#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i02 s VAL 2 N 0.00 2.66 -0.04 6.31 1.01 -1.26 -3.93 120.40 125.16 3i02 s VAL 2 Ca 0.00 0.48 -0.01 0.00 0.00 0.00 0.00 61.98 62.45 3i02 s VAL 2 Cb 0.00 -3.31 0.03 0.00 0.00 0.00 0.00 36.38 33.10 3i02 s VAL 2 CO 0.00 0.04 0.07 -0.32 0.00 0.00 0.00 175.10 174.89 3i02 s MET 3 N 0.91 0.02 -0.14 2.72 1.75 -0.57 -4.96 119.30 119.02 3i02 s MET 3 Ca 0.68 0.24 -0.01 0.00 -1.25 0.00 0.00 55.69 55.35 3i02 s MET 3 Cb -0.43 -0.20 0.04 0.00 2.84 0.00 0.00 34.83 37.08 3i02 s MET 3 CO 0.33 -0.15 -0.03 -0.51 -0.65 0.00 0.00 175.02 174.00 3i02 s LEU 4 N 1.00 1.24 -0.23 4.11 1.43 -1.26 -1.33 118.68 123.64 3i02 s LEU 4 Ca -0.08 -0.49 0.02 0.00 -1.03 0.00 0.00 54.13 52.55 3i02 s LEU 4 Cb -0.11 -0.75 0.05 0.00 0.03 0.00 0.00 46.19 45.41 3i02 s LEU 4 CO -0.04 -0.19 -0.12 -0.69 0.23 0.00 0.00 176.35 175.54 3i02 s VAL 5 N 1.75 2.02 0.11 -1.59 1.01 0.05 -3.96 120.40 119.80 3i02 s VAL 5 Ca 0.02 -1.37 -0.27 0.00 0.00 0.00 0.00 61.98 60.36 3i02 s VAL 5 Cb -0.14 -2.07 -0.06 0.00 0.00 0.00 0.00 36.38 34.10 3i02 s VAL 5 CO -0.07 0.12 0.85 -1.61 0.00 0.00 0.00 175.10 174.38 3i02 s GLU 6 N 1.20 4.61 0.13 2.72 8.01 -1.26 -1.35 118.70 132.76 3i02 s GLU 6 Ca -0.05 1.25 0.02 0.00 0.01 0.00 0.00 54.97 56.20 3i02 s GLU 6 Cb -0.18 -3.34 -0.04 0.00 -4.31 0.00 0.00 34.13 26.26 3i02 s GLU 6 CO -0.07 0.34 -0.03 -1.12 0.01 0.00 0.00 175.26 174.38 3i02 s SER 7 N -0.35 1.12 0.00 -0.19 0.01 0.06 -4.69 113.70 109.67 3i02 s SER 7 Ca 0.41 -1.09 0.00 0.00 1.31 0.00 0.00 55.95 56.58 3i02 s SER 7 Cb -0.22 0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.12 3i02 s SER 7 CO 0.27 -0.53 0.00 0.61 0.41 0.00 0.00 173.24 174.00 3i02 n GLY 8 N -0.13 0.50 3.79 3.44 0.00 -1.26 -1.28 105.19 110.24 3i02 n GLY 8 Ca -0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 3i02 n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3i02 s GLY 9 N -1.02 1.63 0.00 -0.02 0.00 -1.26 -4.69 107.32 101.96 3i02 s GLY 9 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 44.72 44.58 3i02 s GLY 9 CO 0.00 0.28 0.00 0.61 0.00 0.00 0.00 173.10 173.99 3i02 n GLY 10 N -1.89 -1.32 3.69 0.20 0.00 -0.54 -4.90 105.19 100.43 3i02 n GLY 10 Ca 0.07 -1.13 -0.42 0.00 0.00 0.00 0.00 46.02 44.54 3i02 n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3i02 s LEU 11 N 0.00 4.26 -0.03 0.99 2.96 -1.26 -1.57 118.68 124.03 3i02 s LEU 11 Ca 0.00 1.62 0.01 0.00 -0.22 0.00 0.00 54.13 55.54 3i02 s LEU 11 Cb 0.00 -3.56 0.02 0.00 0.50 0.00 0.00 46.19 43.16 3i02 s LEU 11 CO 0.00 -0.49 -0.01 0.54 -1.32 0.00 0.00 176.35 175.07 3i02 s VAL 12 N 2.07 0.27 0.61 1.68 0.11 0.14 -4.96 120.40 120.31 3i02 s VAL 12 Ca 0.51 0.02 -0.18 0.00 -2.93 0.00 0.00 61.98 59.40 3i02 s VAL 12 Cb -0.20 -0.34 -0.03 0.00 -1.53 0.00 0.00 36.38 34.28 3i02 s VAL 12 CO 0.19 0.16 1.22 -1.10 -3.33 0.00 0.00 175.10 172.24 3i02 s GLN 13 N 0.94 2.87 0.22 1.54 -0.21 -1.24 -0.99 119.66 122.80 3i02 s GLN 13 Ca -0.10 1.86 -0.32 0.00 0.02 0.00 0.00 55.36 56.82 3i02 s GLN 13 Cb -0.13 -1.91 -0.14 0.00 1.00 0.00 0.00 33.01 31.83 3i02 s GLN 13 CO -0.01 -1.29 1.42 -2.30 -2.12 0.00 0.00 175.29 170.99 3i02 n PRO 14 N -1.69 2.00 0.00 2.91 -0.02 -1.26 -0.88 135.00 136.06 3i02 n PRO 14 Ca 0.14 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 3i02 n PRO 14 Cb 0.49 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 3i02 n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3i02 n GLY 15 N 2.36 2.17 3.79 -1.23 0.00 -0.23 -4.92 105.19 107.13 3i02 n GLY 15 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 3i02 n GLY 15 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3i02 s GLY 16 N -2.06 1.58 0.43 -0.02 0.00 -0.06 -3.84 107.32 103.36 3i02 s GLY 16 Ca 0.00 -0.57 0.07 0.00 0.00 0.00 0.00 44.72 44.22 3i02 s GLY 16 CO 0.00 0.00 0.22 -0.56 0.00 0.00 0.00 173.10 172.76 3i02 s SER 17 N -4.08 4.49 -0.29 1.64 0.01 -1.26 -2.11 113.70 112.11 3i02 s SER 17 Ca 0.64 -1.10 -0.23 0.00 1.31 0.00 0.00 55.95 56.58 3i02 s SER 17 Cb -0.14 -0.33 0.13 0.00 0.21 0.00 0.00 66.02 65.90 3i02 s SER 17 CO 0.53 -0.64 1.06 -0.22 0.41 0.00 0.00 173.24 174.38 3i02 s LEU 18 N -3.97 -0.42 -0.26 2.44 2.96 -0.57 -4.98 118.68 113.87 3i02 s LEU 18 Ca 0.39 0.77 -0.03 0.00 -0.22 0.00 0.00 54.13 55.04 3i02 s LEU 18 Cb 0.02 1.77 0.02 0.00 0.50 0.00 0.00 46.19 48.50 3i02 s LEU 18 CO 0.22 -0.13 -0.02 -0.60 -1.32 0.00 0.00 176.35 174.50 3i02 s ARG 19 N 0.47 2.94 0.14 1.98 3.52 -1.26 -0.87 118.95 125.87 3i02 s ARG 19 Ca 0.01 -0.92 -0.13 0.00 -0.13 0.00 0.00 55.73 54.55 3i02 s ARG 19 Cb -0.05 -3.09 -0.07 0.00 -1.56 0.00 0.00 34.95 30.18 3i02 s ARG 19 CO -0.09 -0.40 0.53 -0.51 -0.81 0.00 0.00 175.30 174.02 3i02 s LEU 20 N 1.38 4.33 0.24 -0.88 1.43 -0.46 -4.67 118.68 120.06 3i02 s LEU 20 Ca 0.01 1.03 0.08 0.00 -1.03 0.00 0.00 54.13 54.22 3i02 s LEU 20 Cb -0.17 -3.24 -0.05 0.00 0.03 0.00 0.00 46.19 42.76 3i02 s LEU 20 CO -0.02 0.11 -0.13 -0.94 0.23 0.00 0.00 176.35 175.59 3i02 s SER 21 N -1.74 2.82 -0.31 2.29 1.04 -0.40 -1.33 113.70 116.06 3i02 s SER 21 Ca 0.37 -1.06 -0.01 0.00 0.48 0.00 0.00 55.95 55.73 3i02 s SER 21 Cb -0.15 -0.18 0.12 0.00 0.10 0.00 0.00 66.02 65.92 3i02 s SER 21 CO 0.19 -0.17 0.22 0.00 0.98 0.00 0.00 173.24 174.46 3i02 s ALA 23 N 1.85 3.43 0.22 0.00 0.00 -0.46 -0.86 121.76 125.93 3i02 s ALA 23 Ca 0.12 0.92 0.09 0.00 0.00 0.00 0.00 51.96 53.10 3i02 s ALA 23 Cb -0.17 -3.42 -0.05 0.00 0.00 0.00 0.00 23.12 19.48 3i02 s ALA 23 CO -0.23 -0.38 -0.17 0.95 0.00 0.00 0.00 175.76 175.93 3i02 s THR 24 N 0.24 2.00 0.29 0.00 -4.23 -0.51 -0.77 115.64 112.66 3i02 s THR 24 Ca 0.54 -2.21 -0.19 0.00 -1.18 0.00 0.00 61.69 58.65 3i02 s THR 24 Cb -0.32 -2.09 0.06 0.00 1.34 0.00 0.00 72.50 71.49 3i02 s THR 24 CO 0.34 -0.47 0.88 -0.94 -0.54 0.00 0.00 174.62 173.90 3i02 s SER 25 N -3.23 -0.03 0.00 3.99 1.04 -0.44 -4.84 113.70 110.19 3i02 s SER 25 Ca 0.23 -0.89 0.00 0.00 0.48 0.00 0.00 55.95 55.78 3i02 s SER 25 Cb -0.03 0.70 0.00 0.00 0.10 0.00 0.00 66.02 66.78 3i02 s SER 25 CO 0.09 -1.37 0.00 0.61 0.98 0.00 0.00 173.24 173.56 3i02 n GLY 26 N -0.58 0.84 3.77 7.32 0.00 -1.25 -1.52 105.19 113.77 3i02 n GLY 26 Ca -0.06 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.88 3i02 n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3i02 s PHE 27 N -3.32 -0.24 -0.88 1.61 -0.71 -1.26 -4.22 117.98 108.96 3i02 s PHE 27 Ca 0.00 -0.17 -0.22 0.00 -1.04 0.00 0.00 56.93 55.51 3i02 s PHE 27 Cb 0.00 0.67 0.08 0.00 -1.21 0.00 0.00 43.02 42.57 3i02 s PHE 27 CO 0.00 -1.16 1.20 0.99 -1.34 0.00 0.00 175.22 174.91 3i02 s THR 28 N -3.89 4.31 0.13 -4.49 2.01 -1.26 -4.93 115.64 107.51 3i02 s THR 28 Ca 0.09 -0.88 -0.29 0.00 0.31 0.00 0.00 61.69 60.93 3i02 s THR 28 Cb -0.05 -4.86 -0.09 0.00 0.01 0.00 0.00 72.50 67.52 3i02 s THR 28 CO 0.03 -1.66 1.48 0.15 -0.69 0.00 0.00 174.62 173.94 3i02 h PHE 29 N 9.39 -1.58 0.00 4.92 3.57 -1.96 -1.88 116.94 129.40 3i02 h PHE 29 Ca 0.03 0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.62 3i02 h PHE 29 Cb 1.03 0.76 0.00 0.00 2.79 0.00 0.00 35.95 40.54 3i02 h PHE 29 CO 1.15 -0.40 0.21 1.79 -2.23 0.00 0.00 178.31 178.83 3i02 h THR 30 N -0.23 0.00 0.00 4.41 1.35 -1.91 -0.20 112.91 116.34 3i02 h THR 30 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.95 3i02 h THR 30 Cb 0.47 0.56 0.00 0.00 -1.73 0.00 0.00 68.15 67.45 3i02 h THR 30 CO -0.64 0.00 0.00 0.44 -0.25 0.00 0.00 175.52 175.07 3i02 h ASP 31 N 0.00 0.00 -3.83 5.36 3.32 -1.74 -0.69 116.42 118.84 3i02 h ASP 31 Ca 0.00 0.00 -0.69 0.00 0.02 0.00 0.00 57.03 56.36 3i02 h ASP 31 Cb 0.42 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 39.76 3i02 h ASP 31 CO 0.00 0.00 -0.73 -0.31 -1.72 0.00 0.00 179.24 176.48 3i02 s TYR 32 N -3.13 2.83 0.29 4.55 2.02 -0.09 -4.48 117.35 119.34 3i02 s TYR 32 Ca 0.10 -0.06 -0.29 0.00 -0.37 0.00 0.00 57.07 56.44 3i02 s TYR 32 Cb 0.12 -1.66 -0.11 0.00 -0.40 0.00 0.00 41.96 39.91 3i02 s TYR 32 CO 0.59 0.27 1.46 0.71 -1.57 0.00 0.00 175.55 177.00 3i02 s TYR 33 N -0.79 2.89 -0.08 2.71 1.51 0.30 -4.04 117.35 119.85 3i02 s TYR 33 Ca 0.12 1.07 0.04 0.00 -1.01 0.00 0.00 57.07 57.29 3i02 s TYR 33 Cb -0.11 -3.88 -0.01 0.00 -0.11 0.00 0.00 41.96 37.85 3i02 s TYR 33 CO 0.01 -2.77 -0.19 -1.64 -1.11 0.00 0.00 175.55 169.86 3i02 s MET 34 N -0.95 2.82 0.08 -0.62 -1.94 -0.54 0.74 119.30 118.89 3i02 s MET 34 Ca 0.57 -0.79 0.07 0.00 -1.71 0.00 0.00 55.69 53.83 3i02 s MET 34 Cb -0.43 -2.36 -0.04 0.00 2.01 0.00 0.00 34.83 34.01 3i02 s MET 34 CO 0.49 0.37 -0.14 -1.12 -0.01 0.00 0.00 175.02 174.62 3i02 s SER 35 N -0.11 4.12 -0.13 3.03 0.01 -0.13 -1.53 113.70 118.95 3i02 s SER 35 Ca -0.03 -0.42 -0.05 0.00 1.31 0.00 0.00 55.95 56.75 3i02 s SER 35 Cb -0.14 -0.72 -0.04 0.00 0.21 0.00 0.00 66.02 65.33 3i02 s SER 35 CO 0.04 0.21 0.04 0.26 0.41 0.00 0.00 173.24 174.20 3i02 s TRP 36 N -1.10 3.26 0.02 2.43 0.52 -0.60 -0.78 118.94 122.67 3i02 s TRP 36 Ca 0.18 0.16 0.02 0.00 0.02 0.00 0.00 56.10 56.49 3i02 s TRP 36 Cb -0.11 -1.94 -0.01 0.00 -1.15 0.00 0.00 33.47 30.26 3i02 s TRP 36 CO 0.10 0.35 -0.08 0.08 0.02 0.00 0.00 176.95 177.42 3i02 s VAL 37 N -0.33 0.61 0.26 4.03 1.01 0.01 -1.34 120.40 124.64 3i02 s VAL 37 Ca 0.08 -0.66 0.05 0.00 0.00 0.00 0.00 61.98 61.46 3i02 s VAL 37 Cb -0.12 -0.57 -0.06 0.00 0.00 0.00 0.00 36.38 35.63 3i02 s VAL 37 CO 0.02 -0.06 -0.03 0.00 0.00 0.00 0.00 175.10 175.03 3i02 s ARG 38 N -0.79 1.47 -0.27 2.72 1.70 -0.35 0.45 118.95 123.88 3i02 s ARG 38 Ca -0.02 -1.75 -0.00 0.00 -0.47 0.00 0.00 55.73 53.49 3i02 s ARG 38 Cb -0.06 -0.93 0.15 0.00 -0.57 0.00 0.00 34.95 33.54 3i02 s ARG 38 CO 0.00 -0.02 0.37 -1.14 -1.08 0.00 0.00 175.30 173.43 3i02 s GLN 39 N -3.79 0.37 0.54 3.89 0.74 -0.26 -0.41 119.66 120.74 3i02 s GLN 39 Ca 0.29 0.18 -0.21 0.00 0.05 0.00 0.00 55.36 55.67 3i02 s GLN 39 Cb 0.05 -0.47 -0.05 0.00 1.10 0.00 0.00 33.01 33.64 3i02 s GLN 39 CO 0.11 -0.91 1.25 -2.14 -0.55 0.00 0.00 175.29 173.05 3i02 s PRO 40 N 2.50 3.26 -0.09 1.67 0.02 -1.26 -1.78 135.00 139.32 3i02 s PRO 40 Ca 0.10 1.97 -0.40 0.00 0.02 0.00 0.00 61.00 62.69 3i02 s PRO 40 Cb -0.14 -2.19 -0.19 0.00 0.02 0.00 0.00 34.50 32.01 3i02 s PRO 40 CO -0.26 -1.01 1.29 -0.35 -0.33 0.00 0.00 177.00 176.34 3i02 n PRO 41 N -1.06 0.40 -2.62 5.54 -0.04 -1.26 -0.50 135.00 135.46 3i02 n PRO 41 Ca 0.11 0.15 -0.21 0.00 -0.04 0.00 0.00 63.50 63.50 3i02 n PRO 41 Cb 0.47 -1.70 0.01 0.00 -0.04 0.00 0.00 33.50 32.24 3i02 n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3i02 n GLY 42 N 2.43 -0.51 3.32 0.55 0.00 -1.26 -4.98 105.19 104.74 3i02 n GLY 42 Ca 0.22 0.05 -0.18 0.00 0.00 0.00 0.00 46.02 46.10 3i02 n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i02 s LYS 43 N -5.28 1.58 0.70 1.61 1.02 0.34 -5.16 119.74 114.55 3i02 s LYS 43 Ca 0.11 -1.90 -0.10 0.00 0.02 0.00 0.00 55.97 54.10 3i02 s LYS 43 Cb -0.05 -0.04 0.03 0.00 -0.52 0.00 0.00 37.83 37.26 3i02 s LYS 43 CO 0.13 -0.46 1.07 0.00 -0.92 0.00 0.00 175.35 175.17 3i02 s ALA 44 N -3.64 2.96 0.26 5.17 0.00 -1.26 -4.58 121.76 120.67 3i02 s ALA 44 Ca 0.36 -0.53 -0.29 0.00 0.00 0.00 0.00 51.96 51.50 3i02 s ALA 44 Cb 0.05 -2.88 -0.09 0.00 0.00 0.00 0.00 23.12 20.19 3i02 s ALA 44 CO 0.18 -1.19 1.22 -0.51 0.00 0.00 0.00 175.76 175.46 3i02 s LEU 45 N -5.32 4.47 -0.19 0.00 1.43 -1.26 -4.37 118.68 113.44 3i02 s LEU 45 Ca 0.58 2.42 -0.01 0.00 -1.03 0.00 0.00 54.13 56.09 3i02 s LEU 45 Cb -0.11 -3.63 0.06 0.00 0.03 0.00 0.00 46.19 42.54 3i02 s LEU 45 CO 0.49 -0.38 -0.00 -0.70 0.23 0.00 0.00 176.35 175.99 3i02 s GLU 46 N -1.08 1.03 0.13 1.70 2.12 0.45 -4.97 118.70 118.08 3i02 s GLU 46 Ca 0.50 -0.56 -0.31 0.00 0.36 0.00 0.00 54.97 54.96 3i02 s GLU 46 Cb -0.35 -2.16 -0.09 0.00 0.26 0.00 0.00 34.13 31.78 3i02 s GLU 46 CO 0.43 -0.58 1.57 -0.46 -0.54 0.00 0.00 175.26 175.69 3i02 s TRP 47 N 1.71 2.88 -0.07 5.30 -0.00 -1.26 -1.21 118.94 126.28 3i02 s TRP 47 Ca -0.02 0.56 0.18 0.00 -0.00 0.00 0.00 56.10 56.83 3i02 s TRP 47 Cb -0.17 -3.91 -0.28 0.00 -0.00 0.00 0.00 33.47 29.11 3i02 s TRP 47 CO -0.07 -3.44 0.31 1.28 -0.00 0.00 0.00 176.95 175.03 3i02 n LEU 48 N 4.50 0.00 0.00 5.86 4.77 -0.45 -4.58 117.00 127.10 3i02 n LEU 48 Ca 0.14 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 3i02 n LEU 48 Cb 0.40 0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 3i02 n LEU 48 CO 0.61 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.42 3i02 n GLY 49 N 1.55 1.20 3.15 -0.72 0.00 -1.24 -0.64 105.19 108.49 3i02 n GLY 49 Ca -0.12 -1.36 -0.09 0.00 0.00 0.00 0.00 46.02 44.46 3i02 n GLY 49 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3i02 s PHE 50 N -1.89 0.64 -0.08 1.61 -0.12 -0.22 -1.57 117.98 116.36 3i02 s PHE 50 Ca 0.00 -1.08 0.04 0.00 -0.05 0.00 0.00 56.93 55.84 3i02 s PHE 50 Cb 0.00 -0.38 0.00 0.00 -0.63 0.00 0.00 43.02 42.02 3i02 s PHE 50 CO 0.00 -0.49 -0.21 -1.50 -0.05 0.00 0.00 175.22 172.97 3i02 s ILE 51 N -3.98 1.82 0.89 -4.49 2.07 -0.58 -1.02 121.20 115.91 3i02 s ILE 51 Ca 0.16 -0.89 -0.15 0.00 -1.41 0.00 0.00 60.65 58.36 3i02 s ILE 51 Cb 0.07 -1.58 0.21 0.00 0.13 0.00 0.00 42.46 41.29 3i02 s ILE 51 CO -0.03 0.51 1.13 0.54 -1.91 0.00 0.00 174.94 175.18 3i02 n ARG 52 N 3.48 -1.42 -0.68 3.50 1.74 0.44 -1.47 116.66 122.25 3i02 n ARG 52 Ca -0.20 -1.76 -0.03 0.00 -0.77 0.00 0.00 57.85 55.10 3i02 n ARG 52 Cb 0.53 -1.24 0.01 0.00 -1.02 0.00 0.00 32.46 30.74 3i02 n ARG 52 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 3i02 n ASN 52 N -3.90 0.11 -0.03 0.55 0.23 -1.26 -4.10 115.26 106.87 3i02 n ASN 52 Ca 0.14 -1.10 -0.11 0.00 -0.53 0.00 0.00 54.58 52.98 3i02 n ASN 52 Cb 0.51 -0.08 -0.06 0.00 -2.08 0.00 0.00 39.78 38.07 3i02 n ASN 52 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 3i02 h LYS 52 N 0.00 0.20 -0.27 -3.83 3.64 -1.42 0.81 116.57 115.69 3i02 h LYS 52 Ca -0.04 -0.04 0.08 0.00 -1.27 0.00 0.00 60.65 59.38 3i02 h LYS 52 Cb 0.13 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 3i02 h LYS 52 CO 0.04 0.31 0.28 0.28 -2.27 0.00 0.00 179.45 178.08 3i02 h VAL 52 N 0.04 0.48 -0.02 2.00 2.07 -1.95 0.16 116.25 119.04 3i02 h VAL 52 Ca 0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 3i02 h VAL 52 Cb 0.19 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 3i02 h VAL 52 CO -0.00 0.00 -0.27 0.29 0.02 0.00 0.00 177.57 177.61 3i02 n LYS 53 N -3.85 1.41 -1.04 1.57 4.01 -0.98 -4.94 118.16 114.35 3i02 n LYS 53 Ca 0.04 -1.07 0.00 0.00 -0.51 0.00 0.00 58.31 56.76 3i02 n LYS 53 Cb 0.42 -1.48 0.00 0.00 -0.51 0.00 0.00 35.03 33.46 3i02 n LYS 53 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3i02 n GLY 54 N 1.36 0.40 3.84 0.72 0.00 0.56 -3.82 105.19 108.24 3i02 n GLY 54 Ca 0.12 -1.06 -0.29 0.00 0.00 0.00 0.00 46.02 44.79 3i02 n GLY 54 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3i02 n TYR 55 N -3.04 -2.45 -2.13 1.61 4.01 0.23 -4.95 117.16 110.44 3i02 n TYR 55 Ca 0.00 0.93 -0.34 0.00 -0.16 0.00 0.00 57.90 58.33 3i02 n TYR 55 Cb 0.03 -4.23 0.01 0.00 -0.31 0.00 0.00 39.34 34.85 3i02 n TYR 55 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3i02 s THR 56 N -3.30 3.22 0.06 -0.72 -4.23 -1.25 -4.44 115.64 104.98 3i02 s THR 56 Ca 0.65 0.70 0.06 0.00 -1.18 0.00 0.00 61.69 61.92 3i02 s THR 56 Cb -0.32 -3.25 -0.04 0.00 1.34 0.00 0.00 72.50 70.24 3i02 s THR 56 CO 0.81 -0.22 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.93 3i02 s ILE 57 N -1.94 3.34 0.05 2.99 1.01 -1.26 -0.42 121.20 124.96 3i02 s ILE 57 Ca 0.71 -1.08 -0.04 0.00 0.00 0.00 0.00 60.65 60.24 3i02 s ILE 57 Cb -0.23 -2.49 -0.02 0.00 0.01 0.00 0.00 42.46 39.73 3i02 s ILE 57 CO 0.31 0.26 0.05 -0.62 0.00 0.00 0.00 174.94 174.93 3i02 s ASP 58 N -1.78 0.30 0.18 3.58 -1.08 -0.19 -5.01 116.67 112.67 3i02 s ASP 58 Ca 0.18 -0.73 0.02 0.00 -0.52 0.00 0.00 52.55 51.50 3i02 s ASP 58 Cb -0.11 0.22 -0.05 0.00 -1.46 0.00 0.00 42.92 41.53 3i02 s ASP 58 CO 0.10 -0.56 0.01 -0.31 0.52 0.00 0.00 175.17 174.93 3i02 s TYR 59 N -3.21 1.23 0.37 -5.34 2.02 -1.26 -1.05 117.35 110.12 3i02 s TYR 59 Ca 0.00 -1.05 -0.17 0.00 -0.37 0.00 0.00 57.07 55.48 3i02 s TYR 59 Cb 0.03 -0.70 -0.10 0.00 -0.40 0.00 0.00 41.96 40.79 3i02 s TYR 59 CO -0.07 -0.24 0.83 -1.54 -1.57 0.00 0.00 175.55 172.96 3i02 s SER 60 N -3.18 6.82 0.58 2.29 1.04 0.18 -4.85 113.70 116.58 3i02 s SER 60 Ca 0.26 1.44 0.27 0.00 0.48 0.00 0.00 55.95 58.40 3i02 s SER 60 Cb 0.06 -2.44 1.67 0.00 0.10 0.00 0.00 66.02 65.41 3i02 s SER 60 CO 0.05 -0.28 2.18 0.00 0.98 0.00 0.00 173.24 176.16 3i02 h ALA 61 N 2.04 1.73 -0.76 5.32 0.00 -1.93 -0.94 119.26 124.72 3i02 h ALA 61 Ca -0.48 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.39 3i02 h ALA 61 Cb 1.18 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 3i02 h ALA 61 CO 0.63 -0.12 0.33 0.66 0.00 0.00 0.00 179.25 180.75 3i02 h SER 62 N 0.00 1.02 -0.00 0.00 4.64 -1.93 -3.29 113.55 113.99 3i02 h SER 62 Ca 0.04 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 3i02 h SER 62 Cb 0.20 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 3i02 h SER 62 CO -0.00 0.90 -0.05 1.33 -0.87 0.00 0.00 176.83 178.14 3i02 n VAL 63 N -4.34 0.00 -1.71 0.95 0.24 -0.97 -4.98 118.33 107.51 3i02 n VAL 63 Ca 0.07 -0.47 -0.43 0.00 -2.04 0.00 0.00 64.34 61.46 3i02 n VAL 63 Cb 0.16 1.07 -0.03 0.00 -1.47 0.00 0.00 33.84 33.57 3i02 n VAL 63 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 3i02 n LYS 64 N -0.12 2.68 -0.80 7.34 4.81 -0.40 -0.87 118.16 130.81 3i02 n LYS 64 Ca 0.02 0.97 0.00 0.00 -0.87 0.00 0.00 58.31 58.43 3i02 n LYS 64 Cb 0.10 -2.81 0.00 0.00 0.02 0.00 0.00 35.03 32.34 3i02 n LYS 64 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3i02 n GLY 65 N 3.92 0.81 0.00 3.14 0.00 -1.26 -4.77 105.19 107.03 3i02 n GLY 65 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3i02 n GLY 65 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3i02 n ARG 66 N -2.23 1.55 -4.32 1.61 0.63 -0.30 -5.05 116.66 108.54 3i02 n ARG 66 Ca 0.00 0.00 -0.31 0.00 -0.92 0.00 0.00 57.85 56.62 3i02 n ARG 66 Cb 0.00 -0.85 -0.10 0.00 0.45 0.00 0.00 32.46 31.96 3i02 n ARG 66 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 3i02 s PHE 67 N -1.70 2.91 -0.12 -0.14 0.40 -0.05 -2.15 117.98 117.14 3i02 s PHE 67 Ca 0.00 -0.04 0.01 0.00 -0.60 0.00 0.00 56.93 56.30 3i02 s PHE 67 Cb 0.00 -1.57 0.02 0.00 0.51 0.00 0.00 43.02 41.98 3i02 s PHE 67 CO 0.00 0.42 -0.12 0.99 0.70 0.00 0.00 175.22 177.21 3i02 s THR 68 N -1.11 1.31 -0.00 0.64 2.01 0.16 -4.82 115.64 113.84 3i02 s THR 68 Ca 0.20 -0.50 -0.03 0.00 0.31 0.00 0.00 61.69 61.67 3i02 s THR 68 Cb -0.11 -1.25 -0.04 0.00 0.01 0.00 0.00 72.50 71.11 3i02 s THR 68 CO 0.11 0.41 0.19 -0.63 -0.69 0.00 0.00 174.62 174.01 3i02 s ILE 69 N 1.33 5.42 0.12 1.82 1.01 -1.26 0.65 121.20 130.29 3i02 s ILE 69 Ca -0.00 -0.16 -0.25 0.00 0.00 0.00 0.00 60.65 60.23 3i02 s ILE 69 Cb -0.14 -3.55 0.07 0.00 0.01 0.00 0.00 42.46 38.85 3i02 s ILE 69 CO -0.06 0.31 0.80 -0.94 0.00 0.00 0.00 174.94 175.05 3i02 s SER 70 N -1.99 -0.36 -0.03 3.58 1.04 -1.08 -5.00 113.70 109.86 3i02 s SER 70 Ca 0.28 -0.19 -0.01 0.00 0.48 0.00 0.00 55.95 56.51 3i02 s SER 70 Cb -0.13 0.52 0.02 0.00 0.10 0.00 0.00 66.02 66.53 3i02 s SER 70 CO 0.20 -0.90 0.06 0.00 0.98 0.00 0.00 173.24 173.57 3i02 s ARG 71 N -3.46 0.03 -0.73 4.02 1.70 -1.26 0.29 118.95 119.53 3i02 s ARG 71 Ca 0.06 0.15 -0.17 0.00 -0.47 0.00 0.00 55.73 55.31 3i02 s ARG 71 Cb -0.02 -0.09 0.16 0.00 -0.57 0.00 0.00 34.95 34.43 3i02 s ARG 71 CO -0.05 -0.08 0.77 0.34 -1.08 0.00 0.00 175.30 175.20 3i02 s ASP 72 N 0.53 6.49 0.50 -2.89 -1.08 0.50 -4.91 116.67 115.81 3i02 s ASP 72 Ca -0.04 -2.08 0.33 0.00 -0.52 0.00 0.00 52.55 50.24 3i02 s ASP 72 Cb -0.06 -2.27 1.51 0.00 -1.46 0.00 0.00 42.92 40.64 3i02 s ASP 72 CO -0.02 -0.86 1.99 0.78 0.52 0.00 0.00 175.17 177.58 3i02 h ASN 73 N 8.54 0.00 0.35 -0.34 -0.26 -1.96 0.34 115.58 122.25 3i02 h ASN 73 Ca -0.06 0.00 -0.18 0.00 -0.56 0.00 0.00 56.30 55.50 3i02 h ASN 73 Cb 1.06 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.31 3i02 h ASN 73 CO 0.96 0.00 -0.76 0.77 -1.06 0.00 0.00 177.43 177.34 3i02 h SER 74 N 0.00 0.40 -0.01 5.81 4.64 -1.96 -3.29 113.55 119.13 3i02 h SER 74 Ca 0.00 -0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 3i02 h SER 74 Cb 0.33 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 3i02 h SER 74 CO 0.00 1.02 -0.25 0.00 -0.87 0.00 0.00 176.83 176.73 3i02 n GLN 75 N -3.80 1.73 -3.40 4.77 6.02 -0.83 -5.00 117.38 116.87 3i02 n GLN 75 Ca -0.04 -0.81 -0.17 0.00 -0.01 0.00 0.00 57.00 55.97 3i02 n GLN 75 Cb 0.72 -1.21 0.09 0.00 1.02 0.00 0.00 30.24 30.86 3i02 n GLN 75 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 3i02 n SER 76 N -0.05 -2.20 -4.15 1.08 7.64 0.11 -4.72 113.62 111.34 3i02 n SER 76 Ca 0.06 -0.61 -0.30 0.00 1.01 0.00 0.00 58.87 59.03 3i02 n SER 76 Cb 0.30 -5.07 -0.17 0.00 -1.01 0.00 0.00 64.21 58.26 3i02 n SER 76 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3i02 s ILE 77 N -3.36 1.76 -0.12 0.44 1.01 -0.85 -1.43 121.20 118.66 3i02 s ILE 77 Ca 0.02 -0.84 -0.09 0.00 0.00 0.00 0.00 60.65 59.74 3i02 s ILE 77 Cb -0.00 -1.54 -0.04 0.00 0.01 0.00 0.00 42.46 40.88 3i02 s ILE 77 CO 0.72 0.49 0.19 -0.22 0.00 0.00 0.00 174.94 176.12 3i02 s LEU 78 N 0.50 4.37 0.23 2.97 2.96 -0.04 -0.37 118.68 129.29 3i02 s LEU 78 Ca -0.16 0.51 0.11 0.00 -0.22 0.00 0.00 54.13 54.37 3i02 s LEU 78 Cb -0.17 -2.16 -0.05 0.00 0.50 0.00 0.00 46.19 44.31 3i02 s LEU 78 CO 0.06 0.35 -0.22 -0.31 -1.32 0.00 0.00 176.35 174.91 3i02 s TYR 79 N -0.75 2.24 -0.18 5.38 2.02 0.14 0.32 117.35 126.52 3i02 s TYR 79 Ca 0.15 -0.36 -0.04 0.00 -0.37 0.00 0.00 57.07 56.45 3i02 s TYR 79 Cb -0.13 -1.05 0.09 0.00 -0.40 0.00 0.00 41.96 40.47 3i02 s TYR 79 CO 0.04 0.57 0.23 -1.17 -1.57 0.00 0.00 175.55 173.66 3i02 s LEU 80 N -3.04 -0.16 -0.24 -1.29 2.96 -0.44 -2.65 118.68 113.81 3i02 s LEU 80 Ca 0.24 -0.01 -0.17 0.00 -0.22 0.00 0.00 54.13 53.97 3i02 s LEU 80 Cb -0.06 0.46 -0.03 0.00 0.50 0.00 0.00 46.19 47.06 3i02 s LEU 80 CO 0.12 -0.30 0.47 -1.58 -1.32 0.00 0.00 176.35 173.73 3i02 s GLN 81 N 2.35 4.09 -0.14 1.98 2.00 0.21 -1.35 119.66 128.80 3i02 s GLN 81 Ca 0.06 0.25 -0.02 0.00 -2.00 0.00 0.00 55.36 53.66 3i02 s GLN 81 Cb -0.15 -3.62 -0.02 0.00 0.80 0.00 0.00 33.01 30.02 3i02 s GLN 81 CO -0.11 -0.26 -0.09 -1.64 -0.50 0.00 0.00 175.29 172.69 3i02 s MET 82 N 2.00 3.51 0.16 1.67 -1.94 -0.05 0.39 119.30 125.04 3i02 s MET 82 Ca 0.20 -0.61 0.11 0.00 -1.71 0.00 0.00 55.69 53.67 3i02 s MET 82 Cb -0.15 -2.75 -0.04 0.00 2.01 0.00 0.00 34.83 33.89 3i02 s MET 82 CO 0.09 0.23 -0.24 -0.80 -0.01 0.00 0.00 175.02 174.29 3i02 s ASN 82 N 0.35 3.47 -0.97 3.03 0.01 -0.91 -1.51 114.94 118.39 3i02 s ASN 82 Ca -0.08 -0.77 -0.12 0.00 -0.71 0.00 0.00 52.86 51.17 3i02 s ASN 82 Cb -0.15 -0.29 0.01 0.00 0.41 0.00 0.00 41.25 41.23 3i02 s ASN 82 CO 0.05 0.15 0.69 0.41 -1.51 0.00 0.00 177.10 176.88 3i02 n THR 82 N 0.60 -4.97 -2.57 1.60 -1.04 -0.94 -4.86 114.28 102.10 3i02 n THR 82 Ca -0.15 -0.42 -0.40 0.00 -2.04 0.00 0.00 64.05 61.03 3i02 n THR 82 Cb 0.54 -3.82 -0.05 0.00 -1.82 0.00 0.00 70.33 65.19 3i02 n THR 82 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3i02 s LEU 82 N -5.70 4.56 0.52 -4.42 1.43 -0.90 -4.67 118.68 109.51 3i02 s LEU 82 Ca 0.22 2.13 0.01 0.00 -1.03 0.00 0.00 54.13 55.47 3i02 s LEU 82 Cb -0.10 -3.62 -0.00 0.00 0.03 0.00 0.00 46.19 42.50 3i02 s LEU 82 CO 0.88 -0.07 0.06 -0.13 0.23 0.00 0.00 176.35 177.31 3i02 s ARG 83 N -1.10 2.21 0.28 1.70 3.00 -1.26 -1.07 118.95 122.71 3i02 s ARG 83 Ca 0.45 -2.37 0.01 0.00 0.00 0.00 0.00 55.73 53.82 3i02 s ARG 83 Cb -0.29 -1.60 0.54 0.00 0.00 0.00 0.00 34.95 33.59 3i02 s ARG 83 CO 0.37 -0.41 1.85 0.00 0.00 0.00 0.00 175.30 177.11 3i02 h ALA 84 N 1.25 1.51 0.00 2.13 0.00 -1.97 -0.07 119.26 122.11 3i02 h ALA 84 Ca -0.43 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3i02 h ALA 84 Cb 1.32 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3i02 h ALA 84 CO 0.72 0.26 0.00 -1.91 0.00 0.00 0.00 179.25 178.32 3i02 n GLU 85 N -4.58 0.13 0.09 0.00 2.13 -1.26 -1.33 120.64 115.82 3i02 n GLU 85 Ca 0.18 0.59 0.11 0.00 0.66 0.00 0.00 57.16 58.71 3i02 n GLU 85 Cb 0.32 -1.90 -0.00 0.00 0.27 0.00 0.00 31.44 30.13 3i02 n GLU 85 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3i02 n ASP 86 N -2.17 0.77 -4.68 4.31 10.43 -0.04 -4.87 116.55 120.29 3i02 n ASP 86 Ca -0.01 0.27 -0.50 0.00 2.57 0.00 0.00 54.79 57.12 3i02 n ASP 86 Cb 0.06 0.56 -0.05 0.00 1.84 0.00 0.00 41.12 43.53 3i02 n ASP 86 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 3i02 n SER 87 N -2.58 3.23 -3.66 -2.24 7.64 -0.44 -4.88 113.62 110.69 3i02 n SER 87 Ca -0.00 1.00 0.02 0.00 1.01 0.00 0.00 58.87 60.90 3i02 n SER 87 Cb 0.54 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 3i02 n SER 87 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3i02 s ALA 88 N 3.76 -2.36 -0.07 -0.43 0.00 -0.06 -4.48 121.76 118.12 3i02 s ALA 88 Ca 0.93 0.60 -0.23 0.00 0.00 0.00 0.00 51.96 53.26 3i02 s ALA 88 Cb -0.76 0.46 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 3i02 s ALA 88 CO 0.53 -1.08 0.68 0.99 0.00 0.00 0.00 175.76 176.88 3i02 s THR 89 N -2.24 5.06 -0.20 0.00 2.01 -0.73 -0.19 115.64 119.34 3i02 s THR 89 Ca 0.18 1.40 -0.05 0.00 0.31 0.00 0.00 61.69 63.53 3i02 s THR 89 Cb 0.04 -4.02 -0.02 0.00 0.01 0.00 0.00 72.50 68.51 3i02 s THR 89 CO -0.04 0.26 -0.01 -0.31 -0.69 0.00 0.00 174.62 173.84 3i02 s TYR 90 N 0.76 3.03 0.02 4.92 1.51 0.19 -1.10 117.35 126.67 3i02 s TYR 90 Ca 0.36 -0.51 0.03 0.00 -1.01 0.00 0.00 57.07 55.94 3i02 s TYR 90 Cb -0.17 -2.08 -0.04 0.00 -0.11 0.00 0.00 41.96 39.55 3i02 s TYR 90 CO 0.17 -0.28 -0.01 0.71 -1.11 0.00 0.00 175.55 175.03 3i02 s TYR 91 N 1.05 3.01 -0.04 2.71 2.02 0.17 -1.59 117.35 124.68 3i02 s TYR 91 Ca 0.02 0.03 -0.00 0.00 -0.37 0.00 0.00 57.07 56.74 3i02 s TYR 91 Cb -0.14 -1.62 -0.03 0.00 -0.40 0.00 0.00 41.96 39.76 3i02 s TYR 91 CO 0.01 0.45 0.01 0.00 -1.57 0.00 0.00 175.55 174.45 3i02 s ALA 93 N -0.99 -0.10 -0.13 0.00 0.00 0.04 -1.86 121.76 118.72 3i02 s ALA 93 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 51.96 51.83 3i02 s ALA 93 Cb -0.11 -0.03 -0.02 0.00 0.00 0.00 0.00 23.12 22.96 3i02 s ALA 93 CO 0.06 -0.06 1.19 0.50 0.00 0.00 0.00 175.76 177.45 3i02 s ARG 94 N -0.32 4.29 0.00 0.00 3.52 0.03 -0.96 118.95 125.51 3i02 s ARG 94 Ca -0.04 1.60 0.00 0.00 -0.13 0.00 0.00 55.73 57.16 3i02 s ARG 94 Cb -0.02 -3.65 0.00 0.00 -1.56 0.00 0.00 34.95 29.71 3i02 s ARG 94 CO 0.00 -0.57 0.00 -3.47 -0.81 0.00 0.00 175.30 170.45 3i02 n ASP 95 N 5.93 0.00 -4.77 -2.12 2.03 0.23 -0.13 116.55 117.72 3i02 n ASP 95 Ca 0.12 0.00 -0.38 0.00 0.52 0.00 0.00 54.79 55.05 3i02 n ASP 95 Cb 0.46 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.82 3i02 n ASP 95 CO 0.00 0.00 0.00 -0.32 -1.92 0.00 0.00 177.20 174.96 3i02 s MET 96 N 4.18 4.21 -0.07 -0.67 0.00 -1.25 -4.55 119.30 121.15 3i02 s MET 96 Ca 0.00 1.67 -0.11 0.00 0.00 0.00 0.00 55.69 57.25 3i02 s MET 96 Cb 0.00 -2.70 -0.04 0.00 0.00 0.00 0.00 34.83 32.10 3i02 s MET 96 CO 0.00 -0.14 -0.21 -2.13 0.00 0.00 0.00 175.02 172.54 3i02 n ARG 97 N 0.19 0.31 -4.48 4.11 0.63 -1.26 -0.54 116.66 115.63 3i02 n ARG 97 Ca 0.04 0.12 -0.29 0.00 -0.92 0.00 0.00 57.85 56.80 3i02 n ARG 97 Cb 0.48 -1.04 -0.17 0.00 0.45 0.00 0.00 32.46 32.18 3i02 n ARG 97 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 3i02 s ARG 98 N -2.50 2.26 0.00 -0.14 0.52 -1.26 -4.92 118.95 112.90 3i02 s ARG 98 Ca -0.17 -0.58 0.00 0.00 -0.52 0.00 0.00 55.73 54.46 3i02 s ARG 98 Cb 0.02 -1.91 0.00 0.00 0.52 0.00 0.00 34.95 33.58 3i02 s ARG 98 CO 0.25 -0.06 0.00 0.34 0.02 0.00 0.00 175.30 175.86 3i02 n PHE 99 N 4.18 0.00 0.00 -0.53 7.35 -1.26 -1.16 117.46 126.03 3i02 n PHE 99 Ca -0.19 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.50 3i02 n PHE 99 Cb 0.51 -0.11 0.00 0.00 0.35 0.00 0.00 39.48 40.23 3i02 n PHE 99 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 3i02 n ASP 100 N 1.24 0.00 0.00 -2.13 8.00 -1.26 -4.81 116.55 117.59 3i02 n ASP 100 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 3i02 n ASP 100 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 3i02 n ASP 100 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3i02 n GLY 100 N 0.00 -1.70 0.00 0.44 0.00 -0.31 -4.95 105.19 98.67 3i02 n GLY 100 Ca 0.00 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.48 3i02 n GLY 100 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3i02 n ASP 100 N -1.66 0.00 -4.97 1.61 2.03 -1.26 -4.08 116.55 108.21 3i02 n ASP 100 Ca 0.00 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 55.09 3i02 n ASP 100 Cb 0.00 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 40.42 3i02 n ASP 100 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3i02 s ALA 100 N 0.00 4.52 -0.70 -1.67 0.00 -1.26 -4.56 121.76 118.09 3i02 s ALA 100 Ca 0.00 -1.79 -0.22 0.00 0.00 0.00 0.00 51.96 49.95 3i02 s ALA 100 Cb 0.00 -1.19 0.08 0.00 0.00 0.00 0.00 23.12 22.01 3i02 s ALA 100 CO 0.00 -0.59 0.97 -1.64 0.00 0.00 0.00 175.76 174.51 3i02 s MET 100 N -4.44 3.19 0.04 0.00 -1.94 -1.26 -3.95 119.30 110.93 3i02 s MET 100 Ca 0.51 -1.03 -0.25 0.00 -1.71 0.00 0.00 55.69 53.20 3i02 s MET 100 Cb -0.05 -4.36 -0.17 0.00 2.01 0.00 0.00 34.83 32.26 3i02 s MET 100 CO 0.31 -1.79 1.48 0.22 -0.01 0.00 0.00 175.02 175.23 3i02 h ASP 101 N 9.42 -0.19 -4.13 3.03 1.82 -0.79 -3.45 116.42 122.14 3i02 h ASP 101 Ca -0.21 -0.15 -0.41 0.00 -0.39 0.00 0.00 57.03 55.87 3i02 h ASP 101 Cb 1.06 0.05 -0.28 0.00 0.68 0.00 0.00 39.33 40.84 3i02 h ASP 101 CO 1.17 0.05 -0.78 -0.31 -1.61 0.00 0.00 179.24 177.75 3i02 s TYR 102 N -5.33 0.91 0.15 0.28 2.02 -1.25 -4.97 117.35 109.16 3i02 s TYR 102 Ca -0.15 -0.21 0.11 0.00 -0.37 0.00 0.00 57.07 56.45 3i02 s TYR 102 Cb 0.04 -0.58 -0.04 0.00 -0.40 0.00 0.00 41.96 40.98 3i02 s TYR 102 CO 0.63 -0.01 -0.23 -1.58 -1.57 0.00 0.00 175.55 172.79 3i02 s TRP 103 N -0.36 2.37 0.87 2.71 0.52 -1.26 -0.79 118.94 123.00 3i02 s TRP 103 Ca 0.03 -0.34 -0.13 0.00 0.02 0.00 0.00 56.10 55.68 3i02 s TRP 103 Cb -0.05 -1.23 0.20 0.00 -1.15 0.00 0.00 33.47 31.24 3i02 s TRP 103 CO -0.00 0.42 1.18 0.41 0.02 0.00 0.00 176.95 178.98 3i02 n GLY 104 N 0.60 -1.15 0.23 0.98 0.00 -0.77 -4.76 105.19 100.33 3i02 n GLY 104 Ca -0.15 -1.76 0.13 0.00 0.00 0.00 0.00 46.02 44.24 3i02 n GLY 104 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3i02 h GLN 105 N 0.00 0.00 0.00 1.61 1.08 -1.92 -3.46 115.11 112.42 3i02 h GLN 105 Ca -0.38 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.82 3i02 h GLN 105 Cb 1.10 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.53 3i02 h GLN 105 CO 0.29 0.02 0.00 0.41 -0.95 0.00 0.00 178.83 178.60 3i02 n GLY 106 N 0.78 0.83 3.03 3.46 0.00 -1.26 -5.02 105.19 107.01 3i02 n GLY 106 Ca 0.03 -1.69 -0.20 0.00 0.00 0.00 0.00 46.02 44.16 3i02 n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3i02 s THR 107 N -2.77 0.84 -0.11 2.61 -1.32 -0.62 -4.76 115.64 109.51 3i02 s THR 107 Ca 0.00 -0.42 -0.14 0.00 -1.21 0.00 0.00 61.69 59.92 3i02 s THR 107 Cb 0.00 -0.72 -0.05 0.00 -1.51 0.00 0.00 72.50 70.22 3i02 s THR 107 CO 0.00 0.25 0.35 -0.22 -2.21 0.00 0.00 174.62 172.79 3i02 s LEU 108 N -0.01 4.31 -0.13 9.08 2.96 -1.26 -0.64 118.68 133.00 3i02 s LEU 108 Ca 0.00 0.67 0.00 0.00 -0.22 0.00 0.00 54.13 54.58 3i02 s LEU 108 Cb -0.07 -2.47 -0.01 0.00 0.50 0.00 0.00 46.19 44.14 3i02 s LEU 108 CO 0.00 0.15 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.36 3i02 s VAL 109 N 0.06 3.04 -0.26 1.68 1.01 0.73 -1.47 120.40 125.18 3i02 s VAL 109 Ca 0.20 -0.67 0.03 0.00 0.00 0.00 0.00 61.98 61.54 3i02 s VAL 109 Cb -0.14 -2.27 0.07 0.00 0.00 0.00 0.00 36.38 34.03 3i02 s VAL 109 CO 0.07 0.53 -0.08 -0.89 0.00 0.00 0.00 175.10 174.73 3i02 s THR 110 N 0.32 2.04 -0.47 3.92 2.01 -0.61 -0.88 115.64 121.97 3i02 s THR 110 Ca -0.11 -1.64 -0.26 0.00 0.31 0.00 0.00 61.69 60.00 3i02 s THR 110 Cb -0.16 -2.23 0.03 0.00 0.01 0.00 0.00 72.50 70.15 3i02 s THR 110 CO 0.06 -0.12 0.97 -0.69 -0.69 0.00 0.00 174.62 174.15 3i02 s VAL 111 N 1.14 4.42 -0.02 3.82 1.01 -1.25 -0.68 120.40 128.83 3i02 s VAL 111 Ca -0.06 0.83 -0.30 0.00 0.00 0.00 0.00 61.98 62.45 3i02 s VAL 111 Cb -0.20 -4.47 0.07 0.00 0.00 0.00 0.00 36.38 31.79 3i02 s VAL 111 CO -0.06 -0.88 0.69 -0.55 0.00 0.00 0.00 175.10 174.30 3i02 s SER 112 N 2.32 -0.62 0.13 3.32 0.15 -0.16 -4.57 113.70 114.26 3i02 s SER 112 Ca 0.39 0.56 0.18 0.00 0.70 0.00 0.00 55.95 57.78 3i02 s SER 112 Cb -0.10 0.53 -0.07 0.00 -1.71 0.00 0.00 66.02 64.68 3i02 s SER 112 CO 0.27 -0.65 0.97 0.00 1.20 0.00 0.00 173.24 175.03 3i02 h ALA 113 N 2.78 0.63 -2.78 5.45 0.00 -1.94 -3.28 119.26 120.12 3i02 h ALA 113 Ca -0.28 -0.61 -0.56 0.00 0.00 0.00 0.00 54.91 53.47 3i02 h ALA 113 Cb 1.17 0.17 0.17 0.00 0.00 0.00 0.00 17.79 19.30 3i02 h ALA 113 CO 0.38 0.68 0.12 0.00 0.00 0.00 0.00 179.25 180.43 3i02 n ALA 114 N -2.32 -0.02 -2.41 0.00 0.00 -1.26 -4.96 120.51 109.54 3i02 n ALA 114 Ca -0.06 -0.10 -0.35 0.00 0.00 0.00 0.00 53.44 52.94 3i02 n ALA 114 Cb 0.76 -2.12 -0.06 0.00 0.00 0.00 0.00 19.45 18.04 3i02 n ALA 114 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 3i02 s LYS 115 N -3.07 3.91 0.19 0.00 2.47 -1.26 -5.01 119.74 116.96 3i02 s LYS 115 Ca 0.75 0.39 -0.32 0.00 -1.56 0.00 0.00 55.97 55.23 3i02 s LYS 115 Cb -0.38 -2.89 -0.11 0.00 -1.46 0.00 0.00 37.83 32.98 3i02 s LYS 115 CO 0.48 0.47 1.68 0.99 0.16 0.00 0.00 175.35 179.13 3i02 s THR 116 N -1.51 2.20 -0.04 3.43 2.01 -1.26 -4.76 115.64 115.70 3i02 s THR 116 Ca 0.39 0.14 0.02 0.00 0.31 0.00 0.00 61.69 62.54 3i02 s THR 116 Cb -0.14 -3.09 0.01 0.00 0.01 0.00 0.00 72.50 69.29 3i02 s THR 116 CO 0.19 0.01 -0.07 -0.89 -0.69 0.00 0.00 174.62 173.17 3i02 s THR 117 N 1.18 0.67 0.74 -0.82 2.01 0.07 -4.95 115.64 114.54 3i02 s THR 117 Ca 0.73 -0.25 -0.11 0.00 0.31 0.00 0.00 61.69 62.38 3i02 s THR 117 Cb -0.48 -0.64 0.03 0.00 0.01 0.00 0.00 72.50 71.42 3i02 s THR 117 CO 0.32 0.24 1.07 -2.84 -0.69 0.00 0.00 174.62 172.72 3i02 s PRO 118 N 0.55 2.57 0.20 4.92 0.02 -1.26 -1.24 135.00 140.75 3i02 s PRO 118 Ca -0.08 0.90 -0.07 0.00 0.02 0.00 0.00 61.00 61.77 3i02 s PRO 118 Cb -0.12 -1.95 -0.06 0.00 0.02 0.00 0.00 34.50 32.39 3i02 s PRO 118 CO 0.01 -1.35 0.47 -2.14 -0.33 0.00 0.00 177.00 173.66 3i02 s PRO 119 N -5.05 3.69 -0.14 5.54 0.02 -1.26 -2.04 135.00 135.75 3i02 s PRO 119 Ca 0.59 0.06 -0.16 0.00 0.02 0.00 0.00 61.00 61.52 3i02 s PRO 119 Cb -0.15 -2.74 -0.04 0.00 0.02 0.00 0.00 34.50 31.59 3i02 s PRO 119 CO 0.55 0.37 0.37 -1.12 -0.33 0.00 0.00 177.00 176.83 3i02 s SER 120 N -2.54 6.54 -0.27 2.53 0.01 -0.83 -4.94 113.70 114.21 3i02 s SER 120 Ca 0.44 0.63 -0.08 0.00 1.31 0.00 0.00 55.95 58.25 3i02 s SER 120 Cb -0.11 -2.22 -0.02 0.00 0.21 0.00 0.00 66.02 63.87 3i02 s SER 120 CO 0.24 0.06 0.10 -0.69 0.41 0.00 0.00 173.24 173.36 3i02 s VAL 121 N 0.52 4.41 -0.16 3.43 1.01 -1.26 -1.34 120.40 127.01 3i02 s VAL 121 Ca 0.20 -0.24 -0.01 0.00 0.00 0.00 0.00 61.98 61.93 3i02 s VAL 121 Cb -0.14 -3.12 -0.01 0.00 0.00 0.00 0.00 36.38 33.11 3i02 s VAL 121 CO 0.06 0.26 -0.11 -0.31 0.00 0.00 0.00 175.10 175.00 3i02 s TYR 122 N 1.62 2.85 0.21 5.22 2.02 0.82 -4.97 117.35 125.13 3i02 s TYR 122 Ca 0.06 -0.82 -0.30 0.00 -0.37 0.00 0.00 57.07 55.64 3i02 s TYR 122 Cb -0.16 -1.93 -0.08 0.00 -0.40 0.00 0.00 41.96 39.39 3i02 s TYR 122 CO 0.05 -0.37 1.15 -1.25 -1.57 0.00 0.00 175.55 173.56 3i02 s PRO 123 N 0.77 4.55 -0.45 -1.71 0.04 -1.26 -0.23 135.00 136.70 3i02 s PRO 123 Ca -0.05 1.83 -0.02 0.00 0.04 0.00 0.00 61.00 62.80 3i02 s PRO 123 Cb -0.15 -3.23 0.12 0.00 0.04 0.00 0.00 34.50 31.28 3i02 s PRO 123 CO 0.01 0.02 0.24 -0.51 0.04 0.00 0.00 177.00 176.80 3i02 s LEU 124 N -0.60 5.16 0.15 -3.56 1.43 0.08 -4.89 118.68 116.46 3i02 s LEU 124 Ca 0.50 -2.26 0.04 0.00 -1.03 0.00 0.00 54.13 51.37 3i02 s LEU 124 Cb -0.32 -1.81 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 3i02 s LEU 124 CO 0.38 -0.48 0.20 0.00 0.23 0.00 0.00 176.35 176.68 3i02 s ALA 125 N 0.80 3.76 1.07 4.21 0.00 -1.26 -2.27 121.76 128.06 3i02 s ALA 125 Ca 0.11 -1.12 -0.12 0.00 0.00 0.00 0.00 51.96 50.83 3i02 s ALA 125 Cb -0.22 -1.56 0.23 0.00 0.00 0.00 0.00 23.12 21.57 3i02 s ALA 125 CO -0.04 0.54 1.07 -2.14 0.00 0.00 0.00 175.76 175.19 3i02 s PRO 126 N -3.12 -0.21 0.35 0.00 0.02 -1.26 -5.06 135.00 125.72 3i02 s PRO 126 Ca 0.33 1.13 0.19 0.00 0.02 0.00 0.00 61.00 62.67 3i02 s PRO 126 Cb -0.11 -1.61 0.19 0.00 0.02 0.00 0.00 34.50 32.99 3i02 s PRO 126 CO 0.26 -3.33 1.49 0.78 -0.33 0.00 0.00 177.00 175.86 3i02 h GLY 127 N -2.36 0.00 0.00 0.52 0.00 -1.99 -3.43 103.07 95.81 3i02 h GLY 127 Ca -0.54 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.79 3i02 h GLY 127 CO 0.47 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.71 3i02 n THR 132 N -3.13 0.00 -2.76 4.70 -2.24 -1.26 -4.85 114.28 104.74 3i02 n THR 132 Ca 0.03 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.72 3i02 n THR 132 Cb 0.63 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.91 3i02 n THR 132 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3i02 n ASN 133 N 0.00 -2.85 0.00 3.42 5.15 -1.26 -4.99 115.26 114.73 3i02 n ASN 133 Ca 0.00 -3.30 0.00 0.00 -0.60 0.00 0.00 54.58 50.68 3i02 n ASN 133 Cb 0.00 1.80 0.00 0.00 -0.53 0.00 0.00 39.78 41.05 3i02 n ASN 133 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 3i02 n SER 134 N 1.64 -0.95 -3.22 1.20 3.41 -1.26 -4.76 113.62 109.69 3i02 n SER 134 Ca 0.09 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.74 3i02 n SER 134 Cb 0.63 -2.28 -0.02 0.00 -0.26 0.00 0.00 64.21 62.28 3i02 n SER 134 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 3i02 s MET 135 N -1.00 0.48 -0.08 4.33 0.00 -1.26 -2.92 119.30 118.85 3i02 s MET 135 Ca 0.00 0.91 0.00 0.00 0.00 0.00 0.00 55.69 56.61 3i02 s MET 135 Cb 0.00 0.52 -0.03 0.00 0.00 0.00 0.00 34.83 35.32 3i02 s MET 135 CO 0.00 -0.47 -0.07 0.54 0.00 0.00 0.00 175.02 175.02 3i02 s VAL 136 N 2.86 3.67 -0.14 10.11 0.11 0.19 -4.62 120.40 132.58 3i02 s VAL 136 Ca 0.13 -0.48 -0.04 0.00 -2.93 0.00 0.00 61.98 58.65 3i02 s VAL 136 Cb -0.13 -2.51 -0.03 0.00 -1.53 0.00 0.00 36.38 32.17 3i02 s VAL 136 CO -0.19 0.58 -0.00 -0.89 -3.33 0.00 0.00 175.10 171.28 3i02 s THR 137 N -0.62 4.25 0.46 5.04 2.01 -1.26 -0.88 115.64 124.64 3i02 s THR 137 Ca 0.09 -0.24 0.03 0.00 0.31 0.00 0.00 61.69 61.88 3i02 s THR 137 Cb -0.12 -2.85 -0.03 0.00 0.01 0.00 0.00 72.50 69.52 3i02 s THR 137 CO 0.02 0.52 0.04 -0.76 -0.69 0.00 0.00 174.62 173.75 3i02 s LEU 138 N -0.03 2.25 0.20 4.42 1.43 0.62 -4.66 118.68 122.92 3i02 s LEU 138 Ca 0.03 -1.62 -0.23 0.00 -1.03 0.00 0.00 54.13 51.29 3i02 s LEU 138 Cb -0.13 -0.54 0.06 0.00 0.03 0.00 0.00 46.19 45.62 3i02 s LEU 138 CO 0.02 -0.82 0.94 -0.83 0.23 0.00 0.00 176.35 175.88 3i02 s GLY 139 N -3.76 -0.05 -0.03 -3.19 0.00 -0.96 -1.48 107.32 97.84 3i02 s GLY 139 Ca 0.16 -0.15 0.01 0.00 0.00 0.00 0.00 44.72 44.74 3i02 s GLY 139 CO 0.09 0.59 -0.01 0.00 0.00 0.00 0.00 173.10 173.76 3i02 s LEU 141 N 1.00 4.15 -0.42 0.00 2.96 0.68 -1.75 118.68 125.29 3i02 s LEU 141 Ca -0.10 -0.01 -0.07 0.00 -0.22 0.00 0.00 54.13 53.73 3i02 s LEU 141 Cb -0.14 -2.24 0.10 0.00 0.50 0.00 0.00 46.19 44.41 3i02 s LEU 141 CO -0.01 -0.16 0.25 -0.69 -1.32 0.00 0.00 176.35 174.42 3i02 s VAL 142 N 1.88 3.86 -0.16 1.68 1.01 0.31 -0.12 120.40 128.86 3i02 s VAL 142 Ca 0.10 -1.72 -0.07 0.00 0.00 0.00 0.00 61.98 60.29 3i02 s VAL 142 Cb -0.16 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 3i02 s VAL 142 CO 0.11 -0.62 0.10 -0.75 0.00 0.00 0.00 175.10 173.94 3i02 s LYS 143 N 1.31 3.76 0.36 2.72 2.20 -0.45 -1.31 119.74 128.33 3i02 s LYS 143 Ca 0.05 -0.24 -0.26 0.00 -0.36 0.00 0.00 55.97 55.16 3i02 s LYS 143 Cb -0.24 -3.23 -0.12 0.00 -1.51 0.00 0.00 37.83 32.73 3i02 s LYS 143 CO -0.01 0.50 0.97 0.41 -0.36 0.00 0.00 175.35 176.85 3i02 n GLY 144 N 2.86 -0.35 0.52 5.54 0.00 0.32 -1.97 105.19 112.11 3i02 n GLY 144 Ca -0.18 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3i02 n GLY 144 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3i02 n TYR 145 N -0.19 0.00 -3.61 1.61 -0.00 -0.87 -4.71 117.16 109.39 3i02 n TYR 145 Ca 0.10 0.00 -0.12 0.00 -0.00 0.00 0.00 57.90 57.88 3i02 n TYR 145 Cb 0.36 -1.24 -0.07 0.00 -0.00 0.00 0.00 39.34 38.39 3i02 n TYR 145 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 176.86 176.98 3i02 s PHE 146 N 0.00 -0.56 0.00 2.98 5.36 -0.37 -0.68 117.98 124.71 3i02 s PHE 146 Ca 0.00 1.26 0.00 0.00 -0.96 0.00 0.00 56.93 57.23 3i02 s PHE 146 Cb 0.00 0.36 0.00 0.00 -0.34 0.00 0.00 43.02 43.04 3i02 s PHE 146 CO 0.00 -0.34 0.00 -0.35 -1.46 0.00 0.00 175.22 173.07 3i02 n PRO 147 N 1.91 1.74 -1.86 10.12 -0.04 -1.26 -0.75 135.00 144.86 3i02 n PRO 147 Ca -0.13 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.01 3i02 n PRO 147 Cb 0.56 0.00 0.03 0.00 -0.04 0.00 0.00 33.50 34.05 3i02 n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3i02 s GLU 148 N 0.42 3.16 0.43 0.54 0.41 -1.26 -4.69 118.70 117.72 3i02 s GLU 148 Ca 0.00 1.11 0.07 0.00 -0.41 0.00 0.00 54.97 55.74 3i02 s GLU 148 Cb 0.00 -2.02 -0.02 0.00 -1.78 0.00 0.00 34.13 30.31 3i02 s GLU 148 CO 0.00 -0.93 0.33 -1.25 -0.49 0.00 0.00 175.26 172.92 3i02 s PRO 149 N -4.44 2.41 0.07 0.39 0.05 -1.26 -4.87 135.00 127.36 3i02 s PRO 149 Ca 0.61 -1.68 0.05 0.00 0.05 0.00 0.00 61.00 60.03 3i02 s PRO 149 Cb -0.15 -2.24 -0.04 0.00 0.05 0.00 0.00 34.50 32.12 3i02 s PRO 149 CO 0.44 -0.23 -0.03 0.14 0.05 0.00 0.00 177.00 177.37 3i02 s VAL 150 N -2.54 3.88 -0.14 -0.36 -7.23 -1.26 -4.45 120.40 108.29 3i02 s VAL 150 Ca 0.45 -0.97 -0.05 0.00 -1.81 0.00 0.00 61.98 59.60 3i02 s VAL 150 Cb -0.01 -2.81 -0.04 0.00 0.56 0.00 0.00 36.38 34.08 3i02 s VAL 150 CO 0.26 0.18 0.05 0.42 -0.31 0.00 0.00 175.10 175.70 3i02 s THR 151 N -1.23 4.74 -0.11 5.32 -4.23 0.17 -4.91 115.64 115.39 3i02 s THR 151 Ca 0.23 -0.07 0.02 0.00 -1.18 0.00 0.00 61.69 60.70 3i02 s THR 151 Cb -0.11 -3.08 0.01 0.00 1.34 0.00 0.00 72.50 70.66 3i02 s THR 151 CO 0.15 0.54 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.91 3i02 s VAL 152 N -0.29 1.64 0.24 2.29 1.01 -1.26 -0.02 120.40 124.01 3i02 s VAL 152 Ca 0.08 -0.74 0.05 0.00 0.00 0.00 0.00 61.98 61.37 3i02 s VAL 152 Cb -0.12 -1.47 -0.05 0.00 0.00 0.00 0.00 36.38 34.73 3i02 s VAL 152 CO 0.02 0.47 -0.04 0.42 0.00 0.00 0.00 175.10 175.96 3i02 s THR 153 N 0.84 1.32 -0.07 3.92 -4.23 -0.81 -4.97 115.64 111.65 3i02 s THR 153 Ca -0.09 -2.08 0.05 0.00 -1.18 0.00 0.00 61.69 58.39 3i02 s THR 153 Cb -0.15 -2.33 -0.01 0.00 1.34 0.00 0.00 72.50 71.35 3i02 s THR 153 CO 0.00 -0.37 -0.22 0.26 -0.54 0.00 0.00 174.62 173.75 3i02 s TRP 154 N -3.23 2.53 -1.54 3.99 0.52 -1.26 0.20 118.94 120.15 3i02 s TRP 154 Ca 0.27 -0.73 -0.04 0.00 0.02 0.00 0.00 56.10 55.62 3i02 s TRP 154 Cb 0.04 -1.65 0.04 0.00 -1.15 0.00 0.00 33.47 30.75 3i02 s TRP 154 CO 0.09 -0.22 0.31 0.09 0.02 0.00 0.00 176.95 177.24 3i02 n ASN 155 N 3.07 -0.31 -0.17 2.95 5.03 0.56 -1.18 115.26 125.21 3i02 n ASN 155 Ca -0.18 -1.14 -0.02 0.00 0.87 0.00 0.00 54.58 54.11 3i02 n ASN 155 Cb 0.52 -2.31 -0.01 0.00 -1.02 0.00 0.00 39.78 36.97 3i02 n ASN 155 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 3i02 n SER 156 N -2.86 -4.20 0.00 6.41 7.64 -1.26 -2.68 113.62 116.67 3i02 n SER 156 Ca -0.23 0.05 0.00 0.00 1.01 0.00 0.00 58.87 59.70 3i02 n SER 156 Cb 0.65 -1.90 0.00 0.00 -1.01 0.00 0.00 64.21 61.95 3i02 n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3i02 n GLY 157 N -1.48 1.03 0.25 0.23 0.00 -0.33 -4.93 105.19 99.96 3i02 n GLY 157 Ca -0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.12 3i02 n GLY 157 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3i02 h SER 158 N 0.00 0.00 -3.14 1.61 4.64 -1.48 -3.33 113.55 111.85 3i02 h SER 158 Ca 0.00 0.00 -0.74 0.00 -0.47 0.00 0.00 61.79 60.58 3i02 h SER 158 Cb 0.00 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 61.87 3i02 h SER 158 CO 0.00 0.17 0.16 -0.76 -0.87 0.00 0.00 176.83 175.52 3i02 s LEU 159 N -6.95 5.90 -0.05 5.97 1.43 -0.99 -4.79 118.68 119.19 3i02 s LEU 159 Ca -0.01 -1.98 -0.01 0.00 -1.03 0.00 0.00 54.13 51.11 3i02 s LEU 159 Cb 0.11 -2.27 -0.03 0.00 0.03 0.00 0.00 46.19 44.03 3i02 s LEU 159 CO 0.60 -0.90 -0.05 -1.54 0.23 0.00 0.00 176.35 174.69 3i02 n SER 160 N 5.45 2.44 -4.77 2.29 3.41 -1.25 -4.12 113.62 117.07 3i02 n SER 160 Ca 0.02 0.01 -0.37 0.00 -0.26 0.00 0.00 58.87 58.27 3i02 n SER 160 Cb 0.44 -0.11 -0.00 0.00 -0.26 0.00 0.00 64.21 64.28 3i02 n SER 160 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3i02 s SER 161 N -4.85 6.01 0.00 4.04 0.01 -1.26 -2.75 113.70 114.90 3i02 s SER 161 Ca -0.07 2.30 0.00 0.00 1.31 0.00 0.00 55.95 59.49 3i02 s SER 161 Cb 0.02 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.65 3i02 s SER 161 CO 0.11 -1.03 0.00 0.61 0.41 0.00 0.00 173.24 173.34 3i02 n GLY 162 N 0.39 0.47 3.55 3.44 0.00 -1.26 -4.82 105.19 106.96 3i02 n GLY 162 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 3i02 n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i02 s VAL 163 N -2.18 5.02 -0.20 1.61 1.01 -1.11 -1.46 120.40 123.08 3i02 s VAL 163 Ca 0.00 0.06 -0.02 0.00 0.00 0.00 0.00 61.98 62.02 3i02 s VAL 163 Cb 0.00 -3.38 -0.00 0.00 0.00 0.00 0.00 36.38 32.99 3i02 s VAL 163 CO 0.00 0.27 -0.09 -1.00 0.00 0.00 0.00 175.10 174.28 3i02 s HIS 164 N 1.72 2.90 -0.14 5.22 3.76 0.62 -4.97 115.29 124.40 3i02 s HIS 164 Ca 0.07 -1.03 -0.00 0.00 -0.15 0.00 0.00 55.06 53.94 3i02 s HIS 164 Cb -0.16 -2.02 -0.01 0.00 1.11 0.00 0.00 32.58 31.50 3i02 s HIS 164 CO 0.09 -0.55 -0.13 0.99 -0.85 0.00 0.00 174.74 174.29 3i02 s THR 165 N 1.25 3.00 -0.13 1.30 2.01 -1.26 0.02 115.64 121.84 3i02 s THR 165 Ca 0.03 -0.67 -0.13 0.00 0.31 0.00 0.00 61.69 61.23 3i02 s THR 165 Cb -0.14 -2.27 -0.05 0.00 0.01 0.00 0.00 72.50 70.06 3i02 s THR 165 CO -0.04 0.52 0.29 -0.36 -0.69 0.00 0.00 174.62 174.34 3i02 s PHE 166 N 0.49 3.53 0.47 4.92 0.08 -0.18 -5.01 117.98 122.28 3i02 s PHE 166 Ca -0.09 0.65 -0.21 0.00 0.12 0.00 0.00 56.93 57.40 3i02 s PHE 166 Cb -0.16 -2.27 -0.10 0.00 -0.57 0.00 0.00 43.02 39.92 3i02 s PHE 166 CO 0.04 0.39 0.73 -2.30 -0.10 0.00 0.00 175.22 173.98 3i02 n PRO 167 N 3.01 0.83 -2.56 0.24 -0.02 -1.26 -4.18 135.00 131.05 3i02 n PRO 167 Ca -0.14 0.31 -0.41 0.00 -2.02 0.00 0.00 63.50 61.24 3i02 n PRO 167 Cb 0.52 -1.79 -0.04 0.00 -0.02 0.00 0.00 33.50 32.18 3i02 n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3i02 s ALA 168 N -1.47 3.35 -0.12 3.55 0.00 -1.26 -4.80 121.76 121.01 3i02 s ALA 168 Ca 0.66 0.77 -0.02 0.00 0.00 0.00 0.00 51.96 53.37 3i02 s ALA 168 Cb -0.53 -3.33 -0.03 0.00 0.00 0.00 0.00 23.12 19.23 3i02 s ALA 168 CO 0.56 -0.16 -0.03 0.08 0.00 0.00 0.00 175.76 176.21 3i02 s VAL 169 N -0.28 3.99 0.38 0.00 1.01 -0.65 -4.89 120.40 119.95 3i02 s VAL 169 Ca 0.48 -0.35 -0.24 0.00 0.00 0.00 0.00 61.98 61.88 3i02 s VAL 169 Cb -0.28 -2.70 -0.10 0.00 0.00 0.00 0.00 36.38 33.29 3i02 s VAL 169 CO 0.34 0.55 0.96 -0.22 0.00 0.00 0.00 175.10 176.72 3i02 s LEU 170 N -0.25 4.14 -0.42 3.92 2.96 -1.26 -1.41 118.68 126.36 3i02 s LEU 170 Ca 0.05 1.79 0.05 0.00 -0.22 0.00 0.00 54.13 55.79 3i02 s LEU 170 Cb -0.13 -4.27 0.17 0.00 0.50 0.00 0.00 46.19 42.46 3i02 s LEU 170 CO 0.02 -0.24 0.47 -1.58 -1.32 0.00 0.00 176.35 173.71 3i02 s GLN 171 N -2.61 0.82 -1.13 1.98 2.00 0.41 -4.94 119.66 116.20 3i02 s GLN 171 Ca 0.56 -1.15 -0.04 0.00 -2.00 0.00 0.00 55.36 52.73 3i02 s GLN 171 Cb -0.15 -0.65 -0.03 0.00 0.80 0.00 0.00 33.01 32.98 3i02 s GLN 171 CO 0.19 -1.27 0.93 0.45 -0.50 0.00 0.00 175.29 175.09 3i02 n SER 172 N 3.62 -4.29 -0.57 6.67 2.88 -1.26 -2.63 113.62 118.04 3i02 n SER 172 Ca 0.17 -0.69 -0.07 0.00 -1.33 0.00 0.00 58.87 56.94 3i02 n SER 172 Cb 0.49 -5.02 -0.03 0.00 -0.75 0.00 0.00 64.21 58.90 3i02 n SER 172 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 3i02 n ASP 173 N -3.15 -4.19 -3.75 -3.46 8.00 -1.26 -5.00 116.55 103.73 3i02 n ASP 173 Ca -0.18 0.18 -0.21 0.00 0.71 0.00 0.00 54.79 55.29 3i02 n ASP 173 Cb 0.64 -2.35 -0.17 0.00 -0.02 0.00 0.00 41.12 39.22 3i02 n ASP 173 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3i02 s LEU 174 N -1.70 0.56 0.33 0.64 1.43 -1.08 -4.75 118.68 114.11 3i02 s LEU 174 Ca 0.00 -0.04 -0.21 0.00 -1.03 0.00 0.00 54.13 52.85 3i02 s LEU 174 Cb 0.00 -0.34 -0.10 0.00 0.03 0.00 0.00 46.19 45.78 3i02 s LEU 174 CO 0.00 -0.19 0.86 -0.31 0.23 0.00 0.00 176.35 176.93 3i02 s TYR 175 N 1.89 3.53 -0.03 0.29 2.02 0.15 -0.44 117.35 124.75 3i02 s TYR 175 Ca 0.03 1.55 0.03 0.00 -0.37 0.00 0.00 57.07 58.31 3i02 s TYR 175 Cb -0.12 -2.76 0.00 0.00 -0.40 0.00 0.00 41.96 38.67 3i02 s TYR 175 CO -0.04 0.14 -0.12 0.99 -1.57 0.00 0.00 175.55 174.95 3i02 s THR 176 N -1.80 0.99 0.10 -0.71 2.01 -0.50 0.12 115.64 115.85 3i02 s THR 176 Ca 0.52 -0.47 0.00 0.00 0.31 0.00 0.00 61.69 62.05 3i02 s THR 176 Cb -0.14 -0.87 -0.04 0.00 0.01 0.00 0.00 72.50 71.46 3i02 s THR 176 CO 0.19 0.30 -0.01 -1.48 -0.69 0.00 0.00 174.62 172.93 3i02 s LEU 177 N 0.17 2.27 0.13 4.42 0.05 -0.43 -1.64 118.68 123.65 3i02 s LEU 177 Ca -0.04 -1.08 0.03 0.00 0.05 0.00 0.00 54.13 53.10 3i02 s LEU 177 Cb -0.10 0.11 -0.04 0.00 -2.05 0.00 0.00 46.19 44.11 3i02 s LEU 177 CO 0.01 -0.59 -0.08 -0.94 -0.55 0.00 0.00 176.35 174.20 3i02 s SER 178 N -3.02 1.51 0.07 1.48 1.04 -1.26 -0.53 113.70 112.98 3i02 s SER 178 Ca 0.15 -1.01 0.03 0.00 0.48 0.00 0.00 55.95 55.60 3i02 s SER 178 Cb 0.07 0.04 -0.03 0.00 0.10 0.00 0.00 66.02 66.20 3i02 s SER 178 CO -0.04 -0.39 -0.10 -0.55 0.98 0.00 0.00 173.24 173.14 3i02 s SER 179 N -3.12 1.20 0.00 7.02 0.15 -0.72 -1.01 113.70 117.23 3i02 s SER 179 Ca 0.15 -0.66 -0.00 0.00 0.70 0.00 0.00 55.95 56.14 3i02 s SER 179 Cb 0.04 0.02 -0.00 0.00 -1.71 0.00 0.00 66.02 64.36 3i02 s SER 179 CO -0.02 -0.21 -0.00 -0.94 1.20 0.00 0.00 173.24 173.27 3i02 s SER 180 N -1.93 0.04 -0.03 5.45 1.04 0.10 -1.49 113.70 116.88 3i02 s SER 180 Ca -0.03 -0.09 0.04 0.00 0.48 0.00 0.00 55.95 56.35 3i02 s SER 180 Cb -0.07 0.02 -0.00 0.00 0.10 0.00 0.00 66.02 66.07 3i02 s SER 180 CO 0.00 -0.06 -0.14 0.54 0.98 0.00 0.00 173.24 174.57 3i02 s VAL 181 N -0.27 1.16 -0.29 5.02 0.11 -0.55 -0.28 120.40 125.31 3i02 s VAL 181 Ca -0.03 -0.58 -0.04 0.00 -2.93 0.00 0.00 61.98 58.40 3i02 s VAL 181 Cb -0.02 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.86 3i02 s VAL 181 CO -0.00 0.34 0.02 -0.89 -3.33 0.00 0.00 175.10 171.24 3i02 s THR 182 N 0.02 3.36 0.23 5.04 2.01 -0.54 -0.28 115.64 125.48 3i02 s THR 182 Ca -0.02 -1.05 0.12 0.00 0.31 0.00 0.00 61.69 61.05 3i02 s THR 182 Cb -0.09 -2.81 -0.05 0.00 0.01 0.00 0.00 72.50 69.56 3i02 s THR 182 CO 0.01 0.02 -0.22 0.68 -0.69 0.00 0.00 174.62 174.42 3i02 s VAL 183 N 1.37 2.42 0.35 3.82 -7.23 -0.06 -4.76 120.40 116.29 3i02 s VAL 183 Ca -0.01 -2.18 -0.29 0.00 -1.81 0.00 0.00 61.98 57.69 3i02 s VAL 183 Cb -0.18 -2.20 -0.11 0.00 0.56 0.00 0.00 36.38 34.45 3i02 s VAL 183 CO -0.00 -0.23 1.50 -2.84 -0.31 0.00 0.00 175.10 173.21 3i02 s PRO 184 N -3.02 4.14 0.00 4.82 0.02 -1.26 0.56 135.00 140.25 3i02 s PRO 184 Ca 0.25 2.54 0.28 0.00 0.02 0.00 0.00 61.00 64.08 3i02 s PRO 184 Cb -0.07 -2.99 1.33 0.00 0.02 0.00 0.00 34.50 32.79 3i02 s PRO 184 CO 0.12 -0.53 1.94 -1.13 -0.33 0.00 0.00 177.00 177.07 3i02 n SER 185 N 0.98 0.00 0.00 2.53 3.41 -1.15 -1.28 113.62 118.11 3i02 n SER 185 Ca 0.03 0.12 0.10 0.00 -0.26 0.00 0.00 58.87 58.86 3i02 n SER 185 Cb 0.39 -0.37 0.57 0.00 -0.26 0.00 0.00 64.21 64.54 3i02 n SER 185 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3i02 n SER 186 N -1.37 0.00 -0.00 4.04 3.41 -1.26 -3.42 113.62 115.02 3i02 n SER 186 Ca 0.11 -0.37 0.01 0.00 -0.26 0.00 0.00 58.87 58.35 3i02 n SER 186 Cb 0.26 -0.12 -0.01 0.00 -0.26 0.00 0.00 64.21 64.08 3i02 n SER 186 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3i02 n THR 187 N -1.12 0.00 -4.70 6.66 -1.04 -0.40 -4.88 114.28 108.81 3i02 n THR 187 Ca 0.13 -0.03 -0.24 0.00 -2.04 0.00 0.00 64.05 61.86 3i02 n THR 187 Cb 0.11 0.43 -0.15 0.00 -1.82 0.00 0.00 70.33 68.90 3i02 n THR 187 CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 3i02 s TRP 188 N -2.10 1.57 -0.41 -1.42 -0.00 -1.19 -0.82 118.94 114.57 3i02 s TRP 188 Ca -0.01 -0.33 0.06 0.00 -0.00 0.00 0.00 56.10 55.83 3i02 s TRP 188 Cb 0.01 -0.98 0.47 0.00 -0.00 0.00 0.00 33.47 32.97 3i02 s TRP 188 CO 0.06 0.02 1.41 -0.35 -0.00 0.00 0.00 176.95 178.09 3i02 n PRO 189 N 2.29 2.68 -0.25 5.86 -0.04 -1.26 -4.78 135.00 139.50 3i02 n PRO 189 Ca -0.16 -1.92 -0.06 0.00 -0.04 0.00 0.00 63.50 61.32 3i02 n PRO 189 Cb 0.54 -1.87 0.07 0.00 -0.04 0.00 0.00 33.50 32.21 3i02 n PRO 189 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3i02 h SER 190 N 1.63 1.05 -3.11 3.54 4.64 -1.89 -3.41 113.55 116.00 3i02 h SER 190 Ca 0.18 -0.20 -0.64 0.00 -0.47 0.00 0.00 61.79 60.66 3i02 h SER 190 Cb 1.77 -0.27 -0.08 0.00 -0.31 0.00 0.00 62.40 63.50 3i02 h SER 190 CO 0.48 0.98 -0.58 -1.61 -0.87 0.00 0.00 176.83 175.24 3i02 s GLU 191 N -5.37 3.03 0.14 4.77 0.41 -0.00 -5.10 118.70 116.59 3i02 s GLU 191 Ca -0.12 -0.60 -0.28 0.00 -0.41 0.00 0.00 54.97 53.57 3i02 s GLU 191 Cb 0.15 -2.82 -0.07 0.00 -1.78 0.00 0.00 34.13 29.61 3i02 s GLU 191 CO 0.84 0.59 0.86 0.95 -0.49 0.00 0.00 175.26 178.01 3i02 s THR 192 N -1.38 4.42 -0.29 3.63 -4.23 -1.26 -4.58 115.64 111.95 3i02 s THR 192 Ca 0.29 1.88 0.01 0.00 -1.18 0.00 0.00 61.69 62.69 3i02 s THR 192 Cb -0.12 -4.23 0.06 0.00 1.34 0.00 0.00 72.50 69.55 3i02 s THR 192 CO 0.22 0.42 -0.05 -0.69 -0.54 0.00 0.00 174.62 173.99 3i02 s VAL 193 N -0.59 2.53 -0.02 2.29 1.01 -1.26 -4.96 120.40 119.40 3i02 s VAL 193 Ca 0.41 -1.60 0.06 0.00 0.00 0.00 0.00 61.98 60.85 3i02 s VAL 193 Cb -0.23 -2.51 -0.02 0.00 0.00 0.00 0.00 36.38 33.61 3i02 s VAL 193 CO 0.28 -0.12 -0.21 -0.89 0.00 0.00 0.00 175.10 174.16 3i02 s THR 194 N 1.15 2.46 -0.08 3.92 2.01 -1.26 -0.76 115.64 123.08 3i02 s THR 194 Ca -0.06 -0.99 -0.04 0.00 0.31 0.00 0.00 61.69 60.91 3i02 s THR 194 Cb -0.20 -1.91 -0.04 0.00 0.01 0.00 0.00 72.50 70.36 3i02 s THR 194 CO -0.04 0.56 0.11 0.00 -0.69 0.00 0.00 174.62 174.56 3i02 s ASN 196 N -1.23 5.20 -0.12 0.00 0.01 0.13 -0.93 114.94 118.00 3i02 s ASN 196 Ca 0.18 -2.00 -0.11 0.00 -0.71 0.00 0.00 52.86 50.21 3i02 s ASN 196 Cb -0.12 -1.81 -0.05 0.00 0.41 0.00 0.00 41.25 39.69 3i02 s ASN 196 CO 0.07 -0.52 0.25 -0.69 -1.51 0.00 0.00 177.10 174.70 3i02 s VAL 197 N 1.13 5.32 -0.07 1.60 1.01 -0.14 -1.92 120.40 127.33 3i02 s VAL 197 Ca 0.08 0.46 0.02 0.00 0.00 0.00 0.00 61.98 62.54 3i02 s VAL 197 Cb -0.22 -3.55 0.01 0.00 0.00 0.00 0.00 36.38 32.61 3i02 s VAL 197 CO -0.04 0.51 -0.14 0.00 0.00 0.00 0.00 175.10 175.43 3i02 s ALA 198 N -0.39 1.43 -0.51 5.51 0.00 0.98 -1.02 121.76 127.75 3i02 s ALA 198 Ca 0.17 -0.52 0.03 0.00 0.00 0.00 0.00 51.96 51.64 3i02 s ALA 198 Cb -0.13 -0.63 0.14 0.00 0.00 0.00 0.00 23.12 22.51 3i02 s ALA 198 CO 0.05 0.12 0.31 -1.58 0.00 0.00 0.00 175.76 174.66 3i02 s HIS 199 N 0.65 2.57 0.39 0.00 2.46 -0.27 0.41 115.29 121.50 3i02 s HIS 199 Ca -0.14 -2.82 0.12 0.00 0.47 0.00 0.00 55.06 52.69 3i02 s HIS 199 Cb -0.16 -2.24 0.92 0.00 -0.13 0.00 0.00 32.58 30.97 3i02 s HIS 199 CO 0.04 -0.73 1.89 -1.35 -2.47 0.00 0.00 174.74 172.13 3i02 h PRO 200 N 6.30 0.55 -0.24 2.88 0.11 -1.78 -1.65 132.00 138.18 3i02 h PRO 200 Ca 0.03 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.09 3i02 h PRO 200 Cb 0.88 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.85 3i02 h PRO 200 CO 0.58 0.37 0.10 0.00 -0.21 0.00 0.00 178.00 178.84 3i02 h ALA 201 N 1.62 0.31 -0.18 -0.75 0.00 -1.93 -1.64 119.26 116.68 3i02 h ALA 201 Ca 0.41 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3i02 h ALA 201 Cb 0.78 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3i02 h ALA 201 CO -0.17 -0.11 0.00 -1.13 0.00 0.00 0.00 179.25 177.84 3i02 n SER 202 N -4.81 1.25 -2.05 0.00 3.41 -0.96 -4.89 113.62 105.57 3i02 n SER 202 Ca -0.03 -1.80 -0.20 0.00 -0.26 0.00 0.00 58.87 56.58 3i02 n SER 202 Cb 0.12 -0.12 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 3i02 n SER 202 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3i02 n SER 203 N 0.10 -5.67 -4.76 4.04 2.88 -0.62 -4.94 113.62 104.65 3i02 n SER 203 Ca 0.12 0.17 -0.37 0.00 -1.33 0.00 0.00 58.87 57.46 3i02 n SER 203 Cb 0.23 -4.79 -0.06 0.00 -0.75 0.00 0.00 64.21 58.84 3i02 n SER 203 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 3i02 s THR 204 N -2.92 5.20 -0.07 2.46 2.01 -0.70 -4.98 115.64 116.63 3i02 s THR 204 Ca 0.00 0.74 0.01 0.00 0.31 0.00 0.00 61.69 62.75 3i02 s THR 204 Cb 0.00 -3.70 0.02 0.00 0.01 0.00 0.00 72.50 68.83 3i02 s THR 204 CO 0.00 0.43 -0.10 -0.54 -0.69 0.00 0.00 174.62 173.72 3i02 s LYS 205 N 0.03 1.54 -0.02 4.92 3.01 -1.26 -1.11 119.74 126.85 3i02 s LYS 205 Ca 0.21 -0.33 0.01 0.00 -1.01 0.00 0.00 55.97 54.85 3i02 s LYS 205 Cb -0.15 -1.38 0.01 0.00 -1.01 0.00 0.00 37.83 35.31 3i02 s LYS 205 CO 0.08 -0.06 -0.02 0.08 0.51 0.00 0.00 175.35 175.94 3i02 s VAL 206 N 0.96 0.27 -0.21 3.17 1.01 -0.19 -5.02 120.40 120.40 3i02 s VAL 206 Ca -0.09 -0.05 -0.05 0.00 0.00 0.00 0.00 61.98 61.80 3i02 s VAL 206 Cb -0.15 -0.29 -0.02 0.00 0.00 0.00 0.00 36.38 35.92 3i02 s VAL 206 CO 0.00 0.13 -0.01 -1.81 0.00 0.00 0.00 175.10 173.40 3i02 s ASP 207 N 0.51 4.65 -0.29 3.32 1.01 -1.26 -0.96 116.67 123.66 3i02 s ASP 207 Ca -0.05 -0.26 0.03 0.00 0.71 0.00 0.00 52.55 52.97 3i02 s ASP 207 Cb -0.08 -1.80 0.07 0.00 1.01 0.00 0.00 42.92 42.12 3i02 s ASP 207 CO -0.01 0.04 -0.06 -0.75 0.21 0.00 0.00 175.17 174.60 3i02 s LYS 208 N 1.15 2.05 0.17 8.23 2.47 -0.10 -4.97 119.74 128.73 3i02 s LYS 208 Ca 0.02 -1.49 -0.30 0.00 -1.56 0.00 0.00 55.97 52.64 3i02 s LYS 208 Cb -0.14 -3.01 -0.07 0.00 -1.46 0.00 0.00 37.83 33.15 3i02 s LYS 208 CO 0.01 -0.68 1.12 0.21 0.16 0.00 0.00 175.35 176.16 3i02 s LYS 209 N 1.06 4.57 -0.68 4.03 2.20 -1.26 -1.23 119.74 128.43 3i02 s LYS 209 Ca -0.03 1.74 -0.20 0.00 -0.36 0.00 0.00 55.97 57.11 3i02 s LYS 209 Cb -0.20 -3.28 0.10 0.00 -1.51 0.00 0.00 37.83 32.94 3i02 s LYS 209 CO -0.06 0.03 0.87 0.42 -0.36 0.00 0.00 175.35 176.26 3i02 s ILE 210 N -0.12 4.63 -0.05 5.43 -1.09 0.06 -4.90 121.20 125.16 3i02 s ILE 210 Ca 0.50 -0.87 -0.06 0.00 -2.23 0.00 0.00 60.65 58.00 3i02 s ILE 210 Cb -0.30 -4.61 -0.04 0.00 -1.58 0.00 0.00 42.46 35.93 3i02 s ILE 210 CO 0.35 -1.32 0.19 0.54 -1.23 0.00 0.00 174.94 173.47 3i02 s VAL 211 N 3.16 5.43 0.91 2.92 0.11 -1.26 -4.61 120.40 127.06 3i02 s VAL 211 Ca 0.19 0.08 -0.15 0.00 -2.93 0.00 0.00 61.98 59.17 3i02 s VAL 211 Cb -0.18 -3.49 0.24 0.00 -1.53 0.00 0.00 36.38 31.41 3i02 s VAL 211 CO 0.05 0.46 0.54 -0.81 -3.33 0.00 0.00 175.10 172.01 3i02 n PRO 212 N 1.43 -3.77 -0.78 1.54 -0.04 -1.26 -4.76 135.00 127.36 3i02 n PRO 212 Ca -0.15 -0.91 0.00 0.00 -0.04 0.00 0.00 63.50 62.40 3i02 n PRO 212 Cb 0.54 -1.17 0.00 0.00 -0.04 0.00 0.00 33.50 32.82 3i02 n PRO 212 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33