#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nzd s LYS 2 N 0.00 4.01 -0.04 2.12 2.47 -1.26 -4.20 119.74 122.83 1nzd s LYS 2 Ca 0.00 -0.31 0.01 0.00 -1.56 0.00 0.00 55.97 54.11 1nzd s LYS 2 Cb 0.00 -3.41 -0.03 0.00 -1.46 0.00 0.00 37.83 32.93 1nzd s LYS 2 CO 0.00 0.12 -0.03 0.42 0.16 0.00 0.00 175.35 176.02 1nzd s ILE 3 N 0.86 3.99 -0.06 5.43 1.01 0.79 0.79 121.20 134.01 1nzd s ILE 3 Ca 0.06 -0.50 0.05 0.00 0.00 0.00 0.00 60.65 60.26 1nzd s ILE 3 Cb -0.13 -2.70 -0.00 0.00 0.01 0.00 0.00 42.46 39.63 1nzd s ILE 3 CO 0.03 0.51 -0.22 0.00 0.00 0.00 0.00 174.94 175.25 1nzd s ALA 4 N -0.94 1.95 -0.04 9.38 0.00 -0.22 -1.32 121.76 130.57 1nzd s ALA 4 Ca 0.15 -0.90 0.04 0.00 0.00 0.00 0.00 51.96 51.26 1nzd s ALA 4 Cb -0.11 -0.66 -0.00 0.00 0.00 0.00 0.00 23.12 22.35 1nzd s ALA 4 CO 0.05 0.33 -0.17 -1.50 0.00 0.00 0.00 175.76 174.48 1nzd s ILE 5 N 0.06 1.38 0.08 0.00 2.07 -0.38 -0.09 121.20 124.31 1nzd s ILE 5 Ca -0.08 -0.70 -0.03 0.00 -1.41 0.00 0.00 60.65 58.44 1nzd s ILE 5 Cb -0.14 -1.18 -0.03 0.00 0.13 0.00 0.00 42.46 41.24 1nzd s ILE 5 CO 0.05 0.40 0.04 0.27 -1.91 0.00 0.00 174.94 173.78 1nzd s ILE 6 N -0.02 0.18 -0.18 2.00 -4.36 -0.26 -1.72 121.20 116.83 1nzd s ILE 6 Ca -0.02 -1.72 -0.08 0.00 -0.26 0.00 0.00 60.65 58.57 1nzd s ILE 6 Cb -0.11 -1.62 -0.04 0.00 1.25 0.00 0.00 42.46 41.94 1nzd s ILE 6 CO 0.02 -0.80 0.09 0.21 0.24 0.00 0.00 174.94 174.70 1nzd s ASN 7 N -2.94 5.90 0.13 4.36 3.84 -1.26 -0.84 114.94 124.12 1nzd s ASN 7 Ca 0.11 0.17 0.21 0.00 0.21 0.00 0.00 52.86 53.56 1nzd s ASN 7 Cb 0.07 -2.00 0.84 0.00 -0.55 0.00 0.00 41.25 39.61 1nzd s ASN 7 CO -0.07 0.21 1.64 0.80 -2.79 0.00 0.00 177.10 176.88 1nzd n MET 8 N 3.34 0.10 -0.54 0.43 0.00 -0.99 -4.27 117.12 115.19 1nzd n MET 8 Ca -0.17 0.30 -0.00 0.00 -0.00 0.00 0.00 57.70 57.83 1nzd n MET 8 Cb 0.52 -1.68 -0.00 0.00 0.00 0.00 0.00 33.22 32.06 1nzd n MET 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1nzd n GLY 9 N 0.24 0.90 2.93 -5.12 0.00 -1.26 -4.08 105.19 98.81 1nzd n GLY 9 Ca 0.03 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 1nzd n GLY 9 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nzd s ASN 10 N -0.22 -0.07 0.36 1.61 0.01 -1.26 -4.44 114.94 110.93 1nzd s ASN 10 Ca 0.00 0.15 -0.27 0.00 -0.71 0.00 0.00 52.86 52.04 1nzd s ASN 10 Cb 0.00 0.14 -0.09 0.00 0.41 0.00 0.00 41.25 41.71 1nzd s ASN 10 CO -0.00 -0.04 1.22 0.21 -1.51 0.00 0.00 177.10 176.97 1nzd s ASN 11 N 0.21 6.69 -0.20 -1.22 2.47 -1.26 -4.68 114.94 116.95 1nzd s ASN 11 Ca -0.01 2.48 -0.03 0.00 0.42 0.00 0.00 52.86 55.72 1nzd s ASN 11 Cb -0.02 -2.63 -0.01 0.00 -1.45 0.00 0.00 41.25 37.14 1nzd s ASN 11 CO -0.01 -0.57 -0.08 -0.69 -3.72 0.00 0.00 177.10 172.04 1nzd s VAL 12 N -1.27 3.15 0.30 -5.21 1.01 -1.26 -4.47 120.40 112.66 1nzd s VAL 12 Ca 0.52 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.93 1nzd s VAL 12 Cb -0.35 -2.41 0.00 0.00 0.00 0.00 0.00 36.38 33.62 1nzd s VAL 12 CO 0.45 0.45 0.00 -0.38 0.00 0.00 0.00 175.10 175.62 1nzd n ILE 13 N 4.60 0.00 -2.88 2.22 5.41 -1.26 -4.86 119.36 122.59 1nzd n ILE 13 Ca -0.19 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.56 1nzd n ILE 13 Cb 0.51 -0.49 0.00 0.00 -0.71 0.00 0.00 39.64 38.95 1nzd n ILE 13 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1nzd n ASN 14 N -3.49 0.00 -1.62 4.38 0.23 -1.26 -4.71 115.26 108.79 1nzd n ASN 14 Ca 0.00 0.00 0.06 0.00 -0.53 0.00 0.00 54.58 54.11 1nzd n ASN 14 Cb 0.00 0.00 0.33 0.00 -2.08 0.00 0.00 39.78 38.03 1nzd n ASN 14 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1nzd n PHE 15 N 0.00 1.67 1.22 -2.53 3.01 -1.26 -3.48 117.46 116.09 1nzd n PHE 15 Ca 0.00 -0.59 0.14 0.00 1.01 0.00 0.00 57.45 58.01 1nzd n PHE 15 Cb 0.00 -0.41 0.63 0.00 -0.01 0.00 0.00 39.48 39.69 1nzd n PHE 15 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1nzd n LYS 16 N 0.59 0.27 -4.08 -1.08 5.02 -1.26 -1.33 118.16 116.29 1nzd n LYS 16 Ca 0.23 -0.04 -0.13 0.00 -2.02 0.00 0.00 58.31 56.35 1nzd n LYS 16 Cb 1.00 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 34.40 1nzd n LYS 16 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1nzd s THR 17 N -2.75 0.60 0.07 -0.18 -4.23 -1.26 -4.89 115.64 102.99 1nzd s THR 17 Ca 0.21 -1.21 -0.21 0.00 -1.18 0.00 0.00 61.69 59.30 1nzd s THR 17 Cb 0.19 -0.79 -0.11 0.00 1.34 0.00 0.00 72.50 73.14 1nzd s THR 17 CO 0.51 -0.44 1.55 0.58 -0.54 0.00 0.00 174.62 176.28 1nzd h VAL 18 N 4.27 1.21 -0.75 2.29 2.07 -1.94 -0.93 116.25 122.47 1nzd h VAL 18 Ca -0.36 -0.66 0.06 0.00 0.82 0.00 0.00 66.70 66.56 1nzd h VAL 18 Cb 1.20 1.35 -0.06 0.00 -1.52 0.00 0.00 31.29 32.25 1nzd h VAL 18 CO 0.44 0.20 0.44 -0.65 0.02 0.00 0.00 177.57 178.02 1nzd h PRO 19 N 0.06 0.78 -0.17 1.57 0.11 -1.97 0.79 132.00 133.16 1nzd h PRO 19 Ca 0.05 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.07 1nzd h PRO 19 Cb 0.28 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.21 1nzd h PRO 19 CO 0.00 0.52 -0.05 1.03 -0.21 0.00 0.00 178.00 179.29 1nzd h SER 20 N 0.81 0.34 -0.10 -2.05 0.87 -1.77 -2.57 113.55 109.08 1nzd h SER 20 Ca 0.33 -0.38 0.03 0.00 -1.23 0.00 0.00 61.79 60.55 1nzd h SER 20 Cb 0.19 -0.09 -0.04 0.00 -0.44 0.00 0.00 62.40 62.02 1nzd h SER 20 CO -0.18 0.64 -0.11 0.28 -0.53 0.00 0.00 176.83 176.94 1nzd h SER 21 N 0.04 -0.33 -0.83 6.23 0.02 -0.73 -1.24 113.55 116.71 1nzd h SER 21 Ca 0.04 0.06 0.04 0.00 -0.84 0.00 0.00 61.79 61.10 1nzd h SER 21 Cb 0.50 0.16 -0.05 0.00 0.14 0.00 0.00 62.40 63.15 1nzd h SER 21 CO 0.02 -0.14 0.52 -0.08 -1.14 0.00 0.00 176.83 176.01 1nzd h GLU 22 N -0.13 0.96 -0.48 3.45 4.81 -0.88 0.23 114.58 122.54 1nzd h GLU 22 Ca 0.07 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.22 1nzd h GLU 22 Cb 0.24 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 1nzd h GLU 22 CO -0.18 0.64 0.17 1.15 -0.73 0.00 0.00 179.01 180.06 1nzd h THR 23 N 0.99 1.22 -0.26 0.32 2.02 -1.04 -1.19 112.91 114.96 1nzd h THR 23 Ca 0.34 -0.69 -0.03 0.00 0.77 0.00 0.00 66.41 66.81 1nzd h THR 23 Cb 0.07 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1nzd h THR 23 CO -0.14 0.25 0.05 0.40 0.37 0.00 0.00 175.52 176.46 1nzd h ILE 24 N 0.63 1.22 -0.79 3.11 2.04 -0.73 -1.16 117.51 121.83 1nzd h ILE 24 Ca 0.16 -0.75 -0.01 0.00 1.00 0.00 0.00 64.86 65.26 1nzd h ILE 24 Cb 0.22 1.21 -0.04 0.00 -0.74 0.00 0.00 36.82 37.48 1nzd h ILE 24 CO -0.01 0.24 0.46 1.88 0.00 0.00 0.00 178.15 180.72 1nzd h TYR 25 N 0.25 1.05 -0.55 1.37 0.05 -0.85 0.39 116.97 118.68 1nzd h TYR 25 Ca 0.08 -0.01 -0.12 0.00 0.05 0.00 0.00 58.73 58.74 1nzd h TYR 25 Cb 0.31 -0.34 -0.02 0.00 1.01 0.00 0.00 36.73 37.69 1nzd h TYR 25 CO 0.02 0.71 -0.11 -0.07 -1.05 0.00 0.00 178.16 177.66 1nzd h LEU 26 N 1.10 1.04 -0.47 3.88 3.38 -1.05 -1.25 115.31 121.95 1nzd h LEU 26 Ca 0.28 -0.35 0.05 0.00 0.09 0.00 0.00 57.88 57.95 1nzd h LEU 26 Cb -0.02 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.40 1nzd h LEU 26 CO -0.05 1.15 0.21 0.15 0.09 0.00 0.00 178.44 179.99 1nzd h PHE 27 N 0.92 0.38 -0.13 1.13 3.57 -0.42 -1.60 116.94 120.80 1nzd h PHE 27 Ca 0.14 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.66 1nzd h PHE 27 Cb 0.68 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.31 1nzd h PHE 27 CO 0.05 0.18 0.06 0.87 -2.23 0.00 0.00 178.31 177.24 1nzd h LYS 28 N 0.42 0.19 -0.17 1.11 1.79 -0.49 -1.53 116.57 117.89 1nzd h LYS 28 Ca 0.21 -0.03 -0.09 0.00 -2.18 0.00 0.00 60.65 58.56 1nzd h LYS 28 Cb 0.15 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.75 1nzd h LYS 28 CO -0.17 0.24 -0.30 -0.39 -1.08 0.00 0.00 179.45 177.76 1nzd h VAL 29 N 0.09 1.27 -0.38 0.50 -1.51 -1.07 -0.21 116.25 114.93 1nzd h VAL 29 Ca 0.05 -1.28 -0.06 0.00 -1.23 0.00 0.00 66.70 64.18 1nzd h VAL 29 Cb 0.12 1.47 -0.01 0.00 -2.13 0.00 0.00 31.29 30.73 1nzd h VAL 29 CO -0.01 0.39 0.01 0.40 -1.23 0.00 0.00 177.57 177.14 1nzd h ILE 30 N 0.28 1.26 -0.26 7.19 2.04 -1.18 -1.70 117.51 125.14 1nzd h ILE 30 Ca 0.04 -0.97 -0.01 0.00 1.00 0.00 0.00 64.86 64.92 1nzd h ILE 30 Cb 0.67 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 1nzd h ILE 30 CO 0.05 0.33 0.12 0.28 0.00 0.00 0.00 178.15 178.93 1nzd h SER 31 N 0.49 0.34 0.28 1.72 0.02 -0.95 -1.57 113.55 113.88 1nzd h SER 31 Ca 0.11 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1nzd h SER 31 Cb 0.45 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.90 1nzd h SER 31 CO 0.02 0.37 0.00 -0.62 -1.14 0.00 0.00 176.83 175.46 1nzd n GLU 32 N -4.81 0.02 0.00 3.45 1.02 -0.12 -0.65 120.64 119.55 1nzd n GLU 32 Ca -0.03 0.33 0.14 0.00 -0.02 0.00 0.00 57.16 57.58 1nzd n GLU 32 Cb 0.10 -1.50 0.57 0.00 -0.02 0.00 0.00 31.44 30.59 1nzd n GLU 32 CO 0.00 0.00 0.00 -0.12 1.18 0.00 0.00 177.13 178.19 1nzd n MET 33 N -1.47 0.60 -0.49 3.49 1.56 -0.60 -4.89 117.12 115.32 1nzd n MET 33 Ca 0.02 -0.22 0.00 0.00 -0.27 0.00 0.00 57.70 57.23 1nzd n MET 33 Cb 0.10 -1.50 0.00 0.00 2.15 0.00 0.00 33.22 33.97 1nzd n MET 33 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1nzd n GLY 34 N 1.31 0.71 3.77 -5.12 0.00 0.17 -5.07 105.19 100.97 1nzd n GLY 34 Ca 0.13 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 1nzd n GLY 34 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nzd s LEU 35 N 0.00 3.80 -0.43 0.99 1.43 -1.15 -5.06 118.68 118.27 1nzd s LEU 35 Ca 0.00 0.04 -0.23 0.00 -1.03 0.00 0.00 54.13 52.90 1nzd s LEU 35 Cb 0.00 -2.38 0.02 0.00 0.03 0.00 0.00 46.19 43.87 1nzd s LEU 35 CO 0.00 0.21 0.80 0.21 0.23 0.00 0.00 176.35 177.80 1nzd s ASN 36 N -2.11 6.46 0.02 2.29 2.47 -1.26 -4.24 114.94 118.58 1nzd s ASN 36 Ca 0.26 0.05 0.00 0.00 0.42 0.00 0.00 52.86 53.60 1nzd s ASN 36 Cb -0.12 -2.40 -0.02 0.00 -1.45 0.00 0.00 41.25 37.26 1nzd s ASN 36 CO 0.18 -0.87 -0.03 0.54 -3.72 0.00 0.00 177.10 173.19 1nzd s VAL 37 N 3.28 0.16 0.07 -5.21 0.11 -1.26 -0.14 120.40 117.40 1nzd s VAL 37 Ca 0.31 -0.88 0.06 0.00 -2.93 0.00 0.00 61.98 58.54 1nzd s VAL 37 Cb -0.12 -0.29 -0.03 0.00 -1.53 0.00 0.00 36.38 34.41 1nzd s VAL 37 CO 0.21 -0.46 -0.17 -1.81 -3.33 0.00 0.00 175.10 169.55 1nzd s ASP 38 N -1.39 1.99 -0.17 3.54 1.01 -0.44 -4.97 116.67 116.24 1nzd s ASP 38 Ca -0.14 -0.57 -0.10 0.00 0.71 0.00 0.00 52.55 52.44 1nzd s ASP 38 Cb -0.09 -0.11 -0.05 0.00 1.01 0.00 0.00 42.92 43.68 1nzd s ASP 38 CO -0.01 0.02 0.18 -0.63 0.21 0.00 0.00 175.17 174.94 1nzd s ILE 39 N -1.05 5.39 -0.18 0.77 1.01 -1.26 -1.25 121.20 124.64 1nzd s ILE 39 Ca 0.02 0.30 -0.02 0.00 0.00 0.00 0.00 60.65 60.95 1nzd s ILE 39 Cb -0.09 -3.50 -0.01 0.00 0.01 0.00 0.00 42.46 38.86 1nzd s ILE 39 CO 0.02 0.47 -0.08 -0.63 0.00 0.00 0.00 174.94 174.72 1nzd s ILE 40 N 0.06 3.26 0.00 2.92 -1.09 -0.70 -1.21 121.20 124.44 1nzd s ILE 40 Ca 0.12 -0.56 0.00 0.00 -2.23 0.00 0.00 60.65 57.98 1nzd s ILE 40 Cb -0.12 -2.43 0.00 0.00 -1.58 0.00 0.00 42.46 38.33 1nzd s ILE 40 CO 0.01 0.47 0.00 -0.24 -1.23 0.00 0.00 174.94 173.95 1nzd n SER 41 N 4.19 0.25 -0.25 3.58 2.88 0.43 -4.49 113.62 120.21 1nzd n SER 41 Ca -0.18 -0.45 -0.04 0.00 -1.33 0.00 0.00 58.87 56.87 1nzd n SER 41 Cb 0.52 0.00 0.12 0.00 -0.75 0.00 0.00 64.21 64.10 1nzd n SER 41 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1nzd h LEU 42 N 0.00 1.00 -8.30 2.46 3.38 -1.89 -0.47 115.31 111.48 1nzd h LEU 42 Ca 0.00 -0.14 -0.14 0.00 0.09 0.00 0.00 57.88 57.69 1nzd h LEU 42 Cb 0.00 -0.26 -0.15 0.00 0.09 0.00 0.00 40.66 40.34 1nzd h LEU 42 CO 0.00 0.88 -0.66 -0.54 0.09 0.00 0.00 178.44 178.21 1nzd s LYS 43 N -5.52 0.74 0.55 1.13 1.02 -1.26 -4.40 119.74 112.01 1nzd s LYS 43 Ca -0.12 -1.30 -0.20 0.00 0.02 0.00 0.00 55.97 54.38 1nzd s LYS 43 Cb 0.16 0.23 -0.05 0.00 -0.52 0.00 0.00 37.83 37.64 1nzd s LYS 43 CO 0.82 -0.17 1.17 -0.80 -0.92 0.00 0.00 175.35 175.44 1nzd s ASN 44 N -2.97 5.57 0.03 2.83 -0.87 -1.26 -4.17 114.94 114.09 1nzd s ASN 44 Ca 0.14 2.28 -0.03 0.00 -1.57 0.00 0.00 52.86 53.68 1nzd s ASN 44 Cb 0.08 -2.59 0.01 0.00 -0.02 0.00 0.00 41.25 38.73 1nzd s ASN 44 CO -0.05 -1.33 0.14 0.61 -2.57 0.00 0.00 177.10 173.90 1nzd n GLY 45 N 0.32 1.32 0.20 0.66 0.00 -0.32 -4.93 105.19 102.44 1nzd n GLY 45 Ca 0.12 -0.97 -0.04 0.00 0.00 0.00 0.00 46.02 45.13 1nzd n GLY 45 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1nzd h VAL 46 N 1.14 0.52 -0.01 1.61 2.07 -1.94 -3.05 116.25 116.58 1nzd h VAL 46 Ca -0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.48 1nzd h VAL 46 Cb 0.17 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 1nzd h VAL 46 CO 0.05 0.00 -0.22 -1.22 0.02 0.00 0.00 177.57 176.20 1nzd n TYR 47 N -5.34 0.00 -4.35 1.57 4.01 -1.26 -5.04 117.16 106.74 1nzd n TYR 47 Ca 0.03 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.59 1nzd n TYR 47 Cb 0.25 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.18 1nzd n TYR 47 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1nzd s THR 48 N -1.74 1.55 0.23 -0.72 -4.23 -1.15 -4.08 115.64 105.50 1nzd s THR 48 Ca 0.16 -2.15 0.11 0.00 -1.18 0.00 0.00 61.69 58.62 1nzd s THR 48 Cb 0.13 -2.14 -0.05 0.00 1.34 0.00 0.00 72.50 71.79 1nzd s THR 48 CO 0.34 -0.52 -0.16 -0.54 -0.54 0.00 0.00 174.62 173.20 1nzd s LYS 49 N -3.70 1.81 0.21 3.99 1.02 -0.35 -1.18 119.74 121.55 1nzd s LYS 49 Ca 0.24 -1.52 -0.05 0.00 0.02 0.00 0.00 55.97 54.66 1nzd s LYS 49 Cb 0.01 -1.95 -0.05 0.00 -0.52 0.00 0.00 37.83 35.33 1nzd s LYS 49 CO 0.07 0.38 0.46 -1.54 -0.92 0.00 0.00 175.35 173.80 1nzd s SER 50 N -3.11 6.47 0.21 2.83 1.04 -1.26 -0.43 113.70 119.46 1nzd s SER 50 Ca 0.26 0.63 -0.09 0.00 0.48 0.00 0.00 55.95 57.23 1nzd s SER 50 Cb -0.07 -2.11 0.26 0.00 0.10 0.00 0.00 66.02 64.21 1nzd s SER 50 CO 0.14 -0.07 1.78 -0.26 0.98 0.00 0.00 173.24 175.81 1nzd h PHE 51 N 2.23 0.55 0.00 5.02 0.04 -1.28 -2.12 116.94 121.37 1nzd h PHE 51 Ca -0.47 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.33 1nzd h PHE 51 Cb 1.18 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 39.18 1nzd h PHE 51 CO 0.59 0.21 0.00 -0.25 -0.60 0.00 0.00 178.31 178.26 1nzd n ASP 52 N -4.89 0.00 -0.02 2.17 8.00 -1.26 -2.97 116.55 117.58 1nzd n ASP 52 Ca 0.09 -0.19 0.02 0.00 0.71 0.00 0.00 54.79 55.41 1nzd n ASP 52 Cb 0.23 -0.11 0.03 0.00 -0.02 0.00 0.00 41.12 41.25 1nzd n ASP 52 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1nzd n GLU 53 N -1.11 2.54 -4.13 -1.24 1.02 -0.80 -5.04 120.64 111.89 1nzd n GLU 53 Ca 0.08 -1.68 -0.09 0.00 -0.02 0.00 0.00 57.16 55.46 1nzd n GLU 53 Cb 0.06 -1.08 -0.10 0.00 -0.02 0.00 0.00 31.44 30.30 1nzd n GLU 53 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1nzd s VAL 54 N -1.33 0.40 -0.28 2.62 -7.23 -1.16 -4.96 120.40 108.46 1nzd s VAL 54 Ca 0.06 -1.86 -0.06 0.00 -1.81 0.00 0.00 61.98 58.30 1nzd s VAL 54 Cb 0.06 -1.62 -0.00 0.00 0.56 0.00 0.00 36.38 35.38 1nzd s VAL 54 CO 0.01 -0.92 0.06 -0.62 -0.31 0.00 0.00 175.10 173.32 1nzd s ASP 55 N -2.98 5.02 0.55 4.85 -1.08 -1.26 -4.97 116.67 116.79 1nzd s ASP 55 Ca 0.10 -0.58 0.31 0.00 -0.52 0.00 0.00 52.55 51.86 1nzd s ASP 55 Cb 0.07 -1.87 1.47 0.00 -1.46 0.00 0.00 42.92 41.13 1nzd s ASP 55 CO -0.07 -0.14 1.88 1.62 0.52 0.00 0.00 175.17 178.98 1nzd h VAL 56 N 5.79 0.51 -0.26 1.11 3.04 -1.93 0.58 116.25 125.10 1nzd h VAL 56 Ca -0.34 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.35 1nzd h VAL 56 Cb 1.14 0.56 0.00 0.00 -2.01 0.00 0.00 31.29 30.98 1nzd h VAL 56 CO 0.60 0.00 0.00 0.59 -1.01 0.00 0.00 177.57 177.75 1nzd n ASN 57 N -4.14 1.63 -0.51 3.17 3.02 -1.26 -2.81 115.26 114.37 1nzd n ASN 57 Ca 0.16 -2.06 0.14 0.00 -0.03 0.00 0.00 54.58 52.79 1nzd n ASN 57 Cb 0.91 -0.24 0.47 0.00 -0.61 0.00 0.00 39.78 40.30 1nzd n ASN 57 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1nzd n ASP 58 N 0.27 1.63 -4.68 6.41 8.00 0.20 -4.84 116.55 123.53 1nzd n ASP 58 Ca 0.09 -1.51 -0.33 0.00 0.71 0.00 0.00 54.79 53.75 1nzd n ASP 58 Cb 0.29 0.01 -0.09 0.00 -0.02 0.00 0.00 41.12 41.31 1nzd n ASP 58 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1nzd s TYR 59 N -2.04 3.09 -0.21 1.24 2.02 -1.12 -4.76 117.35 115.58 1nzd s TYR 59 Ca 0.36 0.11 0.21 0.00 -0.37 0.00 0.00 57.07 57.38 1nzd s TYR 59 Cb 0.21 -1.70 -0.02 0.00 -0.40 0.00 0.00 41.96 40.04 1nzd s TYR 59 CO 0.35 0.46 1.01 -0.44 -1.57 0.00 0.00 175.55 175.35 1nzd h ASP 60 N 4.56 0.00 -3.63 2.29 3.32 0.06 -3.47 116.42 119.55 1nzd h ASP 60 Ca -0.49 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.34 1nzd h ASP 60 Cb 1.18 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 40.44 1nzd h ASP 60 CO 0.57 0.12 -0.57 -0.13 -1.72 0.00 0.00 179.24 177.51 1nzd s ARG 61 N -3.27 0.13 -0.23 3.56 1.81 -1.15 -4.99 118.95 114.81 1nzd s ARG 61 Ca -0.01 0.27 -0.00 0.00 -1.72 0.00 0.00 55.73 54.27 1nzd s ARG 61 Cb 0.09 -0.03 0.03 0.00 -0.45 0.00 0.00 34.95 34.59 1nzd s ARG 61 CO 0.79 -0.08 -0.10 -1.17 -0.68 0.00 0.00 175.30 174.06 1nzd s LEU 62 N 0.55 2.97 -0.15 2.53 2.96 -1.26 -1.05 118.68 125.23 1nzd s LEU 62 Ca -0.04 -0.89 -0.05 0.00 -0.22 0.00 0.00 54.13 52.93 1nzd s LEU 62 Cb -0.05 -1.60 -0.03 0.00 0.50 0.00 0.00 46.19 45.00 1nzd s LEU 62 CO -0.03 -0.10 0.02 -0.63 -1.32 0.00 0.00 176.35 174.29 1nzd s ILE 63 N 1.28 4.40 -0.11 6.68 1.01 0.87 -1.43 121.20 133.89 1nzd s ILE 63 Ca -0.00 -0.19 0.01 0.00 0.00 0.00 0.00 60.65 60.47 1nzd s ILE 63 Cb -0.16 -2.93 0.02 0.00 0.01 0.00 0.00 42.46 39.40 1nzd s ILE 63 CO -0.07 0.52 -0.13 -0.69 0.00 0.00 0.00 174.94 174.57 1nzd s VAL 64 N -0.02 1.35 0.00 2.92 1.01 0.62 -1.10 120.40 125.17 1nzd s VAL 64 Ca 0.04 -0.53 -0.29 0.00 0.00 0.00 0.00 61.98 61.20 1nzd s VAL 64 Cb -0.13 -1.27 -0.03 0.00 0.00 0.00 0.00 36.38 34.95 1nzd s VAL 64 CO 0.02 0.42 0.95 -0.69 0.00 0.00 0.00 175.10 175.80 1nzd s VAL 65 N 1.26 4.86 0.70 2.92 1.01 -0.02 0.11 120.40 131.23 1nzd s VAL 65 Ca -0.02 2.01 -0.16 0.00 0.00 0.00 0.00 61.98 63.81 1nzd s VAL 65 Cb -0.14 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 31.95 1nzd s VAL 65 CO -0.05 0.18 1.03 -0.46 0.00 0.00 0.00 175.10 175.80 1nzd n ASN 66 N 3.81 0.82 -3.72 3.32 2.04 -0.61 -2.34 115.26 118.58 1nzd n ASN 66 Ca 0.05 0.71 -0.06 0.00 -0.44 0.00 0.00 54.58 54.84 1nzd n ASN 66 Cb 0.51 -1.44 -0.02 0.00 -2.53 0.00 0.00 39.78 36.31 1nzd n ASN 66 CO 0.00 0.00 0.00 -0.94 -0.44 0.00 0.00 177.26 175.88 1nzd s SER 67 N -1.57 -0.28 0.49 0.53 1.04 -1.26 -4.72 113.70 107.94 1nzd s SER 67 Ca 0.75 -0.38 -0.13 0.00 0.48 0.00 0.00 55.95 56.67 1nzd s SER 67 Cb -0.36 0.57 -0.07 0.00 0.10 0.00 0.00 66.02 66.27 1nzd s SER 67 CO 0.48 -1.03 0.92 -0.55 0.98 0.00 0.00 173.24 174.03 1nzd s SER 68 N -2.86 6.52 -0.04 7.02 0.15 -1.26 -4.79 113.70 118.45 1nzd s SER 68 Ca 0.10 1.39 0.08 0.00 0.70 0.00 0.00 55.95 58.21 1nzd s SER 68 Cb -0.03 -2.43 0.21 0.00 -1.71 0.00 0.00 66.02 62.06 1nzd s SER 68 CO 0.01 -0.57 1.16 2.30 1.20 0.00 0.00 173.24 177.34 1nzd n ILE 69 N -1.68 1.25 -2.22 6.45 -5.35 -1.26 -4.60 119.36 111.95 1nzd n ILE 69 Ca 0.05 -1.25 -0.41 0.00 -0.27 0.00 0.00 62.75 60.87 1nzd n ILE 69 Cb 0.54 0.33 -0.03 0.00 -1.74 0.00 0.00 39.64 38.74 1nzd n ILE 69 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 1nzd s ASN 70 N -1.32 6.90 -0.50 7.28 0.01 -1.26 -4.96 114.94 121.09 1nzd s ASN 70 Ca 0.17 2.46 -0.18 0.00 -0.71 0.00 0.00 52.86 54.60 1nzd s ASN 70 Cb 0.12 -2.62 0.06 0.00 0.41 0.00 0.00 41.25 39.22 1nzd s ASN 70 CO 0.07 -0.50 0.58 -0.36 -1.51 0.00 0.00 177.10 175.39 1nzd s PHE 71 N -0.27 3.09 0.13 2.20 0.08 -1.26 -5.03 117.98 116.91 1nzd s PHE 71 Ca 0.54 -0.63 -0.34 0.00 0.12 0.00 0.00 56.93 56.61 1nzd s PHE 71 Cb -0.37 -3.49 -0.14 0.00 -0.57 0.00 0.00 43.02 38.45 1nzd s PHE 71 CO 0.42 -1.00 1.55 0.34 -0.10 0.00 0.00 175.22 176.43 1nzd n PHE 72 N 5.98 2.14 -1.03 0.36 7.35 -1.26 -0.77 117.46 130.23 1nzd n PHE 72 Ca -0.08 0.32 -0.01 0.00 -0.76 0.00 0.00 57.45 56.92 1nzd n PHE 72 Cb 0.45 -2.51 -0.00 0.00 0.35 0.00 0.00 39.48 37.76 1nzd n PHE 72 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1nzd n GLY 73 N 3.32 0.23 2.76 7.13 0.00 -1.26 -2.28 105.19 115.09 1nzd n GLY 73 Ca 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1nzd n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nzd n GLY 74 N -0.13 0.38 3.95 -0.02 0.00 0.05 -5.00 105.19 104.43 1nzd n GLY 74 Ca -0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 1nzd n GLY 74 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nzd s LYS 75 N -0.71 3.33 0.31 1.61 3.01 -0.96 -4.91 119.74 121.41 1nzd s LYS 75 Ca 0.00 -0.47 -0.29 0.00 -1.01 0.00 0.00 55.97 54.19 1nzd s LYS 75 Cb 0.00 -2.67 -0.11 0.00 -1.01 0.00 0.00 37.83 34.05 1nzd s LYS 75 CO 0.00 0.04 1.46 -2.14 0.51 0.00 0.00 175.35 175.22 1nzd s PRO 76 N -4.34 4.21 -0.28 -1.68 0.02 -1.26 -4.40 135.00 127.27 1nzd s PRO 76 Ca 0.42 2.41 0.03 0.00 0.02 0.00 0.00 61.00 63.88 1nzd s PRO 76 Cb -0.10 -3.05 0.07 0.00 0.02 0.00 0.00 34.50 31.44 1nzd s PRO 76 CO 0.36 -0.45 -0.06 1.21 -0.33 0.00 0.00 177.00 177.72 1nzd s ASN 77 N 0.10 4.43 0.51 2.53 3.84 -1.26 -5.00 114.94 120.10 1nzd s ASN 77 Ca 0.57 -1.54 0.18 0.00 0.21 0.00 0.00 52.86 52.27 1nzd s ASN 77 Cb -0.44 -1.50 1.28 0.00 -0.55 0.00 0.00 41.25 40.04 1nzd s ASN 77 CO 0.51 -0.24 2.12 -0.07 -2.79 0.00 0.00 177.10 176.63 1nzd h LEU 78 N 7.77 0.00 -0.68 3.21 3.38 -1.97 -1.31 115.31 125.69 1nzd h LEU 78 Ca -0.15 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 1nzd h LEU 78 Cb 1.04 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.76 1nzd h LEU 78 CO 0.47 0.05 0.36 0.00 0.09 0.00 0.00 178.44 179.40 1nzd h ALA 79 N 1.95 0.88 0.12 1.53 0.00 -1.94 0.21 119.26 122.01 1nzd h ALA 79 Ca -0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1nzd h ALA 79 Cb 0.08 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1nzd h ALA 79 CO 0.01 0.41 -0.06 0.82 0.00 0.00 0.00 179.25 180.44 1nzd h ILE 80 N 0.94 0.90 -0.43 0.00 2.04 -1.58 -3.07 117.51 116.31 1nzd h ILE 80 Ca 0.24 -1.30 0.04 0.00 1.00 0.00 0.00 64.86 64.83 1nzd h ILE 80 Cb 0.07 1.56 -0.04 0.00 -0.74 0.00 0.00 36.82 37.68 1nzd h ILE 80 CO -0.03 0.25 0.20 -0.07 0.00 0.00 0.00 178.15 178.50 1nzd h LEU 81 N -0.90 0.28 -0.77 1.44 3.38 -1.23 -1.22 115.31 116.30 1nzd h LEU 81 Ca -0.02 0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.87 1nzd h LEU 81 Cb 0.54 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1nzd h LEU 81 CO 0.03 0.20 -0.27 0.28 0.09 0.00 0.00 178.44 178.76 1nzd h SER 82 N 0.41 0.64 -0.23 -0.43 0.02 -0.74 -1.17 113.55 112.05 1nzd h SER 82 Ca 0.19 -0.24 -0.06 0.00 -0.84 0.00 0.00 61.79 60.84 1nzd h SER 82 Cb 0.12 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 1nzd h SER 82 CO -0.15 0.89 -0.09 0.00 -1.14 0.00 0.00 176.83 176.34 1nzd h ALA 83 N 1.16 0.32 -0.17 3.77 0.00 -1.38 -1.12 119.26 121.84 1nzd h ALA 83 Ca 0.07 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 1nzd h ALA 83 Cb 0.75 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1nzd h ALA 83 CO 0.06 0.15 -0.35 1.96 0.00 0.00 0.00 179.25 181.07 1nzd h GLN 84 N 0.19 0.35 -0.74 0.00 4.20 -1.18 0.17 115.11 118.11 1nzd h GLN 84 Ca 0.05 -0.15 -0.05 0.00 0.06 0.00 0.00 58.65 58.56 1nzd h GLN 84 Cb 0.57 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.31 1nzd h GLN 84 CO 0.03 0.66 0.25 -0.22 -0.67 0.00 0.00 178.83 178.88 1nzd h LYS 85 N 0.30 1.13 -0.31 1.46 3.64 -1.14 0.40 116.57 122.06 1nzd h LYS 85 Ca 0.04 -0.23 -0.07 0.00 -1.27 0.00 0.00 60.65 59.12 1nzd h LYS 85 Cb 0.76 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 1nzd h LYS 85 CO 0.06 0.95 -0.10 0.35 -2.27 0.00 0.00 179.45 178.44 1nzd h PHE 86 N 1.09 0.69 -0.43 1.91 3.57 -0.44 -2.72 116.94 120.61 1nzd h PHE 86 Ca 0.24 -0.16 -0.05 0.00 3.53 0.00 0.00 57.97 61.53 1nzd h PHE 86 Cb 0.27 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 1nzd h PHE 86 CO 0.02 0.81 0.06 0.52 -2.23 0.00 0.00 178.31 177.49 1nzd h MET 87 N 0.37 0.72 0.00 1.11 2.86 -0.27 -2.75 114.93 116.98 1nzd h MET 87 Ca 0.07 -0.20 -0.02 0.00 -2.06 0.00 0.00 59.70 57.50 1nzd h MET 87 Cb 0.60 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.18 1nzd h MET 87 CO 0.04 0.76 -0.09 0.00 1.06 0.00 0.00 176.91 178.67 1nzd h ALA 88 N 0.93 1.54 0.00 6.32 0.00 -0.19 -2.00 119.26 125.86 1nzd h ALA 88 Ca 0.13 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 1nzd h ALA 88 Cb 0.39 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1nzd h ALA 88 CO 0.01 0.11 -0.49 -0.22 0.00 0.00 0.00 179.25 178.67 1nzd h LYS 89 N 0.00 0.00 -6.70 0.00 1.63 -1.22 -3.44 116.57 106.84 1nzd h LYS 89 Ca -0.00 0.00 -0.52 0.00 -0.85 0.00 0.00 60.65 59.28 1nzd h LYS 89 Cb 0.20 0.00 0.04 0.00 -0.60 0.00 0.00 32.23 31.87 1nzd h LYS 89 CO 0.01 0.48 0.68 -0.47 -3.45 0.00 0.00 179.45 176.71 1nzd s TYR 90 N -2.97 3.18 -0.98 1.91 5.04 -0.75 -4.88 117.35 117.90 1nzd s TYR 90 Ca 0.04 1.17 0.16 0.00 -2.44 0.00 0.00 57.07 56.01 1nzd s TYR 90 Cb 0.07 -3.66 0.56 0.00 0.35 0.00 0.00 41.96 39.28 1nzd s TYR 90 CO 0.74 -2.10 1.47 1.63 -1.34 0.00 0.00 175.55 175.96 1nzd n LYS 91 N 2.48 3.24 -3.52 4.97 4.01 -1.26 -4.68 118.16 123.39 1nzd n LYS 91 Ca 0.06 -2.61 -0.17 0.00 -0.51 0.00 0.00 58.31 55.08 1nzd n LYS 91 Cb 0.42 -1.67 -0.04 0.00 -0.51 0.00 0.00 35.03 33.23 1nzd n LYS 91 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 1nzd n SER 92 N 0.70 1.98 -4.77 4.39 2.88 -1.26 -5.03 113.62 112.52 1nzd n SER 92 Ca 0.21 -2.32 -0.40 0.00 -1.33 0.00 0.00 58.87 55.03 1nzd n SER 92 Cb 0.73 0.42 -0.01 0.00 -0.75 0.00 0.00 64.21 64.59 1nzd n SER 92 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1nzd s LYS 93 N -3.01 4.11 -0.12 -1.46 2.20 -1.26 -4.53 119.74 115.67 1nzd s LYS 93 Ca 0.06 2.26 -0.03 0.00 -0.36 0.00 0.00 55.97 57.91 1nzd s LYS 93 Cb 0.00 -2.90 -0.03 0.00 -1.51 0.00 0.00 37.83 33.39 1nzd s LYS 93 CO 0.04 -0.41 -0.01 0.42 -0.36 0.00 0.00 175.35 175.03 1nzd s ILE 94 N -1.19 4.18 -0.39 5.43 1.01 -0.51 -4.35 121.20 125.38 1nzd s ILE 94 Ca 0.54 -0.28 -0.11 0.00 0.00 0.00 0.00 60.65 60.80 1nzd s ILE 94 Cb -0.40 -2.79 0.04 0.00 0.01 0.00 0.00 42.46 39.32 1nzd s ILE 94 CO 0.53 0.55 0.23 -0.31 0.00 0.00 0.00 174.94 175.94 1nzd s TYR 95 N -0.32 3.26 -0.33 3.97 1.51 -0.52 -0.65 117.35 124.27 1nzd s TYR 95 Ca 0.06 -1.07 -0.17 0.00 -1.01 0.00 0.00 57.07 54.88 1nzd s TYR 95 Cb -0.12 -2.59 -0.01 0.00 -0.11 0.00 0.00 41.96 39.13 1nzd s TYR 95 CO 0.02 -0.70 0.47 -0.47 -1.11 0.00 0.00 175.55 173.76 1nzd s TYR 96 N 1.54 3.20 -0.44 2.71 5.04 -0.32 -0.28 117.35 128.80 1nzd s TYR 96 Ca 0.02 0.21 -0.26 0.00 -2.44 0.00 0.00 57.07 54.61 1nzd s TYR 96 Cb -0.20 -2.82 0.02 0.00 0.35 0.00 0.00 41.96 39.31 1nzd s TYR 96 CO 0.06 -0.46 0.94 -0.51 -1.34 0.00 0.00 175.55 174.24 1nzd s LEU 97 N 2.28 3.97 -0.91 6.97 1.43 0.12 -1.17 118.68 131.37 1nzd s LEU 97 Ca 0.17 0.28 -0.16 0.00 -1.03 0.00 0.00 54.13 53.40 1nzd s LEU 97 Cb -0.16 -3.24 0.18 0.00 0.03 0.00 0.00 46.19 43.01 1nzd s LEU 97 CO 0.12 -1.01 0.97 0.12 0.23 0.00 0.00 176.35 176.78 1nzd s PHE 98 N 3.73 3.52 -0.97 0.29 5.36 -0.54 -1.57 117.98 127.80 1nzd s PHE 98 Ca 0.38 -1.80 0.18 0.00 -0.96 0.00 0.00 56.93 54.73 1nzd s PHE 98 Cb -0.10 -4.04 -0.16 0.00 -0.34 0.00 0.00 43.02 38.38 1nzd s PHE 98 CO 0.25 -1.21 0.78 0.25 -1.46 0.00 0.00 175.22 173.82 1nzd n THR 99 N 4.55 0.00 -3.71 0.12 -2.24 -1.26 -1.96 114.28 109.78 1nzd n THR 99 Ca 0.20 -0.12 -0.23 0.00 -2.27 0.00 0.00 64.05 61.63 1nzd n THR 99 Cb 0.47 1.03 -0.18 0.00 -2.10 0.00 0.00 70.33 69.56 1nzd n THR 99 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nzd s ALA 100 N -2.59 0.52 0.39 6.98 0.00 -1.26 -4.99 121.76 120.81 1nzd s ALA 100 Ca 0.08 -0.09 0.15 0.00 0.00 0.00 0.00 51.96 52.11 1nzd s ALA 100 Cb 0.14 -0.78 1.02 0.00 0.00 0.00 0.00 23.12 23.49 1nzd s ALA 100 CO 0.69 -0.63 1.81 0.82 0.00 0.00 0.00 175.76 178.45 1nzd h ILE 101 N 6.40 0.63 0.00 0.00 2.04 -1.98 0.03 117.51 124.63 1nzd h ILE 101 Ca -0.16 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.54 1nzd h ILE 101 Cb 1.13 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 1nzd h ILE 101 CO 0.23 0.09 0.00 -2.11 0.00 0.00 0.00 178.15 176.36 1nzd n ARG 102 N -4.60 0.44 -2.48 2.37 1.85 -1.26 -4.10 116.66 108.88 1nzd n ARG 102 Ca 0.22 0.05 -0.31 0.00 -1.00 0.00 0.00 57.85 56.80 1nzd n ARG 102 Cb 0.73 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.64 1nzd n ARG 102 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1nzd n LEU 103 N -1.22 5.57 -4.77 2.89 4.77 -0.00 -4.97 117.00 119.27 1nzd n LEU 103 Ca 0.13 -5.26 -0.33 0.00 -0.03 0.00 0.00 56.01 50.52 1nzd n LEU 103 Cb 0.17 -0.69 0.04 0.00 -2.33 0.00 0.00 43.42 40.61 1nzd n LEU 103 CO 0.17 2.14 0.74 -2.16 -1.33 0.00 0.00 177.39 176.96 1nzd s PRO 104 N -3.73 2.86 0.42 3.23 0.04 -1.26 -4.26 135.00 132.29 1nzd s PRO 104 Ca 0.48 1.38 -0.25 0.00 0.04 0.00 0.00 61.00 62.66 1nzd s PRO 104 Cb 0.36 -1.96 -0.10 0.00 0.04 0.00 0.00 34.50 32.84 1nzd s PRO 104 CO -0.22 -1.20 1.14 0.34 0.04 0.00 0.00 177.00 177.09 1nzd n PHE 105 N -2.35 1.65 -3.67 0.56 7.35 -1.26 -4.91 117.46 114.83 1nzd n PHE 105 Ca 0.10 0.54 -0.15 0.00 -0.76 0.00 0.00 57.45 57.18 1nzd n PHE 105 Cb 0.52 -2.30 -0.07 0.00 0.35 0.00 0.00 39.48 37.98 1nzd n PHE 105 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 1nzd s SER 106 N -0.64 -0.36 0.04 -2.13 1.04 -1.26 -4.82 113.70 105.57 1nzd s SER 106 Ca 0.62 0.28 -0.25 0.00 0.48 0.00 0.00 55.95 57.08 1nzd s SER 106 Cb -0.54 0.40 -0.05 0.00 0.10 0.00 0.00 66.02 65.93 1nzd s SER 106 CO 0.57 -0.53 0.77 -1.10 0.98 0.00 0.00 173.24 173.93 1nzd s GLN 107 N -1.45 4.50 0.22 4.02 -1.52 -1.26 -4.96 119.66 119.21 1nzd s GLN 107 Ca -0.12 1.07 0.17 0.00 -1.95 0.00 0.00 55.36 54.53 1nzd s GLN 107 Cb -0.03 -3.37 0.02 0.00 -0.22 0.00 0.00 33.01 29.41 1nzd s GLN 107 CO 0.05 0.25 1.24 0.66 -0.25 0.00 0.00 175.29 177.24 1nzd h SER 108 N 5.79 0.00 -0.25 5.90 4.64 -1.93 -3.39 113.55 124.31 1nzd h SER 108 Ca -0.44 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 60.95 1nzd h SER 108 Cb 1.21 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.23 1nzd h SER 108 CO 0.71 0.44 -0.19 -0.25 -0.87 0.00 0.00 176.83 176.68 1nzd h TRP 109 N 0.00 -0.48 -0.96 4.77 2.91 -1.93 -0.24 115.95 120.03 1nzd h TRP 109 Ca -0.05 0.03 0.24 0.00 1.13 0.00 0.00 58.89 60.25 1nzd h TRP 109 Cb 1.38 0.25 -0.06 0.00 -0.51 0.00 0.00 29.16 30.22 1nzd h TRP 109 CO 0.00 -0.26 0.65 -1.35 -1.03 0.00 0.00 178.44 176.44 1nzd h PRO 110 N -0.18 0.27 0.07 2.65 0.11 -2.00 -0.65 132.00 132.27 1nzd h PRO 110 Ca 0.14 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.23 1nzd h PRO 110 Cb 0.39 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.44 1nzd h PRO 110 CO -0.36 0.18 -0.03 -0.97 -0.21 0.00 0.00 178.00 176.61 1nzd h ASN 111 N 0.28 -0.08 -0.63 -2.05 -1.24 -1.51 -3.37 115.58 106.98 1nzd h ASN 111 Ca 0.50 -0.44 0.12 0.00 0.71 0.00 0.00 56.30 57.19 1nzd h ASN 111 Cb 1.47 0.02 -0.09 0.00 0.73 0.00 0.00 38.32 40.45 1nzd h ASN 111 CO -0.15 0.59 0.14 0.58 -1.29 0.00 0.00 177.43 177.30 1nzd h VAL 112 N -0.95 0.63 -0.50 2.57 2.07 -0.29 -2.71 116.25 117.07 1nzd h VAL 112 Ca -0.01 -0.09 0.14 0.00 0.82 0.00 0.00 66.70 67.56 1nzd h VAL 112 Cb 0.51 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1nzd h VAL 112 CO 0.02 0.05 0.61 0.07 0.02 0.00 0.00 177.57 178.34 1nzd h LYS 113 N 0.27 0.00 -0.47 1.57 2.10 -1.31 0.15 116.57 118.88 1nzd h LYS 113 Ca 0.33 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.98 1nzd h LYS 113 Cb 0.50 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.83 1nzd h LYS 113 CO -0.42 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.12 1nzd n ASN 114 N -3.49 3.37 -4.86 7.07 3.02 -1.02 -4.84 115.26 114.50 1nzd n ASN 114 Ca 0.10 -1.96 -0.31 0.00 -0.03 0.00 0.00 54.58 52.38 1nzd n ASN 114 Cb 0.80 -0.31 -0.03 0.00 -0.61 0.00 0.00 39.78 39.63 1nzd n ASN 114 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1nzd s ARG 115 N -1.13 3.83 0.55 3.52 1.81 0.51 -4.95 118.95 123.09 1nzd s ARG 115 Ca 0.36 0.61 0.36 0.00 -1.72 0.00 0.00 55.73 55.34 1nzd s ARG 115 Cb 0.20 -2.32 1.82 0.00 -0.45 0.00 0.00 34.95 34.19 1nzd s ARG 115 CO 0.26 -0.09 2.10 -1.00 -0.68 0.00 0.00 175.30 175.89 1nzd h PRO 116 N 1.21 0.00 -0.48 3.54 0.13 -1.91 -1.41 132.00 133.08 1nzd h PRO 116 Ca -0.47 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1nzd h PRO 116 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 1nzd h PRO 116 CO 0.63 0.00 0.01 -2.67 -0.23 0.00 0.00 178.00 175.74 1nzd n TRP 117 N -2.88 1.73 0.29 1.56 4.27 -1.26 -4.54 117.44 116.60 1nzd n TRP 117 Ca -0.01 -0.79 0.17 0.00 -3.89 0.00 0.00 57.50 52.98 1nzd n TRP 117 Cb 0.14 -0.46 0.97 0.00 -1.36 0.00 0.00 31.31 30.61 1nzd n TRP 117 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1nzd h ALA 118 N 3.25 1.45 0.00 -1.67 0.00 -1.43 -1.75 119.26 119.11 1nzd h ALA 118 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1nzd h ALA 118 Cb 1.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.62 1nzd h ALA 118 CO 0.41 -0.09 0.00 0.10 0.00 0.00 0.00 179.25 179.68 1nzd h TYR 119 N 0.00 0.00 0.00 0.00 -0.00 -1.83 -2.17 116.97 112.96 1nzd h TYR 119 Ca 0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 58.74 1nzd h TYR 119 Cb 0.15 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 36.88 1nzd h TYR 119 CO 0.00 0.00 -0.04 -0.07 -0.00 0.00 0.00 178.16 178.05 1nzd h LEU 120 N 0.00 0.00 -8.10 0.10 3.38 -1.69 -3.45 115.31 105.54 1nzd h LEU 120 Ca 0.00 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.64 1nzd h LEU 120 Cb 0.06 0.00 -0.25 0.00 0.09 0.00 0.00 40.66 40.56 1nzd h LEU 120 CO 0.00 0.04 -0.75 -0.31 0.09 0.00 0.00 178.44 177.51 1nzd s TYR 121 N -3.35 0.72 0.27 1.13 1.51 -0.82 -5.15 117.35 111.65 1nzd s TYR 121 Ca 0.05 -0.31 0.06 0.00 -1.01 0.00 0.00 57.07 55.86 1nzd s TYR 121 Cb 0.07 -0.44 -0.03 0.00 -0.11 0.00 0.00 41.96 41.45 1nzd s TYR 121 CO 0.64 -0.03 0.30 0.95 -1.11 0.00 0.00 175.55 176.29 1nzd s THR 122 N -0.79 4.58 0.22 -0.71 -4.23 -1.26 -4.95 115.64 108.49 1nzd s THR 122 Ca -0.03 -1.21 -0.09 0.00 -1.18 0.00 0.00 61.69 59.19 1nzd s THR 122 Cb -0.07 -3.54 0.17 0.00 1.34 0.00 0.00 72.50 70.41 1nzd s THR 122 CO 0.00 -0.30 1.85 -0.08 -0.54 0.00 0.00 174.62 175.56 1nzd h GLU 123 N 1.28 1.12 -0.60 3.99 4.81 -1.98 -2.21 114.58 120.97 1nzd h GLU 123 Ca -0.49 -0.11 0.02 0.00 -0.13 0.00 0.00 59.36 58.64 1nzd h GLU 123 Cb 1.24 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 30.36 1nzd h GLU 123 CO 0.60 0.80 0.40 1.49 -0.73 0.00 0.00 179.01 181.56 1nzd h GLU 124 N 1.12 0.75 -0.43 1.92 4.81 -1.95 0.38 114.58 121.19 1nzd h GLU 124 Ca 0.29 -0.05 -0.12 0.00 -0.13 0.00 0.00 59.36 59.36 1nzd h GLU 124 Cb -0.01 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 1nzd h GLU 124 CO -0.05 0.50 -0.20 0.93 -0.73 0.00 0.00 179.01 179.46 1nzd h GLU 125 N 0.78 0.89 0.00 1.92 5.08 -1.81 -3.38 114.58 118.05 1nzd h GLU 125 Ca 0.23 -0.38 -0.36 0.00 -1.00 0.00 0.00 59.36 57.84 1nzd h GLU 125 Cb -0.03 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.13 1nzd h GLU 125 CO -0.05 1.03 -2.36 1.28 -1.00 0.00 0.00 179.01 177.91 1nzd n LEU 126 N -4.20 0.77 -4.62 1.33 4.77 -1.04 -4.18 117.00 109.84 1nzd n LEU 126 Ca -0.01 -0.03 -0.43 0.00 -0.03 0.00 0.00 56.01 55.51 1nzd n LEU 126 Cb 0.44 0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 41.63 1nzd n LEU 126 CO 0.45 0.59 1.68 -0.22 -1.33 0.00 0.00 177.39 178.57 1nzd s LEU 127 N -5.70 3.72 -0.31 2.23 2.96 0.13 -4.69 118.68 117.02 1nzd s LEU 127 Ca -0.16 1.91 -0.22 0.00 -0.22 0.00 0.00 54.13 55.44 1nzd s LEU 127 Cb 0.07 -3.52 -0.00 0.00 0.50 0.00 0.00 46.19 43.23 1nzd s LEU 127 CO 0.74 -1.64 0.72 -0.63 -1.32 0.00 0.00 176.35 174.22 1nzd s ILE 128 N 6.86 4.85 -0.34 6.68 1.01 -1.26 -4.73 121.20 134.27 1nzd s ILE 128 Ca 0.90 1.00 0.12 0.00 0.00 0.00 0.00 60.65 62.68 1nzd s ILE 128 Cb -0.32 -4.09 -0.16 0.00 0.01 0.00 0.00 42.46 37.90 1nzd s ILE 128 CO 0.35 -0.22 0.41 0.29 0.00 0.00 0.00 174.94 175.77 1nzd n LYS 129 N 6.08 1.90 -1.42 2.79 5.02 -1.26 -5.00 118.16 126.26 1nzd n LYS 129 Ca 0.01 -0.05 -0.35 0.00 -2.02 0.00 0.00 58.31 55.90 1nzd n LYS 129 Cb 0.48 -1.17 0.10 0.00 -0.02 0.00 0.00 35.03 34.42 1nzd n LYS 129 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1nzd n SER 130 N -1.56 1.46 -4.77 4.39 7.64 -1.26 -4.95 113.62 114.57 1nzd n SER 130 Ca 0.00 0.71 -0.35 0.00 1.01 0.00 0.00 58.87 60.24 1nzd n SER 130 Cb 0.25 -1.52 0.00 0.00 -1.01 0.00 0.00 64.21 61.93 1nzd n SER 130 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1nzd s PRO 131 N -3.68 3.42 -0.04 1.43 0.04 -1.26 -4.85 135.00 130.06 1nzd s PRO 131 Ca 0.78 1.65 0.05 0.00 0.04 0.00 0.00 61.00 63.52 1nzd s PRO 131 Cb -0.34 -2.08 -0.01 0.00 0.04 0.00 0.00 34.50 32.11 1nzd s PRO 131 CO 0.46 -0.80 -0.20 0.42 0.04 0.00 0.00 177.00 176.92 1nzd s ILE 132 N -1.72 1.63 -0.22 0.56 1.01 0.20 -1.42 121.20 121.25 1nzd s ILE 132 Ca 0.71 -0.84 -0.04 0.00 0.00 0.00 0.00 60.65 60.48 1nzd s ILE 132 Cb -0.25 -1.39 -0.01 0.00 0.01 0.00 0.00 42.46 40.82 1nzd s ILE 132 CO 0.29 0.46 -0.03 -0.75 0.00 0.00 0.00 174.94 174.91 1nzd s LYS 133 N -0.12 3.44 -0.23 2.79 2.20 0.17 -1.60 119.74 126.39 1nzd s LYS 133 Ca -0.01 -0.60 -0.19 0.00 -0.36 0.00 0.00 55.97 54.81 1nzd s LYS 133 Cb -0.11 -3.03 -0.03 0.00 -1.51 0.00 0.00 37.83 33.15 1nzd s LYS 133 CO 0.02 -0.15 0.57 0.08 -0.36 0.00 0.00 175.35 175.51 1nzd s VAL 134 N 1.37 5.05 -0.51 4.02 1.01 0.45 -1.17 120.40 130.61 1nzd s VAL 134 Ca 0.04 1.03 -0.16 0.00 0.00 0.00 0.00 61.98 62.89 1nzd s VAL 134 Cb -0.14 -3.88 0.10 0.00 0.00 0.00 0.00 36.38 32.45 1nzd s VAL 134 CO -0.01 0.10 0.47 -0.63 0.00 0.00 0.00 175.10 175.03 1nzd s ILE 135 N 2.08 5.19 -0.16 2.22 1.01 -0.32 -1.32 121.20 129.90 1nzd s ILE 135 Ca 0.25 -1.25 -0.25 0.00 0.00 0.00 0.00 60.65 59.39 1nzd s ILE 135 Cb -0.16 -4.25 -0.02 0.00 0.01 0.00 0.00 42.46 38.05 1nzd s ILE 135 CO 0.09 -0.75 0.83 -0.55 0.00 0.00 0.00 174.94 174.56 1nzd s SER 136 N 3.14 6.97 0.53 3.58 0.15 0.48 -1.46 113.70 127.08 1nzd s SER 136 Ca 0.04 1.19 0.31 0.00 0.70 0.00 0.00 55.95 58.20 1nzd s SER 136 Cb -0.27 -2.46 1.41 0.00 -1.71 0.00 0.00 66.02 62.99 1nzd s SER 136 CO 0.05 -0.39 2.01 -0.61 1.20 0.00 0.00 173.24 175.50 1nzd h GLN 137 N 7.30 0.00 -6.13 5.44 4.15 -1.51 -0.97 115.11 123.39 1nzd h GLN 137 Ca -0.30 0.00 -0.59 0.00 0.77 0.00 0.00 58.65 58.53 1nzd h GLN 137 Cb 1.13 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.78 1nzd h GLN 137 CO 0.83 0.08 -0.12 0.20 -1.93 0.00 0.00 178.83 177.89 1nzd s GLY 138 N -4.21 2.56 0.47 2.39 0.00 -1.26 -4.47 107.32 102.80 1nzd s GLY 138 Ca -0.01 -0.11 0.26 0.00 0.00 0.00 0.00 44.72 44.87 1nzd s GLY 138 CO 0.56 0.28 1.90 1.19 0.00 0.00 0.00 173.10 177.03 1nzd h ILE 139 N 3.56 0.52 -2.52 0.90 2.10 -1.55 -3.40 117.51 117.11 1nzd h ILE 139 Ca -0.51 -0.93 -0.59 0.00 1.08 0.00 0.00 64.86 63.91 1nzd h ILE 139 Cb 1.22 1.64 -0.12 0.00 -1.09 0.00 0.00 36.82 38.47 1nzd h ILE 139 CO 0.63 0.18 0.77 0.21 -1.08 0.00 0.00 178.15 178.85 1nzd s ASN 140 N -6.14 6.17 0.54 2.19 3.84 -1.26 -4.89 114.94 115.39 1nzd s ASN 140 Ca -0.00 -0.77 0.33 0.00 0.21 0.00 0.00 52.86 52.63 1nzd s ASN 140 Cb 0.11 -2.48 1.35 0.00 -0.55 0.00 0.00 41.25 39.68 1nzd s ASN 140 CO 0.61 -1.61 1.98 -0.07 -2.79 0.00 0.00 177.10 175.22 1nzd h LEU 141 N 12.07 0.00 -0.92 3.21 3.38 -1.99 -2.91 115.31 128.15 1nzd h LEU 141 Ca -0.28 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.60 1nzd h LEU 141 Cb 1.06 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 1nzd h LEU 141 CO 1.22 0.04 -0.19 0.44 0.09 0.00 0.00 178.44 180.04 1nzd h ASP 142 N 0.00 0.57 -0.30 -0.43 5.19 -1.96 0.83 116.42 120.32 1nzd h ASP 142 Ca -0.00 -0.18 -0.07 0.00 -0.62 0.00 0.00 57.03 56.16 1nzd h ASP 142 Cb 0.52 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.86 1nzd h ASP 142 CO 0.00 0.77 -0.03 0.40 -3.12 0.00 0.00 179.24 177.27 1nzd h ILE 143 N 0.51 1.23 -0.20 0.35 2.04 -1.94 0.48 117.51 119.98 1nzd h ILE 143 Ca 0.08 -0.95 -0.12 0.00 1.00 0.00 0.00 64.86 64.88 1nzd h ILE 143 Cb 0.62 0.95 -0.00 0.00 -0.74 0.00 0.00 36.82 37.65 1nzd h ILE 143 CO 0.04 0.33 -0.34 0.00 0.00 0.00 0.00 178.15 178.18 1nzd h ALA 144 N 1.36 0.31 -0.12 1.87 0.00 -1.41 -2.47 119.26 118.79 1nzd h ALA 144 Ca 0.12 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 1nzd h ALA 144 Cb 0.43 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1nzd h ALA 144 CO 0.02 0.36 0.08 0.87 0.00 0.00 0.00 179.25 180.57 1nzd h LYS 145 N 0.25 0.17 -0.80 0.00 1.57 -0.57 -2.52 116.57 114.65 1nzd h LYS 145 Ca 0.01 -0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.87 1nzd h LYS 145 Cb 0.93 -0.04 -0.07 0.00 0.08 0.00 0.00 32.23 33.13 1nzd h LYS 145 CO 0.08 0.14 0.46 0.00 -0.57 0.00 0.00 179.45 179.56 1nzd h ALA 146 N 1.01 1.14 0.00 3.86 0.00 -0.92 -0.62 119.26 123.73 1nzd h ALA 146 Ca 0.04 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1nzd h ALA 146 Cb 0.02 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1nzd h ALA 146 CO -0.01 0.09 -0.02 0.00 0.00 0.00 0.00 179.25 179.31 1nzd h ALA 147 N 1.44 1.01 -0.37 0.00 0.00 -1.17 -3.08 119.26 117.09 1nzd h ALA 147 Ca 0.38 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 1nzd h ALA 147 Cb 0.34 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1nzd h ALA 147 CO -0.24 0.03 0.01 0.72 0.00 0.00 0.00 179.25 179.76 1nzd n HIS 148 N -3.13 1.33 0.10 0.00 8.25 -0.27 -4.66 115.22 116.84 1nzd n HIS 148 Ca 0.00 -0.86 0.05 0.00 -0.26 0.00 0.00 57.72 56.65 1nzd n HIS 148 Cb 0.28 -0.39 0.48 0.00 1.12 0.00 0.00 29.99 31.49 1nzd n HIS 148 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 1nzd h LYS 149 N 2.46 0.32 0.00 -0.41 1.79 -1.40 -2.68 116.57 116.65 1nzd h LYS 149 Ca 0.01 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 1nzd h LYS 149 Cb 1.63 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 32.22 1nzd h LYS 149 CO 0.32 0.25 0.00 1.63 -1.08 0.00 0.00 179.45 180.57 1nzd n LYS 150 N -4.46 0.10 -4.45 3.15 5.02 -1.26 -4.63 118.16 111.62 1nzd n LYS 150 Ca 0.01 0.12 -0.32 0.00 -2.02 0.00 0.00 58.31 56.10 1nzd n LYS 150 Cb 0.11 -1.50 -0.16 0.00 -0.02 0.00 0.00 35.03 33.45 1nzd n LYS 150 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1nzd s VAL 151 N -2.86 1.92 -1.24 -0.18 -7.23 -1.01 -5.02 120.40 104.77 1nzd s VAL 151 Ca 0.13 -0.88 0.25 0.00 -1.81 0.00 0.00 61.98 59.67 1nzd s VAL 151 Cb 0.14 -1.72 0.05 0.00 0.56 0.00 0.00 36.38 35.41 1nzd s VAL 151 CO 0.36 0.52 1.39 -0.90 -0.31 0.00 0.00 175.10 176.17 1nzd n ASP 152 N 4.28 0.74 -0.42 4.85 3.85 -1.26 -4.02 116.55 124.57 1nzd n ASP 152 Ca -0.20 -0.54 0.09 0.00 -0.71 0.00 0.00 54.79 53.43 1nzd n ASP 152 Cb 0.51 0.30 0.36 0.00 -1.35 0.00 0.00 41.12 40.94 1nzd n ASP 152 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.20 175.73 1nzd n ASN 153 N -1.22 1.25 -4.45 -1.12 2.04 -1.26 -4.64 115.26 105.85 1nzd n ASN 153 Ca 0.07 -1.71 -0.44 0.00 -0.44 0.00 0.00 54.58 52.07 1nzd n ASN 153 Cb 0.34 -0.10 -0.05 0.00 -2.53 0.00 0.00 39.78 37.45 1nzd n ASN 153 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 1nzd s VAL 154 N -1.81 4.66 -0.47 3.53 1.01 -1.26 0.59 120.40 126.66 1nzd s VAL 154 Ca 0.28 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.88 1nzd s VAL 154 Cb 0.15 -4.46 0.10 0.00 0.00 0.00 0.00 36.38 32.16 1nzd s VAL 154 CO 0.22 -1.07 0.96 2.30 0.00 0.00 0.00 175.10 177.52 1nzd n ILE 155 N 5.77 0.67 -3.83 2.22 -5.35 -0.63 -4.93 119.36 113.29 1nzd n ILE 155 Ca -0.05 -0.84 -0.12 0.00 -0.27 0.00 0.00 62.75 61.47 1nzd n ILE 155 Cb 0.45 0.70 -0.11 0.00 -1.74 0.00 0.00 39.64 38.94 1nzd n ILE 155 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 1nzd s GLU 156 N -0.80 0.35 -0.01 6.28 2.02 -1.20 -5.04 118.70 120.29 1nzd s GLU 156 Ca 0.09 -0.03 0.00 0.00 0.02 0.00 0.00 54.97 55.05 1nzd s GLU 156 Cb 0.05 0.15 0.01 0.00 0.10 0.00 0.00 34.13 34.44 1nzd s GLU 156 CO 0.07 -0.07 -0.00 -0.06 0.02 0.00 0.00 175.26 175.22 1nzd s PHE 157 N -0.58 0.13 -0.12 1.61 0.40 -1.26 -0.42 117.98 117.75 1nzd s PHE 157 Ca -0.07 0.02 -0.08 0.00 -0.60 0.00 0.00 56.93 56.20 1nzd s PHE 157 Cb -0.04 -0.18 0.04 0.00 0.51 0.00 0.00 43.02 43.35 1nzd s PHE 157 CO 0.01 -0.05 0.31 -2.00 0.70 0.00 0.00 175.22 174.19 1nzd s GLU 158 N 0.43 0.31 0.21 0.44 2.12 -0.44 -4.97 118.70 116.81 1nzd s GLU 158 Ca -0.04 0.54 -0.29 0.00 0.36 0.00 0.00 54.97 55.54 1nzd s GLU 158 Cb -0.06 0.03 -0.08 0.00 0.26 0.00 0.00 34.13 34.27 1nzd s GLU 158 CO -0.01 -0.11 0.91 -0.47 -0.54 0.00 0.00 175.26 175.04 1nzd s TYR 159 N 0.82 3.95 -0.25 5.30 5.04 -1.26 -0.39 117.35 130.56 1nzd s TYR 159 Ca -0.05 1.85 -0.14 0.00 -2.44 0.00 0.00 57.07 56.29 1nzd s TYR 159 Cb -0.06 -2.95 0.08 0.00 0.35 0.00 0.00 41.96 39.37 1nzd s TYR 159 CO -0.06 0.44 0.61 0.12 -1.34 0.00 0.00 175.55 175.32 1nzd s PHE 160 N -1.01 -0.97 -1.14 4.97 5.36 -0.37 -4.89 117.98 119.93 1nzd s PHE 160 Ca 0.41 1.93 -0.20 0.00 -0.96 0.00 0.00 56.93 58.10 1nzd s PHE 160 Cb -0.25 0.55 -0.06 0.00 -0.34 0.00 0.00 43.02 42.92 1nzd s PHE 160 CO 0.31 -0.49 1.92 -0.35 -1.46 0.00 0.00 175.22 175.15 1nzd n PRO 161 N 4.41 2.08 -0.32 10.12 -0.04 -1.26 -3.90 135.00 146.08 1nzd n PRO 161 Ca -0.20 -2.51 0.04 0.00 -0.04 0.00 0.00 63.50 60.79 1nzd n PRO 161 Cb 0.57 -3.42 0.19 0.00 -0.04 0.00 0.00 33.50 30.80 1nzd n PRO 161 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1nzd h ILE 162 N 5.35 0.92 0.00 0.52 2.04 -1.89 -2.97 117.51 121.47 1nzd h ILE 162 Ca 0.36 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.92 1nzd h ILE 162 Cb 0.82 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.87 1nzd h ILE 162 CO 1.54 0.16 0.00 -1.84 0.00 0.00 0.00 178.15 178.01 1nzd n GLU 163 N -4.69 0.02 -0.02 2.37 0.00 -1.26 -2.38 120.64 114.68 1nzd n GLU 163 Ca 0.15 0.27 0.08 0.00 0.00 0.00 0.00 57.16 57.66 1nzd n GLU 163 Cb 0.30 -1.50 0.43 0.00 0.00 0.00 0.00 31.44 30.67 1nzd n GLU 163 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1nzd n GLN 164 N -1.28 1.12 0.02 3.44 6.02 -1.12 -4.15 117.38 121.43 1nzd n GLN 164 Ca 0.01 -0.18 0.14 0.00 -0.01 0.00 0.00 57.00 56.95 1nzd n GLN 164 Cb 0.01 -1.26 0.60 0.00 1.02 0.00 0.00 30.24 30.61 1nzd n GLN 164 CO 0.00 0.00 0.00 0.10 -1.01 0.00 0.00 177.06 176.15 1nzd h TYR 165 N 0.35 0.19 -0.25 1.08 -0.00 -1.74 -2.47 116.97 114.13 1nzd h TYR 165 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 58.73 58.61 1nzd h TYR 165 Cb 0.08 -0.06 -0.00 0.00 0.00 0.00 0.00 36.73 36.74 1nzd h TYR 165 CO 0.02 0.09 -0.34 0.87 -0.00 0.00 0.00 178.16 178.80 1nzd h LYS 166 N 0.18 0.66 0.00 0.10 1.57 -1.89 -3.22 116.57 113.97 1nzd h LYS 166 Ca 0.21 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 1nzd h LYS 166 Cb 0.59 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.93 1nzd h LYS 166 CO -0.03 1.00 0.00 -0.84 -0.57 0.00 0.00 179.45 179.00 1nzd h ILE 167 N 0.38 0.00 -0.02 1.86 3.07 -1.76 -3.01 117.51 118.03 1nzd h ILE 167 Ca 0.03 -0.48 0.00 0.00 1.55 0.00 0.00 64.86 65.95 1nzd h ILE 167 Cb 0.92 1.40 0.00 0.00 -0.27 0.00 0.00 36.82 38.86 1nzd h ILE 167 CO 0.08 0.00 -0.03 1.41 -1.05 0.00 0.00 178.15 178.56 1nzd n HIS 168 N -2.70 0.00 -1.89 0.16 8.25 -1.08 -4.88 115.22 113.08 1nzd n HIS 168 Ca 0.02 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.07 1nzd n HIS 168 Cb 0.33 -0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.43 1nzd n HIS 168 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1nzd s MET 169 N -2.04 4.18 0.48 -0.41 -1.94 -1.14 -4.90 119.30 113.54 1nzd s MET 169 Ca 0.32 2.47 0.18 0.00 -1.71 0.00 0.00 55.69 56.96 1nzd s MET 169 Cb 0.20 -3.00 1.20 0.00 2.01 0.00 0.00 34.83 35.24 1nzd s MET 169 CO 0.33 -0.45 2.02 -0.91 -0.01 0.00 0.00 175.02 176.00 1nzd h ASN 170 N 3.35 0.17 -0.60 3.03 -0.26 -1.92 -1.69 115.58 117.67 1nzd h ASN 170 Ca -0.50 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.25 1nzd h ASN 170 Cb 1.23 -0.03 0.00 0.00 -1.06 0.00 0.00 38.32 38.46 1nzd h ASN 170 CO 0.66 0.10 0.00 -0.90 -1.06 0.00 0.00 177.43 176.24 1nzd n ASP 171 N -4.45 4.20 -4.70 5.81 5.75 -1.26 -5.00 116.55 116.91 1nzd n ASP 171 Ca 0.07 -2.34 -0.40 0.00 -0.01 0.00 0.00 54.79 52.12 1nzd n ASP 171 Cb 0.39 -0.53 0.03 0.00 -1.03 0.00 0.00 41.12 39.98 1nzd n ASP 171 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 1nzd n PHE 172 N 1.06 1.92 -3.69 2.11 -0.00 -0.64 -5.02 117.46 113.21 1nzd n PHE 172 Ca 0.23 0.47 -0.10 0.00 -0.00 0.00 0.00 57.45 58.05 1nzd n PHE 172 Cb 0.77 -2.33 -0.10 0.00 -0.00 0.00 0.00 39.48 37.82 1nzd n PHE 172 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.76 176.11 1nzd s GLN 173 N -2.50 0.42 0.70 -4.13 -0.21 -1.26 -5.07 119.66 107.61 1nzd s GLN 173 Ca 0.67 0.83 -0.16 0.00 0.02 0.00 0.00 55.36 56.72 1nzd s GLN 173 Cb -0.47 -0.01 0.02 0.00 1.00 0.00 0.00 33.01 33.56 1nzd s GLN 173 CO 0.53 -0.16 1.19 -0.51 -2.12 0.00 0.00 175.29 174.23 1nzd s LEU 174 N 1.42 3.38 0.41 2.90 1.43 -1.26 -4.97 118.68 121.97 1nzd s LEU 174 Ca -0.10 2.31 -0.23 0.00 -1.03 0.00 0.00 54.13 55.09 1nzd s LEU 174 Cb -0.08 -4.58 -0.10 0.00 0.03 0.00 0.00 46.19 41.46 1nzd s LEU 174 CO -0.13 -2.08 0.99 -0.44 0.23 0.00 0.00 176.35 174.92 1nzd s SER 175 N -2.05 6.88 0.37 2.29 0.01 -0.43 -5.05 113.70 115.72 1nzd s SER 175 Ca 0.74 1.85 0.03 0.00 1.31 0.00 0.00 55.95 59.88 1nzd s SER 175 Cb -0.28 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.37 1nzd s SER 175 CO 0.43 -0.40 0.55 -0.54 0.41 0.00 0.00 173.24 173.69 1nzd s LYS 176 N -2.77 3.16 -0.05 12.44 1.02 -1.26 -4.55 119.74 127.72 1nzd s LYS 176 Ca 0.59 -0.71 -0.39 0.00 0.02 0.00 0.00 55.97 55.48 1nzd s LYS 176 Cb -0.16 -2.70 -0.17 0.00 -0.52 0.00 0.00 37.83 34.28 1nzd s LYS 176 CO 0.20 -0.03 1.39 -2.30 -0.92 0.00 0.00 175.35 173.69 1nzd n PRO 177 N -1.81 0.84 -4.84 -1.68 -0.02 -1.26 -4.72 135.00 121.51 1nzd n PRO 177 Ca -0.01 0.31 -0.27 0.00 -2.02 0.00 0.00 63.50 61.51 1nzd n PRO 177 Cb 0.58 -1.92 -0.15 0.00 -0.02 0.00 0.00 33.50 31.99 1nzd n PRO 177 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1nzd s THR 178 N 1.24 1.71 0.17 3.45 2.01 -1.26 -5.10 115.64 117.86 1nzd s THR 178 Ca 0.90 -1.08 -0.32 0.00 0.31 0.00 0.00 61.69 61.50 1nzd s THR 178 Cb -1.08 -1.45 -0.11 0.00 0.01 0.00 0.00 72.50 69.87 1nzd s THR 178 CO 0.55 0.34 1.68 -0.75 -0.69 0.00 0.00 174.62 175.75 1nzd s LYS 179 N -0.88 4.16 -0.09 4.92 2.47 -1.26 -4.94 119.74 124.13 1nzd s LYS 179 Ca 0.08 2.50 -0.23 0.00 -1.56 0.00 0.00 55.97 56.77 1nzd s LYS 179 Cb -0.09 -3.20 -0.04 0.00 -1.46 0.00 0.00 37.83 33.05 1nzd s LYS 179 CO 0.01 -0.71 0.68 0.15 0.16 0.00 0.00 175.35 175.63 1nzd s LYS 180 N 1.44 4.40 0.00 4.03 -0.14 -1.26 -4.72 119.74 123.49 1nzd s LYS 180 Ca 0.74 0.82 0.00 0.00 -1.36 0.00 0.00 55.97 56.17 1nzd s LYS 180 Cb -0.47 -3.46 0.00 0.00 -1.68 0.00 0.00 37.83 32.22 1nzd s LYS 180 CO 0.32 0.03 0.32 0.25 -0.76 0.00 0.00 175.35 175.52 1nzd n THR 181 N 3.88 0.00 -4.03 2.17 -2.24 -0.18 -5.04 114.28 108.84 1nzd n THR 181 Ca -0.02 -0.40 -0.08 0.00 -2.27 0.00 0.00 64.05 61.28 1nzd n THR 181 Cb 0.51 1.16 -0.10 0.00 -2.10 0.00 0.00 70.33 69.80 1nzd n THR 181 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1nzd s LEU 182 N -0.32 2.30 -0.17 3.22 1.43 -1.01 -5.02 118.68 119.11 1nzd s LEU 182 Ca 0.00 -0.78 -0.15 0.00 -1.03 0.00 0.00 54.13 52.17 1nzd s LEU 182 Cb 0.00 0.24 -0.22 0.00 0.03 0.00 0.00 46.19 46.24 1nzd s LEU 182 CO 0.00 -0.50 0.28 0.47 0.23 0.00 0.00 176.35 176.83 1nzd n ASP 183 N 0.65 1.98 -3.97 2.29 8.00 -0.18 -1.37 116.55 123.96 1nzd n ASP 183 Ca -0.18 0.33 -0.13 0.00 0.71 0.00 0.00 54.79 55.53 1nzd n ASP 183 Cb 0.59 -0.92 -0.13 0.00 -0.02 0.00 0.00 41.12 40.64 1nzd n ASP 183 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1nzd s VAL 184 N -2.45 0.27 0.03 2.53 1.01 -1.10 -1.28 120.40 119.40 1nzd s VAL 184 Ca -0.26 -0.54 -0.02 0.00 0.00 0.00 0.00 61.98 61.16 1nzd s VAL 184 Cb 0.06 -0.31 -0.02 0.00 0.00 0.00 0.00 36.38 36.11 1nzd s VAL 184 CO 0.67 -0.18 0.00 -0.51 0.00 0.00 0.00 175.10 175.08 1nzd s ILE 185 N -0.72 0.13 -0.17 2.22 2.07 -0.65 -1.72 121.20 122.37 1nzd s ILE 185 Ca -0.06 -1.10 -0.07 0.00 -1.41 0.00 0.00 60.65 58.01 1nzd s ILE 185 Cb -0.05 -0.62 0.07 0.00 0.13 0.00 0.00 42.46 41.99 1nzd s ILE 185 CO -0.00 -0.61 0.37 -0.47 -1.91 0.00 0.00 174.94 172.32 1nzd s TYR 186 N -2.12 -0.64 -0.26 3.50 5.04 -0.64 -2.68 117.35 119.55 1nzd s TYR 186 Ca -0.10 1.30 -0.02 0.00 -2.44 0.00 0.00 57.07 55.81 1nzd s TYR 186 Cb -0.05 0.21 0.02 0.00 0.35 0.00 0.00 41.96 42.49 1nzd s TYR 186 CO -0.03 -0.41 -0.04 0.20 -1.34 0.00 0.00 175.55 173.94 1nzd s GLY 187 N 2.19 1.66 0.00 8.97 0.00 -1.26 -1.06 107.32 117.82 1nzd s GLY 187 Ca -0.04 -1.47 0.00 0.00 0.00 0.00 0.00 44.72 43.21 1nzd s GLY 187 CO -0.12 0.55 0.00 0.61 0.00 0.00 0.00 173.10 174.14 1nzd n GLY 188 N 4.70 0.95 3.40 0.20 0.00 0.06 -4.97 105.19 109.53 1nzd n GLY 188 Ca -0.16 -0.45 -0.20 0.00 0.00 0.00 0.00 46.02 45.20 1nzd n GLY 188 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nzd s SER 189 N 2.00 2.61 0.32 1.61 1.04 -1.26 -2.53 113.70 117.49 1nzd s SER 189 Ca 0.00 -1.17 -0.27 0.00 0.48 0.00 0.00 55.95 54.99 1nzd s SER 189 Cb 0.00 -0.14 -0.09 0.00 0.10 0.00 0.00 66.02 65.89 1nzd s SER 189 CO 0.00 -0.34 1.05 0.12 0.98 0.00 0.00 173.24 175.05 1nzd s PHE 190 N -3.06 3.55 -0.11 5.02 5.36 -1.26 -4.88 117.98 122.59 1nzd s PHE 190 Ca 0.28 1.72 -0.09 0.00 -0.96 0.00 0.00 56.93 57.88 1nzd s PHE 190 Cb 0.03 -3.15 0.03 0.00 -0.34 0.00 0.00 43.02 39.59 1nzd s PHE 190 CO 0.11 -0.36 0.29 0.50 -1.46 0.00 0.00 175.22 174.30 1nzd s ARG 191 N -1.81 0.32 0.82 10.12 3.52 -1.26 -5.03 118.95 125.62 1nzd s ARG 191 Ca 0.49 0.46 -0.12 0.00 -0.13 0.00 0.00 55.73 56.43 1nzd s ARG 191 Cb -0.27 0.10 0.08 0.00 -1.56 0.00 0.00 34.95 33.30 1nzd s ARG 191 CO 0.34 -0.07 1.11 -1.54 -0.81 0.00 0.00 175.30 174.32 1nzd s SER 192 N 0.45 4.33 0.00 -2.12 1.04 -1.26 -2.29 113.70 113.85 1nzd s SER 192 Ca -0.02 1.22 0.00 0.00 0.48 0.00 0.00 55.95 57.63 1nzd s SER 192 Cb -0.04 -1.92 0.00 0.00 0.10 0.00 0.00 66.02 64.15 1nzd s SER 192 CO -0.02 -2.06 0.00 0.61 0.98 0.00 0.00 173.24 172.75 1nzd n GLY 193 N -2.17 0.29 0.36 7.32 0.00 -1.26 -4.22 105.19 105.52 1nzd n GLY 193 Ca 0.07 -1.28 0.05 0.00 0.00 0.00 0.00 46.02 44.86 1nzd n GLY 193 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1nzd h GLN 194 N 0.00 1.04 -0.80 1.61 4.15 -1.94 -1.01 115.11 118.15 1nzd h GLN 194 Ca 0.00 -0.06 0.01 0.00 0.77 0.00 0.00 58.65 59.36 1nzd h GLN 194 Cb 0.00 -0.23 -0.04 0.00 0.21 0.00 0.00 27.48 27.42 1nzd h GLN 194 CO 0.00 0.69 0.53 -0.09 -1.93 0.00 0.00 178.83 178.02 1nzd h ARG 195 N 1.07 1.06 0.05 1.69 9.65 -1.73 0.77 114.38 126.94 1nzd h ARG 195 Ca 0.46 -0.07 -0.00 0.00 -1.10 0.00 0.00 59.98 59.27 1nzd h ARG 195 Cb 0.32 -0.24 0.00 0.00 -1.39 0.00 0.00 29.97 28.67 1nzd h ARG 195 CO -0.22 0.71 -0.02 1.49 2.80 0.00 0.00 179.97 184.73 1nzd h GLU 196 N 1.09 -0.06 -0.53 0.20 4.81 -0.85 0.27 114.58 119.51 1nzd h GLU 196 Ca 0.29 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.62 1nzd h GLU 196 Cb -0.11 0.01 -0.08 0.00 0.63 0.00 0.00 28.75 29.20 1nzd h GLU 196 CO -0.06 0.11 0.09 1.03 -0.73 0.00 0.00 179.01 179.44 1nzd h SER 197 N -0.22 -0.04 0.15 1.04 0.87 -0.73 -1.93 113.55 112.69 1nzd h SER 197 Ca -0.01 0.10 -0.14 0.00 -1.23 0.00 0.00 61.79 60.52 1nzd h SER 197 Cb 0.19 0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 1nzd h SER 197 CO 0.01 0.00 -0.51 0.11 -0.53 0.00 0.00 176.83 175.92 1nzd h LYS 198 N 0.22 0.40 -0.52 2.24 1.57 -0.70 -1.36 116.57 118.42 1nzd h LYS 198 Ca 0.27 -0.23 -0.06 0.00 -1.87 0.00 0.00 60.65 58.75 1nzd h LYS 198 Cb 0.38 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 1nzd h LYS 198 CO -0.37 0.81 0.08 0.52 -0.57 0.00 0.00 179.45 179.92 1nzd h MET 199 N 0.32 0.83 -0.22 3.15 2.86 -0.39 0.27 114.93 121.74 1nzd h MET 199 Ca 0.01 -0.19 -0.07 0.00 -2.06 0.00 0.00 59.70 57.39 1nzd h MET 199 Cb 1.00 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.54 1nzd h MET 199 CO 0.09 0.78 -0.14 0.28 1.06 0.00 0.00 176.91 178.98 1nzd h VAL 200 N 0.79 1.31 -0.26 -2.22 2.07 -1.21 0.85 116.25 117.57 1nzd h VAL 200 Ca 0.17 -1.24 0.03 0.00 0.82 0.00 0.00 66.70 66.47 1nzd h VAL 200 Cb 0.36 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 1nzd h VAL 200 CO 0.01 0.38 0.10 -0.08 0.02 0.00 0.00 177.57 178.00 1nzd h GLU 201 N 0.19 0.21 0.00 1.57 4.57 -0.85 -1.93 114.58 118.35 1nzd h GLU 201 Ca 0.05 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.20 1nzd h GLU 201 Cb 0.65 -0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 29.19 1nzd h GLU 201 CO 0.04 0.14 -1.22 1.19 -1.18 0.00 0.00 179.01 177.97 1nzd n PHE 202 N -5.02 0.79 0.23 0.92 3.72 0.05 -4.27 117.46 113.88 1nzd n PHE 202 Ca -0.01 0.23 0.03 0.00 -0.05 0.00 0.00 57.45 57.65 1nzd n PHE 202 Cb 0.09 -0.89 -0.04 0.00 -0.94 0.00 0.00 39.48 37.70 1nzd n PHE 202 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1nzd n LEU 203 N -2.62 0.23 -4.70 4.37 4.77 0.29 -4.95 117.00 114.39 1nzd n LEU 203 Ca -0.02 -0.37 -0.31 0.00 -0.03 0.00 0.00 56.01 55.28 1nzd n LEU 203 Cb 0.58 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.59 1nzd n LEU 203 CO 0.41 0.06 -0.32 -0.36 -1.33 0.00 0.00 177.39 175.85 1nzd s PHE 204 N -1.82 3.05 -1.54 -1.77 0.40 -0.73 -3.93 117.98 111.63 1nzd s PHE 204 Ca 0.01 0.02 -0.09 0.00 -0.60 0.00 0.00 56.93 56.26 1nzd s PHE 204 Cb 0.05 -1.58 0.08 0.00 0.51 0.00 0.00 43.02 42.07 1nzd s PHE 204 CO 0.27 0.48 0.64 -0.25 0.70 0.00 0.00 175.22 177.06 1nzd n ASP 205 N 0.72 -2.09 -0.03 1.36 8.00 0.46 -4.80 116.55 120.17 1nzd n ASP 205 Ca -0.11 -0.98 0.02 0.00 0.71 0.00 0.00 54.79 54.43 1nzd n ASP 205 Cb 0.52 -3.04 -0.14 0.00 -0.02 0.00 0.00 41.12 38.44 1nzd n ASP 205 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1nzd n THR 206 N -4.43 0.68 -0.84 -3.53 -2.24 -1.26 -4.97 114.28 97.70 1nzd n THR 206 Ca -0.11 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 1nzd n THR 206 Cb 0.59 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 1nzd n THR 206 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nzd n GLY 207 N 1.44 0.83 3.94 3.38 0.00 -1.26 -4.98 105.19 108.54 1nzd n GLY 207 Ca -0.14 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.67 1nzd n GLY 207 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nzd s LEU 208 N 0.00 4.10 -0.99 0.99 1.43 -1.26 -5.03 118.68 117.92 1nzd s LEU 208 Ca 0.00 -0.08 -0.22 0.00 -1.03 0.00 0.00 54.13 52.80 1nzd s LEU 208 Cb 0.00 -2.70 0.07 0.00 0.03 0.00 0.00 46.19 43.59 1nzd s LEU 208 CO 0.00 -0.16 1.36 0.21 0.23 0.00 0.00 176.35 177.98 1nzd s ASN 209 N -4.00 6.53 -0.08 2.29 2.47 -1.26 -4.97 114.94 115.92 1nzd s ASN 209 Ca 0.37 -1.60 0.01 0.00 0.42 0.00 0.00 52.86 52.05 1nzd s ASN 209 Cb -0.09 -2.52 -0.03 0.00 -1.45 0.00 0.00 41.25 37.16 1nzd s ASN 209 CO 0.29 -1.39 -0.08 -0.63 -3.72 0.00 0.00 177.10 171.56 1nzd s ILE 210 N 4.36 3.59 0.02 -5.21 1.01 -1.26 -1.01 121.20 122.70 1nzd s ILE 210 Ca 0.42 -0.52 0.08 0.00 0.00 0.00 0.00 60.65 60.63 1nzd s ILE 210 Cb -0.01 -2.47 -0.02 0.00 0.01 0.00 0.00 42.46 39.97 1nzd s ILE 210 CO -0.10 0.59 -0.23 -0.70 0.00 0.00 0.00 174.94 174.50 1nzd s GLU 211 N -0.64 1.66 -0.29 2.79 2.12 -0.70 -1.73 118.70 121.91 1nzd s GLU 211 Ca 0.10 -0.92 0.02 0.00 0.36 0.00 0.00 54.97 54.53 1nzd s GLU 211 Cb -0.11 -1.72 0.08 0.00 0.26 0.00 0.00 34.13 32.64 1nzd s GLU 211 CO 0.02 0.45 0.00 0.12 -0.54 0.00 0.00 175.26 175.32 1nzd s PHE 212 N -0.68 2.97 0.21 5.30 2.19 0.91 -1.62 117.98 127.27 1nzd s PHE 212 Ca 0.09 -2.35 0.05 0.00 0.33 0.00 0.00 56.93 55.05 1nzd s PHE 212 Cb -0.09 -2.20 -0.03 0.00 -1.31 0.00 0.00 43.02 39.39 1nzd s PHE 212 CO 0.01 -0.88 0.31 -0.59 1.83 0.00 0.00 175.22 175.90 1nzd s PHE 213 N 1.19 3.41 -1.69 10.12 -0.71 -0.22 -2.01 117.98 128.05 1nzd s PHE 213 Ca 0.03 0.00 0.00 0.00 -1.04 0.00 0.00 56.93 55.93 1nzd s PHE 213 Cb -0.19 -1.57 0.00 0.00 -1.21 0.00 0.00 43.02 40.05 1nzd s PHE 213 CO -0.10 0.47 0.00 0.41 -1.34 0.00 0.00 175.22 174.66 1nzd n GLY 214 N -1.11 0.41 0.22 1.99 0.00 -1.08 -0.76 105.19 104.87 1nzd n GLY 214 Ca -0.08 -1.84 0.12 0.00 0.00 0.00 0.00 46.02 44.22 1nzd n GLY 214 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1nzd n ASN 215 N 0.00 1.09 -4.74 1.61 3.02 -1.05 -2.55 115.26 112.64 1nzd n ASN 215 Ca 0.00 -0.88 -0.33 0.00 -0.03 0.00 0.00 54.58 53.35 1nzd n ASN 215 Cb 0.00 0.27 0.09 0.00 -0.61 0.00 0.00 39.78 39.53 1nzd n ASN 215 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nzd s ALA 216 N -2.63 2.18 -0.09 5.41 0.00 -1.24 -4.79 121.76 120.60 1nzd s ALA 216 Ca 0.20 0.63 -0.10 0.00 0.00 0.00 0.00 51.96 52.69 1nzd s ALA 216 Cb 0.18 -3.38 0.02 0.00 0.00 0.00 0.00 23.12 19.95 1nzd s ALA 216 CO 0.59 -1.76 0.26 1.03 0.00 0.00 0.00 175.76 175.88 1nzd s ARG 217 N -4.23 0.36 0.39 0.00 0.52 -1.26 -4.84 118.95 109.89 1nzd s ARG 217 Ca 0.69 0.27 0.17 0.00 -0.52 0.00 0.00 55.73 56.34 1nzd s ARG 217 Cb -0.23 0.17 1.08 0.00 0.52 0.00 0.00 34.95 36.49 1nzd s ARG 217 CO 0.47 -0.06 1.76 1.49 0.02 0.00 0.00 175.30 178.98 1nzd h GLU 218 N 5.44 0.40 0.00 3.54 4.81 -1.97 -0.02 114.58 126.79 1nzd h GLU 218 Ca -0.27 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1nzd h GLU 218 Cb 1.19 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.48 1nzd h GLU 218 CO 0.35 0.27 0.00 1.57 -0.73 0.00 0.00 179.01 180.46 1nzd h LYS 219 N 0.41 0.00 0.00 1.92 2.10 -2.02 -2.58 116.57 116.40 1nzd h LYS 219 Ca 0.61 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 59.24 1nzd h LYS 219 Cb 1.50 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.82 1nzd h LYS 219 CO -0.33 0.00 -0.10 1.96 -2.00 0.00 0.00 179.45 178.99 1nzd h GLN 220 N 0.00 0.00 -4.23 0.07 4.20 -1.42 -3.37 115.11 110.36 1nzd h GLN 220 Ca 0.00 0.00 -0.76 0.00 0.06 0.00 0.00 58.65 57.95 1nzd h GLN 220 Cb 0.27 0.00 -0.21 0.00 0.30 0.00 0.00 27.48 27.84 1nzd h GLN 220 CO 0.00 0.10 1.14 1.19 -0.67 0.00 0.00 178.83 180.58 1nzd n PHE 221 N -3.13 4.78 -1.97 2.96 3.01 -0.97 -4.69 117.46 117.44 1nzd n PHE 221 Ca 0.03 -3.44 0.05 0.00 1.01 0.00 0.00 57.45 55.10 1nzd n PHE 221 Cb 0.54 -1.99 0.13 0.00 -0.01 0.00 0.00 39.48 38.14 1nzd n PHE 221 CO 0.00 0.00 0.00 0.36 1.01 0.00 0.00 176.76 178.13 1nzd n LYS 222 N 4.45 0.91 -3.04 -1.08 2.85 -1.26 -5.01 118.16 115.98 1nzd n LYS 222 Ca 0.33 -2.74 -0.42 0.00 -1.05 0.00 0.00 58.31 54.44 1nzd n LYS 222 Cb 0.41 -0.93 -0.06 0.00 -0.65 0.00 0.00 35.03 33.79 1nzd n LYS 222 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 1nzd s ASN 223 N -2.70 6.52 0.65 -5.58 3.84 -1.26 -4.92 114.94 111.49 1nzd s ASN 223 Ca 0.36 0.35 0.29 0.00 0.21 0.00 0.00 52.86 54.07 1nzd s ASN 223 Cb 0.37 -2.36 1.55 0.00 -0.55 0.00 0.00 41.25 40.27 1nzd s ASN 223 CO -0.11 -0.61 1.89 -0.65 -2.79 0.00 0.00 177.10 174.83 1nzd h PRO 224 N 8.35 0.00 0.00 0.43 0.11 -2.02 0.19 132.00 139.06 1nzd h PRO 224 Ca -0.26 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.81 1nzd h PRO 224 Cb 1.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1nzd h PRO 224 CO 0.86 0.00 -0.19 -0.22 -0.21 0.00 0.00 178.00 178.24 1nzd h LYS 225 N 0.00 0.00 -2.48 1.05 3.64 -2.03 -3.33 116.57 113.42 1nzd h LYS 225 Ca 0.04 0.00 -0.60 0.00 -1.27 0.00 0.00 60.65 58.82 1nzd h LYS 225 Cb 0.79 0.00 -0.41 0.00 -0.41 0.00 0.00 32.23 32.20 1nzd h LYS 225 CO -0.00 0.19 -0.74 0.66 -2.27 0.00 0.00 179.45 177.29 1nzd n TYR 226 N -3.34 2.03 -2.22 1.91 4.01 0.65 -5.11 117.16 115.10 1nzd n TYR 226 Ca 0.00 -3.96 -0.38 0.00 -0.16 0.00 0.00 57.90 53.40 1nzd n TYR 226 Cb 0.42 -0.40 -0.01 0.00 -0.31 0.00 0.00 39.34 39.03 1nzd n TYR 226 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1nzd s PRO 227 N -1.49 3.98 0.08 -0.72 0.04 -1.25 -4.70 135.00 130.93 1nzd s PRO 227 Ca 0.33 1.92 -0.17 0.00 0.04 0.00 0.00 61.00 63.12 1nzd s PRO 227 Cb 0.07 -2.66 0.03 0.00 0.04 0.00 0.00 34.50 31.99 1nzd s PRO 227 CO -0.11 -0.41 0.39 1.67 0.04 0.00 0.00 177.00 178.58 1nzd s TRP 228 N -1.39 -0.21 -0.06 0.56 1.48 -1.26 -5.04 118.94 113.02 1nzd s TRP 228 Ca 0.58 0.03 -0.07 0.00 -1.06 0.00 0.00 56.10 55.59 1nzd s TRP 228 Cb -0.33 0.22 -0.04 0.00 -1.16 0.00 0.00 33.47 32.17 1nzd s TRP 228 CO 0.41 -0.62 -0.14 2.41 -4.06 0.00 0.00 176.95 174.94 1nzd n THR 229 N 0.17 1.03 -3.88 0.66 -1.04 -1.26 -4.99 114.28 104.96 1nzd n THR 229 Ca -0.17 0.10 -0.35 0.00 -2.04 0.00 0.00 64.05 61.58 1nzd n THR 229 Cb 0.62 -1.79 -0.13 0.00 -1.82 0.00 0.00 70.33 67.20 1nzd n THR 229 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1nzd s LYS 230 N -2.30 3.47 0.37 -2.82 1.02 -1.26 -5.02 119.74 113.20 1nzd s LYS 230 Ca -0.14 -0.58 0.02 0.00 0.02 0.00 0.00 55.97 55.30 1nzd s LYS 230 Cb 0.04 -3.10 -0.02 0.00 -0.52 0.00 0.00 37.83 34.23 1nzd s LYS 230 CO 0.19 -0.18 0.56 0.00 -0.92 0.00 0.00 175.35 175.00 1nzd s ALA 231 N 1.48 3.83 0.94 5.17 0.00 -1.26 -0.40 121.76 131.52 1nzd s ALA 231 Ca 0.06 -1.09 -0.14 0.00 0.00 0.00 0.00 51.96 50.79 1nzd s ALA 231 Cb -0.14 -2.01 0.16 0.00 0.00 0.00 0.00 23.12 21.13 1nzd s ALA 231 CO -0.01 -0.13 1.21 -1.25 0.00 0.00 0.00 175.76 175.58 1nzd s PRO 232 N -4.35 0.89 -0.04 0.00 0.04 -1.25 -4.90 135.00 125.40 1nzd s PRO 232 Ca 0.43 -0.05 -0.28 0.00 0.04 0.00 0.00 61.00 61.15 1nzd s PRO 232 Cb -0.10 -1.84 -0.03 0.00 0.04 0.00 0.00 34.50 32.57 1nzd s PRO 232 CO 0.35 -2.30 0.89 0.08 0.04 0.00 0.00 177.00 176.06 1nzd s VAL 233 N -3.54 4.92 -0.20 -0.36 1.01 -0.71 -4.87 120.40 116.65 1nzd s VAL 233 Ca 0.68 1.86 -0.09 0.00 0.00 0.00 0.00 61.98 64.42 1nzd s VAL 233 Cb -0.09 -4.23 -0.05 0.00 0.00 0.00 0.00 36.38 32.01 1nzd s VAL 233 CO 0.52 0.17 0.12 -0.36 0.00 0.00 0.00 175.10 175.55 1nzd s PHE 234 N 1.09 3.34 0.28 5.22 0.40 -1.26 -0.06 117.98 126.99 1nzd s PHE 234 Ca 0.47 0.22 0.09 0.00 -0.60 0.00 0.00 56.93 57.11 1nzd s PHE 234 Cb -0.20 -2.16 -0.05 0.00 0.51 0.00 0.00 43.02 41.12 1nzd s PHE 234 CO 0.23 0.19 -0.13 0.95 0.70 0.00 0.00 175.22 177.16 1nzd s THR 235 N 0.54 2.12 1.32 0.64 -4.23 -0.85 -4.97 115.64 110.20 1nzd s THR 235 Ca 0.07 -2.26 -0.20 0.00 -1.18 0.00 0.00 61.69 58.11 1nzd s THR 235 Cb -0.12 -2.38 0.33 0.00 1.34 0.00 0.00 72.50 71.67 1nzd s THR 235 CO 0.00 -0.36 0.99 -0.83 -0.54 0.00 0.00 174.62 173.88 1nzd s GLY 236 N -3.49 1.48 0.60 3.99 0.00 -1.26 -2.63 107.32 106.00 1nzd s GLY 236 Ca 0.29 -0.71 -0.13 0.00 0.00 0.00 0.00 44.72 44.17 1nzd s GLY 236 CO 0.13 0.21 1.02 -1.59 0.00 0.00 0.00 173.10 172.88 1nzd s LYS 237 N -5.03 3.60 0.15 2.90 -2.85 -1.06 -2.68 119.74 114.77 1nzd s LYS 237 Ca 0.69 0.87 0.01 0.00 -1.00 0.00 0.00 55.97 56.54 1nzd s LYS 237 Cb -0.15 -2.08 -0.04 0.00 -2.06 0.00 0.00 37.83 33.50 1nzd s LYS 237 CO 0.59 -0.56 0.00 0.96 0.10 0.00 0.00 175.35 176.44 1nzd s ILE 238 N -2.94 0.53 0.56 3.79 -4.36 -1.26 -4.91 121.20 112.61 1nzd s ILE 238 Ca 0.57 -1.95 -0.21 0.00 -0.26 0.00 0.00 60.65 58.80 1nzd s ILE 238 Cb -0.11 -2.00 -0.05 0.00 1.25 0.00 0.00 42.46 41.55 1nzd s ILE 238 CO 0.46 -0.56 1.29 -2.65 0.24 0.00 0.00 174.94 173.72 1nzd n PRO 239 N -0.16 1.52 0.25 0.37 -0.02 -1.26 -4.88 135.00 130.81 1nzd n PRO 239 Ca -0.08 0.56 0.07 0.00 -2.02 0.00 0.00 63.50 62.04 1nzd n PRO 239 Cb 0.63 -2.50 0.60 0.00 -0.02 0.00 0.00 33.50 32.21 1nzd n PRO 239 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1nzd h MET 240 N 1.22 0.01 0.00 -0.52 4.05 -1.55 -2.12 114.93 116.02 1nzd h MET 240 Ca -0.50 -0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.92 1nzd h MET 240 Cb 1.32 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.12 1nzd h MET 240 CO 0.56 0.06 0.00 0.27 0.23 0.00 0.00 176.91 178.02 1nzd n ASN 241 N -4.48 0.00 -0.04 1.39 6.94 -1.26 -2.67 115.26 115.14 1nzd n ASN 241 Ca -0.03 -0.94 0.03 0.00 -0.02 0.00 0.00 54.58 53.62 1nzd n ASN 241 Cb 0.13 0.00 0.04 0.00 -2.36 0.00 0.00 39.78 37.59 1nzd n ASN 241 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 1nzd n MET 242 N -0.82 2.15 -0.07 -3.83 2.81 -0.80 -4.80 117.12 111.76 1nzd n MET 242 Ca 0.11 -1.66 -0.11 0.00 -1.81 0.00 0.00 57.70 54.22 1nzd n MET 242 Cb 0.05 -1.06 -0.05 0.00 -0.71 0.00 0.00 33.22 31.45 1nzd n MET 242 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1nzd h VAL 243 N 0.57 1.24 -0.45 2.03 2.07 -1.60 -2.10 116.25 118.01 1nzd h VAL 243 Ca 0.00 -0.81 -0.05 0.00 0.82 0.00 0.00 66.70 66.66 1nzd h VAL 243 Cb 0.71 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.84 1nzd h VAL 243 CO 0.00 0.25 0.08 0.28 0.02 0.00 0.00 177.57 178.20 1nzd h SER 244 N 0.12 0.64 -0.52 0.57 0.02 -1.84 0.97 113.55 113.51 1nzd h SER 244 Ca 0.06 -0.11 -0.12 0.00 -0.84 0.00 0.00 61.79 60.77 1nzd h SER 244 Cb 0.36 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 1nzd h SER 244 CO 0.01 0.66 -0.15 -0.08 -1.14 0.00 0.00 176.83 176.13 1nzd h GLU 245 N 0.67 1.02 -0.40 3.45 4.81 -1.89 -2.05 114.58 120.20 1nzd h GLU 245 Ca 0.15 -0.40 -0.05 0.00 -0.13 0.00 0.00 59.36 58.93 1nzd h GLU 245 Cb 0.30 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 1nzd h GLU 245 CO 0.00 1.09 0.04 -0.22 -0.73 0.00 0.00 179.01 179.19 1nzd h LYS 246 N 0.90 0.67 -0.72 1.92 1.63 -0.79 -2.65 116.57 117.53 1nzd h LYS 246 Ca 0.13 -0.19 0.10 0.00 -0.85 0.00 0.00 60.65 59.84 1nzd h LYS 246 Cb 0.72 -0.07 -0.05 0.00 -0.60 0.00 0.00 32.23 32.23 1nzd h LYS 246 CO 0.06 0.73 0.47 -0.91 -3.45 0.00 0.00 179.45 176.35 1nzd h ASN 247 N 0.51 0.52 0.15 4.20 2.35 -0.61 -2.43 115.58 120.27 1nzd h ASN 247 Ca 0.12 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1nzd h ASN 247 Cb 0.40 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.68 1nzd h ASN 247 CO 0.01 0.31 0.00 -1.20 -1.65 0.00 0.00 177.43 174.90 1nzd n SER 248 N -4.49 0.61 0.14 5.81 7.64 -0.79 -2.12 113.62 120.42 1nzd n SER 248 Ca 0.12 0.75 0.13 0.00 1.01 0.00 0.00 58.87 60.88 1nzd n SER 248 Cb 0.37 -0.84 0.48 0.00 -1.01 0.00 0.00 64.21 63.21 1nzd n SER 248 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1nzd h GLN 249 N 0.00 0.00 -6.21 1.43 4.20 -1.54 -3.42 115.11 109.57 1nzd h GLN 249 Ca 0.00 0.00 -0.55 0.00 0.06 0.00 0.00 58.65 58.16 1nzd h GLN 249 Cb 0.08 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.79 1nzd h GLN 249 CO 0.00 0.00 -0.56 0.00 -0.67 0.00 0.00 178.83 177.60 1nzd s ALA 250 N -3.30 3.52 0.14 3.87 0.00 -0.90 -1.01 121.76 124.08 1nzd s ALA 250 Ca 0.05 -1.32 -0.13 0.00 0.00 0.00 0.00 51.96 50.56 1nzd s ALA 250 Cb 0.10 -1.28 -0.01 0.00 0.00 0.00 0.00 23.12 21.92 1nzd s ALA 250 CO 0.47 0.40 1.54 0.82 0.00 0.00 0.00 175.76 178.99 1nzd h ILE 251 N 1.87 1.27 -3.93 0.00 2.04 -1.14 -3.37 117.51 114.25 1nzd h ILE 251 Ca -0.48 -1.24 -0.25 0.00 1.00 0.00 0.00 64.86 63.89 1nzd h ILE 251 Cb 1.22 1.17 -0.19 0.00 -0.74 0.00 0.00 36.82 38.28 1nzd h ILE 251 CO 0.62 0.42 -0.72 0.00 0.00 0.00 0.00 178.15 178.47 1nzd s ALA 252 N -4.77 0.68 0.01 1.87 0.00 -0.40 -0.70 121.76 118.44 1nzd s ALA 252 Ca -0.12 -0.93 0.04 0.00 0.00 0.00 0.00 51.96 50.94 1nzd s ALA 252 Cb 0.11 0.08 -0.01 0.00 0.00 0.00 0.00 23.12 23.30 1nzd s ALA 252 CO 0.83 -0.09 -0.13 0.00 0.00 0.00 0.00 175.76 176.38 1nzd s ALA 253 N -2.06 1.05 0.06 0.00 0.00 -0.29 -1.64 121.76 118.88 1nzd s ALA 253 Ca -0.04 -0.63 0.01 0.00 0.00 0.00 0.00 51.96 51.30 1nzd s ALA 253 Cb -0.05 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.80 1nzd s ALA 253 CO -0.01 0.23 0.15 -0.51 0.00 0.00 0.00 175.76 175.62 1nzd s LEU 254 N -0.61 4.13 -0.21 0.00 1.02 -1.09 -1.41 118.68 120.51 1nzd s LEU 254 Ca 0.03 0.16 -0.01 0.00 0.02 0.00 0.00 54.13 54.34 1nzd s LEU 254 Cb -0.06 -2.72 0.02 0.00 0.02 0.00 0.00 46.19 43.45 1nzd s LEU 254 CO 0.00 0.18 -0.12 -0.63 0.02 0.00 0.00 176.35 175.80 1nzd s ILE 255 N -1.43 2.57 -0.12 -0.59 -1.09 -0.46 -4.92 121.20 115.16 1nzd s ILE 255 Ca 0.32 -0.91 0.01 0.00 -2.23 0.00 0.00 60.65 57.83 1nzd s ILE 255 Cb -0.13 -2.19 -0.01 0.00 -1.58 0.00 0.00 42.46 38.55 1nzd s ILE 255 CO 0.24 0.38 -0.15 -0.63 -1.23 0.00 0.00 174.94 173.56 1nzd s ILE 256 N 1.33 2.89 1.13 2.92 1.01 -1.26 -1.34 121.20 127.88 1nzd s ILE 256 Ca 0.03 -0.73 -0.17 0.00 0.00 0.00 0.00 60.65 59.78 1nzd s ILE 256 Cb -0.15 -2.19 0.26 0.00 0.01 0.00 0.00 42.46 40.39 1nzd s ILE 256 CO -0.08 0.54 1.13 -0.83 0.00 0.00 0.00 174.94 175.69 1nzd s GLY 257 N 0.26 1.59 -0.05 6.18 0.00 -1.26 -5.03 107.32 109.02 1nzd s GLY 257 Ca -0.11 -0.85 -0.29 0.00 0.00 0.00 0.00 44.72 43.47 1nzd s GLY 257 CO 0.06 -0.04 0.80 -0.35 0.00 0.00 0.00 173.10 173.57 1nzd s ASP 258 N -3.91 -0.51 0.23 1.64 2.15 -1.26 -4.20 116.67 110.82 1nzd s ASP 258 Ca 0.70 0.39 -0.31 0.00 0.43 0.00 0.00 52.55 53.76 1nzd s ASP 258 Cb -0.11 0.45 -0.14 0.00 -0.30 0.00 0.00 42.92 42.82 1nzd s ASP 258 CO 0.56 -0.58 1.23 1.17 -0.17 0.00 0.00 175.17 177.38 1nzd n LYS 259 N 0.47 1.58 -0.05 4.34 3.00 -1.26 -1.37 118.16 124.86 1nzd n LYS 259 Ca -0.14 0.56 0.00 0.00 -0.00 0.00 0.00 58.31 58.73 1nzd n LYS 259 Cb 0.59 -2.09 0.00 0.00 0.00 0.00 0.00 35.03 33.53 1nzd n LYS 259 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1nzd n ASN 260 N 1.83 0.00 -0.03 3.14 5.03 -1.26 -4.70 115.26 119.27 1nzd n ASN 260 Ca 0.12 0.00 -0.18 0.00 0.87 0.00 0.00 54.58 55.39 1nzd n ASN 260 Cb 0.29 -0.76 -0.14 0.00 -1.02 0.00 0.00 39.78 38.15 1nzd n ASN 260 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1nzd n TYR 261 N -2.00 0.94 -1.64 3.10 4.02 -0.47 -4.63 117.16 116.48 1nzd n TYR 261 Ca 0.00 0.22 -0.46 0.00 -0.01 0.00 0.00 57.90 57.66 1nzd n TYR 261 Cb 0.00 -1.13 -0.03 0.00 -0.02 0.00 0.00 39.34 38.16 1nzd n TYR 261 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1nzd n ASN 262 N -3.34 2.32 -3.39 7.72 3.02 -1.04 -0.76 115.26 119.79 1nzd n ASN 262 Ca -0.32 1.15 -0.23 0.00 -0.03 0.00 0.00 54.58 55.14 1nzd n ASN 262 Cb 1.04 -1.37 -0.01 0.00 -0.61 0.00 0.00 39.78 38.84 1nzd n ASN 262 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1nzd n ASP 263 N 2.02 -3.47 0.16 6.41 8.00 0.16 -4.65 116.55 125.17 1nzd n ASP 263 Ca 0.12 -0.40 0.00 0.00 0.71 0.00 0.00 54.79 55.22 1nzd n ASP 263 Cb 0.30 -2.88 0.00 0.00 -0.02 0.00 0.00 41.12 38.52 1nzd n ASP 263 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1nzd n ASN 264 N -2.26 -1.13 -4.91 -2.24 5.15 -0.67 -4.86 115.26 104.33 1nzd n ASN 264 Ca -0.01 0.56 -0.30 0.00 -0.60 0.00 0.00 54.58 54.24 1nzd n ASN 264 Cb 0.53 1.22 -0.04 0.00 -0.53 0.00 0.00 39.78 40.97 1nzd n ASN 264 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1nzd s PHE 265 N -1.90 3.49 -0.10 1.20 0.40 0.06 -1.56 117.98 119.56 1nzd s PHE 265 Ca 0.00 0.39 0.02 0.00 -0.60 0.00 0.00 56.93 56.74 1nzd s PHE 265 Cb 0.00 -1.88 -0.02 0.00 0.51 0.00 0.00 43.02 41.63 1nzd s PHE 265 CO 0.00 0.46 -0.16 0.42 0.70 0.00 0.00 175.22 176.64 1nzd s ILE 266 N -1.69 2.83 0.24 0.64 -1.09 -1.26 -4.81 121.20 116.05 1nzd s ILE 266 Ca 0.38 -0.76 0.06 0.00 -2.23 0.00 0.00 60.65 58.10 1nzd s ILE 266 Cb -0.12 -2.14 -0.03 0.00 -1.58 0.00 0.00 42.46 38.58 1nzd s ILE 266 CO 0.27 0.55 0.24 0.42 -1.23 0.00 0.00 174.94 175.19 1nzd s THR 267 N 0.03 4.73 0.33 2.92 -4.23 -1.26 -4.79 115.64 113.37 1nzd s THR 267 Ca -0.06 -1.22 0.10 0.00 -1.18 0.00 0.00 61.69 59.33 1nzd s THR 267 Cb -0.15 -3.54 0.32 0.00 1.34 0.00 0.00 72.50 70.47 1nzd s THR 267 CO 0.05 -0.31 1.75 0.25 -0.54 0.00 0.00 174.62 175.82 1nzd h LEU 268 N 1.50 0.67 -1.11 4.79 5.85 -1.98 -0.78 115.31 124.27 1nzd h LEU 268 Ca -0.49 0.11 0.18 0.00 0.84 0.00 0.00 57.88 58.52 1nzd h LEU 268 Cb 1.23 0.00 -0.09 0.00 0.37 0.00 0.00 40.66 42.17 1nzd h LEU 268 CO 0.61 0.16 0.61 -0.09 -0.34 0.00 0.00 178.44 179.40 1nzd h ARG 269 N 0.61 0.71 -0.27 1.25 2.43 -1.94 -1.74 114.38 115.44 1nzd h ARG 269 Ca 0.61 -0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.79 1nzd h ARG 269 Cb 1.16 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 30.50 1nzd h ARG 269 CO -0.41 0.47 -0.00 0.28 -1.51 0.00 0.00 179.97 178.80 1nzd h VAL 270 N 0.74 0.80 -0.31 0.20 2.07 -1.53 0.13 116.25 118.35 1nzd h VAL 270 Ca 0.54 -0.03 -0.17 0.00 0.82 0.00 0.00 66.70 67.87 1nzd h VAL 270 Cb 0.88 0.72 -0.00 0.00 -1.52 0.00 0.00 31.29 31.37 1nzd h VAL 270 CO -0.32 0.01 -0.47 -0.50 0.02 0.00 0.00 177.57 176.32 1nzd h TRP 271 N 0.08 1.00 -0.47 1.57 4.06 -1.48 0.16 115.95 120.87 1nzd h TRP 271 Ca 0.13 -0.33 -0.04 0.00 2.06 0.00 0.00 58.89 60.72 1nzd h TRP 271 Cb 0.17 -0.20 -0.02 0.00 -1.00 0.00 0.00 29.16 28.10 1nzd h TRP 271 CO -0.21 1.13 0.14 0.93 -3.56 0.00 0.00 178.44 176.87 1nzd h GLU 272 N 0.65 0.69 0.03 0.49 5.08 -0.93 -0.30 114.58 120.27 1nzd h GLU 272 Ca 0.04 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.22 1nzd h GLU 272 Cb 1.05 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 30.19 1nzd h GLU 272 CO 0.10 0.60 -0.24 1.15 -1.00 0.00 0.00 179.01 179.62 1nzd h THR 273 N 0.67 1.63 -1.01 1.13 2.02 -0.65 -3.05 112.91 113.66 1nzd h THR 273 Ca 0.16 -2.18 0.10 0.00 0.77 0.00 0.00 66.41 65.25 1nzd h THR 273 Cb 0.21 3.07 -0.08 0.00 -1.74 0.00 0.00 68.15 69.61 1nzd h THR 273 CO -0.01 0.59 0.64 -0.03 0.37 0.00 0.00 175.52 177.08 1nzd h MET 274 N -0.67 1.04 0.00 6.66 -1.53 -0.81 -0.92 114.93 118.70 1nzd h MET 274 Ca -0.04 -0.06 0.00 0.00 -3.44 0.00 0.00 59.70 56.16 1nzd h MET 274 Cb 1.10 -0.23 0.00 0.00 -0.55 0.00 0.00 31.60 31.91 1nzd h MET 274 CO 0.05 0.69 0.00 0.00 0.14 0.00 0.00 176.91 177.78 1nzd n ALA 275 N -2.35 2.31 -1.97 0.39 0.00 -0.14 -4.47 120.51 114.27 1nzd n ALA 275 Ca 0.18 -0.11 -0.26 0.00 0.00 0.00 0.00 53.44 53.24 1nzd n ALA 275 Cb 0.29 -1.44 0.15 0.00 0.00 0.00 0.00 19.45 18.45 1nzd n ALA 275 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nzd s SER 276 N -2.78 3.65 0.00 0.00 1.04 -0.35 -1.32 113.70 113.94 1nzd s SER 276 Ca 0.20 -0.21 0.16 0.00 0.48 0.00 0.00 55.95 56.58 1nzd s SER 276 Cb 0.18 0.06 0.55 0.00 0.10 0.00 0.00 66.02 66.92 1nzd s SER 276 CO 0.46 -2.35 1.42 -0.67 0.98 0.00 0.00 173.24 173.07 1nzd n ASP 277 N -3.29 1.77 -4.81 7.02 2.03 -1.26 -4.71 116.55 113.31 1nzd n ASP 277 Ca 0.17 -1.84 -0.36 0.00 0.52 0.00 0.00 54.79 53.27 1nzd n ASP 277 Cb 0.60 -0.17 -0.07 0.00 -0.72 0.00 0.00 41.12 40.76 1nzd n ASP 277 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1nzd s ALA 278 N -1.67 3.72 0.14 -1.67 0.00 -1.26 -4.88 121.76 116.14 1nzd s ALA 278 Ca 0.28 -0.68 -0.31 0.00 0.00 0.00 0.00 51.96 51.25 1nzd s ALA 278 Cb 0.15 -1.92 -0.09 0.00 0.00 0.00 0.00 23.12 21.26 1nzd s ALA 278 CO 0.22 0.51 1.44 0.08 0.00 0.00 0.00 175.76 178.00 1nzd s VAL 279 N -0.67 3.10 -0.35 0.00 1.01 0.12 -4.62 120.40 118.98 1nzd s VAL 279 Ca 0.13 0.80 -0.29 0.00 0.00 0.00 0.00 61.98 62.61 1nzd s VAL 279 Cb -0.12 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.76 1nzd s VAL 279 CO 0.02 0.07 1.25 -0.32 0.00 0.00 0.00 175.10 176.12 1nzd s MET 280 N 1.02 3.86 -0.18 2.72 1.75 -1.26 -1.14 119.30 126.07 1nzd s MET 280 Ca 0.66 1.05 -0.03 0.00 -1.25 0.00 0.00 55.69 56.12 1nzd s MET 280 Cb -0.39 -3.88 -0.02 0.00 2.84 0.00 0.00 34.83 33.39 1nzd s MET 280 CO 0.31 -1.19 -0.06 -0.51 -0.65 0.00 0.00 175.02 172.92 1nzd s LEU 281 N 4.42 2.97 -0.12 4.11 1.43 -0.50 -4.68 118.68 126.30 1nzd s LEU 281 Ca 0.54 -0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 53.34 1nzd s LEU 281 Cb -0.14 -1.72 -0.02 0.00 0.03 0.00 0.00 46.19 44.34 1nzd s LEU 281 CO 0.25 0.09 -0.11 -0.63 0.23 0.00 0.00 176.35 176.17 1nzd s ILE 282 N 0.85 3.27 -0.11 -0.59 1.01 0.21 -1.35 121.20 124.49 1nzd s ILE 282 Ca -0.02 -0.59 -0.29 0.00 0.00 0.00 0.00 60.65 59.75 1nzd s ILE 282 Cb -0.15 -2.38 -0.07 0.00 0.01 0.00 0.00 42.46 39.88 1nzd s ILE 282 CO 0.01 0.53 2.12 -0.67 0.00 0.00 0.00 174.94 176.93 1nzd n ASP 283 N 3.33 3.65 -0.33 3.58 2.03 -0.45 -0.76 116.55 127.60 1nzd n ASP 283 Ca -0.18 0.49 0.09 0.00 0.52 0.00 0.00 54.79 55.71 1nzd n ASP 283 Cb 0.53 -1.55 0.19 0.00 -0.72 0.00 0.00 41.12 39.58 1nzd n ASP 283 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 1nzd h GLU 284 N 13.21 0.02 -0.50 -0.67 4.57 -1.22 0.74 114.58 130.74 1nzd h GLU 284 Ca -0.45 -0.00 0.07 0.00 -1.18 0.00 0.00 59.36 57.80 1nzd h GLU 284 Cb 1.24 -0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.80 1nzd h GLU 284 CO 0.95 0.01 0.34 0.93 -1.18 0.00 0.00 179.01 180.06 1nzd h GLU 285 N 0.02 0.36 -0.16 1.92 5.08 -1.89 -2.51 114.58 117.40 1nzd h GLU 285 Ca 0.51 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.79 1nzd h GLU 285 Cb 0.90 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 1nzd h GLU 285 CO -0.92 0.24 -0.14 0.35 -1.00 0.00 0.00 179.01 177.54 1nzd h PHE 286 N 0.37 0.27 -1.43 4.33 3.57 -1.22 -3.36 116.94 119.48 1nzd h PHE 286 Ca 0.22 -0.03 -0.46 0.00 3.53 0.00 0.00 57.97 61.23 1nzd h PHE 286 Cb 0.40 -0.08 -0.32 0.00 2.79 0.00 0.00 35.95 38.74 1nzd h PHE 286 CO -0.00 0.40 -0.94 -3.47 -2.23 0.00 0.00 178.31 172.07 1nzd n ASP 287 N -4.26 -0.65 -0.03 0.41 2.03 -0.98 -0.67 116.55 112.42 1nzd n ASP 287 Ca -0.01 -2.90 0.20 0.00 0.52 0.00 0.00 54.79 52.61 1nzd n ASP 287 Cb 0.28 0.08 0.68 0.00 -0.72 0.00 0.00 41.12 41.44 1nzd n ASP 287 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1nzd h THR 288 N 2.21 0.73 -0.35 5.18 1.35 -1.62 -0.21 112.91 120.19 1nzd h THR 288 Ca 0.01 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1nzd h THR 288 Cb 0.93 0.69 0.00 0.00 -1.73 0.00 0.00 68.15 68.04 1nzd h THR 288 CO 0.42 0.01 0.00 0.29 -0.25 0.00 0.00 175.52 175.99 1nzd n LYS 289 N -4.38 2.12 -3.76 4.72 5.02 -1.26 -4.94 118.16 115.68 1nzd n LYS 289 Ca 0.11 -1.70 -0.24 0.00 -2.02 0.00 0.00 58.31 54.45 1nzd n LYS 289 Cb 0.63 -1.43 0.04 0.00 -0.02 0.00 0.00 35.03 34.25 1nzd n LYS 289 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1nzd n HIS 290 N 0.90 -2.14 0.15 2.13 8.25 -0.09 -4.89 115.22 119.53 1nzd n HIS 290 Ca 0.17 0.88 0.01 0.00 -0.26 0.00 0.00 57.72 58.52 1nzd n HIS 290 Cb 0.45 -4.33 0.30 0.00 1.12 0.00 0.00 29.99 27.52 1nzd n HIS 290 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1nzd h ARG 291 N -2.01 0.08 -0.12 -0.41 2.47 -1.93 -3.21 114.38 109.25 1nzd h ARG 291 Ca -0.60 -0.03 -0.02 0.00 -1.26 0.00 0.00 59.98 58.07 1nzd h ARG 291 Cb 1.36 -0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.68 1nzd h ARG 291 CO 0.60 0.47 -0.01 0.82 0.56 0.00 0.00 179.97 182.41 1nzd h ILE 292 N 0.07 1.26 -2.50 2.04 2.04 -1.91 -3.44 117.51 115.07 1nzd h ILE 292 Ca 0.00 -0.85 -0.09 0.00 1.00 0.00 0.00 64.86 64.92 1nzd h ILE 292 Cb 0.75 1.59 -0.27 0.00 -0.74 0.00 0.00 36.82 38.15 1nzd h ILE 292 CO 0.06 0.25 -0.33 -0.51 0.00 0.00 0.00 178.15 177.61 1nzd s ILE 293 N -4.91 -0.51 -1.47 -0.67 2.07 -1.21 -5.03 121.20 109.47 1nzd s ILE 293 Ca -0.14 0.14 -0.12 0.00 -1.41 0.00 0.00 60.65 59.12 1nzd s ILE 293 Cb 0.05 -0.68 0.03 0.00 0.13 0.00 0.00 42.46 41.98 1nzd s ILE 293 CO 0.71 0.06 2.40 -3.20 -1.91 0.00 0.00 174.94 172.99 1nzd n ASN 294 N 5.11 5.67 -3.26 4.50 5.15 -1.23 -4.70 115.26 126.50 1nzd n ASN 294 Ca -0.12 -2.82 -0.03 0.00 -0.60 0.00 0.00 54.58 51.00 1nzd n ASN 294 Cb 0.51 -1.59 -0.05 0.00 -0.53 0.00 0.00 39.78 38.12 1nzd n ASN 294 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1nzd s ASP 295 N 2.40 -0.46 0.60 1.20 -1.08 -1.26 -5.05 116.67 113.02 1nzd s ASP 295 Ca 0.53 0.51 0.29 0.00 -0.52 0.00 0.00 52.55 53.36 1nzd s ASP 295 Cb 0.15 1.57 1.58 0.00 -1.46 0.00 0.00 42.92 44.76 1nzd s ASP 295 CO -0.07 -0.28 1.98 0.00 0.52 0.00 0.00 175.17 177.32 1nzd h ALA 296 N 8.10 1.91 0.00 3.66 0.00 -1.96 -2.46 119.26 128.52 1nzd h ALA 296 Ca -0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1nzd h ALA 296 Cb 1.16 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1nzd h ALA 296 CO 0.27 -0.50 0.00 0.00 0.00 0.00 0.00 179.25 179.02 1nzd h ARG 297 N 0.00 0.00 -0.16 0.00 3.08 -1.96 -1.54 114.38 113.79 1nzd h ARG 297 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 1nzd h ARG 297 Cb 0.84 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.89 1nzd h ARG 297 CO -0.00 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.09 1nzd n PHE 298 N -2.95 0.20 -5.13 3.04 3.01 -0.92 -4.87 117.46 109.84 1nzd n PHE 298 Ca -0.02 -0.10 -0.32 0.00 1.01 0.00 0.00 57.45 58.02 1nzd n PHE 298 Cb 0.14 0.00 -0.15 0.00 -0.01 0.00 0.00 39.48 39.46 1nzd n PHE 298 CO 0.00 0.00 0.00 0.71 1.01 0.00 0.00 176.76 178.48 1nzd s TYR 299 N -1.80 2.51 -0.10 1.38 1.51 -0.58 0.64 117.35 120.91 1nzd s TYR 299 Ca 0.32 -0.45 0.02 0.00 -1.01 0.00 0.00 57.07 55.95 1nzd s TYR 299 Cb 0.17 -1.59 0.01 0.00 -0.11 0.00 0.00 41.96 40.45 1nzd s TYR 299 CO 0.26 -0.03 -0.15 0.14 -1.11 0.00 0.00 175.55 174.66 1nzd s VAL 300 N -0.46 1.44 0.06 0.71 -7.23 0.06 -4.88 120.40 110.09 1nzd s VAL 300 Ca 0.05 -0.62 -0.02 0.00 -1.81 0.00 0.00 61.98 59.59 1nzd s VAL 300 Cb -0.12 -1.31 -0.27 0.00 0.56 0.00 0.00 36.38 35.25 1nzd s VAL 300 CO 0.01 0.43 1.06 -1.13 -0.31 0.00 0.00 175.10 175.16 1nzd h ASN 301 N 7.27 0.33 -2.04 4.85 -0.73 -1.94 0.31 115.58 123.64 1nzd h ASN 301 Ca -0.30 -0.39 -0.05 0.00 1.87 0.00 0.00 56.30 57.43 1nzd h ASN 301 Cb 1.18 -0.11 -0.01 0.00 0.27 0.00 0.00 38.32 39.66 1nzd h ASN 301 CO 0.48 1.32 0.04 -0.46 -0.37 0.00 0.00 177.43 178.44 1nzd n ASN 302 N -3.46 -0.74 -0.16 1.15 0.23 -1.26 -4.74 115.26 106.28 1nzd n ASN 302 Ca -0.10 -1.65 0.07 0.00 -0.53 0.00 0.00 54.58 52.38 1nzd n ASN 302 Cb 1.02 1.27 0.38 0.00 -2.08 0.00 0.00 39.78 40.37 1nzd n ASN 302 CO 0.00 0.00 0.00 -0.09 -0.93 0.00 0.00 177.26 176.24 1nzd h ARG 303 N 0.00 0.67 0.10 -3.83 2.43 -1.96 -1.69 114.38 110.10 1nzd h ARG 303 Ca -0.12 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.01 1nzd h ARG 303 Cb 0.46 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 1nzd h ARG 303 CO 0.15 0.44 -0.05 0.00 -1.51 0.00 0.00 179.97 179.01 1nzd h ALA 304 N 1.63 -0.13 -0.34 2.80 0.00 -1.96 -1.99 119.26 119.27 1nzd h ALA 304 Ca 0.31 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.12 1nzd h ALA 304 Cb 0.32 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1nzd h ALA 304 CO -0.10 -0.45 0.10 0.93 0.00 0.00 0.00 179.25 179.73 1nzd h GLU 305 N -0.37 0.23 -0.26 0.00 5.08 -1.85 -1.80 114.58 115.61 1nzd h GLU 305 Ca -0.01 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.39 1nzd h GLU 305 Cb 0.31 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.45 1nzd h GLU 305 CO 0.02 0.16 -0.10 1.25 -1.00 0.00 0.00 179.01 179.33 1nzd h LEU 306 N 0.24 -0.35 -0.33 1.33 5.85 -1.27 0.31 115.31 121.09 1nzd h LEU 306 Ca 0.15 0.09 0.04 0.00 0.84 0.00 0.00 57.88 59.01 1nzd h LEU 306 Cb 0.14 0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 1nzd h LEU 306 CO -0.17 -0.13 0.09 0.40 -0.34 0.00 0.00 178.44 178.29 1nzd h ILE 307 N -0.06 0.87 -0.12 4.05 2.04 -1.04 0.31 117.51 123.57 1nzd h ILE 307 Ca 0.13 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 65.91 1nzd h ILE 307 Cb 0.26 0.63 -0.00 0.00 -0.74 0.00 0.00 36.82 36.97 1nzd h ILE 307 CO -0.30 0.04 0.03 0.44 0.00 0.00 0.00 178.15 178.36 1nzd h ASP 308 N 0.22 0.18 -0.45 1.72 3.32 -0.73 -1.21 116.42 119.45 1nzd h ASP 308 Ca 0.15 -0.23 0.04 0.00 0.02 0.00 0.00 57.03 57.02 1nzd h ASP 308 Cb 0.15 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.61 1nzd h ASP 308 CO -0.18 0.36 0.21 -0.09 -1.72 0.00 0.00 179.24 177.82 1nzd h ARG 309 N -0.01 0.41 -0.56 3.56 9.65 -0.18 0.14 114.38 127.38 1nzd h ARG 309 Ca 0.04 -0.02 -0.03 0.00 -1.10 0.00 0.00 59.98 58.86 1nzd h ARG 309 Cb 0.25 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.71 1nzd h ARG 309 CO 0.00 0.27 0.24 0.28 2.80 0.00 0.00 179.97 183.56 1nzd h VAL 310 N 0.42 1.22 -0.58 0.20 2.07 -0.87 -1.57 116.25 117.14 1nzd h VAL 310 Ca 0.20 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 1nzd h VAL 310 Cb 0.14 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.49 1nzd h VAL 310 CO -0.16 0.26 0.34 0.78 0.02 0.00 0.00 177.57 178.81 1nzd h ASN 311 N 0.77 0.71 -0.70 0.57 -0.26 -0.64 0.72 115.58 116.75 1nzd h ASN 311 Ca 0.19 -0.07 0.06 0.00 -0.56 0.00 0.00 56.30 55.92 1nzd h ASN 311 Cb 0.18 -0.18 -0.04 0.00 -1.06 0.00 0.00 38.32 37.22 1nzd h ASN 311 CO -0.02 0.57 0.46 -0.33 -1.06 0.00 0.00 177.43 177.05 1nzd h GLU 312 N 0.79 0.71 -0.15 0.81 5.08 -0.34 0.19 114.58 121.67 1nzd h GLU 312 Ca 0.21 -0.04 -0.22 0.00 -1.00 0.00 0.00 59.36 58.30 1nzd h GLU 312 Cb -0.00 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 29.10 1nzd h GLU 312 CO -0.04 0.47 -0.77 -0.07 -1.00 0.00 0.00 179.01 177.60 1nzd h LEU 313 N 0.74 0.92 -1.19 1.33 3.38 -0.37 -1.88 115.31 118.24 1nzd h LEU 313 Ca 0.30 -0.60 -0.08 0.00 0.09 0.00 0.00 57.88 57.58 1nzd h LEU 313 Cb 0.24 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1nzd h LEU 313 CO -0.10 1.40 -0.34 0.11 0.09 0.00 0.00 178.44 179.60 1nzd h LYS 314 N 0.53 0.11 0.00 1.13 1.57 0.10 -3.03 116.57 116.98 1nzd h LYS 314 Ca -0.05 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1nzd h LYS 314 Cb 1.40 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.70 1nzd h LYS 314 CO 0.16 0.44 -0.60 0.45 -0.57 0.00 0.00 179.45 179.33 1nzd h HIS 315 N 0.09 0.00 -2.98 -1.35 3.86 -0.60 -3.43 115.15 110.75 1nzd h HIS 315 Ca 0.01 0.00 -0.58 0.00 -1.16 0.00 0.00 60.37 58.65 1nzd h HIS 315 Cb 0.65 0.00 -0.40 0.00 1.06 0.00 0.00 27.41 28.72 1nzd h HIS 315 CO 0.00 0.00 -0.77 0.45 0.86 0.00 0.00 177.93 178.48 1nzd s SER 316 N -5.17 3.74 0.46 2.45 0.15 -0.72 -4.96 113.70 109.65 1nzd s SER 316 Ca 0.04 -1.78 0.12 0.00 0.70 0.00 0.00 55.95 55.02 1nzd s SER 316 Cb 0.10 -0.72 1.06 0.00 -1.71 0.00 0.00 66.02 64.74 1nzd s SER 316 CO 0.73 -0.39 2.09 -0.78 1.20 0.00 0.00 173.24 176.10 1nzd h ASP 317 N 7.82 0.21 -0.46 5.45 3.58 -1.84 -1.33 116.42 129.85 1nzd h ASP 317 Ca -0.11 -0.01 -0.09 0.00 0.42 0.00 0.00 57.03 57.24 1nzd h ASP 317 Cb 0.99 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.98 1nzd h ASP 317 CO 0.44 0.17 -0.08 0.58 -2.88 0.00 0.00 179.24 177.48 1nzd h VAL 318 N 0.24 1.27 -0.63 2.25 2.07 -1.93 -0.38 116.25 119.15 1nzd h VAL 318 Ca 0.06 -1.18 -0.01 0.00 0.82 0.00 0.00 66.70 66.39 1nzd h VAL 318 Cb 0.01 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1nzd h VAL 318 CO -0.01 0.41 0.35 0.25 0.02 0.00 0.00 177.57 178.59 1nzd h LEU 319 N 0.72 0.78 0.48 2.57 5.85 -1.63 0.86 115.31 124.94 1nzd h LEU 319 Ca 0.12 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 1nzd h LEU 319 Cb 0.61 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.45 1nzd h LEU 319 CO 0.04 0.64 -0.23 -0.09 -0.34 0.00 0.00 178.44 178.46 1nzd h ARG 320 N 0.86 -0.62 -0.16 1.25 2.43 -1.11 -0.53 114.38 116.49 1nzd h ARG 320 Ca 0.22 0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.42 1nzd h ARG 320 Cb 0.03 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 1nzd h ARG 320 CO -0.04 -0.40 0.03 0.87 -1.51 0.00 0.00 179.97 178.92 1nzd h LYS 321 N -0.67 0.23 -0.26 0.20 1.57 -0.94 -0.59 116.57 116.11 1nzd h LYS 321 Ca -0.07 -0.03 -0.11 0.00 -1.87 0.00 0.00 60.65 58.58 1nzd h LYS 321 Cb 0.51 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.77 1nzd h LYS 321 CO 0.11 0.23 -0.26 1.49 -0.57 0.00 0.00 179.45 180.46 1nzd h GLU 322 N 0.23 0.63 -0.16 3.15 4.81 -0.52 -1.18 114.58 121.53 1nzd h GLU 322 Ca 0.06 -0.33 -0.12 0.00 -0.13 0.00 0.00 59.36 58.84 1nzd h GLU 322 Cb 0.12 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1nzd h GLU 322 CO -0.00 0.93 -0.41 0.52 -0.73 0.00 0.00 179.01 179.32 1nzd h MET 323 N 0.34 0.36 -0.40 1.92 2.86 -0.64 -2.06 114.93 117.31 1nzd h MET 323 Ca 0.04 -0.17 -0.05 0.00 -2.06 0.00 0.00 59.70 57.45 1nzd h MET 323 Cb 0.82 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.46 1nzd h MET 323 CO 0.06 0.71 0.03 -0.07 1.06 0.00 0.00 176.91 178.71 1nzd h LEU 324 N 0.30 0.66 -0.83 1.22 3.38 -1.04 -0.99 115.31 118.01 1nzd h LEU 324 Ca 0.03 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 57.75 1nzd h LEU 324 Cb 0.85 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.37 1nzd h LEU 324 CO 0.07 0.78 0.52 -1.28 0.09 0.00 0.00 178.44 178.62 1nzd h SER 325 N 0.51 0.85 -0.12 -0.43 0.87 -0.98 -0.84 113.55 113.42 1nzd h SER 325 Ca 0.12 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.64 1nzd h SER 325 Cb 0.42 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 62.20 1nzd h SER 325 CO 0.01 0.58 -0.10 0.40 -0.53 0.00 0.00 176.83 177.19 1nzd h ILE 326 N 1.00 1.35 -0.37 2.23 2.04 -1.17 -1.99 117.51 120.61 1nzd h ILE 326 Ca 0.34 -1.22 -0.06 0.00 1.00 0.00 0.00 64.86 64.93 1nzd h ILE 326 Cb 0.06 1.90 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 1nzd h ILE 326 CO -0.13 0.35 -0.00 0.06 0.00 0.00 0.00 178.15 178.43 1nzd h GLN 327 N -0.12 0.58 -0.43 2.37 3.07 -0.99 -0.39 115.11 119.21 1nzd h GLN 327 Ca 0.02 -0.13 -0.10 0.00 0.09 0.00 0.00 58.65 58.53 1nzd h GLN 327 Cb 0.60 -0.08 -0.02 0.00 0.08 0.00 0.00 27.48 28.06 1nzd h GLN 327 CO 0.02 0.61 -0.13 0.45 0.09 0.00 0.00 178.83 179.87 1nzd h HIS 328 N 0.55 0.87 -0.29 0.06 3.86 -1.13 0.28 115.15 119.36 1nzd h HIS 328 Ca 0.12 -0.17 -0.05 0.00 -1.16 0.00 0.00 60.37 59.11 1nzd h HIS 328 Cb 0.36 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.60 1nzd h HIS 328 CO 0.01 0.87 -0.02 0.22 0.86 0.00 0.00 177.93 179.88 1nzd h ASP 329 N 0.71 0.53 -0.63 2.45 3.58 -0.75 -1.98 116.42 120.33 1nzd h ASP 329 Ca 0.11 -0.33 -0.04 0.00 0.42 0.00 0.00 57.03 57.20 1nzd h ASP 329 Cb 0.62 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 41.50 1nzd h ASP 329 CO 0.04 0.73 0.27 0.40 -2.88 0.00 0.00 179.24 177.80 1nzd h ILE 330 N 0.31 1.23 0.06 2.25 2.04 -0.86 -1.99 117.51 120.55 1nzd h ILE 330 Ca 0.08 -0.70 -0.00 0.00 1.00 0.00 0.00 64.86 65.23 1nzd h ILE 330 Cb 0.47 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1nzd h ILE 330 CO 0.02 0.28 -0.03 0.25 0.00 0.00 0.00 178.15 178.67 1nzd h LEU 331 N 0.95 -0.08 -2.28 1.44 5.85 -0.72 -2.35 115.31 118.12 1nzd h LEU 331 Ca 0.22 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 1nzd h LEU 331 Cb 0.17 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.22 1nzd h LEU 331 CO -0.02 -0.05 -0.05 0.78 -0.34 0.00 0.00 178.44 178.76 1nzd h ASN 332 N -0.08 0.00 0.06 1.25 2.35 -0.99 -1.18 115.58 116.99 1nzd h ASN 332 Ca -0.01 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.66 1nzd h ASN 332 Cb 0.07 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 1nzd h ASN 332 CO 0.01 0.05 -0.25 0.11 -1.65 0.00 0.00 177.43 175.70 1nzd h LYS 333 N 0.00 0.32 0.14 0.81 1.57 -0.81 -0.02 116.57 118.57 1nzd h LYS 333 Ca -0.00 -0.11 -0.29 0.00 -1.87 0.00 0.00 60.65 58.39 1nzd h LYS 333 Cb 0.14 -0.02 0.02 0.00 0.08 0.00 0.00 32.23 32.44 1nzd h LYS 333 CO 0.01 0.55 -1.25 1.15 -0.57 0.00 0.00 179.45 179.34 1nzd h THR 334 N 0.28 1.40 0.00 -0.16 2.02 -1.14 -3.20 112.91 112.11 1nzd h THR 334 Ca 0.04 -2.79 -0.03 0.00 0.77 0.00 0.00 66.41 64.41 1nzd h THR 334 Cb 0.60 2.84 -0.00 0.00 -1.74 0.00 0.00 68.15 69.85 1nzd h THR 334 CO 0.04 0.83 -0.14 0.03 0.37 0.00 0.00 175.52 176.65 1nzd h ARG 335 N 0.15 0.00 0.00 6.66 3.08 -0.91 -1.38 114.38 121.97 1nzd h ARG 335 Ca -0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.89 1nzd h ARG 335 Cb 1.95 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.00 1nzd h ARG 335 CO 0.22 0.14 0.00 0.00 -1.07 0.00 0.00 179.97 179.26 1nzd n ALA 336 N -2.38 1.77 -1.08 0.04 0.00 -0.06 -2.63 120.51 116.17 1nzd n ALA 336 Ca -0.02 0.03 -0.06 0.00 0.00 0.00 0.00 53.44 53.39 1nzd n ALA 336 Cb 0.23 -1.36 0.29 0.00 0.00 0.00 0.00 19.45 18.61 1nzd n ALA 336 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1nzd n LYS 337 N -2.02 3.52 -0.19 0.00 5.02 -0.52 -4.65 118.16 119.32 1nzd n LYS 337 Ca 0.03 -3.09 -0.01 0.00 -2.02 0.00 0.00 58.31 53.23 1nzd n LYS 337 Cb 0.24 -2.18 0.09 0.00 -0.02 0.00 0.00 35.03 33.17 1nzd n LYS 337 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1nzd h LYS 338 N 2.46 0.30 -0.73 1.97 3.64 -1.63 -0.94 116.57 121.65 1nzd h LYS 338 Ca 0.27 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.65 1nzd h LYS 338 Cb 2.29 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 34.01 1nzd h LYS 338 CO 0.72 0.20 0.48 0.00 -2.27 0.00 0.00 179.45 178.57 1nzd h ALA 339 N 1.43 1.51 -0.28 5.00 0.00 -1.88 0.21 119.26 125.24 1nzd h ALA 339 Ca 0.29 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 55.04 1nzd h ALA 339 Cb 0.39 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1nzd h ALA 339 CO -0.34 0.45 -0.27 0.93 0.00 0.00 0.00 179.25 180.01 1nzd h GLU 340 N 0.96 0.68 -0.37 0.00 3.07 -1.70 -1.31 114.58 115.91 1nzd h GLU 340 Ca 0.27 -0.36 -0.01 0.00 -0.50 0.00 0.00 59.36 58.76 1nzd h GLU 340 Cb -0.07 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 27.83 1nzd h GLU 340 CO -0.06 0.97 0.19 2.35 -1.40 0.00 0.00 179.01 181.06 1nzd h TRP 341 N 0.42 0.52 -0.64 4.33 7.01 -0.44 -0.29 115.95 126.86 1nzd h TRP 341 Ca 0.05 -0.02 -0.03 0.00 2.11 0.00 0.00 58.89 60.99 1nzd h TRP 341 Cb 0.84 -0.16 -0.03 0.00 -2.10 0.00 0.00 29.16 27.71 1nzd h TRP 341 CO 0.07 0.42 0.27 1.96 -2.79 0.00 0.00 178.44 178.37 1nzd h GLN 342 N 0.46 0.95 -0.44 2.65 4.20 -0.58 -1.19 115.11 121.17 1nzd h GLN 342 Ca 0.13 -0.17 -0.08 0.00 0.06 0.00 0.00 58.65 58.59 1nzd h GLN 342 Cb 0.09 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 1nzd h GLN 342 CO -0.02 0.79 -0.06 -0.44 -0.67 0.00 0.00 178.83 178.43 1nzd h ASP 343 N 0.90 0.74 -0.12 1.46 3.32 -1.00 -2.07 116.42 119.64 1nzd h ASP 343 Ca 0.22 -0.20 -0.11 0.00 0.02 0.00 0.00 57.03 56.96 1nzd h ASP 343 Cb 0.19 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 1nzd h ASP 343 CO -0.02 0.84 -0.28 0.00 -1.72 0.00 0.00 179.24 178.06 1nzd h ALA 344 N 1.23 0.97 -0.07 3.45 0.00 -0.67 -1.90 119.26 122.27 1nzd h ALA 344 Ca 0.13 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1nzd h ALA 344 Cb 0.52 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1nzd h ALA 344 CO 0.03 0.60 0.01 0.35 0.00 0.00 0.00 179.25 180.24 1nzd h PHE 345 N 0.51 0.13 -0.80 0.00 3.57 -0.91 -0.86 116.94 118.59 1nzd h PHE 345 Ca 0.07 -0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.64 1nzd h PHE 345 Cb 0.75 -0.04 -0.07 0.00 2.79 0.00 0.00 35.95 39.38 1nzd h PHE 345 CO 0.03 0.35 0.45 0.87 -2.23 0.00 0.00 178.31 177.78 1nzd h LYS 346 N -0.13 0.73 -0.48 1.11 1.57 -1.29 0.32 116.57 118.41 1nzd h LYS 346 Ca 0.02 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.71 1nzd h LYS 346 Cb 0.29 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1nzd h LYS 346 CO 0.00 0.49 0.09 -0.22 -0.57 0.00 0.00 179.45 179.24 1nzd h LYS 347 N 0.76 0.74 -0.18 3.15 3.64 -1.14 0.35 116.57 123.88 1nzd h LYS 347 Ca 0.39 -0.15 -0.04 0.00 -1.27 0.00 0.00 60.65 59.58 1nzd h LYS 347 Cb 0.36 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 1nzd h LYS 347 CO -0.25 0.69 -0.06 0.00 -2.27 0.00 0.00 179.45 177.56 1nzd h ALA 348 N 1.39 1.57 -0.75 5.00 0.00 0.52 -2.30 119.26 124.69 1nzd h ALA 348 Ca 0.16 -0.16 -0.40 0.00 0.00 0.00 0.00 54.91 54.50 1nzd h ALA 348 Cb 0.30 -0.09 -0.23 0.00 0.00 0.00 0.00 17.79 17.77 1nzd h ALA 348 CO 0.00 0.31 0.37 0.44 0.00 0.00 0.00 179.25 180.37 1nzd n ILE 349 N -4.32 2.97 -3.88 0.00 -5.35 -0.79 -4.94 119.36 103.05 1nzd n ILE 349 Ca -0.00 -2.31 -0.29 0.00 -0.27 0.00 0.00 62.75 59.88 1nzd n ILE 349 Cb 0.22 -0.44 0.03 0.00 -1.74 0.00 0.00 39.64 37.71 1nzd n ILE 349 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1nzd n ASP 350 N -1.13 -4.33 -0.01 7.28 8.00 -0.86 -5.04 116.55 120.47 1nzd n ASP 350 Ca 0.50 -0.78 0.00 0.00 0.71 0.00 0.00 54.79 55.22 1nzd n ASP 350 Cb 1.39 -3.93 0.00 0.00 -0.02 0.00 0.00 41.12 38.56 1nzd n ASP 350 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99