#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dd3 s PRO 1 N 0.00 3.08 0.60 0.03 0.04 -1.26 -4.92 135.00 132.57 3dd3 s PRO 1 Ca 0.00 1.70 0.38 0.00 0.04 0.00 0.00 61.00 63.12 3dd3 s PRO 1 Cb 0.00 -1.96 1.83 0.00 0.04 0.00 0.00 34.50 34.41 3dd3 s PRO 1 CO 0.00 -1.09 2.15 -1.00 0.04 0.00 0.00 177.00 177.10 3dd3 h PRO 2 N 0.89 0.00 -6.06 0.56 0.13 -1.94 -3.45 132.00 122.14 3dd3 h PRO 2 Ca -0.50 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 63.99 3dd3 h PRO 2 Cb 1.28 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.33 3dd3 h PRO 2 CO 0.55 0.01 -0.57 0.71 -0.23 0.00 0.00 178.00 178.47 3dd3 s TYR 3 N -3.89 3.29 -0.08 1.56 2.02 -1.26 -1.86 117.35 117.13 3dd3 s TYR 3 Ca -0.02 0.16 -0.05 0.00 -0.37 0.00 0.00 57.07 56.79 3dd3 s TYR 3 Cb 0.11 -1.69 0.03 0.00 -0.40 0.00 0.00 41.96 40.00 3dd3 s TYR 3 CO 0.49 0.55 0.19 0.99 -1.57 0.00 0.00 175.55 176.20 3dd3 s THR 4 N -1.33 -0.02 -0.17 -0.71 2.01 -0.85 -0.79 115.64 113.77 3dd3 s THR 4 Ca 0.28 0.08 0.01 0.00 0.31 0.00 0.00 61.69 62.37 3dd3 s THR 4 Cb -0.12 -0.29 0.02 0.00 0.01 0.00 0.00 72.50 72.12 3dd3 s THR 4 CO 0.20 0.03 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.29 3dd3 s VAL 5 N 0.65 1.94 -0.27 3.82 1.01 0.56 -1.85 120.40 126.27 3dd3 s VAL 5 Ca -0.05 -0.87 -0.03 0.00 0.00 0.00 0.00 61.98 61.04 3dd3 s VAL 5 Cb -0.06 -1.77 0.03 0.00 0.00 0.00 0.00 36.38 34.58 3dd3 s VAL 5 CO -0.03 0.51 -0.02 -0.69 0.00 0.00 0.00 175.10 174.87 3dd3 s VAL 6 N 1.34 3.10 0.24 2.92 1.01 -0.64 -0.09 120.40 128.27 3dd3 s VAL 6 Ca 0.05 -1.07 -0.18 0.00 0.00 0.00 0.00 61.98 60.78 3dd3 s VAL 6 Cb -0.13 -2.64 0.02 0.00 0.00 0.00 0.00 36.38 33.63 3dd3 s VAL 6 CO -0.12 0.09 0.59 -0.47 0.00 0.00 0.00 175.10 175.19 3dd3 s TYR 7 N 1.34 -0.04 0.87 5.22 5.04 -1.09 -0.91 117.35 127.76 3dd3 s TYR 7 Ca -0.01 -0.34 -0.11 0.00 -2.44 0.00 0.00 57.07 54.16 3dd3 s TYR 7 Cb -0.18 0.47 0.11 0.00 0.35 0.00 0.00 41.96 42.72 3dd3 s TYR 7 CO -0.02 -1.06 1.09 -0.06 -1.34 0.00 0.00 175.55 174.16 3dd3 s PHE 8 N -3.92 2.38 -1.54 4.97 0.08 -1.26 -1.23 117.98 117.46 3dd3 s PHE 8 Ca 0.13 1.33 -0.12 0.00 0.12 0.00 0.00 56.93 58.39 3dd3 s PHE 8 Cb -0.03 -3.13 -0.02 0.00 -0.57 0.00 0.00 43.02 39.27 3dd3 s PHE 8 CO 0.04 -2.25 2.57 -0.35 -0.10 0.00 0.00 175.22 175.13 3dd3 n PRO 9 N -3.80 3.27 -4.04 0.24 -0.04 -1.26 -4.79 135.00 124.58 3dd3 n PRO 9 Ca 0.07 -2.42 -0.08 0.00 -0.04 0.00 0.00 63.50 61.03 3dd3 n PRO 9 Cb 0.55 -3.06 -0.11 0.00 -0.04 0.00 0.00 33.50 30.85 3dd3 n PRO 9 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3dd3 s VAL 10 N 2.68 0.22 -0.02 0.52 1.01 -1.26 -4.42 120.40 119.13 3dd3 s VAL 10 Ca 0.58 -1.38 -0.22 0.00 0.00 0.00 0.00 61.98 60.96 3dd3 s VAL 10 Cb 0.16 -0.92 -0.14 0.00 0.00 0.00 0.00 36.38 35.48 3dd3 s VAL 10 CO -0.08 -0.74 0.97 0.03 0.00 0.00 0.00 175.10 175.29 3dd3 h ARG 11 N 3.88 -0.49 0.00 2.72 3.08 -1.12 -3.46 114.38 118.99 3dd3 h ARG 11 Ca -0.33 0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.75 3dd3 h ARG 11 Cb 1.18 0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.34 3dd3 h ARG 11 CO 0.53 -0.19 0.00 0.41 -1.07 0.00 0.00 179.97 179.66 3dd3 n GLY 12 N 0.01 1.48 0.12 0.04 0.00 0.12 -1.14 105.19 105.83 3dd3 n GLY 12 Ca -0.09 0.14 0.15 0.00 0.00 0.00 0.00 46.02 46.23 3dd3 n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dd3 n ARG 13 N 9.18 1.17 -0.00 1.61 1.74 -1.26 -3.48 116.66 125.62 3dd3 n ARG 13 Ca 0.00 -0.25 0.08 0.00 -0.77 0.00 0.00 57.85 56.91 3dd3 n ARG 13 Cb 0.00 -1.49 -0.10 0.00 -1.02 0.00 0.00 32.46 29.85 3dd3 n ARG 13 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3dd3 h ALA 15 N 2.08 -0.53 0.16 0.00 0.00 -1.36 0.19 119.26 119.79 3dd3 h ALA 15 Ca 0.00 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.95 3dd3 h ALA 15 Cb 0.46 0.91 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 3dd3 h ALA 15 CO 0.00 -0.91 -0.17 0.00 0.00 0.00 0.00 179.25 178.16 3dd3 h ALA 16 N 0.27 -0.34 -0.84 0.00 0.00 -1.82 0.25 119.26 116.78 3dd3 h ALA 16 Ca 0.11 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.99 3dd3 h ALA 16 Cb 0.60 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 3dd3 h ALA 16 CO -0.54 -0.72 0.56 1.37 0.00 0.00 0.00 179.25 179.92 3dd3 h LEU 17 N -0.37 0.96 -1.52 0.00 8.10 -1.80 -1.09 115.31 119.59 3dd3 h LEU 17 Ca 0.01 -0.02 -0.05 0.00 0.11 0.00 0.00 57.88 57.93 3dd3 h LEU 17 Cb 0.36 -0.24 -0.01 0.00 -0.44 0.00 0.00 40.66 40.33 3dd3 h LEU 17 CO -0.05 0.70 -0.18 0.03 -4.11 0.00 0.00 178.44 174.82 3dd3 h ARG 18 N 1.14 0.08 0.09 0.17 3.08 -0.26 -1.32 114.38 117.36 3dd3 h ARG 18 Ca 0.31 -0.02 -0.27 0.00 0.07 0.00 0.00 59.98 60.07 3dd3 h ARG 18 Cb -0.13 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 29.93 3dd3 h ARG 18 CO -0.07 0.26 -1.15 0.52 -1.07 0.00 0.00 179.97 178.46 3dd3 h MET 19 N 0.08 0.45 0.59 0.04 2.86 -0.09 -1.52 114.93 117.34 3dd3 h MET 19 Ca 0.01 -0.61 -0.03 0.00 -2.06 0.00 0.00 59.70 57.02 3dd3 h MET 19 Cb 0.37 0.20 0.01 0.00 0.06 0.00 0.00 31.60 32.23 3dd3 h MET 19 CO 0.03 1.25 -0.28 1.25 1.06 0.00 0.00 176.91 180.21 3dd3 h LEU 20 N 0.20 -0.67 -0.19 1.22 6.46 -1.05 0.25 115.31 121.53 3dd3 h LEU 20 Ca -0.14 -0.02 0.05 0.00 -0.12 0.00 0.00 57.88 57.66 3dd3 h LEU 20 Cb 1.83 0.17 -0.07 0.00 -0.73 0.00 0.00 40.66 41.86 3dd3 h LEU 20 CO 0.21 -0.41 -0.34 -0.07 -0.62 0.00 0.00 178.44 177.21 3dd3 h LEU 21 N -0.90 -1.07 -0.50 2.25 3.38 -1.33 0.14 115.31 117.27 3dd3 h LEU 21 Ca -0.08 0.16 0.08 0.00 0.09 0.00 0.00 57.88 58.13 3dd3 h LEU 21 Cb 0.65 0.46 -0.07 0.00 0.09 0.00 0.00 40.66 41.79 3dd3 h LEU 21 CO 0.13 -0.36 0.12 0.00 0.09 0.00 0.00 178.44 178.42 3dd3 h ALA 22 N 0.43 0.57 0.00 1.53 0.00 -1.22 -1.20 119.26 119.38 3dd3 h ALA 22 Ca 0.11 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 3dd3 h ALA 22 Cb 0.56 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3dd3 h ALA 22 CO -0.40 -0.29 -0.40 0.22 0.00 0.00 0.00 179.25 178.39 3dd3 h ASP 23 N 0.26 0.00 0.18 0.00 3.58 -0.31 -2.29 116.42 117.83 3dd3 h ASP 23 Ca 0.25 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.70 3dd3 h ASP 23 Cb 0.32 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.37 3dd3 h ASP 23 CO -0.31 0.40 -0.07 0.00 -2.88 0.00 0.00 179.24 176.37 3dd3 n GLN 24 N -3.79 1.02 -2.45 0.28 1.13 0.02 -4.81 117.38 108.78 3dd3 n GLN 24 Ca -0.01 -0.41 -0.11 0.00 -1.94 0.00 0.00 57.00 54.54 3dd3 n GLN 24 Cb 0.47 -1.49 0.01 0.00 0.11 0.00 0.00 30.24 29.33 3dd3 n GLN 24 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3dd3 n GLY 25 N 1.20 0.04 3.90 1.08 0.00 -0.74 -5.02 105.19 105.65 3dd3 n GLY 25 Ca 0.17 -0.39 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 3dd3 n GLY 25 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dd3 s GLN 26 N -4.85 3.59 0.18 1.61 -1.52 -0.53 -5.04 119.66 113.10 3dd3 s GLN 26 Ca 0.09 -0.14 -0.01 0.00 -1.95 0.00 0.00 55.36 53.34 3dd3 s GLN 26 Cb -0.04 -2.88 -0.04 0.00 -0.22 0.00 0.00 33.01 29.83 3dd3 s GLN 26 CO 0.11 0.49 0.38 -1.54 -0.25 0.00 0.00 175.29 174.47 3dd3 s SER 27 N -2.45 6.40 0.15 5.90 1.04 -1.26 -4.48 113.70 119.00 3dd3 s SER 27 Ca 0.40 0.42 -0.18 0.00 0.48 0.00 0.00 55.95 57.07 3dd3 s SER 27 Cb -0.12 -2.02 0.04 0.00 0.10 0.00 0.00 66.02 64.02 3dd3 s SER 27 CO 0.25 -0.01 0.48 -1.66 0.98 0.00 0.00 173.24 173.27 3dd3 s TRP 28 N -1.81 -0.25 -0.12 5.02 -2.14 -1.26 -4.36 118.94 114.02 3dd3 s TRP 28 Ca 0.39 -0.06 -0.05 0.00 2.66 0.00 0.00 56.10 59.04 3dd3 s TRP 28 Cb -0.11 0.36 -0.04 0.00 -3.10 0.00 0.00 33.47 30.58 3dd3 s TRP 28 CO 0.28 -0.79 0.08 0.21 -2.66 0.00 0.00 176.95 174.07 3dd3 s LYS 29 N -3.81 3.35 -0.31 3.25 2.20 0.02 -4.97 119.74 119.48 3dd3 s LYS 29 Ca 0.04 -0.26 -0.11 0.00 -0.36 0.00 0.00 55.97 55.28 3dd3 s LYS 29 Cb 0.00 -3.05 -0.02 0.00 -1.51 0.00 0.00 37.83 33.26 3dd3 s LYS 29 CO -0.10 0.67 0.19 -1.21 -0.36 0.00 0.00 175.35 174.55 3dd3 s GLU 30 N -0.76 3.56 -0.22 4.03 0.41 -1.26 -0.32 118.70 124.14 3dd3 s GLU 30 Ca 0.13 -0.58 -0.10 0.00 -0.41 0.00 0.00 54.97 54.00 3dd3 s GLU 30 Cb -0.12 -3.66 -0.05 0.00 -1.78 0.00 0.00 34.13 28.52 3dd3 s GLU 30 CO 0.03 -0.36 0.13 -2.00 -0.49 0.00 0.00 175.26 172.57 3dd3 s GLU 31 N 1.69 4.10 -0.09 1.61 2.12 0.87 -4.94 118.70 124.06 3dd3 s GLU 31 Ca 0.06 -0.26 -0.03 0.00 0.36 0.00 0.00 54.97 55.10 3dd3 s GLU 31 Cb -0.17 -3.45 -0.03 0.00 0.26 0.00 0.00 34.13 30.74 3dd3 s GLU 31 CO 0.09 0.19 0.04 0.08 -0.54 0.00 0.00 175.26 175.11 3dd3 s VAL 32 N 0.68 4.60 -0.17 3.70 1.01 -1.26 -2.69 120.40 126.28 3dd3 s VAL 32 Ca 0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 61.98 61.89 3dd3 s VAL 32 Cb -0.12 -2.96 -0.01 0.00 0.00 0.00 0.00 36.38 33.29 3dd3 s VAL 32 CO 0.01 0.60 -0.12 -0.69 0.00 0.00 0.00 175.10 174.90 3dd3 s VAL 33 N -0.93 2.96 0.32 2.92 1.01 -0.36 -4.94 120.40 121.38 3dd3 s VAL 33 Ca 0.14 -0.66 -0.07 0.00 0.00 0.00 0.00 61.98 61.39 3dd3 s VAL 33 Cb -0.11 -2.28 -0.06 0.00 0.00 0.00 0.00 36.38 33.93 3dd3 s VAL 33 CO 0.03 0.50 0.62 0.42 0.00 0.00 0.00 175.10 176.67 3dd3 s THR 34 N 0.86 4.95 0.24 3.92 -4.23 -1.26 -3.99 115.64 116.13 3dd3 s THR 34 Ca -0.03 0.25 -0.04 0.00 -1.18 0.00 0.00 61.69 60.68 3dd3 s THR 34 Cb -0.15 -3.73 0.21 0.00 1.34 0.00 0.00 72.50 70.18 3dd3 s THR 34 CO 0.00 -0.37 1.74 0.58 -0.54 0.00 0.00 174.62 176.03 3dd3 h VAL 35 N 1.31 0.70 -0.75 2.29 2.07 -1.99 -0.59 116.25 119.28 3dd3 h VAL 35 Ca -0.47 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 66.90 3dd3 h VAL 35 Cb 1.19 0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 3dd3 h VAL 35 CO 0.66 0.09 0.48 -0.33 0.02 0.00 0.00 177.57 178.49 3dd3 h GLU 36 N 0.50 0.93 -0.64 1.57 3.07 -1.99 0.43 114.58 118.45 3dd3 h GLU 36 Ca 0.41 -0.06 -0.03 0.00 -0.50 0.00 0.00 59.36 59.19 3dd3 h GLU 36 Cb 0.59 -0.21 -0.03 0.00 -0.84 0.00 0.00 28.75 28.26 3dd3 h GLU 36 CO -0.37 0.62 0.29 1.15 -1.40 0.00 0.00 179.01 179.29 3dd3 h THR 37 N 0.96 1.21 -0.09 1.13 2.02 -1.55 -2.47 112.91 114.13 3dd3 h THR 37 Ca 0.29 -0.62 -0.07 0.00 0.77 0.00 0.00 66.41 66.79 3dd3 h THR 37 Cb -0.03 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 66.80 3dd3 h THR 37 CO -0.10 0.25 -0.22 -0.25 0.37 0.00 0.00 175.52 175.57 3dd3 h TRP 38 N 0.90 0.40 -0.79 3.16 2.91 -0.15 -3.18 115.95 119.21 3dd3 h TRP 38 Ca 0.22 -0.15 0.06 0.00 1.13 0.00 0.00 58.89 60.14 3dd3 h TRP 38 Cb 0.12 -0.07 -0.05 0.00 -0.51 0.00 0.00 29.16 28.65 3dd3 h TRP 38 CO 0.01 0.84 0.52 1.96 -1.03 0.00 0.00 178.44 180.73 3dd3 h GLN 39 N -0.15 0.85 -0.58 2.65 4.20 -0.15 -1.23 115.11 120.69 3dd3 h GLN 39 Ca -0.00 -0.05 0.12 0.00 0.06 0.00 0.00 58.65 58.77 3dd3 h GLN 39 Cb 0.83 -0.19 -0.10 0.00 0.30 0.00 0.00 27.48 28.32 3dd3 h GLN 39 CO 0.05 0.57 -0.03 1.49 -0.67 0.00 0.00 178.83 180.23 3dd3 h GLU 40 N 0.88 0.09 0.00 1.46 4.22 -1.42 -3.46 114.58 116.34 3dd3 h GLU 40 Ca 0.33 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.77 3dd3 h GLU 40 Cb 0.18 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3dd3 h GLU 40 CO -0.11 0.06 0.00 0.41 -2.18 0.00 0.00 179.01 177.19 3dd3 n GLY 41 N -1.36 0.67 0.16 1.92 0.00 -0.47 -4.99 105.19 101.12 3dd3 n GLY 41 Ca 0.08 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 3dd3 n GLY 41 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3dd3 h SER 42 N 0.00 0.85 0.32 1.61 0.87 -1.81 -3.18 113.55 112.22 3dd3 h SER 42 Ca 0.00 -0.90 -0.24 0.00 -1.23 0.00 0.00 61.79 59.42 3dd3 h SER 42 Cb 0.00 -0.28 0.01 0.00 -0.44 0.00 0.00 62.40 61.69 3dd3 h SER 42 CO 0.00 1.68 -1.01 0.25 -0.53 0.00 0.00 176.83 177.22 3dd3 h LEU 43 N 0.17 0.58 -1.34 2.23 5.85 -1.90 -3.11 115.31 117.79 3dd3 h LEU 43 Ca -0.24 -0.49 0.13 0.00 0.84 0.00 0.00 57.88 58.12 3dd3 h LEU 43 Cb 2.09 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 42.88 3dd3 h LEU 43 CO 0.26 1.30 0.55 0.50 -0.34 0.00 0.00 178.44 180.72 3dd3 h LYS 44 N 0.23 0.66 0.00 1.25 3.64 -1.86 -0.93 116.57 119.55 3dd3 h LYS 44 Ca -0.10 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 3dd3 h LYS 44 Cb 1.66 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 33.33 3dd3 h LYS 44 CO 0.18 0.43 0.00 0.00 -2.27 0.00 0.00 179.45 177.79 3dd3 n ALA 45 N -2.45 2.12 0.49 5.00 0.00 -1.18 -2.19 120.51 122.32 3dd3 n ALA 45 Ca 0.16 -0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.67 3dd3 n ALA 45 Cb 0.43 -1.42 0.07 0.00 0.00 0.00 0.00 19.45 18.53 3dd3 n ALA 45 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3dd3 n SER 46 N -1.83 0.66 -4.65 0.00 3.41 -0.42 -4.90 113.62 105.90 3dd3 n SER 46 Ca 0.05 -0.01 -0.42 0.00 -0.26 0.00 0.00 58.87 58.24 3dd3 n SER 46 Cb 0.33 0.55 -0.04 0.00 -0.26 0.00 0.00 64.21 64.78 3dd3 n SER 46 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dd3 n LEU 48 N 5.94 -0.86 -1.55 0.00 7.94 -1.26 0.88 117.00 128.08 3dd3 n LEU 48 Ca 0.06 1.65 0.09 0.00 -1.11 0.00 0.00 56.01 56.69 3dd3 n LEU 48 Cb 0.48 -0.26 0.35 0.00 0.53 0.00 0.00 43.42 44.51 3dd3 n LEU 48 CO 0.47 -1.39 0.80 -1.22 -1.11 0.00 0.00 177.39 174.95 3dd3 n TYR 49 N -5.23 1.43 -2.25 1.96 4.01 -1.26 -4.93 117.16 110.90 3dd3 n TYR 49 Ca 0.04 -0.57 -0.14 0.00 -0.16 0.00 0.00 57.90 57.07 3dd3 n TYR 49 Cb 0.28 -0.23 -0.01 0.00 -0.31 0.00 0.00 39.34 39.08 3dd3 n TYR 49 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3dd3 n GLY 50 N 1.15 -0.17 3.14 2.72 0.00 0.25 -5.00 105.19 107.30 3dd3 n GLY 50 Ca 0.25 -0.31 -0.08 0.00 0.00 0.00 0.00 46.02 45.88 3dd3 n GLY 50 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dd3 s GLN 51 N -4.66 0.74 0.14 1.61 -0.21 -1.26 -4.92 119.66 111.10 3dd3 s GLN 51 Ca 0.00 -1.16 0.07 0.00 0.02 0.00 0.00 55.36 54.29 3dd3 s GLN 51 Cb 0.00 0.26 -0.04 0.00 1.00 0.00 0.00 33.01 34.23 3dd3 s GLN 51 CO 0.00 -0.19 -0.05 -0.51 -2.12 0.00 0.00 175.29 172.42 3dd3 s LEU 52 N -2.92 3.18 0.39 2.90 1.43 -1.26 -4.61 118.68 117.79 3dd3 s LEU 52 Ca 0.09 -0.39 -0.22 0.00 -1.03 0.00 0.00 54.13 52.58 3dd3 s LEU 52 Cb 0.07 -1.90 -0.11 0.00 0.03 0.00 0.00 46.19 44.28 3dd3 s LEU 52 CO -0.09 0.14 0.93 -2.16 0.23 0.00 0.00 176.35 175.40 3dd3 s PRO 53 N -2.56 4.31 0.13 1.29 0.04 -1.26 -5.01 135.00 131.93 3dd3 s PRO 53 Ca 0.25 1.14 0.08 0.00 0.04 0.00 0.00 61.00 62.51 3dd3 s PRO 53 Cb -0.10 -2.38 -0.04 0.00 0.04 0.00 0.00 34.50 32.02 3dd3 s PRO 53 CO 0.16 0.07 -0.14 0.21 0.04 0.00 0.00 177.00 177.35 3dd3 s LYS 54 N -2.84 1.95 -0.04 4.56 2.20 -0.09 -3.76 119.74 121.71 3dd3 s LYS 54 Ca 0.58 -1.15 -0.09 0.00 -0.36 0.00 0.00 55.97 54.94 3dd3 s LYS 54 Cb -0.12 -2.18 0.02 0.00 -1.51 0.00 0.00 37.83 34.04 3dd3 s LYS 54 CO 0.16 0.48 0.22 0.12 -0.36 0.00 0.00 175.35 175.97 3dd3 s PHE 55 N -1.29 -0.15 -0.18 4.03 5.36 0.19 -1.62 117.98 124.32 3dd3 s PHE 55 Ca 0.21 0.32 -0.01 0.00 -0.96 0.00 0.00 56.93 56.49 3dd3 s PHE 55 Cb -0.10 0.05 0.05 0.00 -0.34 0.00 0.00 43.02 42.67 3dd3 s PHE 55 CO 0.12 -0.23 -0.04 -0.65 -1.46 0.00 0.00 175.22 172.97 3dd3 s GLN 56 N -0.65 1.32 -0.42 10.12 -1.52 -0.77 0.52 119.66 128.27 3dd3 s GLN 56 Ca -0.07 -0.56 -0.10 0.00 -1.95 0.00 0.00 55.36 52.68 3dd3 s GLN 56 Cb -0.04 -2.09 0.08 0.00 -0.22 0.00 0.00 33.01 30.74 3dd3 s GLN 56 CO 0.02 -0.49 0.27 0.34 -0.25 0.00 0.00 175.29 175.18 3dd3 s ASP 57 N 1.64 5.68 1.77 5.90 -1.08 -0.49 -2.00 116.67 128.09 3dd3 s ASP 57 Ca -0.00 -1.46 0.00 0.00 -0.52 0.00 0.00 52.55 50.56 3dd3 s ASP 57 Cb -0.16 -2.00 0.00 0.00 -1.46 0.00 0.00 42.92 39.30 3dd3 s ASP 57 CO -0.07 -0.54 0.00 0.61 0.52 0.00 0.00 175.17 175.69 3dd3 n GLY 58 N 4.94 3.74 0.72 2.66 0.00 -0.78 -1.29 105.19 115.18 3dd3 n GLY 58 Ca -0.10 0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.06 3dd3 n GLY 58 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dd3 n ASP 59 N 5.88 2.24 -4.61 1.61 5.75 -1.26 -4.83 116.55 121.33 3dd3 n ASP 59 Ca 0.00 -1.75 -0.43 0.00 -0.01 0.00 0.00 54.79 52.60 3dd3 n ASP 59 Cb 0.00 -0.03 -0.02 0.00 -1.03 0.00 0.00 41.12 40.04 3dd3 n ASP 59 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 3dd3 s LEU 60 N -1.92 3.67 -0.34 -2.12 2.96 -0.42 -4.99 118.68 115.52 3dd3 s LEU 60 Ca 0.34 1.28 -0.16 0.00 -0.22 0.00 0.00 54.13 55.36 3dd3 s LEU 60 Cb 0.20 -3.53 -0.01 0.00 0.50 0.00 0.00 46.19 43.35 3dd3 s LEU 60 CO 0.31 -1.45 0.41 -0.89 -1.32 0.00 0.00 176.35 173.41 3dd3 s THR 61 N 5.80 5.12 0.06 3.68 2.01 -1.26 -1.40 115.64 129.65 3dd3 s THR 61 Ca 0.71 0.15 0.05 0.00 0.31 0.00 0.00 61.69 62.90 3dd3 s THR 61 Cb -0.21 -3.86 -0.04 0.00 0.01 0.00 0.00 72.50 68.40 3dd3 s THR 61 CO 0.31 -0.13 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.31 3dd3 s LEU 62 N 2.13 3.24 0.39 4.42 1.43 0.18 -4.95 118.68 125.53 3dd3 s LEU 62 Ca 0.14 -0.21 0.08 0.00 -1.03 0.00 0.00 54.13 53.10 3dd3 s LEU 62 Cb -0.16 -1.94 -0.07 0.00 0.03 0.00 0.00 46.19 44.04 3dd3 s LEU 62 CO 0.12 0.22 -0.00 -0.31 0.23 0.00 0.00 176.35 176.61 3dd3 s TYR 63 N -1.15 2.50 0.00 0.29 2.02 -1.26 -0.64 117.35 119.11 3dd3 s TYR 63 Ca 0.21 -0.61 0.00 0.00 -0.37 0.00 0.00 57.07 56.30 3dd3 s TYR 63 Cb -0.11 -1.69 0.00 0.00 -0.40 0.00 0.00 41.96 39.76 3dd3 s TYR 63 CO 0.13 0.46 0.00 1.04 -1.57 0.00 0.00 175.55 175.61 3dd3 n GLN 64 N -0.95 0.00 -0.10 -0.62 1.13 -1.25 -4.45 117.38 111.14 3dd3 n GLN 64 Ca -0.05 0.37 0.06 0.00 -1.94 0.00 0.00 57.00 55.44 3dd3 n GLN 64 Cb 0.66 -0.23 0.40 0.00 0.11 0.00 0.00 30.24 31.19 3dd3 n GLN 64 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 3dd3 h SER 65 N 0.00 0.55 1.14 1.08 4.64 -1.89 -1.14 113.55 117.92 3dd3 h SER 65 Ca 0.00 -0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 3dd3 h SER 65 Cb 0.00 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 61.94 3dd3 h SER 65 CO 0.00 0.37 -0.79 0.78 -0.87 0.00 0.00 176.83 176.32 3dd3 h ASN 66 N 0.63 0.00 0.18 4.97 2.35 -1.93 -1.24 115.58 120.53 3dd3 h ASN 66 Ca 0.25 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.99 3dd3 h ASN 66 Cb 0.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.55 3dd3 h ASN 66 CO -0.07 0.79 -0.09 0.74 -1.65 0.00 0.00 177.43 177.15 3dd3 h THR 67 N 0.00 0.87 -0.26 2.81 2.02 -1.70 0.10 112.91 116.76 3dd3 h THR 67 Ca -0.01 -0.20 0.06 0.00 0.77 0.00 0.00 66.41 67.04 3dd3 h THR 67 Cb 1.57 0.99 -0.07 0.00 -1.74 0.00 0.00 68.15 68.90 3dd3 h THR 67 CO 0.10 0.05 -0.19 0.40 0.37 0.00 0.00 175.52 176.24 3dd3 h ILE 68 N -0.33 0.47 -0.68 3.11 2.04 -1.11 0.22 117.51 121.23 3dd3 h ILE 68 Ca -0.02 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.87 3dd3 h ILE 68 Cb 0.26 0.47 -0.05 0.00 -0.74 0.00 0.00 36.82 36.76 3dd3 h ILE 68 CO 0.04 0.00 0.42 -0.07 0.00 0.00 0.00 178.15 178.54 3dd3 h LEU 69 N -0.18 0.66 -0.71 1.44 3.38 -1.12 0.13 115.31 118.91 3dd3 h LEU 69 Ca 0.14 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 3dd3 h LEU 69 Cb 0.40 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 3dd3 h LEU 69 CO -0.37 0.45 0.01 0.03 0.09 0.00 0.00 178.44 178.65 3dd3 h ARG 70 N 0.80 1.00 0.16 1.13 3.08 -0.59 0.37 114.38 120.34 3dd3 h ARG 70 Ca 0.28 -0.30 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 3dd3 h ARG 70 Cb 0.07 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.02 3dd3 h ARG 70 CO -0.13 0.98 -0.08 1.25 -1.07 0.00 0.00 179.97 180.92 3dd3 h HIS 71 N 0.92 -0.21 -0.74 3.04 2.76 -0.14 0.18 115.15 120.97 3dd3 h HIS 71 Ca 0.17 -0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.29 3dd3 h HIS 71 Cb 0.52 0.07 -0.03 0.00 1.55 0.00 0.00 27.41 29.52 3dd3 h HIS 71 CO 0.03 -0.13 0.29 -0.07 -1.30 0.00 0.00 177.93 176.75 3dd3 h LEU 72 N -0.23 1.02 -0.59 0.26 3.38 -0.91 -1.49 115.31 116.76 3dd3 h LEU 72 Ca -0.02 -0.16 0.08 0.00 0.09 0.00 0.00 57.88 57.87 3dd3 h LEU 72 Cb 0.18 -0.26 -0.07 0.00 0.09 0.00 0.00 40.66 40.60 3dd3 h LEU 72 CO 0.03 0.91 0.24 1.23 0.09 0.00 0.00 178.44 180.94 3dd3 h GLY 73 N 1.12 0.82 0.85 0.83 0.00 0.04 0.13 103.07 106.86 3dd3 h GLY 73 Ca 0.25 -0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.42 3dd3 h GLY 73 CO -0.02 0.01 -0.21 3.21 0.00 0.00 0.00 176.54 179.53 3dd3 h ARG 74 N 0.43 -0.58 0.00 4.80 3.08 -0.49 0.24 114.38 121.86 3dd3 h ARG 74 Ca 0.29 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.38 3dd3 h ARG 74 Cb 0.32 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.50 3dd3 h ARG 74 CO -0.27 -0.31 0.00 0.25 -1.07 0.00 0.00 179.97 178.57 3dd3 n THR 75 N -5.29 0.57 0.30 2.04 -2.24 -0.57 -3.43 114.28 105.66 3dd3 n THR 75 Ca -0.11 0.02 0.06 0.00 -2.27 0.00 0.00 64.05 61.75 3dd3 n THR 75 Cb 0.29 -0.78 0.09 0.00 -2.10 0.00 0.00 70.33 67.82 3dd3 n THR 75 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3dd3 n LEU 76 N -1.90 2.33 -1.52 3.22 4.77 0.03 -5.01 117.00 118.92 3dd3 n LEU 76 Ca 0.05 -1.30 -0.09 0.00 -0.03 0.00 0.00 56.01 54.64 3dd3 n LEU 76 Cb 0.31 -0.08 0.02 0.00 -2.33 0.00 0.00 43.42 41.34 3dd3 n LEU 76 CO 0.24 0.49 0.06 0.61 -1.33 0.00 0.00 177.39 177.45 3dd3 n GLY 77 N 0.67 0.32 2.13 -0.72 0.00 -1.13 -4.98 105.19 101.49 3dd3 n GLY 77 Ca 0.09 -0.37 -0.25 0.00 0.00 0.00 0.00 46.02 45.49 3dd3 n GLY 77 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dd3 n LEU 78 N -2.00 4.98 -1.59 0.99 4.77 0.85 -4.72 117.00 120.28 3dd3 n LEU 78 Ca -0.02 -4.84 0.01 0.00 -0.03 0.00 0.00 56.01 51.14 3dd3 n LEU 78 Cb 0.53 -0.39 0.07 0.00 -2.33 0.00 0.00 43.42 41.30 3dd3 n LEU 78 CO 0.22 2.12 0.13 0.00 -1.33 0.00 0.00 177.39 178.53 3dd3 n TYR 79 N -0.67 0.51 -0.45 -1.77 4.19 -1.20 -0.12 117.16 117.66 3dd3 n TYR 79 Ca 0.44 -1.22 0.06 0.00 3.31 0.00 0.00 57.90 60.48 3dd3 n TYR 79 Cb 0.89 -0.21 -0.02 0.00 0.49 0.00 0.00 39.34 40.49 3dd3 n TYR 79 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 3dd3 n GLY 80 N -0.22 -2.27 0.10 2.98 0.00 -1.26 -3.68 105.19 100.83 3dd3 n GLY 80 Ca 0.13 -1.37 -0.11 0.00 0.00 0.00 0.00 46.02 44.67 3dd3 n GLY 80 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3dd3 n LYS 81 N -3.02 0.66 -3.47 1.61 2.85 -1.26 -4.81 118.16 110.72 3dd3 n LYS 81 Ca -0.01 0.23 -0.15 0.00 -1.05 0.00 0.00 58.31 57.33 3dd3 n LYS 81 Cb 0.21 -1.72 -0.04 0.00 -0.65 0.00 0.00 35.03 32.83 3dd3 n LYS 81 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 3dd3 n ASP 82 N -3.07 0.88 0.20 -5.58 5.68 -1.26 -5.04 116.55 108.36 3dd3 n ASP 82 Ca -0.23 -2.34 0.06 0.00 -0.50 0.00 0.00 54.79 51.78 3dd3 n ASP 82 Cb 1.07 0.70 0.42 0.00 -1.14 0.00 0.00 41.12 42.17 3dd3 n ASP 82 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 3dd3 h GLN 83 N 0.00 0.00 -0.04 0.11 4.20 -1.94 -2.77 115.11 114.67 3dd3 h GLN 83 Ca -0.19 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.30 3dd3 h GLN 83 Cb 0.75 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.53 3dd3 h GLN 83 CO 0.30 0.32 -0.89 0.37 -0.67 0.00 0.00 178.83 178.26 3dd3 h GLN 84 N 0.00 0.50 -0.13 1.46 4.15 -1.97 -2.89 115.11 116.23 3dd3 h GLN 84 Ca -0.00 -0.49 -0.22 0.00 0.77 0.00 0.00 58.65 58.70 3dd3 h GLN 84 Cb 0.71 0.13 0.01 0.00 0.21 0.00 0.00 27.48 28.54 3dd3 h GLN 84 CO 0.04 1.13 -0.80 0.93 -1.93 0.00 0.00 178.83 178.20 3dd3 h GLU 85 N 0.31 0.73 -0.62 1.69 5.08 -1.87 -2.82 114.58 117.08 3dd3 h GLU 85 Ca -0.07 -0.62 0.04 0.00 -1.00 0.00 0.00 59.36 57.72 3dd3 h GLU 85 Cb 1.51 0.13 -0.05 0.00 0.50 0.00 0.00 28.75 30.85 3dd3 h GLU 85 CO 0.16 1.22 0.35 0.00 -1.00 0.00 0.00 179.01 179.74 3dd3 h ALA 86 N 0.60 0.81 -0.42 3.43 0.00 -1.55 0.66 119.26 122.79 3dd3 h ALA 86 Ca -0.06 0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.90 3dd3 h ALA 86 Cb 1.43 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.04 3dd3 h ALA 86 CO 0.16 0.05 0.17 0.00 0.00 0.00 0.00 179.25 179.63 3dd3 h ALA 87 N 1.30 0.51 -0.46 0.00 0.00 -1.48 -1.30 119.26 117.83 3dd3 h ALA 87 Ca 0.26 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.12 3dd3 h ALA 87 Cb 0.11 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3dd3 h ALA 87 CO -0.15 -0.20 -0.07 -0.07 0.00 0.00 0.00 179.25 178.76 3dd3 h LEU 88 N 0.36 0.79 -0.82 0.00 3.38 -1.18 -1.24 115.31 116.59 3dd3 h LEU 88 Ca 0.19 -0.22 0.09 0.00 0.09 0.00 0.00 57.88 58.02 3dd3 h LEU 88 Cb 0.14 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 40.61 3dd3 h LEU 88 CO -0.17 0.90 0.47 0.58 0.09 0.00 0.00 178.44 180.32 3dd3 h VAL 89 N 0.74 0.92 -0.41 1.22 2.07 -0.66 0.43 116.25 120.56 3dd3 h VAL 89 Ca 0.13 -0.27 -0.09 0.00 0.82 0.00 0.00 66.70 67.28 3dd3 h VAL 89 Cb 0.55 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 3dd3 h VAL 89 CO 0.03 0.15 -0.11 0.44 0.02 0.00 0.00 177.57 178.10 3dd3 h ASP 90 N 0.80 0.80 -0.40 0.57 3.32 -0.88 -0.01 116.42 120.63 3dd3 h ASP 90 Ca 0.39 -0.37 -0.07 0.00 0.02 0.00 0.00 57.03 57.01 3dd3 h ASP 90 Cb 0.35 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 3dd3 h ASP 90 CO -0.24 0.98 0.02 -0.03 -1.72 0.00 0.00 179.24 178.26 3dd3 h MET 91 N 0.61 0.77 0.46 3.56 4.05 -0.81 0.98 114.93 124.55 3dd3 h MET 91 Ca 0.10 -0.19 -0.02 0.00 -0.28 0.00 0.00 59.70 59.31 3dd3 h MET 91 Cb 0.64 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 31.34 3dd3 h MET 91 CO 0.04 0.77 -0.22 0.28 0.23 0.00 0.00 176.91 178.01 3dd3 h VAL 92 N 0.73 0.47 -0.83 -5.77 2.07 -0.79 -1.47 116.25 110.66 3dd3 h VAL 92 Ca 0.15 -0.42 0.08 0.00 0.82 0.00 0.00 66.70 67.33 3dd3 h VAL 92 Cb 0.41 0.64 -0.07 0.00 -1.52 0.00 0.00 31.29 30.75 3dd3 h VAL 92 CO 0.01 0.06 0.49 -1.13 0.02 0.00 0.00 177.57 177.03 3dd3 h ASN 93 N -0.89 0.74 -0.86 0.57 -1.24 -0.76 0.97 115.58 114.11 3dd3 h ASN 93 Ca -0.06 0.03 0.04 0.00 0.71 0.00 0.00 56.30 57.01 3dd3 h ASN 93 Cb 0.57 -0.12 -0.05 0.00 0.73 0.00 0.00 38.32 39.45 3dd3 h ASN 93 CO 0.10 0.45 0.55 0.44 -1.29 0.00 0.00 177.43 177.69 3dd3 h ASP 94 N 0.87 0.92 0.27 1.15 5.19 -0.87 0.24 116.42 124.19 3dd3 h ASP 94 Ca 0.38 -0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.79 3dd3 h ASP 94 Cb 0.26 -0.20 -0.03 0.00 0.18 0.00 0.00 39.33 39.53 3dd3 h ASP 94 CO -0.21 0.63 -0.43 1.23 -3.12 0.00 0.00 179.24 177.33 3dd3 h GLY 95 N 1.07 -0.97 -0.04 2.75 0.00 0.06 -2.04 103.07 103.90 3dd3 h GLY 95 Ca 0.35 0.51 0.11 0.00 0.00 0.00 0.00 47.33 48.30 3dd3 h GLY 95 CO -0.12 -0.30 -0.11 -2.08 0.00 0.00 0.00 176.54 173.93 3dd3 h VAL 96 N -0.77 0.49 -0.89 4.60 2.07 -0.73 -2.33 116.25 118.68 3dd3 h VAL 96 Ca -0.01 -0.01 0.07 0.00 0.82 0.00 0.00 66.70 67.57 3dd3 h VAL 96 Cb 0.74 0.46 -0.06 0.00 -1.52 0.00 0.00 31.29 30.91 3dd3 h VAL 96 CO -0.16 0.00 0.58 -0.08 0.02 0.00 0.00 177.57 177.93 3dd3 h GLU 97 N 0.02 0.95 -0.13 1.57 4.57 -0.40 0.64 114.58 121.80 3dd3 h GLU 97 Ca 0.26 -0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 58.38 3dd3 h GLU 97 Cb 0.40 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 3dd3 h GLU 97 CO -0.53 0.63 0.07 -0.44 -1.18 0.00 0.00 179.01 177.56 3dd3 h ASP 98 N 0.98 0.17 -0.17 1.04 5.19 -0.83 -1.61 116.42 121.18 3dd3 h ASP 98 Ca 0.39 -0.10 -0.12 0.00 -0.62 0.00 0.00 57.03 56.59 3dd3 h ASP 98 Cb 0.25 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 39.70 3dd3 h ASP 98 CO -0.15 0.22 -0.28 0.25 -3.12 0.00 0.00 179.24 176.15 3dd3 h LEU 99 N 0.11 0.66 -0.64 1.55 5.85 -1.13 -2.85 115.31 118.86 3dd3 h LEU 99 Ca 0.05 -0.25 0.07 0.00 0.84 0.00 0.00 57.88 58.58 3dd3 h LEU 99 Cb 0.09 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 40.88 3dd3 h LEU 99 CO -0.01 0.92 0.34 -0.09 -0.34 0.00 0.00 178.44 179.25 3dd3 h ARG 100 N 0.56 0.60 -0.57 1.25 2.43 -0.71 -0.46 114.38 117.47 3dd3 h ARG 100 Ca 0.07 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.17 3dd3 h ARG 100 Cb 0.77 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 30.16 3dd3 h ARG 100 CO 0.06 0.39 0.20 0.00 -1.51 0.00 0.00 179.97 179.12 3dd3 h LYS 102 N 0.83 0.90 -0.87 0.00 1.57 -1.20 -2.27 116.57 115.52 3dd3 h LYS 102 Ca 0.19 -0.42 -0.02 0.00 -1.87 0.00 0.00 60.65 58.53 3dd3 h LYS 102 Cb 0.20 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.46 3dd3 h LYS 102 CO -0.01 1.07 0.46 -0.92 -0.57 0.00 0.00 179.45 179.48 3dd3 h TYR 103 N 0.72 1.22 -0.23 -1.35 3.20 -0.68 -0.82 116.97 119.03 3dd3 h TYR 103 Ca 0.08 -0.04 -0.08 0.00 3.14 0.00 0.00 58.73 61.83 3dd3 h TYR 103 Cb 0.84 -0.39 -0.01 0.00 1.54 0.00 0.00 36.73 38.72 3dd3 h TYR 103 CO 0.06 0.86 -0.16 0.82 -1.64 0.00 0.00 178.16 178.10 3dd3 h ILE 104 N 1.23 1.31 0.00 1.81 2.04 -0.93 -1.01 117.51 121.96 3dd3 h ILE 104 Ca 0.30 -1.28 -0.01 0.00 1.00 0.00 0.00 64.86 64.88 3dd3 h ILE 104 Cb 0.06 1.64 -0.00 0.00 -0.74 0.00 0.00 36.82 37.78 3dd3 h ILE 104 CO -0.05 0.39 -0.03 -1.28 0.00 0.00 0.00 178.15 177.19 3dd3 h SER 105 N 0.22 0.00 0.16 1.72 0.87 -1.22 -0.35 113.55 114.95 3dd3 h SER 105 Ca 0.05 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.60 3dd3 h SER 105 Cb 0.68 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.64 3dd3 h SER 105 CO 0.04 0.03 -0.08 0.25 -0.53 0.00 0.00 176.83 176.54 3dd3 h LEU 106 N 0.00 -0.18 -1.29 2.23 5.85 -0.62 -2.93 115.31 118.37 3dd3 h LEU 106 Ca -0.00 0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.81 3dd3 h LEU 106 Cb 0.06 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.08 3dd3 h LEU 106 CO 0.00 0.06 0.53 0.40 -0.34 0.00 0.00 178.44 179.09 3dd3 h ILE 107 N -0.59 0.99 0.00 4.05 1.08 -1.10 0.19 117.51 122.13 3dd3 h ILE 107 Ca -0.02 -0.28 -0.31 0.00 -0.39 0.00 0.00 64.86 63.86 3dd3 h ILE 107 Cb 0.16 0.10 -0.06 0.00 -3.07 0.00 0.00 36.82 33.95 3dd3 h ILE 107 CO 0.04 0.15 -2.12 -1.22 -0.69 0.00 0.00 178.15 174.31 3dd3 n TYR 108 N -4.50 0.32 -1.85 1.37 4.01 -0.15 -4.41 117.16 111.95 3dd3 n TYR 108 Ca 0.13 0.11 0.05 0.00 -0.16 0.00 0.00 57.90 58.04 3dd3 n TYR 108 Cb 0.27 -1.02 0.13 0.00 -0.31 0.00 0.00 39.34 38.41 3dd3 n TYR 108 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3dd3 n THR 109 N -2.80 1.30 0.00 -0.72 -2.24 -1.11 -4.88 114.28 103.84 3dd3 n THR 109 Ca -0.25 -2.17 0.00 0.00 -2.27 0.00 0.00 64.05 59.36 3dd3 n THR 109 Cb 1.07 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 69.50 3dd3 n THR 109 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3dd3 n ASN 110 N -0.56 0.00 0.00 3.42 2.85 -0.94 -4.93 115.26 115.10 3dd3 n ASN 110 Ca 0.13 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.60 3dd3 n ASN 110 Cb 0.83 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.85 3dd3 n ASN 110 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3dd3 n TYR 111 N 0.00 0.00 -0.12 1.20 9.36 0.62 -2.03 117.16 126.19 3dd3 n TYR 111 Ca 0.00 0.00 -0.10 0.00 3.32 0.00 0.00 57.90 61.12 3dd3 n TYR 111 Cb 0.00 0.00 0.04 0.00 -0.63 0.00 0.00 39.34 38.75 3dd3 n TYR 111 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 3dd3 h GLU 112 N 0.00 0.88 -0.06 2.98 3.07 -1.96 0.39 114.58 119.88 3dd3 h GLU 112 Ca 0.00 -0.37 -0.23 0.00 -0.50 0.00 0.00 59.36 58.26 3dd3 h GLU 112 Cb 0.00 -0.03 0.02 0.00 -0.84 0.00 0.00 28.75 27.89 3dd3 h GLU 112 CO 0.00 1.02 -0.87 0.00 -1.40 0.00 0.00 179.01 177.76 3dd3 h ALA 113 N 0.97 0.19 0.04 3.43 0.00 -1.84 -3.38 119.26 118.67 3dd3 h ALA 113 Ca 0.10 -0.64 -0.25 0.00 0.00 0.00 0.00 54.91 54.12 3dd3 h ALA 113 Cb 0.78 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 3dd3 h ALA 113 CO 0.06 0.63 -1.25 0.78 0.00 0.00 0.00 179.25 179.47 3dd3 h GLY 114 N 0.38 0.09 0.12 0.00 0.00 -1.24 -3.40 103.07 99.02 3dd3 h GLY 114 Ca -0.09 -0.23 0.22 0.00 0.00 0.00 0.00 47.33 47.23 3dd3 h GLY 114 CO 0.17 0.20 0.63 1.70 0.00 0.00 0.00 176.54 179.24 3dd3 h LYS 115 N 0.02 0.46 -0.08 4.80 3.64 -1.10 -0.66 116.57 123.64 3dd3 h LYS 115 Ca -0.12 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.18 3dd3 h LYS 115 Cb 1.88 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.60 3dd3 h LYS 115 CO 0.14 0.30 -0.15 -0.44 -2.27 0.00 0.00 179.45 177.02 3dd3 h ASP 116 N 0.47 0.28 -0.14 4.20 3.32 -1.85 0.24 116.42 122.94 3dd3 h ASP 116 Ca 0.53 -0.55 -0.00 0.00 0.02 0.00 0.00 57.03 57.03 3dd3 h ASP 116 Cb 1.24 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.70 3dd3 h ASP 116 CO -0.25 0.78 0.08 0.44 -1.72 0.00 0.00 179.24 178.57 3dd3 h ASP 117 N -0.21 0.17 -0.38 6.45 3.32 -1.64 -1.40 116.42 122.73 3dd3 h ASP 117 Ca 0.00 -0.06 0.08 0.00 0.02 0.00 0.00 57.03 57.07 3dd3 h ASP 117 Cb 0.73 -0.04 -0.08 0.00 0.22 0.00 0.00 39.33 40.16 3dd3 h ASP 117 CO 0.03 0.18 -0.15 0.22 -1.72 0.00 0.00 179.24 177.81 3dd3 h TYR 118 N 0.14 -0.35 0.00 4.55 3.20 -1.03 0.42 116.97 123.89 3dd3 h TYR 118 Ca 0.05 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.96 3dd3 h TYR 118 Cb 0.04 0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.53 3dd3 h TYR 118 CO -0.05 -0.23 0.00 0.28 -1.64 0.00 0.00 178.16 176.52 3dd3 n VAL 119 N -5.34 0.68 -0.04 1.81 0.31 0.84 -1.32 118.33 115.27 3dd3 n VAL 119 Ca 0.02 0.15 -0.05 0.00 -0.01 0.00 0.00 64.34 64.45 3dd3 n VAL 119 Cb 0.25 -0.85 -0.14 0.00 -0.91 0.00 0.00 33.84 32.19 3dd3 n VAL 119 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 3dd3 n LYS 120 N -1.58 0.66 0.18 5.55 4.81 -0.43 -3.99 118.16 123.35 3dd3 n LYS 120 Ca 0.05 0.10 0.12 0.00 -0.87 0.00 0.00 58.31 57.71 3dd3 n LYS 120 Cb 0.23 -1.66 0.18 0.00 0.02 0.00 0.00 35.03 33.81 3dd3 n LYS 120 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3dd3 h ALA 121 N 1.19 0.90 -0.16 3.14 0.00 0.21 -3.39 119.26 121.16 3dd3 h ALA 121 Ca -0.34 0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.62 3dd3 h ALA 121 Cb 1.92 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.64 3dd3 h ALA 121 CO 0.04 0.00 -0.31 1.25 0.00 0.00 0.00 179.25 180.24 3dd3 h LEU 122 N 0.00 -0.96 -1.33 0.00 5.85 -1.33 -2.54 115.31 115.01 3dd3 h LEU 122 Ca 0.00 0.15 0.25 0.00 0.84 0.00 0.00 57.88 59.11 3dd3 h LEU 122 Cb 0.95 0.41 -0.09 0.00 0.37 0.00 0.00 40.66 42.30 3dd3 h LEU 122 CO 0.00 -0.34 0.65 -0.65 -0.34 0.00 0.00 178.44 177.76 3dd3 h PRO 123 N -0.37 0.44 0.00 5.25 0.11 -1.82 0.45 132.00 136.06 3dd3 h PRO 123 Ca 0.10 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 66.08 3dd3 h PRO 123 Cb 0.53 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 3dd3 h PRO 123 CO -0.36 0.29 -0.50 0.78 -0.21 0.00 0.00 178.00 178.00 3dd3 h GLY 124 N 0.45 0.00 2.00 -0.55 0.00 -1.76 -2.01 103.07 101.21 3dd3 h GLY 124 Ca 0.58 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.74 3dd3 h GLY 124 CO -0.30 0.00 -0.80 1.46 0.00 0.00 0.00 176.54 176.91 3dd3 h GLN 125 N 0.00 0.00 0.00 4.80 1.08 0.02 -3.35 115.11 117.66 3dd3 h GLN 125 Ca -0.00 0.00 -0.25 0.00 -1.45 0.00 0.00 58.65 56.94 3dd3 h GLN 125 Cb 0.89 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.28 3dd3 h GLN 125 CO 0.06 0.80 -1.36 -0.07 -0.95 0.00 0.00 178.83 177.31 3dd3 h LEU 126 N 0.00 0.01 -0.72 1.46 3.38 -1.11 -3.38 115.31 114.96 3dd3 h LEU 126 Ca -0.01 -0.02 0.16 0.00 0.09 0.00 0.00 57.88 58.10 3dd3 h LEU 126 Cb 1.43 -0.00 -0.12 0.00 0.09 0.00 0.00 40.66 42.05 3dd3 h LEU 126 CO 0.10 1.02 0.07 0.50 0.09 0.00 0.00 178.44 180.22 3dd3 h LYS 127 N 0.00 0.16 -0.85 1.13 3.64 -1.49 -1.70 116.57 117.46 3dd3 h LYS 127 Ca -0.15 -0.01 0.20 0.00 -1.27 0.00 0.00 60.65 59.42 3dd3 h LYS 127 Cb 1.90 -0.04 -0.12 0.00 -0.41 0.00 0.00 32.23 33.56 3dd3 h LYS 127 CO 0.11 0.11 0.34 -1.35 -2.27 0.00 0.00 179.45 176.38 3dd3 h PRO 128 N 0.17 0.37 -0.23 1.90 0.11 -1.78 0.31 132.00 132.84 3dd3 h PRO 128 Ca 0.40 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 66.33 3dd3 h PRO 128 Cb 0.69 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.71 3dd3 h PRO 128 CO -0.58 0.25 -0.48 0.74 -0.21 0.00 0.00 178.00 177.72 3dd3 h PHE 129 N 0.38 0.76 -0.43 0.65 0.04 -1.58 0.29 116.94 117.05 3dd3 h PHE 129 Ca 0.52 -0.25 -0.02 0.00 2.80 0.00 0.00 57.97 61.02 3dd3 h PHE 129 Cb 0.94 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 38.92 3dd3 h PHE 129 CO -0.17 0.98 0.20 1.49 -0.60 0.00 0.00 178.31 180.22 3dd3 h GLU 130 N 0.49 0.63 0.18 1.51 4.57 -1.14 -2.35 114.58 118.47 3dd3 h GLU 130 Ca 0.03 -0.10 0.01 0.00 -1.18 0.00 0.00 59.36 58.12 3dd3 h GLU 130 Cb 1.02 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 29.47 3dd3 h GLU 130 CO 0.10 0.55 -0.30 1.15 -1.18 0.00 0.00 179.01 179.33 3dd3 h THR 131 N 0.56 0.37 -0.61 0.32 2.02 -0.12 0.26 112.91 115.70 3dd3 h THR 131 Ca 0.15 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.45 3dd3 h THR 131 Cb 0.13 0.37 -0.12 0.00 -1.74 0.00 0.00 68.15 66.79 3dd3 h THR 131 CO -0.02 0.00 -0.22 -0.07 0.37 0.00 0.00 175.52 175.58 3dd3 h LEU 132 N -0.55 -0.78 -0.43 2.58 3.38 -0.93 -0.73 115.31 117.85 3dd3 h LEU 132 Ca 0.02 0.20 0.01 0.00 0.09 0.00 0.00 57.88 58.20 3dd3 h LEU 132 Cb 0.55 0.45 -0.03 0.00 0.09 0.00 0.00 40.66 41.73 3dd3 h LEU 132 CO -0.14 -0.25 0.27 -0.07 0.09 0.00 0.00 178.44 178.34 3dd3 h LEU 133 N -0.06 0.45 -1.97 1.67 3.38 -1.18 -2.45 115.31 115.15 3dd3 h LEU 133 Ca 0.28 -0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.36 3dd3 h LEU 133 Cb 0.50 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 3dd3 h LEU 133 CO -0.66 0.32 0.30 0.77 0.09 0.00 0.00 178.44 179.25 3dd3 h SER 134 N 0.54 0.03 0.02 -0.43 4.64 0.55 -0.08 113.55 118.83 3dd3 h SER 134 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 3dd3 h SER 134 Cb -0.02 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 3dd3 h SER 134 CO -0.06 0.02 -0.39 0.00 -0.87 0.00 0.00 176.83 175.53 3dd3 n GLN 135 N -4.42 1.26 -3.71 4.77 6.02 -0.88 -3.74 117.38 116.67 3dd3 n GLN 135 Ca 0.07 -1.00 -0.37 0.00 -0.01 0.00 0.00 57.00 55.69 3dd3 n GLN 135 Cb 0.47 -1.48 -0.10 0.00 1.02 0.00 0.00 30.24 30.15 3dd3 n GLN 135 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 3dd3 s ASN 136 N -2.43 5.35 -1.57 1.08 2.47 -0.14 -4.77 114.94 114.93 3dd3 s ASN 136 Ca 0.21 -2.28 -0.07 0.00 0.42 0.00 0.00 52.86 51.14 3dd3 s ASN 136 Cb 0.19 -1.87 0.06 0.00 -1.45 0.00 0.00 41.25 38.18 3dd3 s ASN 136 CO 0.54 -0.52 0.40 0.00 -3.72 0.00 0.00 177.10 173.79 3dd3 n GLN 137 N 4.30 -2.26 -2.50 0.43 6.02 -1.26 -1.46 117.38 120.65 3dd3 n GLN 137 Ca 0.00 0.27 -0.10 0.00 -0.01 0.00 0.00 57.00 57.17 3dd3 n GLN 137 Cb 0.40 -4.39 -0.00 0.00 1.02 0.00 0.00 30.24 27.26 3dd3 n GLN 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dd3 n GLY 138 N -1.93 -0.50 1.53 1.08 0.00 -1.25 -2.54 105.19 101.59 3dd3 n GLY 138 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 3dd3 n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dd3 n GLY 139 N -0.74 0.56 0.05 -0.02 0.00 -0.53 -4.85 105.19 99.65 3dd3 n GLY 139 Ca -0.10 -0.57 0.11 0.00 0.00 0.00 0.00 46.02 45.46 3dd3 n GLY 139 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3dd3 n LYS 140 N -2.76 0.42 0.00 1.61 4.76 -1.05 -4.81 118.16 116.33 3dd3 n LYS 140 Ca 0.00 0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.45 3dd3 n LYS 140 Cb 0.00 -1.65 0.00 0.00 -1.84 0.00 0.00 35.03 31.54 3dd3 n LYS 140 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 3dd3 n THR 141 N -2.19 0.00 -4.63 -0.18 -2.24 -1.26 -5.11 114.28 98.66 3dd3 n THR 141 Ca 0.01 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.50 3dd3 n THR 141 Cb 0.48 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.63 3dd3 n THR 141 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 3dd3 s PHE 142 N 1.47 1.92 0.32 4.78 0.08 -1.26 -5.04 117.98 120.26 3dd3 s PHE 142 Ca 0.00 -1.03 0.03 0.00 0.12 0.00 0.00 56.93 56.05 3dd3 s PHE 142 Cb 0.00 -1.45 0.56 0.00 -0.57 0.00 0.00 43.02 41.56 3dd3 s PHE 142 CO 0.00 0.06 1.85 0.97 -0.10 0.00 0.00 175.22 178.00 3dd3 h ILE 143 N 1.61 1.21 -3.45 0.64 6.09 -1.96 -3.42 117.51 118.23 3dd3 h ILE 143 Ca -0.41 -0.83 -0.36 0.00 -1.37 0.00 0.00 64.86 61.89 3dd3 h ILE 143 Cb 1.29 0.95 -0.35 0.00 0.47 0.00 0.00 36.82 39.17 3dd3 h ILE 143 CO 0.69 0.28 -0.75 -0.69 -3.07 0.00 0.00 178.15 174.61 3dd3 s VAL 144 N -4.96 0.20 0.00 2.19 1.01 -1.26 -4.62 120.40 112.96 3dd3 s VAL 144 Ca -0.08 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.01 3dd3 s VAL 144 Cb 0.15 -0.31 0.00 0.00 0.00 0.00 0.00 36.38 36.22 3dd3 s VAL 144 CO 0.77 0.17 0.00 0.61 0.00 0.00 0.00 175.10 176.65 3dd3 n GLY 145 N 4.37 0.78 0.52 4.51 0.00 -1.26 -4.47 105.19 109.64 3dd3 n GLY 145 Ca -0.22 -0.84 0.08 0.00 0.00 0.00 0.00 46.02 45.04 3dd3 n GLY 145 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dd3 n ASP 146 N -3.03 2.02 -4.74 1.61 5.75 -1.26 -4.04 116.55 112.85 3dd3 n ASP 146 Ca 0.00 -1.51 -0.30 0.00 -0.01 0.00 0.00 54.79 52.97 3dd3 n ASP 146 Cb 0.00 0.22 -0.07 0.00 -1.03 0.00 0.00 41.12 40.24 3dd3 n ASP 146 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3dd3 s GLN 147 N -1.61 2.73 0.54 0.11 -2.07 -1.26 -4.84 119.66 113.25 3dd3 s GLN 147 Ca 0.16 -0.77 -0.22 0.00 -1.82 0.00 0.00 55.36 52.71 3dd3 s GLN 147 Cb 0.13 -2.64 -0.05 0.00 -1.09 0.00 0.00 33.01 29.36 3dd3 s GLN 147 CO 0.30 0.55 1.38 1.51 -1.32 0.00 0.00 175.29 177.71 3dd3 n ILE 148 N 0.45 3.74 -4.50 3.63 3.06 -1.26 -4.83 119.36 119.65 3dd3 n ILE 148 Ca -0.09 -0.50 -0.24 0.00 -2.50 0.00 0.00 62.75 59.42 3dd3 n ILE 148 Cb 0.52 -1.70 -0.10 0.00 0.54 0.00 0.00 39.64 38.89 3dd3 n ILE 148 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 3dd3 s SER 149 N -0.86 2.73 0.40 9.51 1.04 -1.26 -4.64 113.70 120.62 3dd3 s SER 149 Ca 0.70 -1.43 0.08 0.00 0.48 0.00 0.00 55.95 55.79 3dd3 s SER 149 Cb -0.42 -0.02 0.83 0.00 0.10 0.00 0.00 66.02 66.52 3dd3 s SER 149 CO 0.50 -0.64 1.99 2.19 0.98 0.00 0.00 173.24 178.25 3dd3 h PHE 150 N 1.98 0.37 0.00 5.02 -5.15 -0.86 -2.40 116.94 115.90 3dd3 h PHE 150 Ca -0.41 -0.02 -0.04 0.00 -0.20 0.00 0.00 57.97 57.31 3dd3 h PHE 150 Cb 1.25 -0.11 -0.01 0.00 0.22 0.00 0.00 35.95 37.30 3dd3 h PHE 150 CO 0.77 0.34 -0.17 0.00 -2.00 0.00 0.00 178.31 177.26 3dd3 h ALA 151 N 1.69 1.59 -0.84 12.09 0.00 -1.85 -1.71 119.26 130.23 3dd3 h ALA 151 Ca 0.09 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.85 3dd3 h ALA 151 Cb 0.17 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 3dd3 h ALA 151 CO -0.00 0.21 0.55 -0.44 0.00 0.00 0.00 179.25 179.57 3dd3 h ASP 152 N 0.00 0.97 -0.05 0.00 3.32 -1.82 0.21 116.42 119.06 3dd3 h ASP 152 Ca -0.00 -0.03 -0.21 0.00 0.02 0.00 0.00 57.03 56.81 3dd3 h ASP 152 Cb 0.32 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 39.63 3dd3 h ASP 152 CO 0.02 0.71 -0.75 1.88 -1.72 0.00 0.00 179.24 179.38 3dd3 h TYR 153 N 1.15 0.93 -0.13 4.55 0.05 -1.41 0.45 116.97 122.56 3dd3 h TYR 153 Ca 0.31 -0.41 -0.14 0.00 0.05 0.00 0.00 58.73 58.54 3dd3 h TYR 153 Cb -0.12 -0.15 0.00 0.00 1.01 0.00 0.00 36.73 37.47 3dd3 h TYR 153 CO 0.00 1.22 -0.45 -0.97 -1.05 0.00 0.00 178.16 176.91 3dd3 h ASN 154 N 0.48 0.63 -0.56 3.88 -1.24 -1.30 -1.98 115.58 115.49 3dd3 h ASN 154 Ca -0.04 -0.61 -0.09 0.00 0.71 0.00 0.00 56.30 56.28 3dd3 h ASN 154 Cb 1.36 -0.18 -0.02 0.00 0.73 0.00 0.00 38.32 40.21 3dd3 h ASN 154 CO 0.15 1.13 0.02 0.25 -1.29 0.00 0.00 177.43 177.69 3dd3 h LEU 155 N 0.17 0.96 -0.82 0.34 5.85 -0.56 -0.99 115.31 120.26 3dd3 h LEU 155 Ca -0.02 -0.30 0.03 0.00 0.84 0.00 0.00 57.88 58.44 3dd3 h LEU 155 Cb 1.08 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 41.80 3dd3 h LEU 155 CO 0.10 1.02 0.52 0.25 -0.34 0.00 0.00 178.44 179.99 3dd3 h LEU 156 N 0.87 0.87 -0.29 2.25 5.85 -0.04 -0.93 115.31 123.89 3dd3 h LEU 156 Ca 0.16 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.81 3dd3 h LEU 156 Cb 0.52 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 3dd3 h LEU 156 CO 0.03 0.60 -0.07 -0.78 -0.34 0.00 0.00 178.44 177.87 3dd3 h ASP 157 N 1.02 0.56 -0.93 1.25 3.58 -1.04 -1.69 116.42 119.17 3dd3 h ASP 157 Ca 0.33 -0.37 0.03 0.00 0.42 0.00 0.00 57.03 57.44 3dd3 h ASP 157 Cb 0.01 -0.15 -0.05 0.00 1.72 0.00 0.00 39.33 40.85 3dd3 h ASP 157 CO -0.11 0.80 0.60 0.25 -2.88 0.00 0.00 179.24 177.90 3dd3 h LEU 158 N 0.32 1.01 -0.04 2.28 5.85 -1.01 -1.93 115.31 121.78 3dd3 h LEU 158 Ca 0.07 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 3dd3 h LEU 158 Cb 0.55 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 3dd3 h LEU 158 CO 0.03 0.70 -0.00 -0.07 -0.34 0.00 0.00 178.44 178.76 3dd3 h LEU 159 N 1.18 0.07 -1.63 2.25 3.38 -1.15 -2.53 115.31 116.88 3dd3 h LEU 159 Ca 0.37 -0.31 0.08 0.00 0.09 0.00 0.00 57.88 58.10 3dd3 h LEU 159 Cb -0.01 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 3dd3 h LEU 159 CO -0.12 0.37 0.37 -0.07 0.09 0.00 0.00 178.44 179.09 3dd3 h LEU 160 N -0.22 0.38 -0.17 1.67 3.38 -1.20 -2.15 115.31 117.01 3dd3 h LEU 160 Ca 0.01 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.85 3dd3 h LEU 160 Cb 0.33 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 3dd3 h LEU 160 CO 0.00 0.24 -0.65 0.16 0.09 0.00 0.00 178.44 178.29 3dd3 h ILE 161 N 0.43 1.16 0.00 1.22 3.07 -1.21 -3.13 117.51 119.06 3dd3 h ILE 161 Ca 0.25 -2.50 -0.12 0.00 1.55 0.00 0.00 64.86 64.04 3dd3 h ILE 161 Cb 0.42 2.48 -0.02 0.00 -0.27 0.00 0.00 36.82 39.43 3dd3 h ILE 161 CO -0.07 0.63 -0.56 0.45 -1.05 0.00 0.00 178.15 177.55 3dd3 h HIS 162 N 0.00 0.00 0.00 0.16 3.86 -1.00 -1.81 115.15 116.36 3dd3 h HIS 162 Ca -0.01 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.16 3dd3 h HIS 162 Cb 1.42 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.89 3dd3 h HIS 162 CO 0.00 0.56 -0.21 0.93 0.86 0.00 0.00 177.93 180.08 3dd3 h GLU 163 N 0.00 0.00 0.16 2.45 5.08 -1.39 0.25 114.58 121.13 3dd3 h GLU 163 Ca -0.01 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.02 3dd3 h GLU 163 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 3dd3 h GLU 163 CO 0.07 0.21 -1.70 0.28 -1.00 0.00 0.00 179.01 176.87 3dd3 h VAL 164 N 0.00 0.98 -0.14 3.13 2.07 -1.44 -3.00 116.25 117.85 3dd3 h VAL 164 Ca -0.00 -2.59 -0.01 0.00 0.82 0.00 0.00 66.70 64.92 3dd3 h VAL 164 Cb 0.55 2.74 -0.01 0.00 -1.52 0.00 0.00 31.29 33.06 3dd3 h VAL 164 CO 0.03 0.84 0.06 0.25 0.02 0.00 0.00 177.57 178.77 3dd3 h LEU 165 N 0.09 0.19 -6.26 2.57 5.85 -1.18 -3.39 115.31 113.18 3dd3 h LEU 165 Ca -0.32 -0.14 -0.58 0.00 0.84 0.00 0.00 57.88 57.68 3dd3 h LEU 165 Cb 2.07 -0.05 -0.39 0.00 0.37 0.00 0.00 40.66 42.67 3dd3 h LEU 165 CO 0.17 0.28 -1.00 0.00 -0.34 0.00 0.00 178.44 177.55 3dd3 n ALA 166 N -2.21 2.76 -1.52 1.25 0.00 0.85 -5.09 120.51 116.56 3dd3 n ALA 166 Ca -0.05 -3.29 -0.45 0.00 0.00 0.00 0.00 53.44 49.65 3dd3 n ALA 166 Cb 0.11 -0.78 -0.02 0.00 0.00 0.00 0.00 19.45 18.75 3dd3 n ALA 166 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3dd3 n PRO 167 N 2.29 0.84 -0.98 0.00 -0.02 -1.13 -2.29 135.00 133.71 3dd3 n PRO 167 Ca 0.27 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 3dd3 n PRO 167 Cb 0.49 -1.54 0.00 0.00 -0.02 0.00 0.00 33.50 32.43 3dd3 n PRO 167 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dd3 n GLY 168 N 1.52 0.66 0.30 -1.23 0.00 -1.26 -4.89 105.19 100.29 3dd3 n GLY 168 Ca 0.12 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.31 3dd3 n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dd3 n LEU 170 N -3.61 0.47 0.03 0.00 4.77 -1.26 -3.88 117.00 113.51 3dd3 n LEU 170 Ca -0.03 0.01 0.03 0.00 -0.03 0.00 0.00 56.01 55.99 3dd3 n LEU 170 Cb 0.10 -0.18 0.40 0.00 -2.33 0.00 0.00 43.42 41.41 3dd3 n LEU 170 CO 0.26 0.09 1.08 0.44 -1.33 0.00 0.00 177.39 177.92 3dd3 h ASP 171 N 0.57 0.43 0.01 -1.43 3.32 -1.25 -1.11 116.42 116.95 3dd3 h ASP 171 Ca 0.00 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.02 3dd3 h ASP 171 Cb 0.35 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.79 3dd3 h ASP 171 CO 0.00 0.38 0.00 0.00 -1.72 0.00 0.00 179.24 177.90 3dd3 n ALA 172 N -2.48 2.58 -3.43 3.45 0.00 -1.25 -4.57 120.51 114.81 3dd3 n ALA 172 Ca 0.02 -0.18 -0.28 0.00 0.00 0.00 0.00 53.44 53.00 3dd3 n ALA 172 Cb 0.12 -1.47 -0.11 0.00 0.00 0.00 0.00 19.45 17.99 3dd3 n ALA 172 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3dd3 s PHE 173 N -2.01 0.86 0.35 0.00 0.08 -0.42 -5.03 117.98 111.81 3dd3 s PHE 173 Ca 0.43 -1.92 0.09 0.00 0.12 0.00 0.00 56.93 55.65 3dd3 s PHE 173 Cb 0.20 -0.90 0.66 0.00 -0.57 0.00 0.00 43.02 42.41 3dd3 s PHE 173 CO 0.34 -0.83 1.82 -1.35 -0.10 0.00 0.00 175.22 175.09 3dd3 h PRO 174 N 6.39 0.17 0.18 0.24 0.11 -1.81 -1.22 132.00 136.07 3dd3 h PRO 174 Ca 0.15 -0.06 -0.30 0.00 0.11 0.00 0.00 66.00 65.90 3dd3 h PRO 174 Cb 0.94 -0.01 0.02 0.00 0.11 0.00 0.00 31.00 32.06 3dd3 h PRO 174 CO 0.31 0.45 -1.35 -0.07 -0.21 0.00 0.00 178.00 177.13 3dd3 h LEU 175 N 0.15 0.65 -0.66 2.35 3.38 -1.94 -2.37 115.31 116.87 3dd3 h LEU 175 Ca 0.02 -0.69 -0.04 0.00 0.09 0.00 0.00 57.88 57.26 3dd3 h LEU 175 Cb 0.60 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 3dd3 h LEU 175 CO 0.04 1.53 0.24 -0.07 0.09 0.00 0.00 178.44 180.28 3dd3 h LEU 176 N 0.12 0.93 0.56 1.67 3.38 -1.83 0.46 115.31 120.60 3dd3 h LEU 176 Ca -0.19 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.56 3dd3 h LEU 176 Cb 2.05 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 42.57 3dd3 h LEU 176 CO 0.24 0.86 -0.27 0.28 0.09 0.00 0.00 178.44 179.65 3dd3 h SER 177 N 0.94 -0.63 -0.88 -0.43 0.02 -1.30 0.53 113.55 111.80 3dd3 h SER 177 Ca 0.22 -0.04 0.14 0.00 -0.84 0.00 0.00 61.79 61.27 3dd3 h SER 177 Cb 0.24 0.16 -0.09 0.00 0.14 0.00 0.00 62.40 62.85 3dd3 h SER 177 CO -0.01 -0.32 0.49 0.00 -1.14 0.00 0.00 176.83 175.84 3dd3 h ALA 178 N -0.63 1.35 0.18 3.77 0.00 -1.34 -0.94 119.26 121.65 3dd3 h ALA 178 Ca -0.08 0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.92 3dd3 h ALA 178 Cb 0.64 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 3dd3 h ALA 178 CO 0.13 -0.03 -0.29 -0.92 0.00 0.00 0.00 179.25 178.14 3dd3 h TYR 179 N 0.70 -0.77 -0.76 0.00 3.20 0.10 0.35 116.97 119.79 3dd3 h TYR 179 Ca 0.48 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.38 3dd3 h TYR 179 Cb 0.64 0.32 -0.04 0.00 1.54 0.00 0.00 36.73 39.18 3dd3 h TYR 179 CO -0.07 -0.40 0.49 0.28 -1.64 0.00 0.00 178.16 176.82 3dd3 h VAL 180 N -0.54 1.14 -0.47 1.81 2.07 0.62 -0.85 116.25 120.03 3dd3 h VAL 180 Ca 0.02 -0.33 -0.13 0.00 0.82 0.00 0.00 66.70 67.08 3dd3 h VAL 180 Cb 0.54 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 3dd3 h VAL 180 CO -0.13 0.18 -0.20 1.23 0.02 0.00 0.00 177.57 178.66 3dd3 h GLY 181 N 0.96 1.05 1.25 2.17 0.00 -0.77 -1.19 103.07 106.54 3dd3 h GLY 181 Ca 0.30 -0.93 -0.06 0.00 0.00 0.00 0.00 47.33 46.64 3dd3 h GLY 181 CO -0.10 0.84 0.12 -0.09 0.00 0.00 0.00 176.54 177.31 3dd3 h ARG 182 N 0.81 0.93 0.22 4.80 2.43 0.10 -2.90 114.38 120.79 3dd3 h ARG 182 Ca 0.11 -0.22 -0.35 0.00 -0.81 0.00 0.00 59.98 58.72 3dd3 h ARG 182 Cb 0.78 -0.13 0.02 0.00 -0.42 0.00 0.00 29.97 30.22 3dd3 h ARG 182 CO 0.06 0.85 -1.63 -0.07 -1.51 0.00 0.00 179.97 177.68 3dd3 h LEU 183 N 0.89 0.73 -1.97 3.80 3.38 -1.09 -3.25 115.31 117.79 3dd3 h LEU 183 Ca 0.19 -0.92 0.32 0.00 0.09 0.00 0.00 57.88 57.56 3dd3 h LEU 183 Cb 0.36 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 3dd3 h LEU 183 CO 0.00 1.75 0.79 0.28 0.09 0.00 0.00 178.44 181.36 3dd3 h SER 184 N 0.13 0.02 -0.12 -0.43 0.02 -1.25 -2.09 113.55 109.83 3dd3 h SER 184 Ca -0.30 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 3dd3 h SER 184 Cb 2.14 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.68 3dd3 h SER 184 CO 0.22 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.92 3dd3 n ALA 185 N -2.74 2.48 -1.71 3.77 0.00 -1.09 -3.05 120.51 118.16 3dd3 n ALA 185 Ca 0.24 -0.70 -0.43 0.00 0.00 0.00 0.00 53.44 52.55 3dd3 n ALA 185 Cb 1.16 -0.91 -0.03 0.00 0.00 0.00 0.00 19.45 19.67 3dd3 n ALA 185 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3dd3 n ARG 186 N 1.09 2.59 -0.06 0.00 1.74 -0.79 -4.76 116.66 116.47 3dd3 n ARG 186 Ca 0.16 0.93 -0.11 0.00 -0.77 0.00 0.00 57.85 58.07 3dd3 n ARG 186 Cb 0.54 -2.75 -0.05 0.00 -1.02 0.00 0.00 32.46 29.18 3dd3 n ARG 186 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3dd3 h PRO 187 N 6.24 -0.38 -0.25 5.56 0.11 -1.90 0.49 132.00 141.88 3dd3 h PRO 187 Ca -0.44 0.03 -0.15 0.00 0.11 0.00 0.00 66.00 65.54 3dd3 h PRO 187 Cb 1.22 0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.41 3dd3 h PRO 187 CO 0.91 -0.25 -0.47 0.87 -0.21 0.00 0.00 178.00 178.86 3dd3 h LYS 188 N -0.39 0.64 0.01 1.05 1.57 -1.89 -2.31 116.57 115.24 3dd3 h LYS 188 Ca 0.11 -0.36 -0.00 0.00 -1.87 0.00 0.00 60.65 58.53 3dd3 h LYS 188 Cb 0.59 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.92 3dd3 h LYS 188 CO -0.47 0.97 -0.00 1.25 -0.57 0.00 0.00 179.45 180.62 3dd3 h LEU 189 N 0.51 -0.01 -0.74 2.94 5.85 -1.64 -1.10 115.31 121.13 3dd3 h LEU 189 Ca 0.03 -0.23 0.08 0.00 0.84 0.00 0.00 57.88 58.59 3dd3 h LEU 189 Cb 1.00 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 41.93 3dd3 h LEU 189 CO 0.09 0.23 -0.56 0.50 -0.34 0.00 0.00 178.44 178.37 3dd3 h LYS 190 N -0.25 -0.17 -0.74 1.25 3.64 0.04 0.16 116.57 120.51 3dd3 h LYS 190 Ca -0.00 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.45 3dd3 h LYS 190 Cb 0.24 0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.04 3dd3 h LYS 190 CO 0.00 -0.11 0.44 0.00 -2.27 0.00 0.00 179.45 177.51 3dd3 h ALA 191 N 0.34 1.01 -0.16 5.00 0.00 -1.40 -2.65 119.26 121.40 3dd3 h ALA 191 Ca 0.14 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.06 3dd3 h ALA 191 Cb 0.50 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3dd3 h ALA 191 CO -0.79 0.14 0.08 0.35 0.00 0.00 0.00 179.25 179.03 3dd3 h PHE 192 N 0.80 0.15 0.00 0.00 3.57 -0.11 -1.77 116.94 119.58 3dd3 h PHE 192 Ca 0.33 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.83 3dd3 h PHE 192 Cb 0.18 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 38.87 3dd3 h PHE 192 CO -0.06 0.09 0.00 -0.07 -2.23 0.00 0.00 178.31 176.04 3dd3 h LEU 193 N 0.17 0.00 0.00 0.59 3.38 -0.55 -2.11 115.31 116.80 3dd3 h LEU 193 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3dd3 h LEU 193 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3dd3 h LEU 193 CO -0.04 0.00 -0.87 0.00 0.09 0.00 0.00 178.44 177.63 3dd3 n ALA 194 N -1.98 3.36 -1.71 1.53 0.00 -1.01 -4.55 120.51 116.15 3dd3 n ALA 194 Ca 0.01 -0.37 -0.32 0.00 0.00 0.00 0.00 53.44 52.76 3dd3 n ALA 194 Cb 0.27 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.69 3dd3 n ALA 194 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3dd3 s SER 195 N -3.84 5.98 0.40 0.00 1.04 -0.69 -4.82 113.70 111.77 3dd3 s SER 195 Ca 0.05 1.74 0.12 0.00 0.48 0.00 0.00 55.95 58.35 3dd3 s SER 195 Cb 0.15 -2.52 0.93 0.00 0.10 0.00 0.00 66.02 64.68 3dd3 s SER 195 CO 0.77 -1.03 1.92 1.55 0.98 0.00 0.00 173.24 177.44 3dd3 h PRO 196 N 0.51 0.53 -0.30 4.02 0.13 -1.92 0.13 132.00 135.10 3dd3 h PRO 196 Ca -0.47 -0.03 -0.08 0.00 -0.87 0.00 0.00 66.00 64.55 3dd3 h PRO 196 Cb 1.21 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 32.21 3dd3 h PRO 196 CO 0.58 0.35 -0.14 1.05 -0.23 0.00 0.00 178.00 179.61 3dd3 h GLU 197 N 0.54 0.52 0.08 0.86 4.11 -1.94 -1.24 114.58 117.51 3dd3 h GLU 197 Ca 0.36 -0.16 -0.00 0.00 0.07 0.00 0.00 59.36 59.63 3dd3 h GLU 197 Cb 0.66 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.86 3dd3 h GLU 197 CO -0.13 0.65 -0.04 -0.92 0.07 0.00 0.00 179.01 178.64 3dd3 h TYR 198 N 0.48 -0.10 0.00 2.06 3.20 -1.71 -3.39 116.97 117.51 3dd3 h TYR 198 Ca 0.09 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.91 3dd3 h TYR 198 Cb 0.53 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.82 3dd3 h TYR 198 CO 0.02 0.24 -0.21 0.28 -1.64 0.00 0.00 178.16 176.84 3dd3 h VAL 199 N -0.99 0.90 -0.40 1.81 2.07 -0.68 -2.86 116.25 116.10 3dd3 h VAL 199 Ca -0.01 -0.80 0.00 0.00 0.82 0.00 0.00 66.70 66.71 3dd3 h VAL 199 Cb 0.38 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 3dd3 h VAL 199 CO 0.02 0.21 0.00 0.59 0.02 0.00 0.00 177.57 178.41 3dd3 n ASN 200 N -3.92 3.14 -4.88 0.57 3.02 -0.47 -4.80 115.26 107.91 3dd3 n ASN 200 Ca -0.02 -1.95 -0.36 0.00 -0.03 0.00 0.00 54.58 52.22 3dd3 n ASN 200 Cb 0.30 -0.26 -0.06 0.00 -0.61 0.00 0.00 39.78 39.15 3dd3 n ASN 200 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3dd3 s LEU 201 N -1.40 4.39 0.57 3.41 1.43 -1.08 -5.07 118.68 120.92 3dd3 s LEU 201 Ca 0.38 0.53 -0.15 0.00 -1.03 0.00 0.00 54.13 53.86 3dd3 s LEU 201 Cb 0.22 -2.36 -0.05 0.00 0.03 0.00 0.00 46.19 44.02 3dd3 s LEU 201 CO 0.30 0.34 1.02 -2.16 0.23 0.00 0.00 176.35 176.08 3dd3 s PRO 202 N -1.35 3.65 0.10 1.29 0.04 -1.26 -4.69 135.00 132.79 3dd3 s PRO 202 Ca 0.21 0.99 -0.14 0.00 0.04 0.00 0.00 61.00 62.09 3dd3 s PRO 202 Cb -0.13 -2.09 -0.08 0.00 0.04 0.00 0.00 34.50 32.25 3dd3 s PRO 202 CO 0.10 -0.52 1.44 0.82 0.04 0.00 0.00 177.00 178.87 3dd3 h ILE 203 N 0.47 1.30 -2.30 0.56 2.04 -1.96 -0.10 117.51 117.52 3dd3 h ILE 203 Ca -0.46 -1.43 -0.55 0.00 1.00 0.00 0.00 64.86 63.42 3dd3 h ILE 203 Cb 1.20 1.53 -0.14 0.00 -0.74 0.00 0.00 36.82 38.67 3dd3 h ILE 203 CO 0.60 0.46 -0.63 0.20 0.00 0.00 0.00 178.15 178.78 3dd3 s ASN 204 N -6.54 3.13 0.21 1.72 0.01 -1.26 -0.71 114.94 111.50 3dd3 s ASN 204 Ca -0.12 -1.30 0.08 0.00 -0.71 0.00 0.00 52.86 50.80 3dd3 s ASN 204 Cb 0.09 -0.24 0.13 0.00 0.41 0.00 0.00 41.25 41.64 3dd3 s ASN 204 CO 0.83 -0.44 1.48 1.23 -1.51 0.00 0.00 177.10 178.69 3dd3 h GLY 205 N 2.04 0.05 -1.86 0.66 0.00 -1.89 -3.30 103.07 98.77 3dd3 h GLY 205 Ca -0.42 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 46.83 3dd3 h GLY 205 CO 0.73 0.08 0.00 1.16 0.00 0.00 0.00 176.54 178.50 3dd3 n ASN 206 N -3.66 2.72 0.00 0.19 0.23 -1.26 -4.91 115.26 108.58 3dd3 n ASN 206 Ca -0.01 -2.03 0.00 0.00 -0.53 0.00 0.00 54.58 52.00 3dd3 n ASN 206 Cb 0.74 -0.35 0.00 0.00 -2.08 0.00 0.00 39.78 38.09 3dd3 n ASN 206 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3dd3 n GLY 207 N 1.24 0.87 3.76 4.83 0.00 -1.24 -4.99 105.19 109.66 3dd3 n GLY 207 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 3dd3 n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dd3 s LYS 208 N -0.31 4.60 0.00 1.61 1.02 -1.26 -5.01 119.74 120.39 3dd3 s LYS 208 Ca 0.00 1.59 0.00 0.00 0.02 0.00 0.00 55.97 57.58 3dd3 s LYS 208 Cb 0.00 -3.03 0.00 0.00 -0.52 0.00 0.00 37.83 34.28 3dd3 s LYS 208 CO 0.00 0.24 0.00 0.00 -0.92 0.00 0.00 175.35 174.67