#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pvj s ALA 32 N 0.00 2.98 -0.22 4.37 0.00 -1.26 0.17 121.76 127.79 1pvj s ALA 32 Ca 0.00 0.53 -0.01 0.00 0.00 0.00 0.00 51.96 52.48 1pvj s ALA 32 Cb 0.00 -3.21 0.02 0.00 0.00 0.00 0.00 23.12 19.93 1pvj s ALA 32 CO 0.00 -0.10 -0.11 0.50 0.00 0.00 0.00 175.76 176.04 1pvj s ARG 33 N -3.08 2.93 0.11 0.00 3.52 0.15 -4.71 118.95 117.86 1pvj s ARG 33 Ca 0.63 -0.90 0.04 0.00 -0.13 0.00 0.00 55.73 55.38 1pvj s ARG 33 Cb -0.14 -2.82 -0.04 0.00 -1.56 0.00 0.00 34.95 30.39 1pvj s ARG 33 CO 0.18 -0.31 0.07 -0.80 -0.81 0.00 0.00 175.30 173.63 1pvj s ASN 34 N 1.32 5.35 0.00 -2.12 0.01 -1.26 -4.51 114.94 113.72 1pvj s ASN 34 Ca 0.02 -0.11 0.00 0.00 -0.71 0.00 0.00 52.86 52.06 1pvj s ASN 34 Cb -0.15 -1.37 0.00 0.00 0.41 0.00 0.00 41.25 40.14 1pvj s ASN 34 CO -0.08 0.14 0.00 1.21 -1.51 0.00 0.00 177.10 176.87 1pvj n GLU 35 N 0.26 0.00 -0.34 -0.60 0.00 -1.26 0.14 120.64 118.84 1pvj n GLU 35 Ca -0.09 0.00 0.14 0.00 0.00 0.00 0.00 57.16 57.21 1pvj n GLU 35 Cb 0.53 0.00 0.29 0.00 0.00 0.00 0.00 31.44 32.25 1pvj n GLU 35 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.13 178.70 1pvj h LYS 36 N 0.00 0.02 0.06 5.31 -0.00 -1.98 0.21 116.57 120.20 1pvj h LYS 36 Ca 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 60.65 60.65 1pvj h LYS 36 Cb 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.23 1pvj h LYS 36 CO 0.00 0.01 -0.03 1.05 -0.00 0.00 0.00 179.45 180.48 1pvj h GLU 37 N 0.02 -0.08 -0.06 0.07 9.09 0.88 0.01 114.58 124.51 1pvj h GLU 37 Ca 0.59 0.01 0.03 0.00 0.05 0.00 0.00 59.36 60.04 1pvj h GLU 37 Cb 1.21 0.02 -0.04 0.00 -1.65 0.00 0.00 28.75 28.28 1pvj h GLU 37 CO -0.90 0.20 -0.20 0.00 0.05 0.00 0.00 179.01 178.16 1pvj h ALA 38 N 0.55 -0.20 -0.79 1.06 0.00 -0.35 0.48 119.26 120.00 1pvj h ALA 38 Ca -0.01 0.02 0.17 0.00 0.00 0.00 0.00 54.91 55.10 1pvj h ALA 38 Cb 0.32 0.36 -0.11 0.00 0.00 0.00 0.00 17.79 18.36 1pvj h ALA 38 CO 0.01 -0.68 0.27 -0.22 0.00 0.00 0.00 179.25 178.64 1pvj h LYS 39 N -0.29 0.34 -0.17 0.00 3.64 -0.62 0.28 116.57 119.74 1pvj h LYS 39 Ca 0.08 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1pvj h LYS 39 Cb 0.39 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1pvj h LYS 39 CO -0.22 0.22 0.02 0.22 -2.27 0.00 0.00 179.45 177.42 1pvj h ASP 40 N 0.35 0.27 -0.95 4.20 1.82 0.64 -2.51 116.42 120.24 1pvj h ASP 40 Ca 0.46 -0.28 0.19 0.00 -0.39 0.00 0.00 57.03 57.01 1pvj h ASP 40 Cb 0.80 -0.07 -0.08 0.00 0.68 0.00 0.00 39.33 40.65 1pvj h ASP 40 CO -0.50 0.48 0.60 0.28 -1.61 0.00 0.00 179.24 178.50 1pvj h SER 41 N 0.06 0.61 0.11 2.28 0.02 0.31 0.44 113.55 117.37 1pvj h SER 41 Ca 0.05 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 1pvj h SER 41 Cb 0.33 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.82 1pvj h SER 41 CO 0.00 0.25 -0.05 0.00 -1.14 0.00 0.00 176.83 175.89 1pvj h ALA 42 N 1.61 -1.02 -0.96 3.77 0.00 -0.27 -0.13 119.26 122.28 1pvj h ALA 42 Ca 0.51 -0.03 0.22 0.00 0.00 0.00 0.00 54.91 55.60 1pvj h ALA 42 Cb 0.97 0.08 -0.12 0.00 0.00 0.00 0.00 17.79 18.72 1pvj h ALA 42 CO -0.26 -1.01 0.52 0.82 0.00 0.00 0.00 179.25 179.33 1pvj h ILE 43 N -0.15 0.57 0.04 0.00 2.04 -1.04 0.33 117.51 119.30 1pvj h ILE 43 Ca -0.01 -0.20 0.01 0.00 1.00 0.00 0.00 64.86 65.66 1pvj h ILE 43 Cb 0.11 -0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.13 1pvj h ILE 43 CO 0.02 0.10 -0.07 0.74 0.00 0.00 0.00 178.15 178.94 1pvj h THR 44 N 0.57 0.83 -0.27 -0.27 2.02 -0.84 0.42 112.91 115.36 1pvj h THR 44 Ca 0.59 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.81 1pvj h THR 44 Cb 1.06 0.83 -0.04 0.00 -1.74 0.00 0.00 68.15 68.25 1pvj h THR 44 CO -0.46 0.00 0.01 0.15 0.37 0.00 0.00 175.52 175.59 1pvj h PHE 45 N -0.14 0.01 0.88 3.16 3.57 0.15 0.61 116.94 125.18 1pvj h PHE 45 Ca 0.02 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 1pvj h PHE 45 Cb 0.16 0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.94 1pvj h PHE 45 CO -0.12 -0.03 -0.49 0.82 -2.23 0.00 0.00 178.31 176.26 1pvj h ILE 46 N 0.10 0.02 -0.99 1.41 2.04 -0.44 -2.96 117.51 116.69 1pvj h ILE 46 Ca 0.13 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.09 1pvj h ILE 46 Cb 0.16 0.02 -0.08 0.00 -0.74 0.00 0.00 36.82 36.19 1pvj h ILE 46 CO -0.21 0.00 0.63 1.56 0.00 0.00 0.00 178.15 180.14 1pvj h GLN 47 N -1.26 1.01 0.00 2.37 4.20 0.05 -3.51 115.11 117.97 1pvj h GLN 47 Ca -0.12 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.53 1pvj h GLN 47 Cb 0.99 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 28.54 1pvj h GLN 47 CO 0.16 0.67 0.00 1.63 -0.67 0.00 0.00 178.83 180.61 1pvj n LYS 48 N -4.57 0.00 0.00 1.46 4.76 0.21 -5.07 118.16 114.95 1pvj n LYS 48 Ca 0.18 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.62 1pvj n LYS 48 Cb 0.30 -0.98 0.00 0.00 -1.84 0.00 0.00 35.03 32.51 1pvj n LYS 48 CO 0.00 0.00 0.00 0.44 -1.37 0.00 0.00 177.40 176.47 1pvj n ILE 62 N -0.28 0.00 -5.20 -0.18 -6.64 -1.26 -4.97 119.36 100.84 1pvj n ILE 62 Ca 0.00 0.00 -0.30 0.00 -1.77 0.00 0.00 62.75 60.68 1pvj n ILE 62 Cb 0.00 0.00 -0.16 0.00 -1.44 0.00 0.00 39.64 38.04 1pvj n ILE 62 CO 0.00 0.00 0.00 -0.75 -1.77 0.00 0.00 176.55 174.03 1pvj s LYS 63 N -4.88 2.22 -0.17 6.28 2.20 -1.26 -5.08 119.74 119.04 1pvj s LYS 63 Ca 0.00 -0.86 0.01 0.00 -0.36 0.00 0.00 55.97 54.76 1pvj s LYS 63 Cb 0.00 -1.98 0.02 0.00 -1.51 0.00 0.00 37.83 34.36 1pvj s LYS 63 CO 0.00 0.43 -0.18 -0.51 -0.36 0.00 0.00 175.35 174.73 1pvj s LEU 64 N -0.32 2.01 -0.21 5.43 1.43 -1.26 -1.51 118.68 124.26 1pvj s LEU 64 Ca 0.02 -0.62 -0.11 0.00 -1.03 0.00 0.00 54.13 52.39 1pvj s LEU 64 Cb -0.12 -1.37 -0.05 0.00 0.03 0.00 0.00 46.19 44.68 1pvj s LEU 64 CO 0.02 -0.03 0.18 -1.81 0.23 0.00 0.00 176.35 174.93 1pvj s ASP 65 N 1.36 6.22 0.40 2.29 -0.00 -0.19 -4.90 116.67 121.84 1pvj s ASP 65 Ca 0.04 0.24 -0.25 0.00 -0.00 0.00 0.00 52.55 52.59 1pvj s ASP 65 Cb -0.13 -2.11 -0.09 0.00 -0.00 0.00 0.00 42.92 40.59 1pvj s ASP 65 CO -0.12 0.12 1.10 -0.75 -0.00 0.00 0.00 175.17 175.52 1pvj s LYS 66 N 0.66 4.12 -0.04 8.23 2.20 -1.26 -0.06 119.74 133.59 1pvj s LYS 66 Ca 0.09 1.65 -0.08 0.00 -0.36 0.00 0.00 55.97 57.28 1pvj s LYS 66 Cb -0.12 -2.61 -0.05 0.00 -1.51 0.00 0.00 37.83 33.54 1pvj s LYS 66 CO 0.01 -0.21 0.25 0.08 -0.36 0.00 0.00 175.35 175.12 1pvj s VAL 67 N -1.54 5.32 -0.35 4.02 1.01 0.18 -4.85 120.40 124.19 1pvj s VAL 67 Ca 0.57 0.31 -0.10 0.00 0.00 0.00 0.00 61.98 62.76 1pvj s VAL 67 Cb -0.26 -3.54 0.02 0.00 0.00 0.00 0.00 36.38 32.60 1pvj s VAL 67 CO 0.32 0.50 0.18 0.54 0.00 0.00 0.00 175.10 176.64 1pvj s ASN 68 N -1.35 5.65 0.15 3.32 6.03 -1.26 -4.68 114.94 122.80 1pvj s ASN 68 Ca 0.22 -0.88 0.08 0.00 -1.03 0.00 0.00 52.86 51.25 1pvj s ASN 68 Cb -0.13 -2.00 -0.04 0.00 -3.03 0.00 0.00 41.25 36.04 1pvj s ASN 68 CO 0.11 -0.33 -0.10 -1.48 -2.03 0.00 0.00 177.10 173.27 1pvj s LEU 69 N 1.56 2.99 0.00 3.54 2.34 -1.26 -4.94 118.68 122.91 1pvj s LEU 69 Ca 0.02 -0.50 0.00 0.00 0.06 0.00 0.00 54.13 53.71 1pvj s LEU 69 Cb -0.19 -1.73 0.00 0.00 -0.56 0.00 0.00 46.19 43.72 1pvj s LEU 69 CO 0.06 0.13 0.00 0.61 -1.06 0.00 0.00 176.35 176.10 1pvj n GLY 70 N 0.32 2.08 0.00 -3.48 0.00 -1.26 -4.36 105.19 98.48 1pvj n GLY 70 Ca -0.12 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1pvj n GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pvj n GLY 71 N 4.66 0.00 0.28 -0.02 0.00 -1.26 0.43 105.19 109.28 1pvj n GLY 71 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1pvj n GLY 71 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1pvj h GLU 72 N 0.00 0.58 -0.87 1.61 -0.00 -1.99 -2.36 114.58 111.54 1pvj h GLU 72 Ca 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 59.36 59.26 1pvj h GLU 72 Cb 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 28.75 28.65 1pvj h GLU 72 CO 0.00 0.54 0.00 1.28 -0.00 0.00 0.00 179.01 180.83 1pvj n LEU 73 N -4.32 0.87 -4.88 3.06 4.77 0.84 -4.82 117.00 112.51 1pvj n LEU 73 Ca 0.02 -0.44 -0.29 0.00 -0.03 0.00 0.00 56.01 55.28 1pvj n LEU 73 Cb 0.20 -0.44 0.10 0.00 -2.33 0.00 0.00 43.42 40.96 1pvj n LEU 73 CO 0.38 0.22 0.78 -0.94 -1.33 0.00 0.00 177.39 176.50 1pvj s SER 74 N -0.13 4.23 0.00 -1.43 1.04 0.17 -4.53 113.70 113.05 1pvj s SER 74 Ca 0.00 0.77 0.00 0.00 0.48 0.00 0.00 55.95 57.20 1pvj s SER 74 Cb 0.00 -1.24 0.00 0.00 0.10 0.00 0.00 66.02 64.88 1pvj s SER 74 CO 0.00 -2.08 0.00 0.61 0.98 0.00 0.00 173.24 172.75 1pvj n GLY 75 N -3.17 -1.80 2.07 7.32 0.00 -1.26 -4.73 105.19 103.61 1pvj n GLY 75 Ca 0.08 -1.79 -0.03 0.00 0.00 0.00 0.00 46.02 44.29 1pvj n GLY 75 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1pvj n SER 76 N 0.22 2.05 0.17 1.61 3.41 -1.26 -4.75 113.62 115.06 1pvj n SER 76 Ca 0.00 -2.55 0.13 0.00 -0.26 0.00 0.00 58.87 56.19 1pvj n SER 76 Cb 0.00 -0.41 0.41 0.00 -0.26 0.00 0.00 64.21 63.94 1pvj n SER 76 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1pvj h ASN 77 N 1.91 0.00 -5.04 4.04 2.35 -1.89 -3.39 115.58 113.56 1pvj h ASN 77 Ca -0.05 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.60 1pvj h ASN 77 Cb 1.46 0.00 -0.17 0.00 0.05 0.00 0.00 38.32 39.65 1pvj h ASN 77 CO 0.24 0.00 -0.27 -0.32 -1.65 0.00 0.00 177.43 175.44 1pvj s MET 78 N -3.27 0.77 0.04 0.81 0.00 -1.26 -0.02 119.30 116.37 1pvj s MET 78 Ca 0.07 -0.46 0.03 0.00 0.00 0.00 0.00 55.69 55.33 1pvj s MET 78 Cb 0.09 0.33 -0.02 0.00 0.00 0.00 0.00 34.83 35.24 1pvj s MET 78 CO 0.57 -0.24 -0.10 0.71 0.00 0.00 0.00 175.02 175.96 1pvj s TYR 79 N -2.32 0.85 -0.08 4.11 1.51 0.51 -4.83 117.35 117.10 1pvj s TYR 79 Ca -0.07 -0.38 0.02 0.00 -1.01 0.00 0.00 57.07 55.63 1pvj s TYR 79 Cb -0.02 -0.51 0.02 0.00 -0.11 0.00 0.00 41.96 41.34 1pvj s TYR 79 CO -0.02 -0.02 -0.11 0.08 -1.11 0.00 0.00 175.55 174.37 1pvj s VAL 80 N -0.98 1.09 -0.12 0.71 1.01 -1.26 0.74 120.40 121.59 1pvj s VAL 80 Ca -0.04 -0.42 -0.00 0.00 0.00 0.00 0.00 61.98 61.53 1pvj s VAL 80 Cb -0.08 -1.02 0.02 0.00 0.00 0.00 0.00 36.38 35.30 1pvj s VAL 80 CO 0.01 0.35 -0.10 -0.31 0.00 0.00 0.00 175.10 175.05 1pvj s TYR 81 N 0.94 1.68 -0.16 5.22 1.51 -0.81 0.48 117.35 126.21 1pvj s TYR 81 Ca -0.09 -0.86 -0.24 0.00 -1.01 0.00 0.00 57.07 54.86 1pvj s TYR 81 Cb -0.15 -1.33 -0.02 0.00 -0.11 0.00 0.00 41.96 40.36 1pvj s TYR 81 CO 0.00 -0.54 0.79 -0.80 -1.11 0.00 0.00 175.55 173.89 1pvj s ASN 82 N 1.57 6.92 0.06 2.29 0.01 0.92 -1.85 114.94 124.87 1pvj s ASN 82 Ca 0.04 1.13 -0.30 0.00 -0.71 0.00 0.00 52.86 53.01 1pvj s ASN 82 Cb -0.13 -2.43 -0.05 0.00 0.41 0.00 0.00 41.25 39.04 1pvj s ASN 82 CO -0.08 -0.35 1.14 -0.63 -1.51 0.00 0.00 177.10 175.67 1pvj s ILE 83 N 1.96 4.19 0.30 0.60 1.01 0.25 -1.03 121.20 128.48 1pvj s ILE 83 Ca 0.37 1.61 0.03 0.00 0.00 0.00 0.00 60.65 62.66 1pvj s ILE 83 Cb -0.17 -4.03 0.09 0.00 0.01 0.00 0.00 42.46 38.37 1pvj s ILE 83 CO 0.13 0.15 1.77 0.77 0.00 0.00 0.00 174.94 177.75 1pvj h SER 84 N 6.57 0.48 1.37 3.58 4.64 -1.54 -1.98 113.55 126.65 1pvj h SER 84 Ca -0.42 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 1pvj h SER 84 Cb 1.22 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1pvj h SER 84 CO 0.79 0.67 0.00 0.71 -0.87 0.00 0.00 176.83 178.13 1pvj h THR 85 N 0.44 0.00 0.00 2.95 1.35 -1.93 -3.48 112.91 112.25 1pvj h THR 85 Ca 0.07 -0.50 0.00 0.00 -0.55 0.00 0.00 66.41 65.43 1pvj h THR 85 Cb 0.57 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 68.43 1pvj h THR 85 CO 0.04 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.92 1pvj n GLY 86 N 0.93 4.80 0.00 5.82 0.00 -0.75 -5.00 105.19 111.00 1pvj n GLY 86 Ca 0.04 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1pvj n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pvj n GLY 87 N -1.84 0.78 3.47 -0.02 0.00 0.44 -4.50 105.19 103.53 1pvj n GLY 87 Ca 0.00 -2.03 -0.11 0.00 0.00 0.00 0.00 46.02 43.88 1pvj n GLY 87 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1pvj s PHE 88 N -1.53 -0.46 -0.04 1.61 -0.12 0.13 0.84 117.98 118.42 1pvj s PHE 88 Ca 0.00 0.21 -0.01 0.00 -0.05 0.00 0.00 56.93 57.08 1pvj s PHE 88 Cb 0.00 0.56 0.03 0.00 -0.63 0.00 0.00 43.02 42.97 1pvj s PHE 88 CO 0.00 -0.89 0.07 0.08 -0.05 0.00 0.00 175.22 174.43 1pvj s VAL 89 N -3.78 -0.05 -0.22 -2.49 1.01 -0.77 -1.03 120.40 113.07 1pvj s VAL 89 Ca 0.03 0.17 -0.05 0.00 0.00 0.00 0.00 61.98 62.13 1pvj s VAL 89 Cb -0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 36.38 36.21 1pvj s VAL 89 CO -0.10 0.07 -0.00 -0.63 0.00 0.00 0.00 175.10 174.43 1pvj s ILE 90 N 0.93 3.74 -0.09 2.22 1.01 0.24 -1.93 121.20 127.32 1pvj s ILE 90 Ca -0.08 -0.37 -0.01 0.00 0.00 0.00 0.00 60.65 60.19 1pvj s ILE 90 Cb -0.10 -2.72 -0.03 0.00 0.01 0.00 0.00 42.46 39.62 1pvj s ILE 90 CO -0.03 0.40 -0.03 -0.69 0.00 0.00 0.00 174.94 174.58 1pvj s VAL 91 N 1.41 4.00 0.47 2.92 1.01 0.23 -1.62 120.40 128.83 1pvj s VAL 91 Ca 0.05 -0.36 -0.21 0.00 0.00 0.00 0.00 61.98 61.46 1pvj s VAL 91 Cb -0.15 -2.68 -0.08 0.00 0.00 0.00 0.00 36.38 33.48 1pvj s VAL 91 CO -0.00 0.58 1.07 -0.94 0.00 0.00 0.00 175.10 175.81 1pvj s SER 92 N -0.62 6.29 -0.06 3.32 1.04 -0.82 0.19 113.70 123.04 1pvj s SER 92 Ca 0.10 2.04 0.17 0.00 0.48 0.00 0.00 55.95 58.74 1pvj s SER 92 Cb -0.12 -2.57 0.56 0.00 0.10 0.00 0.00 66.02 63.99 1pvj s SER 92 CO 0.02 -0.82 1.48 0.61 0.98 0.00 0.00 173.24 175.51 1pvj n GLY 93 N 0.04 2.86 3.14 7.32 0.00 0.97 -4.73 105.19 114.79 1pvj n GLY 93 Ca 0.09 -0.72 -0.09 0.00 0.00 0.00 0.00 46.02 45.29 1pvj n GLY 93 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1pvj s ASP 94 N -1.08 -0.04 0.52 1.61 -1.08 -1.26 0.31 116.67 115.65 1pvj s ASP 94 Ca 0.41 0.73 0.18 0.00 -0.52 0.00 0.00 52.55 53.36 1pvj s ASP 94 Cb 0.25 1.20 0.99 0.00 -1.46 0.00 0.00 42.92 43.90 1pvj s ASP 94 CO 0.22 -0.25 1.50 0.11 0.52 0.00 0.00 175.17 177.27 1pvj h LYS 95 N 8.19 0.00 0.00 4.34 1.57 -0.56 0.96 116.57 131.07 1pvj h LYS 95 Ca -0.16 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.47 1pvj h LYS 95 Cb 1.12 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.41 1pvj h LYS 95 CO 0.16 0.00 -0.67 0.00 -0.57 0.00 0.00 179.45 178.37 1pvj h ARG 96 N 0.00 0.00 -7.03 3.15 3.08 -1.83 -2.12 114.38 109.63 1pvj h ARG 96 Ca 0.00 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 59.58 1pvj h ARG 96 Cb 0.86 0.00 0.05 0.00 0.08 0.00 0.00 29.97 30.96 1pvj h ARG 96 CO 0.00 0.67 0.12 -1.12 -1.07 0.00 0.00 179.97 178.57 1pvj s SER 97 N -6.78 5.61 0.62 7.04 0.01 0.33 -3.81 113.70 116.71 1pvj s SER 97 Ca -0.01 0.59 -0.17 0.00 1.31 0.00 0.00 55.95 57.67 1pvj s SER 97 Cb 0.12 -1.62 -0.02 0.00 0.21 0.00 0.00 66.02 64.70 1pvj s SER 97 CO 0.77 -1.01 1.16 -2.16 0.41 0.00 0.00 173.24 172.41 1pvj s PRO 98 N -4.90 2.92 0.00 12.44 0.04 -1.26 -4.60 135.00 139.65 1pvj s PRO 98 Ca 0.53 1.63 -0.21 0.00 0.04 0.00 0.00 61.00 62.99 1pvj s PRO 98 Cb -0.10 -1.94 -0.12 0.00 0.04 0.00 0.00 34.50 32.38 1pvj s PRO 98 CO 0.43 -1.20 0.97 1.49 0.04 0.00 0.00 177.00 178.74 1pvj h GLU 99 N 0.57 -0.73 -4.50 4.56 4.81 -1.91 -3.39 114.58 113.99 1pvj h GLU 99 Ca -0.49 0.05 -0.72 0.00 -0.13 0.00 0.00 59.36 58.07 1pvj h GLU 99 Cb 1.27 0.17 -0.21 0.00 0.63 0.00 0.00 28.75 30.61 1pvj h GLU 99 CO 0.55 -0.49 -0.43 0.42 -0.73 0.00 0.00 179.01 178.32 1pvj s ILE 100 N -4.13 5.23 -0.03 2.32 -1.09 -1.26 -1.94 121.20 120.30 1pvj s ILE 100 Ca -0.11 -0.67 0.12 0.00 -2.23 0.00 0.00 60.65 57.76 1pvj s ILE 100 Cb 0.01 -3.91 -0.14 0.00 -1.58 0.00 0.00 42.46 36.84 1pvj s ILE 100 CO 0.33 -0.31 1.09 -0.07 -1.23 0.00 0.00 174.94 174.75 1pvj h LEU 101 N 8.62 0.00 -7.00 2.97 3.38 -1.56 -3.47 115.31 118.25 1pvj h LEU 101 Ca -0.27 0.00 0.20 0.00 0.09 0.00 0.00 57.88 57.90 1pvj h LEU 101 Cb 1.12 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.65 1pvj h LEU 101 CO 0.73 0.81 0.76 -0.83 0.09 0.00 0.00 178.44 180.00 1pvj s GLY 102 N -4.76 -0.19 0.18 0.83 0.00 -1.21 -1.63 107.32 100.53 1pvj s GLY 102 Ca -0.00 2.02 -0.24 0.00 0.00 0.00 0.00 44.72 46.50 1pvj s GLY 102 CO 0.80 0.81 0.78 -2.52 0.00 0.00 0.00 173.10 172.97 1pvj s TYR 103 N -1.74 -0.28 -0.27 1.90 -0.85 -0.07 0.79 117.35 116.82 1pvj s TYR 103 Ca 0.06 -0.03 -0.13 0.00 -0.52 0.00 0.00 57.07 56.45 1pvj s TYR 103 Cb -0.01 0.63 0.10 0.00 0.38 0.00 0.00 41.96 43.06 1pvj s TYR 103 CO -0.04 -0.94 0.64 0.45 -1.52 0.00 0.00 175.55 174.14 1pvj s SER 104 N -2.82 -0.95 0.39 -0.18 0.15 -0.20 -0.80 113.70 109.29 1pvj s SER 104 Ca 0.08 1.47 0.07 0.00 0.70 0.00 0.00 55.95 58.27 1pvj s SER 104 Cb -0.03 1.66 0.81 0.00 -1.71 0.00 0.00 66.02 66.75 1pvj s SER 104 CO -0.01 -0.23 2.00 0.71 1.20 0.00 0.00 173.24 176.91 1pvj h THR 105 N 5.44 1.04 -5.04 6.45 1.35 -1.90 0.41 112.91 120.66 1pvj h THR 105 Ca -0.26 -0.22 -0.62 0.00 -0.55 0.00 0.00 66.41 64.76 1pvj h THR 105 Cb 1.18 0.33 -0.13 0.00 -1.73 0.00 0.00 68.15 67.80 1pvj h THR 105 CO 0.15 0.12 -0.49 -1.54 -0.25 0.00 0.00 175.52 173.51 1pvj n SER 106 N -4.47 2.11 0.00 5.36 3.41 -1.26 -3.04 113.62 115.73 1pvj n SER 106 Ca 0.08 -3.28 0.00 0.00 -0.26 0.00 0.00 58.87 55.41 1pvj n SER 106 Cb 0.18 0.80 0.00 0.00 -0.26 0.00 0.00 64.21 64.93 1pvj n SER 106 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pvj n GLY 107 N -1.07 0.41 3.71 5.00 0.00 -1.26 -3.81 105.19 108.18 1pvj n GLY 107 Ca -0.12 -0.89 -0.06 0.00 0.00 0.00 0.00 46.02 44.94 1pvj n GLY 107 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pvj s SER 108 N -4.00 -0.28 -0.02 1.61 1.04 -1.26 -0.42 113.70 110.37 1pvj s SER 108 Ca 0.00 -0.37 0.02 0.00 0.48 0.00 0.00 55.95 56.08 1pvj s SER 108 Cb 0.00 0.57 -0.03 0.00 0.10 0.00 0.00 66.02 66.66 1pvj s SER 108 CO 0.00 -1.02 -0.05 0.12 0.98 0.00 0.00 173.24 173.27 1pvj s PHE 109 N -3.53 2.95 -0.23 5.02 5.36 -1.26 -0.39 117.98 125.90 1pvj s PHE 109 Ca 0.09 0.01 -0.26 0.00 -0.96 0.00 0.00 56.93 55.81 1pvj s PHE 109 Cb -0.03 -1.65 0.10 0.00 -0.34 0.00 0.00 43.02 41.10 1pvj s PHE 109 CO 0.00 0.39 0.90 0.34 -1.46 0.00 0.00 175.22 175.39 1pvj s ASP 110 N -1.27 -0.54 -0.00 6.13 -1.08 -1.26 -4.88 116.67 113.76 1pvj s ASP 110 Ca 0.16 0.94 0.01 0.00 -0.52 0.00 0.00 52.55 53.14 1pvj s ASP 110 Cb -0.11 0.91 -0.01 0.00 -1.46 0.00 0.00 42.92 42.25 1pvj s ASP 110 CO 0.06 -0.26 0.02 0.00 0.52 0.00 0.00 175.17 175.51 1pvj n ALA 111 N 1.97 2.03 -1.30 3.66 0.00 -1.26 -4.69 120.51 120.91 1pvj n ALA 111 Ca -0.13 -0.02 -0.59 0.00 0.00 0.00 0.00 53.44 52.71 1pvj n ALA 111 Cb 0.56 -0.02 -0.11 0.00 0.00 0.00 0.00 19.45 19.88 1pvj n ALA 111 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1pvj n ASN 112 N -1.43 1.02 0.00 0.00 3.02 -1.26 0.75 115.26 117.36 1pvj n ASN 112 Ca -0.00 0.66 0.00 0.00 -0.03 0.00 0.00 54.58 55.20 1pvj n ASN 112 Cb 0.01 -0.96 0.00 0.00 -0.61 0.00 0.00 39.78 38.22 1pvj n ASN 112 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pvj n GLY 113 N 7.19 3.07 3.43 7.41 0.00 -1.26 -4.92 105.19 120.11 1pvj n GLY 113 Ca 0.52 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 46.09 1pvj n GLY 113 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pvj s LYS 114 N -0.18 3.96 0.13 1.61 1.02 0.23 -4.89 119.74 121.62 1pvj s LYS 114 Ca 0.00 -2.48 -0.20 0.00 0.02 0.00 0.00 55.97 53.31 1pvj s LYS 114 Cb 0.00 -4.91 -0.02 0.00 -0.52 0.00 0.00 37.83 32.38 1pvj s LYS 114 CO 0.00 -1.66 1.70 1.49 -0.92 0.00 0.00 175.35 175.96 1pvj h GLU 115 N 7.51 -0.02 -1.03 1.68 4.57 -1.92 -2.06 114.58 123.32 1pvj h GLU 115 Ca 0.25 0.00 0.26 0.00 -1.18 0.00 0.00 59.36 58.69 1pvj h GLU 115 Cb 0.92 0.01 -0.08 0.00 -0.16 0.00 0.00 28.75 29.43 1pvj h GLU 115 CO 1.15 -0.02 0.67 -2.95 -1.18 0.00 0.00 179.01 176.68 1pvj h ASN 116 N -0.03 0.39 0.46 1.04 -1.07 -1.90 0.85 115.58 115.33 1pvj h ASN 116 Ca 0.10 0.07 -0.23 0.00 0.07 0.00 0.00 56.30 56.31 1pvj h ASN 116 Cb 0.18 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.43 1pvj h ASN 116 CO -0.22 0.09 -0.97 0.40 0.07 0.00 0.00 177.43 176.80 1pvj h ILE 117 N 0.35 1.45 0.07 6.14 2.04 -1.75 -2.94 117.51 122.86 1pvj h ILE 117 Ca 0.57 -2.61 -0.26 0.00 1.00 0.00 0.00 64.86 63.56 1pvj h ILE 117 Cb 1.52 2.52 0.01 0.00 -0.74 0.00 0.00 36.82 40.14 1pvj h ILE 117 CO -0.24 0.77 -1.11 0.00 0.00 0.00 0.00 178.15 177.57 1pvj h ALA 118 N 0.78 0.18 -0.12 1.87 0.00 -0.31 -2.72 119.26 118.94 1pvj h ALA 118 Ca -0.08 -0.77 -0.00 0.00 0.00 0.00 0.00 54.91 54.06 1pvj h ALA 118 Cb 1.62 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.44 1pvj h ALA 118 CO 0.16 0.80 0.06 1.03 0.00 0.00 0.00 179.25 181.31 1pvj h SER 119 N 0.22 0.14 0.28 0.00 0.87 0.63 -0.86 113.55 114.83 1pvj h SER 119 Ca -0.13 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.41 1pvj h SER 119 Cb 1.77 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.70 1pvj h SER 119 CO 0.20 0.12 -0.14 0.15 -0.53 0.00 0.00 176.83 176.63 1pvj h PHE 120 N 0.17 -0.35 -1.23 2.24 3.57 -1.48 -3.08 116.94 116.77 1pvj h PHE 120 Ca 0.04 -0.01 0.36 0.00 3.53 0.00 0.00 57.97 61.90 1pvj h PHE 120 Cb 0.01 0.12 -0.10 0.00 2.79 0.00 0.00 35.95 38.77 1pvj h PHE 120 CO 0.00 -0.22 0.81 0.52 -2.23 0.00 0.00 178.31 177.19 1pvj h MET 121 N -1.03 0.18 -0.15 1.11 2.86 -1.31 0.16 114.93 116.75 1pvj h MET 121 Ca -0.04 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1pvj h MET 121 Cb 0.29 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 1pvj h MET 121 CO 0.06 0.12 0.09 0.93 1.06 0.00 0.00 176.91 179.18 1pvj h GLU 122 N 0.19 0.20 0.27 1.72 5.08 -1.15 -1.63 114.58 119.26 1pvj h GLU 122 Ca 0.71 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 59.04 1pvj h GLU 122 Cb 2.18 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 31.38 1pvj h GLU 122 CO -0.30 0.17 -0.18 0.66 -1.00 0.00 0.00 179.01 178.36 1pvj h SER 123 N 0.18 -0.46 -0.96 1.42 4.64 -0.60 0.25 113.55 118.01 1pvj h SER 123 Ca 0.05 0.03 0.28 0.00 -0.47 0.00 0.00 61.79 61.68 1pvj h SER 123 Cb 0.02 0.14 -0.18 0.00 -0.31 0.00 0.00 62.40 62.07 1pvj h SER 123 CO -0.01 -0.29 0.06 -1.22 -0.87 0.00 0.00 176.83 174.50 1pvj n TYR 124 N -5.31 0.66 0.18 4.77 0.53 -0.93 -1.80 117.16 115.25 1pvj n TYR 124 Ca -0.09 1.16 -0.08 0.00 -1.02 0.00 0.00 57.90 57.87 1pvj n TYR 124 Cb 0.22 -1.25 -0.04 0.00 -1.03 0.00 0.00 39.34 37.24 1pvj n TYR 124 CO 0.00 0.00 0.00 0.28 -1.02 0.00 0.00 176.86 176.12 1pvj h VAL 125 N 0.00 0.00 0.00 -0.72 2.07 -0.48 -0.48 116.25 116.64 1pvj h VAL 125 Ca 0.60 -0.34 -0.64 0.00 0.82 0.00 0.00 66.70 67.15 1pvj h VAL 125 Cb 1.28 0.00 0.02 0.00 -1.52 0.00 0.00 31.29 31.07 1pvj h VAL 125 CO -0.89 0.00 2.71 -1.84 0.02 0.00 0.00 177.57 177.57 1pvj n GLU 126 N -4.25 2.15 0.00 1.57 0.28 -0.00 -0.64 120.64 119.74 1pvj n GLU 126 Ca -0.06 -2.05 0.00 0.00 -0.16 0.00 0.00 57.16 54.89 1pvj n GLU 126 Cb 0.19 -2.96 0.00 0.00 1.43 0.00 0.00 31.44 30.10 1pvj n GLU 126 CO 0.00 0.00 0.00 0.94 -0.16 0.00 0.00 177.13 177.91 1pvj n GLN 127 N 6.11 0.00 0.22 3.44 7.27 -1.06 -4.77 117.38 128.59 1pvj n GLN 127 Ca 0.52 0.00 0.08 0.00 0.07 0.00 0.00 57.00 57.67 1pvj n GLN 127 Cb 0.35 0.00 0.47 0.00 2.41 0.00 0.00 30.24 33.47 1pvj n GLN 127 CO 0.00 0.00 0.00 0.82 0.07 0.00 0.00 177.06 177.95 1pvj h ILE 128 N 0.00 0.76 -0.10 1.69 2.04 0.86 -1.79 117.51 120.97 1pvj h ILE 128 Ca 0.00 -1.13 -0.15 0.00 1.00 0.00 0.00 64.86 64.57 1pvj h ILE 128 Cb 0.00 1.71 0.01 0.00 -0.74 0.00 0.00 36.82 37.79 1pvj h ILE 128 CO 0.00 0.26 -0.53 0.11 0.00 0.00 0.00 178.15 177.99 1pvj h LYS 129 N 0.00 0.54 0.00 2.37 1.57 -1.65 -2.97 116.57 116.44 1pvj h LYS 129 Ca -0.00 -0.45 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1pvj h LYS 129 Cb 0.69 0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.09 1pvj h LYS 129 CO 0.04 1.07 0.00 0.93 -0.57 0.00 0.00 179.45 180.92 1pvj h GLU 130 N 0.15 0.00 0.00 3.15 5.08 -1.60 -0.79 114.58 120.57 1pvj h GLU 130 Ca -0.04 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1pvj h GLU 130 Cb 1.18 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 1pvj h GLU 130 CO 0.11 0.00 -0.39 -0.91 -1.00 0.00 0.00 179.01 176.82 1pvj h ASN 131 N 0.00 0.00 0.19 1.42 2.35 -1.29 -3.20 115.58 115.05 1pvj h ASN 131 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1pvj h ASN 131 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 1pvj h ASN 131 CO 0.00 0.03 0.00 0.29 -1.65 0.00 0.00 177.43 176.10 1pvj n LYS 132 N -2.96 0.09 0.25 0.81 5.02 -0.30 -1.27 118.16 119.80 1pvj n LYS 132 Ca 0.02 0.25 0.16 0.00 -2.02 0.00 0.00 58.31 56.72 1pvj n LYS 132 Cb 0.55 -1.50 0.56 0.00 -0.02 0.00 0.00 35.03 34.63 1pvj n LYS 132 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1pvj h LYS 133 N 0.00 0.00 0.00 1.97 1.79 -1.69 -3.45 116.57 115.20 1pvj h LYS 133 Ca 0.00 0.00 -0.47 0.00 -2.18 0.00 0.00 60.65 58.00 1pvj h LYS 133 Cb 0.10 0.00 0.09 0.00 -1.58 0.00 0.00 32.23 30.84 1pvj h LYS 133 CO 0.00 0.00 0.13 1.28 -1.08 0.00 0.00 179.45 179.78 1pvj n LEU 134 N -3.03 0.00 0.00 2.94 7.99 -0.40 -5.04 117.00 119.46 1pvj n LEU 134 Ca 0.01 -2.15 0.00 0.00 -0.01 0.00 0.00 56.01 53.86 1pvj n LEU 134 Cb 0.35 -0.67 0.00 0.00 -0.11 0.00 0.00 43.42 42.99 1pvj n LEU 134 CO 0.28 -1.01 0.10 -0.90 -1.51 0.00 0.00 177.39 174.35 1pvj n ASP 135 N -2.93 0.29 -4.96 -1.43 5.75 -1.26 -5.07 116.55 106.95 1pvj n ASP 135 Ca 0.17 -1.03 -0.22 0.00 -0.01 0.00 0.00 54.79 53.69 1pvj n ASP 135 Cb 0.61 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.69 1pvj n ASP 135 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1pvj s THR 136 N -0.03 4.67 0.60 2.12 -4.23 -1.26 -5.10 115.64 112.39 1pvj s THR 136 Ca 0.00 -0.66 -0.02 0.00 -1.18 0.00 0.00 61.69 59.84 1pvj s THR 136 Cb 0.00 -3.68 0.04 0.00 1.34 0.00 0.00 72.50 70.20 1pvj s THR 136 CO 0.00 -0.39 0.85 -0.89 -0.54 0.00 0.00 174.62 173.65 1pvj s THR 137 N -2.29 2.64 0.29 3.99 2.01 -1.26 -4.66 115.64 116.36 1pvj s THR 137 Ca 0.42 -0.50 -0.29 0.00 0.31 0.00 0.00 61.69 61.62 1pvj s THR 137 Cb -0.10 -3.04 -0.10 0.00 0.01 0.00 0.00 72.50 69.27 1pvj s THR 137 CO 0.34 -0.03 1.32 -0.47 -0.69 0.00 0.00 174.62 175.09 1pvj s TYR 138 N -2.92 3.12 0.00 4.92 5.04 -0.80 -4.95 117.35 121.76 1pvj s TYR 138 Ca 0.58 1.33 0.00 0.00 -2.44 0.00 0.00 57.07 56.53 1pvj s TYR 138 Cb -0.10 -3.66 0.00 0.00 0.35 0.00 0.00 41.96 38.54 1pvj s TYR 138 CO 0.41 -1.92 0.00 0.00 -1.34 0.00 0.00 175.55 172.70 1pvj n ALA 139 N 1.47 0.00 0.00 3.97 0.00 -1.26 -5.06 120.51 119.63 1pvj n ALA 139 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1pvj n ALA 139 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 1pvj n ALA 139 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1pvj n GLN 146 N 0.00 0.00 -2.55 0.00 7.27 -1.26 -5.16 117.38 115.68 1pvj n GLN 146 Ca 0.00 0.00 -0.20 0.00 0.07 0.00 0.00 57.00 56.87 1pvj n GLN 146 Cb 0.00 0.00 0.10 0.00 2.41 0.00 0.00 30.24 32.75 1pvj n GLN 146 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 1pvj n PRO 147 N 0.87 0.15 -4.81 3.69 -0.04 -1.26 -4.67 135.00 128.93 1pvj n PRO 147 Ca 0.00 -2.64 -0.33 0.00 -0.04 0.00 0.00 63.50 60.50 1pvj n PRO 147 Cb 0.00 -0.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.82 1pvj n PRO 147 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1pvj s VAL 148 N -2.69 3.02 -0.11 0.52 1.01 -1.26 -3.30 120.40 117.59 1pvj s VAL 148 Ca 0.60 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.91 1pvj s VAL 148 Cb -0.04 -2.25 0.02 0.00 0.00 0.00 0.00 36.38 34.11 1pvj s VAL 148 CO 0.39 0.54 -0.14 -0.69 0.00 0.00 0.00 175.10 175.20 1pvj s VAL 149 N 0.18 1.45 0.21 2.92 1.01 -0.59 -4.94 120.40 120.64 1pvj s VAL 149 Ca -0.08 -0.60 -0.30 0.00 0.00 0.00 0.00 61.98 61.00 1pvj s VAL 149 Cb -0.15 -1.34 -0.08 0.00 0.00 0.00 0.00 36.38 34.80 1pvj s VAL 149 CO 0.05 0.43 1.00 -0.54 0.00 0.00 0.00 175.10 176.04 1pvj s LYS 150 N 1.11 4.75 -0.29 2.72 -0.14 -1.26 -0.70 119.74 125.92 1pvj s LYS 150 Ca -0.04 1.57 -0.26 0.00 -1.36 0.00 0.00 55.97 55.88 1pvj s LYS 150 Cb -0.14 -3.28 -0.11 0.00 -1.68 0.00 0.00 37.83 32.61 1pvj s LYS 150 CO -0.03 0.34 1.13 0.45 -0.76 0.00 0.00 175.35 176.48 1pvj n SER 151 N 1.85 0.52 -0.16 2.83 2.88 -1.26 -4.72 113.62 115.55 1pvj n SER 151 Ca -0.00 0.48 -0.09 0.00 -1.33 0.00 0.00 58.87 57.93 1pvj n SER 151 Cb 0.47 -0.51 0.00 0.00 -0.75 0.00 0.00 64.21 63.42 1pvj n SER 151 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1pvj h LEU 152 N 4.45 0.69 -0.32 2.46 3.38 -0.79 -1.95 115.31 123.23 1pvj h LEU 152 Ca -0.12 -0.21 -0.18 0.00 0.09 0.00 0.00 57.88 57.46 1pvj h LEU 152 Cb 0.81 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.38 1pvj h LEU 152 CO 0.61 0.71 -0.53 -0.07 0.09 0.00 0.00 178.44 179.25 1pvj h LEU 153 N 0.63 0.97 -1.32 1.67 4.07 -1.86 -3.00 115.31 116.48 1pvj h LEU 153 Ca 0.15 -0.51 -0.01 0.00 0.08 0.00 0.00 57.88 57.59 1pvj h LEU 153 Cb 0.27 -0.28 -0.03 0.00 1.08 0.00 0.00 40.66 41.71 1pvj h LEU 153 CO -0.00 1.31 0.32 0.44 -1.08 0.00 0.00 178.44 179.42 1pvj h ASP 154 N 0.68 0.69 0.21 -0.43 3.32 -1.79 -0.09 116.42 119.01 1pvj h ASP 154 Ca 0.02 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.02 1pvj h ASP 154 Cb 1.14 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.51 1pvj h ASP 154 CO 0.12 0.56 0.00 0.77 -1.72 0.00 0.00 179.24 178.97 1pvj h SER 155 N 0.79 0.00 -0.02 6.45 4.64 -1.20 -0.82 113.55 123.39 1pvj h SER 155 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1pvj h SER 155 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1pvj h SER 155 CO -0.03 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.22 1pvj n LYS 156 N -2.47 2.34 -3.82 4.77 5.02 -0.13 -4.99 118.16 118.88 1pvj n LYS 156 Ca -0.01 -1.96 -0.27 0.00 -2.02 0.00 0.00 58.31 54.04 1pvj n LYS 156 Cb 0.10 -1.22 0.04 0.00 -0.02 0.00 0.00 35.03 33.92 1pvj n LYS 156 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1pvj n GLY 157 N -0.82 -0.46 3.60 0.72 0.00 -0.31 -4.82 105.19 103.10 1pvj n GLY 157 Ca 0.07 0.19 -0.39 0.00 0.00 0.00 0.00 46.02 45.89 1pvj n GLY 157 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pvj s ILE 158 N -3.38 5.18 -0.39 -0.61 1.01 -0.69 -4.08 121.20 118.25 1pvj s ILE 158 Ca 0.51 0.54 0.04 0.00 0.00 0.00 0.00 60.65 61.74 1pvj s ILE 158 Cb -0.25 -3.69 0.16 0.00 0.01 0.00 0.00 42.46 38.69 1pvj s ILE 158 CO 0.81 0.16 0.42 -1.00 0.00 0.00 0.00 174.94 175.33 1pvj s HIS 159 N 2.05 -0.42 0.54 3.97 3.76 -0.44 -4.59 115.29 120.15 1pvj s HIS 159 Ca 0.14 -0.80 -0.00 0.00 -0.15 0.00 0.00 55.06 54.25 1pvj s HIS 159 Cb -0.16 -0.33 0.02 0.00 1.11 0.00 0.00 32.58 33.22 1pvj s HIS 159 CO 0.10 -1.00 0.78 0.71 -0.85 0.00 0.00 174.74 174.48 1pvj s TYR 160 N 1.35 3.00 0.00 1.40 4.12 -1.26 -4.49 117.35 121.47 1pvj s TYR 160 Ca 0.18 0.15 0.00 0.00 0.02 0.00 0.00 57.07 57.43 1pvj s TYR 160 Cb -0.13 -2.66 0.00 0.00 -1.52 0.00 0.00 41.96 37.65 1pvj s TYR 160 CO -0.04 -0.77 0.00 -1.71 0.02 0.00 0.00 175.55 173.06 1pvj n ASN 161 N -2.34 0.70 0.00 2.29 2.85 -1.26 -1.63 115.26 115.87 1pvj n ASN 161 Ca 0.06 -0.51 0.00 0.00 -0.11 0.00 0.00 54.58 54.01 1pvj n ASN 161 Cb 0.59 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.61 1pvj n ASN 161 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1pvj n GLN 162 N 0.00 -0.59 0.00 1.20 6.02 -1.26 -4.83 117.38 117.92 1pvj n GLN 162 Ca 0.00 -0.59 0.00 0.00 -0.01 0.00 0.00 57.00 56.40 1pvj n GLN 162 Cb 0.00 -0.99 0.00 0.00 1.02 0.00 0.00 30.24 30.27 1pvj n GLN 162 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1pvj n GLY 163 N -0.05 2.57 3.75 1.08 0.00 -1.26 -1.64 105.19 109.64 1pvj n GLY 163 Ca 0.00 -1.86 -0.41 0.00 0.00 0.00 0.00 46.02 43.75 1pvj n GLY 163 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1pvj s ASN 164 N -0.58 7.16 0.00 1.61 3.84 -1.26 0.99 114.94 126.70 1pvj s ASN 164 Ca 0.00 2.28 0.27 0.00 0.21 0.00 0.00 52.86 55.62 1pvj s ASN 164 Cb 0.00 -2.62 1.00 0.00 -0.55 0.00 0.00 41.25 39.08 1pvj s ASN 164 CO 0.00 -0.26 1.71 -0.81 -2.79 0.00 0.00 177.10 174.95 1pvj n PRO 165 N 1.70 1.68 -0.18 0.43 -0.04 -1.26 -4.86 135.00 132.47 1pvj n PRO 165 Ca 0.01 -0.99 -0.02 0.00 -0.04 0.00 0.00 63.50 62.46 1pvj n PRO 165 Cb 0.45 -1.47 0.08 0.00 -0.04 0.00 0.00 33.50 32.52 1pvj n PRO 165 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1pvj h TYR 166 N 2.36 0.41 -0.08 0.54 -1.99 -0.65 -0.81 116.97 116.75 1pvj h TYR 166 Ca 0.00 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.76 1pvj h TYR 166 Cb 0.50 -0.10 0.00 0.00 2.00 0.00 0.00 36.73 39.13 1pvj h TYR 166 CO 0.02 0.15 0.00 0.27 -0.00 0.00 0.00 178.16 178.59 1pvj n ASN 167 N -4.96 0.49 0.29 3.88 6.94 0.28 -4.19 115.26 117.99 1pvj n ASN 167 Ca 0.07 -2.01 0.14 0.00 -0.02 0.00 0.00 54.58 52.76 1pvj n ASN 167 Cb 0.21 -0.08 0.66 0.00 -2.36 0.00 0.00 39.78 38.21 1pvj n ASN 167 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 1pvj h LEU 168 N 0.46 0.00 -2.77 -4.53 4.07 -1.37 -2.20 115.31 108.98 1pvj h LEU 168 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1pvj h LEU 168 Cb 0.14 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.88 1pvj h LEU 168 CO 0.00 0.00 -0.08 0.18 -1.08 0.00 0.00 178.44 177.46 1pvj n LEU 169 N -2.93 1.83 -4.88 1.67 4.77 -1.26 -5.04 117.00 111.16 1pvj n LEU 169 Ca 0.00 -2.49 -0.30 0.00 -0.03 0.00 0.00 56.01 53.19 1pvj n LEU 169 Cb 0.55 -0.29 0.04 0.00 -2.33 0.00 0.00 43.42 41.40 1pvj n LEU 169 CO 0.13 0.58 0.74 0.42 -1.33 0.00 0.00 177.39 177.93 1pvj s THR 170 N -2.05 3.65 0.40 -5.08 -4.23 -0.83 -4.85 115.64 102.65 1pvj s THR 170 Ca 0.21 0.52 -0.25 0.00 -1.18 0.00 0.00 61.69 60.99 1pvj s THR 170 Cb 0.19 -3.53 -0.11 0.00 1.34 0.00 0.00 72.50 70.39 1pvj s THR 170 CO 0.02 -0.70 1.12 -2.65 -0.54 0.00 0.00 174.62 171.87 1pvj n PRO 171 N -2.96 1.61 -3.00 3.99 -0.02 -1.26 -4.36 135.00 128.99 1pvj n PRO 171 Ca 0.07 0.57 -0.41 0.00 -2.02 0.00 0.00 63.50 61.71 1pvj n PRO 171 Cb 0.57 -2.15 -0.05 0.00 -0.02 0.00 0.00 33.50 31.84 1pvj n PRO 171 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1pvj s VAL 172 N -1.21 4.94 0.12 -1.45 1.01 -1.26 0.64 120.40 123.19 1pvj s VAL 172 Ca 0.61 1.40 -0.34 0.00 0.00 0.00 0.00 61.98 63.65 1pvj s VAL 172 Cb -0.56 -4.04 -0.13 0.00 0.00 0.00 0.00 36.38 31.65 1pvj s VAL 172 CO 0.58 0.05 1.66 -0.38 0.00 0.00 0.00 175.10 177.02 1pvj n ILE 173 N 4.79 0.13 -0.04 2.22 5.41 -0.33 -4.84 119.36 126.70 1pvj n ILE 173 Ca 0.02 -0.02 -0.00 0.00 1.00 0.00 0.00 62.75 63.74 1pvj n ILE 173 Cb 0.49 -1.67 -0.11 0.00 -0.71 0.00 0.00 39.64 37.64 1pvj n ILE 173 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1pvj n GLU 174 N 4.19 1.15 -4.37 0.38 1.02 -0.14 -1.37 120.64 121.50 1pvj n GLU 174 Ca 0.18 -0.07 -0.20 0.00 -0.02 0.00 0.00 57.16 57.06 1pvj n GLU 174 Cb 0.30 -1.36 -0.10 0.00 -0.02 0.00 0.00 31.44 30.26 1pvj n GLU 174 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1pvj s LYS 175 N -2.66 1.41 -0.18 3.49 1.02 -0.34 -4.92 119.74 117.56 1pvj s LYS 175 Ca -0.06 -1.63 -0.10 0.00 0.02 0.00 0.00 55.97 54.19 1pvj s LYS 175 Cb 0.07 -1.24 -0.05 0.00 -0.52 0.00 0.00 37.83 36.09 1pvj s LYS 175 CO 0.59 0.20 0.15 0.08 -0.92 0.00 0.00 175.35 175.46 1pvj s VAL 176 N -2.89 5.40 -0.10 3.17 1.01 -1.26 -4.54 120.40 121.19 1pvj s VAL 176 Ca 0.24 0.24 -0.30 0.00 0.00 0.00 0.00 61.98 62.17 1pvj s VAL 176 Cb -0.01 -3.49 -0.01 0.00 0.00 0.00 0.00 36.38 32.87 1pvj s VAL 176 CO 0.09 0.45 1.02 -0.75 0.00 0.00 0.00 175.10 175.90 1pvj s LYS 177 N 0.22 4.43 0.14 2.72 2.20 -1.26 -4.94 119.74 123.24 1pvj s LYS 177 Ca 0.10 1.41 -0.34 0.00 -0.36 0.00 0.00 55.97 56.77 1pvj s LYS 177 Cb -0.11 -3.54 -0.16 0.00 -1.51 0.00 0.00 37.83 32.51 1pvj s LYS 177 CO -0.00 -0.31 1.29 -2.30 -0.36 0.00 0.00 175.35 173.67 1pvj n PRO 178 N 4.96 1.31 -0.96 4.03 -0.02 -1.26 -1.15 135.00 141.90 1pvj n PRO 178 Ca 0.09 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1pvj n PRO 178 Cb 0.49 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 1pvj n PRO 178 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pvj n GLY 179 N 2.35 0.47 3.17 -1.23 0.00 -1.26 -5.03 105.19 103.65 1pvj n GLY 179 Ca 0.16 -0.47 -0.15 0.00 0.00 0.00 0.00 46.02 45.56 1pvj n GLY 179 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1pvj s GLU 180 N -0.88 0.82 0.56 1.61 2.12 -0.30 -5.13 118.70 117.49 1pvj s GLU 180 Ca 0.00 -1.11 -0.17 0.00 0.36 0.00 0.00 54.97 54.05 1pvj s GLU 180 Cb 0.00 -0.55 -0.05 0.00 0.26 0.00 0.00 34.13 33.79 1pvj s GLU 180 CO 0.00 0.09 1.04 -0.65 -0.54 0.00 0.00 175.26 175.20 1pvj s GLN 181 N -2.61 3.53 0.34 4.30 -0.21 -1.26 -4.63 119.66 119.13 1pvj s GLN 181 Ca 0.04 1.17 -0.27 0.00 0.02 0.00 0.00 55.36 56.32 1pvj s GLN 181 Cb -0.04 -2.06 -0.09 0.00 1.00 0.00 0.00 33.01 31.81 1pvj s GLN 181 CO 0.00 -0.63 1.19 0.45 -2.12 0.00 0.00 175.29 174.18 1pvj s SER 182 N -2.72 6.82 -0.10 5.90 0.15 -1.26 -4.74 113.70 117.76 1pvj s SER 182 Ca 0.63 2.42 0.13 0.00 0.70 0.00 0.00 55.95 59.84 1pvj s SER 182 Cb -0.15 -2.63 0.24 0.00 -1.71 0.00 0.00 66.02 61.78 1pvj s SER 182 CO 0.33 -0.47 1.12 0.49 1.20 0.00 0.00 173.24 175.91 1pvj n PHE 183 N 0.62 0.00 -1.75 3.44 3.01 -1.26 -5.07 117.46 116.46 1pvj n PHE 183 Ca 0.01 -0.76 -0.42 0.00 1.01 0.00 0.00 57.45 57.30 1pvj n PHE 183 Cb 0.45 -0.14 -0.02 0.00 -0.01 0.00 0.00 39.48 39.76 1pvj n PHE 183 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1pvj n VAL 184 N -0.83 1.02 0.00 -4.37 0.31 -1.26 -1.67 118.33 111.53 1pvj n VAL 184 Ca 0.11 -0.25 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 1pvj n VAL 184 Cb 0.71 -1.97 0.00 0.00 -0.91 0.00 0.00 33.84 31.67 1pvj n VAL 184 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1pvj n GLY 185 N 2.17 2.69 3.86 2.92 0.00 -0.47 -5.00 105.19 111.36 1pvj n GLY 185 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 1pvj n GLY 185 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1pvj s GLN 186 N -0.49 3.82 0.15 1.61 -0.21 -0.67 -4.82 119.66 119.06 1pvj s GLN 186 Ca 0.00 0.78 -0.21 0.00 0.02 0.00 0.00 55.36 55.95 1pvj s GLN 186 Cb 0.00 -2.19 -0.08 0.00 1.00 0.00 0.00 33.01 31.75 1pvj s GLN 186 CO 0.00 -0.28 0.69 -1.01 -2.12 0.00 0.00 175.29 172.56 1pvj s HIS 187 N -2.70 3.79 1.12 0.91 3.76 -1.26 -1.19 115.29 119.72 1pvj s HIS 187 Ca 0.56 1.42 -0.17 0.00 -0.15 0.00 0.00 55.06 56.73 1pvj s HIS 187 Cb -0.10 -2.62 0.15 0.00 1.11 0.00 0.00 32.58 31.12 1pvj s HIS 187 CO 0.37 0.48 0.31 0.00 -0.85 0.00 0.00 174.74 175.05 1pvj n ALA 188 N 1.34 -3.67 -1.99 -1.40 0.00 0.21 -4.85 120.51 110.15 1pvj n ALA 188 Ca -0.06 -1.20 -0.32 0.00 0.00 0.00 0.00 53.44 51.86 1pvj n ALA 188 Cb 0.50 -1.67 -0.05 0.00 0.00 0.00 0.00 19.45 18.23 1pvj n ALA 188 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pvj s ALA 189 N -2.30 3.19 0.39 0.00 0.00 -0.82 -4.74 121.76 117.48 1pvj s ALA 189 Ca 0.59 0.13 0.27 0.00 0.00 0.00 0.00 51.96 52.95 1pvj s ALA 189 Cb -0.16 -2.95 1.39 0.00 0.00 0.00 0.00 23.12 21.40 1pvj s ALA 189 CO 0.66 0.07 2.05 1.79 0.00 0.00 0.00 175.76 180.33 1pvj h THR 190 N 1.52 0.58 0.00 0.00 1.35 -1.65 -3.41 112.91 111.30 1pvj h THR 190 Ca -0.48 -0.58 0.00 0.00 -0.55 0.00 0.00 66.41 64.80 1pvj h THR 190 Cb 1.18 1.38 0.00 0.00 -1.73 0.00 0.00 68.15 68.98 1pvj h THR 190 CO 0.63 0.13 0.00 0.61 -0.25 0.00 0.00 175.52 176.64 1pvj n GLY 191 N -0.63 0.49 0.14 5.82 0.00 -1.26 -4.51 105.19 105.23 1pvj n GLY 191 Ca -0.02 -1.57 -0.07 0.00 0.00 0.00 0.00 46.02 44.36 1pvj n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pvj h VAL 193 N 0.13 1.12 -0.23 0.00 -1.51 -1.87 0.69 116.25 114.58 1pvj h VAL 193 Ca -0.03 -1.84 -0.14 0.00 -1.23 0.00 0.00 66.70 63.46 1pvj h VAL 193 Cb 1.38 2.06 0.00 0.00 -2.13 0.00 0.00 31.29 32.60 1pvj h VAL 193 CO 0.12 0.48 -0.40 0.00 -1.23 0.00 0.00 177.57 176.54 1pvj h ALA 194 N 1.51 0.35 -0.09 5.19 0.00 -1.77 -0.15 119.26 124.31 1pvj h ALA 194 Ca -0.00 -0.45 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 1pvj h ALA 194 Cb 1.02 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 1pvj h ALA 194 CO 0.06 0.46 -0.10 1.15 0.00 0.00 0.00 179.25 180.82 1pvj h THR 195 N 0.38 1.37 -0.91 0.00 2.02 -1.19 0.51 112.91 115.09 1pvj h THR 195 Ca 0.01 -1.28 0.01 0.00 0.77 0.00 0.00 66.41 65.92 1pvj h THR 195 Cb 1.00 2.03 -0.04 0.00 -1.74 0.00 0.00 68.15 69.39 1pvj h THR 195 CO 0.09 0.36 0.59 0.00 0.37 0.00 0.00 175.52 176.93 1pvj h ALA 196 N 0.56 1.16 -0.26 6.16 0.00 0.40 -1.89 119.26 125.37 1pvj h ALA 196 Ca 0.01 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1pvj h ALA 196 Cb 0.62 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1pvj h ALA 196 CO 0.02 0.57 -0.01 1.15 0.00 0.00 0.00 179.25 180.98 1pvj h THR 197 N 1.24 1.26 -0.57 0.00 2.02 -0.94 -2.90 112.91 113.02 1pvj h THR 197 Ca 0.33 -0.95 -0.04 0.00 0.77 0.00 0.00 66.41 66.52 1pvj h THR 197 Cb -0.12 1.36 -0.03 0.00 -1.74 0.00 0.00 68.15 67.62 1pvj h THR 197 CO -0.07 0.30 0.20 0.00 0.37 0.00 0.00 175.52 176.33 1pvj h ALA 198 N 0.81 1.28 -0.33 6.16 0.00 -0.54 -0.72 119.26 125.91 1pvj h ALA 198 Ca 0.07 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1pvj h ALA 198 Cb 0.45 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1pvj h ALA 198 CO 0.02 0.52 0.08 1.96 0.00 0.00 0.00 179.25 181.83 1pvj h GLN 199 N 0.83 0.53 -0.76 0.00 4.20 -1.32 0.07 115.11 118.65 1pvj h GLN 199 Ca 0.19 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.78 1pvj h GLN 199 Cb 0.20 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.87 1pvj h GLN 199 CO -0.01 0.59 0.48 0.82 -0.67 0.00 0.00 178.83 180.04 1pvj h ILE 200 N 0.38 1.20 -0.52 2.54 2.04 -1.25 -0.85 117.51 121.05 1pvj h ILE 200 Ca 0.10 -0.41 -0.10 0.00 1.00 0.00 0.00 64.86 65.45 1pvj h ILE 200 Cb 0.30 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 1pvj h ILE 200 CO 0.00 0.21 -0.09 0.24 0.00 0.00 0.00 178.15 178.51 1pvj h MET 201 N 1.04 0.96 -0.10 2.37 2.86 -0.67 -2.78 114.93 118.61 1pvj h MET 201 Ca 0.28 -0.33 -0.14 0.00 -2.06 0.00 0.00 59.70 57.44 1pvj h MET 201 Cb -0.08 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.49 1pvj h MET 201 CO -0.06 1.00 -0.55 -0.22 1.06 0.00 0.00 176.91 178.14 1pvj h LYS 202 N 0.86 0.31 -0.09 1.72 1.63 -0.40 0.22 116.57 120.82 1pvj h LYS 202 Ca 0.14 -0.19 0.02 0.00 -0.85 0.00 0.00 60.65 59.77 1pvj h LYS 202 Cb 0.63 0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 32.27 1pvj h LYS 202 CO 0.04 0.78 0.06 -0.92 -3.45 0.00 0.00 179.45 175.96 1pvj h TYR 203 N 0.24 0.00 -0.02 1.91 3.20 -0.90 -0.73 116.97 120.67 1pvj h TYR 203 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1pvj h TYR 203 Cb 1.05 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.32 1pvj h TYR 203 CO 0.03 0.00 -0.26 0.72 -1.64 0.00 0.00 178.16 177.00 1pvj n HIS 204 N -4.51 0.00 -4.18 -3.82 8.25 -0.90 -4.99 115.22 105.06 1pvj n HIS 204 Ca -0.01 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.16 1pvj n HIS 204 Cb 0.17 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.22 1pvj n HIS 204 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1pvj n ASN 205 N 0.21 0.21 -3.90 0.41 3.02 0.73 -4.94 115.26 110.99 1pvj n ASN 205 Ca 0.08 -1.16 -0.10 0.00 -0.03 0.00 0.00 54.58 53.36 1pvj n ASN 205 Cb 0.39 -2.21 -0.10 0.00 -0.61 0.00 0.00 39.78 37.26 1pvj n ASN 205 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1pvj s TYR 206 N -4.14 0.10 0.38 3.10 5.04 -1.12 -4.72 117.35 116.00 1pvj s TYR 206 Ca 0.06 -0.27 -0.07 0.00 -2.44 0.00 0.00 57.07 54.35 1pvj s TYR 206 Cb -0.03 -0.09 0.09 0.00 0.35 0.00 0.00 41.96 42.28 1pvj s TYR 206 CO 0.95 -0.30 0.51 -0.35 -1.34 0.00 0.00 175.55 175.02 1pvj n PRO 207 N 1.26 -0.57 -0.07 4.97 -0.04 -1.26 -4.80 135.00 134.49 1pvj n PRO 207 Ca -0.22 -0.79 -0.09 0.00 -0.04 0.00 0.00 63.50 62.37 1pvj n PRO 207 Cb 0.56 -0.54 -0.09 0.00 -0.04 0.00 0.00 33.50 33.40 1pvj n PRO 207 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1pvj n ASN 208 N -3.35 2.36 -4.16 3.54 5.03 -1.26 -4.68 115.26 112.74 1pvj n ASN 208 Ca 0.06 -0.04 -0.33 0.00 0.87 0.00 0.00 54.58 55.14 1pvj n ASN 208 Cb 0.22 0.27 -0.16 0.00 -1.02 0.00 0.00 39.78 39.09 1pvj n ASN 208 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1pvj s LYS 209 N -2.31 3.02 0.47 3.52 1.02 -1.26 -0.75 119.74 123.45 1pvj s LYS 209 Ca -0.14 -0.85 -0.24 0.00 0.02 0.00 0.00 55.97 54.77 1pvj s LYS 209 Cb 0.05 -2.48 -0.07 0.00 -0.52 0.00 0.00 37.83 34.81 1pvj s LYS 209 CO 0.44 -0.06 1.33 0.20 -0.92 0.00 0.00 175.35 176.33 1pvj s GLY 210 N 0.94 2.89 -0.19 -3.33 0.00 -0.99 -4.85 107.32 101.78 1pvj s GLY 210 Ca -0.04 1.27 -0.16 0.00 0.00 0.00 0.00 44.72 45.79 1pvj s GLY 210 CO -0.05 1.82 -0.02 -0.10 0.00 0.00 0.00 173.10 174.76 1pvj n LEU 211 N -0.40 1.86 -3.92 0.66 0.00 0.74 -4.31 117.00 111.62 1pvj n LEU 211 Ca 0.07 0.48 -0.17 0.00 0.00 0.00 0.00 56.01 56.38 1pvj n LEU 211 Cb 0.44 -0.91 -0.15 0.00 0.00 0.00 0.00 43.42 42.80 1pvj n LEU 211 CO 0.54 0.02 -0.40 -0.75 0.00 0.00 0.00 177.39 176.80 1pvj s LYS 212 N -2.37 0.53 1.05 1.96 2.20 -0.92 -4.50 119.74 117.69 1pvj s LYS 212 Ca -0.25 -0.12 -0.12 0.00 -0.36 0.00 0.00 55.97 55.12 1pvj s LYS 212 Cb 0.05 -0.56 0.22 0.00 -1.51 0.00 0.00 37.83 36.04 1pvj s LYS 212 CO 0.44 0.02 1.07 -0.51 -0.36 0.00 0.00 175.35 176.02 1pvj s ASP 213 N 0.37 1.93 0.05 1.43 1.01 -1.26 -4.11 116.67 116.09 1pvj s ASP 213 Ca -0.04 1.71 -0.07 0.00 0.71 0.00 0.00 52.55 54.86 1pvj s ASP 213 Cb -0.08 -2.36 -0.01 0.00 1.01 0.00 0.00 42.92 41.49 1pvj s ASP 213 CO -0.00 -3.64 0.13 -0.47 0.21 0.00 0.00 175.17 171.39 1pvj s TYR 214 N -2.59 0.18 -0.00 4.23 5.04 -1.09 -4.91 117.35 118.20 1pvj s TYR 214 Ca 0.67 -0.50 -0.26 0.00 -2.44 0.00 0.00 57.07 54.54 1pvj s TYR 214 Cb -0.23 -0.12 0.06 0.00 0.35 0.00 0.00 41.96 42.02 1pvj s TYR 214 CO 0.61 -0.41 0.59 -0.08 -1.34 0.00 0.00 175.55 174.92 1pvj s THR 215 N -2.91 0.01 0.10 4.34 -1.32 -1.26 -2.45 115.64 112.16 1pvj s THR 215 Ca -0.02 -0.11 -0.25 0.00 -1.21 0.00 0.00 61.69 60.09 1pvj s THR 215 Cb 0.01 -0.95 0.08 0.00 -1.51 0.00 0.00 72.50 70.13 1pvj s THR 215 CO -0.06 -0.06 0.71 -0.72 -2.21 0.00 0.00 174.62 172.27 1pvj s TYR 216 N -1.76 -0.47 -0.20 9.09 -0.85 -1.14 -5.01 117.35 117.01 1pvj s TYR 216 Ca -0.09 0.28 -0.06 0.00 -0.52 0.00 0.00 57.07 56.69 1pvj s TYR 216 Cb -0.01 0.55 -0.03 0.00 0.38 0.00 0.00 41.96 42.85 1pvj s TYR 216 CO 0.04 -0.74 0.03 0.99 -1.52 0.00 0.00 175.55 174.36 1pvj s THR 217 N -3.52 4.30 0.24 -3.49 2.01 -1.26 -2.02 115.64 111.90 1pvj s THR 217 Ca 0.02 -0.20 -0.31 0.00 0.31 0.00 0.00 61.69 61.52 1pvj s THR 217 Cb -0.01 -2.95 -0.13 0.00 0.01 0.00 0.00 72.50 69.42 1pvj s THR 217 CO -0.11 0.42 1.42 -0.11 -0.69 0.00 0.00 174.62 175.55 1pvj n LEU 218 N 4.12 3.16 -4.54 4.42 7.94 0.36 -4.82 117.00 127.64 1pvj n LEU 218 Ca -0.17 1.14 -0.53 0.00 -1.11 0.00 0.00 56.01 55.35 1pvj n LEU 218 Cb 0.52 -1.44 -0.06 0.00 0.53 0.00 0.00 43.42 42.98 1pvj n LEU 218 CO 0.33 -0.46 0.63 -0.24 -1.11 0.00 0.00 177.39 176.54 1pvj n SER 219 N 2.18 0.68 0.07 1.96 2.88 -1.26 -4.69 113.62 115.44 1pvj n SER 219 Ca 0.12 1.14 0.10 0.00 -1.33 0.00 0.00 58.87 58.90 1pvj n SER 219 Cb 0.32 -1.09 0.42 0.00 -0.75 0.00 0.00 64.21 63.11 1pvj n SER 219 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1pvj n SER 220 N 1.97 0.37 -1.14 -3.46 3.41 -1.26 -2.31 113.62 111.20 1pvj n SER 220 Ca 0.18 0.58 0.08 0.00 -0.26 0.00 0.00 58.87 59.44 1pvj n SER 220 Cb 0.18 -0.66 0.25 0.00 -0.26 0.00 0.00 64.21 63.72 1pvj n SER 220 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1pvj n ASN 221 N -1.89 3.31 -4.64 4.04 0.23 -1.26 -4.87 115.26 110.17 1pvj n ASN 221 Ca 0.03 -2.19 -0.43 0.00 -0.53 0.00 0.00 54.58 51.46 1pvj n ASN 221 Cb 0.24 -0.44 -0.02 0.00 -2.08 0.00 0.00 39.78 37.47 1pvj n ASN 221 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 1pvj s ASN 222 N -0.87 6.63 0.02 0.53 3.84 -0.98 -4.93 114.94 119.18 1pvj s ASN 222 Ca 0.37 1.66 0.29 0.00 0.21 0.00 0.00 52.86 55.39 1pvj s ASN 222 Cb 0.22 -2.54 1.19 0.00 -0.55 0.00 0.00 41.25 39.57 1pvj s ASN 222 CO 0.21 -1.04 1.90 -0.81 -2.79 0.00 0.00 177.10 174.57 1pvj n PRO 223 N 7.23 0.02 0.00 0.43 -0.04 -1.26 -3.95 135.00 137.44 1pvj n PRO 223 Ca 0.16 0.02 0.13 0.00 -0.04 0.00 0.00 63.50 63.77 1pvj n PRO 223 Cb 0.45 -1.52 0.42 0.00 -0.04 0.00 0.00 33.50 32.81 1pvj n PRO 223 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1pvj n TYR 224 N -1.56 0.00 -4.10 0.54 4.02 -1.26 -4.40 117.16 110.40 1pvj n TYR 224 Ca 0.07 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.84 1pvj n TYR 224 Cb 0.35 -0.05 -0.11 0.00 -0.02 0.00 0.00 39.34 39.51 1pvj n TYR 224 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1pvj s PHE 225 N -2.21 0.73 0.52 -0.72 0.40 -1.25 -0.96 117.98 114.48 1pvj s PHE 225 Ca 0.31 -0.67 -0.18 0.00 -0.60 0.00 0.00 56.93 55.80 1pvj s PHE 225 Cb 0.20 -0.43 -0.07 0.00 0.51 0.00 0.00 43.02 43.23 1pvj s PHE 225 CO 0.41 -0.12 1.02 -0.80 0.70 0.00 0.00 175.22 176.43 1pvj s ASN 226 N -2.14 6.32 0.11 1.36 0.01 -1.26 -4.94 114.94 114.39 1pvj s ASN 226 Ca -0.02 1.77 0.10 0.00 -0.71 0.00 0.00 52.86 54.01 1pvj s ASN 226 Cb -0.04 -2.54 -0.04 0.00 0.41 0.00 0.00 41.25 39.05 1pvj s ASN 226 CO -0.02 -0.80 -0.26 -1.00 -1.51 0.00 0.00 177.10 173.52 1pvj s HIS 227 N -2.31 2.34 0.64 2.20 3.76 -1.26 -4.05 115.29 116.61 1pvj s HIS 227 Ca 0.63 -0.37 -0.12 0.00 -0.15 0.00 0.00 55.06 55.05 1pvj s HIS 227 Cb -0.14 -1.29 -0.02 0.00 1.11 0.00 0.00 32.58 32.24 1pvj s HIS 227 CO 0.27 0.31 1.04 -1.25 -0.85 0.00 0.00 174.74 174.26 1pvj s PRO 228 N -1.92 3.32 -0.12 8.40 0.04 -1.26 -5.17 135.00 138.29 1pvj s PRO 228 Ca 0.14 0.89 -0.02 0.00 0.04 0.00 0.00 61.00 62.06 1pvj s PRO 228 Cb -0.10 -2.04 0.04 0.00 0.04 0.00 0.00 34.50 32.44 1pvj s PRO 228 CO 0.06 -0.79 0.01 0.21 0.04 0.00 0.00 177.00 176.52 1pvj s LYS 229 N -4.93 0.70 -0.09 4.56 2.47 -1.26 -5.07 119.74 116.12 1pvj s LYS 229 Ca 0.57 -0.10 0.01 0.00 -1.56 0.00 0.00 55.97 54.89 1pvj s LYS 229 Cb -0.13 -1.41 -0.02 0.00 -1.46 0.00 0.00 37.83 34.81 1pvj s LYS 229 CO 0.51 -0.42 -0.11 -0.80 0.16 0.00 0.00 175.35 174.70 1pvj s ASN 230 N 1.91 4.30 -0.00 1.43 0.01 -1.26 -0.49 114.94 120.84 1pvj s ASN 230 Ca 0.03 -0.17 0.06 0.00 -0.71 0.00 0.00 52.86 52.08 1pvj s ASN 230 Cb -0.14 -1.24 -0.03 0.00 0.41 0.00 0.00 41.25 40.26 1pvj s ASN 230 CO -0.06 0.29 -0.20 -0.76 -1.51 0.00 0.00 177.10 174.86 1pvj s LEU 231 N -0.37 2.46 -0.03 0.60 1.02 -0.86 -4.98 118.68 116.53 1pvj s LEU 231 Ca 0.04 -0.38 0.01 0.00 0.02 0.00 0.00 54.13 53.82 1pvj s LEU 231 Cb -0.12 -1.46 0.02 0.00 0.02 0.00 0.00 46.19 44.64 1pvj s LEU 231 CO 0.02 0.30 -0.03 0.12 0.02 0.00 0.00 176.35 176.78 1pvj s PHE 232 N -0.77 0.50 -0.18 0.29 5.36 -1.26 -2.90 117.98 119.01 1pvj s PHE 232 Ca 0.12 -0.09 -0.00 0.00 -0.96 0.00 0.00 56.93 56.00 1pvj s PHE 232 Cb -0.10 -0.46 0.00 0.00 -0.34 0.00 0.00 43.02 42.12 1pvj s PHE 232 CO 0.02 -0.12 -0.15 0.00 -1.46 0.00 0.00 175.22 173.52 1pvj s ALA 233 N 0.67 2.50 -0.64 11.12 0.00 -1.02 -5.00 121.76 129.39 1pvj s ALA 233 Ca -0.08 -1.13 -0.06 0.00 0.00 0.00 0.00 51.96 50.69 1pvj s ALA 233 Cb -0.11 -1.31 -0.07 0.00 0.00 0.00 0.00 23.12 21.64 1pvj s ALA 233 CO -0.01 -0.23 3.03 0.00 0.00 0.00 0.00 175.76 178.56 1pvj n ALA 234 N 4.42 6.68 -0.29 0.00 0.00 -1.26 -2.66 120.51 127.39 1pvj n ALA 234 Ca -0.20 -2.89 0.11 0.00 0.00 0.00 0.00 53.44 50.46 1pvj n ALA 234 Cb 0.51 -2.51 0.25 0.00 0.00 0.00 0.00 19.45 17.70 1pvj n ALA 234 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1pvj h ILE 235 N 2.26 0.32 0.00 0.00 2.04 -1.92 0.92 117.51 121.14 1pvj h ILE 235 Ca 0.46 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 66.25 1pvj h ILE 235 Cb 0.85 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1pvj h ILE 235 CO 0.91 0.03 0.33 0.77 0.00 0.00 0.00 178.15 180.19 1pvj h SER 236 N 0.18 0.00 -0.41 1.72 4.64 -1.75 0.27 113.55 118.20 1pvj h SER 236 Ca 0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 1pvj h SER 236 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 1pvj h SER 236 CO -0.66 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 175.65 1pvj n THR 237 N -2.54 1.74 -3.16 2.95 -2.24 0.32 -4.68 114.28 106.66 1pvj n THR 237 Ca -0.01 -1.37 -0.34 0.00 -2.27 0.00 0.00 64.05 60.05 1pvj n THR 237 Cb 0.37 0.11 -0.06 0.00 -2.10 0.00 0.00 70.33 68.65 1pvj n THR 237 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1pvj s ARG 238 N -1.93 4.07 -0.52 -0.78 1.81 0.95 -4.96 118.95 117.59 1pvj s ARG 238 Ca 0.39 0.69 0.07 0.00 -1.72 0.00 0.00 55.73 55.16 1pvj s ARG 238 Cb 0.27 -2.62 0.26 0.00 -0.45 0.00 0.00 34.95 32.41 1pvj s ARG 238 CO 0.16 0.26 0.67 1.04 -0.68 0.00 0.00 175.30 176.75 1pvj n GLN 239 N 0.07 1.76 -1.43 3.54 1.13 -1.25 -2.35 117.38 118.85 1pvj n GLN 239 Ca 0.01 -4.03 -0.51 0.00 -1.94 0.00 0.00 57.00 50.53 1pvj n GLN 239 Cb 0.52 -1.80 -0.08 0.00 0.11 0.00 0.00 30.24 29.00 1pvj n GLN 239 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1pvj n TYR 240 N 0.98 1.55 -2.98 1.08 0.53 0.07 -4.90 117.16 113.49 1pvj n TYR 240 Ca 0.26 0.32 -0.44 0.00 -1.02 0.00 0.00 57.90 57.02 1pvj n TYR 240 Cb 0.47 -2.51 -0.02 0.00 -1.03 0.00 0.00 39.34 36.25 1pvj n TYR 240 CO 0.00 0.00 0.00 1.21 -1.02 0.00 0.00 176.86 177.05 1pvj s ASN 241 N 7.27 6.69 0.00 7.72 3.84 -1.26 -4.63 114.94 134.57 1pvj s ASN 241 Ca 1.11 -2.21 0.00 0.00 0.21 0.00 0.00 52.86 51.97 1pvj s ASN 241 Cb -0.91 -2.37 0.00 0.00 -0.55 0.00 0.00 41.25 37.42 1pvj s ASN 241 CO 0.50 -0.97 0.09 0.79 -2.79 0.00 0.00 177.10 174.72 1pvj n TRP 242 N 6.13 0.00 -0.02 0.43 7.02 -1.26 0.59 117.44 130.34 1pvj n TRP 242 Ca 0.24 0.00 0.08 0.00 -1.02 0.00 0.00 57.50 56.80 1pvj n TRP 242 Cb 0.48 -0.00 -0.16 0.00 -2.42 0.00 0.00 31.31 29.21 1pvj n TRP 242 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 1pvj n ASN 243 N -0.25 0.20 -0.00 -0.99 5.03 -1.26 -4.15 115.26 113.84 1pvj n ASN 243 Ca 0.00 0.00 -0.03 0.00 0.87 0.00 0.00 54.58 55.42 1pvj n ASN 243 Cb 0.01 1.85 -0.11 0.00 -1.02 0.00 0.00 39.78 40.51 1pvj n ASN 243 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1pvj n ASN 244 N -2.28 0.65 -4.50 6.41 3.02 0.20 -4.56 115.26 114.20 1pvj n ASN 244 Ca -0.07 0.29 -0.43 0.00 -0.03 0.00 0.00 54.58 54.34 1pvj n ASN 244 Cb 0.61 0.39 -0.01 0.00 -0.61 0.00 0.00 39.78 40.16 1pvj n ASN 244 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1pvj s ILE 245 N -2.83 4.55 0.83 2.41 1.01 -0.92 -4.53 121.20 121.72 1pvj s ILE 245 Ca -0.05 -1.89 -0.13 0.00 0.00 0.00 0.00 60.65 58.58 1pvj s ILE 245 Cb 0.08 -4.97 0.08 0.00 0.01 0.00 0.00 42.46 37.66 1pvj s ILE 245 CO 0.82 -1.74 1.05 0.18 0.00 0.00 0.00 174.94 175.25 1pvj n LEU 246 N 7.07 3.44 0.18 2.97 4.77 -1.26 -4.89 117.00 129.27 1pvj n LEU 246 Ca 0.36 0.53 0.14 0.00 -0.03 0.00 0.00 56.01 57.01 1pvj n LEU 246 Cb 0.46 -1.45 0.53 0.00 -2.33 0.00 0.00 43.42 40.64 1pvj n LEU 246 CO 0.63 -2.10 0.90 1.55 -1.33 0.00 0.00 177.39 177.04 1pvj h PRO 247 N -1.08 0.00 -1.98 3.23 0.13 -1.88 -3.45 132.00 126.97 1pvj h PRO 247 Ca -0.45 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.69 1pvj h PRO 247 Cb 1.30 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.24 1pvj h PRO 247 CO 0.44 0.00 0.35 -0.08 -0.23 0.00 0.00 178.00 178.48 1pvj s THR 248 N -3.41 0.00 0.07 1.56 -1.32 -1.26 -1.33 115.64 109.96 1pvj s THR 248 Ca 0.04 0.00 0.09 0.00 -1.21 0.00 0.00 61.69 60.61 1pvj s THR 248 Cb 0.09 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 70.05 1pvj s THR 248 CO 0.47 0.00 -0.23 -0.31 -2.21 0.00 0.00 174.62 172.34 1pvj s TYR 249 N -1.64 2.04 -0.28 9.09 1.51 -1.26 -5.02 117.35 121.79 1pvj s TYR 249 Ca -0.05 -0.39 0.17 0.00 -1.01 0.00 0.00 57.07 55.78 1pvj s TYR 249 Cb -0.00 -1.17 -0.23 0.00 -0.11 0.00 0.00 41.96 40.44 1pvj s TYR 249 CO 0.03 0.17 0.48 -1.13 -1.11 0.00 0.00 175.55 173.99 1pvj n SER 250 N 1.48 1.02 0.00 2.29 3.41 -1.26 -5.01 113.62 115.56 1pvj n SER 250 Ca -0.18 -0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.12 1pvj n SER 250 Cb 0.53 1.50 0.00 0.00 -0.26 0.00 0.00 64.21 65.98 1pvj n SER 250 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pvj n GLY 251 N 1.49 0.58 0.78 5.00 0.00 -1.26 -4.94 105.19 106.84 1pvj n GLY 251 Ca -0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.09 1pvj n GLY 251 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pvj n ARG 252 N -1.58 1.99 -0.83 1.61 1.74 -1.26 -5.01 116.66 113.32 1pvj n ARG 252 Ca 0.00 -1.86 -0.31 0.00 -0.77 0.00 0.00 57.85 54.91 1pvj n ARG 252 Cb 0.00 -1.35 0.15 0.00 -1.02 0.00 0.00 32.46 30.24 1pvj n ARG 252 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1pvj s GLU 253 N -1.18 1.30 0.00 5.56 8.01 -1.26 -5.03 118.70 126.10 1pvj s GLU 253 Ca 0.26 1.49 0.00 0.00 0.01 0.00 0.00 54.97 56.73 1pvj s GLU 253 Cb 0.15 -1.76 0.00 0.00 -4.31 0.00 0.00 34.13 28.21 1pvj s GLU 253 CO 0.22 -2.41 0.00 -1.13 0.01 0.00 0.00 175.26 171.94 1pvj n SER 254 N -4.03 0.00 0.07 -0.19 3.41 -1.26 -4.84 113.62 106.77 1pvj n SER 254 Ca 0.11 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.59 1pvj n SER 254 Cb 0.52 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.33 1pvj n SER 254 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1pvj h ASN 255 N 0.00 0.28 -0.32 4.04 4.21 -1.99 -3.25 115.58 118.55 1pvj h ASN 255 Ca 0.00 -0.35 -0.01 0.00 1.21 0.00 0.00 56.30 57.14 1pvj h ASN 255 Cb 0.00 -0.09 -0.01 0.00 -1.12 0.00 0.00 38.32 37.09 1pvj h ASN 255 CO 0.00 1.29 0.15 0.58 -1.29 0.00 0.00 177.43 178.16 1pvj h VAL 256 N 0.05 1.16 -0.29 2.81 2.07 -1.98 -0.38 116.25 119.68 1pvj h VAL 256 Ca -0.17 -0.45 -0.06 0.00 0.82 0.00 0.00 66.70 66.85 1pvj h VAL 256 Cb 1.95 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 32.59 1pvj h VAL 256 CO 0.16 0.16 -0.04 1.56 0.02 0.00 0.00 177.57 179.44 1pvj h GLN 257 N 0.38 0.54 -0.22 1.57 7.50 -1.80 -2.49 115.11 120.59 1pvj h GLN 257 Ca 0.11 -0.19 -0.07 0.00 0.50 0.00 0.00 58.65 59.00 1pvj h GLN 257 Cb 0.12 -0.04 -0.01 0.00 0.05 0.00 0.00 27.48 27.61 1pvj h GLN 257 CO -0.01 0.71 -0.14 0.87 -1.50 0.00 0.00 178.83 178.76 1pvj h LYS 258 N 0.31 0.48 -0.63 1.46 1.57 -1.59 -2.81 116.57 115.37 1pvj h LYS 258 Ca 0.08 -0.22 0.11 0.00 -1.87 0.00 0.00 60.65 58.74 1pvj h LYS 258 Cb 0.49 -0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.72 1pvj h LYS 258 CO 0.02 0.78 0.20 1.98 -0.57 0.00 0.00 179.45 181.86 1pvj h MET 259 N 0.18 0.35 0.07 3.15 1.85 -1.10 0.13 114.93 119.56 1pvj h MET 259 Ca 0.04 -0.02 0.01 0.00 -0.61 0.00 0.00 59.70 59.12 1pvj h MET 259 Cb 0.65 -0.08 -0.03 0.00 0.43 0.00 0.00 31.60 32.58 1pvj h MET 259 CO 0.04 0.23 -0.29 0.00 -0.40 0.00 0.00 176.91 176.48 1pvj h ALA 260 N 1.46 -0.81 -0.18 0.39 0.00 -1.28 -2.20 119.26 116.65 1pvj h ALA 260 Ca 0.33 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1pvj h ALA 260 Cb 0.45 0.70 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1pvj h ALA 260 CO -0.36 -0.88 0.07 0.97 0.00 0.00 0.00 179.25 179.06 1pvj h ILE 261 N -0.42 1.16 -0.63 0.00 6.09 -1.24 -2.17 117.51 120.30 1pvj h ILE 261 Ca -0.00 -0.47 0.15 0.00 -1.37 0.00 0.00 64.86 63.16 1pvj h ILE 261 Cb 0.42 1.15 -0.03 0.00 0.47 0.00 0.00 36.82 38.83 1pvj h ILE 261 CO -0.16 0.15 0.43 0.77 -3.07 0.00 0.00 178.15 176.28 1pvj h SER 262 N 0.13 0.19 0.62 2.19 4.64 -0.73 0.95 113.55 121.54 1pvj h SER 262 Ca 0.06 0.01 -0.25 0.00 -0.47 0.00 0.00 61.79 61.13 1pvj h SER 262 Cb 0.17 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1pvj h SER 262 CO -0.00 0.10 -1.14 -0.08 -0.87 0.00 0.00 176.83 174.83 1pvj h GLU 263 N 0.20 0.26 0.37 4.77 4.81 -1.23 -1.52 114.58 122.25 1pvj h GLU 263 Ca 0.30 -0.40 -0.02 0.00 -0.13 0.00 0.00 59.36 59.12 1pvj h GLU 263 Cb 0.91 0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.43 1pvj h GLU 263 CO -0.06 1.16 -0.18 1.25 -0.73 0.00 0.00 179.01 180.45 1pvj h LEU 264 N 0.09 -0.42 -1.31 1.64 5.85 -0.24 -2.46 115.31 118.47 1pvj h LEU 264 Ca -0.11 -0.10 0.19 0.00 0.84 0.00 0.00 57.88 58.70 1pvj h LEU 264 Cb 1.85 0.11 -0.08 0.00 0.37 0.00 0.00 40.66 42.91 1pvj h LEU 264 CO 0.18 -0.14 0.60 0.24 -0.34 0.00 0.00 178.44 178.98 1pvj h MET 265 N -0.71 0.57 -0.25 1.25 2.86 -1.11 -1.65 114.93 115.90 1pvj h MET 265 Ca -0.05 -0.03 -0.16 0.00 -2.06 0.00 0.00 59.70 57.40 1pvj h MET 265 Cb 0.49 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 1pvj h MET 265 CO 0.08 0.37 -0.48 0.00 1.06 0.00 0.00 176.91 177.94 1pvj h ALA 266 N 1.61 0.69 -0.15 6.32 0.00 -1.05 -2.17 119.26 124.51 1pvj h ALA 266 Ca 0.50 -0.48 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 1pvj h ALA 266 Cb 0.99 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1pvj h ALA 266 CO -0.24 0.67 -0.31 -0.44 0.00 0.00 0.00 179.25 178.93 1pvj h ASP 267 N 0.53 0.54 -0.42 0.00 3.32 -0.90 -2.39 116.42 117.10 1pvj h ASP 267 Ca 0.03 -0.55 -0.01 0.00 0.02 0.00 0.00 57.03 56.51 1pvj h ASP 267 Cb 1.03 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.41 1pvj h ASP 267 CO 0.10 0.99 0.21 0.58 -1.72 0.00 0.00 179.24 179.40 1pvj h VAL 268 N 0.10 1.17 -0.35 -1.35 2.07 -1.37 -0.45 116.25 116.06 1pvj h VAL 268 Ca 0.01 -0.45 0.01 0.00 0.82 0.00 0.00 66.70 67.09 1pvj h VAL 268 Cb 0.90 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 1pvj h VAL 268 CO 0.07 0.18 0.23 1.23 0.02 0.00 0.00 177.57 179.30 1pvj h GLY 269 N 0.54 0.46 0.80 2.17 0.00 -1.39 -2.35 103.07 103.30 1pvj h GLY 269 Ca 0.14 -0.17 -0.20 0.00 0.00 0.00 0.00 47.33 47.10 1pvj h GLY 269 CO -0.02 0.16 -0.87 -2.22 0.00 0.00 0.00 176.54 173.59 1pvj h ILE 270 N 0.43 1.46 -0.18 2.60 2.04 -0.92 -1.26 117.51 121.68 1pvj h ILE 270 Ca 0.14 -2.46 0.05 0.00 1.00 0.00 0.00 64.86 63.59 1pvj h ILE 270 Cb 0.02 3.04 -0.01 0.00 -0.74 0.00 0.00 36.82 39.13 1pvj h ILE 270 CO -0.03 0.71 0.45 0.77 0.00 0.00 0.00 178.15 180.04 1pvj h SER 271 N -0.23 0.00 -0.30 1.72 4.64 -0.58 0.53 113.55 119.33 1pvj h SER 271 Ca -0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 1pvj h SER 271 Cb 1.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.74 1pvj h SER 271 CO 0.16 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.45 1pvj n VAL 272 N -3.16 2.28 -3.82 0.95 0.24 -0.98 -4.74 118.33 109.10 1pvj n VAL 272 Ca 0.02 -1.79 -0.28 0.00 -2.04 0.00 0.00 64.34 60.25 1pvj n VAL 272 Cb 0.55 -0.22 0.04 0.00 -1.47 0.00 0.00 33.84 32.73 1pvj n VAL 272 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1pvj n ASP 273 N -0.33 -5.11 -4.69 -1.34 10.43 0.19 -4.45 116.55 111.24 1pvj n ASP 273 Ca 0.22 -0.72 -0.54 0.00 2.57 0.00 0.00 54.79 56.32 1pvj n ASP 273 Cb 0.91 -4.21 -0.06 0.00 1.84 0.00 0.00 41.12 39.60 1pvj n ASP 273 CO 0.00 0.00 0.00 0.80 -1.07 0.00 0.00 177.20 176.93 1pvj n MET 274 N -4.76 1.53 -2.71 -1.24 1.56 -0.48 -4.86 117.12 106.16 1pvj n MET 274 Ca 0.02 0.56 -0.42 0.00 -0.27 0.00 0.00 57.70 57.59 1pvj n MET 274 Cb 0.54 -2.30 -0.03 0.00 2.15 0.00 0.00 33.22 33.58 1pvj n MET 274 CO 0.00 0.00 0.00 0.34 -0.73 0.00 0.00 175.97 175.58 1pvj s ASP 275 N 3.41 6.20 0.31 6.12 2.15 0.56 -4.93 116.67 130.49 1pvj s ASP 275 Ca 0.95 -0.81 -0.27 0.00 0.43 0.00 0.00 52.55 52.85 1pvj s ASP 275 Cb -0.92 -2.49 -0.09 0.00 -0.30 0.00 0.00 42.92 39.11 1pvj s ASP 275 CO 0.59 -1.61 0.99 -0.31 -0.17 0.00 0.00 175.17 174.66 1pvj s TYR 276 N 4.81 3.68 -0.00 -5.34 1.51 -1.26 -2.04 117.35 118.70 1pvj s TYR 276 Ca 0.29 1.78 -0.01 0.00 -1.01 0.00 0.00 57.07 58.13 1pvj s TYR 276 Cb -0.12 -3.04 0.00 0.00 -0.11 0.00 0.00 41.96 38.70 1pvj s TYR 276 CO 0.11 0.00 0.04 0.41 -1.11 0.00 0.00 175.55 175.00 1pvj n GLY 277 N 0.88 0.55 0.52 0.71 0.00 -1.26 -4.82 105.19 101.77 1pvj n GLY 277 Ca 0.01 -0.83 0.31 0.00 0.00 0.00 0.00 46.02 45.51 1pvj n GLY 277 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1pvj h PRO 278 N 0.00 0.00 -4.60 1.61 0.11 -1.95 -2.19 132.00 124.98 1pvj h PRO 278 Ca -0.01 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.88 1pvj h PRO 278 Cb 0.03 0.00 -0.16 0.00 0.11 0.00 0.00 31.00 30.98 1pvj h PRO 278 CO 0.01 0.00 -0.70 -1.54 -0.21 0.00 0.00 178.00 175.56 1pvj s SER 279 N -4.54 1.03 -0.04 -2.05 1.04 -1.26 -4.29 113.70 103.58 1pvj s SER 279 Ca -0.04 -0.93 0.00 0.00 0.48 0.00 0.00 55.95 55.47 1pvj s SER 279 Cb 0.19 0.09 0.02 0.00 0.10 0.00 0.00 66.02 66.43 1pvj s SER 279 CO 0.65 -0.43 -0.02 -0.44 0.98 0.00 0.00 173.24 173.98 1pvj s SER 280 N -2.78 0.81 0.26 7.02 0.01 -1.26 -4.71 113.70 113.06 1pvj s SER 280 Ca 0.08 -0.08 0.12 0.00 1.31 0.00 0.00 55.95 57.38 1pvj s SER 280 Cb 0.03 -0.35 -0.05 0.00 0.21 0.00 0.00 66.02 65.86 1pvj s SER 280 CO -0.04 -0.09 -0.20 -0.83 0.41 0.00 0.00 173.24 172.48 1pvj s GLY 281 N 1.11 1.82 0.07 3.44 0.00 -0.87 -3.85 107.32 109.04 1pvj s GLY 281 Ca -0.08 -1.83 -0.09 0.00 0.00 0.00 0.00 44.72 42.72 1pvj s GLY 281 CO -0.01 -1.91 0.20 -0.45 0.00 0.00 0.00 173.10 170.92 1pvj s SER 282 N -3.39 0.07 0.38 1.64 0.15 -1.26 -0.32 113.70 110.96 1pvj s SER 282 Ca 0.28 -0.51 0.12 0.00 0.70 0.00 0.00 55.95 56.54 1pvj s SER 282 Cb -0.05 0.32 0.91 0.00 -1.71 0.00 0.00 66.02 65.49 1pvj s SER 282 CO 0.14 -0.65 1.86 0.00 1.20 0.00 0.00 173.24 175.78 1pvj h ALA 283 N 3.06 1.95 0.00 5.45 0.00 -1.90 0.23 119.26 128.06 1pvj h ALA 283 Ca -0.33 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1pvj h ALA 283 Cb 1.20 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1pvj h ALA 283 CO 0.52 -0.22 0.00 0.41 0.00 0.00 0.00 179.25 179.97 1pvj n GLY 284 N -1.46 0.75 0.02 0.00 0.00 -1.26 -3.54 105.19 99.71 1pvj n GLY 284 Ca 0.18 -1.19 -0.01 0.00 0.00 0.00 0.00 46.02 45.01 1pvj n GLY 284 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1pvj n SER 285 N 2.33 -0.06 0.28 1.61 7.64 -1.26 0.48 113.62 124.63 1pvj n SER 285 Ca 0.00 0.10 0.13 0.00 1.01 0.00 0.00 58.87 60.11 1pvj n SER 285 Cb 0.00 -0.01 0.79 0.00 -1.01 0.00 0.00 64.21 63.98 1pvj n SER 285 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1pvj h SER 286 N 0.00 0.00 0.20 6.43 4.64 -1.96 -0.26 113.55 122.60 1pvj h SER 286 Ca 0.01 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.98 1pvj h SER 286 Cb 0.02 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1pvj h SER 286 CO -0.05 0.07 -1.89 0.03 -0.87 0.00 0.00 176.83 174.12 1pvj h ARG 287 N 0.00 0.27 -0.63 4.77 2.47 -0.32 -3.29 114.38 117.64 1pvj h ARG 287 Ca -0.00 -0.46 0.01 0.00 -1.26 0.00 0.00 59.98 58.26 1pvj h ARG 287 Cb 0.16 0.17 -0.03 0.00 -1.65 0.00 0.00 29.97 28.62 1pvj h ARG 287 CO 0.01 1.17 0.41 0.28 0.56 0.00 0.00 179.97 182.40 1pvj h VAL 288 N 0.07 1.15 -0.30 2.04 2.07 -0.67 0.51 116.25 121.12 1pvj h VAL 288 Ca -0.38 -0.29 -0.17 0.00 0.82 0.00 0.00 66.70 66.68 1pvj h VAL 288 Cb 2.05 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 32.05 1pvj h VAL 288 CO 0.11 0.15 -0.48 0.06 0.02 0.00 0.00 177.57 177.43 1pvj h GLN 289 N 0.85 0.86 -0.18 1.57 -0.00 -1.24 -1.92 115.11 115.05 1pvj h GLN 289 Ca 0.23 -0.52 -0.15 0.00 -0.00 0.00 0.00 58.65 58.21 1pvj h GLN 289 Cb -0.09 0.05 -0.01 0.00 -0.00 0.00 0.00 27.48 27.44 1pvj h GLN 289 CO -0.05 1.16 -0.52 -0.09 -0.00 0.00 0.00 178.83 179.33 1pvj h ARG 290 N 0.64 0.49 -0.03 0.06 2.43 -1.57 -3.21 114.38 113.20 1pvj h ARG 290 Ca 0.03 -0.30 -0.01 0.00 -0.81 0.00 0.00 59.98 58.89 1pvj h ARG 290 Cb 1.09 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.67 1pvj h ARG 290 CO 0.11 0.89 -0.03 0.00 -1.51 0.00 0.00 179.97 179.43 1pvj h ALA 291 N 1.05 0.05 -0.72 2.80 0.00 0.07 -2.10 119.26 120.40 1pvj h ALA 291 Ca 0.01 -0.26 0.13 0.00 0.00 0.00 0.00 54.91 54.80 1pvj h ALA 291 Cb 1.04 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.77 1pvj h ALA 291 CO 0.09 -0.18 0.48 -0.07 0.00 0.00 0.00 179.25 179.58 1pvj h LEU 292 N -0.37 0.41 0.00 0.00 3.38 -1.42 -0.15 115.31 117.16 1pvj h LEU 292 Ca 0.01 0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 1pvj h LEU 292 Cb 0.52 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1pvj h LEU 292 CO 0.01 0.22 -0.67 0.11 0.09 0.00 0.00 178.44 178.20 1pvj h LYS 293 N 0.44 0.00 -0.11 1.13 1.57 -1.58 0.26 116.57 118.28 1pvj h LYS 293 Ca 0.35 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.98 1pvj h LYS 293 Cb 0.74 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.06 1pvj h LYS 293 CO -0.11 0.52 -0.52 0.93 -0.57 0.00 0.00 179.45 179.70 1pvj h GLU 294 N -1.00 0.55 0.02 3.15 5.08 -1.40 -2.74 114.58 118.24 1pvj h GLU 294 Ca -0.14 -0.44 -0.22 0.00 -1.00 0.00 0.00 59.36 57.56 1pvj h GLU 294 Cb 0.82 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.13 1pvj h GLU 294 CO -0.08 1.07 -1.17 -0.91 -1.00 0.00 0.00 179.01 176.91 1pvj h ASN 295 N 0.17 0.07 -0.36 1.42 4.21 -1.21 -3.32 115.58 116.54 1pvj h ASN 295 Ca -0.03 -0.63 0.00 0.00 1.21 0.00 0.00 56.30 56.85 1pvj h ASN 295 Cb 1.16 -0.02 0.00 0.00 -1.12 0.00 0.00 38.32 38.34 1pvj h ASN 295 CO 0.11 1.47 0.00 0.49 -1.29 0.00 0.00 177.43 178.21 1pvj n PHE 296 N -4.34 0.47 -1.64 1.19 3.01 -0.80 -0.19 117.46 115.16 1pvj n PHE 296 Ca -0.29 -0.24 -0.13 0.00 1.01 0.00 0.00 57.45 57.81 1pvj n PHE 296 Cb 0.70 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 40.14 1pvj n PHE 296 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1pvj n GLY 297 N 1.36 0.87 3.68 1.37 0.00 -1.03 -4.25 105.19 107.19 1pvj n GLY 297 Ca 0.18 -0.41 -0.29 0.00 0.00 0.00 0.00 46.02 45.49 1pvj n GLY 297 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1pvj s TYR 298 N -2.52 1.33 0.56 1.61 1.51 0.88 -4.96 117.35 115.76 1pvj s TYR 298 Ca 0.00 0.66 -0.21 0.00 -1.01 0.00 0.00 57.07 56.51 1pvj s TYR 298 Cb 0.00 -3.46 -0.04 0.00 -0.11 0.00 0.00 41.96 38.35 1pvj s TYR 298 CO 0.00 -3.28 1.32 1.21 -1.11 0.00 0.00 175.55 173.68 1pvj s ASN 299 N -3.89 5.24 0.40 2.29 3.84 -0.26 -4.62 114.94 117.94 1pvj s ASN 299 Ca 0.69 2.67 0.27 0.00 0.21 0.00 0.00 52.86 56.69 1pvj s ASN 299 Cb -0.12 -2.63 1.45 0.00 -0.55 0.00 0.00 41.25 39.40 1pvj s ASN 299 CO 0.56 -1.58 1.82 1.56 -2.79 0.00 0.00 177.10 176.67 1pvj h GLN 300 N 1.33 0.00 0.00 0.43 1.08 -1.91 -0.50 115.11 115.54 1pvj h GLN 300 Ca -0.51 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 56.68 1pvj h GLN 300 Cb 1.30 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.73 1pvj h GLN 300 CO 0.57 0.00 -0.04 0.66 -0.95 0.00 0.00 178.83 179.07 1pvj h SER 301 N 0.00 0.00 -2.42 1.46 4.64 -1.90 -3.42 113.55 111.90 1pvj h SER 301 Ca 0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 1pvj h SER 301 Cb 0.00 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1pvj h SER 301 CO 0.00 0.04 1.21 -0.69 -0.87 0.00 0.00 176.83 176.52 1pvj s VAL 302 N -3.72 3.21 0.19 0.95 1.01 -0.20 -4.31 120.40 117.53 1pvj s VAL 302 Ca 0.01 0.25 -0.15 0.00 0.00 0.00 0.00 61.98 62.09 1pvj s VAL 302 Cb 0.10 -3.18 0.02 0.00 0.00 0.00 0.00 36.38 33.31 1pvj s VAL 302 CO 0.55 -0.04 0.46 -1.38 0.00 0.00 0.00 175.10 174.69 1pvj s HIS 303 N 4.75 0.04 0.11 5.22 -3.43 -0.16 -4.95 115.29 116.87 1pvj s HIS 303 Ca 0.84 -0.40 -0.07 0.00 -0.80 0.00 0.00 55.06 54.64 1pvj s HIS 303 Cb -0.38 0.26 -0.06 0.00 -1.43 0.00 0.00 32.58 30.98 1pvj s HIS 303 CO 0.37 -0.87 0.37 -1.14 -2.00 0.00 0.00 174.74 171.47 1pvj s GLN 304 N -3.91 3.66 0.02 -0.38 0.74 -1.26 -0.94 119.66 117.59 1pvj s GLN 304 Ca 0.12 -0.00 0.03 0.00 0.05 0.00 0.00 55.36 55.55 1pvj s GLN 304 Cb 0.00 -2.91 -0.01 0.00 1.10 0.00 0.00 33.01 31.18 1pvj s GLN 304 CO -0.01 0.51 -0.09 0.96 -0.55 0.00 0.00 175.29 176.11 1pvj s ILE 305 N -1.54 0.67 -0.17 -2.34 -4.36 0.96 -4.94 121.20 109.48 1pvj s ILE 305 Ca 0.37 -0.64 -0.02 0.00 -0.26 0.00 0.00 60.65 60.10 1pvj s ILE 305 Cb -0.13 -0.62 -0.01 0.00 1.25 0.00 0.00 42.46 42.95 1pvj s ILE 305 CO 0.22 -0.01 -0.08 0.20 0.24 0.00 0.00 174.94 175.51 1pvj s ASN 306 N -0.72 4.25 0.34 4.36 0.01 -1.26 -0.26 114.94 121.66 1pvj s ASN 306 Ca -0.01 -0.32 0.12 0.00 -0.71 0.00 0.00 52.86 51.95 1pvj s ASN 306 Cb -0.06 -1.69 1.08 0.00 0.41 0.00 0.00 41.25 40.99 1pvj s ASN 306 CO 0.00 0.10 1.58 -0.09 -1.51 0.00 0.00 177.10 177.17 1pvj h ARG 307 N 7.24 0.00 0.00 -0.60 9.65 -1.78 0.89 114.38 129.78 1pvj h ARG 307 Ca -0.33 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.55 1pvj h ARG 307 Cb 1.19 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.77 1pvj h ARG 307 CO 0.59 0.00 0.00 0.41 2.80 0.00 0.00 179.97 183.77 1pvj n GLY 308 N -1.37 -0.71 0.88 2.80 0.00 -1.26 -1.85 105.19 103.67 1pvj n GLY 308 Ca 0.31 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.39 1pvj n GLY 308 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1pvj n ASP 309 N -1.26 2.68 -4.28 1.61 8.00 0.31 -4.97 116.55 118.63 1pvj n ASP 309 Ca 0.07 -1.87 -0.16 0.00 0.71 0.00 0.00 54.79 53.54 1pvj n ASP 309 Cb 0.10 -0.11 -0.10 0.00 -0.02 0.00 0.00 41.12 40.99 1pvj n ASP 309 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1pvj s PHE 310 N -1.77 1.40 0.20 1.24 0.40 -0.77 -5.05 117.98 113.62 1pvj s PHE 310 Ca 0.34 -0.79 -0.17 0.00 -0.60 0.00 0.00 56.93 55.71 1pvj s PHE 310 Cb 0.21 -0.74 -0.08 0.00 0.51 0.00 0.00 43.02 42.92 1pvj s PHE 310 CO 0.30 0.07 0.66 -1.54 0.70 0.00 0.00 175.22 175.41 1pvj s SER 311 N -3.23 6.95 0.30 1.36 1.04 -1.26 -4.82 113.70 114.05 1pvj s SER 311 Ca 0.21 1.28 0.02 0.00 0.48 0.00 0.00 55.95 57.94 1pvj s SER 311 Cb 0.03 -2.37 0.76 0.00 0.10 0.00 0.00 66.02 64.54 1pvj s SER 311 CO 0.04 0.05 1.59 0.50 0.98 0.00 0.00 173.24 176.40 1pvj h LYS 312 N 3.41 0.06 -0.42 4.02 3.64 -1.99 0.31 116.57 125.60 1pvj h LYS 312 Ca -0.48 -0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 58.76 1pvj h LYS 312 Cb 1.19 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.99 1pvj h LYS 312 CO 0.65 0.04 -0.25 1.96 -2.27 0.00 0.00 179.45 179.58 1pvj h GLN 313 N 0.06 0.90 -0.17 1.90 7.50 -1.99 -1.81 115.11 121.50 1pvj h GLN 313 Ca 0.59 -0.42 -0.09 0.00 0.50 0.00 0.00 58.65 59.23 1pvj h GLN 313 Cb 1.23 -0.01 -0.01 0.00 0.05 0.00 0.00 27.48 28.73 1pvj h GLN 313 CO -0.83 1.07 -0.30 -0.44 -1.50 0.00 0.00 178.83 176.83 1pvj h ASP 314 N 0.73 0.34 -0.12 1.46 3.45 -1.00 -0.25 116.42 121.02 1pvj h ASP 314 Ca 0.09 -0.12 -0.02 0.00 0.43 0.00 0.00 57.03 57.41 1pvj h ASP 314 Cb 0.83 -0.09 -0.00 0.00 -0.56 0.00 0.00 39.33 39.50 1pvj h ASP 314 CO 0.07 0.63 -0.01 -0.25 -1.57 0.00 0.00 179.24 178.10 1pvj h TRP 315 N 0.29 0.24 -0.64 4.55 2.91 -0.44 -2.48 115.95 120.38 1pvj h TRP 315 Ca 0.04 -0.05 0.00 0.00 1.13 0.00 0.00 58.89 60.02 1pvj h TRP 315 Cb 0.68 -0.06 -0.03 0.00 -0.51 0.00 0.00 29.16 29.24 1pvj h TRP 315 CO 0.02 0.49 0.41 0.93 -1.03 0.00 0.00 178.44 179.26 1pvj h GLU 316 N -0.08 0.85 -0.71 2.65 5.08 -1.12 -1.81 114.58 119.44 1pvj h GLU 316 Ca 0.03 -0.06 0.13 0.00 -1.00 0.00 0.00 59.36 58.46 1pvj h GLU 316 Cb 0.40 -0.19 -0.05 0.00 0.50 0.00 0.00 28.75 29.42 1pvj h GLU 316 CO 0.01 0.58 0.47 0.00 -1.00 0.00 0.00 179.01 179.07 1pvj h ALA 317 N 1.22 2.06 -0.42 3.43 0.00 -0.96 0.29 119.26 124.88 1pvj h ALA 317 Ca 0.23 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 55.04 1pvj h ALA 317 Cb -0.08 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1pvj h ALA 317 CO -0.05 -0.24 -0.11 1.96 0.00 0.00 0.00 179.25 180.81 1pvj h GLN 318 N 0.43 0.82 -0.06 0.00 1.08 -0.86 -1.35 115.11 115.18 1pvj h GLN 318 Ca 0.34 -0.32 -0.13 0.00 -1.45 0.00 0.00 58.65 57.09 1pvj h GLN 318 Cb 0.73 -0.04 0.01 0.00 -0.05 0.00 0.00 27.48 28.12 1pvj h GLN 318 CO -0.11 0.95 -0.46 0.82 -0.95 0.00 0.00 178.83 179.08 1pvj h ILE 319 N 0.64 1.41 -0.73 2.54 2.04 -0.81 -2.74 117.51 119.87 1pvj h ILE 319 Ca 0.11 -1.88 0.06 0.00 1.00 0.00 0.00 64.86 64.15 1pvj h ILE 319 Cb 0.65 2.38 -0.06 0.00 -0.74 0.00 0.00 36.82 39.05 1pvj h ILE 319 CO 0.04 0.55 0.42 0.44 0.00 0.00 0.00 178.15 179.60 1pvj h ASP 320 N -0.06 0.62 -0.47 1.72 3.32 -0.55 -1.25 116.42 119.75 1pvj h ASP 320 Ca -0.04 0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.05 1pvj h ASP 320 Cb 1.14 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 40.56 1pvj h ASP 320 CO 0.09 0.39 0.30 0.50 -1.72 0.00 0.00 179.24 178.81 1pvj h LYS 321 N 0.75 0.59 -0.36 3.56 3.64 -1.23 -0.35 116.57 123.18 1pvj h LYS 321 Ca 0.33 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.71 1pvj h LYS 321 Cb 0.21 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.86 1pvj h LYS 321 CO -0.19 0.39 0.15 0.93 -2.27 0.00 0.00 179.45 178.45 1pvj h GLU 322 N 0.60 0.30 0.00 1.90 4.39 -1.03 -2.22 114.58 118.52 1pvj h GLU 322 Ca 0.18 -0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.81 1pvj h GLU 322 Cb -0.03 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.55 1pvj h GLU 322 CO -0.06 0.20 -0.24 -0.07 -1.16 0.00 0.00 179.01 177.67 1pvj h LEU 323 N 0.31 0.00 -1.71 1.33 3.38 -0.76 -0.83 115.31 117.03 1pvj h LEU 323 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1pvj h LEU 323 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1pvj h LEU 323 CO -0.14 0.24 0.00 0.77 0.09 0.00 0.00 178.44 179.40 1pvj h SER 324 N 0.00 0.00 -0.43 -0.43 4.64 -0.44 -2.13 113.55 114.77 1pvj h SER 324 Ca -0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 1pvj h SER 324 Cb 0.45 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.50 1pvj h SER 324 CO 0.03 0.00 0.05 0.00 -0.87 0.00 0.00 176.83 176.04 1pvj n GLN 325 N -2.88 3.37 -3.86 4.77 6.02 -0.34 -4.95 117.38 119.52 1pvj n GLN 325 Ca -0.00 -3.00 -0.28 0.00 -0.01 0.00 0.00 57.00 53.71 1pvj n GLN 325 Cb 0.21 -2.00 0.00 0.00 1.02 0.00 0.00 30.24 29.47 1pvj n GLN 325 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1pvj n ASN 326 N -0.28 -2.06 -3.71 1.08 3.02 -0.80 -4.95 115.26 107.56 1pvj n ASN 326 Ca 0.28 -1.01 -0.30 0.00 -0.03 0.00 0.00 54.58 53.52 1pvj n ASN 326 Cb 1.07 -3.16 -0.15 0.00 -0.61 0.00 0.00 39.78 36.93 1pvj n ASN 326 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1pvj s GLN 327 N -6.37 0.64 1.01 3.52 -0.21 -1.09 -5.05 119.66 112.10 1pvj s GLN 327 Ca 0.17 -1.00 -0.13 0.00 0.02 0.00 0.00 55.36 54.42 1pvj s GLN 327 Cb -0.06 -1.88 0.12 0.00 1.00 0.00 0.00 33.01 32.19 1pvj s GLN 327 CO 0.88 -0.99 0.67 -2.30 -2.12 0.00 0.00 175.29 171.43 1pvj n PRO 328 N 4.90 -0.91 -5.15 2.91 -0.02 -1.26 -4.04 135.00 131.44 1pvj n PRO 328 Ca -0.03 -0.22 -0.32 0.00 -2.02 0.00 0.00 63.50 60.91 1pvj n PRO 328 Cb 0.42 -2.04 -0.17 0.00 -0.02 0.00 0.00 33.50 31.69 1pvj n PRO 328 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1pvj s VAL 329 N -2.45 2.09 0.20 -1.45 1.01 -0.17 -4.76 120.40 114.88 1pvj s VAL 329 Ca 0.62 -1.00 -0.30 0.00 0.00 0.00 0.00 61.98 61.30 1pvj s VAL 329 Cb -0.21 -1.80 -0.08 0.00 0.00 0.00 0.00 36.38 34.29 1pvj s VAL 329 CO 0.64 0.56 1.08 -0.47 0.00 0.00 0.00 175.10 176.91 1pvj s TYR 330 N 0.39 3.63 0.06 5.22 5.04 -1.11 -1.84 117.35 128.74 1pvj s TYR 330 Ca -0.17 1.65 -0.06 0.00 -2.44 0.00 0.00 57.07 56.05 1pvj s TYR 330 Cb -0.18 -3.24 -0.01 0.00 0.35 0.00 0.00 41.96 38.88 1pvj s TYR 330 CO 0.08 -0.47 0.10 -0.47 -1.34 0.00 0.00 175.55 173.45 1pvj s TYR 331 N -0.48 0.24 0.22 4.97 5.04 -0.53 -1.85 117.35 124.96 1pvj s TYR 331 Ca 0.48 -0.63 -0.23 0.00 -2.44 0.00 0.00 57.07 54.25 1pvj s TYR 331 Cb -0.29 -0.16 0.04 0.00 0.35 0.00 0.00 41.96 41.90 1pvj s TYR 331 CO 0.36 -0.42 0.80 1.14 -1.34 0.00 0.00 175.55 176.08 1pvj s GLN 332 N -3.24 1.51 -0.05 4.97 -2.07 -0.95 -1.11 119.66 118.72 1pvj s GLN 332 Ca 0.00 -0.82 0.04 0.00 -1.82 0.00 0.00 55.36 52.76 1pvj s GLN 332 Cb 0.02 0.53 0.00 0.00 -1.09 0.00 0.00 33.01 32.48 1pvj s GLN 332 CO -0.08 -0.69 -0.17 0.20 -1.32 0.00 0.00 175.29 173.24 1pvj s GLY 333 N -2.90 0.94 0.03 2.60 0.00 -1.12 -2.68 107.32 104.18 1pvj s GLY 333 Ca 0.11 -0.66 -0.18 0.00 0.00 0.00 0.00 44.72 43.99 1pvj s GLY 333 CO 0.04 -0.25 0.52 0.14 0.00 0.00 0.00 173.10 173.55 1pvj s VAL 334 N 0.21 4.87 0.31 1.40 1.01 -0.68 -0.95 120.40 126.57 1pvj s VAL 334 Ca -0.08 1.10 0.06 0.00 0.00 0.00 0.00 61.98 63.06 1pvj s VAL 334 Cb -0.13 -3.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 1pvj s VAL 334 CO 0.03 0.53 0.29 0.61 0.00 0.00 0.00 175.10 176.56 1pvj n GLY 335 N 1.96 2.87 0.00 4.51 0.00 -0.98 -4.64 105.19 108.91 1pvj n GLY 335 Ca -0.11 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.07 1pvj n GLY 335 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1pvj n LYS 336 N -0.58 0.00 0.00 1.61 3.00 -1.26 -2.06 118.16 118.87 1pvj n LYS 336 Ca 0.06 0.45 0.00 0.00 -0.00 0.00 0.00 58.31 58.82 1pvj n LYS 336 Cb 0.56 -1.32 0.00 0.00 0.00 0.00 0.00 35.03 34.27 1pvj n LYS 336 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 1pvj n VAL 337 N -1.68 0.00 0.00 3.15 0.24 -1.26 -4.86 118.33 113.93 1pvj n VAL 337 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1pvj n VAL 337 Cb 0.00 -0.87 0.00 0.00 -1.47 0.00 0.00 33.84 31.50 1pvj n VAL 337 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1pvj n GLY 338 N -0.60 0.18 3.66 7.63 0.00 -0.87 -4.38 105.19 110.81 1pvj n GLY 338 Ca 0.00 -2.29 -0.42 0.00 0.00 0.00 0.00 46.02 43.31 1pvj n GLY 338 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pvj s GLY 339 N 0.00 1.88 -1.30 -0.02 0.00 0.82 -2.33 107.32 106.38 1pvj s GLY 339 Ca 0.00 0.13 -0.10 0.00 0.00 0.00 0.00 44.72 44.75 1pvj s GLY 339 CO 0.00 2.00 1.88 1.42 0.00 0.00 0.00 173.10 178.40 1pvj n HIS 340 N 5.88 3.16 -1.99 1.90 8.25 -0.13 -4.70 115.22 127.60 1pvj n HIS 340 Ca 0.09 -2.85 -0.29 0.00 -0.26 0.00 0.00 57.72 54.42 1pvj n HIS 340 Cb 0.47 -2.04 0.07 0.00 1.12 0.00 0.00 29.99 29.61 1pvj n HIS 340 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1pvj s ALA 341 N 0.82 2.87 0.09 -1.41 0.00 -1.26 -2.78 121.76 120.10 1pvj s ALA 341 Ca 0.41 -0.59 -0.14 0.00 0.00 0.00 0.00 51.96 51.64 1pvj s ALA 341 Cb 0.09 -2.89 0.05 0.00 0.00 0.00 0.00 23.12 20.37 1pvj s ALA 341 CO -0.01 -1.35 0.66 1.97 0.00 0.00 0.00 175.76 177.03 1pvj n PHE 342 N -3.08 -0.93 -5.07 0.00 1.16 -0.27 -4.79 117.46 104.48 1pvj n PHE 342 Ca 0.07 -0.73 -0.30 0.00 -1.87 0.00 0.00 57.45 54.63 1pvj n PHE 342 Cb 0.59 0.35 -0.17 0.00 -1.61 0.00 0.00 39.48 38.65 1pvj n PHE 342 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1pvj s VAL 343 N -2.23 1.81 -0.30 1.97 1.01 -1.04 -1.46 120.40 120.17 1pvj s VAL 343 Ca 0.15 -0.90 -0.10 0.00 0.00 0.00 0.00 61.98 61.13 1pvj s VAL 343 Cb -0.02 -1.56 -0.02 0.00 0.00 0.00 0.00 36.38 34.78 1pvj s VAL 343 CO 0.03 0.51 0.16 -0.63 0.00 0.00 0.00 175.10 175.17 1pvj s ILE 344 N 0.21 4.86 -0.02 2.22 1.01 -0.76 -0.26 121.20 128.45 1pvj s ILE 344 Ca -0.12 -0.19 0.03 0.00 0.00 0.00 0.00 60.65 60.38 1pvj s ILE 344 Cb -0.15 -3.40 0.05 0.00 0.01 0.00 0.00 42.46 38.96 1pvj s ILE 344 CO 0.06 0.15 0.93 -0.90 0.00 0.00 0.00 174.94 175.18 1pvj n ASP 345 N 5.01 0.53 -3.47 3.58 5.75 -0.01 -1.00 116.55 126.94 1pvj n ASP 345 Ca -0.14 -2.00 -0.03 0.00 -0.01 0.00 0.00 54.79 52.61 1pvj n ASP 345 Cb 0.50 -0.19 0.01 0.00 -1.03 0.00 0.00 41.12 40.41 1pvj n ASP 345 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1pvj s GLY 346 N -1.14 0.00 -0.21 6.12 0.00 -1.24 -0.05 107.32 110.81 1pvj s GLY 346 Ca 0.06 -0.17 -0.25 0.00 0.00 0.00 0.00 44.72 44.35 1pvj s GLY 346 CO 0.01 1.73 0.68 0.00 0.00 0.00 0.00 173.10 175.51 1pvj s ALA 347 N -2.46 -1.71 -2.16 3.20 0.00 0.12 -0.26 121.76 118.49 1pvj s ALA 347 Ca 0.19 1.80 0.19 0.00 0.00 0.00 0.00 51.96 54.14 1pvj s ALA 347 Cb -0.02 -0.88 0.82 0.00 0.00 0.00 0.00 23.12 23.04 1pvj s ALA 347 CO 0.04 -0.33 1.57 -0.40 0.00 0.00 0.00 175.76 176.64 1pvj n ASP 348 N 2.32 1.07 0.00 0.00 5.75 -0.83 -1.54 116.55 123.31 1pvj n ASP 348 Ca -0.15 -1.64 0.00 0.00 -0.01 0.00 0.00 54.79 52.99 1pvj n ASP 348 Cb 0.56 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.57 1pvj n ASP 348 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1pvj n GLY 349 N 0.99 2.14 2.19 6.12 0.00 -1.21 -4.74 105.19 110.69 1pvj n GLY 349 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 1pvj n GLY 349 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pvj n ARG 350 N -1.47 2.37 -1.78 1.61 1.74 -1.26 -4.48 116.66 113.39 1pvj n ARG 350 Ca 0.00 -2.83 -0.10 0.00 -0.77 0.00 0.00 57.85 54.15 1pvj n ARG 350 Cb 0.00 -2.11 -0.02 0.00 -1.02 0.00 0.00 32.46 29.31 1pvj n ARG 350 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1pvj n ASN 351 N -0.73 -3.79 -4.39 0.55 5.03 -1.26 -5.03 115.26 105.64 1pvj n ASN 351 Ca 0.55 0.11 -0.31 0.00 0.87 0.00 0.00 54.58 55.80 1pvj n ASN 351 Cb 0.91 -2.65 -0.14 0.00 -1.02 0.00 0.00 39.78 36.87 1pvj n ASN 351 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 1pvj s PHE 352 N -2.45 2.48 -0.02 3.10 0.40 -1.26 -4.71 117.98 115.52 1pvj s PHE 352 Ca 0.00 -0.32 0.03 0.00 -0.60 0.00 0.00 56.93 56.04 1pvj s PHE 352 Cb 0.00 -1.51 -0.03 0.00 0.51 0.00 0.00 43.02 41.98 1pvj s PHE 352 CO 0.00 0.10 -0.08 0.71 0.70 0.00 0.00 175.22 176.65 1pvj s TYR 353 N -0.73 2.85 -0.22 0.36 1.51 0.21 -1.96 117.35 119.37 1pvj s TYR 353 Ca 0.11 -0.05 -0.21 0.00 -1.01 0.00 0.00 57.07 55.91 1pvj s TYR 353 Cb -0.10 -1.63 -0.02 0.00 -0.11 0.00 0.00 41.96 40.10 1pvj s TYR 353 CO 0.01 0.33 0.65 -1.58 -1.11 0.00 0.00 175.55 173.85 1pvj s HIS 354 N -0.91 3.34 -0.01 2.71 2.46 0.64 0.12 115.29 123.64 1pvj s HIS 354 Ca 0.15 0.92 0.03 0.00 0.47 0.00 0.00 55.06 56.63 1pvj s HIS 354 Cb -0.11 -2.84 -0.03 0.00 -0.13 0.00 0.00 32.58 29.46 1pvj s HIS 354 CO 0.05 -0.25 -0.07 0.08 -2.47 0.00 0.00 174.74 172.08 1pvj s VAL 355 N 2.19 3.65 -0.25 0.89 1.01 0.53 -0.83 120.40 127.59 1pvj s VAL 355 Ca 0.29 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 61.56 1pvj s VAL 355 Cb -0.16 -2.57 0.06 0.00 0.00 0.00 0.00 36.38 33.71 1pvj s VAL 355 CO 0.10 0.42 -0.09 0.21 0.00 0.00 0.00 175.10 175.74 1pvj s ASN 356 N -1.33 4.26 0.00 3.32 3.84 0.64 -2.72 114.94 122.95 1pvj s ASN 356 Ca 0.16 -1.32 0.00 0.00 0.21 0.00 0.00 52.86 51.91 1pvj s ASN 356 Cb -0.11 -1.44 0.00 0.00 -0.55 0.00 0.00 41.25 39.15 1pvj s ASN 356 CO 0.07 -0.20 0.82 0.79 -2.79 0.00 0.00 177.10 175.78 1pvj n TRP 357 N 4.50 0.00 -3.66 0.43 7.02 -1.26 -2.49 117.44 121.98 1pvj n TRP 357 Ca -0.13 0.00 -0.31 0.00 -1.02 0.00 0.00 57.50 56.04 1pvj n TRP 357 Cb 0.43 -0.03 0.04 0.00 -2.42 0.00 0.00 31.31 29.33 1pvj n TRP 357 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1pvj n GLY 358 N 0.33 -1.01 0.27 6.99 0.00 -1.26 -4.90 105.19 105.61 1pvj n GLY 358 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.48 1pvj n GLY 358 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1pvj n TRP 359 N -4.11 0.00 0.00 1.61 5.03 -1.17 -4.35 117.44 114.44 1pvj n TRP 359 Ca -0.09 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.44 1pvj n TRP 359 Cb 0.59 0.08 0.00 0.00 -1.03 0.00 0.00 31.31 30.95 1pvj n TRP 359 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 1pvj n GLY 360 N 0.00 1.63 0.00 6.99 0.00 -0.65 -4.10 105.19 109.06 1pvj n GLY 360 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1pvj n GLY 360 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pvj n GLY 361 N -2.00 1.26 3.76 -0.02 0.00 -1.26 -4.90 105.19 102.04 1pvj n GLY 361 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1pvj n GLY 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pvj s VAL 362 N -0.53 2.29 0.00 1.61 0.11 -1.26 -1.68 120.40 120.94 1pvj s VAL 362 Ca 0.00 0.27 0.00 0.00 -2.93 0.00 0.00 61.98 59.32 1pvj s VAL 362 Cb 0.00 -3.17 0.00 0.00 -1.53 0.00 0.00 36.38 31.68 1pvj s VAL 362 CO 0.00 0.05 0.00 -1.20 -3.33 0.00 0.00 175.10 170.62 1pvj n SER 363 N 1.42 0.00 -4.67 3.54 7.64 0.48 -4.77 113.62 117.26 1pvj n SER 363 Ca 0.04 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.58 1pvj n SER 363 Cb 0.39 -0.53 0.12 0.00 -1.01 0.00 0.00 64.21 63.19 1pvj n SER 363 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1pvj n ASP 364 N 0.00 0.90 0.00 6.43 9.92 -0.68 -4.91 116.55 128.22 1pvj n ASP 364 Ca 0.00 0.60 0.00 0.00 -0.53 0.00 0.00 54.79 54.86 1pvj n ASP 364 Cb 0.00 -1.49 0.00 0.00 -0.64 0.00 0.00 41.12 38.99 1pvj n ASP 364 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1pvj n GLY 365 N 0.67 0.16 3.75 0.44 0.00 -1.10 -4.82 105.19 104.29 1pvj n GLY 365 Ca 0.13 -1.43 -0.35 0.00 0.00 0.00 0.00 46.02 44.37 1pvj n GLY 365 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1pvj s PHE 366 N -3.11 3.43 0.18 1.61 0.40 0.02 -0.34 117.98 120.17 1pvj s PHE 366 Ca 0.00 0.36 0.02 0.00 -0.60 0.00 0.00 56.93 56.71 1pvj s PHE 366 Cb 0.00 -2.14 -0.05 0.00 0.51 0.00 0.00 43.02 41.34 1pvj s PHE 366 CO 0.00 0.34 0.00 -0.06 0.70 0.00 0.00 175.22 176.20 1pvj s PHE 367 N 0.22 1.26 -0.03 0.36 0.40 0.12 -0.89 117.98 119.41 1pvj s PHE 367 Ca 0.09 -1.01 -0.12 0.00 -0.60 0.00 0.00 56.93 55.29 1pvj s PHE 367 Cb -0.11 -0.72 -0.05 0.00 0.51 0.00 0.00 43.02 42.65 1pvj s PHE 367 CO -0.01 -0.19 0.32 1.03 0.70 0.00 0.00 175.22 177.07 1pvj s ARG 368 N -3.91 3.75 0.65 0.44 0.52 -0.65 0.66 118.95 120.42 1pvj s ARG 368 Ca 0.25 0.22 0.42 0.00 -0.52 0.00 0.00 55.73 56.10 1pvj s ARG 368 Cb 0.06 -3.19 2.30 0.00 0.52 0.00 0.00 34.95 34.63 1pvj s ARG 368 CO 0.05 0.71 2.34 -0.07 0.02 0.00 0.00 175.30 178.34 1pvj h LEU 369 N 4.71 0.00 -7.21 2.53 3.38 -1.92 -3.44 115.31 113.36 1pvj h LEU 369 Ca -0.52 0.00 0.20 0.00 0.09 0.00 0.00 57.88 57.64 1pvj h LEU 369 Cb 1.22 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.83 1pvj h LEU 369 CO 0.61 0.00 0.62 1.51 0.09 0.00 0.00 178.44 181.27 1pvj s ASP 370 N -5.30 -0.21 0.00 -0.43 3.84 -1.26 -5.02 116.67 108.29 1pvj s ASP 370 Ca -0.05 -0.13 0.23 0.00 -0.00 0.00 0.00 52.55 52.61 1pvj s ASP 370 Cb 0.13 0.32 0.17 0.00 -1.38 0.00 0.00 42.92 42.16 1pvj s ASP 370 CO 0.44 -0.55 1.23 0.00 -0.00 0.00 0.00 175.17 176.28 1pvj n ALA 371 N -0.31 2.54 -1.55 2.11 0.00 -1.26 -5.02 120.51 117.02 1pvj n ALA 371 Ca -0.06 -0.68 -0.42 0.00 0.00 0.00 0.00 53.44 52.28 1pvj n ALA 371 Cb 0.61 -0.79 0.01 0.00 0.00 0.00 0.00 19.45 19.28 1pvj n ALA 371 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1pvj n LEU 372 N 1.21 1.58 -4.79 0.00 4.32 -1.26 -4.00 117.00 114.06 1pvj n LEU 372 Ca 0.13 1.01 -0.36 0.00 -0.02 0.00 0.00 56.01 56.77 1pvj n LEU 372 Cb 0.57 -1.26 -0.07 0.00 -1.62 0.00 0.00 43.42 41.05 1pvj n LEU 372 CO 0.16 -1.98 -0.14 0.21 -1.22 0.00 0.00 177.39 174.42 1pvj s ASN 373 N -0.81 6.33 -0.85 -1.43 3.84 -1.26 -4.81 114.94 115.96 1pvj s ASN 373 Ca 0.63 0.39 -0.22 0.00 0.21 0.00 0.00 52.86 53.87 1pvj s ASN 373 Cb -0.60 -2.10 -0.19 0.00 -0.55 0.00 0.00 41.25 37.81 1pvj s ASN 373 CO 0.57 0.26 2.12 -2.65 -2.79 0.00 0.00 177.10 174.61 1pvj n PRO 374 N 2.89 0.25 0.00 0.43 -0.02 -1.26 -5.04 135.00 132.25 1pvj n PRO 374 Ca -0.17 -1.01 0.00 0.00 -2.02 0.00 0.00 63.50 60.30 1pvj n PRO 374 Cb 0.53 -3.23 0.00 0.00 -0.02 0.00 0.00 33.50 30.78 1pvj n PRO 374 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pvj n GLY 385 N 6.16 -1.63 3.67 -1.23 0.00 -1.26 -5.25 105.19 105.65 1pvj n GLY 385 Ca 0.42 0.90 -0.42 0.00 0.00 0.00 0.00 46.02 46.92 1pvj n GLY 385 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1pvj s PHE 386 N 0.00 1.66 -1.93 1.61 5.36 -1.26 -4.86 117.98 118.56 1pvj s PHE 386 Ca 0.00 -0.25 0.16 0.00 -0.96 0.00 0.00 56.93 55.88 1pvj s PHE 386 Cb 0.00 -4.20 0.19 0.00 -0.34 0.00 0.00 43.02 38.67 1pvj s PHE 386 CO 0.00 -5.19 1.09 0.27 -1.46 0.00 0.00 175.22 169.93 1pvj n ASN 387 N 6.79 2.57 -1.32 6.13 6.94 -1.26 -4.97 115.26 130.14 1pvj n ASN 387 Ca 0.19 -1.75 -0.14 0.00 -0.02 0.00 0.00 54.58 52.86 1pvj n ASN 387 Cb 0.40 -0.07 -0.04 0.00 -2.36 0.00 0.00 39.78 37.71 1pvj n ASN 387 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1pvj n GLY 388 N 0.94 0.80 3.19 4.83 0.00 -1.26 -1.59 105.19 112.10 1pvj n GLY 388 Ca 0.11 -0.32 -0.23 0.00 0.00 0.00 0.00 46.02 45.58 1pvj n GLY 388 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1pvj n TYR 389 N -3.16 -1.89 -0.87 1.61 4.02 -1.26 -1.68 117.16 113.92 1pvj n TYR 389 Ca -0.15 0.50 -0.32 0.00 -0.01 0.00 0.00 57.90 57.91 1pvj n TYR 389 Cb 0.53 -3.76 0.14 0.00 -0.02 0.00 0.00 39.34 36.24 1pvj n TYR 389 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1pvj n GLN 390 N -3.89 -0.17 -3.84 -0.72 6.02 -0.62 -3.54 117.38 110.62 1pvj n GLN 390 Ca -0.07 0.02 -0.04 0.00 -0.01 0.00 0.00 57.00 56.90 1pvj n GLN 390 Cb 0.58 -2.27 0.01 0.00 1.02 0.00 0.00 30.24 29.58 1pvj n GLN 390 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1pvj s SER 391 N -2.28 -0.05 0.20 1.08 1.04 -1.09 -2.17 113.70 110.43 1pvj s SER 391 Ca 0.67 -0.68 -0.23 0.00 0.48 0.00 0.00 55.95 56.20 1pvj s SER 391 Cb -0.25 0.55 0.05 0.00 0.10 0.00 0.00 66.02 66.47 1pvj s SER 391 CO 0.57 -1.08 0.71 0.00 0.98 0.00 0.00 173.24 174.42 1pvj s ALA 392 N -2.50 -1.45 -0.23 5.32 0.00 0.64 -2.24 121.76 121.29 1pvj s ALA 392 Ca 0.18 0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.28 1pvj s ALA 392 Cb -0.03 0.81 0.04 0.00 0.00 0.00 0.00 23.12 23.94 1pvj s ALA 392 CO 0.05 -0.91 -0.12 0.08 0.00 0.00 0.00 175.76 174.86 1pvj s VAL 393 N -3.73 2.39 0.45 0.00 1.01 -0.77 -0.03 120.40 119.72 1pvj s VAL 393 Ca 0.07 -1.22 0.05 0.00 0.00 0.00 0.00 61.98 60.88 1pvj s VAL 393 Cb -0.03 -2.22 -0.05 0.00 0.00 0.00 0.00 36.38 34.08 1pvj s VAL 393 CO -0.02 0.22 0.04 0.68 0.00 0.00 0.00 175.10 176.02 1pvj s VAL 394 N 1.24 1.69 -0.44 2.92 -7.23 -0.11 -2.76 120.40 115.70 1pvj s VAL 394 Ca -0.02 -1.95 0.00 0.00 -1.81 0.00 0.00 61.98 58.21 1pvj s VAL 394 Cb -0.17 -2.64 0.00 0.00 0.56 0.00 0.00 36.38 34.13 1pvj s VAL 394 CO -0.07 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.33 1pvj n GLY 395 N -1.15 0.20 3.53 2.32 0.00 -1.26 -0.99 105.19 107.85 1pvj n GLY 395 Ca -0.10 -0.69 -0.42 0.00 0.00 0.00 0.00 46.02 44.81 1pvj n GLY 395 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pvj s ILE 396 N -2.25 4.09 0.00 -0.61 1.01 -1.26 -1.96 121.20 120.22 1pvj s ILE 396 Ca 0.00 0.39 -0.29 0.00 0.00 0.00 0.00 60.65 60.75 1pvj s ILE 396 Cb 0.00 -4.72 0.07 0.00 0.01 0.00 0.00 42.46 37.82 1pvj s ILE 396 CO 0.00 -1.44 0.66 -1.59 0.00 0.00 0.00 174.94 172.57 1pvj s LYS 397 N 4.74 1.11 0.00 2.79 -2.85 -1.26 -4.82 119.74 119.45 1pvj s LYS 397 Ca 0.34 0.08 0.00 0.00 -1.00 0.00 0.00 55.97 55.39 1pvj s LYS 397 Cb -0.11 0.52 0.00 0.00 -2.06 0.00 0.00 37.83 36.18 1pvj s LYS 397 CO 0.18 -0.38 0.15 -2.30 0.10 0.00 0.00 175.35 173.10