#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dzm h ALA 1 N 0.00 0.45 -1.26 -1.41 0.00 -1.91 -3.29 119.26 111.84 3dzm h ALA 1 Ca 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 54.91 53.60 3dzm h ALA 1 Cb 0.00 0.51 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3dzm h ALA 1 CO 0.00 1.31 0.00 0.00 0.00 0.00 0.00 179.25 180.56 3dzm n ALA 2 N -2.78 -1.73 -3.13 0.00 0.00 -1.12 -5.05 120.51 106.70 3dzm n ALA 2 Ca -0.23 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.80 3dzm n ALA 2 Cb 1.05 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.40 3dzm n ALA 2 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3dzm s LYS 3 N -1.40 2.70 -0.19 0.00 1.02 0.14 -4.97 119.74 117.04 3dzm s LYS 3 Ca 0.00 -1.36 -0.11 0.00 0.02 0.00 0.00 55.97 54.52 3dzm s LYS 3 Cb 0.00 -3.81 -0.05 0.00 -0.52 0.00 0.00 37.83 33.45 3dzm s LYS 3 CO 0.00 -0.90 0.19 -0.06 -0.92 0.00 0.00 175.35 173.66 3dzm s PHE 4 N 1.48 3.42 0.12 3.18 0.08 -1.21 -1.62 117.98 123.43 3dzm s PHE 4 Ca 0.03 0.42 0.03 0.00 0.12 0.00 0.00 56.93 57.53 3dzm s PHE 4 Cb -0.22 -2.23 -0.04 0.00 -0.57 0.00 0.00 43.02 39.96 3dzm s PHE 4 CO 0.04 0.26 -0.08 -1.12 -0.10 0.00 0.00 175.22 174.21 3dzm s SER 5 N 0.43 1.46 -0.07 1.36 0.01 -0.50 -1.01 113.70 115.38 3dzm s SER 5 Ca 0.11 -0.99 0.03 0.00 1.31 0.00 0.00 55.95 56.40 3dzm s SER 5 Cb -0.12 0.04 -0.02 0.00 0.21 0.00 0.00 66.02 66.13 3dzm s SER 5 CO 0.00 -0.39 -0.14 0.54 0.41 0.00 0.00 173.24 173.66 3dzm s VAL 6 N -3.40 3.06 -0.08 3.43 0.11 -0.71 -1.31 120.40 121.51 3dzm s VAL 6 Ca 0.14 -0.71 0.02 0.00 -2.93 0.00 0.00 61.98 58.50 3dzm s VAL 6 Cb 0.03 -2.22 0.01 0.00 -1.53 0.00 0.00 36.38 32.68 3dzm s VAL 6 CO -0.02 0.58 -0.14 -0.70 -3.33 0.00 0.00 175.10 171.48 3dzm s GLU 7 N -0.51 1.99 -0.06 1.54 2.12 0.35 -0.77 118.70 123.36 3dzm s GLU 7 Ca 0.07 -0.51 0.03 0.00 0.36 0.00 0.00 54.97 54.92 3dzm s GLU 7 Cb -0.12 -1.62 -0.02 0.00 0.26 0.00 0.00 34.13 32.63 3dzm s GLU 7 CO 0.02 0.03 -0.13 0.00 -0.54 0.00 0.00 175.26 174.64 3dzm s ALA 8 N 0.67 2.68 0.04 6.30 0.00 -0.64 -0.55 121.76 130.27 3dzm s ALA 8 Ca -0.14 -0.96 -0.02 0.00 0.00 0.00 0.00 51.96 50.84 3dzm s ALA 8 Cb -0.16 -1.02 -0.02 0.00 0.00 0.00 0.00 23.12 21.91 3dzm s ALA 8 CO 0.04 0.52 0.02 0.20 0.00 0.00 0.00 175.76 176.53 3dzm s GLY 9 N -0.59 0.30 0.07 0.00 0.00 0.63 -1.20 107.32 106.53 3dzm s GLY 9 Ca 0.09 -0.82 0.05 0.00 0.00 0.00 0.00 44.72 44.03 3dzm s GLY 9 CO 0.01 -0.93 -0.14 0.00 0.00 0.00 0.00 173.10 172.04 3dzm s ALA 10 N -2.88 1.15 0.00 3.20 0.00 0.91 -0.01 121.76 124.13 3dzm s ALA 10 Ca -0.03 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 50.93 3dzm s ALA 10 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.04 3dzm s ALA 10 CO -0.06 0.14 0.00 0.41 0.00 0.00 0.00 175.76 176.25 3dzm n GLY 11 N 1.22 0.15 3.61 0.00 0.00 -1.04 -1.18 105.19 107.95 3dzm n GLY 11 Ca -0.21 -1.12 -0.35 0.00 0.00 0.00 0.00 46.02 44.34 3dzm n GLY 11 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3dzm s PHE 12 N -4.00 3.22 -0.38 1.61 5.36 0.82 -2.50 117.98 122.11 3dzm s PHE 12 Ca 0.00 0.00 0.10 0.00 -0.96 0.00 0.00 56.93 56.08 3dzm s PHE 12 Cb 0.00 -2.10 0.31 0.00 -0.34 0.00 0.00 43.02 40.90 3dzm s PHE 12 CO 0.00 0.08 0.67 0.98 -1.46 0.00 0.00 175.22 175.49 3dzm n TYR 13 N 3.73 -0.10 -1.11 10.12 9.36 -1.26 -0.96 117.16 136.94 3dzm n TYR 13 Ca -0.16 -3.68 -0.04 0.00 3.32 0.00 0.00 57.90 57.34 3dzm n TYR 13 Cb 0.52 -0.34 -0.02 0.00 -0.63 0.00 0.00 39.34 38.88 3dzm n TYR 13 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3dzm n GLY 14 N 0.68 0.67 0.00 2.98 0.00 -1.25 -4.87 105.19 103.40 3dzm n GLY 14 Ca 0.23 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.69 3dzm n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dzm n GLY 15 N -2.21 3.19 3.80 -0.02 0.00 -1.25 -4.58 105.19 104.12 3dzm n GLY 15 Ca -0.04 -1.07 -0.34 0.00 0.00 0.00 0.00 46.02 44.58 3dzm n GLY 15 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3dzm s PHE 16 N -2.00 3.07 -1.69 1.61 5.36 -1.26 -4.41 117.98 118.66 3dzm s PHE 16 Ca 0.00 1.58 0.00 0.00 -0.96 0.00 0.00 56.93 57.55 3dzm s PHE 16 Cb 0.00 -3.01 0.00 0.00 -0.34 0.00 0.00 43.02 39.67 3dzm s PHE 16 CO 0.00 -0.69 0.00 0.41 -1.46 0.00 0.00 175.22 173.48 3dzm n GLY 17 N -0.41 -0.64 3.69 13.12 0.00 -1.04 -0.04 105.19 119.87 3dzm n GLY 17 Ca 0.09 -0.57 -0.11 0.00 0.00 0.00 0.00 46.02 45.43 3dzm n GLY 17 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dzm s GLY 18 N 0.00 0.78 0.02 -0.02 0.00 0.48 -2.49 107.32 106.10 3dzm s GLY 18 Ca 0.00 -1.03 -0.03 0.00 0.00 0.00 0.00 44.72 43.65 3dzm s GLY 18 CO 0.00 -0.56 0.05 -0.86 0.00 0.00 0.00 173.10 171.73 3dzm s GLN 19 N -2.58 0.45 -0.05 2.90 -2.07 0.99 -1.65 119.66 117.64 3dzm s GLN 19 Ca 0.21 -0.63 0.05 0.00 -1.82 0.00 0.00 55.36 53.17 3dzm s GLN 19 Cb -0.03 0.17 -0.02 0.00 -1.09 0.00 0.00 33.01 32.04 3dzm s GLN 19 CO 0.15 -0.10 -0.21 -0.51 -1.32 0.00 0.00 175.29 173.31 3dzm s LEU 20 N -1.70 2.35 0.07 2.60 1.43 -0.22 -0.27 118.68 122.93 3dzm s LEU 20 Ca -0.11 -0.38 -0.10 0.00 -1.03 0.00 0.00 54.13 52.51 3dzm s LEU 20 Cb -0.06 -1.45 0.00 0.00 0.03 0.00 0.00 46.19 44.72 3dzm s LEU 20 CO -0.02 0.29 0.21 0.00 0.23 0.00 0.00 176.35 177.07 3dzm s ALA 21 N -0.42 -0.36 -0.10 4.21 0.00 0.29 0.35 121.76 125.72 3dzm s ALA 21 Ca 0.04 -0.39 0.01 0.00 0.00 0.00 0.00 51.96 51.62 3dzm s ALA 21 Cb -0.12 0.40 -0.02 0.00 0.00 0.00 0.00 23.12 23.38 3dzm s ALA 21 CO 0.02 -0.45 -0.13 0.54 0.00 0.00 0.00 175.76 175.74 3dzm s VAL 22 N -3.21 3.13 0.00 0.00 0.11 0.32 -0.50 120.40 120.26 3dzm s VAL 22 Ca -0.00 -0.66 0.07 0.00 -2.93 0.00 0.00 61.98 58.46 3dzm s VAL 22 Cb 0.02 -2.28 -0.03 0.00 -1.53 0.00 0.00 36.38 32.56 3dzm s VAL 22 CO -0.07 0.55 -0.20 -0.69 -3.33 0.00 0.00 175.10 171.36 3dzm s VAL 23 N -0.09 2.60 -0.08 2.04 1.01 -0.43 -1.06 120.40 124.41 3dzm s VAL 23 Ca -0.02 -1.08 0.02 0.00 0.00 0.00 0.00 61.98 60.91 3dzm s VAL 23 Cb -0.14 -2.03 0.01 0.00 0.00 0.00 0.00 36.38 34.23 3dzm s VAL 23 CO 0.04 0.46 -0.13 0.00 0.00 0.00 0.00 175.10 175.47 3dzm s ALA 24 N -0.79 1.39 0.17 5.51 0.00 0.29 -1.41 121.76 126.92 3dzm s ALA 24 Ca 0.12 -0.51 -0.06 0.00 0.00 0.00 0.00 51.96 51.52 3dzm s ALA 24 Cb -0.10 -0.65 -0.02 0.00 0.00 0.00 0.00 23.12 22.34 3dzm s ALA 24 CO 0.02 0.05 0.22 -1.83 0.00 0.00 0.00 175.76 174.22 3dzm s GLU 25 N 0.79 1.16 -1.13 0.00 -1.05 -0.64 -1.16 118.70 116.67 3dzm s GLU 25 Ca -0.12 -1.33 -0.09 0.00 -0.15 0.00 0.00 54.97 53.28 3dzm s GLU 25 Cb -0.16 0.34 -0.04 0.00 -0.44 0.00 0.00 34.13 33.83 3dzm s GLU 25 CO 0.02 -0.40 0.86 -0.25 0.95 0.00 0.00 175.26 176.44 3dzm n ASP 26 N -0.22 -5.05 -0.05 0.83 8.00 -1.23 -0.69 116.55 118.14 3dzm n ASP 26 Ca -0.04 -0.81 0.14 0.00 0.71 0.00 0.00 54.79 54.78 3dzm n ASP 26 Cb 0.64 -4.50 0.56 0.00 -0.02 0.00 0.00 41.12 37.79 3dzm n ASP 26 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3dzm n LEU 27 N -3.74 0.31 -3.51 0.64 4.77 -1.26 -2.80 117.00 111.41 3dzm n LEU 27 Ca -0.13 0.16 -0.17 0.00 -0.03 0.00 0.00 56.01 55.85 3dzm n LEU 27 Cb 0.62 -0.29 -0.05 0.00 -2.33 0.00 0.00 43.42 41.37 3dzm n LEU 27 CO 0.63 0.06 0.45 0.00 -1.33 0.00 0.00 177.39 177.20 3dzm s ALA 28 N -2.73 -1.75 0.18 -1.18 0.00 -1.26 -4.60 121.76 110.43 3dzm s ALA 28 Ca 0.21 1.20 -0.18 0.00 0.00 0.00 0.00 51.96 53.19 3dzm s ALA 28 Cb 0.19 0.12 0.13 0.00 0.00 0.00 0.00 23.12 23.56 3dzm s ALA 28 CO 0.53 -0.43 1.62 -1.35 0.00 0.00 0.00 175.76 176.13 3dzm h PRO 29 N 2.82 -0.11 0.16 0.00 0.11 -1.87 -3.01 132.00 130.09 3dzm h PRO 29 Ca -0.28 0.01 -0.31 0.00 0.11 0.00 0.00 66.00 65.54 3dzm h PRO 29 Cb 1.17 0.03 0.03 0.00 0.11 0.00 0.00 31.00 32.33 3dzm h PRO 29 CO 0.38 -0.07 -1.31 0.78 -0.21 0.00 0.00 178.00 177.57 3dzm h GLY 30 N -0.12 0.60 -3.81 -0.55 0.00 -1.97 -3.49 103.07 93.74 3dzm h GLY 30 Ca 0.23 -1.37 -0.51 0.00 0.00 0.00 0.00 47.33 45.68 3dzm h GLY 30 CO -0.56 1.21 0.49 1.08 0.00 0.00 0.00 176.54 178.76 3dzm s LEU 31 N -7.65 4.53 -0.28 3.11 1.02 -1.14 -4.97 118.68 113.30 3dzm s LEU 31 Ca -0.08 2.32 0.11 0.00 0.02 0.00 0.00 54.13 56.50 3dzm s LEU 31 Cb 0.05 -3.64 0.65 0.00 0.02 0.00 0.00 46.19 43.28 3dzm s LEU 31 CO 0.93 -0.19 1.65 -0.81 0.02 0.00 0.00 176.35 177.94 3dzm n PRO 32 N 1.13 3.15 -1.94 1.29 -0.05 -1.26 -4.51 135.00 132.81 3dzm n PRO 32 Ca -0.01 -3.05 -0.36 0.00 -0.05 0.00 0.00 63.50 60.04 3dzm n PRO 32 Cb 0.44 -2.05 0.04 0.00 -0.05 0.00 0.00 33.50 31.89 3dzm n PRO 32 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 175.50 174.94 3dzm s LEU 33 N -3.01 3.62 -0.02 1.53 2.01 -1.26 -1.41 118.68 120.15 3dzm s LEU 33 Ca 0.50 2.39 -0.11 0.00 0.01 0.00 0.00 54.13 56.91 3dzm s LEU 33 Cb 0.41 -4.60 0.02 0.00 0.01 0.00 0.00 46.19 42.03 3dzm s LEU 33 CO 0.10 -1.67 0.24 -0.83 1.01 0.00 0.00 176.35 175.20 3dzm s GLY 34 N -1.65 -0.08 -0.03 -3.19 0.00 -0.11 -3.54 107.32 98.72 3dzm s GLY 34 Ca 0.77 0.19 0.03 0.00 0.00 0.00 0.00 44.72 45.71 3dzm s GLY 34 CO 0.35 0.02 -0.10 0.14 0.00 0.00 0.00 173.10 173.51 3dzm s VAL 35 N -1.21 0.84 -0.10 1.40 1.01 -0.31 -0.58 120.40 121.47 3dzm s VAL 35 Ca -0.13 -0.39 0.02 0.00 0.00 0.00 0.00 61.98 61.48 3dzm s VAL 35 Cb -0.06 -0.75 0.02 0.00 0.00 0.00 0.00 36.38 35.59 3dzm s VAL 35 CO 0.03 0.26 -0.13 -0.60 0.00 0.00 0.00 175.10 174.66 3dzm s ARG 36 N 0.22 1.97 -0.12 2.72 3.52 -0.39 -0.54 118.95 126.32 3dzm s ARG 36 Ca -0.04 -0.47 -0.02 0.00 -0.13 0.00 0.00 55.73 55.07 3dzm s ARG 36 Cb -0.09 -1.70 -0.03 0.00 -1.56 0.00 0.00 34.95 31.57 3dzm s ARG 36 CO 0.01 -0.06 -0.04 -0.51 -0.81 0.00 0.00 175.30 173.88 3dzm s LEU 37 N 0.99 3.26 0.04 -0.88 1.02 -0.22 -1.02 118.68 121.87 3dzm s LEU 37 Ca -0.07 -0.07 -0.11 0.00 0.02 0.00 0.00 54.13 53.90 3dzm s LEU 37 Cb -0.15 -1.76 0.01 0.00 0.02 0.00 0.00 46.19 44.31 3dzm s LEU 37 CO -0.01 0.25 0.23 -0.83 0.02 0.00 0.00 176.35 176.01 3dzm s GLY 38 N -0.12 -0.02 -0.04 -3.19 0.00 -0.85 -0.52 107.32 102.59 3dzm s GLY 38 Ca 0.02 -0.18 0.05 0.00 0.00 0.00 0.00 44.72 44.61 3dzm s GLY 38 CO 0.03 -0.36 -0.18 0.54 0.00 0.00 0.00 173.10 173.12 3dzm s VAL 39 N -2.51 1.50 -0.03 1.40 0.11 0.15 -1.62 120.40 119.41 3dzm s VAL 39 Ca -0.05 -0.76 0.07 0.00 -2.93 0.00 0.00 61.98 58.30 3dzm s VAL 39 Cb -0.01 -1.28 -0.02 0.00 -1.53 0.00 0.00 36.38 33.54 3dzm s VAL 39 CO -0.03 0.43 -0.24 -0.83 -3.33 0.00 0.00 175.10 171.09 3dzm s GLY 40 N -0.06 1.31 -0.06 6.54 0.00 -0.04 -1.06 107.32 113.96 3dzm s GLY 40 Ca -0.02 -1.10 0.05 0.00 0.00 0.00 0.00 44.72 43.65 3dzm s GLY 40 CO 0.02 -0.88 -0.21 -1.36 0.00 0.00 0.00 173.10 170.67 3dzm s PHE 41 N -0.58 2.53 0.02 1.90 0.08 -0.66 -1.37 117.98 119.91 3dzm s PHE 41 Ca 0.09 -0.55 -0.14 0.00 0.12 0.00 0.00 56.93 56.45 3dzm s PHE 41 Cb -0.10 -1.62 0.02 0.00 -0.57 0.00 0.00 43.02 40.74 3dzm s PHE 41 CO -0.00 -0.10 0.31 0.00 -0.10 0.00 0.00 175.22 175.32 3dzm s ALA 42 N -0.29 -0.72 0.72 5.36 0.00 -0.65 -0.39 121.76 125.80 3dzm s ALA 42 Ca 0.01 0.12 -0.13 0.00 0.00 0.00 0.00 51.96 51.95 3dzm s ALA 42 Cb -0.13 0.24 0.03 0.00 0.00 0.00 0.00 23.12 23.26 3dzm s ALA 42 CO 0.03 -0.36 1.11 0.99 0.00 0.00 0.00 175.76 177.52 3dzm s THR 43 N -2.14 3.17 0.16 0.00 2.01 0.94 -1.41 115.64 118.37 3dzm s THR 43 Ca -0.08 0.46 -0.17 0.00 0.31 0.00 0.00 61.69 62.21 3dzm s THR 43 Cb -0.02 -2.95 0.04 0.00 0.01 0.00 0.00 72.50 69.58 3dzm s THR 43 CO -0.01 -0.41 0.48 -0.55 -0.69 0.00 0.00 174.62 173.44 3dzm s SER 44 N -2.90 -0.29 -0.06 3.53 0.15 -0.42 -3.86 113.70 109.86 3dzm s SER 44 Ca 0.65 -0.35 -0.16 0.00 0.70 0.00 0.00 55.95 56.80 3dzm s SER 44 Cb -0.20 0.53 -0.05 0.00 -1.71 0.00 0.00 66.02 64.60 3dzm s SER 44 CO 0.49 -0.95 0.41 -0.62 1.20 0.00 0.00 173.24 173.77 3dzm s ASP 45 N -2.83 6.72 -0.22 5.45 2.15 -1.26 -2.69 116.67 123.99 3dzm s ASP 45 Ca 0.05 0.85 -0.11 0.00 0.43 0.00 0.00 52.55 53.77 3dzm s ASP 45 Cb 0.00 -2.25 -0.18 0.00 -0.30 0.00 0.00 42.92 40.19 3dzm s ASP 45 CO -0.08 0.20 -0.01 0.00 -0.17 0.00 0.00 175.17 175.10 3dzm n ALA 46 N 2.63 1.06 -2.88 3.66 0.00 -1.26 -4.44 120.51 119.28 3dzm n ALA 46 Ca -0.12 -0.82 -0.32 0.00 0.00 0.00 0.00 53.44 52.19 3dzm n ALA 46 Cb 0.52 -0.29 -0.16 0.00 0.00 0.00 0.00 19.45 19.52 3dzm n ALA 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3dzm s LEU 47 N -7.31 2.13 -0.23 0.00 2.01 -1.26 0.08 118.68 114.10 3dzm s LEU 47 Ca -0.32 -0.51 -0.32 0.00 0.01 0.00 0.00 54.13 53.00 3dzm s LEU 47 Cb 0.09 -1.40 -0.09 0.00 0.01 0.00 0.00 46.19 44.80 3dzm s LEU 47 CO 0.60 0.22 2.13 -0.67 1.01 0.00 0.00 176.35 179.64 3dzm n ASP 48 N 3.11 2.92 0.26 2.29 -0.08 -0.25 -4.86 116.55 119.93 3dzm n ASP 48 Ca -0.18 0.47 0.09 0.00 -1.51 0.00 0.00 54.79 53.66 3dzm n ASP 48 Cb 0.52 -1.41 0.66 0.00 2.34 0.00 0.00 41.12 43.24 3dzm n ASP 48 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 3dzm h ASP 49 N 12.67 0.00 -0.14 1.67 3.32 -1.93 -2.07 116.42 129.94 3dzm h ASP 49 Ca -0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.67 3dzm h ASP 49 Cb 1.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.83 3dzm h ASP 49 CO 0.98 0.06 0.00 0.61 -1.72 0.00 0.00 179.24 179.16 3dzm n GLY 50 N -1.30 -0.03 3.71 2.75 0.00 -1.26 -0.20 105.19 108.86 3dzm n GLY 50 Ca -0.03 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 3dzm n GLY 50 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3dzm s TYR 51 N -1.81 3.54 -0.12 1.61 5.04 -0.78 -4.85 117.35 119.98 3dzm s TYR 51 Ca 0.28 1.50 -0.19 0.00 -2.44 0.00 0.00 57.07 56.22 3dzm s TYR 51 Cb 0.15 -3.27 -0.04 0.00 0.35 0.00 0.00 41.96 39.15 3dzm s TYR 51 CO 0.22 -0.64 0.52 0.16 -1.34 0.00 0.00 175.55 174.48 3dzm s ASP 52 N 1.04 6.73 0.00 4.32 3.84 -1.26 -0.35 116.67 130.99 3dzm s ASP 52 Ca 0.55 0.87 0.18 0.00 -0.00 0.00 0.00 52.55 54.15 3dzm s ASP 52 Cb -0.25 -2.31 0.27 0.00 -1.38 0.00 0.00 42.92 39.25 3dzm s ASP 52 CO 0.28 -0.04 1.19 0.18 -0.00 0.00 0.00 175.17 176.79 3dzm n LEU 53 N 3.80 2.86 0.00 2.11 4.77 -0.15 -4.96 117.00 125.43 3dzm n LEU 53 Ca -0.06 -1.36 0.00 0.00 -0.03 0.00 0.00 56.01 54.56 3dzm n LEU 53 Cb 0.51 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 3dzm n LEU 53 CO 0.44 0.60 0.00 0.61 -1.33 0.00 0.00 177.39 177.70 3dzm n GLY 54 N 1.06 0.55 0.00 -0.72 0.00 -1.19 -5.00 105.19 99.89 3dzm n GLY 54 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3dzm n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dzm n GLY 55 N 5.00 -1.73 0.00 -0.02 0.00 -1.26 -4.97 105.19 102.21 3dzm n GLY 55 Ca 0.00 -1.54 0.13 0.00 0.00 0.00 0.00 46.02 44.61 3dzm n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dzm n GLY 56 N -1.58 -0.85 3.70 -0.02 0.00 -1.26 -4.87 105.19 100.31 3dzm n GLY 56 Ca 0.00 -0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 3dzm n GLY 56 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dzm s THR 57 N -2.00 4.91 0.35 2.61 -4.23 -1.26 -4.91 115.64 111.11 3dzm s THR 57 Ca 0.38 1.83 0.07 0.00 -1.18 0.00 0.00 61.69 62.80 3dzm s THR 57 Cb 0.18 -4.22 -0.01 0.00 1.34 0.00 0.00 72.50 69.79 3dzm s THR 57 CO 0.30 0.15 0.44 0.42 -0.54 0.00 0.00 174.62 175.39 3dzm s THR 58 N 1.22 3.73 0.43 3.99 -4.23 -1.26 -0.98 115.64 118.54 3dzm s THR 58 Ca 0.46 -1.09 0.13 0.00 -1.18 0.00 0.00 61.69 60.00 3dzm s THR 58 Cb -0.19 -3.28 0.19 0.00 1.34 0.00 0.00 72.50 70.56 3dzm s THR 58 CO 0.22 -0.13 1.99 -0.25 -0.54 0.00 0.00 174.62 175.91 3dzm h TRP 59 N 0.93 0.11 -0.29 3.99 2.91 -0.65 0.16 115.95 123.10 3dzm h TRP 59 Ca -0.44 -0.01 -0.04 0.00 1.13 0.00 0.00 58.89 59.53 3dzm h TRP 59 Cb 1.26 -0.03 -0.02 0.00 -0.51 0.00 0.00 29.16 29.86 3dzm h TRP 59 CO 0.45 0.23 0.02 0.78 -1.03 0.00 0.00 178.44 178.88 3dzm h GLY 60 N 0.54 0.47 0.57 2.65 0.00 -0.83 -1.62 103.07 104.86 3dzm h GLY 60 Ca 0.02 -0.25 -0.04 0.00 0.00 0.00 0.00 47.33 47.06 3dzm h GLY 60 CO 0.02 0.24 -0.11 -0.55 0.00 0.00 0.00 176.54 176.13 3dzm h ASP 61 N 0.43 0.20 0.78 0.19 3.32 -1.22 -3.11 116.42 116.99 3dzm h ASP 61 Ca 0.10 -0.56 -0.08 0.00 0.02 0.00 0.00 57.03 56.50 3dzm h ASP 61 Cb 0.26 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 3dzm h ASP 61 CO 0.01 0.72 -0.38 1.62 -1.72 0.00 0.00 179.24 179.48 3dzm h VAL 62 N -0.32 0.94 -0.42 -1.35 3.04 -1.35 -2.56 116.25 114.23 3dzm h VAL 62 Ca 0.00 -1.52 0.02 0.00 -1.01 0.00 0.00 66.70 64.19 3dzm h VAL 62 Cb 0.69 1.91 -0.03 0.00 -2.01 0.00 0.00 31.29 31.85 3dzm h VAL 62 CO 0.03 0.38 0.25 0.50 -1.01 0.00 0.00 177.57 177.71 3dzm h LYS 63 N 0.00 0.49 -0.28 4.17 3.64 -1.32 -2.06 116.57 121.21 3dzm h LYS 63 Ca -0.00 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 3dzm h LYS 63 Cb 0.88 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.57 3dzm h LYS 63 CO 0.05 0.33 0.06 1.49 -2.27 0.00 0.00 179.45 179.11 3dzm h GLU 64 N 0.51 0.46 -0.66 1.90 4.57 -1.43 -0.66 114.58 119.27 3dzm h GLU 64 Ca 0.17 -0.11 0.11 0.00 -1.18 0.00 0.00 59.36 58.34 3dzm h GLU 64 Cb 0.00 -0.06 -0.08 0.00 -0.16 0.00 0.00 28.75 28.46 3dzm h GLU 64 CO -0.07 0.55 0.26 0.00 -1.18 0.00 0.00 179.01 178.56 3dzm h ALA 65 N 0.89 0.88 -0.09 2.92 0.00 -1.20 -2.82 119.26 119.83 3dzm h ALA 65 Ca 0.09 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3dzm h ALA 65 Cb 0.30 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3dzm h ALA 65 CO 0.00 -0.18 0.00 0.41 0.00 0.00 0.00 179.25 179.48 3dzm n GLY 66 N -1.30 0.84 2.45 0.00 0.00 -0.80 -4.99 105.19 101.39 3dzm n GLY 66 Ca 0.10 -0.60 -0.19 0.00 0.00 0.00 0.00 46.02 45.33 3dzm n GLY 66 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3dzm n LYS 67 N 1.18 -2.01 -2.35 1.61 3.00 -0.27 -4.21 118.16 115.10 3dzm n LYS 67 Ca 0.13 0.92 -0.38 0.00 -0.00 0.00 0.00 58.31 58.98 3dzm n LYS 67 Cb 0.52 -5.52 -0.03 0.00 0.00 0.00 0.00 35.03 30.01 3dzm n LYS 67 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 3dzm s PHE 68 N -2.99 3.16 -0.29 5.64 0.08 -1.08 -4.59 117.98 117.91 3dzm s PHE 68 Ca 0.04 1.58 -0.13 0.00 0.12 0.00 0.00 56.93 58.55 3dzm s PHE 68 Cb -0.02 -3.34 -0.04 0.00 -0.57 0.00 0.00 43.02 39.05 3dzm s PHE 68 CO 0.05 -1.12 0.27 -1.12 -0.10 0.00 0.00 175.22 173.20 3dzm s SER 69 N -1.16 6.11 0.16 1.36 0.01 -0.52 -4.91 113.70 114.75 3dzm s SER 69 Ca 0.55 0.02 -0.10 0.00 1.31 0.00 0.00 55.95 57.74 3dzm s SER 69 Cb -0.30 -2.16 -0.07 0.00 0.21 0.00 0.00 66.02 63.71 3dzm s SER 69 CO 0.37 -0.14 0.48 -0.70 0.41 0.00 0.00 173.24 173.67 3dzm s GLU 70 N 1.88 3.80 0.03 12.44 2.12 -1.26 -0.65 118.70 137.06 3dzm s GLU 70 Ca 0.10 0.24 -0.14 0.00 0.36 0.00 0.00 54.97 55.52 3dzm s GLU 70 Cb -0.16 -2.83 0.02 0.00 0.26 0.00 0.00 34.13 31.42 3dzm s GLU 70 CO 0.11 0.44 0.32 1.67 -0.54 0.00 0.00 175.26 177.25 3dzm s TRP 71 N -1.61 -0.14 -0.05 5.30 1.48 -0.35 -4.98 118.94 118.59 3dzm s TRP 71 Ca 0.41 0.06 -0.29 0.00 -1.06 0.00 0.00 56.10 55.22 3dzm s TRP 71 Cb -0.13 0.11 0.06 0.00 -1.16 0.00 0.00 33.47 32.35 3dzm s TRP 71 CO 0.20 -0.49 0.64 0.20 -4.06 0.00 0.00 176.95 173.45 3dzm s GLY 72 N -1.89 -0.53 0.07 3.67 0.00 -1.09 -1.51 107.32 106.03 3dzm s GLY 72 Ca -0.07 1.23 -0.10 0.00 0.00 0.00 0.00 44.72 45.78 3dzm s GLY 72 CO -0.02 0.89 0.23 -0.86 0.00 0.00 0.00 173.10 173.35 3dzm s GLN 73 N -1.14 0.83 -0.08 2.90 -2.07 0.92 -1.30 119.66 119.72 3dzm s GLN 73 Ca -0.11 -0.79 0.03 0.00 -1.82 0.00 0.00 55.36 52.67 3dzm s GLN 73 Cb -0.01 0.35 0.01 0.00 -1.09 0.00 0.00 33.01 32.26 3dzm s GLN 73 CO 0.09 -0.27 -0.17 -0.80 -1.32 0.00 0.00 175.29 172.82 3dzm s ASN 74 N -2.57 2.32 -0.15 12.60 0.01 -0.50 -1.84 114.94 124.82 3dzm s ASN 74 Ca 0.01 -0.40 -0.01 0.00 -0.71 0.00 0.00 52.86 51.75 3dzm s ASN 74 Cb 0.02 -1.02 -0.01 0.00 0.41 0.00 0.00 41.25 40.65 3dzm s ASN 74 CO -0.08 0.10 -0.11 -0.69 -1.51 0.00 0.00 177.10 174.80 3dzm s VAL 75 N 0.46 3.15 -0.14 1.60 1.01 -0.31 -1.64 120.40 124.52 3dzm s VAL 75 Ca -0.15 -0.62 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 3dzm s VAL 75 Cb -0.16 -2.35 0.04 0.00 0.00 0.00 0.00 36.38 33.91 3dzm s VAL 75 CO 0.06 0.51 -0.03 -0.89 0.00 0.00 0.00 175.10 174.74 3dzm s THR 76 N 0.54 0.87 -0.15 3.92 2.01 -0.47 0.12 115.64 122.48 3dzm s THR 76 Ca -0.07 -0.40 -0.12 0.00 0.31 0.00 0.00 61.69 61.40 3dzm s THR 76 Cb -0.15 -1.05 -0.05 0.00 0.01 0.00 0.00 72.50 71.26 3dzm s THR 76 CO 0.04 0.16 0.24 -0.76 -0.69 0.00 0.00 174.62 173.61 3dzm s LEU 77 N 1.75 4.27 0.03 4.42 1.02 0.10 -0.86 118.68 129.41 3dzm s LEU 77 Ca 0.02 0.47 0.01 0.00 0.02 0.00 0.00 54.13 54.65 3dzm s LEU 77 Cb -0.14 -2.29 -0.02 0.00 0.02 0.00 0.00 46.19 43.76 3dzm s LEU 77 CO -0.07 0.17 -0.05 -0.94 0.02 0.00 0.00 176.35 175.48 3dzm s SER 78 N 0.15 0.54 -0.07 2.29 1.04 -0.64 0.35 113.70 117.36 3dzm s SER 78 Ca 0.15 -0.46 0.02 0.00 0.48 0.00 0.00 55.95 56.13 3dzm s SER 78 Cb -0.13 0.05 0.02 0.00 0.10 0.00 0.00 66.02 66.06 3dzm s SER 78 CO 0.03 -0.21 -0.11 -0.22 0.98 0.00 0.00 173.24 173.71 3dzm s LEU 79 N -1.32 1.55 -0.06 2.42 2.96 -0.73 -2.00 118.68 121.50 3dzm s LEU 79 Ca -0.11 -0.29 0.04 0.00 -0.22 0.00 0.00 54.13 53.56 3dzm s LEU 79 Cb -0.09 -0.80 -0.00 0.00 0.50 0.00 0.00 46.19 45.80 3dzm s LEU 79 CO -0.00 0.00 -0.19 -1.81 -1.32 0.00 0.00 176.35 173.03 3dzm s ASP 80 N 0.84 2.45 -0.19 3.68 1.01 -0.18 -1.89 116.67 122.38 3dzm s ASP 80 Ca -0.11 -0.41 -0.16 0.00 0.71 0.00 0.00 52.55 52.57 3dzm s ASP 80 Cb -0.15 -0.84 -0.04 0.00 1.01 0.00 0.00 42.92 42.90 3dzm s ASP 80 CO 0.02 0.15 0.42 -0.69 0.21 0.00 0.00 175.17 175.28 3dzm s VAL 81 N 0.16 5.19 -0.06 -1.27 1.01 -0.54 -1.26 120.40 123.63 3dzm s VAL 81 Ca -0.08 0.75 0.01 0.00 0.00 0.00 0.00 61.98 62.65 3dzm s VAL 81 Cb -0.14 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 3dzm s VAL 81 CO 0.04 0.25 -0.05 -0.76 0.00 0.00 0.00 175.10 174.58 3dzm s LEU 82 N 1.27 3.26 -0.08 3.92 1.43 0.26 -2.26 118.68 126.48 3dzm s LEU 82 Ca 0.20 0.00 0.05 0.00 -1.03 0.00 0.00 54.13 53.35 3dzm s LEU 82 Cb -0.15 -1.74 -0.00 0.00 0.03 0.00 0.00 46.19 44.33 3dzm s LEU 82 CO 0.08 0.36 -0.24 -0.47 0.23 0.00 0.00 176.35 176.31 3dzm s TYR 83 N -0.85 2.47 -0.39 0.29 6.14 -0.86 -0.93 117.35 123.23 3dzm s TYR 83 Ca 0.13 -0.90 -0.08 0.00 0.64 0.00 0.00 57.07 56.86 3dzm s TYR 83 Cb -0.11 -1.64 0.06 0.00 0.42 0.00 0.00 41.96 40.69 3dzm s TYR 83 CO 0.02 -0.33 0.20 0.15 0.64 0.00 0.00 175.55 176.23 3dzm s LYS 84 N 0.14 2.58 0.35 4.97 1.02 -0.50 -3.49 119.74 124.81 3dzm s LYS 84 Ca -0.13 -1.36 -0.27 0.00 0.02 0.00 0.00 55.97 54.23 3dzm s LYS 84 Cb -0.16 -3.65 -0.12 0.00 -0.52 0.00 0.00 37.83 33.37 3dzm s LYS 84 CO 0.07 -0.85 1.19 -2.30 -0.92 0.00 0.00 175.35 172.54 3dzm n PRO 85 N 4.86 1.84 -2.56 -1.68 -0.02 -1.26 -4.78 135.00 131.41 3dzm n PRO 85 Ca -0.10 0.65 -0.26 0.00 -2.02 0.00 0.00 63.50 61.76 3dzm n PRO 85 Cb 0.44 -2.19 0.02 0.00 -0.02 0.00 0.00 33.50 31.75 3dzm n PRO 85 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3dzm s SER 86 N -0.44 5.71 -1.38 2.55 0.01 -1.26 -4.36 113.70 114.53 3dzm s SER 86 Ca 0.58 0.63 -0.15 0.00 1.31 0.00 0.00 55.95 58.32 3dzm s SER 86 Cb -0.59 -1.71 0.02 0.00 0.21 0.00 0.00 66.02 63.94 3dzm s SER 86 CO 0.61 -0.93 0.37 0.61 0.41 0.00 0.00 173.24 174.30 3dzm n GLY 87 N -2.43 -0.46 0.08 3.44 0.00 -1.26 -4.78 105.19 99.77 3dzm n GLY 87 Ca 0.03 0.25 -0.02 0.00 0.00 0.00 0.00 46.02 46.29 3dzm n GLY 87 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dzm n LEU 88 N -4.72 -0.20 -4.19 0.99 4.77 -1.26 -4.85 117.00 107.54 3dzm n LEU 88 Ca -0.23 0.75 -0.40 0.00 -0.03 0.00 0.00 56.01 56.10 3dzm n LEU 88 Cb 0.64 -0.25 -0.08 0.00 -2.33 0.00 0.00 43.42 41.39 3dzm n LEU 88 CO 0.79 -0.48 0.02 -0.83 -1.33 0.00 0.00 177.39 175.56 3dzm s GLY 89 N -1.53 2.20 0.26 -0.72 0.00 -1.26 -5.13 107.32 101.14 3dzm s GLY 89 Ca -0.02 -2.77 0.11 0.00 0.00 0.00 0.00 44.72 42.03 3dzm s GLY 89 CO 0.12 1.12 -0.19 1.08 0.00 0.00 0.00 173.10 175.23 3dzm s LEU 90 N 0.91 2.58 0.42 0.66 1.43 -1.26 -5.02 118.68 118.39 3dzm s LEU 90 Ca 0.10 -1.02 0.23 0.00 -1.03 0.00 0.00 54.13 52.40 3dzm s LEU 90 Cb -0.23 -0.99 0.68 0.00 0.03 0.00 0.00 46.19 45.69 3dzm s LEU 90 CO -0.03 -0.02 1.72 1.55 0.23 0.00 0.00 176.35 179.81 3dzm h PRO 91 N 2.37 0.00 -5.35 1.29 0.14 -2.02 -3.42 132.00 125.01 3dzm h PRO 91 Ca -0.40 0.00 -0.61 0.00 0.14 0.00 0.00 66.00 65.13 3dzm h PRO 91 Cb 1.25 0.00 -0.11 0.00 0.14 0.00 0.00 31.00 32.28 3dzm h PRO 91 CO 0.60 0.22 -0.49 0.14 0.14 0.00 0.00 178.00 178.62 3dzm s VAL 92 N -3.42 5.43 -0.02 1.56 -7.23 -1.26 -4.77 120.40 110.68 3dzm s VAL 92 Ca 0.02 0.20 -0.30 0.00 -1.81 0.00 0.00 61.98 60.09 3dzm s VAL 92 Cb 0.09 -3.46 -0.04 0.00 0.56 0.00 0.00 36.38 33.53 3dzm s VAL 92 CO 0.66 0.48 1.17 -0.70 -0.31 0.00 0.00 175.10 176.39 3dzm s GLU 93 N 0.08 4.39 -0.16 4.82 2.12 -0.52 -4.92 118.70 124.52 3dzm s GLU 93 Ca 0.09 1.67 0.01 0.00 0.36 0.00 0.00 54.97 57.10 3dzm s GLU 93 Cb -0.11 -3.49 0.00 0.00 0.26 0.00 0.00 34.13 30.79 3dzm s GLU 93 CO -0.01 -0.36 -0.16 0.14 -0.54 0.00 0.00 175.26 174.33 3dzm s VAL 94 N 1.80 2.54 -0.26 3.70 -7.23 -1.26 -0.41 120.40 119.28 3dzm s VAL 94 Ca 0.56 -0.81 0.01 0.00 -1.81 0.00 0.00 61.98 59.93 3dzm s VAL 94 Cb -0.25 -2.07 0.05 0.00 0.56 0.00 0.00 36.38 34.67 3dzm s VAL 94 CO 0.24 0.52 -0.09 0.00 -0.31 0.00 0.00 175.10 175.46 3dzm s ALA 95 N 0.88 2.62 0.43 1.32 0.00 0.49 -4.32 121.76 123.17 3dzm s ALA 95 Ca -0.04 -1.66 -0.26 0.00 0.00 0.00 0.00 51.96 50.00 3dzm s ALA 95 Cb -0.15 -1.64 -0.09 0.00 0.00 0.00 0.00 23.12 21.24 3dzm s ALA 95 CO -0.01 -1.06 1.44 -1.25 0.00 0.00 0.00 175.76 174.88 3dzm s PRO 96 N 1.19 3.83 0.03 0.00 0.04 -1.23 -0.23 135.00 138.63 3dzm s PRO 96 Ca -0.05 2.46 -0.04 0.00 0.04 0.00 0.00 61.00 63.42 3dzm s PRO 96 Cb -0.19 -2.76 -0.02 0.00 0.04 0.00 0.00 34.50 31.58 3dzm s PRO 96 CO -0.05 -0.72 0.05 1.52 0.04 0.00 0.00 177.00 177.84 3dzm s TYR 97 N -1.18 0.24 0.13 0.56 -0.85 0.12 -2.02 117.35 114.35 3dzm s TYR 97 Ca 0.58 -0.54 0.06 0.00 -0.52 0.00 0.00 57.07 56.66 3dzm s TYR 97 Cb -0.45 -0.18 -0.04 0.00 0.38 0.00 0.00 41.96 41.68 3dzm s TYR 97 CO 0.58 -0.31 -0.15 -0.59 -1.52 0.00 0.00 175.55 173.57 3dzm s PHE 98 N -2.33 1.47 0.19 -3.49 -0.12 -0.96 -0.85 117.98 111.89 3dzm s PHE 98 Ca -0.07 -0.55 -0.18 0.00 -0.05 0.00 0.00 56.93 56.07 3dzm s PHE 98 Cb -0.03 -0.76 0.07 0.00 -0.63 0.00 0.00 43.02 41.67 3dzm s PHE 98 CO -0.04 0.18 0.89 0.41 -0.05 0.00 0.00 175.22 176.61 3dzm n GLY 99 N 0.45 0.74 3.69 1.99 0.00 0.67 -1.46 105.19 111.26 3dzm n GLY 99 Ca -0.15 -1.14 -0.30 0.00 0.00 0.00 0.00 46.02 44.43 3dzm n GLY 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dzm s VAL 100 N -2.13 4.03 0.07 1.61 0.11 -0.79 -1.23 120.40 122.08 3dzm s VAL 100 Ca 0.19 -0.96 0.03 0.00 -2.93 0.00 0.00 61.98 58.32 3dzm s VAL 100 Cb -0.03 -2.91 -0.03 0.00 -1.53 0.00 0.00 36.38 31.88 3dzm s VAL 100 CO 0.06 0.14 -0.09 -0.13 -3.33 0.00 0.00 175.10 171.75 3dzm s ARG 101 N -2.25 0.70 -0.13 1.54 3.00 0.67 -1.78 118.95 120.70 3dzm s ARG 101 Ca 0.25 -1.00 -0.01 0.00 0.00 0.00 0.00 55.73 54.98 3dzm s ARG 101 Cb -0.12 -0.39 0.03 0.00 0.00 0.00 0.00 34.95 34.48 3dzm s ARG 101 CO 0.18 0.06 -0.04 0.71 0.00 0.00 0.00 175.30 176.20 3dzm s TYR 102 N -2.10 1.37 -0.10 -0.53 2.02 0.16 -0.60 117.35 117.57 3dzm s TYR 102 Ca -0.01 -0.76 -0.01 0.00 -0.37 0.00 0.00 57.07 55.91 3dzm s TYR 102 Cb -0.05 -1.16 -0.03 0.00 -0.40 0.00 0.00 41.96 40.31 3dzm s TYR 102 CO -0.01 -0.52 -0.03 1.21 -1.57 0.00 0.00 175.55 174.63 3dzm s ASN 103 N 1.74 4.95 -0.44 2.29 2.47 -0.16 0.01 114.94 125.79 3dzm s ASN 103 Ca 0.03 0.03 -0.07 0.00 0.42 0.00 0.00 52.86 53.27 3dzm s ASN 103 Cb -0.14 -1.44 0.11 0.00 -1.45 0.00 0.00 41.25 38.33 3dzm s ASN 103 CO -0.07 0.33 0.29 -0.36 -3.72 0.00 0.00 177.10 173.56 3dzm s PHE 104 N -0.58 3.46 0.07 0.43 0.08 0.33 -1.20 117.98 120.57 3dzm s PHE 104 Ca 0.09 -1.98 -0.14 0.00 0.12 0.00 0.00 56.93 55.02 3dzm s PHE 104 Cb -0.12 -3.32 -0.06 0.00 -0.57 0.00 0.00 43.02 38.95 3dzm s PHE 104 CO 0.02 -0.97 0.46 0.12 -0.10 0.00 0.00 175.22 174.76 3dzm s PHE 105 N 1.31 3.67 -0.27 0.36 5.36 -0.51 -1.17 117.98 126.73 3dzm s PHE 105 Ca 0.06 0.99 -0.25 0.00 -0.96 0.00 0.00 56.93 56.77 3dzm s PHE 105 Cb -0.25 -2.30 0.09 0.00 -0.34 0.00 0.00 43.02 40.23 3dzm s PHE 105 CO -0.01 0.55 0.86 -1.54 -1.46 0.00 0.00 175.22 173.62 3dzm s SER 106 N -1.41 -0.61 0.00 6.13 1.04 -0.76 -2.01 113.70 116.07 3dzm s SER 106 Ca 0.30 1.17 0.00 0.00 0.48 0.00 0.00 55.95 57.90 3dzm s SER 106 Cb -0.16 1.18 0.00 0.00 0.10 0.00 0.00 66.02 67.14 3dzm s SER 106 CO 0.17 -0.21 0.00 0.61 0.98 0.00 0.00 173.24 174.78 3dzm n GLY 107 N 2.42 1.87 0.00 7.32 0.00 -0.84 -0.06 105.19 115.91 3dzm n GLY 107 Ca -0.13 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.19 3dzm n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dzm n GLY 108 N 0.00 0.08 3.11 -0.02 0.00 -0.57 -0.22 105.19 107.57 3dzm n GLY 108 Ca 0.00 -1.21 -0.09 0.00 0.00 0.00 0.00 46.02 44.72 3dzm n GLY 108 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3dzm s TYR 109 N -3.81 0.66 0.29 1.61 -0.85 -0.80 -1.21 117.35 113.26 3dzm s TYR 109 Ca 0.00 -0.89 0.11 0.00 -0.52 0.00 0.00 57.07 55.77 3dzm s TYR 109 Cb 0.00 -0.42 -0.05 0.00 0.38 0.00 0.00 41.96 41.87 3dzm s TYR 109 CO 0.00 -0.23 -0.12 0.95 -1.52 0.00 0.00 175.55 174.63 3dzm s THR 110 N -3.26 2.66 -0.77 -3.49 -4.23 0.18 -1.50 115.64 105.22 3dzm s THR 110 Ca 0.05 -2.22 0.03 0.00 -1.18 0.00 0.00 61.69 58.36 3dzm s THR 110 Cb 0.03 -2.52 0.20 0.00 1.34 0.00 0.00 72.50 71.55 3dzm s THR 110 CO -0.06 -0.34 0.67 -0.67 -0.54 0.00 0.00 174.62 173.68 3dzm n ASP 111 N -0.74 3.65 0.00 3.99 2.03 -1.01 -1.44 116.55 123.03 3dzm n ASP 111 Ca -0.05 -3.24 0.10 0.00 0.52 0.00 0.00 54.79 52.12 3dzm n ASP 111 Cb 0.61 -0.86 0.48 0.00 -0.72 0.00 0.00 41.12 40.63 3dzm n ASP 111 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 3dzm n PRO 112 N 1.85 0.17 0.00 -0.67 -0.02 -1.26 -4.28 135.00 130.79 3dzm n PRO 112 Ca 0.22 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 3dzm n PRO 112 Cb 0.36 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.34 3dzm n PRO 112 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3dzm n GLU 113 N -1.38 0.00 0.00 -0.52 4.07 -1.26 -5.10 120.64 116.45 3dzm n GLU 113 Ca 0.08 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.18 3dzm n GLU 113 Cb 0.19 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.57 3dzm n GLU 113 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 3dzm n ASP 114 N 0.00 0.00 0.00 4.31 4.64 -1.26 -4.86 116.55 119.38 3dzm n ASP 114 Ca 0.00 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.41 3dzm n ASP 114 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.08 3dzm n ASP 114 CO 0.00 0.00 0.00 -0.46 -0.82 0.00 0.00 177.20 175.92 3dzm n ASN 115 N 0.00 0.00 -2.77 1.67 0.23 -1.26 -4.95 115.26 108.18 3dzm n ASN 115 Ca 0.00 0.00 -0.03 0.00 -0.53 0.00 0.00 54.58 54.02 3dzm n ASN 115 Cb 0.00 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 37.67 3dzm n ASN 115 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 3dzm n LEU 116 N 0.00 -5.88 0.00 -4.53 7.94 -1.26 -4.49 117.00 108.79 3dzm n LEU 116 Ca 0.00 1.79 0.00 0.00 -1.11 0.00 0.00 56.01 56.69 3dzm n LEU 116 Cb 0.00 -2.78 0.00 0.00 0.53 0.00 0.00 43.42 41.17 3dzm n LEU 116 CO 0.00 -3.54 0.00 0.35 -1.11 0.00 0.00 177.39 173.09 3dzm n THR 117 N 1.79 0.00 -3.64 1.96 -2.24 -1.26 -4.24 114.28 106.65 3dzm n THR 117 Ca -0.25 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.43 3dzm n THR 117 Cb 0.42 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.58 3dzm n THR 117 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3dzm s ILE 118 N 0.00 0.00 0.00 2.28 1.09 -1.26 -5.10 121.20 118.21 3dzm s ILE 118 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 60.65 59.55 3dzm s ILE 118 Cb 0.00 -1.00 0.00 0.00 -1.06 0.00 0.00 42.46 40.40 3dzm s ILE 118 CO 0.00 0.00 0.00 2.29 -0.10 0.00 0.00 174.94 177.13 3dzm n LYS 119 N 2.52 0.00 -3.64 2.79 2.85 -1.26 -3.30 118.16 118.12 3dzm n LYS 119 Ca -0.14 0.00 -0.08 0.00 -1.05 0.00 0.00 58.31 57.05 3dzm n LYS 119 Cb 0.56 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 34.87 3dzm n LYS 119 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3dzm s ALA 120 N -1.00 -2.03 -0.03 0.58 0.00 -1.13 -2.41 121.76 115.75 3dzm s ALA 120 Ca 0.00 1.94 0.03 0.00 0.00 0.00 0.00 51.96 53.93 3dzm s ALA 120 Cb 0.00 -1.50 -0.00 0.00 0.00 0.00 0.00 23.12 21.62 3dzm s ALA 120 CO 0.00 -0.25 -0.11 -1.14 0.00 0.00 0.00 175.76 174.25 3dzm s GLN 121 N 0.45 1.12 -0.02 0.00 0.74 -0.56 -1.39 119.66 119.99 3dzm s GLN 121 Ca 0.01 -0.38 0.01 0.00 0.05 0.00 0.00 55.36 55.05 3dzm s GLN 121 Cb -0.05 -1.03 0.01 0.00 1.10 0.00 0.00 33.01 33.04 3dzm s GLN 121 CO -0.08 0.16 -0.03 0.99 -0.55 0.00 0.00 175.29 175.78 3dzm s THR 122 N 0.09 0.34 0.19 -0.34 2.01 -0.36 -1.90 115.64 115.68 3dzm s THR 122 Ca -0.02 -0.10 0.11 0.00 0.31 0.00 0.00 61.69 61.99 3dzm s THR 122 Cb -0.08 -0.35 -0.04 0.00 0.01 0.00 0.00 72.50 72.03 3dzm s THR 122 CO 0.01 0.14 -0.22 -0.51 -0.69 0.00 0.00 174.62 173.35 3dzm s ILE 123 N 0.44 2.48 -0.02 1.82 2.07 0.69 -0.44 121.20 128.23 3dzm s ILE 123 Ca -0.05 -1.98 -0.07 0.00 -1.41 0.00 0.00 60.65 57.14 3dzm s ILE 123 Cb -0.08 -2.19 0.01 0.00 0.13 0.00 0.00 42.46 40.32 3dzm s ILE 123 CO -0.01 -0.12 0.15 -0.44 -1.91 0.00 0.00 174.94 172.62 3dzm s SER 124 N -2.69 -0.05 -0.14 4.50 0.01 -0.50 -1.98 113.70 112.85 3dzm s SER 124 Ca 0.21 -0.02 -0.09 0.00 1.31 0.00 0.00 55.95 57.37 3dzm s SER 124 Cb -0.08 0.26 0.05 0.00 0.21 0.00 0.00 66.02 66.46 3dzm s SER 124 CO 0.11 -0.27 0.35 -0.55 0.41 0.00 0.00 173.24 173.28 3dzm s SER 125 N -0.91 -0.42 -0.24 2.44 0.15 -0.85 -1.08 113.70 112.79 3dzm s SER 125 Ca -0.10 0.75 -0.06 0.00 0.70 0.00 0.00 55.95 57.24 3dzm s SER 125 Cb -0.05 0.65 -0.02 0.00 -1.71 0.00 0.00 66.02 64.89 3dzm s SER 125 CO 0.01 -0.17 0.04 0.20 1.20 0.00 0.00 173.24 174.52 3dzm s ASN 126 N 1.14 4.93 0.10 5.45 0.01 -1.26 -1.42 114.94 123.89 3dzm s ASN 126 Ca -0.08 -0.26 0.08 0.00 -0.71 0.00 0.00 52.86 51.90 3dzm s ASN 126 Cb -0.08 -1.88 -0.03 0.00 0.41 0.00 0.00 41.25 39.67 3dzm s ASN 126 CO -0.09 -0.03 -0.22 -1.10 -1.51 0.00 0.00 177.10 174.15 3dzm s GLN 127 N 1.58 1.19 -0.13 -0.60 -0.21 -0.34 -4.79 119.66 116.36 3dzm s GLN 127 Ca 0.06 -1.15 -0.17 0.00 0.02 0.00 0.00 55.36 54.12 3dzm s GLN 127 Cb -0.15 -1.46 -0.04 0.00 1.00 0.00 0.00 33.01 32.36 3dzm s GLN 127 CO 0.02 0.34 0.41 -1.17 -2.12 0.00 0.00 175.29 172.78 3dzm s LEU 128 N -1.83 4.26 0.25 2.90 2.96 -1.26 -0.99 118.68 124.97 3dzm s LEU 128 Ca 0.07 0.70 0.07 0.00 -0.22 0.00 0.00 54.13 54.76 3dzm s LEU 128 Cb -0.10 -2.58 -0.05 0.00 0.50 0.00 0.00 46.19 43.96 3dzm s LEU 128 CO 0.04 0.03 -0.10 -0.83 -1.32 0.00 0.00 176.35 174.17 3dzm s GLY 129 N 0.58 1.66 0.16 7.98 0.00 0.23 -2.43 107.32 115.51 3dzm s GLY 129 Ca 0.23 -1.80 0.08 0.00 0.00 0.00 0.00 44.72 43.23 3dzm s GLY 129 CO 0.08 -1.81 -0.17 1.08 0.00 0.00 0.00 173.10 172.27 3dzm s LEU 130 N -3.39 2.45 0.18 0.66 1.43 -0.01 -0.24 118.68 119.75 3dzm s LEU 130 Ca 0.27 -0.87 -0.24 0.00 -1.03 0.00 0.00 54.13 52.25 3dzm s LEU 130 Cb 0.01 -0.78 0.06 0.00 0.03 0.00 0.00 46.19 45.51 3dzm s LEU 130 CO 0.10 -0.06 0.95 -0.83 0.23 0.00 0.00 176.35 176.73 3dzm s GLY 131 N -2.71 -0.16 0.00 -3.19 0.00 -0.36 0.53 107.32 101.43 3dzm s GLY 131 Ca 0.16 0.00 -0.03 0.00 0.00 0.00 0.00 44.72 44.85 3dzm s GLY 131 CO 0.06 0.24 0.04 -2.27 0.00 0.00 0.00 173.10 171.18 3dzm s LEU 132 N -3.00 1.92 -0.06 0.66 2.96 -0.68 -0.24 118.68 120.25 3dzm s LEU 132 Ca 0.13 -0.27 -0.30 0.00 -0.22 0.00 0.00 54.13 53.47 3dzm s LEU 132 Cb -0.02 0.30 0.11 0.00 0.50 0.00 0.00 46.19 47.08 3dzm s LEU 132 CO 0.03 -0.26 1.35 -0.83 -1.32 0.00 0.00 176.35 175.32 3dzm s GLY 133 N -1.10 -0.26 -0.01 7.98 0.00 -0.03 -1.27 107.32 112.63 3dzm s GLY 133 Ca -0.12 0.34 0.08 0.00 0.00 0.00 0.00 44.72 45.02 3dzm s GLY 133 CO 0.00 4.40 -0.26 -1.34 0.00 0.00 0.00 173.10 175.90 3dzm s VAL 134 N -2.06 2.11 -0.21 1.40 -7.23 -0.04 0.16 120.40 114.53 3dzm s VAL 134 Ca 0.26 -1.15 -0.01 0.00 -1.81 0.00 0.00 61.98 59.27 3dzm s VAL 134 Cb 0.02 -1.75 0.01 0.00 0.56 0.00 0.00 36.38 35.22 3dzm s VAL 134 CO -0.03 0.54 -0.11 -0.60 -0.31 0.00 0.00 175.10 174.59 3dzm s ARG 135 N -0.73 3.11 -0.18 4.82 3.52 0.68 -1.95 118.95 128.22 3dzm s ARG 135 Ca 0.10 -0.78 -0.08 0.00 -0.13 0.00 0.00 55.73 54.84 3dzm s ARG 135 Cb -0.10 -2.84 -0.04 0.00 -1.56 0.00 0.00 34.95 30.41 3dzm s ARG 135 CO -0.00 -0.25 0.10 0.00 -0.81 0.00 0.00 175.30 174.34 3dzm s ALA 136 N 1.37 3.60 -0.05 6.12 0.00 0.66 -0.38 121.76 133.09 3dzm s ALA 136 Ca 0.04 -0.71 0.04 0.00 0.00 0.00 0.00 51.96 51.34 3dzm s ALA 136 Cb -0.14 -2.02 -0.00 0.00 0.00 0.00 0.00 23.12 20.96 3dzm s ALA 136 CO -0.07 0.26 -0.17 0.00 0.00 0.00 0.00 175.76 175.78 3dzm s ALA 137 N 0.08 1.53 -0.13 0.00 0.00 0.45 -0.26 121.76 123.42 3dzm s ALA 137 Ca 0.08 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.38 3dzm s ALA 137 Cb -0.12 -0.54 0.02 0.00 0.00 0.00 0.00 23.12 22.49 3dzm s ALA 137 CO -0.00 0.25 -0.12 -0.47 0.00 0.00 0.00 175.76 175.42 3dzm s TYR 138 N 0.17 1.91 0.02 0.00 5.04 0.32 -1.44 117.35 123.37 3dzm s TYR 138 Ca -0.07 -1.02 -0.30 0.00 -2.44 0.00 0.00 57.07 53.25 3dzm s TYR 138 Cb -0.13 -1.45 -0.08 0.00 0.35 0.00 0.00 41.96 40.66 3dzm s TYR 138 CO 0.03 -0.59 1.82 -2.14 -1.34 0.00 0.00 175.55 173.33 3dzm s PRO 139 N 1.46 4.16 -0.11 4.97 0.02 -1.26 -0.52 135.00 143.72 3dzm s PRO 139 Ca 0.03 2.44 -0.12 0.00 0.02 0.00 0.00 61.00 63.37 3dzm s PRO 139 Cb -0.13 -3.99 -0.05 0.00 0.02 0.00 0.00 34.50 30.36 3dzm s PRO 139 CO -0.08 -0.88 -0.24 -0.11 -0.33 0.00 0.00 177.00 175.36 3dzm n LEU 140 N 7.00 1.60 -4.39 -5.54 7.94 -0.20 -4.90 117.00 118.51 3dzm n LEU 140 Ca 0.18 0.26 -0.22 0.00 -1.11 0.00 0.00 56.01 55.12 3dzm n LEU 140 Cb 0.41 -0.60 -0.08 0.00 0.53 0.00 0.00 43.42 43.68 3dzm n LEU 140 CO 0.65 -0.26 -0.15 -0.04 -1.11 0.00 0.00 177.39 176.48 3dzm s MET 141 N -2.55 1.81 -0.26 1.96 -1.94 -1.01 -5.04 119.30 112.27 3dzm s MET 141 Ca -0.21 -2.08 -0.36 0.00 -1.71 0.00 0.00 55.69 51.33 3dzm s MET 141 Cb 0.04 -0.10 -0.13 0.00 2.01 0.00 0.00 34.83 36.66 3dzm s MET 141 CO 0.30 -0.56 1.98 -2.30 -0.01 0.00 0.00 175.02 174.42 3dzm n PRO 142 N -0.74 1.42 -1.08 2.03 -0.02 -1.26 -2.17 135.00 133.18 3dzm n PRO 142 Ca 0.01 0.47 -0.03 0.00 -2.02 0.00 0.00 63.50 61.94 3dzm n PRO 142 Cb 0.64 -2.42 -0.01 0.00 -0.02 0.00 0.00 33.50 31.68 3dzm n PRO 142 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3dzm n ASN 143 N 7.72 -3.78 -3.78 2.55 3.02 -1.26 -4.97 115.26 114.75 3dzm n ASN 143 Ca 0.32 0.06 -0.19 0.00 -0.03 0.00 0.00 54.58 54.74 3dzm n ASN 143 Cb 0.22 -1.51 -0.17 0.00 -0.61 0.00 0.00 39.78 37.71 3dzm n ASN 143 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3dzm s LEU 144 N -0.59 0.85 0.07 3.41 2.96 -0.92 -0.15 118.68 124.31 3dzm s LEU 144 Ca 0.00 -0.03 0.06 0.00 -0.22 0.00 0.00 54.13 53.94 3dzm s LEU 144 Cb 0.00 -0.27 -0.03 0.00 0.50 0.00 0.00 46.19 46.39 3dzm s LEU 144 CO 0.00 -0.15 -0.16 -0.94 -1.32 0.00 0.00 176.35 173.78 3dzm s SER 145 N 1.45 1.88 0.22 3.68 1.04 -0.65 -1.04 113.70 120.28 3dzm s SER 145 Ca -0.04 -0.60 -0.30 0.00 0.48 0.00 0.00 55.95 55.49 3dzm s SER 145 Cb -0.13 -0.08 -0.09 0.00 0.10 0.00 0.00 66.02 65.82 3dzm s SER 145 CO -0.03 -0.02 1.23 -0.22 0.98 0.00 0.00 173.24 175.18 3dzm s LEU 146 N -1.66 4.45 -0.06 2.42 2.96 0.33 -1.21 118.68 125.90 3dzm s LEU 146 Ca 0.01 2.34 0.03 0.00 -0.22 0.00 0.00 54.13 56.29 3dzm s LEU 146 Cb -0.10 -3.62 0.01 0.00 0.50 0.00 0.00 46.19 42.99 3dzm s LEU 146 CO 0.03 -0.41 -0.13 -0.69 -1.32 0.00 0.00 176.35 173.83 3dzm s VAL 147 N -0.28 1.18 -0.04 1.68 1.01 0.30 -0.52 120.40 123.72 3dzm s VAL 147 Ca 0.52 -0.52 0.04 0.00 0.00 0.00 0.00 61.98 62.03 3dzm s VAL 147 Cb -0.35 -1.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 3dzm s VAL 147 CO 0.40 0.36 -0.16 -0.83 0.00 0.00 0.00 175.10 174.86 3dzm s GLY 148 N 0.55 1.49 -0.07 4.51 0.00 0.64 -1.19 107.32 113.25 3dzm s GLY 148 Ca -0.13 -1.01 -0.03 0.00 0.00 0.00 0.00 44.72 43.55 3dzm s GLY 148 CO 0.04 -0.81 0.11 -0.35 0.00 0.00 0.00 173.10 172.09 3dzm s ASP 149 N -0.73 1.06 -0.13 1.64 2.15 -0.15 -0.24 116.67 120.26 3dzm s ASP 149 Ca 0.11 0.14 0.02 0.00 0.43 0.00 0.00 52.55 53.25 3dzm s ASP 149 Cb -0.10 0.04 0.01 0.00 -0.30 0.00 0.00 42.92 42.57 3dzm s ASP 149 CO 0.00 -0.26 -0.19 -0.22 -0.17 0.00 0.00 175.17 174.33 3dzm s LEU 150 N 2.22 1.96 0.30 -1.34 0.20 -0.82 -0.31 118.68 120.89 3dzm s LEU 150 Ca 0.04 -0.54 -0.09 0.00 0.69 0.00 0.00 54.13 54.23 3dzm s LEU 150 Cb -0.12 -1.31 0.00 0.00 -0.43 0.00 0.00 46.19 44.33 3dzm s LEU 150 CO -0.05 0.05 0.51 -0.83 -0.29 0.00 0.00 176.35 175.74 3dzm s GLY 151 N 0.89 0.87 -0.02 7.98 0.00 0.56 -0.86 107.32 116.73 3dzm s GLY 151 Ca -0.07 -1.10 0.02 0.00 0.00 0.00 0.00 44.72 43.57 3dzm s GLY 151 CO -0.02 -0.73 -0.07 0.14 0.00 0.00 0.00 173.10 172.42 3dzm s VAL 152 N -3.48 0.57 0.06 1.40 1.01 -0.40 0.23 120.40 119.79 3dzm s VAL 152 Ca 0.25 -0.26 0.08 0.00 0.00 0.00 0.00 61.98 62.04 3dzm s VAL 152 Cb -0.01 -0.51 -0.03 0.00 0.00 0.00 0.00 36.38 35.84 3dzm s VAL 152 CO 0.13 0.18 -0.21 -1.81 0.00 0.00 0.00 175.10 173.39 3dzm s ASP 153 N 0.11 2.50 -0.08 3.32 1.01 -0.22 -1.68 116.67 121.65 3dzm s ASP 153 Ca -0.01 -0.57 0.04 0.00 0.71 0.00 0.00 52.55 52.71 3dzm s ASP 153 Cb -0.06 -0.19 -0.01 0.00 1.01 0.00 0.00 42.92 43.67 3dzm s ASP 153 CO -0.00 0.13 -0.20 -0.47 0.21 0.00 0.00 175.17 174.84 3dzm s TYR 154 N -0.91 2.60 -0.11 4.23 5.04 0.19 -0.88 117.35 127.51 3dzm s TYR 154 Ca 0.07 -0.62 0.00 0.00 -2.44 0.00 0.00 57.07 54.09 3dzm s TYR 154 Cb -0.09 -1.68 -0.02 0.00 0.35 0.00 0.00 41.96 40.52 3dzm s TYR 154 CO 0.03 -0.15 -0.12 0.71 -1.34 0.00 0.00 175.55 174.68 3dzm s TYR 155 N -0.11 2.83 0.11 4.97 2.02 0.48 -0.83 117.35 126.82 3dzm s TYR 155 Ca -0.04 -0.44 -0.30 0.00 -0.37 0.00 0.00 57.07 55.92 3dzm s TYR 155 Cb -0.14 -1.80 -0.07 0.00 -0.40 0.00 0.00 41.96 39.55 3dzm s TYR 155 CO 0.04 -0.06 1.16 -0.06 -1.57 0.00 0.00 175.55 175.07 3dzm s PHE 156 N 0.02 3.49 0.33 2.71 0.08 -1.02 -4.66 117.98 118.93 3dzm s PHE 156 Ca -0.03 1.42 -0.29 0.00 0.12 0.00 0.00 56.93 58.15 3dzm s PHE 156 Cb -0.14 -3.37 -0.12 0.00 -0.57 0.00 0.00 43.02 38.81 3dzm s PHE 156 CO 0.04 -1.04 1.36 0.00 -0.10 0.00 0.00 175.22 175.47 3dzm n GLN 157 N 3.23 2.23 -3.21 0.44 10.64 -1.26 -4.50 117.38 124.96 3dzm n GLN 157 Ca 0.06 0.78 -0.13 0.00 -1.83 0.00 0.00 57.00 55.89 3dzm n GLN 157 Cb 0.46 -2.41 -0.04 0.00 -0.86 0.00 0.00 30.24 27.39 3dzm n GLN 157 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3dzm n ALA 158 N 0.70 0.28 -1.49 2.61 0.00 -1.26 -4.98 120.51 116.37 3dzm n ALA 158 Ca 0.05 -1.04 -0.33 0.00 0.00 0.00 0.00 53.44 52.13 3dzm n ALA 158 Cb 0.36 0.69 0.05 0.00 0.00 0.00 0.00 19.45 20.55 3dzm n ALA 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dzm s PHE 160 N -2.39 2.82 -0.17 0.00 0.08 -0.35 -4.39 117.98 113.59 3dzm s PHE 160 Ca 0.66 -0.08 0.01 0.00 0.12 0.00 0.00 56.93 57.64 3dzm s PHE 160 Cb -0.20 -1.59 0.03 0.00 -0.57 0.00 0.00 43.02 40.68 3dzm s PHE 160 CO 0.43 0.33 -0.14 0.99 -0.10 0.00 0.00 175.22 176.73 3dzm s THR 161 N -0.95 1.70 -0.11 0.64 2.01 -0.25 -1.79 115.64 116.90 3dzm s THR 161 Ca 0.16 -0.80 -0.10 0.00 0.31 0.00 0.00 61.69 61.26 3dzm s THR 161 Cb -0.11 -1.63 -0.05 0.00 0.01 0.00 0.00 72.50 70.73 3dzm s THR 161 CO 0.06 0.40 0.21 -0.60 -0.69 0.00 0.00 174.62 174.00 3dzm s ARG 162 N 1.42 3.72 -0.16 4.92 3.52 0.06 -1.42 118.95 131.01 3dzm s ARG 162 Ca 0.03 -0.01 -0.01 0.00 -0.13 0.00 0.00 55.73 55.62 3dzm s ARG 162 Cb -0.14 -3.25 0.04 0.00 -1.56 0.00 0.00 34.95 30.04 3dzm s ARG 162 CO -0.11 0.64 -0.04 0.08 -0.81 0.00 0.00 175.30 175.06 3dzm s VAL 163 N -0.69 1.00 0.04 7.11 1.01 0.41 -1.99 120.40 127.29 3dzm s VAL 163 Ca 0.16 -0.56 -0.10 0.00 0.00 0.00 0.00 61.98 61.48 3dzm s VAL 163 Cb -0.13 -1.20 -0.05 0.00 0.00 0.00 0.00 36.38 35.00 3dzm s VAL 163 CO 0.05 0.11 0.36 -1.61 0.00 0.00 0.00 175.10 174.02 3dzm s GLU 164 N 1.68 3.74 -0.08 2.72 2.02 -0.95 -1.22 118.70 126.61 3dzm s GLU 164 Ca 0.01 0.16 0.02 0.00 0.02 0.00 0.00 54.97 55.18 3dzm s GLU 164 Cb -0.15 -3.07 0.02 0.00 0.10 0.00 0.00 34.13 31.03 3dzm s GLU 164 CO -0.08 0.61 -0.11 -2.00 0.02 0.00 0.00 175.26 173.71 3dzm s GLU 165 N -1.67 1.70 0.87 1.61 2.12 -0.48 -1.65 118.70 121.20 3dzm s GLU 165 Ca 0.29 -0.39 -0.15 0.00 0.36 0.00 0.00 54.97 55.09 3dzm s GLU 165 Cb -0.14 -1.49 0.20 0.00 0.26 0.00 0.00 34.13 32.96 3dzm s GLU 165 CO 0.16 -0.05 1.17 -0.25 -0.54 0.00 0.00 175.26 175.75 3dzm n ASP 166 N 4.12 0.03 0.07 -1.70 9.92 -0.25 -2.82 116.55 125.91 3dzm n ASP 166 Ca -0.20 -1.42 -0.16 0.00 -0.53 0.00 0.00 54.79 52.49 3dzm n ASP 166 Cb 0.51 -0.90 -0.07 0.00 -0.64 0.00 0.00 41.12 40.02 3dzm n ASP 166 CO 0.00 0.00 0.00 0.44 0.13 0.00 0.00 177.20 177.77 3dzm h ASP 167 N -1.58 0.63 0.50 -2.24 3.32 -1.88 -2.85 116.42 112.33 3dzm h ASP 167 Ca -0.38 -0.52 0.00 0.00 0.02 0.00 0.00 57.03 56.15 3dzm h ASP 167 Cb 1.05 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.41 3dzm h ASP 167 CO 0.27 1.32 0.00 -1.20 -1.72 0.00 0.00 179.24 177.91 3dzm n SER 168 N -3.76 0.48 0.00 6.45 7.64 -1.26 -4.85 113.62 118.32 3dzm n SER 168 Ca -0.08 0.64 0.00 0.00 1.01 0.00 0.00 58.87 60.44 3dzm n SER 168 Cb 0.87 -0.73 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 3dzm n SER 168 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dzm n GLY 169 N -0.34 0.79 3.77 0.23 0.00 -1.07 -5.07 105.19 103.49 3dzm n GLY 169 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 3dzm n GLY 169 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3dzm s ASN 170 N -2.41 6.99 0.02 1.61 0.02 -1.26 -4.74 114.94 115.17 3dzm s ASN 170 Ca 0.00 2.25 0.08 0.00 -1.02 0.00 0.00 52.86 54.17 3dzm s ASN 170 Cb 0.00 -2.62 -0.02 0.00 0.02 0.00 0.00 41.25 38.63 3dzm s ASN 170 CO 0.00 -0.34 -0.23 -0.54 0.02 0.00 0.00 177.10 176.01 3dzm s LYS 171 N -1.85 1.68 0.09 -0.60 1.02 -1.26 -1.09 119.74 117.72 3dzm s LYS 171 Ca 0.50 -0.96 0.09 0.00 0.02 0.00 0.00 55.97 55.62 3dzm s LYS 171 Cb -0.30 -1.76 -0.03 0.00 -0.52 0.00 0.00 37.83 35.22 3dzm s LYS 171 CO 0.38 0.46 -0.23 0.45 -0.92 0.00 0.00 175.35 175.49 3dzm s SER 172 N -0.98 2.85 0.00 2.83 0.15 -0.66 -5.01 113.70 112.88 3dzm s SER 172 Ca 0.09 -0.65 -0.03 0.00 0.70 0.00 0.00 55.95 56.06 3dzm s SER 172 Cb -0.09 -0.20 -0.01 0.00 -1.71 0.00 0.00 66.02 64.01 3dzm s SER 172 CO 0.01 0.15 0.06 -1.58 1.20 0.00 0.00 173.24 173.08 3dzm s GLN 173 N -1.66 0.31 0.32 5.44 0.74 -1.26 -2.24 119.66 121.31 3dzm s GLN 173 Ca 0.10 -0.35 -0.17 0.00 0.05 0.00 0.00 55.36 54.98 3dzm s GLN 173 Cb -0.10 0.12 0.03 0.00 1.10 0.00 0.00 33.01 34.17 3dzm s GLN 173 CO 0.04 -0.06 0.71 -1.54 -0.55 0.00 0.00 175.29 173.88 3dzm s SER 174 N -1.05 -0.07 -0.17 6.67 1.04 -0.84 -5.01 113.70 114.28 3dzm s SER 174 Ca -0.11 -0.91 -0.24 0.00 0.48 0.00 0.00 55.95 55.17 3dzm s SER 174 Cb -0.07 0.76 0.06 0.00 0.10 0.00 0.00 66.02 66.87 3dzm s SER 174 CO 0.00 -1.46 0.63 -0.94 0.98 0.00 0.00 173.24 172.44 3dzm s SER 175 N -3.01 -0.63 0.04 7.02 1.04 -1.26 -0.76 113.70 116.14 3dzm s SER 175 Ca 0.15 1.04 0.08 0.00 0.48 0.00 0.00 55.95 57.70 3dzm s SER 175 Cb -0.05 1.01 -0.03 0.00 0.10 0.00 0.00 66.02 67.06 3dzm s SER 175 CO 0.10 -0.35 -0.24 -0.69 0.98 0.00 0.00 173.24 173.04 3dzm s VAL 176 N -0.22 2.35 0.32 5.02 1.01 -0.74 -4.97 120.40 123.18 3dzm s VAL 176 Ca -0.04 -1.29 0.10 0.00 0.00 0.00 0.00 61.98 60.74 3dzm s VAL 176 Cb -0.03 -1.93 -0.05 0.00 0.00 0.00 0.00 36.38 34.36 3dzm s VAL 176 CO 0.04 0.38 -0.04 0.00 0.00 0.00 0.00 175.10 175.48 3dzm s PRO 178 N -3.67 4.29 -0.54 0.00 0.05 -1.26 0.55 135.00 134.42 3dzm s PRO 178 Ca 0.33 1.11 0.04 0.00 0.05 0.00 0.00 61.00 62.53 3dzm s PRO 178 Cb -0.01 -3.59 0.15 0.00 0.05 0.00 0.00 34.50 31.09 3dzm s PRO 178 CO 0.18 -0.41 0.34 0.20 0.05 0.00 0.00 177.00 177.36 3dzm s GLY 179 N 1.19 2.20 0.26 0.56 0.00 -1.26 -5.03 107.32 105.24 3dzm s GLY 179 Ca 0.40 -3.13 -0.04 0.00 0.00 0.00 0.00 44.72 41.94 3dzm s GLY 179 CO 0.11 1.34 0.35 1.22 0.00 0.00 0.00 173.10 176.12 3dzm n ASP 180 N 2.86 0.03 0.00 1.64 8.00 0.19 -5.00 116.55 124.27 3dzm n ASP 180 Ca 0.14 -1.13 0.00 0.00 0.71 0.00 0.00 54.79 54.51 3dzm n ASP 180 Cb 0.36 -0.27 0.00 0.00 -0.02 0.00 0.00 41.12 41.19 3dzm n ASP 180 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 3dzm n SER 181 N -3.23 0.00 -1.45 -2.24 2.88 -1.26 -3.37 113.62 104.95 3dzm n SER 181 Ca 0.04 0.90 -0.08 0.00 -1.33 0.00 0.00 58.87 58.40 3dzm n SER 181 Cb 0.15 -0.40 0.08 0.00 -0.75 0.00 0.00 64.21 63.29 3dzm n SER 181 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3dzm n GLY 182 N -0.90 2.91 0.12 0.46 0.00 -1.26 -4.44 105.19 102.09 3dzm n GLY 182 Ca 0.00 -0.43 -0.14 0.00 0.00 0.00 0.00 46.02 45.46 3dzm n GLY 182 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3dzm h TYR 183 N 0.49 0.39 -0.62 1.61 3.20 -1.82 -1.82 116.97 118.40 3dzm h TYR 183 Ca 0.23 -0.14 0.12 0.00 3.14 0.00 0.00 58.73 62.08 3dzm h TYR 183 Cb 1.69 -0.07 -0.09 0.00 1.54 0.00 0.00 36.73 39.80 3dzm h TYR 183 CO 0.62 0.80 0.13 0.93 -1.64 0.00 0.00 178.16 179.00 3dzm h GLU 184 N -0.14 0.25 0.32 1.82 4.39 -1.85 0.24 114.58 119.61 3dzm h GLU 184 Ca 0.00 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 3dzm h GLU 184 Cb 0.78 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.38 3dzm h GLU 184 CO 0.04 0.17 -0.15 -0.44 -1.16 0.00 0.00 179.01 177.47 3dzm h ASP 185 N 0.26 -0.36 -0.79 1.42 3.32 -1.88 -2.05 116.42 116.34 3dzm h ASP 185 Ca 0.33 -0.15 0.17 0.00 0.02 0.00 0.00 57.03 57.41 3dzm h ASP 185 Cb 0.50 0.09 -0.11 0.00 0.22 0.00 0.00 39.33 40.03 3dzm h ASP 185 CO -0.42 -0.04 0.26 0.58 -1.72 0.00 0.00 179.24 177.90 3dzm h VAL 186 N -0.70 0.52 0.00 -1.35 2.07 -0.92 -1.53 116.25 114.35 3dzm h VAL 186 Ca -0.04 -0.12 -0.08 0.00 0.82 0.00 0.00 66.70 67.28 3dzm h VAL 186 Cb 0.48 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 3dzm h VAL 186 CO 0.07 0.06 -0.40 -1.13 0.02 0.00 0.00 177.57 176.19 3dzm h ASN 187 N 0.34 0.00 0.85 0.57 -1.24 -0.38 -0.34 115.58 115.38 3dzm h ASN 187 Ca 0.46 0.00 -0.10 0.00 0.71 0.00 0.00 56.30 57.37 3dzm h ASN 187 Cb 0.80 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.83 3dzm h ASN 187 CO -0.50 0.40 -0.47 0.11 -1.29 0.00 0.00 177.43 175.68 3dzm h LYS 188 N 0.00 0.00 0.08 6.67 1.57 -0.55 -3.31 116.57 121.03 3dzm h LYS 188 Ca -0.00 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.41 3dzm h LYS 188 Cb 0.72 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.00 3dzm h LYS 188 CO 0.05 0.47 -2.10 0.34 -0.57 0.00 0.00 179.45 177.64 3dzm n PHE 189 N -3.56 0.90 -3.04 -1.35 7.35 -0.97 -4.81 117.46 111.98 3dzm n PHE 189 Ca -0.00 0.20 -0.40 0.00 -0.76 0.00 0.00 57.45 56.49 3dzm n PHE 189 Cb 0.57 -1.12 -0.05 0.00 0.35 0.00 0.00 39.48 39.23 3dzm n PHE 189 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 3dzm s VAL 190 N -2.55 4.91 -0.57 -2.13 1.01 -0.17 -1.09 120.40 119.80 3dzm s VAL 190 Ca -0.23 1.50 -0.02 0.00 0.00 0.00 0.00 61.98 63.23 3dzm s VAL 190 Cb 0.07 -4.06 0.34 0.00 0.00 0.00 0.00 36.38 32.73 3dzm s VAL 190 CO 0.74 0.31 2.09 0.41 0.00 0.00 0.00 175.10 178.65 3dzm n THR 191 N 3.28 3.36 -1.44 3.92 -1.04 0.11 -4.82 114.28 117.65 3dzm n THR 191 Ca -0.02 -2.72 -0.30 0.00 -2.04 0.00 0.00 64.05 58.96 3dzm n THR 191 Cb 0.51 -1.25 0.11 0.00 -1.82 0.00 0.00 70.33 67.87 3dzm n THR 191 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3dzm s GLN 192 N -3.12 1.77 0.49 -2.82 0.00 -1.26 -4.77 119.66 109.96 3dzm s GLN 192 Ca 0.53 0.68 -0.24 0.00 -0.00 0.00 0.00 55.36 56.33 3dzm s GLN 192 Cb 0.42 -1.88 -0.07 0.00 0.00 0.00 0.00 33.01 31.48 3dzm s GLN 192 CO -0.07 -1.85 1.39 -2.30 0.00 0.00 0.00 175.29 172.45 3dzm n PRO 193 N -3.59 1.98 0.00 9.60 -0.02 -1.26 -4.93 135.00 136.77 3dzm n PRO 193 Ca 0.07 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 3dzm n PRO 193 Cb 0.56 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 3dzm n PRO 193 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3dzm n GLU 194 N -0.53 0.00 -3.72 -0.52 2.13 -1.26 -4.72 120.64 112.01 3dzm n GLU 194 Ca 0.08 0.00 -0.36 0.00 0.66 0.00 0.00 57.16 57.54 3dzm n GLU 194 Cb 0.43 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 32.07 3dzm n GLU 194 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 3dzm s TRP 195 N -0.14 3.50 -0.11 4.31 0.52 -1.26 -0.39 118.94 125.37 3dzm s TRP 195 Ca 0.00 0.48 -0.00 0.00 0.02 0.00 0.00 56.10 56.60 3dzm s TRP 195 Cb 0.00 -2.14 0.02 0.00 -1.15 0.00 0.00 33.47 30.21 3dzm s TRP 195 CO 0.00 0.44 -0.07 0.08 0.02 0.00 0.00 176.95 177.42 3dzm s VAL 196 N -0.13 0.94 -0.01 4.03 1.01 -0.05 -4.97 120.40 121.21 3dzm s VAL 196 Ca 0.13 -0.24 -0.30 0.00 0.00 0.00 0.00 61.98 61.57 3dzm s VAL 196 Cb -0.12 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 3dzm s VAL 196 CO 0.02 0.35 1.09 -0.22 0.00 0.00 0.00 175.10 176.34 3dzm s LEU 197 N 1.70 4.33 -0.16 3.92 2.96 -1.26 -1.05 118.68 129.12 3dzm s LEU 197 Ca 0.04 1.78 0.00 0.00 -0.22 0.00 0.00 54.13 55.73 3dzm s LEU 197 Cb -0.13 -3.57 -0.00 0.00 0.50 0.00 0.00 46.19 42.99 3dzm s LEU 197 CO -0.07 -0.41 -0.15 -0.75 -1.32 0.00 0.00 176.35 173.64 3dzm s LYS 198 N 1.41 3.22 -0.26 1.98 2.20 0.14 -3.76 119.74 124.67 3dzm s LYS 198 Ca 0.54 -0.74 -0.04 0.00 -0.36 0.00 0.00 55.97 55.37 3dzm s LYS 198 Cb -0.24 -2.64 0.09 0.00 -1.51 0.00 0.00 37.83 33.53 3dzm s LYS 198 CO 0.26 0.00 0.12 -1.17 -0.36 0.00 0.00 175.35 174.20 3dzm s LEU 199 N 0.86 0.56 0.02 5.43 2.96 -0.14 -0.32 118.68 128.05 3dzm s LEU 199 Ca -0.04 -1.13 0.05 0.00 -0.22 0.00 0.00 54.13 52.78 3dzm s LEU 199 Cb -0.15 -0.35 -0.02 0.00 0.50 0.00 0.00 46.19 46.17 3dzm s LEU 199 CO -0.01 -0.42 -0.15 -0.13 -1.32 0.00 0.00 176.35 174.33 3dzm s ARG 200 N 2.09 1.07 0.01 1.98 0.52 0.58 -0.12 118.95 125.08 3dzm s ARG 200 Ca 0.07 -0.71 0.03 0.00 -0.52 0.00 0.00 55.73 54.59 3dzm s ARG 200 Cb -0.16 -1.08 -0.04 0.00 0.52 0.00 0.00 34.95 34.19 3dzm s ARG 200 CO -0.29 0.28 -0.04 -0.51 0.02 0.00 0.00 175.30 174.76 3dzm s LEU 201 N -0.90 3.33 0.00 2.53 1.43 -0.32 -0.98 118.68 123.76 3dzm s LEU 201 Ca 0.04 -0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.04 3dzm s LEU 201 Cb -0.07 -1.92 0.00 0.00 0.03 0.00 0.00 46.19 44.23 3dzm s LEU 201 CO 0.01 0.28 0.00 0.61 0.23 0.00 0.00 176.35 177.47 3dzm n GLY 202 N 1.43 1.17 3.04 -3.19 0.00 -0.33 -0.06 105.19 107.24 3dzm n GLY 202 Ca -0.15 -0.84 -0.10 0.00 0.00 0.00 0.00 46.02 44.94 3dzm n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dzm s ALA 203 N -1.00 0.38 -0.06 4.61 0.00 -0.34 -0.54 121.76 124.80 3dzm s ALA 203 Ca 0.00 -0.81 0.03 0.00 0.00 0.00 0.00 51.96 51.18 3dzm s ALA 203 Cb 0.00 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.27 3dzm s ALA 203 CO 0.00 -0.17 -0.16 0.00 0.00 0.00 0.00 175.76 175.43 3dzm s ALA 204 N -2.07 1.49 -0.23 0.00 0.00 -0.35 -1.63 121.76 118.97 3dzm s ALA 204 Ca -0.08 -0.61 -0.06 0.00 0.00 0.00 0.00 51.96 51.22 3dzm s ALA 204 Cb -0.05 -0.57 -0.02 0.00 0.00 0.00 0.00 23.12 22.47 3dzm s ALA 204 CO -0.03 0.21 0.02 -0.47 0.00 0.00 0.00 175.76 175.50 3dzm s TYR 205 N 0.35 3.04 0.72 0.00 5.04 0.05 -1.64 117.35 124.91 3dzm s TYR 205 Ca -0.11 -0.57 -0.11 0.00 -2.44 0.00 0.00 57.07 53.84 3dzm s TYR 205 Cb -0.14 -2.17 0.03 0.00 0.35 0.00 0.00 41.96 40.03 3dzm s TYR 205 CO 0.04 -0.39 1.09 0.50 -1.34 0.00 0.00 175.55 175.45 3dzm s ARG 206 N 1.45 2.58 0.00 4.97 3.52 0.79 -1.73 118.95 130.53 3dzm s ARG 206 Ca 0.05 0.26 0.00 0.00 -0.13 0.00 0.00 55.73 55.92 3dzm s ARG 206 Cb -0.15 -2.04 0.00 0.00 -1.56 0.00 0.00 34.95 31.20 3dzm s ARG 206 CO 0.01 -1.16 0.00 1.97 -0.81 0.00 0.00 175.30 175.31