#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pfz s HIS 79 N 0.00 3.07 -0.05 4.31 3.76 -1.26 -4.99 115.29 120.12 1pfz s HIS 79 Ca 0.00 0.58 -0.30 0.00 -0.15 0.00 0.00 55.06 55.19 1pfz s HIS 79 Cb 0.00 -3.04 -0.05 0.00 1.11 0.00 0.00 32.58 30.60 1pfz s HIS 79 CO 0.00 -1.20 1.52 -1.17 -0.85 0.00 0.00 174.74 173.04 1pfz s LEU 80 N -5.18 4.30 -0.08 0.89 2.96 -1.24 -4.88 118.68 115.44 1pfz s LEU 80 Ca 0.58 2.13 0.03 0.00 -0.22 0.00 0.00 54.13 56.65 1pfz s LEU 80 Cb -0.11 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.05 1pfz s LEU 80 CO 0.46 -0.85 -0.19 -0.89 -1.32 0.00 0.00 176.35 173.56 1pfz s THR 81 N 3.47 1.65 0.10 3.68 2.01 -1.26 0.33 115.64 125.62 1pfz s THR 81 Ca 0.68 -0.78 0.10 0.00 0.31 0.00 0.00 61.69 61.99 1pfz s THR 81 Cb -0.31 -1.45 -0.04 0.00 0.01 0.00 0.00 72.50 70.72 1pfz s THR 81 CO 0.26 0.47 -0.25 0.27 -0.69 0.00 0.00 174.62 174.68 1pfz s ILE 82 N 0.45 2.03 0.10 1.82 -4.36 0.11 -4.95 121.20 116.41 1pfz s ILE 82 Ca -0.16 -1.58 -0.05 0.00 -0.26 0.00 0.00 60.65 58.60 1pfz s ILE 82 Cb -0.17 -1.80 -0.05 0.00 1.25 0.00 0.00 42.46 41.69 1pfz s ILE 82 CO 0.06 0.11 0.33 -0.83 0.24 0.00 0.00 174.94 174.86 1pfz s GLY 83 N -1.78 2.24 0.05 6.27 0.00 -1.26 -0.63 107.32 112.21 1pfz s GLY 83 Ca 0.11 -0.60 -0.00 0.00 0.00 0.00 0.00 44.72 44.23 1pfz s GLY 83 CO 0.04 -0.50 -0.04 -0.11 0.00 0.00 0.00 173.10 172.50 1pfz s PHE 84 N -1.55 0.56 0.02 1.90 -0.12 -0.32 -4.85 117.98 113.63 1pfz s PHE 84 Ca 0.37 -0.93 -0.01 0.00 -0.05 0.00 0.00 56.93 56.31 1pfz s PHE 84 Cb -0.13 -0.39 -0.04 0.00 -0.63 0.00 0.00 43.02 41.84 1pfz s PHE 84 CO 0.23 -0.29 0.16 0.15 -0.05 0.00 0.00 175.22 175.42 1pfz s LYS 85 N -3.43 3.30 -0.08 1.99 -0.14 -0.28 -1.92 119.74 119.18 1pfz s LYS 85 Ca 0.04 -0.43 0.04 0.00 -1.36 0.00 0.00 55.97 54.25 1pfz s LYS 85 Cb 0.04 -2.99 -0.01 0.00 -1.68 0.00 0.00 37.83 33.19 1pfz s LYS 85 CO -0.07 0.64 -0.21 0.08 -0.76 0.00 0.00 175.35 175.03 1pfz s VAL 86 N -1.36 2.39 -0.27 3.17 1.01 0.29 0.36 120.40 125.98 1pfz s VAL 86 Ca 0.29 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.37 1pfz s VAL 86 Cb -0.13 -1.92 0.06 0.00 0.00 0.00 0.00 36.38 34.40 1pfz s VAL 86 CO 0.21 0.56 -0.08 -0.70 0.00 0.00 0.00 175.10 175.09 1pfz s GLU 87 N 0.03 2.22 0.52 2.72 2.12 0.19 -4.58 118.70 121.91 1pfz s GLU 87 Ca -0.08 -1.37 0.07 0.00 0.36 0.00 0.00 54.97 53.95 1pfz s GLU 87 Cb -0.15 -2.96 0.05 0.00 0.26 0.00 0.00 34.13 31.33 1pfz s GLU 87 CO 0.05 -0.61 0.71 0.54 -0.54 0.00 0.00 175.26 175.42 1pfz s ASN 88 N 1.12 5.29 0.48 -1.70 2.20 -1.26 -1.39 114.94 119.68 1pfz s ASN 88 Ca -0.07 -0.54 0.13 0.00 -0.94 0.00 0.00 52.86 51.45 1pfz s ASN 88 Cb -0.20 -0.26 1.13 0.00 -2.00 0.00 0.00 41.25 39.92 1pfz s ASN 88 CO -0.05 -1.12 2.11 0.00 -2.94 0.00 0.00 177.10 175.10 1pfz h ALA 89 N 0.30 1.93 -0.46 3.54 0.00 -1.83 -1.71 119.26 121.03 1pfz h ALA 89 Ca -0.36 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.41 1pfz h ALA 89 Cb 1.28 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1pfz h ALA 89 CO 0.44 0.05 -0.20 1.25 0.00 0.00 0.00 179.25 180.79 1pfz h HIS 90 N 0.20 1.09 -0.67 0.00 -0.00 -1.91 -0.50 115.15 113.37 1pfz h HIS 90 Ca 0.07 -0.26 0.05 0.00 -0.00 0.00 0.00 60.37 60.22 1pfz h HIS 90 Cb 0.05 -0.25 -0.05 0.00 -0.00 0.00 0.00 27.41 27.15 1pfz h HIS 90 CO -0.00 1.07 0.39 -0.44 -0.00 0.00 0.00 177.93 178.95 1pfz h ASP 91 N 0.79 0.61 0.52 3.26 3.32 -1.70 -0.74 116.42 122.47 1pfz h ASP 91 Ca 0.10 0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.07 1pfz h ASP 91 Cb 0.78 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 1pfz h ASP 91 CO 0.06 0.41 -0.49 0.03 -1.72 0.00 0.00 179.24 177.53 1pfz h ARG 92 N 0.74 0.00 -0.08 3.56 3.08 -1.26 -2.36 114.38 118.06 1pfz h ARG 92 Ca 0.28 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.33 1pfz h ARG 92 Cb 0.11 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 1pfz h ARG 92 CO -0.15 0.49 0.01 0.82 -1.07 0.00 0.00 179.97 180.08 1pfz h ILE 93 N 0.00 1.21 -0.85 2.04 2.04 -0.03 -1.71 117.51 120.20 1pfz h ILE 93 Ca -0.00 -0.65 0.07 0.00 1.00 0.00 0.00 64.86 65.28 1pfz h ILE 93 Cb 0.88 1.50 -0.06 0.00 -0.74 0.00 0.00 36.82 38.40 1pfz h ILE 93 CO 0.06 0.18 0.52 -0.07 0.00 0.00 0.00 178.15 178.85 1pfz h LEU 94 N -0.11 0.81 -0.33 1.44 3.38 -1.03 0.10 115.31 119.57 1pfz h LEU 94 Ca 0.02 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.03 1pfz h LEU 94 Cb 0.27 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1pfz h LEU 94 CO 0.00 0.50 0.19 0.50 0.09 0.00 0.00 178.44 179.72 1pfz h LYS 95 N 0.93 0.38 -0.33 1.13 3.64 -1.20 0.11 116.57 121.23 1pfz h LYS 95 Ca 0.38 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.73 1pfz h LYS 95 Cb 0.22 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1pfz h LYS 95 CO -0.19 0.25 0.16 1.15 -2.27 0.00 0.00 179.45 178.55 1pfz h THR 96 N 0.39 1.16 -0.83 1.00 2.02 -0.47 0.19 112.91 116.36 1pfz h THR 96 Ca 0.13 -0.44 0.05 0.00 0.77 0.00 0.00 66.41 66.92 1pfz h THR 96 Cb -0.00 0.84 -0.06 0.00 -1.74 0.00 0.00 68.15 67.19 1pfz h THR 96 CO -0.06 0.16 0.52 0.40 0.37 0.00 0.00 175.52 176.91 1pfz h ILE 97 N 0.40 1.08 -0.03 3.11 2.04 -0.50 -1.29 117.51 122.32 1pfz h ILE 97 Ca 0.11 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 1pfz h ILE 97 Cb 0.11 0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 36.20 1pfz h ILE 97 CO -0.02 0.18 -0.01 0.50 0.00 0.00 0.00 178.15 178.80 1pfz h LYS 98 N 0.98 0.06 -0.68 2.37 3.64 -0.63 0.51 116.57 122.81 1pfz h LYS 98 Ca 0.35 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.76 1pfz h LYS 98 Cb 0.10 -0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.86 1pfz h LYS 98 CO -0.15 0.44 0.38 1.15 -2.27 0.00 0.00 179.45 179.01 1pfz h THR 99 N -0.33 0.98 -0.66 1.00 2.02 -0.70 -2.72 112.91 112.50 1pfz h THR 99 Ca 0.01 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 66.94 1pfz h THR 99 Cb 0.42 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.04 1pfz h THR 99 CO 0.00 0.13 0.00 1.41 0.37 0.00 0.00 175.52 177.43 1pfz n HIS 100 N -4.77 0.87 -3.88 3.16 8.25 -0.51 -4.98 115.22 113.36 1pfz n HIS 100 Ca 0.09 -0.43 -0.32 0.00 -0.26 0.00 0.00 57.72 56.79 1pfz n HIS 100 Cb 0.17 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.29 1pfz n HIS 100 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1pfz n LYS 101 N 1.59 -1.76 -0.05 -0.41 5.02 0.04 -4.86 118.16 117.73 1pfz n LYS 101 Ca 0.23 0.35 0.12 0.00 -2.02 0.00 0.00 58.31 56.99 1pfz n LYS 101 Cb 0.61 -3.95 0.31 0.00 -0.02 0.00 0.00 35.03 31.98 1pfz n LYS 101 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1pfz n LEU 102 N -4.44 2.34 -0.04 -0.35 4.77 -0.42 -4.49 117.00 114.37 1pfz n LEU 102 Ca -0.19 -0.87 -0.08 0.00 -0.03 0.00 0.00 56.01 54.84 1pfz n LEU 102 Cb 0.63 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.63 1pfz n LEU 102 CO 0.72 0.43 0.71 0.50 -1.33 0.00 0.00 177.39 178.43 1pfz h LYS 103 N 3.42 -0.23 0.00 3.23 3.64 -1.89 -0.96 116.57 123.78 1pfz h LYS 103 Ca 0.00 0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.28 1pfz h LYS 103 Cb 0.74 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.59 1pfz h LYS 103 CO 0.00 -0.15 -0.54 -0.91 -2.27 0.00 0.00 179.45 175.58 1pfz h ASN 104 N -0.23 0.00 -0.52 4.20 2.35 -1.91 -2.45 115.58 117.02 1pfz h ASN 104 Ca 0.13 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1pfz h ASN 104 Cb 0.43 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.77 1pfz h ASN 104 CO -0.35 0.54 0.31 0.22 -1.65 0.00 0.00 177.43 176.50 1pfz h TYR 105 N 0.00 0.68 0.06 1.19 3.20 -1.66 -0.47 116.97 119.98 1pfz h TYR 105 Ca -0.01 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 1pfz h TYR 105 Cb 1.01 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 39.06 1pfz h TYR 105 CO 0.00 0.48 -0.03 0.82 -1.64 0.00 0.00 178.16 177.79 1pfz h ILE 106 N 0.69 1.01 0.15 1.81 2.04 -1.02 0.22 117.51 122.43 1pfz h ILE 106 Ca 0.18 -0.25 0.01 0.00 1.00 0.00 0.00 64.86 65.80 1pfz h ILE 106 Cb -0.01 1.18 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 1pfz h ILE 106 CO -0.03 0.06 -0.16 0.50 0.00 0.00 0.00 178.15 178.52 1pfz h LYS 107 N -0.20 -0.34 -0.50 2.37 3.64 -1.26 -0.71 116.57 119.58 1pfz h LYS 107 Ca -0.01 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 1pfz h LYS 107 Cb 0.17 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.04 1pfz h LYS 107 CO 0.01 -0.23 0.16 0.93 -2.27 0.00 0.00 179.45 178.06 1pfz h GLU 108 N -0.35 0.77 0.17 1.90 4.39 -1.08 -0.51 114.58 119.87 1pfz h GLU 108 Ca 0.01 -0.16 -0.00 0.00 0.34 0.00 0.00 59.36 59.54 1pfz h GLU 108 Cb 0.34 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1pfz h GLU 108 CO -0.05 0.72 -0.12 0.77 -1.16 0.00 0.00 179.01 179.17 1pfz h SER 109 N 0.67 -0.31 -0.39 1.42 0.02 -0.83 0.18 113.55 114.32 1pfz h SER 109 Ca 0.16 0.02 0.03 0.00 -0.84 0.00 0.00 61.79 61.16 1pfz h SER 109 Cb 0.26 0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.87 1pfz h SER 109 CO -0.01 -0.19 0.21 0.58 -1.14 0.00 0.00 176.83 176.28 1pfz h VAL 110 N -0.29 1.00 -0.32 2.27 2.07 -1.05 -0.22 116.25 119.71 1pfz h VAL 110 Ca -0.01 -0.15 0.01 0.00 0.82 0.00 0.00 66.70 67.37 1pfz h VAL 110 Cb 0.26 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 1pfz h VAL 110 CO 0.00 0.08 0.19 -1.13 0.02 0.00 0.00 177.57 176.73 1pfz h ASN 111 N 0.43 0.32 -0.15 0.57 -1.24 -0.83 -2.00 115.58 112.67 1pfz h ASN 111 Ca 0.16 -0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.17 1pfz h ASN 111 Cb 0.05 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.02 1pfz h ASN 111 CO -0.10 0.23 0.09 0.15 -1.29 0.00 0.00 177.43 176.51 1pfz h PHE 112 N 0.39 0.20 0.00 0.67 3.57 -0.27 0.74 116.94 122.23 1pfz h PHE 112 Ca 0.12 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.62 1pfz h PHE 112 Cb -0.01 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.66 1pfz h PHE 112 CO -0.07 0.19 0.00 -0.07 -2.23 0.00 0.00 178.31 176.13 1pfz h LEU 113 N 0.16 0.00 0.00 0.59 3.38 -0.90 -2.52 115.31 116.02 1pfz h LEU 113 Ca 0.05 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.83 1pfz h LEU 113 Cb 0.05 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 1pfz h LEU 113 CO -0.01 0.00 -1.87 0.59 0.09 0.00 0.00 178.44 177.24 1pfz n ASN 114 N -2.86 0.37 -0.14 -0.43 3.02 -0.77 -4.51 115.26 109.94 1pfz n ASN 114 Ca -0.01 0.16 -0.12 0.00 -0.03 0.00 0.00 54.58 54.59 1pfz n ASN 114 Cb 0.17 0.88 -0.07 0.00 -0.61 0.00 0.00 39.78 40.15 1pfz n ASN 114 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1pfz h SER 115 N 0.00 -1.64 0.00 6.41 4.64 -0.40 -3.46 113.55 119.09 1pfz h SER 115 Ca -0.25 0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1pfz h SER 115 Cb 1.65 0.70 0.00 0.00 -0.31 0.00 0.00 62.40 64.44 1pfz h SER 115 CO 0.03 -0.38 0.00 0.61 -0.87 0.00 0.00 176.83 176.22 1pfz n GLY 116 N -1.40 0.79 0.00 -0.77 0.00 -1.26 -5.05 105.19 97.51 1pfz n GLY 116 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1pfz n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1pfz n LEU 117 N 0.00 0.00 0.00 0.99 4.77 -1.26 -5.20 117.00 116.30 1pfz n LEU 117 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1pfz n LEU 117 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1pfz n LEU 117 CO 0.00 0.00 0.00 1.07 -1.33 0.00 0.00 177.39 177.13 1pfz n THR 118 N -1.58 0.00 -3.73 -5.08 5.66 -1.26 -5.19 114.28 103.10 1pfz n THR 118 Ca 0.00 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.88 1pfz n THR 118 Cb 0.10 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 68.77 1pfz n THR 118 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 1pfz s VAL 9 N 0.00 -0.02 -0.18 1.08 -7.23 -1.26 -5.23 120.40 107.56 1pfz s VAL 9 Ca 0.00 0.06 -0.07 0.00 -1.81 0.00 0.00 61.98 60.17 1pfz s VAL 9 Cb 0.00 -0.49 0.08 0.00 0.56 0.00 0.00 36.38 36.53 1pfz s VAL 9 CO 0.00 0.03 0.39 -0.62 -0.31 0.00 0.00 175.10 174.59 1pfz s ASP 10 N 0.81 -0.18 -0.02 4.85 -1.08 -1.26 -5.01 116.67 114.78 1pfz s ASP 10 Ca -0.05 0.91 0.26 0.00 -0.52 0.00 0.00 52.55 53.14 1pfz s ASP 10 Cb -0.06 1.16 0.43 0.00 -1.46 0.00 0.00 42.92 43.00 1pfz s ASP 10 CO -0.06 -0.23 1.17 2.22 0.52 0.00 0.00 175.17 178.79 1pfz n PHE 11 N 5.24 0.07 -2.95 -5.34 1.16 -1.26 -4.78 117.46 109.59 1pfz n PHE 11 Ca -0.10 -0.59 -0.40 0.00 -1.87 0.00 0.00 57.45 54.48 1pfz n PHE 11 Cb 0.50 -0.16 -0.04 0.00 -1.61 0.00 0.00 39.48 38.17 1pfz n PHE 11 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 1pfz s GLN 12 N -0.23 4.45 -0.54 3.97 -1.52 -1.26 -1.09 119.66 123.44 1pfz s GLN 12 Ca 0.34 1.01 -0.06 0.00 -1.95 0.00 0.00 55.36 54.71 1pfz s GLN 12 Cb 0.39 -3.47 0.14 0.00 -0.22 0.00 0.00 33.01 29.85 1pfz s GLN 12 CO -0.16 -0.01 0.37 1.21 -0.25 0.00 0.00 175.29 176.45 1pfz s ASN 13 N 0.89 5.50 -0.22 5.90 2.47 0.43 -2.88 114.94 127.03 1pfz s ASN 13 Ca 0.41 -2.34 -0.24 0.00 0.42 0.00 0.00 52.86 51.11 1pfz s ASN 13 Cb -0.18 -1.92 -0.01 0.00 -1.45 0.00 0.00 41.25 37.68 1pfz s ASN 13 CO 0.20 -0.53 0.79 -0.63 -3.72 0.00 0.00 177.10 173.20 1pfz s ILE 14 N 0.70 4.89 -0.40 -5.21 1.01 -0.48 -4.39 121.20 117.31 1pfz s ILE 14 Ca 0.11 1.50 -0.10 0.00 0.00 0.00 0.00 60.65 62.16 1pfz s ILE 14 Cb -0.22 -4.08 0.06 0.00 0.01 0.00 0.00 42.46 38.22 1pfz s ILE 14 CO -0.03 -0.01 0.24 -0.04 0.00 0.00 0.00 174.94 175.10 1pfz s MET 15 N 2.49 2.73 -0.09 2.79 -1.94 -1.26 -0.64 119.30 123.39 1pfz s MET 15 Ca 0.34 -1.28 -0.14 0.00 -1.71 0.00 0.00 55.69 52.90 1pfz s MET 15 Cb -0.16 -3.78 -0.05 0.00 2.01 0.00 0.00 34.83 32.85 1pfz s MET 15 CO 0.09 -0.85 0.36 -0.06 -0.01 0.00 0.00 175.02 174.56 1pfz s PHE 16 N 1.50 3.59 -0.07 -0.03 0.40 0.16 -1.10 117.98 122.42 1pfz s PHE 16 Ca 0.02 0.80 -0.00 0.00 -0.60 0.00 0.00 56.93 57.15 1pfz s PHE 16 Cb -0.21 -2.33 0.02 0.00 0.51 0.00 0.00 43.02 41.01 1pfz s PHE 16 CO 0.04 0.43 -0.04 -0.47 0.70 0.00 0.00 175.22 175.89 1pfz s TYR 17 N -0.24 0.89 -1.21 0.36 5.04 0.16 -1.12 117.35 121.23 1pfz s TYR 17 Ca 0.21 -0.31 0.12 0.00 -2.44 0.00 0.00 57.07 54.66 1pfz s TYR 17 Cb -0.15 -0.84 0.28 0.00 0.35 0.00 0.00 41.96 41.60 1pfz s TYR 17 CO 0.09 -0.31 1.18 0.41 -1.34 0.00 0.00 175.55 175.58 1pfz n GLY 18 N 4.63 1.93 1.17 8.97 0.00 -1.26 -0.72 105.19 119.91 1pfz n GLY 18 Ca -0.15 -0.41 0.08 0.00 0.00 0.00 0.00 46.02 45.53 1pfz n GLY 18 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1pfz n ASP 19 N 0.68 4.09 -4.78 1.61 8.00 -1.26 -4.53 116.55 120.36 1pfz n ASP 19 Ca 0.12 -2.50 -0.37 0.00 0.71 0.00 0.00 54.79 52.75 1pfz n ASP 19 Cb 0.42 -0.48 -0.06 0.00 -0.02 0.00 0.00 41.12 40.97 1pfz n ASP 19 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1pfz s ALA 20 N -1.92 3.24 0.04 2.24 0.00 -1.26 -4.50 121.76 119.61 1pfz s ALA 20 Ca 0.42 0.47 0.08 0.00 0.00 0.00 0.00 51.96 52.93 1pfz s ALA 20 Cb 0.28 -3.13 -0.03 0.00 0.00 0.00 0.00 23.12 20.25 1pfz s ALA 20 CO 0.18 0.20 -0.24 -1.21 0.00 0.00 0.00 175.76 174.69 1pfz s GLU 21 N -2.01 1.63 -0.25 0.00 2.02 -0.13 -4.22 118.70 115.74 1pfz s GLU 21 Ca 0.49 -1.02 -0.02 0.00 0.02 0.00 0.00 54.97 54.44 1pfz s GLU 21 Cb -0.18 -1.77 0.08 0.00 0.10 0.00 0.00 34.13 32.36 1pfz s GLU 21 CO 0.23 0.46 0.06 0.08 0.02 0.00 0.00 175.26 176.11 1pfz s VAL 22 N -0.78 0.67 0.06 2.63 1.01 -1.26 -0.92 120.40 121.80 1pfz s VAL 22 Ca 0.10 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.14 1pfz s VAL 22 Cb -0.09 -1.32 0.00 0.00 0.00 0.00 0.00 36.38 34.97 1pfz s VAL 22 CO 0.02 -0.43 0.00 0.61 0.00 0.00 0.00 175.10 175.30 1pfz n GLY 23 N 4.97 -2.07 3.58 4.51 0.00 0.21 -4.85 105.19 111.53 1pfz n GLY 23 Ca -0.06 -1.41 -0.27 0.00 0.00 0.00 0.00 46.02 44.28 1pfz n GLY 23 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1pfz s ASP 24 N -3.52 3.77 -1.29 1.61 1.47 -1.26 -4.71 116.67 112.74 1pfz s ASP 24 Ca 0.00 -1.29 -0.04 0.00 1.18 0.00 0.00 52.55 52.40 1pfz s ASP 24 Cb 0.00 -0.37 0.00 0.00 -0.34 0.00 0.00 42.92 42.22 1pfz s ASP 24 CO 0.00 -0.34 0.52 0.59 0.68 0.00 0.00 175.17 176.62 1pfz n ASN 25 N -0.88 -5.38 -4.67 2.11 3.02 -1.26 -3.79 115.26 104.41 1pfz n ASN 25 Ca -0.05 -0.24 -0.26 0.00 -0.03 0.00 0.00 54.58 54.00 1pfz n ASN 25 Cb 0.65 -4.21 -0.09 0.00 -0.61 0.00 0.00 39.78 35.52 1pfz n ASN 25 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1pfz s GLN 26 N -5.51 2.11 0.57 3.52 -1.52 -1.26 -4.82 119.66 112.75 1pfz s GLN 26 Ca 0.26 -1.89 -0.08 0.00 -1.95 0.00 0.00 55.36 51.69 1pfz s GLN 26 Cb -0.11 -1.87 -0.03 0.00 -0.22 0.00 0.00 33.01 30.78 1pfz s GLN 26 CO 0.32 -0.03 0.92 -0.65 -0.25 0.00 0.00 175.29 175.60 1pfz s GLN 27 N -3.80 3.40 0.55 2.91 -0.21 -1.26 -5.02 119.66 116.23 1pfz s GLN 27 Ca 0.38 0.40 -0.20 0.00 0.02 0.00 0.00 55.36 55.95 1pfz s GLN 27 Cb 0.05 -2.21 -0.05 0.00 1.00 0.00 0.00 33.01 31.79 1pfz s GLN 27 CO 0.20 -0.50 1.21 -1.25 -2.12 0.00 0.00 175.29 172.83 1pfz s PRO 28 N -5.00 3.22 0.14 2.91 0.04 -1.26 -4.96 135.00 130.09 1pfz s PRO 28 Ca 0.52 1.84 0.09 0.00 0.04 0.00 0.00 61.00 63.49 1pfz s PRO 28 Cb -0.11 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.31 1pfz s PRO 28 CO 0.49 -1.01 -0.13 -0.06 0.04 0.00 0.00 177.00 176.33 1pfz s PHE 29 N -1.57 2.60 -0.22 0.56 0.08 -1.26 -4.84 117.98 113.33 1pfz s PHE 29 Ca 0.73 -0.23 -0.02 0.00 0.12 0.00 0.00 56.93 57.53 1pfz s PHE 29 Cb -0.30 -1.33 0.01 0.00 -0.57 0.00 0.00 43.02 40.82 1pfz s PHE 29 CO 0.34 0.45 -0.08 0.99 -0.10 0.00 0.00 175.22 176.82 1pfz s THR 30 N -1.39 2.97 0.08 0.64 2.01 -1.26 -4.43 115.64 114.25 1pfz s THR 30 Ca 0.21 -0.76 0.07 0.00 0.31 0.00 0.00 61.69 61.52 1pfz s THR 30 Cb -0.10 -2.39 -0.04 0.00 0.01 0.00 0.00 72.50 69.98 1pfz s THR 30 CO 0.13 0.36 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.94 1pfz s PHE 31 N 1.39 2.69 -0.00 4.92 0.08 0.11 0.20 117.98 127.36 1pfz s PHE 31 Ca 0.04 -0.18 0.05 0.00 0.12 0.00 0.00 56.93 56.96 1pfz s PHE 31 Cb -0.15 -1.45 -0.03 0.00 -0.57 0.00 0.00 43.02 40.82 1pfz s PHE 31 CO -0.05 0.38 -0.13 0.96 -0.10 0.00 0.00 175.22 176.28 1pfz s ILE 32 N -1.12 3.17 0.03 0.64 -4.36 -0.86 0.38 121.20 119.07 1pfz s ILE 32 Ca 0.19 -0.88 -0.26 0.00 -0.26 0.00 0.00 60.65 59.43 1pfz s ILE 32 Cb -0.11 -2.32 -0.05 0.00 1.25 0.00 0.00 42.46 41.24 1pfz s ILE 32 CO 0.11 0.45 0.82 -0.76 0.24 0.00 0.00 174.94 175.80 1pfz s LEU 33 N -1.17 4.42 -0.23 0.37 1.43 -0.26 -0.90 118.68 122.34 1pfz s LEU 33 Ca 0.14 1.50 -0.02 0.00 -1.03 0.00 0.00 54.13 54.72 1pfz s LEU 33 Cb -0.11 -3.32 0.07 0.00 0.03 0.00 0.00 46.19 42.86 1pfz s LEU 33 CO 0.04 -0.06 0.04 -0.62 0.23 0.00 0.00 176.35 175.98 1pfz s ASP 34 N 0.26 3.33 0.00 2.29 -1.08 -0.82 -4.53 116.67 116.13 1pfz s ASP 34 Ca 0.42 -1.08 0.19 0.00 -0.52 0.00 0.00 52.55 51.56 1pfz s ASP 34 Cb -0.21 -0.74 0.94 0.00 -1.46 0.00 0.00 42.92 41.45 1pfz s ASP 34 CO 0.24 -0.32 1.57 0.35 0.52 0.00 0.00 175.17 177.53 1pfz n THR 35 N 4.95 0.45 -0.27 1.71 -2.24 -1.26 -1.04 114.28 116.59 1pfz n THR 35 Ca -0.08 0.11 0.08 0.00 -2.27 0.00 0.00 64.05 61.90 1pfz n THR 35 Cb 0.45 -0.80 0.23 0.00 -2.10 0.00 0.00 70.33 68.11 1pfz n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pfz n GLY 36 N 0.31 2.65 3.30 3.38 0.00 -1.26 -3.25 105.19 110.32 1pfz n GLY 36 Ca 0.09 -0.57 -0.32 0.00 0.00 0.00 0.00 46.02 45.22 1pfz n GLY 36 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1pfz s SER 37 N -1.00 3.51 0.13 1.61 0.15 -0.90 -4.85 113.70 112.34 1pfz s SER 37 Ca 0.35 -0.44 0.16 0.00 0.70 0.00 0.00 55.95 56.71 1pfz s SER 37 Cb 0.18 -1.42 -0.08 0.00 -1.71 0.00 0.00 66.02 63.00 1pfz s SER 37 CO 0.24 0.18 1.03 0.00 1.20 0.00 0.00 173.24 175.88 1pfz h ALA 38 N 6.59 0.65 -1.05 5.45 0.00 -1.81 0.57 119.26 129.65 1pfz h ALA 38 Ca -0.24 -0.71 -0.54 0.00 0.00 0.00 0.00 54.91 53.42 1pfz h ALA 38 Cb 1.22 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 19.12 1pfz h ALA 38 CO 0.51 0.82 -0.33 -0.80 0.00 0.00 0.00 179.25 179.45 1pfz s ASN 39 N -6.00 4.82 -0.25 0.00 -0.87 -1.26 -3.94 114.94 107.44 1pfz s ASN 39 Ca -0.01 -1.00 -0.08 0.00 -1.57 0.00 0.00 52.86 50.20 1pfz s ASN 39 Cb 0.08 -0.06 -0.04 0.00 -0.02 0.00 0.00 41.25 41.22 1pfz s ASN 39 CO 0.79 -0.90 0.10 -0.22 -2.57 0.00 0.00 177.10 174.30 1pfz s LEU 40 N -4.22 3.62 -0.16 0.60 0.20 -1.26 -1.09 118.68 116.37 1pfz s LEU 40 Ca 0.43 -0.13 -0.03 0.00 0.69 0.00 0.00 54.13 55.09 1pfz s LEU 40 Cb -0.02 -1.98 -0.02 0.00 -0.43 0.00 0.00 46.19 43.74 1pfz s LEU 40 CO 0.26 -0.02 -0.05 0.26 -0.29 0.00 0.00 176.35 176.51 1pfz s TRP 41 N 1.52 2.99 -0.06 5.38 0.52 0.77 -0.80 118.94 129.26 1pfz s TRP 41 Ca 0.06 -0.42 0.02 0.00 0.02 0.00 0.00 56.10 55.78 1pfz s TRP 41 Cb -0.15 -1.97 0.02 0.00 -1.15 0.00 0.00 33.47 30.22 1pfz s TRP 41 CO 0.05 -0.13 -0.10 0.08 0.02 0.00 0.00 176.95 176.87 1pfz s VAL 42 N 0.52 0.98 0.20 4.03 1.01 0.37 -0.66 120.40 126.85 1pfz s VAL 42 Ca -0.04 -0.38 -0.30 0.00 0.00 0.00 0.00 61.98 61.25 1pfz s VAL 42 Cb -0.15 -0.92 -0.09 0.00 0.00 0.00 0.00 36.38 35.23 1pfz s VAL 42 CO 0.03 0.32 1.37 -2.16 0.00 0.00 0.00 175.10 174.66 1pfz s PRO 43 N 0.75 4.34 0.32 2.72 0.04 -1.26 -0.27 135.00 141.63 1pfz s PRO 43 Ca -0.13 2.14 -0.08 0.00 0.04 0.00 0.00 61.00 62.97 1pfz s PRO 43 Cb -0.15 -3.18 -0.06 0.00 0.04 0.00 0.00 34.50 31.15 1pfz s PRO 43 CO 0.03 -0.35 0.63 0.45 0.04 0.00 0.00 177.00 177.80 1pfz s SER 44 N 0.50 6.53 0.42 6.66 0.15 -0.01 -0.87 113.70 127.07 1pfz s SER 44 Ca 0.59 0.92 0.29 0.00 0.70 0.00 0.00 55.95 58.46 1pfz s SER 44 Cb -0.38 -2.23 1.38 0.00 -1.71 0.00 0.00 66.02 63.08 1pfz s SER 44 CO 0.38 -0.24 1.89 1.62 1.20 0.00 0.00 173.24 178.09 1pfz h VAL 45 N 1.44 0.00 0.00 4.45 3.04 -1.39 0.63 116.25 124.42 1pfz h VAL 45 Ca -0.47 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 65.01 1pfz h VAL 45 Cb 1.18 1.00 0.00 0.00 -2.01 0.00 0.00 31.29 31.46 1pfz h VAL 45 CO 0.66 0.00 0.00 0.29 -1.01 0.00 0.00 177.57 177.51 1pfz n LYS 46 N -2.61 0.28 -3.18 4.17 5.02 -1.26 -4.51 118.16 116.07 1pfz n LYS 46 Ca -0.00 0.06 -0.41 0.00 -2.02 0.00 0.00 58.31 55.94 1pfz n LYS 46 Cb 0.18 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.61 1pfz n LYS 46 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1pfz n THR 48 N 5.42 2.09 -1.68 0.00 -2.24 -1.26 -4.64 114.28 111.98 1pfz n THR 48 Ca -0.03 -2.96 -0.30 0.00 -2.27 0.00 0.00 64.05 58.50 1pfz n THR 48 Cb 0.49 -0.22 0.08 0.00 -2.10 0.00 0.00 70.33 68.57 1pfz n THR 48 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1pfz s THR 49 N -3.10 3.08 0.25 4.28 -4.23 -1.26 -4.81 115.64 109.85 1pfz s THR 49 Ca 0.36 0.35 -0.04 0.00 -1.18 0.00 0.00 61.69 61.19 1pfz s THR 49 Cb 0.35 -3.19 0.22 0.00 1.34 0.00 0.00 72.50 71.21 1pfz s THR 49 CO -0.04 -0.46 1.81 0.00 -0.54 0.00 0.00 174.62 175.39 1pfz h ALA 50 N -0.97 1.21 -0.24 3.99 0.00 -1.99 -0.77 119.26 120.49 1pfz h ALA 50 Ca -0.46 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 1pfz h ALA 50 Cb 1.27 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1pfz h ALA 50 CO 0.61 0.12 0.15 0.78 0.00 0.00 0.00 179.25 180.90 1pfz h GLY 51 N 0.82 0.35 1.93 0.00 0.00 -1.92 -2.78 103.07 101.46 1pfz h GLY 51 Ca 0.41 -0.14 -0.07 0.00 0.00 0.00 0.00 47.33 47.53 1pfz h GLY 51 CO -0.25 0.14 -0.28 0.00 0.00 0.00 0.00 176.54 176.15 1pfz n LEU 53 N -4.17 0.35 -0.68 0.00 4.77 -0.35 -1.44 117.00 115.47 1pfz n LEU 53 Ca -0.02 0.60 0.12 0.00 -0.03 0.00 0.00 56.01 56.69 1pfz n LEU 53 Cb 0.35 -0.57 0.20 0.00 -2.33 0.00 0.00 43.42 41.08 1pfz n LEU 53 CO 0.38 -0.49 0.62 0.35 -1.33 0.00 0.00 177.39 176.93 1pfz n THR 54 N -1.90 0.00 -3.38 -5.08 -2.24 -0.78 -4.96 114.28 95.94 1pfz n THR 54 Ca 0.02 -0.36 -0.20 0.00 -2.27 0.00 0.00 64.05 61.24 1pfz n THR 54 Cb 0.16 1.11 -0.00 0.00 -2.10 0.00 0.00 70.33 69.51 1pfz n THR 54 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1pfz s LYS 55 N -2.15 2.52 -0.30 -0.78 -0.14 -0.52 -5.08 119.74 113.28 1pfz s LYS 55 Ca 0.28 -1.56 -0.15 0.00 -1.36 0.00 0.00 55.97 53.18 1pfz s LYS 55 Cb 0.20 -2.47 -0.03 0.00 -1.68 0.00 0.00 37.83 33.85 1pfz s LYS 55 CO 0.39 -0.40 0.37 -1.01 -0.76 0.00 0.00 175.35 173.94 1pfz s HIS 56 N -2.53 3.23 0.04 3.18 3.76 -1.26 -5.03 115.29 116.67 1pfz s HIS 56 Ca 0.50 0.23 0.02 0.00 -0.15 0.00 0.00 55.06 55.65 1pfz s HIS 56 Cb -0.05 -2.63 -0.04 0.00 1.11 0.00 0.00 32.58 30.97 1pfz s HIS 56 CO 0.30 -0.33 0.06 -0.51 -0.85 0.00 0.00 174.74 173.41 1pfz s LEU 57 N 2.07 3.74 -0.07 0.89 1.43 -1.26 -4.74 118.68 120.74 1pfz s LEU 57 Ca 0.14 0.03 -0.27 0.00 -1.03 0.00 0.00 54.13 53.00 1pfz s LEU 57 Cb -0.16 -2.29 -0.03 0.00 0.03 0.00 0.00 46.19 43.74 1pfz s LEU 57 CO 0.11 0.23 0.86 -0.47 0.23 0.00 0.00 176.35 177.31 1pfz s TYR 58 N -1.25 3.56 -0.33 0.29 5.04 -0.05 -4.69 117.35 119.92 1pfz s TYR 58 Ca 0.25 1.44 0.03 0.00 -2.44 0.00 0.00 57.07 56.35 1pfz s TYR 58 Cb -0.12 -3.00 0.09 0.00 0.35 0.00 0.00 41.96 39.28 1pfz s TYR 58 CO 0.17 -0.06 0.02 0.34 -1.34 0.00 0.00 175.55 174.69 1pfz s ASP 59 N 0.98 4.74 0.49 4.32 -1.08 -1.26 -1.07 116.67 123.79 1pfz s ASP 59 Ca 0.44 -1.94 0.24 0.00 -0.52 0.00 0.00 52.55 50.76 1pfz s ASP 59 Cb -0.19 -1.63 1.26 0.00 -1.46 0.00 0.00 42.92 40.91 1pfz s ASP 59 CO 0.20 -0.35 2.01 0.77 0.52 0.00 0.00 175.17 178.32 1pfz h SER 60 N 7.70 0.00 0.52 -0.34 4.64 -1.95 -2.65 113.55 121.47 1pfz h SER 60 Ca -0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 1pfz h SER 60 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1pfz h SER 60 CO 0.52 0.17 0.00 -1.54 -0.87 0.00 0.00 176.83 175.11 1pfz n SER 61 N -3.74 0.62 -0.01 4.97 3.41 -1.26 -2.31 113.62 115.29 1pfz n SER 61 Ca -0.02 0.69 0.09 0.00 -0.26 0.00 0.00 58.87 59.37 1pfz n SER 61 Cb 0.28 -0.81 -0.10 0.00 -0.26 0.00 0.00 64.21 63.32 1pfz n SER 61 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1pfz n LYS 62 N -2.22 0.88 -3.23 4.33 5.02 -1.00 -4.94 118.16 117.00 1pfz n LYS 62 Ca 0.01 -0.03 -0.40 0.00 -2.02 0.00 0.00 58.31 55.87 1pfz n LYS 62 Cb 0.17 -1.38 -0.08 0.00 -0.02 0.00 0.00 35.03 33.73 1pfz n LYS 62 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1pfz s SER 63 N -2.74 6.42 0.45 4.39 0.15 -0.98 -4.55 113.70 116.84 1pfz s SER 63 Ca 0.07 0.44 0.14 0.00 0.70 0.00 0.00 55.95 57.30 1pfz s SER 63 Cb 0.14 -2.28 1.02 0.00 -1.71 0.00 0.00 66.02 63.18 1pfz s SER 63 CO 0.76 -0.33 2.01 0.03 1.20 0.00 0.00 173.24 176.91 1pfz h ARG 64 N 8.09 0.03 -0.05 5.44 3.08 -1.87 -2.94 114.38 126.17 1pfz h ARG 64 Ca -0.29 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.76 1pfz h ARG 64 Cb 1.14 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.18 1pfz h ARG 64 CO 0.73 0.18 0.00 0.25 -1.07 0.00 0.00 179.97 180.06 1pfz n THR 65 N -4.35 0.04 -2.08 2.04 -2.24 -1.26 -4.96 114.28 101.47 1pfz n THR 65 Ca -0.02 -0.32 -0.40 0.00 -2.27 0.00 0.00 64.05 61.03 1pfz n THR 65 Cb 0.22 0.69 -0.01 0.00 -2.10 0.00 0.00 70.33 69.13 1pfz n THR 65 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1pfz s TYR 66 N -1.96 2.91 -0.03 4.78 5.04 -1.11 -4.39 117.35 122.59 1pfz s TYR 66 Ca 0.35 1.41 -0.00 0.00 -2.44 0.00 0.00 57.07 56.39 1pfz s TYR 66 Cb 0.20 -3.68 0.03 0.00 0.35 0.00 0.00 41.96 38.87 1pfz s TYR 66 CO 0.32 -2.01 0.02 -2.00 -1.34 0.00 0.00 175.55 170.55 1pfz s GLU 67 N -2.06 0.11 0.49 4.97 2.12 0.44 -4.99 118.70 119.79 1pfz s GLU 67 Ca 0.54 0.19 -0.23 0.00 0.36 0.00 0.00 54.97 55.83 1pfz s GLU 67 Cb -0.39 -0.44 -0.06 0.00 0.26 0.00 0.00 34.13 33.50 1pfz s GLU 67 CO 0.51 -0.20 1.29 0.21 -0.54 0.00 0.00 175.26 176.53 1pfz s LYS 68 N 1.37 3.47 0.00 4.30 2.20 -1.26 -1.22 119.74 128.61 1pfz s LYS 68 Ca -0.05 2.09 0.00 0.00 -0.36 0.00 0.00 55.97 57.65 1pfz s LYS 68 Cb -0.13 -2.39 0.00 0.00 -1.51 0.00 0.00 37.83 33.80 1pfz s LYS 68 CO -0.03 -0.88 0.00 -3.47 -0.36 0.00 0.00 175.35 170.62 1pfz n ASP 69 N -0.66 0.00 0.00 1.43 -0.08 -1.25 -4.79 116.55 111.21 1pfz n ASP 69 Ca 0.08 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.36 1pfz n ASP 69 Cb 0.46 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.92 1pfz n ASP 69 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1pfz n GLY 70 N 2.43 1.26 3.68 0.27 0.00 0.45 -4.99 105.19 108.29 1pfz n GLY 70 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 1pfz n GLY 70 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1pfz n THR 71 N -2.00 0.24 -2.66 2.61 -1.04 -1.26 -4.59 114.28 105.58 1pfz n THR 71 Ca 0.00 -0.04 -0.34 0.00 -2.04 0.00 0.00 64.05 61.62 1pfz n THR 71 Cb 0.00 -1.86 -0.05 0.00 -1.82 0.00 0.00 70.33 66.60 1pfz n THR 71 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1pfz s LYS 72 N 2.20 4.09 -0.08 -2.82 1.02 -1.26 -0.32 119.74 122.55 1pfz s LYS 72 Ca 0.82 1.31 0.02 0.00 0.02 0.00 0.00 55.97 58.14 1pfz s LYS 72 Cb -0.59 -2.28 0.01 0.00 -0.52 0.00 0.00 37.83 34.46 1pfz s LYS 72 CO 0.40 -0.18 -0.14 0.08 -0.92 0.00 0.00 175.35 174.59 1pfz s VAL 73 N -1.95 1.31 -0.06 3.17 1.01 0.01 -4.90 120.40 119.00 1pfz s VAL 73 Ca 0.62 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 62.06 1pfz s VAL 73 Cb -0.15 -1.20 0.02 0.00 0.00 0.00 0.00 36.38 35.05 1pfz s VAL 73 CO 0.19 0.40 -0.08 -1.61 0.00 0.00 0.00 175.10 174.01 1pfz s GLU 74 N 0.82 1.24 0.00 2.72 0.41 -1.26 -1.47 118.70 121.15 1pfz s GLU 74 Ca -0.11 -0.24 0.00 0.00 -0.41 0.00 0.00 54.97 54.21 1pfz s GLU 74 Cb -0.15 -1.14 0.00 0.00 -1.78 0.00 0.00 34.13 31.06 1pfz s GLU 74 CO 0.02 -0.06 0.00 0.00 -0.49 0.00 0.00 175.26 174.73 1pfz n MET 75 N 4.06 0.00 -1.16 1.61 0.00 -1.26 -5.03 117.12 115.33 1pfz n MET 75 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.48 1pfz n MET 75 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.73 1pfz n MET 75 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 1pfz n VAL 82 N 0.00 -5.44 -4.69 3.17 0.31 -1.26 -5.13 118.33 105.28 1pfz n VAL 82 Ca 0.00 1.64 -0.24 0.00 -0.01 0.00 0.00 64.34 65.73 1pfz n VAL 82 Cb 0.00 -2.97 -0.15 0.00 -0.91 0.00 0.00 33.84 29.82 1pfz n VAL 82 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1pfz s SER 83 N -1.09 2.16 0.00 4.52 0.01 0.29 -4.99 113.70 114.59 1pfz s SER 83 Ca 0.00 -0.42 0.00 0.00 1.31 0.00 0.00 55.95 56.84 1pfz s SER 83 Cb 0.00 -0.20 0.00 0.00 0.21 0.00 0.00 66.02 66.03 1pfz s SER 83 CO 0.00 0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.43 1pfz n GLY 84 N 2.23 1.69 3.45 3.44 0.00 -0.55 -0.18 105.19 115.27 1pfz n GLY 84 Ca -0.16 -0.75 -0.14 0.00 0.00 0.00 0.00 46.02 44.97 1pfz n GLY 84 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1pfz s PHE 85 N -3.51 -0.57 0.33 1.61 -0.71 -0.08 -0.81 117.98 114.26 1pfz s PHE 85 Ca 0.00 0.60 -0.26 0.00 -1.04 0.00 0.00 56.93 56.23 1pfz s PHE 85 Cb 0.00 0.49 -0.09 0.00 -1.21 0.00 0.00 43.02 42.20 1pfz s PHE 85 CO 0.00 -0.75 1.00 -0.06 -1.34 0.00 0.00 175.22 174.07 1pfz s PHE 86 N -2.80 3.56 0.05 3.49 0.08 0.56 0.00 117.98 122.93 1pfz s PHE 86 Ca -0.03 1.74 -0.02 0.00 0.12 0.00 0.00 56.93 58.73 1pfz s PHE 86 Cb -0.01 -3.05 -0.03 0.00 -0.57 0.00 0.00 43.02 39.36 1pfz s PHE 86 CO -0.04 -0.17 -0.00 -1.12 -0.10 0.00 0.00 175.22 173.79 1pfz s SER 87 N -1.45 0.41 -0.03 1.36 0.01 -0.32 -0.41 113.70 113.27 1pfz s SER 87 Ca 0.51 -0.90 0.07 0.00 1.31 0.00 0.00 55.95 56.94 1pfz s SER 87 Cb -0.22 0.21 -0.01 0.00 0.21 0.00 0.00 66.02 66.20 1pfz s SER 87 CO 0.28 -0.58 -0.23 -0.75 0.41 0.00 0.00 173.24 172.37 1pfz s LYS 88 N -3.63 2.11 0.19 12.44 2.20 -0.35 -1.25 119.74 131.44 1pfz s LYS 88 Ca 0.04 -0.84 -0.24 0.00 -0.36 0.00 0.00 55.97 54.57 1pfz s LYS 88 Cb 0.06 -1.92 0.05 0.00 -1.51 0.00 0.00 37.83 34.51 1pfz s LYS 88 CO -0.09 0.44 0.90 0.34 -0.36 0.00 0.00 175.35 176.59 1pfz s ASP 89 N -0.37 -0.18 -0.13 1.43 -1.08 -0.87 -0.42 116.67 115.06 1pfz s ASP 89 Ca 0.04 -0.50 -0.29 0.00 -0.52 0.00 0.00 52.55 51.28 1pfz s ASP 89 Cb -0.11 0.56 -0.02 0.00 -1.46 0.00 0.00 42.92 41.89 1pfz s ASP 89 CO 0.01 -1.04 1.24 -0.22 0.52 0.00 0.00 175.17 175.68 1pfz s LEU 90 N -2.97 4.22 -0.13 -1.34 2.96 -1.26 -0.69 118.68 119.46 1pfz s LEU 90 Ca 0.13 1.74 -0.02 0.00 -0.22 0.00 0.00 54.13 55.76 1pfz s LEU 90 Cb -0.03 -3.55 -0.02 0.00 0.50 0.00 0.00 46.19 43.09 1pfz s LEU 90 CO 0.04 -0.70 -0.07 -0.69 -1.32 0.00 0.00 176.35 173.61 1pfz s VAL 91 N 3.04 3.59 -0.07 1.68 1.01 0.16 -0.62 120.40 129.19 1pfz s VAL 91 Ca 0.55 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 62.10 1pfz s VAL 91 Cb -0.23 -2.54 -0.00 0.00 0.00 0.00 0.00 36.38 33.61 1pfz s VAL 91 CO 0.17 0.52 -0.21 -0.89 0.00 0.00 0.00 175.10 174.70 1pfz s THR 92 N 0.16 1.76 -0.22 3.92 2.01 -0.10 -1.23 115.64 121.94 1pfz s THR 92 Ca -0.04 -0.87 -0.02 0.00 0.31 0.00 0.00 61.69 61.08 1pfz s THR 92 Cb -0.14 -1.52 0.07 0.00 0.01 0.00 0.00 72.50 70.91 1pfz s THR 92 CO 0.04 0.49 0.03 -0.69 -0.69 0.00 0.00 174.62 173.80 1pfz s VAL 93 N 0.24 0.80 0.00 3.82 1.01 0.65 -0.95 120.40 125.97 1pfz s VAL 93 Ca -0.12 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.01 1pfz s VAL 93 Cb -0.15 -1.31 0.00 0.00 0.00 0.00 0.00 36.38 34.92 1pfz s VAL 93 CO 0.06 -0.26 0.00 0.61 0.00 0.00 0.00 175.10 175.50 1pfz n GLY 94 N 4.93 2.97 1.22 4.51 0.00 -1.26 -1.52 105.19 116.04 1pfz n GLY 94 Ca -0.08 -0.20 0.10 0.00 0.00 0.00 0.00 46.02 45.83 1pfz n GLY 94 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1pfz n ASN 95 N 6.38 3.54 -4.60 1.61 0.23 -1.26 -4.87 115.26 116.30 1pfz n ASN 95 Ca 0.00 -2.09 -0.35 0.00 -0.53 0.00 0.00 54.58 51.61 1pfz n ASN 95 Cb 0.00 -0.45 -0.10 0.00 -2.08 0.00 0.00 39.78 37.15 1pfz n ASN 95 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1pfz s LEU 96 N -1.15 3.70 0.00 -4.53 1.43 -0.58 -5.09 118.68 112.46 1pfz s LEU 96 Ca 0.42 0.02 0.03 0.00 -1.03 0.00 0.00 54.13 53.57 1pfz s LEU 96 Cb 0.23 -1.94 -0.01 0.00 0.03 0.00 0.00 46.19 44.51 1pfz s LEU 96 CO 0.27 0.15 -0.08 -0.44 0.23 0.00 0.00 176.35 176.48 1pfz s SER 97 N 0.49 0.96 -0.11 2.29 0.01 -1.26 -0.25 113.70 115.83 1pfz s SER 97 Ca 0.02 -0.19 -0.30 0.00 1.31 0.00 0.00 55.95 56.79 1pfz s SER 97 Cb -0.13 -0.09 0.08 0.00 0.21 0.00 0.00 66.02 66.09 1pfz s SER 97 CO 0.01 0.07 0.76 -1.48 0.41 0.00 0.00 173.24 173.01 1pfz s LEU 98 N -0.35 -0.61 0.02 2.44 2.34 -0.37 -4.96 118.68 117.18 1pfz s LEU 98 Ca 0.02 0.77 -0.30 0.00 0.06 0.00 0.00 54.13 54.67 1pfz s LEU 98 Cb -0.04 2.37 -0.06 0.00 -0.56 0.00 0.00 46.19 47.90 1pfz s LEU 98 CO -0.00 -0.49 1.49 -2.84 -1.06 0.00 0.00 176.35 173.45 1pfz s PRO 99 N -0.89 4.25 -0.00 1.48 0.02 -1.26 -0.66 135.00 137.93 1pfz s PRO 99 Ca -0.07 2.09 -0.03 0.00 0.02 0.00 0.00 61.00 63.01 1pfz s PRO 99 Cb -0.01 -3.61 -0.00 0.00 0.02 0.00 0.00 34.50 30.90 1pfz s PRO 99 CO 0.06 -0.64 0.06 -0.47 -0.33 0.00 0.00 177.00 175.68 1pfz s TYR 100 N 2.59 0.06 -0.26 6.54 5.04 0.13 -4.91 117.35 126.55 1pfz s TYR 100 Ca 0.67 -0.12 -0.16 0.00 -2.44 0.00 0.00 57.07 55.03 1pfz s TYR 100 Cb -0.34 -0.06 -0.04 0.00 0.35 0.00 0.00 41.96 41.87 1pfz s TYR 100 CO 0.28 -0.15 0.40 0.15 -1.34 0.00 0.00 175.55 174.89 1pfz s LYS 101 N -0.81 4.06 0.41 4.97 1.02 -1.26 -2.05 119.74 126.08 1pfz s LYS 101 Ca -0.09 0.12 0.04 0.00 0.02 0.00 0.00 55.97 56.06 1pfz s LYS 101 Cb -0.05 -3.63 -0.05 0.00 -0.52 0.00 0.00 37.83 33.58 1pfz s LYS 101 CO 0.00 -0.24 0.05 -0.59 -0.92 0.00 0.00 175.35 173.64 1pfz s PHE 102 N 1.97 2.05 -0.26 3.18 -0.71 -0.38 -4.77 117.98 119.06 1pfz s PHE 102 Ca 0.17 -0.95 -0.09 0.00 -1.04 0.00 0.00 56.93 55.02 1pfz s PHE 102 Cb -0.16 -1.47 -0.04 0.00 -1.21 0.00 0.00 43.02 40.14 1pfz s PHE 102 CO 0.09 0.12 0.13 0.42 -1.34 0.00 0.00 175.22 174.64 1pfz s ILE 103 N -3.02 4.80 -0.15 -4.49 1.01 0.02 -1.17 121.20 118.20 1pfz s ILE 103 Ca 0.26 -0.00 -0.23 0.00 0.00 0.00 0.00 60.65 60.67 1pfz s ILE 103 Cb 0.06 -3.27 -0.02 0.00 0.01 0.00 0.00 42.46 39.24 1pfz s ILE 103 CO 0.13 0.30 0.74 -1.61 0.00 0.00 0.00 174.94 174.50 1pfz s GLU 104 N 1.66 4.31 -0.23 2.79 2.02 0.10 -0.48 118.70 128.86 1pfz s GLU 104 Ca 0.07 0.86 -0.13 0.00 0.02 0.00 0.00 54.97 55.79 1pfz s GLU 104 Cb -0.15 -3.54 -0.04 0.00 0.10 0.00 0.00 34.13 30.49 1pfz s GLU 104 CO 0.07 -0.21 0.27 0.08 0.02 0.00 0.00 175.26 175.49 1pfz s VAL 105 N 1.75 5.28 -0.08 2.63 1.01 0.63 -0.90 120.40 130.71 1pfz s VAL 105 Ca 0.35 0.40 0.18 0.00 0.00 0.00 0.00 61.98 62.91 1pfz s VAL 105 Cb -0.17 -3.60 -0.27 0.00 0.00 0.00 0.00 36.38 32.34 1pfz s VAL 105 CO 0.13 0.28 0.42 2.30 0.00 0.00 0.00 175.10 178.23 1pfz n ILE 106 N 4.47 0.00 -3.69 2.22 -5.35 0.75 -0.83 119.36 116.93 1pfz n ILE 106 Ca -0.12 -0.38 -0.14 0.00 -0.27 0.00 0.00 62.75 61.84 1pfz n ILE 106 Cb 0.52 0.16 -0.14 0.00 -1.74 0.00 0.00 39.64 38.44 1pfz n ILE 106 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1pfz s ASP 107 N -3.95 0.26 -0.07 7.28 2.15 -0.83 -4.26 116.67 117.25 1pfz s ASP 107 Ca -0.06 0.50 0.15 0.00 0.43 0.00 0.00 52.55 53.57 1pfz s ASP 107 Cb 0.12 0.50 0.54 0.00 -0.30 0.00 0.00 42.92 43.78 1pfz s ASP 107 CO 0.74 -0.22 1.42 0.35 -0.17 0.00 0.00 175.17 177.30 1pfz n THR 108 N 5.00 1.26 0.00 1.71 -2.24 -1.26 -0.55 114.28 118.20 1pfz n THR 108 Ca -0.12 -0.87 0.00 0.00 -2.27 0.00 0.00 64.05 60.80 1pfz n THR 108 Cb 0.51 0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.84 1pfz n THR 108 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1pfz n ASN 109 N 0.89 0.00 -0.14 3.42 2.85 -1.26 0.18 115.26 121.20 1pfz n ASN 109 Ca 0.20 0.00 0.13 0.00 -0.11 0.00 0.00 54.58 54.80 1pfz n ASN 109 Cb 0.66 0.00 0.45 0.00 1.24 0.00 0.00 39.78 42.13 1pfz n ASN 109 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1pfz n GLY 110 N 0.00 -0.89 0.00 8.20 0.00 -1.26 -3.62 105.19 107.62 1pfz n GLY 110 Ca 0.00 -0.33 0.14 0.00 0.00 0.00 0.00 46.02 45.83 1pfz n GLY 110 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1pfz n PHE 111 N -0.96 0.00 -0.35 1.61 3.01 0.13 -4.10 117.46 116.79 1pfz n PHE 111 Ca 0.11 0.00 -0.04 0.00 1.01 0.00 0.00 57.45 58.53 1pfz n PHE 111 Cb 0.32 -0.37 0.00 0.00 -0.01 0.00 0.00 39.48 39.43 1pfz n PHE 111 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 1pfz h GLU 112 N 0.00 -0.04 0.12 -1.08 5.08 -1.61 0.53 114.58 117.59 1pfz h GLU 112 Ca 0.00 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1pfz h GLU 112 Cb 0.36 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.57 1pfz h GLU 112 CO 0.00 -0.03 -0.40 -1.35 -1.00 0.00 0.00 179.01 176.23 1pfz h PRO 113 N -0.04 -0.61 -0.31 2.33 0.11 -1.90 0.79 132.00 132.37 1pfz h PRO 113 Ca 0.28 0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.42 1pfz h PRO 113 Cb 0.56 0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.79 1pfz h PRO 113 CO -0.92 -0.41 0.14 1.15 -0.21 0.00 0.00 178.00 177.76 1pfz h THR 114 N -0.63 1.17 0.01 -1.15 2.02 -1.61 -0.39 112.91 112.33 1pfz h THR 114 Ca 0.02 -0.50 -0.00 0.00 0.77 0.00 0.00 66.41 66.71 1pfz h THR 114 Cb 0.66 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 67.99 1pfz h THR 114 CO -0.23 0.18 -0.00 0.22 0.37 0.00 0.00 175.52 176.05 1pfz h TYR 115 N 0.36 -0.01 -0.56 3.16 3.20 0.20 0.40 116.97 123.72 1pfz h TYR 115 Ca 0.11 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.03 1pfz h TYR 115 Cb 0.15 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.39 1pfz h TYR 115 CO -0.01 0.12 0.37 1.15 -1.64 0.00 0.00 178.16 178.15 1pfz h THR 116 N -0.14 1.00 -0.01 1.81 2.02 0.70 -0.72 112.91 117.56 1pfz h THR 116 Ca -0.00 -0.18 -0.16 0.00 0.77 0.00 0.00 66.41 66.83 1pfz h THR 116 Cb 0.13 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 66.94 1pfz h THR 116 CO 0.00 0.10 -0.74 0.00 0.37 0.00 0.00 175.52 175.25 1pfz h ALA 117 N 1.70 0.74 -2.21 6.16 0.00 -0.57 -3.45 119.26 121.62 1pfz h ALA 117 Ca 0.24 -0.65 -0.43 0.00 0.00 0.00 0.00 54.91 54.06 1pfz h ALA 117 Cb 0.27 -0.10 0.18 0.00 0.00 0.00 0.00 17.79 18.14 1pfz h ALA 117 CO -0.07 0.87 0.14 -1.54 0.00 0.00 0.00 179.25 178.65 1pfz s SER 118 N -6.86 1.64 -0.19 0.00 1.04 0.09 -4.99 113.70 104.42 1pfz s SER 118 Ca -0.02 0.99 0.14 0.00 0.48 0.00 0.00 55.95 57.54 1pfz s SER 118 Cb 0.11 -1.52 0.39 0.00 0.10 0.00 0.00 66.02 65.11 1pfz s SER 118 CO 0.80 -3.72 1.23 0.35 0.98 0.00 0.00 173.24 172.87 1pfz n THR 119 N -4.54 2.14 -4.50 2.02 -2.24 -1.26 -4.99 114.28 100.91 1pfz n THR 119 Ca 0.08 -2.85 -0.25 0.00 -2.27 0.00 0.00 64.05 58.76 1pfz n THR 119 Cb 0.58 -0.25 -0.10 0.00 -2.10 0.00 0.00 70.33 68.46 1pfz n THR 119 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1pfz s PHE 120 N -3.11 2.29 -0.21 4.78 -0.12 -1.26 -4.95 117.98 115.39 1pfz s PHE 120 Ca 0.37 -0.49 -0.15 0.00 -0.05 0.00 0.00 56.93 56.61 1pfz s PHE 120 Cb 0.34 -1.23 -0.08 0.00 -0.63 0.00 0.00 43.02 41.42 1pfz s PHE 120 CO -0.03 0.57 -0.33 -0.25 -0.05 0.00 0.00 175.22 175.13 1pfz n ASP 121 N -0.71 1.85 -3.32 1.98 8.00 0.13 -4.98 116.55 119.50 1pfz n ASP 121 Ca -0.05 0.32 -0.19 0.00 0.71 0.00 0.00 54.79 55.58 1pfz n ASP 121 Cb 0.63 -0.74 -0.05 0.00 -0.02 0.00 0.00 41.12 40.94 1pfz n ASP 121 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1pfz n GLY 122 N 1.48 3.56 3.09 0.44 0.00 -0.72 -4.25 105.19 108.80 1pfz n GLY 122 Ca -0.32 -2.12 -0.28 0.00 0.00 0.00 0.00 46.02 43.30 1pfz n GLY 122 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pfz s ILE 123 N -2.54 1.50 -0.42 -0.61 1.01 0.17 -2.04 121.20 118.28 1pfz s ILE 123 Ca 0.11 -0.68 -0.14 0.00 0.00 0.00 0.00 60.65 59.94 1pfz s ILE 123 Cb 0.01 -1.34 0.04 0.00 0.01 0.00 0.00 42.46 41.17 1pfz s ILE 123 CO 0.08 0.44 0.31 -0.22 0.00 0.00 0.00 174.94 175.54 1pfz s LEU 124 N 0.63 5.19 0.05 2.97 1.98 -0.08 -0.16 118.68 129.26 1pfz s LEU 124 Ca -0.14 -1.07 -0.30 0.00 -2.89 0.00 0.00 54.13 49.72 1pfz s LEU 124 Cb -0.16 -2.13 -0.05 0.00 0.66 0.00 0.00 46.19 44.50 1pfz s LEU 124 CO 0.04 -0.50 1.15 -0.83 -1.89 0.00 0.00 176.35 174.33 1pfz s GLY 125 N 1.93 2.52 -0.14 7.98 0.00 -0.25 -1.94 107.32 117.42 1pfz s GLY 125 Ca 0.04 0.79 0.16 0.00 0.00 0.00 0.00 44.72 45.71 1pfz s GLY 125 CO 0.08 1.96 1.16 1.04 0.00 0.00 0.00 173.10 177.34 1pfz n LEU 126 N 3.86 2.29 0.00 0.66 4.77 -0.20 -4.40 117.00 123.98 1pfz n LEU 126 Ca 0.08 -3.19 0.00 0.00 -0.03 0.00 0.00 56.01 52.87 1pfz n LEU 126 Cb 0.47 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1pfz n LEU 126 CO 0.55 0.89 0.00 0.61 -1.33 0.00 0.00 177.39 178.11 1pfz n GLY 127 N -1.21 1.89 3.82 -0.72 0.00 0.19 -4.65 105.19 104.51 1pfz n GLY 127 Ca 0.16 -2.04 -0.33 0.00 0.00 0.00 0.00 46.02 43.80 1pfz n GLY 127 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1pfz s TRP 128 N 1.93 3.37 0.10 1.61 0.52 -1.26 -4.60 118.94 120.61 1pfz s TRP 128 Ca 0.00 0.25 -0.35 0.00 0.02 0.00 0.00 56.10 56.03 1pfz s TRP 128 Cb 0.00 -1.77 -0.14 0.00 -1.15 0.00 0.00 33.47 30.41 1pfz s TRP 128 CO 0.00 0.58 1.56 1.17 0.02 0.00 0.00 176.95 180.28 1pfz n LYS 129 N 1.12 1.86 -3.90 4.98 4.81 -1.26 -4.18 118.16 121.58 1pfz n LYS 129 Ca -0.12 0.67 -0.34 0.00 -0.87 0.00 0.00 58.31 57.64 1pfz n LYS 129 Cb 0.53 -2.42 -0.13 0.00 0.02 0.00 0.00 35.03 33.03 1pfz n LYS 129 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1pfz s ASP 130 N 1.24 4.93 0.06 3.14 -1.08 -1.26 -4.95 116.67 118.74 1pfz s ASP 130 Ca 0.82 -1.59 0.10 0.00 -0.52 0.00 0.00 52.55 51.36 1pfz s ASP 130 Cb -0.76 -1.72 0.44 0.00 -1.46 0.00 0.00 42.92 39.42 1pfz s ASP 130 CO 0.43 -0.34 1.31 0.18 0.52 0.00 0.00 175.17 177.26 1pfz n LEU 131 N 4.55 0.12 0.05 -1.34 4.77 -1.25 -1.43 117.00 122.47 1pfz n LEU 131 Ca -0.08 0.54 0.13 0.00 -0.03 0.00 0.00 56.01 56.57 1pfz n LEU 131 Cb 0.43 -0.54 0.49 0.00 -2.33 0.00 0.00 43.42 41.47 1pfz n LEU 131 CO 0.27 -0.46 0.90 -1.54 -1.33 0.00 0.00 177.39 175.23 1pfz n SER 132 N -1.64 0.39 -0.11 -1.43 3.41 -1.26 -3.77 113.62 109.21 1pfz n SER 132 Ca 0.01 0.55 -0.21 0.00 -0.26 0.00 0.00 58.87 58.96 1pfz n SER 132 Cb 0.09 -0.65 -0.09 0.00 -0.26 0.00 0.00 64.21 63.31 1pfz n SER 132 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1pfz n ILE 133 N -1.88 1.21 -3.70 -1.33 5.41 -0.51 -4.98 119.36 113.58 1pfz n ILE 133 Ca 0.06 -0.36 0.01 0.00 1.00 0.00 0.00 62.75 63.45 1pfz n ILE 133 Cb 0.35 -1.61 -0.00 0.00 -0.71 0.00 0.00 39.64 37.66 1pfz n ILE 133 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1pfz s GLY 134 N -5.61 -0.33 0.00 7.39 0.00 -1.08 -4.88 107.32 102.81 1pfz s GLY 134 Ca -0.30 0.48 0.22 0.00 0.00 0.00 0.00 44.72 45.11 1pfz s GLY 134 CO 0.42 0.92 1.45 -1.14 0.00 0.00 0.00 173.10 174.75 1pfz n SER 135 N -0.60 2.89 -4.71 1.64 3.41 -1.26 -3.97 113.62 111.02 1pfz n SER 135 Ca -0.06 -1.92 -0.42 0.00 -0.26 0.00 0.00 58.87 56.21 1pfz n SER 135 Cb 0.62 -0.23 -0.03 0.00 -0.26 0.00 0.00 64.21 64.31 1pfz n SER 135 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1pfz s VAL 136 N -1.53 4.10 0.54 -3.33 1.01 -1.26 -5.02 120.40 114.90 1pfz s VAL 136 Ca 0.37 1.53 -0.17 0.00 0.00 0.00 0.00 61.98 63.70 1pfz s VAL 136 Cb 0.21 -3.98 -0.06 0.00 0.00 0.00 0.00 36.38 32.54 1pfz s VAL 136 CO 0.29 0.13 1.03 -1.81 0.00 0.00 0.00 175.10 174.74 1pfz s ASP 137 N 0.97 6.20 0.69 3.32 1.01 -1.26 -4.83 116.67 122.76 1pfz s ASP 137 Ca 0.57 1.78 -0.17 0.00 0.71 0.00 0.00 52.55 55.45 1pfz s ASP 137 Cb -0.29 -2.53 -0.01 0.00 1.01 0.00 0.00 42.92 41.10 1pfz s ASP 137 CO 0.30 -0.88 1.00 -2.65 0.21 0.00 0.00 175.17 173.14 1pfz n PRO 138 N -1.57 0.65 -0.35 8.23 -0.02 -1.25 -4.56 135.00 136.12 1pfz n PRO 138 Ca 0.08 0.27 0.09 0.00 -2.02 0.00 0.00 63.50 61.92 1pfz n PRO 138 Cb 0.53 -2.24 0.27 0.00 -0.02 0.00 0.00 33.50 32.04 1pfz n PRO 138 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1pfz h ILE 139 N -0.02 0.88 -0.75 4.25 2.10 -1.77 -0.48 117.51 121.72 1pfz h ILE 139 Ca -0.48 -0.32 -0.02 0.00 1.08 0.00 0.00 64.86 65.12 1pfz h ILE 139 Cb 1.34 -0.13 -0.03 0.00 -1.09 0.00 0.00 36.82 36.91 1pfz h ILE 139 CO 0.48 0.17 0.39 0.58 -1.08 0.00 0.00 178.15 178.69 1pfz h VAL 140 N 0.93 1.23 -0.36 2.19 2.07 -1.89 -0.20 116.25 120.22 1pfz h VAL 140 Ca 0.50 -0.61 -0.07 0.00 0.82 0.00 0.00 66.70 67.34 1pfz h VAL 140 Cb 0.58 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1pfz h VAL 140 CO -0.28 0.27 -0.04 0.58 0.02 0.00 0.00 177.57 178.12 1pfz h VAL 141 N 1.04 1.27 -0.59 2.57 2.07 -1.59 -2.75 116.25 118.27 1pfz h VAL 141 Ca 0.26 -1.07 -0.04 0.00 0.82 0.00 0.00 66.70 66.67 1pfz h VAL 141 Cb 0.07 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 1pfz h VAL 141 CO -0.04 0.35 0.21 -0.08 0.02 0.00 0.00 177.57 178.04 1pfz h GLU 142 N 0.48 0.86 -0.88 1.57 4.57 -0.75 0.29 114.58 120.72 1pfz h GLU 142 Ca 0.10 -0.14 0.01 0.00 -1.18 0.00 0.00 59.36 58.15 1pfz h GLU 142 Cb 0.53 -0.15 -0.04 0.00 -0.16 0.00 0.00 28.75 28.93 1pfz h GLU 142 CO 0.03 0.72 0.58 -0.07 -1.18 0.00 0.00 179.01 179.09 1pfz h LEU 143 N 0.85 1.00 -0.49 1.64 3.38 -0.94 -1.45 115.31 119.29 1pfz h LEU 143 Ca 0.20 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 58.03 1pfz h LEU 143 Cb 0.20 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1pfz h LEU 143 CO -0.01 0.72 -0.14 0.50 0.09 0.00 0.00 178.44 179.59 1pfz h LYS 144 N 1.17 0.96 -0.62 1.13 1.63 -1.01 0.41 116.57 120.25 1pfz h LYS 144 Ca 0.33 -0.38 0.08 0.00 -0.85 0.00 0.00 60.65 59.83 1pfz h LYS 144 Cb -0.12 -0.05 -0.04 0.00 -0.60 0.00 0.00 32.23 31.43 1pfz h LYS 144 CO -0.08 1.05 0.41 -0.91 -3.45 0.00 0.00 179.45 176.47 1pfz h ASN 145 N 0.82 0.48 -0.48 4.20 2.35 -0.04 -0.17 115.58 122.74 1pfz h ASN 145 Ca 0.12 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1pfz h ASN 145 Cb 0.70 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.98 1pfz h ASN 145 CO 0.05 0.30 0.00 0.00 -1.65 0.00 0.00 177.43 176.13 1pfz n GLN 146 N -4.48 2.36 -3.30 0.81 6.02 -0.64 -4.92 117.38 113.23 1pfz n GLN 146 Ca 0.09 -1.82 -0.24 0.00 -0.01 0.00 0.00 57.00 55.02 1pfz n GLN 146 Cb 0.29 -1.48 0.03 0.00 1.02 0.00 0.00 30.24 30.11 1pfz n GLN 146 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1pfz n ASN 147 N 0.87 -5.51 0.08 1.08 5.03 -0.08 -4.87 115.26 111.86 1pfz n ASN 147 Ca 0.17 -0.41 0.08 0.00 0.87 0.00 0.00 54.58 55.29 1pfz n ASN 147 Cb 0.48 -4.44 -0.02 0.00 -1.02 0.00 0.00 39.78 34.78 1pfz n ASN 147 CO 0.00 0.00 0.00 0.11 -1.83 0.00 0.00 177.26 175.54 1pfz h LYS 148 N -1.60 0.00 -4.51 3.52 1.79 -1.13 -3.47 116.57 111.17 1pfz h LYS 148 Ca -0.52 0.00 -0.19 0.00 -2.18 0.00 0.00 60.65 57.76 1pfz h LYS 148 Cb 1.35 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 31.85 1pfz h LYS 148 CO 0.57 0.10 -0.68 0.96 -1.08 0.00 0.00 179.45 179.31 1pfz s ILE 149 N -3.22 0.49 0.17 1.86 -4.36 -1.23 -4.99 121.20 109.92 1pfz s ILE 149 Ca -0.01 -1.90 -0.01 0.00 -0.26 0.00 0.00 60.65 58.47 1pfz s ILE 149 Cb 0.09 -1.69 -0.11 0.00 1.25 0.00 0.00 42.46 42.00 1pfz s ILE 149 CO 0.79 -0.85 1.42 -0.33 0.24 0.00 0.00 174.94 176.21 1pfz h GLU 150 N 3.00 0.39 -4.17 0.37 5.08 -1.92 -3.43 114.58 113.91 1pfz h GLU 150 Ca -0.35 -0.33 -0.20 0.00 -1.00 0.00 0.00 59.36 57.48 1pfz h GLU 150 Cb 1.16 0.07 -0.21 0.00 0.50 0.00 0.00 28.75 30.28 1pfz h GLU 150 CO 0.65 0.98 -0.71 -0.80 -1.00 0.00 0.00 179.01 178.12 1pfz s ASN 151 N -6.98 0.44 -1.20 1.42 0.01 -0.79 -5.06 114.94 102.79 1pfz s ASN 151 Ca -0.05 -0.55 -0.15 0.00 -0.71 0.00 0.00 52.86 51.40 1pfz s ASN 151 Cb 0.10 0.09 0.15 0.00 0.41 0.00 0.00 41.25 42.00 1pfz s ASN 151 CO 0.84 -0.29 1.45 0.00 -1.51 0.00 0.00 177.10 177.59 1pfz s ALA 152 N -1.61 3.84 0.12 0.60 0.00 -1.26 -4.05 121.76 119.39 1pfz s ALA 152 Ca -0.13 -3.24 -0.21 0.00 0.00 0.00 0.00 51.96 48.38 1pfz s ALA 152 Cb -0.09 -4.20 0.06 0.00 0.00 0.00 0.00 23.12 18.89 1pfz s ALA 152 CO -0.01 -2.87 0.53 -0.48 0.00 0.00 0.00 175.76 172.92 1pfz s LEU 153 N 2.08 -0.19 0.07 0.00 0.05 -1.26 -1.20 118.68 118.24 1pfz s LEU 153 Ca 0.44 -0.02 -0.01 0.00 0.05 0.00 0.00 54.13 54.59 1pfz s LEU 153 Cb -0.02 2.28 -0.04 0.00 -2.05 0.00 0.00 46.19 46.36 1pfz s LEU 153 CO 0.00 -0.86 -0.00 0.72 -0.55 0.00 0.00 176.35 175.65 1pfz s PHE 154 N -3.36 0.62 0.10 3.48 -0.12 -0.52 -0.61 117.98 117.57 1pfz s PHE 154 Ca -0.00 -1.12 0.03 0.00 -0.05 0.00 0.00 56.93 55.79 1pfz s PHE 154 Cb -0.00 -0.42 -0.04 0.00 -0.63 0.00 0.00 43.02 41.93 1pfz s PHE 154 CO -0.09 -0.42 -0.08 0.95 -0.05 0.00 0.00 175.22 175.52 1pfz s THR 155 N -3.96 0.83 -0.12 -4.49 -4.23 0.01 -0.18 115.64 103.50 1pfz s THR 155 Ca 0.12 -1.75 0.02 0.00 -1.18 0.00 0.00 61.69 58.91 1pfz s THR 155 Cb 0.08 -1.46 0.01 0.00 1.34 0.00 0.00 72.50 72.47 1pfz s THR 155 CO -0.06 -0.69 -0.18 -0.36 -0.54 0.00 0.00 174.62 172.79 1pfz s PHE 156 N -2.90 2.19 -0.25 3.99 0.08 -0.65 -1.65 117.98 118.80 1pfz s PHE 156 Ca 0.08 -1.05 0.03 0.00 0.12 0.00 0.00 56.93 56.11 1pfz s PHE 156 Cb 0.00 -1.54 0.05 0.00 -0.57 0.00 0.00 43.02 40.96 1pfz s PHE 156 CO -0.02 -0.51 -0.12 -0.47 -0.10 0.00 0.00 175.22 174.00 1pfz s TYR 157 N 0.90 3.16 -0.46 0.36 5.04 -0.49 -2.90 117.35 122.95 1pfz s TYR 157 Ca -0.08 -2.20 -0.07 0.00 -2.44 0.00 0.00 57.07 52.28 1pfz s TYR 157 Cb -0.15 -1.91 0.12 0.00 0.35 0.00 0.00 41.96 40.37 1pfz s TYR 157 CO -0.01 -0.86 0.31 -0.51 -1.34 0.00 0.00 175.55 173.14 1pfz s LEU 158 N 1.14 5.57 -0.14 6.97 1.43 -1.26 -1.14 118.68 131.25 1pfz s LEU 158 Ca -0.07 -2.00 -0.37 0.00 -1.03 0.00 0.00 54.13 50.67 1pfz s LEU 158 Cb -0.19 -1.96 -0.14 0.00 0.03 0.00 0.00 46.19 43.94 1pfz s LEU 158 CO -0.06 -0.64 1.77 -0.81 0.23 0.00 0.00 176.35 176.84 1pfz n PRO 159 N 4.75 1.69 0.29 1.29 -0.04 -1.26 -4.41 135.00 137.31 1pfz n PRO 159 Ca -0.05 0.62 0.14 0.00 -0.04 0.00 0.00 63.50 64.16 1pfz n PRO 159 Cb 0.41 -2.38 0.86 0.00 -0.04 0.00 0.00 33.50 32.35 1pfz n PRO 159 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 1pfz h VAL 160 N 5.10 0.61 -0.00 0.52 3.04 -1.87 -2.15 116.25 121.50 1pfz h VAL 160 Ca -0.47 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.20 1pfz h VAL 160 Cb 1.29 1.01 0.00 0.00 -2.01 0.00 0.00 31.29 31.58 1pfz h VAL 160 CO 0.94 0.00 -0.08 0.00 -1.01 0.00 0.00 177.57 177.42 1pfz n HIS 161 N -3.97 0.00 -3.39 3.17 1.44 -1.26 -4.58 115.22 106.63 1pfz n HIS 161 Ca -0.03 0.00 -0.20 0.00 -2.01 0.00 0.00 57.72 55.48 1pfz n HIS 161 Cb 0.09 -0.27 -0.09 0.00 0.12 0.00 0.00 29.99 29.84 1pfz n HIS 161 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1pfz s ASP 162 N -2.62 1.69 0.09 4.39 -1.08 -0.81 -5.00 116.67 113.33 1pfz s ASP 162 Ca 0.26 -1.55 0.11 0.00 -0.52 0.00 0.00 52.55 50.85 1pfz s ASP 162 Cb 0.20 0.33 0.52 0.00 -1.46 0.00 0.00 42.92 42.51 1pfz s ASP 162 CO 0.49 -0.30 1.35 0.29 0.52 0.00 0.00 175.17 177.52 1pfz n LYS 163 N 4.42 0.05 -0.46 4.34 5.02 -1.26 -2.02 118.16 128.25 1pfz n LYS 163 Ca 0.08 0.44 0.10 0.00 -2.02 0.00 0.00 58.31 56.92 1pfz n LYS 163 Cb 0.44 -1.63 0.32 0.00 -0.02 0.00 0.00 35.03 34.14 1pfz n LYS 163 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1pfz n HIS 164 N -1.73 1.14 -4.19 2.13 8.25 -1.26 -4.72 115.22 114.84 1pfz n HIS 164 Ca 0.01 -0.51 -0.12 0.00 -0.26 0.00 0.00 57.72 56.84 1pfz n HIS 164 Cb 0.09 -0.10 -0.10 0.00 1.12 0.00 0.00 29.99 30.99 1pfz n HIS 164 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1pfz s THR 165 N -1.39 0.86 0.11 1.59 -4.23 -0.86 -0.55 115.64 111.17 1pfz s THR 165 Ca 0.48 -1.92 -0.25 0.00 -1.18 0.00 0.00 61.69 58.82 1pfz s THR 165 Cb 0.27 -1.67 0.08 0.00 1.34 0.00 0.00 72.50 72.53 1pfz s THR 165 CO 0.28 -0.79 0.71 -0.83 -0.54 0.00 0.00 174.62 173.46 1pfz s GLY 166 N -2.97 -0.53 -0.06 3.99 0.00 -0.81 -4.40 107.32 102.53 1pfz s GLY 166 Ca 0.12 0.61 0.01 0.00 0.00 0.00 0.00 44.72 45.46 1pfz s GLY 166 CO -0.02 0.20 -0.07 -1.36 0.00 0.00 0.00 173.10 171.84 1pfz s PHE 167 N -3.54 1.07 -0.20 1.90 0.08 -0.29 -1.18 117.98 115.82 1pfz s PHE 167 Ca 0.03 -0.39 -0.05 0.00 0.12 0.00 0.00 56.93 56.64 1pfz s PHE 167 Cb -0.01 -0.89 -0.02 0.00 -0.57 0.00 0.00 43.02 41.52 1pfz s PHE 167 CO -0.10 -0.28 0.01 -1.17 -0.10 0.00 0.00 175.22 173.57 1pfz s LEU 168 N 1.06 3.28 -0.14 -0.37 2.96 0.20 -1.40 118.68 124.28 1pfz s LEU 168 Ca -0.08 -0.19 -0.02 0.00 -0.22 0.00 0.00 54.13 53.61 1pfz s LEU 168 Cb -0.14 -1.83 -0.03 0.00 0.50 0.00 0.00 46.19 44.69 1pfz s LEU 168 CO -0.01 0.06 -0.05 -0.89 -1.32 0.00 0.00 176.35 174.14 1pfz s THR 169 N 1.02 3.78 -0.18 3.68 2.01 -0.66 0.05 115.64 125.34 1pfz s THR 169 Ca 0.02 -0.41 -0.02 0.00 0.31 0.00 0.00 61.69 61.60 1pfz s THR 169 Cb -0.14 -2.63 -0.00 0.00 0.01 0.00 0.00 72.50 69.73 1pfz s THR 169 CO 0.02 0.52 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.73 1pfz s ILE 170 N 0.13 2.97 0.00 1.82 1.01 0.15 -0.81 121.20 126.47 1pfz s ILE 170 Ca -0.02 -0.65 0.00 0.00 0.00 0.00 0.00 60.65 59.98 1pfz s ILE 170 Cb -0.14 -2.30 0.00 0.00 0.01 0.00 0.00 42.46 40.03 1pfz s ILE 170 CO 0.03 0.48 0.00 0.61 0.00 0.00 0.00 174.94 176.06 1pfz n GLY 171 N 4.34 0.93 3.78 6.18 0.00 0.22 -3.62 105.19 117.03 1pfz n GLY 171 Ca -0.19 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.80 1pfz n GLY 171 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pfz s GLY 172 N -2.24 -0.13 -0.23 -0.02 0.00 -1.26 -1.88 107.32 101.55 1pfz s GLY 172 Ca 0.00 -0.00 -0.05 0.00 0.00 0.00 0.00 44.72 44.67 1pfz s GLY 172 CO 0.00 0.65 0.00 -0.42 0.00 0.00 0.00 173.10 173.33 1pfz s ILE 173 N -2.91 3.74 -0.34 0.90 1.01 -1.26 -4.74 121.20 117.60 1pfz s ILE 173 Ca 0.15 -0.37 -0.20 0.00 0.00 0.00 0.00 60.65 60.23 1pfz s ILE 173 Cb -0.01 -2.72 -0.00 0.00 0.01 0.00 0.00 42.46 39.73 1pfz s ILE 173 CO 0.03 0.39 0.63 -1.61 0.00 0.00 0.00 174.94 174.38 1pfz s GLU 174 N 1.52 3.73 0.55 2.79 0.41 -1.26 -4.96 118.70 121.48 1pfz s GLU 174 Ca 0.06 0.10 0.25 0.00 -0.41 0.00 0.00 54.97 54.97 1pfz s GLU 174 Cb -0.15 -3.79 1.47 0.00 -1.78 0.00 0.00 34.13 29.88 1pfz s GLU 174 CO -0.01 -0.69 2.06 0.93 -0.49 0.00 0.00 175.26 177.07 1pfz h GLU 175 N 8.40 0.00 0.00 1.61 4.39 -1.98 -2.53 114.58 124.47 1pfz h GLU 175 Ca -0.27 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.43 1pfz h GLU 175 Cb 1.11 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.76 1pfz h GLU 175 CO 0.82 0.00 -0.01 0.07 -1.16 0.00 0.00 179.01 178.73 1pfz h ARG 176 N 0.00 0.00 0.00 2.33 0.11 -2.04 -2.99 114.38 111.79 1pfz h ARG 176 Ca 0.14 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.22 1pfz h ARG 176 Cb 0.62 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.70 1pfz h ARG 176 CO -0.00 0.01 -0.03 1.19 0.10 0.00 0.00 179.97 181.24 1pfz n PHE 177 N -3.17 0.54 -3.95 4.08 3.72 -0.95 -4.73 117.46 112.99 1pfz n PHE 177 Ca -0.02 0.16 -0.09 0.00 -0.05 0.00 0.00 57.45 57.45 1pfz n PHE 177 Cb 0.17 -0.75 -0.07 0.00 -0.94 0.00 0.00 39.48 37.89 1pfz n PHE 177 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 176.76 178.23 1pfz s TYR 178 N -3.06 0.37 -0.12 1.38 1.13 -1.13 -1.23 117.35 114.69 1pfz s TYR 178 Ca 0.12 -0.75 -0.05 0.00 -1.41 0.00 0.00 57.07 54.97 1pfz s TYR 178 Cb 0.15 -0.09 -0.04 0.00 -1.10 0.00 0.00 41.96 40.88 1pfz s TYR 178 CO 0.58 -0.66 0.08 -1.21 -2.51 0.00 0.00 175.55 171.83 1pfz s GLU 179 N -3.95 3.41 0.89 -3.49 0.41 -0.29 -4.76 118.70 110.92 1pfz s GLU 179 Ca 0.15 -0.26 0.00 0.00 -0.41 0.00 0.00 54.97 54.44 1pfz s GLU 179 Cb 0.04 -3.07 0.00 0.00 -1.78 0.00 0.00 34.13 29.32 1pfz s GLU 179 CO -0.03 0.65 0.00 0.41 -0.49 0.00 0.00 175.26 175.80 1pfz n GLY 180 N 2.36 -1.75 3.79 -1.39 0.00 -1.26 -4.13 105.19 102.81 1pfz n GLY 180 Ca -0.19 -1.25 -0.35 0.00 0.00 0.00 0.00 46.02 44.23 1pfz n GLY 180 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1pfz s PRO 181 N -0.82 4.02 0.47 1.61 0.02 -1.26 -5.00 135.00 134.04 1pfz s PRO 181 Ca 0.00 1.40 -0.20 0.00 0.02 0.00 0.00 61.00 62.22 1pfz s PRO 181 Cb 0.00 -2.32 -0.09 0.00 0.02 0.00 0.00 34.50 32.11 1pfz s PRO 181 CO 0.00 -0.25 1.02 -0.51 -0.33 0.00 0.00 177.00 176.93 1pfz s LEU 182 N -3.05 3.87 -0.19 -5.54 1.43 -1.26 -4.80 118.68 109.14 1pfz s LEU 182 Ca 0.62 1.87 -0.01 0.00 -1.03 0.00 0.00 54.13 55.59 1pfz s LEU 182 Cb -0.18 -4.55 0.00 0.00 0.03 0.00 0.00 46.19 41.49 1pfz s LEU 182 CO 0.23 -0.68 -0.13 -0.89 0.23 0.00 0.00 176.35 175.10 1pfz s THR 183 N -2.03 2.66 -0.08 5.49 2.01 -0.27 -4.90 115.64 118.52 1pfz s THR 183 Ca 0.66 -0.74 -0.13 0.00 0.31 0.00 0.00 61.69 61.78 1pfz s THR 183 Cb -0.15 -2.16 -0.05 0.00 0.01 0.00 0.00 72.50 70.16 1pfz s THR 183 CO 0.18 0.49 0.33 -0.31 -0.69 0.00 0.00 174.62 174.63 1pfz s TYR 184 N 1.24 3.60 -0.15 4.92 1.51 -1.26 -0.56 117.35 126.65 1pfz s TYR 184 Ca 0.03 0.78 0.01 0.00 -1.01 0.00 0.00 57.07 56.87 1pfz s TYR 184 Cb -0.14 -2.27 0.00 0.00 -0.11 0.00 0.00 41.96 39.44 1pfz s TYR 184 CO -0.07 0.49 -0.17 -1.21 -1.11 0.00 0.00 175.55 173.48 1pfz s GLU 185 N -0.41 3.16 0.38 -0.62 0.41 0.30 -4.96 118.70 116.95 1pfz s GLU 185 Ca 0.20 -0.78 -0.26 0.00 -0.41 0.00 0.00 54.97 53.72 1pfz s GLU 185 Cb -0.15 -2.56 -0.09 0.00 -1.78 0.00 0.00 34.13 29.55 1pfz s GLU 185 CO 0.08 0.02 1.15 0.15 -0.49 0.00 0.00 175.26 176.18 1pfz s LYS 186 N 0.79 4.18 0.55 1.61 -0.14 -1.26 -0.82 119.74 124.65 1pfz s LYS 186 Ca -0.06 1.82 -0.19 0.00 -1.36 0.00 0.00 55.97 56.18 1pfz s LYS 186 Cb -0.15 -2.77 -0.05 0.00 -1.68 0.00 0.00 37.83 33.17 1pfz s LYS 186 CO -0.00 -0.20 1.10 -0.51 -0.76 0.00 0.00 175.35 174.98 1pfz s LEU 187 N -2.30 3.71 0.00 3.17 1.43 -0.55 -4.46 118.68 119.68 1pfz s LEU 187 Ca 0.55 2.08 0.05 0.00 -1.03 0.00 0.00 54.13 55.78 1pfz s LEU 187 Cb -0.30 -4.57 0.11 0.00 0.03 0.00 0.00 46.19 41.46 1pfz s LEU 187 CO 0.39 -1.18 1.02 -0.46 0.23 0.00 0.00 176.35 176.34 1pfz n ASN 188 N -1.42 2.21 -4.09 2.29 2.04 0.22 -4.97 115.26 111.54 1pfz n ASN 188 Ca 0.11 -1.84 -0.08 0.00 -0.44 0.00 0.00 54.58 52.32 1pfz n ASN 188 Cb 0.51 -0.08 -0.10 0.00 -2.53 0.00 0.00 39.78 37.58 1pfz n ASN 188 CO 0.00 0.00 0.00 -2.28 -0.44 0.00 0.00 177.26 174.54 1pfz s HIS 189 N -0.88 0.55 -1.84 -2.53 2.46 -1.26 -5.05 115.29 106.74 1pfz s HIS 189 Ca 0.09 -0.93 0.21 0.00 0.47 0.00 0.00 55.06 54.91 1pfz s HIS 189 Cb 0.05 -0.38 -0.03 0.00 -0.13 0.00 0.00 32.58 32.08 1pfz s HIS 189 CO 0.07 -0.29 1.03 -0.40 -2.47 0.00 0.00 174.74 172.68 1pfz n ASP 190 N 0.39 1.86 0.00 9.88 5.75 -1.26 -4.45 116.55 128.73 1pfz n ASP 190 Ca -0.16 -1.43 0.00 0.00 -0.01 0.00 0.00 54.79 53.19 1pfz n ASP 190 Cb 0.60 0.54 0.00 0.00 -1.03 0.00 0.00 41.12 41.22 1pfz n ASP 190 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1pfz n LEU 191 N -0.20 0.00 -4.24 -2.12 4.77 -1.26 -4.77 117.00 109.18 1pfz n LEU 191 Ca 0.08 -0.21 -0.20 0.00 -0.03 0.00 0.00 56.01 55.65 1pfz n LEU 191 Cb 0.44 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.41 1pfz n LEU 191 CO 0.29 0.00 -0.48 -0.31 -1.33 0.00 0.00 177.39 175.56 1pfz s TYR 192 N -1.53 1.49 -1.40 -1.77 1.51 -1.26 -3.99 117.35 110.40 1pfz s TYR 192 Ca 0.00 -0.47 -0.13 0.00 -1.01 0.00 0.00 57.07 55.45 1pfz s TYR 192 Cb 0.00 -0.81 0.07 0.00 -0.11 0.00 0.00 41.96 41.12 1pfz s TYR 192 CO 0.00 0.15 2.08 0.91 -1.11 0.00 0.00 175.55 177.58 1pfz n TRP 193 N 0.95 3.56 -4.93 2.71 7.02 -1.26 -4.51 117.44 120.99 1pfz n TRP 193 Ca -0.19 -2.94 -0.33 0.00 -1.02 0.00 0.00 57.50 53.03 1pfz n TRP 193 Cb 0.55 -2.43 -0.15 0.00 -2.42 0.00 0.00 31.31 26.87 1pfz n TRP 193 CO 0.00 0.00 0.00 -1.14 -2.02 0.00 0.00 177.69 174.53 1pfz s GLN 194 N 2.66 2.93 0.39 -0.99 0.74 -1.26 -1.63 119.66 122.50 1pfz s GLN 194 Ca 0.46 -0.74 0.04 0.00 0.05 0.00 0.00 55.36 55.17 1pfz s GLN 194 Cb 0.12 -2.44 -0.05 0.00 1.10 0.00 0.00 33.01 31.74 1pfz s GLN 194 CO -0.05 0.37 0.07 0.96 -0.55 0.00 0.00 175.29 176.09 1pfz s ILE 195 N -0.09 1.10 -0.17 -2.34 -4.36 0.37 -0.61 121.20 115.11 1pfz s ILE 195 Ca -0.03 -2.00 -0.03 0.00 -0.26 0.00 0.00 60.65 58.33 1pfz s ILE 195 Cb -0.14 -2.58 -0.02 0.00 1.25 0.00 0.00 42.46 40.97 1pfz s ILE 195 CO 0.04 0.00 -0.05 -0.89 0.24 0.00 0.00 174.94 174.28 1pfz s THR 196 N -3.13 3.63 -0.02 8.37 2.01 -1.26 0.04 115.64 125.27 1pfz s THR 196 Ca 0.28 -0.44 -0.10 0.00 0.31 0.00 0.00 61.69 61.74 1pfz s THR 196 Cb 0.06 -2.60 0.01 0.00 0.01 0.00 0.00 72.50 69.98 1pfz s THR 196 CO 0.14 0.47 0.20 -0.76 -0.69 0.00 0.00 174.62 173.98 1pfz s LEU 197 N 0.72 1.28 0.22 4.42 1.43 -0.73 -4.82 118.68 121.20 1pfz s LEU 197 Ca -0.02 0.00 -0.28 0.00 -1.03 0.00 0.00 54.13 52.80 1pfz s LEU 197 Cb -0.15 0.86 -0.09 0.00 0.03 0.00 0.00 46.19 46.85 1pfz s LEU 197 CO 0.02 -0.34 0.88 -1.81 0.23 0.00 0.00 176.35 175.34 1pfz s ASP 198 N -1.08 7.52 -0.12 2.29 1.01 0.23 -0.72 116.67 125.80 1pfz s ASP 198 Ca -0.12 1.82 0.01 0.00 0.71 0.00 0.00 52.55 54.97 1pfz s ASP 198 Cb -0.06 -2.57 -0.01 0.00 1.01 0.00 0.00 42.92 41.29 1pfz s ASP 198 CO 0.02 0.15 -0.14 0.00 0.21 0.00 0.00 175.17 175.41 1pfz s ALA 199 N -1.23 2.57 -0.07 5.23 0.00 0.69 -1.05 121.76 127.90 1pfz s ALA 199 Ca 0.40 -0.90 0.01 0.00 0.00 0.00 0.00 51.96 51.47 1pfz s ALA 199 Cb -0.24 -1.15 0.02 0.00 0.00 0.00 0.00 23.12 21.75 1pfz s ALA 199 CO 0.29 0.27 -0.08 -1.01 0.00 0.00 0.00 175.76 175.24 1pfz s HIS 200 N 0.28 1.18 -0.34 0.00 3.76 0.18 -0.49 115.29 119.86 1pfz s HIS 200 Ca -0.10 -0.45 -0.01 0.00 -0.15 0.00 0.00 55.06 54.34 1pfz s HIS 200 Cb -0.16 -0.96 0.12 0.00 1.11 0.00 0.00 32.58 32.69 1pfz s HIS 200 CO 0.06 -0.31 0.18 0.08 -0.85 0.00 0.00 174.74 173.90 1pfz s VAL 201 N 1.07 0.35 0.00 -0.90 1.01 -0.71 -0.50 120.40 120.71 1pfz s VAL 201 Ca -0.08 -1.52 0.00 0.00 0.00 0.00 0.00 61.98 60.39 1pfz s VAL 201 Cb -0.14 -1.27 0.00 0.00 0.00 0.00 0.00 36.38 34.97 1pfz s VAL 201 CO -0.01 -0.86 0.00 0.61 0.00 0.00 0.00 175.10 174.84 1pfz n GLY 202 N 4.42 2.79 0.09 4.51 0.00 -1.26 -2.76 105.19 112.97 1pfz n GLY 202 Ca 0.05 -0.21 0.11 0.00 0.00 0.00 0.00 46.02 45.96 1pfz n GLY 202 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1pfz n ASN 203 N 9.26 0.63 -4.90 1.61 3.02 -1.26 -4.93 115.26 118.69 1pfz n ASN 203 Ca 0.00 0.24 -0.29 0.00 -0.03 0.00 0.00 54.58 54.51 1pfz n ASN 203 Cb 0.00 0.84 -0.02 0.00 -0.61 0.00 0.00 39.78 39.99 1pfz n ASN 203 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 1pfz s ILE 204 N -3.39 4.92 -0.08 2.41 -4.36 -1.11 -5.10 121.20 114.49 1pfz s ILE 204 Ca -0.03 0.25 -0.24 0.00 -0.26 0.00 0.00 60.65 60.38 1pfz s ILE 204 Cb 0.11 -3.77 0.05 0.00 1.25 0.00 0.00 42.46 40.10 1pfz s ILE 204 CO 0.82 -0.53 0.55 -0.32 0.24 0.00 0.00 174.94 175.71 1pfz s MET 205 N -3.98 0.86 -0.16 0.37 1.75 -1.26 -1.74 119.30 115.14 1pfz s MET 205 Ca 0.47 0.26 -0.00 0.00 -1.25 0.00 0.00 55.69 55.17 1pfz s MET 205 Cb -0.10 0.41 0.04 0.00 2.84 0.00 0.00 34.83 38.01 1pfz s MET 205 CO 0.34 -0.23 -0.08 -0.51 -0.65 0.00 0.00 175.02 173.89 1pfz s LEU 206 N -0.89 1.71 0.10 4.11 1.43 0.36 -4.99 118.68 120.51 1pfz s LEU 206 Ca -0.09 -0.64 -0.28 0.00 -1.03 0.00 0.00 54.13 52.09 1pfz s LEU 206 Cb -0.02 -1.01 -0.06 0.00 0.03 0.00 0.00 46.19 45.12 1pfz s LEU 206 CO 0.06 -0.15 0.90 -0.70 0.23 0.00 0.00 176.35 176.69 1pfz s GLU 207 N 1.57 4.64 -1.40 1.70 2.12 -1.26 -0.22 118.70 125.84 1pfz s GLU 207 Ca 0.01 1.33 -0.00 0.00 0.36 0.00 0.00 54.97 56.67 1pfz s GLU 207 Cb -0.15 -3.36 0.00 0.00 0.26 0.00 0.00 34.13 30.88 1pfz s GLU 207 CO -0.08 0.26 0.44 1.63 -0.54 0.00 0.00 175.26 176.96 1pfz n LYS 208 N 2.69 -3.39 -2.30 4.30 5.02 -1.25 -4.94 118.16 118.29 1pfz n LYS 208 Ca 0.00 0.42 -0.33 0.00 -2.02 0.00 0.00 58.31 56.38 1pfz n LYS 208 Cb 0.49 -4.57 -0.02 0.00 -0.02 0.00 0.00 35.03 30.91 1pfz n LYS 208 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1pfz s ALA 209 N -3.94 2.91 0.14 7.82 0.00 0.10 -4.71 121.76 124.09 1pfz s ALA 209 Ca 0.01 0.33 -0.30 0.00 0.00 0.00 0.00 51.96 52.00 1pfz s ALA 209 Cb -0.01 -3.18 -0.07 0.00 0.00 0.00 0.00 23.12 19.87 1pfz s ALA 209 CO 0.88 -0.45 0.95 -0.80 0.00 0.00 0.00 175.76 176.34 1pfz s ASN 210 N -2.77 7.53 -0.16 0.00 0.01 -0.99 -1.77 114.94 116.79 1pfz s ASN 210 Ca 0.62 1.82 -0.00 0.00 -0.71 0.00 0.00 52.86 54.59 1pfz s ASN 210 Cb -0.13 -2.59 0.04 0.00 0.41 0.00 0.00 41.25 38.98 1pfz s ASN 210 CO 0.31 0.00 -0.06 0.00 -1.51 0.00 0.00 177.10 175.84 1pfz s ILE 212 N 1.64 5.11 -0.48 0.00 1.01 -0.17 -0.47 121.20 127.83 1pfz s ILE 212 Ca 0.01 0.43 -0.23 0.00 0.00 0.00 0.00 60.65 60.87 1pfz s ILE 212 Cb -0.15 -3.83 0.03 0.00 0.01 0.00 0.00 42.46 38.53 1pfz s ILE 212 CO -0.08 -0.02 0.81 -0.69 0.00 0.00 0.00 174.94 174.96 1pfz s VAL 213 N 2.20 4.60 -0.15 2.92 1.01 -0.65 0.20 120.40 130.54 1pfz s VAL 213 Ca 0.16 0.31 -0.05 0.00 0.00 0.00 0.00 61.98 62.41 1pfz s VAL 213 Cb -0.16 -4.37 0.06 0.00 0.00 0.00 0.00 36.38 31.90 1pfz s VAL 213 CO 0.11 -0.82 0.08 -0.62 0.00 0.00 0.00 175.10 173.85 1pfz s ASP 214 N 2.36 2.16 0.08 3.32 2.15 -0.90 -4.78 116.67 121.06 1pfz s ASP 214 Ca 0.29 -0.51 0.15 0.00 0.43 0.00 0.00 52.55 52.91 1pfz s ASP 214 Cb -0.13 -0.23 0.66 0.00 -0.30 0.00 0.00 42.92 42.92 1pfz s ASP 214 CO 0.21 -0.33 1.48 -1.54 -0.17 0.00 0.00 175.17 174.81 1pfz n SER 215 N 5.28 0.20 -0.23 -0.34 3.41 -1.26 -2.25 113.62 118.43 1pfz n SER 215 Ca -0.06 0.56 0.14 0.00 -0.26 0.00 0.00 58.87 59.24 1pfz n SER 215 Cb 0.49 -0.60 0.69 0.00 -0.26 0.00 0.00 64.21 64.54 1pfz n SER 215 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pfz n GLY 216 N -0.27 -0.51 3.30 5.00 0.00 -1.26 -4.62 105.19 106.83 1pfz n GLY 216 Ca 0.02 -0.30 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 1pfz n GLY 216 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pfz s THR 217 N -1.98 2.94 -1.25 2.61 2.01 -0.96 -0.43 115.64 118.58 1pfz s THR 217 Ca 0.41 -0.67 0.23 0.00 0.31 0.00 0.00 61.69 61.97 1pfz s THR 217 Cb 0.20 -2.27 0.32 0.00 0.01 0.00 0.00 72.50 70.76 1pfz s THR 217 CO 0.33 0.49 1.76 -1.54 -0.69 0.00 0.00 174.62 174.97 1pfz n SER 218 N 4.16 0.00 -2.51 3.53 3.41 -0.25 -0.34 113.62 121.62 1pfz n SER 218 Ca -0.19 0.17 -0.12 0.00 -0.26 0.00 0.00 58.87 58.47 1pfz n SER 218 Cb 0.52 -0.37 -0.04 0.00 -0.26 0.00 0.00 64.21 64.05 1pfz n SER 218 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pfz n ALA 219 N -1.37 0.36 -2.77 7.33 0.00 -1.26 -4.50 120.51 118.29 1pfz n ALA 219 Ca 0.09 -1.12 -0.37 0.00 0.00 0.00 0.00 53.44 52.04 1pfz n ALA 219 Cb 0.22 0.83 -0.11 0.00 0.00 0.00 0.00 19.45 20.39 1pfz n ALA 219 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1pfz s ILE 220 N -2.58 4.93 -0.02 0.00 -1.09 -1.02 -2.65 121.20 118.77 1pfz s ILE 220 Ca 0.17 0.04 -0.01 0.00 -2.23 0.00 0.00 60.65 58.62 1pfz s ILE 220 Cb 0.01 -3.32 -0.04 0.00 -1.58 0.00 0.00 42.46 37.53 1pfz s ILE 220 CO 0.12 0.31 0.09 0.42 -1.23 0.00 0.00 174.94 174.64 1pfz s THR 221 N 1.54 4.82 0.06 2.92 -4.23 -0.95 -1.61 115.64 118.19 1pfz s THR 221 Ca 0.07 -0.33 -0.00 0.00 -1.18 0.00 0.00 61.69 60.25 1pfz s THR 221 Cb -0.15 -3.19 -0.04 0.00 1.34 0.00 0.00 72.50 70.46 1pfz s THR 221 CO 0.07 0.39 -0.04 0.68 -0.54 0.00 0.00 174.62 175.18 1pfz s VAL 222 N -1.17 0.33 0.32 2.29 -7.23 -0.27 -2.29 120.40 112.37 1pfz s VAL 222 Ca 0.22 -1.71 -0.29 0.00 -1.81 0.00 0.00 61.98 58.39 1pfz s VAL 222 Cb -0.12 -1.38 -0.12 0.00 0.56 0.00 0.00 36.38 35.32 1pfz s VAL 222 CO 0.13 -0.89 1.44 -2.65 -0.31 0.00 0.00 175.10 172.82 1pfz n PRO 223 N 0.30 2.40 -0.17 4.82 -0.02 -1.24 -0.59 135.00 140.50 1pfz n PRO 223 Ca -0.15 0.85 -0.03 0.00 -2.02 0.00 0.00 63.50 62.15 1pfz n PRO 223 Cb 0.60 -2.53 0.04 0.00 -0.02 0.00 0.00 33.50 31.58 1pfz n PRO 223 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 1pfz h THR 224 N 2.96 0.40 -0.83 3.45 1.35 -1.87 0.12 112.91 118.49 1pfz h THR 224 Ca -0.47 0.00 0.01 0.00 -0.55 0.00 0.00 66.41 65.39 1pfz h THR 224 Cb 1.26 0.40 -0.04 0.00 -1.73 0.00 0.00 68.15 68.04 1pfz h THR 224 CO 0.70 0.00 0.54 -0.78 -0.25 0.00 0.00 175.52 175.73 1pfz h ASP 225 N -0.05 0.96 -0.86 5.36 3.58 -1.97 0.17 116.42 123.61 1pfz h ASP 225 Ca 0.25 -0.03 0.01 0.00 0.42 0.00 0.00 57.03 57.68 1pfz h ASP 225 Cb 0.43 -0.24 -0.04 0.00 1.72 0.00 0.00 39.33 41.20 1pfz h ASP 225 CO -0.57 0.70 0.57 0.15 -2.88 0.00 0.00 179.24 177.21 1pfz h PHE 226 N 1.13 1.08 -0.28 0.28 3.04 -1.59 -1.21 116.94 119.39 1pfz h PHE 226 Ca 0.30 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 62.24 1pfz h PHE 226 Cb -0.12 -0.37 -0.01 0.00 2.56 0.00 0.00 35.95 38.01 1pfz h PHE 226 CO -0.01 0.68 0.03 1.25 -2.02 0.00 0.00 178.31 178.24 1pfz h LEU 227 N 1.17 0.46 -0.58 0.59 5.85 -0.26 -2.01 115.31 120.52 1pfz h LEU 227 Ca 0.32 -0.28 0.09 0.00 0.84 0.00 0.00 57.88 58.85 1pfz h LEU 227 Cb -0.13 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 40.70 1pfz h LEU 227 CO -0.07 0.62 0.20 0.78 -0.34 0.00 0.00 178.44 179.64 1pfz h ASN 228 N 0.28 0.19 -0.03 1.25 -0.26 -0.45 -1.05 115.58 115.50 1pfz h ASN 228 Ca 0.08 0.08 -0.00 0.00 -0.56 0.00 0.00 56.30 55.90 1pfz h ASN 228 Cb 0.37 0.07 -0.00 0.00 -1.06 0.00 0.00 38.32 37.69 1pfz h ASN 228 CO 0.01 0.12 0.02 0.11 -1.06 0.00 0.00 177.43 176.63 1pfz h LYS 229 N 0.38 0.05 -0.29 0.81 1.57 -1.09 -2.85 116.57 115.14 1pfz h LYS 229 Ca 0.29 -0.00 0.06 0.00 -1.87 0.00 0.00 60.65 59.13 1pfz h LYS 229 Cb 0.36 -0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.58 1pfz h LYS 229 CO -0.30 0.06 -0.39 0.52 -0.57 0.00 0.00 179.45 178.77 1pfz h MET 230 N 0.02 -0.35 0.00 3.15 2.86 -0.57 -2.32 114.93 117.72 1pfz h MET 230 Ca 0.01 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1pfz h MET 230 Cb 0.03 0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.77 1pfz h MET 230 CO -0.00 -0.23 0.00 -0.07 1.06 0.00 0.00 176.91 177.67 1pfz h LEU 231 N -0.36 0.00 -8.87 1.22 3.38 -1.14 -3.43 115.31 106.12 1pfz h LEU 231 Ca 0.12 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 57.45 1pfz h LEU 231 Cb 0.58 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 1pfz h LEU 231 CO -0.49 0.00 1.32 0.00 0.09 0.00 0.00 178.44 179.36 1pfz n GLN 232 N -2.43 1.58 -1.42 1.13 6.02 -0.88 -1.57 117.38 119.82 1pfz n GLN 232 Ca -0.00 0.49 -0.14 0.00 -0.01 0.00 0.00 57.00 57.34 1pfz n GLN 232 Cb 0.14 -2.67 -0.06 0.00 1.02 0.00 0.00 30.24 28.67 1pfz n GLN 232 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1pfz n ASN 233 N 9.16 -4.95 -0.31 1.08 3.02 -1.26 -4.86 115.26 117.13 1pfz n ASN 233 Ca 0.33 0.36 0.06 0.00 -0.03 0.00 0.00 54.58 55.29 1pfz n ASN 233 Cb 0.29 -3.72 0.24 0.00 -0.61 0.00 0.00 39.78 35.98 1pfz n ASN 233 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1pfz n LEU 234 N -1.64 0.92 -3.55 3.41 4.77 -0.61 -4.87 117.00 115.43 1pfz n LEU 234 Ca -0.14 -0.43 -0.22 0.00 -0.03 0.00 0.00 56.01 55.19 1pfz n LEU 234 Cb 0.51 -0.09 0.08 0.00 -2.33 0.00 0.00 43.42 41.59 1pfz n LEU 234 CO 0.22 0.21 0.19 0.47 -1.33 0.00 0.00 177.39 177.15 1pfz n ASP 235 N -0.08 -4.70 -4.40 -1.43 8.00 -1.26 -4.78 116.55 107.90 1pfz n ASP 235 Ca 0.10 -0.58 -0.31 0.00 0.71 0.00 0.00 54.79 54.71 1pfz n ASP 235 Cb 0.17 -5.03 -0.14 0.00 -0.02 0.00 0.00 41.12 36.10 1pfz n ASP 235 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1pfz s VAL 236 N -3.34 2.51 0.03 2.53 1.01 -1.26 -4.49 120.40 117.38 1pfz s VAL 236 Ca 0.37 -1.12 0.04 0.00 0.00 0.00 0.00 61.98 61.27 1pfz s VAL 236 Cb -0.16 -1.98 -0.02 0.00 0.00 0.00 0.00 36.38 34.22 1pfz s VAL 236 CO 0.73 0.46 -0.13 -0.63 0.00 0.00 0.00 175.10 175.53 1pfz s ILE 237 N -0.78 1.00 -0.18 2.22 1.01 0.69 -4.95 121.20 120.22 1pfz s ILE 237 Ca 0.12 -0.86 -0.15 0.00 0.00 0.00 0.00 60.65 59.77 1pfz s ILE 237 Cb -0.10 -0.90 -0.04 0.00 0.01 0.00 0.00 42.46 41.42 1pfz s ILE 237 CO 0.02 0.04 0.33 -0.75 0.00 0.00 0.00 174.94 174.58 1pfz s LYS 238 N -0.93 4.23 0.05 2.79 2.20 -1.26 0.13 119.74 126.95 1pfz s LYS 238 Ca 0.01 0.13 -0.31 0.00 -0.36 0.00 0.00 55.97 55.45 1pfz s LYS 238 Cb -0.07 -3.47 -0.08 0.00 -1.51 0.00 0.00 37.83 32.71 1pfz s LYS 238 CO 0.01 0.14 1.61 0.08 -0.36 0.00 0.00 175.35 176.82 1pfz s VAL 239 N 0.78 3.20 0.14 4.02 1.01 -0.94 -4.90 120.40 123.71 1pfz s VAL 239 Ca 0.17 0.62 -0.35 0.00 0.00 0.00 0.00 61.98 62.42 1pfz s VAL 239 Cb -0.14 -3.40 -0.15 0.00 0.00 0.00 0.00 36.38 32.70 1pfz s VAL 239 CO 0.06 -0.01 1.47 -2.65 0.00 0.00 0.00 175.10 173.97 1pfz n PRO 240 N 5.66 1.75 -0.94 2.72 -0.02 -1.26 -1.52 135.00 141.40 1pfz n PRO 240 Ca 0.15 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 1pfz n PRO 240 Cb 0.41 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 1pfz n PRO 240 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1pfz n PHE 241 N 2.97 0.00 -4.82 6.00 3.01 -1.26 -4.98 117.46 118.39 1pfz n PHE 241 Ca 0.17 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.37 1pfz n PHE 241 Cb 0.25 -1.56 -0.15 0.00 -0.01 0.00 0.00 39.48 38.02 1pfz n PHE 241 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1pfz s LEU 242 N 0.00 2.09 -0.27 4.37 1.43 -0.58 -5.06 118.68 120.67 1pfz s LEU 242 Ca 0.00 -0.43 -0.03 0.00 -1.03 0.00 0.00 54.13 52.65 1pfz s LEU 242 Cb 0.00 -0.99 -0.07 0.00 0.03 0.00 0.00 46.19 45.16 1pfz s LEU 242 CO 0.00 0.20 1.68 -2.65 0.23 0.00 0.00 176.35 175.81 1pfz n PRO 243 N 2.27 1.01 -3.63 1.29 -0.02 -1.26 -4.41 135.00 130.25 1pfz n PRO 243 Ca -0.16 -0.71 -0.04 0.00 -2.02 0.00 0.00 63.50 60.57 1pfz n PRO 243 Cb 0.53 -1.96 -0.05 0.00 -0.02 0.00 0.00 33.50 32.00 1pfz n PRO 243 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1pfz s PHE 244 N 3.03 -0.13 0.04 6.00 -0.12 -1.26 -4.96 117.98 120.59 1pfz s PHE 244 Ca 0.25 0.26 -0.05 0.00 -0.05 0.00 0.00 56.93 57.34 1pfz s PHE 244 Cb 0.09 0.47 -0.05 0.00 -0.63 0.00 0.00 43.02 42.91 1pfz s PHE 244 CO -0.01 -0.09 0.27 0.71 -0.05 0.00 0.00 175.22 176.05 1pfz s TYR 245 N -0.59 3.54 0.08 3.49 1.51 -1.26 -2.22 117.35 121.90 1pfz s TYR 245 Ca 0.06 0.48 0.09 0.00 -1.01 0.00 0.00 57.07 56.69 1pfz s TYR 245 Cb -0.02 -1.93 -0.03 0.00 -0.11 0.00 0.00 41.96 39.86 1pfz s TYR 245 CO -0.09 0.58 -0.23 0.08 -1.11 0.00 0.00 175.55 174.78 1pfz s VAL 246 N -1.41 1.87 0.13 0.71 1.01 0.35 -1.52 120.40 121.55 1pfz s VAL 246 Ca 0.31 -1.44 -0.24 0.00 0.00 0.00 0.00 61.98 60.62 1pfz s VAL 246 Cb -0.13 -1.65 0.07 0.00 0.00 0.00 0.00 36.38 34.67 1pfz s VAL 246 CO 0.20 0.13 0.61 0.28 0.00 0.00 0.00 175.10 176.32 1pfz s THR 247 N -0.96 0.00 0.14 3.92 -1.32 0.80 -0.22 115.64 118.00 1pfz s THR 247 Ca 0.09 -0.01 -0.31 0.00 -1.21 0.00 0.00 61.69 60.25 1pfz s THR 247 Cb -0.10 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 69.80 1pfz s THR 247 CO 0.03 -0.01 1.46 -0.76 -2.21 0.00 0.00 174.62 173.14 1pfz s LEU 248 N -2.54 4.37 0.56 9.08 1.43 -1.26 0.26 118.68 130.57 1pfz s LEU 248 Ca -0.01 2.45 0.29 0.00 -1.03 0.00 0.00 54.13 55.83 1pfz s LEU 248 Cb -0.01 -3.59 1.46 0.00 0.03 0.00 0.00 46.19 44.08 1pfz s LEU 248 CO -0.10 -0.72 1.93 0.00 0.23 0.00 0.00 176.35 177.68 1pfz n ASN 250 N -4.08 3.67 -4.65 0.00 6.94 -1.26 -4.96 115.26 110.92 1pfz n ASN 250 Ca 0.12 -2.01 -0.60 0.00 -0.02 0.00 0.00 54.58 52.07 1pfz n ASN 250 Cb 0.74 -0.46 -0.08 0.00 -2.36 0.00 0.00 39.78 37.62 1pfz n ASN 250 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 1pfz n ASN 251 N 1.49 1.89 -0.01 0.53 2.85 0.19 -4.81 115.26 117.39 1pfz n ASN 251 Ca 0.23 1.00 0.14 0.00 -0.11 0.00 0.00 54.58 55.83 1pfz n ASN 251 Cb 0.58 -1.06 0.56 0.00 1.24 0.00 0.00 39.78 41.10 1pfz n ASN 251 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 1pfz n SER 252 N 5.70 0.13 0.05 1.20 7.64 -1.26 -3.41 113.62 123.68 1pfz n SER 252 Ca 0.32 0.21 0.13 0.00 1.01 0.00 0.00 58.87 60.54 1pfz n SER 252 Cb 0.07 -0.30 0.37 0.00 -1.01 0.00 0.00 64.21 63.35 1pfz n SER 252 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1pfz n LYS 253 N -1.44 0.16 -1.65 1.43 5.02 -1.26 -4.85 118.16 115.57 1pfz n LYS 253 Ca 0.08 0.10 -0.44 0.00 -2.02 0.00 0.00 58.31 56.02 1pfz n LYS 253 Cb 0.33 -1.65 -0.04 0.00 -0.02 0.00 0.00 35.03 33.65 1pfz n LYS 253 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1pfz n LEU 254 N -1.92 3.80 -4.82 -0.35 4.77 -1.22 -4.95 117.00 112.30 1pfz n LEU 254 Ca 0.05 0.81 -0.31 0.00 -0.03 0.00 0.00 56.01 56.54 1pfz n LEU 254 Cb 0.40 -1.48 0.04 0.00 -2.33 0.00 0.00 43.42 40.05 1pfz n LEU 254 CO 0.32 -0.01 0.71 -2.16 -1.33 0.00 0.00 177.39 174.92 1pfz s PRO 255 N 4.68 3.02 -0.20 3.23 0.04 -1.26 -4.81 135.00 139.70 1pfz s PRO 255 Ca 0.92 0.94 -0.08 0.00 0.04 0.00 0.00 61.00 62.83 1pfz s PRO 255 Cb -0.51 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.00 1pfz s PRO 255 CO 0.44 -1.03 0.07 0.99 0.04 0.00 0.00 177.00 177.51 1pfz s THR 256 N -3.04 4.73 0.30 1.26 2.01 -1.26 -4.26 115.64 115.38 1pfz s THR 256 Ca 0.58 -0.05 -0.29 0.00 0.31 0.00 0.00 61.69 62.24 1pfz s THR 256 Cb -0.14 -3.15 -0.10 0.00 0.01 0.00 0.00 72.50 69.12 1pfz s THR 256 CO 0.54 0.43 1.29 -0.36 -0.69 0.00 0.00 174.62 175.83 1pfz s PHE 257 N 0.67 3.15 -0.12 4.92 0.08 -0.30 -4.48 117.98 121.90 1pfz s PHE 257 Ca 0.04 1.39 -0.01 0.00 0.12 0.00 0.00 56.93 58.47 1pfz s PHE 257 Cb -0.13 -3.63 0.03 0.00 -0.57 0.00 0.00 43.02 38.73 1pfz s PHE 257 CO 0.02 -1.75 -0.04 -1.21 -0.10 0.00 0.00 175.22 172.14 1pfz s GLU 258 N -1.38 1.14 -0.12 0.44 2.02 0.34 -1.01 118.70 120.15 1pfz s GLU 258 Ca 0.50 -0.23 0.02 0.00 0.02 0.00 0.00 54.97 55.28 1pfz s GLU 258 Cb -0.38 -1.57 -0.01 0.00 0.10 0.00 0.00 34.13 32.27 1pfz s GLU 258 CO 0.48 -0.36 -0.19 -0.06 0.02 0.00 0.00 175.26 175.15 1pfz s PHE 259 N 1.78 2.68 0.07 1.61 0.08 0.69 0.48 117.98 125.38 1pfz s PHE 259 Ca 0.03 -0.89 0.05 0.00 0.12 0.00 0.00 56.93 56.24 1pfz s PHE 259 Cb -0.14 -1.78 -0.03 0.00 -0.57 0.00 0.00 43.02 40.51 1pfz s PHE 259 CO -0.07 -0.34 -0.14 0.95 -0.10 0.00 0.00 175.22 175.52 1pfz s THR 260 N 0.38 1.11 0.34 0.64 -4.23 -0.22 0.09 115.64 113.75 1pfz s THR 260 Ca -0.15 -1.32 0.05 0.00 -1.18 0.00 0.00 61.69 59.10 1pfz s THR 260 Cb -0.17 -1.08 -0.02 0.00 1.34 0.00 0.00 72.50 72.57 1pfz s THR 260 CO 0.07 -0.24 0.19 -1.54 -0.54 0.00 0.00 174.62 172.57 1pfz n SER 261 N 1.26 0.33 0.22 3.99 3.41 0.16 -0.60 113.62 122.38 1pfz n SER 261 Ca -0.21 -3.01 0.15 0.00 -0.26 0.00 0.00 58.87 55.54 1pfz n SER 261 Cb 0.54 1.23 0.59 0.00 -0.26 0.00 0.00 64.21 66.31 1pfz n SER 261 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1pfz h GLU 262 N 0.00 0.00 -0.00 4.33 4.39 -2.00 -3.22 114.58 118.08 1pfz h GLU 262 Ca -0.26 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.44 1pfz h GLU 262 Cb 1.11 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.76 1pfz h GLU 262 CO 0.39 0.00 -0.32 0.09 -1.16 0.00 0.00 179.01 178.01 1pfz n ASN 263 N -2.75 0.45 -3.60 1.42 4.13 -1.26 -5.08 115.26 108.56 1pfz n ASN 263 Ca 0.01 -0.72 -0.06 0.00 1.68 0.00 0.00 54.58 55.49 1pfz n ASN 263 Cb 0.29 0.93 -0.01 0.00 -1.54 0.00 0.00 39.78 39.45 1pfz n ASN 263 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1pfz s GLY 264 N -1.63 -0.02 -0.06 7.41 0.00 -1.22 -5.03 107.32 106.77 1pfz s GLY 264 Ca 0.03 -0.28 -0.01 0.00 0.00 0.00 0.00 44.72 44.46 1pfz s GLY 264 CO 0.29 0.11 -0.01 1.25 0.00 0.00 0.00 173.10 174.73 1pfz s LYS 265 N -3.28 0.67 -0.11 2.90 2.20 -1.26 -0.67 119.74 120.20 1pfz s LYS 265 Ca 0.13 0.04 0.04 0.00 -0.36 0.00 0.00 55.97 55.82 1pfz s LYS 265 Cb -0.04 -0.92 0.00 0.00 -1.51 0.00 0.00 37.83 35.36 1pfz s LYS 265 CO 0.06 -0.23 -0.24 0.71 -0.36 0.00 0.00 175.35 175.30 1pfz s TYR 266 N 1.61 2.57 0.18 4.03 2.02 0.11 -4.99 117.35 122.89 1pfz s TYR 266 Ca -0.00 -1.10 0.09 0.00 -0.37 0.00 0.00 57.07 55.69 1pfz s TYR 266 Cb -0.13 -1.72 -0.04 0.00 -0.40 0.00 0.00 41.96 39.67 1pfz s TYR 266 CO -0.04 -0.45 -0.20 0.95 -1.57 0.00 0.00 175.55 174.25 1pfz s THR 267 N 0.42 1.97 -0.23 -0.71 -4.23 -1.26 -0.22 115.64 111.38 1pfz s THR 267 Ca -0.17 -1.98 -0.02 0.00 -1.18 0.00 0.00 61.69 58.34 1pfz s THR 267 Cb -0.18 -1.94 0.07 0.00 1.34 0.00 0.00 72.50 71.80 1pfz s THR 267 CO 0.07 -0.28 0.04 -0.22 -0.54 0.00 0.00 174.62 173.69 1pfz s LEU 268 N -2.73 1.50 0.59 4.79 2.96 -0.18 -4.97 118.68 120.64 1pfz s LEU 268 Ca 0.18 -1.04 -0.15 0.00 -0.22 0.00 0.00 54.13 52.89 1pfz s LEU 268 Cb -0.06 -0.69 -0.04 0.00 0.50 0.00 0.00 46.19 45.89 1pfz s LEU 268 CO 0.08 -0.33 1.04 -1.61 -1.32 0.00 0.00 176.35 174.21 1pfz s GLU 269 N 1.78 3.43 0.40 1.98 8.01 -1.26 -1.15 118.70 131.89 1pfz s GLU 269 Ca 0.01 1.12 0.22 0.00 0.01 0.00 0.00 54.97 56.33 1pfz s GLU 269 Cb -0.17 -2.05 1.21 0.00 -4.31 0.00 0.00 34.13 28.81 1pfz s GLU 269 CO -0.13 -0.71 1.71 -1.35 0.01 0.00 0.00 175.26 174.79 1pfz h PRO 270 N 0.43 0.27 -0.87 0.39 0.11 -1.88 -1.10 132.00 129.36 1pfz h PRO 270 Ca -0.47 -0.02 0.18 0.00 0.11 0.00 0.00 66.00 65.81 1pfz h PRO 270 Cb 1.21 -0.06 -0.06 0.00 0.11 0.00 0.00 31.00 32.19 1pfz h PRO 270 CO 0.58 0.18 0.57 1.05 -0.21 0.00 0.00 178.00 180.17 1pfz h GLU 271 N 0.28 0.46 0.00 1.05 4.11 -1.95 -0.93 114.58 117.61 1pfz h GLU 271 Ca 0.69 -0.03 -0.06 0.00 0.07 0.00 0.00 59.36 60.03 1pfz h GLU 271 Cb 1.89 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 31.03 1pfz h GLU 271 CO -0.38 0.31 -0.27 1.88 0.07 0.00 0.00 179.01 180.62 1pfz h TYR 272 N 0.48 0.00 -0.30 2.06 0.05 -1.56 -3.28 116.97 114.43 1pfz h TYR 272 Ca 0.45 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.23 1pfz h TYR 272 Cb 1.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.74 1pfz h TYR 272 CO -0.00 0.27 0.00 2.48 -1.05 0.00 0.00 178.16 179.86 1pfz n TYR 273 N -3.29 0.81 -3.76 4.88 0.18 -0.40 -4.66 117.16 110.91 1pfz n TYR 273 Ca 0.01 -0.74 -0.35 0.00 1.88 0.00 0.00 57.90 58.70 1pfz n TYR 273 Cb 0.54 -0.22 -0.08 0.00 -0.38 0.00 0.00 39.34 39.20 1pfz n TYR 273 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 1pfz s LEU 274 N -2.19 4.21 -0.39 -3.48 1.43 -0.91 0.19 118.68 117.54 1pfz s LEU 274 Ca 0.36 0.25 -0.07 0.00 -1.03 0.00 0.00 54.13 53.64 1pfz s LEU 274 Cb 0.27 -2.08 0.07 0.00 0.03 0.00 0.00 46.19 44.48 1pfz s LEU 274 CO 0.12 0.21 0.20 -1.10 0.23 0.00 0.00 176.35 176.00 1pfz s GLN 275 N 0.19 2.49 -0.11 1.70 -0.21 0.65 -4.92 119.66 119.46 1pfz s GLN 275 Ca 0.09 -1.45 -0.29 0.00 0.02 0.00 0.00 55.36 53.72 1pfz s GLN 275 Cb -0.11 -3.63 -0.04 0.00 1.00 0.00 0.00 33.01 30.23 1pfz s GLN 275 CO -0.01 -0.89 1.51 -1.01 -2.12 0.00 0.00 175.29 172.77 1pfz s HIS 276 N 1.36 2.31 -0.18 0.91 3.76 -1.26 0.65 115.29 122.84 1pfz s HIS 276 Ca 0.02 0.51 0.17 0.00 -0.15 0.00 0.00 55.06 55.62 1pfz s HIS 276 Cb -0.22 -3.77 0.45 0.00 1.11 0.00 0.00 32.58 30.15 1pfz s HIS 276 CO 0.01 -3.00 1.17 0.44 -0.85 0.00 0.00 174.74 172.51 1pfz n ILE 277 N 5.50 1.40 0.00 0.60 -5.35 -0.57 -4.88 119.36 116.06 1pfz n ILE 277 Ca 0.16 -2.71 0.00 0.00 -0.27 0.00 0.00 62.75 59.93 1pfz n ILE 277 Cb 0.44 0.31 0.00 0.00 -1.74 0.00 0.00 39.64 38.65 1pfz n ILE 277 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1pfz n GLU 278 N -0.43 0.00 0.08 6.28 1.02 -1.02 0.38 120.64 126.95 1pfz n GLU 278 Ca 0.17 0.09 0.12 0.00 -0.02 0.00 0.00 57.16 57.52 1pfz n GLU 278 Cb 0.91 -1.52 0.12 0.00 -0.02 0.00 0.00 31.44 30.92 1pfz n GLU 278 CO 0.00 0.00 0.00 0.38 1.18 0.00 0.00 177.13 178.69 1pfz h ASP 279 N 0.00 0.00 0.21 1.62 3.04 -1.90 -3.29 116.42 116.11 1pfz h ASP 279 Ca 0.00 -0.14 -0.35 0.00 -3.24 0.00 0.00 57.03 53.30 1pfz h ASP 279 Cb 0.04 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.34 1pfz h ASP 279 CO 0.00 0.07 -1.77 0.58 -2.04 0.00 0.00 179.24 176.08 1pfz h VAL 280 N 0.00 0.91 -2.06 4.15 2.07 -0.44 -3.47 116.25 117.41 1pfz h VAL 280 Ca 0.00 -2.52 -0.03 0.00 0.82 0.00 0.00 66.70 64.97 1pfz h VAL 280 Cb 0.84 2.73 -0.21 0.00 -1.52 0.00 0.00 31.29 33.12 1pfz h VAL 280 CO 0.00 0.86 0.07 -0.83 0.02 0.00 0.00 177.57 177.69 1pfz s GLY 281 N -5.16 -0.54 0.17 2.17 0.00 -1.19 -4.45 107.32 98.32 1pfz s GLY 281 Ca -0.16 2.05 -0.33 0.00 0.00 0.00 0.00 44.72 46.28 1pfz s GLY 281 CO 0.84 1.85 1.35 -1.05 0.00 0.00 0.00 173.10 176.10 1pfz n PRO 282 N 3.10 1.59 -1.73 2.90 -0.02 -1.24 -1.82 135.00 137.79 1pfz n PRO 282 Ca -0.15 0.57 -0.21 0.00 -2.02 0.00 0.00 63.50 61.69 1pfz n PRO 282 Cb 0.56 -2.20 -0.08 0.00 -0.02 0.00 0.00 33.50 31.76 1pfz n PRO 282 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pfz n GLY 283 N 2.46 1.57 3.86 -1.23 0.00 -1.26 -4.98 105.19 105.60 1pfz n GLY 283 Ca 0.15 -0.02 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 1pfz n GLY 283 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pfz s LEU 284 N -4.89 4.38 0.07 0.99 1.43 -0.76 -0.54 118.68 119.37 1pfz s LEU 284 Ca 0.00 0.49 0.04 0.00 -1.03 0.00 0.00 54.13 53.63 1pfz s LEU 284 Cb 0.00 -2.12 -0.03 0.00 0.03 0.00 0.00 46.19 44.07 1pfz s LEU 284 CO 0.00 0.38 -0.12 0.00 0.23 0.00 0.00 176.35 176.84 1pfz s MET 286 N -1.98 3.43 -0.16 0.00 -1.94 0.21 -0.14 119.30 118.72 1pfz s MET 286 Ca -0.02 -0.17 -0.28 0.00 -1.71 0.00 0.00 55.69 53.51 1pfz s MET 286 Cb -0.08 -3.17 -0.01 0.00 2.01 0.00 0.00 34.83 33.59 1pfz s MET 286 CO 0.01 0.76 0.98 -0.51 -0.01 0.00 0.00 175.02 176.25 1pfz s LEU 287 N -1.19 4.18 -0.91 -0.03 1.43 -0.58 -0.25 118.68 121.33 1pfz s LEU 287 Ca 0.17 1.39 -0.05 0.00 -1.03 0.00 0.00 54.13 54.62 1pfz s LEU 287 Cb -0.12 -3.47 0.09 0.00 0.03 0.00 0.00 46.19 42.71 1pfz s LEU 287 CO 0.07 -0.51 2.58 -3.20 0.23 0.00 0.00 176.35 175.51 1pfz n ASN 288 N 5.51 7.30 -3.97 2.29 5.15 0.13 -4.61 115.26 127.06 1pfz n ASN 288 Ca 0.09 -3.16 -0.24 0.00 -0.60 0.00 0.00 54.58 50.67 1pfz n ASN 288 Cb 0.48 -1.30 -0.17 0.00 -0.53 0.00 0.00 39.78 38.26 1pfz n ASN 288 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1pfz s ILE 289 N -1.61 0.96 -0.00 -1.44 1.01 -1.26 -2.43 121.20 116.42 1pfz s ILE 289 Ca 0.56 -0.35 0.08 0.00 0.00 0.00 0.00 60.65 60.94 1pfz s ILE 289 Cb 0.28 -0.92 -0.02 0.00 0.01 0.00 0.00 42.46 41.81 1pfz s ILE 289 CO -0.15 0.32 -0.25 -0.63 0.00 0.00 0.00 174.94 174.23 1pfz s ILE 290 N 0.91 2.00 -0.15 2.92 1.01 -0.63 -4.94 121.20 122.32 1pfz s ILE 290 Ca -0.10 -1.14 -0.27 0.00 0.00 0.00 0.00 60.65 59.14 1pfz s ILE 290 Cb -0.15 -1.67 -0.01 0.00 0.01 0.00 0.00 42.46 40.64 1pfz s ILE 290 CO 0.01 0.51 0.93 -0.83 0.00 0.00 0.00 174.94 175.55 1pfz s GLY 291 N -0.74 2.17 -0.18 6.18 0.00 -1.26 -1.12 107.32 112.37 1pfz s GLY 291 Ca 0.10 0.20 -0.08 0.00 0.00 0.00 0.00 44.72 44.94 1pfz s GLY 291 CO -0.00 1.83 0.41 -2.27 0.00 0.00 0.00 173.10 173.06 1pfz s LEU 292 N 2.19 -0.38 -0.12 0.66 2.96 0.25 -4.80 118.68 119.44 1pfz s LEU 292 Ca 0.43 0.94 -0.03 0.00 -0.22 0.00 0.00 54.13 55.25 1pfz s LEU 292 Cb -0.17 1.34 -0.03 0.00 0.50 0.00 0.00 46.19 47.82 1pfz s LEU 292 CO 0.14 -0.21 0.00 -1.81 -1.32 0.00 0.00 176.35 173.15 1pfz s ASP 293 N 2.04 5.18 0.42 3.68 1.01 -1.26 -3.71 116.67 124.02 1pfz s ASP 293 Ca -0.05 0.06 0.07 0.00 0.71 0.00 0.00 52.55 53.34 1pfz s ASP 293 Cb -0.10 -1.64 -0.03 0.00 1.01 0.00 0.00 42.92 42.16 1pfz s ASP 293 CO -0.13 0.29 0.29 -0.36 0.21 0.00 0.00 175.17 175.47 1pfz s PHE 294 N -0.33 2.63 0.57 4.23 0.40 -1.26 -4.98 117.98 119.23 1pfz s PHE 294 Ca 0.07 -0.55 0.31 0.00 -0.60 0.00 0.00 56.93 56.16 1pfz s PHE 294 Cb -0.12 -2.07 1.45 0.00 0.51 0.00 0.00 43.02 42.79 1pfz s PHE 294 CO 0.02 0.00 1.83 -1.35 0.70 0.00 0.00 175.22 176.42 1pfz h PRO 295 N 1.20 0.00 -5.00 0.24 0.11 -2.02 -3.41 132.00 123.12 1pfz h PRO 295 Ca -0.42 0.00 -0.32 0.00 0.11 0.00 0.00 66.00 65.37 1pfz h PRO 295 Cb 1.26 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.23 1pfz h PRO 295 CO 0.63 0.00 -0.70 0.14 -0.21 0.00 0.00 178.00 177.86 1pfz s VAL 296 N -4.78 1.05 -0.22 3.15 -7.23 -1.26 -5.08 120.40 106.03 1pfz s VAL 296 Ca -0.04 -2.04 -0.38 0.00 -1.81 0.00 0.00 61.98 57.71 1pfz s VAL 296 Cb 0.19 -1.92 -0.14 0.00 0.56 0.00 0.00 36.38 35.07 1pfz s VAL 296 CO 0.66 -0.68 1.84 -2.65 -0.31 0.00 0.00 175.10 173.97 1pfz n PRO 297 N -0.21 1.51 -3.86 4.82 -0.02 -1.26 -4.93 135.00 131.04 1pfz n PRO 297 Ca -0.09 0.54 -0.12 0.00 -2.02 0.00 0.00 63.50 61.81 1pfz n PRO 297 Cb 0.61 -2.33 -0.13 0.00 -0.02 0.00 0.00 33.50 31.63 1pfz n PRO 297 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1pfz s THR 298 N 4.15 0.02 -0.04 3.45 2.01 -1.26 -2.34 115.64 121.63 1pfz s THR 298 Ca 0.98 -0.18 0.07 0.00 0.31 0.00 0.00 61.69 62.86 1pfz s THR 298 Cb -0.92 -0.17 -0.02 0.00 0.01 0.00 0.00 72.50 71.41 1pfz s THR 298 CO 0.59 -0.10 -0.24 -0.36 -0.69 0.00 0.00 174.62 173.83 1pfz s PHE 299 N -0.28 2.43 -0.31 4.92 0.40 0.16 -3.92 117.98 121.37 1pfz s PHE 299 Ca -0.03 -0.48 -0.09 0.00 -0.60 0.00 0.00 56.93 55.73 1pfz s PHE 299 Cb -0.02 -1.55 0.00 0.00 0.51 0.00 0.00 43.02 41.95 1pfz s PHE 299 CO 0.00 -0.06 0.13 0.42 0.70 0.00 0.00 175.22 176.42 1pfz s ILE 300 N -0.49 4.39 -1.04 0.64 1.01 -0.97 -1.00 121.20 123.74 1pfz s ILE 300 Ca 0.06 -0.55 -0.18 0.00 0.00 0.00 0.00 60.65 59.98 1pfz s ILE 300 Cb -0.11 -3.27 0.12 0.00 0.01 0.00 0.00 42.46 39.21 1pfz s ILE 300 CO 0.01 0.04 1.29 -0.76 0.00 0.00 0.00 174.94 175.52 1pfz s LEU 301 N 1.57 4.74 0.00 2.97 1.43 0.13 -2.24 118.68 127.28 1pfz s LEU 301 Ca 0.04 -2.23 0.00 0.00 -1.03 0.00 0.00 54.13 50.91 1pfz s LEU 301 Cb -0.17 -2.44 0.00 0.00 0.03 0.00 0.00 46.19 43.61 1pfz s LEU 301 CO 0.05 -1.06 0.00 0.61 0.23 0.00 0.00 176.35 176.18 1pfz n GLY 302 N 5.34 0.43 0.35 -3.19 0.00 -1.08 -2.12 105.19 104.91 1pfz n GLY 302 Ca 0.30 -1.64 0.04 0.00 0.00 0.00 0.00 46.02 44.72 1pfz n GLY 302 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1pfz h ASP 303 N 0.00 -0.96 -0.96 1.61 1.82 -0.80 -1.28 116.42 115.85 1pfz h ASP 303 Ca 0.00 0.29 0.13 0.00 -0.39 0.00 0.00 57.03 57.06 1pfz h ASP 303 Cb 0.00 0.61 -0.09 0.00 0.68 0.00 0.00 39.33 40.53 1pfz h ASP 303 CO 0.00 -0.31 0.58 -0.65 -1.61 0.00 0.00 179.24 177.25 1pfz h PRO 304 N -0.00 0.85 -0.26 0.28 0.11 -1.83 0.24 132.00 131.38 1pfz h PRO 304 Ca 0.43 -0.05 -0.17 0.00 0.11 0.00 0.00 66.00 66.32 1pfz h PRO 304 Cb 0.67 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 31.59 1pfz h PRO 304 CO -0.97 0.56 -0.52 0.35 -0.21 0.00 0.00 178.00 177.21 1pfz h PHE 305 N 0.87 0.94 0.00 0.65 3.04 -1.55 -3.00 116.94 117.90 1pfz h PHE 305 Ca 0.49 -0.32 0.00 0.00 3.98 0.00 0.00 57.97 62.12 1pfz h PHE 305 Cb 0.57 -0.18 0.00 0.00 2.56 0.00 0.00 35.95 38.90 1pfz h PHE 305 CO -0.02 1.11 0.00 -1.33 -2.02 0.00 0.00 178.31 176.05 1pfz n MET 306 N -4.00 0.14 0.09 1.11 2.81 -0.49 -1.20 117.12 115.58 1pfz n MET 306 Ca -0.04 0.07 -0.03 0.00 -1.81 0.00 0.00 57.70 55.89 1pfz n MET 306 Cb 0.61 -1.50 -0.07 0.00 -0.71 0.00 0.00 33.22 31.55 1pfz n MET 306 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1pfz h ARG 307 N 0.00 0.00 0.11 0.03 2.47 -0.85 -3.33 114.38 112.81 1pfz h ARG 307 Ca 0.00 0.00 -0.35 0.00 -1.26 0.00 0.00 59.98 58.37 1pfz h ARG 307 Cb 0.35 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.65 1pfz h ARG 307 CO 0.00 0.77 -1.96 1.17 0.56 0.00 0.00 179.97 180.51 1pfz n LYS 308 N -3.28 0.74 -4.83 0.04 4.81 -0.89 -4.26 118.16 110.50 1pfz n LYS 308 Ca -0.00 0.27 -0.33 0.00 -0.87 0.00 0.00 58.31 57.37 1pfz n LYS 308 Cb 0.87 -1.72 -0.14 0.00 0.02 0.00 0.00 35.03 34.05 1pfz n LYS 308 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1pfz s TYR 309 N -2.56 2.77 0.31 5.64 2.02 -0.34 -1.30 117.35 123.89 1pfz s TYR 309 Ca -0.20 -0.57 -0.28 0.00 -0.37 0.00 0.00 57.07 55.65 1pfz s TYR 309 Cb 0.07 -1.79 -0.09 0.00 -0.40 0.00 0.00 41.96 39.74 1pfz s TYR 309 CO 0.78 -0.14 1.11 0.12 -1.57 0.00 0.00 175.55 175.84 1pfz s PHE 310 N 0.12 3.46 0.02 2.71 5.36 0.79 -4.41 117.98 126.03 1pfz s PHE 310 Ca -0.07 1.66 0.04 0.00 -0.96 0.00 0.00 56.93 57.61 1pfz s PHE 310 Cb -0.15 -3.29 -0.02 0.00 -0.34 0.00 0.00 43.02 39.22 1pfz s PHE 310 CO 0.05 -0.70 -0.13 0.95 -1.46 0.00 0.00 175.22 173.93 1pfz s THR 311 N -1.26 1.05 -0.11 0.12 -4.23 -1.14 -2.44 115.64 107.63 1pfz s THR 311 Ca 0.48 -0.79 0.04 0.00 -1.18 0.00 0.00 61.69 60.24 1pfz s THR 311 Cb -0.31 -0.92 0.00 0.00 1.34 0.00 0.00 72.50 72.62 1pfz s THR 311 CO 0.39 0.13 -0.23 -0.69 -0.54 0.00 0.00 174.62 173.68 1pfz s VAL 312 N -0.60 2.02 -0.38 2.29 1.01 0.46 -1.63 120.40 123.56 1pfz s VAL 312 Ca 0.03 -0.99 -0.05 0.00 0.00 0.00 0.00 61.98 60.97 1pfz s VAL 312 Cb -0.06 -1.76 0.08 0.00 0.00 0.00 0.00 36.38 34.64 1pfz s VAL 312 CO 0.00 0.55 0.17 -0.36 0.00 0.00 0.00 175.10 175.47 1pfz s PHE 313 N 0.43 3.41 -0.41 5.22 0.40 0.74 0.18 117.98 127.95 1pfz s PHE 313 Ca -0.17 -1.92 -0.14 0.00 -0.60 0.00 0.00 56.93 54.11 1pfz s PHE 313 Cb -0.18 -2.83 0.03 0.00 0.51 0.00 0.00 43.02 40.56 1pfz s PHE 313 CO 0.07 -0.88 0.29 0.34 0.70 0.00 0.00 175.22 175.74 1pfz s ASP 314 N 1.78 5.98 0.00 1.36 -1.08 -0.28 -1.44 116.67 122.99 1pfz s ASP 314 Ca 0.03 -1.03 -0.22 0.00 -0.52 0.00 0.00 52.55 50.80 1pfz s ASP 314 Cb -0.22 -2.11 -0.18 0.00 -1.46 0.00 0.00 42.92 38.95 1pfz s ASP 314 CO -0.01 -0.47 1.25 1.88 0.52 0.00 0.00 175.17 178.34 1pfz h TYR 315 N 8.58 0.30 -0.76 -5.34 0.05 -1.44 -0.81 116.97 117.55 1pfz h TYR 315 Ca -0.26 -0.11 0.09 0.00 0.05 0.00 0.00 58.73 58.50 1pfz h TYR 315 Cb 1.11 -0.06 -0.07 0.00 1.01 0.00 0.00 36.73 38.72 1pfz h TYR 315 CO 0.57 0.74 0.42 -0.44 -1.05 0.00 0.00 178.16 178.40 1pfz h ASP 316 N -0.23 0.58 -0.57 3.88 3.32 -1.91 -2.73 116.42 118.77 1pfz h ASP 316 Ca 0.00 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1pfz h ASP 316 Cb 0.72 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.22 1pfz h ASP 316 CO 0.03 0.33 0.00 0.59 -1.72 0.00 0.00 179.24 178.48 1pfz n ASN 317 N -4.80 3.59 -4.00 6.45 3.02 -1.24 -5.00 115.26 113.29 1pfz n ASN 317 Ca 0.12 -1.98 -0.44 0.00 -0.03 0.00 0.00 54.58 52.25 1pfz n ASN 317 Cb 0.27 -0.38 0.02 0.00 -0.61 0.00 0.00 39.78 39.09 1pfz n ASN 317 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1pfz n HIS 318 N 1.36 -1.50 -3.95 3.10 8.25 -0.37 -4.87 115.22 117.24 1pfz n HIS 318 Ca 0.20 0.15 -0.08 0.00 -0.26 0.00 0.00 57.72 57.72 1pfz n HIS 318 Cb 0.57 -2.90 -0.04 0.00 1.12 0.00 0.00 29.99 28.74 1pfz n HIS 318 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1pfz s SER 319 N -3.50 -0.13 -0.11 0.41 1.04 -0.84 -1.47 113.70 109.09 1pfz s SER 319 Ca 0.48 -0.84 0.03 0.00 0.48 0.00 0.00 55.95 56.10 1pfz s SER 319 Cb -0.25 0.64 0.01 0.00 0.10 0.00 0.00 66.02 66.52 1pfz s SER 319 CO 0.95 -1.22 -0.19 -0.69 0.98 0.00 0.00 173.24 173.06 1pfz s VAL 320 N -3.93 1.80 -0.04 5.02 1.01 0.00 -1.12 120.40 123.14 1pfz s VAL 320 Ca 0.19 -0.84 -0.10 0.00 0.00 0.00 0.00 61.98 61.23 1pfz s VAL 320 Cb -0.02 -1.60 -0.05 0.00 0.00 0.00 0.00 36.38 34.71 1pfz s VAL 320 CO 0.09 0.50 0.28 -0.83 0.00 0.00 0.00 175.10 175.14 1pfz s GLY 321 N 0.74 2.31 -0.01 4.51 0.00 0.13 -0.54 107.32 114.45 1pfz s GLY 321 Ca -0.11 -0.45 0.02 0.00 0.00 0.00 0.00 44.72 44.19 1pfz s GLY 321 CO 0.01 -0.17 -0.08 -0.42 0.00 0.00 0.00 173.10 172.45 1pfz s ILE 322 N -1.13 0.64 0.01 0.90 1.01 0.27 -0.40 121.20 122.51 1pfz s ILE 322 Ca 0.22 -0.34 -0.28 0.00 0.00 0.00 0.00 60.65 60.25 1pfz s ILE 322 Cb -0.14 -0.55 0.07 0.00 0.01 0.00 0.00 42.46 41.85 1pfz s ILE 322 CO 0.11 0.19 0.67 0.00 0.00 0.00 0.00 174.94 175.91 1pfz s ALA 323 N -0.12 -1.73 0.15 9.38 0.00 -1.02 -1.12 121.76 127.31 1pfz s ALA 323 Ca 0.02 1.07 -0.33 0.00 0.00 0.00 0.00 51.96 52.72 1pfz s ALA 323 Cb -0.04 0.25 -0.13 0.00 0.00 0.00 0.00 23.12 23.21 1pfz s ALA 323 CO -0.00 -0.50 1.68 -0.11 0.00 0.00 0.00 175.76 176.83 1pfz n LEU 324 N 0.48 3.52 -4.77 0.00 7.94 -1.26 -0.15 117.00 122.77 1pfz n LEU 324 Ca -0.18 1.06 -0.38 0.00 -1.11 0.00 0.00 56.01 55.40 1pfz n LEU 324 Cb 0.60 -1.48 -0.04 0.00 0.53 0.00 0.00 43.42 43.02 1pfz n LEU 324 CO 0.20 -0.07 0.75 0.00 -1.11 0.00 0.00 177.39 177.16 1pfz s ALA 325 N 1.44 3.20 -0.15 1.96 0.00 -0.42 -1.14 121.76 126.66 1pfz s ALA 325 Ca 0.79 0.77 -0.29 0.00 0.00 0.00 0.00 51.96 53.22 1pfz s ALA 325 Cb -0.60 -3.29 -0.01 0.00 0.00 0.00 0.00 23.12 19.22 1pfz s ALA 325 CO 0.37 -0.18 1.19 0.15 0.00 0.00 0.00 175.76 177.29 1pfz s LYS 326 N -2.09 4.28 0.19 0.00 1.02 -0.36 -4.74 119.74 118.04 1pfz s LYS 326 Ca 0.53 1.59 -0.06 0.00 0.02 0.00 0.00 55.97 58.05 1pfz s LYS 326 Cb -0.26 -3.68 0.11 0.00 -0.52 0.00 0.00 37.83 33.49 1pfz s LYS 326 CO 0.32 -0.60 1.58 0.87 -0.92 0.00 0.00 175.35 176.60 1pfz h LYS 327 N 7.81 0.81 -4.68 1.68 1.57 -1.93 -3.42 116.57 118.42 1pfz h LYS 327 Ca -0.27 -0.37 -0.63 0.00 -1.87 0.00 0.00 60.65 57.51 1pfz h LYS 327 Cb 1.11 -0.02 -0.37 0.00 0.08 0.00 0.00 32.23 33.04 1pfz h LYS 327 CO 0.94 1.00 -0.82 -0.80 -0.57 0.00 0.00 179.45 179.20 1pfz s ASN 328 N -6.78 3.43 0.00 0.86 0.01 -1.26 -4.80 114.94 106.40 1pfz s ASN 328 Ca -0.10 -0.89 0.22 0.00 -0.71 0.00 0.00 52.86 51.39 1pfz s ASN 328 Cb 0.12 -1.30 1.30 0.00 0.41 0.00 0.00 41.25 41.79 1pfz s ASN 328 CO 0.85 -0.12 1.68 0.18 -1.51 0.00 0.00 177.10 178.18