#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gnd s ASP 2 N 0.00 2.36 0.13 7.83 1.11 -1.26 -4.97 116.67 121.87 1gnd s ASP 2 Ca 0.00 1.14 -0.09 0.00 0.18 0.00 0.00 52.55 53.78 1gnd s ASP 2 Cb 0.00 -1.79 -0.06 0.00 1.07 0.00 0.00 42.92 42.14 1gnd s ASP 2 CO 0.00 -3.29 1.38 -0.33 1.18 0.00 0.00 175.17 174.11 1gnd h GLU 3 N -2.00 0.72 -3.74 8.23 4.39 -1.96 -3.44 114.58 116.78 1gnd h GLU 3 Ca -0.55 -0.53 -0.14 0.00 0.34 0.00 0.00 59.36 58.47 1gnd h GLU 3 Cb 1.33 0.09 -0.19 0.00 -0.10 0.00 0.00 28.75 29.88 1gnd h GLU 3 CO 0.57 1.15 -0.55 -1.83 -1.16 0.00 0.00 179.01 177.19 1gnd s GLU 4 N -3.86 0.49 0.05 2.33 -1.05 -1.26 -1.88 118.70 113.52 1gnd s GLU 4 Ca -0.09 -0.60 -0.01 0.00 -0.15 0.00 0.00 54.97 54.12 1gnd s GLU 4 Cb 0.10 0.19 -0.03 0.00 -0.44 0.00 0.00 34.13 33.95 1gnd s GLU 4 CO 0.88 -0.11 -0.02 0.71 0.95 0.00 0.00 175.26 177.67 1gnd s TYR 5 N -1.92 0.45 -0.04 4.83 2.02 -0.33 -4.94 117.35 117.41 1gnd s TYR 5 Ca -0.11 -0.94 -0.25 0.00 -0.37 0.00 0.00 57.07 55.41 1gnd s TYR 5 Cb -0.05 -0.34 -0.22 0.00 -0.40 0.00 0.00 41.96 40.95 1gnd s TYR 5 CO -0.02 -0.35 1.07 -0.44 -1.57 0.00 0.00 175.55 174.25 1gnd h ASP 6 N 3.43 0.19 -4.36 2.29 3.32 -1.12 -3.29 116.42 116.88 1gnd h ASP 6 Ca -0.34 -0.72 -0.31 0.00 0.02 0.00 0.00 57.03 55.68 1gnd h ASP 6 Cb 1.16 -0.06 -0.25 0.00 0.22 0.00 0.00 39.33 40.40 1gnd h ASP 6 CO 0.61 0.89 -0.75 -0.69 -1.72 0.00 0.00 179.24 177.58 1gnd s VAL 7 N -3.33 0.53 -0.07 -1.35 1.01 -0.98 -1.54 120.40 114.68 1gnd s VAL 7 Ca -0.16 -0.70 0.05 0.00 0.00 0.00 0.00 61.98 61.17 1gnd s VAL 7 Cb 0.01 -0.53 -0.00 0.00 0.00 0.00 0.00 36.38 35.86 1gnd s VAL 7 CO 0.73 -0.14 -0.22 -0.63 0.00 0.00 0.00 175.10 174.84 1gnd s ILE 8 N -0.80 1.87 -0.09 2.22 1.01 -1.08 -1.64 121.20 122.69 1gnd s ILE 8 Ca -0.04 -0.94 0.03 0.00 0.00 0.00 0.00 60.65 59.70 1gnd s ILE 8 Cb -0.06 -1.60 -0.01 0.00 0.01 0.00 0.00 42.46 40.79 1gnd s ILE 8 CO 0.00 0.52 -0.19 -0.69 0.00 0.00 0.00 174.94 174.59 1gnd s VAL 9 N 0.08 2.60 -0.25 2.92 1.01 0.16 -1.76 120.40 125.16 1gnd s VAL 9 Ca -0.09 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.02 1gnd s VAL 9 Cb -0.15 -2.03 0.03 0.00 0.00 0.00 0.00 36.38 34.23 1gnd s VAL 9 CO 0.05 0.55 -0.05 -0.76 0.00 0.00 0.00 175.10 174.90 1gnd s LEU 10 N 0.07 3.27 0.00 3.92 1.43 0.29 -0.70 118.68 126.96 1gnd s LEU 10 Ca -0.08 -0.87 0.00 0.00 -1.03 0.00 0.00 54.13 52.15 1gnd s LEU 10 Cb -0.15 -1.68 0.00 0.00 0.03 0.00 0.00 46.19 44.38 1gnd s LEU 10 CO 0.05 -0.14 0.00 0.61 0.23 0.00 0.00 176.35 177.11 1gnd n GLY 11 N 4.68 2.79 1.77 -3.19 0.00 0.14 -2.97 105.19 108.41 1gnd n GLY 11 Ca -0.16 -1.61 -0.19 0.00 0.00 0.00 0.00 46.02 44.06 1gnd n GLY 11 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gnd n THR 12 N 0.91 2.75 -1.55 2.61 -2.24 -1.26 -4.67 114.28 110.83 1gnd n THR 12 Ca 0.00 -3.49 -0.29 0.00 -2.27 0.00 0.00 64.05 57.99 1gnd n THR 12 Cb 0.00 -0.87 0.11 0.00 -2.10 0.00 0.00 70.33 67.48 1gnd n THR 12 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1gnd s GLY 13 N -2.92 1.60 0.21 3.38 0.00 -1.26 -2.07 107.32 106.26 1gnd s GLY 13 Ca 0.51 -0.39 -0.11 0.00 0.00 0.00 0.00 44.72 44.73 1gnd s GLY 13 CO 0.01 0.11 1.68 1.41 0.00 0.00 0.00 173.10 176.31 1gnd h LEU 14 N -1.31 -0.16 0.13 0.66 3.38 -1.87 -1.89 115.31 114.25 1gnd h LEU 14 Ca -0.49 0.13 0.01 0.00 0.09 0.00 0.00 57.88 57.62 1gnd h LEU 14 Cb 1.30 0.21 -0.02 0.00 0.09 0.00 0.00 40.66 42.25 1gnd h LEU 14 CO 0.61 -0.06 -0.15 0.74 0.09 0.00 0.00 178.44 179.67 1gnd h THR 15 N 0.16 0.67 -0.36 0.22 2.02 -1.95 -2.13 112.91 111.54 1gnd h THR 15 Ca 0.30 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.51 1gnd h THR 15 Cb 0.47 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 1gnd h THR 15 CO -0.46 0.00 0.17 -0.33 0.37 0.00 0.00 175.52 175.28 1gnd h GLU 16 N -0.31 0.35 -0.77 6.66 3.07 -1.81 -0.85 114.58 120.91 1gnd h GLU 16 Ca 0.01 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 58.84 1gnd h GLU 16 Cb 0.31 -0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 28.10 1gnd h GLU 16 CO -0.05 0.23 0.44 0.00 -1.40 0.00 0.00 179.01 178.23 1gnd h ILE 18 N 1.07 1.24 -0.84 0.00 2.04 -1.09 -1.51 117.51 118.42 1gnd h ILE 18 Ca 0.28 -0.81 -0.02 0.00 1.00 0.00 0.00 64.86 65.31 1gnd h ILE 18 Cb 0.00 1.36 -0.04 0.00 -0.74 0.00 0.00 36.82 37.41 1gnd h ILE 18 CO -0.05 0.25 0.43 -0.07 0.00 0.00 0.00 178.15 178.71 1gnd h LEU 19 N 0.14 1.06 0.10 1.44 3.38 -1.00 -2.20 115.31 118.23 1gnd h LEU 19 Ca 0.06 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1gnd h LEU 19 Cb 0.35 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1gnd h LEU 19 CO 0.01 0.87 -0.10 -1.28 0.09 0.00 0.00 178.44 178.02 1gnd h SER 20 N 1.18 -0.28 -0.76 -0.43 0.87 -0.83 -2.02 113.55 111.28 1gnd h SER 20 Ca 0.29 0.03 0.04 0.00 -1.23 0.00 0.00 61.79 60.92 1gnd h SER 20 Cb 0.07 0.10 -0.05 0.00 -0.44 0.00 0.00 62.40 62.07 1gnd h SER 20 CO -0.04 -0.16 0.48 1.23 -0.53 0.00 0.00 176.83 177.80 1gnd h GLY 21 N -0.23 1.12 1.01 5.77 0.00 -1.06 -1.41 103.07 108.26 1gnd h GLY 21 Ca 0.01 -0.35 -0.00 0.00 0.00 0.00 0.00 47.33 46.98 1gnd h GLY 21 CO -0.03 0.28 0.49 -2.22 0.00 0.00 0.00 176.54 175.06 1gnd h ILE 22 N 0.91 1.22 -0.57 2.60 2.04 -1.18 -1.15 117.51 121.38 1gnd h ILE 22 Ca 0.32 -0.46 -0.06 0.00 1.00 0.00 0.00 64.86 65.65 1gnd h ILE 22 Cb 0.06 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.22 1gnd h ILE 22 CO -0.13 0.22 0.11 0.24 0.00 0.00 0.00 178.15 178.59 1gnd h MET 23 N 1.08 0.94 -0.40 2.37 2.86 -0.61 -0.86 114.93 120.31 1gnd h MET 23 Ca 0.29 -0.24 -0.04 0.00 -2.06 0.00 0.00 59.70 57.64 1gnd h MET 23 Cb -0.06 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.47 1gnd h MET 23 CO -0.06 0.89 0.10 0.77 1.06 0.00 0.00 176.91 179.67 1gnd h SER 24 N 0.84 0.60 -0.12 1.22 0.02 -0.99 -2.02 113.55 113.10 1gnd h SER 24 Ca 0.18 -0.23 -0.02 0.00 -0.84 0.00 0.00 61.79 60.88 1gnd h SER 24 Cb 0.40 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 1gnd h SER 24 CO 0.01 0.68 0.03 0.58 -1.14 0.00 0.00 176.83 176.98 1gnd h VAL 25 N 0.50 1.11 -0.01 2.27 2.07 -1.00 -1.32 116.25 119.87 1gnd h VAL 25 Ca 0.13 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.26 1gnd h VAL 25 Cb 0.31 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1gnd h VAL 25 CO 0.00 0.13 0.00 0.59 0.02 0.00 0.00 177.57 178.31 1gnd n ASN 26 N -4.41 0.05 0.00 0.57 5.03 -0.35 -4.88 115.26 111.27 1gnd n ASN 26 Ca -0.00 -1.89 0.00 0.00 0.87 0.00 0.00 54.58 53.56 1gnd n ASN 26 Cb 0.15 -0.01 0.00 0.00 -1.02 0.00 0.00 39.78 38.91 1gnd n ASN 26 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1gnd n GLY 27 N 0.57 0.56 3.89 7.41 0.00 -0.50 -5.05 105.19 112.08 1gnd n GLY 27 Ca 0.03 -0.72 -0.31 0.00 0.00 0.00 0.00 46.02 45.02 1gnd n GLY 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gnd s LYS 28 N -1.34 3.65 -0.34 1.61 3.01 -0.81 -5.03 119.74 120.50 1gnd s LYS 28 Ca 0.00 -0.02 -0.19 0.00 -1.01 0.00 0.00 55.97 54.75 1gnd s LYS 28 Cb 0.00 -2.80 -0.00 0.00 -1.01 0.00 0.00 37.83 34.02 1gnd s LYS 28 CO 0.00 0.42 0.57 0.21 0.51 0.00 0.00 175.35 177.07 1gnd s LYS 29 N -2.75 3.71 0.04 1.68 2.47 -1.26 -4.45 119.74 119.18 1gnd s LYS 29 Ca 0.42 0.01 0.08 0.00 -1.56 0.00 0.00 55.97 54.93 1gnd s LYS 29 Cb -0.12 -3.79 -0.03 0.00 -1.46 0.00 0.00 37.83 32.44 1gnd s LYS 29 CO 0.24 -0.65 -0.23 0.08 0.16 0.00 0.00 175.35 174.95 1gnd s VAL 30 N 2.53 1.87 -0.11 4.02 1.01 -1.26 -0.57 120.40 127.89 1gnd s VAL 30 Ca 0.22 -1.27 0.03 0.00 0.00 0.00 0.00 61.98 60.96 1gnd s VAL 30 Cb -0.15 -1.61 0.00 0.00 0.00 0.00 0.00 36.38 34.62 1gnd s VAL 30 CO 0.13 0.28 -0.22 -0.22 0.00 0.00 0.00 175.10 175.08 1gnd s LEU 31 N -1.18 2.18 -0.15 3.92 0.20 -0.65 -2.52 118.68 120.49 1gnd s LEU 31 Ca 0.09 -0.54 0.01 0.00 0.69 0.00 0.00 54.13 54.39 1gnd s LEU 31 Cb -0.09 -1.45 0.02 0.00 -0.43 0.00 0.00 46.19 44.24 1gnd s LEU 31 CO 0.02 0.14 -0.18 -2.28 -0.29 0.00 0.00 176.35 173.76 1gnd s HIS 32 N 0.45 2.41 0.23 5.38 2.46 0.11 -0.67 115.29 125.66 1gnd s HIS 32 Ca -0.15 -1.30 0.09 0.00 0.47 0.00 0.00 55.06 54.16 1gnd s HIS 32 Cb -0.17 -1.70 -0.05 0.00 -0.13 0.00 0.00 32.58 30.53 1gnd s HIS 32 CO 0.06 -0.65 -0.15 -1.64 -2.47 0.00 0.00 174.74 169.90 1gnd s MET 33 N 1.15 1.44 -0.21 2.88 -1.94 0.12 -0.33 119.30 122.41 1gnd s MET 33 Ca -0.01 -1.66 -0.13 0.00 -1.71 0.00 0.00 55.69 52.18 1gnd s MET 33 Cb -0.14 -1.28 0.06 0.00 2.01 0.00 0.00 34.83 35.49 1gnd s MET 33 CO -0.07 0.20 0.52 0.34 -0.01 0.00 0.00 175.02 176.00 1gnd s ASP 34 N -3.38 -0.65 0.44 3.03 -1.08 -0.68 -0.68 116.67 113.67 1gnd s ASP 34 Ca 0.25 1.12 0.28 0.00 -0.52 0.00 0.00 52.55 53.68 1gnd s ASP 34 Cb -0.01 1.03 0.91 0.00 -1.46 0.00 0.00 42.92 43.38 1gnd s ASP 34 CO 0.09 -0.20 1.80 0.08 0.52 0.00 0.00 175.17 177.46 1gnd h ARG 35 N 6.66 0.00 -7.16 4.34 0.11 -1.87 -1.45 114.38 115.00 1gnd h ARG 35 Ca -0.33 0.00 -0.47 0.00 0.10 0.00 0.00 59.98 59.28 1gnd h ARG 35 Cb 1.19 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.29 1gnd h ARG 35 CO 0.23 0.00 0.36 -0.80 0.10 0.00 0.00 179.97 179.85 1gnd s ASN 36 N -5.59 6.63 0.00 0.08 0.01 -1.26 -4.12 114.94 110.69 1gnd s ASN 36 Ca 0.04 1.54 0.24 0.00 -0.71 0.00 0.00 52.86 53.98 1gnd s ASN 36 Cb 0.08 -2.50 1.43 0.00 0.41 0.00 0.00 41.25 40.68 1gnd s ASN 36 CO 0.58 -0.56 1.88 -0.81 -1.51 0.00 0.00 177.10 176.67 1gnd n PRO 37 N -1.52 0.93 -4.24 -0.60 -0.04 -1.26 -1.05 135.00 127.22 1gnd n PRO 37 Ca 0.06 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.38 1gnd n PRO 37 Cb 0.54 -1.40 -0.10 0.00 -0.04 0.00 0.00 33.50 32.50 1gnd n PRO 37 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1gnd s TYR 38 N -2.00 1.32 0.41 0.54 -0.85 -1.26 -4.80 117.35 110.70 1gnd s TYR 38 Ca 0.36 -1.35 -0.06 0.00 -0.52 0.00 0.00 57.07 55.49 1gnd s TYR 38 Cb 0.17 -0.67 -0.05 0.00 0.38 0.00 0.00 41.96 41.79 1gnd s TYR 38 CO 0.28 -0.58 0.71 0.71 -1.52 0.00 0.00 175.55 175.15 1gnd s TYR 39 N -3.98 3.51 0.00 -3.49 2.02 -1.26 -4.66 117.35 109.49 1gnd s TYR 39 Ca 0.39 0.81 0.00 0.00 -0.37 0.00 0.00 57.07 57.90 1gnd s TYR 39 Cb 0.07 -2.27 0.00 0.00 -0.40 0.00 0.00 41.96 39.36 1gnd s TYR 39 CO 0.14 -0.10 0.00 0.41 -1.57 0.00 0.00 175.55 174.43 1gnd n GLY 40 N -1.66 2.96 7.00 0.71 0.00 -0.88 -4.58 105.19 108.75 1gnd n GLY 40 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1gnd n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gnd n GLY 41 N -1.16 3.06 0.27 -0.02 0.00 -1.26 -0.95 105.19 105.13 1gnd n GLY 41 Ca 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 46.02 45.80 1gnd n GLY 41 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1gnd h GLU 42 N 0.00 0.60 -2.18 1.61 4.39 -1.95 -3.16 114.58 113.89 1gnd h GLU 42 Ca 0.00 -0.16 -0.52 0.00 0.34 0.00 0.00 59.36 59.01 1gnd h GLU 42 Cb 0.00 -0.07 -0.14 0.00 -0.10 0.00 0.00 28.75 28.44 1gnd h GLU 42 CO 0.00 0.67 0.88 -1.13 -1.16 0.00 0.00 179.01 178.27 1gnd n SER 43 N -4.22 6.76 -4.96 1.42 3.41 -0.12 -4.67 113.62 111.25 1gnd n SER 43 Ca 0.01 -3.08 -0.22 0.00 -0.26 0.00 0.00 58.87 55.32 1gnd n SER 43 Cb 0.31 -1.30 0.01 0.00 -0.26 0.00 0.00 64.21 62.97 1gnd n SER 43 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1gnd s SER 44 N 0.62 5.76 -0.14 4.04 1.04 -1.17 -4.64 113.70 119.21 1gnd s SER 44 Ca 0.59 0.14 0.01 0.00 0.48 0.00 0.00 55.95 57.17 1gnd s SER 44 Cb 0.32 -1.35 -0.00 0.00 0.10 0.00 0.00 66.02 65.09 1gnd s SER 44 CO -0.16 -0.73 -0.16 -0.55 0.98 0.00 0.00 173.24 172.62 1gnd s SER 45 N -4.25 3.67 -0.56 7.02 0.15 -1.26 -1.43 113.70 117.04 1gnd s SER 45 Ca 0.49 -0.45 -0.22 0.00 0.70 0.00 0.00 55.95 56.48 1gnd s SER 45 Cb -0.10 -1.55 0.06 0.00 -1.71 0.00 0.00 66.02 62.71 1gnd s SER 45 CO 0.37 0.11 0.84 -0.63 1.20 0.00 0.00 173.24 175.13 1gnd s ILE 46 N 0.65 4.54 0.31 6.45 -1.09 0.34 -4.88 121.20 127.52 1gnd s ILE 46 Ca -0.08 -0.17 0.09 0.00 -2.23 0.00 0.00 60.65 58.26 1gnd s ILE 46 Cb -0.16 -4.50 0.04 0.00 -1.58 0.00 0.00 42.46 36.27 1gnd s ILE 46 CO 0.02 -1.10 1.72 0.74 -1.23 0.00 0.00 174.94 175.10 1gnd h THR 47 N 5.96 1.32 -3.59 2.92 2.02 -1.87 -2.05 112.91 117.62 1gnd h THR 47 Ca -0.27 -1.57 -0.67 0.00 0.77 0.00 0.00 66.41 64.67 1gnd h THR 47 Cb 1.08 1.79 -0.27 0.00 -1.74 0.00 0.00 68.15 69.00 1gnd h THR 47 CO 1.07 0.46 -0.80 -2.84 0.37 0.00 0.00 175.52 173.78 1gnd s PRO 48 N -4.04 3.02 0.38 6.66 0.02 -1.26 -4.48 135.00 135.29 1gnd s PRO 48 Ca -0.03 -0.74 0.10 0.00 0.02 0.00 0.00 61.00 60.34 1gnd s PRO 48 Cb 0.14 -2.46 0.86 0.00 0.02 0.00 0.00 34.50 33.05 1gnd s PRO 48 CO 0.76 0.33 1.92 1.25 -0.33 0.00 0.00 177.00 180.92 1gnd h LEU 49 N 6.29 0.58 -0.68 -5.54 5.85 -1.36 -2.43 115.31 118.03 1gnd h LEU 49 Ca -0.31 0.02 0.11 0.00 0.84 0.00 0.00 57.88 58.54 1gnd h LEU 49 Cb 1.20 -0.10 -0.08 0.00 0.37 0.00 0.00 40.66 42.05 1gnd h LEU 49 CO 0.52 0.33 0.29 -0.33 -0.34 0.00 0.00 178.44 178.91 1gnd h GLU 50 N 0.64 0.46 -0.73 1.25 3.07 -1.97 -2.33 114.58 114.98 1gnd h GLU 50 Ca 0.38 -0.03 0.01 0.00 -0.50 0.00 0.00 59.36 59.21 1gnd h GLU 50 Cb 0.59 -0.10 -0.04 0.00 -0.84 0.00 0.00 28.75 28.36 1gnd h GLU 50 CO -0.15 0.31 0.48 0.93 -1.40 0.00 0.00 179.01 179.18 1gnd h GLU 51 N 0.48 0.97 -0.54 2.33 4.39 -1.85 -2.49 114.58 117.86 1gnd h GLU 51 Ca 0.35 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.97 1gnd h GLU 51 Cb 0.45 -0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 28.86 1gnd h GLU 51 CO -0.32 0.65 0.27 1.25 -1.16 0.00 0.00 179.01 179.69 1gnd h LEU 52 N 0.99 0.71 -1.17 1.33 5.85 -1.48 0.21 115.31 121.76 1gnd h LEU 52 Ca 0.27 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 1gnd h LEU 52 Cb -0.10 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.72 1gnd h LEU 52 CO -0.06 0.63 0.27 1.88 -0.34 0.00 0.00 178.44 180.83 1gnd h TYR 53 N 0.73 0.84 0.07 1.25 -1.99 -1.44 -2.52 116.97 113.91 1gnd h TYR 53 Ca 0.19 -0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.88 1gnd h TYR 53 Cb 0.11 -0.26 0.00 0.00 2.00 0.00 0.00 36.73 38.58 1gnd h TYR 53 CO -0.00 0.63 -0.03 0.87 -0.00 0.00 0.00 178.16 179.62 1gnd h LYS 54 N 0.85 -0.09 -0.39 4.88 1.57 -0.89 -1.16 116.57 121.34 1gnd h LYS 54 Ca 0.21 0.01 0.11 0.00 -1.87 0.00 0.00 60.65 59.11 1gnd h LYS 54 Cb 0.11 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 1gnd h LYS 54 CO -0.02 0.29 0.33 0.00 -0.57 0.00 0.00 179.45 179.48 1gnd h ARG 55 N -0.48 0.00 -0.73 3.15 3.08 -0.49 0.43 114.38 119.33 1gnd h ARG 55 Ca -0.01 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.86 1gnd h ARG 55 Cb 0.42 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.36 1gnd h ARG 55 CO 0.01 0.00 0.23 1.19 -1.07 0.00 0.00 179.97 180.33 1gnd n PHE 56 N -4.10 2.42 -2.58 3.04 3.72 -0.96 -4.95 117.46 114.04 1gnd n PHE 56 Ca 0.07 -1.11 -0.17 0.00 -0.05 0.00 0.00 57.45 56.18 1gnd n PHE 56 Cb 0.51 -0.66 -0.00 0.00 -0.94 0.00 0.00 39.48 38.39 1gnd n PHE 56 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1gnd n GLN 57 N 0.00 -2.48 -3.47 -1.08 6.02 0.14 -4.94 117.38 111.58 1gnd n GLN 57 Ca 0.39 0.74 -0.43 0.00 -0.01 0.00 0.00 57.00 57.69 1gnd n GLN 57 Cb 1.36 -5.40 -0.06 0.00 1.02 0.00 0.00 30.24 27.16 1gnd n GLN 57 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1gnd s LEU 58 N -5.94 6.01 0.56 1.08 2.96 -0.45 -4.94 118.68 117.95 1gnd s LEU 58 Ca 0.07 -2.25 0.26 0.00 -0.22 0.00 0.00 54.13 51.99 1gnd s LEU 58 Cb -0.04 -2.08 1.50 0.00 0.50 0.00 0.00 46.19 46.08 1gnd s LEU 58 CO 0.09 -0.64 2.07 -0.07 -1.32 0.00 0.00 176.35 176.47 1gnd h LEU 59 N 8.13 0.00 -9.24 -0.68 4.07 -1.92 -3.39 115.31 112.28 1gnd h LEU 59 Ca -0.11 0.00 -0.56 0.00 0.08 0.00 0.00 57.88 57.29 1gnd h LEU 59 Cb 1.05 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.76 1gnd h LEU 59 CO 0.84 0.00 0.87 -1.83 -1.08 0.00 0.00 178.44 177.24 1gnd s GLU 60 N -4.83 4.26 0.27 1.13 -1.05 -1.26 -5.01 118.70 112.21 1gnd s GLU 60 Ca -0.05 1.78 -0.05 0.00 -0.15 0.00 0.00 54.97 56.51 1gnd s GLU 60 Cb 0.17 -3.71 0.07 0.00 -0.44 0.00 0.00 34.13 30.21 1gnd s GLU 60 CO 0.63 -0.64 0.28 0.41 0.95 0.00 0.00 175.26 176.88 1gnd n GLY 61 N 3.63 -2.09 3.76 -3.83 0.00 -1.26 -4.96 105.19 100.44 1gnd n GLY 61 Ca 0.14 -1.53 -0.41 0.00 0.00 0.00 0.00 46.02 44.21 1gnd n GLY 61 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1gnd s PRO 62 N -3.63 4.24 0.94 1.61 0.02 -1.26 -4.99 135.00 131.92 1gnd s PRO 62 Ca 0.17 2.38 -0.12 0.00 0.02 0.00 0.00 61.00 63.45 1gnd s PRO 62 Cb -0.01 -3.06 0.15 0.00 0.02 0.00 0.00 34.50 31.60 1gnd s PRO 62 CO 0.13 -0.42 1.10 -2.14 -0.33 0.00 0.00 177.00 175.34 1gnd s PRO 63 N -1.10 0.93 0.30 5.54 0.02 -1.26 -4.93 135.00 134.50 1gnd s PRO 63 Ca 0.56 0.64 0.01 0.00 0.02 0.00 0.00 61.00 62.23 1gnd s PRO 63 Cb -0.43 -1.78 0.55 0.00 0.02 0.00 0.00 34.50 32.86 1gnd s PRO 63 CO 0.50 -2.42 1.90 1.05 -0.33 0.00 0.00 177.00 177.71 1gnd h GLU 64 N -1.67 0.97 0.00 5.54 9.09 -1.94 -2.58 114.58 123.99 1gnd h GLU 64 Ca -0.52 -0.06 0.00 0.00 0.05 0.00 0.00 59.36 58.84 1gnd h GLU 64 Cb 1.31 -0.22 0.00 0.00 -1.65 0.00 0.00 28.75 28.19 1gnd h GLU 64 CO 0.57 0.64 0.00 0.25 0.05 0.00 0.00 179.01 180.52 1gnd n THR 65 N -4.50 1.01 1.18 -1.06 -2.24 -1.26 -2.94 114.28 104.47 1gnd n THR 65 Ca 0.14 0.41 0.13 0.00 -2.27 0.00 0.00 64.05 62.46 1gnd n THR 65 Cb 0.23 -1.34 0.66 0.00 -2.10 0.00 0.00 70.33 67.77 1gnd n THR 65 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1gnd n MET 66 N -2.10 0.26 0.00 -0.78 2.81 -0.97 -5.03 117.12 111.32 1gnd n MET 66 Ca 0.01 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.93 1gnd n MET 66 Cb 0.14 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.15 1gnd n MET 66 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1gnd n GLY 67 N 1.15 -0.98 3.61 3.03 0.00 -1.15 -4.70 105.19 106.15 1gnd n GLY 67 Ca 0.11 -1.27 -0.43 0.00 0.00 0.00 0.00 46.02 44.43 1gnd n GLY 67 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1gnd s ARG 68 N 0.00 3.78 0.48 1.61 3.52 -1.26 -4.94 118.95 122.14 1gnd s ARG 68 Ca 0.00 0.75 0.25 0.00 -0.13 0.00 0.00 55.73 56.60 1gnd s ARG 68 Cb 0.00 -3.89 1.30 0.00 -1.56 0.00 0.00 34.95 30.80 1gnd s ARG 68 CO 0.00 -1.30 1.88 0.78 -0.81 0.00 0.00 175.30 175.85 1gnd h GLY 69 N 11.12 0.40 2.00 8.12 0.00 -1.99 -1.13 103.07 121.59 1gnd h GLY 69 Ca -0.23 -0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 1gnd h GLY 69 CO 1.10 -0.01 -0.05 3.21 0.00 0.00 0.00 176.54 180.79 1gnd h ARG 70 N 0.18 0.00 -0.16 4.80 3.08 -1.92 -0.63 114.38 119.73 1gnd h ARG 70 Ca 0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.49 1gnd h ARG 70 Cb 1.43 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.48 1gnd h ARG 70 CO -0.09 0.05 0.00 -0.25 -1.07 0.00 0.00 179.97 178.61 1gnd n ASP 71 N -3.19 0.93 -4.60 7.04 8.00 -0.43 -4.85 116.55 119.45 1gnd n ASP 71 Ca -0.00 -1.91 -0.34 0.00 0.71 0.00 0.00 54.79 53.25 1gnd n ASP 71 Cb 0.29 -0.11 -0.11 0.00 -0.02 0.00 0.00 41.12 41.17 1gnd n ASP 71 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1gnd s TRP 72 N -1.79 2.99 -0.40 1.24 0.52 -1.17 -3.18 118.94 117.14 1gnd s TRP 72 Ca 0.16 0.04 0.03 0.00 0.02 0.00 0.00 56.10 56.35 1gnd s TRP 72 Cb 0.08 -1.74 0.16 0.00 -1.15 0.00 0.00 33.47 30.83 1gnd s TRP 72 CO 0.11 0.34 0.35 -0.80 0.02 0.00 0.00 176.95 176.98 1gnd s ASN 73 N -0.76 1.42 -0.53 2.95 -0.87 -0.74 -4.12 114.94 112.29 1gnd s ASN 73 Ca 0.12 -2.63 -0.27 0.00 -1.57 0.00 0.00 52.86 48.51 1gnd s ASN 73 Cb -0.11 -0.11 0.03 0.00 -0.02 0.00 0.00 41.25 41.04 1gnd s ASN 73 CO 0.02 -0.20 1.08 -0.69 -2.57 0.00 0.00 177.10 174.74 1gnd s VAL 74 N 0.47 4.22 0.23 1.60 1.01 -0.77 -4.82 120.40 122.33 1gnd s VAL 74 Ca 0.28 0.82 -0.30 0.00 0.00 0.00 0.00 61.98 62.78 1gnd s VAL 74 Cb -0.04 -4.61 -0.09 0.00 0.00 0.00 0.00 36.38 31.65 1gnd s VAL 74 CO -0.13 -1.13 1.11 -1.81 0.00 0.00 0.00 175.10 173.15 1gnd s ASP 75 N 2.69 7.25 0.26 3.32 1.01 -1.26 -0.51 116.67 129.43 1gnd s ASP 75 Ca 0.40 2.19 0.17 0.00 0.71 0.00 0.00 52.55 56.02 1gnd s ASP 75 Cb -0.09 -2.61 0.06 0.00 1.01 0.00 0.00 42.92 41.29 1gnd s ASP 75 CO 0.26 -0.20 1.34 -0.07 0.21 0.00 0.00 175.17 176.71 1gnd h LEU 76 N 4.53 0.00 -6.50 1.23 3.38 -1.56 -3.38 115.31 113.01 1gnd h LEU 76 Ca -0.45 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 56.92 1gnd h LEU 76 Cb 1.21 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.57 1gnd h LEU 76 CO 0.70 0.43 -0.88 -0.38 0.09 0.00 0.00 178.44 178.40 1gnd n ILE 77 N -3.13 -0.35 -2.56 1.22 5.41 -1.26 -5.03 119.36 113.66 1gnd n ILE 77 Ca 0.00 -3.89 -0.41 0.00 1.00 0.00 0.00 62.75 59.46 1gnd n ILE 77 Cb 0.72 -1.82 -0.04 0.00 -0.71 0.00 0.00 39.64 37.78 1gnd n ILE 77 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1gnd s PRO 78 N -0.51 4.67 -0.02 0.38 0.04 -1.26 -5.00 135.00 133.29 1gnd s PRO 78 Ca 0.31 1.68 -0.11 0.00 0.04 0.00 0.00 61.00 62.92 1gnd s PRO 78 Cb 0.04 -3.26 0.02 0.00 0.04 0.00 0.00 34.50 31.33 1gnd s PRO 78 CO -0.18 0.21 0.25 0.15 0.04 0.00 0.00 177.00 177.47 1gnd s LYS 79 N -0.84 0.55 0.18 4.56 1.02 -1.26 -4.75 119.74 119.20 1gnd s LYS 79 Ca 0.46 -0.16 0.05 0.00 0.02 0.00 0.00 55.97 56.34 1gnd s LYS 79 Cb -0.29 0.24 -0.04 0.00 -0.52 0.00 0.00 37.83 37.22 1gnd s LYS 79 CO 0.36 -0.14 0.20 -0.06 -0.92 0.00 0.00 175.35 174.79 1gnd s PHE 80 N -1.09 3.25 -0.12 3.18 0.08 -0.66 -4.90 117.98 117.73 1gnd s PHE 80 Ca -0.12 0.00 -0.03 0.00 0.12 0.00 0.00 56.93 56.91 1gnd s PHE 80 Cb -0.05 -1.54 -0.03 0.00 -0.57 0.00 0.00 43.02 40.82 1gnd s PHE 80 CO 0.03 0.51 0.00 -0.51 -0.10 0.00 0.00 175.22 175.15 1gnd s LEU 81 N -3.30 3.56 -0.31 -0.37 1.02 -0.44 -2.11 118.68 116.73 1gnd s LEU 81 Ca 0.32 0.08 -0.29 0.00 0.02 0.00 0.00 54.13 54.26 1gnd s LEU 81 Cb -0.10 -1.84 0.01 0.00 0.02 0.00 0.00 46.19 44.29 1gnd s LEU 81 CO 0.25 0.30 1.13 -0.32 0.02 0.00 0.00 176.35 177.73 1gnd s MET 82 N -0.40 4.04 0.25 1.70 -2.45 -1.26 0.11 119.30 121.29 1gnd s MET 82 Ca 0.08 1.12 -0.01 0.00 -1.25 0.00 0.00 55.69 55.63 1gnd s MET 82 Cb -0.12 -3.77 0.55 0.00 1.25 0.00 0.00 34.83 32.75 1gnd s MET 82 CO 0.02 -0.94 1.30 0.00 1.05 0.00 0.00 175.02 176.45 1gnd n ALA 83 N 7.01 0.35 -0.84 4.11 0.00 0.01 0.50 120.51 131.65 1gnd n ALA 83 Ca 0.13 0.90 0.08 0.00 0.00 0.00 0.00 53.44 54.54 1gnd n ALA 83 Cb 0.47 -0.62 0.35 0.00 0.00 0.00 0.00 19.45 19.65 1gnd n ALA 83 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1gnd n ASN 84 N -5.24 4.98 -4.42 0.00 3.02 -1.26 -4.89 115.26 107.45 1gnd n ASN 84 Ca 0.18 -2.81 -0.29 0.00 -0.03 0.00 0.00 54.58 51.62 1gnd n ASN 84 Cb 0.57 -0.61 0.20 0.00 -0.61 0.00 0.00 39.78 39.32 1gnd n ASN 84 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1gnd s GLY 85 N -1.10 1.57 0.23 7.41 0.00 0.18 -4.97 107.32 110.64 1gnd s GLY 85 Ca 0.50 -0.56 0.06 0.00 0.00 0.00 0.00 44.72 44.71 1gnd s GLY 85 CO 0.16 0.14 1.53 1.46 0.00 0.00 0.00 173.10 176.39 1gnd h GLN 86 N -2.13 0.16 -0.52 2.90 4.20 -1.95 -3.20 115.11 114.59 1gnd h GLN 86 Ca -0.52 -0.13 0.01 0.00 0.06 0.00 0.00 58.65 58.07 1gnd h GLN 86 Cb 1.32 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 29.10 1gnd h GLN 86 CO 0.51 0.77 0.34 1.25 -0.67 0.00 0.00 178.83 181.03 1gnd h LEU 87 N 0.12 0.59 -1.73 1.46 6.46 -1.93 -0.99 115.31 119.28 1gnd h LEU 87 Ca -0.01 -0.01 0.02 0.00 -0.12 0.00 0.00 57.88 57.75 1gnd h LEU 87 Cb 1.19 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 40.96 1gnd h LEU 87 CO 0.10 0.43 0.21 0.58 -0.62 0.00 0.00 178.44 179.14 1gnd h VAL 88 N 0.70 1.04 -0.03 1.05 2.07 -1.85 0.53 116.25 119.75 1gnd h VAL 88 Ca 0.19 -0.12 -0.14 0.00 0.82 0.00 0.00 66.70 67.44 1gnd h VAL 88 Cb -0.08 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1gnd h VAL 88 CO -0.04 0.07 -0.63 0.11 0.02 0.00 0.00 177.57 177.09 1gnd h LYS 89 N 0.36 0.13 -0.54 1.57 1.57 -1.24 -1.50 116.57 116.93 1gnd h LYS 89 Ca 0.13 -0.09 -0.11 0.00 -1.87 0.00 0.00 60.65 58.70 1gnd h LYS 89 Cb 0.06 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 1gnd h LYS 89 CO -0.03 0.72 -0.09 0.52 -0.57 0.00 0.00 179.45 179.99 1gnd h MET 90 N 0.09 1.01 -0.37 3.15 2.86 0.11 -1.42 114.93 120.37 1gnd h MET 90 Ca -0.01 -0.37 -0.06 0.00 -2.06 0.00 0.00 59.70 57.21 1gnd h MET 90 Cb 1.13 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.70 1gnd h MET 90 CO 0.09 1.05 -0.00 -0.07 1.06 0.00 0.00 176.91 179.04 1gnd h LEU 91 N 0.88 0.55 -0.37 1.22 4.07 -0.99 -2.82 115.31 117.85 1gnd h LEU 91 Ca 0.14 -0.11 -0.18 0.00 0.08 0.00 0.00 57.88 57.81 1gnd h LEU 91 Cb 0.66 -0.14 -0.00 0.00 1.08 0.00 0.00 40.66 42.25 1gnd h LEU 91 CO 0.05 0.62 -0.58 -0.07 -1.08 0.00 0.00 178.44 177.38 1gnd h LEU 92 N 0.56 0.82 -0.43 1.67 3.38 -0.94 -1.75 115.31 118.62 1gnd h LEU 92 Ca 0.12 -0.45 0.03 0.00 0.09 0.00 0.00 57.88 57.66 1gnd h LEU 92 Cb 0.36 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1gnd h LEU 92 CO 0.01 1.22 0.23 0.22 0.09 0.00 0.00 178.44 180.21 1gnd h TYR 93 N 0.55 0.42 0.01 1.13 3.20 -1.05 -2.75 116.97 118.49 1gnd h TYR 93 Ca 0.00 0.02 -0.19 0.00 3.14 0.00 0.00 58.73 61.70 1gnd h TYR 93 Cb 1.16 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 39.29 1gnd h TYR 93 CO 0.06 0.22 -0.87 1.79 -1.64 0.00 0.00 178.16 177.72 1gnd h THR 94 N 0.45 1.57 0.00 1.81 1.35 -1.53 -3.48 112.91 113.08 1gnd h THR 94 Ca 0.18 -2.82 0.00 0.00 -0.55 0.00 0.00 66.41 63.22 1gnd h THR 94 Cb 0.08 2.55 0.00 0.00 -1.73 0.00 0.00 68.15 69.05 1gnd h THR 94 CO -0.12 0.81 0.00 -0.62 -0.25 0.00 0.00 175.52 175.34 1gnd n GLU 95 N -3.57 0.00 0.17 4.72 1.02 -0.67 -4.93 120.64 117.38 1gnd n GLU 95 Ca -0.02 0.38 0.13 0.00 -0.02 0.00 0.00 57.16 57.64 1gnd n GLU 95 Cb 0.82 -3.20 0.56 0.00 -0.02 0.00 0.00 31.44 29.60 1gnd n GLU 95 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 1gnd h VAL 96 N 0.00 0.00 0.00 2.62 -1.51 -1.83 -2.28 116.25 113.25 1gnd h VAL 96 Ca 0.00 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 65.23 1gnd h VAL 96 Cb 0.00 1.00 0.00 0.00 -2.13 0.00 0.00 31.29 30.16 1gnd h VAL 96 CO 0.00 0.00 0.02 0.35 -1.23 0.00 0.00 177.57 176.71 1gnd n THR 97 N -2.41 1.32 0.41 7.19 -2.24 -1.25 -0.37 114.28 116.94 1gnd n THR 97 Ca 0.01 0.66 0.13 0.00 -2.27 0.00 0.00 64.05 62.58 1gnd n THR 97 Cb 0.21 -1.66 0.50 0.00 -2.10 0.00 0.00 70.33 67.28 1gnd n THR 97 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1gnd h ARG 98 N 0.00 0.00 -0.00 -0.78 9.65 -1.77 -3.11 114.38 118.37 1gnd h ARG 98 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1gnd h ARG 98 Cb 0.04 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.62 1gnd h ARG 98 CO 0.00 0.00 -0.20 0.66 2.80 0.00 0.00 179.97 183.23 1gnd n TYR 99 N -2.34 0.00 -4.12 2.20 4.01 0.50 -5.04 117.16 112.37 1gnd n TYR 99 Ca 0.02 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.47 1gnd n TYR 99 Cb 0.26 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.22 1gnd n TYR 99 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1gnd s LEU 100 N -1.66 3.52 -0.22 7.72 2.01 -1.18 -4.98 118.68 123.90 1gnd s LEU 100 Ca 0.06 -0.18 0.02 0.00 0.01 0.00 0.00 54.13 54.04 1gnd s LEU 100 Cb 0.06 -2.23 0.04 0.00 0.01 0.00 0.00 46.19 44.07 1gnd s LEU 100 CO 0.22 0.16 -0.15 -1.81 1.01 0.00 0.00 176.35 175.78 1gnd s ASP 101 N -2.45 3.74 -0.08 2.29 1.11 -1.26 -4.97 116.67 115.04 1gnd s ASP 101 Ca 0.27 -0.95 -0.07 0.00 0.18 0.00 0.00 52.55 51.98 1gnd s ASP 101 Cb -0.11 -1.52 -0.04 0.00 1.07 0.00 0.00 42.92 42.31 1gnd s ASP 101 CO 0.19 -0.08 0.18 -0.36 1.18 0.00 0.00 175.17 176.28 1gnd s PHE 102 N 1.22 3.60 -0.05 4.23 0.08 -1.26 -0.38 117.98 125.41 1gnd s PHE 102 Ca -0.01 0.54 0.02 0.00 0.12 0.00 0.00 56.93 57.60 1gnd s PHE 102 Cb -0.16 -1.95 0.01 0.00 -0.57 0.00 0.00 43.02 40.35 1gnd s PHE 102 CO -0.09 0.71 -0.10 0.21 -0.10 0.00 0.00 175.22 175.85 1gnd s LYS 103 N -1.26 1.32 0.41 0.44 2.20 -0.77 -4.92 119.74 117.16 1gnd s LYS 103 Ca 0.19 -0.31 -0.26 0.00 -0.36 0.00 0.00 55.97 55.23 1gnd s LYS 103 Cb -0.13 -1.15 -0.09 0.00 -1.51 0.00 0.00 37.83 34.95 1gnd s LYS 103 CO 0.08 0.02 1.34 0.08 -0.36 0.00 0.00 175.35 176.51 1gnd s VAL 104 N 0.63 2.47 0.03 4.02 1.01 -1.26 -2.33 120.40 124.96 1gnd s VAL 104 Ca -0.12 0.42 -0.30 0.00 0.00 0.00 0.00 61.98 61.99 1gnd s VAL 104 Cb -0.14 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 1gnd s VAL 104 CO 0.02 0.07 1.07 -0.69 0.00 0.00 0.00 175.10 175.57 1gnd s VAL 105 N -1.23 4.50 0.21 2.92 1.01 -0.19 -4.91 120.40 122.72 1gnd s VAL 105 Ca 0.57 1.81 -0.08 0.00 0.00 0.00 0.00 61.98 64.28 1gnd s VAL 105 Cb -0.40 -4.16 0.16 0.00 0.00 0.00 0.00 36.38 31.98 1gnd s VAL 105 CO 0.52 0.15 1.81 -0.08 0.00 0.00 0.00 175.10 177.49 1gnd h GLU 106 N 6.71 1.15 -4.14 2.72 4.81 -1.88 -3.27 114.58 120.68 1gnd h GLU 106 Ca -0.41 -0.17 -0.13 0.00 -0.13 0.00 0.00 59.36 58.52 1gnd h GLU 106 Cb 1.22 -0.21 -0.14 0.00 0.63 0.00 0.00 28.75 30.25 1gnd h GLU 106 CO 0.77 0.89 -0.54 0.20 -0.73 0.00 0.00 179.01 179.60 1gnd s GLY 107 N -3.24 0.54 -0.07 1.92 0.00 -1.04 -4.16 107.32 101.27 1gnd s GLY 107 Ca -0.13 -1.10 -0.00 0.00 0.00 0.00 0.00 44.72 43.49 1gnd s GLY 107 CO 0.82 -1.14 -0.03 -0.45 0.00 0.00 0.00 173.10 172.30 1gnd s SER 108 N -2.95 1.58 0.32 1.64 0.15 -1.26 -1.95 113.70 111.23 1gnd s SER 108 Ca 0.13 -0.16 0.05 0.00 0.70 0.00 0.00 55.95 56.67 1gnd s SER 108 Cb 0.06 -0.55 -0.06 0.00 -1.71 0.00 0.00 66.02 63.76 1gnd s SER 108 CO -0.05 -0.13 0.03 -0.36 1.20 0.00 0.00 173.24 173.93 1gnd s PHE 109 N 1.60 2.00 -0.01 3.44 0.40 0.37 -2.29 117.98 123.50 1gnd s PHE 109 Ca 0.00 -0.89 -0.08 0.00 -0.60 0.00 0.00 56.93 55.36 1gnd s PHE 109 Cb -0.13 -1.29 0.01 0.00 0.51 0.00 0.00 43.02 42.12 1gnd s PHE 109 CO -0.04 0.09 0.17 0.54 0.70 0.00 0.00 175.22 176.68 1gnd s VAL 110 N -3.20 0.07 -0.11 -0.44 0.11 0.22 -2.45 120.40 114.60 1gnd s VAL 110 Ca 0.35 -0.58 -0.12 0.00 -2.93 0.00 0.00 61.98 58.71 1gnd s VAL 110 Cb 0.08 -0.44 -0.05 0.00 -1.53 0.00 0.00 36.38 34.44 1gnd s VAL 110 CO 0.15 -0.32 0.26 -0.47 -3.33 0.00 0.00 175.10 171.39 1gnd s TYR 111 N -1.20 3.57 -0.24 1.54 6.14 -0.60 -0.42 117.35 126.15 1gnd s TYR 111 Ca -0.13 0.66 -0.06 0.00 0.64 0.00 0.00 57.07 58.18 1gnd s TYR 111 Cb -0.06 -2.19 0.12 0.00 0.42 0.00 0.00 41.96 40.25 1gnd s TYR 111 CO 0.02 0.51 0.47 0.21 0.64 0.00 0.00 175.55 177.39 1gnd s LYS 112 N -0.42 0.40 -1.47 4.97 2.36 -0.34 -4.58 119.74 120.67 1gnd s LYS 112 Ca 0.17 0.98 0.00 0.00 -2.55 0.00 0.00 55.97 54.58 1gnd s LYS 112 Cb -0.13 0.26 0.00 0.00 -1.05 0.00 0.00 37.83 36.90 1gnd s LYS 112 CO 0.06 -0.38 0.00 0.41 1.55 0.00 0.00 175.35 176.99 1gnd n GLY 113 N 5.40 0.67 0.39 5.54 0.00 -1.26 -2.85 105.19 113.07 1gnd n GLY 113 Ca -0.07 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.68 1gnd n GLY 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gnd n GLY 114 N -1.06 0.70 3.09 -0.02 0.00 -1.26 -5.07 105.19 101.57 1gnd n GLY 114 Ca -0.17 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.77 1gnd n GLY 114 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1gnd s LYS 115 N -0.85 0.60 0.03 1.61 2.20 -1.13 -5.11 119.74 117.08 1gnd s LYS 115 Ca 0.00 -1.11 -0.00 0.00 -0.36 0.00 0.00 55.97 54.50 1gnd s LYS 115 Cb 0.00 0.06 -0.04 0.00 -1.51 0.00 0.00 37.83 36.34 1gnd s LYS 115 CO 0.00 -0.07 0.14 0.96 -0.36 0.00 0.00 175.35 176.02 1gnd s ILE 116 N -3.23 5.02 0.05 5.43 -4.36 -1.26 -1.19 121.20 121.66 1gnd s ILE 116 Ca 0.03 -0.41 0.01 0.00 -0.26 0.00 0.00 60.65 60.01 1gnd s ILE 116 Cb 0.03 -3.37 -0.03 0.00 1.25 0.00 0.00 42.46 40.34 1gnd s ILE 116 CO -0.06 0.25 -0.05 -0.31 0.24 0.00 0.00 174.94 175.01 1gnd s TYR 117 N -1.34 0.56 0.44 1.37 2.02 0.44 -4.93 117.35 115.92 1gnd s TYR 117 Ca 0.28 -0.77 -0.24 0.00 -0.37 0.00 0.00 57.07 55.97 1gnd s TYR 117 Cb -0.12 -0.37 -0.08 0.00 -0.40 0.00 0.00 41.96 40.99 1gnd s TYR 117 CO 0.20 -0.22 1.19 0.21 -1.57 0.00 0.00 175.55 175.36 1gnd s LYS 118 N -2.74 3.84 -0.39 -0.62 2.20 -1.26 -0.61 119.74 120.16 1gnd s LYS 118 Ca -0.02 1.84 -0.24 0.00 -0.36 0.00 0.00 55.97 57.20 1gnd s LYS 118 Cb -0.01 -2.51 0.01 0.00 -1.51 0.00 0.00 37.83 33.81 1gnd s LYS 118 CO -0.04 -0.50 0.83 0.08 -0.36 0.00 0.00 175.35 175.35 1gnd s VAL 119 N -1.47 4.67 -0.22 4.02 1.01 -0.97 -4.81 120.40 122.63 1gnd s VAL 119 Ca 0.61 0.86 -0.28 0.00 0.00 0.00 0.00 61.98 63.18 1gnd s VAL 119 Cb -0.30 -4.27 0.00 0.00 0.00 0.00 0.00 36.38 31.81 1gnd s VAL 119 CO 0.38 -0.54 0.98 -2.16 0.00 0.00 0.00 175.10 173.76 1gnd s PRO 120 N 3.27 4.25 0.00 2.72 0.04 -1.26 -4.93 135.00 139.09 1gnd s PRO 120 Ca 0.33 1.25 0.00 0.00 0.04 0.00 0.00 61.00 62.62 1gnd s PRO 120 Cb -0.12 -3.63 0.00 0.00 0.04 0.00 0.00 34.50 30.78 1gnd s PRO 120 CO 0.19 -0.58 0.37 -1.13 0.04 0.00 0.00 177.00 175.89 1gnd n SER 121 N 6.15 0.74 -4.48 6.66 3.41 -1.26 -4.84 113.62 120.00 1gnd n SER 121 Ca 0.10 -0.88 -0.24 0.00 -0.26 0.00 0.00 58.87 57.59 1gnd n SER 121 Cb 0.47 0.22 -0.10 0.00 -0.26 0.00 0.00 64.21 64.53 1gnd n SER 121 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1gnd s THR 122 N -0.22 2.25 0.29 6.66 -4.23 -1.26 -4.86 115.64 114.26 1gnd s THR 122 Ca 0.00 -2.29 -0.02 0.00 -1.18 0.00 0.00 61.69 58.19 1gnd s THR 122 Cb 0.00 -2.42 0.23 0.00 1.34 0.00 0.00 72.50 71.65 1gnd s THR 122 CO 0.00 -0.34 1.92 -0.33 -0.54 0.00 0.00 174.62 175.34 1gnd h GLU 123 N 2.21 1.04 -0.75 3.99 5.08 -1.95 -0.47 114.58 123.73 1gnd h GLU 123 Ca -0.41 -0.10 -0.06 0.00 -1.00 0.00 0.00 59.36 57.79 1gnd h GLU 123 Cb 1.25 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 30.25 1gnd h GLU 123 CO 0.65 0.75 0.22 1.15 -1.00 0.00 0.00 179.01 180.78 1gnd h THR 124 N 1.06 1.26 -0.04 1.13 2.02 -1.99 -2.03 112.91 114.32 1gnd h THR 124 Ca 0.27 -0.93 -0.19 0.00 0.77 0.00 0.00 66.41 66.34 1gnd h THR 124 Cb -0.01 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 1gnd h THR 124 CO -0.05 0.36 -0.78 -0.33 0.37 0.00 0.00 175.52 175.10 1gnd h GLU 125 N 1.11 0.30 -0.08 6.66 5.08 -1.87 -3.02 114.58 122.76 1gnd h GLU 125 Ca 0.24 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1gnd h GLU 125 Cb 0.32 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 1gnd h GLU 125 CO -0.01 0.94 0.05 0.00 -1.00 0.00 0.00 179.01 179.00 1gnd h ALA 126 N 0.98 0.11 0.00 3.43 0.00 -0.78 0.18 119.26 123.17 1gnd h ALA 126 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1gnd h ALA 126 Cb 1.36 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1gnd h ALA 126 CO 0.13 -0.39 0.00 -0.07 0.00 0.00 0.00 179.25 178.91 1gnd h LEU 127 N 0.10 0.00 0.00 0.00 3.38 -1.35 -2.29 115.31 115.15 1gnd h LEU 127 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1gnd h LEU 127 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1gnd h LEU 127 CO -0.01 0.00 -1.35 0.00 0.09 0.00 0.00 178.44 177.18 1gnd n ALA 128 N -1.91 3.76 -1.77 1.53 0.00 -0.71 -5.00 120.51 116.40 1gnd n ALA 128 Ca -0.00 -0.52 -0.41 0.00 0.00 0.00 0.00 53.44 52.51 1gnd n ALA 128 Cb 0.15 -0.70 -0.00 0.00 0.00 0.00 0.00 19.45 18.90 1gnd n ALA 128 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1gnd n SER 129 N -1.78 3.81 -0.71 0.00 2.88 -0.03 -4.91 113.62 112.88 1gnd n SER 129 Ca 0.00 1.22 0.12 0.00 -1.33 0.00 0.00 58.87 58.88 1gnd n SER 129 Cb 0.40 -1.62 0.34 0.00 -0.75 0.00 0.00 64.21 62.58 1gnd n SER 129 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1gnd n ASN 130 N 0.62 2.15 0.12 -3.46 5.03 -1.26 -4.21 115.26 114.25 1gnd n ASN 130 Ca 0.02 -1.76 -0.03 0.00 0.87 0.00 0.00 54.58 53.68 1gnd n ASN 130 Cb 0.39 -0.10 0.12 0.00 -1.02 0.00 0.00 39.78 39.17 1gnd n ASN 130 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 1gnd h LEU 131 N 2.99 0.06 -9.08 3.41 3.38 -1.93 -3.46 115.31 110.68 1gnd h LEU 131 Ca 0.00 -0.04 -0.53 0.00 0.09 0.00 0.00 57.88 57.40 1gnd h LEU 131 Cb 0.65 -0.02 -0.14 0.00 0.09 0.00 0.00 40.66 41.24 1gnd h LEU 131 CO 0.00 0.71 -0.74 -0.04 0.09 0.00 0.00 178.44 178.47 1gnd s MET 132 N -3.51 1.53 0.65 1.13 -1.94 -1.26 -5.03 119.30 110.86 1gnd s MET 132 Ca -0.02 -1.71 -0.08 0.00 -1.71 0.00 0.00 55.69 52.18 1gnd s MET 132 Cb 0.12 -1.43 0.02 0.00 2.01 0.00 0.00 34.83 35.55 1gnd s MET 132 CO 0.78 0.23 0.99 0.20 -0.01 0.00 0.00 175.02 177.21 1gnd s GLY 133 N -3.43 1.62 0.26 -0.03 0.00 -1.26 -4.78 107.32 99.70 1gnd s GLY 133 Ca 0.27 -0.61 -0.10 0.00 0.00 0.00 0.00 44.72 44.28 1gnd s GLY 133 CO 0.11 -0.27 1.49 -0.13 0.00 0.00 0.00 173.10 174.31 1gnd n MET 134 N -2.80 -0.12 0.09 2.90 1.56 -1.26 -1.02 117.12 116.47 1gnd n MET 134 Ca 0.06 1.49 -0.22 0.00 -0.27 0.00 0.00 57.70 58.76 1gnd n MET 134 Cb 0.58 -2.22 -0.15 0.00 2.15 0.00 0.00 33.22 33.58 1gnd n MET 134 CO 0.00 0.00 0.00 0.74 -0.73 0.00 0.00 175.97 175.98 1gnd h PHE 135 N 0.00 0.80 -0.76 1.12 0.04 -2.01 -3.29 116.94 112.84 1gnd h PHE 135 Ca 0.43 -0.56 -0.03 0.00 2.80 0.00 0.00 57.97 60.60 1gnd h PHE 135 Cb 0.67 -0.04 -0.04 0.00 2.20 0.00 0.00 35.95 38.74 1gnd h PHE 135 CO -0.76 1.43 0.35 1.49 -0.60 0.00 0.00 178.31 180.21 1gnd h GLU 136 N -0.05 1.11 -0.47 1.51 4.81 -1.82 -2.54 114.58 117.13 1gnd h GLU 136 Ca -0.19 -0.17 0.10 0.00 -0.13 0.00 0.00 59.36 58.97 1gnd h GLU 136 Cb 1.88 -0.20 -0.09 0.00 0.63 0.00 0.00 28.75 30.97 1gnd h GLU 136 CO 0.21 0.87 -0.16 0.87 -0.73 0.00 0.00 179.01 180.07 1gnd h LYS 137 N 1.09 -0.06 -0.95 1.92 1.57 -1.19 0.94 116.57 119.90 1gnd h LYS 137 Ca 0.26 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 59.09 1gnd h LYS 137 Cb 0.14 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.41 1gnd h LYS 137 CO -0.03 -0.04 0.61 0.00 -0.57 0.00 0.00 179.45 179.43 1gnd h ARG 138 N -0.06 1.14 -0.32 3.15 2.47 -1.53 0.18 114.38 119.42 1gnd h ARG 138 Ca 0.22 -0.07 -0.12 0.00 -1.26 0.00 0.00 59.98 58.76 1gnd h ARG 138 Cb 0.40 -0.26 -0.01 0.00 -1.65 0.00 0.00 29.97 28.45 1gnd h ARG 138 CO -0.51 0.75 -0.28 0.00 0.56 0.00 0.00 179.97 180.49 1gnd h ARG 139 N 1.17 0.65 -0.55 0.04 3.08 -0.84 -2.36 114.38 115.57 1gnd h ARG 139 Ca 0.38 -0.28 -0.09 0.00 0.07 0.00 0.00 59.98 60.07 1gnd h ARG 139 Cb 0.04 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 1gnd h ARG 139 CO -0.13 0.86 -0.01 0.35 -1.07 0.00 0.00 179.97 179.97 1gnd h PHE 140 N 0.56 1.02 -0.67 3.04 3.57 0.21 -1.91 116.94 122.77 1gnd h PHE 140 Ca 0.07 -0.16 -0.02 0.00 3.53 0.00 0.00 57.97 61.39 1gnd h PHE 140 Cb 0.77 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 39.21 1gnd h PHE 140 CO 0.03 0.92 0.34 -0.09 -2.23 0.00 0.00 178.31 177.28 1gnd h ARG 141 N 0.87 0.94 -0.43 1.11 1.12 -0.37 -1.88 114.38 115.74 1gnd h ARG 141 Ca 0.16 -0.11 -0.07 0.00 -1.11 0.00 0.00 59.98 58.84 1gnd h ARG 141 Cb 0.52 -0.18 -0.01 0.00 -0.01 0.00 0.00 29.97 30.28 1gnd h ARG 141 CO 0.03 0.71 -0.02 0.87 -3.11 0.00 0.00 179.97 178.45 1gnd h LYS 142 N 0.94 0.77 -0.07 0.20 1.79 -0.91 -2.66 116.57 116.63 1gnd h LYS 142 Ca 0.23 -0.26 0.03 0.00 -2.18 0.00 0.00 60.65 58.48 1gnd h LYS 142 Cb 0.07 -0.06 -0.04 0.00 -1.58 0.00 0.00 32.23 30.62 1gnd h LYS 142 CO -0.03 0.85 -0.17 0.35 -1.08 0.00 0.00 179.45 179.37 1gnd h PHE 143 N 0.61 -0.43 -0.95 -1.35 3.57 -0.66 -1.69 116.94 116.04 1gnd h PHE 143 Ca 0.12 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.66 1gnd h PHE 143 Cb 0.52 0.20 -0.05 0.00 2.79 0.00 0.00 35.95 39.41 1gnd h PHE 143 CO 0.04 -0.24 0.62 -0.07 -2.23 0.00 0.00 178.31 176.43 1gnd h LEU 144 N -0.24 1.06 -1.18 0.59 3.38 -1.33 -1.60 115.31 116.00 1gnd h LEU 144 Ca 0.08 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1gnd h LEU 144 Cb 0.34 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1gnd h LEU 144 CO -0.21 0.75 -0.09 0.58 0.09 0.00 0.00 178.44 179.56 1gnd h VAL 145 N 1.25 1.21 -0.13 1.22 2.07 -1.12 0.20 116.25 120.95 1gnd h VAL 145 Ca 0.36 -0.92 -0.01 0.00 0.82 0.00 0.00 66.70 66.96 1gnd h VAL 145 Cb -0.08 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 1gnd h VAL 145 CO -0.10 0.30 0.05 0.15 0.02 0.00 0.00 177.57 178.00 1gnd h PHE 146 N 0.43 0.19 -0.82 1.57 3.57 -0.52 -1.34 116.94 120.03 1gnd h PHE 146 Ca 0.08 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 1gnd h PHE 146 Cb 0.43 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.07 1gnd h PHE 146 CO 0.01 0.28 0.38 0.28 -2.23 0.00 0.00 178.31 177.04 1gnd h VAL 147 N 0.05 1.26 0.00 1.41 2.07 -0.86 -1.05 116.25 119.13 1gnd h VAL 147 Ca 0.04 -0.73 -0.07 0.00 0.82 0.00 0.00 66.70 66.76 1gnd h VAL 147 Cb 0.17 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 1gnd h VAL 147 CO -0.00 0.31 -0.33 0.00 0.02 0.00 0.00 177.57 177.57 1gnd h ALA 148 N 1.20 1.38 0.00 1.67 0.00 -0.42 -3.14 119.26 119.95 1gnd h ALA 148 Ca 0.28 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1gnd h ALA 148 Cb 0.13 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1gnd h ALA 148 CO -0.03 0.41 -1.51 0.09 0.00 0.00 0.00 179.25 178.21 1gnd n ASN 149 N -4.03 0.41 -4.55 0.00 3.02 -0.52 -4.97 115.26 104.61 1gnd n ASN 149 Ca -0.02 0.13 -0.48 0.00 -0.03 0.00 0.00 54.58 54.19 1gnd n ASN 149 Cb 0.38 1.25 -0.03 0.00 -0.61 0.00 0.00 39.78 40.76 1gnd n ASN 149 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1gnd n PHE 150 N -2.43 1.02 -3.37 3.10 -0.00 -0.42 -4.92 117.46 110.44 1gnd n PHE 150 Ca -0.02 0.74 -0.13 0.00 -0.00 0.00 0.00 57.45 58.04 1gnd n PHE 150 Cb 0.55 -2.22 -0.08 0.00 -0.00 0.00 0.00 39.48 37.73 1gnd n PHE 150 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1gnd s ASP 151 N -0.33 0.91 0.00 -2.13 -1.08 -1.26 -5.03 116.67 107.75 1gnd s ASP 151 Ca 0.68 -0.36 0.00 0.00 -0.52 0.00 0.00 52.55 52.34 1gnd s ASP 151 Cb -0.83 0.83 0.00 0.00 -1.46 0.00 0.00 42.92 41.46 1gnd s ASP 151 CO 0.55 -0.35 0.78 -1.84 0.52 0.00 0.00 175.17 174.83 1gnd n GLU 152 N 5.34 0.00 0.00 4.34 0.28 -1.26 -0.60 120.64 128.74 1gnd n GLU 152 Ca -0.02 0.30 0.11 0.00 -0.16 0.00 0.00 57.16 57.39 1gnd n GLU 152 Cb 0.48 -1.56 0.01 0.00 1.43 0.00 0.00 31.44 31.81 1gnd n GLU 152 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1gnd n ASN 153 N -1.28 1.06 -3.83 -1.84 4.13 -1.26 -4.76 115.26 107.48 1gnd n ASN 153 Ca 0.00 -0.91 -0.30 0.00 1.68 0.00 0.00 54.58 55.05 1gnd n ASN 153 Cb 0.06 0.69 -0.15 0.00 -1.54 0.00 0.00 39.78 38.84 1gnd n ASN 153 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1gnd s ASP 154 N -2.88 4.23 0.66 6.41 2.15 0.23 -5.01 116.67 122.46 1gnd s ASP 154 Ca 0.11 -2.03 0.26 0.00 0.43 0.00 0.00 52.55 51.33 1gnd s ASP 154 Cb 0.17 -1.18 1.42 0.00 -0.30 0.00 0.00 42.92 43.03 1gnd s ASP 154 CO 0.76 -0.37 1.81 -0.65 -0.17 0.00 0.00 175.17 176.54 1gnd h PRO 155 N 7.65 0.00 0.00 4.34 0.11 -1.86 -1.31 132.00 140.93 1gnd h PRO 155 Ca -0.08 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.92 1gnd h PRO 155 Cb 1.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 1gnd h PRO 155 CO 0.50 0.00 -0.50 -0.22 -0.21 0.00 0.00 178.00 177.58 1gnd h LYS 156 N 0.00 0.00 0.00 1.05 3.64 -1.95 -2.96 116.57 116.36 1gnd h LYS 156 Ca 0.03 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1gnd h LYS 156 Cb 0.91 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.73 1gnd h LYS 156 CO -0.00 0.50 0.00 1.79 -2.27 0.00 0.00 179.45 179.46 1gnd h THR 157 N 0.00 0.00 -3.82 1.00 1.35 -1.54 -3.42 112.91 106.48 1gnd h THR 157 Ca -0.00 -0.48 -0.44 0.00 -0.55 0.00 0.00 66.41 64.94 1gnd h THR 157 Cb 1.03 1.39 0.17 0.00 -1.73 0.00 0.00 68.15 69.00 1gnd h THR 157 CO 0.06 0.00 0.21 -0.36 -0.25 0.00 0.00 175.52 175.18 1gnd s PHE 158 N -3.28 1.53 -0.44 4.73 0.40 -1.12 -4.59 117.98 115.20 1gnd s PHE 158 Ca 0.06 0.71 0.10 0.00 -0.60 0.00 0.00 56.93 57.20 1gnd s PHE 158 Cb 0.10 -3.44 0.36 0.00 0.51 0.00 0.00 43.02 40.55 1gnd s PHE 158 CO 0.53 -3.16 0.86 0.39 0.70 0.00 0.00 175.22 174.54 1gnd n GLU 159 N -4.29 1.99 -0.88 0.44 1.02 -1.26 -4.79 120.64 112.86 1gnd n GLU 159 Ca 0.09 -3.98 0.00 0.00 -0.02 0.00 0.00 57.16 53.25 1gnd n GLU 159 Cb 0.59 -1.89 0.00 0.00 -0.02 0.00 0.00 31.44 30.12 1gnd n GLU 159 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gnd n GLY 160 N -0.00 0.90 3.86 0.62 0.00 -1.26 -5.02 105.19 104.28 1gnd n GLY 160 Ca 0.27 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.95 1gnd n GLY 160 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1gnd s VAL 161 N -3.57 4.85 -0.40 1.61 -7.23 -1.26 -5.06 120.40 109.34 1gnd s VAL 161 Ca 0.00 0.71 -0.11 0.00 -1.81 0.00 0.00 61.98 60.77 1gnd s VAL 161 Cb 0.00 -3.67 0.05 0.00 0.56 0.00 0.00 36.38 33.33 1gnd s VAL 161 CO 0.00 0.02 0.24 -0.62 -0.31 0.00 0.00 175.10 174.44 1gnd s ASP 162 N -2.10 5.73 0.49 4.85 2.15 -1.26 -4.89 116.67 121.64 1gnd s ASP 162 Ca 0.45 -1.22 0.26 0.00 0.43 0.00 0.00 52.55 52.47 1gnd s ASP 162 Cb -0.13 -2.02 1.33 0.00 -0.30 0.00 0.00 42.92 41.80 1gnd s ASP 162 CO 0.20 -0.47 1.88 -0.65 -0.17 0.00 0.00 175.17 175.96 1gnd h PRO 163 N 8.45 0.14 -0.01 4.34 0.11 -1.97 -0.11 132.00 142.95 1gnd h PRO 163 Ca -0.25 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1gnd h PRO 163 Cb 1.10 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1gnd h PRO 163 CO 0.72 0.10 -0.16 1.04 -0.21 0.00 0.00 178.00 179.48 1gnd n GLN 164 N -4.37 1.19 0.00 1.05 6.02 -1.26 -2.79 117.38 117.22 1gnd n GLN 164 Ca 0.18 -0.72 0.00 0.00 -0.01 0.00 0.00 57.00 56.45 1gnd n GLN 164 Cb 0.84 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.61 1gnd n GLN 164 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1gnd n ASN 165 N -0.28 1.27 -4.66 1.08 3.02 -0.59 -4.81 115.26 110.28 1gnd n ASN 165 Ca 0.15 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.27 1gnd n ASN 165 Cb 0.36 0.04 -0.03 0.00 -0.61 0.00 0.00 39.78 39.54 1gnd n ASN 165 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1gnd s THR 166 N -1.30 3.61 0.90 3.41 2.01 -0.16 -4.69 115.64 119.43 1gnd s THR 166 Ca 0.00 0.76 -0.11 0.00 0.31 0.00 0.00 61.69 62.64 1gnd s THR 166 Cb 0.00 -3.49 0.13 0.00 0.01 0.00 0.00 72.50 69.15 1gnd s THR 166 CO 0.00 -0.06 1.09 -0.94 -0.69 0.00 0.00 174.62 174.02 1gnd s SER 167 N 3.18 3.35 0.33 3.53 1.04 -1.26 -0.67 113.70 123.21 1gnd s SER 167 Ca 0.72 1.62 0.15 0.00 0.48 0.00 0.00 55.95 58.92 1gnd s SER 167 Cb -0.33 -2.28 0.56 0.00 0.10 0.00 0.00 66.02 64.08 1gnd s SER 167 CO 0.29 -2.73 1.70 -0.03 0.98 0.00 0.00 173.24 173.44 1gnd h MET 168 N -1.61 0.00 -0.66 4.02 4.05 -1.34 -2.91 114.93 116.48 1gnd h MET 168 Ca -0.49 0.00 0.02 0.00 -0.28 0.00 0.00 59.70 58.95 1gnd h MET 168 Cb 1.28 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 32.04 1gnd h MET 168 CO 0.52 0.47 0.42 -0.09 0.23 0.00 0.00 176.91 178.46 1gnd h ARG 169 N 0.00 0.82 -0.49 0.39 2.43 -1.73 0.13 114.38 115.93 1gnd h ARG 169 Ca -0.00 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.07 1gnd h ARG 169 Cb 0.95 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 30.30 1gnd h ARG 169 CO 0.06 0.54 0.10 -0.44 -1.51 0.00 0.00 179.97 178.72 1gnd h ASP 170 N 0.84 0.70 -0.46 -3.80 3.32 -1.81 -1.43 116.42 113.78 1gnd h ASP 170 Ca 0.25 -0.13 -0.13 0.00 0.02 0.00 0.00 57.03 57.05 1gnd h ASP 170 Cb -0.04 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 1gnd h ASP 170 CO -0.08 0.71 -0.21 0.58 -1.72 0.00 0.00 179.24 178.52 1gnd h VAL 171 N 0.72 1.27 -0.46 -1.35 2.07 -1.12 0.04 116.25 117.42 1gnd h VAL 171 Ca 0.16 -1.37 -0.07 0.00 0.82 0.00 0.00 66.70 66.24 1gnd h VAL 171 Cb 0.30 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 1gnd h VAL 171 CO 0.00 0.47 -0.01 1.88 0.02 0.00 0.00 177.57 179.94 1gnd h TYR 172 N 0.84 0.82 -0.38 1.57 0.05 -0.62 -2.97 116.97 116.27 1gnd h TYR 172 Ca 0.11 -0.11 -0.08 0.00 0.05 0.00 0.00 58.73 58.70 1gnd h TYR 172 Cb 0.78 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 38.28 1gnd h TYR 172 CO 0.05 0.77 -0.07 0.00 -1.05 0.00 0.00 178.16 177.85 1gnd h ARG 173 N 0.72 0.73 -0.52 4.88 3.08 -0.90 -1.21 114.38 121.15 1gnd h ARG 173 Ca 0.14 -0.27 0.15 0.00 0.07 0.00 0.00 59.98 60.07 1gnd h ARG 173 Cb 0.45 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 1gnd h ARG 173 CO 0.02 0.86 0.41 -0.22 -1.07 0.00 0.00 179.97 179.98 1gnd h LYS 174 N 0.54 0.00 -0.02 0.04 3.64 -0.84 0.16 116.57 120.09 1gnd h LYS 174 Ca 0.10 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1gnd h LYS 174 Cb 0.58 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1gnd h LYS 174 CO 0.03 0.00 -0.21 1.19 -2.27 0.00 0.00 179.45 178.19 1gnd n PHE 175 N -4.16 0.00 -3.49 1.91 3.01 -1.13 -5.01 117.46 108.58 1gnd n PHE 175 Ca 0.10 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.37 1gnd n PHE 175 Cb 0.63 0.00 0.07 0.00 -0.01 0.00 0.00 39.48 40.17 1gnd n PHE 175 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1gnd n ASP 176 N 0.31 -2.98 -4.71 4.37 2.03 0.55 -4.86 116.55 111.26 1gnd n ASP 176 Ca 0.08 -0.73 -0.37 0.00 0.52 0.00 0.00 54.79 54.29 1gnd n ASP 176 Cb 0.38 -4.70 -0.07 0.00 -0.72 0.00 0.00 41.12 36.02 1gnd n ASP 176 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1gnd s LEU 177 N -6.26 4.22 1.05 -2.67 1.43 -0.72 -5.03 118.68 110.69 1gnd s LEU 177 Ca 0.13 0.58 -0.16 0.00 -1.03 0.00 0.00 54.13 53.66 1gnd s LEU 177 Cb -0.03 -2.50 0.21 0.00 0.03 0.00 0.00 46.19 43.91 1gnd s LEU 177 CO 0.77 0.01 1.16 -0.83 0.23 0.00 0.00 176.35 177.69 1gnd s GLY 178 N 0.72 1.62 0.19 -3.19 0.00 -1.26 -4.82 107.32 100.58 1gnd s GLY 178 Ca 0.20 -0.81 -0.12 0.00 0.00 0.00 0.00 44.72 43.99 1gnd s GLY 178 CO 0.07 -0.07 1.72 -1.61 0.00 0.00 0.00 173.10 173.20 1gnd h GLN 179 N -2.00 0.25 -0.25 2.90 5.75 -1.99 -2.07 115.11 117.70 1gnd h GLN 179 Ca -0.48 -0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 57.99 1gnd h GLN 179 Cb 1.30 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 29.78 1gnd h GLN 179 CO 0.46 0.17 0.08 -0.44 -2.65 0.00 0.00 178.83 176.44 1gnd h ASP 180 N 0.26 0.31 0.44 -0.69 5.19 -2.00 -0.71 116.42 119.22 1gnd h ASP 180 Ca 0.27 -0.03 -0.22 0.00 -0.62 0.00 0.00 57.03 56.43 1gnd h ASP 180 Cb 0.37 -0.08 -0.00 0.00 0.18 0.00 0.00 39.33 39.80 1gnd h ASP 180 CO -0.34 0.30 -0.96 0.58 -3.12 0.00 0.00 179.24 175.71 1gnd h VAL 181 N 0.34 1.44 -0.58 -1.35 2.07 -1.80 -3.12 116.25 113.26 1gnd h VAL 181 Ca 0.09 -2.56 -0.04 0.00 0.82 0.00 0.00 66.70 65.00 1gnd h VAL 181 Cb 0.11 2.49 -0.03 0.00 -1.52 0.00 0.00 31.29 32.34 1gnd h VAL 181 CO -0.01 0.76 0.21 0.40 0.02 0.00 0.00 177.57 178.95 1gnd h ILE 182 N 0.18 1.23 0.31 4.57 2.04 -0.67 -0.24 117.51 124.93 1gnd h ILE 182 Ca -0.08 -0.75 0.00 0.00 1.00 0.00 0.00 64.86 65.03 1gnd h ILE 182 Cb 1.60 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 38.28 1gnd h ILE 182 CO 0.16 0.29 -0.45 0.44 0.00 0.00 0.00 178.15 178.59 1gnd h ASP 183 N 0.81 -1.26 0.75 1.72 3.32 -1.18 -0.20 116.42 120.38 1gnd h ASP 183 Ca 0.19 0.12 -0.07 0.00 0.02 0.00 0.00 57.03 57.29 1gnd h ASP 183 Cb 0.24 0.44 -0.01 0.00 0.22 0.00 0.00 39.33 40.22 1gnd h ASP 183 CO -0.01 -0.56 -0.34 2.19 -1.72 0.00 0.00 179.24 178.79 1gnd h PHE 184 N -0.81 0.00 -0.01 4.55 -5.15 -1.47 -2.26 116.94 111.79 1gnd h PHE 184 Ca -0.02 0.00 -0.12 0.00 -0.20 0.00 0.00 57.97 57.63 1gnd h PHE 184 Cb 0.76 0.00 0.01 0.00 0.22 0.00 0.00 35.95 36.94 1gnd h PHE 184 CO -0.30 0.34 -0.48 1.15 -2.00 0.00 0.00 178.31 177.03 1gnd h THR 185 N 0.00 1.46 -0.38 0.88 2.02 -0.75 -0.52 112.91 115.62 1gnd h THR 185 Ca -0.00 -2.01 -0.13 0.00 0.77 0.00 0.00 66.41 65.04 1gnd h THR 185 Cb 0.81 2.62 -0.01 0.00 -1.74 0.00 0.00 68.15 69.83 1gnd h THR 185 CO 0.04 0.57 -0.28 1.23 0.37 0.00 0.00 175.52 177.46 1gnd h GLY 186 N -0.22 0.93 1.09 2.16 0.00 -1.08 -1.03 103.07 104.92 1gnd h GLY 186 Ca -0.06 -0.90 -0.30 0.00 0.00 0.00 0.00 47.33 46.07 1gnd h GLY 186 CO 0.09 0.82 -1.64 0.45 0.00 0.00 0.00 176.54 176.26 1gnd h HIS 187 N 0.66 0.22 0.00 5.60 3.86 -1.50 -1.51 115.15 122.49 1gnd h HIS 187 Ca 0.07 -0.16 0.00 0.00 -1.16 0.00 0.00 60.37 59.12 1gnd h HIS 187 Cb 0.85 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.31 1gnd h HIS 187 CO 0.06 1.26 -0.92 0.00 0.86 0.00 0.00 177.93 179.19 1gnd n ALA 188 N -2.65 3.62 -0.05 2.45 0.00 -0.21 -3.85 120.51 119.81 1gnd n ALA 188 Ca -0.18 -0.40 -0.10 0.00 0.00 0.00 0.00 53.44 52.76 1gnd n ALA 188 Cb 1.04 -0.53 -0.03 0.00 0.00 0.00 0.00 19.45 19.92 1gnd n ALA 188 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1gnd n LEU 189 N -1.50 1.34 0.20 0.00 4.77 -1.06 -4.64 117.00 116.10 1gnd n LEU 189 Ca 0.02 0.22 0.09 0.00 -0.03 0.00 0.00 56.01 56.30 1gnd n LEU 189 Cb 0.27 -0.50 0.26 0.00 -2.33 0.00 0.00 43.42 41.11 1gnd n LEU 189 CO 0.30 -0.15 0.72 0.00 -1.33 0.00 0.00 177.39 176.93 1gnd h ALA 190 N -0.53 0.90 -1.02 -1.18 0.00 -1.24 -3.41 119.26 112.77 1gnd h ALA 190 Ca -0.16 -0.20 -0.18 0.00 0.00 0.00 0.00 54.91 54.36 1gnd h ALA 190 Cb 0.88 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 1gnd h ALA 190 CO -0.10 0.28 -0.21 1.28 0.00 0.00 0.00 179.25 180.50 1gnd n LEU 191 N -3.22 -1.18 -4.80 0.00 4.32 -0.86 -4.84 117.00 106.43 1gnd n LEU 191 Ca 0.02 0.06 -0.32 0.00 -0.02 0.00 0.00 56.01 55.75 1gnd n LEU 191 Cb 0.54 -1.55 0.03 0.00 -1.62 0.00 0.00 43.42 40.83 1gnd n LEU 191 CO 0.35 -0.21 0.72 -0.31 -1.22 0.00 0.00 177.39 176.72 1gnd s TYR 192 N -2.41 2.93 -0.15 -1.77 2.02 -0.62 -4.97 117.35 112.38 1gnd s TYR 192 Ca 0.00 1.50 0.18 0.00 -0.37 0.00 0.00 57.07 58.38 1gnd s TYR 192 Cb 0.00 -3.00 -0.25 0.00 -0.40 0.00 0.00 41.96 38.31 1gnd s TYR 192 CO 0.00 -1.28 0.29 0.54 -1.57 0.00 0.00 175.55 173.53 1gnd n ARG 193 N -2.48 0.67 -4.51 -0.62 3.00 -1.26 -4.44 116.66 107.02 1gnd n ARG 193 Ca 0.09 0.02 -0.25 0.00 -0.01 0.00 0.00 57.85 57.70 1gnd n ARG 193 Cb 0.53 -1.58 -0.09 0.00 0.00 0.00 0.00 32.46 31.32 1gnd n ARG 193 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1gnd s THR 194 N -2.71 0.84 -0.32 0.55 -4.23 -1.26 -4.68 115.64 103.83 1gnd s THR 194 Ca -0.08 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.55 1gnd s THR 194 Cb 0.08 -2.48 0.75 0.00 1.34 0.00 0.00 72.50 72.18 1gnd s THR 194 CO 0.84 0.00 1.63 0.47 -0.54 0.00 0.00 174.62 177.02 1gnd n ASP 195 N -1.09 5.31 0.25 3.99 8.00 -1.26 -4.46 116.55 127.29 1gnd n ASP 195 Ca -0.06 -2.84 0.12 0.00 0.71 0.00 0.00 54.79 52.72 1gnd n ASP 195 Cb 0.66 -0.67 0.66 0.00 -0.02 0.00 0.00 41.12 41.74 1gnd n ASP 195 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1gnd h ASP 196 N 3.63 0.00 0.24 -2.24 5.19 -2.02 -2.71 116.42 118.50 1gnd h ASP 196 Ca 0.00 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.38 1gnd h ASP 196 Cb 1.85 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 41.35 1gnd h ASP 196 CO 0.45 0.15 -0.12 0.10 -3.12 0.00 0.00 179.24 176.70 1gnd h TYR 197 N 0.00 0.00 -0.76 4.55 -0.00 -1.96 -3.01 116.97 115.80 1gnd h TYR 197 Ca -0.00 0.00 0.16 0.00 -0.00 0.00 0.00 58.73 58.88 1gnd h TYR 197 Cb 0.44 0.00 -0.10 0.00 -0.00 0.00 0.00 36.73 37.07 1gnd h TYR 197 CO 0.00 0.12 0.26 1.25 -0.00 0.00 0.00 178.16 179.79 1gnd h LEU 198 N 0.00 0.18 -3.10 0.10 5.85 -1.84 -1.35 115.31 115.14 1gnd h LEU 198 Ca -0.00 0.13 -0.17 0.00 0.84 0.00 0.00 57.88 58.67 1gnd h LEU 198 Cb 0.27 0.13 -0.10 0.00 0.37 0.00 0.00 40.66 41.33 1gnd h LEU 198 CO 0.02 0.04 0.22 0.47 -0.34 0.00 0.00 178.44 178.84 1gnd n ASP 199 N -5.07 3.99 -4.43 1.25 8.00 -1.14 -2.16 116.55 117.00 1gnd n ASP 199 Ca 0.15 -2.89 -0.22 0.00 0.71 0.00 0.00 54.79 52.54 1gnd n ASP 199 Cb 0.45 -0.68 -0.10 0.00 -0.02 0.00 0.00 41.12 40.77 1gnd n ASP 199 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1gnd s GLN 200 N -2.30 1.55 0.29 -1.24 -1.52 -0.51 -4.97 119.66 110.97 1gnd s GLN 200 Ca 0.40 -1.71 -0.27 0.00 -1.95 0.00 0.00 55.36 51.83 1gnd s GLN 200 Cb 0.32 -1.52 -0.14 0.00 -0.22 0.00 0.00 33.01 31.44 1gnd s GLN 200 CO 0.10 0.27 0.83 -2.30 -0.25 0.00 0.00 175.29 173.93 1gnd n PRO 201 N -0.54 0.92 0.21 2.91 -0.02 -1.26 -2.54 135.00 134.68 1gnd n PRO 201 Ca -0.06 0.32 0.07 0.00 -2.02 0.00 0.00 63.50 61.81 1gnd n PRO 201 Cb 0.60 -1.60 0.45 0.00 -0.02 0.00 0.00 33.50 32.93 1gnd n PRO 201 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1gnd h LEU 203 N 0.00 -1.32 -0.11 0.00 5.85 -1.81 -1.94 115.31 115.98 1gnd h LEU 203 Ca -0.00 0.27 0.04 0.00 0.84 0.00 0.00 57.88 59.03 1gnd h LEU 203 Cb 0.69 0.68 -0.05 0.00 0.37 0.00 0.00 40.66 42.34 1gnd h LEU 203 CO 0.04 -0.30 -0.23 -0.08 -0.34 0.00 0.00 178.44 177.53 1gnd h GLU 204 N -0.08 -0.30 -0.79 1.25 4.81 -1.89 -1.43 114.58 116.16 1gnd h GLU 204 Ca 0.29 0.02 0.06 0.00 -0.13 0.00 0.00 59.36 59.60 1gnd h GLU 204 Cb 0.57 0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.97 1gnd h GLU 204 CO -0.84 -0.20 0.52 1.15 -0.73 0.00 0.00 179.01 178.90 1gnd h THR 205 N -0.31 1.05 -0.22 0.32 2.02 -1.63 -0.81 112.91 113.33 1gnd h THR 205 Ca 0.09 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 66.97 1gnd h THR 205 Cb 0.44 0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.95 1gnd h THR 205 CO -0.28 0.16 0.12 0.40 0.37 0.00 0.00 175.52 176.28 1gnd h ILE 206 N 0.87 1.13 -0.18 3.11 2.04 -0.65 -2.06 117.51 121.77 1gnd h ILE 206 Ca 0.33 -0.35 -0.06 0.00 1.00 0.00 0.00 64.86 65.78 1gnd h ILE 206 Cb 0.21 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 1gnd h ILE 206 CO -0.11 0.12 -0.18 0.78 0.00 0.00 0.00 178.15 178.76 1gnd h ASN 207 N 0.24 0.29 -0.29 1.72 -0.26 -0.32 -1.95 115.58 115.01 1gnd h ASN 207 Ca 0.08 -0.07 -0.05 0.00 -0.56 0.00 0.00 56.30 55.70 1gnd h ASN 207 Cb 0.09 -0.08 -0.01 0.00 -1.06 0.00 0.00 38.32 37.26 1gnd h ASN 207 CO -0.01 0.49 -0.00 0.03 -1.06 0.00 0.00 177.43 176.87 1gnd h ARG 208 N 0.28 0.51 -0.26 0.81 3.08 -0.92 -1.78 114.38 116.09 1gnd h ARG 208 Ca 0.05 -0.16 -0.07 0.00 0.07 0.00 0.00 59.98 59.86 1gnd h ARG 208 Cb 0.48 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 1gnd h ARG 208 CO 0.03 0.66 -0.15 0.82 -1.07 0.00 0.00 179.97 180.27 1gnd h ILE 209 N 0.29 1.23 -0.62 2.04 2.04 -1.18 -2.59 117.51 118.72 1gnd h ILE 209 Ca 0.08 -1.03 0.01 0.00 1.00 0.00 0.00 64.86 64.92 1gnd h ILE 209 Cb 0.44 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.68 1gnd h ILE 209 CO 0.02 0.33 0.41 0.11 0.00 0.00 0.00 178.15 179.02 1gnd h LYS 210 N 0.42 0.82 -0.76 2.37 1.79 -1.13 -2.37 116.57 117.71 1gnd h LYS 210 Ca 0.08 -0.05 0.03 0.00 -2.18 0.00 0.00 60.65 58.53 1gnd h LYS 210 Cb 0.51 -0.19 -0.05 0.00 -1.58 0.00 0.00 32.23 30.92 1gnd h LYS 210 CO 0.03 0.54 0.49 1.25 -1.08 0.00 0.00 179.45 180.68 1gnd h LEU 211 N 0.85 0.80 -0.35 2.94 5.85 -0.95 0.04 115.31 124.49 1gnd h LEU 211 Ca 0.23 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 1gnd h LEU 211 Cb -0.10 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.74 1gnd h LEU 211 CO -0.05 0.55 0.14 0.22 -0.34 0.00 0.00 178.44 178.96 1gnd h TYR 212 N 0.95 0.53 -0.22 1.25 5.03 -1.21 -1.19 116.97 122.11 1gnd h TYR 212 Ca 0.31 -0.04 -0.02 0.00 2.58 0.00 0.00 58.73 61.56 1gnd h TYR 212 Cb 0.02 -0.16 -0.01 0.00 1.55 0.00 0.00 36.73 38.13 1gnd h TYR 212 CO -0.03 0.49 0.08 0.77 -1.32 0.00 0.00 178.16 178.15 1gnd h SER 213 N 0.42 0.31 0.25 -2.11 0.02 -1.04 -3.05 113.55 108.35 1gnd h SER 213 Ca 0.12 -0.19 -0.06 0.00 -0.84 0.00 0.00 61.79 60.82 1gnd h SER 213 Cb 0.19 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 1gnd h SER 213 CO -0.01 0.41 -0.27 -0.33 -1.14 0.00 0.00 176.83 175.50 1gnd h GLU 214 N 0.19 0.04 0.00 3.45 5.08 -0.87 -2.27 114.58 120.19 1gnd h GLU 214 Ca 0.07 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1gnd h GLU 214 Cb 0.21 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1gnd h GLU 214 CO -0.00 0.31 0.00 0.43 -1.00 0.00 0.00 179.01 178.74 1gnd n SER 215 N -4.21 0.00 0.00 1.42 7.64 -0.46 -4.66 113.62 113.35 1gnd n SER 215 Ca -0.02 -0.33 0.00 0.00 1.01 0.00 0.00 58.87 59.53 1gnd n SER 215 Cb 0.33 -0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 1gnd n SER 215 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1gnd n LEU 216 N -1.10 0.00 -1.29 -3.43 -0.00 -0.86 -4.41 117.00 105.91 1gnd n LEU 216 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.12 1gnd n LEU 216 Cb 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.50 1gnd n LEU 216 CO 0.11 0.00 -0.26 0.00 -0.00 0.00 0.00 177.39 177.24 1gnd n ALA 217 N -0.83 -2.49 -0.70 1.47 0.00 -1.26 -4.06 120.51 112.64 1gnd n ALA 217 Ca 0.00 0.26 -0.04 0.00 0.00 0.00 0.00 53.44 53.65 1gnd n ALA 217 Cb 0.00 -1.01 0.07 0.00 0.00 0.00 0.00 19.45 18.51 1gnd n ALA 217 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1gnd n ARG 218 N 0.90 -0.01 -0.02 0.00 -4.01 -1.26 -3.73 116.66 108.52 1gnd n ARG 218 Ca 0.00 -0.35 0.00 0.00 -1.04 0.00 0.00 57.85 56.46 1gnd n ARG 218 Cb 0.00 -0.94 0.00 0.00 -3.04 0.00 0.00 32.46 28.48 1gnd n ARG 218 CO 0.00 0.00 0.00 0.98 -3.04 0.00 0.00 177.63 175.57 1gnd n TYR 219 N -3.49 0.00 -2.65 2.89 4.19 -1.26 -2.67 117.16 114.16 1gnd n TYR 219 Ca 0.03 0.00 -0.05 0.00 3.31 0.00 0.00 57.90 61.19 1gnd n TYR 219 Cb 0.14 -0.89 0.02 0.00 0.49 0.00 0.00 39.34 39.10 1gnd n TYR 219 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1gnd n GLY 220 N -2.00 0.56 0.00 2.98 0.00 -1.24 -5.04 105.19 100.44 1gnd n GLY 220 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1gnd n GLY 220 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gnd n LYS 221 N -1.52 0.00 -3.82 1.61 4.76 -1.09 -5.01 118.16 113.09 1gnd n LYS 221 Ca -0.01 0.00 -0.06 0.00 -2.87 0.00 0.00 58.31 55.37 1gnd n LYS 221 Cb 0.52 -0.01 -0.02 0.00 -1.84 0.00 0.00 35.03 33.68 1gnd n LYS 221 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1gnd s SER 222 N -1.03 -0.22 0.00 4.39 1.04 -1.23 -4.47 113.70 112.18 1gnd s SER 222 Ca 0.00 -0.54 0.20 0.00 0.48 0.00 0.00 55.95 56.09 1gnd s SER 222 Cb 0.00 0.63 0.74 0.00 0.10 0.00 0.00 66.02 67.49 1gnd s SER 222 CO 0.00 -1.17 1.54 -0.81 0.98 0.00 0.00 173.24 173.77 1gnd n PRO 223 N -0.47 1.71 -3.67 4.02 -0.04 -1.26 -4.50 135.00 130.80 1gnd n PRO 223 Ca -0.05 -1.07 -0.34 0.00 -0.04 0.00 0.00 63.50 61.99 1gnd n PRO 223 Cb 0.60 -1.39 -0.05 0.00 -0.04 0.00 0.00 33.50 32.62 1gnd n PRO 223 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1gnd s TYR 224 N -1.78 3.57 0.10 0.54 2.02 -1.26 -0.81 117.35 119.73 1gnd s TYR 224 Ca 0.32 0.67 0.10 0.00 -0.37 0.00 0.00 57.07 57.79 1gnd s TYR 224 Cb 0.17 -2.07 -0.04 0.00 -0.40 0.00 0.00 41.96 39.63 1gnd s TYR 224 CO 0.26 0.56 -0.26 -0.51 -1.57 0.00 0.00 175.55 174.03 1gnd s LEU 225 N -1.89 2.26 -0.06 -1.29 1.43 0.12 -1.02 118.68 118.23 1gnd s LEU 225 Ca 0.31 -0.68 -0.04 0.00 -1.03 0.00 0.00 54.13 52.69 1gnd s LEU 225 Cb -0.13 -1.19 0.02 0.00 0.03 0.00 0.00 46.19 44.92 1gnd s LEU 225 CO 0.18 0.19 0.15 -0.47 0.23 0.00 0.00 176.35 176.62 1gnd s TYR 226 N -0.98 -0.17 0.33 0.29 5.04 -0.99 -1.33 117.35 119.55 1gnd s TYR 226 Ca 0.12 0.43 -0.27 0.00 -2.44 0.00 0.00 57.07 54.91 1gnd s TYR 226 Cb -0.10 0.02 -0.09 0.00 0.35 0.00 0.00 41.96 42.13 1gnd s TYR 226 CO 0.04 -0.11 1.07 -2.14 -1.34 0.00 0.00 175.55 173.07 1gnd s PRO 227 N 0.43 4.45 0.37 4.97 0.02 -1.26 -1.85 135.00 142.12 1gnd s PRO 227 Ca -0.03 1.66 -0.28 0.00 0.02 0.00 0.00 61.00 62.37 1gnd s PRO 227 Cb -0.04 -2.92 -0.11 0.00 0.02 0.00 0.00 34.50 31.45 1gnd s PRO 227 CO -0.02 0.08 1.45 -1.17 -0.33 0.00 0.00 177.00 177.01 1gnd s LEU 228 N -1.94 4.34 0.00 -5.54 2.96 0.49 -1.55 118.68 117.44 1gnd s LEU 228 Ca 0.50 2.98 0.00 0.00 -0.22 0.00 0.00 54.13 57.38 1gnd s LEU 228 Cb -0.27 -3.67 0.00 0.00 0.50 0.00 0.00 46.19 42.75 1gnd s LEU 228 CO 0.35 -0.80 0.00 -1.22 -1.32 0.00 0.00 176.35 173.36 1gnd n TYR 229 N 0.53 0.00 -0.71 5.38 4.01 -0.07 -4.79 117.16 121.50 1gnd n TYR 229 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 1gnd n TYR 229 Cb 0.40 -0.38 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 1gnd n TYR 229 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gnd n GLY 230 N -2.02 -2.69 0.29 2.72 0.00 -0.60 -4.48 105.19 98.42 1gnd n GLY 230 Ca 0.00 -1.69 0.19 0.00 0.00 0.00 0.00 46.02 44.52 1gnd n GLY 230 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1gnd h LEU 231 N 0.00 0.00 -2.37 0.99 3.38 -1.91 -2.85 115.31 112.55 1gnd h LEU 231 Ca 0.00 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.00 1gnd h LEU 231 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1gnd h LEU 231 CO 0.00 0.00 0.17 1.23 0.09 0.00 0.00 178.44 179.93 1gnd h GLY 232 N 1.38 0.00 2.00 0.83 0.00 -1.92 -1.09 103.07 104.27 1gnd h GLY 232 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1gnd h GLY 232 CO 0.00 0.00 -0.01 0.83 0.00 0.00 0.00 176.54 177.36 1gnd h GLU 233 N 0.00 0.00 -0.04 4.80 4.39 -1.76 -3.22 114.58 118.76 1gnd h GLU 233 Ca 0.05 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.73 1gnd h GLU 233 Cb 0.39 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.04 1gnd h GLU 233 CO -0.00 0.01 -0.04 -0.07 -1.16 0.00 0.00 179.01 177.74 1gnd h LEU 234 N 0.00 0.10 -1.30 1.33 4.07 -1.44 -1.34 115.31 116.73 1gnd h LEU 234 Ca -0.00 -0.50 0.00 0.00 0.08 0.00 0.00 57.88 57.46 1gnd h LEU 234 Cb 0.37 -0.03 -0.03 0.00 1.08 0.00 0.00 40.66 42.05 1gnd h LEU 234 CO 0.00 0.59 0.44 -0.65 -1.08 0.00 0.00 178.44 177.73 1gnd h PRO 235 N -0.38 0.90 -0.04 1.13 0.11 -1.74 -1.40 132.00 130.59 1gnd h PRO 235 Ca 0.01 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.05 1gnd h PRO 235 Cb 0.56 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 31.47 1gnd h PRO 235 CO 0.01 0.61 0.01 1.96 -0.21 0.00 0.00 178.00 180.38 1gnd h GLN 236 N 0.93 0.06 -0.80 1.05 4.20 -1.59 -2.17 115.11 116.80 1gnd h GLN 236 Ca 0.25 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.92 1gnd h GLN 236 Cb -0.08 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.65 1gnd h GLN 236 CO -0.05 0.28 0.40 0.78 -0.67 0.00 0.00 178.83 179.57 1gnd h GLY 237 N -0.18 1.21 1.03 3.46 0.00 -0.85 -2.75 103.07 105.00 1gnd h GLY 237 Ca 0.01 -0.58 -0.11 0.00 0.00 0.00 0.00 47.33 46.66 1gnd h GLY 237 CO 0.00 0.55 -0.14 0.74 0.00 0.00 0.00 176.54 177.69 1gnd h PHE 238 N 1.13 0.98 -0.83 5.60 0.04 -1.21 -1.87 116.94 120.78 1gnd h PHE 238 Ca 0.28 -0.22 0.08 0.00 2.80 0.00 0.00 57.97 60.91 1gnd h PHE 238 Cb 0.08 -0.24 -0.07 0.00 2.20 0.00 0.00 35.95 37.93 1gnd h PHE 238 CO 0.01 0.99 0.49 0.00 -0.60 0.00 0.00 178.31 179.20 1gnd h ALA 239 N 0.85 1.18 -0.08 2.45 0.00 -1.27 0.16 119.26 122.53 1gnd h ALA 239 Ca 0.11 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1gnd h ALA 239 Cb 0.69 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1gnd h ALA 239 CO 0.05 0.15 -0.29 -0.09 0.00 0.00 0.00 179.25 179.07 1gnd h ARG 240 N 0.85 0.15 -0.18 0.00 2.43 -1.29 -2.78 114.38 113.56 1gnd h ARG 240 Ca 0.39 -0.05 -0.20 0.00 -0.81 0.00 0.00 59.98 59.31 1gnd h ARG 240 Cb 0.30 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1gnd h ARG 240 CO -0.22 0.44 -0.68 1.25 -1.51 0.00 0.00 179.97 179.25 1gnd h LEU 241 N 0.14 0.85 -0.99 3.80 6.46 0.05 -3.17 115.31 122.46 1gnd h LEU 241 Ca 0.02 -0.52 -0.05 0.00 -0.12 0.00 0.00 57.88 57.21 1gnd h LEU 241 Cb 0.59 -0.25 -0.03 0.00 -0.73 0.00 0.00 40.66 40.25 1gnd h LEU 241 CO 0.04 1.30 0.18 0.77 -0.62 0.00 0.00 178.44 180.12 1gnd h SER 242 N 0.53 0.85 -0.69 1.25 4.64 -0.71 -2.44 113.55 116.98 1gnd h SER 242 Ca -0.02 -0.14 0.05 0.00 -0.47 0.00 0.00 61.79 61.21 1gnd h SER 242 Cb 1.29 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 63.12 1gnd h SER 242 CO 0.14 0.80 0.45 0.00 -0.87 0.00 0.00 176.83 177.36 1gnd h ALA 243 N 1.31 1.70 -0.75 5.18 0.00 -1.48 0.28 119.26 125.49 1gnd h ALA 243 Ca 0.20 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 1gnd h ALA 243 Cb 0.26 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1gnd h ALA 243 CO -0.01 0.20 0.29 0.82 0.00 0.00 0.00 179.25 180.56 1gnd h ILE 244 N 0.74 1.25 -0.00 0.00 1.08 -1.44 -2.69 117.51 116.45 1gnd h ILE 244 Ca 0.29 -0.82 0.00 0.00 -0.39 0.00 0.00 64.86 63.95 1gnd h ILE 244 Cb 0.20 0.36 0.00 0.00 -3.07 0.00 0.00 36.82 34.32 1gnd h ILE 244 CO -0.09 0.33 -0.25 -1.22 -0.69 0.00 0.00 178.15 176.23 1gnd n TYR 245 N -4.28 0.00 -1.45 1.37 4.01 -0.41 -4.91 117.16 111.48 1gnd n TYR 245 Ca 0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.81 1gnd n TYR 245 Cb 0.19 -0.26 0.00 0.00 -0.31 0.00 0.00 39.34 38.96 1gnd n TYR 245 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gnd n GLY 246 N 1.41 0.78 3.94 2.72 0.00 -0.30 -5.07 105.19 108.68 1gnd n GLY 246 Ca 0.09 -0.66 -0.25 0.00 0.00 0.00 0.00 46.02 45.20 1gnd n GLY 246 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gnd s GLY 247 N -2.74 1.71 -0.09 -0.02 0.00 0.83 -4.88 107.32 102.13 1gnd s GLY 247 Ca 0.00 -1.00 0.01 0.00 0.00 0.00 0.00 44.72 43.73 1gnd s GLY 247 CO 0.00 -0.61 -0.11 -0.51 0.00 0.00 0.00 173.10 171.87 1gnd s THR 248 N -3.17 1.18 -0.09 0.90 -4.23 -1.05 -4.38 115.64 104.79 1gnd s THR 248 Ca 0.60 -0.44 -0.00 0.00 -1.18 0.00 0.00 61.69 60.66 1gnd s THR 248 Cb -0.11 -1.12 -0.03 0.00 1.34 0.00 0.00 72.50 72.59 1gnd s THR 248 CO 0.44 0.38 -0.07 -0.31 -0.54 0.00 0.00 174.62 174.52 1gnd s TYR 249 N 1.14 2.94 -0.08 3.99 1.51 -1.26 0.04 117.35 125.64 1gnd s TYR 249 Ca -0.05 -0.11 -0.03 0.00 -1.01 0.00 0.00 57.07 55.87 1gnd s TYR 249 Cb -0.14 -1.78 0.04 0.00 -0.11 0.00 0.00 41.96 39.97 1gnd s TYR 249 CO -0.02 0.20 0.07 -1.64 -1.11 0.00 0.00 175.55 173.04 1gnd s MET 250 N -0.44 -0.02 0.48 -0.62 -1.94 0.55 -4.97 119.30 112.35 1gnd s MET 250 Ca 0.06 0.25 0.02 0.00 -1.71 0.00 0.00 55.69 54.31 1gnd s MET 250 Cb -0.12 -0.88 0.01 0.00 2.01 0.00 0.00 34.83 35.85 1gnd s MET 250 CO 0.02 -0.42 0.69 -0.51 -0.01 0.00 0.00 175.02 174.79 1gnd s LEU 251 N 2.15 3.53 -1.55 -0.03 1.43 -1.26 -1.69 118.68 121.26 1gnd s LEU 251 Ca 0.04 0.09 -0.10 0.00 -1.03 0.00 0.00 54.13 53.13 1gnd s LEU 251 Cb -0.13 -2.99 0.08 0.00 0.03 0.00 0.00 46.19 43.18 1gnd s LEU 251 CO -0.05 -0.85 0.67 -3.20 0.23 0.00 0.00 176.35 173.15 1gnd n ASN 252 N -2.13 -2.29 -3.88 2.29 2.85 -0.22 -4.89 115.26 106.99 1gnd n ASN 252 Ca 0.04 -0.97 -0.30 0.00 -0.11 0.00 0.00 54.58 53.24 1gnd n ASN 252 Cb 0.59 -3.07 -0.15 0.00 1.24 0.00 0.00 39.78 38.39 1gnd n ASN 252 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 1gnd s LYS 253 N -6.72 1.28 0.56 1.20 1.02 -0.62 -4.97 119.74 111.49 1gnd s LYS 253 Ca 0.42 -1.73 -0.20 0.00 0.02 0.00 0.00 55.97 54.48 1gnd s LYS 253 Cb -0.23 -2.73 -0.04 0.00 -0.52 0.00 0.00 37.83 34.31 1gnd s LYS 253 CO 0.90 -1.00 1.23 -1.25 -0.92 0.00 0.00 175.35 174.30 1gnd s PRO 254 N 0.91 3.12 -0.24 -1.68 0.04 -1.26 -3.73 135.00 132.16 1gnd s PRO 254 Ca 0.12 1.89 -0.07 0.00 0.04 0.00 0.00 61.00 62.98 1gnd s PRO 254 Cb -0.20 -2.06 -0.03 0.00 0.04 0.00 0.00 34.50 32.25 1gnd s PRO 254 CO -0.11 -1.10 0.06 0.08 0.04 0.00 0.00 177.00 175.96 1gnd s VAL 255 N -1.53 4.25 0.01 -0.36 1.01 -1.26 -4.31 120.40 118.21 1gnd s VAL 255 Ca 0.74 -0.19 0.03 0.00 0.00 0.00 0.00 61.98 62.56 1gnd s VAL 255 Cb -0.32 -2.98 -0.25 0.00 0.00 0.00 0.00 36.38 32.83 1gnd s VAL 255 CO 0.36 0.35 0.87 0.44 0.00 0.00 0.00 175.10 177.11 1gnd h ASP 256 N 8.15 0.22 -3.47 3.32 3.32 -1.27 -3.49 116.42 123.20 1gnd h ASP 256 Ca -0.38 -0.32 0.10 0.00 0.02 0.00 0.00 57.03 56.44 1gnd h ASP 256 Cb 1.17 -0.07 -0.26 0.00 0.22 0.00 0.00 39.33 40.40 1gnd h ASP 256 CO 0.58 1.27 0.58 -0.62 -1.72 0.00 0.00 179.24 179.33 1gnd s ASP 257 N -6.71 -0.34 -0.42 6.45 2.15 -1.18 -5.03 116.67 111.59 1gnd s ASP 257 Ca -0.07 0.53 -0.17 0.00 0.43 0.00 0.00 52.55 53.27 1gnd s ASP 257 Cb 0.08 0.49 0.02 0.00 -0.30 0.00 0.00 42.92 43.21 1gnd s ASP 257 CO 0.83 -0.21 0.40 -0.63 -0.17 0.00 0.00 175.17 175.40 1gnd s ILE 258 N -0.45 5.14 0.20 4.11 1.01 -1.26 -1.98 121.20 127.96 1gnd s ILE 258 Ca 0.02 -0.48 -0.30 0.00 0.00 0.00 0.00 60.65 59.89 1gnd s ILE 258 Cb -0.03 -4.02 -0.08 0.00 0.01 0.00 0.00 42.46 38.34 1gnd s ILE 258 CO -0.04 -0.41 1.11 -0.63 0.00 0.00 0.00 174.94 174.97 1gnd s ILE 259 N 2.00 3.74 0.00 2.92 -1.09 0.12 -4.91 121.20 123.97 1gnd s ILE 259 Ca 0.10 1.55 0.00 0.00 -2.23 0.00 0.00 60.65 60.07 1gnd s ILE 259 Cb -0.18 -3.99 0.00 0.00 -1.58 0.00 0.00 42.46 36.71 1gnd s ILE 259 CO 0.12 0.29 0.00 1.15 -1.23 0.00 0.00 174.94 175.27 1gnd n MET 260 N 2.08 0.00 0.00 2.79 0.00 -1.26 -0.97 117.12 119.76 1gnd n MET 260 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.72 1gnd n MET 260 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.68 1gnd n MET 260 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 1gnd n GLU 261 N -0.47 0.00 0.00 3.17 4.07 -1.22 -4.94 120.64 121.25 1gnd n GLU 261 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1gnd n GLU 261 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1gnd n GLU 261 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1gnd n ASN 262 N -0.32 0.00 -1.29 4.31 3.02 -1.26 -3.60 115.26 116.13 1gnd n ASN 262 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1gnd n ASN 262 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1gnd n ASN 262 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gnd n GLY 263 N 0.43 1.43 5.74 7.41 0.00 -1.26 -4.87 105.19 114.08 1gnd n GLY 263 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1gnd n GLY 263 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gnd n LYS 264 N 1.11 0.00 0.00 1.61 4.76 -1.24 -4.62 118.16 119.78 1gnd n LYS 264 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1gnd n LYS 264 Cb 0.31 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.50 1gnd n LYS 264 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1gnd n VAL 265 N 0.00 0.00 -3.25 -0.18 0.31 -0.86 -3.41 118.33 110.94 1gnd n VAL 265 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.32 1gnd n VAL 265 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 1gnd n VAL 265 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1gnd n VAL 266 N 0.00 0.00 0.00 2.52 0.24 -1.26 -4.68 118.33 115.16 1gnd n VAL 266 Ca 0.00 -0.11 0.00 0.00 -2.04 0.00 0.00 64.34 62.19 1gnd n VAL 266 Cb 0.00 0.12 0.00 0.00 -1.47 0.00 0.00 33.84 32.49 1gnd n VAL 266 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1gnd n GLY 267 N -0.08 2.01 3.01 7.63 0.00 -0.14 -4.48 105.19 113.13 1gnd n GLY 267 Ca -0.01 -0.66 -0.20 0.00 0.00 0.00 0.00 46.02 45.15 1gnd n GLY 267 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gnd s VAL 268 N -2.00 0.81 -0.23 1.61 1.01 -0.25 0.14 120.40 121.48 1gnd s VAL 268 Ca 0.00 -0.38 -0.04 0.00 0.00 0.00 0.00 61.98 61.56 1gnd s VAL 268 Cb 0.00 -0.71 -0.00 0.00 0.00 0.00 0.00 36.38 35.66 1gnd s VAL 268 CO 0.00 0.25 -0.03 -0.75 0.00 0.00 0.00 175.10 174.57 1gnd s LYS 269 N 0.13 3.31 -0.07 2.72 2.20 -0.84 -0.41 119.74 126.78 1gnd s LYS 269 Ca -0.02 -0.68 0.01 0.00 -0.36 0.00 0.00 55.97 54.92 1gnd s LYS 269 Cb -0.08 -3.04 0.02 0.00 -1.51 0.00 0.00 37.83 33.22 1gnd s LYS 269 CO 0.00 -0.24 -0.06 0.45 -0.36 0.00 0.00 175.35 175.15 1gnd s SER 270 N 1.47 1.51 -1.30 1.43 0.15 0.83 -0.65 113.70 117.15 1gnd s SER 270 Ca 0.05 -0.19 -0.13 0.00 0.70 0.00 0.00 55.95 56.38 1gnd s SER 270 Cb -0.15 -0.61 0.00 0.00 -1.71 0.00 0.00 66.02 63.56 1gnd s SER 270 CO -0.03 -0.08 0.55 -0.62 1.20 0.00 0.00 173.24 174.27 1gnd n GLU 271 N 4.40 -1.92 0.00 5.44 1.02 -1.26 -1.43 120.64 126.90 1gnd n GLU 271 Ca -0.18 0.34 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 1gnd n GLU 271 Cb 0.51 -4.00 0.00 0.00 -0.02 0.00 0.00 31.44 27.93 1gnd n GLU 271 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gnd n GLY 272 N -1.95 1.21 3.76 0.62 0.00 -1.26 -4.97 105.19 102.60 1gnd n GLY 272 Ca -0.21 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 1gnd n GLY 272 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gnd s GLU 273 N 0.00 3.02 -0.07 1.61 2.02 -0.51 -5.00 118.70 119.76 1gnd s GLU 273 Ca 0.00 1.81 0.03 0.00 0.02 0.00 0.00 54.97 56.84 1gnd s GLU 273 Cb 0.00 -1.94 0.00 0.00 0.10 0.00 0.00 34.13 32.29 1gnd s GLU 273 CO 0.00 -1.16 -0.17 0.08 0.02 0.00 0.00 175.26 174.02 1gnd s VAL 274 N -1.60 1.53 -0.04 2.63 1.01 -1.26 -0.12 120.40 122.54 1gnd s VAL 274 Ca 0.77 -0.72 0.06 0.00 0.00 0.00 0.00 61.98 62.09 1gnd s VAL 274 Cb -0.30 -1.34 -0.01 0.00 0.00 0.00 0.00 36.38 34.73 1gnd s VAL 274 CO 0.33 0.44 -0.24 0.00 0.00 0.00 0.00 175.10 175.63 1gnd s ALA 275 N 0.39 2.02 0.31 5.51 0.00 0.45 -4.87 121.76 125.58 1gnd s ALA 275 Ca -0.13 -1.00 -0.08 0.00 0.00 0.00 0.00 51.96 50.75 1gnd s ALA 275 Cb -0.15 -0.59 -0.06 0.00 0.00 0.00 0.00 23.12 22.31 1gnd s ALA 275 CO 0.05 0.42 0.62 1.03 0.00 0.00 0.00 175.76 177.89 1gnd s ARG 276 N -0.27 3.72 0.07 0.00 1.81 -0.79 -1.09 118.95 122.41 1gnd s ARG 276 Ca 0.01 0.22 -0.25 0.00 -1.72 0.00 0.00 55.73 53.99 1gnd s ARG 276 Cb -0.12 -2.56 0.06 0.00 -0.45 0.00 0.00 34.95 31.88 1gnd s ARG 276 CO 0.02 0.16 0.59 0.00 -0.68 0.00 0.00 175.30 175.39 1gnd n LYS 278 N 0.17 0.65 -4.02 0.00 5.02 -0.59 -4.55 118.16 114.85 1gnd n LYS 278 Ca -0.18 0.27 -0.09 0.00 -2.02 0.00 0.00 58.31 56.29 1gnd n LYS 278 Cb 0.62 -1.76 -0.11 0.00 -0.02 0.00 0.00 35.03 33.76 1gnd n LYS 278 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1gnd s GLN 279 N -2.58 0.41 -0.02 1.97 -0.21 -1.10 -4.75 119.66 113.37 1gnd s GLN 279 Ca -0.08 -0.76 0.03 0.00 0.02 0.00 0.00 55.36 54.58 1gnd s GLN 279 Cb 0.08 0.07 -0.00 0.00 1.00 0.00 0.00 33.01 34.15 1gnd s GLN 279 CO 0.82 -0.05 -0.11 -1.17 -2.12 0.00 0.00 175.29 172.66 1gnd s LEU 280 N -1.78 1.92 -0.04 2.90 2.96 -0.70 -2.63 118.68 121.31 1gnd s LEU 280 Ca -0.10 -0.21 0.06 0.00 -0.22 0.00 0.00 54.13 53.66 1gnd s LEU 280 Cb -0.06 -0.61 -0.02 0.00 0.50 0.00 0.00 46.19 46.00 1gnd s LEU 280 CO -0.02 0.11 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.25 1gnd s ILE 281 N -0.07 2.21 0.20 6.68 1.01 -0.72 0.09 121.20 130.60 1gnd s ILE 281 Ca 0.01 -1.03 -0.23 0.00 0.00 0.00 0.00 60.65 59.40 1gnd s ILE 281 Cb -0.07 -1.80 0.05 0.00 0.01 0.00 0.00 42.46 40.66 1gnd s ILE 281 CO 0.00 0.58 0.69 0.00 0.00 0.00 0.00 174.94 176.21 1gnd s ASP 283 N -2.81 5.46 0.40 0.00 1.47 -1.16 -1.51 116.67 118.52 1gnd s ASP 283 Ca 0.06 0.12 0.14 0.00 1.18 0.00 0.00 52.55 54.05 1gnd s ASP 283 Cb -0.03 -1.13 0.98 0.00 -0.34 0.00 0.00 42.92 42.40 1gnd s ASP 283 CO -0.04 -1.00 1.87 -0.65 0.68 0.00 0.00 175.17 176.03 1gnd h PRO 284 N 0.16 0.49 0.00 2.11 0.11 -1.94 -2.76 132.00 130.17 1gnd h PRO 284 Ca -0.44 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1gnd h PRO 284 Cb 1.28 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1gnd h PRO 284 CO 0.54 0.33 0.00 0.66 -0.21 0.00 0.00 178.00 179.32 1gnd h SER 285 N 0.51 0.00 0.48 -2.05 4.64 -1.96 -1.99 113.55 113.17 1gnd h SER 285 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 1gnd h SER 285 Cb 0.94 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 1gnd h SER 285 CO -0.18 0.00 -0.55 -1.22 -0.87 0.00 0.00 176.83 174.01 1gnd n TYR 286 N -2.60 0.02 -3.14 4.77 4.01 -1.04 -4.52 117.16 114.67 1gnd n TYR 286 Ca -0.02 0.01 -0.19 0.00 -0.16 0.00 0.00 57.90 57.54 1gnd n TYR 286 Cb 0.05 -0.25 -0.03 0.00 -0.31 0.00 0.00 39.34 38.80 1gnd n TYR 286 CO 0.00 0.00 0.00 1.33 -0.46 0.00 0.00 176.86 177.73 1gnd n VAL 287 N -1.53 -0.29 -0.11 -0.72 0.24 -0.75 -4.98 118.33 110.18 1gnd n VAL 287 Ca 0.05 -4.09 0.26 0.00 -2.04 0.00 0.00 64.34 58.53 1gnd n VAL 287 Cb 0.34 -0.50 0.72 0.00 -1.47 0.00 0.00 33.84 32.93 1gnd n VAL 287 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 1gnd h PRO 288 N 3.29 0.00 -0.20 7.34 0.11 -1.79 -0.19 132.00 140.56 1gnd h PRO 288 Ca 0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1gnd h PRO 288 Cb 0.96 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1gnd h PRO 288 CO 0.45 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.84 1gnd n ASP 289 N -4.13 1.72 -1.15 -2.05 5.75 -1.26 -3.79 116.55 111.65 1gnd n ASP 289 Ca 0.16 -1.76 -0.00 0.00 -0.01 0.00 0.00 54.79 53.18 1gnd n ASP 289 Cb 0.89 -0.13 0.13 0.00 -1.03 0.00 0.00 41.12 40.98 1gnd n ASP 289 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1gnd n ARG 290 N 0.37 1.66 -3.87 0.11 1.74 -0.08 -5.03 116.66 111.55 1gnd n ARG 290 Ca 0.15 -3.23 -0.10 0.00 -0.77 0.00 0.00 57.85 53.91 1gnd n ARG 290 Cb 0.33 -1.43 -0.08 0.00 -1.02 0.00 0.00 32.46 30.25 1gnd n ARG 290 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1gnd s VAL 291 N -2.91 0.13 0.05 1.55 1.01 -1.25 -1.40 120.40 117.58 1gnd s VAL 291 Ca 0.39 -1.06 0.04 0.00 0.00 0.00 0.00 61.98 61.35 1gnd s VAL 291 Cb 0.38 -1.08 -0.02 0.00 0.00 0.00 0.00 36.38 35.65 1gnd s VAL 291 CO -0.07 -0.58 -0.13 0.00 0.00 0.00 0.00 175.10 174.32 1gnd s ARG 292 N -3.07 0.80 -0.21 2.72 1.70 -0.17 -4.84 118.95 115.87 1gnd s ARG 292 Ca -0.01 -0.81 -0.29 0.00 -0.47 0.00 0.00 55.73 54.15 1gnd s ARG 292 Cb 0.01 -0.76 0.00 0.00 -0.57 0.00 0.00 34.95 33.64 1gnd s ARG 292 CO -0.07 0.18 1.08 0.21 -1.08 0.00 0.00 175.30 175.62 1gnd s LYS 293 N -1.40 4.26 0.00 3.89 2.20 -1.26 -1.48 119.74 125.96 1gnd s LYS 293 Ca -0.02 1.41 0.25 0.00 -0.36 0.00 0.00 55.97 57.26 1gnd s LYS 293 Cb -0.09 -3.66 0.55 0.00 -1.51 0.00 0.00 37.83 33.13 1gnd s LYS 293 CO 0.01 -0.63 1.46 0.00 -0.36 0.00 0.00 175.35 175.84 1gnd n ALA 294 N 6.31 2.50 0.00 3.13 0.00 0.21 -4.97 120.51 127.68 1gnd n ALA 294 Ca 0.12 -0.63 0.00 0.00 0.00 0.00 0.00 53.44 52.93 1gnd n ALA 294 Cb 0.46 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.95 1gnd n ALA 294 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gnd n GLY 295 N 1.29 0.81 3.09 0.00 0.00 -1.22 -4.91 105.19 104.24 1gnd n GLY 295 Ca 0.16 -2.01 -0.11 0.00 0.00 0.00 0.00 46.02 44.06 1gnd n GLY 295 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1gnd s GLN 296 N -1.42 0.60 0.05 1.61 -0.21 -1.26 0.13 119.66 119.16 1gnd s GLN 296 Ca 0.00 -0.96 0.06 0.00 0.02 0.00 0.00 55.36 54.48 1gnd s GLN 296 Cb 0.00 -0.17 -0.02 0.00 1.00 0.00 0.00 33.01 33.81 1gnd s GLN 296 CO 0.00 0.00 -0.16 0.14 -2.12 0.00 0.00 175.29 173.16 1gnd s VAL 297 N -2.30 1.25 -0.01 1.09 -7.23 -0.62 -1.16 120.40 111.41 1gnd s VAL 297 Ca -0.03 -1.10 0.03 0.00 -1.81 0.00 0.00 61.98 59.07 1gnd s VAL 297 Cb -0.04 -1.13 -0.03 0.00 0.56 0.00 0.00 36.38 35.74 1gnd s VAL 297 CO -0.02 0.01 -0.07 -0.63 -0.31 0.00 0.00 175.10 174.08 1gnd s ILE 298 N -0.91 3.63 -0.04 -0.62 1.01 -0.63 -1.28 121.20 122.35 1gnd s ILE 298 Ca 0.02 -0.71 -0.02 0.00 0.00 0.00 0.00 60.65 59.95 1gnd s ILE 298 Cb -0.08 -2.55 0.03 0.00 0.01 0.00 0.00 42.46 39.87 1gnd s ILE 298 CO 0.02 0.44 0.08 -0.60 0.00 0.00 0.00 174.94 174.88 1gnd s ARG 299 N -1.26 -0.01 -0.18 2.79 3.52 -0.24 -2.61 118.95 120.96 1gnd s ARG 299 Ca 0.16 0.33 0.01 0.00 -0.13 0.00 0.00 55.73 56.10 1gnd s ARG 299 Cb -0.11 -0.30 0.02 0.00 -1.56 0.00 0.00 34.95 32.99 1gnd s ARG 299 CO 0.06 -0.23 -0.19 0.42 -0.81 0.00 0.00 175.30 174.55 1gnd s ILE 300 N 1.54 2.19 -0.19 4.11 1.01 -0.34 -0.73 121.20 128.79 1gnd s ILE 300 Ca -0.04 -0.90 -0.17 0.00 0.00 0.00 0.00 60.65 59.54 1gnd s ILE 300 Cb -0.12 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 1gnd s ILE 300 CO -0.04 0.53 0.44 -0.63 0.00 0.00 0.00 174.94 175.24 1gnd s ILE 301 N 1.22 5.17 -0.10 2.92 1.01 -0.61 -1.29 121.20 129.52 1gnd s ILE 301 Ca 0.03 0.79 0.04 0.00 0.00 0.00 0.00 60.65 61.51 1gnd s ILE 301 Cb -0.14 -3.77 -0.00 0.00 0.01 0.00 0.00 42.46 38.57 1gnd s ILE 301 CO -0.10 0.24 -0.23 0.00 0.00 0.00 0.00 174.94 174.84 1gnd s ILE 303 N 0.34 5.33 0.13 0.00 1.01 -0.28 -1.37 121.20 126.36 1gnd s ILE 303 Ca -0.18 0.40 0.08 0.00 0.00 0.00 0.00 60.65 60.95 1gnd s ILE 303 Cb -0.18 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 38.68 1gnd s ILE 303 CO 0.09 0.37 -0.19 -0.76 0.00 0.00 0.00 174.94 174.45 1gnd s LEU 304 N 0.69 2.36 -0.25 2.97 1.43 -0.43 -0.74 118.68 124.71 1gnd s LEU 304 Ca 0.13 -0.76 0.11 0.00 -1.03 0.00 0.00 54.13 52.58 1gnd s LEU 304 Cb -0.13 -0.83 0.48 0.00 0.03 0.00 0.00 46.19 45.74 1gnd s LEU 304 CO 0.03 0.01 1.39 -1.54 0.23 0.00 0.00 176.35 176.46 1gnd n SER 305 N 0.77 2.48 -3.56 2.29 3.41 -1.26 -1.10 113.62 116.65 1gnd n SER 305 Ca -0.17 -3.66 -0.17 0.00 -0.26 0.00 0.00 58.87 54.62 1gnd n SER 305 Cb 0.55 -0.59 -0.06 0.00 -0.26 0.00 0.00 64.21 63.85 1gnd n SER 305 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 1gnd s HIS 306 N -3.17 -0.70 0.85 7.33 0.00 -1.26 -4.94 115.29 113.40 1gnd s HIS 306 Ca 0.42 1.41 -0.11 0.00 -3.00 0.00 0.00 55.06 53.78 1gnd s HIS 306 Cb 0.38 0.36 0.10 0.00 -4.00 0.00 0.00 32.58 29.42 1gnd s HIS 306 CO -0.00 -0.52 1.10 -2.14 -1.00 0.00 0.00 174.74 172.18 1gnd s PRO 307 N -0.62 1.63 0.15 -0.38 0.02 -1.26 -4.88 135.00 129.67 1gnd s PRO 307 Ca -0.07 1.18 -0.30 0.00 0.02 0.00 0.00 61.00 61.82 1gnd s PRO 307 Cb -0.02 -1.82 -0.08 0.00 0.02 0.00 0.00 34.50 32.60 1gnd s PRO 307 CO 0.07 -2.09 1.29 0.42 -0.33 0.00 0.00 177.00 176.36 1gnd s ILE 308 N -2.83 3.44 0.65 2.83 1.01 -1.26 -4.98 121.20 120.06 1gnd s ILE 308 Ca 0.63 1.12 -0.16 0.00 0.00 0.00 0.00 60.65 62.25 1gnd s ILE 308 Cb -0.19 -3.72 -0.00 0.00 0.01 0.00 0.00 42.46 38.56 1gnd s ILE 308 CO 0.57 0.14 1.15 -1.59 0.00 0.00 0.00 174.94 175.21 1gnd s LYS 309 N 0.33 2.72 -0.06 2.79 -2.85 -1.26 -3.23 119.74 118.18 1gnd s LYS 309 Ca 0.58 1.56 0.00 0.00 -1.00 0.00 0.00 55.97 57.11 1gnd s LYS 309 Cb -0.35 -1.93 0.00 0.00 -2.06 0.00 0.00 37.83 33.50 1gnd s LYS 309 CO 0.35 -1.34 0.00 0.09 0.10 0.00 0.00 175.35 174.54 1gnd n ASN 310 N -2.25 -3.39 -4.57 0.03 5.03 -1.26 -5.01 115.26 103.83 1gnd n ASN 310 Ca 0.12 0.01 -0.25 0.00 0.87 0.00 0.00 54.58 55.33 1gnd n ASN 310 Cb 0.51 -0.94 -0.09 0.00 -1.02 0.00 0.00 39.78 38.24 1gnd n ASN 310 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1gnd s THR 311 N -1.91 3.12 -1.31 3.41 -4.23 -1.20 -4.87 115.64 108.65 1gnd s THR 311 Ca 0.00 -1.86 -0.09 0.00 -1.18 0.00 0.00 61.69 58.57 1gnd s THR 311 Cb 0.00 -2.59 -0.09 0.00 1.34 0.00 0.00 72.50 71.16 1gnd s THR 311 CO 0.00 -0.23 2.99 -3.20 -0.54 0.00 0.00 174.62 173.65 1gnd n ASN 312 N -0.31 8.10 -3.76 3.99 5.15 -1.26 -4.51 115.26 122.66 1gnd n ASN 312 Ca -0.09 -2.64 -0.25 0.00 -0.60 0.00 0.00 54.58 51.00 1gnd n ASN 312 Cb 0.57 -1.51 0.04 0.00 -0.53 0.00 0.00 39.78 38.35 1gnd n ASN 312 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1gnd n ASP 313 N 3.12 -2.98 -4.76 1.20 8.00 -1.26 -4.92 116.55 114.94 1gnd n ASP 313 Ca 0.71 -0.77 -0.41 0.00 0.71 0.00 0.00 54.79 55.03 1gnd n ASP 313 Cb 0.34 -4.12 -0.02 0.00 -0.02 0.00 0.00 41.12 37.30 1gnd n ASP 313 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gnd s ALA 314 N -3.49 3.50 -1.16 2.24 0.00 -1.26 -4.92 121.76 116.67 1gnd s ALA 314 Ca 0.30 1.22 0.28 0.00 0.00 0.00 0.00 51.96 53.76 1gnd s ALA 314 Cb -0.15 -3.47 1.09 0.00 0.00 0.00 0.00 23.12 20.59 1gnd s ALA 314 CO 0.81 -0.60 1.81 0.27 0.00 0.00 0.00 175.76 178.05 1gnd n ASN 315 N 1.08 0.20 -3.58 0.00 2.04 -1.26 -4.73 115.26 109.02 1gnd n ASN 315 Ca 0.01 0.07 -0.13 0.00 -0.44 0.00 0.00 54.58 54.09 1gnd n ASN 315 Cb 0.42 -0.23 -0.06 0.00 -2.53 0.00 0.00 39.78 37.38 1gnd n ASN 315 CO 0.00 0.00 0.00 -0.94 -0.44 0.00 0.00 177.26 175.88 1gnd s SER 316 N -2.87 -0.51 0.06 0.53 1.04 -1.26 -3.60 113.70 107.09 1gnd s SER 316 Ca 0.17 0.72 -0.27 0.00 0.48 0.00 0.00 55.95 57.06 1gnd s SER 316 Cb 0.19 0.64 0.09 0.00 0.10 0.00 0.00 66.02 67.04 1gnd s SER 316 CO 0.55 -0.36 0.83 0.00 0.98 0.00 0.00 173.24 175.24 1gnd s GLN 318 N -3.29 2.98 -0.05 0.00 2.00 -0.82 -0.84 119.66 119.62 1gnd s GLN 318 Ca 0.05 -0.69 0.01 0.00 -2.00 0.00 0.00 55.36 52.73 1gnd s GLN 318 Cb -0.01 -2.51 0.02 0.00 0.80 0.00 0.00 33.01 31.31 1gnd s GLN 318 CO -0.08 0.40 -0.05 0.42 -0.50 0.00 0.00 175.29 175.48 1gnd s ILE 319 N -0.14 0.62 -0.06 -2.34 1.01 0.49 -0.48 121.20 120.30 1gnd s ILE 319 Ca -0.01 -0.16 0.05 0.00 0.00 0.00 0.00 60.65 60.54 1gnd s ILE 319 Cb -0.14 -0.64 -0.02 0.00 0.01 0.00 0.00 42.46 41.68 1gnd s ILE 319 CO 0.03 0.25 -0.21 -0.63 0.00 0.00 0.00 174.94 174.38 1gnd s ILE 320 N 0.99 2.42 -0.33 2.92 1.01 -1.03 -1.42 121.20 125.76 1gnd s ILE 320 Ca -0.10 -0.94 0.03 0.00 0.00 0.00 0.00 60.65 59.64 1gnd s ILE 320 Cb -0.14 -1.91 0.09 0.00 0.01 0.00 0.00 42.46 40.51 1gnd s ILE 320 CO -0.00 0.57 0.04 -0.63 0.00 0.00 0.00 174.94 174.92 1gnd s ILE 321 N -0.32 2.38 0.43 2.92 1.01 -0.50 -1.55 121.20 125.58 1gnd s ILE 321 Ca 0.02 -2.19 -0.26 0.00 0.00 0.00 0.00 60.65 58.22 1gnd s ILE 321 Cb -0.13 -2.69 -0.09 0.00 0.01 0.00 0.00 42.46 39.57 1gnd s ILE 321 CO 0.02 -0.51 1.40 -2.84 0.00 0.00 0.00 174.94 173.01 1gnd s PRO 322 N 0.96 3.79 0.38 2.79 0.02 -1.26 -2.37 135.00 139.31 1gnd s PRO 322 Ca 0.07 2.37 0.15 0.00 0.02 0.00 0.00 61.00 63.61 1gnd s PRO 322 Cb -0.20 -2.71 1.00 0.00 0.02 0.00 0.00 34.50 32.61 1gnd s PRO 322 CO -0.07 -0.71 1.80 -0.56 -0.33 0.00 0.00 177.00 177.13 1gnd h GLN 323 N 2.47 0.49 0.00 5.54 3.07 -1.85 -1.44 115.11 123.39 1gnd h GLN 323 Ca -0.51 -0.03 -0.05 0.00 0.09 0.00 0.00 58.65 58.16 1gnd h GLN 323 Cb 1.26 -0.11 -0.01 0.00 0.08 0.00 0.00 27.48 28.70 1gnd h GLN 323 CO 0.62 0.32 -0.22 -0.97 0.09 0.00 0.00 178.83 178.67 1gnd h ASN 324 N 0.50 0.00 0.60 0.06 -1.24 -1.90 -1.40 115.58 112.21 1gnd h ASN 324 Ca 0.55 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.56 1gnd h ASN 324 Cb 1.23 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.28 1gnd h ASN 324 CO -0.28 0.22 0.00 0.00 -1.29 0.00 0.00 177.43 176.08 1gnd n GLN 325 N -3.95 0.34 -0.31 6.67 1.13 -0.54 -3.62 117.38 117.09 1gnd n GLN 325 Ca -0.02 0.02 0.01 0.00 -1.94 0.00 0.00 57.00 55.07 1gnd n GLN 325 Cb 0.30 -1.50 0.02 0.00 0.11 0.00 0.00 30.24 29.16 1gnd n GLN 325 CO 0.00 0.00 0.00 1.33 -1.44 0.00 0.00 177.06 176.95 1gnd n VAL 326 N -1.32 0.27 -3.41 5.09 0.24 -1.00 -4.84 118.33 113.36 1gnd n VAL 326 Ca 0.12 -0.32 -0.20 0.00 -2.04 0.00 0.00 64.34 61.91 1gnd n VAL 326 Cb 0.24 0.52 0.05 0.00 -1.47 0.00 0.00 33.84 33.19 1gnd n VAL 326 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1gnd n ASN 327 N -0.19 -6.25 -4.01 -1.34 3.02 -0.90 -5.03 115.26 100.55 1gnd n ASN 327 Ca 0.02 -0.75 -0.14 0.00 -0.03 0.00 0.00 54.58 53.68 1gnd n ASN 327 Cb 0.63 -4.40 -0.10 0.00 -0.61 0.00 0.00 39.78 35.30 1gnd n ASN 327 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1gnd s ARG 328 N -4.82 1.33 -0.06 3.52 0.52 -0.58 -5.05 118.95 113.81 1gnd s ARG 328 Ca 0.39 -1.72 0.13 0.00 -0.52 0.00 0.00 55.73 54.01 1gnd s ARG 328 Cb -0.09 0.27 0.42 0.00 0.52 0.00 0.00 34.95 36.07 1gnd s ARG 328 CO 0.79 -0.45 1.35 1.63 0.02 0.00 0.00 175.30 178.64 1gnd n LYS 329 N -0.35 2.97 -3.66 3.54 5.02 -1.26 -4.36 118.16 120.05 1gnd n LYS 329 Ca 0.03 -2.37 -0.14 0.00 -2.02 0.00 0.00 58.31 53.82 1gnd n LYS 329 Cb 0.65 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 34.09 1gnd n LYS 329 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1gnd s SER 330 N -1.25 -0.66 0.78 4.39 1.04 -1.26 -5.05 113.70 111.69 1gnd s SER 330 Ca 0.32 1.28 -0.11 0.00 0.48 0.00 0.00 55.95 57.92 1gnd s SER 330 Cb 0.21 1.30 0.06 0.00 0.10 0.00 0.00 66.02 67.68 1gnd s SER 330 CO 0.15 -0.22 1.10 -1.81 0.98 0.00 0.00 173.24 173.44 1gnd s ASP 331 N 0.33 4.37 -0.09 7.02 1.01 -1.26 -4.49 116.67 123.56 1gnd s ASP 331 Ca -0.00 1.89 0.02 0.00 0.71 0.00 0.00 52.55 55.17 1gnd s ASP 331 Cb -0.04 -2.53 -0.02 0.00 1.01 0.00 0.00 42.92 41.34 1gnd s ASP 331 CO 0.01 -2.13 -0.14 -0.63 0.21 0.00 0.00 175.17 172.49 1gnd s ILE 332 N -2.80 3.06 0.09 0.77 1.01 -1.00 -4.51 121.20 117.82 1gnd s ILE 332 Ca 0.63 -0.69 0.10 0.00 0.00 0.00 0.00 60.65 60.69 1gnd s ILE 332 Cb -0.18 -2.24 -0.04 0.00 0.01 0.00 0.00 42.46 40.01 1gnd s ILE 332 CO 0.55 0.56 -0.26 -0.31 0.00 0.00 0.00 174.94 175.47 1gnd s TYR 333 N -0.17 2.27 -0.04 3.97 1.51 -0.54 -1.41 117.35 122.94 1gnd s TYR 333 Ca -0.00 -0.39 -0.01 0.00 -1.01 0.00 0.00 57.07 55.65 1gnd s TYR 333 Cb -0.13 -1.28 0.03 0.00 -0.11 0.00 0.00 41.96 40.46 1gnd s TYR 333 CO 0.03 0.25 0.04 0.08 -1.11 0.00 0.00 175.55 174.84 1gnd s VAL 334 N -0.96 -0.04 0.10 0.71 1.01 -0.51 -1.52 120.40 119.20 1gnd s VAL 334 Ca 0.13 0.33 0.09 0.00 0.00 0.00 0.00 61.98 62.52 1gnd s VAL 334 Cb -0.10 -0.17 -0.04 0.00 0.00 0.00 0.00 36.38 36.07 1gnd s VAL 334 CO 0.04 0.16 -0.23 0.00 0.00 0.00 0.00 175.10 175.08 1gnd s MET 336 N -1.85 0.21 0.14 0.00 1.75 -0.02 -1.37 119.30 118.15 1gnd s MET 336 Ca 0.08 -0.07 -0.00 0.00 -1.25 0.00 0.00 55.69 54.45 1gnd s MET 336 Cb -0.10 -0.22 -0.04 0.00 2.84 0.00 0.00 34.83 37.31 1gnd s MET 336 CO 0.04 0.03 0.04 0.96 -0.65 0.00 0.00 175.02 175.45 1gnd s ILE 337 N 0.05 0.29 0.00 10.11 -0.00 -0.77 -1.65 121.20 129.23 1gnd s ILE 337 Ca -0.00 -1.93 0.00 0.00 -0.00 0.00 0.00 60.65 58.72 1gnd s ILE 337 Cb -0.02 -2.07 0.00 0.00 -0.00 0.00 0.00 42.46 40.37 1gnd s ILE 337 CO -0.00 -0.47 0.00 -1.54 -0.00 0.00 0.00 174.94 172.93 1gnd n SER 338 N -0.14 0.00 0.23 4.36 3.41 -1.24 -0.54 113.62 119.70 1gnd n SER 338 Ca -0.06 -0.24 0.13 0.00 -0.26 0.00 0.00 58.87 58.44 1gnd n SER 338 Cb 0.64 0.00 0.67 0.00 -0.26 0.00 0.00 64.21 65.26 1gnd n SER 338 CO 0.00 0.00 0.00 0.10 -0.16 0.00 0.00 175.04 174.98 1gnd h TYR 339 N 0.24 0.00 0.00 7.33 -0.00 -1.67 -0.30 116.97 122.57 1gnd h TYR 339 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 58.73 58.66 1gnd h TYR 339 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.72 1gnd h TYR 339 CO 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 178.16 177.82 1gnd h ALA 340 N 1.62 1.19 -0.58 0.10 0.00 -1.88 -1.88 119.26 117.82 1gnd h ALA 340 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1gnd h ALA 340 Cb 0.32 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1gnd h ALA 340 CO 0.00 0.43 0.00 0.72 0.00 0.00 0.00 179.25 180.40 1gnd n HIS 341 N -3.77 1.18 -3.68 0.00 8.25 -0.13 -4.97 115.22 112.10 1gnd n HIS 341 Ca -0.01 -0.60 -0.25 0.00 -0.26 0.00 0.00 57.72 56.60 1gnd n HIS 341 Cb 0.43 -0.17 0.06 0.00 1.12 0.00 0.00 29.99 31.43 1gnd n HIS 341 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1gnd n ASN 342 N 0.98 -5.21 0.00 0.41 3.02 -0.71 -0.89 115.26 112.86 1gnd n ASN 342 Ca 0.23 -0.63 0.00 0.00 -0.03 0.00 0.00 54.58 54.14 1gnd n ASN 342 Cb 0.77 -4.65 0.00 0.00 -0.61 0.00 0.00 39.78 35.29 1gnd n ASN 342 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1gnd n VAL 343 N -4.79 0.07 -3.99 2.41 0.24 -1.23 -4.24 118.33 106.80 1gnd n VAL 343 Ca -0.03 -0.52 -0.08 0.00 -2.04 0.00 0.00 64.34 61.67 1gnd n VAL 343 Cb 0.57 1.00 -0.09 0.00 -1.47 0.00 0.00 33.84 33.85 1gnd n VAL 343 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1gnd s ALA 344 N -0.07 0.22 0.67 2.33 0.00 -1.19 -1.79 121.76 121.93 1gnd s ALA 344 Ca 0.00 -0.99 -0.14 0.00 0.00 0.00 0.00 51.96 50.84 1gnd s ALA 344 Cb 0.00 0.51 0.01 0.00 0.00 0.00 0.00 23.12 23.64 1gnd s ALA 344 CO 0.00 -0.47 1.09 0.00 0.00 0.00 0.00 175.76 176.38 1gnd s ALA 345 N -3.92 2.48 -0.20 0.00 0.00 -1.24 -4.10 121.76 114.77 1gnd s ALA 345 Ca 0.10 0.44 -0.41 0.00 0.00 0.00 0.00 51.96 52.09 1gnd s ALA 345 Cb 0.06 -3.29 -0.17 0.00 0.00 0.00 0.00 23.12 19.72 1gnd s ALA 345 CO -0.07 -1.30 1.53 0.94 0.00 0.00 0.00 175.76 176.85 1gnd n GLN 346 N -2.63 0.76 -0.84 0.00 -0.06 -1.26 -1.33 117.38 112.02 1gnd n GLN 346 Ca 0.10 0.28 0.00 0.00 -2.00 0.00 0.00 57.00 55.37 1gnd n GLN 346 Cb 0.52 -1.89 0.00 0.00 -4.06 0.00 0.00 30.24 24.82 1gnd n GLN 346 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1gnd n GLY 347 N 3.38 0.70 3.56 1.69 0.00 -1.26 -5.00 105.19 108.27 1gnd n GLY 347 Ca 0.25 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.97 1gnd n GLY 347 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gnd s LYS 348 N -0.16 2.10 0.07 1.61 -0.14 -0.44 -4.55 119.74 118.23 1gnd s LYS 348 Ca 0.00 -1.03 0.07 0.00 -1.36 0.00 0.00 55.97 53.65 1gnd s LYS 348 Cb 0.00 -2.29 -0.03 0.00 -1.68 0.00 0.00 37.83 33.83 1gnd s LYS 348 CO 0.00 0.51 -0.19 0.71 -0.76 0.00 0.00 175.35 175.62 1gnd s TYR 349 N -1.19 1.62 -0.18 3.18 1.51 -0.26 -2.77 117.35 119.26 1gnd s TYR 349 Ca 0.21 -0.40 0.01 0.00 -1.01 0.00 0.00 57.07 55.87 1gnd s TYR 349 Cb -0.11 -0.92 0.03 0.00 -0.11 0.00 0.00 41.96 40.85 1gnd s TYR 349 CO 0.13 0.13 -0.14 0.42 -1.11 0.00 0.00 175.55 174.97 1gnd s ILE 350 N -1.03 1.79 -0.16 2.71 1.01 0.30 -1.32 121.20 124.49 1gnd s ILE 350 Ca 0.05 -0.92 0.01 0.00 0.00 0.00 0.00 60.65 59.78 1gnd s ILE 350 Cb -0.09 -1.73 0.01 0.00 0.01 0.00 0.00 42.46 40.66 1gnd s ILE 350 CO 0.03 0.35 -0.18 0.00 0.00 0.00 0.00 174.94 175.14 1gnd s ALA 351 N 1.37 2.39 -0.22 9.38 0.00 -0.47 -1.85 121.76 132.35 1gnd s ALA 351 Ca 0.02 -1.13 -0.04 0.00 0.00 0.00 0.00 51.96 50.81 1gnd s ALA 351 Cb -0.14 -1.18 -0.01 0.00 0.00 0.00 0.00 23.12 21.78 1gnd s ALA 351 CO -0.10 -0.17 -0.03 0.42 0.00 0.00 0.00 175.76 175.88 1gnd s ILE 352 N 1.03 3.54 -0.16 0.00 1.09 -0.47 -0.69 121.20 125.54 1gnd s ILE 352 Ca -0.01 -0.44 -0.07 0.00 -1.10 0.00 0.00 60.65 59.03 1gnd s ILE 352 Cb -0.14 -2.61 -0.04 0.00 -1.06 0.00 0.00 42.46 38.60 1gnd s ILE 352 CO -0.05 0.42 0.07 0.00 -0.10 0.00 0.00 174.94 175.27 1gnd s ALA 353 N 1.42 3.46 0.04 9.38 0.00 -0.42 -2.40 121.76 133.23 1gnd s ALA 353 Ca 0.05 -0.74 -0.05 0.00 0.00 0.00 0.00 51.96 51.23 1gnd s ALA 353 Cb -0.14 -1.88 -0.01 0.00 0.00 0.00 0.00 23.12 21.08 1gnd s ALA 353 CO -0.02 0.28 0.08 -1.54 0.00 0.00 0.00 175.76 174.56 1gnd s SER 354 N 0.06 0.20 0.13 0.00 1.04 -0.57 -1.20 113.70 113.35 1gnd s SER 354 Ca 0.06 -0.55 -0.26 0.00 0.48 0.00 0.00 55.95 55.68 1gnd s SER 354 Cb -0.12 0.21 0.07 0.00 0.10 0.00 0.00 66.02 66.29 1gnd s SER 354 CO 0.01 -0.49 1.03 0.28 0.98 0.00 0.00 173.24 175.04 1gnd s THR 355 N -2.56 0.00 -0.02 2.02 -1.32 -1.07 -1.47 115.64 111.22 1gnd s THR 355 Ca -0.05 -0.58 -0.22 0.00 -1.21 0.00 0.00 61.69 59.63 1gnd s THR 355 Cb -0.02 -2.07 -0.05 0.00 -1.51 0.00 0.00 72.50 68.86 1gnd s THR 355 CO -0.04 0.00 0.63 -0.89 -2.21 0.00 0.00 174.62 172.11 1gnd s THR 356 N -3.04 4.92 0.12 5.08 2.01 -1.26 -1.61 115.64 121.86 1gnd s THR 356 Ca 0.13 1.32 -0.31 0.00 0.31 0.00 0.00 61.69 63.14 1gnd s THR 356 Cb -0.00 -3.97 -0.08 0.00 0.01 0.00 0.00 72.50 68.45 1gnd s THR 356 CO 0.01 0.37 1.44 -0.69 -0.69 0.00 0.00 174.62 175.07 1gnd s VAL 357 N 0.06 3.15 0.00 3.82 1.01 -0.31 -4.90 120.40 123.23 1gnd s VAL 357 Ca 0.33 0.81 0.00 0.00 0.00 0.00 0.00 61.98 63.12 1gnd s VAL 357 Cb -0.18 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.68 1gnd s VAL 357 CO 0.18 0.06 0.00 -0.62 0.00 0.00 0.00 175.10 174.72 1gnd n GLU 358 N 4.04 2.19 -4.33 2.72 1.02 -1.26 -4.76 120.64 120.26 1gnd n GLU 358 Ca 0.12 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.99 1gnd n GLU 358 Cb 0.41 -0.78 -0.06 0.00 -0.02 0.00 0.00 31.44 30.99 1gnd n GLU 358 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1gnd n THR 359 N -1.08 0.00 0.20 2.62 -2.24 -1.26 -5.02 114.28 107.50 1gnd n THR 359 Ca 0.00 -2.15 0.05 0.00 -2.27 0.00 0.00 64.05 59.67 1gnd n THR 359 Cb 0.00 0.54 0.21 0.00 -2.10 0.00 0.00 70.33 68.98 1gnd n THR 359 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1gnd n THR 360 N -1.04 1.21 -3.06 4.28 -2.24 -1.26 -4.12 114.28 108.05 1gnd n THR 360 Ca -0.15 -0.69 -0.18 0.00 -2.27 0.00 0.00 64.05 60.76 1gnd n THR 360 Cb 0.57 -0.19 -0.02 0.00 -2.10 0.00 0.00 70.33 68.59 1gnd n THR 360 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1gnd n ASP 361 N 0.44 -0.60 -0.29 3.42 -0.08 -1.26 -5.00 116.55 113.17 1gnd n ASP 361 Ca 0.15 -2.96 0.31 0.00 -1.51 0.00 0.00 54.79 50.78 1gnd n ASP 361 Cb 0.64 0.12 0.70 0.00 2.34 0.00 0.00 41.12 44.92 1gnd n ASP 361 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1gnd h PRO 362 N 3.75 0.07 0.00 -0.67 0.13 -2.01 -1.11 132.00 132.16 1gnd h PRO 362 Ca 0.01 -0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.08 1gnd h PRO 362 Cb 0.95 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.05 1gnd h PRO 362 CO 0.41 0.05 -0.30 1.49 -0.23 0.00 0.00 178.00 179.42 1gnd h GLU 363 N 0.08 0.00 0.01 0.86 4.81 -1.96 -2.97 114.58 115.40 1gnd h GLU 363 Ca 0.54 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 59.56 1gnd h GLU 363 Cb 2.00 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 31.37 1gnd h GLU 363 CO -0.06 0.30 -0.91 -0.22 -0.73 0.00 0.00 179.01 177.39 1gnd h LYS 364 N 0.00 0.23 -0.21 1.92 3.64 -1.64 -3.22 116.57 117.29 1gnd h LYS 364 Ca -0.00 -0.26 0.06 0.00 -1.27 0.00 0.00 60.65 59.18 1gnd h LYS 364 Cb 0.92 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.81 1gnd h LYS 364 CO 0.04 0.99 0.17 0.93 -2.27 0.00 0.00 179.45 179.31 1gnd h GLU 365 N 0.12 0.00 -0.13 1.90 5.08 -1.48 -2.11 114.58 117.96 1gnd h GLU 365 Ca -0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1gnd h GLU 365 Cb 1.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.80 1gnd h GLU 365 CO 0.14 0.00 0.00 0.28 -1.00 0.00 0.00 179.01 178.43 1gnd n VAL 366 N -4.24 0.15 -0.25 3.13 0.31 -1.22 -4.43 118.33 111.78 1gnd n VAL 366 Ca 0.02 -0.35 0.04 0.00 -0.01 0.00 0.00 64.34 64.04 1gnd n VAL 366 Cb 0.31 0.52 0.17 0.00 -0.91 0.00 0.00 33.84 33.94 1gnd n VAL 366 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1gnd h GLU 367 N 2.56 0.45 -0.72 5.55 4.39 -1.52 -2.21 114.58 123.08 1gnd h GLU 367 Ca 0.00 -0.03 0.15 0.00 0.34 0.00 0.00 59.36 59.83 1gnd h GLU 367 Cb 0.56 -0.10 -0.11 0.00 -0.10 0.00 0.00 28.75 29.00 1gnd h GLU 367 CO 0.00 0.30 0.15 -1.35 -1.16 0.00 0.00 179.01 176.95 1gnd h PRO 368 N 0.46 0.24 -0.10 2.33 0.11 -1.83 -1.56 132.00 131.66 1gnd h PRO 368 Ca 0.40 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 66.41 1gnd h PRO 368 Cb 0.57 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.63 1gnd h PRO 368 CO -0.38 0.16 -0.24 0.00 -0.21 0.00 0.00 178.00 177.33 1gnd h ALA 369 N 1.60 0.17 0.00 -0.75 0.00 -1.75 -3.24 119.26 115.28 1gnd h ALA 369 Ca 0.40 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1gnd h ALA 369 Cb 0.68 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1gnd h ALA 369 CO -0.51 0.15 -0.03 -0.07 0.00 0.00 0.00 179.25 178.79 1gnd h LEU 370 N -0.10 0.00 -1.18 0.00 3.38 -1.09 -0.62 115.31 115.70 1gnd h LEU 370 Ca -0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1gnd h LEU 370 Cb 0.85 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 1gnd h LEU 370 CO 0.05 0.03 -0.06 -0.33 0.09 0.00 0.00 178.44 178.22 1gnd h GLU 371 N 0.00 0.49 0.00 1.13 5.08 -1.32 -0.63 114.58 119.34 1gnd h GLU 371 Ca -0.00 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1gnd h GLU 371 Cb 0.05 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1gnd h GLU 371 CO 0.00 0.57 0.00 -0.07 -1.00 0.00 0.00 179.01 178.51 1gnd h LEU 372 N 0.47 0.00 0.00 1.33 3.38 -1.19 -2.97 115.31 116.33 1gnd h LEU 372 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1gnd h LEU 372 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1gnd h LEU 372 CO 0.02 0.00 -1.10 0.18 0.09 0.00 0.00 178.44 177.63 1gnd n LEU 373 N -3.00 0.25 0.00 1.67 4.77 -0.80 -4.47 117.00 115.42 1gnd n LEU 373 Ca -0.01 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.74 1gnd n LEU 373 Cb 0.20 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1gnd n LEU 373 CO 0.23 0.06 0.00 -0.62 -1.33 0.00 0.00 177.39 175.73 1gnd n GLU 374 N -1.63 0.00 -1.84 3.23 -0.58 -0.31 -4.18 120.64 115.34 1gnd n GLU 374 Ca -0.00 0.00 -0.27 0.00 -0.42 0.00 0.00 57.16 56.46 1gnd n GLU 374 Cb 0.26 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 31.08 1gnd n GLU 374 CO 0.00 0.00 0.00 -2.14 -0.48 0.00 0.00 177.13 174.51 1gnd s PRO 375 N 0.00 2.24 -0.20 3.49 0.02 -1.26 -4.87 135.00 134.42 1gnd s PRO 375 Ca 0.00 0.41 -0.07 0.00 0.02 0.00 0.00 61.00 61.36 1gnd s PRO 375 Cb 0.00 -4.76 -0.04 0.00 0.02 0.00 0.00 34.50 29.73 1gnd s PRO 375 CO 0.00 -3.50 0.06 0.42 -0.33 0.00 0.00 177.00 173.65 1gnd s ILE 376 N 11.48 4.61 -0.00 2.83 1.01 -1.26 -4.72 121.20 135.16 1gnd s ILE 376 Ca 0.80 -0.09 -0.24 0.00 0.00 0.00 0.00 60.65 61.12 1gnd s ILE 376 Cb -0.11 -3.10 -0.18 0.00 0.01 0.00 0.00 42.46 39.07 1gnd s ILE 376 CO 0.11 0.42 1.30 0.44 0.00 0.00 0.00 174.94 177.21 1gnd h ASP 377 N 7.15 0.12 -3.86 3.58 3.32 -1.27 -3.47 116.42 122.00 1gnd h ASP 377 Ca -0.36 -0.48 -0.11 0.00 0.02 0.00 0.00 57.03 56.10 1gnd h ASP 377 Cb 1.17 -0.03 -0.24 0.00 0.22 0.00 0.00 39.33 40.45 1gnd h ASP 377 CO 0.66 0.58 -0.17 -1.58 -1.72 0.00 0.00 179.24 177.00 1gnd s GLN 378 N -4.29 0.54 -0.06 3.56 2.00 -1.18 -4.99 119.66 115.24 1gnd s GLN 378 Ca -0.15 0.66 0.03 0.00 -2.00 0.00 0.00 55.36 53.90 1gnd s GLN 378 Cb 0.03 0.25 -0.02 0.00 0.80 0.00 0.00 33.01 34.06 1gnd s GLN 378 CO 0.70 -0.07 -0.16 0.15 -0.50 0.00 0.00 175.29 175.41 1gnd s LYS 379 N 0.33 2.62 -0.25 1.67 1.02 -1.26 -1.13 119.74 122.74 1gnd s LYS 379 Ca -0.01 -0.72 0.00 0.00 0.02 0.00 0.00 55.97 55.26 1gnd s LYS 379 Cb -0.04 -2.38 0.07 0.00 -0.52 0.00 0.00 37.83 34.96 1gnd s LYS 379 CO -0.00 0.54 -0.01 -0.06 -0.92 0.00 0.00 175.35 174.90 1gnd s PHE 380 N -0.52 2.12 -0.00 3.18 0.08 -0.16 -4.99 117.98 117.70 1gnd s PHE 380 Ca 0.07 -1.67 -0.20 0.00 0.12 0.00 0.00 56.93 55.25 1gnd s PHE 380 Cb -0.12 -1.59 -0.05 0.00 -0.57 0.00 0.00 43.02 40.69 1gnd s PHE 380 CO 0.01 -0.77 0.58 0.08 -0.10 0.00 0.00 175.22 175.02 1gnd s VAL 381 N 1.48 4.91 -0.09 -0.44 1.01 -1.26 -1.57 120.40 124.44 1gnd s VAL 381 Ca -0.01 1.22 -0.04 0.00 0.00 0.00 0.00 61.98 63.15 1gnd s VAL 381 Cb -0.18 -3.92 0.05 0.00 0.00 0.00 0.00 36.38 32.33 1gnd s VAL 381 CO -0.10 0.43 0.17 0.00 0.00 0.00 0.00 175.10 175.61 1gnd s ALA 382 N -0.27 -0.18 -0.14 5.51 0.00 0.09 -5.02 121.76 121.75 1gnd s ALA 382 Ca 0.30 0.56 -0.04 0.00 0.00 0.00 0.00 51.96 52.78 1gnd s ALA 382 Cb -0.18 -0.86 -0.03 0.00 0.00 0.00 0.00 23.12 22.04 1gnd s ALA 382 CO 0.17 -0.61 0.01 0.42 0.00 0.00 0.00 175.76 175.74 1gnd s ILE 383 N 2.30 4.30 0.07 0.00 1.01 -1.26 -1.08 121.20 126.55 1gnd s ILE 383 Ca 0.03 -0.22 0.07 0.00 0.00 0.00 0.00 60.65 60.53 1gnd s ILE 383 Cb -0.12 -2.88 -0.03 0.00 0.01 0.00 0.00 42.46 39.44 1gnd s ILE 383 CO -0.06 0.52 -0.19 -0.44 0.00 0.00 0.00 174.94 174.77 1gnd s SER 384 N -0.02 2.26 0.21 3.58 0.01 -0.41 -4.99 113.70 114.36 1gnd s SER 384 Ca 0.03 -0.61 -0.09 0.00 1.31 0.00 0.00 55.95 56.60 1gnd s SER 384 Cb -0.13 -0.13 -0.07 0.00 0.21 0.00 0.00 66.02 65.90 1gnd s SER 384 CO 0.02 0.06 0.52 -1.81 0.41 0.00 0.00 173.24 172.43 1gnd s ASP 385 N -1.61 6.61 -0.12 2.44 1.01 -1.26 -1.58 116.67 122.16 1gnd s ASP 385 Ca 0.05 0.87 -0.01 0.00 0.71 0.00 0.00 52.55 54.17 1gnd s ASP 385 Cb -0.09 -2.20 -0.02 0.00 1.01 0.00 0.00 42.92 41.61 1gnd s ASP 385 CO 0.03 -0.05 -0.09 -0.76 0.21 0.00 0.00 175.17 174.51 1gnd s LEU 386 N -2.78 2.96 0.05 1.23 1.43 0.12 -4.94 118.68 116.76 1gnd s LEU 386 Ca 0.46 -0.19 0.07 0.00 -1.03 0.00 0.00 54.13 53.44 1gnd s LEU 386 Cb -0.11 -1.67 -0.03 0.00 0.03 0.00 0.00 46.19 44.41 1gnd s LEU 386 CO 0.22 0.23 -0.21 -0.31 0.23 0.00 0.00 176.35 176.51 1gnd s TYR 387 N -0.00 1.80 0.02 0.29 2.02 -1.26 0.64 117.35 120.85 1gnd s TYR 387 Ca -0.02 -0.38 0.02 0.00 -0.37 0.00 0.00 57.07 56.32 1gnd s TYR 387 Cb -0.14 -1.05 -0.01 0.00 -0.40 0.00 0.00 41.96 40.36 1gnd s TYR 387 CO 0.03 0.11 -0.08 -1.83 -1.57 0.00 0.00 175.55 172.22 1gnd s GLU 388 N -1.32 0.56 0.54 -0.62 -1.05 -0.55 -1.88 118.70 114.39 1gnd s GLU 388 Ca 0.07 -0.47 -0.21 0.00 -0.15 0.00 0.00 54.97 54.21 1gnd s GLU 388 Cb -0.09 -0.47 -0.05 0.00 -0.44 0.00 0.00 34.13 33.08 1gnd s GLU 388 CO 0.02 0.12 1.27 -1.25 0.95 0.00 0.00 175.26 176.37 1gnd s PRO 389 N -0.76 3.20 -0.12 -4.83 0.04 -1.26 -1.00 135.00 130.27 1gnd s PRO 389 Ca -0.02 2.01 0.17 0.00 0.04 0.00 0.00 61.00 63.20 1gnd s PRO 389 Cb -0.06 -2.18 -0.24 0.00 0.04 0.00 0.00 34.50 32.06 1gnd s PRO 389 CO 0.00 -1.07 0.32 -0.89 0.04 0.00 0.00 177.00 175.41 1gnd n ILE 390 N -1.10 1.26 -4.01 0.56 5.41 -0.50 -4.81 119.36 116.18 1gnd n ILE 390 Ca 0.11 -0.79 -0.35 0.00 1.00 0.00 0.00 62.75 62.72 1gnd n ILE 390 Cb 0.47 -0.56 -0.09 0.00 -0.71 0.00 0.00 39.64 38.75 1gnd n ILE 390 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1gnd s ASP 391 N -5.54 5.75 0.20 4.38 -1.08 -1.26 -5.01 116.67 114.12 1gnd s ASP 391 Ca -0.08 0.17 0.23 0.00 -0.52 0.00 0.00 52.55 52.35 1gnd s ASP 391 Cb 0.08 -1.92 0.19 0.00 -1.46 0.00 0.00 42.92 39.80 1gnd s ASP 391 CO 0.84 0.24 1.24 -2.24 0.52 0.00 0.00 175.17 175.77 1gnd h ASP 392 N 6.18 0.00 0.00 -0.34 2.03 -1.90 -3.44 116.42 118.94 1gnd h ASP 392 Ca -0.42 -0.08 0.00 0.00 -0.73 0.00 0.00 57.03 55.80 1gnd h ASP 392 Cb 1.18 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.68 1gnd h ASP 392 CO 0.67 0.04 0.00 0.61 -1.03 0.00 0.00 179.24 179.53 1gnd n GLY 393 N 1.23 0.39 3.78 7.15 0.00 -1.25 -4.84 105.19 111.64 1gnd n GLY 393 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 1gnd n GLY 393 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1gnd s SER 394 N -2.04 6.40 0.00 1.61 1.04 -1.26 -1.47 113.70 117.98 1gnd s SER 394 Ca 0.00 2.13 0.00 0.00 0.48 0.00 0.00 55.95 58.56 1gnd s SER 394 Cb 0.00 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.53 1gnd s SER 394 CO 0.00 -0.75 0.00 -0.62 0.98 0.00 0.00 173.24 172.85 1gnd n GLU 395 N -0.45 0.00 -0.29 4.02 1.02 -1.26 -4.34 120.64 119.33 1gnd n GLU 395 Ca 0.07 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.20 1gnd n GLU 395 Cb 0.50 0.00 0.17 0.00 -0.02 0.00 0.00 31.44 32.09 1gnd n GLU 395 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1gnd h SER 396 N 0.00 1.01 -0.80 1.62 4.64 -1.82 -3.36 113.55 114.84 1gnd h SER 396 Ca 0.00 -0.04 -0.18 0.00 -0.47 0.00 0.00 61.79 61.10 1gnd h SER 396 Cb 0.00 -0.25 -0.04 0.00 -0.31 0.00 0.00 62.40 61.79 1gnd h SER 396 CO 0.00 0.75 -0.19 0.00 -0.87 0.00 0.00 176.83 176.51 1gnd n GLN 397 N -4.39 -0.66 -3.80 4.77 1.13 -0.54 -2.03 117.38 111.87 1gnd n GLN 397 Ca 0.10 0.65 -0.37 0.00 -1.94 0.00 0.00 57.00 55.44 1gnd n GLN 397 Cb 0.04 -4.58 -0.13 0.00 0.11 0.00 0.00 30.24 25.68 1gnd n GLN 397 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1gnd s VAL 398 N -2.38 3.69 -0.42 5.09 1.01 -1.26 -1.73 120.40 124.39 1gnd s VAL 398 Ca 0.00 -0.92 -0.07 0.00 0.00 0.00 0.00 61.98 60.99 1gnd s VAL 398 Cb 0.00 -2.97 0.10 0.00 0.00 0.00 0.00 36.38 33.51 1gnd s VAL 398 CO 0.00 0.01 0.25 -0.36 0.00 0.00 0.00 175.10 175.00 1gnd s PHE 399 N 1.43 3.42 0.07 5.22 0.08 0.11 -3.87 117.98 124.45 1gnd s PHE 399 Ca 0.00 -1.87 -0.09 0.00 0.12 0.00 0.00 56.93 55.10 1gnd s PHE 399 Cb -0.18 -3.12 -0.06 0.00 -0.57 0.00 0.00 43.02 39.09 1gnd s PHE 399 CO 0.01 -0.92 0.37 0.00 -0.10 0.00 0.00 175.22 174.59 1gnd s SER 401 N -1.81 5.22 0.22 0.00 1.04 -0.57 -4.80 113.70 113.00 1gnd s SER 401 Ca 0.33 -0.34 0.02 0.00 0.48 0.00 0.00 55.95 56.44 1gnd s SER 401 Cb -0.14 -0.46 -0.03 0.00 0.10 0.00 0.00 66.02 65.49 1gnd s SER 401 CO 0.18 -1.17 0.38 0.00 0.98 0.00 0.00 173.24 173.61 1gnd s SER 403 N -3.61 4.14 -0.06 0.00 0.01 -0.79 -4.96 113.70 108.42 1gnd s SER 403 Ca 0.36 1.82 -0.28 0.00 1.31 0.00 0.00 55.95 59.16 1gnd s SER 403 Cb -0.10 -2.47 -0.03 0.00 0.21 0.00 0.00 66.02 63.63 1gnd s SER 403 CO 0.30 -2.27 0.89 -0.31 0.41 0.00 0.00 173.24 172.26 1gnd s TYR 404 N -2.87 3.58 0.95 2.43 2.02 -1.26 -4.90 117.35 117.29 1gnd s TYR 404 Ca 0.62 1.50 -0.16 0.00 -0.37 0.00 0.00 57.07 58.66 1gnd s TYR 404 Cb -0.18 -3.04 0.22 0.00 -0.40 0.00 0.00 41.96 38.56 1gnd s TYR 404 CO 0.56 -0.06 1.25 -0.40 -1.57 0.00 0.00 175.55 175.34 1gnd n ASP 405 N 4.26 -0.03 0.00 2.29 5.68 -1.26 -4.98 116.55 122.50 1gnd n ASP 405 Ca 0.04 -1.44 0.10 0.00 -0.50 0.00 0.00 54.79 52.99 1gnd n ASP 405 Cb 0.50 -0.97 0.44 0.00 -1.14 0.00 0.00 41.12 39.95 1gnd n ASP 405 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1gnd n ALA 406 N -3.88 1.93 -1.75 2.12 0.00 -1.26 -4.89 120.51 112.79 1gnd n ALA 406 Ca -0.20 -0.07 -0.37 0.00 0.00 0.00 0.00 53.44 52.80 1gnd n ALA 406 Cb 0.55 -1.32 0.04 0.00 0.00 0.00 0.00 19.45 18.72 1gnd n ALA 406 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1gnd s THR 407 N -2.94 2.36 -0.43 0.00 -4.23 -1.26 -4.68 115.64 104.46 1gnd s THR 407 Ca 0.11 0.23 0.05 0.00 -1.18 0.00 0.00 61.69 60.90 1gnd s THR 407 Cb 0.13 -3.10 0.66 0.00 1.34 0.00 0.00 72.50 71.54 1gnd s THR 407 CO 0.36 -0.04 1.88 0.35 -0.54 0.00 0.00 174.62 176.63 1gnd n THR 408 N -1.54 3.14 -4.06 3.99 -2.24 -1.26 -4.91 114.28 107.40 1gnd n THR 408 Ca 0.14 -1.96 -0.10 0.00 -2.27 0.00 0.00 64.05 59.85 1gnd n THR 408 Cb 0.48 -0.45 -0.07 0.00 -2.10 0.00 0.00 70.33 68.19 1gnd n THR 408 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 1gnd s HIS 409 N -3.27 0.64 -2.17 4.78 0.00 -1.26 -1.66 115.29 112.34 1gnd s HIS 409 Ca 0.56 -0.96 0.22 0.00 -3.00 0.00 0.00 55.06 51.88 1gnd s HIS 409 Cb 0.47 -0.15 1.05 0.00 -4.00 0.00 0.00 32.58 29.96 1gnd s HIS 409 CO 0.10 -0.78 1.71 1.19 -1.00 0.00 0.00 174.74 175.97 1gnd n PHE 410 N -0.28 0.08 -0.20 0.38 3.72 -0.90 -4.58 117.46 115.69 1gnd n PHE 410 Ca -0.02 -0.04 -0.13 0.00 -0.05 0.00 0.00 57.45 57.20 1gnd n PHE 410 Cb 0.64 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 39.08 1gnd n PHE 410 CO 0.00 0.00 0.00 1.05 -0.05 0.00 0.00 176.76 177.76 1gnd h GLU 411 N 1.16 -0.30 0.00 -1.08 9.09 -1.99 -0.61 114.58 120.86 1gnd h GLU 411 Ca 0.00 0.02 -0.09 0.00 0.05 0.00 0.00 59.36 59.34 1gnd h GLU 411 Cb 0.25 0.07 -0.01 0.00 -1.65 0.00 0.00 28.75 27.41 1gnd h GLU 411 CO 0.00 -0.20 -0.42 1.79 0.05 0.00 0.00 179.01 180.23 1gnd h THR 412 N -0.31 1.26 -0.32 -1.06 1.35 -2.00 -1.64 112.91 110.19 1gnd h THR 412 Ca 0.09 -1.44 -0.11 0.00 -0.55 0.00 0.00 66.41 64.40 1gnd h THR 412 Cb 0.55 1.79 -0.01 0.00 -1.73 0.00 0.00 68.15 68.75 1gnd h THR 412 CO -0.66 0.41 -0.22 0.74 -0.25 0.00 0.00 175.52 175.54 1gnd h THR 413 N 0.00 1.29 -0.74 6.82 2.02 -1.77 -2.51 112.91 118.03 1gnd h THR 413 Ca -0.00 -1.36 -0.06 0.00 0.77 0.00 0.00 66.41 65.76 1gnd h THR 413 Cb 0.75 1.47 -0.03 0.00 -1.74 0.00 0.00 68.15 68.60 1gnd h THR 413 CO 0.05 0.44 0.24 0.00 0.37 0.00 0.00 175.52 176.62 1gnd h ASN 415 N 1.10 0.86 -0.07 0.00 2.35 -1.18 -1.79 115.58 116.86 1gnd h ASN 415 Ca 0.24 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.97 1gnd h ASN 415 Cb 0.29 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.45 1gnd h ASN 415 CO -0.01 0.62 0.02 -0.78 -1.65 0.00 0.00 177.43 175.64 1gnd h ASP 416 N 1.02 0.09 -0.64 5.81 3.58 -1.09 -1.66 116.42 123.52 1gnd h ASP 416 Ca 0.28 -0.19 0.08 0.00 0.42 0.00 0.00 57.03 57.63 1gnd h ASP 416 Cb -0.10 -0.02 -0.07 0.00 1.72 0.00 0.00 39.33 40.86 1gnd h ASP 416 CO -0.07 0.25 0.30 0.40 -2.88 0.00 0.00 179.24 177.25 1gnd h ILE 417 N -0.07 0.85 -0.53 2.25 2.04 -1.14 -0.95 117.51 119.96 1gnd h ILE 417 Ca 0.02 -0.18 -0.06 0.00 1.00 0.00 0.00 64.86 65.63 1gnd h ILE 417 Cb 0.19 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 1gnd h ILE 417 CO -0.00 0.10 0.08 0.11 0.00 0.00 0.00 178.15 178.44 1gnd h LYS 418 N 0.53 0.88 0.07 2.37 1.57 -1.22 -1.05 116.57 119.72 1gnd h LYS 418 Ca 0.31 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1gnd h LYS 418 Cb 0.32 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 1gnd h LYS 418 CO -0.25 0.86 -0.06 0.22 -0.57 0.00 0.00 179.45 179.65 1gnd h ASP 419 N 0.76 -0.15 -0.50 0.86 3.58 -0.69 -1.50 116.42 118.79 1gnd h ASP 419 Ca 0.16 0.01 0.02 0.00 0.42 0.00 0.00 57.03 57.65 1gnd h ASP 419 Cb 0.41 0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.48 1gnd h ASP 419 CO 0.01 -0.09 0.29 0.40 -2.88 0.00 0.00 179.24 176.97 1gnd h ILE 420 N -0.13 1.04 -0.95 2.25 2.04 -1.09 -1.25 117.51 119.43 1gnd h ILE 420 Ca 0.00 -0.20 0.04 0.00 1.00 0.00 0.00 64.86 65.70 1gnd h ILE 420 Cb 0.12 0.41 -0.05 0.00 -0.74 0.00 0.00 36.82 36.56 1gnd h ILE 420 CO -0.01 0.11 0.62 0.22 0.00 0.00 0.00 178.15 179.09 1gnd h TYR 421 N 0.59 1.15 -0.05 1.37 5.03 -1.01 -0.52 116.97 123.53 1gnd h TYR 421 Ca 0.20 0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.54 1gnd h TYR 421 Cb 0.03 -0.39 -0.00 0.00 1.55 0.00 0.00 36.73 37.92 1gnd h TYR 421 CO -0.07 0.67 0.02 -0.22 -1.32 0.00 0.00 178.16 177.24 1gnd h LYS 422 N 1.19 0.08 -0.84 1.82 3.64 -0.53 -0.38 116.57 121.56 1gnd h LYS 422 Ca 0.38 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.75 1gnd h LYS 422 Cb 0.01 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 1gnd h LYS 422 CO -0.11 0.21 0.54 0.00 -2.27 0.00 0.00 179.45 177.81 1gnd h ARG 423 N -0.07 1.11 0.40 1.90 3.08 -0.78 0.41 114.38 120.42 1gnd h ARG 423 Ca 0.02 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 1gnd h ARG 423 Cb 0.16 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 29.97 1gnd h ARG 423 CO -0.00 0.75 -0.19 0.52 -1.07 0.00 0.00 179.97 179.97 1gnd h MET 424 N 1.14 -0.51 0.00 0.04 2.86 -0.83 -3.35 114.93 114.27 1gnd h MET 424 Ca 0.30 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.98 1gnd h MET 424 Cb -0.11 0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.67 1gnd h MET 424 CO -0.06 -0.34 0.00 0.00 1.06 0.00 0.00 176.91 177.56 1gnd h ALA 425 N -1.34 1.00 -0.15 6.32 0.00 -1.13 -3.48 119.26 120.48 1gnd h ALA 425 Ca -0.05 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1gnd h ALA 425 Cb 0.41 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1gnd h ALA 425 CO 0.09 0.00 -0.05 0.41 0.00 0.00 0.00 179.25 179.70 1gnd n GLY 426 N 0.99 0.55 3.63 0.00 0.00 0.14 -5.01 105.19 105.49 1gnd n GLY 426 Ca 0.04 -0.94 -0.09 0.00 0.00 0.00 0.00 46.02 45.03 1gnd n GLY 426 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1gnd s SER 427 N -2.96 -0.21 0.23 1.61 1.04 -1.21 -5.03 113.70 107.16 1gnd s SER 427 Ca 0.00 -0.64 -0.17 0.00 0.48 0.00 0.00 55.95 55.62 1gnd s SER 427 Cb 0.00 0.62 -0.08 0.00 0.10 0.00 0.00 66.02 66.66 1gnd s SER 427 CO 0.00 -1.15 0.68 0.00 0.98 0.00 0.00 173.24 173.75 1gnd s ALA 428 N -3.93 3.44 -0.27 5.32 0.00 -1.26 -3.98 121.76 121.07 1gnd s ALA 428 Ca 0.13 0.05 -0.28 0.00 0.00 0.00 0.00 51.96 51.87 1gnd s ALA 428 Cb -0.02 -2.73 -0.04 0.00 0.00 0.00 0.00 23.12 20.33 1gnd s ALA 428 CO 0.03 0.37 2.15 0.12 0.00 0.00 0.00 175.76 178.42 1gnd s PHE 429 N -1.62 1.29 -2.11 0.00 5.36 -1.26 -5.05 117.98 114.60 1gnd s PHE 429 Ca 0.44 0.66 0.17 0.00 -0.96 0.00 0.00 56.93 57.24 1gnd s PHE 429 Cb -0.15 -3.94 0.13 0.00 -0.34 0.00 0.00 43.02 38.73 1gnd s PHE 429 CO 0.20 -3.68 1.03 -3.47 -1.46 0.00 0.00 175.22 167.84