#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ucb s VAL 2 N 0.00 3.05 0.01 6.31 0.11 -1.26 -4.11 120.40 124.51 1ucb s VAL 2 Ca 0.00 0.06 0.08 0.00 -2.93 0.00 0.00 61.98 59.19 1ucb s VAL 2 Cb 0.00 -3.04 -0.02 0.00 -1.53 0.00 0.00 36.38 31.78 1ucb s VAL 2 CO 0.00 -0.01 -0.26 0.20 -3.33 0.00 0.00 175.10 171.70 1ucb s ASN 3 N 5.24 3.06 -0.25 3.54 0.02 0.42 -4.97 114.94 122.00 1ucb s ASN 3 Ca 0.90 -0.52 -0.03 0.00 -1.02 0.00 0.00 52.86 52.20 1ucb s ASN 3 Cb -0.40 -0.31 0.08 0.00 0.02 0.00 0.00 41.25 40.64 1ucb s ASN 3 CO 0.40 0.29 0.08 -0.76 0.02 0.00 0.00 177.10 177.12 1ucb s LEU 4 N -0.88 1.36 -0.29 0.60 1.43 -1.26 -1.71 118.68 117.93 1ucb s LEU 4 Ca 0.11 -1.19 -0.06 0.00 -1.03 0.00 0.00 54.13 51.95 1ucb s LEU 4 Cb -0.10 -0.61 0.02 0.00 0.03 0.00 0.00 46.19 45.52 1ucb s LEU 4 CO 0.00 -0.38 0.06 0.68 0.23 0.00 0.00 176.35 176.95 1ucb s VAL 5 N 1.84 3.76 0.49 -1.59 -7.23 -0.41 -3.63 120.40 113.64 1ucb s VAL 5 Ca 0.05 -0.82 -0.06 0.00 -1.81 0.00 0.00 61.98 59.35 1ucb s VAL 5 Cb -0.17 -2.97 -0.04 0.00 0.56 0.00 0.00 36.38 33.77 1ucb s VAL 5 CO -0.20 0.06 0.80 -1.61 -0.31 0.00 0.00 175.10 173.83 1ucb s GLU 6 N 1.46 3.55 0.07 4.82 8.01 -1.26 -1.30 118.70 134.05 1ucb s GLU 6 Ca 0.01 0.23 -0.27 0.00 0.01 0.00 0.00 54.97 54.96 1ucb s GLU 6 Cb -0.17 -2.36 0.09 0.00 -4.31 0.00 0.00 34.13 27.37 1ucb s GLU 6 CO 0.01 -0.22 1.03 -1.54 0.01 0.00 0.00 175.26 174.55 1ucb s SER 7 N -4.10 -0.18 0.00 -0.19 1.04 0.11 -4.90 113.70 105.48 1ucb s SER 7 Ca 0.48 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.65 1ucb s SER 7 Cb -0.10 0.38 0.00 0.00 0.10 0.00 0.00 66.02 66.40 1ucb s SER 7 CO 0.45 -0.69 0.00 0.61 0.98 0.00 0.00 173.24 174.59 1ucb n GLY 8 N -0.41 0.25 3.78 7.32 0.00 -1.26 -0.36 105.19 114.50 1ucb n GLY 8 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 1ucb n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ucb s GLY 9 N -1.55 2.73 0.00 -0.02 0.00 -1.26 -4.68 107.32 102.53 1ucb s GLY 9 Ca 0.00 0.80 0.00 0.00 0.00 0.00 0.00 44.72 45.52 1ucb s GLY 9 CO 0.00 1.23 0.00 0.61 0.00 0.00 0.00 173.10 174.94 1ucb n GLY 10 N 0.33 1.12 3.70 0.20 0.00 -1.07 -4.88 105.19 104.59 1ucb n GLY 10 Ca 0.07 -0.71 -0.39 0.00 0.00 0.00 0.00 46.02 44.99 1ucb n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ucb s LEU 11 N 0.00 4.24 0.03 0.99 2.96 -1.26 -1.55 118.68 124.09 1ucb s LEU 11 Ca 0.00 0.82 0.04 0.00 -0.22 0.00 0.00 54.13 54.77 1ucb s LEU 11 Cb 0.00 -2.76 -0.02 0.00 0.50 0.00 0.00 46.19 43.91 1ucb s LEU 11 CO 0.00 -0.08 -0.12 0.68 -1.32 0.00 0.00 176.35 175.50 1ucb s VAL 12 N 1.00 0.98 0.39 1.68 -7.23 -0.31 -4.98 120.40 111.92 1ucb s VAL 12 Ca 0.27 -0.89 -0.16 0.00 -1.81 0.00 0.00 61.98 59.39 1ucb s VAL 12 Cb -0.16 -0.89 -0.09 0.00 0.56 0.00 0.00 36.38 35.81 1ucb s VAL 12 CO 0.11 0.00 0.83 -1.10 -0.31 0.00 0.00 175.10 174.63 1ucb s GLN 13 N -1.01 4.03 0.13 4.82 -0.21 -1.23 -0.41 119.66 125.78 1ucb s GLN 13 Ca 0.01 0.80 -0.35 0.00 0.02 0.00 0.00 55.36 55.84 1ucb s GLN 13 Cb -0.07 -2.32 -0.15 0.00 1.00 0.00 0.00 33.01 31.47 1ucb s GLN 13 CO 0.01 0.02 1.50 -2.30 -2.12 0.00 0.00 175.29 172.40 1ucb n PRO 14 N -0.73 1.79 0.00 2.91 -0.02 -1.26 -1.15 135.00 136.54 1ucb n PRO 14 Ca 0.05 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1ucb n PRO 14 Cb 0.54 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 1ucb n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ucb n GLY 15 N 3.12 0.47 2.97 -1.23 0.00 0.54 -4.97 105.19 106.10 1ucb n GLY 15 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 1ucb n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ucb n GLY 16 N -2.00 -1.80 3.35 -0.02 0.00 -0.30 -4.21 105.19 100.21 1ucb n GLY 16 Ca 0.00 -1.64 -0.20 0.00 0.00 0.00 0.00 46.02 44.18 1ucb n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ucb s SER 17 N -4.56 2.69 -0.06 1.61 0.01 -1.26 -3.15 113.70 108.98 1ucb s SER 17 Ca 0.59 -0.95 -0.31 0.00 1.31 0.00 0.00 55.95 56.59 1ucb s SER 17 Cb -0.03 -0.16 0.07 0.00 0.21 0.00 0.00 66.02 66.12 1ucb s SER 17 CO 0.42 -0.09 0.70 -0.22 0.41 0.00 0.00 173.24 174.46 1ucb s LEU 18 N -3.04 -0.64 -0.20 2.44 2.96 -0.53 -4.99 118.68 114.68 1ucb s LEU 18 Ca 0.20 0.70 -0.01 0.00 -0.22 0.00 0.00 54.13 54.80 1ucb s LEU 18 Cb -0.03 2.50 0.06 0.00 0.50 0.00 0.00 46.19 49.21 1ucb s LEU 18 CO 0.07 -0.59 -0.00 -0.75 -1.32 0.00 0.00 176.35 173.76 1ucb s LYS 19 N -1.18 1.03 0.19 1.98 2.20 -1.26 -0.02 119.74 122.68 1ucb s LYS 19 Ca -0.10 -0.61 -0.08 0.00 -0.36 0.00 0.00 55.97 54.82 1ucb s LYS 19 Cb -0.00 -2.24 -0.07 0.00 -1.51 0.00 0.00 37.83 34.01 1ucb s LYS 19 CO 0.09 -0.61 0.48 0.14 -0.36 0.00 0.00 175.35 175.09 1ucb s VAL 20 N 1.69 5.03 0.18 4.02 -7.23 -1.03 -4.71 120.40 118.35 1ucb s VAL 20 Ca -0.02 0.32 0.08 0.00 -1.81 0.00 0.00 61.98 60.55 1ucb s VAL 20 Cb -0.17 -3.62 -0.04 0.00 0.56 0.00 0.00 36.38 33.10 1ucb s VAL 20 CO -0.07 0.00 -0.17 -0.94 -0.31 0.00 0.00 175.10 173.61 1ucb s SER 21 N -2.33 2.61 -0.19 4.85 1.04 0.52 -2.26 113.70 117.94 1ucb s SER 21 Ca 0.44 -0.92 -0.03 0.00 0.48 0.00 0.00 55.95 55.92 1ucb s SER 21 Cb -0.12 -0.15 0.06 0.00 0.10 0.00 0.00 66.02 65.92 1ucb s SER 21 CO 0.22 -0.09 0.05 0.00 0.98 0.00 0.00 173.24 174.40 1ucb s VAL 23 N 1.92 5.32 0.47 0.00 1.01 -0.42 -0.31 120.40 128.38 1ucb s VAL 23 Ca -0.00 0.46 0.07 0.00 0.00 0.00 0.00 61.98 62.51 1ucb s VAL 23 Cb -0.17 -3.60 -0.00 0.00 0.00 0.00 0.00 36.38 32.61 1ucb s VAL 23 CO -0.09 0.38 0.34 0.42 0.00 0.00 0.00 175.10 176.16 1ucb s THR 24 N 0.58 2.19 -0.21 3.92 -4.23 -0.66 -1.29 115.64 115.93 1ucb s THR 24 Ca 0.14 -1.48 -0.35 0.00 -1.18 0.00 0.00 61.69 58.82 1ucb s THR 24 Cb -0.13 -2.67 0.14 0.00 1.34 0.00 0.00 72.50 71.19 1ucb s THR 24 CO 0.03 0.00 1.23 -0.94 -0.54 0.00 0.00 174.62 174.40 1ucb s SER 25 N -4.14 -0.12 0.00 3.99 1.04 -0.69 -4.93 113.70 108.84 1ucb s SER 25 Ca 0.41 0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.85 1ucb s SER 25 Cb -0.01 0.12 0.00 0.00 0.10 0.00 0.00 66.02 66.23 1ucb s SER 25 CO 0.24 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 174.87 1ucb n GLY 26 N -0.03 0.58 3.55 7.32 0.00 -1.26 -0.43 105.19 114.92 1ucb n GLY 26 Ca 0.01 -0.38 -0.06 0.00 0.00 0.00 0.00 46.02 45.58 1ucb n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ucb s PHE 27 N -2.00 -0.23 -0.87 1.61 -0.71 -1.26 -4.03 117.98 110.48 1ucb s PHE 27 Ca 0.00 0.15 -0.25 0.00 -1.04 0.00 0.00 56.93 55.80 1ucb s PHE 27 Cb 0.00 0.52 0.04 0.00 -1.21 0.00 0.00 43.02 42.38 1ucb s PHE 27 CO 0.00 -0.36 1.34 0.99 -1.34 0.00 0.00 175.22 175.85 1ucb s THR 28 N -2.69 3.87 0.29 -4.49 2.01 -1.26 -4.88 115.64 108.49 1ucb s THR 28 Ca 0.07 -0.22 0.00 0.00 0.31 0.00 0.00 61.69 61.86 1ucb s THR 28 Cb -0.01 -4.97 0.41 0.00 0.01 0.00 0.00 72.50 67.94 1ucb s THR 28 CO -0.07 -1.87 1.49 0.33 -0.69 0.00 0.00 174.62 173.82 1ucb n PHE 29 N 9.00 0.57 0.20 4.92 7.35 -1.26 -1.03 117.46 137.21 1ucb n PHE 29 Ca 0.17 1.15 0.14 0.00 -0.76 0.00 0.00 57.45 58.15 1ucb n PHE 29 Cb 0.50 -1.19 0.72 0.00 0.35 0.00 0.00 39.48 39.86 1ucb n PHE 29 CO 0.00 0.00 0.00 0.77 -0.76 0.00 0.00 176.76 176.77 1ucb h SER 30 N 0.00 0.00 1.08 -2.13 0.02 -1.88 -2.63 113.55 108.01 1ucb h SER 30 Ca 0.56 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.47 1ucb h SER 30 Cb 1.12 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.65 1ucb h SER 30 CO -0.91 0.00 -0.94 0.44 -1.14 0.00 0.00 176.83 174.28 1ucb h ASP 31 N 0.00 0.00 -2.75 3.07 3.32 -1.42 -3.42 116.42 115.21 1ucb h ASP 31 Ca 0.00 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.46 1ucb h ASP 31 Cb 0.04 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.49 1ucb h ASP 31 CO 0.00 0.15 -0.62 -0.31 -1.72 0.00 0.00 179.24 176.74 1ucb s TYR 32 N -3.23 2.95 0.13 4.55 1.51 -0.99 -4.87 117.35 117.39 1ucb s TYR 32 Ca 0.00 -0.10 -0.25 0.00 -1.01 0.00 0.00 57.07 55.71 1ucb s TYR 32 Cb 0.09 -1.41 -0.07 0.00 -0.11 0.00 0.00 41.96 40.45 1ucb s TYR 32 CO 0.78 0.52 0.77 0.71 -1.11 0.00 0.00 175.55 177.22 1ucb s TYR 33 N -1.78 3.86 0.27 2.71 1.51 -1.26 -3.82 117.35 118.84 1ucb s TYR 33 Ca 0.29 1.59 0.08 0.00 -1.01 0.00 0.00 57.07 58.03 1ucb s TYR 33 Cb -0.09 -2.78 -0.04 0.00 -0.11 0.00 0.00 41.96 38.94 1ucb s TYR 33 CO 0.20 0.46 0.10 -1.64 -1.11 0.00 0.00 175.55 173.56 1ucb s MET 34 N -0.87 2.57 0.06 -0.62 -1.94 -1.02 -3.42 119.30 114.05 1ucb s MET 34 Ca 0.36 -1.28 -0.05 0.00 -1.71 0.00 0.00 55.69 53.02 1ucb s MET 34 Cb -0.22 -2.33 -0.02 0.00 2.01 0.00 0.00 34.83 34.26 1ucb s MET 34 CO 0.25 0.35 0.08 0.71 -0.01 0.00 0.00 175.02 176.41 1ucb s TYR 35 N -2.26 0.31 -0.09 -0.03 2.02 -0.36 -2.10 117.35 114.84 1ucb s TYR 35 Ca 0.33 -0.75 0.01 0.00 -0.37 0.00 0.00 57.07 56.28 1ucb s TYR 35 Cb -0.07 -0.21 0.02 0.00 -0.40 0.00 0.00 41.96 41.30 1ucb s TYR 35 CO 0.22 -0.43 -0.11 -1.58 -1.57 0.00 0.00 175.55 172.08 1ucb s TRP 36 N -3.57 1.53 0.19 2.71 0.52 -0.52 -1.32 118.94 118.47 1ucb s TRP 36 Ca 0.03 -0.66 0.08 0.00 0.02 0.00 0.00 56.10 55.57 1ucb s TRP 36 Cb 0.05 -1.17 -0.04 0.00 -1.15 0.00 0.00 33.47 31.15 1ucb s TRP 36 CO -0.09 -0.39 -0.16 0.08 0.02 0.00 0.00 176.95 176.41 1ucb s VAL 37 N 1.09 1.75 0.03 4.03 1.01 -0.16 -0.85 120.40 127.30 1ucb s VAL 37 Ca -0.06 -2.07 -0.00 0.00 0.00 0.00 0.00 61.98 59.84 1ucb s VAL 37 Cb -0.14 -1.94 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 1ucb s VAL 37 CO -0.01 -0.48 -0.03 0.00 0.00 0.00 0.00 175.10 174.58 1ucb s ARG 38 N -3.26 0.37 -0.19 2.72 1.70 0.52 -0.01 118.95 120.79 1ucb s ARG 38 Ca 0.19 -0.73 0.01 0.00 -0.47 0.00 0.00 55.73 54.74 1ucb s ARG 38 Cb -0.03 0.13 0.03 0.00 -0.57 0.00 0.00 34.95 34.51 1ucb s ARG 38 CO 0.07 -0.06 -0.16 -1.14 -1.08 0.00 0.00 175.30 172.92 1ucb s GLN 39 N -1.94 2.64 0.91 3.89 0.74 0.29 -0.78 119.66 125.41 1ucb s GLN 39 Ca -0.12 -0.89 -0.12 0.00 0.05 0.00 0.00 55.36 54.29 1ucb s GLN 39 Cb -0.07 -2.54 0.13 0.00 1.10 0.00 0.00 33.01 31.64 1ucb s GLN 39 CO -0.03 -0.31 1.13 0.95 -0.55 0.00 0.00 175.29 176.49 1ucb s THR 40 N 1.30 2.13 0.54 -0.34 -4.23 0.06 -0.78 115.64 114.30 1ucb s THR 40 Ca 0.02 0.04 0.23 0.00 -1.18 0.00 0.00 61.69 60.79 1ucb s THR 40 Cb -0.15 -2.77 0.34 0.00 1.34 0.00 0.00 72.50 71.27 1ucb s THR 40 CO -0.11 -0.05 2.07 -0.65 -0.54 0.00 0.00 174.62 175.34 1ucb h PRO 41 N -1.48 0.00 0.00 3.99 0.11 -1.90 -0.34 132.00 132.38 1ucb h PRO 41 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1ucb h PRO 41 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1ucb h PRO 41 CO 0.61 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.79 1ucb n GLU 42 N -4.33 0.98 -2.30 1.05 4.71 -1.26 -4.84 120.64 114.66 1ucb n GLU 42 Ca 0.04 0.00 -0.12 0.00 -0.01 0.00 0.00 57.16 57.07 1ucb n GLU 42 Cb 0.36 -1.04 -0.00 0.00 -1.01 0.00 0.00 31.44 29.75 1ucb n GLU 42 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1ucb n LYS 43 N -0.54 -1.23 -3.62 3.49 4.76 -0.14 -5.02 118.16 115.87 1ucb n LYS 43 Ca 0.02 0.57 -0.34 0.00 -2.87 0.00 0.00 58.31 55.69 1ucb n LYS 43 Cb 0.01 -4.71 -0.05 0.00 -1.84 0.00 0.00 35.03 28.43 1ucb n LYS 43 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1ucb s ARG 44 N -4.68 3.71 -0.01 1.97 0.52 -1.24 -4.87 118.95 114.35 1ucb s ARG 44 Ca 0.03 0.10 0.02 0.00 -0.52 0.00 0.00 55.73 55.35 1ucb s ARG 44 Cb -0.01 -2.98 -0.03 0.00 0.52 0.00 0.00 34.95 32.44 1ucb s ARG 44 CO 0.03 0.55 -0.04 -0.51 0.02 0.00 0.00 175.30 175.36 1ucb s LEU 45 N -2.02 3.32 -0.09 2.53 1.02 -1.26 -0.76 118.68 121.41 1ucb s LEU 45 Ca 0.34 -0.07 -0.06 0.00 0.02 0.00 0.00 54.13 54.36 1ucb s LEU 45 Cb -0.13 -1.87 0.03 0.00 0.02 0.00 0.00 46.19 44.24 1ucb s LEU 45 CO 0.19 0.30 0.22 -1.61 0.02 0.00 0.00 176.35 175.47 1ucb s GLU 46 N -1.37 0.22 0.03 1.70 2.02 0.04 -4.98 118.70 116.35 1ucb s GLU 46 Ca 0.17 0.40 -0.26 0.00 0.02 0.00 0.00 54.97 55.31 1ucb s GLU 46 Cb -0.11 -0.00 -0.05 0.00 0.10 0.00 0.00 34.13 34.07 1ucb s GLU 46 CO 0.07 -0.10 0.81 -0.46 0.02 0.00 0.00 175.26 175.61 1ucb s TRP 47 N 0.68 3.70 -0.12 1.61 -0.00 -1.26 -0.36 118.94 123.20 1ucb s TRP 47 Ca -0.05 1.51 0.03 0.00 -0.00 0.00 0.00 56.10 57.59 1ucb s TRP 47 Cb -0.06 -2.89 -0.03 0.00 -0.00 0.00 0.00 33.47 30.49 1ucb s TRP 47 CO -0.04 0.19 0.11 1.33 -0.00 0.00 0.00 176.95 178.54 1ucb n VAL 48 N 3.15 0.00 0.00 5.86 0.24 -0.03 -4.63 118.33 122.92 1ucb n VAL 48 Ca -0.00 -0.40 0.00 0.00 -2.04 0.00 0.00 64.34 61.89 1ucb n VAL 48 Cb 0.50 0.95 0.00 0.00 -1.47 0.00 0.00 33.84 33.82 1ucb n VAL 48 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ucb n ALA 49 N -1.11 0.00 -2.12 2.33 0.00 -1.13 -4.26 120.51 114.23 1ucb n ALA 49 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1ucb n ALA 49 Cb 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.40 1ucb n ALA 49 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1ucb s TYR 50 N -2.00 0.67 -0.13 0.00 -0.85 -0.94 -1.44 117.35 112.66 1ucb s TYR 50 Ca 0.00 -1.06 -0.11 0.00 -0.52 0.00 0.00 57.07 55.38 1ucb s TYR 50 Cb 0.00 -0.44 0.04 0.00 0.38 0.00 0.00 41.96 41.94 1ucb s TYR 50 CO 0.00 -0.35 0.33 -1.50 -1.52 0.00 0.00 175.55 172.52 1ucb s ILE 51 N -3.87 -0.01 0.73 -3.49 2.07 -0.89 -2.92 121.20 112.83 1ucb s ILE 51 Ca 0.11 0.03 -0.15 0.00 -1.41 0.00 0.00 60.65 59.23 1ucb s ILE 51 Cb 0.07 -0.47 0.04 0.00 0.13 0.00 0.00 42.46 42.23 1ucb s ILE 51 CO -0.07 0.01 1.19 -0.55 -1.91 0.00 0.00 174.94 173.61 1ucb s SER 52 N 0.42 4.23 0.36 4.50 0.15 0.53 -2.45 113.70 121.45 1ucb s SER 52 Ca -0.02 2.30 0.03 0.00 0.70 0.00 0.00 55.95 58.97 1ucb s SER 52 Cb -0.04 -2.58 0.68 0.00 -1.71 0.00 0.00 66.02 62.37 1ucb s SER 52 CO -0.02 -2.24 2.01 0.06 1.20 0.00 0.00 173.24 174.25 1ucb h GLN 52 N -0.35 0.78 -0.01 5.44 -0.00 -1.85 0.30 115.11 119.41 1ucb h GLN 52 Ca -0.47 -0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.13 1ucb h GLN 52 Cb 1.29 -0.18 0.00 0.00 -0.00 0.00 0.00 27.48 28.59 1ucb h GLN 52 CO 0.50 0.52 0.00 0.41 -0.00 0.00 0.00 178.83 180.25 1ucb n GLY 53 N -1.45 -0.73 2.89 0.06 0.00 -1.26 -4.85 105.19 99.85 1ucb n GLY 53 Ca 0.07 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1ucb n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ucb n GLY 54 N 1.03 0.61 0.10 -0.02 0.00 0.09 -4.90 105.19 102.09 1ucb n GLY 54 Ca 0.22 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.16 1ucb n GLY 54 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1ucb h ASP 55 N 0.00 0.15 -3.75 1.61 3.04 -1.90 -3.46 116.42 112.11 1ucb h ASP 55 Ca 0.00 -0.14 -0.68 0.00 -3.24 0.00 0.00 57.03 52.97 1ucb h ASP 55 Cb 0.09 -0.05 -0.21 0.00 -1.04 0.00 0.00 39.33 38.13 1ucb h ASP 55 CO 0.00 1.02 -0.72 -0.63 -2.04 0.00 0.00 179.24 176.87 1ucb s ILE 56 N -2.96 3.49 0.07 4.15 1.01 -1.26 -4.97 121.20 120.73 1ucb s ILE 56 Ca -0.01 -0.55 -0.05 0.00 0.00 0.00 0.00 60.65 60.03 1ucb s ILE 56 Cb 0.10 -2.42 -0.02 0.00 0.01 0.00 0.00 42.46 40.13 1ucb s ILE 56 CO 0.83 0.59 0.09 0.42 0.00 0.00 0.00 174.94 176.87 1ucb s THR 57 N -0.70 0.17 -0.18 2.92 -4.23 -1.26 -0.34 115.64 112.03 1ucb s THR 57 Ca 0.11 -1.44 -0.29 0.00 -1.18 0.00 0.00 61.69 58.89 1ucb s THR 57 Cb -0.11 -1.39 0.11 0.00 1.34 0.00 0.00 72.50 72.45 1ucb s THR 57 CO 0.01 -0.80 0.93 -0.62 -0.54 0.00 0.00 174.62 173.61 1ucb s ASP 58 N -2.85 -0.47 0.11 3.99 2.15 -1.15 -5.00 116.67 113.46 1ucb s ASP 58 Ca 0.05 0.64 -0.07 0.00 0.43 0.00 0.00 52.55 53.60 1ucb s ASP 58 Cb 0.06 0.56 -0.01 0.00 -0.30 0.00 0.00 42.92 43.23 1ucb s ASP 58 CO -0.10 -0.34 0.18 -0.31 -0.17 0.00 0.00 175.17 174.43 1ucb s TYR 59 N -0.70 0.32 1.01 -5.34 1.51 -1.26 -2.22 117.35 110.67 1ucb s TYR 59 Ca -0.02 -0.74 -0.15 0.00 -1.01 0.00 0.00 57.07 55.14 1ucb s TYR 59 Cb -0.02 -0.13 0.20 0.00 -0.11 0.00 0.00 41.96 41.90 1ucb s TYR 59 CO 0.01 -0.57 1.17 -1.25 -1.11 0.00 0.00 175.55 173.80 1ucb s PRO 60 N -3.91 0.33 0.21 -1.71 0.04 -1.26 -4.74 135.00 123.96 1ucb s PRO 60 Ca 0.10 0.03 0.25 0.00 0.04 0.00 0.00 61.00 61.42 1ucb s PRO 60 Cb 0.05 -1.77 0.87 0.00 0.04 0.00 0.00 34.50 33.69 1ucb s PRO 60 CO -0.07 -2.70 1.76 -0.25 0.04 0.00 0.00 177.00 175.79 1ucb n ASP 61 N -4.06 0.73 0.22 6.66 8.00 -1.26 -0.50 116.55 126.34 1ucb n ASP 61 Ca 0.10 0.60 0.12 0.00 0.71 0.00 0.00 54.79 56.32 1ucb n ASP 61 Cb 0.59 -0.78 0.32 0.00 -0.02 0.00 0.00 41.12 41.23 1ucb n ASP 61 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 1ucb h THR 62 N 0.00 0.21 0.00 -3.53 1.35 -1.99 -3.32 112.91 105.63 1ucb h THR 62 Ca 0.00 -1.08 0.00 0.00 -0.55 0.00 0.00 66.41 64.78 1ucb h THR 62 Cb 0.62 1.91 0.00 0.00 -1.73 0.00 0.00 68.15 68.95 1ucb h THR 62 CO 0.00 0.11 -0.10 0.52 -0.25 0.00 0.00 175.52 175.79 1ucb n VAL 63 N -3.16 0.00 -1.84 6.82 0.31 -1.14 -5.01 118.33 114.32 1ucb n VAL 63 Ca 0.02 -0.34 -0.42 0.00 -0.01 0.00 0.00 64.34 63.59 1ucb n VAL 63 Cb 0.49 0.92 -0.03 0.00 -0.91 0.00 0.00 33.84 34.31 1ucb n VAL 63 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1ucb s LYS 64 N -0.89 4.17 0.00 5.55 2.20 0.35 -2.49 119.74 128.63 1ucb s LYS 64 Ca 0.00 2.44 0.00 0.00 -0.36 0.00 0.00 55.97 58.05 1ucb s LYS 64 Cb 0.00 -3.62 0.00 0.00 -1.51 0.00 0.00 37.83 32.70 1ucb s LYS 64 CO 0.00 -0.79 0.00 0.41 -0.36 0.00 0.00 175.35 174.61 1ucb n GLY 65 N 4.11 2.35 0.13 5.54 0.00 -1.26 -4.87 105.19 111.19 1ucb n GLY 65 Ca 0.17 -0.40 -0.17 0.00 0.00 0.00 0.00 46.02 45.62 1ucb n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ucb n ARG 66 N 0.00 0.66 -3.69 1.61 1.74 -1.04 -4.98 116.66 110.97 1ucb n ARG 66 Ca 0.00 0.14 -0.33 0.00 -0.77 0.00 0.00 57.85 56.89 1ucb n ARG 66 Cb 0.00 -1.54 -0.05 0.00 -1.02 0.00 0.00 32.46 29.85 1ucb n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1ucb s PHE 67 N -2.52 3.52 -0.04 -1.55 0.40 -1.09 -2.04 117.98 114.66 1ucb s PHE 67 Ca -0.30 0.59 -0.01 0.00 -0.60 0.00 0.00 56.93 56.61 1ucb s PHE 67 Cb 0.08 -2.02 0.03 0.00 0.51 0.00 0.00 43.02 41.62 1ucb s PHE 67 CO 0.65 0.50 0.02 0.99 0.70 0.00 0.00 175.22 178.08 1ucb s THR 68 N -1.52 0.11 -0.10 0.64 2.01 0.48 -4.90 115.64 112.35 1ucb s THR 68 Ca 0.36 0.22 -0.09 0.00 0.31 0.00 0.00 61.69 62.49 1ucb s THR 68 Cb -0.13 -0.28 -0.04 0.00 0.01 0.00 0.00 72.50 72.06 1ucb s THR 68 CO 0.22 0.18 0.20 -0.51 -0.69 0.00 0.00 174.62 174.01 1ucb s ILE 69 N 1.62 5.41 0.15 1.82 2.07 -1.26 -0.29 121.20 130.72 1ucb s ILE 69 Ca -0.01 0.34 -0.09 0.00 -1.41 0.00 0.00 60.65 59.48 1ucb s ILE 69 Cb -0.13 -3.47 -0.01 0.00 0.13 0.00 0.00 42.46 38.99 1ucb s ILE 69 CO -0.03 0.61 0.26 -0.94 -1.91 0.00 0.00 174.94 172.93 1ucb s SER 70 N -1.02 0.06 0.02 4.50 1.04 -0.69 -4.99 113.70 112.62 1ucb s SER 70 Ca 0.17 -0.82 -0.08 0.00 0.48 0.00 0.00 55.95 55.70 1ucb s SER 70 Cb -0.13 0.42 -0.00 0.00 0.10 0.00 0.00 66.02 66.41 1ucb s SER 70 CO 0.06 -0.86 0.15 0.00 0.98 0.00 0.00 173.24 173.57 1ucb s ARG 71 N -3.94 0.57 -0.54 4.02 1.70 -1.26 0.49 118.95 119.98 1ucb s ARG 71 Ca 0.15 -0.53 0.04 0.00 -0.47 0.00 0.00 55.73 54.91 1ucb s ARG 71 Cb 0.04 0.23 0.15 0.00 -0.57 0.00 0.00 34.95 34.79 1ucb s ARG 71 CO -0.02 -0.15 0.33 0.34 -1.08 0.00 0.00 175.30 174.72 1ucb s ASP 72 N -1.72 4.00 0.58 -2.89 -1.08 0.23 -4.97 116.67 110.82 1ucb s ASP 72 Ca -0.10 -3.15 0.30 0.00 -0.52 0.00 0.00 52.55 49.08 1ucb s ASP 72 Cb -0.05 -1.34 1.43 0.00 -1.46 0.00 0.00 42.92 41.50 1ucb s ASP 72 CO -0.01 -0.19 1.82 0.78 0.52 0.00 0.00 175.17 178.09 1ucb h ASN 73 N 6.17 0.00 0.02 -0.34 2.35 -1.93 0.17 115.58 122.01 1ucb h ASN 73 Ca 0.04 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.57 1ucb h ASN 73 Cb 0.86 0.00 0.02 0.00 0.05 0.00 0.00 38.32 39.25 1ucb h ASN 73 CO 0.61 0.00 -0.86 0.00 -1.65 0.00 0.00 177.43 175.53 1ucb h ALA 74 N 1.36 0.08 -0.09 -0.83 0.00 -1.95 -3.27 119.26 114.56 1ucb h ALA 74 Ca 0.32 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1ucb h ALA 74 Cb 1.57 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.42 1ucb h ALA 74 CO -0.00 0.52 0.00 1.63 0.00 0.00 0.00 179.25 181.40 1ucb n LYS 75 N -4.03 1.80 -2.99 0.00 5.02 -0.04 -4.94 118.16 112.98 1ucb n LYS 75 Ca -0.11 -1.17 -0.22 0.00 -2.02 0.00 0.00 58.31 54.79 1ucb n LYS 75 Cb 0.80 -1.45 0.02 0.00 -0.02 0.00 0.00 35.03 34.37 1ucb n LYS 75 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1ucb n ASN 76 N 0.41 -5.30 -4.46 4.39 4.13 0.38 -4.86 115.26 109.95 1ucb n ASN 76 Ca 0.18 -0.24 -0.27 0.00 1.68 0.00 0.00 54.58 55.93 1ucb n ASN 76 Cb 0.38 -4.33 -0.11 0.00 -1.54 0.00 0.00 39.78 34.18 1ucb n ASN 76 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1ucb s SER 77 N -2.57 3.66 0.00 6.41 0.01 -1.12 -1.66 113.70 118.44 1ucb s SER 77 Ca 0.27 -0.76 0.07 0.00 1.31 0.00 0.00 55.95 56.84 1ucb s SER 77 Cb -0.13 -0.39 -0.02 0.00 0.21 0.00 0.00 66.02 65.69 1ucb s SER 77 CO 0.33 0.13 -0.22 -0.22 0.41 0.00 0.00 173.24 173.66 1ucb s LEU 78 N -2.62 2.09 0.19 2.44 2.96 0.57 -0.60 118.68 123.71 1ucb s LEU 78 Ca 0.21 -0.45 0.06 0.00 -0.22 0.00 0.00 54.13 53.73 1ucb s LEU 78 Cb -0.08 -1.13 -0.05 0.00 0.50 0.00 0.00 46.19 45.43 1ucb s LEU 78 CO 0.11 0.25 -0.12 -0.31 -1.32 0.00 0.00 176.35 174.96 1ucb s TYR 79 N -0.62 1.56 -0.29 5.38 2.02 0.18 -0.40 117.35 125.18 1ucb s TYR 79 Ca 0.09 -0.66 -0.01 0.00 -0.37 0.00 0.00 57.07 56.11 1ucb s TYR 79 Cb -0.09 -0.77 0.13 0.00 -0.40 0.00 0.00 41.96 40.83 1ucb s TYR 79 CO 0.00 0.24 0.25 -1.17 -1.57 0.00 0.00 175.55 173.30 1ucb s LEU 80 N -3.27 -0.03 -0.19 -1.29 2.96 -0.96 -1.70 118.68 114.21 1ucb s LEU 80 Ca 0.21 -0.92 -0.26 0.00 -0.22 0.00 0.00 54.13 52.94 1ucb s LEU 80 Cb 0.01 0.28 -0.01 0.00 0.50 0.00 0.00 46.19 46.97 1ucb s LEU 80 CO 0.05 -0.40 0.86 -1.58 -1.32 0.00 0.00 176.35 173.96 1ucb s GLN 81 N 2.27 4.28 -0.07 1.98 2.00 0.60 -2.45 119.66 128.27 1ucb s GLN 81 Ca 0.09 1.06 0.01 0.00 -2.00 0.00 0.00 55.36 54.53 1ucb s GLN 81 Cb -0.15 -3.59 -0.03 0.00 0.80 0.00 0.00 33.01 30.04 1ucb s GLN 81 CO -0.33 -0.39 -0.08 -1.64 -0.50 0.00 0.00 175.29 172.34 1ucb s MET 82 N 2.38 2.73 0.15 1.67 -1.94 0.97 -0.39 119.30 124.88 1ucb s MET 82 Ca 0.39 -0.57 -0.04 0.00 -1.71 0.00 0.00 55.69 53.76 1ucb s MET 82 Cb -0.16 -2.57 -0.03 0.00 2.01 0.00 0.00 34.83 34.08 1ucb s MET 82 CO 0.11 0.65 0.15 -1.12 -0.01 0.00 0.00 175.02 174.80 1ucb s SER 82 N -0.77 0.20 -1.51 3.03 0.01 -0.87 -1.45 113.70 112.34 1ucb s SER 82 Ca 0.12 -1.10 0.00 0.00 1.31 0.00 0.00 55.95 56.27 1ucb s SER 82 Cb -0.11 0.36 0.00 0.00 0.21 0.00 0.00 66.02 66.48 1ucb s SER 82 CO 0.01 -0.80 0.00 0.54 0.41 0.00 0.00 173.24 173.40 1ucb n ARG 82 N -0.15 -1.82 -1.55 12.44 3.00 -1.21 -4.63 116.66 122.73 1ucb n ARG 82 Ca -0.05 0.85 -0.52 0.00 -0.01 0.00 0.00 57.85 58.12 1ucb n ARG 82 Cb 0.64 -5.42 -0.05 0.00 0.00 0.00 0.00 32.46 27.62 1ucb n ARG 82 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1ucb n LEU 82 N -2.75 1.07 -4.60 0.55 4.77 -1.19 -4.59 117.00 110.27 1ucb n LEU 82 Ca -0.19 1.14 -0.27 0.00 -0.03 0.00 0.00 56.01 56.66 1ucb n LEU 82 Cb 0.63 -1.13 -0.10 0.00 -2.33 0.00 0.00 43.42 40.49 1ucb n LEU 82 CO 0.24 -1.46 -0.32 -0.54 -1.33 0.00 0.00 177.39 173.98 1ucb s LYS 83 N -0.07 1.94 0.31 3.23 1.02 -1.26 -0.34 119.74 124.57 1ucb s LYS 83 Ca 0.80 -2.00 0.01 0.00 0.02 0.00 0.00 55.97 54.80 1ucb s LYS 83 Cb -0.97 -1.71 0.56 0.00 -0.52 0.00 0.00 37.83 35.19 1ucb s LYS 83 CO 0.52 0.03 1.93 0.77 -0.92 0.00 0.00 175.35 177.68 1ucb h SER 84 N 1.84 0.86 -0.01 2.83 0.02 -1.95 0.28 113.55 117.42 1ucb h SER 84 Ca -0.43 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 1ucb h SER 84 Cb 1.25 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.60 1ucb h SER 84 CO 0.75 0.57 0.04 -0.33 -1.14 0.00 0.00 176.83 176.72 1ucb h GLU 85 N 0.98 0.00 0.00 3.45 3.07 -1.95 0.16 114.58 120.29 1ucb h GLU 85 Ca 0.36 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.22 1ucb h GLU 85 Cb 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.06 1ucb h GLU 85 CO -0.12 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.24 1ucb n ASP 86 N -3.18 0.00 -4.60 1.42 8.00 0.09 -4.76 116.55 113.51 1ucb n ASP 86 Ca -0.03 0.19 -0.43 0.00 0.71 0.00 0.00 54.79 55.24 1ucb n ASP 86 Cb 0.12 -0.39 -0.03 0.00 -0.02 0.00 0.00 41.12 40.79 1ucb n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ucb s THR 87 N -2.79 3.06 0.17 -3.53 2.01 0.04 -4.89 115.64 109.72 1ucb s THR 87 Ca 0.20 0.06 -0.24 0.00 0.31 0.00 0.00 61.69 62.02 1ucb s THR 87 Cb 0.19 -3.08 0.06 0.00 0.01 0.00 0.00 72.50 69.68 1ucb s THR 87 CO 0.48 -0.05 0.96 0.00 -0.69 0.00 0.00 174.62 175.32 1ucb s ALA 88 N 7.95 -1.61 -0.22 7.40 0.00 -0.80 -4.37 121.76 130.11 1ucb s ALA 88 Ca 0.98 0.02 -0.19 0.00 0.00 0.00 0.00 51.96 52.77 1ucb s ALA 88 Cb -0.32 0.66 -0.03 0.00 0.00 0.00 0.00 23.12 23.43 1ucb s ALA 88 CO 0.35 -1.05 0.55 1.41 0.00 0.00 0.00 175.76 177.02 1ucb s MET 89 N -3.11 4.15 -0.21 0.00 -2.45 0.04 -1.26 119.30 116.46 1ucb s MET 89 Ca 0.14 0.44 -0.09 0.00 -1.25 0.00 0.00 55.69 54.92 1ucb s MET 89 Cb -0.02 -3.60 -0.05 0.00 1.25 0.00 0.00 34.83 32.42 1ucb s MET 89 CO 0.03 -0.25 0.12 0.71 1.05 0.00 0.00 175.02 176.69 1ucb s TYR 90 N 1.95 3.33 0.11 4.11 1.51 0.24 -0.54 117.35 128.06 1ucb s TYR 90 Ca 0.24 0.20 0.08 0.00 -1.01 0.00 0.00 57.07 56.59 1ucb s TYR 90 Cb -0.16 -2.18 -0.04 0.00 -0.11 0.00 0.00 41.96 39.47 1ucb s TYR 90 CO 0.09 0.15 -0.14 0.71 -1.11 0.00 0.00 175.55 175.26 1ucb s TYR 91 N 0.66 2.64 -0.01 2.71 2.02 0.98 -1.23 117.35 125.12 1ucb s TYR 91 Ca 0.07 -0.21 0.04 0.00 -0.37 0.00 0.00 57.07 56.60 1ucb s TYR 91 Cb -0.12 -1.39 -0.03 0.00 -0.40 0.00 0.00 41.96 40.02 1ucb s TYR 91 CO 0.01 0.41 -0.13 0.00 -1.57 0.00 0.00 175.55 174.26 1ucb s ALA 93 N -0.85 0.04 0.06 0.00 0.00 -0.44 -1.46 121.76 119.11 1ucb s ALA 93 Ca 0.14 -0.87 0.04 0.00 0.00 0.00 0.00 51.96 51.26 1ucb s ALA 93 Cb -0.11 0.71 -0.03 0.00 0.00 0.00 0.00 23.12 23.69 1ucb s ALA 93 CO 0.04 -0.57 -0.11 -0.98 0.00 0.00 0.00 175.76 174.14 1ucb s ARG 94 N -3.94 0.68 0.28 0.00 1.70 -0.70 -1.23 118.95 115.75 1ucb s ARG 94 Ca 0.13 -0.87 -0.05 0.00 -0.47 0.00 0.00 55.73 54.47 1ucb s ARG 94 Cb 0.04 -0.54 0.07 0.00 -0.57 0.00 0.00 34.95 33.95 1ucb s ARG 94 CO -0.04 0.11 0.21 0.41 -1.08 0.00 0.00 175.30 174.91 1ucb n GLY 95 N 1.32 -3.06 2.68 3.88 0.00 -1.10 -2.16 105.19 106.76 1ucb n GLY 95 Ca -0.22 -1.37 -0.22 0.00 0.00 0.00 0.00 46.02 44.22 1ucb n GLY 95 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ucb s LEU 96 N 0.00 0.15 0.42 0.99 2.96 -0.88 -4.63 118.68 117.71 1ucb s LEU 96 Ca 0.15 -0.20 0.28 0.00 -0.22 0.00 0.00 54.13 54.14 1ucb s LEU 96 Cb -0.02 -0.04 1.41 0.00 0.50 0.00 0.00 46.19 48.04 1ucb s LEU 96 CO 0.12 -0.30 1.61 0.44 -1.32 0.00 0.00 176.35 176.90 1ucb h ASP 97 N 8.40 0.26 -0.97 3.68 3.32 -1.98 0.42 116.42 129.55 1ucb h ASP 97 Ca -0.14 0.16 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1ucb h ASP 97 Cb 1.14 0.16 -0.05 0.00 0.22 0.00 0.00 39.33 40.79 1ucb h ASP 97 CO 0.22 -0.23 0.63 -0.78 -1.72 0.00 0.00 179.24 177.35 1ucb h ASP 98 N 0.07 1.13 0.00 6.45 1.82 -2.06 -3.45 116.42 120.38 1ucb h ASP 98 Ca 0.83 -0.04 0.00 0.00 -0.39 0.00 0.00 57.03 57.43 1ucb h ASP 98 Cb 2.54 -0.28 0.00 0.00 0.68 0.00 0.00 39.33 42.26 1ucb h ASP 98 CO -0.49 0.84 0.00 0.61 -1.61 0.00 0.00 179.24 178.58 1ucb n GLY 99 N -1.33 0.00 3.11 -0.78 0.00 0.11 -5.17 105.19 101.13 1ucb n GLY 99 Ca 0.11 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 1ucb n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ucb s ALA 100 N 0.00 1.04 -0.02 4.61 0.00 -1.03 -5.00 121.76 121.36 1ucb s ALA 100 Ca 0.00 -0.73 -0.00 0.00 0.00 0.00 0.00 51.96 51.23 1ucb s ALA 100 Cb 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 23.12 22.95 1ucb s ALA 100 CO 0.00 0.20 0.05 -1.49 0.00 0.00 0.00 175.76 174.51 1ucb h TRP 100 N 5.12 -0.01 -2.66 0.00 4.06 -1.90 -2.33 115.95 118.22 1ucb h TRP 100 Ca -0.36 -0.00 -0.73 0.00 2.06 0.00 0.00 58.89 59.86 1ucb h TRP 100 Cb 1.18 0.00 -0.33 0.00 -1.00 0.00 0.00 29.16 29.01 1ucb h TRP 100 CO 0.51 -0.01 0.25 1.19 -3.56 0.00 0.00 178.44 176.83 1ucb n PHE 100 N -2.69 2.84 0.08 0.49 3.72 -1.26 -2.72 117.46 117.92 1ucb n PHE 100 Ca -0.00 -3.21 -0.11 0.00 -0.05 0.00 0.00 57.45 54.08 1ucb n PHE 100 Cb 0.01 -1.00 -0.05 0.00 -0.94 0.00 0.00 39.48 37.50 1ucb n PHE 100 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ucb h ALA 101 N 4.98 0.38 -3.46 4.37 0.00 -1.69 -3.44 119.26 120.40 1ucb h ALA 101 Ca 0.20 -0.76 -0.60 0.00 0.00 0.00 0.00 54.91 53.75 1ucb h ALA 101 Cb 0.64 -0.05 -0.33 0.00 0.00 0.00 0.00 17.79 18.05 1ucb h ALA 101 CO 1.14 0.91 -0.85 0.71 0.00 0.00 0.00 179.25 181.16 1ucb s TYR 102 N -3.10 2.00 0.16 0.00 2.02 -1.13 -5.00 117.35 112.30 1ucb s TYR 102 Ca -0.04 -0.76 0.11 0.00 -0.37 0.00 0.00 57.07 56.01 1ucb s TYR 102 Cb 0.09 -1.38 -0.04 0.00 -0.40 0.00 0.00 41.96 40.23 1ucb s TYR 102 CO 0.85 -0.32 -0.24 -1.58 -1.57 0.00 0.00 175.55 172.69 1ucb s TRP 103 N 0.43 2.18 0.33 2.71 0.52 -1.26 -1.71 118.94 122.14 1ucb s TRP 103 Ca -0.15 -0.39 -0.02 0.00 0.02 0.00 0.00 56.10 55.57 1ucb s TRP 103 Cb -0.16 -1.13 0.07 0.00 -1.15 0.00 0.00 33.47 31.10 1ucb s TRP 103 CO 0.06 0.39 0.46 0.41 0.02 0.00 0.00 176.95 178.28 1ucb n GLY 104 N 0.59 0.25 0.19 0.98 0.00 -0.53 -4.70 105.19 101.97 1ucb n GLY 104 Ca -0.15 -1.92 0.13 0.00 0.00 0.00 0.00 46.02 44.08 1ucb n GLY 104 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1ucb h GLN 105 N 0.00 0.00 0.00 1.61 -0.00 -1.91 -3.46 115.11 111.35 1ucb h GLN 105 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.50 1ucb h GLN 105 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.99 1ucb h GLN 105 CO 0.15 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.39 1ucb n GLY 106 N 1.00 0.48 2.94 0.06 0.00 -1.26 -5.05 105.19 103.36 1ucb n GLY 106 Ca 0.04 -1.45 -0.27 0.00 0.00 0.00 0.00 46.02 44.34 1ucb n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1ucb s THR 107 N -1.42 1.11 -0.05 2.61 -1.32 -0.36 -4.89 115.64 111.32 1ucb s THR 107 Ca 0.00 -0.36 -0.30 0.00 -1.21 0.00 0.00 61.69 59.82 1ucb s THR 107 Cb 0.00 -1.09 -0.02 0.00 -1.51 0.00 0.00 72.50 69.87 1ucb s THR 107 CO 0.00 0.38 0.99 -0.22 -2.21 0.00 0.00 174.62 173.56 1ucb s LEU 108 N 1.49 4.31 -0.18 9.08 2.96 -1.26 -0.59 118.68 134.50 1ucb s LEU 108 Ca 0.01 1.60 -0.00 0.00 -0.22 0.00 0.00 54.13 55.52 1ucb s LEU 108 Cb -0.13 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 43.01 1ucb s LEU 108 CO -0.06 -0.35 -0.15 -0.69 -1.32 0.00 0.00 176.35 173.78 1ucb s VAL 109 N 1.47 2.55 -0.21 1.68 1.01 -0.39 -2.60 120.40 123.91 1ucb s VAL 109 Ca 0.50 -0.79 -0.02 0.00 0.00 0.00 0.00 61.98 61.67 1ucb s VAL 109 Cb -0.20 -2.09 0.00 0.00 0.00 0.00 0.00 36.38 34.09 1ucb s VAL 109 CO 0.23 0.51 -0.08 -0.89 0.00 0.00 0.00 175.10 174.87 1ucb s THR 110 N 1.12 3.01 -0.43 3.92 2.01 -0.59 -1.91 115.64 122.76 1ucb s THR 110 Ca 0.00 -0.63 -0.12 0.00 0.31 0.00 0.00 61.69 61.25 1ucb s THR 110 Cb -0.14 -2.35 0.06 0.00 0.01 0.00 0.00 72.50 70.07 1ucb s THR 110 CO -0.05 0.45 0.30 -0.69 -0.69 0.00 0.00 174.62 173.93 1ucb s VAL 111 N 1.42 4.75 0.13 3.82 1.01 -1.26 -1.17 120.40 129.11 1ucb s VAL 111 Ca 0.05 -1.10 -0.10 0.00 0.00 0.00 0.00 61.98 60.82 1ucb s VAL 111 Cb -0.14 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.44 1ucb s VAL 111 CO -0.06 -0.46 0.29 -0.55 0.00 0.00 0.00 175.10 174.32 1ucb s SER 112 N 2.13 0.01 0.04 3.32 0.15 0.45 -4.54 113.70 115.26 1ucb s SER 112 Ca 0.03 -0.69 0.23 0.00 0.70 0.00 0.00 55.95 56.23 1ucb s SER 112 Cb -0.22 0.42 0.15 0.00 -1.71 0.00 0.00 66.02 64.65 1ucb s SER 112 CO 0.05 -0.84 1.13 1.33 1.20 0.00 0.00 173.24 176.11 1ucb n VAL 113 N -0.17 0.13 -1.49 4.45 0.24 -1.26 -3.49 118.33 116.73 1ucb n VAL 113 Ca -0.11 -0.17 -0.31 0.00 -2.04 0.00 0.00 64.34 61.71 1ucb n VAL 113 Cb 0.63 0.27 0.07 0.00 -1.47 0.00 0.00 33.84 33.33 1ucb n VAL 113 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ucb s ALA 114 N -3.13 2.52 0.23 2.33 0.00 -1.26 -5.05 121.76 117.40 1ucb s ALA 114 Ca 0.06 0.09 0.06 0.00 0.00 0.00 0.00 51.96 52.17 1ucb s ALA 114 Cb 0.15 -3.19 -0.03 0.00 0.00 0.00 0.00 23.12 20.05 1ucb s ALA 114 CO 0.78 -1.42 0.28 -1.54 0.00 0.00 0.00 175.76 173.86 1ucb s SER 115 N -3.71 5.97 0.20 0.00 1.04 -1.26 -5.01 113.70 110.93 1ucb s SER 115 Ca 0.59 -0.06 -0.31 0.00 0.48 0.00 0.00 55.95 56.65 1ucb s SER 115 Cb -0.15 -1.66 -0.10 0.00 0.10 0.00 0.00 66.02 64.21 1ucb s SER 115 CO 0.55 -0.04 1.54 -0.89 0.98 0.00 0.00 173.24 175.38 1ucb s THR 116 N -2.01 2.54 -0.01 2.02 2.01 -1.26 -4.76 115.64 114.17 1ucb s THR 116 Ca 0.33 0.41 0.02 0.00 0.31 0.00 0.00 61.69 62.76 1ucb s THR 116 Cb -0.09 -3.26 0.00 0.00 0.01 0.00 0.00 72.50 69.16 1ucb s THR 116 CO 0.27 0.04 -0.06 -0.75 -0.69 0.00 0.00 174.62 173.44 1ucb s LYS 117 N 0.58 0.56 0.33 4.92 2.20 0.41 -4.94 119.74 123.80 1ucb s LYS 117 Ca 0.67 -0.18 -0.17 0.00 -0.36 0.00 0.00 55.97 55.93 1ucb s LYS 117 Cb -0.44 -0.56 -0.09 0.00 -1.51 0.00 0.00 37.83 35.23 1ucb s LYS 117 CO 0.36 0.08 0.77 0.20 -0.36 0.00 0.00 175.35 176.40 1ucb s GLY 118 N 0.12 2.39 0.50 5.54 0.00 -1.26 -2.25 107.32 112.37 1ucb s GLY 118 Ca -0.01 0.12 -0.04 0.00 0.00 0.00 0.00 44.72 44.79 1ucb s GLY 118 CO -0.00 0.36 0.78 2.56 0.00 0.00 0.00 173.10 176.80 1ucb s PRO 119 N -2.87 3.21 -0.12 2.90 0.04 -1.25 -4.59 135.00 132.32 1ucb s PRO 119 Ca 0.54 -0.07 -0.05 0.00 0.04 0.00 0.00 61.00 61.46 1ucb s PRO 119 Cb -0.11 -2.41 -0.04 0.00 0.04 0.00 0.00 34.50 31.99 1ucb s PRO 119 CO 0.17 -0.36 0.06 -1.12 0.04 0.00 0.00 177.00 175.79 1ucb s SER 120 N -4.20 5.70 -0.23 6.66 0.01 0.51 -4.91 113.70 117.25 1ucb s SER 120 Ca 0.49 0.24 -0.04 0.00 1.31 0.00 0.00 55.95 57.95 1ucb s SER 120 Cb -0.10 -1.78 -0.01 0.00 0.21 0.00 0.00 66.02 64.34 1ucb s SER 120 CO 0.43 0.34 -0.03 -0.69 0.41 0.00 0.00 173.24 173.70 1ucb s VAL 121 N -0.65 3.45 0.00 3.43 1.01 -1.26 -0.34 120.40 126.05 1ucb s VAL 121 Ca 0.11 -0.49 0.05 0.00 0.00 0.00 0.00 61.98 61.65 1ucb s VAL 121 Cb -0.12 -2.59 -0.03 0.00 0.00 0.00 0.00 36.38 33.64 1ucb s VAL 121 CO 0.02 0.40 -0.13 -0.36 0.00 0.00 0.00 175.10 175.03 1ucb s PHE 122 N 1.49 2.70 0.34 5.22 0.08 -0.37 -4.93 117.98 122.51 1ucb s PHE 122 Ca 0.06 -0.16 -0.22 0.00 0.12 0.00 0.00 56.93 56.73 1ucb s PHE 122 Cb -0.14 -1.56 -0.10 0.00 -0.57 0.00 0.00 43.02 40.65 1ucb s PHE 122 CO -0.03 0.27 0.88 -1.25 -0.10 0.00 0.00 175.22 174.99 1ucb s PRO 123 N -1.22 4.32 -0.87 0.24 0.04 -1.26 -0.52 135.00 135.72 1ucb s PRO 123 Ca 0.14 1.08 -0.06 0.00 0.04 0.00 0.00 61.00 62.20 1ucb s PRO 123 Cb -0.11 -2.55 0.22 0.00 0.04 0.00 0.00 34.50 32.10 1ucb s PRO 123 CO 0.05 0.18 0.77 -0.51 0.04 0.00 0.00 177.00 177.52 1ucb s LEU 124 N -2.56 5.88 0.24 -3.56 1.43 0.66 -4.84 118.68 115.93 1ucb s LEU 124 Ca 0.53 -3.31 -0.30 0.00 -1.03 0.00 0.00 54.13 50.03 1ucb s LEU 124 Cb -0.14 -2.02 -0.10 0.00 0.03 0.00 0.00 46.19 43.97 1ucb s LEU 124 CO 0.19 -0.32 1.41 0.00 0.23 0.00 0.00 176.35 177.86 1ucb s ALA 125 N -0.75 3.60 0.24 4.21 0.00 -1.26 -1.04 121.76 126.76 1ucb s ALA 125 Ca 0.24 1.28 -0.30 0.00 0.00 0.00 0.00 51.96 53.18 1ucb s ALA 125 Cb -0.11 -3.54 -0.10 0.00 0.00 0.00 0.00 23.12 19.37 1ucb s ALA 125 CO -0.09 -0.69 1.39 -1.25 0.00 0.00 0.00 175.76 175.11 1ucb s PRO 126 N -0.32 4.31 0.21 0.00 0.04 -1.26 -4.92 135.00 133.07 1ucb s PRO 126 Ca 0.59 2.22 0.02 0.00 0.04 0.00 0.00 61.00 63.87 1ucb s PRO 126 Cb -0.41 -3.13 -0.01 0.00 0.04 0.00 0.00 34.50 30.99 1ucb s PRO 126 CO 0.42 -0.35 0.22 -1.13 0.04 0.00 0.00 177.00 176.21 1ucb n SER 127 N 2.29 -0.60 0.25 6.66 3.41 -1.26 -4.41 113.62 119.96 1ucb n SER 127 Ca 0.06 -2.27 0.16 0.00 -0.26 0.00 0.00 58.87 56.56 1ucb n SER 127 Cb 0.41 1.24 0.66 0.00 -0.26 0.00 0.00 64.21 66.27 1ucb n SER 127 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1ucb h SER 128 N 1.24 0.00 1.92 4.04 4.64 -1.95 -1.24 113.55 122.20 1ucb h SER 128 Ca -0.15 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1ucb h SER 128 Cb 0.73 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.82 1ucb h SER 128 CO 0.22 0.00 -0.08 0.11 -0.87 0.00 0.00 176.83 176.21 1ucb h LYS 129 N 0.00 0.00 -0.26 4.77 1.79 -1.97 -3.20 116.57 117.70 1ucb h LYS 129 Ca 0.00 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.40 1ucb h LYS 129 Cb 0.46 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.07 1ucb h LYS 129 CO 0.00 0.02 -0.04 -1.13 -1.08 0.00 0.00 179.45 177.22 1ucb n SER 130 N -3.08 3.09 -3.95 0.86 3.41 -0.50 -4.95 113.62 108.49 1ucb n SER 130 Ca 0.04 -3.35 -0.27 0.00 -0.26 0.00 0.00 58.87 55.03 1ucb n SER 130 Cb 0.54 -0.57 -0.17 0.00 -0.26 0.00 0.00 64.21 63.75 1ucb n SER 130 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1ucb s THR 133 N -3.01 1.16 -0.15 6.66 2.01 -1.00 0.51 115.64 121.82 1ucb s THR 133 Ca 0.42 -0.40 -0.01 0.00 0.31 0.00 0.00 61.69 62.02 1ucb s THR 133 Cb 0.36 -1.13 0.04 0.00 0.01 0.00 0.00 72.50 71.77 1ucb s THR 133 CO 0.04 0.39 -0.06 -0.44 -0.69 0.00 0.00 174.62 173.86 1ucb s SER 134 N 1.46 2.60 1.07 3.53 0.01 0.24 -4.94 113.70 117.66 1ucb s SER 134 Ca 0.01 -0.54 0.00 0.00 1.31 0.00 0.00 55.95 56.73 1ucb s SER 134 Cb -0.13 -0.87 0.00 0.00 0.21 0.00 0.00 66.02 65.23 1ucb s SER 134 CO -0.06 -0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.03 1ucb n GLY 135 N 4.91 2.10 1.56 3.44 0.00 -1.26 -1.32 105.19 114.62 1ucb n GLY 135 Ca -0.12 -0.47 -0.03 0.00 0.00 0.00 0.00 46.02 45.40 1ucb n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ucb n GLY 136 N 0.00 2.89 3.14 -0.02 0.00 -1.26 -4.83 105.19 105.11 1ucb n GLY 136 Ca 0.00 -0.65 -0.31 0.00 0.00 0.00 0.00 46.02 45.07 1ucb n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ucb s THR 137 N -2.17 1.84 0.15 2.61 2.01 -0.44 0.05 115.64 119.70 1ucb s THR 137 Ca 0.37 -0.86 0.09 0.00 0.31 0.00 0.00 61.69 61.59 1ucb s THR 137 Cb 0.29 -1.63 -0.04 0.00 0.01 0.00 0.00 72.50 71.12 1ucb s THR 137 CO 0.09 0.51 -0.12 0.00 -0.69 0.00 0.00 174.62 174.41 1ucb s ALA 138 N 0.74 2.86 0.02 7.40 0.00 0.13 0.79 121.76 133.70 1ucb s ALA 138 Ca -0.10 -1.41 0.09 0.00 0.00 0.00 0.00 51.96 50.54 1ucb s ALA 138 Cb -0.16 -0.73 -0.03 0.00 0.00 0.00 0.00 23.12 22.21 1ucb s ALA 138 CO 0.01 0.53 -0.26 0.00 0.00 0.00 0.00 175.76 176.05 1ucb s ALA 139 N -1.46 2.25 0.16 0.00 0.00 0.18 -1.05 121.76 121.84 1ucb s ALA 139 Ca 0.22 -1.22 -0.12 0.00 0.00 0.00 0.00 51.96 50.84 1ucb s ALA 139 Cb -0.10 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.51 1ucb s ALA 139 CO 0.13 0.54 0.36 -0.48 0.00 0.00 0.00 175.76 176.31 1ucb s LEU 140 N -1.05 0.69 0.00 0.00 0.05 -0.91 -4.14 118.68 113.32 1ucb s LEU 140 Ca 0.11 -0.67 0.00 0.00 0.05 0.00 0.00 54.13 53.63 1ucb s LEU 140 Cb -0.10 1.53 0.00 0.00 -2.05 0.00 0.00 46.19 45.57 1ucb s LEU 140 CO 0.01 -0.92 0.00 0.61 -0.55 0.00 0.00 176.35 175.51 1ucb n GLY 141 N -0.23 1.69 3.15 -3.48 0.00 -0.21 -0.85 105.19 105.26 1ucb n GLY 141 Ca -0.10 -0.53 -0.13 0.00 0.00 0.00 0.00 46.02 45.27 1ucb n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ucb s LEU 143 N -0.09 4.36 -0.79 0.00 2.96 0.32 -1.85 118.68 123.59 1ucb s LEU 143 Ca -0.02 -1.33 -0.19 0.00 -0.22 0.00 0.00 54.13 52.37 1ucb s LEU 143 Cb -0.03 -1.82 0.12 0.00 0.50 0.00 0.00 46.19 44.97 1ucb s LEU 143 CO 0.01 -0.35 0.97 -0.69 -1.32 0.00 0.00 176.35 174.96 1ucb s VAL 144 N 1.32 4.74 0.08 1.68 1.01 -0.20 -1.23 120.40 127.81 1ucb s VAL 144 Ca -0.01 -1.27 0.01 0.00 0.00 0.00 0.00 61.98 60.71 1ucb s VAL 144 Cb -0.20 -4.67 -0.04 0.00 0.00 0.00 0.00 36.38 31.47 1ucb s VAL 144 CO 0.01 -1.37 0.20 -0.75 0.00 0.00 0.00 175.10 173.18 1ucb s LYS 145 N 2.74 3.32 -0.52 2.72 2.20 0.54 -1.51 119.74 129.24 1ucb s LYS 145 Ca 0.24 -0.53 -0.23 0.00 -0.36 0.00 0.00 55.97 55.10 1ucb s LYS 145 Cb -0.12 -2.95 0.03 0.00 -1.51 0.00 0.00 37.83 33.28 1ucb s LYS 145 CO -0.02 0.58 0.64 -0.25 -0.36 0.00 0.00 175.35 175.94 1ucb n ASP 146 N 0.14 -6.53 -4.02 1.43 8.00 -0.95 -0.37 116.55 114.25 1ucb n ASP 146 Ca -0.06 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.36 1ucb n ASP 146 Cb 0.52 -3.36 -0.10 0.00 -0.02 0.00 0.00 41.12 38.16 1ucb n ASP 146 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1ucb s TYR 147 N -2.21 0.36 -0.24 1.24 1.13 -0.99 -3.92 117.35 112.73 1ucb s TYR 147 Ca 0.25 -0.77 -0.20 0.00 -1.41 0.00 0.00 57.07 54.95 1ucb s TYR 147 Cb -0.04 -0.27 0.06 0.00 -1.10 0.00 0.00 41.96 40.61 1ucb s TYR 147 CO 0.83 -0.31 0.62 0.12 -2.51 0.00 0.00 175.55 174.29 1ucb s PHE 148 N -2.83 -0.75 0.00 -3.49 5.36 -0.95 -0.98 117.98 114.34 1ucb s PHE 148 Ca -0.03 1.73 0.00 0.00 -0.96 0.00 0.00 56.93 57.67 1ucb s PHE 148 Cb 0.00 0.31 0.00 0.00 -0.34 0.00 0.00 43.02 42.99 1ucb s PHE 148 CO -0.06 -0.37 0.00 -0.35 -1.46 0.00 0.00 175.22 172.98 1ucb n PRO 149 N 3.16 1.80 -1.80 10.12 -0.04 -1.26 -0.44 135.00 146.54 1ucb n PRO 149 Ca -0.16 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 62.99 1ucb n PRO 149 Cb 0.56 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 34.04 1ucb n PRO 149 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1ucb s GLN 150 N 0.43 3.44 0.52 0.54 -1.52 -1.26 -4.80 119.66 117.00 1ucb s GLN 150 Ca 0.00 0.80 0.02 0.00 -1.95 0.00 0.00 55.36 54.23 1ucb s GLN 150 Cb 0.00 -2.06 -0.00 0.00 -0.22 0.00 0.00 33.01 30.73 1ucb s GLN 150 CO 0.00 -0.70 0.06 -1.25 -0.25 0.00 0.00 175.29 173.15 1ucb s PRO 151 N -5.14 2.21 0.14 2.91 0.04 -1.26 -5.00 135.00 128.90 1ucb s PRO 151 Ca 0.56 -2.36 0.09 0.00 0.04 0.00 0.00 61.00 59.33 1ucb s PRO 151 Cb -0.12 -1.61 -0.04 0.00 0.04 0.00 0.00 34.50 32.78 1ucb s PRO 151 CO 0.54 -0.41 -0.20 0.08 0.04 0.00 0.00 177.00 177.05 1ucb s VAL 152 N -2.87 1.83 -0.10 -0.36 1.01 -1.26 -4.54 120.40 114.11 1ucb s VAL 152 Ca 0.09 -1.75 0.00 0.00 0.00 0.00 0.00 61.98 60.32 1ucb s VAL 152 Cb 0.01 -1.75 0.02 0.00 0.00 0.00 0.00 36.38 34.66 1ucb s VAL 152 CO 0.05 -0.17 -0.10 0.42 0.00 0.00 0.00 175.10 175.30 1ucb s THR 153 N -1.58 1.13 -0.08 3.92 -4.23 -0.69 -5.00 115.64 109.11 1ucb s THR 153 Ca 0.12 -0.39 0.00 0.00 -1.18 0.00 0.00 61.69 60.24 1ucb s THR 153 Cb -0.08 -1.10 -0.03 0.00 1.34 0.00 0.00 72.50 72.63 1ucb s THR 153 CO 0.06 0.38 -0.07 -0.69 -0.54 0.00 0.00 174.62 173.75 1ucb s VAL 154 N 1.38 3.67 0.14 2.29 1.01 -1.26 -1.82 120.40 125.81 1ucb s VAL 154 Ca -0.01 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.51 1ucb s VAL 154 Cb -0.14 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.68 1ucb s VAL 154 CO -0.05 0.58 -0.01 -0.94 0.00 0.00 0.00 175.10 174.68 1ucb s SER 156 N -0.55 1.05 -0.10 3.32 1.04 0.02 -4.95 113.70 113.53 1ucb s SER 156 Ca 0.08 -1.13 0.03 0.00 0.48 0.00 0.00 55.95 55.42 1ucb s SER 156 Cb -0.12 0.14 0.01 0.00 0.10 0.00 0.00 66.02 66.15 1ucb s SER 156 CO 0.02 -0.56 -0.21 0.26 0.98 0.00 0.00 173.24 173.72 1ucb s TRP 157 N -3.71 2.36 -1.37 5.02 0.52 -1.26 0.32 118.94 120.82 1ucb s TRP 157 Ca 0.20 -1.02 -0.00 0.00 0.02 0.00 0.00 56.10 55.30 1ucb s TRP 157 Cb 0.06 -1.61 0.00 0.00 -1.15 0.00 0.00 33.47 30.77 1ucb s TRP 157 CO 0.01 -0.44 0.52 0.09 0.02 0.00 0.00 176.95 177.15 1ucb n ASN 162 N 3.73 -0.65 -2.74 2.95 4.13 0.37 -0.90 115.26 122.15 1ucb n ASN 162 Ca -0.20 -0.94 -0.20 0.00 1.68 0.00 0.00 54.58 54.92 1ucb n ASN 162 Cb 0.52 -3.42 0.01 0.00 -1.54 0.00 0.00 39.78 35.35 1ucb n ASN 162 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1ucb n SER 163 N -3.01 -5.46 0.00 6.41 7.64 -1.26 -1.37 113.62 116.57 1ucb n SER 163 Ca -0.30 -0.13 0.00 0.00 1.01 0.00 0.00 58.87 59.45 1ucb n SER 163 Cb 0.68 -4.50 0.00 0.00 -1.01 0.00 0.00 64.21 59.38 1ucb n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ucb n GLY 164 N -1.19 1.34 0.22 0.23 0.00 -0.07 -4.92 105.19 100.79 1ucb n GLY 164 Ca -0.16 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 1ucb n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ucb h ALA 165 N 0.00 0.48 -1.86 4.61 0.00 -1.00 -3.40 119.26 118.10 1ucb h ALA 165 Ca 0.00 -0.33 -0.63 0.00 0.00 0.00 0.00 54.91 53.95 1ucb h ALA 165 Cb 0.00 -0.12 -0.14 0.00 0.00 0.00 0.00 17.79 17.53 1ucb h ALA 165 CO 0.00 0.38 0.43 -1.17 0.00 0.00 0.00 179.25 178.90 1ucb s LEU 166 N -9.19 4.35 -0.08 0.00 2.96 -1.00 -4.85 118.68 110.86 1ucb s LEU 166 Ca -0.13 -0.56 0.05 0.00 -0.22 0.00 0.00 54.13 53.27 1ucb s LEU 166 Cb 0.09 -2.69 -0.08 0.00 0.50 0.00 0.00 46.19 44.01 1ucb s LEU 166 CO 0.81 -1.17 -0.00 0.35 -1.32 0.00 0.00 176.35 175.02 1ucb n THR 167 N 6.02 0.50 -2.89 3.68 -2.24 -1.26 -4.33 114.28 113.76 1ucb n THR 167 Ca -0.01 -0.27 -0.40 0.00 -2.27 0.00 0.00 64.05 61.09 1ucb n THR 167 Cb 0.47 -0.81 -0.05 0.00 -2.10 0.00 0.00 70.33 67.84 1ucb n THR 167 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ucb s SER 168 N -4.16 7.30 0.00 3.42 1.04 -1.26 -3.64 113.70 116.41 1ucb s SER 168 Ca -0.06 1.56 0.00 0.00 0.48 0.00 0.00 55.95 57.93 1ucb s SER 168 Cb 0.02 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.63 1ucb s SER 168 CO 0.27 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 175.07 1ucb n GLY 169 N 2.39 0.82 3.74 7.32 0.00 -1.26 -4.72 105.19 113.48 1ucb n GLY 169 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1ucb n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ucb s VAL 171 N -2.74 4.05 -0.39 1.61 1.01 -1.24 -2.24 120.40 120.45 1ucb s VAL 171 Ca 0.00 1.79 0.01 0.00 0.00 0.00 0.00 61.98 63.78 1ucb s VAL 171 Cb 0.00 -4.14 0.14 0.00 0.00 0.00 0.00 36.38 32.38 1ucb s VAL 171 CO 0.00 0.32 0.24 -1.00 0.00 0.00 0.00 175.10 174.66 1ucb s HIS 172 N -0.34 1.11 -0.42 5.22 3.76 0.54 -4.94 115.29 120.22 1ucb s HIS 172 Ca 0.47 -1.95 -0.20 0.00 -0.15 0.00 0.00 55.06 53.24 1ucb s HIS 172 Cb -0.27 -1.16 0.02 0.00 1.11 0.00 0.00 32.58 32.27 1ucb s HIS 172 CO 0.33 -0.81 0.58 -0.08 -0.85 0.00 0.00 174.74 173.91 1ucb s THR 173 N 0.69 4.91 0.65 1.30 -1.32 -1.26 -0.88 115.64 119.72 1ucb s THR 173 Ca 0.21 0.06 -0.15 0.00 -1.21 0.00 0.00 61.69 60.60 1ucb s THR 173 Cb -0.18 -4.13 -0.00 0.00 -1.51 0.00 0.00 72.50 66.67 1ucb s THR 173 CO -0.03 -0.50 1.12 -0.36 -2.21 0.00 0.00 174.62 172.64 1ucb s PHE 174 N 2.61 2.61 0.47 9.09 0.40 0.51 -4.97 117.98 128.70 1ucb s PHE 174 Ca 0.20 1.55 -0.23 0.00 -0.60 0.00 0.00 56.93 57.85 1ucb s PHE 174 Cb -0.15 -3.19 -0.07 0.00 0.51 0.00 0.00 43.02 40.12 1ucb s PHE 174 CO 0.17 -1.71 1.18 -1.25 0.70 0.00 0.00 175.22 174.31 1ucb s PRO 175 N -4.01 3.72 0.56 0.24 0.04 -1.26 -4.51 135.00 129.78 1ucb s PRO 175 Ca 0.68 1.80 -0.20 0.00 0.04 0.00 0.00 61.00 63.31 1ucb s PRO 175 Cb -0.21 -2.39 -0.04 0.00 0.04 0.00 0.00 34.50 31.89 1ucb s PRO 175 CO 0.40 -0.59 1.26 0.00 0.04 0.00 0.00 177.00 178.11 1ucb s ALA 176 N -1.53 2.70 -0.06 8.56 0.00 -1.26 -4.82 121.76 125.34 1ucb s ALA 176 Ca 0.64 1.12 0.06 0.00 0.00 0.00 0.00 51.96 53.78 1ucb s ALA 176 Cb -0.29 -3.49 -0.01 0.00 0.00 0.00 0.00 23.12 19.33 1ucb s ALA 176 CO 0.35 -1.18 -0.25 0.08 0.00 0.00 0.00 175.76 174.77 1ucb s VAL 177 N -1.47 2.06 -0.22 0.00 1.01 -0.25 -4.92 120.40 116.61 1ucb s VAL 177 Ca 0.73 -1.06 -0.24 0.00 0.00 0.00 0.00 61.98 61.41 1ucb s VAL 177 Cb -0.34 -1.74 -0.01 0.00 0.00 0.00 0.00 36.38 34.29 1ucb s VAL 177 CO 0.39 0.57 0.81 -0.22 0.00 0.00 0.00 175.10 176.65 1ucb s LEU 178 N -0.11 4.11 0.73 3.92 2.96 -1.26 -1.53 118.68 127.50 1ucb s LEU 178 Ca -0.05 1.06 -0.05 0.00 -0.22 0.00 0.00 54.13 54.86 1ucb s LEU 178 Cb -0.14 -3.18 0.10 0.00 0.50 0.00 0.00 46.19 43.48 1ucb s LEU 178 CO 0.04 -0.46 1.03 -1.10 -1.32 0.00 0.00 176.35 174.54 1ucb s GLN 179 N 2.56 1.79 0.45 1.98 -0.21 0.29 -4.95 119.66 121.57 1ucb s GLN 179 Ca 0.35 -0.65 0.12 0.00 0.02 0.00 0.00 55.36 55.20 1ucb s GLN 179 Cb -0.16 -2.21 1.01 0.00 1.00 0.00 0.00 33.01 32.65 1ucb s GLN 179 CO 0.09 -1.45 2.05 0.66 -2.12 0.00 0.00 175.29 174.53 1ucb h SER 180 N -0.67 0.20 0.22 5.90 4.64 -1.97 -0.08 113.55 121.79 1ucb h SER 180 Ca -0.41 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1ucb h SER 180 Cb 1.28 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1ucb h SER 180 CO 0.48 0.21 0.00 -1.54 -0.87 0.00 0.00 176.83 175.11 1ucb n SER 182 N -4.44 0.00 0.00 4.97 3.41 -1.26 -4.81 113.62 111.49 1ucb n SER 182 Ca -0.01 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.89 1ucb n SER 182 Cb 0.14 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 63.72 1ucb n SER 182 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ucb n GLY 183 N -0.55 0.73 3.71 5.00 0.00 -0.04 -5.03 105.19 109.01 1ucb n GLY 183 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 1ucb n GLY 183 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ucb s LEU 184 N 0.00 3.48 0.56 0.99 1.43 -1.26 -4.87 118.68 119.02 1ucb s LEU 184 Ca 0.00 -0.30 -0.03 0.00 -1.03 0.00 0.00 54.13 52.77 1ucb s LEU 184 Cb 0.00 -2.12 0.02 0.00 0.03 0.00 0.00 46.19 44.12 1ucb s LEU 184 CO 0.00 0.08 0.83 -0.31 0.23 0.00 0.00 176.35 177.19 1ucb s TYR 185 N -1.73 3.12 -0.25 0.29 2.02 -0.16 -0.55 117.35 120.10 1ucb s TYR 185 Ca 0.29 0.39 -0.18 0.00 -0.37 0.00 0.00 57.07 57.19 1ucb s TYR 185 Cb -0.10 -2.69 0.07 0.00 -0.40 0.00 0.00 41.96 38.84 1ucb s TYR 185 CO 0.20 -0.79 0.63 0.45 -1.57 0.00 0.00 175.55 174.47 1ucb s SER 186 N -4.33 -0.77 0.15 2.29 0.15 -0.58 -2.23 113.70 108.37 1ucb s SER 186 Ca 0.54 1.34 -0.02 0.00 0.70 0.00 0.00 55.95 58.51 1ucb s SER 186 Cb -0.10 1.27 -0.04 0.00 -1.71 0.00 0.00 66.02 65.44 1ucb s SER 186 CO 0.42 -0.23 0.09 -1.48 1.20 0.00 0.00 173.24 173.24 1ucb s LEU 187 N 1.04 1.57 0.00 3.45 0.05 -0.57 -1.09 118.68 123.13 1ucb s LEU 187 Ca -0.06 -1.22 0.03 0.00 0.05 0.00 0.00 54.13 52.93 1ucb s LEU 187 Cb -0.05 0.39 -0.01 0.00 -2.05 0.00 0.00 46.19 44.47 1ucb s LEU 187 CO -0.10 -0.77 -0.08 -0.44 -0.55 0.00 0.00 176.35 174.41 1ucb s SER 188 N -3.07 0.97 -0.11 1.48 0.01 -1.26 -1.03 113.70 110.69 1ucb s SER 188 Ca 0.27 -0.19 0.03 0.00 1.31 0.00 0.00 55.95 57.37 1ucb s SER 188 Cb 0.07 -0.09 0.00 0.00 0.21 0.00 0.00 66.02 66.21 1ucb s SER 188 CO 0.04 0.07 -0.23 -0.55 0.41 0.00 0.00 173.24 172.98 1ucb s SER 189 N -0.34 3.17 -0.01 2.44 0.15 -0.77 -0.36 113.70 117.97 1ucb s SER 189 Ca 0.02 -0.55 0.03 0.00 0.70 0.00 0.00 55.95 56.16 1ucb s SER 189 Cb -0.04 -1.43 -0.01 0.00 -1.71 0.00 0.00 66.02 62.83 1ucb s SER 189 CO -0.00 0.15 -0.12 -0.69 1.20 0.00 0.00 173.24 173.78 1ucb s VAL 190 N 0.42 0.94 -0.03 4.45 1.01 -0.06 -1.67 120.40 125.45 1ucb s VAL 190 Ca -0.17 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 61.35 1ucb s VAL 190 Cb -0.17 -0.79 0.00 0.00 0.00 0.00 0.00 36.38 35.41 1ucb s VAL 190 CO 0.07 0.27 -0.10 0.54 0.00 0.00 0.00 175.10 175.88 1ucb s VAL 191 N -0.16 0.89 -0.18 2.92 0.11 -0.03 0.20 120.40 124.15 1ucb s VAL 191 Ca 0.02 -0.42 -0.15 0.00 -2.93 0.00 0.00 61.98 58.51 1ucb s VAL 191 Cb -0.06 -0.79 -0.04 0.00 -1.53 0.00 0.00 36.38 33.96 1ucb s VAL 191 CO -0.00 0.28 0.34 0.42 -3.33 0.00 0.00 175.10 172.80 1ucb s THR 192 N 0.20 5.26 0.14 5.04 -4.23 -0.95 -2.15 115.64 118.95 1ucb s THR 192 Ca -0.04 0.61 0.05 0.00 -1.18 0.00 0.00 61.69 61.13 1ucb s THR 192 Cb -0.09 -3.67 -0.04 0.00 1.34 0.00 0.00 72.50 70.03 1ucb s THR 192 CO 0.01 0.32 -0.11 0.68 -0.54 0.00 0.00 174.62 174.98 1ucb s VAL 193 N 0.91 1.17 0.08 2.29 -7.23 -0.22 -4.77 120.40 112.64 1ucb s VAL 193 Ca 0.17 -1.98 -0.31 0.00 -1.81 0.00 0.00 61.98 58.06 1ucb s VAL 193 Cb -0.14 -1.76 -0.08 0.00 0.56 0.00 0.00 36.38 34.96 1ucb s VAL 193 CO 0.06 -0.69 1.52 -2.16 -0.31 0.00 0.00 175.10 173.52 1ucb s PRO 194 N -3.52 4.25 0.62 4.82 0.04 -1.26 0.19 135.00 140.14 1ucb s PRO 194 Ca 0.15 2.19 0.27 0.00 0.04 0.00 0.00 61.00 63.64 1ucb s PRO 194 Cb 0.01 -3.43 1.36 0.00 0.04 0.00 0.00 34.50 32.48 1ucb s PRO 194 CO 0.01 -0.60 1.78 0.66 0.04 0.00 0.00 177.00 178.88 1ucb h SER 195 N 7.58 0.00 0.83 6.66 4.64 -0.66 0.58 113.55 133.18 1ucb h SER 195 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1ucb h SER 195 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1ucb h SER 195 CO 0.91 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.33 1ucb n SER 196 N -3.34 0.03 0.08 4.97 3.41 -1.26 -3.10 113.62 114.40 1ucb n SER 196 Ca 0.06 0.50 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 1ucb n SER 196 Cb 0.71 -0.51 -0.04 0.00 -0.26 0.00 0.00 64.21 64.10 1ucb n SER 196 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1ucb h SER 197 N 0.00 0.00 -3.83 4.04 4.64 -1.24 -3.44 113.55 113.71 1ucb h SER 197 Ca 0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 1ucb h SER 197 Cb 0.41 0.00 0.11 0.00 -0.31 0.00 0.00 62.40 62.61 1ucb h SER 197 CO 0.00 0.60 0.79 0.18 -0.87 0.00 0.00 176.83 177.53 1ucb n LEU 198 N -3.08 4.73 0.00 5.97 4.77 -1.18 -0.54 117.00 127.66 1ucb n LEU 198 Ca -0.04 1.22 0.00 0.00 -0.03 0.00 0.00 56.01 57.16 1ucb n LEU 198 Cb 0.81 -1.62 0.00 0.00 -2.33 0.00 0.00 43.42 40.28 1ucb n LEU 198 CO 0.42 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 1ucb n GLY 199 N 0.68 2.09 0.91 -0.72 0.00 -1.26 -4.74 105.19 102.15 1ucb n GLY 199 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1ucb n GLY 199 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ucb n THR 200 N -2.00 0.00 -3.27 2.61 -1.04 -0.46 -5.06 114.28 105.06 1ucb n THR 200 Ca 0.00 0.00 -0.32 0.00 -2.04 0.00 0.00 64.05 61.69 1ucb n THR 200 Cb 0.00 -1.01 -0.06 0.00 -1.82 0.00 0.00 70.33 67.44 1ucb n THR 200 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1ucb s GLN 203 N -1.93 3.92 -0.19 -2.82 -1.52 0.29 -5.06 119.66 112.34 1ucb s GLN 203 Ca 0.00 0.49 -0.11 0.00 -1.95 0.00 0.00 55.36 53.79 1ucb s GLN 203 Cb 0.00 -2.55 -0.05 0.00 -0.22 0.00 0.00 33.01 30.19 1ucb s GLN 203 CO 0.00 0.24 0.17 0.99 -0.25 0.00 0.00 175.29 176.44 1ucb s THR 205 N -1.89 5.39 -0.19 -0.19 2.01 -1.26 -4.80 115.64 114.71 1ucb s THR 205 Ca 0.50 0.27 0.01 0.00 0.31 0.00 0.00 61.69 62.78 1ucb s THR 205 Cb -0.11 -3.51 0.02 0.00 0.01 0.00 0.00 72.50 68.91 1ucb s THR 205 CO 0.19 0.43 -0.19 -0.31 -0.69 0.00 0.00 174.62 174.05 1ucb s TYR 206 N 0.39 2.81 -0.07 4.92 2.02 -1.26 -4.95 117.35 121.21 1ucb s TYR 206 Ca 0.10 -1.63 0.00 0.00 -0.37 0.00 0.00 57.07 55.17 1ucb s TYR 206 Cb -0.11 -1.93 0.02 0.00 -0.40 0.00 0.00 41.96 39.54 1ucb s TYR 206 CO -0.01 -0.80 -0.05 0.42 -1.57 0.00 0.00 175.55 173.55 1ucb s ILE 207 N 1.30 0.65 -0.15 2.71 1.01 -1.26 -1.03 121.20 124.43 1ucb s ILE 207 Ca 0.05 -0.13 -0.16 0.00 0.00 0.00 0.00 60.65 60.41 1ucb s ILE 207 Cb -0.13 -0.70 -0.04 0.00 0.01 0.00 0.00 42.46 41.59 1ucb s ILE 207 CO -0.12 0.28 0.39 0.00 0.00 0.00 0.00 174.94 175.49 1ucb s ASN 209 N 0.66 5.92 -0.18 0.00 0.02 0.15 -1.68 114.94 119.83 1ucb s ASN 209 Ca 0.21 -0.02 0.01 0.00 -1.02 0.00 0.00 52.86 52.04 1ucb s ASN 209 Cb -0.14 -2.09 0.01 0.00 0.02 0.00 0.00 41.25 39.05 1ucb s ASN 209 CO 0.07 -0.03 -0.18 -0.69 0.02 0.00 0.00 177.10 176.29 1ucb s VAL 210 N 1.64 2.26 -0.05 1.60 1.01 -0.08 -0.80 120.40 125.98 1ucb s VAL 210 Ca 0.07 -0.88 0.05 0.00 0.00 0.00 0.00 61.98 61.22 1ucb s VAL 210 Cb -0.16 -1.96 -0.01 0.00 0.00 0.00 0.00 36.38 34.26 1ucb s VAL 210 CO 0.09 0.53 -0.21 0.21 0.00 0.00 0.00 175.10 175.72 1ucb s ASN 211 N 1.22 2.60 -0.46 3.32 3.04 -0.76 -0.94 114.94 122.96 1ucb s ASN 211 Ca 0.03 -0.43 0.05 0.00 0.04 0.00 0.00 52.86 52.55 1ucb s ASN 211 Cb -0.14 -0.77 0.20 0.00 -1.54 0.00 0.00 41.25 39.00 1ucb s ASN 211 CO -0.09 0.19 0.44 1.57 -3.04 0.00 0.00 177.10 176.17 1ucb n HIS 212 N 3.11 0.14 -0.33 0.43 -0.00 0.83 -1.71 115.22 117.68 1ucb n HIS 212 Ca -0.18 -3.58 0.25 0.00 -0.00 0.00 0.00 57.72 54.21 1ucb n HIS 212 Cb 0.52 -0.09 0.47 0.00 -0.00 0.00 0.00 29.99 30.90 1ucb n HIS 212 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.34 177.21 1ucb h LYS 213 N 5.03 0.01 -0.56 1.57 1.57 -1.80 -2.43 116.57 119.97 1ucb h LYS 213 Ca 0.19 -0.00 0.11 0.00 -1.87 0.00 0.00 60.65 59.08 1ucb h LYS 213 Cb 0.86 -0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.08 1ucb h LYS 213 CO 0.48 0.01 0.03 -1.35 -0.57 0.00 0.00 179.45 178.05 1ucb h PRO 214 N 0.01 0.15 -0.67 3.15 0.11 -1.94 0.62 132.00 133.43 1ucb h PRO 214 Ca 0.75 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.85 1ucb h PRO 214 Cb 1.84 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.92 1ucb h PRO 214 CO -0.83 0.10 0.00 -1.13 -0.21 0.00 0.00 178.00 175.93 1ucb n SER 215 N -5.22 4.37 -1.66 -2.05 3.41 -0.95 -4.93 113.62 106.59 1ucb n SER 215 Ca 0.07 -2.32 -0.18 0.00 -0.26 0.00 0.00 58.87 56.18 1ucb n SER 215 Cb 0.31 -0.54 -0.07 0.00 -0.26 0.00 0.00 64.21 63.65 1ucb n SER 215 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1ucb n ASN 216 N 1.21 -4.89 -4.74 4.04 3.02 0.21 -4.85 115.26 109.25 1ucb n ASN 216 Ca 0.24 0.40 -0.40 0.00 -0.03 0.00 0.00 54.58 54.78 1ucb n ASN 216 Cb 0.79 -4.33 -0.05 0.00 -0.61 0.00 0.00 39.78 35.57 1ucb n ASN 216 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1ucb s THR 217 N -2.60 4.29 -0.21 3.41 2.01 -1.06 -4.93 115.64 116.55 1ucb s THR 217 Ca 0.00 2.07 -0.04 0.00 0.31 0.00 0.00 61.69 64.03 1ucb s THR 217 Cb 0.00 -4.32 0.11 0.00 0.01 0.00 0.00 72.50 68.30 1ucb s THR 217 CO 0.00 0.41 0.34 -0.75 -0.69 0.00 0.00 174.62 173.93 1ucb s LYS 218 N -0.61 0.28 -0.04 4.92 2.20 -1.25 -0.12 119.74 125.12 1ucb s LYS 218 Ca 0.44 0.57 -0.02 0.00 -0.36 0.00 0.00 55.97 56.60 1ucb s LYS 218 Cb -0.25 -0.45 0.03 0.00 -1.51 0.00 0.00 37.83 35.65 1ucb s LYS 218 CO 0.31 -0.54 0.09 0.54 -0.36 0.00 0.00 175.35 175.38 1ucb s VAL 219 N 2.49 -0.04 -0.35 4.02 0.11 -0.12 -5.00 120.40 121.52 1ucb s VAL 219 Ca 0.08 0.16 -0.07 0.00 -2.93 0.00 0.00 61.98 59.22 1ucb s VAL 219 Cb -0.15 -0.15 0.04 0.00 -1.53 0.00 0.00 36.38 34.59 1ucb s VAL 219 CO -0.14 0.06 0.12 -1.81 -3.33 0.00 0.00 175.10 170.01 1ucb s ASP 220 N 0.90 5.35 -0.21 3.54 1.01 -1.26 -0.91 116.67 125.09 1ucb s ASP 220 Ca -0.07 -1.17 -0.08 0.00 0.71 0.00 0.00 52.55 51.93 1ucb s ASP 220 Cb -0.10 -1.88 -0.04 0.00 1.01 0.00 0.00 42.92 41.91 1ucb s ASP 220 CO -0.04 -0.34 0.09 -0.75 0.21 0.00 0.00 175.17 174.34 1ucb s LYS 221 N 1.40 3.95 -0.29 8.23 2.47 -0.68 -4.94 119.74 129.89 1ucb s LYS 221 Ca -0.01 -0.34 -0.22 0.00 -1.56 0.00 0.00 55.97 53.83 1ucb s LYS 221 Cb -0.20 -3.34 -0.01 0.00 -1.46 0.00 0.00 37.83 32.83 1ucb s LYS 221 CO 0.03 0.13 0.72 0.50 0.16 0.00 0.00 175.35 176.89 1ucb s ARG 222 N 0.80 4.00 -0.14 4.03 3.00 -1.26 -1.55 118.95 127.83 1ucb s ARG 222 Ca 0.05 0.55 -0.18 0.00 -1.00 0.00 0.00 55.73 55.15 1ucb s ARG 222 Cb -0.13 -3.70 -0.04 0.00 0.00 0.00 0.00 34.95 31.08 1ucb s ARG 222 CO 0.02 -0.58 0.47 0.08 0.00 0.00 0.00 175.30 175.29 1ucb s VAL 223 N 2.77 5.18 0.08 7.11 1.01 -0.19 -4.97 120.40 131.38 1ucb s VAL 223 Ca 0.30 0.92 0.03 0.00 0.00 0.00 0.00 61.98 63.23 1ucb s VAL 223 Cb -0.15 -3.81 -0.03 0.00 0.00 0.00 0.00 36.38 32.39 1ucb s VAL 223 CO 0.11 0.29 -0.10 -1.61 0.00 0.00 0.00 175.10 173.79 1ucb s GLU 226 N 0.88 0.76 0.00 2.72 2.02 -1.26 -4.43 118.70 119.39 1ucb s GLU 226 Ca 0.25 -1.03 0.29 0.00 0.02 0.00 0.00 54.97 54.50 1ucb s GLU 226 Cb -0.15 -0.49 1.75 0.00 0.10 0.00 0.00 34.13 35.34 1ucb s GLU 226 CO 0.10 0.08 2.08 -0.35 0.02 0.00 0.00 175.26 177.19