#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dzm n ALA 1 N 0.00 -0.02 -1.78 1.57 0.00 -1.26 -4.90 120.51 114.12 3dzm n ALA 1 Ca 0.00 0.02 -0.41 0.00 0.00 0.00 0.00 53.44 53.06 3dzm n ALA 1 Cb 0.00 -0.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.98 3dzm n ALA 1 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dzm s ALA 2 N -1.98 3.46 -0.07 0.00 0.00 -1.26 -5.00 121.76 116.91 3dzm s ALA 2 Ca 0.00 1.12 -0.17 0.00 0.00 0.00 0.00 51.96 52.91 3dzm s ALA 2 Cb 0.00 -3.42 -0.05 0.00 0.00 0.00 0.00 23.12 19.65 3dzm s ALA 2 CO 0.00 -0.45 0.45 0.15 0.00 0.00 0.00 175.76 175.90 3dzm s LYS 3 N -1.58 4.19 -0.08 0.00 1.02 -0.89 -4.94 119.74 117.46 3dzm s LYS 3 Ca 0.48 0.43 0.04 0.00 0.02 0.00 0.00 55.97 56.94 3dzm s LYS 3 Cb -0.37 -3.35 -0.01 0.00 -0.52 0.00 0.00 37.83 33.58 3dzm s LYS 3 CO 0.48 0.37 -0.20 -0.06 -0.92 0.00 0.00 175.35 175.01 3dzm s PHE 4 N -0.06 2.59 0.07 3.18 0.08 -1.26 -1.02 117.98 121.56 3dzm s PHE 4 Ca 0.25 -0.68 0.08 0.00 0.12 0.00 0.00 56.93 56.70 3dzm s PHE 4 Cb -0.16 -1.68 -0.03 0.00 -0.57 0.00 0.00 43.02 40.58 3dzm s PHE 4 CO 0.11 -0.19 -0.22 -1.12 -0.10 0.00 0.00 175.22 173.71 3dzm s SER 5 N -0.03 2.60 -0.10 1.36 0.01 -0.26 -1.69 113.70 115.59 3dzm s SER 5 Ca -0.06 -0.60 -0.20 0.00 1.31 0.00 0.00 55.95 56.40 3dzm s SER 5 Cb -0.15 -0.19 -0.04 0.00 0.21 0.00 0.00 66.02 65.86 3dzm s SER 5 CO 0.05 0.13 0.54 -0.69 0.41 0.00 0.00 173.24 173.68 3dzm s VAL 6 N -0.95 5.15 0.02 3.43 1.01 -0.55 -0.50 120.40 128.00 3dzm s VAL 6 Ca 0.08 1.10 0.08 0.00 0.00 0.00 0.00 61.98 63.24 3dzm s VAL 6 Cb -0.09 -3.88 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 3dzm s VAL 6 CO 0.03 0.30 -0.26 -0.70 0.00 0.00 0.00 175.10 174.48 3dzm s GLU 7 N 0.67 1.89 -0.04 2.72 2.12 0.91 -0.48 118.70 126.49 3dzm s GLU 7 Ca 0.29 -1.01 0.01 0.00 0.36 0.00 0.00 54.97 54.63 3dzm s GLU 7 Cb -0.16 -1.95 0.02 0.00 0.26 0.00 0.00 34.13 32.30 3dzm s GLU 7 CO 0.13 0.52 -0.05 0.00 -0.54 0.00 0.00 175.26 175.31 3dzm s ALA 8 N -0.71 0.70 0.06 6.30 0.00 -0.75 -1.20 121.76 126.16 3dzm s ALA 8 Ca 0.11 -0.07 -0.02 0.00 0.00 0.00 0.00 51.96 51.97 3dzm s ALA 8 Cb -0.10 -0.41 -0.03 0.00 0.00 0.00 0.00 23.12 22.58 3dzm s ALA 8 CO 0.01 0.01 0.01 0.20 0.00 0.00 0.00 175.76 175.99 3dzm s GLY 9 N 0.85 0.43 0.02 0.00 0.00 -0.29 -1.67 107.32 106.66 3dzm s GLY 9 Ca -0.12 -1.12 0.06 0.00 0.00 0.00 0.00 44.72 43.54 3dzm s GLY 9 CO 0.01 -1.23 -0.17 0.00 0.00 0.00 0.00 173.10 171.70 3dzm s ALA 10 N -3.92 1.41 0.00 3.20 0.00 -0.32 -0.17 121.76 121.97 3dzm s ALA 10 Ca 0.07 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.18 3dzm s ALA 10 Cb 0.07 -0.29 0.00 0.00 0.00 0.00 0.00 23.12 22.91 3dzm s ALA 10 CO -0.10 0.31 0.00 0.41 0.00 0.00 0.00 175.76 176.39 3dzm n GLY 11 N 2.15 -0.52 3.78 0.00 0.00 0.32 -1.63 105.19 109.29 3dzm n GLY 11 Ca -0.17 -0.75 -0.37 0.00 0.00 0.00 0.00 46.02 44.74 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 -3.96 3.54 -0.41 1.61 5.36 0.97 -1.77 117.98 123.31 3dzm s PHE 12 Ca 0.00 0.63 0.08 0.00 -0.96 0.00 0.00 56.93 56.68 3dzm s PHE 12 Cb 0.00 -2.22 0.28 0.00 -0.34 0.00 0.00 43.02 40.75 3dzm s PHE 12 CO 0.00 0.44 0.72 0.98 -1.46 0.00 0.00 175.22 175.90 3dzm n TYR 13 N 2.86 -1.07 -3.68 10.12 9.36 -1.25 -0.42 117.16 133.08 3dzm n TYR 13 Ca -0.15 -3.13 -0.27 0.00 3.32 0.00 0.00 57.90 57.68 3dzm n TYR 13 Cb 0.53 0.22 0.04 0.00 -0.63 0.00 0.00 39.34 39.50 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 1.02 -0.79 0.00 2.98 0.00 -1.20 -4.79 105.19 102.41 3dzm n GLY 14 Ca 0.18 0.37 0.00 0.00 0.00 0.00 0.00 46.02 46.57 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 -1.66 3.90 3.86 -0.02 0.00 -1.26 -4.63 105.19 105.40 3dzm n GLY 15 Ca -0.16 -1.68 -0.36 0.00 0.00 0.00 0.00 46.02 43.83 3dzm n GLY 15 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dzm s PHE 16 N -2.39 3.53 0.00 1.61 0.08 -1.25 -4.29 117.98 115.27 3dzm s PHE 16 Ca 0.00 0.43 0.00 0.00 0.12 0.00 0.00 56.93 57.48 3dzm s PHE 16 Cb 0.00 -1.88 0.00 0.00 -0.57 0.00 0.00 43.02 40.57 3dzm s PHE 16 CO 0.00 0.68 0.00 0.41 -0.10 0.00 0.00 175.22 176.21 3dzm n GLY 17 N 1.65 -0.70 2.72 4.36 0.00 -0.73 -1.41 105.19 111.08 3dzm n GLY 17 Ca -0.17 0.09 -0.02 0.00 0.00 0.00 0.00 46.02 45.92 3dzm n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dzm n GLY 18 N 0.00 0.79 2.98 -0.02 0.00 -0.13 -0.52 105.19 108.28 3dzm n GLY 18 Ca 0.00 -1.08 -0.12 0.00 0.00 0.00 0.00 46.02 44.83 3dzm n GLY 18 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3dzm s GLN 19 N -2.03 0.19 -0.09 1.61 0.74 0.76 -0.78 119.66 120.06 3dzm s GLN 19 Ca 0.16 -0.09 0.04 0.00 0.05 0.00 0.00 55.36 55.52 3dzm s GLN 19 Cb -0.02 0.08 0.00 0.00 1.10 0.00 0.00 33.01 34.17 3dzm s GLN 19 CO 0.04 -0.03 -0.22 -1.17 -0.55 0.00 0.00 175.29 173.35 3dzm s LEU 20 N -0.44 2.02 0.04 3.68 2.96 -0.14 -1.14 118.68 125.65 3dzm s LEU 20 Ca -0.05 -0.51 -0.08 0.00 -0.22 0.00 0.00 54.13 53.27 3dzm s LEU 20 Cb -0.03 -1.31 -0.00 0.00 0.50 0.00 0.00 46.19 45.35 3dzm s LEU 20 CO 0.00 0.15 0.16 0.00 -1.32 0.00 0.00 176.35 175.34 3dzm s ALA 21 N 0.34 -0.25 -0.13 5.97 0.00 -0.34 -0.11 121.76 127.24 3dzm s ALA 21 Ca -0.17 -0.39 -0.04 0.00 0.00 0.00 0.00 51.96 51.36 3dzm s ALA 21 Cb -0.17 0.27 -0.04 0.00 0.00 0.00 0.00 23.12 23.19 3dzm s ALA 21 CO 0.08 -0.35 0.04 0.08 0.00 0.00 0.00 175.76 175.60 3dzm s VAL 22 N -2.61 4.58 -0.05 0.00 1.01 -0.33 -0.06 120.40 122.93 3dzm s VAL 22 Ca -0.05 -0.13 0.06 0.00 0.00 0.00 0.00 61.98 61.86 3dzm s VAL 22 Cb -0.01 -2.99 -0.01 0.00 0.00 0.00 0.00 36.38 33.37 3dzm s VAL 22 CO -0.04 0.56 -0.23 -0.69 0.00 0.00 0.00 175.10 174.69 3dzm s VAL 23 N -0.42 2.24 -0.17 2.92 1.01 0.35 -1.01 120.40 125.31 3dzm s VAL 23 Ca 0.09 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 61.06 3dzm s VAL 23 Cb -0.12 -1.82 0.02 0.00 0.00 0.00 0.00 36.38 34.47 3dzm s VAL 23 CO 0.02 0.57 -0.17 0.00 0.00 0.00 0.00 175.10 175.52 3dzm s ALA 24 N -0.30 2.18 0.33 5.51 0.00 0.41 -1.10 121.76 128.79 3dzm s ALA 24 Ca 0.01 -1.15 0.10 0.00 0.00 0.00 0.00 51.96 50.92 3dzm s ALA 24 Cb -0.13 -1.16 -0.06 0.00 0.00 0.00 0.00 23.12 21.77 3dzm s ALA 24 CO 0.02 -0.42 -0.06 -1.21 0.00 0.00 0.00 175.76 174.10 3dzm s GLU 25 N 1.35 1.94 -1.05 0.00 2.02 -0.19 -1.20 118.70 121.57 3dzm s GLU 25 Ca 0.04 -1.81 -0.17 0.00 0.02 0.00 0.00 54.97 53.06 3dzm s GLU 25 Cb -0.13 -1.83 -0.00 0.00 0.10 0.00 0.00 34.13 32.26 3dzm s GLU 25 CO -0.12 0.17 0.75 -0.25 0.02 0.00 0.00 175.26 175.84 3dzm n ASP 26 N -0.85 -5.50 0.01 -0.19 8.00 -1.23 -2.09 116.55 114.71 3dzm n ASP 26 Ca -0.05 -0.92 -0.12 0.00 0.71 0.00 0.00 54.79 54.41 3dzm n ASP 26 Cb 0.62 -3.25 -0.09 0.00 -0.02 0.00 0.00 41.12 38.38 3dzm n ASP 26 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3dzm h LEU 27 N -1.44 -0.09-10.31 0.64 3.38 -1.77 -3.36 115.31 102.36 3dzm h LEU 27 Ca -0.59 -0.50 -0.47 0.00 0.09 0.00 0.00 57.88 56.42 3dzm h LEU 27 Cb 1.33 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.09 3dzm h LEU 27 CO 0.45 0.51 -0.31 0.00 0.09 0.00 0.00 178.44 179.17 3dzm s ALA 28 N -3.71 4.30 0.13 1.53 0.00 -1.26 -4.71 121.76 118.05 3dzm s ALA 28 Ca -0.15 -1.79 -0.19 0.00 0.00 0.00 0.00 51.96 49.83 3dzm s ALA 28 Cb 0.00 -1.28 -0.00 0.00 0.00 0.00 0.00 23.12 21.84 3dzm s ALA 28 CO 0.59 -0.29 1.72 -1.35 0.00 0.00 0.00 175.76 176.43 3dzm h PRO 29 N 0.82 0.08 -0.07 0.00 0.11 -1.90 -3.29 132.00 127.75 3dzm h PRO 29 Ca -0.40 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 3dzm h PRO 29 Cb 1.27 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3dzm h PRO 29 CO 0.51 0.05 0.00 0.41 -0.21 0.00 0.00 178.00 178.77 3dzm n GLY 30 N -1.20 0.22 3.66 -0.55 0.00 -1.26 -5.04 105.19 101.02 3dzm n GLY 30 Ca -0.01 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 3dzm n GLY 30 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3dzm s LEU 31 N -0.73 4.14 -1.32 0.99 2.96 -1.24 -4.97 118.68 118.50 3dzm s LEU 31 Ca 0.11 1.17 -0.08 0.00 -0.22 0.00 0.00 54.13 55.11 3dzm s LEU 31 Cb 0.07 -3.27 0.13 0.00 0.50 0.00 0.00 46.19 43.62 3dzm s LEU 31 CO 0.10 -0.47 2.17 -0.81 -1.32 0.00 0.00 176.35 176.03 3dzm n PRO 32 N 5.57 4.04 -4.17 0.98 -0.05 -1.26 -4.43 135.00 135.68 3dzm n PRO 32 Ca 0.06 -3.40 -0.18 0.00 -0.05 0.00 0.00 63.50 59.93 3dzm n PRO 32 Cb 0.48 -2.80 -0.12 0.00 -0.05 0.00 0.00 33.50 31.02 3dzm n PRO 32 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 175.50 174.28 3dzm s LEU 33 N -0.96 2.29 0.07 1.53 1.98 -1.26 -3.19 118.68 119.14 3dzm s LEU 33 Ca 0.48 -0.63 -0.08 0.00 -2.89 0.00 0.00 54.13 51.00 3dzm s LEU 33 Cb 0.14 -0.49 -0.00 0.00 0.66 0.00 0.00 46.19 46.50 3dzm s LEU 33 CO -0.04 -0.10 0.17 -0.83 -1.89 0.00 0.00 176.35 173.66 3dzm s GLY 34 N -1.81 0.10 -0.00 7.98 0.00 -0.44 -3.56 107.32 109.59 3dzm s GLY 34 Ca -0.01 -0.56 0.02 0.00 0.00 0.00 0.00 44.72 44.16 3dzm s GLY 34 CO 0.02 -0.74 -0.06 -1.34 0.00 0.00 0.00 173.10 170.99 3dzm s VAL 35 N -3.48 0.44 -0.10 1.40 -7.23 -0.34 -0.89 120.40 110.20 3dzm s VAL 35 Ca 0.02 -0.25 0.02 0.00 -1.81 0.00 0.00 61.98 59.96 3dzm s VAL 35 Cb 0.03 -0.37 -0.01 0.00 0.56 0.00 0.00 36.38 36.59 3dzm s VAL 35 CO -0.09 0.12 -0.17 -0.60 -0.31 0.00 0.00 175.10 174.05 3dzm s ARG 36 N -0.15 3.06 -0.16 4.82 3.52 -0.31 -0.44 118.95 129.28 3dzm s ARG 36 Ca 0.02 -0.75 0.01 0.00 -0.13 0.00 0.00 55.73 54.88 3dzm s ARG 36 Cb -0.02 -2.47 0.02 0.00 -1.56 0.00 0.00 34.95 30.92 3dzm s ARG 36 CO -0.00 0.31 -0.19 -1.17 -0.81 0.00 0.00 175.30 173.44 3dzm s LEU 37 N 0.08 1.99 0.01 -0.88 2.96 -0.18 -0.34 118.68 122.31 3dzm s LEU 37 Ca -0.07 -0.59 0.02 0.00 -0.22 0.00 0.00 54.13 53.27 3dzm s LEU 37 Cb -0.15 -1.38 -0.01 0.00 0.50 0.00 0.00 46.19 45.15 3dzm s LEU 37 CO 0.05 0.00 -0.08 -0.83 -1.32 0.00 0.00 176.35 174.17 3dzm s GLY 38 N 1.23 0.41 -0.11 7.98 0.00 -0.19 -1.18 107.32 115.46 3dzm s GLY 38 Ca 0.02 -0.43 -0.01 0.00 0.00 0.00 0.00 44.72 44.31 3dzm s GLY 38 CO -0.10 -0.40 -0.08 0.54 0.00 0.00 0.00 173.10 173.07 3dzm s VAL 39 N -0.44 3.59 0.04 1.40 0.11 0.84 -1.31 120.40 124.63 3dzm s VAL 39 Ca 0.00 -0.49 0.07 0.00 -2.93 0.00 0.00 61.98 58.63 3dzm s VAL 39 Cb -0.04 -2.51 -0.02 0.00 -1.53 0.00 0.00 36.38 32.27 3dzm s VAL 39 CO -0.00 0.55 -0.21 -0.83 -3.33 0.00 0.00 175.10 171.28 3dzm s GLY 40 N -0.20 1.11 -0.06 6.54 0.00 0.48 -0.97 107.32 114.22 3dzm s GLY 40 Ca 0.02 -1.05 0.03 0.00 0.00 0.00 0.00 44.72 43.72 3dzm s GLY 40 CO 0.03 -0.97 -0.14 -0.12 0.00 0.00 0.00 173.10 171.89 3dzm s PHE 41 N -0.79 1.58 -0.08 1.90 5.36 0.04 -0.79 117.98 125.20 3dzm s PHE 41 Ca 0.07 -0.56 -0.09 0.00 -0.96 0.00 0.00 56.93 55.39 3dzm s PHE 41 Cb -0.09 -1.12 0.02 0.00 -0.34 0.00 0.00 43.02 41.49 3dzm s PHE 41 CO 0.02 -0.26 0.26 0.00 -1.46 0.00 0.00 175.22 173.77 3dzm s ALA 42 N 0.49 -0.64 0.91 11.12 0.00 -0.62 -0.96 121.76 132.07 3dzm s ALA 42 Ca -0.12 0.64 -0.11 0.00 0.00 0.00 0.00 51.96 52.36 3dzm s ALA 42 Cb -0.15 -0.35 0.14 0.00 0.00 0.00 0.00 23.12 22.77 3dzm s ALA 42 CO 0.04 -0.14 1.10 0.95 0.00 0.00 0.00 175.76 177.70 3dzm s THR 43 N -0.10 2.55 -0.02 0.00 -4.23 -0.50 -0.95 115.64 112.39 3dzm s THR 43 Ca -0.02 0.18 -0.28 0.00 -1.18 0.00 0.00 61.69 60.38 3dzm s THR 43 Cb -0.03 -2.48 0.10 0.00 1.34 0.00 0.00 72.50 71.44 3dzm s THR 43 CO 0.01 -0.23 0.84 -0.55 -0.54 0.00 0.00 174.62 174.14 3dzm s SER 44 N -3.08 -0.44 0.53 3.99 0.15 -0.17 -3.85 113.70 110.84 3dzm s SER 44 Ca 0.65 0.19 -0.20 0.00 0.70 0.00 0.00 55.95 57.29 3dzm s SER 44 Cb -0.20 0.42 -0.06 0.00 -1.71 0.00 0.00 66.02 64.47 3dzm s SER 44 CO 0.58 -0.61 1.12 -0.62 1.20 0.00 0.00 173.24 174.91 3dzm s ASP 45 N -2.04 5.82 -0.08 5.45 2.15 -1.26 -2.65 116.67 124.06 3dzm s ASP 45 Ca 0.01 2.14 -0.04 0.00 0.43 0.00 0.00 52.55 55.09 3dzm s ASP 45 Cb -0.01 -2.58 -0.04 0.00 -0.30 0.00 0.00 42.92 40.00 3dzm s ASP 45 CO -0.05 -1.15 -0.11 0.00 -0.17 0.00 0.00 175.17 173.70 3dzm n ALA 46 N -1.23 2.46 -3.36 3.66 0.00 -1.26 -4.68 120.51 116.09 3dzm n ALA 46 Ca 0.11 -0.33 -0.33 0.00 0.00 0.00 0.00 53.44 52.89 3dzm n ALA 46 Cb 0.51 0.39 -0.16 0.00 0.00 0.00 0.00 19.45 20.19 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 -6.44 2.31 -0.74 0.00 2.01 -1.26 -0.61 118.68 113.95 3dzm s LEU 47 Ca -0.12 -0.50 -0.26 0.00 0.01 0.00 0.00 54.13 53.26 3dzm s LEU 47 Cb 0.04 -1.49 -0.07 0.00 0.01 0.00 0.00 46.19 44.68 3dzm s LEU 47 CO 0.15 0.12 2.11 -0.62 1.01 0.00 0.00 176.35 179.12 3dzm s ASP 48 N 0.58 4.76 -0.41 2.29 -1.08 -0.17 -4.91 116.67 117.72 3dzm s ASP 48 Ca -0.11 0.03 -0.16 0.00 -0.52 0.00 0.00 52.55 51.79 3dzm s ASP 48 Cb -0.16 -2.54 0.02 0.00 -1.46 0.00 0.00 42.92 38.78 3dzm s ASP 48 CO 0.04 -2.95 0.38 1.51 0.52 0.00 0.00 175.17 174.66 3dzm s ASP 49 N 9.41 6.16 -0.17 -0.34 -4.77 -1.26 0.16 116.67 125.86 3dzm s ASP 49 Ca 0.79 -0.76 -0.01 0.00 -3.30 0.00 0.00 52.55 49.28 3dzm s ASP 49 Cb -0.11 -2.20 -0.00 0.00 -1.09 0.00 0.00 42.92 39.52 3dzm s ASP 49 CO 0.11 -0.52 -0.13 -0.83 0.70 0.00 0.00 175.17 174.50 3dzm s GLY 50 N 1.75 1.51 0.19 2.12 0.00 -1.26 -4.53 107.32 107.10 3dzm s GLY 50 Ca 0.09 -1.07 -0.14 0.00 0.00 0.00 0.00 44.72 43.59 3dzm s GLY 50 CO 0.12 0.13 0.60 -0.47 0.00 0.00 0.00 173.10 173.47 3dzm s TYR 51 N 0.97 3.55 0.01 1.90 5.04 0.43 -4.74 117.35 124.52 3dzm s TYR 51 Ca -0.02 1.09 -0.30 0.00 -2.44 0.00 0.00 57.07 55.40 3dzm s TYR 51 Cb -0.15 -2.41 -0.06 0.00 0.35 0.00 0.00 41.96 39.70 3dzm s TYR 51 CO -0.02 0.35 1.48 0.34 -1.34 0.00 0.00 175.55 176.36 3dzm s ASP 52 N -1.88 6.78 -0.11 4.32 -1.08 -1.26 -2.43 116.67 121.01 3dzm s ASP 52 Ca 0.42 2.21 0.08 0.00 -0.52 0.00 0.00 52.55 54.74 3dzm s ASP 52 Cb -0.14 -2.56 -0.13 0.00 -1.46 0.00 0.00 42.92 38.63 3dzm s ASP 52 CO 0.20 -0.78 0.02 0.18 0.52 0.00 0.00 175.17 175.31 3dzm n LEU 53 N 5.59 0.36 0.00 -1.34 4.77 0.05 -4.99 117.00 121.43 3dzm n LEU 53 Ca 0.14 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 3dzm n LEU 53 Cb 0.43 0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 3dzm n LEU 53 CO 0.60 0.32 0.00 0.61 -1.33 0.00 0.00 177.39 177.59 3dzm n GLY 54 N 2.40 0.46 0.00 -0.72 0.00 -1.17 -4.92 105.19 101.25 3dzm n GLY 54 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 1.26 2.85 -0.02 0.00 -1.26 -4.86 105.19 108.17 3dzm n GLY 55 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.03 0.41 3.73 -0.02 0.00 -1.26 -4.98 105.19 103.04 3dzm n GLY 56 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.08 5.04 0.36 2.61 -4.23 -1.26 -4.92 115.64 111.17 3dzm s THR 57 Ca 0.00 1.28 0.07 0.00 -1.18 0.00 0.00 61.69 61.87 3dzm s THR 57 Cb 0.00 -3.96 -0.00 0.00 1.34 0.00 0.00 72.50 69.87 3dzm s THR 57 CO 0.00 0.31 0.49 0.42 -0.54 0.00 0.00 174.62 175.30 3dzm s THR 58 N 0.51 3.69 0.29 3.99 -4.23 -1.26 -0.77 115.64 117.86 3dzm s THR 58 Ca 0.33 -1.02 -0.02 0.00 -1.18 0.00 0.00 61.69 59.80 3dzm s THR 58 Cb -0.17 -3.27 0.25 0.00 1.34 0.00 0.00 72.50 70.65 3dzm s THR 58 CO 0.16 -0.11 1.95 -0.25 -0.54 0.00 0.00 174.62 175.83 3dzm h TRP 59 N 0.84 1.04 -0.91 3.99 2.91 -1.72 -1.67 115.95 120.42 3dzm h TRP 59 Ca -0.44 0.01 0.13 0.00 1.13 0.00 0.00 58.89 59.72 3dzm h TRP 59 Cb 1.26 -0.35 -0.09 0.00 -0.51 0.00 0.00 29.16 29.48 3dzm h TRP 59 CO 0.42 0.68 0.53 0.78 -1.03 0.00 0.00 178.44 179.82 3dzm h GLY 60 N 1.12 1.49 0.95 2.65 0.00 -1.84 0.09 103.07 107.53 3dzm h GLY 60 Ca 0.29 -0.34 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 3dzm h GLY 60 CO -0.06 0.06 0.17 -0.55 0.00 0.00 0.00 176.54 176.16 3dzm h ASP 61 N 0.80 0.59 0.69 0.19 3.32 -1.70 -2.65 116.42 117.66 3dzm h ASP 61 Ca 0.47 -0.17 -0.26 0.00 0.02 0.00 0.00 57.03 57.08 3dzm h ASP 61 Cb 0.56 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 3dzm h ASP 61 CO -0.31 0.61 -1.25 -0.37 -1.72 0.00 0.00 179.24 176.20 3dzm h VAL 62 N 0.55 1.47 -0.01 -1.35 -1.51 -1.19 -2.45 116.25 111.75 3dzm h VAL 62 Ca 0.14 -3.10 -0.02 0.00 -1.23 0.00 0.00 66.70 62.49 3dzm h VAL 62 Cb 0.20 2.87 -0.00 0.00 -2.13 0.00 0.00 31.29 32.23 3dzm h VAL 62 CO -0.01 0.89 -0.10 0.50 -1.23 0.00 0.00 177.57 177.62 3dzm h LYS 63 N 0.05 0.02 0.30 5.19 3.64 -1.02 0.39 116.57 125.14 3dzm h LYS 63 Ca -0.13 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.23 3dzm h LYS 63 Cb 1.93 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.75 3dzm h LYS 63 CO 0.17 0.12 -0.14 1.49 -2.27 0.00 0.00 179.45 178.82 3dzm h GLU 64 N 0.02 -0.39 -1.02 1.90 4.57 -1.39 -1.66 114.58 116.62 3dzm h GLU 64 Ca 0.00 0.03 0.31 0.00 -1.18 0.00 0.00 59.36 58.52 3dzm h GLU 64 Cb 0.19 0.09 -0.14 0.00 -0.16 0.00 0.00 28.75 28.73 3dzm h GLU 64 CO 0.01 -0.26 0.60 0.00 -1.18 0.00 0.00 179.01 178.18 3dzm h ALA 65 N -1.65 1.97 0.00 2.92 0.00 -1.31 -1.86 119.26 119.33 3dzm h ALA 65 Ca -0.04 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3dzm h ALA 65 Cb 0.31 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3dzm h ALA 65 CO 0.07 -0.55 -0.99 0.41 0.00 0.00 0.00 179.25 178.20 3dzm n GLY 66 N -1.32 -1.29 2.37 0.00 0.00 0.12 -4.97 105.19 100.10 3dzm n GLY 66 Ca 0.31 -0.34 -0.17 0.00 0.00 0.00 0.00 46.02 45.81 3dzm n GLY 66 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3dzm n LYS 67 N -2.14 -1.33 -2.12 1.61 5.02 -0.67 -4.52 118.16 114.00 3dzm n LYS 67 Ca 0.02 0.89 -0.40 0.00 -2.02 0.00 0.00 58.31 56.80 3dzm n LYS 67 Cb 0.46 -5.30 -0.01 0.00 -0.02 0.00 0.00 35.03 30.17 3dzm n LYS 67 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 3dzm s PHE 68 N -2.81 2.96 -0.10 2.13 0.08 -0.90 -4.56 117.98 114.78 3dzm s PHE 68 Ca 0.00 1.44 -0.20 0.00 0.12 0.00 0.00 56.93 58.29 3dzm s PHE 68 Cb 0.00 -3.62 -0.04 0.00 -0.57 0.00 0.00 43.02 38.79 3dzm s PHE 68 CO 0.00 -1.85 0.55 -1.12 -0.10 0.00 0.00 175.22 172.69 3dzm s SER 69 N -0.71 6.79 -0.08 1.36 0.01 -0.56 -4.90 113.70 115.61 3dzm s SER 69 Ca 0.54 0.94 -0.01 0.00 1.31 0.00 0.00 55.95 58.73 3dzm s SER 69 Cb -0.37 -2.33 -0.03 0.00 0.21 0.00 0.00 66.02 63.50 3dzm s SER 69 CO 0.49 -0.03 -0.02 -0.70 0.41 0.00 0.00 173.24 173.39 3dzm s GLU 70 N 0.63 2.89 0.07 12.44 2.12 -1.26 -0.83 118.70 134.77 3dzm s GLU 70 Ca 0.30 -0.46 0.01 0.00 0.36 0.00 0.00 54.97 55.17 3dzm s GLU 70 Cb -0.16 -2.72 -0.04 0.00 0.26 0.00 0.00 34.13 31.47 3dzm s GLU 70 CO 0.13 0.69 -0.05 1.67 -0.54 0.00 0.00 175.26 177.15 3dzm s TRP 71 N -0.87 0.68 -0.10 5.30 1.48 -0.21 -5.00 118.94 120.22 3dzm s TRP 71 Ca 0.13 -0.86 -0.30 0.00 -1.06 0.00 0.00 56.10 54.01 3dzm s TRP 71 Cb -0.11 -0.43 0.08 0.00 -1.16 0.00 0.00 33.47 31.85 3dzm s TRP 71 CO 0.02 -0.21 0.76 0.20 -4.06 0.00 0.00 176.95 173.66 3dzm s GLY 72 N -2.62 -0.50 0.01 3.67 0.00 -1.09 -1.43 107.32 105.36 3dzm s GLY 72 Ca 0.04 1.57 -0.22 0.00 0.00 0.00 0.00 44.72 46.12 3dzm s GLY 72 CO -0.05 1.08 0.48 -0.86 0.00 0.00 0.00 173.10 173.75 3dzm s GLN 73 N -0.97 0.92 -0.17 2.90 -2.07 0.45 -0.99 119.66 119.73 3dzm s GLN 73 Ca -0.08 -0.13 0.01 0.00 -1.82 0.00 0.00 55.36 53.34 3dzm s GLN 73 Cb -0.01 0.42 0.03 0.00 -1.09 0.00 0.00 33.01 32.36 3dzm s GLN 73 CO 0.07 -0.30 -0.14 -0.80 -1.32 0.00 0.00 175.29 172.80 3dzm s ASN 74 N -1.62 3.04 -0.25 12.60 0.01 -0.13 -1.48 114.94 127.11 3dzm s ASN 74 Ca -0.09 -0.67 -0.12 0.00 -0.71 0.00 0.00 52.86 51.27 3dzm s ASN 74 Cb -0.02 -1.26 -0.05 0.00 0.41 0.00 0.00 41.25 40.34 3dzm s ASN 74 CO 0.03 -0.08 0.24 -0.69 -1.51 0.00 0.00 177.10 175.09 3dzm s VAL 75 N 1.41 5.29 -0.10 1.60 1.01 -0.80 -1.59 120.40 127.23 3dzm s VAL 75 Ca 0.03 0.32 0.04 0.00 0.00 0.00 0.00 61.98 62.36 3dzm s VAL 75 Cb -0.14 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.67 3dzm s VAL 75 CO -0.10 0.28 -0.21 -0.89 0.00 0.00 0.00 175.10 174.17 3dzm s THR 76 N 1.43 1.87 -0.09 3.92 2.01 0.02 0.03 115.64 124.84 3dzm s THR 76 Ca 0.10 -0.91 -0.12 0.00 0.31 0.00 0.00 61.69 61.07 3dzm s THR 76 Cb -0.15 -1.63 -0.05 0.00 0.01 0.00 0.00 72.50 70.68 3dzm s THR 76 CO 0.07 0.52 0.29 -0.76 -0.69 0.00 0.00 174.62 174.05 3dzm s LEU 77 N 0.45 4.36 -0.05 4.42 1.43 0.22 -0.39 118.68 129.13 3dzm s LEU 77 Ca -0.17 0.65 0.01 0.00 -1.03 0.00 0.00 54.13 53.59 3dzm s LEU 77 Cb -0.17 -2.36 0.02 0.00 0.03 0.00 0.00 46.19 43.71 3dzm s LEU 77 CO 0.07 0.26 -0.03 -0.55 0.23 0.00 0.00 176.35 176.33 3dzm s SER 78 N -0.47 0.95 -0.20 2.29 0.15 -0.43 -1.09 113.70 114.89 3dzm s SER 78 Ca 0.19 -0.11 0.01 0.00 0.70 0.00 0.00 55.95 56.74 3dzm s SER 78 Cb -0.14 -0.41 0.04 0.00 -1.71 0.00 0.00 66.02 63.80 3dzm s SER 78 CO 0.07 -0.08 -0.15 -0.22 1.20 0.00 0.00 173.24 174.06 3dzm s LEU 79 N 1.08 2.45 -0.09 3.45 2.96 -0.40 -1.02 118.68 127.11 3dzm s LEU 79 Ca -0.09 -0.88 0.03 0.00 -0.22 0.00 0.00 54.13 52.97 3dzm s LEU 79 Cb -0.14 -1.40 -0.02 0.00 0.50 0.00 0.00 46.19 45.13 3dzm s LEU 79 CO -0.01 -0.09 -0.17 -1.81 -1.32 0.00 0.00 176.35 172.95 3dzm s ASP 80 N 1.29 3.73 -0.40 3.68 1.01 0.53 -1.76 116.67 124.75 3dzm s ASP 80 Ca -0.00 -0.35 -0.18 0.00 0.71 0.00 0.00 52.55 52.73 3dzm s ASP 80 Cb -0.16 -1.20 0.01 0.00 1.01 0.00 0.00 42.92 42.59 3dzm s ASP 80 CO -0.10 0.24 0.51 -0.69 0.21 0.00 0.00 175.17 175.34 3dzm s VAL 81 N -0.08 5.00 -0.27 -1.27 1.01 -0.29 -1.16 120.40 123.33 3dzm s VAL 81 Ca -0.03 -0.00 -0.16 0.00 0.00 0.00 0.00 61.98 61.79 3dzm s VAL 81 Cb -0.14 -4.05 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 3dzm s VAL 81 CO 0.04 -0.40 0.41 -0.76 0.00 0.00 0.00 175.10 174.39 3dzm s LEU 82 N 2.40 4.07 -0.38 3.92 1.43 -0.07 -2.84 118.68 127.21 3dzm s LEU 82 Ca 0.17 0.30 -0.14 0.00 -1.03 0.00 0.00 54.13 53.43 3dzm s LEU 82 Cb -0.16 -2.48 0.00 0.00 0.03 0.00 0.00 46.19 43.59 3dzm s LEU 82 CO 0.15 -0.23 0.27 -0.72 0.23 0.00 0.00 176.35 176.05 3dzm s TYR 83 N 2.13 3.23 0.65 0.29 -0.85 -0.95 -1.32 117.35 120.53 3dzm s TYR 83 Ca 0.16 -0.45 -0.18 0.00 -0.52 0.00 0.00 57.07 56.08 3dzm s TYR 83 Cb -0.16 -2.53 -0.01 0.00 0.38 0.00 0.00 41.96 39.64 3dzm s TYR 83 CO 0.10 -0.50 1.30 1.63 -1.52 0.00 0.00 175.55 176.56 3dzm n LYS 84 N 5.13 1.14 0.00 -3.49 4.76 -1.19 -3.99 118.16 120.51 3dzm n LYS 84 Ca -0.12 0.44 0.00 0.00 -2.87 0.00 0.00 58.31 55.77 3dzm n LYS 84 Cb 0.48 -2.53 0.00 0.00 -1.84 0.00 0.00 35.03 31.14 3dzm n LYS 84 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 3dzm n PRO 85 N -1.87 0.00 0.00 1.97 -0.04 -1.26 -5.00 135.00 128.80 3dzm n PRO 85 Ca 0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 3dzm n PRO 85 Cb 0.48 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.94 3dzm n PRO 85 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3dzm n LEU 90 N 0.00 0.00 -0.11 1.53 4.32 -1.26 -5.11 117.00 116.37 3dzm n LEU 90 Ca 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 56.01 55.92 3dzm n LEU 90 Cb 0.00 0.00 0.01 0.00 -1.62 0.00 0.00 43.42 41.81 3dzm n LEU 90 CO 0.00 0.00 0.97 -0.65 -1.22 0.00 0.00 177.39 176.49 3dzm h PRO 91 N 0.00 0.35 -6.17 3.23 0.11 -2.06 -3.40 132.00 124.06 3dzm h PRO 91 Ca 0.00 -0.02 -0.55 0.00 0.11 0.00 0.00 66.00 65.54 3dzm h PRO 91 Cb 0.00 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 30.99 3dzm h PRO 91 CO 0.00 0.23 0.13 0.54 -0.21 0.00 0.00 178.00 178.69 3dzm s VAL 92 N -6.16 4.90 -0.38 3.15 0.11 -1.26 -4.87 120.40 115.89 3dzm s VAL 92 Ca -0.13 1.55 -0.19 0.00 -2.93 0.00 0.00 61.98 60.28 3dzm s VAL 92 Cb 0.11 -4.08 0.01 0.00 -1.53 0.00 0.00 36.38 30.89 3dzm s VAL 92 CO 0.71 0.30 0.58 -0.70 -3.33 0.00 0.00 175.10 172.66 3dzm s GLU 93 N 0.42 3.51 -0.14 1.54 2.12 -0.85 -4.97 118.70 120.33 3dzm s GLU 93 Ca 0.39 -0.20 -0.03 0.00 0.36 0.00 0.00 54.97 55.49 3dzm s GLU 93 Cb -0.19 -3.86 -0.03 0.00 0.26 0.00 0.00 34.13 30.32 3dzm s GLU 93 CO 0.21 -0.78 -0.06 0.14 -0.54 0.00 0.00 175.26 174.23 3dzm s VAL 94 N 2.58 3.73 -0.11 3.70 -7.23 -1.26 -0.84 120.40 120.97 3dzm s VAL 94 Ca 0.21 -0.42 0.01 0.00 -1.81 0.00 0.00 61.98 59.96 3dzm s VAL 94 Cb -0.15 -2.61 0.02 0.00 0.56 0.00 0.00 36.38 34.20 3dzm s VAL 94 CO 0.15 0.51 -0.12 0.00 -0.31 0.00 0.00 175.10 175.33 3dzm s ALA 95 N 0.20 1.55 0.81 1.32 0.00 0.02 -4.40 121.76 121.26 3dzm s ALA 95 Ca -0.03 -0.66 -0.11 0.00 0.00 0.00 0.00 51.96 51.16 3dzm s ALA 95 Cb -0.14 -0.85 0.08 0.00 0.00 0.00 0.00 23.12 22.21 3dzm s ALA 95 CO 0.03 -0.19 1.13 -1.25 0.00 0.00 0.00 175.76 175.48 3dzm s PRO 96 N 1.21 1.83 0.16 0.00 0.05 -1.26 -0.87 135.00 136.13 3dzm s PRO 96 Ca -0.03 1.39 -0.16 0.00 0.05 0.00 0.00 61.00 62.25 3dzm s PRO 96 Cb -0.14 -1.83 0.03 0.00 0.05 0.00 0.00 34.50 32.61 3dzm s PRO 96 CO -0.04 -2.00 0.45 1.52 0.05 0.00 0.00 177.00 176.99 3dzm s TYR 97 N -2.67 -0.13 0.11 0.56 -0.85 -0.29 -2.25 117.35 111.83 3dzm s TYR 97 Ca 0.65 -0.20 0.01 0.00 -0.52 0.00 0.00 57.07 57.01 3dzm s TYR 97 Cb -0.21 0.31 -0.04 0.00 0.38 0.00 0.00 41.96 42.40 3dzm s TYR 97 CO 0.54 -0.80 -0.02 -0.59 -1.52 0.00 0.00 175.55 173.16 3dzm s PHE 98 N -3.85 0.87 0.01 -3.49 -0.12 -1.13 -2.04 117.98 108.23 3dzm s PHE 98 Ca 0.07 -1.03 -0.03 0.00 -0.05 0.00 0.00 56.93 55.89 3dzm s PHE 98 Cb 0.01 -0.52 0.01 0.00 -0.63 0.00 0.00 43.02 41.89 3dzm s PHE 98 CO -0.07 -0.29 0.13 0.41 -0.05 0.00 0.00 175.22 175.35 3dzm n GLY 99 N -0.06 0.89 3.75 1.99 0.00 -0.08 -1.14 105.19 110.54 3dzm n GLY 99 Ca -0.10 -0.90 -0.30 0.00 0.00 0.00 0.00 46.02 44.72 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 -2.32 4.38 0.03 1.61 0.11 -0.72 -1.79 120.40 121.69 3dzm s VAL 100 Ca 0.03 -0.83 0.01 0.00 -2.93 0.00 0.00 61.98 58.25 3dzm s VAL 100 Cb -0.00 -3.10 -0.02 0.00 -1.53 0.00 0.00 36.38 31.72 3dzm s VAL 100 CO 0.00 0.12 -0.04 -0.13 -3.33 0.00 0.00 175.10 171.72 3dzm s ARG 101 N -2.37 0.36 -0.10 1.54 1.81 0.67 -1.28 118.95 119.59 3dzm s ARG 101 Ca 0.28 -0.64 0.01 0.00 -1.72 0.00 0.00 55.73 53.66 3dzm s ARG 101 Cb -0.12 0.00 0.02 0.00 -0.45 0.00 0.00 34.95 34.40 3dzm s ARG 101 CO 0.21 -0.02 -0.11 -0.47 -0.68 0.00 0.00 175.30 174.22 3dzm s TYR 102 N -1.43 1.62 -0.09 -0.53 5.04 -0.25 0.67 117.35 122.39 3dzm s TYR 102 Ca -0.14 -0.75 0.04 0.00 -2.44 0.00 0.00 57.07 53.78 3dzm s TYR 102 Cb -0.10 -1.24 0.00 0.00 0.35 0.00 0.00 41.96 40.97 3dzm s TYR 102 CO -0.01 -0.44 -0.23 1.21 -1.34 0.00 0.00 175.55 174.75 3dzm s ASN 103 N 1.20 2.91 -0.68 4.32 2.47 0.72 -0.61 114.94 125.28 3dzm s ASN 103 Ca -0.04 -0.52 -0.15 0.00 0.42 0.00 0.00 52.86 52.57 3dzm s ASN 103 Cb -0.14 -1.25 0.17 0.00 -1.45 0.00 0.00 41.25 38.58 3dzm s ASN 103 CO -0.03 0.16 0.65 -0.36 -3.72 0.00 0.00 177.10 173.79 3dzm s PHE 104 N 0.30 3.46 -0.13 0.43 0.08 0.10 -0.82 117.98 121.41 3dzm s PHE 104 Ca -0.16 -1.58 -0.28 0.00 0.12 0.00 0.00 56.93 55.02 3dzm s PHE 104 Cb -0.17 -3.84 -0.01 0.00 -0.57 0.00 0.00 43.02 38.43 3dzm s PHE 104 CO 0.08 -1.04 0.96 0.12 -0.10 0.00 0.00 175.22 175.24 3dzm s PHE 105 N 1.06 3.48 -0.03 0.36 5.36 -0.19 -1.90 117.98 126.13 3dzm s PHE 105 Ca 0.11 1.50 -0.06 0.00 -0.96 0.00 0.00 56.93 57.52 3dzm s PHE 105 Cb -0.20 -3.14 0.01 0.00 -0.34 0.00 0.00 43.02 39.34 3dzm s PHE 105 CO -0.02 -0.24 0.13 -1.54 -1.46 0.00 0.00 175.22 172.09 3dzm s SER 106 N 1.11 -0.06 0.00 6.13 1.04 -0.55 -1.23 113.70 120.15 3dzm s SER 106 Ca 0.45 0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.92 3dzm s SER 106 Cb -0.18 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.19 3dzm s SER 106 CO 0.16 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 174.79 3dzm n GLY 107 N 2.28 1.25 0.00 7.32 0.00 -0.23 -0.41 105.19 115.40 3dzm n GLY 107 Ca -0.17 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.04 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 0.92 3.08 -0.02 0.00 -0.51 0.05 105.19 108.72 3dzm n GLY 108 Ca 0.00 -1.86 -0.16 0.00 0.00 0.00 0.00 46.02 44.00 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 -2.76 0.86 0.44 1.61 -0.85 -0.91 -1.05 117.35 114.70 3dzm s TYR 109 Ca 0.00 -0.39 0.08 0.00 -0.52 0.00 0.00 57.07 56.23 3dzm s TYR 109 Cb 0.00 -0.51 0.00 0.00 0.38 0.00 0.00 41.96 41.83 3dzm s TYR 109 CO 0.00 -0.02 0.49 0.95 -1.52 0.00 0.00 175.55 175.45 3dzm s THR 110 N -1.04 2.65 -0.60 -3.49 -4.23 -0.01 -1.66 115.64 107.26 3dzm s THR 110 Ca -0.04 -1.20 0.04 0.00 -1.18 0.00 0.00 61.69 59.31 3dzm s THR 110 Cb -0.08 -2.85 0.16 0.00 1.34 0.00 0.00 72.50 71.07 3dzm s THR 110 CO 0.01 0.00 0.40 -0.62 -0.54 0.00 0.00 174.62 173.87 3dzm s ASP 111 N -4.27 4.16 0.00 3.99 2.15 -1.04 -1.50 116.67 120.15 3dzm s ASP 111 Ca 0.51 -3.46 0.18 0.00 0.43 0.00 0.00 52.55 50.21 3dzm s ASP 111 Cb -0.06 -1.41 1.08 0.00 -0.30 0.00 0.00 42.92 42.24 3dzm s ASP 111 CO 0.30 -0.14 1.50 -2.65 -0.17 0.00 0.00 175.17 174.01 3dzm n PRO 112 N 2.47 0.55 0.00 4.34 -0.02 -1.26 -4.46 135.00 136.63 3dzm n PRO 112 Ca 0.17 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 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 -1.02 0.00 -3.28 -0.52 4.07 -1.26 -5.02 120.64 113.61 3dzm n GLU 113 Ca 0.13 0.00 -0.30 0.00 -0.06 0.00 0.00 57.16 56.93 3dzm n GLU 113 Cb 0.07 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 31.41 3dzm n GLU 113 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 3dzm s ASP 114 N -2.45 6.55 0.00 4.31 -1.08 -1.26 -4.95 116.67 117.80 3dzm s ASP 114 Ca 0.00 0.90 0.00 0.00 -0.52 0.00 0.00 52.55 52.93 3dzm s ASP 114 Cb 0.00 -2.22 0.00 0.00 -1.46 0.00 0.00 42.92 39.24 3dzm s ASP 114 CO 0.00 -0.18 0.00 -0.46 0.52 0.00 0.00 175.17 175.05 3dzm n ASN 115 N -0.63 0.00 -3.71 -0.34 0.23 -1.26 -4.77 115.26 104.78 3dzm n ASN 115 Ca 0.00 0.00 -0.30 0.00 -0.53 0.00 0.00 54.58 53.76 3dzm n ASN 115 Cb 0.53 0.00 -0.14 0.00 -2.08 0.00 0.00 39.78 38.09 3dzm n ASN 115 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 3dzm s LEU 116 N 0.00 2.32 0.00 -4.53 2.96 -1.26 -4.97 118.68 113.21 3dzm s LEU 116 Ca 0.00 -2.03 0.00 0.00 -0.22 0.00 0.00 54.13 51.88 3dzm s LEU 116 Cb 0.00 -0.89 0.00 0.00 0.50 0.00 0.00 46.19 45.80 3dzm s LEU 116 CO 0.00 -0.36 0.00 0.35 -1.32 0.00 0.00 176.35 175.02 3dzm n THR 117 N 4.33 0.00 -3.72 3.68 -2.24 -1.26 -3.48 114.28 111.59 3dzm n THR 117 Ca 0.03 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.67 3dzm n THR 117 Cb 0.39 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.53 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 0.01 -1.57 2.28 1.09 -1.26 -5.07 121.20 116.69 3dzm s ILE 118 Ca 0.00 -0.12 0.00 0.00 -1.10 0.00 0.00 60.65 59.43 3dzm s ILE 118 Cb 0.00 -0.62 0.00 0.00 -1.06 0.00 0.00 42.46 40.78 3dzm s ILE 118 CO 0.00 -0.06 0.00 2.29 -0.10 0.00 0.00 174.94 177.07 3dzm n LYS 119 N 2.34 0.00 -3.77 2.79 2.85 -1.23 -1.63 118.16 119.51 3dzm n LYS 119 Ca -0.16 0.00 -0.13 0.00 -1.05 0.00 0.00 58.31 56.97 3dzm n LYS 119 Cb 0.57 0.00 -0.10 0.00 -0.65 0.00 0.00 35.03 34.85 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 -0.75 -0.12 0.58 0.00 -1.22 -2.50 121.76 116.75 3dzm s ALA 120 Ca 0.00 0.50 -0.01 0.00 0.00 0.00 0.00 51.96 52.45 3dzm s ALA 120 Cb 0.00 -0.14 0.03 0.00 0.00 0.00 0.00 23.12 23.02 3dzm s ALA 120 CO 0.00 -0.22 -0.03 -1.14 0.00 0.00 0.00 175.76 174.37 3dzm s GLN 121 N -0.80 1.10 -0.06 0.00 2.00 -0.66 -0.67 119.66 120.58 3dzm s GLN 121 Ca -0.09 -0.21 0.05 0.00 -2.00 0.00 0.00 55.36 53.12 3dzm s GLN 121 Cb -0.04 -1.53 -0.01 0.00 0.80 0.00 0.00 33.01 32.22 3dzm s GLN 121 CO 0.03 -0.36 -0.23 0.99 -0.50 0.00 0.00 175.29 175.23 3dzm s THR 122 N 1.80 2.28 -0.01 -0.34 2.01 -0.10 -2.13 115.64 119.14 3dzm s THR 122 Ca 0.03 -0.99 0.05 0.00 0.31 0.00 0.00 61.69 61.10 3dzm s THR 122 Cb -0.13 -1.85 -0.03 0.00 0.01 0.00 0.00 72.50 70.50 3dzm s THR 122 CO -0.07 0.57 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.64 3dzm s ILE 123 N -0.25 2.97 0.00 1.82 1.01 0.11 -0.92 121.20 125.93 3dzm s ILE 123 Ca -0.01 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.74 3dzm s ILE 123 Cb -0.13 -2.20 -0.00 0.00 0.01 0.00 0.00 42.46 40.14 3dzm s ILE 123 CO 0.03 0.48 -0.02 -0.44 0.00 0.00 0.00 174.94 174.99 3dzm s SER 124 N -1.04 0.23 -0.11 3.58 0.01 -0.19 -1.06 113.70 115.12 3dzm s SER 124 Ca 0.13 -0.09 -0.05 0.00 1.31 0.00 0.00 55.95 57.26 3dzm s SER 124 Cb -0.11 -0.01 0.05 0.00 0.21 0.00 0.00 66.02 66.16 3dzm s SER 124 CO 0.03 -0.01 0.23 -0.55 0.41 0.00 0.00 173.24 173.35 3dzm s SER 125 N -0.21 0.03 -0.22 2.44 0.15 -0.36 -0.53 113.70 115.00 3dzm s SER 125 Ca -0.01 0.51 -0.10 0.00 0.70 0.00 0.00 55.95 57.05 3dzm s SER 125 Cb -0.02 0.46 -0.05 0.00 -1.71 0.00 0.00 66.02 64.71 3dzm s SER 125 CO -0.00 -0.19 0.13 0.20 1.20 0.00 0.00 173.24 174.57 3dzm s ASN 126 N 1.69 6.03 0.01 5.45 0.01 -1.26 -1.02 114.94 125.85 3dzm s ASN 126 Ca -0.05 0.14 0.03 0.00 -0.71 0.00 0.00 52.86 52.27 3dzm s ASN 126 Cb -0.11 -2.07 -0.01 0.00 0.41 0.00 0.00 41.25 39.47 3dzm s ASN 126 CO -0.08 0.12 -0.11 -1.10 -1.51 0.00 0.00 177.10 174.43 3dzm s GLN 127 N 0.70 0.81 0.25 -0.60 -0.21 -0.00 -4.76 119.66 115.84 3dzm s GLN 127 Ca 0.07 -0.51 -0.14 0.00 0.02 0.00 0.00 55.36 54.80 3dzm s GLN 127 Cb -0.12 -0.77 -0.08 0.00 1.00 0.00 0.00 33.01 33.03 3dzm s GLN 127 CO 0.01 0.20 0.64 -1.17 -2.12 0.00 0.00 175.29 172.85 3dzm s LEU 128 N -0.62 4.19 0.23 2.90 2.96 -1.26 -0.20 118.68 126.87 3dzm s LEU 128 Ca 0.02 1.15 -0.14 0.00 -0.22 0.00 0.00 54.13 54.93 3dzm s LEU 128 Cb -0.06 -3.73 0.01 0.00 0.50 0.00 0.00 46.19 42.91 3dzm s LEU 128 CO 0.00 -0.07 0.49 -0.83 -1.32 0.00 0.00 176.35 174.62 3dzm s GLY 129 N -2.11 0.30 0.04 7.98 0.00 0.21 -2.12 107.32 111.62 3dzm s GLY 129 Ca 0.47 -0.65 0.04 0.00 0.00 0.00 0.00 44.72 44.59 3dzm s GLY 129 CO 0.19 -0.50 -0.13 -2.27 0.00 0.00 0.00 173.10 170.40 3dzm s LEU 130 N -2.96 2.17 0.15 0.66 2.96 -0.40 -0.23 118.68 121.03 3dzm s LEU 130 Ca 0.17 -0.45 -0.23 0.00 -0.22 0.00 0.00 54.13 53.40 3dzm s LEU 130 Cb -0.01 -0.53 0.07 0.00 0.50 0.00 0.00 46.19 46.22 3dzm s LEU 130 CO 0.05 0.00 0.63 -0.83 -1.32 0.00 0.00 176.35 174.88 3dzm s GLY 131 N -1.14 -0.58 0.19 7.98 0.00 -0.74 -0.01 107.32 113.01 3dzm s GLY 131 Ca 0.00 0.49 -0.03 0.00 0.00 0.00 0.00 44.72 45.18 3dzm s GLY 131 CO 0.01 0.16 0.16 0.48 0.00 0.00 0.00 173.10 173.91 3dzm s LEU 132 N -2.74 1.16 0.00 0.66 0.05 -0.89 -0.90 118.68 116.02 3dzm s LEU 132 Ca 0.02 -1.27 0.00 0.00 0.05 0.00 0.00 54.13 52.92 3dzm s LEU 132 Cb -0.01 0.57 0.00 0.00 -2.05 0.00 0.00 46.19 44.69 3dzm s LEU 132 CO -0.12 -0.86 0.00 0.61 -0.55 0.00 0.00 176.35 175.44 3dzm n GLY 133 N -0.25 -1.49 3.14 -3.48 0.00 -0.87 -1.01 105.19 101.25 3dzm n GLY 133 Ca -0.00 -1.07 -0.22 0.00 0.00 0.00 0.00 46.02 44.72 3dzm n GLY 133 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3dzm s VAL 134 N -2.08 1.21 -0.10 1.61 -7.23 0.95 -1.13 120.40 113.63 3dzm s VAL 134 Ca 0.00 -0.78 0.03 0.00 -1.81 0.00 0.00 61.98 59.42 3dzm s VAL 134 Cb 0.00 -1.03 -0.01 0.00 0.56 0.00 0.00 36.38 35.90 3dzm s VAL 134 CO 0.00 0.24 -0.20 -0.60 -0.31 0.00 0.00 175.10 174.22 3dzm s ARG 135 N -0.63 3.04 -0.13 4.82 3.52 -0.05 -1.87 118.95 127.64 3dzm s ARG 135 Ca 0.05 -0.82 0.03 0.00 -0.13 0.00 0.00 55.73 54.86 3dzm s ARG 135 Cb -0.07 -2.38 0.01 0.00 -1.56 0.00 0.00 34.95 30.95 3dzm s ARG 135 CO 0.00 0.25 -0.21 0.00 -0.81 0.00 0.00 175.30 174.53 3dzm s ALA 136 N 0.20 2.15 -0.06 6.12 0.00 0.47 -0.80 121.76 129.83 3dzm s ALA 136 Ca -0.12 -1.02 0.05 0.00 0.00 0.00 0.00 51.96 50.87 3dzm s ALA 136 Cb -0.16 -0.95 -0.02 0.00 0.00 0.00 0.00 23.12 21.99 3dzm s ALA 136 CO 0.07 -0.01 -0.20 0.00 0.00 0.00 0.00 175.76 175.62 3dzm s ALA 137 N 0.80 2.37 -0.06 0.00 0.00 -0.02 -0.52 121.76 124.33 3dzm s ALA 137 Ca -0.08 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 50.87 3dzm s ALA 137 Cb -0.16 -0.82 0.02 0.00 0.00 0.00 0.00 23.12 22.17 3dzm s ALA 137 CO -0.01 0.44 -0.04 -0.47 0.00 0.00 0.00 175.76 175.69 3dzm s TYR 138 N -0.28 0.79 0.33 0.00 5.04 -0.30 -2.00 117.35 120.93 3dzm s TYR 138 Ca 0.01 -0.24 -0.26 0.00 -2.44 0.00 0.00 57.07 54.13 3dzm s TYR 138 Cb -0.13 -0.75 -0.09 0.00 0.35 0.00 0.00 41.96 41.34 3dzm s TYR 138 CO 0.03 -0.25 1.01 -2.14 -1.34 0.00 0.00 175.55 172.86 3dzm s PRO 139 N 1.25 4.48 0.17 4.97 0.02 -1.26 -0.25 135.00 144.37 3dzm s PRO 139 Ca -0.06 1.51 0.00 0.00 0.02 0.00 0.00 61.00 62.48 3dzm s PRO 139 Cb -0.14 -2.84 0.00 0.00 0.02 0.00 0.00 34.50 31.54 3dzm s PRO 139 CO -0.02 0.14 0.00 -0.11 -0.33 0.00 0.00 177.00 176.68 3dzm n LEU 140 N 0.57 0.17 -4.42 -5.54 7.94 -0.38 -4.90 117.00 110.45 3dzm n LEU 140 Ca 0.02 0.27 -0.22 0.00 -1.11 0.00 0.00 56.01 54.97 3dzm n LEU 140 Cb 0.48 0.13 -0.09 0.00 0.53 0.00 0.00 43.42 44.47 3dzm n LEU 140 CO 0.47 -0.65 -0.20 -0.04 -1.11 0.00 0.00 177.39 175.86 3dzm s MET 141 N -2.00 1.76 0.20 1.96 -1.94 -0.84 -5.03 119.30 113.41 3dzm s MET 141 Ca 0.00 -2.04 -0.32 0.00 -1.71 0.00 0.00 55.69 51.62 3dzm s MET 141 Cb 0.00 -0.36 -0.13 0.00 2.01 0.00 0.00 34.83 36.35 3dzm s MET 141 CO 0.00 -0.45 1.67 -2.30 -0.01 0.00 0.00 175.02 173.93 3dzm n PRO 142 N -0.74 2.59 -1.12 2.03 -0.02 -1.26 -1.95 135.00 134.54 3dzm n PRO 142 Ca -0.02 0.93 -0.04 0.00 -2.02 0.00 0.00 63.50 62.36 3dzm n PRO 142 Cb 0.65 -2.75 -0.02 0.00 -0.02 0.00 0.00 33.50 31.36 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 3.67 -4.82 -3.78 2.55 3.02 -1.26 -4.96 115.26 109.68 3dzm n ASN 143 Ca 0.16 0.10 -0.25 0.00 -0.03 0.00 0.00 54.58 54.56 3dzm n ASN 143 Cb 0.33 -2.67 -0.17 0.00 -0.61 0.00 0.00 39.78 36.66 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 -0.90 0.81 0.26 3.41 2.96 -0.82 -2.11 118.68 122.28 3dzm s LEU 144 Ca 0.00 -0.29 0.11 0.00 -0.22 0.00 0.00 54.13 53.73 3dzm s LEU 144 Cb 0.00 -0.53 -0.05 0.00 0.50 0.00 0.00 46.19 46.11 3dzm s LEU 144 CO 0.00 -0.21 -0.19 -0.94 -1.32 0.00 0.00 176.35 173.69 3dzm s SER 145 N 1.91 3.38 -0.18 3.68 1.04 -0.77 -1.24 113.70 121.51 3dzm s SER 145 Ca 0.04 -1.03 -0.15 0.00 0.48 0.00 0.00 55.95 55.29 3dzm s SER 145 Cb -0.13 -0.27 -0.04 0.00 0.10 0.00 0.00 66.02 65.68 3dzm s SER 145 CO -0.06 -0.00 0.35 -0.22 0.98 0.00 0.00 173.24 174.28 3dzm s LEU 146 N -3.46 4.20 0.03 2.42 2.96 0.65 -0.48 118.68 125.00 3dzm s LEU 146 Ca 0.28 0.51 0.05 0.00 -0.22 0.00 0.00 54.13 54.76 3dzm s LEU 146 Cb -0.04 -2.44 -0.03 0.00 0.50 0.00 0.00 46.19 44.17 3dzm s LEU 146 CO 0.13 0.01 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.35 3dzm s VAL 147 N 0.90 3.14 -0.01 1.68 1.01 0.96 -1.14 120.40 126.94 3dzm s VAL 147 Ca 0.18 -1.01 0.03 0.00 0.00 0.00 0.00 61.98 61.17 3dzm s VAL 147 Cb -0.14 -2.34 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 3dzm s VAL 147 CO 0.06 0.36 -0.09 -0.83 0.00 0.00 0.00 175.10 174.60 3dzm s GLY 148 N -1.42 0.47 -0.07 4.51 0.00 0.33 -1.37 107.32 109.76 3dzm s GLY 148 Ca 0.16 -0.40 -0.03 0.00 0.00 0.00 0.00 44.72 44.44 3dzm s GLY 148 CO 0.06 -0.32 0.15 -0.35 0.00 0.00 0.00 173.10 172.64 3dzm s ASP 149 N -0.19 0.19 -0.11 1.64 2.15 -0.13 -0.39 116.67 119.84 3dzm s ASP 149 Ca 0.03 0.31 -0.00 0.00 0.43 0.00 0.00 52.55 53.31 3dzm s ASP 149 Cb -0.04 0.21 0.02 0.00 -0.30 0.00 0.00 42.92 42.81 3dzm s ASP 149 CO -0.00 -0.18 -0.07 -0.22 -0.17 0.00 0.00 175.17 174.52 3dzm s LEU 150 N 1.56 1.19 0.37 -1.34 2.96 -0.78 -0.75 118.68 121.88 3dzm s LEU 150 Ca -0.05 -0.28 -0.09 0.00 -0.22 0.00 0.00 54.13 53.48 3dzm s LEU 150 Cb -0.12 -0.81 0.03 0.00 0.50 0.00 0.00 46.19 45.79 3dzm s LEU 150 CO -0.06 -0.11 0.64 -0.83 -1.32 0.00 0.00 176.35 174.67 3dzm s GLY 151 N 1.62 0.92 -0.04 7.98 0.00 -0.14 -0.03 107.32 117.62 3dzm s GLY 151 Ca 0.03 -1.12 0.02 0.00 0.00 0.00 0.00 44.72 43.65 3dzm s GLY 151 CO -0.07 -0.64 -0.09 0.54 0.00 0.00 0.00 173.10 172.84 3dzm s VAL 152 N -2.68 0.81 0.17 1.40 0.11 -0.18 0.69 120.40 120.72 3dzm s VAL 152 Ca 0.23 -0.33 0.09 0.00 -2.93 0.00 0.00 61.98 59.03 3dzm s VAL 152 Cb -0.03 -0.74 -0.04 0.00 -1.53 0.00 0.00 36.38 34.04 3dzm s VAL 152 CO 0.16 0.27 -0.13 -1.81 -3.33 0.00 0.00 175.10 170.26 3dzm s ASP 153 N 0.46 4.10 -0.09 3.54 1.01 0.05 -2.09 116.67 123.65 3dzm s ASP 153 Ca -0.08 -0.60 0.04 0.00 0.71 0.00 0.00 52.55 52.62 3dzm s ASP 153 Cb -0.12 -0.64 -0.00 0.00 1.01 0.00 0.00 42.92 43.17 3dzm s ASP 153 CO 0.01 0.12 -0.23 -0.47 0.21 0.00 0.00 175.17 174.81 3dzm s TYR 154 N -1.60 2.43 -0.10 4.23 5.04 0.98 -0.79 117.35 127.54 3dzm s TYR 154 Ca 0.23 -0.93 0.02 0.00 -2.44 0.00 0.00 57.07 53.95 3dzm s TYR 154 Cb -0.09 -1.62 -0.01 0.00 0.35 0.00 0.00 41.96 40.58 3dzm s TYR 154 CO 0.14 -0.36 -0.16 0.71 -1.34 0.00 0.00 175.55 174.54 3dzm s TYR 155 N 0.24 2.73 0.40 4.97 2.02 0.86 -1.27 117.35 127.30 3dzm s TYR 155 Ca -0.15 -0.61 -0.23 0.00 -0.37 0.00 0.00 57.07 55.71 3dzm s TYR 155 Cb -0.17 -1.76 -0.10 0.00 -0.40 0.00 0.00 41.96 39.53 3dzm s TYR 155 CO 0.07 -0.16 1.00 -0.06 -1.57 0.00 0.00 175.55 174.83 3dzm s PHE 156 N 0.09 3.34 0.36 2.71 0.08 -0.90 -4.59 117.98 119.07 3dzm s PHE 156 Ca -0.07 1.66 -0.28 0.00 0.12 0.00 0.00 56.93 58.36 3dzm s PHE 156 Cb -0.15 -3.00 -0.10 0.00 -0.57 0.00 0.00 43.02 39.20 3dzm s PHE 156 CO 0.05 -0.31 1.36 -0.65 -0.10 0.00 0.00 175.22 175.56 3dzm s GLN 157 N -2.67 4.23 0.37 0.44 -0.21 -1.26 -4.54 119.66 116.02 3dzm s GLN 157 Ca 0.58 2.31 0.05 0.00 0.02 0.00 0.00 55.36 58.32 3dzm s GLN 157 Cb -0.17 -3.00 -0.03 0.00 1.00 0.00 0.00 33.01 30.82 3dzm s GLN 157 CO 0.22 -0.33 0.19 0.00 -2.12 0.00 0.00 175.29 173.24 3dzm s ALA 158 N -1.15 2.43 0.56 6.09 0.00 -1.26 -4.93 121.76 123.50 3dzm s ALA 158 Ca 0.51 -1.58 -0.19 0.00 0.00 0.00 0.00 51.96 50.69 3dzm s ALA 158 Cb -0.41 1.07 -0.06 0.00 0.00 0.00 0.00 23.12 23.71 3dzm s ALA 158 CO 0.55 -0.48 0.93 0.00 0.00 0.00 0.00 175.76 176.76 3dzm s PHE 160 N -1.49 2.88 -0.17 0.00 0.08 -0.58 -4.41 117.98 114.29 3dzm s PHE 160 Ca 0.72 -0.61 -0.03 0.00 0.12 0.00 0.00 56.93 57.13 3dzm s PHE 160 Cb -0.44 -1.91 -0.02 0.00 -0.57 0.00 0.00 43.02 40.08 3dzm s PHE 160 CO 0.50 -0.22 -0.05 0.99 -0.10 0.00 0.00 175.22 176.33 3dzm s THR 161 N 0.51 3.58 -0.20 0.64 2.01 0.31 -2.23 115.64 120.25 3dzm s THR 161 Ca -0.07 -0.46 -0.07 0.00 0.31 0.00 0.00 61.69 61.41 3dzm s THR 161 Cb -0.15 -2.58 -0.04 0.00 0.01 0.00 0.00 72.50 69.75 3dzm s THR 161 CO 0.04 0.47 0.05 -0.60 -0.69 0.00 0.00 174.62 173.89 3dzm s ARG 162 N 0.73 3.84 -0.24 4.92 3.52 -0.44 -1.03 118.95 130.26 3dzm s ARG 162 Ca -0.02 -0.41 -0.05 0.00 -0.13 0.00 0.00 55.73 55.12 3dzm s ARG 162 Cb -0.15 -3.22 -0.01 0.00 -1.56 0.00 0.00 34.95 30.02 3dzm s ARG 162 CO 0.02 0.12 -0.01 0.08 -0.81 0.00 0.00 175.30 174.71 3dzm s VAL 163 N 0.77 3.59 0.04 7.11 1.01 -0.10 -1.62 120.40 131.20 3dzm s VAL 163 Ca 0.03 -0.50 -0.06 0.00 0.00 0.00 0.00 61.98 61.45 3dzm s VAL 163 Cb -0.14 -2.69 -0.05 0.00 0.00 0.00 0.00 36.38 33.51 3dzm s VAL 163 CO 0.02 0.34 0.30 -0.70 0.00 0.00 0.00 175.10 175.06 3dzm s GLU 164 N 1.50 3.60 0.00 2.72 2.12 -0.45 -0.93 118.70 127.26 3dzm s GLU 164 Ca 0.05 -0.07 0.06 0.00 0.36 0.00 0.00 54.97 55.37 3dzm s GLU 164 Cb -0.15 -3.03 -0.02 0.00 0.26 0.00 0.00 34.13 31.19 3dzm s GLU 164 CO -0.01 0.61 -0.18 -2.00 -0.54 0.00 0.00 175.26 173.13 3dzm s GLU 165 N -1.96 1.42 0.45 4.30 2.12 0.16 -1.76 118.70 123.42 3dzm s GLU 165 Ca 0.31 -0.71 -0.05 0.00 0.36 0.00 0.00 54.97 54.87 3dzm s GLU 165 Cb -0.13 -1.41 -0.04 0.00 0.26 0.00 0.00 34.13 32.81 3dzm s GLU 165 CO 0.18 0.38 0.75 -0.51 -0.54 0.00 0.00 175.26 175.52 3dzm s ASP 166 N -0.62 6.31 0.23 -1.70 1.11 -0.03 -3.42 116.67 118.54 3dzm s ASP 166 Ca 0.07 0.89 -0.07 0.00 0.18 0.00 0.00 52.55 53.62 3dzm s ASP 166 Cb -0.07 -2.23 0.39 0.00 1.07 0.00 0.00 42.92 42.08 3dzm s ASP 166 CO -0.00 -0.51 1.68 0.44 1.18 0.00 0.00 175.17 177.96 3dzm h ASP 167 N 0.47 -0.05 0.32 0.27 3.32 -1.66 0.24 116.42 119.34 3dzm h ASP 167 Ca -0.47 0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.72 3dzm h ASP 167 Cb 1.20 0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.96 3dzm h ASP 167 CO 0.62 -0.05 0.00 -1.20 -1.72 0.00 0.00 179.24 176.90 3dzm n SER 168 N -5.18 0.08 0.00 6.45 7.64 -1.26 -4.86 113.62 116.49 3dzm n SER 168 Ca 0.12 0.53 0.00 0.00 1.01 0.00 0.00 58.87 60.53 3dzm n SER 168 Cb 0.41 -0.54 0.00 0.00 -1.01 0.00 0.00 64.21 63.07 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 -0.58 0.62 3.71 0.23 0.00 0.07 -5.05 105.19 104.19 3dzm n GLY 169 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.84 6.75 0.00 1.61 0.01 -1.26 -4.68 114.94 114.53 3dzm s ASN 170 Ca 0.00 2.39 -0.07 0.00 -0.71 0.00 0.00 52.86 54.47 3dzm s ASN 170 Cb 0.00 -2.58 -0.05 0.00 0.41 0.00 0.00 41.25 39.03 3dzm s ASN 170 CO 0.00 -0.72 0.27 -0.54 -1.51 0.00 0.00 177.10 174.60 3dzm s LYS 171 N 1.37 3.59 0.10 -0.60 1.02 -1.26 -0.85 119.74 123.10 3dzm s LYS 171 Ca 0.67 -0.05 0.04 0.00 0.02 0.00 0.00 55.97 56.64 3dzm s LYS 171 Cb -0.38 -3.09 -0.04 0.00 -0.52 0.00 0.00 37.83 33.80 3dzm s LYS 171 CO 0.30 0.66 -0.10 -1.54 -0.92 0.00 0.00 175.35 173.75 3dzm s SER 172 N -1.63 1.45 -0.02 2.83 1.04 -0.72 -4.99 113.70 111.65 3dzm s SER 172 Ca 0.27 -0.81 0.03 0.00 0.48 0.00 0.00 55.95 55.92 3dzm s SER 172 Cb -0.13 0.01 -0.00 0.00 0.10 0.00 0.00 66.02 65.99 3dzm s SER 172 CO 0.15 -0.26 -0.10 -1.58 0.98 0.00 0.00 173.24 172.43 3dzm s GLN 173 N -2.77 1.01 0.23 4.02 0.74 -1.26 -1.34 119.66 120.29 3dzm s GLN 173 Ca 0.05 -0.35 0.00 0.00 0.05 0.00 0.00 55.36 55.12 3dzm s GLN 173 Cb -0.03 -0.94 -0.05 0.00 1.10 0.00 0.00 33.01 33.09 3dzm s GLN 173 CO 0.00 0.16 0.10 -1.54 -0.55 0.00 0.00 175.29 173.46 3dzm s SER 174 N 0.06 0.83 0.23 6.67 1.04 -0.64 -5.01 113.70 116.89 3dzm s SER 174 Ca -0.01 -1.38 -0.16 0.00 0.48 0.00 0.00 55.95 54.88 3dzm s SER 174 Cb -0.08 0.24 0.01 0.00 0.10 0.00 0.00 66.02 66.29 3dzm s SER 174 CO 0.00 -0.76 0.52 -0.94 0.98 0.00 0.00 173.24 173.04 3dzm s SER 175 N -3.25 -0.17 -0.04 7.02 1.04 -1.26 -1.33 113.70 115.71 3dzm s SER 175 Ca 0.38 -0.70 -0.06 0.00 0.48 0.00 0.00 55.95 56.04 3dzm s SER 175 Cb 0.08 0.60 0.01 0.00 0.10 0.00 0.00 66.02 66.80 3dzm s SER 175 CO 0.13 -1.12 0.15 0.54 0.98 0.00 0.00 173.24 173.92 3dzm s VAL 176 N -3.94 0.03 0.19 5.02 0.11 -0.95 -5.00 120.40 115.86 3dzm s VAL 176 Ca 0.15 -0.25 0.08 0.00 -2.93 0.00 0.00 61.98 59.03 3dzm s VAL 176 Cb -0.01 -0.31 -0.05 0.00 -1.53 0.00 0.00 36.38 34.48 3dzm s VAL 176 CO 0.04 -0.14 -0.16 0.00 -3.33 0.00 0.00 175.10 171.51 3dzm s PRO 178 N -3.38 4.47 -0.88 0.00 0.04 -1.26 0.68 135.00 134.66 3dzm s PRO 178 Ca 0.20 1.99 -0.01 0.00 0.04 0.00 0.00 61.00 63.22 3dzm s PRO 178 Cb -0.02 -3.17 0.22 0.00 0.04 0.00 0.00 34.50 31.56 3dzm s PRO 178 CO 0.07 -0.08 0.77 0.20 0.04 0.00 0.00 177.00 178.00 3dzm s GLY 179 N -0.23 3.06 1.18 0.56 0.00 -1.26 -5.02 107.32 105.62 3dzm s GLY 179 Ca 0.51 -3.83 -0.17 0.00 0.00 0.00 0.00 44.72 41.22 3dzm s GLY 179 CO 0.42 1.19 1.06 0.99 0.00 0.00 0.00 173.10 176.76 3dzm s ASP 180 N -0.17 1.00 0.04 1.64 1.01 0.21 -4.96 116.67 115.44 3dzm s ASP 180 Ca 0.27 0.94 -0.26 0.00 0.71 0.00 0.00 52.55 54.21 3dzm s ASP 180 Cb -0.07 -1.40 -0.17 0.00 1.01 0.00 0.00 42.92 42.28 3dzm s ASP 180 CO -0.12 -4.11 1.43 -1.28 0.21 0.00 0.00 175.17 171.30 3dzm h SER 181 N -2.56 -0.34 -0.13 0.27 0.87 -2.01 -2.95 113.55 106.69 3dzm h SER 181 Ca -0.50 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 59.94 3dzm h SER 181 Cb 1.32 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.37 3dzm h SER 181 CO 0.42 -0.08 0.00 0.61 -0.53 0.00 0.00 176.83 177.25 3dzm n GLY 182 N -0.70 1.28 0.07 5.77 0.00 -1.26 -4.51 105.19 105.84 3dzm n GLY 182 Ca -0.10 -0.19 -0.14 0.00 0.00 0.00 0.00 46.02 45.59 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 0.89 0.09 -0.23 1.61 3.20 -1.82 -2.82 116.97 117.88 3dzm h TYR 183 Ca 0.00 -0.04 0.07 0.00 3.14 0.00 0.00 58.73 61.90 3dzm h TYR 183 Cb 0.66 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.91 3dzm h TYR 183 CO 0.20 0.70 0.19 0.93 -1.64 0.00 0.00 178.16 178.54 3dzm h GLU 184 N -0.55 0.00 0.04 1.82 5.08 -1.82 0.26 114.58 119.42 3dzm h GLU 184 Ca -0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 3dzm h GLU 184 Cb 0.70 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.96 3dzm h GLU 184 CO 0.01 0.00 -0.38 -0.44 -1.00 0.00 0.00 179.01 177.20 3dzm h ASP 185 N 0.00 0.26 -0.97 1.42 3.45 -1.84 -2.80 116.42 115.93 3dzm h ASP 185 Ca 0.11 -0.89 0.11 0.00 0.43 0.00 0.00 57.03 56.79 3dzm h ASP 185 Cb 0.48 -0.08 -0.08 0.00 -0.56 0.00 0.00 39.33 39.09 3dzm h ASP 185 CO -0.00 1.13 0.60 0.58 -1.57 0.00 0.00 179.24 179.98 3dzm h VAL 186 N -0.57 0.92 -0.10 -1.35 2.07 -1.25 -2.22 116.25 113.76 3dzm h VAL 186 Ca -0.06 -0.33 -0.09 0.00 0.82 0.00 0.00 66.70 67.04 3dzm h VAL 186 Cb 1.23 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 3dzm h VAL 186 CO 0.07 0.18 -0.33 -1.13 0.02 0.00 0.00 177.57 176.38 3dzm h ASN 187 N 0.96 0.21 -0.23 0.57 -1.24 -0.96 0.20 115.58 115.09 3dzm h ASN 187 Ca 0.48 -0.07 -0.09 0.00 0.71 0.00 0.00 56.30 57.32 3dzm h ASN 187 Cb 0.45 -0.06 -0.00 0.00 0.73 0.00 0.00 38.32 39.44 3dzm h ASN 187 CO -0.26 0.54 -0.23 0.11 -1.29 0.00 0.00 177.43 176.30 3dzm h LYS 188 N 0.18 0.55 0.13 6.67 1.57 -1.19 -3.34 116.57 121.15 3dzm h LYS 188 Ca 0.02 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.50 3dzm h LYS 188 Cb 0.68 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.00 3dzm h LYS 188 CO 0.05 0.88 -0.06 0.35 -0.57 0.00 0.00 179.45 180.10 3dzm h PHE 189 N 0.25 -0.16 -3.60 -1.35 3.57 -1.22 -3.45 116.94 110.98 3dzm h PHE 189 Ca 0.04 -0.00 -0.51 0.00 3.53 0.00 0.00 57.97 61.02 3dzm h PHE 189 Cb 0.78 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.57 3dzm h PHE 189 CO 0.08 0.30 0.42 0.08 -2.23 0.00 0.00 178.31 176.96 3dzm s VAL 190 N -3.74 4.11 -0.92 1.41 1.01 0.68 -1.00 120.40 121.93 3dzm s VAL 190 Ca -0.14 1.84 -0.00 0.00 0.00 0.00 0.00 61.98 63.68 3dzm s VAL 190 Cb 0.01 -4.17 0.30 0.00 0.00 0.00 0.00 36.38 32.52 3dzm s VAL 190 CO 0.55 0.33 1.37 0.35 0.00 0.00 0.00 175.10 177.69 3dzm n THR 191 N 2.36 4.72 -2.31 3.92 -2.24 0.22 -4.78 114.28 116.17 3dzm n THR 191 Ca 0.02 -5.78 -0.25 0.00 -2.27 0.00 0.00 64.05 55.76 3dzm n THR 191 Cb 0.47 -1.86 0.10 0.00 -2.10 0.00 0.00 70.33 66.94 3dzm n THR 191 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dzm s GLN 192 N -3.22 1.78 0.28 -0.78 0.00 -1.26 -4.67 119.66 111.78 3dzm s GLN 192 Ca 0.37 -0.60 -0.30 0.00 -0.00 0.00 0.00 55.36 54.83 3dzm s GLN 192 Cb 0.13 -2.19 -0.10 0.00 0.00 0.00 0.00 33.01 30.85 3dzm s GLN 192 CO -0.00 -1.47 1.45 -2.14 0.00 0.00 0.00 175.29 173.12 3dzm s PRO 193 N -5.29 4.24 0.00 9.60 0.02 -1.26 -4.93 135.00 137.39 3dzm s PRO 193 Ca 0.64 2.36 0.00 0.00 0.02 0.00 0.00 61.00 64.02 3dzm s PRO 193 Cb -0.08 -3.08 0.00 0.00 0.02 0.00 0.00 34.50 31.37 3dzm s PRO 193 CO 0.45 -0.43 0.00 -1.91 -0.33 0.00 0.00 177.00 174.79 3dzm n GLU 194 N 1.89 0.00 -3.11 5.54 2.13 -1.26 -4.61 120.64 121.21 3dzm n GLU 194 Ca 0.05 0.00 -0.39 0.00 0.66 0.00 0.00 57.16 57.48 3dzm n GLU 194 Cb 0.40 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.06 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 0.00 3.50 -0.03 4.31 0.52 -1.26 -0.10 118.94 125.89 3dzm s TRP 195 Ca 0.00 1.09 0.06 0.00 0.02 0.00 0.00 56.10 57.27 3dzm s TRP 195 Cb 0.00 -2.76 -0.01 0.00 -1.15 0.00 0.00 33.47 29.54 3dzm s TRP 195 CO 0.00 0.02 -0.22 0.08 0.02 0.00 0.00 176.95 176.85 3dzm s VAL 196 N 1.13 1.74 -0.16 4.03 1.01 0.03 -4.98 120.40 123.19 3dzm s VAL 196 Ca 0.33 -0.92 -0.09 0.00 0.00 0.00 0.00 61.98 61.30 3dzm s VAL 196 Cb -0.17 -1.45 -0.05 0.00 0.00 0.00 0.00 36.38 34.72 3dzm s VAL 196 CO 0.14 0.49 0.14 -0.22 0.00 0.00 0.00 175.10 175.65 3dzm s LEU 197 N -0.38 4.29 -0.15 3.92 2.96 -1.26 -0.77 118.68 127.29 3dzm s LEU 197 Ca 0.05 0.35 0.02 0.00 -0.22 0.00 0.00 54.13 54.33 3dzm s LEU 197 Cb -0.10 -2.09 0.01 0.00 0.50 0.00 0.00 46.19 44.52 3dzm s LEU 197 CO 0.00 0.28 -0.21 -0.75 -1.32 0.00 0.00 176.35 174.36 3dzm s LYS 198 N -0.27 2.95 -0.16 1.98 2.20 0.22 -3.21 119.74 123.44 3dzm s LYS 198 Ca 0.11 -0.82 -0.03 0.00 -0.36 0.00 0.00 55.97 54.88 3dzm s LYS 198 Cb -0.12 -2.45 0.05 0.00 -1.51 0.00 0.00 37.83 33.81 3dzm s LYS 198 CO 0.01 -0.09 0.03 -1.17 -0.36 0.00 0.00 175.35 173.77 3dzm s LEU 199 N 1.01 0.96 0.02 5.43 2.96 0.44 -0.96 118.68 128.53 3dzm s LEU 199 Ca -0.02 -0.59 0.01 0.00 -0.22 0.00 0.00 54.13 53.31 3dzm s LEU 199 Cb -0.15 -0.53 -0.02 0.00 0.50 0.00 0.00 46.19 46.00 3dzm s LEU 199 CO -0.06 -0.27 -0.04 -0.13 -1.32 0.00 0.00 176.35 174.52 3dzm s ARG 200 N 1.91 0.35 0.07 1.98 0.52 0.07 -0.02 118.95 123.82 3dzm s ARG 200 Ca 0.01 -0.51 0.08 0.00 -0.52 0.00 0.00 55.73 54.80 3dzm s ARG 200 Cb -0.16 -0.11 -0.03 0.00 0.52 0.00 0.00 34.95 35.17 3dzm s ARG 200 CO -0.07 0.01 -0.21 -0.51 0.02 0.00 0.00 175.30 174.54 3dzm s LEU 201 N -1.09 2.50 0.00 2.53 1.43 -0.65 -0.95 118.68 122.44 3dzm s LEU 201 Ca -0.09 -0.52 -0.07 0.00 -1.03 0.00 0.00 54.13 52.42 3dzm s LEU 201 Cb -0.07 -1.44 0.02 0.00 0.03 0.00 0.00 46.19 44.73 3dzm s LEU 201 CO -0.00 0.23 0.32 0.61 0.23 0.00 0.00 176.35 177.74 3dzm n GLY 202 N 1.38 1.01 3.05 -3.19 0.00 -0.47 -1.17 105.19 105.80 3dzm n GLY 202 Ca -0.16 -0.98 -0.18 0.00 0.00 0.00 0.00 46.02 44.70 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 -1.31 0.81 -0.00 4.61 0.00 -0.67 -0.03 121.76 125.17 3dzm s ALA 203 Ca 0.07 -0.55 0.03 0.00 0.00 0.00 0.00 51.96 51.52 3dzm s ALA 203 Cb -0.01 -0.15 -0.03 0.00 0.00 0.00 0.00 23.12 22.93 3dzm s ALA 203 CO 0.01 0.16 -0.08 0.00 0.00 0.00 0.00 175.76 175.86 3dzm s ALA 204 N -0.55 2.98 -0.12 0.00 0.00 0.37 -1.81 121.76 122.63 3dzm s ALA 204 Ca 0.01 -1.01 0.02 0.00 0.00 0.00 0.00 51.96 50.98 3dzm s ALA 204 Cb -0.05 -1.11 0.01 0.00 0.00 0.00 0.00 23.12 21.96 3dzm s ALA 204 CO 0.00 0.61 -0.19 -0.47 0.00 0.00 0.00 175.76 175.71 3dzm s TYR 205 N -0.96 2.35 0.03 0.00 5.04 0.37 -1.86 117.35 122.31 3dzm s TYR 205 Ca 0.16 -1.14 -0.27 0.00 -2.44 0.00 0.00 57.07 53.38 3dzm s TYR 205 Cb -0.11 -1.63 -0.04 0.00 0.35 0.00 0.00 41.96 40.53 3dzm s TYR 205 CO 0.07 -0.54 0.87 0.50 -1.34 0.00 0.00 175.55 175.11 3dzm s ARG 206 N 0.85 4.56 0.00 4.97 3.52 -0.90 -1.48 118.95 130.47 3dzm s ARG 206 Ca -0.08 1.24 0.00 0.00 -0.13 0.00 0.00 55.73 56.76 3dzm s ARG 206 Cb -0.15 -3.41 0.00 0.00 -1.56 0.00 0.00 34.95 29.82 3dzm s ARG 206 CO -0.01 0.12 0.13 1.97 -0.81 0.00 0.00 175.30 176.71