#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o1v n PHE 2 N 0.00 -1.97 -3.80 0.00 3.72 -1.26 -4.63 117.46 109.52 1o1v n PHE 2 Ca 0.00 0.71 -0.12 0.00 -0.05 0.00 0.00 57.45 57.98 1o1v n PHE 2 Cb 0.00 -4.00 -0.09 0.00 -0.94 0.00 0.00 39.48 34.45 1o1v n PHE 2 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1o1v s THR 3 N -3.59 0.06 0.00 4.37 2.01 -1.26 -2.59 115.64 114.65 1o1v s THR 3 Ca 0.22 -0.51 0.00 0.00 0.31 0.00 0.00 61.69 61.71 1o1v s THR 3 Cb -0.06 -0.53 0.00 0.00 0.01 0.00 0.00 72.50 71.92 1o1v s THR 3 CO 0.82 -0.28 0.00 0.61 -0.69 0.00 0.00 174.62 175.08 1o1v n GLY 4 N 1.49 -2.18 3.90 4.40 0.00 0.22 -4.79 105.19 108.23 1o1v n GLY 4 Ca -0.21 -1.61 -0.28 0.00 0.00 0.00 0.00 46.02 43.91 1o1v n GLY 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o1v s LYS 5 N -0.22 3.53 -0.23 1.61 1.02 -0.50 -1.62 119.74 123.33 1o1v s LYS 5 Ca 0.00 0.34 -0.03 0.00 0.02 0.00 0.00 55.97 56.29 1o1v s LYS 5 Cb 0.00 -2.29 0.12 0.00 -0.52 0.00 0.00 37.83 35.14 1o1v s LYS 5 CO 0.00 -0.32 0.35 -0.06 -0.92 0.00 0.00 175.35 174.40 1o1v s PHE 6 N -2.87 -0.73 -1.11 3.18 0.08 0.11 -2.84 117.98 113.81 1o1v s PHE 6 Ca 0.50 0.75 -0.21 0.00 0.12 0.00 0.00 56.93 58.08 1o1v s PHE 6 Cb -0.10 -0.04 0.04 0.00 -0.57 0.00 0.00 43.02 42.35 1o1v s PHE 6 CO 0.47 -0.69 1.60 -2.00 -0.10 0.00 0.00 175.22 174.51 1o1v s GLU 7 N 2.51 3.59 0.30 0.44 2.12 -0.39 -0.45 118.70 126.82 1o1v s GLU 7 Ca 0.11 -1.34 -0.30 0.00 0.36 0.00 0.00 54.97 53.80 1o1v s GLU 7 Cb -0.15 -5.39 -0.11 0.00 0.26 0.00 0.00 34.13 28.74 1o1v s GLU 7 CO -0.15 -2.40 1.53 1.41 -0.54 0.00 0.00 175.26 175.11 1o1v s MET 8 N 4.96 4.16 0.00 4.30 -2.45 -0.37 -2.79 119.30 127.11 1o1v s MET 8 Ca 0.51 2.50 0.00 0.00 -1.25 0.00 0.00 55.69 57.46 1o1v s MET 8 Cb 0.01 -3.03 0.00 0.00 1.25 0.00 0.00 34.83 33.05 1o1v s MET 8 CO -0.02 -0.55 0.00 -0.85 1.05 0.00 0.00 175.02 174.65 1o1v n GLU 9 N 1.86 0.00 -3.75 4.11 0.28 -0.52 -3.21 120.64 119.41 1o1v n GLU 9 Ca 0.06 0.00 -0.35 0.00 -0.16 0.00 0.00 57.16 56.71 1o1v n GLU 9 Cb 0.38 -0.09 -0.08 0.00 1.43 0.00 0.00 31.44 33.09 1o1v n GLU 9 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1o1v s SER 10 N -2.35 6.20 0.23 -1.84 0.15 -1.23 -4.97 113.70 109.89 1o1v s SER 10 Ca 0.00 0.24 -0.05 0.00 0.70 0.00 0.00 55.95 56.84 1o1v s SER 10 Cb 0.00 -2.08 -0.02 0.00 -1.71 0.00 0.00 66.02 62.20 1o1v s SER 10 CO 0.00 0.20 0.29 -1.61 1.20 0.00 0.00 173.24 173.31 1o1v s GLU 11 N 0.26 1.39 0.15 5.44 8.01 -1.26 -1.52 118.70 131.16 1o1v s GLU 11 Ca 0.08 -1.50 0.03 0.00 0.01 0.00 0.00 54.97 53.60 1o1v s GLU 11 Cb -0.11 0.36 -0.05 0.00 -4.31 0.00 0.00 34.13 30.02 1o1v s GLU 11 CO -0.01 -0.52 -0.07 0.15 0.01 0.00 0.00 175.26 174.82 1o1v s LYS 12 N -4.03 1.06 -1.64 1.61 1.02 -1.22 -4.85 119.74 111.69 1o1v s LYS 12 Ca 0.32 -1.47 -0.12 0.00 0.02 0.00 0.00 55.97 54.72 1o1v s LYS 12 Cb 0.03 -0.49 0.11 0.00 -0.52 0.00 0.00 37.83 36.96 1o1v s LYS 12 CO 0.12 0.01 0.54 0.09 -0.92 0.00 0.00 175.35 175.18 1o1v n ASN 13 N -0.20 -1.66 0.20 2.83 4.13 -1.26 -4.44 115.26 114.86 1o1v n ASN 13 Ca -0.09 -1.09 -0.09 0.00 1.68 0.00 0.00 54.58 54.99 1o1v n ASN 13 Cb 0.61 -2.46 -0.04 0.00 -1.54 0.00 0.00 39.78 36.35 1o1v n ASN 13 CO 0.00 0.00 0.00 0.22 0.28 0.00 0.00 177.26 177.76 1o1v h TYR 14 N -1.53 -0.53 -0.93 3.10 5.03 -1.95 -0.62 116.97 119.54 1o1v h TYR 14 Ca -0.61 -0.01 0.02 0.00 2.58 0.00 0.00 58.73 60.70 1o1v h TYR 14 Cb 1.39 0.18 -0.05 0.00 1.55 0.00 0.00 36.73 39.79 1o1v h TYR 14 CO 0.59 -0.33 0.61 0.38 -1.32 0.00 0.00 178.16 178.10 1o1v h ASP 15 N -1.14 1.05 0.07 -2.11 2.03 -1.96 -0.57 116.42 113.79 1o1v h ASP 15 Ca -0.06 -0.02 -0.00 0.00 -0.73 0.00 0.00 57.03 56.22 1o1v h ASP 15 Cb 0.44 -0.26 0.00 0.00 -0.83 0.00 0.00 39.33 38.69 1o1v h ASP 15 CO 0.10 0.75 -0.04 -0.08 -1.03 0.00 0.00 179.24 178.94 1o1v h GLU 16 N 1.23 -0.09 -0.40 4.15 4.57 -1.95 0.96 114.58 123.05 1o1v h GLU 16 Ca 0.35 0.01 0.04 0.00 -1.18 0.00 0.00 59.36 58.57 1o1v h GLU 16 Cb -0.10 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.48 1o1v h GLU 16 CO -0.09 0.12 0.18 0.35 -1.18 0.00 0.00 179.01 178.40 1o1v h PHE 17 N -0.30 0.33 -0.23 0.92 3.57 -0.68 -1.23 116.94 119.31 1o1v h PHE 17 Ca -0.01 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 1o1v h PHE 17 Cb 0.26 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 1o1v h PHE 17 CO -0.01 0.16 0.02 0.52 -2.23 0.00 0.00 178.31 176.78 1o1v h MET 18 N 0.37 0.40 -0.64 1.11 2.86 -1.03 0.15 114.93 118.14 1o1v h MET 18 Ca 0.18 -0.11 0.13 0.00 -2.06 0.00 0.00 59.70 57.83 1o1v h MET 18 Cb 0.11 -0.04 -0.09 0.00 0.06 0.00 0.00 31.60 31.63 1o1v h MET 18 CO -0.14 0.55 0.13 -0.22 1.06 0.00 0.00 176.91 178.29 1o1v h LYS 19 N 0.19 0.24 -0.41 1.72 1.63 -0.50 -0.14 116.57 119.30 1o1v h LYS 19 Ca 0.07 -0.01 -0.14 0.00 -0.85 0.00 0.00 60.65 59.72 1o1v h LYS 19 Cb 0.36 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.92 1o1v h LYS 19 CO 0.01 0.16 -0.29 -0.07 -3.45 0.00 0.00 179.45 175.81 1o1v h LEU 20 N 0.25 0.92 -2.00 5.20 3.38 -0.85 -1.76 115.31 120.45 1o1v h LEU 20 Ca 0.34 -0.37 0.13 0.00 0.09 0.00 0.00 57.88 58.07 1o1v h LEU 20 Cb 0.54 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1o1v h LEU 20 CO -0.44 1.13 0.33 0.25 0.09 0.00 0.00 178.44 179.80 1o1v h LEU 21 N 0.75 0.00 0.00 1.67 5.85 0.83 -3.46 115.31 120.95 1o1v h LEU 21 Ca 0.09 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.81 1o1v h LEU 21 Cb 0.85 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.88 1o1v h LEU 21 CO 0.07 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.78 1o1v n GLY 22 N -1.62 0.76 3.02 3.75 0.00 -0.22 -4.79 105.19 106.09 1o1v n GLY 22 Ca 0.08 -0.70 -0.09 0.00 0.00 0.00 0.00 46.02 45.31 1o1v n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1o1v s ILE 23 N -1.05 0.12 0.75 -0.61 -1.09 -1.20 -3.36 121.20 114.76 1o1v s ILE 23 Ca 0.00 -1.01 -0.11 0.00 -2.23 0.00 0.00 60.65 57.29 1o1v s ILE 23 Cb 0.00 -0.49 0.04 0.00 -1.58 0.00 0.00 42.46 40.43 1o1v s ILE 23 CO 0.00 -0.56 1.09 -0.55 -1.23 0.00 0.00 174.94 173.70 1o1v s SER 24 N -1.69 5.02 -0.04 3.58 0.15 -1.26 -4.69 113.70 114.77 1o1v s SER 24 Ca -0.12 1.24 -0.25 0.00 0.70 0.00 0.00 55.95 57.51 1o1v s SER 24 Cb -0.07 -2.01 -0.21 0.00 -1.71 0.00 0.00 66.02 62.02 1o1v s SER 24 CO -0.02 -1.62 1.12 -1.28 1.20 0.00 0.00 173.24 172.64 1o1v h SER 25 N -0.85 0.12 -0.73 5.45 0.87 -2.01 -2.82 113.55 113.58 1o1v h SER 25 Ca -0.46 -0.66 0.12 0.00 -1.23 0.00 0.00 61.79 59.57 1o1v h SER 25 Cb 1.26 -0.03 -0.09 0.00 -0.44 0.00 0.00 62.40 63.10 1o1v h SER 25 CO 0.61 0.76 0.31 -2.24 -0.53 0.00 0.00 176.83 175.74 1o1v h ASP 26 N -0.52 0.33 0.06 6.23 2.03 -1.99 0.11 116.42 122.68 1o1v h ASP 26 Ca -0.01 0.09 -0.13 0.00 -0.73 0.00 0.00 57.03 56.25 1o1v h ASP 26 Cb 0.75 0.05 -0.01 0.00 -0.83 0.00 0.00 39.33 39.29 1o1v h ASP 26 CO 0.02 0.16 -0.43 -0.37 -1.03 0.00 0.00 179.24 177.58 1o1v h VAL 27 N 0.49 1.31 0.33 4.15 -1.51 -1.97 -0.77 116.25 118.28 1o1v h VAL 27 Ca 0.39 -1.61 -0.01 0.00 -1.23 0.00 0.00 66.70 64.23 1o1v h VAL 27 Cb 0.53 1.64 -0.01 0.00 -2.13 0.00 0.00 31.29 31.32 1o1v h VAL 27 CO -0.35 0.50 -0.22 0.40 -1.23 0.00 0.00 177.57 176.67 1o1v h ILE 28 N 0.38 0.55 -0.05 7.19 2.04 -0.68 0.21 117.51 127.15 1o1v h ILE 28 Ca 0.03 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.92 1o1v h ILE 28 Cb 0.92 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 1o1v h ILE 28 CO 0.08 0.00 -0.12 -0.33 0.00 0.00 0.00 178.15 177.77 1o1v h GLU 29 N -0.53 -0.18 -0.50 2.37 4.39 -0.60 0.88 114.58 120.41 1o1v h GLU 29 Ca -0.03 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.68 1o1v h GLU 29 Cb 0.45 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.11 1o1v h GLU 29 CO 0.03 -0.12 0.30 0.87 -1.16 0.00 0.00 179.01 178.93 1o1v h LYS 30 N -0.19 0.69 -0.71 2.33 1.57 -1.07 -2.01 116.57 117.17 1o1v h LYS 30 Ca 0.06 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1o1v h LYS 30 Cb 0.27 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 1o1v h LYS 30 CO -0.16 0.51 0.38 0.00 -0.57 0.00 0.00 179.45 179.61 1o1v h ALA 31 N 1.14 0.92 0.08 3.86 0.00 0.16 0.90 119.26 126.33 1o1v h ALA 31 Ca 0.18 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1o1v h ALA 31 Cb -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1o1v h ALA 31 CO -0.03 0.44 -0.04 0.00 0.00 0.00 0.00 179.25 179.62 1o1v h ARG 32 N 0.99 -0.11 -0.86 0.00 3.08 -0.53 -2.55 114.38 114.39 1o1v h ARG 32 Ca 0.25 0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.40 1o1v h ARG 32 Cb 0.06 0.02 -0.07 0.00 0.08 0.00 0.00 29.97 30.06 1o1v h ARG 32 CO -0.04 0.07 0.51 -0.91 -1.07 0.00 0.00 179.97 178.53 1o1v h ASN 33 N -0.26 0.74 -4.30 7.04 4.21 -1.13 -3.42 115.58 118.46 1o1v h ASN 33 Ca -0.01 0.04 -0.50 0.00 1.21 0.00 0.00 56.30 57.05 1o1v h ASN 33 Cb 0.22 -0.10 0.04 0.00 -1.12 0.00 0.00 38.32 37.37 1o1v h ASN 33 CO 0.02 0.42 0.40 0.12 -1.29 0.00 0.00 177.43 177.11 1o1v s PHE 34 N -6.02 3.56 -0.31 1.19 5.36 0.29 -5.04 117.98 117.01 1o1v s PHE 34 Ca -0.12 1.35 -0.14 0.00 -0.96 0.00 0.00 56.93 57.06 1o1v s PHE 34 Cb 0.20 -2.75 -0.03 0.00 -0.34 0.00 0.00 43.02 40.10 1o1v s PHE 34 CO 0.79 -0.58 0.34 0.15 -1.46 0.00 0.00 175.22 174.46 1o1v s LYS 35 N -4.78 3.78 -0.51 10.12 1.02 -1.26 -4.83 119.74 123.27 1o1v s LYS 35 Ca 0.56 -0.24 -0.27 0.00 0.02 0.00 0.00 55.97 56.04 1o1v s LYS 35 Cb -0.11 -3.73 -0.01 0.00 -0.52 0.00 0.00 37.83 33.46 1o1v s LYS 35 CO 0.46 -0.39 1.72 0.42 -0.92 0.00 0.00 175.35 176.64 1o1v s ILE 36 N 2.00 3.52 -0.96 2.17 1.01 -1.20 -4.81 121.20 122.93 1o1v s ILE 36 Ca 0.12 0.43 -0.24 0.00 0.00 0.00 0.00 60.65 60.96 1o1v s ILE 36 Cb -0.16 -3.99 0.02 0.00 0.01 0.00 0.00 42.46 38.34 1o1v s ILE 36 CO 0.11 -0.82 1.61 -0.69 0.00 0.00 0.00 174.94 175.15 1o1v s VAL 37 N 7.57 3.75 0.49 2.92 1.01 -0.97 -1.24 120.40 133.92 1o1v s VAL 37 Ca 0.67 -0.56 -0.23 0.00 0.00 0.00 0.00 61.98 61.86 1o1v s VAL 37 Cb -0.15 -4.69 -0.07 0.00 0.00 0.00 0.00 36.38 31.48 1o1v s VAL 37 CO 0.26 -1.59 1.27 -0.89 0.00 0.00 0.00 175.10 174.15 1o1v s THR 38 N 6.75 2.59 0.01 3.92 2.01 0.41 -2.68 115.64 128.65 1o1v s THR 38 Ca 0.54 0.46 -0.00 0.00 0.31 0.00 0.00 61.69 62.99 1o1v s THR 38 Cb -0.03 -3.24 -0.01 0.00 0.01 0.00 0.00 72.50 69.23 1o1v s THR 38 CO -0.05 0.01 -0.02 -0.70 -0.69 0.00 0.00 174.62 173.17 1o1v s GLU 39 N -2.71 0.23 0.02 4.92 2.12 -0.90 0.09 118.70 122.47 1o1v s GLU 39 Ca 0.66 -0.45 -0.04 0.00 0.36 0.00 0.00 54.97 55.50 1o1v s GLU 39 Cb -0.35 0.08 -0.01 0.00 0.26 0.00 0.00 34.13 34.11 1o1v s GLU 39 CO 0.43 -0.04 0.05 0.08 -0.54 0.00 0.00 175.26 175.24 1o1v s VAL 40 N -1.08 0.12 -0.49 3.70 1.01 -0.64 -0.34 120.40 122.68 1o1v s VAL 40 Ca -0.12 -0.99 0.05 0.00 0.00 0.00 0.00 61.98 60.92 1o1v s VAL 40 Cb -0.07 -0.61 0.18 0.00 0.00 0.00 0.00 36.38 35.88 1o1v s VAL 40 CO -0.01 -0.54 0.42 0.00 0.00 0.00 0.00 175.10 174.97 1o1v n GLN 41 N 1.17 0.75 -1.65 2.72 6.02 -0.94 -0.61 117.38 124.85 1o1v n GLN 41 Ca -0.21 -3.57 -0.38 0.00 -0.01 0.00 0.00 57.00 52.83 1o1v n GLN 41 Cb 0.57 -1.80 0.04 0.00 1.02 0.00 0.00 30.24 30.07 1o1v n GLN 41 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 1o1v n GLN 42 N 2.38 1.16 -2.94 -1.09 7.27 -1.07 -2.79 117.38 120.30 1o1v n GLN 42 Ca 0.27 0.44 -0.14 0.00 0.07 0.00 0.00 57.00 57.63 1o1v n GLN 42 Cb 0.45 -2.25 0.02 0.00 2.41 0.00 0.00 30.24 30.87 1o1v n GLN 42 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 1o1v n ASP 43 N -0.65 -1.14 -3.30 1.69 2.03 0.57 -4.90 116.55 110.85 1o1v n ASP 43 Ca 0.12 -3.26 -0.11 0.00 0.52 0.00 0.00 54.79 52.07 1o1v n ASP 43 Cb 0.45 0.76 0.00 0.00 -0.72 0.00 0.00 41.12 41.61 1o1v n ASP 43 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1o1v n GLY 44 N 0.78 -1.19 3.43 0.27 0.00 -1.26 -2.20 105.19 105.02 1o1v n GLY 44 Ca 0.15 0.63 0.00 0.00 0.00 0.00 0.00 46.02 46.80 1o1v n GLY 44 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1o1v n GLN 45 N -1.81 0.00 -2.10 1.61 3.00 -1.26 -4.97 117.38 111.85 1o1v n GLN 45 Ca -0.10 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.58 1o1v n GLN 45 Cb 0.57 0.00 -0.01 0.00 0.00 0.00 0.00 30.24 30.80 1o1v n GLN 45 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1o1v s ASP 46 N 0.00 6.38 -0.30 1.08 2.15 -0.93 -2.40 116.67 122.64 1o1v s ASP 46 Ca 0.00 1.45 -0.01 0.00 0.43 0.00 0.00 52.55 54.42 1o1v s ASP 46 Cb 0.00 -2.47 0.13 0.00 -0.30 0.00 0.00 42.92 40.28 1o1v s ASP 46 CO 0.00 -0.75 0.25 -0.36 -0.17 0.00 0.00 175.17 174.14 1o1v s PHE 47 N -2.95 -0.15 -1.08 -5.34 0.40 -0.79 -0.32 117.98 107.75 1o1v s PHE 47 Ca 0.56 -0.54 -0.22 0.00 -0.60 0.00 0.00 56.93 56.13 1o1v s PHE 47 Cb -0.11 -0.61 0.03 0.00 0.51 0.00 0.00 43.02 42.85 1o1v s PHE 47 CO 0.45 -0.90 1.61 0.99 0.70 0.00 0.00 175.22 178.07 1o1v s THR 48 N 2.10 3.88 0.45 0.64 2.01 -1.12 -3.11 115.64 120.49 1o1v s THR 48 Ca 0.11 -0.98 -0.08 0.00 0.31 0.00 0.00 61.69 61.05 1o1v s THR 48 Cb -0.15 -4.92 -0.05 0.00 0.01 0.00 0.00 72.50 67.39 1o1v s THR 48 CO -0.29 -1.77 0.79 0.86 -0.69 0.00 0.00 174.62 173.52 1o1v s TRP 49 N 5.83 3.52 0.10 4.92 -0.11 -0.35 -2.21 118.94 130.65 1o1v s TRP 49 Ca 0.52 0.94 -0.06 0.00 1.22 0.00 0.00 56.10 58.73 1o1v s TRP 49 Cb -0.00 -2.38 -0.02 0.00 -1.50 0.00 0.00 33.47 29.57 1o1v s TRP 49 CO -0.03 -0.21 0.13 -1.12 -4.62 0.00 0.00 176.95 171.10 1o1v s SER 50 N -3.64 0.23 -0.04 5.86 0.01 0.54 -1.53 113.70 115.13 1o1v s SER 50 Ca 0.49 -0.85 -0.02 0.00 1.31 0.00 0.00 55.95 56.89 1o1v s SER 50 Cb -0.10 0.31 0.03 0.00 0.21 0.00 0.00 66.02 66.47 1o1v s SER 50 CO 0.39 -0.72 0.05 -1.10 0.41 0.00 0.00 173.24 172.27 1o1v s GLN 51 N -3.92 -0.04 -0.23 12.44 -1.52 -0.63 -2.13 119.66 123.64 1o1v s GLN 51 Ca 0.10 0.33 -0.08 0.00 -1.95 0.00 0.00 55.36 53.75 1o1v s GLN 51 Cb 0.06 -0.48 -0.04 0.00 -0.22 0.00 0.00 33.01 32.33 1o1v s GLN 51 CO -0.07 -0.29 0.10 -1.01 -0.25 0.00 0.00 175.29 173.76 1o1v s HIS 52 N 1.92 3.19 0.08 0.91 3.76 -1.09 -1.52 115.29 122.55 1o1v s HIS 52 Ca 0.02 -0.07 -0.16 0.00 -0.15 0.00 0.00 55.06 54.70 1o1v s HIS 52 Cb -0.12 -2.21 0.03 0.00 1.11 0.00 0.00 32.58 31.39 1o1v s HIS 52 CO -0.03 -0.09 0.37 1.52 -0.85 0.00 0.00 174.74 175.66 1o1v s TYR 53 N 1.13 -0.18 -0.39 1.40 1.13 -0.12 -2.28 117.35 118.04 1o1v s TYR 53 Ca 0.05 -0.01 -0.30 0.00 -1.41 0.00 0.00 57.07 55.41 1o1v s TYR 53 Cb -0.14 0.19 0.04 0.00 -1.10 0.00 0.00 41.96 40.95 1o1v s TYR 53 CO 0.04 -0.61 0.55 0.43 -2.51 0.00 0.00 175.55 173.46 1o1v n SER 54 N 0.20 -6.13 -0.93 -0.18 7.64 -1.26 0.49 113.62 113.45 1o1v n SER 54 Ca -0.17 0.08 -0.10 0.00 1.01 0.00 0.00 58.87 59.69 1o1v n SER 54 Cb 0.61 -2.40 -0.03 0.00 -1.01 0.00 0.00 64.21 61.38 1o1v n SER 54 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1o1v n GLY 55 N 0.00 0.68 2.51 0.23 0.00 -1.26 -3.25 105.19 104.10 1o1v n GLY 55 Ca -0.04 -0.53 -0.20 0.00 0.00 0.00 0.00 46.02 45.25 1o1v n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o1v n GLY 56 N -1.45 1.01 3.77 -0.02 0.00 -0.80 -4.95 105.19 102.75 1o1v n GLY 56 Ca -0.11 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.48 1o1v n GLY 56 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1o1v s HIS 57 N -2.86 2.64 -0.00 1.61 3.76 0.18 -4.25 115.29 116.37 1o1v s HIS 57 Ca 0.00 1.27 -0.01 0.00 -0.15 0.00 0.00 55.06 56.17 1o1v s HIS 57 Cb 0.00 -3.89 -0.04 0.00 1.11 0.00 0.00 32.58 29.76 1o1v s HIS 57 CO 0.00 -2.69 0.09 0.99 -0.85 0.00 0.00 174.74 172.29 1o1v s THR 58 N -1.17 4.82 0.06 1.30 2.01 -1.26 -0.95 115.64 120.45 1o1v s THR 58 Ca 0.55 -0.38 0.05 0.00 0.31 0.00 0.00 61.69 62.22 1o1v s THR 58 Cb -0.43 -3.21 -0.03 0.00 0.01 0.00 0.00 72.50 68.84 1o1v s THR 58 CO 0.57 0.35 -0.13 -0.32 -0.69 0.00 0.00 174.62 174.40 1o1v s MET 59 N -1.76 0.79 -0.57 4.92 0.00 -0.57 -5.00 119.30 117.11 1o1v s MET 59 Ca 0.23 -0.88 0.04 0.00 0.00 0.00 0.00 55.69 55.08 1o1v s MET 59 Cb -0.12 -0.77 0.16 0.00 0.00 0.00 0.00 34.83 34.10 1o1v s MET 59 CO 0.15 0.17 0.39 0.99 0.00 0.00 0.00 175.02 176.72 1o1v s THR 60 N -1.19 2.02 0.73 10.11 2.01 -1.26 -1.61 115.64 126.44 1o1v s THR 60 Ca -0.02 -3.51 -0.11 0.00 0.31 0.00 0.00 61.69 58.36 1o1v s THR 60 Cb -0.09 -2.35 0.03 0.00 0.01 0.00 0.00 72.50 70.09 1o1v s THR 60 CO 0.02 -1.02 1.08 0.21 -0.69 0.00 0.00 174.62 174.22 1o1v s ASN 61 N -0.68 4.96 -0.01 3.53 3.84 -0.58 -4.87 114.94 121.13 1o1v s ASN 61 Ca 0.25 1.72 -0.18 0.00 0.21 0.00 0.00 52.86 54.86 1o1v s ASN 61 Cb -0.08 -2.51 0.03 0.00 -0.55 0.00 0.00 41.25 38.14 1o1v s ASN 61 CO -0.13 -1.73 0.39 -1.59 -2.79 0.00 0.00 177.10 171.26 1o1v s LYS 62 N -4.95 0.77 0.14 0.43 -2.85 -1.26 -1.21 119.74 110.82 1o1v s LYS 62 Ca 0.60 -0.13 -0.25 0.00 -1.00 0.00 0.00 55.97 55.19 1o1v s LYS 62 Cb -0.16 0.35 0.07 0.00 -2.06 0.00 0.00 37.83 36.03 1o1v s LYS 62 CO 0.55 -0.23 1.00 -0.59 0.10 0.00 0.00 175.35 176.18 1o1v s PHE 63 N -1.44 -0.10 -0.02 1.78 -0.71 -1.18 -4.90 117.98 111.40 1o1v s PHE 63 Ca -0.12 -0.19 0.07 0.00 -1.04 0.00 0.00 56.93 55.64 1o1v s PHE 63 Cb -0.04 0.64 -0.02 0.00 -1.21 0.00 0.00 43.02 42.39 1o1v s PHE 63 CO 0.05 -0.78 -0.22 0.95 -1.34 0.00 0.00 175.22 173.87 1o1v s THR 64 N -3.12 1.77 0.53 -4.49 -4.23 -1.26 -1.89 115.64 102.95 1o1v s THR 64 Ca 0.13 -0.95 -0.16 0.00 -1.18 0.00 0.00 61.69 59.53 1o1v s THR 64 Cb -0.01 -1.48 -0.07 0.00 1.34 0.00 0.00 72.50 72.29 1o1v s THR 64 CO 0.02 0.50 1.01 0.68 -0.54 0.00 0.00 174.62 176.29 1o1v s VAL 65 N -0.44 4.31 0.00 2.29 -7.23 -1.01 -2.71 120.40 115.62 1o1v s VAL 65 Ca 0.06 1.12 0.00 0.00 -1.81 0.00 0.00 61.98 61.35 1o1v s VAL 65 Cb -0.09 -3.62 0.00 0.00 0.56 0.00 0.00 36.38 33.23 1o1v s VAL 65 CO -0.00 -0.62 0.00 0.61 -0.31 0.00 0.00 175.10 174.78 1o1v n GLY 66 N -1.37 0.43 3.22 2.32 0.00 0.06 -4.96 105.19 104.89 1o1v n GLY 66 Ca 0.07 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.99 1o1v n GLY 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o1v s LYS 67 N -0.61 1.06 0.47 1.61 1.02 -1.10 -5.02 119.74 117.17 1o1v s LYS 67 Ca 0.00 -1.42 -0.03 0.00 0.02 0.00 0.00 55.97 54.54 1o1v s LYS 67 Cb 0.00 0.29 -0.02 0.00 -0.52 0.00 0.00 37.83 37.58 1o1v s LYS 67 CO 0.00 -0.34 0.74 -1.21 -0.92 0.00 0.00 175.35 173.62 1o1v s GLU 68 N -4.05 3.30 -0.11 1.68 8.01 -1.26 -3.57 118.70 122.70 1o1v s GLU 68 Ca 0.26 -0.09 -0.22 0.00 0.01 0.00 0.00 54.97 54.93 1o1v s GLU 68 Cb 0.06 -2.45 0.05 0.00 -4.31 0.00 0.00 34.13 27.49 1o1v s GLU 68 CO 0.04 -0.26 0.54 0.45 0.01 0.00 0.00 175.26 176.04 1o1v s SER 69 N -4.16 -0.51 -0.69 -0.19 0.15 -1.14 -4.73 113.70 102.43 1o1v s SER 69 Ca 0.48 0.75 -0.27 0.00 0.70 0.00 0.00 55.95 57.60 1o1v s SER 69 Cb -0.10 0.75 0.01 0.00 -1.71 0.00 0.00 66.02 64.97 1o1v s SER 69 CO 0.42 -0.39 1.53 0.21 1.20 0.00 0.00 173.24 176.21 1o1v s ASN 70 N -0.56 5.78 0.30 5.45 2.47 -1.26 -2.73 114.94 124.37 1o1v s ASN 70 Ca -0.07 -0.11 -0.13 0.00 0.42 0.00 0.00 52.86 52.97 1o1v s ASN 70 Cb -0.03 -2.55 -0.08 0.00 -1.45 0.00 0.00 41.25 37.14 1o1v s ASN 70 CO 0.05 -2.07 0.68 -0.63 -3.72 0.00 0.00 177.10 171.41 1o1v s ILE 71 N 7.18 4.75 0.16 -5.21 -1.09 -0.12 -4.98 121.20 121.89 1o1v s ILE 71 Ca 0.49 0.81 0.02 0.00 -2.23 0.00 0.00 60.65 59.74 1o1v s ILE 71 Cb -0.10 -3.61 -0.05 0.00 -1.58 0.00 0.00 42.46 37.12 1o1v s ILE 71 CO 0.17 -0.16 -0.03 0.00 -1.23 0.00 0.00 174.94 173.69 1o1v s GLN 72 N -2.95 1.06 -0.77 2.79 -2.07 -1.26 -2.04 119.66 114.42 1o1v s GLN 72 Ca 0.52 -1.49 0.03 0.00 -1.82 0.00 0.00 55.36 52.61 1o1v s GLN 72 Cb -0.10 -0.36 0.27 0.00 -1.09 0.00 0.00 33.01 31.73 1o1v s GLN 72 CO 0.19 -0.06 0.97 0.25 -1.32 0.00 0.00 175.29 175.31 1o1v n THR 73 N -0.21 3.26 -3.52 3.63 -2.24 -0.97 -4.75 114.28 109.49 1o1v n THR 73 Ca -0.08 -5.44 -0.20 0.00 -2.27 0.00 0.00 64.05 56.05 1o1v n THR 73 Cb 0.62 -2.09 0.06 0.00 -2.10 0.00 0.00 70.33 66.82 1o1v n THR 73 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1o1v n MET 74 N 0.97 -3.95 -2.68 -0.78 0.00 -1.26 -1.87 117.12 107.54 1o1v n MET 74 Ca 0.29 0.71 -0.14 0.00 0.00 0.00 0.00 57.70 58.56 1o1v n MET 74 Cb 0.39 -5.33 -0.00 0.00 0.00 0.00 0.00 33.22 28.27 1o1v n MET 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1o1v n GLY 75 N -1.40 -0.50 0.00 3.03 0.00 -1.26 -4.91 105.19 100.15 1o1v n GLY 75 Ca -0.20 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1o1v n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o1v n GLY 76 N -0.86 0.67 3.75 -0.02 0.00 -0.78 -5.00 105.19 102.94 1o1v n GLY 76 Ca -0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 1o1v n GLY 76 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1o1v s LYS 77 N 2.89 3.04 0.04 1.61 2.20 -1.21 -4.76 119.74 123.55 1o1v s LYS 77 Ca 0.00 2.24 0.02 0.00 -0.36 0.00 0.00 55.97 57.87 1o1v s LYS 77 Cb 0.00 -2.20 -0.02 0.00 -1.51 0.00 0.00 37.83 34.10 1o1v s LYS 77 CO 0.00 -1.27 -0.07 0.99 -0.36 0.00 0.00 175.35 174.64 1o1v s THR 78 N -1.30 0.44 0.09 3.43 2.01 -1.26 -2.28 115.64 116.77 1o1v s THR 78 Ca 0.73 -1.04 -0.26 0.00 0.31 0.00 0.00 61.69 61.43 1o1v s THR 78 Cb -0.41 -0.53 0.08 0.00 0.01 0.00 0.00 72.50 71.65 1o1v s THR 78 CO 0.47 -0.41 0.93 0.72 -0.69 0.00 0.00 174.62 175.64 1o1v s PHE 79 N -1.41 -0.22 0.46 4.92 -0.12 -0.87 -5.04 117.98 115.71 1o1v s PHE 79 Ca -0.11 -0.02 -0.05 0.00 -0.05 0.00 0.00 56.93 56.69 1o1v s PHE 79 Cb -0.10 0.60 -0.04 0.00 -0.63 0.00 0.00 43.02 42.85 1o1v s PHE 79 CO 0.00 -0.72 0.76 0.15 -0.05 0.00 0.00 175.22 175.36 1o1v s LYS 80 N -3.23 3.57 0.03 1.99 1.02 -1.26 -0.95 119.74 120.91 1o1v s LYS 80 Ca 0.09 0.18 -0.04 0.00 0.02 0.00 0.00 55.97 56.23 1o1v s LYS 80 Cb -0.01 -2.41 -0.02 0.00 -0.52 0.00 0.00 37.83 34.88 1o1v s LYS 80 CO -0.02 -0.15 0.05 0.00 -0.92 0.00 0.00 175.35 174.31 1o1v s ALA 81 N -2.65 0.03 -0.41 5.17 0.00 -1.11 -4.45 121.76 118.35 1o1v s ALA 81 Ca 0.47 -0.62 -0.11 0.00 0.00 0.00 0.00 51.96 51.70 1o1v s ALA 81 Cb -0.10 0.22 0.05 0.00 0.00 0.00 0.00 23.12 23.29 1o1v s ALA 81 CO 0.42 -0.28 0.26 0.99 0.00 0.00 0.00 175.76 177.15 1o1v s THR 82 N -2.44 4.60 0.16 0.00 2.01 -1.20 -2.89 115.64 115.89 1o1v s THR 82 Ca -0.06 -1.08 -0.18 0.00 0.31 0.00 0.00 61.69 60.67 1o1v s THR 82 Cb -0.02 -3.69 -0.07 0.00 0.01 0.00 0.00 72.50 68.72 1o1v s THR 82 CO -0.04 -0.40 0.64 -0.69 -0.69 0.00 0.00 174.62 173.44 1o1v s VAL 83 N 1.53 4.68 0.07 3.82 1.01 -1.23 -2.99 120.40 127.28 1o1v s VAL 83 Ca 0.03 1.15 -0.02 0.00 0.00 0.00 0.00 61.98 63.14 1o1v s VAL 83 Cb -0.21 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 1o1v s VAL 83 CO 0.05 0.31 0.01 -1.10 0.00 0.00 0.00 175.10 174.37 1o1v s GLN 84 N -1.74 0.69 -0.54 2.72 -0.21 0.10 -0.76 119.66 119.92 1o1v s GLN 84 Ca 0.38 -1.24 0.06 0.00 0.02 0.00 0.00 55.36 54.58 1o1v s GLN 84 Cb -0.17 0.23 0.21 0.00 1.00 0.00 0.00 33.01 34.28 1o1v s GLN 84 CO 0.20 -0.15 0.55 -0.12 -2.12 0.00 0.00 175.29 173.64 1o1v n MET 85 N 0.05 1.40 -3.48 2.91 1.56 -1.26 -0.47 117.12 117.84 1o1v n MET 85 Ca -0.12 -3.94 -0.28 0.00 -0.27 0.00 0.00 57.70 53.09 1o1v n MET 85 Cb 0.62 -1.86 -0.03 0.00 2.15 0.00 0.00 33.22 34.09 1o1v n MET 85 CO 0.00 0.00 0.00 -1.21 -0.73 0.00 0.00 175.97 174.03 1o1v s GLU 86 N -1.38 3.59 3.03 2.12 0.41 -1.11 -4.83 118.70 120.53 1o1v s GLU 86 Ca 0.34 -0.12 0.00 0.00 -0.41 0.00 0.00 54.97 54.77 1o1v s GLU 86 Cb 0.09 -2.72 0.00 0.00 -1.78 0.00 0.00 34.13 29.72 1o1v s GLU 86 CO -0.11 0.29 0.00 0.41 -0.49 0.00 0.00 175.26 175.35 1o1v n GLY 87 N -0.81 1.73 2.85 -1.39 0.00 -1.26 -1.38 105.19 104.91 1o1v n GLY 87 Ca -0.03 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.17 1o1v n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o1v n GLY 88 N 0.00 5.63 3.20 -0.02 0.00 -1.26 -4.98 105.19 107.76 1o1v n GLY 88 Ca 0.00 -2.53 -0.09 0.00 0.00 0.00 0.00 46.02 43.40 1o1v n GLY 88 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o1v s LYS 89 N -4.02 0.93 -0.94 1.61 1.02 -0.48 -4.60 119.74 113.24 1o1v s LYS 89 Ca 0.51 -1.25 -0.03 0.00 0.02 0.00 0.00 55.97 55.22 1o1v s LYS 89 Cb 0.42 0.29 0.25 0.00 -0.52 0.00 0.00 37.83 38.26 1o1v s LYS 89 CO -0.37 -0.28 0.94 -0.11 -0.92 0.00 0.00 175.35 174.61 1o1v n LEU 90 N -0.09 4.72 -4.77 3.17 7.94 0.30 -2.76 117.00 125.51 1o1v n LEU 90 Ca -0.09 -5.16 -0.33 0.00 -1.11 0.00 0.00 56.01 49.33 1o1v n LEU 90 Cb 0.63 -1.16 0.06 0.00 0.53 0.00 0.00 43.42 43.48 1o1v n LEU 90 CO 0.27 1.59 0.73 -0.69 -1.11 0.00 0.00 177.39 178.18 1o1v s VAL 91 N -1.66 3.21 0.07 1.96 1.01 0.38 -2.14 120.40 123.23 1o1v s VAL 91 Ca 0.30 0.53 -0.26 0.00 0.00 0.00 0.00 61.98 62.54 1o1v s VAL 91 Cb -0.04 -3.04 0.07 0.00 0.00 0.00 0.00 36.38 33.38 1o1v s VAL 91 CO -0.08 -0.38 0.66 0.54 0.00 0.00 0.00 175.10 175.84 1o1v s VAL 92 N -2.43 0.00 0.12 2.92 0.11 -0.97 0.01 120.40 120.16 1o1v s VAL 92 Ca 0.66 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.69 1o1v s VAL 92 Cb -0.20 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.61 1o1v s VAL 92 CO 0.45 0.00 0.06 0.54 -3.33 0.00 0.00 175.10 172.82 1o1v s ASN 93 N -2.20 0.32 0.03 3.54 4.22 -1.16 -2.93 114.94 116.75 1o1v s ASN 93 Ca -0.02 -1.12 -0.04 0.00 -2.14 0.00 0.00 52.86 49.53 1o1v s ASN 93 Cb -0.01 0.29 -0.01 0.00 1.28 0.00 0.00 41.25 42.80 1o1v s ASN 93 CO -0.05 -0.72 0.07 -0.36 -2.04 0.00 0.00 177.10 174.00 1o1v s PHE 94 N -4.01 0.20 -1.17 1.54 0.08 -0.76 -3.23 117.98 110.64 1o1v s PHE 94 Ca 0.20 -0.47 -0.20 0.00 0.12 0.00 0.00 56.93 56.58 1o1v s PHE 94 Cb 0.07 -0.15 -0.04 0.00 -0.57 0.00 0.00 43.02 42.33 1o1v s PHE 94 CO -0.01 -0.31 1.92 -0.35 -0.10 0.00 0.00 175.22 176.36 1o1v n PRO 95 N 1.04 2.18 0.00 0.24 -0.04 -1.26 -2.81 135.00 134.35 1o1v n PRO 95 Ca -0.20 -2.58 0.00 0.00 -0.04 0.00 0.00 63.50 60.67 1o1v n PRO 95 Cb 0.57 -3.44 0.00 0.00 -0.04 0.00 0.00 33.50 30.59 1o1v n PRO 95 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1o1v n ASN 96 N 10.26 0.00 -2.64 3.54 4.05 -1.26 -5.12 115.26 124.09 1o1v n ASN 96 Ca 0.48 0.00 -0.13 0.00 0.45 0.00 0.00 54.58 55.38 1o1v n ASN 96 Cb 0.44 0.00 -0.04 0.00 1.23 0.00 0.00 39.78 41.41 1o1v n ASN 96 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1o1v n TYR 97 N 0.00 -0.97 -3.96 1.20 4.11 -1.12 -4.57 117.16 111.84 1o1v n TYR 97 Ca 0.00 -1.99 -0.09 0.00 -0.00 0.00 0.00 57.90 55.82 1o1v n TYR 97 Cb 0.00 0.35 -0.10 0.00 -0.00 0.00 0.00 39.34 39.59 1o1v n TYR 97 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.86 175.28 1o1v s HIS 98 N -3.23 0.26 0.07 -3.48 2.46 -1.10 -1.82 115.29 108.45 1o1v s HIS 98 Ca 0.26 -0.60 -0.09 0.00 0.47 0.00 0.00 55.06 55.10 1o1v s HIS 98 Cb 0.00 -0.19 0.00 0.00 -0.13 0.00 0.00 32.58 32.27 1o1v s HIS 98 CO 0.19 -0.34 0.20 -1.14 -2.47 0.00 0.00 174.74 171.18 1o1v s GLN 99 N -2.66 0.80 -0.18 2.88 0.74 -1.15 -2.48 119.66 117.61 1o1v s GLN 99 Ca -0.05 -0.83 -0.02 0.00 0.05 0.00 0.00 55.36 54.52 1o1v s GLN 99 Cb -0.01 0.33 0.05 0.00 1.10 0.00 0.00 33.01 34.48 1o1v s GLN 99 CO -0.05 -0.25 0.01 0.95 -0.55 0.00 0.00 175.29 175.40 1o1v s THR 100 N -3.39 0.70 0.22 -0.34 -4.23 -0.16 -2.29 115.64 106.15 1o1v s THR 100 Ca 0.01 -0.59 -0.21 0.00 -1.18 0.00 0.00 61.69 59.72 1o1v s THR 100 Cb 0.03 -1.11 -0.08 0.00 1.34 0.00 0.00 72.50 72.67 1o1v s THR 100 CO -0.08 -0.11 0.75 -0.44 -0.54 0.00 0.00 174.62 174.19 1o1v s SER 101 N 1.78 7.14 0.08 3.99 0.01 -0.91 -2.04 113.70 123.76 1o1v s SER 101 Ca -0.01 1.49 -0.11 0.00 1.31 0.00 0.00 55.95 58.64 1o1v s SER 101 Cb -0.17 -2.45 0.01 0.00 0.21 0.00 0.00 66.02 63.62 1o1v s SER 101 CO -0.07 0.06 0.24 -1.61 0.41 0.00 0.00 173.24 172.26 1o1v s GLU 102 N -1.82 0.84 -0.11 12.44 2.02 0.13 -0.54 118.70 131.66 1o1v s GLU 102 Ca 0.42 -0.80 0.01 0.00 0.02 0.00 0.00 54.97 54.63 1o1v s GLU 102 Cb -0.18 0.35 -0.01 0.00 0.10 0.00 0.00 34.13 34.39 1o1v s GLU 102 CO 0.22 -0.27 -0.17 0.42 0.02 0.00 0.00 175.26 175.48 1o1v s ILE 103 N -3.43 2.74 -0.07 -1.63 -1.09 -1.26 -1.37 121.20 115.08 1o1v s ILE 103 Ca 0.01 -0.78 -0.06 0.00 -2.23 0.00 0.00 60.65 57.60 1o1v s ILE 103 Cb 0.03 -2.12 0.02 0.00 -1.58 0.00 0.00 42.46 38.81 1o1v s ILE 103 CO -0.09 0.54 0.19 -0.69 -1.23 0.00 0.00 174.94 173.66 1o1v s VAL 104 N 0.27 -0.01 -1.70 2.92 1.01 -0.93 -4.92 120.40 117.05 1o1v s VAL 104 Ca -0.12 0.04 -0.17 0.00 0.00 0.00 0.00 61.98 61.72 1o1v s VAL 104 Cb -0.16 -0.28 0.15 0.00 0.00 0.00 0.00 36.38 36.09 1o1v s VAL 104 CO 0.06 0.01 0.73 0.61 0.00 0.00 0.00 175.10 176.52 1o1v n GLY 105 N 3.25 -0.42 3.49 4.51 0.00 -1.26 -0.54 105.19 114.22 1o1v n GLY 105 Ca -0.15 0.13 -0.18 0.00 0.00 0.00 0.00 46.02 45.82 1o1v n GLY 105 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1o1v n ASP 106 N -2.67 -2.21 -3.99 1.61 2.03 -1.26 -5.02 116.55 105.03 1o1v n ASP 106 Ca 0.04 -0.69 -0.08 0.00 0.52 0.00 0.00 54.79 54.59 1o1v n ASP 106 Cb 0.51 -4.83 -0.09 0.00 -0.72 0.00 0.00 41.12 35.98 1o1v n ASP 106 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1o1v s LYS 107 N -5.46 0.61 -0.30 -0.67 1.02 0.30 -3.49 119.74 111.76 1o1v s LYS 107 Ca 0.04 -0.98 -0.12 0.00 0.02 0.00 0.00 55.97 54.94 1o1v s LYS 107 Cb -0.01 0.23 -0.04 0.00 -0.52 0.00 0.00 37.83 37.49 1o1v s LYS 107 CO 0.75 -0.14 0.21 -1.17 -0.92 0.00 0.00 175.35 174.08 1o1v s LEU 108 N -2.52 4.18 0.02 3.17 2.96 -1.20 -2.18 118.68 123.10 1o1v s LEU 108 Ca 0.01 -0.14 0.04 0.00 -0.22 0.00 0.00 54.13 53.81 1o1v s LEU 108 Cb 0.03 -2.12 -0.02 0.00 0.50 0.00 0.00 46.19 44.58 1o1v s LEU 108 CO -0.08 -0.11 -0.11 0.54 -1.32 0.00 0.00 176.35 175.28 1o1v s VAL 109 N 1.75 0.84 0.08 1.68 0.11 -0.47 -0.36 120.40 124.03 1o1v s VAL 109 Ca 0.07 -0.77 0.02 0.00 -2.93 0.00 0.00 61.98 58.36 1o1v s VAL 109 Cb -0.16 -0.77 -0.04 0.00 -1.53 0.00 0.00 36.38 33.88 1o1v s VAL 109 CO 0.11 0.01 -0.07 -1.61 -3.33 0.00 0.00 175.10 170.20 1o1v s GLU 110 N -0.86 0.75 0.03 1.54 2.02 -0.79 -0.69 118.70 120.69 1o1v s GLU 110 Ca 0.00 -1.14 0.03 0.00 0.02 0.00 0.00 54.97 53.88 1o1v s GLU 110 Cb -0.06 -0.27 -0.02 0.00 0.10 0.00 0.00 34.13 33.87 1o1v s GLU 110 CO 0.01 0.01 -0.09 0.08 0.02 0.00 0.00 175.26 175.29 1o1v s VAL 111 N -2.82 0.69 0.27 2.63 1.01 -0.86 -2.33 120.40 118.98 1o1v s VAL 111 Ca 0.05 -0.89 -0.21 0.00 0.00 0.00 0.00 61.98 60.92 1o1v s VAL 111 Cb -0.00 -0.68 0.02 0.00 0.00 0.00 0.00 36.38 35.72 1o1v s VAL 111 CO -0.03 -0.17 0.69 -0.55 0.00 0.00 0.00 175.10 175.04 1o1v s SER 112 N -1.18 -0.28 -0.07 3.32 0.15 0.14 -0.99 113.70 114.80 1o1v s SER 112 Ca -0.04 -0.56 -0.20 0.00 0.70 0.00 0.00 55.95 55.84 1o1v s SER 112 Cb -0.08 0.71 0.04 0.00 -1.71 0.00 0.00 66.02 64.98 1o1v s SER 112 CO 0.01 -1.30 0.47 -0.89 1.20 0.00 0.00 173.24 172.73 1o1v s THR 113 N -3.91 0.03 -0.03 6.45 2.01 -1.04 -0.46 115.64 118.69 1o1v s THR 113 Ca 0.11 -0.21 -0.29 0.00 0.31 0.00 0.00 61.69 61.60 1o1v s THR 113 Cb -0.05 -0.75 0.07 0.00 0.01 0.00 0.00 72.50 71.77 1o1v s THR 113 CO 0.05 -0.12 0.65 -0.51 -0.69 0.00 0.00 174.62 174.00 1o1v s ILE 114 N -0.90 0.00 0.00 1.82 2.07 -0.89 -2.70 121.20 120.60 1o1v s ILE 114 Ca -0.10 -0.03 0.00 0.00 -1.41 0.00 0.00 60.65 59.11 1o1v s ILE 114 Cb -0.03 -0.98 0.00 0.00 0.13 0.00 0.00 42.46 41.58 1o1v s ILE 114 CO 0.05 -0.02 0.00 0.61 -1.91 0.00 0.00 174.94 173.67 1o1v n GLY 115 N 0.80 0.41 2.72 1.50 0.00 -1.26 -1.19 105.19 108.16 1o1v n GLY 115 Ca -0.19 0.69 -0.05 0.00 0.00 0.00 0.00 46.02 46.46 1o1v n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o1v n GLY 116 N 0.00 1.62 3.15 -0.02 0.00 -1.26 -5.12 105.19 103.56 1o1v n GLY 116 Ca 0.00 -0.82 -0.09 0.00 0.00 0.00 0.00 46.02 45.11 1o1v n GLY 116 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1o1v s VAL 117 N -2.11 0.14 0.22 1.61 -7.23 -0.34 -5.17 120.40 107.52 1o1v s VAL 117 Ca 0.23 -1.14 0.03 0.00 -1.81 0.00 0.00 61.98 59.29 1o1v s VAL 117 Cb 0.41 -1.07 -0.03 0.00 0.56 0.00 0.00 36.38 36.25 1o1v s VAL 117 CO -0.03 -0.63 0.37 -0.89 -0.31 0.00 0.00 175.10 173.61 1o1v s THR 118 N -3.04 5.25 0.06 5.32 2.01 -1.26 -2.10 115.64 121.88 1o1v s THR 118 Ca -0.01 -0.71 -0.16 0.00 0.31 0.00 0.00 61.69 61.12 1o1v s THR 118 Cb 0.01 -3.80 0.03 0.00 0.01 0.00 0.00 72.50 68.75 1o1v s THR 118 CO -0.07 -0.26 0.37 -0.47 -0.69 0.00 0.00 174.62 173.51 1o1v s TYR 119 N -1.93 -0.19 0.01 4.92 5.04 0.39 -4.85 117.35 120.74 1o1v s TYR 119 Ca 0.36 0.07 -0.28 0.00 -2.44 0.00 0.00 57.07 54.77 1o1v s TYR 119 Cb -0.10 0.18 0.10 0.00 0.35 0.00 0.00 41.96 42.49 1o1v s TYR 119 CO 0.30 -0.57 0.86 -1.83 -1.34 0.00 0.00 175.55 172.97 1o1v s GLU 120 N -2.77 0.86 0.08 4.97 1.03 -1.26 0.24 118.70 121.85 1o1v s GLU 120 Ca -0.03 -0.32 -0.02 0.00 0.03 0.00 0.00 54.97 54.62 1o1v s GLU 120 Cb -0.00 0.40 -0.03 0.00 -0.80 0.00 0.00 34.13 33.69 1o1v s GLU 120 CO -0.05 -0.38 0.03 1.03 -1.33 0.00 0.00 175.26 174.57 1o1v s ARG 121 N -3.18 0.74 0.01 -4.83 0.52 -0.99 -3.45 118.95 107.78 1o1v s ARG 121 Ca 0.05 -1.24 -0.02 0.00 -0.52 0.00 0.00 55.73 53.99 1o1v s ARG 121 Cb -0.01 0.24 -0.01 0.00 0.52 0.00 0.00 34.95 35.69 1o1v s ARG 121 CO -0.09 -0.18 0.02 0.08 0.02 0.00 0.00 175.30 175.15 1o1v s VAL 122 N -3.95 0.10 0.09 3.52 1.01 -0.58 -1.89 120.40 118.70 1o1v s VAL 122 Ca 0.12 -0.79 -0.00 0.00 0.00 0.00 0.00 61.98 61.30 1o1v s VAL 122 Cb 0.07 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 36.12 1o1v s VAL 122 CO -0.07 -0.44 -0.02 -0.44 0.00 0.00 0.00 175.10 174.14 1o1v s SER 123 N -1.34 0.68 -0.14 3.32 0.01 0.52 -1.44 113.70 115.30 1o1v s SER 123 Ca -0.15 -1.06 -0.15 0.00 1.31 0.00 0.00 55.95 55.90 1o1v s SER 123 Cb -0.09 0.19 -0.04 0.00 0.21 0.00 0.00 66.02 66.28 1o1v s SER 123 CO -0.00 -0.59 0.36 -0.54 0.41 0.00 0.00 173.24 172.88 1o1v s LYS 124 N -3.92 4.27 -0.83 12.44 1.02 -1.12 -3.27 119.74 128.33 1o1v s LYS 124 Ca 0.13 0.24 -0.25 0.00 0.02 0.00 0.00 55.97 56.10 1o1v s LYS 124 Cb 0.07 -3.42 -0.01 0.00 -0.52 0.00 0.00 37.83 33.95 1o1v s LYS 124 CO -0.05 0.22 1.70 0.50 -0.92 0.00 0.00 175.35 176.80 1o1v s ARG 125 N 0.47 2.92 0.11 1.68 3.52 -1.23 -1.26 118.95 125.16 1o1v s ARG 125 Ca 0.20 -0.24 -0.20 0.00 -0.13 0.00 0.00 55.73 55.36 1o1v s ARG 125 Cb -0.14 -4.81 -0.08 0.00 -1.56 0.00 0.00 34.95 28.36 1o1v s ARG 125 CO 0.06 -2.74 1.69 -0.07 -0.81 0.00 0.00 175.30 173.44 1o1v h LEU 126 N 15.53 0.26 0.00 -0.88 3.38 -1.89 -3.49 115.31 128.23 1o1v h LEU 126 Ca -0.03 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1o1v h LEU 126 Cb 1.05 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.74 1o1v h LEU 126 CO 1.27 0.28 0.00 0.00 0.09 0.00 0.00 178.44 180.09