#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h47 s PRO 29 N 0.00 4.44 0.07 1.97 0.04 -1.26 -4.95 135.00 135.31 2h47 s PRO 29 Ca 0.00 1.76 -0.24 0.00 0.04 0.00 0.00 61.00 62.56 2h47 s PRO 29 Cb 0.00 -3.35 -0.16 0.00 0.04 0.00 0.00 34.50 31.03 2h47 s PRO 29 CO 0.00 -0.23 1.63 -0.09 0.04 0.00 0.00 177.00 178.35 2h47 h ARG 30 N 6.70 -0.06 -6.19 4.56 2.43 -2.15 -3.44 114.38 116.23 2h47 h ARG 30 Ca -0.42 0.00 -0.53 0.00 -0.81 0.00 0.00 59.98 58.23 2h47 h ARG 30 Cb 1.21 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.73 2h47 h ARG 30 CO 0.80 0.05 -0.53 -1.21 -1.51 0.00 0.00 179.97 177.57 2h47 s GLU 31 N -5.80 2.97 -0.13 0.20 2.02 -1.26 -5.12 118.70 111.58 2h47 s GLU 31 Ca -0.14 -0.95 -0.04 0.00 0.02 0.00 0.00 54.97 53.87 2h47 s GLU 31 Cb 0.05 -2.63 0.06 0.00 0.10 0.00 0.00 34.13 31.71 2h47 s GLU 31 CO 0.66 0.44 0.18 0.08 0.02 0.00 0.00 175.26 176.63 2h47 s VAL 32 N -1.96 -0.27 0.18 2.63 1.01 -1.26 -5.13 120.40 115.61 2h47 s VAL 32 Ca 0.32 0.17 -0.32 0.00 0.00 0.00 0.00 61.98 62.15 2h47 s VAL 32 Cb -0.09 -0.44 -0.12 0.00 0.00 0.00 0.00 36.38 35.74 2h47 s VAL 32 CO 0.25 0.00 1.76 -0.11 0.00 0.00 0.00 175.10 177.00 2h47 n LEU 33 N 5.32 4.00 -4.15 3.92 7.94 -1.26 -5.01 117.00 127.76 2h47 n LEU 33 Ca -0.05 1.04 -0.15 0.00 -1.11 0.00 0.00 56.01 55.74 2h47 n LEU 33 Cb 0.50 -1.56 -0.11 0.00 0.53 0.00 0.00 43.42 42.77 2h47 n LEU 33 CO 0.06 0.17 -0.42 0.42 -1.11 0.00 0.00 177.39 176.51 2h47 s THR 34 N 1.64 0.88 0.00 1.96 -4.23 -1.26 -5.16 115.64 109.47 2h47 s THR 34 Ca 0.77 -1.46 0.00 0.00 -1.18 0.00 0.00 61.69 59.83 2h47 s THR 34 Cb -0.50 -1.14 0.00 0.00 1.34 0.00 0.00 72.50 72.20 2h47 s THR 34 CO 0.34 -0.46 0.00 0.61 -0.54 0.00 0.00 174.62 174.57 2h47 n GLY 35 N 0.89 6.56 2.06 3.99 0.00 -1.26 -4.88 105.19 112.54 2h47 n GLY 35 Ca -0.18 -1.90 -0.01 0.00 0.00 0.00 0.00 46.02 43.93 2h47 n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h47 n GLY 36 N 3.60 0.48 3.83 -0.02 0.00 -1.26 -5.03 105.19 106.79 2h47 n GLY 36 Ca 0.00 -0.51 -0.34 0.00 0.00 0.00 0.00 46.02 45.18 2h47 n GLY 36 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2h47 s HIS 37 N -1.99 3.41 0.40 1.61 3.76 -1.26 -5.05 115.29 116.17 2h47 s HIS 37 Ca 0.00 1.47 -0.05 0.00 -0.15 0.00 0.00 55.06 56.33 2h47 s HIS 37 Cb 0.00 -2.72 -0.04 0.00 1.11 0.00 0.00 32.58 30.93 2h47 s HIS 37 CO 0.00 0.05 0.69 -1.12 -0.85 0.00 0.00 174.74 173.51 2h47 s SER 38 N -2.09 6.36 0.15 1.40 0.01 -1.26 -4.72 113.70 113.55 2h47 s SER 38 Ca 0.56 0.83 -0.34 0.00 1.31 0.00 0.00 55.95 58.30 2h47 s SER 38 Cb -0.11 -2.20 -0.15 0.00 0.21 0.00 0.00 66.02 63.77 2h47 s SER 38 CO 0.17 -0.41 1.41 0.52 0.41 0.00 0.00 173.24 175.34 2h47 n VAL 39 N -1.70 0.30 -0.21 3.43 0.31 0.92 -4.86 118.33 116.51 2h47 n VAL 39 Ca -0.01 -0.08 -0.05 0.00 -0.01 0.00 0.00 64.34 64.20 2h47 n VAL 39 Cb 0.55 -1.20 0.11 0.00 -0.91 0.00 0.00 33.84 32.39 2h47 n VAL 39 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2h47 h SER 40 N 4.81 0.96 -3.22 4.52 4.64 -1.91 -3.44 113.55 119.91 2h47 h SER 40 Ca -0.46 -0.18 -0.57 0.00 -0.47 0.00 0.00 61.79 60.11 2h47 h SER 40 Cb 1.30 -0.25 -0.04 0.00 -0.31 0.00 0.00 62.40 63.09 2h47 h SER 40 CO 0.80 0.91 -0.09 0.00 -0.87 0.00 0.00 176.83 177.58 2h47 s ALA 41 N -5.30 3.61 0.48 5.18 0.00 -1.26 -5.05 121.76 119.41 2h47 s ALA 41 Ca -0.11 -0.09 -0.24 0.00 0.00 0.00 0.00 51.96 51.52 2h47 s ALA 41 Cb 0.15 -2.53 -0.07 0.00 0.00 0.00 0.00 23.12 20.67 2h47 s ALA 41 CO 0.83 0.44 1.34 -1.25 0.00 0.00 0.00 175.76 177.12 2h47 s PRO 42 N -1.46 3.57 0.26 0.00 0.04 -1.26 -4.85 135.00 131.29 2h47 s PRO 42 Ca 0.32 2.20 -0.10 0.00 0.04 0.00 0.00 61.00 63.45 2h47 s PRO 42 Cb -0.17 -2.50 0.38 0.00 0.04 0.00 0.00 34.50 32.25 2h47 s PRO 42 CO 0.18 -0.84 1.58 1.96 0.04 0.00 0.00 177.00 179.92 2h47 h GLN 43 N 2.06 -0.01 0.00 4.56 4.20 -1.96 0.39 115.11 124.35 2h47 h GLN 43 Ca -0.50 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.21 2h47 h GLN 43 Cb 1.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.05 2h47 h GLN 43 CO 0.60 -0.00 0.45 1.05 -0.67 0.00 0.00 178.83 180.26 2h47 h GLU 44 N -0.01 0.00 0.00 1.46 4.11 -1.88 0.32 114.58 118.59 2h47 h GLU 44 Ca 0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.85 2h47 h GLU 44 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 2h47 h GLU 44 CO -0.93 0.00 -1.50 0.09 0.07 0.00 0.00 179.01 176.75 2h47 n ASN 45 N -2.37 0.40 -4.80 3.06 4.13 0.14 -4.94 115.26 110.88 2h47 n ASN 45 Ca -0.01 -0.15 -0.35 0.00 1.68 0.00 0.00 54.58 55.74 2h47 n ASN 45 Cb 0.48 1.37 -0.07 0.00 -1.54 0.00 0.00 39.78 40.02 2h47 n ASN 45 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 2h47 s ARG 46 N -3.35 4.42 0.07 3.52 0.52 0.11 -1.28 118.95 122.96 2h47 s ARG 46 Ca -0.02 1.23 0.00 0.00 -0.52 0.00 0.00 55.73 56.42 2h47 s ARG 46 Cb 0.14 -2.51 -0.04 0.00 0.52 0.00 0.00 34.95 33.06 2h47 s ARG 46 CO 0.86 0.14 -0.05 0.96 0.02 0.00 0.00 175.30 177.23 2h47 s ILE 47 N -1.88 0.44 -0.14 1.52 -4.36 -0.07 -1.48 121.20 115.23 2h47 s ILE 47 Ca 0.56 -1.86 0.01 0.00 -0.26 0.00 0.00 60.65 59.09 2h47 s ILE 47 Cb -0.14 -1.59 0.02 0.00 1.25 0.00 0.00 42.46 42.00 2h47 s ILE 47 CO 0.19 -0.94 -0.15 -0.31 0.24 0.00 0.00 174.94 173.97 2h47 s TYR 48 N -3.77 2.14 -0.29 1.37 1.51 0.22 -1.78 117.35 116.76 2h47 s TYR 48 Ca 0.09 -1.15 -0.09 0.00 -1.01 0.00 0.00 57.07 54.91 2h47 s TYR 48 Cb 0.07 -1.56 -0.02 0.00 -0.11 0.00 0.00 41.96 40.33 2h47 s TYR 48 CO -0.08 -0.62 0.14 0.08 -1.11 0.00 0.00 175.55 173.97 2h47 s VAL 49 N 1.32 4.69 -0.54 0.71 1.01 0.34 -1.36 120.40 126.57 2h47 s VAL 49 Ca 0.01 -0.24 -0.23 0.00 0.00 0.00 0.00 61.98 61.53 2h47 s VAL 49 Cb -0.13 -3.31 0.05 0.00 0.00 0.00 0.00 36.38 32.98 2h47 s VAL 49 CO -0.08 0.17 0.84 -0.32 0.00 0.00 0.00 175.10 175.71 2h47 s MET 50 N 1.65 3.26 -0.53 2.72 1.75 -0.84 -0.19 119.30 127.12 2h47 s MET 50 Ca 0.06 -0.46 -0.20 0.00 -1.25 0.00 0.00 55.69 53.83 2h47 s MET 50 Cb -0.16 -4.07 0.06 0.00 2.84 0.00 0.00 34.83 33.50 2h47 s MET 50 CO 0.07 -1.41 0.70 0.34 -0.65 0.00 0.00 175.02 174.07 2h47 s ASP 51 N 2.81 6.23 0.42 1.11 -1.08 -0.20 -4.12 116.67 121.85 2h47 s ASP 51 Ca 0.26 -0.89 0.20 0.00 -0.52 0.00 0.00 52.55 51.59 2h47 s ASP 51 Cb -0.15 -2.32 0.94 0.00 -1.46 0.00 0.00 42.92 39.93 2h47 s ASP 51 CO 0.17 -1.00 1.87 0.77 0.52 0.00 0.00 175.17 177.50 2h47 h SER 52 N 9.10 0.00 -6.59 -0.34 4.64 -1.43 -2.47 113.55 116.45 2h47 h SER 52 Ca -0.28 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.53 2h47 h SER 52 Cb 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2h47 h SER 52 CO 1.01 0.28 -0.96 0.52 -0.87 0.00 0.00 176.83 176.82 2h47 n VAL 53 N -3.70 -3.90 -0.34 0.95 0.31 -1.21 -4.27 118.33 106.16 2h47 n VAL 53 Ca -0.01 -0.72 0.19 0.00 -0.01 0.00 0.00 64.34 63.79 2h47 n VAL 53 Cb 0.39 -3.07 0.41 0.00 -0.91 0.00 0.00 33.84 30.67 2h47 n VAL 53 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 2h47 h PHE 54 N -2.14 0.99 0.00 3.52 3.57 -1.90 0.12 116.94 121.10 2h47 h PHE 54 Ca -0.68 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 60.86 2h47 h PHE 54 Cb 1.38 -0.28 -0.00 0.00 2.79 0.00 0.00 35.95 39.84 2h47 h PHE 54 CO 0.39 -0.00 -0.01 0.52 -2.23 0.00 0.00 178.31 176.98 2h47 h MET 55 N 0.51 0.00 -0.88 1.11 2.86 -1.99 -2.87 114.93 113.67 2h47 h MET 55 Ca 0.67 0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.97 2h47 h MET 55 Cb 1.35 0.00 -0.32 0.00 0.06 0.00 0.00 31.60 32.70 2h47 h MET 55 CO -0.51 0.01 -0.93 0.72 1.06 0.00 0.00 176.91 177.26 2h47 n HIS 56 N -3.29 -0.31 0.00 -0.22 8.25 0.12 -4.99 115.22 114.79 2h47 n HIS 56 Ca -0.03 -2.74 0.00 0.00 -0.26 0.00 0.00 57.72 54.69 2h47 n HIS 56 Cb 0.09 0.28 0.00 0.00 1.12 0.00 0.00 29.99 31.48 2h47 n HIS 56 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2h47 n LEU 57 N -0.07 0.00 -0.35 2.41 7.94 0.20 -0.71 117.00 126.42 2h47 n LEU 57 Ca 0.09 0.20 0.14 0.00 -1.11 0.00 0.00 56.01 55.33 2h47 n LEU 57 Cb 0.78 -0.20 0.61 0.00 0.53 0.00 0.00 43.42 45.14 2h47 n LEU 57 CO 0.15 -0.20 0.92 0.35 -1.11 0.00 0.00 177.39 177.50 2h47 n THR 58 N -1.18 0.02 -2.61 1.96 -2.24 -1.26 -1.52 114.28 107.46 2h47 n THR 58 Ca 0.00 -0.19 -0.16 0.00 -2.27 0.00 0.00 64.05 61.43 2h47 n THR 58 Cb 0.25 0.21 0.02 0.00 -2.10 0.00 0.00 70.33 68.71 2h47 n THR 58 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2h47 n GLU 59 N -0.13 2.00 -2.76 -0.78 2.13 0.11 -3.72 120.64 117.49 2h47 n GLU 59 Ca 0.20 -3.73 -0.37 0.00 0.66 0.00 0.00 57.16 53.91 2h47 n GLU 59 Cb 0.28 -1.63 -0.06 0.00 0.27 0.00 0.00 31.44 30.30 2h47 n GLU 59 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 2h47 s SER 60 N -3.26 7.28 0.19 4.31 1.04 0.10 -4.88 113.70 118.48 2h47 s SER 60 Ca 0.35 1.85 -0.04 0.00 0.48 0.00 0.00 55.95 58.59 2h47 s SER 60 Cb 0.43 -2.58 -0.03 0.00 0.10 0.00 0.00 66.02 63.95 2h47 s SER 60 CO -0.05 -0.11 0.21 0.00 0.98 0.00 0.00 173.24 174.27 2h47 s ARG 61 N -2.12 1.22 -0.24 4.02 3.03 -0.93 0.94 118.95 124.86 2h47 s ARG 61 Ca 0.51 -1.46 -0.07 0.00 2.03 0.00 0.00 55.73 56.73 2h47 s ARG 61 Cb -0.19 0.32 -0.03 0.00 -1.03 0.00 0.00 34.95 34.02 2h47 s ARG 61 CO 0.24 -0.43 0.07 0.08 -1.13 0.00 0.00 175.30 174.13 2h47 s VAL 62 N -4.09 4.38 -0.12 4.99 1.01 0.09 -1.03 120.40 125.63 2h47 s VAL 62 Ca 0.30 -0.15 -0.14 0.00 0.00 0.00 0.00 61.98 61.99 2h47 s VAL 62 Cb 0.05 -3.04 -0.05 0.00 0.00 0.00 0.00 36.38 33.34 2h47 s VAL 62 CO 0.08 0.35 0.33 -1.00 0.00 0.00 0.00 175.10 174.86 2h47 s HIS 63 N 1.47 3.53 -0.20 5.22 3.76 0.74 -1.64 115.29 128.17 2h47 s HIS 63 Ca 0.06 0.71 -0.08 0.00 -0.15 0.00 0.00 55.06 55.59 2h47 s HIS 63 Cb -0.15 -2.33 -0.04 0.00 1.11 0.00 0.00 32.58 31.17 2h47 s HIS 63 CO 0.04 0.35 0.08 0.08 -0.85 0.00 0.00 174.74 174.43 2h47 s VAL 64 N 0.07 4.84 0.22 -0.90 1.01 0.50 -0.50 120.40 125.64 2h47 s VAL 64 Ca 0.19 -0.01 0.05 0.00 0.00 0.00 0.00 61.98 62.21 2h47 s VAL 64 Cb -0.14 -3.21 -0.05 0.00 0.00 0.00 0.00 36.38 32.99 2h47 s VAL 64 CO 0.07 0.43 -0.07 -0.31 0.00 0.00 0.00 175.10 175.21 2h47 s TYR 65 N 0.64 1.64 -0.38 5.22 1.51 -0.73 -0.32 117.35 124.92 2h47 s TYR 65 Ca 0.04 -0.76 -0.13 0.00 -1.01 0.00 0.00 57.07 55.22 2h47 s TYR 65 Cb -0.13 -0.89 0.02 0.00 -0.11 0.00 0.00 41.96 40.86 2h47 s TYR 65 CO 0.01 0.15 0.24 0.34 -1.11 0.00 0.00 175.55 175.19 2h47 s ASP 66 N -3.32 5.89 0.54 2.29 -1.08 -0.49 -0.89 116.67 119.62 2h47 s ASP 66 Ca 0.25 -0.92 0.34 0.00 -0.52 0.00 0.00 52.55 51.70 2h47 s ASP 66 Cb 0.03 -2.08 1.38 0.00 -1.46 0.00 0.00 42.92 40.79 2h47 s ASP 66 CO 0.08 -0.40 1.98 0.10 0.52 0.00 0.00 175.17 177.45 2h47 h TYR 67 N 8.51 0.00 -0.06 -5.34 -0.00 -1.52 0.53 116.97 119.10 2h47 h TYR 67 Ca -0.27 0.00 -0.13 0.00 0.00 0.00 0.00 58.73 58.34 2h47 h TYR 67 Cb 1.11 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.83 2h47 h TYR 67 CO 0.57 0.00 -0.55 1.79 -0.00 0.00 0.00 178.16 179.97 2h47 h THR 68 N 0.00 1.37 0.00 -0.90 1.35 -1.93 -3.36 112.91 109.44 2h47 h THR 68 Ca 0.00 -1.86 0.00 0.00 -0.55 0.00 0.00 66.41 64.00 2h47 h THR 68 Cb 0.49 1.94 0.00 0.00 -1.73 0.00 0.00 68.15 68.84 2h47 h THR 68 CO 0.00 0.54 0.00 -0.46 -0.25 0.00 0.00 175.52 175.35 2h47 n ASN 69 N -3.91 0.52 -0.66 5.36 0.23 -1.07 -5.01 115.26 110.72 2h47 n ASN 69 Ca -0.02 -1.16 -0.09 0.00 -0.53 0.00 0.00 54.58 52.79 2h47 n ASN 69 Cb 0.57 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 38.23 2h47 n ASN 69 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2h47 n GLY 70 N -0.08 0.96 3.75 4.83 0.00 0.18 -4.97 105.19 109.86 2h47 n GLY 70 Ca 0.00 -0.21 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 2h47 n GLY 70 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2h47 s LYS 71 N -2.48 4.77 -0.11 1.61 2.20 -1.20 -4.82 119.74 119.71 2h47 s LYS 71 Ca 0.00 1.60 -0.28 0.00 -0.36 0.00 0.00 55.97 56.92 2h47 s LYS 71 Cb 0.00 -3.26 -0.02 0.00 -1.51 0.00 0.00 37.83 33.05 2h47 s LYS 71 CO 0.00 0.39 0.95 0.12 -0.36 0.00 0.00 175.35 176.44 2h47 s PHE 72 N -1.06 3.51 -0.03 4.03 5.36 -1.26 -1.39 117.98 127.14 2h47 s PHE 72 Ca 0.43 1.51 0.18 0.00 -0.96 0.00 0.00 56.93 58.09 2h47 s PHE 72 Cb -0.28 -3.12 -0.28 0.00 -0.34 0.00 0.00 43.02 39.00 2h47 s PHE 72 CO 0.35 -0.19 0.39 1.28 -1.46 0.00 0.00 175.22 175.59 2h47 n LEU 73 N 4.88 0.00 0.00 6.12 4.77 0.57 -4.96 117.00 128.37 2h47 n LEU 73 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 2h47 n LEU 73 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 2h47 n LEU 73 CO 0.51 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 2h47 n GLY 74 N 1.49 -0.63 3.77 -0.72 0.00 -1.20 -4.79 105.19 103.12 2h47 n GLY 74 Ca -0.03 -1.44 -0.09 0.00 0.00 0.00 0.00 46.02 44.46 2h47 n GLY 74 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2h47 s MET 75 N -2.00 1.93 -0.13 1.61 0.23 -1.26 -0.37 119.30 119.31 2h47 s MET 75 Ca 0.00 -1.25 -0.04 0.00 -1.03 0.00 0.00 55.69 53.37 2h47 s MET 75 Cb 0.00 0.58 0.06 0.00 -1.53 0.00 0.00 34.83 33.94 2h47 s MET 75 CO 0.00 -0.88 0.13 0.08 -2.03 0.00 0.00 175.02 172.32 2h47 s VAL 76 N -3.28 -0.18 0.21 5.16 1.01 -0.65 -4.96 120.40 117.70 2h47 s VAL 76 Ca 0.16 0.11 -0.30 0.00 0.00 0.00 0.00 61.98 61.94 2h47 s VAL 76 Cb -0.04 -0.43 -0.09 0.00 0.00 0.00 0.00 36.38 35.81 2h47 s VAL 76 CO 0.10 -0.06 1.40 -2.16 0.00 0.00 0.00 175.10 174.38 2h47 s PRO 77 N 2.22 4.31 -0.20 2.72 0.04 -1.26 -0.73 135.00 142.10 2h47 s PRO 77 Ca 0.04 2.19 0.13 0.00 0.04 0.00 0.00 61.00 63.40 2h47 s PRO 77 Cb -0.14 -3.16 0.43 0.00 0.04 0.00 0.00 34.50 31.67 2h47 s PRO 77 CO -0.07 -0.38 1.21 0.25 0.04 0.00 0.00 177.00 178.04 2h47 n THR 78 N 2.79 1.96 0.00 1.26 -2.24 0.27 -4.91 114.28 113.41 2h47 n THR 78 Ca 0.08 -3.09 0.00 0.00 -2.27 0.00 0.00 64.05 58.77 2h47 n THR 78 Cb 0.41 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 2h47 n THR 78 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2h47 n ALA 79 N -0.87 0.00 -2.62 6.98 0.00 -1.14 -3.28 120.51 119.58 2h47 n ALA 79 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.23 2h47 n ALA 79 Cb 0.78 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.17 2h47 n ALA 79 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2h47 s PHE 80 N 0.00 3.26 -1.15 0.00 5.36 -1.24 0.01 117.98 124.21 2h47 s PHE 80 Ca 0.00 0.81 -0.29 0.00 -0.96 0.00 0.00 56.93 56.50 2h47 s PHE 80 Cb 0.00 -2.97 0.03 0.00 -0.34 0.00 0.00 43.02 39.75 2h47 s PHE 80 CO 0.00 -0.41 0.69 -1.71 -1.46 0.00 0.00 175.22 172.33 2h47 n ASN 81 N 5.88 -4.43 -4.83 6.13 5.15 -0.57 -3.53 115.26 119.06 2h47 n ASN 81 Ca 0.01 -1.21 -0.33 0.00 -0.60 0.00 0.00 54.58 52.45 2h47 n ASN 81 Cb 0.49 -1.91 -0.07 0.00 -0.53 0.00 0.00 39.78 37.75 2h47 n ASN 81 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 2h47 s GLY 82 N -3.44 2.38 0.37 8.20 0.00 -1.20 -4.76 107.32 108.86 2h47 s GLY 82 Ca 0.43 0.31 0.08 0.00 0.00 0.00 0.00 44.72 45.54 2h47 s GLY 82 CO 0.95 0.58 0.13 0.30 0.00 0.00 0.00 173.10 175.05 2h47 s HIS 83 N -2.12 2.63 0.13 1.90 3.76 -0.09 -4.92 115.29 116.57 2h47 s HIS 83 Ca 0.60 -0.47 -0.24 0.00 -0.15 0.00 0.00 55.06 54.80 2h47 s HIS 83 Cb -0.09 -1.72 0.07 0.00 1.11 0.00 0.00 32.58 31.94 2h47 s HIS 83 CO 0.14 0.31 0.60 0.54 -0.85 0.00 0.00 174.74 175.48 2h47 s VAL 84 N -2.51 0.00 0.15 -0.90 0.11 -1.26 -2.04 120.40 113.95 2h47 s VAL 84 Ca 0.38 -0.03 -0.25 0.00 -2.93 0.00 0.00 61.98 59.16 2h47 s VAL 84 Cb 0.00 -1.01 0.06 0.00 -1.53 0.00 0.00 36.38 33.91 2h47 s VAL 84 CO 0.22 -0.02 0.85 0.00 -3.33 0.00 0.00 175.10 172.83 2h47 s GLN 85 N -3.38 1.25 -0.02 1.54 -2.07 -0.49 -5.00 119.66 111.48 2h47 s GLN 85 Ca -0.01 -0.63 0.03 0.00 -1.82 0.00 0.00 55.36 52.93 2h47 s GLN 85 Cb -0.01 0.46 -0.03 0.00 -1.09 0.00 0.00 33.01 32.35 2h47 s GLN 85 CO -0.10 -0.56 -0.08 0.08 -1.32 0.00 0.00 175.29 173.31 2h47 s VAL 86 N -3.44 3.55 0.50 3.63 1.01 -1.26 -1.31 120.40 123.09 2h47 s VAL 86 Ca 0.09 -0.71 -0.23 0.00 0.00 0.00 0.00 61.98 61.13 2h47 s VAL 86 Cb -0.02 -2.50 -0.06 0.00 0.00 0.00 0.00 36.38 33.79 2h47 s VAL 86 CO -0.01 0.47 1.35 -0.94 0.00 0.00 0.00 175.10 175.97 2h47 s SER 87 N -1.18 5.61 0.23 3.32 1.04 -0.30 -4.91 113.70 117.51 2h47 s SER 87 Ca 0.15 2.75 -0.07 0.00 0.48 0.00 0.00 55.95 59.26 2h47 s SER 87 Cb -0.11 -2.64 0.30 0.00 0.10 0.00 0.00 66.02 63.68 2h47 s SER 87 CO 0.05 -1.34 1.83 0.78 0.98 0.00 0.00 173.24 175.54 2h47 h ASN 88 N 1.85 0.72 0.07 7.02 2.35 -1.92 0.69 115.58 126.36 2h47 h ASN 88 Ca -0.51 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.27 2h47 h ASN 88 Cb 1.28 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 39.53 2h47 h ASN 88 CO 0.59 0.46 0.00 -0.90 -1.65 0.00 0.00 177.43 175.93 2h47 n ASP 89 N -4.69 0.00 -3.27 5.81 5.68 -1.26 -4.86 116.55 113.96 2h47 n ASP 89 Ca 0.11 -0.17 -0.12 0.00 -0.50 0.00 0.00 54.79 54.11 2h47 n ASP 89 Cb 0.18 -0.10 0.03 0.00 -1.14 0.00 0.00 41.12 40.10 2h47 n ASP 89 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2h47 n GLY 90 N -0.35 -1.18 0.00 6.12 0.00 0.23 -4.93 105.19 105.08 2h47 n GLY 90 Ca 0.07 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.61 2h47 n GLY 90 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h47 n LYS 91 N -2.72 0.50 -4.28 1.61 5.02 -1.26 -5.01 118.16 112.02 2h47 n LYS 91 Ca -0.06 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.01 2h47 n LYS 91 Cb 0.57 -0.37 -0.12 0.00 -0.02 0.00 0.00 35.03 35.09 2h47 n LYS 91 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2h47 s LYS 92 N -0.89 1.12 -0.32 1.97 -0.14 -1.26 -0.51 119.74 119.71 2h47 s LYS 92 Ca 0.00 -1.24 -0.05 0.00 -1.36 0.00 0.00 55.97 53.33 2h47 s LYS 92 Cb 0.00 -1.21 0.04 0.00 -1.68 0.00 0.00 37.83 34.98 2h47 s LYS 92 CO 0.00 0.26 0.07 0.42 -0.76 0.00 0.00 175.35 175.34 2h47 s ILE 93 N -1.66 3.53 -0.08 2.17 1.01 0.39 -1.15 121.20 125.41 2h47 s ILE 93 Ca 0.09 -1.20 -0.23 0.00 0.00 0.00 0.00 60.65 59.31 2h47 s ILE 93 Cb -0.08 -3.00 -0.03 0.00 0.01 0.00 0.00 42.46 39.36 2h47 s ILE 93 CO 0.05 -0.14 0.70 -0.31 0.00 0.00 0.00 174.94 175.24 2h47 s TYR 94 N 1.36 3.56 0.20 3.97 4.12 -0.42 -1.06 117.35 129.07 2h47 s TYR 94 Ca -0.03 1.23 0.07 0.00 0.02 0.00 0.00 57.07 58.36 2h47 s TYR 94 Cb -0.19 -2.82 -0.05 0.00 -1.52 0.00 0.00 41.96 37.38 2h47 s TYR 94 CO 0.02 0.06 -0.12 0.95 0.02 0.00 0.00 175.55 176.47 2h47 s THR 95 N 0.93 1.54 -0.00 -0.71 -4.23 0.22 -1.40 115.64 111.99 2h47 s THR 95 Ca 0.37 -2.16 0.00 0.00 -1.18 0.00 0.00 61.69 58.73 2h47 s THR 95 Cb -0.18 -2.04 0.00 0.00 1.34 0.00 0.00 72.50 71.63 2h47 s THR 95 CO 0.17 -0.60 0.00 -0.32 -0.54 0.00 0.00 174.62 173.33 2h47 s MET 96 N -3.69 0.04 0.19 3.99 0.00 -0.87 -0.05 119.30 118.91 2h47 s MET 96 Ca 0.22 0.01 -0.19 0.00 0.00 0.00 0.00 55.69 55.73 2h47 s MET 96 Cb 0.01 -0.08 0.07 0.00 0.00 0.00 0.00 34.83 34.82 2h47 s MET 96 CO 0.06 -0.02 0.92 -2.37 0.00 0.00 0.00 175.02 173.61 2h47 n THR 97 N 3.26 0.00 -4.78 10.11 5.66 -0.91 -0.92 114.28 126.69 2h47 n THR 97 Ca -0.15 -0.57 -0.26 0.00 -3.05 0.00 0.00 64.05 60.02 2h47 n THR 97 Cb 0.58 0.74 -0.16 0.00 -1.55 0.00 0.00 70.33 69.94 2h47 n THR 97 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2h47 s THR 98 N -2.11 1.39 0.36 1.09 2.01 -1.23 -1.97 115.64 115.18 2h47 s THR 98 Ca 0.20 -0.66 0.09 0.00 0.31 0.00 0.00 61.69 61.63 2h47 s THR 98 Cb -0.03 -1.22 -0.06 0.00 0.01 0.00 0.00 72.50 71.20 2h47 s THR 98 CO 0.06 0.41 0.00 -0.31 -0.69 0.00 0.00 174.62 174.09 2h47 s TYR 99 N 0.31 2.52 -0.17 4.92 1.51 -0.42 -3.79 117.35 122.23 2h47 s TYR 99 Ca -0.10 -0.49 -0.08 0.00 -1.01 0.00 0.00 57.07 55.39 2h47 s TYR 99 Cb -0.14 -1.54 0.06 0.00 -0.11 0.00 0.00 41.96 40.23 2h47 s TYR 99 CO 0.04 0.47 0.40 -1.01 -1.11 0.00 0.00 175.55 174.33 2h47 s HIS 100 N -2.57 -0.62 0.54 2.71 3.76 -1.26 -1.68 115.29 116.18 2h47 s HIS 100 Ca 0.35 1.29 0.48 0.00 -0.15 0.00 0.00 55.06 57.03 2h47 s HIS 100 Cb 0.02 0.25 1.71 0.00 1.11 0.00 0.00 32.58 35.67 2h47 s HIS 100 CO 0.19 -0.36 1.58 0.93 -0.85 0.00 0.00 174.74 176.22 2h47 h GLU 101 N 7.36 0.00 0.00 1.40 5.08 -1.62 0.40 114.58 127.20 2h47 h GLU 101 Ca -0.32 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.00 2h47 h GLU 101 Cb 1.17 -0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.33 2h47 h GLU 101 CO 0.26 0.00 -0.49 0.54 -1.00 0.00 0.00 179.01 178.33 2h47 n ARG 102 N -4.04 0.55 0.00 2.33 5.12 0.11 -5.00 116.66 115.72 2h47 n ARG 102 Ca 0.44 -1.94 0.00 0.00 -1.93 0.00 0.00 57.85 54.42 2h47 n ARG 102 Cb 1.96 -0.81 0.00 0.00 -1.16 0.00 0.00 32.46 32.46 2h47 n ARG 102 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 2h47 n ILE 103 N -0.42 0.00 1.38 0.55 5.41 0.14 -3.32 119.36 123.10 2h47 n ILE 103 Ca 0.08 0.00 0.13 0.00 1.00 0.00 0.00 62.75 63.97 2h47 n ILE 103 Cb 0.78 0.00 0.43 0.00 -0.71 0.00 0.00 39.64 40.14 2h47 n ILE 103 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2h47 n THR 104 N 0.00 0.00 -3.53 1.39 -2.24 -1.26 -4.65 114.28 103.98 2h47 n THR 104 Ca 0.00 -0.26 -0.10 0.00 -2.27 0.00 0.00 64.05 61.42 2h47 n THR 104 Cb 0.00 0.64 -0.02 0.00 -2.10 0.00 0.00 70.33 68.85 2h47 n THR 104 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2h47 s ARG 105 N -2.09 1.21 0.00 -0.78 1.70 -1.21 -5.17 118.95 112.61 2h47 s ARG 105 Ca 0.34 -0.51 0.00 0.00 -0.47 0.00 0.00 55.73 55.09 2h47 s ARG 105 Cb 0.21 0.52 0.00 0.00 -0.57 0.00 0.00 34.95 35.10 2h47 s ARG 105 CO 0.37 -0.54 0.00 0.41 -1.08 0.00 0.00 175.30 174.46 2h47 n GLY 106 N -0.36 1.26 3.73 3.88 0.00 -1.26 -0.72 105.19 111.72 2h47 n GLY 106 Ca -0.12 -2.06 -0.42 0.00 0.00 0.00 0.00 46.02 43.42 2h47 n GLY 106 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2h47 n LYS 107 N 1.05 2.57 -3.35 1.61 4.81 -1.26 -4.55 118.16 119.04 2h47 n LYS 107 Ca 0.00 0.91 -0.38 0.00 -0.87 0.00 0.00 58.31 57.97 2h47 n LYS 107 Cb 0.00 -2.67 -0.06 0.00 0.02 0.00 0.00 35.03 32.32 2h47 n LYS 107 CO 0.00 0.00 0.00 0.50 1.17 0.00 0.00 177.40 179.07 2h47 s ARG 108 N -0.45 4.12 -0.24 1.64 3.52 -1.26 -2.40 118.95 123.88 2h47 s ARG 108 Ca 0.65 0.62 -0.02 0.00 -0.13 0.00 0.00 55.73 56.85 2h47 s ARG 108 Cb -0.53 -3.24 0.08 0.00 -1.56 0.00 0.00 34.95 29.70 2h47 s ARG 108 CO 0.48 0.63 0.07 -1.12 -0.81 0.00 0.00 175.30 174.55 2h47 s SER 109 N -1.00 3.30 -0.20 -2.12 0.01 -0.68 -4.94 113.70 108.07 2h47 s SER 109 Ca 0.27 -1.11 -0.17 0.00 1.31 0.00 0.00 55.95 56.25 2h47 s SER 109 Cb -0.18 -0.63 -0.04 0.00 0.21 0.00 0.00 66.02 65.38 2h47 s SER 109 CO 0.17 -0.36 0.45 -1.81 0.41 0.00 0.00 173.24 172.10 2h47 s ASP 110 N 1.83 6.49 0.21 2.44 1.01 -1.26 -1.30 116.67 126.09 2h47 s ASP 110 Ca 0.03 0.58 0.01 0.00 0.71 0.00 0.00 52.55 53.89 2h47 s ASP 110 Cb -0.17 -2.26 -0.05 0.00 1.01 0.00 0.00 42.92 41.46 2h47 s ASP 110 CO -0.17 -0.12 0.06 0.68 0.21 0.00 0.00 175.17 175.84 2h47 s VAL 111 N 1.42 0.53 -0.12 -1.27 -7.23 -0.83 -1.14 120.40 111.77 2h47 s VAL 111 Ca 0.21 -1.99 0.02 0.00 -1.81 0.00 0.00 61.98 58.41 2h47 s VAL 111 Cb -0.15 -2.39 -0.01 0.00 0.56 0.00 0.00 36.38 34.39 2h47 s VAL 111 CO 0.09 -0.21 -0.19 -0.69 -0.31 0.00 0.00 175.10 173.78 2h47 s VAL 112 N -3.77 2.49 -0.04 1.32 1.01 -0.62 -2.15 120.40 118.64 2h47 s VAL 112 Ca 0.32 -0.86 0.05 0.00 0.00 0.00 0.00 61.98 61.49 2h47 s VAL 112 Cb 0.07 -2.00 -0.02 0.00 0.00 0.00 0.00 36.38 34.43 2h47 s VAL 112 CO 0.09 0.54 -0.19 -1.61 0.00 0.00 0.00 175.10 173.93 2h47 s GLU 113 N 0.38 2.34 -0.29 2.72 2.02 0.92 -0.58 118.70 126.21 2h47 s GLU 113 Ca -0.15 -0.79 -0.04 0.00 0.02 0.00 0.00 54.97 54.01 2h47 s GLU 113 Cb -0.17 -2.24 0.03 0.00 0.10 0.00 0.00 34.13 31.85 2h47 s GLU 113 CO 0.07 0.60 0.03 0.08 0.02 0.00 0.00 175.26 176.06 2h47 s VAL 114 N -0.68 3.46 0.08 2.63 1.01 -0.62 -0.61 120.40 125.67 2h47 s VAL 114 Ca 0.11 -0.97 0.04 0.00 0.00 0.00 0.00 61.98 61.16 2h47 s VAL 114 Cb -0.10 -2.84 -0.04 0.00 0.00 0.00 0.00 36.38 33.40 2h47 s VAL 114 CO -0.00 0.04 -0.00 0.26 0.00 0.00 0.00 175.10 175.40 2h47 s TRP 115 N 1.39 2.99 0.05 5.22 0.52 -0.22 -1.72 118.94 127.17 2h47 s TRP 115 Ca -0.00 -0.02 -0.30 0.00 0.02 0.00 0.00 56.10 55.80 2h47 s TRP 115 Cb -0.18 -1.55 -0.05 0.00 -1.15 0.00 0.00 33.47 30.54 2h47 s TRP 115 CO -0.00 0.47 1.13 0.34 0.02 0.00 0.00 176.95 178.92 2h47 s ASP 116 N -2.20 7.16 0.28 2.95 3.68 -0.43 0.15 116.67 128.26 2h47 s ASP 116 Ca 0.25 1.92 -0.00 0.00 2.13 0.00 0.00 52.55 56.84 2h47 s ASP 116 Cb -0.12 -2.58 0.41 0.00 -1.45 0.00 0.00 42.92 39.18 2h47 s ASP 116 CO 0.17 -0.41 1.79 0.00 0.13 0.00 0.00 175.17 176.86 2h47 h ALA 117 N 6.76 1.18 0.11 3.66 0.00 -1.09 0.24 119.26 130.13 2h47 h ALA 117 Ca -0.41 -0.24 -0.32 0.00 0.00 0.00 0.00 54.91 53.93 2h47 h ALA 117 Cb 1.22 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 2h47 h ALA 117 CO 0.79 0.54 -1.65 -0.44 0.00 0.00 0.00 179.25 178.49 2h47 h ASP 118 N 0.68 0.36 0.95 0.00 5.19 -1.93 -3.35 116.42 118.32 2h47 h ASP 118 Ca 0.14 -0.58 -0.04 0.00 -0.62 0.00 0.00 57.03 55.94 2h47 h ASP 118 Cb 0.41 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 39.80 2h47 h ASP 118 CO 0.02 1.49 -1.08 0.11 -3.12 0.00 0.00 179.24 176.66 2h47 h LYS 119 N 0.06 0.00 -5.76 3.56 1.79 -1.85 0.26 116.57 114.64 2h47 h LYS 119 Ca -0.29 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 57.84 2h47 h LYS 119 Cb 2.02 0.00 0.14 0.00 -1.58 0.00 0.00 32.23 32.82 2h47 h LYS 119 CO 0.14 0.06 -0.83 1.28 -1.08 0.00 0.00 179.45 179.02 2h47 n LEU 120 N -2.73 -4.14 -4.21 2.94 4.77 0.85 -4.88 117.00 109.60 2h47 n LEU 120 Ca -0.02 -0.74 -0.23 0.00 -0.03 0.00 0.00 56.01 54.99 2h47 n LEU 120 Cb 0.61 -2.96 -0.14 0.00 -2.33 0.00 0.00 43.42 38.60 2h47 n LEU 120 CO 0.41 0.32 -0.50 0.42 -1.33 0.00 0.00 177.39 176.71 2h47 s THR 121 N -3.46 1.44 0.31 -5.08 -4.23 -1.21 -4.90 115.64 98.51 2h47 s THR 121 Ca 0.18 -1.14 -0.29 0.00 -1.18 0.00 0.00 61.69 59.25 2h47 s THR 121 Cb -0.03 -1.27 -0.10 0.00 1.34 0.00 0.00 72.50 72.43 2h47 s THR 121 CO 0.77 0.10 1.31 0.12 -0.54 0.00 0.00 174.62 176.38 2h47 s PHE 122 N -0.85 3.08 0.00 3.99 5.36 -1.26 -1.31 117.98 126.99 2h47 s PHE 122 Ca 0.05 1.37 0.00 0.00 -0.96 0.00 0.00 56.93 57.38 2h47 s PHE 122 Cb -0.08 -3.68 0.00 0.00 -0.34 0.00 0.00 43.02 38.92 2h47 s PHE 122 CO 0.02 -1.90 0.00 0.39 -1.46 0.00 0.00 175.22 172.26 2h47 n GLU 123 N 1.14 0.77 -3.72 10.12 1.02 -0.70 -4.91 120.64 124.37 2h47 n GLU 123 Ca 0.01 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.02 2h47 n GLU 123 Cb 0.42 -0.73 -0.10 0.00 -0.02 0.00 0.00 31.44 31.02 2h47 n GLU 123 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2h47 s LYS 124 N -1.45 0.54 -0.12 3.49 2.20 -1.12 -5.00 119.74 118.27 2h47 s LYS 124 Ca 0.00 0.62 -0.01 0.00 -0.36 0.00 0.00 55.97 56.22 2h47 s LYS 124 Cb 0.00 0.26 -0.02 0.00 -1.51 0.00 0.00 37.83 36.56 2h47 s LYS 124 CO 0.00 -0.07 -0.09 -2.00 -0.36 0.00 0.00 175.35 172.83 2h47 s GLU 125 N 0.21 3.32 -0.20 4.03 2.12 -1.26 -1.58 118.70 125.34 2h47 s GLU 125 Ca -0.00 -0.62 -0.01 0.00 0.36 0.00 0.00 54.97 54.70 2h47 s GLU 125 Cb -0.03 -2.69 0.01 0.00 0.26 0.00 0.00 34.13 31.68 2h47 s GLU 125 CO 0.01 0.31 -0.14 0.42 -0.54 0.00 0.00 175.26 175.32 2h47 s ILE 126 N 0.12 2.54 0.35 -3.70 1.01 0.25 -4.97 121.20 116.80 2h47 s ILE 126 Ca -0.04 -0.82 -0.29 0.00 0.00 0.00 0.00 60.65 59.50 2h47 s ILE 126 Cb -0.14 -2.13 -0.11 0.00 0.01 0.00 0.00 42.46 40.09 2h47 s ILE 126 CO 0.04 0.46 1.51 -1.20 0.00 0.00 0.00 174.94 175.76 2h47 n SER 127 N 4.68 3.79 -4.10 3.58 7.64 -1.26 -1.59 113.62 126.35 2h47 n SER 127 Ca -0.20 1.21 -0.16 0.00 1.01 0.00 0.00 58.87 60.73 2h47 n SER 127 Cb 0.50 -1.61 -0.12 0.00 -1.01 0.00 0.00 64.21 61.97 2h47 n SER 127 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2h47 s LEU 128 N -1.59 2.24 0.38 -3.43 1.43 -0.29 -4.32 118.68 113.10 2h47 s LEU 128 Ca 0.56 -0.53 -0.27 0.00 -1.03 0.00 0.00 54.13 52.85 2h47 s LEU 128 Cb -0.48 -0.34 -0.10 0.00 0.03 0.00 0.00 46.19 45.30 2h47 s LEU 128 CO 0.60 -0.12 1.39 -2.16 0.23 0.00 0.00 176.35 176.29 2h47 s PRO 129 N -1.49 4.09 -0.13 1.29 0.04 -1.26 -4.32 135.00 133.22 2h47 s PRO 129 Ca -0.05 2.37 -0.01 0.00 0.04 0.00 0.00 61.00 63.35 2h47 s PRO 129 Cb -0.09 -2.91 -0.01 0.00 0.04 0.00 0.00 34.50 31.52 2h47 s PRO 129 CO 0.01 -0.47 1.12 -0.35 0.04 0.00 0.00 177.00 177.35 2h47 n PRO 130 N 0.40 0.34 -0.11 0.56 -0.04 -1.26 -3.62 135.00 131.27 2h47 n PRO 130 Ca 0.02 -0.55 0.00 0.00 -0.04 0.00 0.00 63.50 62.93 2h47 n PRO 130 Cb 0.41 -1.96 0.00 0.00 -0.04 0.00 0.00 33.50 31.91 2h47 n PRO 130 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2h47 n LYS 131 N 4.43 0.00 -1.72 0.54 2.85 -1.26 -5.03 118.16 117.97 2h47 n LYS 131 Ca 0.07 -0.27 -0.42 0.00 -1.05 0.00 0.00 58.31 56.64 2h47 n LYS 131 Cb 0.04 -0.22 -0.01 0.00 -0.65 0.00 0.00 35.03 34.19 2h47 n LYS 131 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 177.40 180.24 2h47 n ARG 132 N 0.00 2.31 -1.58 -1.58 -4.01 -1.24 -1.34 116.66 109.23 2h47 n ARG 132 Ca 0.00 0.81 -0.48 0.00 -1.04 0.00 0.00 57.85 57.14 2h47 n ARG 132 Cb 0.52 -2.46 -0.04 0.00 -3.04 0.00 0.00 32.46 27.45 2h47 n ARG 132 CO 0.00 0.00 0.00 1.55 -3.04 0.00 0.00 177.63 176.14 2h47 n VAL 133 N 0.66 1.11 -3.91 8.89 3.14 0.15 -4.74 118.33 123.63 2h47 n VAL 133 Ca 0.05 -0.28 -0.30 0.00 -2.96 0.00 0.00 64.34 60.84 2h47 n VAL 133 Cb 0.36 -0.86 -0.15 0.00 -1.06 0.00 0.00 33.84 32.14 2h47 n VAL 133 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 2h47 s GLN 134 N -0.60 1.39 0.04 1.45 -0.21 -1.26 -5.04 119.66 115.43 2h47 s GLN 134 Ca 0.70 -1.86 -0.17 0.00 0.02 0.00 0.00 55.36 54.05 2h47 s GLN 134 Cb -0.82 -2.88 0.06 0.00 1.00 0.00 0.00 33.01 30.36 2h47 s GLN 134 CO 0.54 -1.01 0.78 0.41 -2.12 0.00 0.00 175.29 173.90 2h47 n GLY 135 N 4.09 0.54 3.55 3.09 0.00 -1.26 -5.15 105.19 110.04 2h47 n GLY 135 Ca 0.03 -1.01 -0.39 0.00 0.00 0.00 0.00 46.02 44.65 2h47 n GLY 135 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2h47 n LEU 136 N 0.00 2.18 -3.54 0.99 4.77 -1.26 -4.84 117.00 115.31 2h47 n LEU 136 Ca 0.01 0.82 -0.39 0.00 -0.03 0.00 0.00 56.01 56.43 2h47 n LEU 136 Cb 0.38 -1.28 -0.03 0.00 -2.33 0.00 0.00 43.42 40.16 2h47 n LEU 136 CO 0.12 -2.32 2.40 0.59 -1.33 0.00 0.00 177.39 176.84 2h47 n ASN 137 N 0.03 3.78 -4.77 -1.43 3.02 -1.26 -4.96 115.26 109.67 2h47 n ASN 137 Ca 0.12 -2.64 -0.39 0.00 -0.03 0.00 0.00 54.58 51.64 2h47 n ASN 137 Cb 0.46 -1.27 -0.06 0.00 -0.61 0.00 0.00 39.78 38.29 2h47 n ASN 137 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2h47 s TYR 138 N 4.05 3.90 0.22 3.10 1.51 -1.26 -4.49 117.35 124.38 2h47 s TYR 138 Ca 0.52 1.75 -0.08 0.00 -1.01 0.00 0.00 57.07 58.25 2h47 s TYR 138 Cb 0.14 -2.86 0.32 0.00 -0.11 0.00 0.00 41.96 39.45 2h47 s TYR 138 CO 0.03 0.45 1.73 -0.44 -1.11 0.00 0.00 175.55 176.21 2h47 h ASP 139 N 4.08 0.21 0.00 2.29 3.32 -1.94 -2.65 116.42 121.72 2h47 h ASP 139 Ca -0.46 0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.68 2h47 h ASP 139 Cb 1.20 0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.83 2h47 h ASP 139 CO 0.67 0.11 0.00 0.61 -1.72 0.00 0.00 179.24 178.91 2h47 n GLY 140 N -1.31 -0.04 0.02 2.75 0.00 -1.26 -2.20 105.19 103.15 2h47 n GLY 140 Ca 0.10 -0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.22 2h47 n GLY 140 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2h47 n LEU 141 N -0.83 0.58 -3.29 0.99 4.77 -1.00 0.11 117.00 118.33 2h47 n LEU 141 Ca 0.01 -0.12 -0.15 0.00 -0.03 0.00 0.00 56.01 55.72 2h47 n LEU 141 Cb 0.00 -0.06 -0.06 0.00 -2.33 0.00 0.00 43.42 40.97 2h47 n LEU 141 CO 0.00 0.08 -0.12 0.12 -1.33 0.00 0.00 177.39 176.15 2h47 s PHE 142 N -3.22 -0.44 0.00 -1.77 5.36 -0.94 -1.97 117.98 115.01 2h47 s PHE 142 Ca 0.02 -0.86 0.00 0.00 -0.96 0.00 0.00 56.93 55.14 2h47 s PHE 142 Cb 0.15 -0.31 0.00 0.00 -0.34 0.00 0.00 43.02 42.52 2h47 s PHE 142 CO 0.84 -1.01 0.00 0.54 -1.46 0.00 0.00 175.22 174.13 2h47 n ARG 143 N 3.96 2.04 -3.77 10.12 5.12 -0.53 -4.79 116.66 128.80 2h47 n ARG 143 Ca 0.14 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.93 2h47 n ARG 143 Cb 0.48 0.00 -0.10 0.00 -1.16 0.00 0.00 32.46 31.68 2h47 n ARG 143 CO 0.00 0.00 0.00 1.14 -1.93 0.00 0.00 177.63 176.84 2h47 s GLN 144 N -1.92 0.46 0.95 5.56 -2.07 -1.26 -0.80 119.66 120.58 2h47 s GLN 144 Ca 0.00 0.18 -0.13 0.00 -1.82 0.00 0.00 55.36 53.59 2h47 s GLN 144 Cb 0.00 0.21 0.02 0.00 -1.09 0.00 0.00 33.01 32.15 2h47 s GLN 144 CO 0.00 -0.09 0.28 0.25 -1.32 0.00 0.00 175.29 174.41 2h47 n THR 145 N 2.32 0.02 0.01 3.63 -2.24 0.40 -4.83 114.28 113.59 2h47 n THR 145 Ca -0.16 -0.23 -0.00 0.00 -2.27 0.00 0.00 64.05 61.39 2h47 n THR 145 Cb 0.57 -0.55 0.30 0.00 -2.10 0.00 0.00 70.33 68.55 2h47 n THR 145 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2h47 h THR 146 N -1.49 1.20 -0.08 4.28 2.02 -1.62 -1.70 112.91 115.51 2h47 h THR 146 Ca -0.43 -0.79 0.00 0.00 0.77 0.00 0.00 66.41 65.96 2h47 h THR 146 Cb 1.28 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 68.66 2h47 h THR 146 CO 0.33 0.27 0.00 -0.90 0.37 0.00 0.00 175.52 175.59 2h47 n ASP 147 N -4.28 0.43 0.00 4.18 5.68 0.95 -4.88 116.55 118.63 2h47 n ASP 147 Ca 0.01 -1.93 0.00 0.00 -0.50 0.00 0.00 54.79 52.37 2h47 n ASP 147 Cb 0.25 -0.05 0.00 0.00 -1.14 0.00 0.00 41.12 40.18 2h47 n ASP 147 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2h47 n GLY 148 N 0.66 0.00 0.24 6.12 0.00 -0.64 -4.81 105.19 106.75 2h47 n GLY 148 Ca 0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.90 2h47 n GLY 148 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2h47 h LYS 149 N 0.00 0.85 -6.81 1.61 1.79 -1.90 -3.46 116.57 108.65 2h47 h LYS 149 Ca 0.00 -0.60 -0.67 0.00 -2.18 0.00 0.00 60.65 57.20 2h47 h LYS 149 Cb 0.61 0.09 -0.22 0.00 -1.58 0.00 0.00 32.23 31.13 2h47 h LYS 149 CO 0.00 1.22 -0.87 -0.06 -1.08 0.00 0.00 179.45 178.67 2h47 s PHE 150 N -3.99 2.25 -0.20 -1.35 0.40 -1.26 -1.40 117.98 112.42 2h47 s PHE 150 Ca -0.11 -0.39 -0.08 0.00 -0.60 0.00 0.00 56.93 55.76 2h47 s PHE 150 Cb 0.10 -1.22 -0.04 0.00 0.51 0.00 0.00 43.02 42.36 2h47 s PHE 150 CO 0.90 0.32 0.09 0.42 0.70 0.00 0.00 175.22 177.65 2h47 s ILE 151 N -1.06 4.95 -0.34 0.64 1.01 -0.68 -0.45 121.20 125.27 2h47 s ILE 151 Ca 0.13 0.03 -0.04 0.00 0.00 0.00 0.00 60.65 60.77 2h47 s ILE 151 Cb -0.10 -3.26 0.06 0.00 0.01 0.00 0.00 42.46 39.17 2h47 s ILE 151 CO 0.06 0.42 0.08 -0.69 0.00 0.00 0.00 174.94 174.81 2h47 s VAL 152 N 0.63 3.34 0.34 2.92 1.01 0.02 -1.41 120.40 127.24 2h47 s VAL 152 Ca 0.05 -1.45 0.08 0.00 0.00 0.00 0.00 61.98 60.66 2h47 s VAL 152 Cb -0.13 -2.99 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 2h47 s VAL 152 CO 0.01 -0.26 0.17 -1.48 0.00 0.00 0.00 175.10 173.54 2h47 s LEU 153 N 1.28 3.31 -0.11 3.92 0.05 -0.62 -1.46 118.68 125.05 2h47 s LEU 153 Ca -0.01 -0.74 -0.04 0.00 0.05 0.00 0.00 54.13 53.39 2h47 s LEU 153 Cb -0.20 -1.81 -0.04 0.00 -2.05 0.00 0.00 46.19 42.09 2h47 s LEU 153 CO -0.00 -0.32 0.05 -1.58 -0.55 0.00 0.00 176.35 173.95 2h47 s GLN 154 N -3.88 3.31 0.30 1.48 2.00 -0.83 -0.29 119.66 121.74 2h47 s GLN 154 Ca 0.38 -0.32 0.10 0.00 -2.00 0.00 0.00 55.36 53.53 2h47 s GLN 154 Cb -0.03 -2.99 -0.05 0.00 0.80 0.00 0.00 33.01 30.74 2h47 s GLN 154 CO 0.23 0.64 -0.07 -0.80 -0.50 0.00 0.00 175.29 174.80 2h47 s ASN 155 N -0.68 4.06 -0.28 6.67 0.01 0.16 -0.68 114.94 124.21 2h47 s ASN 155 Ca 0.12 -0.92 -0.19 0.00 -0.71 0.00 0.00 52.86 51.15 2h47 s ASN 155 Cb -0.12 -0.53 0.09 0.00 0.41 0.00 0.00 41.25 41.09 2h47 s ASN 155 CO 0.02 -0.08 0.74 0.00 -1.51 0.00 0.00 177.10 176.28 2h47 s ALA 156 N -2.47 -1.89 0.00 0.60 0.00 -0.45 -2.81 121.76 114.75 2h47 s ALA 156 Ca 0.32 2.27 0.00 0.00 0.00 0.00 0.00 51.96 54.55 2h47 s ALA 156 Cb -0.03 -1.38 0.00 0.00 0.00 0.00 0.00 23.12 21.70 2h47 s ALA 156 CO 0.18 -0.36 0.71 -1.13 0.00 0.00 0.00 175.76 175.16 2h47 n SER 157 N 3.69 0.00 0.12 0.00 3.41 -1.26 -4.66 113.62 114.92 2h47 n SER 157 Ca -0.18 -1.45 0.13 0.00 -0.26 0.00 0.00 58.87 57.11 2h47 n SER 157 Cb 0.58 -0.09 0.44 0.00 -0.26 0.00 0.00 64.21 64.87 2h47 n SER 157 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2h47 n PRO 158 N 0.00 0.24 -1.64 4.33 -0.04 -1.26 -5.09 135.00 131.55 2h47 n PRO 158 Ca 0.00 0.30 -0.46 0.00 -0.04 0.00 0.00 63.50 63.30 2h47 n PRO 158 Cb 0.59 -1.84 -0.03 0.00 -0.04 0.00 0.00 33.50 32.18 2h47 n PRO 158 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2h47 n ALA 159 N -1.79 0.47 -2.42 0.55 0.00 -1.26 -4.93 120.51 111.13 2h47 n ALA 159 Ca 0.04 0.43 -0.29 0.00 0.00 0.00 0.00 53.44 53.62 2h47 n ALA 159 Cb 0.36 -2.18 -0.03 0.00 0.00 0.00 0.00 19.45 17.59 2h47 n ALA 159 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2h47 s THR 160 N -0.18 4.95 -0.14 0.00 -4.23 -1.26 -3.84 115.64 110.95 2h47 s THR 160 Ca 0.69 0.23 -0.30 0.00 -1.18 0.00 0.00 61.69 61.13 2h47 s THR 160 Cb -0.71 -3.73 0.13 0.00 1.34 0.00 0.00 72.50 69.53 2h47 s THR 160 CO 0.51 -0.38 1.02 -0.94 -0.54 0.00 0.00 174.62 174.30 2h47 s SER 161 N -3.15 -0.32 -0.20 3.99 1.04 -1.12 -3.72 113.70 110.22 2h47 s SER 161 Ca 0.46 0.25 -0.09 0.00 0.48 0.00 0.00 55.95 57.06 2h47 s SER 161 Cb -0.11 0.28 -0.05 0.00 0.10 0.00 0.00 66.02 66.25 2h47 s SER 161 CO 0.30 -0.37 0.10 -0.63 0.98 0.00 0.00 173.24 173.63 2h47 s ILE 162 N -1.65 5.12 0.11 -1.02 1.01 -1.02 0.39 121.20 124.15 2h47 s ILE 162 Ca 0.01 0.09 -0.06 0.00 0.00 0.00 0.00 60.65 60.69 2h47 s ILE 162 Cb -0.01 -3.33 -0.05 0.00 0.01 0.00 0.00 42.46 39.08 2h47 s ILE 162 CO -0.02 0.44 0.36 -0.83 0.00 0.00 0.00 174.94 174.89 2h47 s GLY 163 N 0.46 2.26 -0.07 6.18 0.00 0.60 0.06 107.32 116.82 2h47 s GLY 163 Ca 0.06 -0.53 0.05 0.00 0.00 0.00 0.00 44.72 44.29 2h47 s GLY 163 CO -0.00 -0.41 -0.21 -0.42 0.00 0.00 0.00 173.10 172.06 2h47 s ILE 164 N -1.54 1.76 -0.09 0.90 -1.09 0.45 -1.60 121.20 119.99 2h47 s ILE 164 Ca 0.37 -0.88 0.02 0.00 -2.23 0.00 0.00 60.65 57.94 2h47 s ILE 164 Cb -0.13 -1.51 0.01 0.00 -1.58 0.00 0.00 42.46 39.25 2h47 s ILE 164 CO 0.22 0.49 -0.16 -0.69 -1.23 0.00 0.00 174.94 173.57 2h47 s VAL 165 N 0.13 1.51 -0.51 2.92 1.01 -0.50 -0.71 120.40 124.25 2h47 s VAL 165 Ca -0.09 -0.68 -0.27 0.00 0.00 0.00 0.00 61.98 60.94 2h47 s VAL 165 Cb -0.14 -1.35 0.03 0.00 0.00 0.00 0.00 36.38 34.91 2h47 s VAL 165 CO 0.05 0.44 1.06 -0.62 0.00 0.00 0.00 175.10 176.02 2h47 s ASP 166 N 0.70 6.50 0.17 3.32 -1.08 0.93 -1.68 116.67 125.53 2h47 s ASP 166 Ca -0.13 0.14 -0.15 0.00 -0.52 0.00 0.00 52.55 51.90 2h47 s ASP 166 Cb -0.16 -2.50 0.10 0.00 -1.46 0.00 0.00 42.92 38.90 2h47 s ASP 166 CO 0.03 -1.24 1.75 0.58 0.52 0.00 0.00 175.17 176.81 2h47 h VAL 167 N 6.14 0.88 -0.49 1.11 2.07 -1.53 0.42 116.25 124.85 2h47 h VAL 167 Ca -0.24 -0.11 -0.12 0.00 0.82 0.00 0.00 66.70 67.05 2h47 h VAL 167 Cb 1.07 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 2h47 h VAL 167 CO 1.11 0.06 -0.16 0.00 0.02 0.00 0.00 177.57 178.59 2h47 h ALA 168 N 1.27 0.79 0.00 1.67 0.00 -1.92 -2.85 119.26 118.23 2h47 h ALA 168 Ca 0.19 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2h47 h ALA 168 Cb 0.17 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2h47 h ALA 168 CO -0.19 0.66 -0.06 0.87 0.00 0.00 0.00 179.25 180.53 2h47 h LYS 169 N 0.83 0.00 -5.91 0.00 1.57 -1.89 -3.47 116.57 107.70 2h47 h LYS 169 Ca 0.12 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 58.50 2h47 h LYS 169 Cb 0.71 0.00 0.10 0.00 0.08 0.00 0.00 32.23 33.12 2h47 h LYS 169 CO 0.05 0.00 -0.74 0.41 -0.57 0.00 0.00 179.45 178.60 2h47 n GLY 170 N 1.25 -0.45 3.16 3.86 0.00 0.15 -4.99 105.19 108.17 2h47 n GLY 170 Ca 0.05 0.18 -0.12 0.00 0.00 0.00 0.00 46.02 46.13 2h47 n GLY 170 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2h47 s ASP 171 N -3.77 -0.06 -0.49 1.61 1.01 -1.10 -4.78 116.67 109.09 2h47 s ASP 171 Ca 0.35 -0.08 -0.28 0.00 0.71 0.00 0.00 52.55 53.25 2h47 s ASP 171 Cb -0.16 0.25 0.01 0.00 1.01 0.00 0.00 42.92 44.03 2h47 s ASP 171 CO 0.76 -0.40 1.46 -0.47 0.21 0.00 0.00 175.17 176.73 2h47 s TYR 172 N -1.34 2.27 -0.10 4.23 5.04 -1.26 -0.05 117.35 126.14 2h47 s TYR 172 Ca -0.14 0.58 0.00 0.00 -2.44 0.00 0.00 57.07 55.07 2h47 s TYR 172 Cb -0.07 -4.33 -0.25 0.00 0.35 0.00 0.00 41.96 37.66 2h47 s TYR 172 CO 0.03 -2.05 0.43 1.33 -1.34 0.00 0.00 175.55 173.95 2h47 n VAL 173 N 7.00 1.71 -4.03 3.14 0.24 0.11 -4.93 118.33 121.57 2h47 n VAL 173 Ca 0.15 -0.70 -0.12 0.00 -2.04 0.00 0.00 64.34 61.63 2h47 n VAL 173 Cb 0.49 -1.48 -0.12 0.00 -1.47 0.00 0.00 33.84 31.26 2h47 n VAL 173 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2h47 s GLU 174 N -2.57 0.38 -0.64 7.34 2.56 -1.14 -4.88 118.70 119.76 2h47 s GLU 174 Ca -0.17 -0.54 0.04 0.00 0.00 0.00 0.00 54.97 54.29 2h47 s GLU 174 Cb 0.07 -0.14 0.16 0.00 2.00 0.00 0.00 34.13 36.22 2h47 s GLU 174 CO 0.78 0.02 0.41 0.34 -0.56 0.00 0.00 175.26 176.25 2h47 s ASP 175 N -1.16 4.70 -1.05 -1.70 -1.08 -1.26 -0.41 116.67 114.70 2h47 s ASP 175 Ca -0.09 -3.47 -0.25 0.00 -0.52 0.00 0.00 52.55 48.22 2h47 s ASP 175 Cb -0.08 -1.66 -0.18 0.00 -1.46 0.00 0.00 42.92 39.54 2h47 s ASP 175 CO -0.00 -0.16 2.00 0.52 0.52 0.00 0.00 175.17 178.05 2h47 n VAL 176 N 2.51 0.87 0.61 1.11 0.31 0.11 -4.73 118.33 119.12 2h47 n VAL 176 Ca 0.13 -0.90 0.09 0.00 -0.01 0.00 0.00 64.34 63.66 2h47 n VAL 176 Cb 0.34 -2.08 0.41 0.00 -0.91 0.00 0.00 33.84 31.59 2h47 n VAL 176 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2h47 n THR 177 N 8.33 0.73 0.34 2.52 -2.24 -1.26 -2.42 114.28 120.27 2h47 n THR 177 Ca 0.43 0.17 0.15 0.00 -2.27 0.00 0.00 64.05 62.53 2h47 n THR 177 Cb 0.46 -0.89 0.60 0.00 -2.10 0.00 0.00 70.33 68.41 2h47 n THR 177 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2h47 h ALA 178 N 2.59 1.00 -0.04 6.98 0.00 -1.94 -2.01 119.26 125.85 2h47 h ALA 178 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2h47 h ALA 178 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2h47 h ALA 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 2h47 n ALA 179 N -1.92 2.59 -1.70 0.00 0.00 -1.10 -4.88 120.51 113.50 2h47 n ALA 179 Ca 0.01 -0.21 -0.43 0.00 0.00 0.00 0.00 53.44 52.81 2h47 n ALA 179 Cb 0.25 -1.25 -0.03 0.00 0.00 0.00 0.00 19.45 18.42 2h47 n ALA 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h47 n ALA 180 N -0.53 2.04 -0.55 0.00 0.00 -0.76 -0.72 120.51 119.99 2h47 n ALA 180 Ca 0.14 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.99 2h47 n ALA 180 Cb 0.13 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.16 2h47 n ALA 180 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2h47 n GLY 181 N 2.96 0.74 3.49 0.00 0.00 -1.26 -5.00 105.19 106.10 2h47 n GLY 181 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 2h47 n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h47 s TRP 183 N -2.81 -0.66 0.41 0.00 -0.11 0.12 -4.85 118.94 111.04 2h47 s TRP 183 Ca 0.03 1.29 0.00 0.00 1.22 0.00 0.00 56.10 58.63 2h47 s TRP 183 Cb 0.00 0.34 0.00 0.00 -1.50 0.00 0.00 33.47 32.31 2h47 s TRP 183 CO 0.02 -0.52 0.00 -1.13 -4.62 0.00 0.00 176.95 170.70 2h47 n SER 184 N 1.47 -5.27 -4.09 5.86 3.41 -1.26 -2.48 113.62 111.26 2h47 n SER 184 Ca -0.18 1.04 -0.32 0.00 -0.26 0.00 0.00 58.87 59.15 2h47 n SER 184 Cb 0.56 -3.23 -0.16 0.00 -0.26 0.00 0.00 64.21 61.12 2h47 n SER 184 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2h47 s VAL 185 N -4.12 1.87 -0.42 -3.33 1.01 0.30 -4.26 120.40 111.45 2h47 s VAL 185 Ca 0.00 -0.83 -0.03 0.00 0.00 0.00 0.00 61.98 61.12 2h47 s VAL 185 Cb 0.00 -1.70 0.11 0.00 0.00 0.00 0.00 36.38 34.79 2h47 s VAL 185 CO 0.00 0.51 0.21 -0.63 0.00 0.00 0.00 175.10 175.19 2h47 s ILE 186 N 1.25 3.32 0.69 2.22 1.09 -0.12 -4.39 121.20 125.26 2h47 s ILE 186 Ca 0.02 -2.07 -0.16 0.00 -1.10 0.00 0.00 60.65 57.34 2h47 s ILE 186 Cb -0.13 -3.27 0.02 0.00 -1.06 0.00 0.00 42.46 38.01 2h47 s ILE 186 CO -0.10 -0.70 1.20 -2.84 -0.10 0.00 0.00 174.94 172.40 2h47 s PRO 187 N 1.12 2.42 -0.40 2.79 0.02 -1.26 -0.74 135.00 138.94 2h47 s PRO 187 Ca 0.08 1.74 -0.10 0.00 0.02 0.00 0.00 61.00 62.75 2h47 s PRO 187 Cb -0.23 -1.87 0.06 0.00 0.02 0.00 0.00 34.50 32.48 2h47 s PRO 187 CO -0.04 -1.61 0.24 -0.65 -0.33 0.00 0.00 177.00 174.61 2h47 s GLN 188 N -3.78 2.69 0.49 5.54 -0.21 -0.93 -4.84 119.66 118.62 2h47 s GLN 188 Ca 0.74 -1.32 0.28 0.00 0.02 0.00 0.00 55.36 55.08 2h47 s GLN 188 Cb -0.29 -3.77 1.50 0.00 1.00 0.00 0.00 33.01 31.45 2h47 s GLN 188 CO 0.42 -0.86 1.82 -1.35 -2.12 0.00 0.00 175.29 173.20 2h47 h PRO 189 N 8.43 0.00 -0.39 2.91 0.11 -1.84 -1.98 132.00 139.24 2h47 h PRO 189 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 2h47 h PRO 189 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2h47 h PRO 189 CO 0.73 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.79 2h47 n ASN 190 N -2.57 3.04 -3.90 -2.05 6.94 -1.14 -4.89 115.26 110.70 2h47 n ASN 190 Ca -0.02 -1.94 -0.18 0.00 -0.02 0.00 0.00 54.58 52.43 2h47 n ASN 190 Cb 0.19 -0.26 -0.16 0.00 -2.36 0.00 0.00 39.78 37.20 2h47 n ASN 190 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2h47 s ARG 191 N -1.49 0.55 0.26 -3.83 0.52 -0.74 -5.06 118.95 109.16 2h47 s ARG 191 Ca 0.38 -0.09 -0.06 0.00 -0.52 0.00 0.00 55.73 55.44 2h47 s ARG 191 Cb 0.21 -0.60 0.48 0.00 0.52 0.00 0.00 34.95 35.57 2h47 s ARG 191 CO 0.30 -0.02 1.62 -1.00 0.02 0.00 0.00 175.30 176.22 2h47 h PRO 192 N 6.78 0.09 -1.45 3.54 0.13 -1.90 -3.32 132.00 135.86 2h47 h PRO 192 Ca -0.36 -0.01 -0.42 0.00 -0.87 0.00 0.00 66.00 64.35 2h47 h PRO 192 Cb 1.16 -0.02 -0.33 0.00 0.13 0.00 0.00 31.00 31.94 2h47 h PRO 192 CO 0.49 0.06 -0.99 2.89 -0.23 0.00 0.00 178.00 180.21 2h47 n ARG 193 N -5.38 0.97 -4.18 0.86 1.85 -1.26 -0.03 116.66 109.49 2h47 n ARG 193 Ca 0.15 -2.97 -0.15 0.00 -1.00 0.00 0.00 57.85 53.88 2h47 n ARG 193 Cb 0.52 -1.51 -0.11 0.00 -1.05 0.00 0.00 32.46 30.31 2h47 n ARG 193 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 2h47 s SER 194 N -2.07 1.52 0.24 2.89 0.01 -1.25 -1.53 113.70 113.50 2h47 s SER 194 Ca 0.35 -0.81 -0.22 0.00 1.31 0.00 0.00 55.95 56.58 2h47 s SER 194 Cb 0.33 -0.00 0.04 0.00 0.21 0.00 0.00 66.02 66.59 2h47 s SER 194 CO -0.08 -0.25 0.68 0.72 0.41 0.00 0.00 173.24 174.72 2h47 s PHE 195 N -2.40 -0.31 0.40 2.43 -0.12 -0.94 -2.18 117.98 114.86 2h47 s PHE 195 Ca 0.06 -0.05 0.05 0.00 -0.05 0.00 0.00 56.93 56.94 2h47 s PHE 195 Cb -0.03 0.65 -0.06 0.00 -0.63 0.00 0.00 43.02 42.95 2h47 s PHE 195 CO 0.00 -1.10 0.03 -1.64 -0.05 0.00 0.00 175.22 172.47 2h47 s MET 196 N -3.86 1.91 -0.09 1.99 -1.94 0.08 -0.85 119.30 116.54 2h47 s MET 196 Ca 0.07 -2.11 -0.19 0.00 -1.71 0.00 0.00 55.69 51.75 2h47 s MET 196 Cb -0.04 -1.36 0.04 0.00 2.01 0.00 0.00 34.83 35.48 2h47 s MET 196 CO -0.00 -0.16 0.46 -0.08 -0.01 0.00 0.00 175.02 175.23 2h47 s THR 197 N -2.92 0.02 0.05 2.05 -1.32 -0.78 -0.95 115.64 111.80 2h47 s THR 197 Ca 0.30 -0.18 -0.23 0.00 -1.21 0.00 0.00 61.69 60.38 2h47 s THR 197 Cb 0.08 -0.72 -0.06 0.00 -1.51 0.00 0.00 72.50 70.29 2h47 s THR 197 CO 0.15 -0.10 0.70 -0.63 -2.21 0.00 0.00 174.62 172.54 2h47 s ILE 198 N -0.65 4.72 0.26 5.08 1.01 -1.03 -1.07 121.20 129.52 2h47 s ILE 198 Ca -0.07 1.50 0.11 0.00 0.00 0.00 0.00 60.65 62.19 2h47 s ILE 198 Cb -0.03 -4.05 -0.05 0.00 0.01 0.00 0.00 42.46 38.34 2h47 s ILE 198 CO 0.04 0.42 -0.19 0.00 0.00 0.00 0.00 174.94 175.21 2h47 n GLY 200 N -0.53 -0.41 0.55 0.00 0.00 -0.65 -0.57 105.19 103.58 2h47 n GLY 200 Ca -0.06 0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.10 2h47 n GLY 200 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2h47 n ASP 201 N -1.45 1.83 0.00 1.61 5.75 -1.26 -4.84 116.55 118.19 2h47 n ASP 201 Ca -0.00 -1.50 0.00 0.00 -0.01 0.00 0.00 54.79 53.28 2h47 n ASP 201 Cb 0.12 0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 2h47 n ASP 201 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2h47 n GLY 202 N 1.28 0.57 3.84 6.12 0.00 0.26 -4.78 105.19 112.48 2h47 n GLY 202 Ca 0.15 -0.11 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 2h47 n GLY 202 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2h47 s GLY 203 N -2.10 2.31 -0.10 -0.02 0.00 -1.25 0.81 107.32 106.97 2h47 s GLY 203 Ca 0.00 -1.69 0.02 0.00 0.00 0.00 0.00 44.72 43.05 2h47 s GLY 203 CO 0.00 -1.87 -0.16 1.08 0.00 0.00 0.00 173.10 172.16 2h47 s LEU 204 N -4.11 2.60 -0.29 0.66 1.43 -1.26 -1.77 118.68 115.94 2h47 s LEU 204 Ca 0.40 -0.33 -0.10 0.00 -1.03 0.00 0.00 54.13 53.07 2h47 s LEU 204 Cb -0.01 -1.55 -0.03 0.00 0.03 0.00 0.00 46.19 44.63 2h47 s LEU 204 CO 0.23 0.22 0.16 -0.22 0.23 0.00 0.00 176.35 176.98 2h47 s LEU 205 N -0.00 4.00 -0.06 1.79 2.96 -0.23 -1.71 118.68 125.43 2h47 s LEU 205 Ca -0.05 -0.26 -0.15 0.00 -0.22 0.00 0.00 54.13 53.45 2h47 s LEU 205 Cb -0.14 -2.05 -0.05 0.00 0.50 0.00 0.00 46.19 44.45 2h47 s LEU 205 CO 0.04 -0.12 0.40 -0.89 -1.32 0.00 0.00 176.35 174.47 2h47 s THR 206 N 1.68 5.13 -0.12 3.68 2.01 -0.01 -1.86 115.64 126.14 2h47 s THR 206 Ca 0.06 0.81 0.02 0.00 0.31 0.00 0.00 61.69 62.89 2h47 s THR 206 Cb -0.16 -3.72 0.01 0.00 0.01 0.00 0.00 72.50 68.64 2h47 s THR 206 CO 0.08 0.48 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.68 2h47 s ILE 207 N -0.33 1.70 -0.33 1.82 -1.09 -0.03 -2.22 121.20 120.71 2h47 s ILE 207 Ca 0.23 -0.75 -0.05 0.00 -2.23 0.00 0.00 60.65 57.84 2h47 s ILE 207 Cb -0.16 -1.53 0.05 0.00 -1.58 0.00 0.00 42.46 39.24 2h47 s ILE 207 CO 0.11 0.48 0.09 0.20 -1.23 0.00 0.00 174.94 174.58 2h47 s ASN 208 N 0.99 5.22 0.45 3.58 0.01 0.24 -2.21 114.94 123.22 2h47 s ASN 208 Ca -0.05 -1.23 -0.22 0.00 -0.71 0.00 0.00 52.86 50.65 2h47 s ASN 208 Cb -0.15 -1.83 -0.09 0.00 0.41 0.00 0.00 41.25 39.59 2h47 s ASN 208 CO -0.03 -0.33 1.04 -0.76 -1.51 0.00 0.00 177.10 175.51 2h47 s LEU 209 N 1.35 3.95 0.48 0.60 1.43 -0.59 0.52 118.68 126.43 2h47 s LEU 209 Ca -0.02 1.97 0.02 0.00 -1.03 0.00 0.00 54.13 55.07 2h47 s LEU 209 Cb -0.20 -4.43 0.01 0.00 0.03 0.00 0.00 46.19 41.61 2h47 s LEU 209 CO 0.01 -0.67 0.69 -0.83 0.23 0.00 0.00 176.35 175.78 2h47 s GLY 210 N -1.83 1.72 0.61 -3.19 0.00 0.90 -4.63 107.32 100.89 2h47 s GLY 210 Ca 0.64 -1.27 0.29 0.00 0.00 0.00 0.00 44.72 44.37 2h47 s GLY 210 CO 0.22 -1.06 1.89 0.83 0.00 0.00 0.00 173.10 174.99 2h47 h GLU 211 N 0.32 0.00 -0.06 2.90 5.08 -1.97 0.32 114.58 121.18 2h47 h GLU 211 Ca -0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 2h47 h GLU 211 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2h47 h GLU 211 CO 0.53 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.14 2h47 n ASP 212 N -3.52 0.82 0.00 1.42 5.75 -1.26 -4.89 116.55 114.86 2h47 n ASP 212 Ca 0.06 -1.45 0.00 0.00 -0.01 0.00 0.00 54.79 53.38 2h47 n ASP 212 Cb 0.60 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.66 2h47 n ASP 212 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2h47 n GLY 213 N 1.01 0.83 3.94 6.12 0.00 0.11 -4.92 105.19 112.29 2h47 n GLY 213 Ca 0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.93 2h47 n GLY 213 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h47 s LYS 214 N -0.23 3.47 -0.40 1.61 1.02 -1.26 -4.44 119.74 119.52 2h47 s LYS 214 Ca 0.00 -0.51 -0.27 0.00 0.02 0.00 0.00 55.97 55.21 2h47 s LYS 214 Cb 0.00 -2.89 -0.07 0.00 -0.52 0.00 0.00 37.83 34.35 2h47 s LYS 214 CO 0.00 0.45 2.35 0.28 -0.92 0.00 0.00 175.35 177.50 2h47 n VAL 215 N -0.75 0.09 0.18 3.17 0.31 -1.26 -0.07 118.33 119.99 2h47 n VAL 215 Ca -0.06 -0.63 -0.08 0.00 -0.01 0.00 0.00 64.34 63.55 2h47 n VAL 215 Cb 0.54 -2.61 -0.04 0.00 -0.91 0.00 0.00 33.84 30.82 2h47 n VAL 215 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2h47 h ALA 216 N 17.45 -0.54 -2.55 3.52 0.00 -0.19 -3.46 119.26 133.49 2h47 h ALA 216 Ca -0.30 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.35 2h47 h ALA 216 Cb 1.26 0.21 -0.14 0.00 0.00 0.00 0.00 17.79 19.13 2h47 h ALA 216 CO 1.08 -0.50 -0.46 -1.54 0.00 0.00 0.00 179.25 177.83 2h47 s SER 217 N -4.94 0.16 0.17 0.00 1.04 -0.93 -5.01 113.70 104.19 2h47 s SER 217 Ca -0.08 -1.01 -0.05 0.00 0.48 0.00 0.00 55.95 55.29 2h47 s SER 217 Cb 0.01 0.37 -0.03 0.00 0.10 0.00 0.00 66.02 66.48 2h47 s SER 217 CO 0.24 -0.82 0.19 0.00 0.98 0.00 0.00 173.24 173.83 2h47 s GLN 218 N -4.00 1.12 -0.27 4.02 -2.07 -1.26 -0.59 119.66 116.61 2h47 s GLN 218 Ca 0.20 -1.38 -0.24 0.00 -1.82 0.00 0.00 55.36 52.12 2h47 s GLN 218 Cb 0.05 0.31 0.09 0.00 -1.09 0.00 0.00 33.01 32.37 2h47 s GLN 218 CO 0.00 -0.38 0.80 -1.54 -1.32 0.00 0.00 175.29 172.86 2h47 s SER 219 N -3.05 -0.69 -0.10 12.60 1.04 -0.94 -5.00 113.70 117.57 2h47 s SER 219 Ca 0.25 1.29 -0.03 0.00 0.48 0.00 0.00 55.95 57.94 2h47 s SER 219 Cb 0.05 1.30 -0.03 0.00 0.10 0.00 0.00 66.02 67.44 2h47 s SER 219 CO 0.04 -0.22 0.03 -0.13 0.98 0.00 0.00 173.24 173.94 2h47 s ARG 220 N 0.53 3.16 0.61 4.02 0.52 -1.26 -0.83 118.95 125.70 2h47 s ARG 220 Ca -0.01 -0.36 -0.02 0.00 -0.52 0.00 0.00 55.73 54.83 2h47 s ARG 220 Cb -0.05 -2.90 0.05 0.00 0.52 0.00 0.00 34.95 32.57 2h47 s ARG 220 CO -0.04 0.67 0.87 -1.54 0.02 0.00 0.00 175.30 175.27 2h47 s SER 221 N -0.76 5.07 0.84 0.23 1.04 -0.69 -4.93 113.70 114.49 2h47 s SER 221 Ca 0.12 0.13 -0.12 0.00 0.48 0.00 0.00 55.95 56.56 2h47 s SER 221 Cb -0.12 -0.91 0.09 0.00 0.10 0.00 0.00 66.02 65.19 2h47 s SER 221 CO 0.02 -1.34 1.10 -0.54 0.98 0.00 0.00 173.24 173.47 2h47 s LYS 222 N -4.95 1.75 0.31 4.02 1.02 -1.26 -4.50 119.74 116.13 2h47 s LYS 222 Ca 0.59 0.59 -0.29 0.00 0.02 0.00 0.00 55.97 56.87 2h47 s LYS 222 Cb -0.10 -1.88 -0.12 0.00 -0.52 0.00 0.00 37.83 35.20 2h47 s LYS 222 CO 0.41 -1.84 1.38 0.94 -0.92 0.00 0.00 175.35 175.32 2h47 n GLN 223 N -3.57 2.23 -0.10 1.68 7.27 -1.26 -4.54 117.38 119.08 2h47 n GLN 223 Ca 0.07 0.79 -0.17 0.00 0.07 0.00 0.00 57.00 57.75 2h47 n GLN 223 Cb 0.57 -2.43 -0.09 0.00 2.41 0.00 0.00 30.24 30.70 2h47 n GLN 223 CO 0.00 0.00 0.00 -0.12 0.07 0.00 0.00 177.06 177.01 2h47 n MET 224 N 1.18 0.49 -4.01 3.69 0.00 0.24 -4.91 117.12 113.80 2h47 n MET 224 Ca 0.07 0.15 -0.09 0.00 -0.00 0.00 0.00 57.70 57.82 2h47 n MET 224 Cb 0.35 -1.36 -0.08 0.00 0.00 0.00 0.00 33.22 32.13 2h47 n MET 224 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 175.97 175.38 2h47 s PHE 225 N -2.40 0.50 -0.32 1.12 -0.12 -1.14 -4.80 117.98 110.83 2h47 s PHE 225 Ca -0.28 -0.89 -0.23 0.00 -0.05 0.00 0.00 56.93 55.48 2h47 s PHE 225 Cb 0.09 -0.20 0.00 0.00 -0.63 0.00 0.00 43.02 42.28 2h47 s PHE 225 CO 0.44 -0.61 0.77 0.45 -0.05 0.00 0.00 175.22 176.22 2h47 s SER 226 N -2.97 6.62 0.28 1.98 0.15 -1.26 -4.39 113.70 114.11 2h47 s SER 226 Ca 0.17 0.58 0.00 0.00 0.70 0.00 0.00 55.95 57.40 2h47 s SER 226 Cb 0.05 -2.40 0.51 0.00 -1.71 0.00 0.00 66.02 62.47 2h47 s SER 226 CO -0.02 -0.63 1.86 0.58 1.20 0.00 0.00 173.24 176.24 2h47 h VAL 227 N 5.62 1.00 0.03 4.45 2.07 -1.88 -1.05 116.25 126.49 2h47 h VAL 227 Ca -0.25 -0.36 -0.36 0.00 0.82 0.00 0.00 66.70 66.56 2h47 h VAL 227 Cb 1.10 -0.15 -0.05 0.00 -1.52 0.00 0.00 31.29 30.66 2h47 h VAL 227 CO 0.88 0.19 -2.16 2.29 0.02 0.00 0.00 177.57 178.80 2h47 n LYS 228 N -4.55 0.68 0.15 1.57 2.85 -1.26 -3.97 118.16 113.63 2h47 n LYS 228 Ca 0.17 0.17 0.08 0.00 -1.05 0.00 0.00 58.31 57.68 2h47 n LYS 228 Cb 0.28 -1.63 0.06 0.00 -0.65 0.00 0.00 35.03 33.09 2h47 n LYS 228 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 2h47 h ASP 229 N 0.02 0.00 0.00 -5.58 3.32 -1.97 -3.42 116.42 108.79 2h47 h ASP 229 Ca -0.46 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.35 2h47 h ASP 229 Cb 2.05 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 41.46 2h47 h ASP 229 CO 0.03 0.20 -0.43 -0.67 -1.72 0.00 0.00 179.24 176.64 2h47 n ASP 230 N -3.01 -2.36 -4.71 6.45 2.03 -0.42 -5.01 116.55 109.52 2h47 n ASP 230 Ca 0.01 -3.65 -0.42 0.00 0.52 0.00 0.00 54.79 51.26 2h47 n ASP 230 Cb 0.62 1.92 0.00 0.00 -0.72 0.00 0.00 41.12 42.94 2h47 n ASP 230 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2h47 n PRO 231 N 0.44 2.15 -3.88 -0.67 -0.04 -1.06 -4.39 135.00 127.55 2h47 n PRO 231 Ca 0.06 0.76 -0.21 0.00 -0.04 0.00 0.00 63.50 64.07 2h47 n PRO 231 Cb 0.70 -2.40 -0.03 0.00 -0.04 0.00 0.00 33.50 31.73 2h47 n PRO 231 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2h47 s ILE 232 N -1.13 4.37 0.31 0.52 -4.36 -1.26 -1.19 121.20 118.46 2h47 s ILE 232 Ca 0.57 -1.21 -0.25 0.00 -0.26 0.00 0.00 60.65 59.50 2h47 s ILE 232 Cb -0.53 -3.47 -0.10 0.00 1.25 0.00 0.00 42.46 39.61 2h47 s ILE 232 CO 0.61 -0.27 0.91 -0.36 0.24 0.00 0.00 174.94 176.07 2h47 s PHE 233 N -2.14 3.67 0.11 1.37 0.40 0.54 -4.89 117.98 117.04 2h47 s PHE 233 Ca 0.37 1.71 0.28 0.00 -0.60 0.00 0.00 56.93 58.69 2h47 s PHE 233 Cb -0.08 -2.87 1.08 0.00 0.51 0.00 0.00 43.02 41.66 2h47 s PHE 233 CO 0.28 0.22 1.88 -0.84 0.70 0.00 0.00 175.22 177.46 2h47 h ILE 234 N 2.60 0.34 -2.63 0.64 3.07 -1.92 -3.42 117.51 116.18 2h47 h ILE 234 Ca -0.47 -0.88 -0.55 0.00 1.55 0.00 0.00 64.86 64.51 2h47 h ILE 234 Cb 1.19 1.67 -0.01 0.00 -0.27 0.00 0.00 36.82 39.40 2h47 h ILE 234 CO 0.65 0.13 1.08 0.00 -1.05 0.00 0.00 178.15 178.96 2h47 s ALA 235 N -3.66 3.61 0.20 0.16 0.00 -1.26 -4.97 121.76 115.84 2h47 s ALA 235 Ca 0.01 0.89 0.01 0.00 0.00 0.00 0.00 51.96 52.86 2h47 s ALA 235 Cb 0.10 -3.74 -0.04 0.00 0.00 0.00 0.00 23.12 19.44 2h47 s ALA 235 CO 0.60 -1.41 0.37 -1.25 0.00 0.00 0.00 175.76 174.07 2h47 s PRO 236 N 4.03 3.49 -0.73 0.00 0.04 -1.26 -4.63 135.00 135.93 2h47 s PRO 236 Ca 0.72 -0.45 -0.11 0.00 0.04 0.00 0.00 61.00 61.21 2h47 s PRO 236 Cb -0.32 -2.87 0.19 0.00 0.04 0.00 0.00 34.50 31.54 2h47 s PRO 236 CO 0.29 0.42 0.64 0.00 0.04 0.00 0.00 177.00 178.39 2h47 s ALA 237 N -1.87 3.89 -0.20 8.56 0.00 0.57 -4.69 121.76 128.02 2h47 s ALA 237 Ca 0.37 -3.21 -0.25 0.00 0.00 0.00 0.00 51.96 48.87 2h47 s ALA 237 Cb -0.11 -3.24 -0.01 0.00 0.00 0.00 0.00 23.12 19.76 2h47 s ALA 237 CO 0.29 -2.19 0.84 -1.17 0.00 0.00 0.00 175.76 173.53 2h47 s LEU 238 N 0.27 4.14 0.00 0.00 2.96 -1.26 -1.72 118.68 123.07 2h47 s LEU 238 Ca 0.16 1.14 0.00 0.00 -0.22 0.00 0.00 54.13 55.21 2h47 s LEU 238 Cb -0.15 -3.24 0.00 0.00 0.50 0.00 0.00 46.19 43.30 2h47 s LEU 238 CO -0.06 -0.45 0.00 -0.67 -1.32 0.00 0.00 176.35 173.85 2h47 n ASP 239 N 5.53 0.09 0.15 3.68 -0.08 0.36 -4.79 116.55 121.49 2h47 n ASP 239 Ca 0.05 -0.13 -0.25 0.00 -1.51 0.00 0.00 54.79 52.96 2h47 n ASP 239 Cb 0.48 0.00 -0.16 0.00 2.34 0.00 0.00 41.12 43.78 2h47 n ASP 239 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 2h47 h LYS 240 N 0.00 0.54 0.00 -0.67 1.63 -1.97 -3.40 116.57 112.71 2h47 h LYS 240 Ca 0.00 -0.92 0.00 0.00 -0.85 0.00 0.00 60.65 58.88 2h47 h LYS 240 Cb 0.00 0.34 0.00 0.00 -0.60 0.00 0.00 32.23 31.97 2h47 h LYS 240 CO 0.00 1.44 -0.17 -0.40 -3.45 0.00 0.00 179.45 176.87 2h47 n ASP 241 N -3.71 0.98 -3.56 4.20 5.75 -1.26 -2.88 116.55 116.07 2h47 n ASP 241 Ca -0.17 -2.07 -0.16 0.00 -0.01 0.00 0.00 54.79 52.38 2h47 n ASP 241 Cb 1.11 -0.18 -0.06 0.00 -1.03 0.00 0.00 41.12 40.96 2h47 n ASP 241 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 2h47 s LYS 242 N -0.94 1.02 -0.05 0.11 -2.85 -1.26 -0.02 119.74 115.75 2h47 s LYS 242 Ca 0.09 0.02 0.02 0.00 -1.00 0.00 0.00 55.97 55.10 2h47 s LYS 242 Cb 0.07 0.48 0.01 0.00 -2.06 0.00 0.00 37.83 36.33 2h47 s LYS 242 CO 0.01 -0.34 -0.11 0.00 0.10 0.00 0.00 175.35 175.01 2h47 s ALA 243 N -1.74 1.10 -0.02 0.59 0.00 -0.64 -0.49 121.76 120.57 2h47 s ALA 243 Ca -0.09 -0.36 -0.01 0.00 0.00 0.00 0.00 51.96 51.50 2h47 s ALA 243 Cb -0.01 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 2h47 s ALA 243 CO 0.04 0.12 0.07 -1.01 0.00 0.00 0.00 175.76 174.99 2h47 s HIS 244 N 0.53 3.28 0.07 0.00 3.76 -0.70 -0.28 115.29 121.95 2h47 s HIS 244 Ca -0.10 0.21 0.05 0.00 -0.15 0.00 0.00 55.06 55.07 2h47 s HIS 244 Cb -0.14 -1.75 -0.03 0.00 1.11 0.00 0.00 32.58 31.78 2h47 s HIS 244 CO 0.02 0.55 -0.14 -0.06 -0.85 0.00 0.00 174.74 174.26 2h47 s PHE 245 N -1.16 1.19 0.13 1.40 0.40 -0.17 -0.32 117.98 119.46 2h47 s PHE 245 Ca 0.21 -0.47 0.07 0.00 -0.60 0.00 0.00 56.93 56.14 2h47 s PHE 245 Cb -0.12 -0.67 -0.04 0.00 0.51 0.00 0.00 43.02 42.70 2h47 s PHE 245 CO 0.12 0.05 -0.04 0.14 0.70 0.00 0.00 175.22 176.19 2h47 s VAL 246 N -1.35 3.61 0.37 -0.44 -7.23 -1.26 -0.45 120.40 113.66 2h47 s VAL 246 Ca -0.02 -1.30 0.07 0.00 -1.81 0.00 0.00 61.98 58.93 2h47 s VAL 246 Cb -0.10 -2.75 -0.02 0.00 0.56 0.00 0.00 36.38 34.07 2h47 s VAL 246 CO 0.02 0.02 0.37 -0.94 -0.31 0.00 0.00 175.10 174.26 2h47 s SER 247 N -2.54 5.30 0.36 4.85 1.04 -0.33 -0.34 113.70 122.04 2h47 s SER 247 Ca 0.25 -0.55 0.11 0.00 0.48 0.00 0.00 55.95 56.24 2h47 s SER 247 Cb -0.10 -0.82 0.90 0.00 0.10 0.00 0.00 66.02 66.09 2h47 s SER 247 CO 0.17 -0.51 1.82 1.88 0.98 0.00 0.00 173.24 177.57 2h47 h TYR 248 N 1.07 0.81 -0.62 5.02 0.99 -1.44 -1.72 116.97 121.08 2h47 h TYR 248 Ca -0.43 0.03 -0.24 0.00 2.00 0.00 0.00 58.73 60.08 2h47 h TYR 248 Cb 1.26 -0.25 -0.14 0.00 1.00 0.00 0.00 36.73 38.60 2h47 h TYR 248 CO 0.50 0.21 0.31 0.66 -0.00 0.00 0.00 178.16 179.83 2h47 n TYR 249 N -4.63 2.01 -1.67 4.88 4.02 -1.26 -4.24 117.16 116.27 2h47 n TYR 249 Ca 0.21 -1.14 -0.07 0.00 -0.01 0.00 0.00 57.90 56.90 2h47 n TYR 249 Cb 0.62 -0.63 -0.02 0.00 -0.02 0.00 0.00 39.34 39.29 2h47 n TYR 249 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2h47 n GLY 250 N -0.28 0.48 4.00 2.72 0.00 -0.65 -4.93 105.19 106.53 2h47 n GLY 250 Ca 0.35 -0.68 -0.19 0.00 0.00 0.00 0.00 46.02 45.50 2h47 n GLY 250 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2h47 s ASN 251 N -2.81 5.43 -0.04 1.61 0.01 -1.26 -0.86 114.94 117.01 2h47 s ASN 251 Ca 0.00 -0.32 0.01 0.00 -0.71 0.00 0.00 52.86 51.84 2h47 s ASN 251 Cb 0.00 -0.62 0.02 0.00 0.41 0.00 0.00 41.25 41.06 2h47 s ASN 251 CO 0.00 -0.99 -0.02 -0.69 -1.51 0.00 0.00 177.10 173.90 2h47 s VAL 252 N -2.55 0.35 0.34 1.60 1.01 -0.68 -1.19 120.40 119.28 2h47 s VAL 252 Ca 0.57 0.00 0.09 0.00 0.00 0.00 0.00 61.98 62.64 2h47 s VAL 252 Cb -0.10 -0.42 -0.06 0.00 0.00 0.00 0.00 36.38 35.81 2h47 s VAL 252 CO 0.36 0.19 0.01 -0.31 0.00 0.00 0.00 175.10 175.35 2h47 s TYR 253 N 1.07 2.54 0.05 5.22 1.51 0.41 -2.61 117.35 125.54 2h47 s TYR 253 Ca -0.09 -0.45 -0.00 0.00 -1.01 0.00 0.00 57.07 55.52 2h47 s TYR 253 Cb -0.14 -1.50 -0.04 0.00 -0.11 0.00 0.00 41.96 40.18 2h47 s TYR 253 CO -0.01 0.48 -0.04 -1.12 -1.11 0.00 0.00 175.55 173.75 2h47 s SER 254 N -3.71 0.53 -0.34 2.29 0.01 -0.84 -1.00 113.70 110.63 2h47 s SER 254 Ca 0.35 -0.89 -0.01 0.00 1.31 0.00 0.00 55.95 56.71 2h47 s SER 254 Cb 0.00 0.16 0.13 0.00 0.21 0.00 0.00 66.02 66.53 2h47 s SER 254 CO 0.19 -0.51 0.19 0.00 0.41 0.00 0.00 173.24 173.51 2h47 s ALA 255 N -3.33 0.99 -0.23 1.44 0.00 0.62 -1.66 121.76 119.58 2h47 s ALA 255 Ca 0.03 -1.72 -0.26 0.00 0.00 0.00 0.00 51.96 50.00 2h47 s ALA 255 Cb 0.04 -1.58 0.00 0.00 0.00 0.00 0.00 23.12 21.58 2h47 s ALA 255 CO -0.07 -1.97 0.92 0.34 0.00 0.00 0.00 175.76 174.98 2h47 s ASP 256 N 1.30 6.95 -0.37 0.00 -1.08 -0.77 -1.62 116.67 121.08 2h47 s ASP 256 Ca 0.15 1.18 0.07 0.00 -0.52 0.00 0.00 52.55 53.43 2h47 s ASP 256 Cb -0.21 -2.48 0.44 0.00 -1.46 0.00 0.00 42.92 39.21 2h47 s ASP 256 CO -0.10 -0.57 1.14 2.22 0.52 0.00 0.00 175.17 178.37 2h47 n PHE 257 N 6.09 2.99 -0.02 -5.34 1.16 0.97 -1.76 117.46 121.55 2h47 n PHE 257 Ca 0.08 -2.71 -0.08 0.00 -1.87 0.00 0.00 57.45 52.86 2h47 n PHE 257 Cb 0.47 -0.20 -0.14 0.00 -1.61 0.00 0.00 39.48 38.00 2h47 n PHE 257 CO 0.00 0.00 0.00 -1.13 -1.87 0.00 0.00 176.76 173.76 2h47 n SER 258 N -0.56 0.88 -4.13 5.98 3.41 -1.19 -4.88 113.62 113.14 2h47 n SER 258 Ca 0.39 0.42 -0.26 0.00 -0.26 0.00 0.00 58.87 59.16 2h47 n SER 258 Cb 0.80 -0.07 0.16 0.00 -0.26 0.00 0.00 64.21 64.84 2h47 n SER 258 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2h47 n GLY 259 N 1.55 -0.50 0.28 5.00 0.00 -1.26 -4.98 105.19 105.27 2h47 n GLY 259 Ca -0.17 -1.86 -0.07 0.00 0.00 0.00 0.00 46.02 43.93 2h47 n GLY 259 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2h47 h ASP 260 N -1.17 0.86 -2.16 1.61 3.32 -1.97 -3.43 116.42 113.47 2h47 h ASP 260 Ca -0.37 -0.14 -0.54 0.00 0.02 0.00 0.00 57.03 55.99 2h47 h ASP 260 Cb 1.16 -0.22 -0.08 0.00 0.22 0.00 0.00 39.33 40.41 2h47 h ASP 260 CO 0.32 0.76 -0.61 -1.61 -1.72 0.00 0.00 179.24 176.38 2h47 s GLU 261 N -5.67 2.44 -0.07 3.56 0.41 -1.26 -5.09 118.70 113.03 2h47 s GLU 261 Ca -0.13 -1.36 -0.24 0.00 -0.41 0.00 0.00 54.97 52.83 2h47 s GLU 261 Cb 0.14 -2.25 -0.03 0.00 -1.78 0.00 0.00 34.13 30.20 2h47 s GLU 261 CO 0.80 0.34 0.75 0.08 -0.49 0.00 0.00 175.26 176.73 2h47 s VAL 262 N -2.30 5.01 -0.37 2.63 1.01 -1.26 -4.74 120.40 120.39 2h47 s VAL 262 Ca 0.32 1.54 -0.09 0.00 0.00 0.00 0.00 61.98 63.75 2h47 s VAL 262 Cb -0.06 -4.08 0.04 0.00 0.00 0.00 0.00 36.38 32.27 2h47 s VAL 262 CO 0.21 0.22 0.18 -0.54 0.00 0.00 0.00 175.10 175.17 2h47 s LYS 263 N 0.95 2.73 0.49 2.72 3.01 -0.72 -4.58 119.74 124.34 2h47 s LYS 263 Ca 0.39 -1.15 -0.03 0.00 -1.01 0.00 0.00 55.97 54.17 2h47 s LYS 263 Cb -0.18 -3.65 -0.01 0.00 -1.01 0.00 0.00 37.83 32.98 2h47 s LYS 263 CO 0.19 -0.72 0.75 0.14 0.51 0.00 0.00 175.35 176.22 2h47 s VAL 264 N 1.49 4.27 0.36 3.17 -7.23 -1.26 -1.85 120.40 119.34 2h47 s VAL 264 Ca 0.01 -0.17 -0.13 0.00 -1.81 0.00 0.00 61.98 59.88 2h47 s VAL 264 Cb -0.20 -3.62 0.03 0.00 0.56 0.00 0.00 36.38 33.16 2h47 s VAL 264 CO 0.05 -0.53 0.68 -0.62 -0.31 0.00 0.00 175.10 174.37 2h47 s ASP 265 N -4.19 0.21 0.00 4.85 3.68 -0.67 -4.97 116.67 115.58 2h47 s ASP 265 Ca 0.49 -1.17 0.00 0.00 2.13 0.00 0.00 52.55 54.00 2h47 s ASP 265 Cb -0.10 0.77 0.00 0.00 -1.45 0.00 0.00 42.92 42.14 2h47 s ASP 265 CO 0.42 -1.52 0.00 0.61 0.13 0.00 0.00 175.17 174.80 2h47 n GLY 266 N -0.52 1.73 3.81 2.66 0.00 -1.26 -1.99 105.19 109.62 2h47 n GLY 266 Ca -0.05 -2.16 -0.29 0.00 0.00 0.00 0.00 46.02 43.52 2h47 n GLY 266 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2h47 s PRO 267 N -1.67 3.00 -0.09 1.61 0.04 -1.26 -5.03 135.00 131.60 2h47 s PRO 267 Ca 0.00 -0.69 0.03 0.00 0.04 0.00 0.00 61.00 60.37 2h47 s PRO 267 Cb 0.00 -2.77 0.01 0.00 0.04 0.00 0.00 34.50 31.78 2h47 s PRO 267 CO 0.00 0.55 -0.17 1.67 0.04 0.00 0.00 177.00 179.09 2h47 s TRP 268 N -1.52 1.94 0.38 0.56 1.48 -1.07 -4.85 118.94 115.86 2h47 s TRP 268 Ca 0.31 -0.82 -0.26 0.00 -1.06 0.00 0.00 56.10 54.27 2h47 s TRP 268 Cb -0.12 -1.37 -0.09 0.00 -1.16 0.00 0.00 33.47 30.73 2h47 s TRP 268 CO 0.24 -0.39 1.19 0.45 -4.06 0.00 0.00 176.95 174.38 2h47 s SER 269 N 0.68 6.61 0.02 -2.66 0.15 -1.26 -1.68 113.70 115.56 2h47 s SER 269 Ca -0.13 2.40 0.25 0.00 0.70 0.00 0.00 55.95 59.17 2h47 s SER 269 Cb -0.16 -2.62 0.52 0.00 -1.71 0.00 0.00 66.02 62.05 2h47 s SER 269 CO 0.03 -0.62 1.42 0.18 1.20 0.00 0.00 173.24 175.46 2h47 n LEU 270 N 0.28 0.50 -4.69 3.45 4.77 -0.04 -4.88 117.00 116.37 2h47 n LEU 270 Ca 0.03 0.06 -0.35 0.00 -0.03 0.00 0.00 56.01 55.72 2h47 n LEU 270 Cb 0.45 -0.25 -0.09 0.00 -2.33 0.00 0.00 43.42 41.20 2h47 n LEU 270 CO 0.52 0.09 -0.27 -0.76 -1.33 0.00 0.00 177.39 175.64 2h47 s LEU 271 N -3.17 3.76 0.00 2.23 1.43 -1.26 -4.87 118.68 116.80 2h47 s LEU 271 Ca 0.10 0.17 -0.01 0.00 -1.03 0.00 0.00 54.13 53.36 2h47 s LEU 271 Cb 0.17 -1.89 0.08 0.00 0.03 0.00 0.00 46.19 44.58 2h47 s LEU 271 CO 0.69 0.32 0.57 -0.46 0.23 0.00 0.00 176.35 177.71 2h47 n ASN 272 N 2.52 0.68 -0.31 2.29 0.23 -1.26 -4.86 115.26 114.55 2h47 n ASN 272 Ca -0.18 -1.59 -0.01 0.00 -0.53 0.00 0.00 54.58 52.27 2h47 n ASN 272 Cb 0.53 -0.38 0.17 0.00 -2.08 0.00 0.00 39.78 38.02 2h47 n ASN 272 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2h47 h ASP 273 N -0.40 1.03 0.59 0.53 3.32 -2.00 -2.15 116.42 117.35 2h47 h ASP 273 Ca -0.19 -0.03 -0.14 0.00 0.02 0.00 0.00 57.03 56.69 2h47 h ASP 273 Cb 0.67 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 2h47 h ASP 273 CO 0.19 0.75 -0.65 -0.08 -1.72 0.00 0.00 179.24 177.73 2h47 h GLU 274 N 1.21 0.05 -0.10 3.56 4.81 -1.99 -1.92 114.58 120.21 2h47 h GLU 274 Ca 0.33 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.45 2h47 h GLU 274 Cb -0.14 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.24 2h47 h GLU 274 CO -0.07 0.68 -0.25 -0.44 -0.73 0.00 0.00 179.01 178.21 2h47 h ASP 275 N 0.04 0.17 0.16 1.04 3.32 -1.76 -2.34 116.42 117.03 2h47 h ASP 275 Ca -0.01 -0.05 -0.26 0.00 0.02 0.00 0.00 57.03 56.74 2h47 h ASP 275 Cb 1.16 -0.04 0.02 0.00 0.22 0.00 0.00 39.33 40.68 2h47 h ASP 275 CO 0.09 0.42 -1.05 0.11 -1.72 0.00 0.00 179.24 177.08 2h47 h LYS 276 N 0.16 0.58 -0.39 3.56 1.57 -1.16 -0.60 116.57 120.29 2h47 h LYS 276 Ca 0.03 -0.66 0.04 0.00 -1.87 0.00 0.00 60.65 58.19 2h47 h LYS 276 Cb 0.53 0.20 -0.02 0.00 0.08 0.00 0.00 32.23 33.01 2h47 h LYS 276 CO 0.04 1.26 0.26 0.00 -0.57 0.00 0.00 179.45 180.44 2h47 h ALA 277 N 0.50 1.93 -0.45 3.86 0.00 -0.91 0.61 119.26 124.81 2h47 h ALA 277 Ca -0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2h47 h ALA 277 Cb 1.71 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.41 2h47 h ALA 277 CO 0.20 0.01 0.00 1.63 0.00 0.00 0.00 179.25 181.08 2h47 n LYS 278 N -4.48 2.41 -3.81 0.00 4.76 -0.92 -4.99 118.16 111.13 2h47 n LYS 278 Ca 0.04 -2.15 -0.24 0.00 -2.87 0.00 0.00 58.31 53.09 2h47 n LYS 278 Cb 0.21 -1.50 0.02 0.00 -1.84 0.00 0.00 35.03 31.92 2h47 n LYS 278 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2h47 n ASN 279 N 1.32 -1.61 -4.77 4.39 3.02 0.21 -1.31 115.26 116.50 2h47 n ASN 279 Ca 0.20 -0.86 -0.38 0.00 -0.03 0.00 0.00 54.58 53.51 2h47 n ASN 279 Cb 0.55 -3.76 -0.04 0.00 -0.61 0.00 0.00 39.78 35.93 2h47 n ASN 279 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 2h47 s TRP 280 N -3.67 3.37 0.13 3.10 0.52 -0.28 -0.97 118.94 121.14 2h47 s TRP 280 Ca 0.13 1.66 -0.16 0.00 0.02 0.00 0.00 56.10 57.75 2h47 s TRP 280 Cb -0.07 -3.20 0.03 0.00 -1.15 0.00 0.00 33.47 29.08 2h47 s TRP 280 CO 0.84 -0.65 0.41 0.14 0.02 0.00 0.00 176.95 177.71 2h47 s VAL 281 N -1.45 0.07 0.39 4.03 -7.23 -1.11 -4.73 120.40 110.36 2h47 s VAL 281 Ca 0.53 -0.59 -0.25 0.00 -1.81 0.00 0.00 61.98 59.85 2h47 s VAL 281 Cb -0.26 -1.20 -0.09 0.00 0.56 0.00 0.00 36.38 35.39 2h47 s VAL 281 CO 0.33 -0.30 1.16 -2.84 -0.31 0.00 0.00 175.10 173.14 2h47 s PRO 282 N -3.81 4.11 -0.10 4.82 0.02 -1.26 -1.44 135.00 137.34 2h47 s PRO 282 Ca 0.04 1.81 -0.09 0.00 0.02 0.00 0.00 61.00 62.77 2h47 s PRO 282 Cb 0.02 -2.70 0.03 0.00 0.02 0.00 0.00 34.50 31.86 2h47 s PRO 282 CO -0.11 -0.27 0.27 0.20 -0.33 0.00 0.00 177.00 176.76 2h47 s GLY 283 N -1.15 -0.20 0.00 0.52 0.00 0.15 -4.61 107.32 102.02 2h47 s GLY 283 Ca 0.56 0.77 0.00 0.00 0.00 0.00 0.00 44.72 46.05 2h47 s GLY 283 CO 0.38 0.66 0.00 0.61 0.00 0.00 0.00 173.10 174.75 2h47 n GLY 284 N 2.94 0.81 0.00 0.20 0.00 -0.39 -4.50 105.19 104.25 2h47 n GLY 284 Ca -0.13 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 43.88 2h47 n GLY 284 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2h47 n TYR 285 N 6.74 0.00 -1.49 1.61 4.02 -0.71 -4.57 117.16 122.75 2h47 n TYR 285 Ca 0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.49 2h47 n TYR 285 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.30 2h47 n TYR 285 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2h47 n ASN 286 N 0.00 5.81 -0.03 7.72 3.02 -1.25 -4.65 115.26 125.88 2h47 n ASN 286 Ca 0.00 -2.70 0.15 0.00 -0.03 0.00 0.00 54.58 52.00 2h47 n ASN 286 Cb 0.00 -1.57 0.80 0.00 -0.61 0.00 0.00 39.78 38.40 2h47 n ASN 286 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2h47 n LEU 287 N 5.08 0.12 -4.32 3.41 -0.00 -1.26 -0.70 117.00 119.33 2h47 n LEU 287 Ca 0.62 0.11 -0.17 0.00 -0.00 0.00 0.00 56.01 56.57 2h47 n LEU 287 Cb 0.32 -0.15 -0.10 0.00 -0.00 0.00 0.00 43.42 43.48 2h47 n LEU 287 CO 0.88 0.02 -0.38 0.68 -0.00 0.00 0.00 177.39 178.60 2h47 s VAL 288 N -2.32 1.29 0.07 1.47 -7.23 -1.26 -2.60 120.40 109.82 2h47 s VAL 288 Ca 0.36 -2.09 -0.23 0.00 -1.81 0.00 0.00 61.98 58.22 2h47 s VAL 288 Cb 0.21 -2.16 0.06 0.00 0.56 0.00 0.00 36.38 35.05 2h47 s VAL 288 CO 0.42 -0.50 0.55 -0.83 -0.31 0.00 0.00 175.10 174.43 2h47 s GLY 289 N -3.29 -0.47 -0.09 2.32 0.00 -0.63 -4.82 107.32 100.34 2h47 s GLY 289 Ca 0.24 0.60 -0.00 0.00 0.00 0.00 0.00 44.72 45.56 2h47 s GLY 289 CO 0.06 0.29 -0.05 -2.27 0.00 0.00 0.00 173.10 171.13 2h47 s LEU 290 N -2.13 1.05 -0.71 0.66 2.96 -1.26 -0.17 118.68 119.08 2h47 s LEU 290 Ca -0.04 -0.21 -0.20 0.00 -0.22 0.00 0.00 54.13 53.46 2h47 s LEU 290 Cb -0.00 -0.66 0.10 0.00 0.50 0.00 0.00 46.19 46.12 2h47 s LEU 290 CO -0.04 -0.12 0.93 -2.28 -1.32 0.00 0.00 176.35 173.52 2h47 s HIS 291 N 1.60 2.89 0.30 5.38 5.65 0.13 -4.90 115.29 126.34 2h47 s HIS 291 Ca 0.01 -0.89 0.01 0.00 0.25 0.00 0.00 55.06 54.44 2h47 s HIS 291 Cb -0.13 -4.21 0.54 0.00 -1.18 0.00 0.00 32.58 27.60 2h47 s HIS 291 CO -0.05 -1.50 1.90 0.00 -0.65 0.00 0.00 174.74 174.43 2h47 h ARG 292 N 9.25 0.99 0.00 2.88 3.08 -1.89 -0.24 114.38 128.45 2h47 h ARG 292 Ca -0.17 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 59.81 2h47 h ARG 292 Cb 1.06 -0.22 -0.00 0.00 0.08 0.00 0.00 29.97 30.89 2h47 h ARG 292 CO 1.13 0.65 -0.01 0.00 -1.07 0.00 0.00 179.97 180.68 2h47 h ALA 293 N 1.51 1.04 0.00 0.04 0.00 -1.95 -2.89 119.26 117.01 2h47 h ALA 293 Ca 0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2h47 h ALA 293 Cb 0.27 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2h47 h ALA 293 CO -0.17 0.01 -0.11 -1.13 0.00 0.00 0.00 179.25 177.86 2h47 n SER 294 N -3.16 0.17 -0.10 0.00 3.41 -1.01 -4.99 113.62 107.95 2h47 n SER 294 Ca -0.02 -0.53 -0.01 0.00 -0.26 0.00 0.00 58.87 58.05 2h47 n SER 294 Cb 0.15 1.00 -0.01 0.00 -0.26 0.00 0.00 64.21 65.10 2h47 n SER 294 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2h47 n GLY 295 N 1.07 0.46 3.70 5.00 0.00 -0.13 -4.85 105.19 110.44 2h47 n GLY 295 Ca 0.00 -0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 2h47 n GLY 295 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2h47 s ARG 296 N -1.01 4.51 -0.13 1.61 0.52 -1.04 -2.11 118.95 121.29 2h47 s ARG 296 Ca 0.00 1.44 -0.02 0.00 -0.52 0.00 0.00 55.73 56.63 2h47 s ARG 296 Cb 0.00 -3.48 -0.03 0.00 0.52 0.00 0.00 34.95 31.97 2h47 s ARG 296 CO 0.00 -0.15 -0.05 1.41 0.02 0.00 0.00 175.30 176.53 2h47 s MET 297 N 1.32 3.44 -0.11 3.54 -2.45 0.16 -0.69 119.30 124.51 2h47 s MET 297 Ca 0.52 -0.54 -0.02 0.00 -1.25 0.00 0.00 55.69 54.39 2h47 s MET 297 Cb -0.21 -2.81 -0.03 0.00 1.25 0.00 0.00 34.83 33.03 2h47 s MET 297 CO 0.25 0.33 -0.02 0.71 1.05 0.00 0.00 175.02 177.35 2h47 s TYR 298 N 0.10 3.09 -0.02 4.11 1.51 0.76 0.12 117.35 127.02 2h47 s TYR 298 Ca -0.02 0.02 -0.05 0.00 -1.01 0.00 0.00 57.07 56.01 2h47 s TYR 298 Cb -0.14 -1.84 0.00 0.00 -0.11 0.00 0.00 41.96 39.88 2h47 s TYR 298 CO 0.03 0.28 0.12 0.08 -1.11 0.00 0.00 175.55 174.95 2h47 s VAL 299 N -0.44 0.05 -0.28 0.71 1.01 -0.55 -1.61 120.40 119.29 2h47 s VAL 299 Ca 0.08 -0.38 -0.21 0.00 0.00 0.00 0.00 61.98 61.46 2h47 s VAL 299 Cb -0.12 -0.30 -0.01 0.00 0.00 0.00 0.00 36.38 35.95 2h47 s VAL 299 CO 0.02 -0.21 0.68 -0.36 0.00 0.00 0.00 175.10 175.23 2h47 s PHE 300 N -0.70 3.25 0.09 5.22 2.99 -1.07 0.37 117.98 128.13 2h47 s PHE 300 Ca -0.08 0.79 0.10 0.00 0.00 0.00 0.00 56.93 57.74 2h47 s PHE 300 Cb -0.05 -2.97 -0.03 0.00 0.00 0.00 0.00 43.02 39.97 2h47 s PHE 300 CO 0.01 -0.42 -0.26 -1.64 -0.00 0.00 0.00 175.22 172.91 2h47 s MET 301 N 2.65 1.55 -0.03 0.44 -1.94 -0.12 0.30 119.30 122.15 2h47 s MET 301 Ca 0.28 -1.20 0.00 0.00 -1.71 0.00 0.00 55.69 53.06 2h47 s MET 301 Cb -0.15 -1.87 0.03 0.00 2.01 0.00 0.00 34.83 34.85 2h47 s MET 301 CO 0.10 0.46 0.02 -3.38 -0.01 0.00 0.00 175.02 172.21 2h47 s HIS 302 N -0.94 0.15 0.96 -0.03 -3.43 -0.52 -1.27 115.29 110.21 2h47 s HIS 302 Ca 0.12 0.08 -0.12 0.00 -0.80 0.00 0.00 55.06 54.34 2h47 s HIS 302 Cb -0.10 -0.32 0.16 0.00 -1.43 0.00 0.00 32.58 30.89 2h47 s HIS 302 CO 0.04 -0.11 1.10 -1.25 -2.00 0.00 0.00 174.74 172.52 2h47 s PRO 303 N 1.12 0.77 -1.27 -0.38 0.04 -1.26 -2.73 135.00 131.28 2h47 s PRO 303 Ca -0.09 0.51 -0.07 0.00 0.04 0.00 0.00 61.00 61.40 2h47 s PRO 303 Cb -0.13 -1.78 0.01 0.00 0.04 0.00 0.00 34.50 32.64 2h47 s PRO 303 CO -0.03 -2.50 1.10 -0.25 0.04 0.00 0.00 177.00 175.36 2h47 n ASP 304 N -4.01 -5.37 -4.87 6.66 8.00 -0.42 -4.90 116.55 111.63 2h47 n ASP 304 Ca 0.06 -0.53 -0.31 0.00 0.71 0.00 0.00 54.79 54.72 2h47 n ASP 304 Cb 0.57 -4.85 0.00 0.00 -0.02 0.00 0.00 41.12 36.83 2h47 n ASP 304 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2h47 s GLY 305 N -3.50 1.69 0.00 0.44 0.00 -0.14 -5.04 107.32 100.76 2h47 s GLY 305 Ca 0.45 -0.13 0.00 0.00 0.00 0.00 0.00 44.72 45.04 2h47 s GLY 305 CO 0.70 0.13 0.00 0.58 0.00 0.00 0.00 173.10 174.50 2h47 n LYS 306 N -2.50 0.00 -1.69 2.90 2.85 -1.26 -4.94 118.16 113.52 2h47 n LYS 306 Ca 0.05 0.00 -0.43 0.00 -1.05 0.00 0.00 58.31 56.88 2h47 n LYS 306 Cb 0.54 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.90 2h47 n LYS 306 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 2h47 n GLU 307 N 0.00 2.17 -0.85 -1.58 4.07 -1.26 -2.35 120.64 120.84 2h47 n GLU 307 Ca 0.00 0.77 0.00 0.00 -0.06 0.00 0.00 57.16 57.87 2h47 n GLU 307 Cb 0.00 -2.42 0.00 0.00 -0.06 0.00 0.00 31.44 28.96 2h47 n GLU 307 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2h47 n GLY 308 N 1.67 0.63 0.58 8.31 0.00 -1.26 -4.91 105.19 110.21 2h47 n GLY 308 Ca 0.09 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.17 2h47 n GLY 308 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2h47 n THR 309 N -2.72 0.15 0.10 2.61 -2.24 -0.99 -4.65 114.28 106.55 2h47 n THR 309 Ca 0.00 -0.58 0.01 0.00 -2.27 0.00 0.00 64.05 61.22 2h47 n THR 309 Cb 0.00 1.16 0.06 0.00 -2.10 0.00 0.00 70.33 69.45 2h47 n THR 309 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2h47 n HIS 310 N 0.76 0.00 -0.17 4.78 1.44 -1.26 -1.53 115.22 119.23 2h47 n HIS 310 Ca 0.09 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.81 2h47 n HIS 310 Cb 0.36 -0.40 0.01 0.00 0.12 0.00 0.00 29.99 30.09 2h47 n HIS 310 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 2h47 n LYS 311 N -1.40 2.66 -1.94 -1.40 5.02 -1.26 -1.26 118.16 118.59 2h47 n LYS 311 Ca 0.01 -1.56 -0.38 0.00 -2.02 0.00 0.00 58.31 54.36 2h47 n LYS 311 Cb 0.03 -1.02 0.02 0.00 -0.02 0.00 0.00 35.03 34.03 2h47 n LYS 311 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2h47 s PHE 312 N -1.13 2.53 0.74 2.13 0.40 -0.58 -4.33 117.98 117.73 2h47 s PHE 312 Ca 0.03 1.40 -0.16 0.00 -0.60 0.00 0.00 56.93 57.61 2h47 s PHE 312 Cb 0.03 -3.70 -0.01 0.00 0.51 0.00 0.00 43.02 39.85 2h47 s PHE 312 CO 0.00 -2.46 0.74 -2.30 0.70 0.00 0.00 175.22 171.90 2h47 n PRO 313 N -0.60 0.34 -2.42 0.24 -0.02 -1.26 -3.71 135.00 127.57 2h47 n PRO 313 Ca 0.08 0.17 -0.42 0.00 -2.02 0.00 0.00 63.50 61.30 2h47 n PRO 313 Cb 0.45 -2.02 -0.03 0.00 -0.02 0.00 0.00 33.50 31.88 2h47 n PRO 313 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2h47 s ALA 314 N -1.92 3.53 -0.07 3.55 0.00 0.11 -4.75 121.76 122.20 2h47 s ALA 314 Ca 0.69 0.64 0.14 0.00 0.00 0.00 0.00 51.96 53.42 2h47 s ALA 314 Cb -0.34 -3.54 -0.10 0.00 0.00 0.00 0.00 23.12 19.14 2h47 s ALA 314 CO 0.55 -0.84 1.09 0.00 0.00 0.00 0.00 175.76 176.56 2h47 h ALA 315 N 7.62 0.62 -2.80 0.00 0.00 -1.50 -2.47 119.26 120.72 2h47 h ALA 315 Ca -0.34 -0.83 -0.04 0.00 0.00 0.00 0.00 54.91 53.70 2h47 h ALA 315 Cb 1.16 0.11 -0.12 0.00 0.00 0.00 0.00 17.79 18.94 2h47 h ALA 315 CO 0.90 0.99 -0.05 -1.21 0.00 0.00 0.00 179.25 179.88 2h47 s GLU 316 N -2.84 1.21 -0.15 0.00 2.02 -0.48 -1.57 118.70 116.88 2h47 s GLU 316 Ca -0.00 -0.82 -0.00 0.00 0.02 0.00 0.00 54.97 54.17 2h47 s GLU 316 Cb 0.08 0.48 -0.01 0.00 0.10 0.00 0.00 34.13 34.79 2h47 s GLU 316 CO 0.79 -0.49 -0.13 0.42 0.02 0.00 0.00 175.26 175.87 2h47 s ILE 317 N -3.85 2.88 -0.09 -1.63 1.01 0.19 -0.95 121.20 118.76 2h47 s ILE 317 Ca 0.07 -0.70 -0.04 0.00 0.00 0.00 0.00 60.65 59.98 2h47 s ILE 317 Cb 0.01 -2.22 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 2h47 s ILE 317 CO -0.07 0.51 0.08 0.26 0.00 0.00 0.00 174.94 175.72 2h47 s TRP 318 N 0.74 3.40 -0.26 3.97 0.52 0.16 -1.80 118.94 125.68 2h47 s TRP 318 Ca -0.06 0.36 -0.05 0.00 0.02 0.00 0.00 56.10 56.38 2h47 s TRP 318 Cb -0.15 -1.86 0.00 0.00 -1.15 0.00 0.00 33.47 30.31 2h47 s TRP 318 CO 0.01 0.62 0.02 0.08 0.02 0.00 0.00 176.95 177.69 2h47 s VAL 319 N -1.00 3.63 0.01 4.03 1.01 0.17 -1.48 120.40 126.77 2h47 s VAL 319 Ca 0.16 -0.63 0.05 0.00 0.00 0.00 0.00 61.98 61.55 2h47 s VAL 319 Cb -0.12 -2.78 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 2h47 s VAL 319 CO 0.05 0.23 -0.12 -0.04 0.00 0.00 0.00 175.10 175.22 2h47 s MET 320 N 1.48 2.35 -0.39 2.72 -1.94 0.12 0.04 119.30 123.67 2h47 s MET 320 Ca 0.04 -0.83 -0.14 0.00 -1.71 0.00 0.00 55.69 53.04 2h47 s MET 320 Cb -0.16 -2.36 0.01 0.00 2.01 0.00 0.00 34.83 34.33 2h47 s MET 320 CO -0.00 0.58 0.29 0.34 -0.01 0.00 0.00 175.02 176.21 2h47 s ASP 321 N -1.35 6.10 0.45 3.03 -1.08 -0.37 0.37 116.67 123.81 2h47 s ASP 321 Ca 0.15 -0.78 0.22 0.00 -0.52 0.00 0.00 52.55 51.62 2h47 s ASP 321 Cb -0.11 -2.15 1.06 0.00 -1.46 0.00 0.00 42.92 40.26 2h47 s ASP 321 CO 0.06 -0.40 1.92 0.71 0.52 0.00 0.00 175.17 177.98 2h47 h THR 322 N 5.60 0.78 -0.27 1.71 1.35 -1.73 0.33 112.91 120.67 2h47 h THR 322 Ca -0.28 -0.97 -0.19 0.00 -0.55 0.00 0.00 66.41 64.42 2h47 h THR 322 Cb 1.13 1.59 0.00 0.00 -1.73 0.00 0.00 68.15 69.14 2h47 h THR 322 CO 0.71 0.23 -0.59 0.11 -0.25 0.00 0.00 175.52 175.73 2h47 h LYS 323 N 0.00 0.87 -0.01 4.72 1.57 -1.92 -3.28 116.57 118.51 2h47 h LYS 323 Ca -0.00 -0.58 0.00 0.00 -1.87 0.00 0.00 60.65 58.20 2h47 h LYS 323 Cb 0.57 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.96 2h47 h LYS 323 CO 0.03 1.21 -0.57 0.25 -0.57 0.00 0.00 179.45 179.80 2h47 n THR 324 N -4.00 0.00 -2.39 -0.16 -2.24 -1.14 -4.98 114.28 99.37 2h47 n THR 324 Ca -0.05 -0.21 -0.16 0.00 -2.27 0.00 0.00 64.05 61.36 2h47 n THR 324 Cb 0.65 1.18 -0.01 0.00 -2.10 0.00 0.00 70.33 70.05 2h47 n THR 324 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2h47 n LYS 325 N -0.33 -1.95 -4.40 -0.78 5.02 0.11 -4.97 118.16 110.87 2h47 n LYS 325 Ca 0.08 0.81 -0.24 0.00 -2.02 0.00 0.00 58.31 56.94 2h47 n LYS 325 Cb 0.44 -5.43 -0.11 0.00 -0.02 0.00 0.00 35.03 29.91 2h47 n LYS 325 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2h47 s GLN 326 N -4.99 1.46 0.14 1.97 -1.52 -1.16 -4.95 119.66 110.61 2h47 s GLN 326 Ca 0.00 -1.55 -0.29 0.00 -1.95 0.00 0.00 55.36 51.57 2h47 s GLN 326 Cb 0.00 -1.59 -0.07 0.00 -0.22 0.00 0.00 33.01 31.13 2h47 s GLN 326 CO 0.00 0.32 0.91 0.50 -0.25 0.00 0.00 175.29 176.77 2h47 s ARG 327 N -3.01 4.70 -0.00 2.91 3.52 -1.26 -1.24 118.95 124.57 2h47 s ARG 327 Ca 0.21 1.38 0.04 0.00 -0.13 0.00 0.00 55.73 57.23 2h47 s ARG 327 Cb -0.06 -3.34 -0.04 0.00 -1.56 0.00 0.00 34.95 29.95 2h47 s ARG 327 CO 0.10 0.34 0.13 1.33 -0.81 0.00 0.00 175.30 176.38 2h47 n VAL 328 N 2.33 0.00 -3.59 7.11 0.24 0.11 -4.92 118.33 119.60 2h47 n VAL 328 Ca -0.00 -0.31 -0.11 0.00 -2.04 0.00 0.00 64.34 61.87 2h47 n VAL 328 Cb 0.49 0.82 -0.06 0.00 -1.47 0.00 0.00 33.84 33.62 2h47 n VAL 328 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2h47 s ALA 329 N -1.62 -1.92 -0.04 2.33 0.00 -1.18 -4.79 121.76 114.55 2h47 s ALA 329 Ca 0.01 1.68 -0.03 0.00 0.00 0.00 0.00 51.96 53.61 2h47 s ALA 329 Cb 0.03 -0.91 0.02 0.00 0.00 0.00 0.00 23.12 22.26 2h47 s ALA 329 CO 0.15 -0.29 0.10 -0.98 0.00 0.00 0.00 175.76 174.74 2h47 s ARG 330 N -0.57 0.10 0.15 0.00 1.70 -1.26 0.42 118.95 119.48 2h47 s ARG 330 Ca -0.01 0.20 -0.09 0.00 -0.47 0.00 0.00 55.73 55.36 2h47 s ARG 330 Cb -0.02 -0.03 -0.01 0.00 -0.57 0.00 0.00 34.95 34.32 2h47 s ARG 330 CO -0.00 -0.06 0.27 0.96 -1.08 0.00 0.00 175.30 175.39 2h47 s ILE 331 N 0.42 0.08 0.23 4.99 -4.36 -0.74 -4.97 121.20 116.84 2h47 s ILE 331 Ca -0.03 -1.34 -0.31 0.00 -0.26 0.00 0.00 60.65 58.71 2h47 s ILE 331 Cb -0.04 -1.75 -0.14 0.00 1.25 0.00 0.00 42.46 41.77 2h47 s ILE 331 CO -0.02 -0.35 1.25 -2.65 0.24 0.00 0.00 174.94 173.41 2h47 n PRO 332 N -0.19 1.62 0.00 0.37 -0.02 -1.26 0.57 135.00 136.08 2h47 n PRO 332 Ca -0.09 0.58 0.13 0.00 -2.02 0.00 0.00 63.50 62.10 2h47 n PRO 332 Cb 0.63 -2.13 0.35 0.00 -0.02 0.00 0.00 33.50 32.34 2h47 n PRO 332 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2h47 n GLY 333 N 1.88 -1.00 4.07 -1.23 0.00 -0.61 -4.38 105.19 103.92 2h47 n GLY 333 Ca 0.12 -0.35 -0.34 0.00 0.00 0.00 0.00 46.02 45.46 2h47 n GLY 333 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h47 n ARG 334 N -1.13 -3.19 -2.87 1.61 1.74 -1.25 -0.64 116.66 110.93 2h47 n ARG 334 Ca 0.09 0.38 -0.18 0.00 -0.77 0.00 0.00 57.85 57.36 2h47 n ARG 334 Cb 0.33 -5.11 0.00 0.00 -1.02 0.00 0.00 32.46 26.67 2h47 n ARG 334 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2h47 n ASP 335 N -2.57 -4.37 -4.80 0.55 8.00 -0.93 -4.83 116.55 107.60 2h47 n ASP 335 Ca 0.07 -0.11 -0.32 0.00 0.71 0.00 0.00 54.79 55.13 2h47 n ASP 335 Cb 0.50 -3.63 0.03 0.00 -0.02 0.00 0.00 41.12 37.99 2h47 n ASP 335 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2h47 s ALA 336 N -2.86 2.66 0.00 2.24 0.00 0.19 -4.34 121.76 119.66 2h47 s ALA 336 Ca 0.19 0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.50 2h47 s ALA 336 Cb -0.10 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.79 2h47 s ALA 336 CO 0.24 -1.02 0.00 1.28 0.00 0.00 0.00 175.76 176.26 2h47 n LEU 337 N -2.40 0.97 -4.17 0.00 4.77 0.14 0.04 117.00 116.35 2h47 n LEU 337 Ca 0.09 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.94 2h47 n LEU 337 Cb 0.53 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.51 2h47 n LEU 337 CO 0.49 0.16 -0.40 -0.44 -1.33 0.00 0.00 177.39 175.88 2h47 s SER 338 N -3.08 1.29 0.26 -1.43 0.01 -0.97 -1.74 113.70 108.04 2h47 s SER 338 Ca 0.00 -0.89 -0.03 0.00 1.31 0.00 0.00 55.95 56.34 2h47 s SER 338 Cb 0.00 0.05 -0.02 0.00 0.21 0.00 0.00 66.02 66.25 2h47 s SER 338 CO 0.00 -0.35 0.30 0.00 0.41 0.00 0.00 173.24 173.60 2h47 s MET 339 N -3.23 1.50 0.00 12.44 0.23 0.12 -0.82 119.30 129.54 2h47 s MET 339 Ca 0.08 -1.63 -0.25 0.00 -1.03 0.00 0.00 55.69 52.86 2h47 s MET 339 Cb 0.01 0.36 0.06 0.00 -1.53 0.00 0.00 34.83 33.72 2h47 s MET 339 CO -0.02 -0.57 0.57 -0.08 -2.03 0.00 0.00 175.02 172.89 2h47 s THR 340 N -3.80 0.02 -0.06 3.16 -1.32 -0.75 -4.83 115.64 108.05 2h47 s THR 340 Ca 0.34 -0.15 0.05 0.00 -1.21 0.00 0.00 61.69 60.71 2h47 s THR 340 Cb 0.03 -0.94 -0.00 0.00 -1.51 0.00 0.00 72.50 70.08 2h47 s THR 340 CO 0.15 -0.09 -0.20 -0.63 -2.21 0.00 0.00 174.62 171.65 2h47 s ILE 341 N -1.79 1.69 -0.36 5.08 -1.09 -1.26 -0.99 121.20 122.47 2h47 s ILE 341 Ca -0.09 -0.84 -0.09 0.00 -2.23 0.00 0.00 60.65 57.40 2h47 s ILE 341 Cb -0.01 -1.45 0.03 0.00 -1.58 0.00 0.00 42.46 39.45 2h47 s ILE 341 CO 0.04 0.48 0.17 -0.62 -1.23 0.00 0.00 174.94 173.77 2h47 s ASP 342 N 0.11 5.58 0.07 3.58 -1.08 -0.58 -4.96 116.67 119.38 2h47 s ASP 342 Ca -0.08 -1.05 -0.35 0.00 -0.52 0.00 0.00 52.55 50.55 2h47 s ASP 342 Cb -0.14 -1.97 -0.19 0.00 -1.46 0.00 0.00 42.92 39.17 2h47 s ASP 342 CO 0.04 -0.36 1.59 1.56 0.52 0.00 0.00 175.17 178.52 2h47 h GLN 343 N 8.35 -1.04 -0.40 4.34 1.08 -1.93 -2.34 115.11 123.16 2h47 h GLN 343 Ca -0.25 0.07 0.08 0.00 -1.45 0.00 0.00 58.65 57.11 2h47 h GLN 343 Cb 1.10 0.24 -0.09 0.00 -0.05 0.00 0.00 27.48 28.67 2h47 h GLN 343 CO 0.64 -0.69 -0.23 1.96 -0.95 0.00 0.00 178.83 179.56 2h47 h GLN 344 N -1.08 -0.16 -0.00 1.46 4.20 -1.97 -1.98 115.11 115.58 2h47 h GLN 344 Ca -0.10 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.62 2h47 h GLN 344 Cb 0.86 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.68 2h47 h GLN 344 CO 0.12 -0.10 -0.08 0.54 -0.67 0.00 0.00 178.83 178.63 2h47 n ARG 345 N -5.39 0.84 -3.28 1.46 3.00 -1.25 -4.95 116.66 107.09 2h47 n ARG 345 Ca 0.02 -0.28 -0.15 0.00 -0.01 0.00 0.00 57.85 57.43 2h47 n ARG 345 Cb 0.31 -1.49 0.08 0.00 0.00 0.00 0.00 32.46 31.35 2h47 n ARG 345 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2h47 n ASN 346 N -0.84 -5.20 -4.40 0.55 3.02 -0.75 -4.91 115.26 102.74 2h47 n ASN 346 Ca 0.16 -0.67 -0.21 0.00 -0.03 0.00 0.00 54.58 53.83 2h47 n ASN 346 Cb 0.26 -5.12 -0.10 0.00 -0.61 0.00 0.00 39.78 34.21 2h47 n ASN 346 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2h47 s LEU 347 N -5.64 2.57 -0.01 3.41 1.43 -0.93 -1.74 118.68 117.77 2h47 s LEU 347 Ca 0.31 -1.02 0.00 0.00 -1.03 0.00 0.00 54.13 52.39 2h47 s LEU 347 Cb -0.04 -0.86 0.01 0.00 0.03 0.00 0.00 46.19 45.32 2h47 s LEU 347 CO 0.73 -0.08 0.00 -0.32 0.23 0.00 0.00 176.35 176.91 2h47 s MET 348 N -3.58 0.02 -0.13 1.70 -2.45 -0.92 -1.53 119.30 112.41 2h47 s MET 348 Ca 0.26 0.04 0.03 0.00 -1.25 0.00 0.00 55.69 54.76 2h47 s MET 348 Cb -0.03 -0.09 0.00 0.00 1.25 0.00 0.00 34.83 35.97 2h47 s MET 348 CO 0.10 -0.04 -0.22 -0.51 1.05 0.00 0.00 175.02 175.41 2h47 s LEU 349 N 0.28 2.15 0.08 4.11 1.43 -0.17 -0.87 118.68 125.69 2h47 s LEU 349 Ca -0.02 -0.57 0.06 0.00 -1.03 0.00 0.00 54.13 52.57 2h47 s LEU 349 Cb -0.04 -1.45 -0.04 0.00 0.03 0.00 0.00 46.19 44.70 2h47 s LEU 349 CO -0.01 0.11 -0.08 0.42 0.23 0.00 0.00 176.35 177.02 2h47 s THR 350 N 0.64 3.50 -0.02 5.49 -4.23 -0.60 -1.82 115.64 118.60 2h47 s THR 350 Ca -0.11 -1.11 0.01 0.00 -1.18 0.00 0.00 61.69 59.30 2h47 s THR 350 Cb -0.16 -2.61 0.02 0.00 1.34 0.00 0.00 72.50 71.09 2h47 s THR 350 CO 0.02 0.19 -0.01 -0.22 -0.54 0.00 0.00 174.62 174.06 2h47 s LEU 351 N -2.00 1.38 -0.01 4.79 2.96 -0.00 0.07 118.68 125.87 2h47 s LEU 351 Ca 0.21 -0.04 0.19 0.00 -0.22 0.00 0.00 54.13 54.27 2h47 s LEU 351 Cb -0.11 -0.22 0.55 0.00 0.50 0.00 0.00 46.19 46.92 2h47 s LEU 351 CO 0.13 -0.06 1.46 -0.90 -1.32 0.00 0.00 176.35 175.65 2h47 n ASP 352 N 3.86 3.71 0.00 3.68 5.68 -1.01 0.27 116.55 132.74 2h47 n ASP 352 Ca -0.24 -2.03 0.00 0.00 -0.50 0.00 0.00 54.79 52.03 2h47 n ASP 352 Cb 0.52 -0.42 0.00 0.00 -1.14 0.00 0.00 41.12 40.08 2h47 n ASP 352 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2h47 n GLY 353 N 1.30 1.37 0.00 6.12 0.00 -1.15 -4.78 105.19 108.05 2h47 n GLY 353 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 2h47 n GLY 353 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h47 n GLY 354 N -0.09 0.00 3.36 -0.02 0.00 -1.26 0.67 105.19 107.85 2h47 n GLY 354 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2h47 n GLY 354 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2h47 s ASN 355 N -0.29 3.39 -0.22 1.61 0.01 -1.26 0.31 114.94 118.48 2h47 s ASN 355 Ca 0.00 -0.38 -0.05 0.00 -0.71 0.00 0.00 52.86 51.72 2h47 s ASN 355 Cb 0.00 -0.58 -0.01 0.00 0.41 0.00 0.00 41.25 41.07 2h47 s ASN 355 CO 0.00 0.32 -0.01 -0.69 -1.51 0.00 0.00 177.10 175.21 2h47 s VAL 356 N -0.59 3.64 -0.13 1.60 1.01 -0.87 -2.39 120.40 122.67 2h47 s VAL 356 Ca 0.09 -0.40 -0.06 0.00 0.00 0.00 0.00 61.98 61.60 2h47 s VAL 356 Cb -0.11 -2.67 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 2h47 s VAL 356 CO 0.00 0.40 0.10 0.20 0.00 0.00 0.00 175.10 175.81 2h47 s ASN 357 N 1.47 6.05 -0.30 3.32 0.01 0.11 -0.15 114.94 125.45 2h47 s ASN 357 Ca 0.05 0.33 -0.07 0.00 -0.71 0.00 0.00 52.86 52.47 2h47 s ASN 357 Cb -0.14 -1.94 0.01 0.00 0.41 0.00 0.00 41.25 39.58 2h47 s ASN 357 CO -0.01 0.35 0.09 -0.69 -1.51 0.00 0.00 177.10 175.32 2h47 s VAL 358 N -0.67 4.01 0.13 1.60 1.01 0.71 -1.56 120.40 125.63 2h47 s VAL 358 Ca 0.12 -0.68 0.08 0.00 0.00 0.00 0.00 61.98 61.50 2h47 s VAL 358 Cb -0.12 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 2h47 s VAL 358 CO 0.02 0.07 -0.09 -0.31 0.00 0.00 0.00 175.10 174.80 2h47 s TYR 359 N 1.51 2.72 -0.28 5.22 1.51 -0.05 0.39 117.35 128.36 2h47 s TYR 359 Ca 0.03 -0.18 -0.09 0.00 -1.01 0.00 0.00 57.07 55.82 2h47 s TYR 359 Cb -0.17 -1.38 -0.02 0.00 -0.11 0.00 0.00 41.96 40.27 2h47 s TYR 359 CO 0.03 0.46 0.12 0.34 -1.11 0.00 0.00 175.55 175.39 2h47 s ASP 360 N -2.46 5.42 -0.26 2.29 2.15 0.63 -2.17 116.67 122.28 2h47 s ASP 360 Ca 0.23 -0.35 0.12 0.00 0.43 0.00 0.00 52.55 52.98 2h47 s ASP 360 Cb -0.10 -1.98 0.54 0.00 -0.30 0.00 0.00 42.92 41.07 2h47 s ASP 360 CO 0.15 -0.11 1.49 2.30 -0.17 0.00 0.00 175.17 178.82 2h47 n ILE 361 N 4.96 2.51 0.28 4.11 -5.35 -0.71 -1.29 119.36 123.87 2h47 n ILE 361 Ca -0.15 -2.31 0.12 0.00 -0.27 0.00 0.00 62.75 60.14 2h47 n ILE 361 Cb 0.50 -0.31 0.56 0.00 -1.74 0.00 0.00 39.64 38.66 2h47 n ILE 361 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 2h47 h SER 362 N 1.37 0.00 -2.52 7.28 4.64 -1.90 -3.42 113.55 119.00 2h47 h SER 362 Ca 0.17 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.93 2h47 h SER 362 Cb 1.68 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.64 2h47 h SER 362 CO 0.39 0.00 -0.71 -1.10 -0.87 0.00 0.00 176.83 174.54 2h47 s GLN 363 N -3.46 1.62 0.20 4.77 -1.52 -1.26 -5.05 119.66 114.96 2h47 s GLN 363 Ca 0.01 -1.79 -0.10 0.00 -1.95 0.00 0.00 55.36 51.53 2h47 s GLN 363 Cb 0.08 -1.46 0.25 0.00 -0.22 0.00 0.00 33.01 31.66 2h47 s GLN 363 CO 0.31 0.17 1.76 -1.35 -0.25 0.00 0.00 175.29 175.93 2h47 h PRO 364 N 2.26 0.46 -5.95 2.91 0.11 -1.95 -3.39 132.00 126.45 2h47 h PRO 364 Ca -0.40 -0.03 -0.57 0.00 0.11 0.00 0.00 66.00 65.11 2h47 h PRO 364 Cb 1.24 -0.10 -0.06 0.00 0.11 0.00 0.00 31.00 32.19 2h47 h PRO 364 CO 0.65 0.31 0.14 -2.00 -0.21 0.00 0.00 178.00 176.89 2h47 s GLU 365 N -6.10 4.38 0.41 1.05 2.12 -1.26 -4.70 118.70 114.60 2h47 s GLU 365 Ca -0.13 0.85 -0.25 0.00 0.36 0.00 0.00 54.97 55.80 2h47 s GLU 365 Cb 0.16 -3.49 -0.08 0.00 0.26 0.00 0.00 34.13 30.98 2h47 s GLU 365 CO 0.75 -0.05 1.23 -2.14 -0.54 0.00 0.00 175.26 174.51 2h47 s PRO 366 N 1.20 3.99 -0.24 4.30 0.02 -1.26 -4.83 135.00 138.19 2h47 s PRO 366 Ca 0.36 1.98 0.00 0.00 0.02 0.00 0.00 61.00 63.36 2h47 s PRO 366 Cb -0.17 -2.70 0.03 0.00 0.02 0.00 0.00 34.50 31.68 2h47 s PRO 366 CO 0.16 -0.41 -0.10 0.21 -0.33 0.00 0.00 177.00 176.52 2h47 s LYS 367 N -2.28 2.72 -0.30 5.54 2.20 -0.41 -4.91 119.74 122.29 2h47 s LYS 367 Ca 0.57 -1.04 -0.29 0.00 -0.36 0.00 0.00 55.97 54.85 2h47 s LYS 367 Cb -0.34 -2.88 -0.02 0.00 -1.51 0.00 0.00 37.83 33.08 2h47 s LYS 367 CO 0.43 -0.41 1.62 -1.17 -0.36 0.00 0.00 175.35 175.47 2h47 s LEU 368 N 1.26 3.70 -0.18 5.43 2.96 -1.26 -0.27 118.68 130.33 2h47 s LEU 368 Ca -0.01 1.35 -0.24 0.00 -0.22 0.00 0.00 54.13 55.01 2h47 s LEU 368 Cb -0.17 -3.53 -0.22 0.00 0.50 0.00 0.00 46.19 42.77 2h47 s LEU 368 CO -0.06 -1.43 0.42 -0.07 -1.32 0.00 0.00 176.35 173.89 2h47 h LEU 369 N 12.41 0.02 -7.21 -0.68 3.38 -0.42 -3.49 115.31 119.33 2h47 h LEU 369 Ca -0.32 -0.70 0.12 0.00 0.09 0.00 0.00 57.88 57.07 2h47 h LEU 369 Cb 1.15 -0.01 -0.13 0.00 0.09 0.00 0.00 40.66 41.76 2h47 h LEU 369 CO 1.03 1.33 0.46 0.00 0.09 0.00 0.00 178.44 181.35 2h47 s ARG 370 N -2.32 0.99 -0.13 1.13 1.70 -1.19 -5.00 118.95 114.13 2h47 s ARG 370 Ca -0.25 -0.43 0.01 0.00 -0.47 0.00 0.00 55.73 54.59 2h47 s ARG 370 Cb 0.03 0.41 0.02 0.00 -0.57 0.00 0.00 34.95 34.84 2h47 s ARG 370 CO 0.64 -0.44 -0.16 0.99 -1.08 0.00 0.00 175.30 175.25 2h47 s THR 371 N -3.25 1.61 -0.58 4.99 2.01 -1.26 -0.21 115.64 118.95 2h47 s THR 371 Ca 0.07 -0.68 -0.20 0.00 0.31 0.00 0.00 61.69 61.18 2h47 s THR 371 Cb -0.01 -1.49 0.08 0.00 0.01 0.00 0.00 72.50 71.09 2h47 s THR 371 CO -0.06 0.46 0.76 -0.63 -0.69 0.00 0.00 174.62 174.47 2h47 s ILE 372 N 1.23 4.68 0.36 1.82 1.01 0.79 -4.96 121.20 126.14 2h47 s ILE 372 Ca -0.00 -0.62 -0.25 0.00 0.00 0.00 0.00 60.65 59.78 2h47 s ILE 372 Cb -0.14 -4.49 -0.09 0.00 0.01 0.00 0.00 42.46 37.75 2h47 s ILE 372 CO -0.07 -1.12 1.03 -1.61 0.00 0.00 0.00 174.94 173.17 2h47 s GLU 373 N 3.10 4.35 -1.32 2.79 2.02 -1.26 -2.05 118.70 126.33 2h47 s GLU 373 Ca 0.16 1.51 -0.08 0.00 0.02 0.00 0.00 54.97 56.58 2h47 s GLU 373 Cb -0.20 -2.71 0.01 0.00 0.10 0.00 0.00 34.13 31.32 2h47 s GLU 373 CO 0.10 0.03 1.15 0.41 0.02 0.00 0.00 175.26 176.96 2h47 n GLY 374 N 0.53 -0.50 0.24 -1.39 0.00 -1.12 -4.88 105.19 98.08 2h47 n GLY 374 Ca 0.03 0.22 0.11 0.00 0.00 0.00 0.00 46.02 46.39 2h47 n GLY 374 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h47 h ALA 375 N 0.99 1.09 -2.65 4.61 0.00 -0.24 -3.46 119.26 119.60 2h47 h ALA 375 Ca -0.56 -0.16 0.11 0.00 0.00 0.00 0.00 54.91 54.30 2h47 h ALA 375 Cb 1.36 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 19.04 2h47 h ALA 375 CO 0.54 0.22 0.36 0.00 0.00 0.00 0.00 179.25 180.37 2h47 s ALA 376 N -3.82 -1.50 -0.13 0.00 0.00 -1.11 -4.84 121.76 110.36 2h47 s ALA 376 Ca -0.01 0.08 -0.03 0.00 0.00 0.00 0.00 51.96 52.01 2h47 s ALA 376 Cb 0.11 0.72 -0.24 0.00 0.00 0.00 0.00 23.12 23.71 2h47 s ALA 376 CO 0.61 -0.98 0.31 0.39 0.00 0.00 0.00 175.76 176.09 2h47 n GLU 377 N -0.44 0.73 -3.12 0.00 1.02 -1.26 -4.22 120.64 113.35 2h47 n GLU 377 Ca -0.07 0.24 -0.14 0.00 -0.02 0.00 0.00 57.16 57.18 2h47 n GLU 377 Cb 0.61 -1.69 -0.04 0.00 -0.02 0.00 0.00 31.44 30.29 2h47 n GLU 377 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2h47 s ALA 378 N -2.56 -0.63 -0.04 0.62 0.00 -1.16 -4.59 121.76 113.40 2h47 s ALA 378 Ca -0.22 -1.17 0.05 0.00 0.00 0.00 0.00 51.96 50.62 2h47 s ALA 378 Cb 0.07 -2.22 -0.01 0.00 0.00 0.00 0.00 23.12 20.97 2h47 s ALA 378 CO 0.75 -2.13 -0.20 0.45 0.00 0.00 0.00 175.76 174.63 2h47 s SER 379 N 0.77 2.50 -0.04 0.00 0.15 0.21 -1.25 113.70 116.04 2h47 s SER 379 Ca 0.28 -0.41 0.05 0.00 0.70 0.00 0.00 55.95 56.57 2h47 s SER 379 Cb -0.02 -0.63 0.08 0.00 -1.71 0.00 0.00 66.02 63.74 2h47 s SER 379 CO -0.10 0.20 1.04 0.18 1.20 0.00 0.00 173.24 175.76 2h47 n LEU 380 N 2.99 2.08 -3.78 3.45 4.77 -1.26 -2.94 117.00 122.31 2h47 n LEU 380 Ca -0.17 -2.28 -0.13 0.00 -0.03 0.00 0.00 56.01 53.40 2h47 n LEU 380 Cb 0.53 -0.12 -0.13 0.00 -2.33 0.00 0.00 43.42 41.37 2h47 n LEU 380 CO 0.25 0.55 -0.16 -1.58 -1.33 0.00 0.00 177.39 175.13 2h47 s GLN 381 N -1.51 0.20 -0.09 3.23 0.74 -1.26 -4.59 119.66 116.38 2h47 s GLN 381 Ca 0.09 0.35 -0.06 0.00 0.05 0.00 0.00 55.36 55.79 2h47 s GLN 381 Cb 0.08 0.00 0.04 0.00 1.10 0.00 0.00 33.01 34.22 2h47 s GLN 381 CO 0.01 -0.09 0.23 0.54 -0.55 0.00 0.00 175.29 175.43 2h47 s VAL 382 N 0.58 -0.02 0.02 1.34 0.11 -1.26 -1.99 120.40 119.19 2h47 s VAL 382 Ca -0.04 0.08 0.01 0.00 -2.93 0.00 0.00 61.98 59.10 2h47 s VAL 382 Cb -0.05 -0.35 -0.02 0.00 -1.53 0.00 0.00 36.38 34.43 2h47 s VAL 382 CO -0.03 0.03 -0.04 -1.10 -3.33 0.00 0.00 175.10 170.63 2h47 s GLN 383 N 0.76 0.34 0.36 1.54 -0.21 -0.47 -4.54 119.66 117.44 2h47 s GLN 383 Ca -0.05 -0.51 -0.17 0.00 0.02 0.00 0.00 55.36 54.64 2h47 s GLN 383 Cb -0.07 -0.09 -0.10 0.00 1.00 0.00 0.00 33.01 33.76 2h47 s GLN 383 CO -0.05 0.01 0.80 -0.06 -2.12 0.00 0.00 175.29 173.88 2h47 s PHE 384 N -1.06 3.35 0.32 0.91 0.40 -1.26 0.72 117.98 121.36 2h47 s PHE 384 Ca -0.10 1.34 -0.28 0.00 -0.60 0.00 0.00 56.93 57.29 2h47 s PHE 384 Cb -0.08 -2.64 -0.10 0.00 0.51 0.00 0.00 43.02 40.72 2h47 s PHE 384 CO -0.00 0.03 1.19 -1.58 0.70 0.00 0.00 175.22 175.55 2h47 s HIS 385 N -2.05 3.30 0.57 0.36 5.65 -0.55 -4.89 115.29 117.68 2h47 s HIS 385 Ca 0.57 1.57 -0.20 0.00 0.25 0.00 0.00 55.06 57.25 2h47 s HIS 385 Cb -0.10 -3.45 -0.04 0.00 -1.18 0.00 0.00 32.58 27.81 2h47 s HIS 385 CO 0.16 -1.16 1.27 -2.14 -0.65 0.00 0.00 174.74 172.22 2h47 s PRO 386 N -1.72 3.03 0.00 2.88 0.02 -1.26 -4.84 135.00 133.10 2h47 s PRO 386 Ca 0.48 2.02 0.00 0.00 0.02 0.00 0.00 61.00 63.52 2h47 s PRO 386 Cb -0.35 -2.08 0.00 0.00 0.02 0.00 0.00 34.50 32.10 2h47 s PRO 386 CO 0.45 -1.21 0.00 1.33 -0.33 0.00 0.00 177.00 177.24