#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 5lve s ILE 2 N 0.00 4.55 -0.14 2.12 1.01 -1.26 -5.02 121.20 122.46 5lve s ILE 2 Ca 0.00 1.94 -0.15 0.00 0.00 0.00 0.00 60.65 62.44 5lve s ILE 2 Cb 0.00 -4.24 -0.05 0.00 0.01 0.00 0.00 42.46 38.18 5lve s ILE 2 CO 0.00 0.21 0.35 -0.69 0.00 0.00 0.00 174.94 174.81 5lve s VAL 3 N 0.61 5.27 -0.23 2.92 1.01 -1.26 -4.75 120.40 123.96 5lve s VAL 3 Ca 0.51 0.67 -0.06 0.00 0.00 0.00 0.00 61.98 63.10 5lve s VAL 3 Cb -0.24 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.44 5lve s VAL 3 CO 0.29 0.38 0.02 -0.04 0.00 0.00 0.00 175.10 175.75 5lve s MET 4 N 0.45 3.54 -0.19 2.72 1.00 -1.26 -0.57 119.30 125.00 5lve s MET 4 Ca 0.19 -0.54 -0.01 0.00 0.00 0.00 0.00 55.69 55.34 5lve s MET 4 Cb -0.14 -3.18 0.01 0.00 0.00 0.00 0.00 34.83 31.52 5lve s MET 4 CO 0.06 -0.17 -0.15 0.99 0.00 0.00 0.00 175.02 175.75 5lve s THR 5 N 1.51 2.54 0.28 2.05 2.01 0.05 -4.11 115.64 119.97 5lve s THR 5 Ca 0.06 -0.78 0.07 0.00 0.31 0.00 0.00 61.69 61.35 5lve s THR 5 Cb -0.15 -2.10 -0.03 0.00 0.01 0.00 0.00 72.50 70.23 5lve s THR 5 CO 0.01 0.50 0.23 -1.10 -0.69 0.00 0.00 174.62 173.57 5lve s GLN 6 N 1.30 2.85 -0.27 4.92 -0.21 -1.26 -0.91 119.66 126.08 5lve s GLN 6 Ca 0.04 -1.15 -0.25 0.00 0.02 0.00 0.00 55.36 54.02 5lve s GLN 6 Cb -0.14 -2.53 0.08 0.00 1.00 0.00 0.00 33.01 31.43 5lve s GLN 6 CO -0.09 0.29 0.81 -1.54 -2.12 0.00 0.00 175.29 172.64 5lve s SER 7 N -3.90 -0.66 0.98 5.90 1.04 -0.75 -4.65 113.70 111.66 5lve s SER 7 Ca 0.36 1.27 -0.15 0.00 0.48 0.00 0.00 55.95 57.91 5lve s SER 7 Cb -0.07 1.28 0.19 0.00 0.10 0.00 0.00 66.02 67.52 5lve s SER 7 CO 0.25 -0.23 1.22 -2.16 0.98 0.00 0.00 173.24 173.30 5lve s PRO 8 N 0.30 0.50 0.15 4.02 0.04 -1.26 -0.96 135.00 137.79 5lve s PRO 8 Ca 0.01 -0.12 -0.08 0.00 0.04 0.00 0.00 61.00 60.84 5lve s PRO 8 Cb -0.05 -1.80 -0.01 0.00 0.04 0.00 0.00 34.50 32.67 5lve s PRO 8 CO -0.01 -2.55 1.44 -0.44 0.04 0.00 0.00 177.00 175.48 5lve h ASP 9 N -1.75 0.85 -4.50 6.66 3.32 -1.82 -3.41 116.42 115.77 5lve h ASP 9 Ca -0.46 -0.46 -0.17 0.00 0.02 0.00 0.00 57.03 55.96 5lve h ASP 9 Cb 1.28 -0.24 -0.23 0.00 0.22 0.00 0.00 39.33 40.35 5lve h ASP 9 CO 0.46 1.22 -0.58 -0.94 -1.72 0.00 0.00 179.24 177.68 5lve s SER 10 N -6.94 0.02 -0.07 6.45 1.04 -1.26 -1.14 113.70 111.80 5lve s SER 10 Ca -0.09 -0.11 -0.00 0.00 0.48 0.00 0.00 55.95 56.23 5lve s SER 10 Cb 0.11 0.19 0.02 0.00 0.10 0.00 0.00 66.02 66.43 5lve s SER 10 CO 0.87 -0.22 -0.04 -0.22 0.98 0.00 0.00 173.24 174.61 5lve s LEU 11 N -0.83 1.04 -0.05 2.42 2.96 0.76 -4.89 118.68 120.08 5lve s LEU 11 Ca -0.09 -0.16 -0.05 0.00 -0.22 0.00 0.00 54.13 53.61 5lve s LEU 11 Cb -0.05 -0.55 -0.04 0.00 0.50 0.00 0.00 46.19 46.04 5lve s LEU 11 CO 0.00 -0.11 0.18 0.00 -1.32 0.00 0.00 176.35 175.10 5lve s ALA 12 N 1.46 3.90 0.14 5.97 0.00 -1.26 -1.62 121.76 130.35 5lve s ALA 12 Ca -0.02 -0.67 -0.25 0.00 0.00 0.00 0.00 51.96 51.03 5lve s ALA 12 Cb -0.13 -1.96 0.07 0.00 0.00 0.00 0.00 23.12 21.09 5lve s ALA 12 CO -0.03 0.67 0.80 0.54 0.00 0.00 0.00 175.76 177.73 5lve s VAL 13 N -1.19 0.00 0.23 0.00 0.11 -0.57 -4.87 120.40 114.12 5lve s VAL 13 Ca 0.22 -0.38 0.05 0.00 -2.93 0.00 0.00 61.98 58.94 5lve s VAL 13 Cb -0.13 -1.46 -0.03 0.00 -1.53 0.00 0.00 36.38 33.23 5lve s VAL 13 CO 0.12 0.00 0.32 -0.44 -3.33 0.00 0.00 175.10 171.77 5lve s SER 14 N -2.76 6.18 0.26 3.54 0.01 -1.26 -0.53 113.70 119.14 5lve s SER 14 Ca 0.07 0.03 -0.30 0.00 1.31 0.00 0.00 55.95 57.06 5lve s SER 14 Cb -0.02 -1.79 -0.13 0.00 0.21 0.00 0.00 66.02 64.29 5lve s SER 14 CO -0.04 -0.05 1.37 -0.11 0.41 0.00 0.00 173.24 174.83 5lve n LEU 15 N -1.24 3.14 0.00 2.44 7.94 -1.26 -2.28 117.00 125.74 5lve n LEU 15 Ca -0.09 1.16 0.00 0.00 -1.11 0.00 0.00 56.01 55.97 5lve n LEU 15 Cb 0.57 -1.43 0.00 0.00 0.53 0.00 0.00 43.42 43.08 5lve n LEU 15 CO 0.45 -0.52 0.00 0.61 -1.11 0.00 0.00 177.39 176.82 5lve n GLY 16 N 1.86 1.73 3.89 -3.96 0.00 0.11 -4.95 105.19 103.87 5lve n GLY 16 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 5lve n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 5lve s GLU 17 N -0.49 3.19 0.11 1.61 2.02 -0.96 -4.28 118.70 119.90 5lve s GLU 17 Ca 0.00 0.42 -0.26 0.00 0.02 0.00 0.00 54.97 55.15 5lve s GLU 17 Cb 0.00 -2.14 -0.07 0.00 0.10 0.00 0.00 34.13 32.03 5lve s GLU 17 CO 0.00 -0.71 0.82 0.50 0.02 0.00 0.00 175.26 175.89 5lve s ARG 18 N -5.15 4.58 -0.06 1.61 3.52 -1.21 -0.39 118.95 121.86 5lve s ARG 18 Ca 0.55 1.20 0.03 0.00 -0.13 0.00 0.00 55.73 57.38 5lve s ARG 18 Cb -0.11 -3.33 0.01 0.00 -1.56 0.00 0.00 34.95 29.96 5lve s ARG 18 CO 0.50 0.38 -0.14 0.00 -0.81 0.00 0.00 175.30 175.24 5lve s ALA 19 N -0.48 1.34 -0.05 6.12 0.00 0.29 -4.97 121.76 124.00 5lve s ALA 19 Ca 0.39 -0.51 0.03 0.00 0.00 0.00 0.00 51.96 51.88 5lve s ALA 19 Cb -0.22 -0.54 0.00 0.00 0.00 0.00 0.00 23.12 22.36 5lve s ALA 19 CO 0.26 0.17 -0.14 0.99 0.00 0.00 0.00 175.76 177.04 5lve s THR 20 N 0.43 1.23 0.01 0.00 2.01 -1.26 -0.50 115.64 117.56 5lve s THR 20 Ca -0.11 -0.57 0.03 0.00 0.31 0.00 0.00 61.69 61.35 5lve s THR 20 Cb -0.14 -1.08 -0.01 0.00 0.01 0.00 0.00 72.50 71.27 5lve s THR 20 CO 0.03 0.37 -0.11 0.27 -0.69 0.00 0.00 174.62 174.49 5lve s ILE 21 N 0.32 0.84 0.24 1.82 -4.36 -0.53 -4.83 121.20 114.70 5lve s ILE 21 Ca -0.08 -0.68 0.08 0.00 -0.26 0.00 0.00 60.65 59.71 5lve s ILE 21 Cb -0.13 -0.75 -0.04 0.00 1.25 0.00 0.00 42.46 42.79 5lve s ILE 21 CO 0.03 0.07 0.08 0.20 0.24 0.00 0.00 174.94 175.56 5lve s ASN 22 N -0.68 5.03 -0.16 4.36 0.01 -0.14 -1.22 114.94 122.14 5lve s ASN 22 Ca 0.01 -0.42 -0.10 0.00 -0.71 0.00 0.00 52.86 51.64 5lve s ASN 22 Cb -0.06 -1.13 0.05 0.00 0.41 0.00 0.00 41.25 40.52 5lve s ASN 22 CO 0.00 0.00 0.40 0.00 -1.51 0.00 0.00 177.10 175.99 5lve s LYS 24 N 1.02 1.39 -0.07 0.00 1.02 -0.09 -0.31 119.74 122.70 5lve s LYS 24 Ca -0.07 -0.51 -0.04 0.00 0.02 0.00 0.00 55.97 55.37 5lve s LYS 24 Cb -0.07 -1.27 -0.04 0.00 -0.52 0.00 0.00 37.83 35.94 5lve s LYS 24 CO -0.08 0.24 0.12 -1.54 -0.92 0.00 0.00 175.35 173.16 5lve s SER 25 N -0.05 6.09 0.57 2.83 1.04 -0.41 -0.77 113.70 123.00 5lve s SER 25 Ca -0.00 0.34 0.38 0.00 0.48 0.00 0.00 55.95 57.15 5lve s SER 25 Cb -0.09 -1.89 1.98 0.00 0.10 0.00 0.00 66.02 66.12 5lve s SER 25 CO 0.01 0.35 2.16 0.77 0.98 0.00 0.00 173.24 177.51 5lve h SER 26 N 4.59 0.00 -5.08 7.02 4.64 -1.18 -3.42 113.55 120.13 5lve h SER 26 Ca -0.52 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.70 5lve h SER 26 Cb 1.21 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.13 5lve h SER 26 CO 0.61 0.00 -0.36 0.00 -0.87 0.00 0.00 176.83 176.21 5lve s GLN 27 N -3.93 0.74 0.35 4.77 -2.07 -1.26 -4.97 119.66 113.29 5lve s GLN 27 Ca -0.03 -0.64 -0.29 0.00 -1.82 0.00 0.00 55.36 52.58 5lve s GLN 27 Cb 0.11 0.31 -0.11 0.00 -1.09 0.00 0.00 33.01 32.23 5lve s GLN 27 CO 0.40 -0.22 1.47 0.45 -1.32 0.00 0.00 175.29 176.06 5lve s SER 27 N -2.18 6.44 -0.11 12.60 0.15 -1.26 -4.79 113.70 124.55 5lve s SER 27 Ca -0.04 2.95 0.14 0.00 0.70 0.00 0.00 55.95 59.71 5lve s SER 27 Cb -0.00 -2.66 0.44 0.00 -1.71 0.00 0.00 66.02 62.09 5lve s SER 27 CO -0.05 -0.81 1.36 1.33 1.20 0.00 0.00 173.24 176.27 5lve n VAL 27 N 0.83 1.80 -3.17 4.45 0.24 -0.56 -4.90 118.33 117.02 5lve n VAL 27 Ca 0.02 -1.54 -0.41 0.00 -2.04 0.00 0.00 64.34 60.36 5lve n VAL 27 Cb 0.39 0.03 -0.07 0.00 -1.47 0.00 0.00 33.84 32.73 5lve n VAL 27 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 5lve s LEU 27 N -2.13 4.28 0.00 1.34 2.96 -1.26 -1.45 118.68 122.42 5lve s LEU 27 Ca 0.35 0.10 0.00 0.00 -0.22 0.00 0.00 54.13 54.36 5lve s LEU 27 Cb 0.26 -2.70 0.00 0.00 0.50 0.00 0.00 46.19 44.25 5lve s LEU 27 CO 0.11 -0.53 0.00 0.00 -1.32 0.00 0.00 176.35 174.61 5lve n TYR 27 N 5.89 -1.93 0.00 5.38 9.36 -0.26 -4.93 117.16 130.67 5lve n TYR 27 Ca -0.03 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.19 5lve n TYR 27 Cb 0.49 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.20 5lve n TYR 27 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 5lve n SER 27 N -1.51 0.00 0.00 2.98 7.64 -1.26 0.11 113.62 121.58 5lve n SER 27 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 5lve n SER 27 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 5lve n SER 27 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 5lve n ASN 28 N 0.00 0.38 -2.52 6.43 0.23 -1.26 -5.03 115.26 113.49 5lve n ASN 28 Ca 0.00 -1.09 -0.19 0.00 -0.53 0.00 0.00 54.58 52.78 5lve n ASN 28 Cb 0.00 0.00 -0.00 0.00 -2.08 0.00 0.00 39.78 37.70 5lve n ASN 28 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 5lve n SER 29 N -0.04 -5.25 -4.76 0.53 3.41 0.12 -4.99 113.62 102.64 5lve n SER 29 Ca 0.00 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.29 5lve n SER 29 Cb 0.25 -4.38 -0.07 0.00 -0.26 0.00 0.00 64.21 59.75 5lve n SER 29 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 5lve s LYS 30 N -5.16 2.98 -0.36 4.33 1.02 -1.23 -4.86 119.74 116.47 5lve s LYS 30 Ca 0.05 -0.53 -0.15 0.00 0.02 0.00 0.00 55.97 55.36 5lve s LYS 30 Cb -0.02 -2.80 -0.01 0.00 -0.52 0.00 0.00 37.83 34.48 5lve s LYS 30 CO 0.06 0.64 0.37 -0.80 -0.92 0.00 0.00 175.35 174.70 5lve s ASN 31 N -1.74 6.17 -1.45 2.83 0.01 -1.26 -1.10 114.94 118.41 5lve s ASN 31 Ca 0.22 -0.34 -0.09 0.00 -0.71 0.00 0.00 52.86 51.95 5lve s ASN 31 Cb -0.12 -2.20 0.04 0.00 0.41 0.00 0.00 41.25 39.38 5lve s ASN 31 CO 0.14 -0.38 2.52 -1.22 -1.51 0.00 0.00 177.10 176.64 5lve n TYR 32 N 5.40 2.68 -4.91 2.20 4.02 -0.53 -3.75 117.16 122.27 5lve n TYR 32 Ca -0.09 -2.94 -0.28 0.00 -0.01 0.00 0.00 57.90 54.58 5lve n TYR 32 Cb 0.49 -2.18 -0.17 0.00 -0.02 0.00 0.00 39.34 37.47 5lve n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 5lve s LEU 33 N -0.54 1.88 0.21 7.72 1.98 -1.26 -1.72 118.68 126.95 5lve s LEU 33 Ca 0.57 -0.43 0.05 0.00 -2.89 0.00 0.00 54.13 51.44 5lve s LEU 33 Cb 0.17 -1.12 -0.05 0.00 0.66 0.00 0.00 46.19 45.85 5lve s LEU 33 CO -0.07 0.10 -0.07 0.00 -1.89 0.00 0.00 176.35 174.43 5lve s ALA 34 N 0.47 1.86 -0.05 5.97 0.00 0.28 -0.85 121.76 129.45 5lve s ALA 34 Ca -0.16 -1.70 0.05 0.00 0.00 0.00 0.00 51.96 50.15 5lve s ALA 34 Cb -0.17 0.21 -0.01 0.00 0.00 0.00 0.00 23.12 23.16 5lve s ALA 34 CO 0.06 -0.12 -0.20 -1.58 0.00 0.00 0.00 175.76 173.93 5lve s TRP 35 N -3.23 1.98 0.01 0.00 0.52 0.15 -0.32 118.94 118.04 5lve s TRP 35 Ca 0.24 -0.59 0.09 0.00 0.02 0.00 0.00 56.10 55.87 5lve s TRP 35 Cb 0.03 -1.32 -0.02 0.00 -1.15 0.00 0.00 33.47 31.01 5lve s TRP 35 CO 0.07 -0.19 -0.26 0.71 0.02 0.00 0.00 176.95 177.29 5lve s TYR 36 N -0.01 2.33 -0.18 -1.98 1.51 0.92 -0.43 117.35 119.51 5lve s TYR 36 Ca -0.04 -0.43 -0.07 0.00 -1.01 0.00 0.00 57.07 55.52 5lve s TYR 36 Cb -0.12 -1.44 -0.04 0.00 -0.11 0.00 0.00 41.96 40.24 5lve s TYR 36 CO 0.03 0.05 0.05 -1.14 -1.11 0.00 0.00 175.55 173.43 5lve s GLN 37 N -0.94 3.94 -0.37 -0.62 0.74 0.11 -1.08 119.66 121.44 5lve s GLN 37 Ca 0.11 -0.36 0.03 0.00 0.05 0.00 0.00 55.36 55.18 5lve s GLN 37 Cb -0.10 -3.18 0.11 0.00 1.10 0.00 0.00 33.01 30.93 5lve s GLN 37 CO 0.01 0.27 0.11 -1.14 -0.55 0.00 0.00 175.29 173.98 5lve s GLN 38 N 0.38 1.36 0.66 1.67 0.74 0.30 -0.68 119.66 124.10 5lve s GLN 38 Ca 0.02 -1.82 -0.14 0.00 0.05 0.00 0.00 55.36 53.47 5lve s GLN 38 Cb -0.13 -2.86 -0.00 0.00 1.10 0.00 0.00 33.01 31.12 5lve s GLN 38 CO 0.00 -1.00 1.09 0.15 -0.55 0.00 0.00 175.29 174.99 5lve s LYS 39 N 0.83 2.87 -0.07 1.67 1.02 -1.26 -1.58 119.74 123.22 5lve s LYS 39 Ca 0.12 1.30 -0.38 0.00 0.02 0.00 0.00 55.97 57.03 5lve s LYS 39 Cb -0.20 -1.97 -0.16 0.00 -0.52 0.00 0.00 37.83 34.98 5lve s LYS 39 CO -0.10 -1.19 1.55 -2.30 -0.92 0.00 0.00 175.35 172.40 5lve n PRO 40 N -2.49 1.28 -1.04 -1.68 -0.02 -1.26 -1.25 135.00 128.54 5lve n PRO 40 Ca 0.10 0.47 -0.01 0.00 -2.02 0.00 0.00 63.50 62.03 5lve n PRO 40 Cb 0.52 -2.15 -0.01 0.00 -0.02 0.00 0.00 33.50 31.85 5lve n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 5lve n GLY 41 N 3.37 0.47 3.47 -1.23 0.00 -1.26 -5.02 105.19 104.99 5lve n GLY 41 Ca 0.22 -0.18 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 5lve n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 5lve s GLN 42 N -1.00 1.65 0.65 1.61 -0.21 -0.38 -5.15 119.66 116.84 5lve s GLN 42 Ca 0.00 -1.82 -0.11 0.00 0.02 0.00 0.00 55.36 53.45 5lve s GLN 42 Cb 0.00 -1.47 -0.02 0.00 1.00 0.00 0.00 33.01 32.52 5lve s GLN 42 CO 0.00 0.14 1.06 -1.25 -2.12 0.00 0.00 175.29 173.12 5lve s PRO 43 N -3.64 3.29 0.05 2.91 0.04 -1.26 -4.60 135.00 131.79 5lve s PRO 43 Ca 0.30 0.62 -0.31 0.00 0.04 0.00 0.00 61.00 61.66 5lve s PRO 43 Cb 0.01 -2.06 -0.07 0.00 0.04 0.00 0.00 34.50 32.42 5lve s PRO 43 CO 0.14 -0.76 1.48 -2.14 0.04 0.00 0.00 177.00 175.75 5lve s PRO 44 N -5.25 4.26 -0.06 0.56 0.02 -1.26 -4.60 135.00 128.67 5lve s PRO 44 Ca 0.56 2.11 0.03 0.00 0.02 0.00 0.00 61.00 63.73 5lve s PRO 44 Cb -0.11 -3.49 -0.02 0.00 0.02 0.00 0.00 34.50 30.90 5lve s PRO 44 CO 0.53 -0.59 -0.15 0.15 -0.33 0.00 0.00 177.00 176.61 5lve s LYS 45 N 2.12 2.62 0.14 5.54 1.02 0.15 -4.88 119.74 126.46 5lve s LYS 45 Ca 0.67 -0.71 -0.33 0.00 0.02 0.00 0.00 55.97 55.62 5lve s LYS 45 Cb -0.36 -2.39 -0.13 0.00 -0.52 0.00 0.00 37.83 34.43 5lve s LYS 45 CO 0.29 0.55 1.65 -0.11 -0.92 0.00 0.00 175.35 176.81 5lve n LEU 46 N 2.52 3.34 -0.03 3.17 7.94 -1.26 0.05 117.00 132.73 5lve n LEU 46 Ca -0.17 1.06 -0.08 0.00 -1.11 0.00 0.00 56.01 55.71 5lve n LEU 46 Cb 0.52 -1.45 -0.03 0.00 0.53 0.00 0.00 43.42 42.99 5lve n LEU 46 CO 0.26 -0.16 -0.69 -0.11 -1.11 0.00 0.00 177.39 175.58 5lve n LEU 47 N 3.95 0.75 -3.87 -1.96 7.94 0.43 -4.80 117.00 119.44 5lve n LEU 47 Ca 0.17 0.12 -0.11 0.00 -1.11 0.00 0.00 56.01 55.09 5lve n LEU 47 Cb 0.30 -0.29 -0.11 0.00 0.53 0.00 0.00 43.42 43.85 5lve n LEU 47 CO 0.64 0.04 -0.20 -0.63 -1.11 0.00 0.00 177.39 176.13 5lve s ILE 48 N -2.18 0.07 0.25 1.96 1.01 -0.79 -1.39 121.20 120.12 5lve s ILE 48 Ca -0.12 -0.58 -0.01 0.00 0.00 0.00 0.00 60.65 59.95 5lve s ILE 48 Cb 0.04 -0.36 -0.03 0.00 0.01 0.00 0.00 42.46 42.12 5lve s ILE 48 CO 0.15 -0.32 0.25 -0.72 0.00 0.00 0.00 174.94 174.30 5lve s TYR 49 N -1.09 1.16 -1.34 3.97 1.13 -0.04 0.30 117.35 121.43 5lve s TYR 49 Ca -0.12 -1.33 -0.00 0.00 -1.41 0.00 0.00 57.07 54.20 5lve s TYR 49 Cb -0.07 -0.43 0.00 0.00 -1.10 0.00 0.00 41.96 40.37 5lve s TYR 49 CO 0.01 -0.79 0.03 0.91 -2.51 0.00 0.00 175.55 173.19 5lve n TRP 50 N -0.39 -1.29 0.00 -3.49 5.03 -0.89 -0.52 117.44 115.89 5lve n TRP 50 Ca 0.03 0.02 0.00 0.00 3.03 0.00 0.00 57.50 60.58 5lve n TRP 50 Cb 0.64 -3.26 0.00 0.00 -1.03 0.00 0.00 31.31 27.66 5lve n TRP 50 CO 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 177.69 177.66 5lve n ALA 51 N -2.21 0.00 -0.63 6.99 0.00 -0.03 -4.17 120.51 120.47 5lve n ALA 51 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 5lve n ALA 51 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.09 5lve n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 5lve n SER 52 N 0.71 0.31 -4.69 0.00 3.41 -1.08 -3.46 113.62 108.83 5lve n SER 52 Ca 0.00 -0.95 -0.40 0.00 -0.26 0.00 0.00 58.87 57.26 5lve n SER 52 Cb 0.00 0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 63.92 5lve n SER 52 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 5lve s THR 53 N -0.02 5.01 0.21 6.66 2.01 0.32 -4.57 115.64 125.27 5lve s THR 53 Ca 0.00 1.36 -0.30 0.00 0.31 0.00 0.00 61.69 63.06 5lve s THR 53 Cb 0.00 -4.01 -0.08 0.00 0.01 0.00 0.00 72.50 68.42 5lve s THR 53 CO 0.00 0.16 0.94 -0.13 -0.69 0.00 0.00 174.62 174.90 5lve s ARG 54 N 1.45 4.81 0.63 4.92 0.52 -1.26 -0.87 118.95 129.15 5lve s ARG 54 Ca 0.34 1.47 -0.14 0.00 -0.52 0.00 0.00 55.73 56.88 5lve s ARG 54 Cb -0.17 -3.30 -0.02 0.00 0.52 0.00 0.00 34.95 31.98 5lve s ARG 54 CO 0.14 0.45 1.05 -2.00 0.02 0.00 0.00 175.30 174.96 5lve s GLU 55 N -0.92 3.19 0.16 3.54 2.56 -0.48 -4.93 118.70 121.82 5lve s GLU 55 Ca 0.42 1.09 -0.34 0.00 0.00 0.00 0.00 54.97 56.15 5lve s GLU 55 Cb -0.25 -2.02 -0.16 0.00 2.00 0.00 0.00 34.13 33.70 5lve s GLU 55 CO 0.31 -0.90 1.23 0.43 -0.56 0.00 0.00 175.26 175.76 5lve n SER 56 N -2.45 1.53 0.00 -1.70 7.64 -1.26 -1.68 113.62 115.70 5lve n SER 56 Ca 0.08 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.10 5lve n SER 56 Cb 0.53 -1.23 0.00 0.00 -1.01 0.00 0.00 64.21 62.50 5lve n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 5lve n GLY 57 N 2.17 2.32 3.71 0.23 0.00 -1.26 -5.03 105.19 107.33 5lve n GLY 57 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 5lve n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 5lve s VAL 58 N -2.44 4.74 0.67 1.61 1.01 -0.68 -5.02 120.40 120.29 5lve s VAL 58 Ca 0.00 1.97 -0.17 0.00 0.00 0.00 0.00 61.98 63.78 5lve s VAL 58 Cb 0.00 -4.26 0.00 0.00 0.00 0.00 0.00 36.38 32.12 5lve s VAL 58 CO 0.00 0.12 1.24 -2.84 0.00 0.00 0.00 175.10 173.63 5lve s PRO 59 N 1.21 2.48 0.53 2.72 0.02 -1.26 -4.88 135.00 135.82 5lve s PRO 59 Ca 0.52 1.91 0.36 0.00 0.02 0.00 0.00 61.00 63.80 5lve s PRO 59 Cb -0.22 -1.86 1.80 0.00 0.02 0.00 0.00 34.50 34.24 5lve s PRO 59 CO 0.26 -1.61 2.08 -0.44 -0.33 0.00 0.00 177.00 176.96 5lve h ASP 60 N 0.30 0.00 0.48 2.53 3.32 -2.01 -2.36 116.42 118.67 5lve h ASP 60 Ca -0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.55 5lve h ASP 60 Cb 1.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.86 5lve h ASP 60 CO 0.52 0.00 0.00 0.08 -1.72 0.00 0.00 179.24 178.12 5lve h ARG 61 N 0.00 0.00 -5.84 3.56 0.11 -1.94 -3.41 114.38 106.87 5lve h ARG 61 Ca 0.00 0.00 -0.57 0.00 0.10 0.00 0.00 59.98 59.51 5lve h ARG 61 Cb 0.15 0.00 -0.07 0.00 1.11 0.00 0.00 29.97 31.16 5lve h ARG 61 CO 0.00 0.00 0.01 -0.06 0.10 0.00 0.00 179.97 180.02 5lve s PHE 62 N -3.88 3.51 -0.06 4.08 0.40 -0.89 -2.01 117.98 119.13 5lve s PHE 62 Ca -0.02 1.05 -0.01 0.00 -0.60 0.00 0.00 56.93 57.35 5lve s PHE 62 Cb 0.11 -2.71 0.03 0.00 0.51 0.00 0.00 43.02 40.95 5lve s PHE 62 CO 0.46 0.06 0.00 0.45 0.70 0.00 0.00 175.22 176.89 5lve s SER 63 N 0.82 1.27 -0.11 1.36 0.15 0.37 -4.98 113.70 112.58 5lve s SER 63 Ca 0.31 -0.06 -0.06 0.00 0.70 0.00 0.00 55.95 56.84 5lve s SER 63 Cb -0.16 -0.38 -0.04 0.00 -1.71 0.00 0.00 66.02 63.73 5lve s SER 63 CO 0.14 -0.17 0.12 -0.83 1.20 0.00 0.00 173.24 173.70 5lve s GLY 64 N 1.69 2.11 0.29 9.45 0.00 -1.26 -0.23 107.32 119.36 5lve s GLY 64 Ca 0.00 -0.68 -0.05 0.00 0.00 0.00 0.00 44.72 43.99 5lve s GLY 64 CO -0.04 -0.44 0.41 -1.35 0.00 0.00 0.00 173.10 171.69 5lve s SER 65 N -1.07 0.49 0.00 1.64 1.04 0.05 -4.24 113.70 111.61 5lve s SER 65 Ca 0.16 -1.30 0.00 0.00 0.48 0.00 0.00 55.95 55.28 5lve s SER 65 Cb -0.12 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.59 5lve s SER 65 CO 0.05 -1.16 0.00 0.61 0.98 0.00 0.00 173.24 173.72 5lve n GLY 66 N -0.46 1.16 3.53 7.32 0.00 -1.26 -0.82 105.19 114.67 5lve n GLY 66 Ca 0.01 -2.15 -0.08 0.00 0.00 0.00 0.00 46.02 43.80 5lve n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 5lve s SER 67 N 0.00 -0.31 0.27 1.61 0.15 -0.57 -4.93 113.70 109.93 5lve s SER 67 Ca 0.00 0.04 0.00 0.00 0.70 0.00 0.00 55.95 56.69 5lve s SER 67 Cb 0.00 0.32 0.00 0.00 -1.71 0.00 0.00 66.02 64.63 5lve s SER 67 CO 0.00 -0.51 0.00 0.61 1.20 0.00 0.00 173.24 174.54 5lve n GLY 68 N -0.11 1.57 0.00 9.45 0.00 -1.26 -2.56 105.19 112.28 5lve n GLY 68 Ca -0.07 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.08 5lve n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 5lve n THR 69 N 0.00 0.00 -4.02 2.61 -2.24 -1.26 -1.50 114.28 107.87 5lve n THR 69 Ca 0.00 -0.44 -0.31 0.00 -2.27 0.00 0.00 64.05 61.03 5lve n THR 69 Cb 0.00 1.09 -0.16 0.00 -2.10 0.00 0.00 70.33 69.16 5lve n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 5lve s ASP 70 N -0.21 3.46 0.19 3.42 1.01 -1.06 -1.29 116.67 122.19 5lve s ASP 70 Ca 0.00 -0.91 0.08 0.00 0.71 0.00 0.00 52.55 52.43 5lve s ASP 70 Cb 0.00 -1.30 -0.04 0.00 1.01 0.00 0.00 42.92 42.59 5lve s ASP 70 CO 0.00 -0.13 -0.15 -0.36 0.21 0.00 0.00 175.17 174.74 5lve s PHE 71 N 1.35 1.69 -0.03 4.23 0.40 0.58 -1.51 117.98 124.70 5lve s PHE 71 Ca -0.01 -0.55 -0.03 0.00 -0.60 0.00 0.00 56.93 55.73 5lve s PHE 71 Cb -0.16 -0.81 0.01 0.00 0.51 0.00 0.00 43.02 42.57 5lve s PHE 71 CO -0.08 0.33 0.09 0.99 0.70 0.00 0.00 175.22 177.24 5lve s THR 72 N -2.69 0.02 -0.15 0.64 2.01 0.00 -1.14 115.64 114.32 5lve s THR 72 Ca 0.19 -0.14 -0.00 0.00 0.31 0.00 0.00 61.69 62.05 5lve s THR 72 Cb -0.02 -0.17 -0.01 0.00 0.01 0.00 0.00 72.50 72.31 5lve s THR 72 CO 0.06 -0.08 -0.13 -0.22 -0.69 0.00 0.00 174.62 173.57 5lve s LEU 73 N -0.21 2.62 -0.08 4.42 2.96 -0.36 -0.77 118.68 127.27 5lve s LEU 73 Ca -0.03 -0.40 0.04 0.00 -0.22 0.00 0.00 54.13 53.52 5lve s LEU 73 Cb -0.02 -1.60 0.00 0.00 0.50 0.00 0.00 46.19 45.07 5lve s LEU 73 CO 0.00 0.10 -0.20 -0.89 -1.32 0.00 0.00 176.35 174.05 5lve s THR 74 N 0.71 1.72 -0.33 3.68 2.01 0.68 -1.45 115.64 122.67 5lve s THR 74 Ca -0.06 -0.83 -0.03 0.00 0.31 0.00 0.00 61.69 61.08 5lve s THR 74 Cb -0.15 -1.51 0.06 0.00 0.01 0.00 0.00 72.50 70.91 5lve s THR 74 CO 0.02 0.49 0.05 -0.63 -0.69 0.00 0.00 174.62 173.86 5lve s ILE 75 N 0.42 3.15 0.24 1.82 1.01 0.35 -0.48 121.20 127.71 5lve s ILE 75 Ca -0.16 -1.49 -0.05 0.00 0.00 0.00 0.00 60.65 58.95 5lve s ILE 75 Cb -0.17 -2.88 0.21 0.00 0.01 0.00 0.00 42.46 39.63 5lve s ILE 75 CO 0.07 -0.23 1.83 0.77 0.00 0.00 0.00 174.94 177.37 5lve h SER 76 N 8.03 0.75 -2.21 3.58 4.64 -1.68 0.83 113.55 127.50 5lve h SER 76 Ca -0.20 0.03 -0.38 0.00 -0.47 0.00 0.00 61.79 60.78 5lve h SER 76 Cb 1.06 -0.12 -0.34 0.00 -0.31 0.00 0.00 62.40 62.69 5lve h SER 76 CO 0.57 0.46 -0.68 -0.55 -0.87 0.00 0.00 176.83 175.76 5lve s SER 77 N -5.69 1.89 0.12 4.97 0.15 -1.25 -3.33 113.70 110.56 5lve s SER 77 Ca -0.12 -1.10 -0.32 0.00 0.70 0.00 0.00 55.95 55.10 5lve s SER 77 Cb 0.19 0.35 -0.12 0.00 -1.71 0.00 0.00 66.02 64.73 5lve s SER 77 CO 0.79 -0.36 1.75 -0.11 1.20 0.00 0.00 173.24 176.50 5lve n LEU 78 N 4.99 3.69 -4.84 3.45 7.94 0.48 -4.70 117.00 128.00 5lve n LEU 78 Ca 0.01 1.03 -0.21 0.00 -1.11 0.00 0.00 56.01 55.72 5lve n LEU 78 Cb 0.45 -1.50 -0.04 0.00 0.53 0.00 0.00 43.42 42.87 5lve n LEU 78 CO 0.04 0.02 -0.09 -1.10 -1.11 0.00 0.00 177.39 175.14 5lve s GLN 79 N 2.11 2.69 0.25 1.96 -1.52 -1.26 0.09 119.66 123.99 5lve s GLN 79 Ca 0.81 -1.32 -0.03 0.00 -1.95 0.00 0.00 55.36 52.88 5lve s GLN 79 Cb -0.57 -2.45 0.46 0.00 -0.22 0.00 0.00 33.01 30.24 5lve s GLN 79 CO 0.38 0.10 1.78 0.00 -0.25 0.00 0.00 175.29 177.30 5lve h ALA 80 N 1.28 1.20 0.00 6.09 0.00 -2.00 -0.65 119.26 125.17 5lve h ALA 80 Ca -0.45 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.53 5lve h ALA 80 Cb 1.25 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.00 5lve h ALA 80 CO 0.59 -0.04 0.00 -0.85 0.00 0.00 0.00 179.25 178.95 5lve n GLU 81 N -4.84 0.14 0.00 0.00 0.28 -1.26 -2.76 120.64 112.19 5lve n GLU 81 Ca 0.15 0.17 0.13 0.00 -0.16 0.00 0.00 57.16 57.44 5lve n GLU 81 Cb 0.37 -1.50 0.33 0.00 1.43 0.00 0.00 31.44 32.06 5lve n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 5lve n ASP 82 N -1.38 0.74 -4.65 -1.84 8.00 -0.25 -4.86 116.55 112.31 5lve n ASP 82 Ca 0.06 -0.56 -0.42 0.00 0.71 0.00 0.00 54.79 54.58 5lve n ASP 82 Cb 0.16 0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 41.41 5lve n ASP 82 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 5lve s VAL 83 N -2.75 3.32 -0.06 2.53 1.01 -1.11 -4.86 120.40 118.48 5lve s VAL 83 Ca 0.18 0.37 -0.22 0.00 0.00 0.00 0.00 61.98 62.31 5lve s VAL 83 Cb 0.18 -3.28 0.07 0.00 0.00 0.00 0.00 36.38 33.36 5lve s VAL 83 CO 0.61 -0.07 0.97 0.00 0.00 0.00 0.00 175.10 176.61 5lve n ALA 84 N 8.15 -2.80 -2.79 5.51 0.00 -1.16 -4.68 120.51 122.73 5lve n ALA 84 Ca 0.20 -0.53 -0.35 0.00 0.00 0.00 0.00 53.44 52.76 5lve n ALA 84 Cb 0.43 0.02 -0.10 0.00 0.00 0.00 0.00 19.45 19.81 5lve n ALA 84 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 5lve s VAL 85 N -2.01 4.96 -0.14 0.00 1.01 -0.61 -0.79 120.40 122.82 5lve s VAL 85 Ca 0.23 0.03 -0.05 0.00 0.00 0.00 0.00 61.98 62.20 5lve s VAL 85 Cb -0.00 -3.26 -0.03 0.00 0.00 0.00 0.00 36.38 33.08 5lve s VAL 85 CO -0.02 0.43 0.02 -0.31 0.00 0.00 0.00 175.10 175.22 5lve s TYR 86 N 0.60 3.19 -0.01 5.22 1.51 0.01 -0.53 117.35 127.33 5lve s TYR 86 Ca 0.05 0.05 0.07 0.00 -1.01 0.00 0.00 57.07 56.24 5lve s TYR 86 Cb -0.13 -1.94 -0.02 0.00 -0.11 0.00 0.00 41.96 39.77 5lve s TYR 86 CO 0.01 0.26 -0.24 0.71 -1.11 0.00 0.00 175.55 175.18 5lve s TYR 87 N -0.16 2.12 0.12 2.71 2.02 -0.24 -1.14 117.35 122.79 5lve s TYR 87 Ca 0.06 -0.40 0.02 0.00 -0.37 0.00 0.00 57.07 56.38 5lve s TYR 87 Cb -0.12 -1.36 -0.04 0.00 -0.40 0.00 0.00 41.96 40.04 5lve s TYR 87 CO 0.02 -0.03 0.23 0.00 -1.57 0.00 0.00 175.55 174.20 5lve s ALA 89 N -1.65 -0.93 -0.09 0.00 0.00 0.56 -1.55 121.76 118.10 5lve s ALA 89 Ca 0.34 0.57 -0.01 0.00 0.00 0.00 0.00 51.96 52.86 5lve s ALA 89 Cb -0.12 -0.05 -0.03 0.00 0.00 0.00 0.00 23.12 22.92 5lve s ALA 89 CO 0.27 -0.26 -0.04 1.14 0.00 0.00 0.00 175.76 176.87 5lve s GLN 90 N -1.06 3.01 -0.26 0.00 1.03 -0.26 -0.55 119.66 121.57 5lve s GLN 90 Ca -0.11 -0.50 0.13 0.00 0.04 0.00 0.00 55.36 54.92 5lve s GLN 90 Cb -0.04 -2.72 0.47 0.00 0.03 0.00 0.00 33.01 30.75 5lve s GLN 90 CO 0.04 0.58 1.17 2.48 -2.54 0.00 0.00 175.29 177.02 5lve n TYR 91 N 2.48 1.94 0.00 9.60 4.11 -0.70 -2.56 117.16 132.03 5lve n TYR 91 Ca -0.18 -2.05 -0.19 0.00 -0.00 0.00 0.00 57.90 55.48 5lve n TYR 91 Cb 0.53 -0.29 -0.14 0.00 -0.00 0.00 0.00 39.34 39.44 5lve n TYR 91 CO 0.00 0.00 0.00 -0.92 -0.00 0.00 0.00 176.86 175.94 5lve h TYR 92 N 2.14 0.36 -3.11 -3.48 3.20 -1.92 -3.48 116.97 110.68 5lve h TYR 92 Ca 0.16 -0.26 -0.16 0.00 3.14 0.00 0.00 58.73 61.61 5lve h TYR 92 Cb 1.43 -0.01 -0.26 0.00 1.54 0.00 0.00 36.73 39.43 5lve h TYR 92 CO 0.71 1.30 -0.42 -1.54 -1.64 0.00 0.00 178.16 176.57 5lve s SER 93 N -6.80 -0.27 0.44 -2.11 1.04 -1.26 -5.09 113.70 99.65 5lve s SER 93 Ca -0.17 0.52 -0.23 0.00 0.48 0.00 0.00 55.95 56.54 5lve s SER 93 Cb 0.01 0.52 -0.08 0.00 0.10 0.00 0.00 66.02 66.57 5lve s SER 93 CO 0.77 -0.09 1.13 0.42 0.98 0.00 0.00 173.24 176.45 5lve s THR 94 N 0.18 3.30 0.14 2.02 -4.23 -1.26 -3.68 115.64 112.10 5lve s THR 94 Ca -0.00 0.98 -0.30 0.00 -1.18 0.00 0.00 61.69 61.18 5lve s THR 94 Cb -0.02 -3.50 -0.07 0.00 1.34 0.00 0.00 72.50 70.26 5lve s THR 94 CO 0.00 -0.01 1.12 -2.84 -0.54 0.00 0.00 174.62 172.35 5lve s PRO 95 N -2.65 4.55 0.36 3.99 0.02 -1.26 -4.99 135.00 135.01 5lve s PRO 95 Ca 0.62 1.72 -0.28 0.00 0.02 0.00 0.00 61.00 63.07 5lve s PRO 95 Cb -0.26 -3.31 -0.11 0.00 0.02 0.00 0.00 34.50 30.84 5lve s PRO 95 CO 0.32 -0.02 1.48 0.71 -0.33 0.00 0.00 177.00 179.16 5lve s TYR 96 N 0.18 2.67 0.13 6.54 2.02 -1.24 -4.74 117.35 122.91 5lve s TYR 96 Ca 0.52 1.15 0.08 0.00 -0.37 0.00 0.00 57.07 58.45 5lve s TYR 96 Cb -0.29 -3.98 -0.04 0.00 -0.40 0.00 0.00 41.96 37.25 5lve s TYR 96 CO 0.33 -2.92 -0.18 -1.54 -1.57 0.00 0.00 175.55 169.68 5lve s SER 97 N -0.11 2.42 0.15 2.29 1.04 -1.06 -4.97 113.70 113.46 5lve s SER 97 Ca 0.54 -0.79 0.08 0.00 0.48 0.00 0.00 55.95 56.26 5lve s SER 97 Cb -0.46 -0.12 -0.04 0.00 0.10 0.00 0.00 66.02 65.50 5lve s SER 97 CO 0.60 -0.04 -0.09 -0.36 0.98 0.00 0.00 173.24 174.34 5lve s PHE 98 N -1.78 2.70 0.72 5.02 0.40 -1.26 -1.10 117.98 122.68 5lve s PHE 98 Ca 0.10 -0.19 -0.11 0.00 -0.60 0.00 0.00 56.93 56.13 5lve s PHE 98 Cb -0.07 -1.35 0.16 0.00 0.51 0.00 0.00 43.02 42.27 5lve s PHE 98 CO 0.05 0.48 0.98 0.41 0.70 0.00 0.00 175.22 177.84 5lve n GLY 99 N 0.27 -1.24 1.15 4.36 0.00 -0.60 -4.51 105.19 104.61 5lve n GLY 99 Ca -0.12 -1.73 0.07 0.00 0.00 0.00 0.00 46.02 44.25 5lve n GLY 99 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 5lve n GLN 100 N -3.06 2.73 -0.35 1.61 6.02 -1.26 -4.83 117.38 118.24 5lve n GLN 100 Ca 0.13 -2.02 0.04 0.00 -0.01 0.00 0.00 57.00 55.14 5lve n GLN 100 Cb 0.44 -1.62 -0.02 0.00 1.02 0.00 0.00 30.24 30.06 5lve n GLN 100 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 5lve n GLY 101 N 1.05 -2.54 2.88 1.08 0.00 -1.26 -4.98 105.19 101.43 5lve n GLY 101 Ca 0.18 -1.37 -0.26 0.00 0.00 0.00 0.00 46.02 44.57 5lve n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 5lve s THR 102 N -2.92 0.92 -0.20 2.61 2.01 -0.29 -4.65 115.64 113.12 5lve s THR 102 Ca 0.00 -0.23 -0.21 0.00 0.31 0.00 0.00 61.69 61.56 5lve s THR 102 Cb 0.00 -0.97 -0.03 0.00 0.01 0.00 0.00 72.50 71.52 5lve s THR 102 CO 0.00 0.34 0.63 -0.75 -0.69 0.00 0.00 174.62 174.16 5lve s LYS 103 N 1.75 4.22 -0.27 4.92 2.20 -0.29 -0.81 119.74 131.46 5lve s LYS 103 Ca 0.05 0.62 -0.10 0.00 -0.36 0.00 0.00 55.97 56.18 5lve s LYS 103 Cb -0.13 -3.58 -0.05 0.00 -1.51 0.00 0.00 37.83 32.57 5lve s LYS 103 CO -0.08 -0.24 0.16 -0.51 -0.36 0.00 0.00 175.35 174.32 5lve s LEU 104 N 1.90 3.91 0.31 5.43 1.43 0.03 -0.17 118.68 131.52 5lve s LEU 104 Ca 0.29 -0.03 0.08 0.00 -1.03 0.00 0.00 54.13 53.44 5lve s LEU 104 Cb -0.16 -2.07 -0.06 0.00 0.03 0.00 0.00 46.19 43.93 5lve s LEU 104 CO 0.10 -0.03 -0.08 -1.61 0.23 0.00 0.00 176.35 174.97 5lve s GLU 105 N 1.60 1.67 -0.37 1.70 2.02 -0.64 -3.00 118.70 121.68 5lve s GLU 105 Ca 0.07 -1.85 -0.06 0.00 0.02 0.00 0.00 54.97 53.15 5lve s GLU 105 Cb -0.15 -1.40 0.07 0.00 0.10 0.00 0.00 34.13 32.74 5lve s GLU 105 CO 0.08 0.09 0.15 0.42 0.02 0.00 0.00 175.26 176.02 5lve s ILE 106 N -2.83 3.66 0.00 -1.63 1.01 -1.25 -1.51 121.20 118.65 5lve s ILE 106 Ca 0.31 -1.44 0.00 0.00 0.00 0.00 0.00 60.65 59.52 5lve s ILE 106 Cb 0.03 -3.21 0.00 0.00 0.01 0.00 0.00 42.46 39.29 5lve s ILE 106 CO 0.14 -0.36 0.00 2.29 0.00 0.00 0.00 174.94 177.01 5lve n LYS 107 N 4.76 0.00 0.00 2.79 2.85 0.31 -4.88 118.16 124.00 5lve n LYS 107 Ca -0.10 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.16 5lve n LYS 107 Cb 0.43 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.81 5lve n LYS 107 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22