26 121.20 122.84 1b4j s ILE 106 Ca -0.02 0.32 -0.00 0.00 -1.41 0.00 0.00 60.65 59.53 1b4j s ILE 106 Cb -0.08 -3.18 -0.04 0.00 0.13 0.00 0.00 42.46 39.29 1b4j s ILE 106 CO 0.00 0.03 0.39 -0.75 -1.91 0.00 0.00 174.94 172.70 1b4j s LYS 107 N -2.50 3.51 0.00 3.50 2.20 0.27 -4.73 119.74 122.00 1b4j s LYS 107 Ca 0.62 -0.37 0.00 0.00 -0.36 0.00 0.00 55.97 55.86 1b4j s LYS 107 Cb -0.39 -2.85 0.00 0.00 -1.51 0.00 0.00 37.83 33.08 1b4j s LYS 107 CO 0.50 0.40 0.00 2.89 -0.36 0.00 0.00 175.35 178.78 1b4j n ARG 108 N -0.70 0.00 -3.34 4.03 1.85 -1.26 -4.87 116.66 112.37 1b4j n ARG 108 Ca -0.05 0.00 -0.38 0.00 -1.00 0.00 0.00 57.85 56.42 1b4j n ARG 108 Cb 0.54 0.00 -0.06 0.00 -1.05 0.00 0.00 32.46 31.89 1b4j n ARG 108 CO 0.00 0.00 0.00 -0.08 -0.01 0.00 0.00 177.63 177.54 1b4j s THR 109 N -2.89 4.98 0.35 8.89 -1.32 -1.26 -5.02 115.64 119.36 1b4j s THR 109 Ca 0.00 1.04 -0.17 0.00 -1.21 0.00 0.00 61.69 61.35 1b4j s THR 109 Cb 0.00 -3.83 -0.13 0.00 -1.51 0.00 0.00 72.50 67.04 1b4j s THR 109 CO 0.00 0.48 0.04 0.52 -2.21 0.00 0.00 174.62 173.45 1b4j n VAL 110 N 2.44 0.44 -3.44 5.08 0.31 -1.26 -4.91 118.33 117.00 1b4j n VAL 110 Ca -0.10 -0.41 -0.17 0.00 -0.01 0.00 0.00 64.34 63.65 1b4j n VAL 110 Cb 0.51 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 33.33 1b4j n VAL 110 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1b4j s ALA 111 N -1.44 -0.43 0.35 3.52 0.00 -0.79 -4.92 121.76 118.06 1b4j s ALA 111 Ca 0.49 0.08 -0.28 0.00 0.00 0.00 0.00 51.96 52.25 1b4j s ALA 111 Cb -0.51 -1.56 -0.12 0.00 0.00 0.00 0.00 23.12 20.93 1b4j s ALA 111 CO 0.52 -1.43 1.25 0.00 0.00 0.00 0.00 175.76 176.11 1b4j n ALA 112 N 5.32 1.12 -1.80 0.00 0.00 -1.26 -1.92 120.51 121.97 1b4j n ALA 112 Ca -0.04 0.35 -0.30 0.00 0.00 0.00 0.00 53.44 53.45 1b4j n ALA 112 Cb 0.48 -2.23 0.07 0.00 0.00 0.00 0.00 19.45 17.77 1b4j n ALA 112 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1b4j s PRO 113 N -1.90 2.41 -0.25 0.00 0.04 -1.26 -4.55 135.00 129.50 1b4j s PRO 113 Ca 0.57 0.42 0.01 0.00 0.04 0.00 0.00 61.00 62.04 1b4j s PRO 113 Cb -0.57 -1.97 0.04 0.00 0.04 0.00 0.00 34.50 32.04 1b4j s PRO 113 CO 0.61 -1.34 -0.11 -1.12 0.04 0.00 0.00 177.00 175.08 1b4j s SER 114 N -4.29 4.20 -0.11 6.66 0.01 -0.07 -4.85 113.70 115.26 1b4j s SER 114 Ca 0.60 -1.14 -0.11 0.00 1.31 0.00 0.00 55.95 56.60 1b4j s SER 114 Cb -0.12 -1.57 -0.05 0.00 0.21 0.00 0.00 66.02 64.49 1b4j s SER 114 CO 0.52 -0.15 0.25 -0.69 0.41 0.00 0.00 173.24 173.58 1b4j s VAL 115 N 1.19 5.32 0.01 3.43 1.01 -1.23 0.07 120.40 130.19 1b4j s VAL 115 Ca -0.04 0.47 0.03 0.00 0.00 0.00 0.00 61.98 62.44 1b4j s VAL 115 Cb -0.18 -3.55 -0.01 0.00 0.00 0.00 0.00 36.38 32.64 1b4j s VAL 115 CO -0.06 0.53 -0.09 -0.36 0.00 0.00 0.00 175.10 175.11 1b4j s PHE 116 N -0.49 0.83 -0.05 5.22 0.08 0.04 -4.95 117.98 118.66 1b4j s PHE 116 Ca 0.17 -0.21 0.06 0.00 0.12 0.00 0.00 56.93 57.07 1b4j s PHE 116 Cb -0.13 -0.52 -0.02 0.00 -0.57 0.00 0.00 43.02 41.78 1b4j s PHE 116 CO 0.06 -0.01 -0.22 -1.50 -0.10 0.00 0.00 175.22 173.44 1b4j s ILE 117 N -0.42 2.35 -0.15 0.64 2.07 -1.26 -0.34 121.20 124.10 1b4j s ILE 117 Ca 0.02 -0.98 0.02 0.00 -1.41 0.00 0.00 60.65 58.30 1b4j s ILE 117 Cb -0.05 -1.87 0.01 0.00 0.13 0.00 0.00 42.46 40.69 1b4j s ILE 117 CO -0.00 0.58 -0.20 -0.36 -1.91 0.00 0.00 174.94 173.05 1b4j s PHE 118 N -0.42 2.56 0.48 3.50 0.08 -1.12 -5.04 117.98 118.02 1b4j s PHE 118 Ca 0.04 -1.37 -0.21 0.00 0.12 0.00 0.00 56.93 55.52 1b4j s PHE 118 Cb -0.12 -1.77 -0.08 0.00 -0.57 0.00 0.00 43.02 40.48 1b4j s PHE 118 CO 0.01 -0.66 1.06 -2.14 -0.10 0.00 0.00 175.22 173.40 1b4j s PRO 119 N 1.04 3.79 0.82 0.24 0.02 -1.26 -3.43 135.00 136.22 1b4j s PRO 119 Ca -0.02 1.45 -0.13 0.00 0.02 0.00 0.00 61.00 62.31 1b4j s PRO 119 Cb -0.14 -2.17 0.08 0.00 0.02 0.00 0.00 34.50 32.29 1b4j s PRO 119 CO -0.06 -0.45 1.15 -0.35 -0.33 0.00 0.00 177.00 176.96 1b4j n PRO 120 N -0.84 0.12 -2.38 5.54 -0.04 -1.26 -4.94 135.00 131.21 1b4j n PRO 120 Ca 0.09 0.12 -0.28 0.00 -0.04 0.00 0.00 63.50 63.39 1b4j n PRO 120 Cb 0.52 -2.40 0.02 0.00 -0.04 0.00 0.00 33.50 31.60 1b4j n PRO 120 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1b4j s SER 121 N -2.13 5.90 0.22 3.54 1.04 -1.26 -4.99 113.70 116.02 1b4j s SER 121 Ca 0.72 0.91 -0.04 0.00 0.48 0.00 0.00 55.95 58.03 1b4j s SER 121 Cb -0.29 -2.01 0.21 0.00 0.10 0.00 0.00 66.02 64.03 1b4j s SER 121 CO 0.52 -0.88 1.64 0.44 0.98 0.00 0.00 173.24 175.94 1b4j h ASP 122 N -0.08 0.76 -0.36 7.02 3.32 -2.00 -2.73 116.42 122.35 1b4j h ASP 122 Ca -0.46 -0.27 -0.03 0.00 0.02 0.00 0.00 57.03 56.30 1b4j h ASP 122 Cb 1.23 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.55 1b4j h ASP 122 CO 0.61 0.96 0.15 1.05 -1.72 0.00 0.00 179.24 180.29 1b4j h GLU 123 N 0.66 0.59 -0.52 3.56 9.09 -2.00 -0.91 114.58 125.05 1b4j h GLU 123 Ca 0.09 -0.08 -0.07 0.00 0.05 0.00 0.00 59.36 59.35 1b4j h GLU 123 Cb 0.71 -0.11 -0.02 0.00 -1.65 0.00 0.00 28.75 27.69 1b4j h GLU 123 CO 0.05 0.51 0.05 0.37 0.05 0.00 0.00 179.01 180.04 1b4j h GLN 124 N 0.59 0.88 0.08 1.06 5.75 -1.86 -3.26 115.11 118.35 1b4j h GLN 124 Ca 0.14 -0.25 -0.00 0.00 -0.15 0.00 0.00 58.65 58.39 1b4j h GLN 124 Cb 0.15 -0.09 0.00 0.00 1.07 0.00 0.00 27.48 28.60 1b4j h GLN 124 CO -0.01 0.88 -0.04 -0.07 -2.65 0.00 0.00 178.83 176.94 1b4j h LEU 125 N 0.76 -0.09 -1.99 -2.39 3.38 -0.91 -3.12 115.31 110.95 1b4j h LEU 125 Ca 0.15 0.00 0.23 0.00 0.09 0.00 0.00 57.88 58.36 1b4j h LEU 125 Cb 0.45 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 1b4j h LEU 125 CO 0.02 -0.07 0.59 0.11 0.09 0.00 0.00 178.44 179.18 1b4j h LYS 126 N -0.11 0.00 -0.00 1.13 1.79 -1.28 -0.92 116.57 117.18 1b4j h LYS 126 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1b4j h LYS 126 Cb 0.08 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.73 1b4j h LYS 126 CO 0.02 0.00 -0.28 -1.13 -1.08 0.00 0.00 179.45 176.98 1b4j n SER 127 N -4.20 0.35 0.00 0.86 3.41 -1.18 -4.95 113.62 107.90 1b4j n SER 127 Ca 0.16 -0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 1b4j n SER 127 Cb 0.88 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.78 1b4j n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1b4j n GLY 128 N 1.47 1.57 3.75 5.00 0.00 -0.35 -5.06 105.19 111.56 1b4j n GLY 128 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 1b4j n GLY 128 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1b4j s THR 129 N -1.78 1.80 -0.40 2.61 -4.23 -1.22 -0.79 115.64 111.63 1b4j s THR 129 Ca 0.00 -1.81 0.06 0.00 -1.18 0.00 0.00 61.69 58.76 1b4j s THR 129 Cb 0.00 -2.61 0.17 0.00 1.34 0.00 0.00 72.50 71.40 1b4j s THR 129 CO 0.00 0.00 0.51 0.00 -0.54 0.00 0.00 174.62 174.59 1b4j s ALA 130 N -2.73 -1.46 -0.49 3.99 0.00 0.35 -3.48 121.76 117.94 1b4j s ALA 130 Ca 0.28 -0.37 -0.18 0.00 0.00 0.00 0.00 51.96 51.69 1b4j s ALA 130 Cb 0.03 -2.42 0.05 0.00 0.00 0.00 0.00 23.12 20.79 1b4j s ALA 130 CO 0.16 -2.19 0.57 -1.12 0.00 0.00 0.00 175.76 173.18 1b4j s SER 131 N 1.62 6.21 -0.44 0.00 0.01 -1.26 -2.56 113.70 117.29 1b4j s SER 131 Ca 0.17 -0.92 -0.18 0.00 1.31 0.00 0.00 55.95 56.32 1b4j s SER 131 Cb -0.09 -2.27 0.03 0.00 0.21 0.00 0.00 66.02 63.90 1b4j s SER 131 CO -0.05 -0.82 0.52 -0.69 0.41 0.00 0.00 173.24 172.62 1b4j s VAL 132 N 2.43 4.99 -0.33 3.43 1.01 0.69 -4.23 120.40 128.39 1b4j s VAL 132 Ca 0.13 -0.26 -0.16 0.00 0.00 0.00 0.00 61.98 61.69 1b4j s VAL 132 Cb -0.19 -4.13 -0.01 0.00 0.00 0.00 0.00 36.38 32.04 1b4j s VAL 132 CO 0.12 -0.53 0.41 -0.69 0.00 0.00 0.00 175.10 174.41 1b4j s VAL 133 N 2.39 5.12 0.00 2.92 1.01 -1.22 -1.47 120.40 129.15 1b4j s VAL 133 Ca 0.15 0.23 -0.17 0.00 0.00 0.00 0.00 61.98 62.20 1b4j s VAL 133 Cb -0.17 -3.85 -0.06 0.00 0.00 0.00 0.00 36.38 32.31 1b4j s VAL 133 CO 0.15 -0.09 0.48 0.00 0.00 0.00 0.00 175.10 175.63 1b4j s LEU 135 N -0.74 2.87 -0.40 0.00 1.98 0.54 -2.37 118.68 120.55 1b4j s LEU 135 Ca 0.26 -1.10 -0.14 0.00 -2.89 0.00 0.00 54.13 50.27 1b4j s LEU 135 Cb -0.17 -1.48 0.02 0.00 0.66 0.00 0.00 46.19 45.21 1b4j s LEU 135 CO 0.15 -0.13 0.27 -0.76 -1.89 0.00 0.00 176.35 173.99 1b4j s LEU 136 N 1.20 4.98 -0.14 -0.68 1.02 -0.88 -0.78 118.68 123.41 1b4j s LEU 136 Ca -0.04 -0.91 -0.07 0.00 0.02 0.00 0.00 54.13 53.13 1b4j s LEU 136 Cb -0.17 -2.12 -0.04 0.00 0.02 0.00 0.00 46.19 43.87 1b4j s LEU 136 CO -0.08 -0.43 0.11 0.21 0.02 0.00 0.00 176.35 176.18 1b4j s ASN 137 N 1.65 6.08 -0.75 2.29 2.47 0.11 -2.18 114.94 124.61 1b4j s ASN 137 Ca 0.04 0.31 -0.06 0.00 0.42 0.00 0.00 52.86 53.58 1b4j s ASN 137 Cb -0.19 -1.98 0.01 0.00 -1.45 0.00 0.00 41.25 37.64 1b4j s ASN 137 CO 0.09 0.32 0.51 0.59 -3.72 0.00 0.00 177.10 174.88 1b4j n ASN 138 N 2.60 -3.83 -4.33 -4.21 3.02 -1.21 -0.89 115.26 106.40 1b4j n ASN 138 Ca -0.18 -0.87 -0.19 0.00 -0.03 0.00 0.00 54.58 53.31 1b4j n ASN 138 Cb 0.54 -1.31 0.03 0.00 -0.61 0.00 0.00 39.78 38.42 1b4j n ASN 138 CO 0.00 0.00 0.00 2.22 -2.62 0.00 0.00 177.26 176.86 1b4j n PHE 139 N -2.68 -1.54 0.00 3.10 -1.74 -1.24 -4.54 117.46 108.82 1b4j n PHE 139 Ca -0.24 -1.80 0.00 0.00 -0.56 0.00 0.00 57.45 54.85 1b4j n PHE 139 Cb 0.55 -0.40 0.00 0.00 1.52 0.00 0.00 39.48 41.15 1b4j n PHE 139 CO 0.00 0.00 0.00 0.98 -0.56 0.00 0.00 176.76 177.18 1b4j n TYR 140 N -1.77 0.00 -1.23 2.97 4.19 -0.81 -2.77 117.16 117.75 1b4j n TYR 140 Ca 0.05 0.00 -0.30 0.00 3.31 0.00 0.00 57.90 60.96 1b4j n TYR 140 Cb 0.50 0.00 0.25 0.00 0.49 0.00 0.00 39.34 40.57 1b4j n TYR 140 CO 0.00 0.00 0.00 -1.25 0.91 0.00 0.00 176.86 176.52 1b4j s PRO 141 N 0.00 -1.28 0.36 2.98 0.04 -1.26 -1.88 135.00 133.96 1b4j s PRO 141 Ca 0.00 -0.28 0.11 0.00 0.04 0.00 0.00 61.00 60.87 1b4j s PRO 141 Cb 0.00 -1.61 0.89 0.00 0.04 0.00 0.00 34.50 33.82 1b4j s PRO 141 CO 0.00 -3.71 1.84 -0.09 0.04 0.00 0.00 177.00 175.08 1b4j h ARG 142 N -2.57 0.60 -5.43 4.56 2.43 -2.00 -3.41 114.38 108.56 1b4j h ARG 142 Ca -0.42 -0.04 -0.39 0.00 -0.81 0.00 0.00 59.98 58.32 1b4j h ARG 142 Cb 1.27 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.67 1b4j h ARG 142 CO 0.28 0.40 1.41 0.39 -1.51 0.00 0.00 179.97 180.94 1b4j n GLU 143 N -4.59 0.72 -3.95 0.20 4.71 -1.26 -4.90 120.64 111.58 1b4j n GLU 143 Ca 0.20 -0.15 -0.20 0.00 -0.01 0.00 0.00 57.16 57.00 1b4j n GLU 143 Cb 0.58 -3.03 -0.06 0.00 -1.01 0.00 0.00 31.44 27.92 1b4j n GLU 143 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1b4j n ALA 144 N 14.98 0.48 -3.61 0.62 0.00 -1.26 -4.46 120.51 127.25 1b4j n ALA 144 Ca 0.45 -1.68 -0.03 0.00 0.00 0.00 0.00 53.44 52.19 1b4j n ALA 144 Cb 0.42 1.15 -0.05 0.00 0.00 0.00 0.00 19.45 20.96 1b4j n ALA 144 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1b4j s LYS 145 N -3.26 0.56 -0.16 0.00 2.20 -0.72 -4.99 119.74 113.37 1b4j s LYS 145 Ca 0.18 1.23 -0.03 0.00 -0.36 0.00 0.00 55.97 56.99 1b4j s LYS 145 Cb 0.01 0.54 -0.02 0.00 -1.51 0.00 0.00 37.83 36.84 1b4j s LYS 145 CO 0.13 -0.16 -0.06 0.08 -0.36 0.00 0.00 175.35 174.97 1b4j s VAL 146 N 2.34 3.60 -0.33 4.02 1.01 -1.26 -0.86 120.40 128.92 1b4j s VAL 146 Ca -0.07 -0.46 0.03 0.00 0.00 0.00 0.00 61.98 61.48 1b4j s VAL 146 Cb -0.08 -2.57 0.09 0.00 0.00 0.00 0.00 36.38 33.81 1b4j s VAL 146 CO -0.19 0.49 0.03 -1.58 0.00 0.00 0.00 175.10 173.85 1b4j s GLN 147 N 0.56 1.74 0.33 2.72 2.00 0.61 -4.96 119.66 122.66 1b4j s GLN 147 Ca -0.04 -1.73 -0.27 0.00 -2.00 0.00 0.00 55.36 51.31 1b4j s GLN 147 Cb -0.15 -3.18 -0.09 0.00 0.80 0.00 0.00 33.01 30.39 1b4j s GLN 147 CO 0.03 -0.86 1.04 -1.58 -0.50 0.00 0.00 175.29 173.42 1b4j s TRP 148 N 0.98 3.52 -0.24 1.67 0.52 -1.26 -0.90 118.94 123.24 1b4j s TRP 148 Ca 0.06 1.71 -0.03 0.00 0.02 0.00 0.00 56.10 57.86 1b4j s TRP 148 Cb -0.20 -3.14 0.10 0.00 -1.15 0.00 0.00 33.47 29.08 1b4j s TRP 148 CO -0.07 -0.37 0.20 0.21 0.02 0.00 0.00 176.95 176.95 1b4j s LYS 149 N -1.90 0.20 -0.38 4.98 2.47 -0.99 -3.36 119.74 120.77 1b4j s LYS 149 Ca 0.50 -0.06 -0.14 0.00 -1.56 0.00 0.00 55.97 54.71 1b4j s LYS 149 Cb -0.26 -1.16 0.00 0.00 -1.46 0.00 0.00 37.83 34.96 1b4j s LYS 149 CO 0.33 -0.82 0.27 0.08 0.16 0.00 0.00 175.35 175.36 1b4j s VAL 150 N 2.26 5.21 -1.42 4.02 1.01 0.33 -1.31 120.40 130.51 1b4j s VAL 150 Ca 0.07 -0.48 -0.10 0.00 0.00 0.00 0.00 61.98 61.48 1b4j s VAL 150 Cb -0.15 -3.80 0.04 0.00 0.00 0.00 0.00 36.38 32.47 1b4j s VAL 150 CO -0.21 -0.17 1.06 0.47 0.00 0.00 0.00 175.10 176.25 1b4j n ASP 151 N 5.12 -5.14 0.00 3.32 8.00 0.15 -0.84 116.55 127.16 1b4j n ASP 151 Ca -0.12 -0.66 0.00 0.00 0.71 0.00 0.00 54.79 54.72 1b4j n ASP 151 Cb 0.48 -4.52 0.00 0.00 -0.02 0.00 0.00 41.12 37.06 1b4j n ASP 151 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1b4j n ASN 152 N -2.96 0.00 -4.76 -2.24 3.02 -1.26 -4.98 115.26 102.08 1b4j n ASN 152 Ca -0.02 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.14 1b4j n ASN 152 Cb 0.56 -0.96 -0.06 0.00 -0.61 0.00 0.00 39.78 38.72 1b4j n ASN 152 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1b4j s ALA 153 N -2.84 3.47 -0.31 5.41 0.00 -0.02 -5.03 121.76 122.44 1b4j s ALA 153 Ca 0.00 0.04 -0.25 0.00 0.00 0.00 0.00 51.96 51.75 1b4j s ALA 153 Cb 0.00 -2.77 0.01 0.00 0.00 0.00 0.00 23.12 20.36 1b4j s ALA 153 CO 0.00 0.13 0.87 -1.17 0.00 0.00 0.00 175.76 175.59 1b4j s LEU 154 N -0.07 4.05 1.13 0.00 0.20 -1.26 -0.51 118.68 122.22 1b4j s LEU 154 Ca 0.32 0.76 -0.17 0.00 0.69 0.00 0.00 54.13 55.72 1b4j s LEU 154 Cb -0.18 -3.21 0.25 0.00 -0.43 0.00 0.00 46.19 42.62 1b4j s LEU 154 CO 0.17 -0.70 1.12 -1.10 -0.29 0.00 0.00 176.35 175.55 1b4j s GLN 155 N 3.17 -0.66 -0.30 1.98 -1.52 -1.21 -4.99 119.66 116.12 1b4j s GLN 155 Ca 0.36 0.06 -0.14 0.00 -1.95 0.00 0.00 55.36 53.69 1b4j s GLN 155 Cb -0.13 -1.65 0.18 0.00 -0.22 0.00 0.00 33.01 31.18 1b4j s GLN 155 CO 0.14 -3.37 1.05 0.45 -0.25 0.00 0.00 175.29 173.31 1b4j s SER 156 N -3.84 -0.47 0.00 5.90 0.15 -1.26 -4.95 113.70 109.23 1b4j s SER 156 Ca 0.69 0.45 0.00 0.00 0.70 0.00 0.00 55.95 57.79 1b4j s SER 156 Cb -0.12 1.46 0.00 0.00 -1.71 0.00 0.00 66.02 65.65 1b4j s SER 156 CO 0.56 -0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.52 1b4j n GLY 157 N 5.17 1.09 0.89 9.45 0.00 -1.26 -4.90 105.19 115.63 1b4j n GLY 157 Ca -0.07 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.02 1b4j n GLY 157 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1b4j n ASN 158 N 0.00 3.67 -4.07 1.61 0.23 -1.26 -4.98 115.26 110.46 1b4j n ASN 158 Ca 0.00 -2.61 -0.14 0.00 -0.53 0.00 0.00 54.58 51.30 1b4j n ASN 158 Cb 0.00 -0.44 -0.12 0.00 -2.08 0.00 0.00 39.78 37.14 1b4j n ASN 158 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 1b4j s SER 159 N -1.48 0.98 -0.25 0.53 1.04 -1.26 -3.05 113.70 110.22 1b4j s SER 159 Ca 0.36 -0.53 -0.03 0.00 0.48 0.00 0.00 55.95 56.23 1b4j s SER 159 Cb 0.26 0.01 0.10 0.00 0.10 0.00 0.00 66.02 66.50 1b4j s SER 159 CO 0.13 -0.16 0.19 -1.58 0.98 0.00 0.00 173.24 172.80 1b4j s GLN 160 N -1.50 0.20 0.59 4.02 0.74 0.27 -4.93 119.66 119.05 1b4j s GLN 160 Ca -0.08 -0.15 -0.08 0.00 0.05 0.00 0.00 55.36 55.10 1b4j s GLN 160 Cb -0.09 -1.16 -0.02 0.00 1.10 0.00 0.00 33.01 32.84 1b4j s GLN 160 CO 0.01 -0.86 0.94 -1.83 -0.55 0.00 0.00 175.29 172.99 1b4j s GLU 161 N 2.24 3.26 -0.13 1.67 -1.05 -1.25 -2.95 118.70 120.48 1b4j s GLU 161 Ca 0.07 0.33 -0.05 0.00 -0.15 0.00 0.00 54.97 55.17 1b4j s GLU 161 Cb -0.15 -2.21 0.06 0.00 -0.44 0.00 0.00 34.13 31.39 1b4j s GLU 161 CO -0.24 -0.59 0.28 0.45 0.95 0.00 0.00 175.26 176.11 1b4j s SER 162 N -4.23 0.04 0.08 0.83 0.15 -0.49 -4.93 113.70 105.15 1b4j s SER 162 Ca 0.53 0.63 0.03 0.00 0.70 0.00 0.00 55.95 57.84 1b4j s SER 162 Cb -0.11 0.68 -0.04 0.00 -1.71 0.00 0.00 66.02 64.84 1b4j s SER 162 CO 0.49 -0.21 0.09 0.54 1.20 0.00 0.00 173.24 175.34 1b4j s VAL 163 N 2.01 4.62 0.69 4.45 0.11 -1.26 -1.83 120.40 129.18 1b4j s VAL 163 Ca -0.03 -0.73 0.01 0.00 -2.93 0.00 0.00 61.98 58.30 1b4j s VAL 163 Cb -0.11 -3.23 0.12 0.00 -1.53 0.00 0.00 36.38 31.63 1b4j s VAL 163 CO -0.09 0.13 0.95 0.42 -3.33 0.00 0.00 175.10 173.18 1b4j s THR 164 N -1.40 2.17 0.64 5.04 -4.23 -0.05 -5.00 115.64 112.81 1b4j s THR 164 Ca 0.30 -0.65 0.07 0.00 -1.18 0.00 0.00 61.69 60.22 1b4j s THR 164 Cb -0.12 -2.52 0.11 0.00 1.34 0.00 0.00 72.50 71.31 1b4j s THR 164 CO 0.23 0.00 0.88 -1.61 -0.54 0.00 0.00 174.62 173.57 1b4j s GLU 165 N -5.05 2.04 0.14 3.99 0.41 -1.26 -4.53 118.70 114.44 1b4j s GLU 165 Ca 0.65 -1.53 -0.31 0.00 -0.41 0.00 0.00 54.97 53.37 1b4j s GLU 165 Cb -0.06 -2.54 -0.11 0.00 -1.78 0.00 0.00 34.13 29.65 1b4j s GLU 165 CO 0.43 -1.11 1.81 -0.65 -0.49 0.00 0.00 175.26 175.26 1b4j s GLN 166 N -4.85 4.13 0.18 1.61 -0.21 -1.26 -4.53 119.66 114.73 1b4j s GLN 166 Ca 0.64 2.60 -0.33 0.00 0.02 0.00 0.00 55.36 58.28 1b4j s GLN 166 Cb -0.05 -3.51 -0.14 0.00 1.00 0.00 0.00 33.01 30.30 1b4j s GLN 166 CO 0.41 -0.83 1.42 -3.47 -2.12 0.00 0.00 175.29 170.71 1b4j n ASP 167 N 5.42 2.50 -0.17 5.90 -0.08 -0.24 -4.77 116.55 125.10 1b4j n ASP 167 Ca 0.17 1.12 0.07 0.00 -1.51 0.00 0.00 54.79 54.65 1b4j n ASP 167 Cb 0.38 -1.36 0.37 0.00 2.34 0.00 0.00 41.12 42.85 1b4j n ASP 167 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 1b4j h SER 168 N 4.76 0.63 0.00 1.67 4.64 -1.91 -1.14 113.55 122.20 1b4j h SER 168 Ca -0.45 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1b4j h SER 168 Cb 1.29 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1b4j h SER 168 CO 0.80 0.40 0.00 1.17 -0.87 0.00 0.00 176.83 178.33 1b4j n LYS 169 N -4.48 0.00 -0.01 4.77 0.00 -1.26 -4.51 118.16 112.66 1b4j n LYS 169 Ca 0.11 0.39 0.14 0.00 0.00 0.00 0.00 58.31 58.95 1b4j n LYS 169 Cb 0.26 -0.88 0.69 0.00 0.00 0.00 0.00 35.03 35.09 1b4j n LYS 169 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1b4j n ASP 170 N -1.98 0.73 -3.84 3.14 5.68 -1.26 -4.95 116.55 114.07 1b4j n ASP 170 Ca 0.00 -1.31 -0.25 0.00 -0.50 0.00 0.00 54.79 52.73 1b4j n ASP 170 Cb 0.00 -0.01 0.02 0.00 -1.14 0.00 0.00 41.12 39.99 1b4j n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1b4j n SER 171 N -0.40 -2.16 -4.29 -1.12 7.64 -0.43 -4.92 113.62 107.94 1b4j n SER 171 Ca 0.20 -0.85 -0.22 0.00 1.01 0.00 0.00 58.87 59.01 1b4j n SER 171 Cb 0.22 -3.75 -0.12 0.00 -1.01 0.00 0.00 64.21 59.55 1b4j n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1b4j s THR 172 N -3.60 1.67 0.00 0.44 -4.23 -1.26 -4.67 115.64 103.99 1b4j s THR 172 Ca 0.23 -1.67 0.00 0.00 -1.18 0.00 0.00 61.69 59.07 1b4j s THR 172 Cb -0.12 -1.62 0.00 0.00 1.34 0.00 0.00 72.50 72.10 1b4j s THR 172 CO 0.84 -0.19 0.00 -1.22 -0.54 0.00 0.00 174.62 173.50 1b4j n TYR 173 N 0.77 -3.42 -3.61 3.99 4.02 -1.11 -1.08 117.16 116.72 1b4j n TYR 173 Ca -0.17 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 57.65 1b4j n TYR 173 Cb 0.55 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.82 1b4j n TYR 173 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 1b4j s SER 174 N -1.00 -0.24 0.00 7.72 0.01 -1.26 -3.33 113.70 115.60 1b4j s SER 174 Ca 0.00 0.30 -0.07 0.00 1.31 0.00 0.00 55.95 57.49 1b4j s SER 174 Cb 0.00 0.25 0.00 0.00 0.21 0.00 0.00 66.02 66.48 1b4j s SER 174 CO 0.00 -0.20 0.14 -0.22 0.41 0.00 0.00 173.24 173.37 1b4j s LEU 175 N -0.86 1.56 -0.19 2.44 0.20 -0.92 -0.87 118.68 120.04 1b4j s LEU 175 Ca 0.03 -0.21 -0.04 0.00 0.69 0.00 0.00 54.13 54.60 1b4j s LEU 175 Cb -0.01 0.67 0.06 0.00 -0.43 0.00 0.00 46.19 46.48 1b4j s LEU 175 CO -0.04 -0.37 0.06 -0.94 -0.29 0.00 0.00 176.35 174.77 1b4j s SER 176 N -1.39 2.74 -0.34 3.68 1.04 -0.76 -2.07 113.70 116.60 1b4j s SER 176 Ca -0.15 -0.77 -0.15 0.00 0.48 0.00 0.00 55.95 55.36 1b4j s SER 176 Cb -0.08 -0.47 -0.01 0.00 0.10 0.00 0.00 66.02 65.56 1b4j s SER 176 CO 0.02 -0.32 0.37 -0.55 0.98 0.00 0.00 173.24 173.73 1b4j s SER 177 N 1.95 6.19 -0.14 7.02 0.15 -1.00 -1.39 113.70 126.48 1b4j s SER 177 Ca 0.00 -0.20 -0.07 0.00 0.70 0.00 0.00 55.95 56.38 1b4j s SER 177 Cb -0.17 -2.20 -0.04 0.00 -1.71 0.00 0.00 66.02 61.90 1b4j s SER 177 CO -0.09 -0.34 0.12 -0.89 1.20 0.00 0.00 173.24 173.24 1b4j s THR 178 N 2.03 5.33 -0.17 6.45 2.01 -1.15 -1.04 115.64 129.10 1b4j s THR 178 Ca 0.12 0.15 0.01 0.00 0.31 0.00 0.00 61.69 62.28 1b4j s THR 178 Cb -0.16 -3.35 0.02 0.00 0.01 0.00 0.00 72.50 69.02 1b4j s THR 178 CO 0.12 0.57 -0.19 -0.22 -0.69 0.00 0.00 174.62 174.20 1b4j s LEU 179 N -0.60 2.07 -0.03 4.42 2.96 -0.54 -0.57 118.68 126.39 1b4j s LEU 179 Ca 0.12 -0.62 0.06 0.00 -0.22 0.00 0.00 54.13 53.47 1b4j s LEU 179 Cb -0.12 -1.44 -0.01 0.00 0.50 0.00 0.00 46.19 45.13 1b4j s LEU 179 CO 0.02 0.00 -0.20 -0.89 -1.32 0.00 0.00 176.35 173.96 1b4j s THR 180 N 1.26 1.65 0.04 3.68 2.01 -1.17 -0.22 115.64 122.88 1b4j s THR 180 Ca 0.04 -0.86 -0.16 0.00 0.31 0.00 0.00 61.69 61.01 1b4j s THR 180 Cb -0.13 -1.39 0.03 0.00 0.01 0.00 0.00 72.50 71.02 1b4j s THR 180 CO -0.11 0.47 0.36 -1.48 -0.69 0.00 0.00 174.62 173.16 1b4j s LEU 181 N -0.23 0.63 0.56 4.42 0.05 -1.06 -4.91 118.68 118.14 1b4j s LEU 181 Ca 0.01 -0.05 -0.19 0.00 0.05 0.00 0.00 54.13 53.95 1b4j s LEU 181 Cb -0.10 1.54 -0.07 0.00 -2.05 0.00 0.00 46.19 45.51 1b4j s LEU 181 CO 0.01 -0.62 0.80 -1.54 -0.55 0.00 0.00 176.35 174.45 1b4j n SER 182 N 0.63 0.13 0.11 1.48 3.41 -1.26 -0.50 113.62 117.63 1b4j n SER 182 Ca -0.19 0.82 0.07 0.00 -0.26 0.00 0.00 58.87 59.31 1b4j n SER 182 Cb 0.59 -1.30 0.37 0.00 -0.26 0.00 0.00 64.21 63.62 1b4j n SER 182 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1b4j n LYS 183 N -0.43 0.09 -0.07 4.33 2.85 0.03 -1.63 118.16 123.31 1b4j n LYS 183 Ca 0.12 0.57 -0.08 0.00 -1.05 0.00 0.00 58.31 57.87 1b4j n LYS 183 Cb 0.46 -1.86 -0.04 0.00 -0.65 0.00 0.00 35.03 32.93 1b4j n LYS 183 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1b4j h ALA 184 N 1.79 0.05 -0.71 0.58 0.00 -1.88 -3.08 119.26 116.01 1b4j h ALA 184 Ca 0.00 -0.55 0.18 0.00 0.00 0.00 0.00 54.91 54.54 1b4j h ALA 184 Cb 0.14 0.41 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 1b4j h ALA 184 CO 0.00 0.40 0.49 0.22 0.00 0.00 0.00 179.25 180.36 1b4j h ASP 185 N -1.00 0.16 0.44 0.00 1.82 -1.76 -1.63 116.42 114.45 1b4j h ASP 185 Ca -0.07 0.01 -0.02 0.00 -0.39 0.00 0.00 57.03 56.56 1b4j h ASP 185 Cb 0.60 -0.02 0.00 0.00 0.68 0.00 0.00 39.33 40.60 1b4j h ASP 185 CO -0.04 0.08 -0.21 0.22 -1.61 0.00 0.00 179.24 177.67 1b4j h TYR 186 N 0.17 -0.55 0.00 0.28 3.20 -1.46 -3.04 116.97 115.56 1b4j h TYR 186 Ca 0.34 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.20 1b4j h TYR 186 Cb 1.11 0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.57 1b4j h TYR 186 CO -0.00 -0.34 0.08 0.39 -1.64 0.00 0.00 178.16 176.65 1b4j n GLU 187 N -4.11 0.00 0.21 1.82 1.02 -0.67 -1.09 120.64 117.82 1b4j n GLU 187 Ca -0.07 0.30 0.09 0.00 -0.02 0.00 0.00 57.16 57.45 1b4j n GLU 187 Cb 0.23 -1.58 0.34 0.00 -0.02 0.00 0.00 31.44 30.40 1b4j n GLU 187 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1b4j h LYS 188 N 0.00 0.00 -5.77 3.49 1.57 -1.28 -3.46 116.57 111.12 1b4j h LYS 188 Ca 0.00 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 58.17 1b4j h LYS 188 Cb 0.17 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 32.36 1b4j h LYS 188 CO 0.00 0.24 -0.59 -1.01 -0.57 0.00 0.00 179.45 177.52 1b4j s HIS 189 N -3.43 2.53 -0.04 -1.35 3.76 -0.25 -5.08 115.29 111.43 1b4j s HIS 189 Ca 0.02 -0.61 0.00 0.00 -0.15 0.00 0.00 55.06 54.32 1b4j s HIS 189 Cb 0.09 -1.75 -0.03 0.00 1.11 0.00 0.00 32.58 32.00 1b4j s HIS 189 CO 0.66 0.41 -0.04 1.17 -0.85 0.00 0.00 174.74 176.09 1b4j n LYS 190 N -1.01 0.24 -3.84 1.40 4.81 -1.26 -4.85 118.16 113.65 1b4j n LYS 190 Ca -0.04 0.02 -0.35 0.00 -0.87 0.00 0.00 58.31 57.07 1b4j n LYS 190 Cb 0.66 -1.09 -0.09 0.00 0.02 0.00 0.00 35.03 34.53 1b4j n LYS 190 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1b4j s VAL 191 N -2.09 5.06 -0.19 3.15 1.01 -1.26 -2.47 120.40 123.62 1b4j s VAL 191 Ca -0.06 0.07 0.01 0.00 0.00 0.00 0.00 61.98 62.00 1b4j s VAL 191 Cb 0.02 -3.31 0.04 0.00 0.00 0.00 0.00 36.38 33.12 1b4j s VAL 191 CO 0.10 0.43 -0.11 -0.31 0.00 0.00 0.00 175.10 175.21 1b4j s TYR 192 N 0.56 2.32 0.33 5.22 1.51 -0.76 -0.68 117.35 125.86 1b4j s TYR 192 Ca 0.06 -1.49 0.09 0.00 -1.01 0.00 0.00 57.07 54.72 1b4j s TYR 192 Cb -0.12 -1.61 -0.05 0.00 -0.11 0.00 0.00 41.96 40.07 1b4j s TYR 192 CO 0.01 -0.72 0.06 0.00 -1.11 0.00 0.00 175.55 173.78 1b4j s ALA 193 N 1.43 3.31 -0.26 3.71 0.00 -0.43 -1.16 121.76 128.35 1b4j s ALA 193 Ca 0.00 -1.89 -0.03 0.00 0.00 0.00 0.00 51.96 50.04 1b4j s ALA 193 Cb -0.15 -0.53 0.11 0.00 0.00 0.00 0.00 23.12 22.55 1b4j s ALA 193 CO -0.09 0.07 0.22 0.00 0.00 0.00 0.00 175.76 175.96 1b4j s GLU 195 N 2.27 3.09 -0.22 0.00 2.12 -0.07 -0.90 118.70 124.98 1b4j s GLU 195 Ca 0.08 -0.77 -0.12 0.00 0.36 0.00 0.00 54.97 54.52 1b4j s GLU 195 Cb -0.15 -3.97 -0.05 0.00 0.26 0.00 0.00 34.13 30.22 1b4j s GLU 195 CO -0.26 -0.85 0.21 0.08 -0.54 0.00 0.00 175.26 173.90 1b4j s VAL 196 N 2.12 5.33 -0.16 3.70 1.01 0.69 -0.28 120.40 132.80 1b4j s VAL 196 Ca 0.12 0.31 0.01 0.00 0.00 0.00 0.00 61.98 62.42 1b4j s VAL 196 Cb -0.17 -3.55 0.01 0.00 0.00 0.00 0.00 36.38 32.67 1b4j s VAL 196 CO 0.13 0.35 -0.18 -0.89 0.00 0.00 0.00 175.10 174.51 1b4j s THR 197 N 0.95 2.37 0.20 3.92 2.01 -0.04 -1.73 115.64 123.32 1b4j s THR 197 Ca 0.10 -0.86 0.00 0.00 0.31 0.00 0.00 61.69 61.25 1b4j s THR 197 Cb -0.13 -1.99 -0.05 0.00 0.01 0.00 0.00 72.50 70.34 1b4j s THR 197 CO 0.04 0.52 0.07 -2.28 -0.69 0.00 0.00 174.62 172.29 1b4j s HIS 198 N 1.02 1.26 -2.11 4.92 2.46 -1.26 -1.75 115.29 119.83 1b4j s HIS 198 Ca -0.02 -1.20 0.15 0.00 0.47 0.00 0.00 55.06 54.46 1b4j s HIS 198 Cb -0.15 -0.70 0.53 0.00 -0.13 0.00 0.00 32.58 32.13 1b4j s HIS 198 CO -0.05 -0.40 1.39 0.00 -2.47 0.00 0.00 174.74 173.21 1b4j n GLN 199 N -0.31 1.64 -0.04 2.88 10.64 -1.26 -3.21 117.38 127.72 1b4j n GLN 199 Ca -0.02 -0.98 0.03 0.00 -1.83 0.00 0.00 57.00 54.20 1b4j n GLN 199 Cb 0.65 -1.30 -0.14 0.00 -0.86 0.00 0.00 30.24 28.59 1b4j n GLN 199 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1b4j n GLY 200 N 1.02 -0.87 3.73 2.61 0.00 -1.26 -4.94 105.19 105.47 1b4j n GLY 200 Ca 0.13 -0.39 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 1b4j n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b4j s LEU 201 N -4.68 4.45 0.13 0.99 1.02 -1.20 -4.64 118.68 114.75 1b4j s LEU 201 Ca -0.08 1.65 -0.16 0.00 0.02 0.00 0.00 54.13 55.57 1b4j s LEU 201 Cb 0.10 -3.47 -0.01 0.00 0.02 0.00 0.00 46.19 42.83 1b4j s LEU 201 CO 0.77 -0.10 1.66 0.77 0.02 0.00 0.00 176.35 179.46 1b4j h SER 202 N 5.97 0.59 -3.56 2.29 4.64 -1.92 -3.45 113.55 118.11 1b4j h SER 202 Ca -0.43 -0.20 -0.54 0.00 -0.47 0.00 0.00 61.79 60.16 1b4j h SER 202 Cb 1.21 -0.15 -0.13 0.00 -0.31 0.00 0.00 62.40 63.02 1b4j h SER 202 CO 0.73 0.63 -0.51 -0.94 -0.87 0.00 0.00 176.83 175.86 1b4j s SER 203 N -5.93 2.60 0.02 4.97 1.04 -1.26 -5.12 113.70 110.01 1b4j s SER 203 Ca -0.13 -1.68 -0.19 0.00 0.48 0.00 0.00 55.95 54.43 1b4j s SER 203 Cb 0.10 0.51 -0.06 0.00 0.10 0.00 0.00 66.02 66.68 1b4j s SER 203 CO 0.76 -0.95 0.54 -2.84 0.98 0.00 0.00 173.24 171.73 1b4j s PRO 204 N -3.68 4.21 0.44 4.02 0.02 -1.26 -4.81 135.00 133.94 1b4j s PRO 204 Ca 0.26 0.66 -0.06 0.00 0.02 0.00 0.00 61.00 61.88 1b4j s PRO 204 Cb 0.03 -3.29 -0.04 0.00 0.02 0.00 0.00 34.50 31.21 1b4j s PRO 204 CO 0.16 0.51 0.75 0.14 -0.33 0.00 0.00 177.00 178.23 1b4j s VAL 205 N -0.63 4.91 -0.13 3.83 -7.23 -0.70 -4.86 120.40 115.59 1b4j s VAL 205 Ca 0.29 0.23 -0.04 0.00 -1.81 0.00 0.00 61.98 60.65 1b4j s VAL 205 Cb -0.18 -3.83 0.06 0.00 0.56 0.00 0.00 36.38 32.99 1b4j s VAL 205 CO 0.17 -0.73 0.13 0.28 -0.31 0.00 0.00 175.10 174.64 1b4j s THR 206 N -2.59 -0.19 -0.03 5.32 -1.32 -1.26 -0.22 115.64 115.34 1b4j s THR 206 Ca 0.47 0.11 -0.18 0.00 -1.21 0.00 0.00 61.69 60.89 1b4j s THR 206 Cb -0.10 -0.43 -0.05 0.00 -1.51 0.00 0.00 72.50 70.40 1b4j s THR 206 CO 0.40 -0.05 0.50 -0.54 -2.21 0.00 0.00 174.62 172.72 1b4j s LYS 207 N 2.23 4.20 0.21 7.08 -0.14 -0.08 -4.85 119.74 128.40 1b4j s LYS 207 Ca 0.04 0.55 0.03 0.00 -1.36 0.00 0.00 55.97 55.22 1b4j s LYS 207 Cb -0.14 -3.33 -0.05 0.00 -1.68 0.00 0.00 37.83 32.63 1b4j s LYS 207 CO -0.08 0.42 0.00 -1.12 -0.76 0.00 0.00 175.35 173.81 1b4j s SER 208 N -0.26 1.57 -0.14 2.83 0.01 -1.26 0.25 113.70 116.70 1b4j s SER 208 Ca 0.27 -1.21 -0.27 0.00 1.31 0.00 0.00 55.95 56.05 1b4j s SER 208 Cb -0.17 0.06 0.07 0.00 0.21 0.00 0.00 66.02 66.18 1b4j s SER 208 CO 0.14 -0.54 0.66 0.72 0.41 0.00 0.00 173.24 174.62 1b4j s PHE 209 N -3.52 -0.67 -0.09 2.43 -0.71 -0.31 -4.98 117.98 110.13 1b4j s PHE 209 Ca 0.27 1.40 0.04 0.00 -1.04 0.00 0.00 56.93 57.60 1b4j s PHE 209 Cb 0.06 0.32 -0.01 0.00 -1.21 0.00 0.00 43.02 42.18 1b4j s PHE 209 CO 0.07 -0.48 -0.23 -0.80 -1.34 0.00 0.00 175.22 172.45 1b4j s ASN 210 N -0.48 3.24 -0.25 1.98 0.01 -1.26 -1.82 114.94 116.36 1b4j s ASN 210 Ca -0.06 -0.50 -0.28 0.00 -0.71 0.00 0.00 52.86 51.31 1b4j s ASN 210 Cb -0.03 -1.20 -0.04 0.00 0.41 0.00 0.00 41.25 40.39 1b4j s ASN 210 CO 0.05 0.20 2.12 -0.13 -1.51 0.00 0.00 177.10 177.84 1b4j s ARG 211 N 0.11 3.16 0.00 -0.60 0.52 -1.03 -3.29 118.95 117.81 1b4j s ARG 211 Ca -0.11 1.87 0.00 0.00 -0.52 0.00 0.00 55.73 56.97 1b4j s ARG 211 Cb -0.16 -4.34 0.00 0.00 0.52 0.00 0.00 34.95 30.98 1b4j s ARG 211 CO 0.06 -2.07 0.00 0.41 0.02 0.00 0.00 175.30 173.72 1b4j n GLY 212 N 5.69 2.49 3.94 -3.53 0.00 -1.26 -5.04 105.19 107.48 1b4j n GLY 212 Ca 0.28 -0.79 -0.29 0.00 0.00 0.00 0.00 46.02 45.22 1b4j n GLY 212 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1b4j s GLU 213 N 0.00 0.79 0.00 1.61 -1.05 -1.21 -5.31 118.70 113.54 1b4j s GLU 213 Ca 0.00 -0.51 0.00 0.00 -0.15 0.00 0.00 54.97 54.31 1b4j s GLU 213 Cb 0.00 -1.92 0.00 0.00 -0.44 0.00 0.00 34.13 31.77 1b4j s GLU 213 CO 0.00 -2.28 0.00 0.00 0.95 0.00 0.00 175.26 173.93