#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d3k n LYS 4 N 0.00 0.00 -2.56 -0.67 5.02 -1.25 -4.86 118.16 113.83 1d3k n LYS 4 Ca 0.00 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.88 1d3k n LYS 4 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 34.97 1d3k n LYS 4 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1d3k s THR 5 N -2.30 4.12 -0.25 -0.18 2.01 -1.26 -2.32 115.64 115.47 1d3k s THR 5 Ca 0.00 1.73 -0.04 0.00 0.31 0.00 0.00 61.69 63.69 1d3k s THR 5 Cb 0.00 -4.10 0.01 0.00 0.01 0.00 0.00 72.50 68.41 1d3k s THR 5 CO 0.00 0.25 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.47 1d3k s VAL 6 N 0.13 3.35 -0.56 3.82 1.01 -0.02 -4.95 120.40 123.19 1d3k s VAL 6 Ca 0.51 -0.71 -0.23 0.00 0.00 0.00 0.00 61.98 61.55 1d3k s VAL 6 Cb -0.27 -2.63 0.05 0.00 0.00 0.00 0.00 36.38 33.53 1d3k s VAL 6 CO 0.32 0.27 0.88 -0.13 0.00 0.00 0.00 175.10 176.45 1d3k s ARG 7 N 1.43 3.26 0.02 2.72 0.52 -1.26 -1.32 118.95 124.32 1d3k s ARG 7 Ca 0.03 -0.46 -0.22 0.00 -0.52 0.00 0.00 55.73 54.56 1d3k s ARG 7 Cb -0.16 -4.09 -0.05 0.00 0.52 0.00 0.00 34.95 31.17 1d3k s ARG 7 CO -0.02 -1.48 0.65 -0.46 0.02 0.00 0.00 175.30 174.00 1d3k s TRP 8 N 3.71 3.71 -0.45 -0.53 -0.11 0.25 -0.96 118.94 124.56 1d3k s TRP 8 Ca 0.26 1.29 -0.22 0.00 1.22 0.00 0.00 56.10 58.66 1d3k s TRP 8 Cb -0.14 -2.67 0.03 0.00 -1.50 0.00 0.00 33.47 29.18 1d3k s TRP 8 CO 0.17 0.34 0.71 0.00 -4.62 0.00 0.00 176.95 173.55 1d3k s ALA 10 N 3.06 3.61 -0.49 0.00 0.00 0.41 -4.79 121.76 123.56 1d3k s ALA 10 Ca 0.26 -0.28 -0.16 0.00 0.00 0.00 0.00 51.96 51.78 1d3k s ALA 10 Cb -0.13 -2.45 0.09 0.00 0.00 0.00 0.00 23.12 20.63 1d3k s ALA 10 CO 0.20 0.25 0.44 0.08 0.00 0.00 0.00 175.76 176.74 1d3k s VAL 11 N -0.22 5.20 0.07 0.00 1.01 -1.26 -0.62 120.40 124.58 1d3k s VAL 11 Ca 0.22 -1.15 0.00 0.00 0.00 0.00 0.00 61.98 61.06 1d3k s VAL 11 Cb -0.15 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 32.03 1d3k s VAL 11 CO 0.10 -0.68 0.00 -0.24 0.00 0.00 0.00 175.10 174.28 1d3k n SER 12 N 5.29 -2.29 -0.03 3.32 2.88 0.13 -4.27 113.62 118.64 1d3k n SER 12 Ca -0.12 0.31 -0.08 0.00 -1.33 0.00 0.00 58.87 57.64 1d3k n SER 12 Cb 0.43 -0.88 -0.02 0.00 -0.75 0.00 0.00 64.21 62.99 1d3k n SER 12 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1d3k h GLU 13 N 0.00 -0.17 -0.43 -1.46 4.39 -1.93 -1.15 114.58 113.83 1d3k h GLU 13 Ca 0.01 0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.67 1d3k h GLU 13 Cb 0.27 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.94 1d3k h GLU 13 CO 0.00 -0.11 0.09 0.45 -1.16 0.00 0.00 179.01 178.29 1d3k h HIS 14 N -0.17 0.74 -0.55 4.33 3.86 -1.90 -1.01 115.15 120.45 1d3k h HIS 14 Ca 0.12 -0.09 -0.10 0.00 -1.16 0.00 0.00 60.37 59.13 1d3k h HIS 14 Cb 0.35 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.59 1d3k h HIS 14 CO -0.31 0.70 -0.05 0.93 0.86 0.00 0.00 177.93 180.06 1d3k h GLU 15 N 0.57 1.01 -0.99 2.45 5.08 -1.73 -1.88 114.58 119.08 1d3k h GLU 15 Ca 0.13 -0.34 0.02 0.00 -1.00 0.00 0.00 59.36 58.17 1d3k h GLU 15 Cb 0.34 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.46 1d3k h GLU 15 CO 0.00 1.02 0.65 0.00 -1.00 0.00 0.00 179.01 179.69 1d3k h ALA 16 N 0.95 1.32 -0.37 3.43 0.00 -0.98 0.20 119.26 123.80 1d3k h ALA 16 Ca 0.15 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1d3k h ALA 16 Cb 0.60 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1d3k h ALA 16 CO 0.04 0.61 0.03 1.15 0.00 0.00 0.00 179.25 181.07 1d3k h THR 17 N 1.30 1.25 -0.51 0.00 2.02 -0.87 -1.26 112.91 114.84 1d3k h THR 17 Ca 0.38 -0.93 -0.07 0.00 0.77 0.00 0.00 66.41 66.55 1d3k h THR 17 Cb -0.09 1.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 1d3k h THR 17 CO -0.10 0.31 0.03 0.50 0.37 0.00 0.00 175.52 176.64 1d3k h LYS 18 N 0.47 0.83 -0.61 6.66 3.64 -0.78 -2.51 116.57 124.26 1d3k h LYS 18 Ca 0.11 -0.21 -0.03 0.00 -1.27 0.00 0.00 60.65 59.25 1d3k h LYS 18 Cb 0.42 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.11 1d3k h LYS 18 CO 0.01 0.81 0.27 0.00 -2.27 0.00 0.00 179.45 178.28 1d3k h GLN 20 N 0.85 0.27 -0.37 0.00 3.07 -0.98 -0.23 115.11 117.71 1d3k h GLN 20 Ca 0.21 -0.08 -0.14 0.00 0.09 0.00 0.00 58.65 58.73 1d3k h GLN 20 Cb 0.16 -0.03 -0.01 0.00 0.08 0.00 0.00 27.48 27.69 1d3k h GLN 20 CO -0.02 0.48 -0.33 0.77 0.09 0.00 0.00 178.83 179.82 1d3k h SER 21 N 0.25 0.87 0.05 0.06 0.02 -1.04 -1.61 113.55 112.15 1d3k h SER 21 Ca 0.04 -0.37 0.02 0.00 -0.84 0.00 0.00 61.79 60.64 1d3k h SER 21 Cb 0.53 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.80 1d3k h SER 21 CO 0.04 1.12 -0.15 0.15 -1.14 0.00 0.00 176.83 176.85 1d3k h PHE 22 N 0.69 -0.38 0.03 3.45 3.57 -0.13 -0.12 116.94 124.05 1d3k h PHE 22 Ca 0.07 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.60 1d3k h PHE 22 Cb 0.89 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 1d3k h PHE 22 CO 0.05 -0.22 -0.16 -0.09 -2.23 0.00 0.00 178.31 175.66 1d3k h ARG 23 N -0.27 -0.27 -0.60 1.11 2.43 -0.97 -0.75 114.38 115.06 1d3k h ARG 23 Ca 0.03 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1d3k h ARG 23 Cb 0.31 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.89 1d3k h ARG 23 CO -0.11 -0.18 0.33 -0.44 -1.51 0.00 0.00 179.97 178.06 1d3k h ASP 24 N -0.28 0.75 0.17 -3.80 3.32 -1.05 -1.05 116.42 114.49 1d3k h ASP 24 Ca 0.04 -0.09 -0.15 0.00 0.02 0.00 0.00 57.03 56.85 1d3k h ASP 24 Cb 0.33 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 1d3k h ASP 24 CO -0.13 0.62 -0.55 0.45 -1.72 0.00 0.00 179.24 177.91 1d3k h HIS 25 N 0.81 0.51 0.00 4.55 3.86 -0.84 -2.35 115.15 121.69 1d3k h HIS 25 Ca 0.21 -0.18 -0.07 0.00 -1.16 0.00 0.00 60.37 59.17 1d3k h HIS 25 Cb 0.04 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.40 1d3k h HIS 25 CO -0.01 0.86 -0.33 0.52 0.86 0.00 0.00 177.93 179.83 1d3k h MET 26 N 0.31 0.00 -0.40 2.45 2.86 -0.91 -2.55 114.93 116.69 1d3k h MET 26 Ca 0.00 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.55 1d3k h MET 26 Cb 1.06 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.71 1d3k h MET 26 CO 0.09 0.33 -0.13 0.87 1.06 0.00 0.00 176.91 179.14 1d3k h LYS 27 N 0.00 0.72 0.00 1.72 1.57 -0.66 0.57 116.57 120.49 1d3k h LYS 27 Ca -0.00 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 1d3k h LYS 27 Cb 0.59 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.84 1d3k h LYS 27 CO 0.04 0.82 0.00 0.66 -0.57 0.00 0.00 179.45 180.41 1d3k h SER 28 N 0.65 0.00 0.00 0.86 4.64 -1.18 -3.35 113.55 115.17 1d3k h SER 28 Ca 0.11 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.26 1d3k h SER 28 Cb 0.59 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.65 1d3k h SER 28 CO 0.04 0.00 -1.66 1.33 -0.87 0.00 0.00 176.83 175.67 1d3k n VAL 29 N -2.89 0.62 -3.04 0.95 0.24 -1.12 -4.99 118.33 108.11 1d3k n VAL 29 Ca 0.03 -0.40 -0.40 0.00 -2.04 0.00 0.00 64.34 61.54 1d3k n VAL 29 Cb 0.45 -0.67 -0.05 0.00 -1.47 0.00 0.00 33.84 32.09 1d3k n VAL 29 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1d3k s ILE 30 N -2.27 4.70 1.12 1.34 -1.09 0.18 -5.06 121.20 120.12 1d3k s ILE 30 Ca -0.05 1.55 -0.13 0.00 -2.23 0.00 0.00 60.65 59.80 1d3k s ILE 30 Cb 0.03 -4.08 0.26 0.00 -1.58 0.00 0.00 42.46 37.09 1d3k s ILE 30 CO 0.40 0.41 1.05 -2.16 -1.23 0.00 0.00 174.94 173.41 1d3k s PRO 31 N -0.31 -0.57 0.49 2.79 0.04 -1.26 -4.80 135.00 131.38 1d3k s PRO 31 Ca 0.36 0.76 0.14 0.00 0.04 0.00 0.00 61.00 62.30 1d3k s PRO 31 Cb -0.20 -1.60 1.17 0.00 0.04 0.00 0.00 34.50 33.90 1d3k s PRO 31 CO 0.22 -3.47 2.13 0.66 0.04 0.00 0.00 177.00 176.58 1d3k h SER 32 N -2.43 0.12 -0.33 6.66 4.64 -1.97 -0.04 113.55 120.19 1d3k h SER 32 Ca -0.60 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.72 1d3k h SER 32 Cb 1.33 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1d3k h SER 32 CO 0.52 0.09 0.00 -0.90 -0.87 0.00 0.00 176.83 175.67 1d3k n ASP 33 N -4.52 2.98 -4.99 4.97 5.68 -1.26 -4.92 116.55 114.49 1d3k n ASP 33 Ca -0.01 -2.31 -0.19 0.00 -0.50 0.00 0.00 54.79 51.77 1d3k n ASP 33 Cb 0.08 -0.48 0.00 0.00 -1.14 0.00 0.00 41.12 39.59 1d3k n ASP 33 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 1d3k s GLY 34 N -0.62 1.67 0.46 6.12 0.00 -0.03 -3.89 107.32 111.02 1d3k s GLY 34 Ca 0.28 -1.43 -0.22 0.00 0.00 0.00 0.00 44.72 43.34 1d3k s GLY 34 CO 0.12 -1.30 1.11 2.56 0.00 0.00 0.00 173.10 175.58 1d3k s PRO 35 N -4.30 3.83 0.32 2.90 0.04 -1.26 -3.87 135.00 132.66 1d3k s PRO 35 Ca 0.48 1.62 0.09 0.00 0.04 0.00 0.00 61.00 63.23 1d3k s PRO 35 Cb -0.10 -2.35 -0.06 0.00 0.04 0.00 0.00 34.50 32.04 1d3k s PRO 35 CO 0.33 -0.46 -0.10 -1.54 0.04 0.00 0.00 177.00 175.28 1d3k s SER 36 N -1.56 3.48 0.01 6.66 1.04 -0.98 -4.91 113.70 117.44 1d3k s SER 36 Ca 0.64 -1.18 0.05 0.00 0.48 0.00 0.00 55.95 55.94 1d3k s SER 36 Cb -0.24 -0.30 -0.03 0.00 0.10 0.00 0.00 66.02 65.55 1d3k s SER 36 CO 0.29 -0.21 -0.12 -0.69 0.98 0.00 0.00 173.24 173.49 1d3k s VAL 37 N -2.70 3.24 0.05 5.02 1.01 -1.26 -0.84 120.40 124.93 1d3k s VAL 37 Ca 0.31 -0.91 0.05 0.00 0.00 0.00 0.00 61.98 61.43 1d3k s VAL 37 Cb 0.02 -2.37 -0.02 0.00 0.00 0.00 0.00 36.38 34.00 1d3k s VAL 37 CO 0.15 0.41 -0.13 0.00 0.00 0.00 0.00 175.10 175.53 1d3k s ALA 38 N -0.93 1.08 -0.16 5.51 0.00 -0.43 -4.82 121.76 122.00 1d3k s ALA 38 Ca 0.15 -0.88 -0.02 0.00 0.00 0.00 0.00 51.96 51.22 1d3k s ALA 38 Cb -0.11 -0.12 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 1d3k s ALA 38 CO 0.06 0.16 -0.08 0.00 0.00 0.00 0.00 175.76 175.90 1d3k s VAL 40 N 0.66 2.89 -0.13 0.00 1.01 -0.25 -4.95 120.40 119.63 1d3k s VAL 40 Ca -0.05 -1.02 -0.17 0.00 0.00 0.00 0.00 61.98 60.75 1d3k s VAL 40 Cb -0.15 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.72 1d3k s VAL 40 CO 0.02 0.20 0.41 -0.75 0.00 0.00 0.00 175.10 174.98 1d3k s LYS 41 N 1.33 4.31 0.26 2.72 2.20 -1.26 -0.44 119.74 128.85 1d3k s LYS 41 Ca 0.00 0.32 0.04 0.00 -0.36 0.00 0.00 55.97 55.98 1d3k s LYS 41 Cb -0.17 -3.43 -0.06 0.00 -1.51 0.00 0.00 37.83 32.67 1d3k s LYS 41 CO -0.04 0.19 0.00 0.15 -0.36 0.00 0.00 175.35 175.29 1d3k s LYS 42 N 0.55 1.44 0.22 4.03 -0.14 0.21 -4.94 119.74 121.12 1d3k s LYS 42 Ca 0.23 -1.75 0.16 0.00 -1.36 0.00 0.00 55.97 53.25 1d3k s LYS 42 Cb -0.14 -0.75 0.02 0.00 -1.68 0.00 0.00 37.83 35.27 1d3k s LYS 42 CO 0.08 -0.10 1.26 0.00 -0.76 0.00 0.00 175.35 175.84 1d3k h ALA 43 N 2.36 0.67 -2.73 5.17 0.00 -1.94 0.36 119.26 123.15 1d3k h ALA 43 Ca -0.39 -0.51 -0.08 0.00 0.00 0.00 0.00 54.91 53.93 1d3k h ALA 43 Cb 1.23 0.02 -0.11 0.00 0.00 0.00 0.00 17.79 18.93 1d3k h ALA 43 CO 0.66 0.64 -0.21 0.45 0.00 0.00 0.00 179.25 180.79 1d3k s SER 44 N -6.20 -0.05 0.40 0.00 0.15 -1.26 -4.60 113.70 102.14 1d3k s SER 44 Ca 0.02 -0.80 0.10 0.00 0.70 0.00 0.00 55.95 55.97 1d3k s SER 44 Cb 0.08 0.49 0.84 0.00 -1.71 0.00 0.00 66.02 65.72 1d3k s SER 44 CO 0.76 -0.97 1.95 0.10 1.20 0.00 0.00 173.24 176.28 1d3k h TYR 45 N 2.41 0.22 -0.50 3.44 -0.00 -1.93 -2.43 116.97 118.20 1d3k h TYR 45 Ca -0.30 -0.02 -0.07 0.00 -0.00 0.00 0.00 58.73 58.34 1d3k h TYR 45 Cb 1.24 -0.07 -0.02 0.00 -0.00 0.00 0.00 36.73 37.88 1d3k h TYR 45 CO 0.39 0.32 0.02 1.25 -0.00 0.00 0.00 178.16 180.14 1d3k h LEU 46 N 0.21 0.78 -1.04 0.10 5.85 -1.95 0.21 115.31 119.47 1d3k h LEU 46 Ca 0.05 -0.18 -0.10 0.00 0.84 0.00 0.00 57.88 58.48 1d3k h LEU 46 Cb 0.31 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 1d3k h LEU 46 CO 0.02 0.84 -0.48 0.44 -0.34 0.00 0.00 178.44 178.92 1d3k h ASP 47 N 0.76 0.01 -0.33 1.25 3.32 -1.85 -1.65 116.42 117.92 1d3k h ASP 47 Ca 0.15 -0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.04 1d3k h ASP 47 Cb 0.44 -0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.98 1d3k h ASP 47 CO 0.02 0.48 -0.39 0.00 -1.72 0.00 0.00 179.24 177.63 1d3k h ILE 49 N 0.65 1.04 -0.46 0.00 2.04 -0.66 -2.19 117.51 117.92 1d3k h ILE 49 Ca 0.05 -0.10 0.01 0.00 1.00 0.00 0.00 64.86 65.82 1d3k h ILE 49 Cb 0.99 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 38.11 1d3k h ILE 49 CO 0.09 0.03 0.29 0.03 0.00 0.00 0.00 178.15 178.59 1d3k h ARG 50 N -0.01 0.57 -0.96 2.37 2.47 -1.28 -2.36 114.38 115.18 1d3k h ARG 50 Ca 0.01 -0.03 0.04 0.00 -1.26 0.00 0.00 59.98 58.73 1d3k h ARG 50 Cb 0.04 -0.13 -0.06 0.00 -1.65 0.00 0.00 29.97 28.17 1d3k h ARG 50 CO -0.00 0.38 0.63 0.00 0.56 0.00 0.00 179.97 181.53 1d3k h ALA 51 N 1.19 1.39 -0.18 0.04 0.00 -0.97 -0.31 119.26 120.41 1d3k h ALA 51 Ca 0.18 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1d3k h ALA 51 Cb -0.03 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.42 1d3k h ALA 51 CO -0.06 0.51 -0.10 0.82 0.00 0.00 0.00 179.25 180.42 1d3k h ILE 52 N 1.20 1.31 -0.34 0.00 2.04 -1.21 0.60 117.51 121.11 1d3k h ILE 52 Ca 0.38 -1.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 1d3k h ILE 52 Cb 0.02 1.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 1d3k h ILE 52 CO -0.12 0.35 0.18 0.00 0.00 0.00 0.00 178.15 178.56 1d3k h ALA 53 N 0.68 1.68 -0.42 1.87 0.00 -1.00 -1.60 119.26 120.47 1d3k h ALA 53 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1d3k h ALA 53 Cb 0.59 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1d3k h ALA 53 CO 0.03 0.27 0.00 0.00 0.00 0.00 0.00 179.25 179.55 1d3k n ALA 54 N -2.48 2.65 -3.07 0.00 0.00 -0.17 -4.92 120.51 112.52 1d3k n ALA 54 Ca 0.02 -0.87 -0.20 0.00 0.00 0.00 0.00 53.44 52.39 1d3k n ALA 54 Cb 0.10 -0.99 0.04 0.00 0.00 0.00 0.00 19.45 18.60 1d3k n ALA 54 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1d3k n ASN 55 N 0.69 -5.65 -0.01 0.00 5.15 -0.60 -4.88 115.26 109.96 1d3k n ASN 55 Ca 0.15 -0.31 0.09 0.00 -0.60 0.00 0.00 54.58 53.91 1d3k n ASN 55 Cb 0.48 -4.42 -0.13 0.00 -0.53 0.00 0.00 39.78 35.18 1d3k n ASN 55 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1d3k n GLU 56 N -3.85 0.74 -4.00 1.20 -0.58 0.20 -5.00 120.64 109.35 1d3k n GLU 56 Ca -0.07 -0.12 -0.09 0.00 -0.42 0.00 0.00 57.16 56.46 1d3k n GLU 56 Cb 0.59 -1.40 -0.05 0.00 -0.57 0.00 0.00 31.44 30.01 1d3k n GLU 56 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1d3k s ALA 57 N -3.08 -0.19 -0.03 0.62 0.00 -1.07 -4.93 121.76 113.07 1d3k s ALA 57 Ca -0.03 -0.92 0.02 0.00 0.00 0.00 0.00 51.96 51.03 1d3k s ALA 57 Cb 0.12 1.06 -0.03 0.00 0.00 0.00 0.00 23.12 24.27 1d3k s ALA 57 CO 0.74 -0.86 -0.01 -0.25 0.00 0.00 0.00 175.76 175.38 1d3k n ASP 58 N -0.49 4.03 -3.80 0.00 8.00 -0.13 -4.13 116.55 120.02 1d3k n ASP 58 Ca -0.02 -0.01 -0.11 0.00 0.71 0.00 0.00 54.79 55.37 1d3k n ASP 58 Cb 0.62 0.35 -0.08 0.00 -0.02 0.00 0.00 41.12 41.99 1d3k n ASP 58 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1d3k s ALA 59 N -2.08 -0.49 -0.22 2.24 0.00 -1.09 -4.47 121.76 115.65 1d3k s ALA 59 Ca -0.03 -0.18 -0.27 0.00 0.00 0.00 0.00 51.96 51.48 1d3k s ALA 59 Cb 0.01 0.32 0.08 0.00 0.00 0.00 0.00 23.12 23.54 1d3k s ALA 59 CO 0.12 -0.40 0.79 0.54 0.00 0.00 0.00 175.76 176.81 1d3k s VAL 60 N -2.68 0.00 -0.08 0.00 0.11 -1.24 -0.85 120.40 115.66 1d3k s VAL 60 Ca -0.04 0.00 -0.18 0.00 -2.93 0.00 0.00 61.98 58.83 1d3k s VAL 60 Cb -0.00 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.80 1d3k s VAL 60 CO -0.04 0.00 0.47 -0.89 -3.33 0.00 0.00 175.10 171.31 1d3k s THR 61 N -0.10 5.11 0.04 5.04 2.01 -1.26 -1.76 115.64 124.72 1d3k s THR 61 Ca -0.02 0.96 0.05 0.00 0.31 0.00 0.00 61.69 62.99 1d3k s THR 61 Cb -0.04 -3.81 -0.02 0.00 0.01 0.00 0.00 72.50 68.65 1d3k s THR 61 CO 0.02 0.40 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.43 1d3k s LEU 62 N 0.12 2.17 0.58 4.42 1.43 0.10 -4.93 118.68 122.57 1d3k s LEU 62 Ca 0.26 -0.47 -0.20 0.00 -1.03 0.00 0.00 54.13 52.70 1d3k s LEU 62 Cb -0.16 -0.69 -0.04 0.00 0.03 0.00 0.00 46.19 45.34 1d3k s LEU 62 CO 0.12 0.06 1.24 -0.62 0.23 0.00 0.00 176.35 177.39 1d3k s ASP 63 N -1.13 5.20 0.38 2.29 2.15 -1.26 -0.89 116.67 123.40 1d3k s ASP 63 Ca 0.03 2.49 0.08 0.00 0.43 0.00 0.00 52.55 55.57 1d3k s ASP 63 Cb -0.08 -2.61 0.80 0.00 -0.30 0.00 0.00 42.92 40.74 1d3k s ASP 63 CO 0.01 -1.60 1.96 0.00 -0.17 0.00 0.00 175.17 175.38 1d3k h ALA 64 N 1.04 1.77 -0.15 3.66 0.00 -1.80 -0.45 119.26 123.33 1d3k h ALA 64 Ca -0.51 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.36 1d3k h ALA 64 Cb 1.30 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1d3k h ALA 64 CO 0.56 0.11 -0.02 0.78 0.00 0.00 0.00 179.25 180.68 1d3k h GLY 65 N 0.68 0.22 1.85 0.00 0.00 -1.91 -1.22 103.07 102.70 1d3k h GLY 65 Ca 0.31 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.53 1d3k h GLY 65 CO -0.10 0.10 -0.13 1.41 0.00 0.00 0.00 176.54 177.82 1d3k h LEU 66 N 0.21 0.00 -1.04 3.11 3.38 -1.20 -3.20 115.31 116.57 1d3k h LEU 66 Ca 0.05 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 1d3k h LEU 66 Cb 0.18 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1d3k h LEU 66 CO 0.01 0.01 -0.26 0.58 0.09 0.00 0.00 178.44 178.86 1d3k h VAL 67 N 0.00 1.26 0.18 1.22 2.07 -0.66 -1.45 116.25 118.87 1d3k h VAL 67 Ca 0.00 -1.23 -0.01 0.00 0.82 0.00 0.00 66.70 66.28 1d3k h VAL 67 Cb 0.87 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.05 1d3k h VAL 67 CO 0.00 0.38 -0.09 0.22 0.02 0.00 0.00 177.57 178.10 1d3k h TYR 68 N 0.32 -0.23 -0.97 1.57 3.20 -1.52 -2.35 116.97 116.98 1d3k h TYR 68 Ca 0.05 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.98 1d3k h TYR 68 Cb 0.64 0.08 -0.07 0.00 1.54 0.00 0.00 36.73 38.92 1d3k h TYR 68 CO 0.02 0.03 0.63 -0.44 -1.64 0.00 0.00 178.16 176.75 1d3k h ASP 69 N -0.47 1.00 0.33 -2.11 5.19 -1.61 -1.50 116.42 117.25 1d3k h ASP 69 Ca -0.03 0.01 -0.03 0.00 -0.62 0.00 0.00 57.03 56.37 1d3k h ASP 69 Cb 0.36 -0.20 -0.00 0.00 0.18 0.00 0.00 39.33 39.66 1d3k h ASP 69 CO 0.04 0.64 -0.13 0.00 -3.12 0.00 0.00 179.24 176.67 1d3k h ALA 70 N 1.44 1.36 0.03 3.45 0.00 -1.12 -2.48 119.26 121.93 1d3k h ALA 70 Ca 0.42 -0.12 -0.22 0.00 0.00 0.00 0.00 54.91 54.99 1d3k h ALA 70 Cb 0.16 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1d3k h ALA 70 CO -0.17 0.17 -0.99 -0.92 0.00 0.00 0.00 179.25 177.34 1d3k h TYR 71 N 0.00 0.22 -4.13 0.00 5.03 -0.73 -0.36 116.97 116.99 1d3k h TYR 71 Ca -0.00 -0.14 -0.54 0.00 2.58 0.00 0.00 58.73 60.62 1d3k h TYR 71 Cb 0.34 -0.02 0.15 0.00 1.55 0.00 0.00 36.73 38.75 1d3k h TYR 71 CO 0.00 1.04 0.46 -0.51 -1.32 0.00 0.00 178.16 177.82 1d3k s LEU 72 N -7.12 3.49 0.67 2.82 1.43 -0.94 -3.27 118.68 115.77 1d3k s LEU 72 Ca -0.02 2.47 -0.16 0.00 -1.03 0.00 0.00 54.13 55.40 1d3k s LEU 72 Cb 0.09 -4.60 0.01 0.00 0.03 0.00 0.00 46.19 41.72 1d3k s LEU 72 CO 0.83 -2.02 1.15 0.00 0.23 0.00 0.00 176.35 176.54 1d3k s ALA 73 N -1.67 2.37 -1.39 4.21 0.00 -1.26 -2.14 121.76 121.87 1d3k s ALA 73 Ca 0.78 0.71 0.10 0.00 0.00 0.00 0.00 51.96 53.55 1d3k s ALA 73 Cb -0.33 -3.38 0.39 0.00 0.00 0.00 0.00 23.12 19.81 1d3k s ALA 73 CO 0.40 -1.43 1.24 -0.35 0.00 0.00 0.00 175.76 175.63 1d3k n PRO 74 N -2.38 2.44 -0.04 0.00 -0.04 -1.26 -4.86 135.00 128.86 1d3k n PRO 74 Ca 0.12 -1.56 -0.17 0.00 -0.04 0.00 0.00 63.50 61.85 1d3k n PRO 74 Cb 0.51 -1.57 -0.13 0.00 -0.04 0.00 0.00 33.50 32.27 1d3k n PRO 74 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1d3k h ASN 75 N 2.27 0.14 -6.57 3.54 4.21 -1.70 -3.49 115.58 113.98 1d3k h ASN 75 Ca 0.00 -0.91 -0.51 0.00 1.21 0.00 0.00 56.30 56.08 1d3k h ASN 75 Cb 0.87 -0.05 -0.04 0.00 -1.12 0.00 0.00 38.32 37.98 1d3k h ASN 75 CO 0.12 1.21 -0.92 0.59 -1.29 0.00 0.00 177.43 177.13 1d3k n ASN 76 N -4.42 -1.52 -4.91 5.81 4.13 -0.93 -4.82 115.26 108.62 1d3k n ASN 76 Ca -0.15 -1.08 -0.27 0.00 1.68 0.00 0.00 54.58 54.76 1d3k n ASN 76 Cb 0.62 -2.77 -0.01 0.00 -1.54 0.00 0.00 39.78 36.08 1d3k n ASN 76 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1d3k s LEU 77 N -6.98 3.76 0.09 3.41 1.43 -0.16 -3.88 118.68 116.36 1d3k s LEU 77 Ca 0.15 0.87 0.05 0.00 -1.03 0.00 0.00 54.13 54.17 1d3k s LEU 77 Cb -0.06 -3.78 -0.03 0.00 0.03 0.00 0.00 46.19 42.34 1d3k s LEU 77 CO 0.91 -0.47 -0.14 -1.59 0.23 0.00 0.00 176.35 175.28 1d3k s LYS 78 N -4.42 0.90 0.07 1.70 -2.85 0.16 -4.06 119.74 111.25 1d3k s LYS 78 Ca 0.46 -1.06 -0.30 0.00 -1.00 0.00 0.00 55.97 54.07 1d3k s LYS 78 Cb -0.10 -0.87 -0.06 0.00 -2.06 0.00 0.00 37.83 34.74 1d3k s LYS 78 CO 0.40 0.18 1.15 -1.25 0.10 0.00 0.00 175.35 175.93 1d3k s PRO 79 N -2.08 4.48 0.00 1.78 0.04 -1.26 -0.96 135.00 137.00 1d3k s PRO 79 Ca 0.02 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.77 1d3k s PRO 79 Cb -0.08 -3.35 0.00 0.00 0.04 0.00 0.00 34.50 31.11 1d3k s PRO 79 CO 0.02 -0.17 0.00 1.33 0.04 0.00 0.00 177.00 178.22 1d3k n VAL 80 N 3.66 0.00 -3.83 -0.36 0.24 -0.10 -4.81 118.33 113.14 1d3k n VAL 80 Ca 0.07 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.24 1d3k n VAL 80 Cb 0.47 -0.74 -0.15 0.00 -1.47 0.00 0.00 33.84 31.95 1d3k n VAL 80 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1d3k s VAL 81 N -1.95 -0.02 0.10 3.34 1.01 -1.20 -1.61 120.40 120.06 1d3k s VAL 81 Ca 0.00 0.09 0.07 0.00 0.00 0.00 0.00 61.98 62.14 1d3k s VAL 81 Cb 0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 36.38 36.28 1d3k s VAL 81 CO 0.00 0.04 -0.11 0.00 0.00 0.00 0.00 175.10 175.02 1d3k s ALA 82 N 0.45 2.90 0.42 5.51 0.00 0.08 0.00 121.76 131.13 1d3k s ALA 82 Ca -0.04 -1.24 -0.12 0.00 0.00 0.00 0.00 51.96 50.56 1d3k s ALA 82 Cb -0.05 -0.87 -0.07 0.00 0.00 0.00 0.00 23.12 22.13 1d3k s ALA 82 CO -0.01 0.63 0.81 -1.21 0.00 0.00 0.00 175.76 175.97 1d3k s GLU 83 N -2.11 3.82 0.07 0.00 2.02 -0.79 -0.91 118.70 120.82 1d3k s GLU 83 Ca 0.20 0.57 0.04 0.00 0.02 0.00 0.00 54.97 55.80 1d3k s GLU 83 Cb -0.11 -2.35 -0.03 0.00 0.10 0.00 0.00 34.13 31.74 1d3k s GLU 83 CO 0.12 -0.07 -0.12 -0.59 0.02 0.00 0.00 175.26 174.63 1d3k s PHE 84 N -2.39 1.06 0.01 1.61 -0.12 -0.61 -4.70 117.98 112.84 1d3k s PHE 84 Ca 0.53 -0.51 0.00 0.00 -0.05 0.00 0.00 56.93 56.90 1d3k s PHE 84 Cb -0.10 -0.60 -0.00 0.00 -0.63 0.00 0.00 43.02 41.69 1d3k s PHE 84 CO 0.30 0.02 0.00 0.66 -0.05 0.00 0.00 175.22 176.15 1d3k n TYR 85 N 1.16 0.02 0.00 3.49 4.01 0.23 -0.48 117.16 125.58 1d3k n TYR 85 Ca -0.20 -0.04 0.00 0.00 -0.16 0.00 0.00 57.90 57.49 1d3k n TYR 85 Cb 0.55 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.57 1d3k n TYR 85 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1d3k n GLY 86 N 4.71 2.12 3.65 2.72 0.00 -1.26 -1.56 105.19 115.57 1d3k n GLY 86 Ca -0.00 0.09 -0.05 0.00 0.00 0.00 0.00 46.02 46.05 1d3k n GLY 86 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1d3k s SER 87 N -4.00 -0.24 0.29 1.61 1.04 -1.25 -4.99 113.70 106.15 1d3k s SER 87 Ca 0.00 -0.23 0.10 0.00 0.48 0.00 0.00 55.95 56.30 1d3k s SER 87 Cb 0.00 0.43 0.41 0.00 0.10 0.00 0.00 66.02 66.96 1d3k s SER 87 CO 0.00 -0.76 1.65 0.11 0.98 0.00 0.00 173.24 175.22 1d3k h LYS 88 N 2.00 0.05 -0.20 4.02 1.57 -1.91 -1.84 116.57 120.26 1d3k h LYS 88 Ca -0.23 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.49 1d3k h LYS 88 Cb 1.23 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.54 1d3k h LYS 88 CO 0.28 0.60 0.03 0.93 -0.57 0.00 0.00 179.45 180.71 1d3k h GLU 89 N 0.04 0.33 -2.56 3.15 3.07 -1.97 -3.36 114.58 113.28 1d3k h GLU 89 Ca -0.00 -0.09 -0.60 0.00 -0.50 0.00 0.00 59.36 58.17 1d3k h GLU 89 Cb 1.01 -0.04 -0.40 0.00 -0.84 0.00 0.00 28.75 28.48 1d3k h GLU 89 CO 0.08 0.49 -0.81 -3.47 -1.40 0.00 0.00 179.01 173.89 1d3k n ASP 90 N -4.74 1.23 -4.73 1.42 2.03 -1.19 -5.10 116.55 105.47 1d3k n ASP 90 Ca -0.04 -2.81 -0.42 0.00 0.52 0.00 0.00 54.79 52.04 1d3k n ASP 90 Cb 0.19 -0.65 -0.03 0.00 -0.72 0.00 0.00 41.12 39.92 1d3k n ASP 90 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1d3k s PRO 91 N -0.87 4.17 -0.13 -0.67 0.04 -0.70 -3.81 135.00 133.04 1d3k s PRO 91 Ca 0.31 2.48 -0.01 0.00 0.04 0.00 0.00 61.00 63.82 1d3k s PRO 91 Cb 0.04 -3.10 -0.02 0.00 0.04 0.00 0.00 34.50 31.46 1d3k s PRO 91 CO -0.16 -0.65 -0.09 -0.65 0.04 0.00 0.00 177.00 175.50 1d3k s GLN 92 N 0.73 3.36 -0.53 4.56 -0.21 -0.60 -4.91 119.66 122.06 1d3k s GLN 92 Ca 0.70 -0.60 0.02 0.00 0.02 0.00 0.00 55.36 55.49 1d3k s GLN 92 Cb -0.46 -2.72 0.50 0.00 1.00 0.00 0.00 33.01 31.33 1d3k s GLN 92 CO 0.35 0.31 1.82 0.25 -2.12 0.00 0.00 175.29 175.91 1d3k n THR 93 N 3.28 3.28 -3.88 -0.19 -2.24 -1.26 -0.60 114.28 112.66 1d3k n THR 93 Ca -0.18 -2.94 -0.09 0.00 -2.27 0.00 0.00 64.05 58.58 1d3k n THR 93 Cb 0.53 -0.95 -0.04 0.00 -2.10 0.00 0.00 70.33 67.77 1d3k n THR 93 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1d3k s PHE 94 N -3.64 0.08 0.20 4.78 -0.71 -1.26 -2.23 117.98 115.20 1d3k s PHE 94 Ca 0.59 -0.46 -0.09 0.00 -1.04 0.00 0.00 56.93 55.93 1d3k s PHE 94 Cb 0.48 0.37 -0.01 0.00 -1.21 0.00 0.00 43.02 42.65 1d3k s PHE 94 CO 0.02 -1.02 0.34 1.52 -1.34 0.00 0.00 175.22 174.73 1d3k s TYR 95 N -3.95 0.48 -0.15 3.49 1.13 -0.45 -4.79 117.35 113.11 1d3k s TYR 95 Ca 0.15 -0.82 -0.08 0.00 -1.41 0.00 0.00 57.07 54.91 1d3k s TYR 95 Cb -0.02 -0.03 -0.04 0.00 -1.10 0.00 0.00 41.96 40.77 1d3k s TYR 95 CO 0.05 -0.81 0.11 0.71 -2.51 0.00 0.00 175.55 173.10 1d3k s TYR 96 N -4.01 3.44 -0.14 -3.49 2.02 -1.26 -1.21 117.35 112.69 1d3k s TYR 96 Ca 0.22 0.36 -0.21 0.00 -0.37 0.00 0.00 57.07 57.07 1d3k s TYR 96 Cb 0.02 -2.03 -0.03 0.00 -0.40 0.00 0.00 41.96 39.53 1d3k s TYR 96 CO 0.05 0.47 0.63 0.00 -1.57 0.00 0.00 175.55 175.13 1d3k s ALA 97 N -0.31 3.47 0.28 3.71 0.00 -0.27 -1.41 121.76 127.23 1d3k s ALA 97 Ca 0.11 -0.12 0.03 0.00 0.00 0.00 0.00 51.96 51.98 1d3k s ALA 97 Cb -0.12 -2.92 -0.06 0.00 0.00 0.00 0.00 23.12 20.02 1d3k s ALA 97 CO 0.01 -0.33 0.04 0.14 0.00 0.00 0.00 175.76 175.61 1d3k s VAL 98 N 1.38 1.06 -0.24 0.00 -7.23 -0.42 -0.08 120.40 114.88 1d3k s VAL 98 Ca 0.31 -2.02 0.02 0.00 -1.81 0.00 0.00 61.98 58.48 1d3k s VAL 98 Cb -0.16 -2.59 0.05 0.00 0.56 0.00 0.00 36.38 34.24 1d3k s VAL 98 CO 0.13 -0.13 -0.11 0.00 -0.31 0.00 0.00 175.10 174.68 1d3k s ALA 99 N -3.40 2.35 -0.10 1.32 0.00 -1.26 -2.55 121.76 118.12 1d3k s ALA 99 Ca 0.34 -1.55 -0.13 0.00 0.00 0.00 0.00 51.96 50.62 1d3k s ALA 99 Cb 0.07 -1.47 -0.05 0.00 0.00 0.00 0.00 23.12 21.67 1d3k s ALA 99 CO 0.13 -1.05 0.29 0.08 0.00 0.00 0.00 175.76 175.21 1d3k s VAL 100 N 1.22 5.27 0.22 0.00 1.01 -0.49 -1.39 120.40 126.23 1d3k s VAL 100 Ca -0.06 0.56 0.00 0.00 0.00 0.00 0.00 61.98 62.49 1d3k s VAL 100 Cb -0.19 -3.60 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 1d3k s VAL 100 CO -0.07 0.50 0.09 0.68 0.00 0.00 0.00 175.10 176.30 1d3k s VAL 101 N -0.33 0.35 0.23 2.92 -7.23 0.14 -1.39 120.40 115.10 1d3k s VAL 101 Ca 0.18 -1.99 -0.18 0.00 -1.81 0.00 0.00 61.98 58.18 1d3k s VAL 101 Cb -0.14 -2.48 -0.08 0.00 0.56 0.00 0.00 36.38 34.24 1d3k s VAL 101 CO 0.07 -0.10 0.70 -0.54 -0.31 0.00 0.00 175.10 174.92 1d3k s LYS 102 N -4.06 4.17 0.18 4.82 1.02 -1.26 -1.08 119.74 123.53 1d3k s LYS 102 Ca 0.35 0.78 -0.33 0.00 0.02 0.00 0.00 55.97 56.79 1d3k s LYS 102 Cb 0.07 -2.80 -0.13 0.00 -0.52 0.00 0.00 37.83 34.46 1d3k s LYS 102 CO 0.11 0.36 1.65 1.17 -0.92 0.00 0.00 175.35 177.72 1d3k n LYS 103 N 0.51 2.46 -1.95 1.68 4.81 0.96 -2.35 118.16 124.28 1d3k n LYS 103 Ca -0.01 0.89 -0.13 0.00 -0.87 0.00 0.00 58.31 58.18 1d3k n LYS 103 Cb 0.52 -2.70 -0.02 0.00 0.02 0.00 0.00 35.03 32.85 1d3k n LYS 103 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1d3k n ASP 104 N 3.69 -4.31 0.02 3.14 8.00 -1.26 -4.88 116.55 120.96 1d3k n ASP 104 Ca 0.16 0.11 0.13 0.00 0.71 0.00 0.00 54.79 55.90 1d3k n ASP 104 Cb 0.32 -3.32 0.54 0.00 -0.02 0.00 0.00 41.12 38.63 1d3k n ASP 104 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1d3k n SER 105 N -0.42 0.15 -2.22 -2.24 3.41 -0.99 -4.96 113.62 106.35 1d3k n SER 105 Ca -0.15 0.52 -0.11 0.00 -0.26 0.00 0.00 58.87 58.87 1d3k n SER 105 Cb 0.56 -0.56 0.05 0.00 -0.26 0.00 0.00 64.21 63.99 1d3k n SER 105 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1d3k n GLY 106 N 1.19 0.09 3.43 5.00 0.00 -1.26 -5.07 105.19 108.57 1d3k n GLY 106 Ca 0.06 -0.17 -0.15 0.00 0.00 0.00 0.00 46.02 45.76 1d3k n GLY 106 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1d3k s PHE 107 N -3.18 -0.53 0.39 1.61 -0.71 -1.26 -5.13 117.98 109.17 1d3k s PHE 107 Ca 0.18 1.07 0.05 0.00 -1.04 0.00 0.00 56.93 57.19 1d3k s PHE 107 Cb -0.08 0.26 0.05 0.00 -1.21 0.00 0.00 43.02 42.04 1d3k s PHE 107 CO 0.39 -0.44 0.42 1.04 -1.34 0.00 0.00 175.22 175.30 1d3k n GLN 108 N 1.72 0.83 0.19 1.99 1.13 -1.26 -4.97 117.38 117.00 1d3k n GLN 108 Ca -0.18 -2.28 0.08 0.00 -1.94 0.00 0.00 57.00 52.68 1d3k n GLN 108 Cb 0.56 0.04 0.60 0.00 0.11 0.00 0.00 30.24 31.56 1d3k n GLN 108 CO 0.00 0.00 0.00 1.98 -1.44 0.00 0.00 177.06 177.60 1d3k h MET 109 N 0.00 0.11 -0.23 -1.09 4.05 -1.89 -1.52 114.93 114.36 1d3k h MET 109 Ca -0.22 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.20 1d3k h MET 109 Cb 0.88 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.65 1d3k h MET 109 CO 0.32 0.07 0.00 0.27 0.23 0.00 0.00 176.91 177.81 1d3k n ASN 110 N -4.52 1.32 -1.19 1.39 6.94 -1.26 -3.56 115.26 114.38 1d3k n ASN 110 Ca -0.01 -1.94 0.01 0.00 -0.02 0.00 0.00 54.58 52.62 1d3k n ASN 110 Cb 0.11 -0.15 0.12 0.00 -2.36 0.00 0.00 39.78 37.50 1d3k n ASN 110 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1d3k n GLN 111 N 0.20 1.39 0.22 -3.83 6.02 -0.57 -4.79 117.38 116.01 1d3k n GLN 111 Ca 0.10 -3.05 0.11 0.00 -0.01 0.00 0.00 57.00 54.15 1d3k n GLN 111 Cb 0.22 -1.23 0.28 0.00 1.02 0.00 0.00 30.24 30.53 1d3k n GLN 111 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1d3k h LEU 112 N 1.26 0.00 -9.43 1.08 3.38 -1.64 -3.45 115.31 106.51 1d3k h LEU 112 Ca -0.03 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.34 1d3k h LEU 112 Cb 1.35 0.00 0.05 0.00 0.09 0.00 0.00 40.66 42.15 1d3k h LEU 112 CO 0.13 0.10 0.81 -1.14 0.09 0.00 0.00 178.44 178.44 1d3k n ARG 113 N -3.15 2.01 -0.22 1.13 0.63 -1.26 -1.52 116.66 114.28 1d3k n ARG 113 Ca 0.03 0.73 0.00 0.00 -0.92 0.00 0.00 57.85 57.68 1d3k n ARG 113 Cb 0.51 -2.49 0.00 0.00 0.45 0.00 0.00 32.46 30.93 1d3k n ARG 113 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1d3k n GLY 114 N 3.49 1.38 3.93 5.14 0.00 0.69 -4.99 105.19 114.84 1d3k n GLY 114 Ca 0.18 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 1d3k n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d3k s LYS 115 N -0.42 2.17 -0.12 1.61 -0.14 -0.57 -3.75 119.74 118.52 1d3k s LYS 115 Ca 0.00 -0.31 -0.06 0.00 -1.36 0.00 0.00 55.97 54.24 1d3k s LYS 115 Cb 0.00 -2.19 -0.04 0.00 -1.68 0.00 0.00 37.83 33.92 1d3k s LYS 115 CO 0.00 -1.24 0.10 0.15 -0.76 0.00 0.00 175.35 173.60 1d3k s LYS 116 N -5.23 3.37 0.03 1.68 1.02 -1.26 -1.03 119.74 118.32 1d3k s LYS 116 Ca 0.60 -0.21 0.09 0.00 0.02 0.00 0.00 55.97 56.47 1d3k s LYS 116 Cb -0.10 -3.10 -0.03 0.00 -0.52 0.00 0.00 37.83 34.08 1d3k s LYS 116 CO 0.44 0.72 -0.25 -1.54 -0.92 0.00 0.00 175.35 173.80 1d3k s SER 117 N -0.88 3.01 -0.23 2.83 1.04 -0.77 -0.70 113.70 118.01 1d3k s SER 117 Ca 0.14 -0.54 -0.02 0.00 0.48 0.00 0.00 55.95 56.01 1d3k s SER 117 Cb -0.12 -0.29 0.01 0.00 0.10 0.00 0.00 66.02 65.73 1d3k s SER 117 CO 0.03 0.26 -0.08 0.00 0.98 0.00 0.00 173.24 174.43 1d3k s HIS 119 N 1.37 2.74 0.24 0.00 3.76 -0.45 -1.69 115.29 121.26 1d3k s HIS 119 Ca 0.03 -0.15 -0.05 0.00 -0.15 0.00 0.00 55.06 54.74 1d3k s HIS 119 Cb -0.15 -1.47 0.26 0.00 1.11 0.00 0.00 32.58 32.32 1d3k s HIS 119 CO -0.06 0.39 1.78 1.79 -0.85 0.00 0.00 174.74 177.79 1d3k h THR 120 N 3.45 1.25 0.00 1.30 1.35 -1.73 -3.39 112.91 115.14 1d3k h THR 120 Ca -0.49 -0.89 0.00 0.00 -0.55 0.00 0.00 66.41 64.49 1d3k h THR 120 Cb 1.16 0.57 0.00 0.00 -1.73 0.00 0.00 68.15 68.15 1d3k h THR 120 CO 0.52 0.34 0.00 0.61 -0.25 0.00 0.00 175.52 176.74 1d3k n GLY 121 N -0.78 2.49 3.68 5.82 0.00 -1.26 -1.54 105.19 113.61 1d3k n GLY 121 Ca 0.05 -0.54 -0.45 0.00 0.00 0.00 0.00 46.02 45.08 1d3k n GLY 121 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1d3k n LEU 122 N 0.00 3.36 0.00 0.99 7.94 0.51 -2.54 117.00 127.26 1d3k n LEU 122 Ca 0.00 1.08 0.00 0.00 -1.11 0.00 0.00 56.01 55.98 1d3k n LEU 122 Cb 0.00 -1.47 0.00 0.00 0.53 0.00 0.00 43.42 42.48 1d3k n LEU 122 CO 0.00 -0.16 0.00 0.61 -1.11 0.00 0.00 177.39 176.73 1d3k n GLY 123 N 3.52 0.93 3.86 -3.96 0.00 -1.26 -5.00 105.19 103.28 1d3k n GLY 123 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 1d3k n GLY 123 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1d3k s ARG 124 N -0.04 3.88 0.00 1.61 0.52 -1.05 -3.83 118.95 120.04 1d3k s ARG 124 Ca 0.00 0.58 0.00 0.00 -0.52 0.00 0.00 55.73 55.79 1d3k s ARG 124 Cb 0.00 -2.39 0.00 0.00 0.52 0.00 0.00 34.95 33.08 1d3k s ARG 124 CO 0.00 0.03 0.94 0.43 0.02 0.00 0.00 175.30 176.72 1d3k n SER 125 N -0.93 0.00 -0.12 0.23 7.64 -1.26 -0.47 113.62 118.71 1d3k n SER 125 Ca 0.03 0.94 -0.13 0.00 1.01 0.00 0.00 58.87 60.73 1d3k n SER 125 Cb 0.54 -0.44 -0.02 0.00 -1.01 0.00 0.00 64.21 63.27 1d3k n SER 125 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1d3k h ALA 126 N -1.71 0.56 0.00 -0.43 0.00 -1.90 -0.23 119.26 115.54 1d3k h ALA 126 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1d3k h ALA 126 Cb 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1d3k h ALA 126 CO 0.00 0.60 0.00 0.78 0.00 0.00 0.00 179.25 180.63 1d3k h GLY 127 N 0.70 0.00 0.00 0.00 0.00 -1.66 -3.40 103.07 98.72 1d3k h GLY 127 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1d3k h GLY 127 CO 0.08 0.00 0.00 1.87 0.00 0.00 0.00 176.54 178.49 1d3k n TRP 128 N -2.63 -2.61 -0.15 5.60 -0.00 -0.44 -4.20 117.44 113.01 1d3k n TRP 128 Ca 0.04 0.57 -0.03 0.00 -0.00 0.00 0.00 57.50 58.09 1d3k n TRP 128 Cb 0.42 1.11 0.06 0.00 -0.00 0.00 0.00 31.31 32.90 1d3k n TRP 128 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 177.69 176.78 1d3k h ASN 129 N 0.00 -0.07 0.30 5.87 2.35 -0.64 -0.93 115.58 122.45 1d3k h ASN 129 Ca 0.00 0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 1d3k h ASN 129 Cb 0.00 0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.52 1d3k h ASN 129 CO 0.00 -0.00 -0.14 0.40 -1.65 0.00 0.00 177.43 176.03 1d3k h ILE 130 N 0.19 0.60 -0.63 2.81 1.08 -1.27 -1.85 117.51 118.44 1d3k h ILE 130 Ca 0.24 -0.77 -0.01 0.00 -0.39 0.00 0.00 64.86 63.92 1d3k h ILE 130 Cb 0.33 0.94 -0.03 0.00 -3.07 0.00 0.00 36.82 34.99 1d3k h ILE 130 CO -0.34 0.13 0.34 1.55 -0.69 0.00 0.00 178.15 179.14 1d3k h PRO 131 N -0.89 0.88 -0.18 2.37 0.13 -1.76 -1.95 132.00 130.60 1d3k h PRO 131 Ca -0.04 -0.10 -0.13 0.00 -0.87 0.00 0.00 66.00 64.85 1d3k h PRO 131 Cb 0.52 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.46 1d3k h PRO 131 CO 0.07 0.66 -0.45 0.82 -0.23 0.00 0.00 178.00 178.87 1d3k h ILE 132 N 0.85 1.32 -0.66 -3.56 1.08 -1.29 -2.34 117.51 112.91 1d3k h ILE 132 Ca 0.22 -1.65 -0.03 0.00 -0.39 0.00 0.00 64.86 63.01 1d3k h ILE 132 Cb 0.04 1.68 -0.03 0.00 -3.07 0.00 0.00 36.82 35.44 1d3k h ILE 132 CO -0.04 0.51 0.29 1.23 -0.69 0.00 0.00 178.15 179.45 1d3k h GLY 133 N 1.15 1.02 2.00 5.37 0.00 -1.05 -0.18 103.07 111.38 1d3k h GLY 133 Ca 0.02 -0.50 -0.09 0.00 0.00 0.00 0.00 47.33 46.76 1d3k h GLY 133 CO 0.08 0.48 -0.45 1.41 0.00 0.00 0.00 176.54 178.06 1d3k h LEU 134 N 0.94 0.00 -1.27 3.11 3.38 -1.09 -3.21 115.31 117.17 1d3k h LEU 134 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1d3k h LEU 134 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1d3k h LEU 134 CO -0.03 0.45 -0.28 0.18 0.09 0.00 0.00 178.44 178.86 1d3k n LEU 135 N -3.40 2.26 -0.33 1.67 4.77 -0.91 -4.66 117.00 116.41 1d3k n LEU 135 Ca 0.01 -0.79 0.20 0.00 -0.03 0.00 0.00 56.01 55.39 1d3k n LEU 135 Cb 0.61 -0.01 0.39 0.00 -2.33 0.00 0.00 43.42 42.08 1d3k n LEU 135 CO 0.39 0.40 0.91 0.22 -1.33 0.00 0.00 177.39 177.97 1d3k h TYR 136 N 3.11 0.30 0.00 -1.77 3.20 -1.04 0.24 116.97 121.01 1d3k h TYR 136 Ca 0.00 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1d3k h TYR 136 Cb 0.81 0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.11 1d3k h TYR 136 CO 0.00 -0.41 -0.27 0.00 -1.64 0.00 0.00 178.16 175.84 1d3k n ASP 138 N -1.79 0.54 -4.79 0.00 9.92 0.81 -4.82 116.55 116.42 1d3k n ASP 138 Ca 0.05 0.44 -0.34 0.00 -0.53 0.00 0.00 54.79 54.41 1d3k n ASP 138 Cb 0.38 -0.52 -0.01 0.00 -0.64 0.00 0.00 41.12 40.33 1d3k n ASP 138 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1d3k s LEU 139 N -3.94 3.76 0.38 0.64 1.43 -1.00 -5.01 118.68 114.94 1d3k s LEU 139 Ca 0.11 2.05 -0.17 0.00 -1.03 0.00 0.00 54.13 55.09 1d3k s LEU 139 Cb 0.15 -4.57 -0.09 0.00 0.03 0.00 0.00 46.19 41.71 1d3k s LEU 139 CO 0.60 -1.05 0.83 -2.16 0.23 0.00 0.00 176.35 174.79 1d3k s PRO 140 N -3.35 4.06 0.33 1.29 0.04 -1.26 -4.96 135.00 131.15 1d3k s PRO 140 Ca 0.70 0.83 -0.23 0.00 0.04 0.00 0.00 61.00 62.34 1d3k s PRO 140 Cb -0.20 -2.32 -0.10 0.00 0.04 0.00 0.00 34.50 31.92 1d3k s PRO 140 CO 0.25 0.05 0.88 -1.21 0.04 0.00 0.00 177.00 177.02 1d3k s GLU 141 N -3.18 4.38 0.11 4.56 2.02 -1.26 -3.67 118.70 121.66 1d3k s GLU 141 Ca 0.57 1.13 -0.30 0.00 0.02 0.00 0.00 54.97 56.39 1d3k s GLU 141 Cb -0.10 -2.63 -0.06 0.00 0.10 0.00 0.00 34.13 31.44 1d3k s GLU 141 CO 0.18 0.22 1.06 -1.25 0.02 0.00 0.00 175.26 175.49 1d3k s PRO 142 N -2.39 4.58 -0.01 0.39 0.04 -1.26 -5.09 135.00 131.27 1d3k s PRO 142 Ca 0.52 1.61 0.05 0.00 0.04 0.00 0.00 61.00 63.22 1d3k s PRO 142 Cb -0.15 -3.35 0.15 0.00 0.04 0.00 0.00 34.50 31.19 1d3k s PRO 142 CO 0.20 0.02 1.09 0.54 0.04 0.00 0.00 177.00 178.89 1d3k n ARG 143 N 3.04 1.44 -3.90 4.56 1.74 -1.24 -4.38 116.66 117.91 1d3k n ARG 143 Ca 0.04 -0.61 -0.22 0.00 -0.77 0.00 0.00 57.85 56.29 1d3k n ARG 143 Cb 0.48 -1.18 -0.17 0.00 -1.02 0.00 0.00 32.46 30.56 1d3k n ARG 143 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1d3k s LYS 144 N -1.74 0.68 0.53 5.56 2.20 -1.26 -2.74 119.74 122.98 1d3k s LYS 144 Ca 0.11 0.03 -0.18 0.00 -0.36 0.00 0.00 55.97 55.57 1d3k s LYS 144 Cb 0.06 -0.92 -0.06 0.00 -1.51 0.00 0.00 37.83 35.40 1d3k s LYS 144 CO 0.07 -0.22 1.06 -1.25 -0.36 0.00 0.00 175.35 174.65 1d3k s PRO 145 N 1.58 3.54 0.22 4.03 0.05 -1.26 -4.98 135.00 138.18 1d3k s PRO 145 Ca -0.01 1.35 -0.08 0.00 0.05 0.00 0.00 61.00 62.31 1d3k s PRO 145 Cb -0.13 -2.06 0.34 0.00 0.05 0.00 0.00 34.50 32.71 1d3k s PRO 145 CO -0.04 -0.65 1.72 1.25 0.05 0.00 0.00 177.00 179.34 1d3k h LEU 146 N 1.09 0.15 -0.99 -3.56 5.85 -1.88 -1.42 115.31 114.55 1d3k h LEU 146 Ca -0.49 0.10 0.18 0.00 0.84 0.00 0.00 57.88 58.51 1d3k h LEU 146 Cb 1.23 0.11 -0.10 0.00 0.37 0.00 0.00 40.66 42.26 1d3k h LEU 146 CO 0.58 0.07 0.60 -0.33 -0.34 0.00 0.00 178.44 179.03 1d3k h GLU 147 N 0.36 0.77 -0.06 1.25 3.07 -1.98 -0.73 114.58 117.26 1d3k h GLU 147 Ca 0.34 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 59.15 1d3k h GLU 147 Cb 0.49 -0.17 -0.00 0.00 -0.84 0.00 0.00 28.75 28.23 1d3k h GLU 147 CO -0.38 0.51 -0.01 -0.22 -1.40 0.00 0.00 179.01 177.51 1d3k h LYS 148 N 0.79 0.11 -0.36 2.33 3.11 -1.64 -1.97 116.57 118.94 1d3k h LYS 148 Ca 0.56 -0.04 -0.05 0.00 -2.81 0.00 0.00 60.65 58.31 1d3k h LYS 148 Cb 0.81 -0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 32.02 1d3k h LYS 148 CO -0.36 0.43 0.02 0.00 -2.81 0.00 0.00 179.45 176.73 1d3k h ALA 149 N 0.68 1.37 -0.36 5.00 0.00 -1.12 -1.97 119.26 122.85 1d3k h ALA 149 Ca 0.02 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 1d3k h ALA 149 Cb 0.39 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1d3k h ALA 149 CO 0.00 0.44 -0.17 0.28 0.00 0.00 0.00 179.25 179.81 1d3k h VAL 150 N 0.53 1.28 0.00 0.00 2.07 -1.11 -1.82 116.25 117.20 1d3k h VAL 150 Ca 0.12 -1.28 -0.02 0.00 0.82 0.00 0.00 66.70 66.34 1d3k h VAL 150 Cb 0.31 1.34 -0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1d3k h VAL 150 CO 0.01 0.42 -0.07 0.00 0.02 0.00 0.00 177.57 177.95 1d3k h ALA 151 N 0.80 1.79 0.00 1.67 0.00 -0.91 -2.10 119.26 120.51 1d3k h ALA 151 Ca 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1d3k h ALA 151 Cb 0.71 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1d3k h ALA 151 CO 0.05 0.09 -0.84 -0.91 0.00 0.00 0.00 179.25 177.65 1d3k h ASN 152 N 0.00 0.00 0.01 0.00 2.35 -1.09 -3.37 115.58 113.48 1d3k h ASN 152 Ca -0.00 -0.08 -0.02 0.00 -0.55 0.00 0.00 56.30 55.65 1d3k h ASN 152 Cb 0.14 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.51 1d3k h ASN 152 CO 0.01 0.04 -0.07 0.15 -1.65 0.00 0.00 177.43 175.91 1d3k h PHE 153 N 0.00 0.05 -3.38 1.19 3.57 -0.68 -3.46 116.94 114.23 1d3k h PHE 153 Ca 0.00 -0.03 -0.47 0.00 3.53 0.00 0.00 57.97 60.99 1d3k h PHE 153 Cb 0.91 -0.00 0.04 0.00 2.79 0.00 0.00 35.95 39.69 1d3k h PHE 153 CO 0.00 0.97 0.08 -0.06 -2.23 0.00 0.00 178.31 177.07 1d3k s PHE 154 N -2.48 3.32 -0.57 0.41 0.08 -0.93 -0.22 117.98 117.59 1d3k s PHE 154 Ca -0.18 0.57 0.01 0.00 0.12 0.00 0.00 56.93 57.44 1d3k s PHE 154 Cb -0.02 -2.51 0.48 0.00 -0.57 0.00 0.00 43.02 40.39 1d3k s PHE 154 CO 0.70 -0.56 1.86 -1.13 -0.10 0.00 0.00 175.22 175.99 1d3k n SER 155 N -2.36 6.64 0.00 1.36 3.41 -0.20 -4.72 113.62 117.74 1d3k n SER 155 Ca 0.03 -3.77 0.00 0.00 -0.26 0.00 0.00 58.87 54.87 1d3k n SER 155 Cb 0.57 -0.84 0.00 0.00 -0.26 0.00 0.00 64.21 63.68 1d3k n SER 155 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1d3k n GLY 156 N -0.92 4.25 3.52 5.00 0.00 -1.26 -4.82 105.19 110.96 1d3k n GLY 156 Ca 0.58 -1.26 -0.13 0.00 0.00 0.00 0.00 46.02 45.22 1d3k n GLY 156 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1d3k s SER 157 N 0.00 0.63 -0.23 1.61 0.01 -0.07 -1.84 113.70 113.81 1d3k s SER 157 Ca 0.00 -1.35 -0.01 0.00 1.31 0.00 0.00 55.95 55.90 1d3k s SER 157 Cb 0.00 0.66 0.06 0.00 0.21 0.00 0.00 66.02 66.95 1d3k s SER 157 CO 0.00 -1.29 -0.00 0.00 0.41 0.00 0.00 173.24 172.36 1d3k s ALA 159 N 1.58 2.92 0.45 0.00 0.00 0.41 -1.34 121.76 125.78 1d3k s ALA 159 Ca -0.02 -3.14 -0.23 0.00 0.00 0.00 0.00 51.96 48.57 1d3k s ALA 159 Cb -0.18 -2.03 -0.10 0.00 0.00 0.00 0.00 23.12 20.81 1d3k s ALA 159 CO -0.09 -2.05 0.95 -2.30 0.00 0.00 0.00 175.76 172.27 1d3k n PRO 160 N 2.94 1.20 -0.43 0.00 -0.02 -1.26 -1.80 135.00 135.63 1d3k n PRO 160 Ca 0.12 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1d3k n PRO 160 Cb 0.35 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 1d3k n PRO 160 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1d3k s ALA 162 N -3.41 2.36 -0.69 0.00 0.00 -0.74 -4.91 121.76 114.36 1d3k s ALA 162 Ca 0.00 -0.22 -0.22 0.00 0.00 0.00 0.00 51.96 51.53 1d3k s ALA 162 Cb 0.00 -3.10 0.08 0.00 0.00 0.00 0.00 23.12 20.11 1d3k s ALA 162 CO 0.00 -1.62 0.95 0.34 0.00 0.00 0.00 175.76 175.43 1d3k s ASP 163 N -3.97 6.24 0.60 0.00 -1.08 -1.26 -4.79 116.67 112.40 1d3k s ASP 163 Ca 0.60 -1.20 0.33 0.00 -0.52 0.00 0.00 52.55 51.76 1d3k s ASP 163 Cb -0.14 -2.40 1.90 0.00 -1.46 0.00 0.00 42.92 40.82 1d3k s ASP 163 CO 0.54 -1.35 2.25 1.23 0.52 0.00 0.00 175.17 178.37 1d3k h GLY 164 N 11.04 0.00 0.83 2.66 0.00 -1.82 -0.66 103.07 115.12 1d3k h GLY 164 Ca -0.23 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.02 1d3k h GLY 164 CO 1.16 0.00 -0.19 -0.84 0.00 0.00 0.00 176.54 176.68 1d3k h THR 165 N 0.00 1.32 0.00 4.70 2.02 -1.96 -2.31 112.91 116.68 1d3k h THR 165 Ca -0.00 -1.33 -0.23 0.00 0.77 0.00 0.00 66.41 65.61 1d3k h THR 165 Cb 0.06 1.73 -0.04 0.00 -1.74 0.00 0.00 68.15 68.16 1d3k h THR 165 CO 0.00 0.41 -1.21 0.44 0.37 0.00 0.00 175.52 175.53 1d3k h ASP 166 N 0.17 0.00 -2.24 4.18 5.19 -1.91 -3.40 116.42 118.42 1d3k h ASP 166 Ca 0.04 0.00 -0.58 0.00 -0.62 0.00 0.00 57.03 55.86 1d3k h ASP 166 Cb 0.72 0.00 -0.39 0.00 0.18 0.00 0.00 39.33 39.84 1d3k h ASP 166 CO 0.05 0.99 -0.94 0.49 -3.12 0.00 0.00 179.24 176.71 1d3k n PHE 167 N -3.25 0.47 -0.15 4.55 3.72 -0.29 -4.99 117.46 117.52 1d3k n PHE 167 Ca -0.05 -3.66 0.17 0.00 -0.05 0.00 0.00 57.45 53.86 1d3k n PHE 167 Cb 0.97 -0.23 0.54 0.00 -0.94 0.00 0.00 39.48 39.82 1d3k n PHE 167 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1d3k h PRO 168 N 4.63 0.33 0.00 -1.08 0.13 -1.63 -1.93 132.00 132.44 1d3k h PRO 168 Ca 0.16 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 65.24 1d3k h PRO 168 Cb 0.84 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 31.89 1d3k h PRO 168 CO 0.52 0.22 -0.12 1.96 -0.23 0.00 0.00 178.00 180.34 1d3k h GLN 169 N 0.34 0.00 0.00 0.86 7.50 -1.92 -2.09 115.11 119.79 1d3k h GLN 169 Ca 0.37 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.52 1d3k h GLN 169 Cb 0.96 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.49 1d3k h GLN 169 CO -0.11 0.12 0.00 1.28 -1.50 0.00 0.00 178.83 178.63 1d3k n LEU 170 N -3.92 0.00 -0.00 1.46 4.77 -0.72 -0.89 117.00 117.69 1d3k n LEU 170 Ca -0.02 0.42 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 1d3k n LEU 170 Cb 0.22 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1d3k n LEU 170 CO 0.32 -0.10 0.48 0.00 -1.33 0.00 0.00 177.39 176.77 1d3k h GLN 172 N 0.00 0.91 0.00 0.00 4.15 -1.13 -0.77 115.11 118.27 1d3k h GLN 172 Ca 0.00 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1d3k h GLN 172 Cb 0.55 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 28.03 1d3k h GLN 172 CO 0.00 0.60 -0.41 1.28 -1.93 0.00 0.00 178.83 178.37 1d3k n LEU 173 N -4.59 0.51 -3.00 -2.39 4.32 -0.49 -4.47 117.00 106.87 1d3k n LEU 173 Ca 0.18 0.22 -0.14 0.00 -0.02 0.00 0.00 56.01 56.26 1d3k n LEU 173 Cb 0.37 -0.28 -0.03 0.00 -1.62 0.00 0.00 43.42 41.86 1d3k n LEU 173 CO 0.28 0.01 -0.05 0.00 -1.22 0.00 0.00 177.39 176.41 1d3k n PRO 175 N 2.67 0.19 0.00 0.00 -0.02 -0.40 -1.12 135.00 136.31 1d3k n PRO 175 Ca 0.21 0.07 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1d3k n PRO 175 Cb 0.54 -1.59 0.00 0.00 -0.02 0.00 0.00 33.50 32.42 1d3k n PRO 175 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1d3k n GLY 176 N 2.56 2.80 3.60 -1.23 0.00 -1.26 -4.57 105.19 107.09 1d3k n GLY 176 Ca 0.24 -0.05 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 1d3k n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d3k n GLY 178 N -1.53 0.72 2.64 0.00 0.00 -1.26 -1.01 105.19 104.75 1d3k n GLY 178 Ca -0.17 0.51 -0.36 0.00 0.00 0.00 0.00 46.02 46.00 1d3k n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d3k s SER 180 N -1.15 -0.05 0.00 0.00 1.04 -1.26 -4.47 113.70 107.80 1d3k s SER 180 Ca 0.56 -0.64 0.07 0.00 0.48 0.00 0.00 55.95 56.42 1d3k s SER 180 Cb 0.45 0.54 0.35 0.00 0.10 0.00 0.00 66.02 67.46 1d3k s SER 180 CO -0.25 -1.04 1.12 0.35 0.98 0.00 0.00 173.24 174.40 1d3k n THR 181 N -0.61 1.01 0.26 2.02 -2.24 -1.26 -1.37 114.28 112.08 1d3k n THR 181 Ca -0.05 0.25 0.14 0.00 -2.27 0.00 0.00 64.05 62.12 1d3k n THR 181 Cb 0.60 -1.13 0.67 0.00 -2.10 0.00 0.00 70.33 68.37 1d3k n THR 181 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1d3k h LEU 182 N 0.00 0.00 -8.88 3.22 3.38 -1.94 -3.37 115.31 107.72 1d3k h LEU 182 Ca 0.00 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.35 1d3k h LEU 182 Cb 0.08 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 40.70 1d3k h LEU 182 CO 0.00 0.12 0.11 0.21 0.09 0.00 0.00 178.44 178.97 1d3k s ASN 183 N -5.99 6.47 0.31 -0.43 2.47 -0.47 -4.94 114.94 112.35 1d3k s ASN 183 Ca -0.01 0.39 0.24 0.00 0.42 0.00 0.00 52.86 53.90 1d3k s ASN 183 Cb 0.11 -2.32 1.11 0.00 -1.45 0.00 0.00 41.25 38.70 1d3k s ASN 183 CO 0.58 -0.46 1.73 0.06 -3.72 0.00 0.00 177.10 175.28 1d3k h GLN 184 N 8.20 0.00 -0.48 0.43 3.07 -1.85 -1.87 115.11 122.61 1d3k h GLN 184 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.47 1d3k h GLN 184 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.68 1d3k h GLN 184 CO 0.79 0.00 0.00 0.66 0.09 0.00 0.00 178.83 180.37 1d3k n TYR 185 N -2.31 1.44 -3.08 0.06 4.01 -1.26 -4.32 117.16 111.69 1d3k n TYR 185 Ca 0.01 -0.73 -0.36 0.00 -0.16 0.00 0.00 57.90 56.65 1d3k n TYR 185 Cb 0.16 -0.34 -0.06 0.00 -0.31 0.00 0.00 39.34 38.78 1d3k n TYR 185 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 1d3k s PHE 186 N -2.41 3.67 0.00 -0.72 5.36 -0.71 -3.19 117.98 119.98 1d3k s PHE 186 Ca 0.47 1.42 0.00 0.00 -0.96 0.00 0.00 56.93 57.86 1d3k s PHE 186 Cb 0.35 -2.64 0.00 0.00 -0.34 0.00 0.00 43.02 40.39 1d3k s PHE 186 CO 0.16 0.35 0.00 0.41 -1.46 0.00 0.00 175.22 174.68 1d3k n GLY 187 N 0.79 -1.95 0.14 13.12 0.00 -0.59 -2.30 105.19 114.40 1d3k n GLY 187 Ca -0.02 -1.43 -0.13 0.00 0.00 0.00 0.00 46.02 44.44 1d3k n GLY 187 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1d3k h TYR 188 N 0.00 -0.23 0.00 1.61 0.05 -1.93 -0.98 116.97 115.50 1d3k h TYR 188 Ca 0.00 -0.01 -0.09 0.00 0.05 0.00 0.00 58.73 58.68 1d3k h TYR 188 Cb 0.00 0.07 -0.01 0.00 1.01 0.00 0.00 36.73 37.80 1d3k h TYR 188 CO 0.00 0.14 -0.44 0.77 -1.05 0.00 0.00 178.16 177.58 1d3k h SER 189 N -0.65 0.00 -0.27 3.88 0.02 -1.94 -2.00 113.55 112.59 1d3k h SER 189 Ca -0.02 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.79 1d3k h SER 189 Cb 0.47 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.01 1d3k h SER 189 CO 0.04 0.44 -0.36 1.23 -1.14 0.00 0.00 176.83 177.04 1d3k h GLY 190 N 1.33 0.79 1.60 -3.77 0.00 -1.47 -1.20 103.07 100.37 1d3k h GLY 190 Ca -0.00 -0.86 -0.06 0.00 0.00 0.00 0.00 47.33 46.41 1d3k h GLY 190 CO 0.06 0.77 -0.06 0.00 0.00 0.00 0.00 176.54 177.31 1d3k h ALA 191 N 0.68 1.33 -0.36 3.60 0.00 -0.96 -1.25 119.26 122.31 1d3k h ALA 191 Ca 0.03 -0.23 -0.17 0.00 0.00 0.00 0.00 54.91 54.54 1d3k h ALA 191 Cb 0.94 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1d3k h ALA 191 CO 0.08 0.45 -0.44 0.35 0.00 0.00 0.00 179.25 179.70 1d3k h PHE 192 N 0.46 1.12 -0.85 0.00 3.57 -1.23 -3.01 116.94 117.00 1d3k h PHE 192 Ca 0.09 -0.35 -0.01 0.00 3.53 0.00 0.00 57.97 61.23 1d3k h PHE 192 Cb 0.40 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 38.87 1d3k h PHE 192 CO 0.01 1.19 0.49 -0.22 -2.23 0.00 0.00 178.31 177.55 1d3k h LYS 193 N 0.74 1.16 -0.84 1.11 3.64 -0.59 -0.25 116.57 121.54 1d3k h LYS 193 Ca 0.05 -0.11 0.07 0.00 -1.27 0.00 0.00 60.65 59.39 1d3k h LYS 193 Cb 1.03 -0.24 -0.06 0.00 -0.41 0.00 0.00 32.23 32.56 1d3k h LYS 193 CO 0.10 0.83 0.55 0.00 -2.27 0.00 0.00 179.45 178.66 1d3k h LEU 195 N 0.90 -0.00 -0.63 0.00 5.85 -1.24 -2.02 115.31 118.17 1d3k h LEU 195 Ca 0.37 -0.82 0.09 0.00 0.84 0.00 0.00 57.88 58.36 1d3k h LEU 195 Cb 0.28 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.24 1d3k h LEU 195 CO -0.14 0.83 0.26 0.50 -0.34 0.00 0.00 178.44 179.54 1d3k h LYS 196 N -0.84 0.44 0.00 1.25 3.64 -0.80 -1.63 116.57 118.63 1d3k h LYS 196 Ca -0.00 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1d3k h LYS 196 Cb 0.82 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.54 1d3k h LYS 196 CO 0.00 0.29 -0.02 -0.44 -2.27 0.00 0.00 179.45 177.02 1d3k h ASP 197 N 0.46 0.00 0.00 4.20 3.32 -1.07 -3.47 116.42 119.86 1d3k h ASP 197 Ca 0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.36 1d3k h ASP 197 Cb 0.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.92 1d3k h ASP 197 CO -0.29 0.02 0.00 0.61 -1.72 0.00 0.00 179.24 177.86 1d3k n GLY 198 N -0.35 0.90 0.18 2.75 0.00 -0.61 -4.98 105.19 103.08 1d3k n GLY 198 Ca -0.01 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 1d3k n GLY 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d3k h ALA 199 N 0.00 0.10 -1.88 4.61 0.00 -1.60 -3.47 119.26 117.02 1d3k h ALA 199 Ca 0.00 -0.66 -0.60 0.00 0.00 0.00 0.00 54.91 53.65 1d3k h ALA 199 Cb 0.00 0.06 -0.12 0.00 0.00 0.00 0.00 17.79 17.73 1d3k h ALA 199 CO 0.00 0.58 -0.63 0.20 0.00 0.00 0.00 179.25 179.40 1d3k s GLY 200 N -4.24 2.17 -0.03 0.00 0.00 -0.84 -4.90 107.32 99.48 1d3k s GLY 200 Ca -0.11 -2.05 0.21 0.00 0.00 0.00 0.00 44.72 42.77 1d3k s GLY 200 CO 0.89 -1.97 0.49 1.22 0.00 0.00 0.00 173.10 173.73 1d3k n ASP 201 N -0.92 0.12 -3.82 1.64 8.00 0.12 -4.55 116.55 117.14 1d3k n ASP 201 Ca -0.04 0.05 -0.12 0.00 0.71 0.00 0.00 54.79 55.38 1d3k n ASP 201 Cb 0.63 1.61 -0.11 0.00 -0.02 0.00 0.00 41.12 43.23 1d3k n ASP 201 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1d3k s VAL 202 N -3.32 0.03 -0.10 2.53 0.11 -1.13 -4.38 120.40 114.14 1d3k s VAL 202 Ca -0.07 -0.28 0.02 0.00 -2.93 0.00 0.00 61.98 58.71 1d3k s VAL 202 Cb 0.12 -0.39 0.01 0.00 -1.53 0.00 0.00 36.38 34.60 1d3k s VAL 202 CO 0.88 -0.15 -0.15 0.00 -3.33 0.00 0.00 175.10 172.35 1d3k s ALA 203 N -0.55 1.65 -0.57 1.54 0.00 -0.49 -1.17 121.76 122.17 1d3k s ALA 203 Ca -0.06 -0.70 -0.18 0.00 0.00 0.00 0.00 51.96 51.01 1d3k s ALA 203 Cb -0.04 -0.81 0.11 0.00 0.00 0.00 0.00 23.12 22.38 1d3k s ALA 203 CO 0.01 -0.06 0.64 -0.06 0.00 0.00 0.00 175.76 176.29 1d3k s PHE 204 N 0.96 3.07 0.00 0.00 0.08 -0.68 -1.40 117.98 120.01 1d3k s PHE 204 Ca -0.07 -1.05 0.00 0.00 0.12 0.00 0.00 56.93 55.93 1d3k s PHE 204 Cb -0.15 -3.94 0.00 0.00 -0.57 0.00 0.00 43.02 38.36 1d3k s PHE 204 CO -0.01 -1.21 0.00 1.33 -0.10 0.00 0.00 175.22 175.23 1d3k n VAL 205 N 5.46 0.00 -3.33 -0.44 0.24 -1.06 -3.53 118.33 115.67 1d3k n VAL 205 Ca -0.11 0.00 -0.19 0.00 -2.04 0.00 0.00 64.34 62.00 1d3k n VAL 205 Cb 0.42 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.78 1d3k n VAL 205 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1d3k s GLN 206 N 0.07 2.77 0.43 7.34 -2.07 -1.26 -1.29 119.66 125.65 1d3k s GLN 206 Ca 0.00 -1.30 0.11 0.00 -1.82 0.00 0.00 55.36 52.35 1d3k s GLN 206 Cb 0.00 -2.62 0.98 0.00 -1.09 0.00 0.00 33.01 30.28 1d3k s GLN 206 CO 0.00 -0.16 2.04 1.12 -1.32 0.00 0.00 175.29 176.97 1d3k h HIS 207 N 0.86 0.41 0.00 9.60 2.07 -1.59 -2.59 115.15 123.92 1d3k h HIS 207 Ca -0.42 0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.11 1d3k h HIS 207 Cb 1.27 -0.14 0.00 0.00 2.57 0.00 0.00 27.41 31.11 1d3k h HIS 207 CO 0.45 0.24 -0.36 -1.13 -3.07 0.00 0.00 177.93 174.05 1d3k n SER 208 N -4.48 0.42 -0.14 3.10 3.41 -1.26 -4.40 113.62 110.27 1d3k n SER 208 Ca 0.05 0.06 -0.04 0.00 -0.26 0.00 0.00 58.87 58.68 1d3k n SER 208 Cb 0.19 -0.02 0.03 0.00 -0.26 0.00 0.00 64.21 64.15 1d3k n SER 208 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1d3k h THR 209 N 0.00 0.56 -0.22 6.66 2.02 -1.86 -1.10 112.91 118.97 1d3k h THR 209 Ca 0.00 -0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.12 1d3k h THR 209 Cb 0.56 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 1d3k h THR 209 CO 0.00 0.00 -0.10 -0.29 0.37 0.00 0.00 175.52 175.50 1d3k h ILE 210 N 0.01 1.20 0.00 3.11 2.10 -1.79 -1.99 117.51 120.14 1d3k h ILE 210 Ca 0.22 -0.84 -0.04 0.00 1.08 0.00 0.00 64.86 65.27 1d3k h ILE 210 Cb 0.33 1.15 -0.01 0.00 -1.09 0.00 0.00 36.82 37.20 1d3k h ILE 210 CO -0.45 0.27 -0.19 -0.26 -1.08 0.00 0.00 178.15 176.43 1d3k h PHE 211 N 0.33 0.00 0.00 2.19 0.04 -1.55 0.18 116.94 118.13 1d3k h PHE 211 Ca 0.07 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.84 1d3k h PHE 211 Cb 0.40 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.55 1d3k h PHE 211 CO 0.01 0.19 -0.31 0.39 -0.60 0.00 0.00 178.31 177.99 1d3k n GLU 212 N -3.27 0.18 -0.02 1.51 1.02 -0.52 -4.20 120.64 115.34 1d3k n GLU 212 Ca 0.01 0.09 -0.00 0.00 -0.02 0.00 0.00 57.16 57.24 1d3k n GLU 212 Cb 0.46 -1.65 -0.04 0.00 -0.02 0.00 0.00 31.44 30.19 1d3k n GLU 212 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1d3k n ASN 213 N -1.93 3.69 -4.04 1.62 3.02 -0.95 -4.95 115.26 111.72 1d3k n ASN 213 Ca 0.05 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.28 1d3k n ASN 213 Cb 0.40 0.88 -0.15 0.00 -0.61 0.00 0.00 39.78 40.29 1d3k n ASN 213 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1d3k s LEU 214 N -4.01 3.28 0.31 3.41 1.43 0.60 -5.01 118.68 118.69 1d3k s LEU 214 Ca -0.02 -1.37 0.16 0.00 -1.03 0.00 0.00 54.13 51.86 1d3k s LEU 214 Cb 0.02 -1.47 0.36 0.00 0.03 0.00 0.00 46.19 45.14 1d3k s LEU 214 CO 0.23 -0.21 1.58 0.00 0.23 0.00 0.00 176.35 178.18 1d3k h ALA 215 N 7.81 0.82 -3.03 4.21 0.00 -1.85 -3.42 119.26 123.80 1d3k h ALA 215 Ca -0.18 -0.46 -0.60 0.00 0.00 0.00 0.00 54.91 53.67 1d3k h ALA 215 Cb 1.05 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 18.66 1d3k h ALA 215 CO 0.45 0.63 -0.33 -0.80 0.00 0.00 0.00 179.25 179.20 1d3k s ASN 216 N -6.51 6.46 0.54 0.00 0.01 -1.26 -4.96 114.94 109.22 1d3k s ASN 216 Ca 0.01 0.54 0.20 0.00 -0.71 0.00 0.00 52.86 52.90 1d3k s ASN 216 Cb 0.10 -2.18 1.41 0.00 0.41 0.00 0.00 41.25 40.99 1d3k s ASN 216 CO 0.73 0.15 2.17 0.50 -1.51 0.00 0.00 177.10 179.14 1d3k h LYS 217 N 6.34 0.00 -0.33 -0.60 3.11 -1.99 -1.11 116.57 121.99 1d3k h LYS 217 Ca -0.43 0.00 -0.08 0.00 -2.81 0.00 0.00 60.65 57.33 1d3k h LYS 217 Cb 1.17 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 32.39 1d3k h LYS 217 CO 0.73 0.00 -0.12 0.00 -2.81 0.00 0.00 179.45 177.25 1d3k h ALA 218 N 1.99 1.18 0.05 5.00 0.00 -1.98 0.74 119.26 126.25 1d3k h ALA 218 Ca 0.00 -0.28 -0.24 0.00 0.00 0.00 0.00 54.91 54.39 1d3k h ALA 218 Cb 0.02 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1d3k h ALA 218 CO -0.00 0.52 -1.05 -0.44 0.00 0.00 0.00 179.25 178.28 1d3k h ASP 219 N 0.52 0.42 0.73 0.00 3.32 -1.62 -3.24 116.42 116.55 1d3k h ASP 219 Ca 0.09 -0.39 -0.12 0.00 0.02 0.00 0.00 57.03 56.64 1d3k h ASP 219 Cb 0.52 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 1d3k h ASP 219 CO 0.03 1.23 -0.57 0.03 -1.72 0.00 0.00 179.24 178.24 1d3k h ARG 220 N 0.14 0.00 0.00 3.56 3.08 -1.21 -2.74 114.38 117.21 1d3k h ARG 220 Ca -0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1d3k h ARG 220 Cb 1.73 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.78 1d3k h ARG 220 CO 0.17 0.57 0.00 -0.25 -1.07 0.00 0.00 179.97 179.40 1d3k n ASP 221 N -3.68 0.00 -0.37 7.04 8.00 0.23 -0.65 116.55 127.12 1d3k n ASP 221 Ca -0.01 0.31 0.14 0.00 0.71 0.00 0.00 54.79 55.94 1d3k n ASP 221 Cb 0.61 -0.37 0.50 0.00 -0.02 0.00 0.00 41.12 41.84 1d3k n ASP 221 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1d3k n GLN 222 N -1.37 1.32 -4.43 -1.24 1.13 -1.03 -4.89 117.38 106.86 1d3k n GLN 222 Ca 0.03 -0.73 -0.23 0.00 -1.94 0.00 0.00 57.00 54.13 1d3k n GLN 222 Cb 0.07 -1.48 -0.10 0.00 0.11 0.00 0.00 30.24 28.83 1d3k n GLN 222 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 1d3k s TYR 223 N -2.19 2.13 0.23 1.08 1.51 0.17 -0.03 117.35 120.26 1d3k s TYR 223 Ca 0.33 -0.40 -0.03 0.00 -1.01 0.00 0.00 57.07 55.97 1d3k s TYR 223 Cb 0.20 -0.95 -0.03 0.00 -0.11 0.00 0.00 41.96 41.08 1d3k s TYR 223 CO 0.40 0.60 0.24 -1.21 -1.11 0.00 0.00 175.55 174.48 1d3k s GLU 224 N -3.46 1.35 0.06 -0.62 2.02 -0.24 -4.35 118.70 113.46 1d3k s GLU 224 Ca 0.27 -1.57 0.07 0.00 0.02 0.00 0.00 54.97 53.76 1d3k s GLU 224 Cb -0.04 0.33 -0.04 0.00 0.10 0.00 0.00 34.13 34.48 1d3k s GLU 224 CO 0.12 -0.49 -0.15 -0.51 0.02 0.00 0.00 175.26 174.26 1d3k s LEU 225 N -3.14 2.80 -0.21 1.80 1.43 0.18 -0.68 118.68 120.86 1d3k s LEU 225 Ca 0.35 -0.39 -0.16 0.00 -1.03 0.00 0.00 54.13 52.89 1d3k s LEU 225 Cb 0.05 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.59 1d3k s LEU 225 CO 0.13 0.23 0.42 -0.76 0.23 0.00 0.00 176.35 176.60 1d3k s LEU 226 N -1.71 4.14 0.23 1.79 1.43 -0.49 -2.16 118.68 121.92 1d3k s LEU 226 Ca 0.17 0.53 0.02 0.00 -1.03 0.00 0.00 54.13 53.82 1d3k s LEU 226 Cb -0.11 -2.55 -0.04 0.00 0.03 0.00 0.00 46.19 43.53 1d3k s LEU 226 CO 0.08 -0.11 0.39 0.00 0.23 0.00 0.00 176.35 176.93 1d3k n LEU 228 N -1.07 0.27 -2.02 0.00 4.77 -1.26 -2.19 117.00 115.51 1d3k n LEU 228 Ca -0.07 0.58 -0.18 0.00 -0.03 0.00 0.00 56.01 56.31 1d3k n LEU 228 Cb 0.55 -0.55 0.17 0.00 -2.33 0.00 0.00 43.42 41.26 1d3k n LEU 228 CO 0.47 -0.44 1.14 -0.90 -1.33 0.00 0.00 177.39 176.34 1d3k n ASP 229 N -1.81 3.77 -4.01 -1.43 5.68 -1.26 -4.88 116.55 112.60 1d3k n ASP 229 Ca 0.02 -3.32 -0.30 0.00 -0.50 0.00 0.00 54.79 50.70 1d3k n ASP 229 Cb 0.16 -0.78 -0.01 0.00 -1.14 0.00 0.00 41.12 39.36 1d3k n ASP 229 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1d3k n ASN 230 N -0.77 -2.45 -4.12 -1.12 3.02 -0.93 -4.97 115.26 103.91 1d3k n ASN 230 Ca 0.49 -0.94 -0.20 0.00 -0.03 0.00 0.00 54.58 53.90 1d3k n ASN 230 Cb 1.47 -3.25 -0.09 0.00 -0.61 0.00 0.00 39.78 37.29 1d3k n ASN 230 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1d3k s THR 231 N -3.55 0.53 0.04 3.41 -4.23 -1.25 -4.85 115.64 105.75 1d3k s THR 231 Ca 0.40 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.99 1d3k s THR 231 Cb -0.21 -2.54 -0.03 0.00 1.34 0.00 0.00 72.50 71.07 1d3k s THR 231 CO 0.88 0.00 -0.21 -0.13 -0.54 0.00 0.00 174.62 174.62 1d3k s ARG 232 N -3.83 1.44 0.09 3.99 0.52 -1.26 -0.92 118.95 118.97 1d3k s ARG 232 Ca 0.34 -0.95 0.02 0.00 -0.52 0.00 0.00 55.73 54.62 1d3k s ARG 232 Cb 0.05 -1.55 -0.04 0.00 0.52 0.00 0.00 34.95 33.94 1d3k s ARG 232 CO 0.16 0.40 -0.07 0.15 0.02 0.00 0.00 175.30 175.96 1d3k s LYS 233 N -1.16 0.79 1.06 3.54 1.02 -0.92 -4.95 119.74 119.12 1d3k s LYS 233 Ca 0.08 -1.23 -0.12 0.00 0.02 0.00 0.00 55.97 54.72 1d3k s LYS 233 Cb -0.09 -0.25 0.23 0.00 -0.52 0.00 0.00 37.83 37.20 1d3k s LYS 233 CO 0.02 0.00 1.07 -2.14 -0.92 0.00 0.00 175.35 173.38 1d3k s PRO 234 N -3.38 -0.11 0.38 -1.68 0.02 -1.26 -0.65 135.00 128.33 1d3k s PRO 234 Ca 0.08 1.04 0.28 0.00 0.02 0.00 0.00 61.00 62.42 1d3k s PRO 234 Cb 0.02 -1.63 1.22 0.00 0.02 0.00 0.00 34.50 34.12 1d3k s PRO 234 CO -0.03 -3.24 1.84 -0.39 -0.33 0.00 0.00 177.00 174.85 1d3k h VAL 235 N -2.28 0.00 0.00 3.83 -1.51 -1.88 -2.57 116.25 111.84 1d3k h VAL 235 Ca -0.55 -0.28 0.00 0.00 -1.23 0.00 0.00 66.70 64.64 1d3k h VAL 235 Cb 1.31 1.09 0.00 0.00 -2.13 0.00 0.00 31.29 31.56 1d3k h VAL 235 CO 0.48 0.00 -0.12 0.47 -1.23 0.00 0.00 177.57 177.18 1d3k n ASP 236 N -2.56 0.36 -2.19 4.19 9.92 -1.26 -3.70 116.55 121.30 1d3k n ASP 236 Ca 0.01 0.39 -0.23 0.00 -0.53 0.00 0.00 54.79 54.43 1d3k n ASP 236 Cb 0.22 -0.43 0.18 0.00 -0.64 0.00 0.00 41.12 40.45 1d3k n ASP 236 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1d3k n GLU 237 N -1.77 2.24 0.15 -1.24 1.02 -0.97 -4.59 120.64 115.47 1d3k n GLU 237 Ca 0.06 -3.02 0.08 0.00 -0.02 0.00 0.00 57.16 54.26 1d3k n GLU 237 Cb 0.37 -2.17 0.57 0.00 -0.02 0.00 0.00 31.44 30.20 1d3k n GLU 237 CO 0.00 0.00 0.00 0.10 1.18 0.00 0.00 177.13 178.41 1d3k h TYR 238 N 1.01 0.18 -0.01 -0.32 -0.00 -1.75 -1.52 116.97 114.56 1d3k h TYR 238 Ca 0.63 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.36 1d3k h TYR 238 Cb 2.81 -0.06 -0.00 0.00 0.00 0.00 0.00 36.73 39.48 1d3k h TYR 238 CO 1.58 0.11 0.01 0.87 -0.00 0.00 0.00 178.16 180.73 1d3k h LYS 239 N 0.19 0.00 -0.24 0.10 1.57 -1.92 0.50 116.57 116.76 1d3k h LYS 239 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1d3k h LYS 239 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1d3k h LYS 239 CO -0.01 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.62 1d3k n ASP 240 N -3.73 2.70 -2.89 0.86 8.00 -0.63 -4.74 116.55 116.12 1d3k n ASP 240 Ca -0.03 -2.07 -0.11 0.00 0.71 0.00 0.00 54.79 53.29 1d3k n ASP 240 Cb 0.09 -0.19 0.00 0.00 -0.02 0.00 0.00 41.12 41.01 1d3k n ASP 240 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1d3k s HIS 242 N 0.39 1.28 -0.07 0.00 -3.43 -1.03 -4.49 115.29 107.94 1d3k s HIS 242 Ca 0.32 -1.14 0.07 0.00 -0.80 0.00 0.00 55.06 53.52 1d3k s HIS 242 Cb 0.13 -0.73 -0.24 0.00 -1.43 0.00 0.00 32.58 30.32 1d3k s HIS 242 CO -0.16 -0.33 0.57 1.28 -2.00 0.00 0.00 174.74 174.09 1d3k n LEU 243 N -0.31 1.35 -3.61 5.38 4.77 0.88 -4.61 117.00 120.85 1d3k n LEU 243 Ca -0.03 0.35 -0.01 0.00 -0.03 0.00 0.00 56.01 56.29 1d3k n LEU 243 Cb 0.65 -0.18 -0.01 0.00 -2.33 0.00 0.00 43.42 41.55 1d3k n LEU 243 CO 0.35 0.52 1.04 0.00 -1.33 0.00 0.00 177.39 177.97 1d3k s ALA 244 N -2.59 -2.17 -0.14 -1.18 0.00 -1.23 -5.00 121.76 109.46 1d3k s ALA 244 Ca -0.10 1.04 -0.05 0.00 0.00 0.00 0.00 51.96 52.86 1d3k s ALA 244 Cb 0.08 0.17 -0.04 0.00 0.00 0.00 0.00 23.12 23.33 1d3k s ALA 244 CO 0.81 -0.88 0.03 -0.65 0.00 0.00 0.00 175.76 175.07 1d3k s GLN 245 N -2.42 3.51 0.11 0.00 -0.21 -1.26 -1.11 119.66 118.28 1d3k s GLN 245 Ca 0.12 -0.37 0.06 0.00 0.02 0.00 0.00 55.36 55.20 1d3k s GLN 245 Cb 0.03 -3.01 -0.04 0.00 1.00 0.00 0.00 33.01 30.99 1d3k s GLN 245 CO -0.04 0.48 -0.15 0.14 -2.12 0.00 0.00 175.29 173.60 1d3k s VAL 246 N -0.24 1.38 0.66 1.09 -7.23 -0.35 -4.96 120.40 110.76 1d3k s VAL 246 Ca 0.07 -1.62 -0.17 0.00 -1.81 0.00 0.00 61.98 58.45 1d3k s VAL 246 Cb -0.12 -1.47 0.00 0.00 0.56 0.00 0.00 36.38 35.36 1d3k s VAL 246 CO 0.02 -0.32 1.20 -2.84 -0.31 0.00 0.00 175.10 172.85 1d3k s PRO 247 N -2.38 2.56 0.90 4.82 0.02 -1.26 -1.34 135.00 138.32 1d3k s PRO 247 Ca 0.07 1.75 -0.10 0.00 0.02 0.00 0.00 61.00 62.74 1d3k s PRO 247 Cb -0.07 -1.88 0.14 0.00 0.02 0.00 0.00 34.50 32.70 1d3k s PRO 247 CO 0.03 -1.51 1.12 -1.12 -0.33 0.00 0.00 177.00 175.20 1d3k s SER 248 N -1.90 3.14 0.56 2.53 0.01 -0.95 -4.54 113.70 112.55 1d3k s SER 248 Ca 0.75 2.04 -0.19 0.00 1.31 0.00 0.00 55.95 59.86 1d3k s SER 248 Cb -0.29 -2.52 -0.05 0.00 0.21 0.00 0.00 66.02 63.37 1d3k s SER 248 CO 0.40 -2.94 1.13 -1.00 0.41 0.00 0.00 173.24 171.24 1d3k s HIS 249 N -2.70 2.65 -0.00 2.43 3.76 -1.26 -4.28 115.29 115.89 1d3k s HIS 249 Ca 0.66 1.54 -0.04 0.00 -0.15 0.00 0.00 55.06 57.07 1d3k s HIS 249 Cb -0.22 -3.28 -0.00 0.00 1.11 0.00 0.00 32.58 30.19 1d3k s HIS 249 CO 0.58 -1.61 0.08 0.95 -0.85 0.00 0.00 174.74 173.89 1d3k s THR 250 N -1.83 0.07 0.10 1.30 -4.23 -0.07 -1.88 115.64 109.11 1d3k s THR 250 Ca 0.72 -0.61 -0.30 0.00 -1.18 0.00 0.00 61.69 60.33 1d3k s THR 250 Cb -0.24 -0.32 -0.06 0.00 1.34 0.00 0.00 72.50 73.23 1d3k s THR 250 CO 0.29 -0.33 1.00 -0.69 -0.54 0.00 0.00 174.62 174.34 1d3k s VAL 251 N -1.09 4.42 0.22 2.29 1.01 0.10 -0.72 120.40 126.63 1d3k s VAL 251 Ca -0.12 1.96 0.10 0.00 0.00 0.00 0.00 61.98 63.92 1d3k s VAL 251 Cb -0.07 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.01 1d3k s VAL 251 CO 0.00 0.28 -0.10 0.68 0.00 0.00 0.00 175.10 175.97 1d3k s VAL 252 N 0.15 3.08 0.18 2.92 -7.23 -0.72 -0.92 120.40 117.86 1d3k s VAL 252 Ca 0.49 -1.88 -0.07 0.00 -1.81 0.00 0.00 61.98 58.70 1d3k s VAL 252 Cb -0.24 -2.58 -0.02 0.00 0.56 0.00 0.00 36.38 34.10 1d3k s VAL 252 CO 0.30 -0.23 0.26 0.00 -0.31 0.00 0.00 175.10 175.12 1d3k s ALA 253 N -2.00 0.26 0.68 1.32 0.00 -0.13 -3.64 121.76 118.23 1d3k s ALA 253 Ca 0.27 -1.09 -0.17 0.00 0.00 0.00 0.00 51.96 50.97 1d3k s ALA 253 Cb -0.07 0.98 0.01 0.00 0.00 0.00 0.00 23.12 24.03 1d3k s ALA 253 CO 0.16 -0.65 1.27 1.03 0.00 0.00 0.00 175.76 177.57 1d3k s ARG 254 N -4.02 2.39 0.36 0.00 0.52 -1.26 -0.66 118.95 116.27 1d3k s ARG 254 Ca 0.22 1.98 0.21 0.00 -0.52 0.00 0.00 55.73 57.62 1d3k s ARG 254 Cb 0.04 -1.84 0.21 0.00 0.52 0.00 0.00 34.95 33.88 1d3k s ARG 254 CO 0.04 -1.70 1.47 0.66 0.02 0.00 0.00 175.30 175.79 1d3k h SER 255 N 0.26 0.00 -3.44 0.23 4.64 -1.90 -3.36 113.55 109.99 1d3k h SER 255 Ca -0.50 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.26 1d3k h SER 255 Cb 1.33 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 63.08 1d3k h SER 255 CO 0.52 0.15 -0.83 -0.32 -0.87 0.00 0.00 176.83 175.47 1d3k s MET 256 N -3.15 2.07 -1.45 4.77 -2.45 -1.26 -4.72 119.30 113.10 1d3k s MET 256 Ca 0.05 -0.56 -0.10 0.00 -1.25 0.00 0.00 55.69 53.83 1d3k s MET 256 Cb 0.06 -1.66 0.04 0.00 1.25 0.00 0.00 34.83 34.53 1d3k s MET 256 CO 0.71 0.09 0.96 0.41 1.05 0.00 0.00 175.02 178.23 1d3k n GLY 257 N 3.67 -0.52 0.04 2.11 0.00 -1.26 -4.90 105.19 104.33 1d3k n GLY 257 Ca -0.21 0.20 0.14 0.00 0.00 0.00 0.00 46.02 46.15 1d3k n GLY 257 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d3k n GLY 258 N -1.75 -1.19 2.41 -0.02 0.00 -1.26 -4.91 105.19 98.47 1d3k n GLY 258 Ca -0.00 -0.20 -0.18 0.00 0.00 0.00 0.00 46.02 45.64 1d3k n GLY 258 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1d3k n LYS 259 N -1.21 -1.86 0.24 1.61 5.02 -1.26 -4.51 118.16 116.19 1d3k n LYS 259 Ca 0.13 0.87 0.10 0.00 -2.02 0.00 0.00 58.31 57.39 1d3k n LYS 259 Cb 0.27 -5.49 0.68 0.00 -0.02 0.00 0.00 35.03 30.47 1d3k n LYS 259 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 1d3k h GLU 260 N 0.00 0.00 -0.29 1.97 9.09 -1.92 -1.06 114.58 122.37 1d3k h GLU 260 Ca -0.42 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 58.91 1d3k h GLU 260 Cb 1.30 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.40 1d3k h GLU 260 CO 0.50 0.00 -0.16 0.38 0.05 0.00 0.00 179.01 179.78 1d3k h ASP 261 N 0.00 0.64 -0.02 3.06 2.03 -2.00 -1.96 116.42 118.17 1d3k h ASP 261 Ca 0.03 -0.42 -0.13 0.00 -0.73 0.00 0.00 57.03 55.78 1d3k h ASP 261 Cb 0.11 -0.18 -0.01 0.00 -0.83 0.00 0.00 39.33 38.43 1d3k h ASP 261 CO -0.00 0.92 -0.40 -0.07 -1.03 0.00 0.00 179.24 178.66 1d3k h LEU 262 N 0.37 0.57 -0.29 0.15 3.38 -1.78 -0.22 115.31 117.49 1d3k h LEU 262 Ca 0.06 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1d3k h LEU 262 Cb 0.69 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1d3k h LEU 262 CO 0.05 0.91 0.19 0.40 0.09 0.00 0.00 178.44 180.07 1d3k h ILE 263 N 0.45 1.09 -0.40 1.22 2.04 -1.15 0.11 117.51 120.86 1d3k h ILE 263 Ca 0.04 -0.17 -0.07 0.00 1.00 0.00 0.00 64.86 65.66 1d3k h ILE 263 Cb 0.89 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 1d3k h ILE 263 CO 0.08 0.08 -0.03 -0.25 0.00 0.00 0.00 178.15 178.03 1d3k h TRP 264 N 0.39 0.79 -0.68 1.37 2.91 -1.18 -1.37 115.95 118.18 1d3k h TRP 264 Ca 0.11 -0.15 0.04 0.00 1.13 0.00 0.00 58.89 60.01 1d3k h TRP 264 Cb -0.03 -0.20 -0.05 0.00 -0.51 0.00 0.00 29.16 28.38 1d3k h TRP 264 CO -0.05 0.82 0.42 1.49 -1.03 0.00 0.00 178.44 180.08 1d3k h GLU 265 N 0.54 0.78 -0.02 2.65 4.81 -0.74 -0.04 114.58 122.57 1d3k h GLU 265 Ca 0.11 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1d3k h GLU 265 Cb 0.52 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.72 1d3k h GLU 265 CO 0.03 0.52 0.00 1.25 -0.73 0.00 0.00 179.01 180.08 1d3k h LEU 266 N 0.80 0.03 -0.86 1.64 5.85 -0.66 -2.36 115.31 119.76 1d3k h LEU 266 Ca 0.28 -0.26 -0.10 0.00 0.84 0.00 0.00 57.88 58.64 1d3k h LEU 266 Cb 0.06 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1d3k h LEU 266 CO -0.12 0.28 -0.25 -0.07 -0.34 0.00 0.00 178.44 177.94 1d3k h LEU 267 N -0.23 0.57 -0.45 2.25 3.38 -1.09 0.12 115.31 119.86 1d3k h LEU 267 Ca 0.00 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 1d3k h LEU 267 Cb 0.27 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1d3k h LEU 267 CO 0.00 0.81 0.10 -1.13 0.09 0.00 0.00 178.44 178.31 1d3k h ASN 268 N 0.50 0.69 -0.30 -0.43 -1.24 -0.99 -0.60 115.58 113.20 1d3k h ASN 268 Ca 0.07 -0.24 -0.16 0.00 0.71 0.00 0.00 56.30 56.68 1d3k h ASN 268 Cb 0.69 -0.18 -0.00 0.00 0.73 0.00 0.00 38.32 39.56 1d3k h ASN 268 CO 0.05 0.75 -0.44 1.56 -1.29 0.00 0.00 177.43 178.06 1d3k h GLN 269 N 0.59 0.86 -0.52 6.67 4.20 -1.26 -2.90 115.11 122.76 1d3k h GLN 269 Ca 0.14 -0.48 0.02 0.00 0.06 0.00 0.00 58.65 58.38 1d3k h GLN 269 Cb 0.34 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.12 1d3k h GLN 269 CO 0.00 1.12 0.32 0.00 -0.67 0.00 0.00 178.83 179.61 1d3k h ALA 270 N 0.80 0.66 0.00 3.87 0.00 -0.47 -2.00 119.26 122.12 1d3k h ALA 270 Ca 0.04 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1d3k h ALA 270 Cb 1.03 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1d3k h ALA 270 CO 0.10 0.04 -0.28 -0.56 0.00 0.00 0.00 179.25 178.55 1d3k h GLN 271 N 0.64 0.00 -0.23 0.00 3.07 -1.08 0.26 115.11 117.77 1d3k h GLN 271 Ca 0.20 0.00 -0.20 0.00 0.09 0.00 0.00 58.65 58.75 1d3k h GLN 271 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.55 1d3k h GLN 271 CO -0.08 0.28 -0.63 0.93 0.09 0.00 0.00 178.83 179.43 1d3k h GLU 272 N 0.00 0.81 0.12 0.06 5.08 -1.20 -1.26 114.58 118.19 1d3k h GLU 272 Ca -0.00 -0.56 -0.33 0.00 -1.00 0.00 0.00 59.36 57.46 1d3k h GLU 272 Cb 0.65 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 1d3k h GLU 272 CO 0.04 1.19 -1.76 0.45 -1.00 0.00 0.00 179.01 177.92 1d3k h HIS 273 N 0.60 0.46 0.00 4.33 3.86 -1.15 -3.41 115.15 119.85 1d3k h HIS 273 Ca -0.01 -0.34 -0.00 0.00 -1.16 0.00 0.00 60.37 58.86 1d3k h HIS 273 Cb 1.24 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 29.69 1d3k h HIS 273 CO 0.07 1.53 -0.16 1.19 0.86 0.00 0.00 177.93 181.43 1d3k n PHE 274 N -3.44 0.00 -0.63 2.45 3.72 0.90 -3.94 117.46 116.53 1d3k n PHE 274 Ca -0.23 -0.72 -0.05 0.00 -0.05 0.00 0.00 57.45 56.39 1d3k n PHE 274 Cb 1.05 -0.12 0.04 0.00 -0.94 0.00 0.00 39.48 39.52 1d3k n PHE 274 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1d3k n GLY 275 N -1.01 -2.42 3.67 1.37 0.00 -0.47 -1.40 105.19 104.92 1d3k n GLY 275 Ca 0.11 -1.47 -0.51 0.00 0.00 0.00 0.00 46.02 44.15 1d3k n GLY 275 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1d3k n LYS 276 N -2.06 1.70 -2.00 1.61 4.76 -1.26 -1.31 118.16 119.60 1d3k n LYS 276 Ca 0.03 0.62 -0.19 0.00 -2.87 0.00 0.00 58.31 55.90 1d3k n LYS 276 Cb 0.10 -2.37 -0.04 0.00 -1.84 0.00 0.00 35.03 30.88 1d3k n LYS 276 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1d3k n ASP 277 N 5.04 -5.31 -0.04 4.39 8.00 -1.26 -4.87 116.55 122.50 1d3k n ASP 277 Ca 0.22 0.24 -0.20 0.00 0.71 0.00 0.00 54.79 55.76 1d3k n ASP 277 Cb 0.23 -4.57 -0.13 0.00 -0.02 0.00 0.00 41.12 36.62 1d3k n ASP 277 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1d3k n LYS 278 N -2.64 0.73 -4.18 -1.24 4.76 -0.43 -4.99 118.16 110.17 1d3k n LYS 278 Ca -0.21 0.23 -0.16 0.00 -2.87 0.00 0.00 58.31 55.29 1d3k n LYS 278 Cb 0.65 -1.65 -0.12 0.00 -1.84 0.00 0.00 35.03 32.07 1d3k n LYS 278 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1d3k s SER 279 N -6.88 1.22 0.03 4.39 0.15 -1.25 -4.91 113.70 106.46 1d3k s SER 279 Ca -0.26 -0.48 0.23 0.00 0.70 0.00 0.00 55.95 56.14 1d3k s SER 279 Cb 0.07 -0.03 0.15 0.00 -1.71 0.00 0.00 66.02 64.50 1d3k s SER 279 CO 0.72 -0.08 1.13 0.29 1.20 0.00 0.00 173.24 176.51 1d3k n LYS 280 N 1.73 0.14 0.03 5.44 4.76 -1.26 -4.28 118.16 124.72 1d3k n LYS 280 Ca -0.20 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.02 1d3k n LYS 280 Cb 0.55 -1.55 -0.14 0.00 -1.84 0.00 0.00 35.03 32.05 1d3k n LYS 280 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1d3k h GLU 281 N 0.00 0.32 -2.92 1.97 3.07 -1.98 -3.48 114.58 111.56 1d3k h GLU 281 Ca 0.00 -0.54 -0.12 0.00 -0.50 0.00 0.00 59.36 58.19 1d3k h GLU 281 Cb 0.61 0.20 -0.22 0.00 -0.84 0.00 0.00 28.75 28.51 1d3k h GLU 281 CO 0.00 1.26 -0.27 0.12 -1.40 0.00 0.00 179.01 178.72 1d3k s PHE 282 N -2.55 -0.29 -0.10 4.33 5.36 -1.26 -5.13 117.98 118.33 1d3k s PHE 282 Ca -0.19 0.61 0.02 0.00 -0.96 0.00 0.00 56.93 56.40 1d3k s PHE 282 Cb 0.06 0.12 0.02 0.00 -0.34 0.00 0.00 43.02 42.88 1d3k s PHE 282 CO 0.80 -0.31 -0.14 -0.65 -1.46 0.00 0.00 175.22 173.47 1d3k s GLN 283 N -0.65 2.02 0.21 10.12 1.11 -1.26 -4.39 119.66 126.83 1d3k s GLN 283 Ca -0.07 -0.49 -0.04 0.00 0.01 0.00 0.00 55.36 54.76 1d3k s GLN 283 Cb -0.04 -1.74 0.17 0.00 -1.01 0.00 0.00 33.01 30.39 1d3k s GLN 283 CO 0.03 -0.06 1.60 1.25 0.01 0.00 0.00 175.29 178.11 1d3k h LEU 284 N 7.37 0.74 -3.97 2.90 5.85 -1.53 -3.31 115.31 123.36 1d3k h LEU 284 Ca -0.31 -0.30 -0.52 0.00 0.84 0.00 0.00 57.88 57.60 1d3k h LEU 284 Cb 1.17 -0.20 -0.30 0.00 0.37 0.00 0.00 40.66 41.70 1d3k h LEU 284 CO 0.48 1.00 0.64 0.49 -0.34 0.00 0.00 178.44 180.71 1d3k n PHE 285 N -4.07 3.01 -3.65 1.25 3.72 -1.26 -4.75 117.46 111.70 1d3k n PHE 285 Ca -0.01 -1.93 -0.02 0.00 -0.05 0.00 0.00 57.45 55.44 1d3k n PHE 285 Cb 0.48 -0.97 -0.01 0.00 -0.94 0.00 0.00 39.48 38.04 1d3k n PHE 285 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1d3k s SER 286 N -1.40 -0.14 -0.24 4.37 1.04 -1.25 -4.30 113.70 111.78 1d3k s SER 286 Ca 0.57 -0.20 -0.27 0.00 0.48 0.00 0.00 55.95 56.53 1d3k s SER 286 Cb 0.48 0.30 0.12 0.00 0.10 0.00 0.00 66.02 67.02 1d3k s SER 286 CO 0.10 -0.54 1.02 -0.55 0.98 0.00 0.00 173.24 174.25 1d3k s SER 287 N -2.83 -0.42 0.02 7.02 0.15 -1.25 -4.59 113.70 111.80 1d3k s SER 287 Ca 0.12 0.70 0.18 0.00 0.70 0.00 0.00 55.95 57.65 1d3k s SER 287 Cb 0.01 0.67 0.75 0.00 -1.71 0.00 0.00 66.02 65.75 1d3k s SER 287 CO -0.02 -0.22 1.57 -0.81 1.20 0.00 0.00 173.24 174.96 1d3k n PRO 288 N 1.70 0.02 0.00 5.44 -0.04 -1.26 -2.85 135.00 138.01 1d3k n PRO 288 Ca -0.12 0.22 0.12 0.00 -0.04 0.00 0.00 63.50 63.69 1d3k n PRO 288 Cb 0.57 -1.53 0.31 0.00 -0.04 0.00 0.00 33.50 32.80 1d3k n PRO 288 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1d3k n HIS 289 N -1.57 0.00 0.00 0.54 8.25 -1.26 -5.03 115.22 116.15 1d3k n HIS 289 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 1d3k n HIS 289 Cb 0.21 -0.21 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1d3k n HIS 289 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1d3k n GLY 290 N 1.44 2.19 3.86 -1.41 0.00 -1.13 -4.88 105.19 105.26 1d3k n GLY 290 Ca 0.08 -1.28 -0.36 0.00 0.00 0.00 0.00 46.02 44.46 1d3k n GLY 290 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d3k s LYS 291 N -1.98 3.71 -1.50 1.61 1.02 -1.26 -3.93 119.74 117.41 1d3k s LYS 291 Ca 0.00 0.14 -0.12 0.00 0.02 0.00 0.00 55.97 56.01 1d3k s LYS 291 Cb 0.00 -3.13 0.07 0.00 -0.52 0.00 0.00 37.83 34.25 1d3k s LYS 291 CO 0.00 0.67 0.99 -0.25 -0.92 0.00 0.00 175.35 175.84 1d3k n ASP 292 N 1.46 -4.73 -4.67 2.83 8.00 -1.26 -4.94 116.55 113.24 1d3k n ASP 292 Ca -0.13 -0.76 -0.40 0.00 0.71 0.00 0.00 54.79 54.21 1d3k n ASP 292 Cb 0.53 -4.02 -0.05 0.00 -0.02 0.00 0.00 41.12 37.55 1d3k n ASP 292 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1d3k s LEU 293 N -7.25 4.16 0.00 0.64 1.43 -1.26 -4.29 118.68 112.12 1d3k s LEU 293 Ca 0.61 0.97 0.00 0.00 -1.03 0.00 0.00 54.13 54.67 1d3k s LEU 293 Cb -0.30 -3.02 0.00 0.00 0.03 0.00 0.00 46.19 42.90 1d3k s LEU 293 CO 0.82 -0.31 0.00 0.18 0.23 0.00 0.00 176.35 177.27 1d3k n LEU 294 N 5.06 0.00 -4.12 1.79 4.77 -1.26 -4.77 117.00 118.46 1d3k n LEU 294 Ca 0.01 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.90 1d3k n LEU 294 Cb 0.49 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.48 1d3k n LEU 294 CO 0.46 0.00 -0.37 -0.36 -1.33 0.00 0.00 177.39 175.78 1d3k s PHE 295 N 0.00 0.70 0.27 -1.77 0.08 -1.26 -4.41 117.98 111.59 1d3k s PHE 295 Ca 0.00 -0.96 -0.29 0.00 0.12 0.00 0.00 56.93 55.79 1d3k s PHE 295 Cb 0.00 -0.45 -0.09 0.00 -0.57 0.00 0.00 43.02 41.91 1d3k s PHE 295 CO 0.00 -0.25 1.13 0.15 -0.10 0.00 0.00 175.22 176.14 1d3k s LYS 296 N -3.74 4.60 0.47 0.44 1.02 -1.26 -4.23 119.74 117.04 1d3k s LYS 296 Ca 0.08 1.85 0.15 0.00 0.02 0.00 0.00 55.97 58.07 1d3k s LYS 296 Cb 0.06 -3.19 1.08 0.00 -0.52 0.00 0.00 37.83 35.26 1d3k s LYS 296 CO -0.07 0.14 2.04 -0.44 -0.92 0.00 0.00 175.35 176.10 1d3k h ASP 297 N 3.96 0.00 0.43 2.83 5.19 -1.90 -1.91 116.42 125.01 1d3k h ASP 297 Ca -0.47 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.94 1d3k h ASP 297 Cb 1.21 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.72 1d3k h ASP 297 CO 0.68 0.13 0.00 -1.54 -3.12 0.00 0.00 179.24 175.39 1d3k n SER 298 N -4.38 0.00 -4.80 6.45 3.41 -1.26 -4.79 113.62 108.25 1d3k n SER 298 Ca -0.03 -0.26 -0.34 0.00 -0.26 0.00 0.00 58.87 57.99 1d3k n SER 298 Cb 0.20 -0.23 -0.02 0.00 -0.26 0.00 0.00 64.21 63.90 1d3k n SER 298 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1d3k s ALA 299 N -2.47 2.82 -0.28 7.33 0.00 -0.72 -4.41 121.76 124.03 1d3k s ALA 299 Ca 0.30 0.57 0.06 0.00 0.00 0.00 0.00 51.96 52.88 1d3k s ALA 299 Cb 0.19 -3.26 -0.07 0.00 0.00 0.00 0.00 23.12 19.99 1d3k s ALA 299 CO 0.41 -0.48 0.26 0.72 0.00 0.00 0.00 175.76 176.66 1d3k n HIS 300 N -1.28 0.00 -3.50 0.00 8.25 0.37 -4.91 115.22 114.14 1d3k n HIS 300 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.55 1d3k n HIS 300 Cb 0.52 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.63 1d3k n HIS 300 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1d3k n GLY 301 N 1.18 -1.18 3.32 -1.41 0.00 -1.22 -4.62 105.19 101.27 1d3k n GLY 301 Ca 0.01 -0.99 -0.25 0.00 0.00 0.00 0.00 46.02 44.79 1d3k n GLY 301 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1d3k s PHE 302 N -3.00 1.93 -0.04 1.61 0.08 -1.26 -1.57 117.98 115.72 1d3k s PHE 302 Ca 0.00 -0.41 0.03 0.00 0.12 0.00 0.00 56.93 56.67 1d3k s PHE 302 Cb 0.00 -1.04 0.00 0.00 -0.57 0.00 0.00 43.02 41.42 1d3k s PHE 302 CO 0.00 0.27 -0.13 -0.51 -0.10 0.00 0.00 175.22 174.75 1d3k s LEU 303 N -2.09 1.78 0.26 -0.37 1.43 -0.09 -4.94 118.68 114.67 1d3k s LEU 303 Ca 0.10 -0.28 -0.29 0.00 -1.03 0.00 0.00 54.13 52.63 1d3k s LEU 303 Cb -0.09 -0.78 -0.09 0.00 0.03 0.00 0.00 46.19 45.26 1d3k s LEU 303 CO 0.05 0.08 1.19 -0.75 0.23 0.00 0.00 176.35 177.15 1d3k s LYS 304 N 0.29 4.52 0.25 1.70 2.20 -1.26 -0.74 119.74 126.70 1d3k s LYS 304 Ca -0.07 1.94 -0.26 0.00 -0.36 0.00 0.00 55.97 57.22 1d3k s LYS 304 Cb -0.12 -3.17 -0.09 0.00 -1.51 0.00 0.00 37.83 32.94 1d3k s LYS 304 CO 0.02 0.01 0.87 0.08 -0.36 0.00 0.00 175.35 175.98 1d3k s VAL 305 N -0.81 4.27 0.74 4.02 1.01 -0.63 -4.86 120.40 124.13 1d3k s VAL 305 Ca 0.48 1.78 -0.15 0.00 0.00 0.00 0.00 61.98 64.09 1d3k s VAL 305 Cb -0.34 -4.09 0.02 0.00 0.00 0.00 0.00 36.38 31.97 1d3k s VAL 305 CO 0.43 0.32 1.05 -2.65 0.00 0.00 0.00 175.10 174.25 1d3k n PRO 306 N 1.04 0.47 -1.61 2.72 -0.02 -1.26 -4.86 135.00 131.48 1d3k n PRO 306 Ca -0.01 0.22 -0.56 0.00 -2.02 0.00 0.00 63.50 61.13 1d3k n PRO 306 Cb 0.49 -2.30 -0.07 0.00 -0.02 0.00 0.00 33.50 31.60 1d3k n PRO 306 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1d3k n PRO 307 N -2.21 0.78 -2.52 0.52 -0.02 -1.26 -2.69 135.00 127.58 1d3k n PRO 307 Ca 0.13 0.28 -0.12 0.00 -2.02 0.00 0.00 63.50 61.78 1d3k n PRO 307 Cb 0.50 -1.89 -0.00 0.00 -0.02 0.00 0.00 33.50 32.09 1d3k n PRO 307 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1d3k n ARG 308 N 2.94 -2.43 -2.48 -0.52 1.74 -1.26 -4.94 116.66 109.71 1d3k n ARG 308 Ca 0.21 0.51 -0.41 0.00 -0.77 0.00 0.00 57.85 57.40 1d3k n ARG 308 Cb 0.13 -5.11 -0.04 0.00 -1.02 0.00 0.00 32.46 26.42 1d3k n ARG 308 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 1d3k s MET 309 N -5.11 4.58 0.52 5.56 1.75 -1.10 -5.03 119.30 120.48 1d3k s MET 309 Ca 0.03 1.76 0.01 0.00 -1.25 0.00 0.00 55.69 56.23 1d3k s MET 309 Cb -0.02 -3.26 0.02 0.00 2.84 0.00 0.00 34.83 34.41 1d3k s MET 309 CO 0.04 0.06 0.75 0.16 -0.65 0.00 0.00 175.02 175.37 1d3k s ASP 310 N -0.14 5.47 0.22 1.11 -4.77 -1.26 -4.42 116.67 112.89 1d3k s ASP 310 Ca 0.49 0.13 -0.08 0.00 -3.30 0.00 0.00 52.55 49.80 1d3k s ASP 310 Cb -0.30 -1.14 0.28 0.00 -1.09 0.00 0.00 42.92 40.67 1d3k s ASP 310 CO 0.36 -0.99 1.82 0.00 0.70 0.00 0.00 175.17 177.06 1d3k h ALA 311 N 0.17 1.01 -0.55 2.11 0.00 -1.91 -1.90 119.26 118.19 1d3k h ALA 311 Ca -0.44 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.49 1d3k h ALA 311 Cb 1.28 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 1d3k h ALA 311 CO 0.54 0.13 0.36 0.87 0.00 0.00 0.00 179.25 181.16 1d3k h LYS 312 N 0.79 0.72 -0.35 0.00 1.57 -1.95 0.81 116.57 118.16 1d3k h LYS 312 Ca 0.33 -0.04 -0.17 0.00 -1.87 0.00 0.00 60.65 58.90 1d3k h LYS 312 Cb 0.20 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 1d3k h LYS 312 CO -0.18 0.48 -0.43 1.98 -0.57 0.00 0.00 179.45 180.72 1d3k h MET 313 N 0.74 0.92 0.12 3.15 4.05 -1.88 -1.38 114.93 120.65 1d3k h MET 313 Ca 0.20 -0.52 -0.00 0.00 -0.28 0.00 0.00 59.70 59.11 1d3k h MET 313 Cb -0.08 0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 30.75 1d3k h MET 313 CO -0.05 1.17 -0.07 -0.92 0.23 0.00 0.00 176.91 177.26 1d3k h TYR 314 N 0.73 -0.19 -0.31 1.39 3.20 -1.04 -2.94 116.97 117.82 1d3k h TYR 314 Ca 0.05 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.85 1d3k h TYR 314 Cb 1.04 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 39.36 1d3k h TYR 314 CO 0.07 -0.12 -0.08 -0.07 -1.64 0.00 0.00 178.16 176.32 1d3k h LEU 315 N -0.18 0.49 0.00 2.82 3.38 -0.81 -3.50 115.31 117.50 1d3k h LEU 315 Ca -0.01 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1d3k h LEU 315 Cb 0.16 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1d3k h LEU 315 CO 0.01 0.62 0.00 0.61 0.09 0.00 0.00 178.44 179.77 1d3k n GLY 316 N -0.71 1.63 0.21 0.83 0.00 -0.53 -4.51 105.19 102.11 1d3k n GLY 316 Ca 0.01 -1.70 -0.07 0.00 0.00 0.00 0.00 46.02 44.26 1d3k n GLY 316 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1d3k h TYR 317 N 0.00 0.62 0.44 1.61 3.20 -1.88 -1.64 116.97 119.32 1d3k h TYR 317 Ca 0.00 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 1d3k h TYR 317 Cb 0.00 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 1d3k h TYR 317 CO 0.00 0.40 -0.36 0.93 -1.64 0.00 0.00 178.16 177.49 1d3k h GLU 318 N 0.67 -0.74 -0.71 1.82 5.08 -1.97 -0.07 114.58 118.66 1d3k h GLU 318 Ca 0.18 0.05 0.08 0.00 -1.00 0.00 0.00 59.36 58.68 1d3k h GLU 318 Cb -0.07 0.17 -0.07 0.00 0.50 0.00 0.00 28.75 29.28 1d3k h GLU 318 CO -0.04 -0.50 0.37 -0.92 -1.00 0.00 0.00 179.01 176.92 1d3k h TYR 319 N -0.77 0.66 0.00 4.33 3.20 -1.78 0.04 116.97 122.65 1d3k h TYR 319 Ca -0.06 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.79 1d3k h TYR 319 Cb 0.65 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.72 1d3k h TYR 319 CO -0.14 0.26 -0.25 0.28 -1.64 0.00 0.00 178.16 176.67 1d3k h VAL 320 N 0.64 1.12 0.03 1.81 2.07 -1.18 -2.27 116.25 118.46 1d3k h VAL 320 Ca 0.34 -0.86 -0.00 0.00 0.82 0.00 0.00 66.70 67.00 1d3k h VAL 320 Cb 0.32 1.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1d3k h VAL 320 CO -0.25 0.24 -0.01 0.74 0.02 0.00 0.00 177.57 178.31 1d3k h THR 321 N 0.00 1.24 -0.99 2.57 2.02 0.79 -2.04 112.91 116.50 1d3k h THR 321 Ca -0.00 -0.83 0.18 0.00 0.77 0.00 0.00 66.41 66.52 1d3k h THR 321 Cb 0.45 1.79 -0.10 0.00 -1.74 0.00 0.00 68.15 68.56 1d3k h THR 321 CO 0.03 0.21 0.61 0.00 0.37 0.00 0.00 175.52 176.75 1d3k h ALA 322 N 0.56 1.72 -0.21 6.16 0.00 -0.71 0.23 119.26 127.01 1d3k h ALA 322 Ca -0.00 0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.81 1d3k h ALA 322 Cb 0.37 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1d3k h ALA 322 CO 0.01 -0.05 -0.45 0.82 0.00 0.00 0.00 179.25 179.57 1d3k h ILE 323 N 0.77 1.31 0.63 0.00 2.04 -1.35 -2.81 117.51 118.10 1d3k h ILE 323 Ca 0.54 -1.68 -0.03 0.00 1.00 0.00 0.00 64.86 64.70 1d3k h ILE 323 Cb 0.84 1.83 0.01 0.00 -0.74 0.00 0.00 36.82 38.76 1d3k h ILE 323 CO -0.32 0.53 -0.30 0.03 0.00 0.00 0.00 178.15 178.08 1d3k h ARG 324 N 0.39 -0.82 0.00 2.37 3.08 -0.42 -2.38 114.38 116.60 1d3k h ARG 324 Ca 0.00 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1d3k h ARG 324 Cb 1.06 0.19 0.00 0.00 0.08 0.00 0.00 29.97 31.30 1d3k h ARG 324 CO 0.10 -0.53 0.12 0.09 -1.07 0.00 0.00 179.97 178.68 1d3k n ASN 325 N -5.44 0.42 -0.01 7.04 5.03 0.67 -0.36 115.26 122.62 1d3k n ASN 325 Ca -0.13 0.65 -0.12 0.00 0.87 0.00 0.00 54.58 55.86 1d3k n ASN 325 Cb 0.36 -0.67 -0.14 0.00 -1.02 0.00 0.00 39.78 38.30 1d3k n ASN 325 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.26 175.68 1d3k h LEU 326 N 0.00 0.11 0.05 3.41 5.85 -1.17 -2.25 115.31 121.31 1d3k h LEU 326 Ca 0.00 -0.23 -0.09 0.00 0.84 0.00 0.00 57.88 58.40 1d3k h LEU 326 Cb 0.24 -0.03 0.01 0.00 0.37 0.00 0.00 40.66 41.24 1d3k h LEU 326 CO 0.00 1.20 -0.39 0.03 -0.34 0.00 0.00 178.44 178.94 1d3k h ARG 327 N 0.02 0.17 0.00 1.25 -0.00 -0.25 -3.42 114.38 112.15 1d3k h ARG 327 Ca -0.30 -0.26 0.00 0.00 -0.50 0.00 0.00 59.98 58.92 1d3k h ARG 327 Cb 2.01 0.09 0.00 0.00 0.00 0.00 0.00 29.97 32.07 1d3k h ARG 327 CO 0.09 1.07 -0.24 0.39 0.00 0.00 0.00 179.97 181.28 1d3k n GLU 328 N -4.39 0.13 -1.44 0.04 1.02 -0.58 -5.00 120.64 110.42 1d3k n GLU 328 Ca -0.11 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.08 1d3k n GLU 328 Cb 0.62 -0.71 0.00 0.00 -0.02 0.00 0.00 31.44 31.33 1d3k n GLU 328 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1d3k n GLY 329 N 1.53 -1.17 3.04 0.62 0.00 -0.85 -5.01 105.19 103.36 1d3k n GLY 329 Ca -0.03 -0.12 -0.25 0.00 0.00 0.00 0.00 46.02 45.62 1d3k n GLY 329 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1d3k s THR 330 N -1.95 1.17 -2.00 2.61 2.01 -1.26 -5.00 115.64 111.21 1d3k s THR 330 Ca 0.00 -0.51 0.09 0.00 0.31 0.00 0.00 61.69 61.58 1d3k s THR 330 Cb 0.00 -1.05 0.26 0.00 0.01 0.00 0.00 72.50 71.72 1d3k s THR 330 CO 0.00 0.36 1.00 0.00 -0.69 0.00 0.00 174.62 175.28