#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a2k n ILE 2 N 0.00 0.00 0.00 2.02 5.41 -1.26 -3.59 119.36 121.94 3a2k n ILE 2 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 3a2k n ILE 2 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 3a2k n ILE 2 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 3a2k n ASP 3 N 0.20 1.60 -0.09 4.38 5.68 -1.26 -3.58 116.55 123.48 3a2k n ASP 3 Ca 0.00 0.00 -0.06 0.00 -0.50 0.00 0.00 54.79 54.23 3a2k n ASP 3 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 3a2k n ASP 3 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 3a2k h LYS 4 N 0.00 -0.08 0.00 0.11 1.57 -1.99 2.01 116.57 118.20 3a2k h LYS 4 Ca 0.00 0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 3a2k h LYS 4 Cb 0.50 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 3a2k h LYS 4 CO 0.00 -0.05 -0.34 -0.24 -0.57 0.00 0.00 179.45 178.24 3a2k h VAL 5 N -0.08 0.74 -0.09 0.50 3.04 -1.84 -1.64 116.25 116.89 3a2k h VAL 5 Ca 0.17 -1.53 -0.23 0.00 -1.01 0.00 0.00 66.70 64.09 3a2k h VAL 5 Cb 0.34 1.99 0.01 0.00 -2.01 0.00 0.00 31.29 31.62 3a2k h VAL 5 CO -0.39 0.34 -0.87 -0.09 -1.01 0.00 0.00 177.57 175.55 3a2k h ARG 6 N 0.00 0.70 0.27 4.17 2.43 -1.21 -1.84 114.38 118.90 3a2k h ARG 6 Ca -0.00 -0.64 0.00 0.00 -0.81 0.00 0.00 59.98 58.53 3a2k h ARG 6 Cb 0.96 0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.64 3a2k h ARG 6 CO 0.04 1.24 -0.32 0.00 -1.51 0.00 0.00 179.97 179.42 3a2k h ALA 7 N 0.56 -0.65 -0.88 2.80 0.00 0.32 -1.10 119.26 120.31 3a2k h ALA 7 Ca -0.08 -0.09 0.24 0.00 0.00 0.00 0.00 54.91 54.98 3a2k h ALA 7 Cb 1.50 0.48 -0.15 0.00 0.00 0.00 0.00 17.79 19.62 3a2k h ALA 7 CO 0.17 -0.90 0.21 0.35 0.00 0.00 0.00 179.25 179.07 3a2k h PHE 8 N -0.64 0.30 -0.72 0.00 3.57 -1.30 1.61 116.94 119.76 3a2k h PHE 8 Ca -0.01 0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.56 3a2k h PHE 8 Cb 0.60 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.31 3a2k h PHE 8 CO -0.21 -0.24 0.47 0.82 -2.23 0.00 0.00 178.31 176.91 3a2k h ILE 9 N 0.17 1.15 0.05 1.41 1.08 -0.63 -2.06 117.51 118.68 3a2k h ILE 9 Ca 0.56 -0.32 -0.00 0.00 -0.39 0.00 0.00 64.86 64.70 3a2k h ILE 9 Cb 1.13 0.12 0.00 0.00 -3.07 0.00 0.00 36.82 35.00 3a2k h ILE 9 CO -0.69 0.17 -0.02 -0.74 -0.69 0.00 0.00 178.15 176.18 3a2k h HIS 10 N 0.94 -0.06 -0.86 1.37 2.76 0.12 0.10 115.15 119.52 3a2k h HIS 10 Ca 0.28 -0.00 0.11 0.00 -2.20 0.00 0.00 60.37 58.55 3a2k h HIS 10 Cb -0.06 0.02 -0.12 0.00 1.55 0.00 0.00 27.41 28.80 3a2k h HIS 10 CO -0.03 0.56 -0.41 -2.13 -1.30 0.00 0.00 177.93 174.61 3a2k n ARG 11 N -4.79 -0.28 -0.50 5.26 0.00 0.50 0.23 116.66 117.07 3a2k n ARG 11 Ca -0.08 1.31 0.09 0.00 -0.00 0.00 0.00 57.85 59.17 3a2k n ARG 11 Cb 0.32 -1.94 0.31 0.00 0.00 0.00 0.00 32.46 31.15 3a2k n ARG 11 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 3a2k n HIS 12 N -5.18 1.23 0.00 -0.14 8.25 -0.78 -5.01 115.22 113.58 3a2k n HIS 12 Ca 0.06 -0.51 0.00 0.00 -0.26 0.00 0.00 57.72 57.01 3a2k n HIS 12 Cb 0.29 -0.17 0.00 0.00 1.12 0.00 0.00 29.99 31.23 3a2k n HIS 12 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 3a2k n GLN 13 N 1.07 0.00 0.00 -0.41 -0.06 0.13 -4.38 117.38 113.74 3a2k n GLN 13 Ca 0.23 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.23 3a2k n GLN 13 Cb 0.75 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.93 3a2k n GLN 13 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 3a2k n LEU 14 N 0.00 0.00 0.00 1.69 4.77 -1.26 -4.51 117.00 117.68 3a2k n LEU 14 Ca 0.00 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.82 3a2k n LEU 14 Cb 0.00 -0.17 -0.14 0.00 -2.33 0.00 0.00 43.42 40.78 3a2k n LEU 14 CO 0.00 0.00 -0.64 -0.07 -1.33 0.00 0.00 177.39 175.35 3a2k h LEU 15 N 0.00 0.24 -6.07 2.23 3.38 -1.76 -3.39 115.31 109.94 3a2k h LEU 15 Ca 0.00 -0.52 -0.62 0.00 0.09 0.00 0.00 57.88 56.83 3a2k h LEU 15 Cb 0.00 -0.08 -0.41 0.00 0.09 0.00 0.00 40.66 40.27 3a2k h LEU 15 CO 0.00 1.47 -0.45 -0.24 0.09 0.00 0.00 178.44 179.31 3a2k n SER 16 N -3.30 4.23 -3.34 -0.43 2.88 -1.26 -4.97 113.62 107.43 3a2k n SER 16 Ca -0.24 -3.50 -0.16 0.00 -1.33 0.00 0.00 58.87 53.64 3a2k n SER 16 Cb 1.05 -0.71 -0.07 0.00 -0.75 0.00 0.00 64.21 63.73 3a2k n SER 16 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 3a2k s GLU 17 N -2.76 0.68 0.00 -1.46 2.02 -1.26 -5.07 118.70 110.84 3a2k s GLU 17 Ca 0.41 -0.88 0.00 0.00 0.02 0.00 0.00 54.97 54.52 3a2k s GLU 17 Cb 0.17 -0.67 0.00 0.00 0.10 0.00 0.00 34.13 33.73 3a2k s GLU 17 CO -0.03 -1.21 0.00 0.41 0.02 0.00 0.00 175.26 174.45 3a2k n GLY 18 N 4.16 -0.43 0.00 -1.39 0.00 -1.26 -4.98 105.19 101.29 3a2k n GLY 18 Ca 0.12 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.27 3a2k n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a2k n ALA 19 N -0.34 0.00 -3.86 4.61 0.00 -1.26 -4.75 120.51 114.91 3a2k n ALA 19 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 3a2k n ALA 19 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.29 3a2k n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3a2k s ALA 20 N 0.00 1.42 0.09 0.00 0.00 -1.26 -1.36 121.76 120.65 3a2k s ALA 20 Ca 0.00 -0.85 0.07 0.00 0.00 0.00 0.00 51.96 51.18 3a2k s ALA 20 Cb 0.00 -1.17 -0.03 0.00 0.00 0.00 0.00 23.12 21.92 3a2k s ALA 20 CO 0.00 -0.92 -0.18 0.54 0.00 0.00 0.00 175.76 175.20 3a2k s VAL 21 N 1.66 1.44 -0.33 0.00 0.11 -1.13 -1.50 120.40 120.65 3a2k s VAL 21 Ca -0.01 -1.44 0.02 0.00 -2.93 0.00 0.00 61.98 57.63 3a2k s VAL 21 Cb -0.16 -1.34 0.10 0.00 -1.53 0.00 0.00 36.38 33.45 3a2k s VAL 21 CO -0.07 -0.13 0.07 -0.63 -3.33 0.00 0.00 175.10 171.00 3a2k s ILE 22 N -1.21 1.74 -0.42 7.04 1.01 -0.95 -2.61 121.20 125.80 3a2k s ILE 22 Ca 0.03 -1.98 -0.16 0.00 0.00 0.00 0.00 60.65 58.53 3a2k s ILE 22 Cb -0.10 -2.30 0.02 0.00 0.01 0.00 0.00 42.46 40.09 3a2k s ILE 22 CO 0.03 -0.63 0.38 0.54 0.00 0.00 0.00 174.94 175.27 3a2k s VAL 23 N 1.17 5.16 0.62 2.92 0.11 -0.71 -2.36 120.40 127.32 3a2k s VAL 23 Ca 0.10 -0.50 -0.13 0.00 -2.93 0.00 0.00 61.98 58.52 3a2k s VAL 23 Cb -0.18 -4.00 -0.03 0.00 -1.53 0.00 0.00 36.38 30.64 3a2k s VAL 23 CO -0.15 -0.39 1.04 -0.83 -3.33 0.00 0.00 175.10 171.44 3a2k s GLY 24 N 1.79 1.81 -0.18 6.54 0.00 -0.86 -2.23 107.32 114.19 3a2k s GLY 24 Ca 0.09 0.10 -0.13 0.00 0.00 0.00 0.00 44.72 44.77 3a2k s GLY 24 CO 0.12 0.39 0.46 0.14 0.00 0.00 0.00 173.10 174.20 3a2k s VAL 25 N -2.91 -0.01 0.00 1.40 1.01 -0.80 -4.61 120.40 114.47 3a2k s VAL 25 Ca 0.58 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.60 3a2k s VAL 25 Cb -0.13 -0.65 0.00 0.00 0.00 0.00 0.00 36.38 35.60 3a2k s VAL 25 CO 0.47 0.01 0.00 -1.20 0.00 0.00 0.00 175.10 174.39 3a2k n SER 26 N 3.48 0.00 0.00 3.32 7.64 -1.26 -4.08 113.62 122.72 3a2k n SER 26 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.70 3a2k n SER 26 Cb 0.56 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 3a2k n SER 26 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3a2k n GLY 27 N 4.03 0.00 0.00 0.23 0.00 -1.26 -4.87 105.19 103.32 3a2k n GLY 27 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3a2k n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a2k n GLY 28 N 0.00 1.24 0.29 -0.02 0.00 -1.26 -4.72 105.19 100.72 3a2k n GLY 28 Ca 0.00 -0.13 -0.08 0.00 0.00 0.00 0.00 46.02 45.81 3a2k n GLY 28 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3a2k n PRO 29 N 0.00 -0.31 0.42 1.61 -0.02 -1.26 -1.66 135.00 133.78 3a2k n PRO 29 Ca 0.00 1.05 -0.18 0.00 -2.02 0.00 0.00 63.50 62.35 3a2k n PRO 29 Cb 0.00 -1.54 -0.09 0.00 -0.02 0.00 0.00 33.50 31.85 3a2k n PRO 29 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3a2k h ASP 30 N 0.00 -0.90 -0.78 2.55 3.32 -1.91 -3.07 116.42 115.64 3a2k h ASP 30 Ca 0.11 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 3a2k h ASP 30 Cb 0.29 0.23 -0.04 0.00 0.22 0.00 0.00 39.33 40.03 3a2k h ASP 30 CO -0.65 -0.58 0.45 0.77 -1.72 0.00 0.00 179.24 177.51 3a2k h SER 31 N -1.16 0.95 -0.36 6.45 4.64 -1.65 -2.26 113.55 120.16 3a2k h SER 31 Ca -0.11 -0.06 -0.05 0.00 -0.47 0.00 0.00 61.79 61.10 3a2k h SER 31 Cb 0.83 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.66 3a2k h SER 31 CO 0.18 0.75 0.02 -0.07 -0.87 0.00 0.00 176.83 176.84 3a2k h LEU 32 N 1.09 0.60 -0.91 5.97 3.38 -1.47 -3.07 115.31 120.89 3a2k h LEU 32 Ca 0.28 -0.29 0.12 0.00 0.09 0.00 0.00 57.88 58.08 3a2k h LEU 32 Cb -0.01 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 40.49 3a2k h LEU 32 CO -0.05 0.74 0.54 0.00 0.09 0.00 0.00 178.44 179.75 3a2k h ALA 33 N 0.88 1.36 -1.57 1.53 0.00 -1.30 -2.79 119.26 117.37 3a2k h ALA 33 Ca 0.10 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3a2k h ALA 33 Cb 0.42 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3a2k h ALA 33 CO 0.01 0.11 0.00 -0.11 0.00 0.00 0.00 179.25 179.26 3a2k n LEU 34 N -4.72 0.00 -0.08 0.00 0.00 -1.12 -2.21 117.00 108.87 3a2k n LEU 34 Ca 0.17 0.74 -0.02 0.00 0.00 0.00 0.00 56.01 56.90 3a2k n LEU 34 Cb 0.35 -0.24 -0.02 0.00 0.00 0.00 0.00 43.42 43.52 3a2k n LEU 34 CO 0.26 -0.24 0.12 0.18 0.00 0.00 0.00 177.39 177.71 3a2k n LEU 35 N -1.53 -0.20 -0.13 -1.96 7.99 -1.16 -0.56 117.00 119.45 3a2k n LEU 35 Ca 0.00 0.40 -0.06 0.00 -0.01 0.00 0.00 56.01 56.34 3a2k n LEU 35 Cb 0.00 -0.07 -0.05 0.00 -0.11 0.00 0.00 43.42 43.19 3a2k n LEU 35 CO 0.00 -0.31 0.50 -0.74 -1.51 0.00 0.00 177.39 175.33 3a2k h HIS 36 N 0.00 -0.85 -0.47 -1.77 2.76 -1.31 0.56 115.15 114.07 3a2k h HIS 36 Ca 0.03 0.05 0.07 0.00 -2.20 0.00 0.00 60.37 58.32 3a2k h HIS 36 Cb 0.08 0.41 -0.03 0.00 1.55 0.00 0.00 27.41 29.42 3a2k h HIS 36 CO -0.25 -0.21 0.32 0.28 -1.30 0.00 0.00 177.93 176.78 3a2k h VAL 37 N -0.10 0.93 0.67 5.26 2.07 -0.34 -1.90 116.25 122.83 3a2k h VAL 37 Ca 0.05 -0.12 -0.03 0.00 0.82 0.00 0.00 66.70 67.42 3a2k h VAL 37 Cb 0.24 0.56 0.01 0.00 -1.52 0.00 0.00 31.29 30.58 3a2k h VAL 37 CO -0.36 0.06 -0.32 0.15 0.02 0.00 0.00 177.57 177.13 3a2k h PHE 38 N 0.34 -0.83 -0.97 1.57 3.57 0.16 -2.42 116.94 118.36 3a2k h PHE 38 Ca 0.21 -0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.81 3a2k h PHE 38 Cb 0.40 0.27 -0.13 0.00 2.79 0.00 0.00 35.95 39.28 3a2k h PHE 38 CO -0.00 -0.52 -0.49 1.28 -2.23 0.00 0.00 178.31 176.35 3a2k n LEU 39 N -4.95 -0.86 -0.32 0.59 4.77 0.17 -0.63 117.00 115.76 3a2k n LEU 39 Ca -0.11 1.71 -0.01 0.00 -0.03 0.00 0.00 56.01 57.57 3a2k n LEU 39 Cb 0.35 -0.29 0.12 0.00 -2.33 0.00 0.00 43.42 41.27 3a2k n LEU 39 CO 0.27 -1.45 1.22 0.77 -1.33 0.00 0.00 177.39 176.87 3a2k h SER 40 N 0.00 0.94 0.66 -1.43 4.64 -1.46 -1.83 113.55 115.07 3a2k h SER 40 Ca 0.23 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 3a2k h SER 40 Cb 0.47 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 3a2k h SER 40 CO -0.93 0.64 -0.19 0.18 -0.87 0.00 0.00 176.83 175.66 3a2k n LEU 41 N -4.54 0.28 0.05 5.97 7.99 -0.14 -2.45 117.00 124.17 3a2k n LEU 41 Ca 0.11 0.21 -0.16 0.00 -0.01 0.00 0.00 56.01 56.16 3a2k n LEU 41 Cb 0.10 -0.33 -0.14 0.00 -0.11 0.00 0.00 43.42 42.94 3a2k n LEU 41 CO 0.34 0.06 -0.39 0.03 -1.51 0.00 0.00 177.39 175.92 3a2k h ARG 42 N 0.16 0.22 0.37 3.23 3.08 -0.05 -1.48 114.38 119.91 3a2k h ARG 42 Ca 0.00 -0.38 -0.02 0.00 0.07 0.00 0.00 59.98 59.65 3a2k h ARG 42 Cb 0.46 0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.65 3a2k h ARG 42 CO 0.00 1.07 -0.18 -0.44 -1.07 0.00 0.00 179.97 179.35 3a2k h ASP 43 N 0.06 -0.42 -0.10 7.04 5.19 -1.49 -1.18 116.42 125.51 3a2k h ASP 43 Ca -0.26 -0.01 0.03 0.00 -0.62 0.00 0.00 57.03 56.17 3a2k h ASP 43 Cb 2.01 0.11 -0.00 0.00 0.18 0.00 0.00 39.33 41.63 3a2k h ASP 43 CO 0.15 -0.27 0.24 -0.08 -3.12 0.00 0.00 179.24 176.16 3a2k h GLU 44 N -0.55 0.00 0.00 3.56 4.81 -1.51 -3.11 114.58 117.78 3a2k h GLU 44 Ca -0.05 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.06 3a2k h GLU 44 Cb 0.41 0.00 -0.26 0.00 0.63 0.00 0.00 28.75 29.54 3a2k h GLU 44 CO 0.08 0.00 -0.85 0.91 -0.73 0.00 0.00 179.01 178.43 3a2k n TRP 45 N -3.30 0.00 -1.78 0.92 5.03 -0.56 -5.06 117.44 112.69 3a2k n TRP 45 Ca 0.00 -0.79 -0.02 0.00 3.03 0.00 0.00 57.50 59.72 3a2k n TRP 45 Cb 0.33 -0.18 0.01 0.00 -1.03 0.00 0.00 31.31 30.44 3a2k n TRP 45 CO 0.00 0.00 0.00 1.17 -0.03 0.00 0.00 177.69 178.83 3a2k n LYS 46 N -0.02 -0.35 -3.67 -0.99 4.81 -0.78 -4.77 118.16 112.38 3a2k n LYS 46 Ca 0.10 0.10 -0.11 0.00 -0.87 0.00 0.00 58.31 57.52 3a2k n LYS 46 Cb 0.99 -2.16 -0.08 0.00 0.02 0.00 0.00 35.03 33.80 3a2k n LYS 46 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 3a2k s LEU 47 N -3.13 -0.41 -0.44 3.14 1.02 -0.52 -4.14 118.68 114.20 3a2k s LEU 47 Ca 0.04 1.23 -0.15 0.00 0.02 0.00 0.00 54.13 55.26 3a2k s LEU 47 Cb -0.01 2.01 0.05 0.00 0.02 0.00 0.00 46.19 48.26 3a2k s LEU 47 CO 0.08 -0.21 0.36 -1.58 0.02 0.00 0.00 176.35 175.02 3a2k s GLN 48 N 0.84 2.98 0.20 1.70 0.74 -0.46 -4.45 119.66 121.21 3a2k s GLN 48 Ca -0.04 -1.18 -0.19 0.00 0.05 0.00 0.00 55.36 53.99 3a2k s GLN 48 Cb -0.05 -4.06 -0.08 0.00 1.10 0.00 0.00 33.01 29.92 3a2k s GLN 48 CO -0.07 -0.91 0.69 0.08 -0.55 0.00 0.00 175.29 174.54 3a2k s VAL 49 N 1.69 4.61 -0.27 1.34 1.01 -1.26 -2.84 120.40 124.66 3a2k s VAL 49 Ca 0.05 1.23 -0.03 0.00 0.00 0.00 0.00 61.98 63.23 3a2k s VAL 49 Cb -0.22 -3.85 0.11 0.00 0.00 0.00 0.00 36.38 32.42 3a2k s VAL 49 CO 0.08 0.24 0.20 -0.63 0.00 0.00 0.00 175.10 174.99 3a2k s ILE 50 N -1.48 -0.22 0.48 2.22 1.01 -1.07 -4.38 121.20 117.76 3a2k s ILE 50 Ca 0.41 -0.56 -0.23 0.00 0.00 0.00 0.00 60.65 60.27 3a2k s ILE 50 Cb -0.17 -0.93 -0.07 0.00 0.01 0.00 0.00 42.46 41.31 3a2k s ILE 50 CO 0.21 -0.56 1.26 0.00 0.00 0.00 0.00 174.94 175.85 3a2k s ALA 51 N 2.22 2.96 -0.22 9.38 0.00 -0.95 -1.74 121.76 133.41 3a2k s ALA 51 Ca 0.09 1.13 -0.04 0.00 0.00 0.00 0.00 51.96 53.13 3a2k s ALA 51 Cb -0.15 -3.47 0.12 0.00 0.00 0.00 0.00 23.12 19.62 3a2k s ALA 51 CO -0.32 -0.95 0.38 0.00 0.00 0.00 0.00 175.76 174.87 3a2k s ALA 52 N -1.41 -1.05 -0.04 0.00 0.00 -0.95 -1.66 121.76 116.65 3a2k s ALA 52 Ca 0.66 1.07 0.02 0.00 0.00 0.00 0.00 51.96 53.70 3a2k s ALA 52 Cb -0.34 -1.52 0.01 0.00 0.00 0.00 0.00 23.12 21.27 3a2k s ALA 52 CO 0.42 -1.07 -0.10 -1.58 0.00 0.00 0.00 175.76 173.42 3a2k s HIS 53 N 2.55 1.18 -0.06 0.00 5.65 -1.14 -1.91 115.29 121.57 3a2k s HIS 53 Ca 0.08 -0.36 0.02 0.00 0.25 0.00 0.00 55.06 55.04 3a2k s HIS 53 Cb -0.14 -0.87 -0.03 0.00 -1.18 0.00 0.00 32.58 30.36 3a2k s HIS 53 CO -0.14 -0.18 -0.10 0.54 -0.65 0.00 0.00 174.74 174.21 3a2k s VAL 54 N 0.46 3.48 -0.20 0.89 0.11 -1.26 -2.52 120.40 121.35 3a2k s VAL 54 Ca -0.09 -0.57 -0.06 0.00 -2.93 0.00 0.00 61.98 58.34 3a2k s VAL 54 Cb -0.12 -2.40 -0.03 0.00 -1.53 0.00 0.00 36.38 32.30 3a2k s VAL 54 CO 0.02 0.59 0.02 -0.62 -3.33 0.00 0.00 175.10 171.78 3a2k s ASP 55 N -0.79 4.97 0.72 3.54 2.15 -1.04 -4.91 116.67 121.30 3a2k s ASP 55 Ca 0.12 -0.17 -0.03 0.00 0.43 0.00 0.00 52.55 52.91 3a2k s ASP 55 Cb -0.11 -1.85 0.11 0.00 -0.30 0.00 0.00 42.92 40.77 3a2k s ASP 55 CO 0.01 0.07 1.00 -1.38 -0.17 0.00 0.00 175.17 174.70 3a2k s HIS 56 N 0.99 1.94 -0.15 -5.34 0.00 -1.26 -0.82 115.29 110.65 3a2k s HIS 56 Ca 0.02 -0.09 -0.17 0.00 -3.00 0.00 0.00 55.06 51.83 3a2k s HIS 56 Cb -0.14 -3.10 -0.04 0.00 -4.00 0.00 0.00 32.58 25.29 3a2k s HIS 56 CO 0.02 -1.65 0.42 1.41 -1.00 0.00 0.00 174.74 173.94 3a2k s MET 57 N -5.18 4.28 0.00 -0.38 1.75 -1.21 -4.26 119.30 114.30 3a2k s MET 57 Ca 0.65 0.32 0.00 0.00 -1.25 0.00 0.00 55.69 55.41 3a2k s MET 57 Cb -0.07 -3.46 0.00 0.00 2.84 0.00 0.00 34.83 34.15 3a2k s MET 57 CO 0.44 0.12 0.00 1.97 -0.65 0.00 0.00 175.02 176.91 3a2k n PHE 58 N 3.86 0.00 -1.89 4.11 1.16 -1.26 -4.99 117.46 118.45 3a2k n PHE 58 Ca -0.08 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.50 3a2k n PHE 58 Cb 0.51 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.38 3a2k n PHE 58 CO 0.00 0.00 0.00 -2.13 -1.87 0.00 0.00 176.76 172.76 3a2k n ARG 59 N 0.00 0.00 0.00 3.97 0.63 -1.26 -4.96 116.66 115.04 3a2k n ARG 59 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 3a2k n ARG 59 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 3a2k n ARG 59 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3a2k n GLY 60 N 0.00 0.44 0.26 5.14 0.00 -1.26 -3.37 105.19 106.41 3a2k n GLY 60 Ca 0.00 -0.91 0.11 0.00 0.00 0.00 0.00 46.02 45.22 3a2k n GLY 60 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3a2k h ARG 61 N 0.00 0.00 0.69 1.61 0.11 -2.00 -3.16 114.38 111.63 3a2k h ARG 61 Ca 0.00 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.05 3a2k h ARG 61 Cb 0.00 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.09 3a2k h ARG 61 CO 0.00 0.12 -0.33 0.93 0.10 0.00 0.00 179.97 180.78 3a2k h GLU 62 N 0.00 -0.90 -0.50 0.08 3.07 -1.94 -0.79 114.58 113.61 3a2k h GLU 62 Ca -0.00 0.06 0.10 0.00 -0.50 0.00 0.00 59.36 59.02 3a2k h GLU 62 Cb 0.27 0.20 -0.10 0.00 -0.84 0.00 0.00 28.75 28.28 3a2k h GLU 62 CO 0.02 -0.60 -0.24 0.66 -1.40 0.00 0.00 179.01 177.45 3a2k h SER 63 N -1.13 -0.82 0.23 1.42 4.64 -1.64 -1.65 113.55 114.60 3a2k h SER 63 Ca -0.10 0.19 -0.01 0.00 -0.47 0.00 0.00 61.79 61.40 3a2k h SER 63 Cb 0.71 0.44 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3a2k h SER 63 CO 0.16 -0.26 -0.11 -0.33 -0.87 0.00 0.00 176.83 175.42 3a2k h GLU 64 N -0.12 -0.30 -0.12 4.77 5.08 -1.61 -2.10 114.58 120.18 3a2k h GLU 64 Ca 0.23 0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.66 3a2k h GLU 64 Cb 0.49 0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.74 3a2k h GLU 64 CO -0.58 -0.20 -0.36 0.93 -1.00 0.00 0.00 179.01 177.80 3a2k h GLU 65 N -0.63 -0.43 -0.30 2.33 5.08 -1.17 0.27 114.58 119.72 3a2k h GLU 65 Ca -0.03 0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 3a2k h GLU 65 Cb 0.24 0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.54 3a2k h GLU 65 CO 0.05 -0.29 -0.30 0.93 -1.00 0.00 0.00 179.01 178.40 3a2k h GLU 66 N -0.45 -0.15 -0.51 2.33 5.08 -1.43 -1.27 114.58 118.19 3a2k h GLU 66 Ca 0.09 0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.55 3a2k h GLU 66 Cb 0.59 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.79 3a2k h GLU 66 CO -0.37 -0.10 0.03 1.98 -1.00 0.00 0.00 179.01 179.56 3a2k h MET 67 N -0.15 0.15 0.00 2.33 4.05 -0.50 -2.49 114.93 118.31 3a2k h MET 67 Ca 0.05 -0.01 -0.13 0.00 -0.28 0.00 0.00 59.70 59.34 3a2k h MET 67 Cb 0.29 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.04 3a2k h MET 67 CO -0.37 0.10 -0.60 0.93 0.23 0.00 0.00 176.91 177.20 3a2k h GLU 68 N 0.15 0.00 0.00 0.39 5.08 -0.36 -2.74 114.58 117.10 3a2k h GLU 68 Ca 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 3a2k h GLU 68 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 3a2k h GLU 68 CO -0.39 0.60 -0.13 1.19 -1.00 0.00 0.00 179.01 179.28 3a2k n PHE 69 N -3.61 0.62 -0.03 4.33 3.01 -0.49 -1.43 117.46 119.85 3a2k n PHE 69 Ca -0.00 0.18 -0.15 0.00 1.01 0.00 0.00 57.45 58.48 3a2k n PHE 69 Cb 0.65 -0.76 -0.13 0.00 -0.01 0.00 0.00 39.48 39.23 3a2k n PHE 69 CO 0.00 0.00 0.00 -0.39 1.01 0.00 0.00 176.76 177.38 3a2k h VAL 70 N 0.00 1.66 -0.58 -4.37 -1.51 -1.48 -3.27 116.25 106.70 3a2k h VAL 70 Ca 0.00 -2.23 0.09 0.00 -1.23 0.00 0.00 66.70 63.33 3a2k h VAL 70 Cb 0.67 3.15 -0.11 0.00 -2.13 0.00 0.00 31.29 32.87 3a2k h VAL 70 CO 0.00 0.60 -0.39 0.11 -1.23 0.00 0.00 177.57 176.66 3a2k h LYS 71 N -0.73 -0.19 0.00 5.19 1.79 -1.15 0.33 116.57 121.81 3a2k h LYS 71 Ca -0.04 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 3a2k h LYS 71 Cb 1.11 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.80 3a2k h LYS 71 CO 0.04 -0.13 0.00 2.89 -1.08 0.00 0.00 179.45 181.17 3a2k n ARG 72 N -5.42 0.10 0.04 3.15 1.85 -0.51 -2.15 116.66 113.71 3a2k n ARG 72 Ca 0.03 0.39 -0.22 0.00 -1.00 0.00 0.00 57.85 57.05 3a2k n ARG 72 Cb 0.35 -1.71 -0.14 0.00 -1.05 0.00 0.00 32.46 29.91 3a2k n ARG 72 CO 0.00 0.00 0.00 0.35 -0.01 0.00 0.00 177.63 177.97 3a2k h PHE 73 N 0.00 0.60 -0.67 2.89 3.57 -0.49 -2.44 116.94 120.40 3a2k h PHE 73 Ca 0.00 -0.44 0.09 0.00 3.53 0.00 0.00 57.97 61.16 3a2k h PHE 73 Cb 0.25 -0.02 -0.07 0.00 2.79 0.00 0.00 35.95 38.90 3a2k h PHE 73 CO 0.00 1.72 0.31 0.00 -2.23 0.00 0.00 178.31 178.11 3a2k h VAL 75 N 0.53 1.20 0.00 0.00 -1.51 -1.64 0.70 116.25 115.53 3a2k h VAL 75 Ca 0.33 -0.77 0.00 0.00 -1.23 0.00 0.00 66.70 65.04 3a2k h VAL 75 Cb 0.37 1.70 0.00 0.00 -2.13 0.00 0.00 31.29 31.23 3a2k h VAL 75 CO -0.28 0.19 0.17 -0.62 -1.23 0.00 0.00 177.57 175.80 3a2k n GLU 76 N -4.95 0.03 -2.41 5.19 1.02 -0.77 -1.05 120.64 117.69 3a2k n GLU 76 Ca -0.08 0.41 0.01 0.00 -0.02 0.00 0.00 57.16 57.48 3a2k n GLU 76 Cb 0.19 -1.76 0.04 0.00 -0.02 0.00 0.00 31.44 29.90 3a2k n GLU 76 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3a2k n ARG 77 N -1.55 1.19 -3.83 3.49 1.74 -0.67 -5.05 116.66 111.98 3a2k n ARG 77 Ca -0.00 -2.94 -0.32 0.00 -0.77 0.00 0.00 57.85 53.82 3a2k n ARG 77 Cb 0.17 -1.03 0.01 0.00 -1.02 0.00 0.00 32.46 30.60 3a2k n ARG 77 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3a2k n ARG 78 N -0.31 -1.02 -4.19 5.56 1.74 -0.21 -4.96 116.66 113.27 3a2k n ARG 78 Ca 0.05 0.53 -0.21 0.00 -0.77 0.00 0.00 57.85 57.45 3a2k n ARG 78 Cb 0.90 -2.87 -0.16 0.00 -1.02 0.00 0.00 32.46 29.31 3a2k n ARG 78 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3a2k s ILE 79 N -3.25 0.63 -0.03 0.55 1.01 0.23 -5.01 121.20 115.35 3a2k s ILE 79 Ca 0.24 -0.17 -0.33 0.00 0.00 0.00 0.00 60.65 60.40 3a2k s ILE 79 Cb -0.12 -0.65 -0.11 0.00 0.01 0.00 0.00 42.46 41.59 3a2k s ILE 79 CO 0.91 0.25 1.87 -0.11 0.00 0.00 0.00 174.94 177.86 3a2k n LEU 80 N 4.12 3.58 -3.14 2.97 7.94 -1.26 -4.46 117.00 126.74 3a2k n LEU 80 Ca -0.23 0.97 -0.32 0.00 -1.11 0.00 0.00 56.01 55.32 3a2k n LEU 80 Cb 0.51 -1.41 -0.01 0.00 0.53 0.00 0.00 43.42 43.03 3a2k n LEU 80 CO 0.22 -0.02 0.65 0.00 -1.11 0.00 0.00 177.39 177.14 3a2k n GLU 82 N -0.21 0.45 -3.92 0.00 4.07 -0.66 -4.88 120.64 115.48 3a2k n GLU 82 Ca 0.38 0.04 -0.21 0.00 -0.06 0.00 0.00 57.16 57.31 3a2k n GLU 82 Cb 0.36 -2.19 -0.03 0.00 -0.06 0.00 0.00 31.44 29.52 3a2k n GLU 82 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 3a2k s THR 83 N 9.44 4.69 0.22 6.31 2.01 -1.26 -2.87 115.64 134.18 3a2k s THR 83 Ca 1.20 -1.15 -0.19 0.00 0.31 0.00 0.00 61.69 61.87 3a2k s THR 83 Cb -0.91 -3.60 0.07 0.00 0.01 0.00 0.00 72.50 68.07 3a2k s THR 83 CO 0.44 -0.30 0.93 0.00 -0.69 0.00 0.00 174.62 175.00 3a2k n ALA 84 N -1.37 -2.35 -3.64 7.40 0.00 -1.05 -4.95 120.51 114.54 3a2k n ALA 84 Ca -0.07 -1.03 -0.07 0.00 0.00 0.00 0.00 53.44 52.27 3a2k n ALA 84 Cb 0.58 0.64 -0.07 0.00 0.00 0.00 0.00 19.45 20.60 3a2k n ALA 84 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3a2k s GLN 85 N -2.06 0.54 -0.09 0.00 0.74 -1.26 -2.51 119.66 115.02 3a2k s GLN 85 Ca 0.20 0.76 -0.01 0.00 0.05 0.00 0.00 55.36 56.36 3a2k s GLN 85 Cb -0.03 0.20 0.03 0.00 1.10 0.00 0.00 33.01 34.31 3a2k s GLN 85 CO 0.07 -0.08 -0.01 0.42 -0.55 0.00 0.00 175.29 175.13 3a2k s ILE 86 N 0.79 0.51 -0.31 -2.34 1.01 0.00 -4.91 121.20 115.96 3a2k s ILE 86 Ca -0.03 -0.00 0.09 0.00 0.00 0.00 0.00 60.65 60.71 3a2k s ILE 86 Cb -0.05 -0.66 0.56 0.00 0.01 0.00 0.00 42.46 42.32 3a2k s ILE 86 CO -0.10 0.25 1.58 0.47 0.00 0.00 0.00 174.94 177.14 3a2k n ASP 87 N 5.10 3.13 -1.80 3.58 8.00 -1.26 -3.29 116.55 130.01 3a2k n ASP 87 Ca -0.08 -3.59 -0.01 0.00 0.71 0.00 0.00 54.79 51.81 3a2k n ASP 87 Cb 0.50 -0.67 0.30 0.00 -0.02 0.00 0.00 41.12 41.22 3a2k n ASP 87 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3a2k n VAL 88 N -0.96 2.53 -0.27 2.53 0.24 -1.26 -4.00 118.33 117.14 3a2k n VAL 88 Ca 0.38 -1.33 0.06 0.00 -2.04 0.00 0.00 64.34 61.41 3a2k n VAL 88 Cb 1.18 -0.38 0.17 0.00 -1.47 0.00 0.00 33.84 33.34 3a2k n VAL 88 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 3a2k h PRO 89 N 2.73 0.10 0.00 7.34 0.11 -1.95 2.20 132.00 142.53 3a2k h PRO 89 Ca 0.15 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.25 3a2k h PRO 89 Cb 2.01 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 33.10 3a2k h PRO 89 CO 0.57 0.06 -0.02 0.00 -0.21 0.00 0.00 178.00 178.41 3a2k h ALA 90 N 1.73 1.91 0.00 -0.75 0.00 -1.96 0.05 119.26 120.24 3a2k h ALA 90 Ca 0.43 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.33 3a2k h ALA 90 Cb 0.77 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.56 3a2k h ALA 90 CO -0.69 0.02 -1.42 0.34 0.00 0.00 0.00 179.25 177.51 3a2k n PHE 91 N -4.43 0.00 -0.03 0.00 7.35 -0.77 -3.18 117.46 116.40 3a2k n PHE 91 Ca -0.03 0.00 -0.14 0.00 -0.76 0.00 0.00 57.45 56.52 3a2k n PHE 91 Cb 0.10 -0.22 -0.11 0.00 0.35 0.00 0.00 39.48 39.61 3a2k n PHE 91 CO 0.00 0.00 0.00 0.37 -0.76 0.00 0.00 176.76 176.37 3a2k h GLN 92 N 0.00 0.06 0.00 -4.13 5.75 0.43 -2.99 115.11 114.22 3a2k h GLN 92 Ca 0.00 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.45 3a2k h GLN 92 Cb 0.70 0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.26 3a2k h GLN 92 CO 0.00 0.73 0.00 0.54 -2.65 0.00 0.00 178.83 177.45 3a2k n ARG 93 N -4.70 0.09 -0.06 1.69 1.74 -0.06 -0.04 116.66 115.32 3a2k n ARG 93 Ca -0.09 0.29 0.11 0.00 -0.77 0.00 0.00 57.85 57.39 3a2k n ARG 93 Cb 0.37 -1.65 0.43 0.00 -1.02 0.00 0.00 32.46 30.59 3a2k n ARG 93 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3a2k n SER 94 N -1.81 1.35 -0.00 0.55 2.88 -1.17 -3.64 113.62 111.77 3a2k n SER 94 Ca 0.03 -1.63 0.02 0.00 -1.33 0.00 0.00 58.87 55.97 3a2k n SER 94 Cb 0.22 -0.08 -0.03 0.00 -0.75 0.00 0.00 64.21 63.58 3a2k n SER 94 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3a2k n ALA 95 N 0.10 2.61 0.00 -1.46 0.00 0.94 -5.02 120.51 117.69 3a2k n ALA 95 Ca 0.16 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.46 3a2k n ALA 95 Cb 0.28 -0.18 0.00 0.00 0.00 0.00 0.00 19.45 19.56 3a2k n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a2k n GLY 96 N 1.19 1.41 1.24 0.00 0.00 -1.06 -5.10 105.19 102.88 3a2k n GLY 96 Ca 0.01 -0.11 -0.07 0.00 0.00 0.00 0.00 46.02 45.84 3a2k n GLY 96 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3a2k n LEU 97 N 0.00 0.00 0.00 0.99 7.99 -1.26 -5.01 117.00 119.71 3a2k n LEU 97 Ca 0.00 -0.84 0.00 0.00 -0.01 0.00 0.00 56.01 55.16 3a2k n LEU 97 Cb 0.00 -0.09 0.00 0.00 -0.11 0.00 0.00 43.42 43.22 3a2k n LEU 97 CO 0.00 -0.50 0.00 0.61 -1.51 0.00 0.00 177.39 175.99 3a2k n GLY 98 N 2.79 1.16 0.00 -0.72 0.00 -1.26 -4.53 105.19 102.62 3a2k n GLY 98 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3a2k n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a2k n ALA 99 N -3.00 1.46 0.30 4.61 0.00 -1.26 -4.72 120.51 117.89 3a2k n ALA 99 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.59 3a2k n ALA 99 Cb 0.00 0.00 0.72 0.00 0.00 0.00 0.00 19.45 20.17 3a2k n ALA 99 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3a2k h GLN 100 N 0.00 0.00 0.63 0.00 1.08 -1.99 -0.42 115.11 114.40 3a2k h GLN 100 Ca 0.00 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.17 3a2k h GLN 100 Cb 0.00 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.44 3a2k h GLN 100 CO 0.00 0.00 -0.30 0.93 -0.95 0.00 0.00 178.83 178.51 3a2k h GLU 101 N 0.00 -0.81 -1.35 1.46 3.07 -1.99 -2.70 114.58 112.26 3a2k h GLU 101 Ca 0.03 0.06 0.39 0.00 -0.50 0.00 0.00 59.36 59.34 3a2k h GLU 101 Cb 0.88 0.18 -0.05 0.00 -0.84 0.00 0.00 28.75 28.92 3a2k h GLU 101 CO -0.00 -0.54 1.03 0.00 -1.40 0.00 0.00 179.01 178.10 3a2k h ALA 102 N -1.57 3.26 -2.20 3.43 0.00 -1.37 -0.98 119.26 119.82 3a2k h ALA 102 Ca -0.09 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3a2k h ALA 102 Cb 0.65 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3a2k h ALA 102 CO 0.14 -1.73 0.00 0.00 0.00 0.00 0.00 179.25 177.67 3a2k n ALA 103 N -2.73 -0.10 -0.20 0.00 0.00 -1.03 -1.38 120.51 115.06 3a2k n ALA 103 Ca 0.30 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.73 3a2k n ALA 103 Cb 1.46 0.09 0.23 0.00 0.00 0.00 0.00 19.45 21.23 3a2k n ALA 103 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 3a2k h ARG 104 N 0.00 0.97 -0.33 0.00 -0.00 -1.16 0.26 114.38 114.11 3a2k h ARG 104 Ca 0.00 -0.08 -0.03 0.00 -0.00 0.00 0.00 59.98 59.88 3a2k h ARG 104 Cb 0.00 -0.21 -0.01 0.00 -0.00 0.00 0.00 29.97 29.75 3a2k h ARG 104 CO 0.00 0.67 0.11 -0.84 -0.00 0.00 0.00 179.97 179.91 3a2k h ILE 105 N 0.99 1.20 0.21 0.08 3.07 -1.28 0.26 117.51 122.03 3a2k h ILE 105 Ca 0.26 -0.65 -0.01 0.00 1.55 0.00 0.00 64.86 66.01 3a2k h ILE 105 Cb -0.05 1.00 0.00 0.00 -0.27 0.00 0.00 36.82 37.50 3a2k h ILE 105 CO -0.05 0.22 -0.10 0.00 -1.05 0.00 0.00 178.15 177.17 3a2k h ARG 107 N -0.96 -0.04 -0.38 0.00 2.43 -0.52 -0.94 114.38 113.96 3a2k h ARG 107 Ca -0.03 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.10 3a2k h ARG 107 Cb 0.46 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 3a2k h ARG 107 CO 0.05 -0.02 0.08 1.88 -1.51 0.00 0.00 179.97 180.44 3a2k h TYR 108 N -0.04 0.65 -1.08 2.20 0.99 -0.52 -1.55 116.97 117.63 3a2k h TYR 108 Ca 0.25 -0.08 0.33 0.00 2.00 0.00 0.00 58.73 61.22 3a2k h TYR 108 Cb 0.52 -0.18 -0.13 0.00 1.00 0.00 0.00 36.73 37.94 3a2k h TYR 108 CO -0.91 0.64 0.65 -0.09 -0.00 0.00 0.00 178.16 178.46 3a2k h ARG 109 N 0.47 0.31 0.21 4.88 2.43 0.03 0.19 114.38 122.90 3a2k h ARG 109 Ca 0.12 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 3a2k h ARG 109 Cb 0.33 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 3a2k h ARG 109 CO 0.00 0.20 -0.10 0.35 -1.51 0.00 0.00 179.97 178.91 3a2k h PHE 110 N 0.31 -0.26 -0.91 2.20 3.04 -0.28 -2.70 116.94 118.35 3a2k h PHE 110 Ca 0.71 -0.01 0.24 0.00 3.98 0.00 0.00 57.97 62.90 3a2k h PHE 110 Cb 1.78 0.09 -0.05 0.00 2.56 0.00 0.00 35.95 40.33 3a2k h PHE 110 CO -0.01 0.14 0.63 0.74 -2.02 0.00 0.00 178.31 177.79 3a2k h PHE 111 N -0.83 0.24 -0.43 0.41 -1.00 -0.34 0.82 116.94 115.83 3a2k h PHE 111 Ca -0.03 0.01 -0.04 0.00 2.81 0.00 0.00 57.97 60.72 3a2k h PHE 111 Cb 0.51 -0.07 -0.02 0.00 3.61 0.00 0.00 35.95 39.98 3a2k h PHE 111 CO 0.06 0.05 0.09 0.00 -1.61 0.00 0.00 178.31 176.91 3a2k h ALA 112 N 1.58 0.56 -0.05 2.45 0.00 -0.52 -0.05 119.26 123.24 3a2k h ALA 112 Ca 0.45 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 55.20 3a2k h ALA 112 Cb 1.50 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 19.08 3a2k h ALA 112 CO -0.09 0.25 -0.28 0.93 0.00 0.00 0.00 179.25 180.06 3a2k h GLU 113 N 0.56 -0.38 -0.86 0.00 3.07 -0.54 -1.43 114.58 114.99 3a2k h GLU 113 Ca 0.13 0.03 0.02 0.00 -0.50 0.00 0.00 59.36 59.04 3a2k h GLU 113 Cb 0.33 0.09 -0.04 0.00 -0.84 0.00 0.00 28.75 28.29 3a2k h GLU 113 CO 0.00 -0.26 0.57 -0.07 -1.40 0.00 0.00 179.01 177.86 3a2k h LEU 114 N -0.40 0.97 -0.03 1.33 3.38 -1.03 0.66 115.31 120.20 3a2k h LEU 114 Ca 0.08 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 3a2k h LEU 114 Cb 0.51 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3a2k h LEU 114 CO -0.28 0.69 -0.05 -0.03 0.09 0.00 0.00 178.44 178.86 3a2k h MET 115 N 1.14 0.08 -0.31 1.13 4.05 -0.69 -1.66 114.93 118.66 3a2k h MET 115 Ca 0.32 -0.05 -0.12 0.00 -0.28 0.00 0.00 59.70 59.57 3a2k h MET 115 Cb -0.08 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 30.72 3a2k h MET 115 CO -0.08 0.64 -0.27 1.49 0.23 0.00 0.00 176.91 178.92 3a2k h GLU 116 N -0.47 0.73 -0.62 0.39 4.81 -1.19 -2.27 114.58 115.96 3a2k h GLU 116 Ca 0.00 -0.37 0.00 0.00 -0.13 0.00 0.00 59.36 58.86 3a2k h GLU 116 Cb 0.64 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.02 3a2k h GLU 116 CO 0.01 0.99 0.00 1.63 -0.73 0.00 0.00 179.01 180.91 3a2k n LYS 117 N -4.26 1.78 0.00 1.92 5.02 0.23 -3.61 118.16 119.24 3a2k n LYS 117 Ca -0.03 -0.75 0.00 0.00 -2.02 0.00 0.00 58.31 55.51 3a2k n LYS 117 Cb 0.46 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.99 3a2k n LYS 117 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 3a2k n HIS 118 N 0.12 0.00 -1.14 2.13 -0.00 -0.63 -4.92 115.22 110.77 3a2k n HIS 118 Ca 0.07 0.00 -0.05 0.00 0.46 0.00 0.00 57.72 58.20 3a2k n HIS 118 Cb 0.36 0.02 -0.02 0.00 -0.12 0.00 0.00 29.99 30.23 3a2k n HIS 118 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 3a2k n GLN 119 N 0.00 -1.72 -0.90 1.57 6.02 -0.97 -4.96 117.38 116.42 3a2k n GLN 119 Ca 0.00 0.64 -0.32 0.00 -0.01 0.00 0.00 57.00 57.31 3a2k n GLN 119 Cb 0.32 -5.01 0.15 0.00 1.02 0.00 0.00 30.24 26.72 3a2k n GLN 119 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3a2k n ALA 120 N 1.09 -0.47 -0.06 -1.58 0.00 -0.89 -4.89 120.51 113.70 3a2k n ALA 120 Ca -0.05 -0.44 -0.09 0.00 0.00 0.00 0.00 53.44 52.86 3a2k n ALA 120 Cb 0.50 -2.21 -0.06 0.00 0.00 0.00 0.00 19.45 17.69 3a2k n ALA 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a2k n GLY 121 N 0.46 -0.18 3.64 0.00 0.00 -0.56 -4.72 105.19 103.83 3a2k n GLY 121 Ca 0.13 -0.08 -0.26 0.00 0.00 0.00 0.00 46.02 45.80 3a2k n GLY 121 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3a2k s TYR 122 N -2.26 2.79 -0.12 1.61 4.12 -0.83 -1.88 117.35 120.79 3a2k s TYR 122 Ca -0.17 -0.16 -0.02 0.00 0.02 0.00 0.00 57.07 56.74 3a2k s TYR 122 Cb 0.05 -1.34 0.04 0.00 -1.52 0.00 0.00 41.96 39.18 3a2k s TYR 122 CO 0.29 0.53 -0.01 0.08 0.02 0.00 0.00 175.55 176.46 3a2k s VAL 123 N -1.78 0.59 -0.04 0.71 1.01 -0.87 -2.24 120.40 117.77 3a2k s VAL 123 Ca 0.27 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 62.07 3a2k s VAL 123 Cb -0.09 -0.82 -0.03 0.00 0.00 0.00 0.00 36.38 35.44 3a2k s VAL 123 CO 0.18 0.14 -0.06 0.00 0.00 0.00 0.00 175.10 175.36 3a2k s ALA 124 N 1.87 3.03 0.02 5.51 0.00 -0.99 -1.18 121.76 130.01 3a2k s ALA 124 Ca 0.03 -0.93 0.04 0.00 0.00 0.00 0.00 51.96 51.09 3a2k s ALA 124 Cb -0.14 -1.21 -0.02 0.00 0.00 0.00 0.00 23.12 21.75 3a2k s ALA 124 CO -0.07 0.59 -0.11 0.08 0.00 0.00 0.00 175.76 176.25 3a2k s VAL 125 N -0.89 0.89 -0.25 0.00 1.01 -0.64 -2.03 120.40 118.48 3a2k s VAL 125 Ca 0.14 -0.78 -0.29 0.00 0.00 0.00 0.00 61.98 61.05 3a2k s VAL 125 Cb -0.11 -0.80 0.01 0.00 0.00 0.00 0.00 36.38 35.48 3a2k s VAL 125 CO 0.04 0.03 1.08 -0.83 0.00 0.00 0.00 175.10 175.42 3a2k s GLY 126 N -0.85 1.64 -0.22 4.51 0.00 -1.26 -4.18 107.32 106.95 3a2k s GLY 126 Ca 0.01 0.13 -0.02 0.00 0.00 0.00 0.00 44.72 44.84 3a2k s GLY 126 CO 0.01 2.26 0.03 0.30 0.00 0.00 0.00 173.10 175.70 3a2k s HIS 127 N 3.42 1.37 0.53 1.90 3.76 -1.26 -4.98 115.29 120.02 3a2k s HIS 127 Ca 0.46 -1.17 -0.17 0.00 -0.15 0.00 0.00 55.06 54.02 3a2k s HIS 127 Cb -0.15 -1.25 -0.07 0.00 1.11 0.00 0.00 32.58 32.23 3a2k s HIS 127 CO 0.10 -0.69 1.02 -3.38 -0.85 0.00 0.00 174.74 170.94 3a2k s HIS 128 N 1.74 3.18 0.56 1.40 -3.43 -1.24 0.17 115.29 117.67 3a2k s HIS 128 Ca 0.00 1.52 0.41 0.00 -0.80 0.00 0.00 55.06 56.19 3a2k s HIS 128 Cb -0.17 -2.93 1.57 0.00 -1.43 0.00 0.00 32.58 29.61 3a2k s HIS 128 CO -0.11 -0.70 1.68 0.78 -2.00 0.00 0.00 174.74 174.38 3a2k h GLY 129 N 0.97 0.00 0.86 -1.38 0.00 -1.12 1.59 103.07 104.00 3a2k h GLY 129 Ca -0.48 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 46.76 3a2k h GLY 129 CO 0.59 0.00 -0.24 -0.55 0.00 0.00 0.00 176.54 176.35 3a2k h ASP 130 N 0.00 0.57 -0.84 0.19 5.19 -1.89 -1.04 116.42 118.60 3a2k h ASP 130 Ca 0.68 -0.49 0.20 0.00 -0.62 0.00 0.00 57.03 56.80 3a2k h ASP 130 Cb 2.85 -0.16 -0.12 0.00 0.18 0.00 0.00 39.33 42.08 3a2k h ASP 130 CO -0.01 0.95 0.31 0.44 -3.12 0.00 0.00 179.24 177.81 3a2k h ASP 131 N 0.21 0.20 0.75 6.45 3.32 0.19 -1.53 116.42 126.01 3a2k h ASP 131 Ca 0.03 0.15 -0.04 0.00 0.02 0.00 0.00 57.03 57.20 3a2k h ASP 131 Cb 0.80 0.17 0.01 0.00 0.22 0.00 0.00 39.33 40.52 3a2k h ASP 131 CO 0.06 -0.02 -0.36 -0.61 -1.72 0.00 0.00 179.24 176.59 3a2k h GLN 132 N 0.35 -0.97 0.00 3.56 5.75 -0.94 -2.05 115.11 120.81 3a2k h GLN 132 Ca 0.51 0.07 0.00 0.00 -0.15 0.00 0.00 58.65 59.07 3a2k h GLN 132 Cb 0.94 0.22 0.00 0.00 1.07 0.00 0.00 27.48 29.71 3a2k h GLN 132 CO -0.53 -0.65 0.00 0.28 -2.65 0.00 0.00 178.83 175.28 3a2k n VAL 133 N -4.77 0.00 -0.07 2.39 0.31 -0.42 -0.66 118.33 115.12 3a2k n VAL 133 Ca -0.13 1.33 -0.02 0.00 -0.01 0.00 0.00 64.34 65.52 3a2k n VAL 133 Cb 0.40 -1.81 -0.02 0.00 -0.91 0.00 0.00 33.84 31.50 3a2k n VAL 133 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3a2k n GLU 134 N -2.52 -0.07 -0.09 5.55 1.02 -0.60 -0.06 120.64 123.87 3a2k n GLU 134 Ca 0.00 0.27 -0.03 0.00 -0.02 0.00 0.00 57.16 57.38 3a2k n GLU 134 Cb 0.00 -0.40 0.20 0.00 -0.02 0.00 0.00 31.44 31.22 3a2k n GLU 134 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3a2k h THR 135 N 0.00 1.23 0.70 2.62 2.02 -0.13 0.12 112.91 119.48 3a2k h THR 135 Ca 0.03 -0.91 -0.03 0.00 0.77 0.00 0.00 66.41 66.26 3a2k h THR 135 Cb 0.06 0.85 0.00 0.00 -1.74 0.00 0.00 68.15 67.32 3a2k h THR 135 CO -0.15 0.32 -0.38 0.40 0.37 0.00 0.00 175.52 176.09 3a2k h ILE 136 N 0.70 0.23 0.31 3.11 1.08 0.14 0.52 117.51 123.59 3a2k h ILE 136 Ca 0.14 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.60 3a2k h ILE 136 Cb 0.39 0.23 0.00 0.00 -3.07 0.00 0.00 36.82 34.37 3a2k h ILE 136 CO 0.01 0.00 -0.15 -0.07 -0.69 0.00 0.00 178.15 177.25 3a2k h LEU 137 N -1.00 -0.36 -0.63 1.44 4.07 -1.31 0.78 115.31 118.30 3a2k h LEU 137 Ca -0.09 -0.13 0.16 0.00 0.08 0.00 0.00 57.88 57.90 3a2k h LEU 137 Cb 0.79 0.09 -0.12 0.00 1.08 0.00 0.00 40.66 42.50 3a2k h LEU 137 CO 0.13 -0.06 -0.04 0.80 -1.08 0.00 0.00 178.44 178.19 3a2k n MET 138 N -5.17 -0.05 0.01 1.13 1.56 0.40 -0.09 117.12 114.91 3a2k n MET 138 Ca -0.10 0.96 0.11 0.00 -0.27 0.00 0.00 57.70 58.41 3a2k n MET 138 Cb 0.25 -1.50 0.03 0.00 2.15 0.00 0.00 33.22 34.15 3a2k n MET 138 CO 0.00 0.00 0.00 0.54 -0.73 0.00 0.00 175.97 175.78 3a2k n ARG 139 N -4.89 0.15 0.08 2.12 5.12 0.17 -2.52 116.66 116.90 3a2k n ARG 139 Ca 0.14 -0.01 -0.12 0.00 -1.93 0.00 0.00 57.85 55.92 3a2k n ARG 139 Cb 0.44 -1.54 -0.08 0.00 -1.16 0.00 0.00 32.46 30.11 3a2k n ARG 139 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 3a2k h LEU 140 N 0.00 -0.21 -0.36 0.55 7.12 0.41 -2.88 115.31 119.94 3a2k h LEU 140 Ca 0.00 -0.30 -0.07 0.00 0.13 0.00 0.00 57.88 57.64 3a2k h LEU 140 Cb 0.62 0.06 -0.01 0.00 -0.53 0.00 0.00 40.66 40.80 3a2k h LEU 140 CO 0.00 0.23 -0.36 -0.37 -0.13 0.00 0.00 178.44 177.82 3a2k h VAL 141 N -0.72 0.67 -0.06 1.05 -1.51 -1.36 -3.02 116.25 111.30 3a2k h VAL 141 Ca -0.03 -1.72 -0.17 0.00 -1.23 0.00 0.00 66.70 63.55 3a2k h VAL 141 Cb 0.50 2.16 -0.01 0.00 -2.13 0.00 0.00 31.29 31.81 3a2k h VAL 141 CO 0.04 0.35 -0.71 -0.09 -1.23 0.00 0.00 177.57 175.93 3a2k h ARG 142 N 0.00 0.30 0.00 5.19 1.12 -1.54 -3.47 114.38 115.97 3a2k h ARG 142 Ca -0.00 -0.24 0.00 0.00 -1.11 0.00 0.00 59.98 58.62 3a2k h ARG 142 Cb 1.13 0.05 0.00 0.00 -0.01 0.00 0.00 29.97 31.14 3a2k h ARG 142 CO 0.05 0.89 0.00 0.41 -3.11 0.00 0.00 179.97 178.21 3a2k n GLY 143 N 0.51 0.82 0.45 2.80 0.00 -1.09 -4.98 105.19 103.69 3a2k n GLY 143 Ca -0.03 0.00 0.25 0.00 0.00 0.00 0.00 46.02 46.24 3a2k n GLY 143 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3a2k h SER 144 N 0.00 0.00 -0.70 1.61 0.02 -1.82 -3.44 113.55 109.21 3a2k h SER 144 Ca 0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 3a2k h SER 144 Cb 0.00 0.00 0.05 0.00 0.14 0.00 0.00 62.40 62.59 3a2k h SER 144 CO 0.00 0.00 -0.06 0.35 -1.14 0.00 0.00 176.83 175.98 3a2k n THR 145 N -3.68 0.36 0.00 -2.27 -2.24 -1.25 -3.94 114.28 101.25 3a2k n THR 145 Ca 0.14 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 3a2k n THR 145 Cb 0.95 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 3a2k n THR 145 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3a2k n SER 146 N 1.15 0.00 -0.10 3.42 3.41 -1.26 -4.69 113.62 115.54 3a2k n SER 146 Ca 0.14 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.64 3a2k n SER 146 Cb 0.09 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 63.88 3a2k n SER 146 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 3a2k n LYS 147 N 0.00 0.68 0.22 4.33 2.85 -1.26 -4.39 118.16 120.60 3a2k n LYS 147 Ca 0.00 0.02 0.12 0.00 -1.05 0.00 0.00 58.31 57.40 3a2k n LYS 147 Cb 0.00 -1.53 0.37 0.00 -0.65 0.00 0.00 35.03 33.21 3a2k n LYS 147 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 177.40 178.13 3a2k h GLY 148 N 3.74 0.00 -0.11 2.58 0.00 -1.88 -2.53 103.07 104.86 3a2k h GLY 148 Ca -0.54 0.00 0.02 0.00 0.00 0.00 0.00 47.33 46.81 3a2k h GLY 148 CO 0.02 0.00 -0.37 -1.82 0.00 0.00 0.00 176.54 174.37 3a2k h TYR 149 N 0.00 -1.11 0.00 5.60 3.20 -1.77 -3.35 116.97 119.54 3a2k h TYR 149 Ca -0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 3a2k h TYR 149 Cb 0.86 0.50 0.00 0.00 1.54 0.00 0.00 36.73 39.62 3a2k h TYR 149 CO 0.00 -0.37 0.00 0.00 -1.64 0.00 0.00 178.16 176.15 3a2k n ALA 150 N -2.88 0.00 0.00 1.82 0.00 -0.96 -4.82 120.51 113.68 3a2k n ALA 150 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3a2k n ALA 150 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.70 3a2k n ALA 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a2k n GLY 151 N 0.00 0.91 3.68 0.00 0.00 -1.26 -4.48 105.19 104.04 3a2k n GLY 151 Ca 0.00 -1.92 -0.41 0.00 0.00 0.00 0.00 46.02 43.68 3a2k n GLY 151 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a2k s ILE 152 N -2.63 4.88 -0.33 -0.61 -1.09 -1.26 -5.00 121.20 115.16 3a2k s ILE 152 Ca 0.00 1.67 -0.29 0.00 -2.23 0.00 0.00 60.65 59.80 3a2k s ILE 152 Cb 0.00 -4.15 0.02 0.00 -1.58 0.00 0.00 42.46 36.75 3a2k s ILE 152 CO 0.00 0.04 1.09 -2.84 -1.23 0.00 0.00 174.94 172.00 3a2k s PRO 153 N 2.03 4.04 0.00 2.79 0.02 -1.26 -4.96 135.00 137.66 3a2k s PRO 153 Ca 0.39 1.06 0.00 0.00 0.02 0.00 0.00 61.00 62.47 3a2k s PRO 153 Cb -0.17 -3.75 0.00 0.00 0.02 0.00 0.00 34.50 30.60 3a2k s PRO 153 CO 0.13 -0.94 0.34 0.28 -0.33 0.00 0.00 177.00 176.49 3a2k n VAL 154 N 5.94 0.00 -4.41 3.83 0.31 -1.26 -4.54 118.33 118.20 3a2k n VAL 154 Ca 0.12 0.57 -0.20 0.00 -0.01 0.00 0.00 64.34 64.82 3a2k n VAL 154 Cb 0.47 -0.79 -0.15 0.00 -0.91 0.00 0.00 33.84 32.46 3a2k n VAL 154 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 3a2k s LYS 155 N -2.05 0.85 0.03 5.55 -2.85 -1.26 -1.50 119.74 118.51 3a2k s LYS 155 Ca 0.00 -0.34 -0.04 0.00 -1.00 0.00 0.00 55.97 54.60 3a2k s LYS 155 Cb 0.00 -0.81 -0.01 0.00 -2.06 0.00 0.00 37.83 34.95 3a2k s LYS 155 CO 0.00 0.18 0.05 -0.98 0.10 0.00 0.00 175.35 174.70 3a2k s ARG 156 N -0.11 0.48 -0.75 1.78 1.70 -0.83 -4.90 118.95 116.32 3a2k s ARG 156 Ca 0.02 -0.69 -0.24 0.00 -0.47 0.00 0.00 55.73 54.35 3a2k s ARG 156 Cb -0.05 0.18 -0.16 0.00 -0.57 0.00 0.00 34.95 34.36 3a2k s ARG 156 CO -0.00 -0.11 2.41 -0.35 -1.08 0.00 0.00 175.30 176.17 3a2k n PRO 157 N 1.10 0.57 -3.45 3.89 -0.04 -1.26 -0.09 135.00 135.71 3a2k n PRO 157 Ca -0.21 -0.36 -0.43 0.00 -0.04 0.00 0.00 63.50 62.46 3a2k n PRO 157 Cb 0.57 -2.97 -0.09 0.00 -0.04 0.00 0.00 33.50 30.96 3a2k n PRO 157 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 3a2k s PHE 158 N 11.19 3.24 0.00 0.54 5.99 0.10 -4.91 117.98 134.14 3a2k s PHE 158 Ca 1.05 -0.68 0.00 0.00 0.00 0.00 0.00 56.93 57.30 3a2k s PHE 158 Cb -0.38 -2.73 0.00 0.00 0.00 0.00 0.00 43.02 39.91 3a2k s PHE 158 CO 0.26 -0.64 0.00 1.58 -0.00 0.00 0.00 175.22 176.42 3a2k n HIS 159 N 5.17 0.00 0.00 10.12 -0.00 -1.26 -1.88 115.22 127.36 3a2k n HIS 159 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.61 3a2k n HIS 159 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.45 3a2k n HIS 159 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3a2k n GLY 160 N 0.00 -0.30 0.00 1.57 0.00 -1.26 -5.01 105.19 100.19 3a2k n GLY 160 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3a2k n GLY 160 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a2k n GLY 161 N 1.96 0.74 3.48 -0.02 0.00 -0.79 -5.09 105.19 105.47 3a2k n GLY 161 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 3a2k n GLY 161 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3a2k s TYR 162 N 1.44 1.83 -0.11 1.61 4.12 -0.79 -0.72 117.35 124.73 3a2k s TYR 162 Ca 0.00 -1.14 0.01 0.00 0.02 0.00 0.00 57.07 55.96 3a2k s TYR 162 Cb 0.00 -1.19 0.02 0.00 -1.52 0.00 0.00 41.96 39.26 3a2k s TYR 162 CO 0.00 -0.17 -0.12 -1.17 0.02 0.00 0.00 175.55 174.11 3a2k s LEU 163 N -3.54 1.54 -0.09 -1.29 0.20 0.87 -2.06 118.68 114.30 3a2k s LEU 163 Ca 0.29 -0.38 0.02 0.00 0.69 0.00 0.00 54.13 54.76 3a2k s LEU 163 Cb 0.05 -0.99 -0.02 0.00 -0.43 0.00 0.00 46.19 44.81 3a2k s LEU 163 CO 0.15 -0.04 -0.16 -0.63 -0.29 0.00 0.00 176.35 175.37 3a2k s ILE 164 N 1.27 2.81 -0.55 6.68 -1.09 -0.32 -1.97 121.20 128.02 3a2k s ILE 164 Ca -0.02 -0.77 0.05 0.00 -2.23 0.00 0.00 60.65 57.68 3a2k s ILE 164 Cb -0.14 -2.13 0.35 0.00 -1.58 0.00 0.00 42.46 38.96 3a2k s ILE 164 CO -0.05 0.55 0.96 0.54 -1.23 0.00 0.00 174.94 175.71 3a2k n ARG 165 N 3.08 3.15 0.00 2.79 1.74 -0.56 -1.61 116.66 125.25 3a2k n ARG 165 Ca -0.18 -4.76 0.03 0.00 -0.77 0.00 0.00 57.85 52.17 3a2k n ARG 165 Cb 0.52 -2.21 0.14 0.00 -1.02 0.00 0.00 32.46 29.89 3a2k n ARG 165 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 3a2k n PRO 166 N -0.25 0.11 0.00 5.56 -0.02 -1.26 -0.52 135.00 138.61 3a2k n PRO 166 Ca 0.31 0.15 0.15 0.00 -2.02 0.00 0.00 63.50 62.10 3a2k n PRO 166 Cb 0.43 -1.50 0.77 0.00 -0.02 0.00 0.00 33.50 33.18 3a2k n PRO 166 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3a2k n PHE 167 N -1.18 0.00 0.18 6.00 0.99 -1.26 -3.52 117.46 118.67 3a2k n PHE 167 Ca 0.03 0.00 0.15 0.00 -0.00 0.00 0.00 57.45 57.63 3a2k n PHE 167 Cb 0.03 -0.06 0.74 0.00 -1.00 0.00 0.00 39.48 39.19 3a2k n PHE 167 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 3a2k h LEU 168 N 0.65 0.00 -1.93 4.37 5.85 0.23 -2.45 115.31 122.03 3a2k h LEU 168 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3a2k h LEU 168 Cb 0.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.24 3a2k h LEU 168 CO 0.00 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.10 3a2k h ALA 169 N 1.86 1.00 -2.90 1.25 0.00 -1.81 -2.98 119.26 115.69 3a2k h ALA 169 Ca 0.09 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 3a2k h ALA 169 Cb 0.42 0.00 -0.23 0.00 0.00 0.00 0.00 17.79 17.98 3a2k h ALA 169 CO -0.00 0.00 -0.42 0.14 0.00 0.00 0.00 179.25 178.97 3a2k s VAL 170 N -3.77 0.04 0.75 0.00 -7.23 -0.93 -4.87 120.40 104.39 3a2k s VAL 170 Ca -0.02 -0.30 -0.15 0.00 -1.81 0.00 0.00 61.98 59.70 3a2k s VAL 170 Cb 0.10 -0.43 0.04 0.00 0.56 0.00 0.00 36.38 36.65 3a2k s VAL 170 CO 0.37 -0.16 1.15 -0.24 -0.31 0.00 0.00 175.10 175.91 3a2k n SER 171 N 2.16 1.10 0.23 4.85 2.88 -1.26 -1.53 113.62 122.05 3a2k n SER 171 Ca -0.17 0.66 0.12 0.00 -1.33 0.00 0.00 58.87 58.15 3a2k n SER 171 Cb 0.57 -1.49 0.49 0.00 -0.75 0.00 0.00 64.21 63.03 3a2k n SER 171 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 3a2k h ARG 172 N -0.40 0.00 0.09 -1.46 0.11 -1.94 -2.34 114.38 108.44 3a2k h ARG 172 Ca -0.48 0.00 0.02 0.00 0.10 0.00 0.00 59.98 59.63 3a2k h ARG 172 Cb 1.32 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 32.35 3a2k h ARG 172 CO 0.48 0.16 -0.36 0.00 0.10 0.00 0.00 179.97 180.35 3a2k h ALA 173 N 1.84 -0.61 0.00 0.08 0.00 -2.00 -2.14 119.26 116.43 3a2k h ALA 173 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3a2k h ALA 173 Cb 0.71 0.60 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3a2k h ALA 173 CO 0.02 -0.91 0.00 0.39 0.00 0.00 0.00 179.25 178.76 3a2k n GLU 174 N -5.44 0.13 0.07 0.00 1.02 -0.98 -1.54 120.64 113.91 3a2k n GLU 174 Ca -0.06 0.32 -0.04 0.00 -0.02 0.00 0.00 57.16 57.35 3a2k n GLU 174 Cb 0.35 -1.72 -0.08 0.00 -0.02 0.00 0.00 31.44 29.96 3a2k n GLU 174 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3a2k h ILE 175 N 0.00 1.39 0.19 -3.67 1.08 -1.01 -2.34 117.51 113.14 3a2k h ILE 175 Ca 0.00 -3.01 -0.31 0.00 -0.39 0.00 0.00 64.86 61.15 3a2k h ILE 175 Cb 0.37 2.68 0.03 0.00 -3.07 0.00 0.00 36.82 36.82 3a2k h ILE 175 CO 0.00 0.79 -1.35 -0.33 -0.69 0.00 0.00 178.15 176.57 3a2k h GLU 176 N 0.00 0.48 -0.19 2.37 3.07 -0.68 -1.97 114.58 117.66 3a2k h GLU 176 Ca -0.04 -0.76 0.05 0.00 -0.50 0.00 0.00 59.36 58.11 3a2k h GLU 176 Cb 1.68 0.28 -0.06 0.00 -0.84 0.00 0.00 28.75 29.81 3a2k h GLU 176 CO 0.11 1.36 -0.21 0.00 -1.40 0.00 0.00 179.01 178.86 3a2k h ALA 177 N 0.33 -0.12 -0.26 3.43 0.00 -1.31 -2.24 119.26 119.09 3a2k h ALA 177 Ca -0.20 0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.66 3a2k h ALA 177 Cb 2.05 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 20.26 3a2k h ALA 177 CO 0.25 -0.65 -0.32 -0.92 0.00 0.00 0.00 179.25 177.61 3a2k h TYR 178 N -0.24 0.62 0.70 0.00 3.20 -1.50 -1.82 116.97 117.94 3a2k h TYR 178 Ca 0.12 -0.15 -0.03 0.00 3.14 0.00 0.00 58.73 61.80 3a2k h TYR 178 Cb 0.42 -0.14 0.01 0.00 1.54 0.00 0.00 36.73 38.55 3a2k h TYR 178 CO -0.34 0.80 -0.34 0.00 -1.64 0.00 0.00 178.16 176.64 3a2k h ARG 180 N -1.02 -0.24 -0.93 0.00 2.43 -1.50 -2.44 114.38 110.68 3a2k h ARG 180 Ca -0.10 0.02 0.27 0.00 -0.81 0.00 0.00 59.98 59.36 3a2k h ARG 180 Cb 0.74 0.06 -0.15 0.00 -0.42 0.00 0.00 29.97 30.19 3a2k h ARG 180 CO 0.16 0.10 0.28 1.96 -1.51 0.00 0.00 179.97 180.96 3a2k h GLN 181 N -0.63 0.16 -1.16 0.20 4.20 -1.39 0.28 115.11 116.77 3a2k h GLN 181 Ca -0.03 -0.01 -0.64 0.00 0.06 0.00 0.00 58.65 58.03 3a2k h GLN 181 Cb 0.46 -0.04 -0.35 0.00 0.30 0.00 0.00 27.48 27.86 3a2k h GLN 181 CO 0.04 0.11 0.17 -1.33 -0.67 0.00 0.00 178.83 177.15 3a2k n MET 182 N -5.25 3.09 -1.23 1.46 2.81 -0.53 -5.02 117.12 112.45 3a2k n MET 182 Ca 0.25 -3.76 0.00 0.00 -1.81 0.00 0.00 57.70 52.38 3a2k n MET 182 Cb 0.81 -2.28 0.00 0.00 -0.71 0.00 0.00 33.22 31.04 3a2k n MET 182 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3a2k n GLY 183 N -0.73 -4.44 0.00 3.03 0.00 0.99 -4.92 105.19 99.12 3a2k n GLY 183 Ca 0.52 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3a2k n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3a2k n LEU 184 N 0.87 0.00 0.00 0.99 4.32 -1.22 -4.78 117.00 117.18 3a2k n LEU 184 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 3a2k n LEU 184 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 3a2k n LEU 184 CO 0.00 0.00 0.00 -1.54 -1.22 0.00 0.00 177.39 174.63 3a2k n SER 185 N 0.00 -0.77 -2.68 -1.43 3.41 -1.26 -4.55 113.62 106.34 3a2k n SER 185 Ca 0.00 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.23 3a2k n SER 185 Cb 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 63.88 3a2k n SER 185 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 3a2k n PRO 186 N -0.77 0.00 0.00 4.33 -0.02 -1.26 -4.85 135.00 132.43 3a2k n PRO 186 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3a2k n PRO 186 Cb 0.00 -0.91 0.00 0.00 -0.02 0.00 0.00 33.50 32.57 3a2k n PRO 186 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3a2k n ARG 187 N 3.90 0.00 -2.15 -0.52 1.74 -1.26 -4.81 116.66 113.56 3a2k n ARG 187 Ca 0.29 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 57.16 3a2k n ARG 187 Cb -0.03 -0.02 0.12 0.00 -1.02 0.00 0.00 32.46 31.50 3a2k n ARG 187 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3a2k s ASP 189 N -4.59 6.56 0.00 0.00 1.11 -1.26 -4.91 116.67 113.58 3a2k s ASP 189 Ca 0.58 0.68 0.29 0.00 0.18 0.00 0.00 52.55 54.28 3a2k s ASP 189 Cb -0.03 -2.32 1.64 0.00 1.07 0.00 0.00 42.92 43.28 3a2k s ASP 189 CO 0.39 -0.31 2.07 -2.65 1.18 0.00 0.00 175.17 175.84 3a2k n PRO 190 N 5.44 1.10 -0.73 8.23 -0.02 -1.26 -3.89 135.00 143.87 3a2k n PRO 190 Ca -0.02 -0.14 -0.02 0.00 -2.02 0.00 0.00 63.50 61.30 3a2k n PRO 190 Cb 0.49 -1.46 0.22 0.00 -0.02 0.00 0.00 33.50 32.74 3a2k n PRO 190 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3a2k n SER 191 N -0.79 3.14 0.00 2.55 7.64 -1.26 -4.60 113.62 120.30 3a2k n SER 191 Ca 0.21 -3.49 0.03 0.00 1.01 0.00 0.00 58.87 56.64 3a2k n SER 191 Cb 0.14 -0.63 0.17 0.00 -1.01 0.00 0.00 64.21 62.88 3a2k n SER 191 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 3a2k n ASN 192 N -0.89 0.00 -4.44 6.43 6.94 -1.25 -4.72 115.26 117.32 3a2k n ASN 192 Ca 0.32 0.30 -0.46 0.00 -0.02 0.00 0.00 54.58 54.72 3a2k n ASN 192 Cb 1.06 -0.37 -0.12 0.00 -2.36 0.00 0.00 39.78 38.00 3a2k n ASN 192 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3a2k n GLU 193 N -1.37 0.29 0.00 -3.83 -0.58 -1.26 -4.49 120.64 109.40 3a2k n GLU 193 Ca 0.03 0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.81 3a2k n GLU 193 Cb 0.07 -1.90 0.00 0.00 -0.57 0.00 0.00 31.44 29.03 3a2k n GLU 193 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 3a2k n LYS 194 N 8.31 0.00 -0.12 3.49 4.81 -1.26 -4.97 118.16 128.42 3a2k n LYS 194 Ca 0.56 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 58.00 3a2k n LYS 194 Cb 0.11 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.16 3a2k n LYS 194 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3a2k n ASP 195 N 0.00 1.48 0.08 3.14 9.92 -1.26 -3.48 116.55 126.44 3a2k n ASP 195 Ca 0.00 -1.23 -0.10 0.00 -0.53 0.00 0.00 54.79 52.93 3a2k n ASP 195 Cb 0.00 -0.30 -0.07 0.00 -0.64 0.00 0.00 41.12 40.10 3a2k n ASP 195 CO 0.00 0.00 0.00 -0.78 0.13 0.00 0.00 177.20 176.55 3a2k h ASP 196 N 2.62 0.25 -3.63 -2.24 3.58 -1.94 -3.44 116.42 111.62 3a2k h ASP 196 Ca 0.00 -0.24 -0.66 0.00 0.42 0.00 0.00 57.03 56.56 3a2k h ASP 196 Cb 0.31 -0.08 -0.23 0.00 1.72 0.00 0.00 39.33 41.05 3a2k h ASP 196 CO 0.00 1.11 -0.61 -0.31 -2.88 0.00 0.00 179.24 176.55 3a2k s TYR 197 N -2.93 3.11 0.04 0.28 1.51 -1.23 -4.96 117.35 113.17 3a2k s TYR 197 Ca -0.02 -0.56 -0.07 0.00 -1.01 0.00 0.00 57.07 55.41 3a2k s TYR 197 Cb 0.09 -2.26 -0.02 0.00 -0.11 0.00 0.00 41.96 39.67 3a2k s TYR 197 CO 0.84 -0.42 0.39 0.25 -1.11 0.00 0.00 175.55 175.50 3a2k n THR 198 N 4.92 -0.16 -0.30 -0.71 -2.24 -1.26 0.29 114.28 114.81 3a2k n THR 198 Ca -0.16 0.61 -0.00 0.00 -2.27 0.00 0.00 64.05 62.23 3a2k n THR 198 Cb 0.50 -0.75 0.04 0.00 -2.10 0.00 0.00 70.33 68.03 3a2k n THR 198 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 3a2k n ARG 199 N -4.17 -0.17 0.19 -0.78 3.00 -1.26 -0.96 116.66 112.50 3a2k n ARG 199 Ca 0.00 1.23 -0.15 0.00 -0.00 0.00 0.00 57.85 58.94 3a2k n ARG 199 Cb 0.06 -1.82 -0.08 0.00 0.00 0.00 0.00 32.46 30.62 3a2k n ARG 199 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.63 176.72 3a2k h ASN 200 N 0.00 -0.37 -0.91 6.15 4.21 0.39 -3.01 115.58 122.04 3a2k h ASN 200 Ca 0.29 0.02 0.19 0.00 1.21 0.00 0.00 56.30 58.00 3a2k h ASN 200 Cb 0.49 0.10 -0.07 0.00 -1.12 0.00 0.00 38.32 37.72 3a2k h ASN 200 CO -0.79 -0.26 0.59 0.03 -1.29 0.00 0.00 177.43 175.71 3a2k h ARG 201 N -0.42 0.50 0.53 0.81 3.08 -0.60 1.34 114.38 119.62 3a2k h ARG 201 Ca -0.04 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 3a2k h ARG 201 Cb 0.33 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 3a2k h ARG 201 CO 0.06 0.33 -0.35 0.74 -1.07 0.00 0.00 179.97 179.68 3a2k h PHE 202 N 0.51 -0.92 -0.58 3.04 -1.00 -1.39 -1.57 116.94 115.03 3a2k h PHE 202 Ca 0.47 -0.01 0.02 0.00 2.81 0.00 0.00 57.97 61.27 3a2k h PHE 202 Cb 1.03 0.33 -0.03 0.00 3.61 0.00 0.00 35.95 40.89 3a2k h PHE 202 CO -0.00 -0.52 0.38 -0.09 -1.61 0.00 0.00 178.31 176.47 3a2k h ARG 203 N -0.84 0.69 0.23 1.51 2.43 0.16 0.38 114.38 118.94 3a2k h ARG 203 Ca -0.06 -0.04 -0.31 0.00 -0.81 0.00 0.00 59.98 58.75 3a2k h ARG 203 Cb 0.69 -0.16 0.03 0.00 -0.42 0.00 0.00 29.97 30.12 3a2k h ARG 203 CO 0.05 0.46 -1.39 0.45 -1.51 0.00 0.00 179.97 178.03 3a2k h HIS 204 N 0.71 0.90 0.00 2.20 3.86 0.02 -3.40 115.15 119.45 3a2k h HIS 204 Ca 0.22 -0.66 -0.04 0.00 -1.16 0.00 0.00 60.37 58.73 3a2k h HIS 204 Cb 0.02 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.45 3a2k h HIS 204 CO -0.00 1.53 -1.15 0.72 0.86 0.00 0.00 177.93 179.90 3a2k n HIS 205 N -3.78 0.00 0.42 2.45 8.25 -0.61 -4.76 115.22 117.18 3a2k n HIS 205 Ca -0.17 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.12 3a2k n HIS 205 Cb 1.06 -0.10 -0.08 0.00 1.12 0.00 0.00 29.99 31.99 3a2k n HIS 205 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 3a2k h ILE 206 N -0.06 0.00 -0.48 1.59 2.04 -0.71 -3.14 117.51 116.74 3a2k h ILE 206 Ca -0.06 -0.21 0.07 0.00 1.00 0.00 0.00 64.86 65.66 3a2k h ILE 206 Cb 1.07 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 37.06 3a2k h ILE 206 CO -0.03 0.00 -0.46 0.58 0.00 0.00 0.00 178.15 178.24 3a2k h VAL 207 N -1.29 0.08 -1.03 1.67 2.07 -0.61 -1.88 116.25 115.25 3a2k h VAL 207 Ca -0.11 0.00 0.27 0.00 0.82 0.00 0.00 66.70 67.68 3a2k h VAL 207 Cb 0.83 0.08 -0.11 0.00 -1.52 0.00 0.00 31.29 30.56 3a2k h VAL 207 CO 0.18 0.00 0.63 -0.65 0.02 0.00 0.00 177.57 177.76 3a2k h PRO 208 N -0.30 0.46 -0.27 1.57 0.11 -1.77 0.86 132.00 132.66 3a2k h PRO 208 Ca 0.14 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.15 3a2k h PRO 208 Cb 0.58 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.57 3a2k h PRO 208 CO -0.63 0.30 -0.15 -0.07 -0.21 0.00 0.00 178.00 177.25 3a2k h LEU 209 N 0.47 0.45 0.33 2.35 3.38 -1.30 0.24 115.31 121.24 3a2k h LEU 209 Ca 0.64 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.47 3a2k h LEU 209 Cb 1.42 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.05 3a2k h LEU 209 CO -0.41 0.63 -0.16 -0.07 0.09 0.00 0.00 178.44 178.51 3a2k h LEU 210 N 0.43 -0.38 -0.27 1.67 -0.00 0.14 -2.72 115.31 114.17 3a2k h LEU 210 Ca 0.08 0.01 0.05 0.00 -0.00 0.00 0.00 57.88 58.02 3a2k h LEU 210 Cb 0.51 0.10 -0.05 0.00 -0.00 0.00 0.00 40.66 41.22 3a2k h LEU 210 CO 0.03 -0.09 -0.07 -1.14 -0.00 0.00 0.00 178.44 177.17 3a2k n ARG 211 N -4.19 -0.03 -0.12 1.13 3.00 0.25 0.29 116.66 116.98 3a2k n ARG 211 Ca -0.06 0.42 -0.12 0.00 -0.00 0.00 0.00 57.85 58.10 3a2k n ARG 211 Cb 0.18 -0.63 -0.02 0.00 0.00 0.00 0.00 32.46 31.98 3a2k n ARG 211 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.63 179.59 3a2k h GLN 212 N 0.00 0.73 0.00 -0.14 4.20 -0.54 -2.92 115.11 116.44 3a2k h GLN 212 Ca 0.13 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.53 3a2k h GLN 212 Cb 0.19 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.94 3a2k h GLN 212 CO -0.28 0.91 -0.02 0.93 -0.67 0.00 0.00 178.83 179.70 3a2k h GLU 213 N 0.52 0.00 -1.78 1.46 4.39 0.45 -3.41 114.58 116.22 3a2k h GLU 213 Ca 0.09 0.00 0.07 0.00 0.34 0.00 0.00 59.36 59.86 3a2k h GLU 213 Cb 0.67 0.00 -0.22 0.00 -0.10 0.00 0.00 28.75 29.09 3a2k h GLU 213 CO 0.05 0.02 0.09 1.21 -1.16 0.00 0.00 179.01 179.22 3a2k s ASN 214 N -5.86 -0.86 0.29 1.42 2.47 -0.36 -5.04 114.94 107.00 3a2k s ASN 214 Ca -0.04 1.29 0.01 0.00 0.42 0.00 0.00 52.86 54.55 3a2k s ASN 214 Cb 0.14 1.61 0.44 0.00 -1.45 0.00 0.00 41.25 41.99 3a2k s ASN 214 CO 0.52 -0.20 1.78 1.55 -3.72 0.00 0.00 177.10 177.03 3a2k h PRO 215 N 7.10 0.60 -2.36 0.43 0.13 -1.80 -3.27 132.00 132.84 3a2k h PRO 215 Ca -0.25 -0.17 -0.77 0.00 -0.87 0.00 0.00 66.00 63.94 3a2k h PRO 215 Cb 1.18 -0.06 -0.30 0.00 0.13 0.00 0.00 31.00 31.94 3a2k h PRO 215 CO 0.14 0.69 0.69 0.54 -0.23 0.00 0.00 178.00 179.83 3a2k n ARG 216 N -4.20 4.87 -0.07 0.86 1.74 -1.26 -4.71 116.66 113.88 3a2k n ARG 216 Ca 0.01 -4.68 -0.07 0.00 -0.77 0.00 0.00 57.85 52.34 3a2k n ARG 216 Cb 0.32 -2.43 -0.05 0.00 -1.02 0.00 0.00 32.46 29.27 3a2k n ARG 216 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3a2k h LEU 217 N 4.21 0.00 0.00 0.55 5.85 -1.91 -3.11 115.31 120.90 3a2k h LEU 217 Ca 0.41 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.78 3a2k h LEU 217 Cb 0.41 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.44 3a2k h LEU 217 CO 1.14 0.80 0.15 0.00 -0.34 0.00 0.00 178.44 180.19 3a2k n HIS 218 N -4.67 0.00 -0.08 1.25 1.44 -1.26 -0.90 115.22 111.01 3a2k n HIS 218 Ca -0.08 0.00 -0.07 0.00 -2.01 0.00 0.00 57.72 55.56 3a2k n HIS 218 Cb 0.26 -0.21 -0.03 0.00 0.12 0.00 0.00 29.99 30.14 3a2k n HIS 218 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 3a2k n GLU 219 N -1.14 0.48 0.18 -1.40 1.02 -1.24 -3.20 120.64 115.34 3a2k n GLU 219 Ca 0.00 0.45 0.09 0.00 -0.02 0.00 0.00 57.16 57.67 3a2k n GLU 219 Cb 0.15 -1.63 0.46 0.00 -0.02 0.00 0.00 31.44 30.40 3a2k n GLU 219 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3a2k h ARG 220 N -1.00 0.00 0.03 3.49 2.47 -0.94 0.31 114.38 118.74 3a2k h ARG 220 Ca -0.03 0.00 -0.34 0.00 -1.26 0.00 0.00 59.98 58.35 3a2k h ARG 220 Cb 0.69 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.96 3a2k h ARG 220 CO -0.02 0.00 -2.02 1.19 0.56 0.00 0.00 179.97 179.68 3a2k n PHE 221 N -2.17 0.73 0.22 3.04 3.01 -0.62 -3.15 117.46 118.52 3a2k n PHE 221 Ca -0.01 0.22 -0.13 0.00 1.01 0.00 0.00 57.45 58.54 3a2k n PHE 221 Cb 0.24 -1.12 -0.07 0.00 -0.01 0.00 0.00 39.48 38.52 3a2k n PHE 221 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 3a2k h GLN 222 N 0.02 -0.57 -1.12 -1.08 5.75 -0.41 -0.02 115.11 117.69 3a2k h GLN 222 Ca -0.41 0.04 0.32 0.00 -0.15 0.00 0.00 58.65 58.45 3a2k h GLN 222 Cb 2.06 0.13 -0.04 0.00 1.07 0.00 0.00 27.48 30.69 3a2k h GLN 222 CO 0.05 -0.27 0.82 0.37 -2.65 0.00 0.00 178.83 177.15 3a2k h GLN 223 N -1.00 0.00 0.62 1.69 4.15 -1.37 0.38 115.11 119.57 3a2k h GLN 223 Ca -0.06 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.33 3a2k h GLN 223 Cb 0.56 0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.26 3a2k h GLN 223 CO 0.10 0.00 -0.30 -0.92 -1.93 0.00 0.00 178.83 175.78 3a2k h TYR 224 N 0.00 -0.77 -0.80 3.99 3.20 -1.39 -0.75 116.97 120.45 3a2k h TYR 224 Ca 0.53 -0.02 0.16 0.00 3.14 0.00 0.00 58.73 62.54 3a2k h TYR 224 Cb 2.16 0.25 -0.15 0.00 1.54 0.00 0.00 36.73 40.54 3a2k h TYR 224 CO 0.00 -0.48 -0.23 1.03 -1.64 0.00 0.00 178.16 176.84 3a2k h SER 225 N -1.16 -0.86 0.16 -2.11 0.87 0.16 0.06 113.55 110.67 3a2k h SER 225 Ca -0.08 0.25 -0.01 0.00 -1.23 0.00 0.00 61.79 60.72 3a2k h SER 225 Cb 0.63 0.53 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 3a2k h SER 225 CO 0.14 -0.28 -0.08 -0.33 -0.53 0.00 0.00 176.83 175.76 3a2k h GLU 226 N -0.02 -0.21 -0.41 2.24 5.08 -1.00 0.84 114.58 121.10 3a2k h GLU 226 Ca 0.37 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.79 3a2k h GLU 226 Cb 0.59 0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.83 3a2k h GLU 226 CO -0.83 -0.13 -0.36 1.98 -1.00 0.00 0.00 179.01 178.66 3a2k h MET 227 N -0.22 -0.15 0.00 2.33 4.05 0.53 0.11 114.93 121.58 3a2k h MET 227 Ca -0.02 0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.39 3a2k h MET 227 Cb 0.17 0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 31.00 3a2k h MET 227 CO 0.04 -0.10 -0.07 0.52 0.23 0.00 0.00 176.91 177.53 3a2k h MET 228 N -0.15 0.00 0.00 0.39 2.86 -0.93 -1.40 114.93 115.70 3a2k h MET 228 Ca 0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 3a2k h MET 228 Cb 0.33 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.99 3a2k h MET 228 CO -0.47 0.07 0.00 0.00 1.06 0.00 0.00 176.91 177.57 3a2k n ALA 229 N -2.40 -0.34 0.09 6.32 0.00 0.29 -0.51 120.51 123.96 3a2k n ALA 229 Ca -0.03 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.28 3a2k n ALA 229 Cb 0.16 0.16 -0.07 0.00 0.00 0.00 0.00 19.45 19.69 3a2k n ALA 229 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 3a2k h GLU 230 N 0.00 -0.15 -0.51 0.00 4.11 -1.12 -1.52 114.58 115.38 3a2k h GLU 230 Ca 0.00 0.01 0.08 0.00 0.07 0.00 0.00 59.36 59.52 3a2k h GLU 230 Cb 0.00 0.03 -0.10 0.00 0.50 0.00 0.00 28.75 29.18 3a2k h GLU 230 CO 0.00 -0.08 -0.44 -0.44 0.07 0.00 0.00 179.01 178.12 3a2k h ASP 231 N -0.18 -1.50 0.25 3.06 3.45 -1.32 -2.01 116.42 118.17 3a2k h ASP 231 Ca -0.02 0.24 0.01 0.00 0.43 0.00 0.00 57.03 57.69 3a2k h ASP 231 Cb 0.14 0.67 -0.03 0.00 -0.56 0.00 0.00 39.33 39.55 3a2k h ASP 231 CO 0.03 -0.35 -0.37 -0.08 -1.57 0.00 0.00 179.24 176.89 3a2k h GLU 232 N -0.27 -0.67 -0.57 3.56 4.57 -0.34 -2.99 114.58 117.87 3a2k h GLU 232 Ca 0.16 0.05 0.02 0.00 -1.18 0.00 0.00 59.36 58.40 3a2k h GLU 232 Cb 0.57 0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 29.28 3a2k h GLU 232 CO -0.64 -0.44 0.38 0.37 -1.18 0.00 0.00 179.01 177.49 3a2k h GLN 233 N -0.69 0.71 0.00 1.92 4.15 -0.90 -1.78 115.11 118.52 3a2k h GLN 233 Ca -0.00 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.38 3a2k h GLN 233 Cb 0.66 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.19 3a2k h GLN 233 CO -0.14 0.47 0.00 0.34 -1.93 0.00 0.00 178.83 177.57 3a2k n PHE 234 N -4.46 0.00 -0.27 3.99 7.35 -0.79 -2.03 117.46 121.25 3a2k n PHE 234 Ca 0.06 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 56.76 3a2k n PHE 234 Cb 0.08 -0.33 0.06 0.00 0.35 0.00 0.00 39.48 39.64 3a2k n PHE 234 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 3a2k n LEU 235 N -1.87 -0.40 -0.36 -2.13 4.32 -0.98 0.75 117.00 116.34 3a2k n LEU 235 Ca 0.00 1.27 -0.01 0.00 -0.02 0.00 0.00 56.01 57.25 3a2k n LEU 235 Cb 0.00 -0.32 0.05 0.00 -1.62 0.00 0.00 43.42 41.52 3a2k n LEU 235 CO 0.00 -1.17 0.60 -0.33 -1.22 0.00 0.00 177.39 175.27 3a2k h GLU 236 N 0.00 -0.02 -0.02 3.23 4.39 -0.87 0.67 114.58 121.96 3a2k h GLU 236 Ca 0.29 0.00 0.03 0.00 0.34 0.00 0.00 59.36 60.02 3a2k h GLU 236 Cb 0.47 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.07 3a2k h GLU 236 CO -0.74 -0.01 -0.46 1.49 -1.16 0.00 0.00 179.01 178.14 3a2k h GLU 237 N -0.02 -0.57 0.01 2.33 4.81 0.95 0.94 114.58 123.02 3a2k h GLU 237 Ca 0.35 0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.65 3a2k h GLU 237 Cb 0.61 0.13 -0.05 0.00 0.63 0.00 0.00 28.75 30.06 3a2k h GLU 237 CO -0.96 -0.38 -0.43 -0.07 -0.73 0.00 0.00 179.01 176.44 3a2k h LEU 238 N -0.60 -1.31 0.00 1.64 4.07 -0.00 -2.04 115.31 117.07 3a2k h LEU 238 Ca 0.04 0.16 0.00 0.00 0.08 0.00 0.00 57.88 58.16 3a2k h LEU 238 Cb 0.67 0.51 0.00 0.00 1.08 0.00 0.00 40.66 42.92 3a2k h LEU 238 CO -0.34 -0.47 0.00 0.00 -1.08 0.00 0.00 178.44 176.55 3a2k n ALA 239 N -2.89 0.00 -0.14 1.53 0.00 0.19 -0.01 120.51 119.19 3a2k n ALA 239 Ca -0.06 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.34 3a2k n ALA 239 Cb 0.37 0.42 -0.03 0.00 0.00 0.00 0.00 19.45 20.21 3a2k n ALA 239 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3a2k n ALA 240 N -2.67 -0.21 -0.29 0.00 0.00 0.27 -0.08 120.51 117.53 3a2k n ALA 240 Ca 0.00 0.28 -0.09 0.00 0.00 0.00 0.00 53.44 53.63 3a2k n ALA 240 Cb 0.00 0.22 -0.06 0.00 0.00 0.00 0.00 19.45 19.61 3a2k n ALA 240 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3a2k h ASP 241 N 0.00 -1.78 -0.38 0.00 3.32 -0.67 0.11 116.42 117.02 3a2k h ASP 241 Ca 0.05 0.28 0.04 0.00 0.02 0.00 0.00 57.03 57.42 3a2k h ASP 241 Cb 0.14 0.80 -0.05 0.00 0.22 0.00 0.00 39.33 40.44 3a2k h ASP 241 CO -0.31 -0.31 -0.25 0.00 -1.72 0.00 0.00 179.24 176.65 3a2k h ALA 242 N 0.58 -0.29 -0.53 3.45 0.00 0.32 -1.75 119.26 121.05 3a2k h ALA 242 Ca 0.18 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.18 3a2k h ALA 242 Cb 0.52 1.11 -0.06 0.00 0.00 0.00 0.00 17.79 19.36 3a2k h ALA 242 CO -0.80 -0.46 -0.31 -0.11 0.00 0.00 0.00 179.25 177.57 3a2k n LEU 243 N -3.94 -0.56 -0.32 0.00 7.94 0.43 0.11 117.00 120.66 3a2k n LEU 243 Ca 0.00 0.97 0.09 0.00 -1.11 0.00 0.00 56.01 55.96 3a2k n LEU 243 Cb 0.12 -0.14 0.30 0.00 0.53 0.00 0.00 43.42 44.23 3a2k n LEU 243 CO -0.05 -0.78 1.23 0.78 -1.11 0.00 0.00 177.39 177.46 3a2k h ASN 244 N 0.00 0.81 -0.11 1.96 4.21 -0.95 -0.89 115.58 120.62 3a2k h ASN 244 Ca 0.08 0.04 0.00 0.00 1.21 0.00 0.00 56.30 57.64 3a2k h ASN 244 Cb 0.22 -0.12 0.00 0.00 -1.12 0.00 0.00 38.32 37.30 3a2k h ASN 244 CO -0.49 0.43 0.00 0.29 -1.29 0.00 0.00 177.43 176.37 3a2k n LYS 245 N -4.59 1.26 0.00 0.81 5.02 0.29 -3.31 118.16 117.65 3a2k n LYS 245 Ca 0.18 -0.40 0.00 0.00 -2.02 0.00 0.00 58.31 56.07 3a2k n LYS 245 Cb 0.39 -1.10 0.00 0.00 -0.02 0.00 0.00 35.03 34.30 3a2k n LYS 245 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3a2k n VAL 246 N -0.19 0.00 -2.86 -0.18 0.31 -0.46 -4.93 118.33 110.02 3a2k n VAL 246 Ca 0.04 -0.18 -0.43 0.00 -0.01 0.00 0.00 64.34 63.76 3a2k n VAL 246 Cb 0.10 1.20 -0.04 0.00 -0.91 0.00 0.00 33.84 34.19 3a2k n VAL 246 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 3a2k s MET 247 N -0.25 3.18 0.20 5.55 -1.94 -0.50 -2.04 119.30 123.50 3a2k s MET 247 Ca 0.00 -0.65 -0.32 0.00 -1.71 0.00 0.00 55.69 53.01 3a2k s MET 247 Cb 0.00 -4.16 -0.15 0.00 2.01 0.00 0.00 34.83 32.53 3a2k s MET 247 CO 0.00 -1.68 1.23 0.39 -0.01 0.00 0.00 175.02 174.94 3a2k n GLU 248 N 7.57 1.44 0.00 2.03 1.02 -1.07 -4.86 120.64 126.78 3a2k n GLU 248 Ca -0.02 0.51 0.00 0.00 -0.02 0.00 0.00 57.16 57.63 3a2k n GLU 248 Cb 0.46 -2.05 0.00 0.00 -0.02 0.00 0.00 31.44 29.83 3a2k n GLU 248 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 3a2k n LYS 249 N 1.77 0.00 -2.33 3.49 2.85 -1.26 -3.75 118.16 118.93 3a2k n LYS 249 Ca 0.14 0.00 -0.43 0.00 -1.05 0.00 0.00 58.31 56.97 3a2k n LYS 249 Cb 0.27 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.63 3a2k n LYS 249 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 177.40 176.21 3a2k s GLN 250 N 0.74 3.52 0.00 -1.58 2.00 -1.26 -4.71 119.66 118.36 3a2k s GLN 250 Ca 0.00 0.90 0.00 0.00 -2.00 0.00 0.00 55.36 54.26 3a2k s GLN 250 Cb 0.00 -4.05 0.00 0.00 0.80 0.00 0.00 33.01 29.76 3a2k s GLN 250 CO 0.00 -1.64 0.00 0.72 -0.50 0.00 0.00 175.29 173.87 3a2k n HIS 251 N 9.04 0.00 -0.09 1.67 8.25 -1.26 -5.05 115.22 127.78 3a2k n HIS 251 Ca 0.16 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.40 3a2k n HIS 251 Cb 0.48 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.47 3a2k n HIS 251 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3a2k n ARG 252 N 0.00 0.59 -4.30 -0.41 1.74 -1.26 -4.98 116.66 108.04 3a2k n ARG 252 Ca 0.00 0.53 -0.17 0.00 -0.77 0.00 0.00 57.85 57.44 3a2k n ARG 252 Cb 0.00 -1.74 -0.10 0.00 -1.02 0.00 0.00 32.46 29.60 3a2k n ARG 252 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3a2k s ASP 253 N -6.90 2.25 0.10 0.55 1.01 -1.26 -5.15 116.67 107.27 3a2k s ASP 253 Ca -0.28 -1.00 -0.04 0.00 0.71 0.00 0.00 52.55 51.94 3a2k s ASP 253 Cb 0.06 -0.09 -0.05 0.00 1.01 0.00 0.00 42.92 43.86 3a2k s ASP 253 CO 0.61 -0.22 0.33 0.00 0.21 0.00 0.00 175.17 176.10 3a2k s ALA 254 N -3.01 3.84 0.30 5.23 0.00 -1.22 -4.89 121.76 122.01 3a2k s ALA 254 Ca 0.19 -0.61 0.09 0.00 0.00 0.00 0.00 51.96 51.63 3a2k s ALA 254 Cb -0.00 -2.07 -0.04 0.00 0.00 0.00 0.00 23.12 21.01 3a2k s ALA 254 CO 0.04 0.69 0.10 0.00 0.00 0.00 0.00 175.76 176.59 3a2k s ALA 255 N -1.56 3.39 -0.06 0.00 0.00 -1.25 -1.42 121.76 120.86 3a2k s ALA 255 Ca 0.37 -1.71 -0.02 0.00 0.00 0.00 0.00 51.96 50.59 3a2k s ALA 255 Cb -0.13 -0.82 0.04 0.00 0.00 0.00 0.00 23.12 22.22 3a2k s ALA 255 CO 0.24 0.15 0.12 -1.17 0.00 0.00 0.00 175.76 175.09 3a2k s LEU 256 N -3.78 0.42 -0.46 0.00 2.96 -0.59 -2.60 118.68 114.63 3a2k s LEU 256 Ca 0.35 0.24 -0.28 0.00 -0.22 0.00 0.00 54.13 54.22 3a2k s LEU 256 Cb -0.05 0.20 0.03 0.00 0.50 0.00 0.00 46.19 46.87 3a2k s LEU 256 CO 0.22 -0.19 1.09 -0.44 -1.32 0.00 0.00 176.35 175.70 3a2k s SER 257 N 1.68 6.63 0.25 3.68 0.01 -0.87 -1.49 113.70 123.59 3a2k s SER 257 Ca -0.03 0.45 -0.04 0.00 1.31 0.00 0.00 55.95 57.64 3a2k s SER 257 Cb -0.12 -2.53 0.48 0.00 0.21 0.00 0.00 66.02 64.06 3a2k s SER 257 CO -0.05 -1.17 1.71 0.40 0.41 0.00 0.00 173.24 174.53 3a2k h ILE 258 N 6.15 0.59 0.00 1.44 1.08 -1.34 -2.44 117.51 122.99 3a2k h ILE 258 Ca -0.23 -0.13 0.00 0.00 -0.39 0.00 0.00 64.86 64.11 3a2k h ILE 258 Cb 1.06 0.18 0.00 0.00 -3.07 0.00 0.00 36.82 35.00 3a2k h ILE 258 CO 1.10 0.07 0.00 0.61 -0.69 0.00 0.00 178.15 179.24 3a2k n GLY 259 N -1.34 -3.04 0.28 5.37 0.00 -1.26 -0.37 105.19 104.83 3a2k n GLY 259 Ca 0.15 0.27 0.07 0.00 0.00 0.00 0.00 46.02 46.50 3a2k n GLY 259 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3a2k h PRO 260 N 0.00 0.17 -0.05 1.61 0.13 -1.96 -1.36 132.00 130.53 3a2k h PRO 260 Ca 0.00 -0.01 0.01 0.00 -0.87 0.00 0.00 66.00 65.13 3a2k h PRO 260 Cb 0.00 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 31.07 3a2k h PRO 260 CO 0.00 0.11 -0.19 0.35 -0.23 0.00 0.00 178.00 178.04 3a2k h PHE 261 N 0.17 -0.56 0.00 1.56 3.57 -1.24 -2.26 116.94 118.18 3a2k h PHE 261 Ca 0.44 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.96 3a2k h PHE 261 Cb 0.79 0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.77 3a2k h PHE 261 CO -0.34 -0.19 0.00 -0.07 -2.23 0.00 0.00 178.31 175.48 3a2k h LEU 262 N -0.19 0.00 -0.71 0.59 3.38 0.34 0.42 115.31 119.14 3a2k h LEU 262 Ca 0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 3a2k h LEU 262 Cb 0.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 3a2k h LEU 262 CO -0.15 0.00 -0.10 -0.33 0.09 0.00 0.00 178.44 177.95 3a2k h GLU 263 N 0.00 0.00 -6.26 1.13 5.08 -0.74 -3.44 114.58 110.34 3a2k h GLU 263 Ca 0.00 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.04 3a2k h GLU 263 Cb 0.12 0.00 0.18 0.00 0.50 0.00 0.00 28.75 29.55 3a2k h GLU 263 CO 0.00 0.10 -0.76 1.28 -1.00 0.00 0.00 179.01 178.63 3a2k n LEU 264 N -3.17 -1.82 -4.84 1.33 4.77 0.15 -5.01 117.00 108.41 3a2k n LEU 264 Ca 0.02 -0.27 -0.37 0.00 -0.03 0.00 0.00 56.01 55.35 3a2k n LEU 264 Cb 0.46 -0.81 -0.06 0.00 -2.33 0.00 0.00 43.42 40.68 3a2k n LEU 264 CO 0.32 -3.14 0.13 -2.84 -1.33 0.00 0.00 177.39 170.53 3a2k s PRO 265 N -3.36 3.92 0.15 3.23 0.02 -1.26 -4.95 135.00 132.76 3a2k s PRO 265 Ca 0.43 0.41 -0.17 0.00 0.02 0.00 0.00 61.00 61.70 3a2k s PRO 265 Cb -0.07 -3.17 0.07 0.00 0.02 0.00 0.00 34.50 31.35 3a2k s PRO 265 CO 0.47 0.65 1.71 0.00 -0.33 0.00 0.00 177.00 179.50 3a2k h ARG 266 N 4.45 0.10 -0.95 5.54 3.08 -1.95 0.34 114.38 124.99 3a2k h ARG 266 Ca -0.51 -0.01 0.36 0.00 0.07 0.00 0.00 59.98 59.89 3a2k h ARG 266 Cb 1.21 -0.02 -0.17 0.00 0.08 0.00 0.00 29.97 31.07 3a2k h ARG 266 CO 0.63 0.07 0.36 -2.30 -1.07 0.00 0.00 179.97 177.65 3a2k n PRO 267 N -5.17 -0.06 0.05 0.04 -0.02 -1.26 0.23 135.00 128.81 3a2k n PRO 267 Ca 0.01 1.35 -0.21 0.00 -2.02 0.00 0.00 63.50 62.63 3a2k n PRO 267 Cb 0.17 -2.33 -0.15 0.00 -0.02 0.00 0.00 33.50 31.18 3a2k n PRO 267 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3a2k h LEU 268 N 0.00 0.48 -0.91 2.45 3.38 -1.39 -2.91 115.31 116.42 3a2k h LEU 268 Ca 0.73 -0.93 0.24 0.00 0.09 0.00 0.00 57.88 58.01 3a2k h LEU 268 Cb 1.83 -0.16 -0.16 0.00 0.09 0.00 0.00 40.66 42.27 3a2k h LEU 268 CO -0.78 1.45 0.09 1.56 0.09 0.00 0.00 178.44 180.85 3a2k h GLN 269 N -0.33 0.08 0.05 1.13 4.20 0.89 0.12 115.11 121.25 3a2k h GLN 269 Ca -0.18 -0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.53 3a2k h GLN 269 Cb 1.70 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 29.46 3a2k h GLN 269 CO 0.14 0.05 -0.05 -0.09 -0.67 0.00 0.00 178.83 178.21 3a2k h ARG 270 N 0.08 -0.10 -0.29 1.46 2.43 -0.87 -2.72 114.38 114.38 3a2k h ARG 270 Ca 0.55 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.76 3a2k h ARG 270 Cb 1.10 0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 30.61 3a2k h ARG 270 CO -0.79 -0.07 -0.49 0.00 -1.51 0.00 0.00 179.97 177.11 3a2k h ARG 271 N -0.11 -0.39 -0.94 0.20 2.47 -0.66 0.16 114.38 115.11 3a2k h ARG 271 Ca -0.01 0.03 0.25 0.00 -1.26 0.00 0.00 59.98 58.99 3a2k h ARG 271 Cb 0.09 0.09 -0.06 0.00 -1.65 0.00 0.00 29.97 28.44 3a2k h ARG 271 CO -0.01 -0.26 0.65 -0.39 0.56 0.00 0.00 179.97 180.52 3a2k h VAL 272 N -0.41 0.58 0.67 2.04 -1.51 -1.04 0.65 116.25 117.24 3a2k h VAL 272 Ca 0.05 -0.07 -0.03 0.00 -1.23 0.00 0.00 66.70 65.42 3a2k h VAL 272 Cb 0.55 0.35 0.01 0.00 -2.13 0.00 0.00 31.29 30.07 3a2k h VAL 272 CO -0.49 0.04 -0.32 -0.07 -1.23 0.00 0.00 177.57 175.50 3a2k h LEU 273 N 0.22 -0.77 -0.97 4.19 3.38 -0.43 0.13 115.31 121.06 3a2k h LEU 273 Ca 0.48 0.03 0.18 0.00 0.09 0.00 0.00 57.88 58.65 3a2k h LEU 273 Cb 1.52 0.20 -0.17 0.00 0.09 0.00 0.00 40.66 42.29 3a2k h LEU 273 CO -0.12 -0.41 -0.30 0.00 0.09 0.00 0.00 178.44 177.71 3a2k n GLN 274 N -5.22 -0.15 0.20 1.13 6.02 0.19 -1.25 117.38 118.30 3a2k n GLN 274 Ca -0.11 1.51 -0.14 0.00 -0.01 0.00 0.00 57.00 58.24 3a2k n GLN 274 Cb 0.36 -2.24 -0.08 0.00 1.02 0.00 0.00 30.24 29.29 3a2k n GLN 274 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 3a2k h LEU 275 N 0.00 -0.41 -0.27 1.08 3.38 -0.45 -2.22 115.31 116.44 3a2k h LEU 275 Ca 0.41 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.31 3a2k h LEU 275 Cb 0.65 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 3a2k h LEU 275 CO -0.98 -0.14 -0.16 -0.11 0.09 0.00 0.00 178.44 177.14 3a2k n LEU 276 N -5.22 -0.28 0.06 1.67 -0.00 0.46 -0.20 117.00 113.49 3a2k n LEU 276 Ca -0.10 0.81 -0.01 0.00 -0.00 0.00 0.00 56.01 56.71 3a2k n LEU 276 Cb 0.26 -0.23 0.27 0.00 -0.00 0.00 0.00 43.42 43.72 3a2k n LEU 276 CO 0.33 -0.55 0.80 -0.07 -0.00 0.00 0.00 177.39 177.89 3a2k h LEU 277 N 0.00 0.37 0.11 -1.96 3.38 -1.36 -0.57 115.31 115.28 3a2k h LEU 277 Ca 0.04 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 3a2k h LEU 277 Cb 0.11 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3a2k h LEU 277 CO -0.25 0.59 -0.06 0.25 0.09 0.00 0.00 178.44 179.06 3a2k h LEU 278 N 0.34 -0.14 -0.55 1.67 5.85 -0.29 -1.65 115.31 120.54 3a2k h LEU 278 Ca 0.06 0.01 0.11 0.00 0.84 0.00 0.00 57.88 58.90 3a2k h LEU 278 Cb 0.55 0.04 -0.11 0.00 0.37 0.00 0.00 40.66 41.52 3a2k h LEU 278 CO 0.04 -0.10 -0.17 -0.09 -0.34 0.00 0.00 178.44 177.78 3a2k h ARG 279 N -0.16 -0.03 0.00 1.25 2.43 0.05 -0.52 114.38 117.41 3a2k h ARG 279 Ca -0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3a2k h ARG 279 Cb 0.12 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 3a2k h ARG 279 CO 0.02 -0.02 0.00 1.28 -1.51 0.00 0.00 179.97 179.74 3a2k n LEU 280 N -5.40 0.00 0.00 3.80 4.77 -0.28 -4.55 117.00 115.34 3a2k n LEU 280 Ca 0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 3a2k n LEU 280 Cb 0.31 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 3a2k n LEU 280 CO 0.07 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.13 3a2k n TYR 281 N -0.99 0.00 0.00 -1.77 0.18 -0.47 -5.04 117.16 109.07 3a2k n TYR 281 Ca 0.04 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.82 3a2k n TYR 281 Cb 0.02 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 38.98 3a2k n TYR 281 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3a2k n GLY 282 N 0.00 1.64 0.74 -7.48 0.00 -0.33 -5.04 105.19 94.72 3a2k n GLY 282 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3a2k n GLY 282 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a2k n GLY 283 N 0.00 0.00 3.89 -0.02 0.00 -1.26 -4.87 105.19 102.93 3a2k n GLY 283 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 3a2k n GLY 283 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3a2k s VAL 284 N 0.00 3.32 -0.01 1.61 -7.23 -1.26 -5.04 120.40 111.79 3a2k s VAL 284 Ca 0.00 0.37 -0.11 0.00 -1.81 0.00 0.00 61.98 60.43 3a2k s VAL 284 Cb 0.00 -3.42 -0.06 0.00 0.56 0.00 0.00 36.38 33.46 3a2k s VAL 284 CO 0.00 -0.53 0.67 -0.65 -0.31 0.00 0.00 175.10 174.28 3a2k h PRO 285 N -0.65 -0.39 -2.35 4.82 0.11 -2.02 -3.34 132.00 128.18 3a2k h PRO 285 Ca -0.45 0.03 -0.43 0.00 0.11 0.00 0.00 66.00 65.26 3a2k h PRO 285 Cb 1.26 0.09 -0.06 0.00 0.11 0.00 0.00 31.00 32.40 3a2k h PRO 285 CO 0.64 -0.26 1.23 -0.35 -0.21 0.00 0.00 178.00 179.05 3a2k n PRO 286 N -3.88 2.80 -0.10 1.05 -0.04 -1.26 -4.32 135.00 129.25 3a2k n PRO 286 Ca -0.05 -1.78 0.05 0.00 -0.04 0.00 0.00 63.50 61.69 3a2k n PRO 286 Cb 0.16 -2.31 0.10 0.00 -0.04 0.00 0.00 33.50 31.41 3a2k n PRO 286 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 3a2k n THR 287 N 2.51 1.48 -0.45 0.52 5.66 -1.25 -4.80 114.28 117.94 3a2k n THR 287 Ca 0.56 -1.57 0.00 0.00 -3.05 0.00 0.00 64.05 59.99 3a2k n THR 287 Cb 0.60 0.14 0.00 0.00 -1.55 0.00 0.00 70.33 69.52 3a2k n THR 287 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 3a2k n LEU 288 N -0.72 0.00 0.00 1.09 4.77 -1.26 -4.63 117.00 116.25 3a2k n LEU 288 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 3a2k n LEU 288 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 3a2k n LEU 288 CO 0.03 0.00 0.08 0.35 -1.33 0.00 0.00 177.39 176.52 3a2k n THR 289 N 0.11 0.00 0.00 -5.08 -2.24 -1.26 -1.38 114.28 104.43 3a2k n THR 289 Ca 0.00 0.65 0.00 0.00 -2.27 0.00 0.00 64.05 62.43 3a2k n THR 289 Cb 0.00 -1.13 0.00 0.00 -2.10 0.00 0.00 70.33 67.10 3a2k n THR 289 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3a2k n SER 290 N -0.33 0.00 -0.09 3.42 7.64 -1.26 0.11 113.62 123.10 3a2k n SER 290 Ca 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.74 3a2k n SER 290 Cb 0.00 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.10 3a2k n SER 290 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 3a2k h VAL 291 N 0.00 0.01 0.04 0.44 -1.51 -1.72 -0.81 116.25 112.69 3a2k h VAL 291 Ca 0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.47 3a2k h VAL 291 Cb 0.00 0.01 0.00 0.00 -2.13 0.00 0.00 31.29 29.17 3a2k h VAL 291 CO 0.00 0.00 -0.02 0.45 -1.23 0.00 0.00 177.57 176.77 3a2k h HIS 292 N -0.47 -0.05 -0.98 5.19 3.86 0.20 -0.93 115.15 121.97 3a2k h HIS 292 Ca 0.06 -0.00 0.22 0.00 -1.16 0.00 0.00 60.37 59.49 3a2k h HIS 292 Cb 0.63 0.01 -0.19 0.00 1.06 0.00 0.00 27.41 28.93 3a2k h HIS 292 CO -0.67 -0.03 -0.17 0.82 0.86 0.00 0.00 177.93 178.74 3a2k h ILE 293 N -0.08 0.02 -0.17 2.45 2.04 -1.28 0.58 117.51 121.08 3a2k h ILE 293 Ca -0.00 -0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.89 3a2k h ILE 293 Cb 0.04 0.02 -0.07 0.00 -0.74 0.00 0.00 36.82 36.07 3a2k h ILE 293 CO 0.01 0.00 -0.48 1.23 0.00 0.00 0.00 178.15 178.91 3a2k h GLY 294 N 0.00 -0.87 0.50 5.37 0.00 -1.12 -1.06 103.07 105.88 3a2k h GLY 294 Ca 0.50 0.60 0.05 0.00 0.00 0.00 0.00 47.33 48.49 3a2k h GLY 294 CO -0.99 -0.21 -0.07 0.45 0.00 0.00 0.00 176.54 175.72 3a2k h HIS 295 N -0.52 -0.16 -0.15 5.60 3.86 0.15 0.44 115.15 124.38 3a2k h HIS 295 Ca 0.06 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.31 3a2k h HIS 295 Cb 0.65 0.11 -0.03 0.00 1.06 0.00 0.00 27.41 29.20 3a2k h HIS 295 CO -0.55 -0.12 -0.18 0.82 0.86 0.00 0.00 177.93 178.75 3a2k h ILE 296 N -0.02 0.00 -0.93 2.45 1.08 -0.94 0.37 117.51 119.53 3a2k h ILE 296 Ca 0.12 0.00 0.27 0.00 -0.39 0.00 0.00 64.86 64.86 3a2k h ILE 296 Cb 0.20 0.00 -0.16 0.00 -3.07 0.00 0.00 36.82 33.79 3a2k h ILE 296 CO -0.25 0.00 0.23 -0.07 -0.69 0.00 0.00 178.15 177.36 3a2k h LEU 297 N -0.12 -0.08 -0.24 1.44 4.07 -0.37 0.25 115.31 120.25 3a2k h LEU 297 Ca 0.03 0.23 0.01 0.00 0.08 0.00 0.00 57.88 58.22 3a2k h LEU 297 Cb 0.19 0.33 -0.01 0.00 1.08 0.00 0.00 40.66 42.25 3a2k h LEU 297 CO -0.20 -0.25 0.15 -0.03 -1.08 0.00 0.00 178.44 177.03 3a2k h MET 298 N 0.13 0.30 0.00 1.13 4.05 0.56 -2.33 114.93 118.77 3a2k h MET 298 Ca 0.61 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 60.01 3a2k h MET 298 Cb 1.32 -0.07 0.00 0.00 -0.80 0.00 0.00 31.60 32.05 3a2k h MET 298 CO -0.75 0.20 0.08 -0.11 0.23 0.00 0.00 176.91 176.57 3a2k n LEU 299 N -4.93 0.48 -0.00 3.39 -0.00 0.12 -1.37 117.00 114.69 3a2k n LEU 299 Ca -0.02 0.69 0.06 0.00 -0.00 0.00 0.00 56.01 56.74 3a2k n LEU 299 Cb 0.03 -0.73 -0.08 0.00 -0.00 0.00 0.00 43.42 42.64 3a2k n LEU 299 CO 0.33 -0.86 -0.55 0.00 -0.00 0.00 0.00 177.39 176.31 3a2k n GLU 301 N -1.81 0.31 -0.97 0.00 1.02 -0.74 -4.95 120.64 113.50 3a2k n GLU 301 Ca -0.02 -0.23 -0.37 0.00 -0.02 0.00 0.00 57.16 56.53 3a2k n GLU 301 Cb 0.28 -1.50 0.05 0.00 -0.02 0.00 0.00 31.44 30.25 3a2k n GLU 301 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3a2k n ARG 302 N -1.15 -0.10 -0.06 3.49 5.12 -0.47 -4.95 116.66 118.55 3a2k n ARG 302 Ca 0.07 -0.03 -0.22 0.00 -1.93 0.00 0.00 57.85 55.74 3a2k n ARG 302 Cb 0.36 -1.08 -0.13 0.00 -1.16 0.00 0.00 32.46 30.45 3a2k n ARG 302 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3a2k n GLY 303 N 3.32 -0.63 3.63 -0.13 0.00 -1.26 -4.90 105.19 105.22 3a2k n GLY 303 Ca -0.01 -0.13 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 3a2k n GLY 303 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3a2k s ARG 304 N -2.48 3.81 0.20 1.61 0.52 -1.26 -4.92 118.95 116.43 3a2k s ARG 304 Ca -0.27 1.69 -0.09 0.00 -0.52 0.00 0.00 55.73 56.54 3a2k s ARG 304 Cb 0.07 -4.03 0.13 0.00 0.52 0.00 0.00 34.95 31.63 3a2k s ARG 304 CO 0.67 -1.27 1.75 -1.35 0.02 0.00 0.00 175.30 175.12 3a2k h PRO 305 N 10.69 1.10 -6.31 3.54 0.11 -1.92 -3.41 132.00 135.79 3a2k h PRO 305 Ca -0.34 -0.21 -0.55 0.00 0.11 0.00 0.00 66.00 65.01 3a2k h PRO 305 Cb 1.15 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 32.07 3a2k h PRO 305 CO 1.00 0.92 0.57 -1.12 -0.21 0.00 0.00 178.00 179.15 3a2k s SER 306 N -6.30 7.21 -0.29 -2.05 0.01 -1.26 -3.35 113.70 107.67 3a2k s SER 306 Ca -0.12 1.66 -0.07 0.00 1.31 0.00 0.00 55.95 58.72 3a2k s SER 306 Cb 0.15 -2.56 0.14 0.00 0.21 0.00 0.00 66.02 63.96 3a2k s SER 306 CO 0.83 -0.45 0.61 -0.83 0.41 0.00 0.00 173.24 173.81 3a2k s GLY 307 N 1.18 -0.76 0.07 3.44 0.00 -1.22 -4.98 107.32 105.04 3a2k s GLY 307 Ca 0.52 2.12 0.04 0.00 0.00 0.00 0.00 44.72 47.39 3a2k s GLY 307 CO 0.21 3.09 0.01 1.06 0.00 0.00 0.00 173.10 177.48 3a2k s MET 308 N 2.86 2.66 -0.11 2.90 -1.94 -1.26 -1.98 119.30 122.43 3a2k s MET 308 Ca 0.02 -0.76 -0.06 0.00 -1.71 0.00 0.00 55.69 53.18 3a2k s MET 308 Cb -0.13 -2.60 0.04 0.00 2.01 0.00 0.00 34.83 34.15 3a2k s MET 308 CO -0.19 0.57 0.25 0.42 -0.01 0.00 0.00 175.02 176.06 3a2k s ILE 309 N -1.27 -0.03 -0.17 2.53 1.01 -0.87 -5.01 121.20 117.39 3a2k s ILE 309 Ca 0.25 0.12 -0.09 0.00 0.00 0.00 0.00 60.65 60.93 3a2k s ILE 309 Cb -0.12 -0.38 -0.05 0.00 0.01 0.00 0.00 42.46 41.92 3a2k s ILE 309 CO 0.17 0.05 0.15 -1.81 0.00 0.00 0.00 174.94 173.50 3a2k s ASP 310 N 1.10 6.29 0.39 3.58 1.01 -1.26 -1.95 116.67 125.83 3a2k s ASP 310 Ca -0.08 0.33 0.05 0.00 0.71 0.00 0.00 52.55 53.56 3a2k s ASP 310 Cb -0.09 -2.09 -0.07 0.00 1.01 0.00 0.00 42.92 41.68 3a2k s ASP 310 CO -0.07 0.25 0.03 -0.76 0.21 0.00 0.00 175.17 174.82 3a2k s LEU 311 N -0.07 2.58 0.49 1.23 1.43 0.19 -5.01 118.68 119.52 3a2k s LEU 311 Ca 0.11 -1.40 -0.23 0.00 -1.03 0.00 0.00 54.13 51.57 3a2k s LEU 311 Cb -0.12 -0.69 -0.06 0.00 0.03 0.00 0.00 46.19 45.35 3a2k s LEU 311 CO 0.00 -0.55 1.31 -2.16 0.23 0.00 0.00 176.35 175.19 3a2k s PRO 312 N -3.78 3.49 -1.39 1.29 0.04 -1.26 -2.54 135.00 130.84 3a2k s PRO 312 Ca 0.33 2.14 -0.07 0.00 0.04 0.00 0.00 61.00 63.44 3a2k s PRO 312 Cb 0.09 -2.42 0.03 0.00 0.04 0.00 0.00 34.50 32.24 3a2k s PRO 312 CO 0.16 -0.88 0.91 1.63 0.04 0.00 0.00 177.00 178.86 3a2k n LYS 313 N -0.61 -5.77 -2.19 4.56 5.02 -1.26 -3.09 118.16 114.81 3a2k n LYS 313 Ca 0.08 0.66 -0.12 0.00 -2.02 0.00 0.00 58.31 56.91 3a2k n LYS 313 Cb 0.45 -5.47 -0.02 0.00 -0.02 0.00 0.00 35.03 29.98 3a2k n LYS 313 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3a2k n GLY 314 N -1.64 -0.12 3.74 0.72 0.00 -1.05 -4.91 105.19 101.92 3a2k n GLY 314 Ca -0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 3a2k n GLY 314 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3a2k s LEU 315 N -5.14 4.57 0.05 0.99 0.20 -1.06 -4.65 118.68 113.65 3a2k s LEU 315 Ca 0.00 1.93 0.06 0.00 0.69 0.00 0.00 54.13 56.81 3a2k s LEU 315 Cb 0.00 -3.60 -0.03 0.00 -0.43 0.00 0.00 46.19 42.13 3a2k s LEU 315 CO 0.00 0.02 -0.18 -0.54 -0.29 0.00 0.00 176.35 175.36 3a2k s LYS 316 N -0.69 1.12 -0.08 1.98 1.02 -1.03 0.56 119.74 122.63 3a2k s LYS 316 Ca 0.44 -0.90 -0.00 0.00 0.02 0.00 0.00 55.97 55.53 3a2k s LYS 316 Cb -0.26 -1.21 0.02 0.00 -0.52 0.00 0.00 37.83 35.87 3a2k s LYS 316 CO 0.32 0.30 -0.04 0.08 -0.92 0.00 0.00 175.35 175.09 3a2k s VAL 317 N -0.91 0.63 -0.02 3.17 1.01 -0.82 -2.49 120.40 120.96 3a2k s VAL 317 Ca 0.04 -0.08 0.05 0.00 0.00 0.00 0.00 61.98 62.00 3a2k s VAL 317 Cb -0.09 -0.71 -0.01 0.00 0.00 0.00 0.00 36.38 35.58 3a2k s VAL 317 CO 0.02 0.29 -0.18 -0.63 0.00 0.00 0.00 175.10 174.60 3a2k s ILE 318 N 1.59 1.42 -0.18 2.22 1.09 -0.50 -2.05 121.20 124.79 3a2k s ILE 318 Ca 0.00 -0.75 -0.05 0.00 -1.10 0.00 0.00 60.65 58.75 3a2k s ILE 318 Cb -0.13 -1.19 -0.03 0.00 -1.06 0.00 0.00 42.46 40.05 3a2k s ILE 318 CO -0.04 0.40 0.01 -0.60 -0.10 0.00 0.00 174.94 174.61 3a2k s ARG 319 N -0.26 3.74 -0.40 2.79 3.52 -0.84 -0.42 118.95 127.09 3a2k s ARG 319 Ca 0.03 -0.47 0.04 0.00 -0.13 0.00 0.00 55.73 55.20 3a2k s ARG 319 Cb -0.09 -3.07 0.11 0.00 -1.56 0.00 0.00 34.95 30.35 3a2k s ARG 319 CO 0.00 0.16 0.12 0.45 -0.81 0.00 0.00 175.30 175.23 3a2k s SER 320 N 0.61 4.57 0.68 -2.12 0.15 -1.18 -3.38 113.70 113.03 3a2k s SER 320 Ca -0.00 -2.43 0.00 0.00 0.70 0.00 0.00 55.95 54.22 3a2k s SER 320 Cb -0.14 -1.59 0.00 0.00 -1.71 0.00 0.00 66.02 62.58 3a2k s SER 320 CO 0.02 -0.33 0.00 -1.22 1.20 0.00 0.00 173.24 172.91 3a2k n TYR 321 N 3.88 0.00 0.80 3.44 4.02 -1.21 -0.10 117.16 127.99 3a2k n TYR 321 Ca 0.04 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 58.02 3a2k n TYR 321 Cb 0.39 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.67 3a2k n TYR 321 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 3a2k n ASP 322 N 6.37 1.38 -4.93 7.72 -0.08 -1.26 -4.95 116.55 120.81 3a2k n ASP 322 Ca 0.00 -1.19 -0.26 0.00 -1.51 0.00 0.00 54.79 51.83 3a2k n ASP 322 Cb 0.00 0.68 0.04 0.00 2.34 0.00 0.00 41.12 44.17 3a2k n ASP 322 CO 0.00 0.00 0.00 -0.60 0.12 0.00 0.00 177.20 176.72 3a2k s ARG 323 N -2.27 2.78 -0.34 -0.67 3.52 0.86 -0.97 118.95 121.86 3a2k s ARG 323 Ca 0.12 -0.13 0.02 0.00 -0.13 0.00 0.00 55.73 55.60 3a2k s ARG 323 Cb 0.14 -2.29 0.15 0.00 -1.56 0.00 0.00 34.95 31.39 3a2k s ARG 323 CO 0.55 -0.76 0.33 0.00 -0.81 0.00 0.00 175.30 174.60 3a2k s LEU 325 N 1.75 4.28 -0.34 0.00 1.43 0.44 -1.54 118.68 124.70 3a2k s LEU 325 Ca 0.14 1.70 -0.05 0.00 -1.03 0.00 0.00 54.13 54.89 3a2k s LEU 325 Cb -0.15 -3.56 0.05 0.00 0.03 0.00 0.00 46.19 42.56 3a2k s LEU 325 CO -0.14 -0.49 0.09 -0.36 0.23 0.00 0.00 176.35 175.68 3a2k s PHE 326 N 1.94 3.29 -0.08 0.29 0.40 -0.51 -1.41 117.98 121.90 3a2k s PHE 326 Ca 0.53 -1.64 -0.01 0.00 -0.60 0.00 0.00 56.93 55.21 3a2k s PHE 326 Cb -0.22 -2.34 0.03 0.00 0.51 0.00 0.00 43.02 41.00 3a2k s PHE 326 CO 0.21 -0.78 -0.02 -0.08 0.70 0.00 0.00 175.22 175.26 3a2k s THR 327 N 1.34 0.52 -0.69 0.64 -1.32 -1.04 -3.44 115.64 111.66 3a2k s THR 327 Ca -0.02 0.02 0.26 0.00 -1.21 0.00 0.00 61.69 60.74 3a2k s THR 327 Cb -0.20 -0.64 0.29 0.00 -1.51 0.00 0.00 72.50 70.44 3a2k s THR 327 CO 0.01 0.28 1.76 2.19 -2.21 0.00 0.00 174.62 176.66 3a2k h PHE 328 N 8.23 0.00 0.00 9.09 -0.00 -1.83 -2.72 116.94 129.71 3a2k h PHE 328 Ca -0.23 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.74 3a2k h PHE 328 Cb 1.13 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.08 3a2k h PHE 328 CO 0.48 0.00 0.00 -3.47 -0.00 0.00 0.00 178.31 175.32 3a2k n ASP 329 N -2.32 0.00 0.00 -0.68 2.03 -1.26 -4.50 116.55 109.82 3a2k n ASP 329 Ca 0.05 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.36 3a2k n ASP 329 Cb 0.42 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.82 3a2k n ASP 329 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3a2k n ALA 330 N -3.00 0.00 0.00 -1.67 0.00 -1.26 -4.99 120.51 109.59 3a2k n ALA 330 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3a2k n ALA 330 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3a2k n ALA 330 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3a2k n GLU 331 N -0.01 0.00 -2.95 0.00 1.02 -1.26 -4.97 120.64 112.47 3a2k n GLU 331 Ca 0.00 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.74 3a2k n GLU 331 Cb 0.00 -0.62 -0.05 0.00 -0.02 0.00 0.00 31.44 30.75 3a2k n GLU 331 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 3a2k s SER 332 N -4.56 7.16 0.00 1.62 0.01 -1.26 -4.54 113.70 112.14 3a2k s SER 332 Ca 0.00 1.40 0.00 0.00 1.31 0.00 0.00 55.95 58.66 3a2k s SER 332 Cb 0.00 -2.47 0.00 0.00 0.21 0.00 0.00 66.02 63.76 3a2k s SER 332 CO 0.00 -0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.18 3a2k n GLY 333 N 2.74 0.96 0.00 3.44 0.00 -1.26 -5.20 105.19 105.87 3a2k n GLY 333 Ca -0.00 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.99 3a2k n GLY 333 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3a2k n GLU 334 N 0.00 0.00 -3.67 1.61 1.02 -1.26 -5.16 120.64 113.18 3a2k n GLU 334 Ca 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.15 3a2k n GLU 334 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 31.43 3a2k n GLU 334 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3a2k n LYS 335 N 0.84 0.25 0.00 3.49 5.02 -1.26 -5.12 118.16 121.38 3a2k n LYS 335 Ca 0.00 -0.82 0.00 0.00 -2.02 0.00 0.00 58.31 55.47 3a2k n LYS 335 Cb 0.00 1.26 0.00 0.00 -0.02 0.00 0.00 35.03 36.27 3a2k n LYS 335 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3a2k n GLY 336 N -0.76 3.14 3.61 0.72 0.00 -1.26 -5.11 105.19 105.53 3a2k n GLY 336 Ca 0.02 -1.96 -0.04 0.00 0.00 0.00 0.00 46.02 44.04 3a2k n GLY 336 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3a2k s TYR 337 N -2.93 -0.13 -0.12 1.61 -0.00 -1.26 -5.01 117.35 109.51 3a2k s TYR 337 Ca 0.00 0.15 -0.05 0.00 -0.00 0.00 0.00 57.07 57.17 3a2k s TYR 337 Cb 0.00 0.50 0.06 0.00 -0.00 0.00 0.00 41.96 42.52 3a2k s TYR 337 CO 0.00 -0.16 0.24 -0.46 -0.00 0.00 0.00 175.55 175.17 3a2k s TRP 338 N -1.79 -0.36 0.01 -3.49 -0.11 -1.26 -1.13 118.94 110.80 3a2k s TRP 338 Ca 0.08 0.87 0.02 0.00 1.22 0.00 0.00 56.10 58.29 3a2k s TRP 338 Cb -0.01 -0.06 -0.01 0.00 -1.50 0.00 0.00 33.47 31.90 3a2k s TRP 338 CO -0.05 -0.31 -0.07 -0.06 -4.62 0.00 0.00 176.95 171.84 3a2k s PHE 339 N 2.13 0.62 0.57 5.86 2.99 -0.91 -5.01 117.98 124.24 3a2k s PHE 339 Ca -0.01 -0.19 -0.17 0.00 0.00 0.00 0.00 56.93 56.57 3a2k s PHE 339 Cb -0.12 -0.39 -0.05 0.00 0.00 0.00 0.00 43.02 42.46 3a2k s PHE 339 CO -0.08 -0.02 1.05 -1.21 -0.00 0.00 0.00 175.22 174.97 3a2k s GLU 340 N -0.44 3.43 -0.50 0.44 2.02 -1.26 -1.17 118.70 121.21 3a2k s GLU 340 Ca 0.00 1.25 -0.06 0.00 0.02 0.00 0.00 54.97 56.18 3a2k s GLU 340 Cb -0.04 -2.05 0.13 0.00 0.10 0.00 0.00 34.13 32.28 3a2k s GLU 340 CO -0.00 -0.73 0.34 -1.17 0.02 0.00 0.00 175.26 173.72 3a2k s LEU 341 N -4.26 5.49 0.26 1.80 2.96 1.71 -4.78 118.68 121.86 3a2k s LEU 341 Ca 0.65 -2.21 -0.30 0.00 -0.22 0.00 0.00 54.13 52.05 3a2k s LEU 341 Cb -0.16 -1.92 -0.10 0.00 0.50 0.00 0.00 46.19 44.51 3a2k s LEU 341 CO 0.33 -0.56 1.39 -2.84 -1.32 0.00 0.00 176.35 173.35 3a2k s PRO 342 N 0.90 4.31 -0.05 0.98 0.02 -1.26 -4.02 135.00 135.89 3a2k s PRO 342 Ca 0.10 2.24 0.01 0.00 0.02 0.00 0.00 61.00 63.37 3a2k s PRO 342 Cb -0.23 -3.11 0.02 0.00 0.02 0.00 0.00 34.50 31.20 3a2k s PRO 342 CO -0.03 -0.34 -0.04 0.54 -0.33 0.00 0.00 177.00 176.80 3a2k s VAL 343 N -0.25 0.52 0.57 3.83 0.11 -1.26 -3.60 120.40 120.33 3a2k s VAL 343 Ca 0.56 -0.11 -0.14 0.00 -2.93 0.00 0.00 61.98 59.37 3a2k s VAL 343 Cb -0.40 -0.56 -0.05 0.00 -1.53 0.00 0.00 36.38 33.83 3a2k s VAL 343 CO 0.45 0.23 1.02 -2.84 -3.33 0.00 0.00 175.10 170.62 3a2k s PRO 344 N 0.97 3.67 -0.10 1.54 0.02 -1.26 -5.04 135.00 134.80 3a2k s PRO 344 Ca -0.10 0.92 -0.33 0.00 0.02 0.00 0.00 61.00 61.51 3a2k s PRO 344 Cb -0.14 -2.09 0.13 0.00 0.02 0.00 0.00 34.50 32.42 3a2k s PRO 344 CO -0.00 -0.51 1.26 0.00 -0.33 0.00 0.00 177.00 177.43 3a2k s ALA 345 N -2.83 -2.18 -0.43 -1.55 0.00 -1.11 -4.98 121.76 108.68 3a2k s ALA 345 Ca 0.58 1.12 0.03 0.00 0.00 0.00 0.00 51.96 53.70 3a2k s ALA 345 Cb -0.11 0.13 0.12 0.00 0.00 0.00 0.00 23.12 23.25 3a2k s ALA 345 CO 0.42 -0.85 0.17 -1.17 0.00 0.00 0.00 175.76 174.33 3a2k s LEU 346 N -2.61 4.15 -0.26 0.00 0.20 -1.26 -2.17 118.68 116.72 3a2k s LEU 346 Ca 0.12 -2.58 -0.17 0.00 0.69 0.00 0.00 54.13 52.19 3a2k s LEU 346 Cb 0.02 -1.52 -0.03 0.00 -0.43 0.00 0.00 46.19 44.24 3a2k s LEU 346 CO -0.04 -0.30 0.47 -0.22 -0.29 0.00 0.00 176.35 175.97 3a2k s LEU 347 N 0.33 4.05 -0.04 -0.68 0.20 -0.85 -4.98 118.68 116.71 3a2k s LEU 347 Ca 0.14 0.46 -0.19 0.00 0.69 0.00 0.00 54.13 55.24 3a2k s LEU 347 Cb -0.23 -2.59 -0.05 0.00 -0.43 0.00 0.00 46.19 42.89 3a2k s LEU 347 CO -0.04 -0.25 0.52 -2.84 -0.29 0.00 0.00 176.35 173.45 3a2k s PRO 348 N 2.19 4.26 -0.06 0.98 0.02 -1.26 -1.29 135.00 139.84 3a2k s PRO 348 Ca 0.19 0.58 -0.01 0.00 0.02 0.00 0.00 61.00 61.79 3a2k s PRO 348 Cb -0.16 -3.35 -0.03 0.00 0.02 0.00 0.00 34.50 30.98 3a2k s PRO 348 CO 0.09 0.35 -0.00 -0.51 -0.33 0.00 0.00 177.00 176.60 3a2k s LEU 349 N -0.07 3.53 0.00 -5.54 1.43 0.63 -4.97 118.68 113.69 3a2k s LEU 349 Ca 0.28 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.46 3a2k s LEU 349 Cb -0.17 -1.88 0.00 0.00 0.03 0.00 0.00 46.19 44.17 3a2k s LEU 349 CO 0.14 0.34 0.18 -2.65 0.23 0.00 0.00 176.35 174.60 3a2k n PRO 350 N 1.89 0.00 -2.57 1.29 -0.02 -1.26 -2.20 135.00 132.13 3a2k n PRO 350 Ca -0.17 0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.04 3a2k n PRO 350 Cb 0.53 -1.35 -0.01 0.00 -0.02 0.00 0.00 33.50 32.65 3a2k n PRO 350 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 3a2k n ASN 351 N -0.61 4.68 -0.35 2.55 0.23 -1.26 -4.95 115.26 115.55 3a2k n ASN 351 Ca 0.00 -3.71 -0.02 0.00 -0.53 0.00 0.00 54.58 50.31 3a2k n ASN 351 Cb 0.00 -0.48 -0.01 0.00 -2.08 0.00 0.00 39.78 37.21 3a2k n ASN 351 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3a2k n GLY 352 N -0.43 0.24 3.10 4.83 0.00 -0.93 -4.86 105.19 107.13 3a2k n GLY 352 Ca 0.37 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.12 3a2k n GLY 352 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3a2k n TYR 353 N -1.07 1.00 -3.54 1.61 4.02 -1.23 -2.35 117.16 115.59 3a2k n TYR 353 Ca -0.02 -2.13 -0.07 0.00 -0.01 0.00 0.00 57.90 55.66 3a2k n TYR 353 Cb 0.24 -0.29 -0.02 0.00 -0.02 0.00 0.00 39.34 39.25 3a2k n TYR 353 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3a2k s ALA 354 N -2.74 -1.92 0.02 -0.72 0.00 0.73 -0.27 121.76 116.86 3a2k s ALA 354 Ca 0.00 1.28 0.06 0.00 0.00 0.00 0.00 51.96 53.30 3a2k s ALA 354 Cb -0.00 0.09 -0.03 0.00 0.00 0.00 0.00 23.12 23.18 3a2k s ALA 354 CO 0.00 -0.61 -0.15 0.42 0.00 0.00 0.00 175.76 175.42 3a2k s ILE 355 N -2.64 2.99 -0.10 0.00 1.01 -0.41 -1.13 121.20 120.92 3a2k s ILE 355 Ca 0.06 -1.05 0.02 0.00 0.00 0.00 0.00 60.65 59.68 3a2k s ILE 355 Cb -0.01 -2.26 0.01 0.00 0.01 0.00 0.00 42.46 40.21 3a2k s ILE 355 CO -0.06 0.37 -0.17 -0.63 0.00 0.00 0.00 174.94 174.45 3a2k s ILE 356 N -0.92 1.54 -0.01 2.92 1.01 0.10 -2.00 121.20 123.85 3a2k s ILE 356 Ca 0.15 -0.69 0.05 0.00 0.00 0.00 0.00 60.65 60.15 3a2k s ILE 356 Cb -0.11 -1.39 -0.03 0.00 0.01 0.00 0.00 42.46 40.95 3a2k s ILE 356 CO 0.05 0.45 -0.14 -0.94 0.00 0.00 0.00 174.94 174.37 3a2k s SER 357 N 0.76 4.11 0.24 3.58 1.04 -0.92 -1.14 113.70 121.36 3a2k s SER 357 Ca -0.11 -0.26 -0.19 0.00 0.48 0.00 0.00 55.95 55.87 3a2k s SER 357 Cb -0.16 -0.83 0.02 0.00 0.10 0.00 0.00 66.02 65.15 3a2k s SER 357 CO 0.02 0.30 0.61 -1.83 0.98 0.00 0.00 173.24 173.32 3a2k s GLU 358 N -1.15 1.60 0.07 4.02 -1.05 -0.65 -2.75 118.70 118.79 3a2k s GLU 358 Ca 0.14 -0.97 0.02 0.00 -0.15 0.00 0.00 54.97 54.01 3a2k s GLU 358 Cb -0.11 0.56 -0.04 0.00 -0.44 0.00 0.00 34.13 34.10 3a2k s GLU 358 CO 0.04 -0.71 0.14 -0.06 0.95 0.00 0.00 175.26 175.62 3a2k s PHE 359 N -3.91 3.34 -0.14 4.83 0.40 -1.26 -0.67 117.98 120.57 3a2k s PHE 359 Ca 0.12 0.16 -0.04 0.00 -0.60 0.00 0.00 56.93 56.57 3a2k s PHE 359 Cb -0.03 -1.68 0.07 0.00 0.51 0.00 0.00 43.02 41.88 3a2k s PHE 359 CO 0.03 0.55 0.20 0.20 0.70 0.00 0.00 175.22 176.91 3a2k s GLY 360 N -2.45 0.00 0.12 4.36 0.00 -0.34 -4.95 107.32 104.05 3a2k s GLY 360 Ca 0.32 0.50 -0.26 0.00 0.00 0.00 0.00 44.72 45.28 3a2k s GLY 360 CO 0.25 1.93 1.64 -2.09 0.00 0.00 0.00 173.10 174.82 3a2k h GLU 361 N 8.33 -0.40 -6.74 2.90 4.57 -1.87 -2.74 114.58 118.63 3a2k h GLU 361 Ca -0.15 0.03 -0.46 0.00 -1.18 0.00 0.00 59.36 57.60 3a2k h GLU 361 Cb 1.13 0.09 0.03 0.00 -0.16 0.00 0.00 28.75 29.84 3a2k h GLU 361 CO 0.20 -0.27 -0.07 -1.01 -1.18 0.00 0.00 179.01 176.68 3a2k s HIS 362 N -6.07 3.24 0.30 0.92 3.76 -1.26 -4.63 115.29 111.56 3a2k s HIS 362 Ca -0.15 0.29 -0.29 0.00 -0.15 0.00 0.00 55.06 54.76 3a2k s HIS 362 Cb 0.09 -2.34 -0.09 0.00 1.11 0.00 0.00 32.58 31.34 3a2k s HIS 362 CO 0.66 -0.38 1.11 -0.47 -0.85 0.00 0.00 174.74 174.80 3a2k s TYR 363 N -2.59 3.50 0.24 1.40 5.04 -1.26 -4.86 117.35 118.81 3a2k s TYR 363 Ca 0.49 1.68 -0.31 0.00 -2.44 0.00 0.00 57.07 56.48 3a2k s TYR 363 Cb -0.10 -3.29 -0.14 0.00 0.35 0.00 0.00 41.96 38.78 3a2k s TYR 363 CO 0.39 -0.65 1.37 -2.30 -1.34 0.00 0.00 175.55 173.01 3a2k n PRO 364 N 0.98 1.93 0.00 4.97 -0.02 -1.26 -4.93 135.00 136.67 3a2k n PRO 364 Ca -0.00 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 3a2k n PRO 364 Cb 0.45 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 3a2k n PRO 364 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3a2k n ARG 365 N 1.92 -0.86 -1.77 -0.52 1.74 -1.26 -5.05 116.66 110.85 3a2k n ARG 365 Ca 0.12 -0.47 -0.38 0.00 -0.77 0.00 0.00 57.85 56.35 3a2k n ARG 365 Cb 0.31 -0.97 0.05 0.00 -1.02 0.00 0.00 32.46 30.83 3a2k n ARG 365 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 3a2k s LYS 366 N -0.01 2.85 0.74 5.56 -2.85 -1.26 -4.94 119.74 119.82 3a2k s LYS 366 Ca 0.00 2.14 -0.17 0.00 -1.00 0.00 0.00 55.97 56.95 3a2k s LYS 366 Cb 0.00 -2.05 -0.10 0.00 -2.06 0.00 0.00 37.83 33.63 3a2k s LYS 366 CO 0.00 -1.39 -0.01 1.04 0.10 0.00 0.00 175.35 175.09 3a2k n GLN 367 N -1.47 0.10 -1.25 1.78 6.02 -1.26 -4.89 117.38 116.42 3a2k n GLN 367 Ca 0.13 0.05 -0.36 0.00 -0.01 0.00 0.00 57.00 56.81 3a2k n GLN 367 Cb 0.47 -1.37 0.06 0.00 1.02 0.00 0.00 30.24 30.42 3a2k n GLN 367 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3a2k n ALA 368 N -2.21 -1.90 0.00 -1.58 0.00 -1.26 -4.92 120.51 108.64 3a2k n ALA 368 Ca 0.06 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.26 3a2k n ALA 368 Cb 0.51 -1.76 0.00 0.00 0.00 0.00 0.00 19.45 18.19 3a2k n ALA 368 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a2k n GLY 369 N 1.85 -0.58 0.00 0.00 0.00 -1.26 -5.05 105.19 100.15 3a2k n GLY 369 Ca 0.09 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.44 3a2k n GLY 369 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3a2k n ASN 370 N 0.00 0.00 -0.55 1.61 5.15 -1.26 -4.83 115.26 115.38 3a2k n ASN 370 Ca 0.00 0.00 0.01 0.00 -0.60 0.00 0.00 54.58 53.99 3a2k n ASN 370 Cb 0.00 0.00 0.05 0.00 -0.53 0.00 0.00 39.78 39.30 3a2k n ASN 370 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 3a2k n ASP 371 N -0.75 1.32 -3.96 1.20 9.92 -1.26 -3.14 116.55 119.87 3a2k n ASP 371 Ca 0.00 -2.09 -0.08 0.00 -0.53 0.00 0.00 54.79 52.09 3a2k n ASP 371 Cb 0.00 -0.42 -0.09 0.00 -0.64 0.00 0.00 41.12 39.97 3a2k n ASP 371 CO 0.00 0.00 0.00 -1.66 0.13 0.00 0.00 177.20 175.67 3a2k s TRP 372 N -1.36 0.29 -0.27 1.24 1.48 -1.25 0.13 118.94 119.20 3a2k s TRP 372 Ca 0.06 -0.72 -0.23 0.00 -1.06 0.00 0.00 56.10 54.15 3a2k s TRP 372 Cb 0.04 -0.20 0.07 0.00 -1.16 0.00 0.00 33.47 32.22 3a2k s TRP 372 CO 0.02 -0.42 0.71 0.12 -4.06 0.00 0.00 176.95 173.32 3a2k s PHE 373 N -3.43 -0.82 -0.10 1.66 5.36 0.02 -4.96 117.98 115.72 3a2k s PHE 373 Ca 0.02 1.93 0.03 0.00 -0.96 0.00 0.00 56.93 57.95 3a2k s PHE 373 Cb 0.04 0.32 -0.01 0.00 -0.34 0.00 0.00 43.02 43.03 3a2k s PHE 373 CO -0.08 -0.40 -0.19 0.08 -1.46 0.00 0.00 175.22 173.17 3a2k s VAL 374 N 0.56 2.56 -0.01 3.12 1.01 -1.26 -1.54 120.40 124.85 3a2k s VAL 374 Ca -0.01 -0.86 0.05 0.00 0.00 0.00 0.00 61.98 61.16 3a2k s VAL 374 Cb -0.05 -2.01 -0.01 0.00 0.00 0.00 0.00 36.38 34.30 3a2k s VAL 374 CO -0.02 0.55 -0.16 -0.69 0.00 0.00 0.00 175.10 174.78 3a2k s VAL 375 N 0.10 1.25 -0.30 2.92 1.01 -1.00 0.87 120.40 125.25 3a2k s VAL 375 Ca -0.09 -0.71 -0.20 0.00 0.00 0.00 0.00 61.98 60.99 3a2k s VAL 375 Cb -0.15 -1.05 -0.01 0.00 0.00 0.00 0.00 36.38 35.17 3a2k s VAL 375 CO 0.06 0.33 0.61 -0.62 0.00 0.00 0.00 175.10 175.48 3a2k s ASP 376 N -0.43 6.48 0.21 3.32 3.68 -1.26 -1.81 116.67 126.85 3a2k s ASP 376 Ca 0.06 0.40 -0.16 0.00 2.13 0.00 0.00 52.55 54.99 3a2k s ASP 376 Cb -0.06 -2.32 0.21 0.00 -1.45 0.00 0.00 42.92 39.30 3a2k s ASP 376 CO -0.00 -0.46 1.61 -0.65 0.13 0.00 0.00 175.17 175.79 3a2k h PRO 377 N 8.19 -0.06 0.00 4.34 0.11 -1.89 -3.11 132.00 139.59 3a2k h PRO 377 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3a2k h PRO 377 Cb 1.12 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3a2k h PRO 377 CO 0.79 -0.04 0.00 0.00 -0.21 0.00 0.00 178.00 178.55 3a2k n ALA 378 N -3.12 0.00 0.00 -0.75 0.00 -1.26 -3.26 120.51 112.12 3a2k n ALA 378 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 3a2k n ALA 378 Cb 0.35 0.11 0.00 0.00 0.00 0.00 0.00 19.45 19.90 3a2k n ALA 378 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3a2k n SER 379 N -0.64 0.00 -3.67 0.00 3.41 -1.18 -4.51 113.62 107.03 3a2k n SER 379 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.46 3a2k n SER 379 Cb 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 3a2k n SER 379 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3a2k s VAL 380 N -1.20 0.02 -0.04 -3.33 0.11 -1.20 -5.01 120.40 109.75 3a2k s VAL 380 Ca 0.00 -0.16 -0.30 0.00 -2.93 0.00 0.00 61.98 58.59 3a2k s VAL 380 Cb 0.00 -0.76 -0.03 0.00 -1.53 0.00 0.00 36.38 34.06 3a2k s VAL 380 CO 0.00 -0.09 1.05 -0.94 -3.33 0.00 0.00 175.10 171.79 3a2k s SER 381 N -0.67 7.24 0.54 3.54 1.04 -1.26 -4.85 113.70 119.28 3a2k s SER 381 Ca -0.08 1.67 0.07 0.00 0.48 0.00 0.00 55.95 58.09 3a2k s SER 381 Cb -0.03 -2.56 0.06 0.00 0.10 0.00 0.00 66.02 63.58 3a2k s SER 381 CO 0.04 -0.40 0.74 -0.76 0.98 0.00 0.00 173.24 173.84 3a2k s LEU 382 N 1.58 3.31 0.00 2.42 1.43 -1.26 -1.74 118.68 124.41 3a2k s LEU 382 Ca 0.52 -0.52 -0.17 0.00 -1.03 0.00 0.00 54.13 52.94 3a2k s LEU 382 Cb -0.21 -2.21 0.23 0.00 0.03 0.00 0.00 46.19 44.02 3a2k s LEU 382 CO 0.23 -1.18 1.21 -0.81 0.23 0.00 0.00 176.35 176.03 3a2k n PRO 383 N -2.20 -1.62 -3.73 1.29 -0.05 -1.26 -4.51 135.00 122.92 3a2k n PRO 383 Ca 0.12 -1.88 -0.36 0.00 -0.05 0.00 0.00 63.50 61.33 3a2k n PRO 383 Cb 0.60 -1.35 -0.10 0.00 -0.05 0.00 0.00 33.50 32.60 3a2k n PRO 383 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 175.50 174.94 3a2k s LEU 384 N 0.00 3.98 -0.04 1.53 1.43 -1.26 -2.08 118.68 122.24 3a2k s LEU 384 Ca 0.70 0.06 -0.02 0.00 -1.03 0.00 0.00 54.13 53.84 3a2k s LEU 384 Cb -0.03 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 3a2k s LEU 384 CO 0.50 0.07 0.11 -0.13 0.23 0.00 0.00 176.35 177.13 3a2k s ARG 385 N 1.04 3.22 -0.16 1.70 3.00 -0.30 0.47 118.95 127.93 3a2k s ARG 385 Ca 0.06 -0.37 0.00 0.00 0.00 0.00 0.00 55.73 55.43 3a2k s ARG 385 Cb -0.14 -2.97 0.03 0.00 0.00 0.00 0.00 34.95 31.87 3a2k s ARG 385 CO 0.04 0.69 -0.10 0.54 0.00 0.00 0.00 175.30 176.47 3a2k s VAL 386 N -1.16 1.37 0.28 3.52 0.11 -0.32 0.30 120.40 124.50 3a2k s VAL 386 Ca 0.21 -0.66 0.04 0.00 -2.93 0.00 0.00 61.98 58.65 3a2k s VAL 386 Cb -0.12 -1.40 -0.03 0.00 -1.53 0.00 0.00 36.38 33.29 3a2k s VAL 386 CO 0.12 0.29 0.21 0.00 -3.33 0.00 0.00 175.10 172.39 3a2k s ARG 387 N 1.54 1.54 0.52 1.54 1.04 -0.35 -2.14 118.95 122.65 3a2k s ARG 387 Ca 0.02 -1.87 -0.07 0.00 -1.04 0.00 0.00 55.73 52.77 3a2k s ARG 387 Cb -0.14 0.26 -0.04 0.00 -2.04 0.00 0.00 34.95 32.99 3a2k s ARG 387 CO -0.09 -0.54 0.86 0.95 -0.04 0.00 0.00 175.30 176.44 3a2k s THR 388 N -3.72 4.85 0.71 4.99 -4.23 -0.29 -0.42 115.64 117.54 3a2k s THR 388 Ca 0.40 0.41 -0.16 0.00 -1.18 0.00 0.00 61.69 61.15 3a2k s THR 388 Cb 0.04 -3.86 -0.03 0.00 1.34 0.00 0.00 72.50 69.99 3a2k s THR 388 CO 0.21 -0.93 0.65 -2.11 -0.54 0.00 0.00 174.62 171.90 3a2k n ARG 389 N -2.37 0.37 -3.76 3.99 1.85 -1.26 -4.90 116.66 110.59 3a2k n ARG 389 Ca 0.02 0.17 -0.15 0.00 -1.00 0.00 0.00 57.85 56.89 3a2k n ARG 389 Cb 0.55 -1.92 -0.15 0.00 -1.05 0.00 0.00 32.46 29.88 3a2k n ARG 389 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 3a2k s ARG 390 N -2.86 0.01 0.00 2.89 3.52 -1.26 -5.07 118.95 116.19 3a2k s ARG 390 Ca 0.68 0.28 0.00 0.00 -0.13 0.00 0.00 55.73 56.55 3a2k s ARG 390 Cb -0.36 -0.23 0.00 0.00 -1.56 0.00 0.00 34.95 32.80 3a2k s ARG 390 CO 0.56 -0.18 0.00 0.54 -0.81 0.00 0.00 175.30 175.41 3a2k n ARG 391 N 4.26 0.00 -0.20 5.12 1.74 -1.26 -0.77 116.66 125.55 3a2k n ARG 391 Ca -0.26 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 56.90 3a2k n ARG 391 Cb 0.51 0.00 0.16 0.00 -1.02 0.00 0.00 32.46 32.11 3a2k n ARG 391 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3a2k n GLY 392 N -0.34 4.15 3.59 -0.13 0.00 -1.26 -4.98 105.19 106.22 3a2k n GLY 392 Ca 0.00 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.72 3a2k n GLY 392 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3a2k n ASP 393 N -0.81 1.00 -3.53 1.61 8.00 0.05 -4.87 116.55 117.99 3a2k n ASP 393 Ca 0.15 1.02 -0.13 0.00 0.71 0.00 0.00 54.79 56.54 3a2k n ASP 393 Cb 0.65 -1.32 -0.05 0.00 -0.02 0.00 0.00 41.12 40.38 3a2k n ASP 393 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3a2k s ARG 394 N -1.97 1.74 0.00 -1.24 1.70 -1.26 -1.08 118.95 116.84 3a2k s ARG 394 Ca 0.63 -1.63 0.00 0.00 -0.47 0.00 0.00 55.73 54.26 3a2k s ARG 394 Cb -0.56 0.43 0.00 0.00 -0.57 0.00 0.00 34.95 34.24 3a2k s ARG 394 CO 0.57 -0.71 0.00 0.00 -1.08 0.00 0.00 175.30 174.08 3a2k n MET 395 N -0.49 0.00 -3.97 3.89 0.00 -0.76 -4.54 117.12 111.26 3a2k n MET 395 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 57.70 57.59 3a2k n MET 395 Cb 0.62 0.00 -0.12 0.00 0.00 0.00 0.00 33.22 33.72 3a2k n MET 395 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 175.97 176.11 3a2k s VAL 396 N -2.98 0.15 -0.15 3.17 -7.23 -1.26 -1.10 120.40 111.00 3a2k s VAL 396 Ca 0.00 -0.53 -0.03 0.00 -1.81 0.00 0.00 61.98 59.60 3a2k s VAL 396 Cb 0.00 -0.22 -0.03 0.00 0.56 0.00 0.00 36.38 36.69 3a2k s VAL 396 CO 0.00 -0.25 -0.04 -0.76 -0.31 0.00 0.00 175.10 173.75 3a2k s LEU 397 N -0.82 3.26 0.10 1.32 1.43 -0.70 -1.03 118.68 122.25 3a2k s LEU 397 Ca -0.08 -0.11 -0.00 0.00 -1.03 0.00 0.00 54.13 52.91 3a2k s LEU 397 Cb -0.06 -1.78 0.22 0.00 0.03 0.00 0.00 46.19 44.61 3a2k s LEU 397 CO -0.00 0.19 0.52 1.17 0.23 0.00 0.00 176.35 178.46 3a2k n LYS 398 N 3.36 -0.03 0.00 1.70 4.81 0.33 -3.84 118.16 124.49 3a2k n LYS 398 Ca -0.17 0.50 0.00 0.00 -0.87 0.00 0.00 58.31 57.77 3a2k n LYS 398 Cb 0.53 -0.78 0.00 0.00 0.02 0.00 0.00 35.03 34.79 3a2k n LYS 398 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3a2k n GLY 399 N -1.18 0.14 0.00 3.14 0.00 -1.26 -4.71 105.19 101.31 3a2k n GLY 399 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3a2k n GLY 399 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3a2k n THR 400 N 0.00 0.00 0.00 2.61 -1.04 -1.25 -4.84 114.28 109.76 3a2k n THR 400 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3a2k n THR 400 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 3a2k n THR 400 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3a2k n GLY 401 N 4.66 0.12 0.00 3.41 0.00 -1.26 -4.35 105.19 107.76 3a2k n GLY 401 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3a2k n GLY 401 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a2k n GLY 402 N 0.00 0.39 3.65 -0.02 0.00 -1.26 -4.97 105.19 102.98 3a2k n GLY 402 Ca 0.00 -1.73 -0.35 0.00 0.00 0.00 0.00 46.02 43.94 3a2k n GLY 402 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3a2k s THR 403 N 0.00 4.19 -0.02 2.61 2.01 -1.26 -1.71 115.64 121.45 3a2k s THR 403 Ca 0.00 -0.29 -0.09 0.00 0.31 0.00 0.00 61.69 61.62 3a2k s THR 403 Cb 0.00 -2.76 0.01 0.00 0.01 0.00 0.00 72.50 69.76 3a2k s THR 403 CO 0.00 0.59 0.20 -0.75 -0.69 0.00 0.00 174.62 173.97 3a2k s LYS 404 N -0.75 0.46 0.39 4.92 2.20 -0.26 -4.97 119.74 121.73 3a2k s LYS 404 Ca 0.12 -0.16 -0.26 0.00 -0.36 0.00 0.00 55.97 55.31 3a2k s LYS 404 Cb -0.11 0.20 -0.09 0.00 -1.51 0.00 0.00 37.83 36.32 3a2k s LYS 404 CO 0.02 -0.11 1.18 0.15 -0.36 0.00 0.00 175.35 176.23 3a2k s LYS 405 N -0.96 4.12 0.07 4.03 1.02 -1.26 -1.83 119.74 124.93 3a2k s LYS 405 Ca -0.10 1.87 -0.29 0.00 0.02 0.00 0.00 55.97 57.47 3a2k s LYS 405 Cb -0.05 -2.74 -0.17 0.00 -0.52 0.00 0.00 37.83 34.34 3a2k s LYS 405 CO 0.02 -0.28 1.64 -0.07 -0.92 0.00 0.00 175.35 175.74 3a2k h LEU 406 N 2.77 -0.47 -0.98 3.17 4.07 -1.44 -2.57 115.31 119.86 3a2k h LEU 406 Ca -0.49 0.00 0.20 0.00 0.08 0.00 0.00 57.88 57.68 3a2k h LEU 406 Cb 1.23 0.12 -0.19 0.00 1.08 0.00 0.00 40.66 42.91 3a2k h LEU 406 CO 0.63 -0.32 -0.24 1.17 -1.08 0.00 0.00 178.44 178.60 3a2k n LYS 407 N -5.32 -0.09 -0.16 1.13 0.00 -1.26 0.12 118.16 112.58 3a2k n LYS 407 Ca -0.11 1.53 0.17 0.00 0.00 0.00 0.00 58.31 59.90 3a2k n LYS 407 Cb 0.24 -2.29 0.53 0.00 0.00 0.00 0.00 35.03 33.52 3a2k n LYS 407 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 3a2k h GLU 408 N 0.00 0.34 0.24 1.64 4.81 -1.85 -2.88 114.58 116.89 3a2k h GLU 408 Ca 0.48 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.67 3a2k h GLU 408 Cb 0.74 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.04 3a2k h GLU 408 CO -1.01 0.23 -0.11 0.82 -0.73 0.00 0.00 179.01 178.20 3a2k h ILE 409 N 0.35 0.21 -1.14 2.32 2.04 0.97 -2.82 117.51 119.44 3a2k h ILE 409 Ca 0.37 -0.86 0.34 0.00 1.00 0.00 0.00 64.86 65.71 3a2k h ILE 409 Cb 0.94 0.36 -0.12 0.00 -0.74 0.00 0.00 36.82 37.27 3a2k h ILE 409 CO -0.11 0.06 0.72 -0.26 0.00 0.00 0.00 178.15 178.56 3a2k h PHE 410 N -1.05 0.66 0.05 1.37 -1.00 -1.30 0.19 116.94 115.86 3a2k h PHE 410 Ca -0.03 0.03 -0.25 0.00 2.81 0.00 0.00 57.97 60.53 3a2k h PHE 410 Cb 0.34 -0.18 0.01 0.00 3.61 0.00 0.00 35.95 39.73 3a2k h PHE 410 CO 0.02 -0.09 -1.07 0.82 -1.61 0.00 0.00 178.31 176.38 3a2k h ILE 411 N 0.26 1.42 -0.31 -0.55 2.04 -1.56 -1.80 117.51 117.01 3a2k h ILE 411 Ca 0.71 -2.64 -0.16 0.00 1.00 0.00 0.00 64.86 63.77 3a2k h ILE 411 Cb 1.96 2.61 -0.01 0.00 -0.74 0.00 0.00 36.82 40.65 3a2k h ILE 411 CO -0.41 0.78 -0.43 -0.33 0.00 0.00 0.00 178.15 177.77 3a2k h GLU 412 N 0.18 0.79 -0.81 2.37 5.08 -0.72 -1.82 114.58 119.65 3a2k h GLU 412 Ca -0.11 -0.43 0.00 0.00 -1.00 0.00 0.00 59.36 57.83 3a2k h GLU 412 Cb 1.73 0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.01 3a2k h GLU 412 CO 0.18 1.06 0.00 0.00 -1.00 0.00 0.00 179.01 179.25 3a2k n ALA 413 N -2.53 2.66 -3.91 3.43 0.00 0.46 -4.92 120.51 115.70 3a2k n ALA 413 Ca -0.02 -0.25 -0.27 0.00 0.00 0.00 0.00 53.44 52.89 3a2k n ALA 413 Cb 0.55 -1.01 0.01 0.00 0.00 0.00 0.00 19.45 19.00 3a2k n ALA 413 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3a2k n LYS 414 N 0.04 -0.57 -3.87 0.00 5.02 -0.68 -4.91 118.16 113.19 3a2k n LYS 414 Ca 0.04 -0.16 -0.37 0.00 -2.02 0.00 0.00 58.31 55.80 3a2k n LYS 414 Cb 0.33 -1.04 -0.07 0.00 -0.02 0.00 0.00 35.03 34.24 3a2k n LYS 414 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3a2k s ILE 415 N -4.06 5.44 0.71 -0.18 1.01 -0.73 -5.04 121.20 118.34 3a2k s ILE 415 Ca 0.28 0.19 -0.16 0.00 0.00 0.00 0.00 60.65 60.95 3a2k s ILE 415 Cb -0.16 -3.39 -0.02 0.00 0.01 0.00 0.00 42.46 38.91 3a2k s ILE 415 CO 0.57 0.58 0.72 -2.65 0.00 0.00 0.00 174.94 174.17 3a2k n PRO 416 N 2.29 0.41 0.24 2.79 -0.02 -1.26 -4.75 135.00 134.70 3a2k n PRO 416 Ca -0.19 0.18 -0.10 0.00 -2.02 0.00 0.00 63.50 61.37 3a2k n PRO 416 Cb 0.54 -2.00 -0.05 0.00 -0.02 0.00 0.00 33.50 31.98 3a2k n PRO 416 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3a2k h ARG 417 N -0.28 -0.65 -1.32 -0.52 -0.00 -1.97 -2.11 114.38 107.53 3a2k h ARG 417 Ca -0.46 0.04 0.38 0.00 -0.50 0.00 0.00 59.98 59.44 3a2k h ARG 417 Cb 1.35 0.15 -0.05 0.00 0.00 0.00 0.00 29.97 31.41 3a2k h ARG 417 CO 0.45 -0.43 1.07 0.52 0.00 0.00 0.00 179.97 181.57 3a2k h MET 418 N -1.15 0.00 0.54 0.04 2.86 -2.01 1.08 114.93 116.28 3a2k h MET 418 Ca -0.07 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.54 3a2k h MET 418 Cb 0.52 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.18 3a2k h MET 418 CO 0.11 0.00 -0.26 0.93 1.06 0.00 0.00 176.91 178.75 3a2k h GLU 419 N 0.00 -0.70 -0.95 1.72 4.39 -1.85 -3.03 114.58 114.17 3a2k h GLU 419 Ca 0.63 0.05 0.27 0.00 0.34 0.00 0.00 59.36 60.65 3a2k h GLU 419 Cb 2.76 0.16 -0.14 0.00 -0.10 0.00 0.00 28.75 31.42 3a2k h GLU 419 CO -0.01 -0.39 0.43 0.00 -1.16 0.00 0.00 179.01 177.88 3a2k h ARG 420 N -0.99 0.30 0.30 2.33 2.47 0.19 0.77 114.38 119.75 3a2k h ARG 420 Ca -0.07 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.61 3a2k h ARG 420 Cb 0.63 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 28.88 3a2k h ARG 420 CO 0.12 0.20 -0.14 -0.44 0.56 0.00 0.00 179.97 180.27 3a2k h ASP 421 N 0.31 -0.34 0.11 7.04 3.32 -1.48 -3.09 116.42 122.29 3a2k h ASP 421 Ca 0.64 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 57.49 3a2k h ASP 421 Cb 1.36 0.09 0.00 0.00 0.22 0.00 0.00 39.33 41.00 3a2k h ASP 421 CO -0.61 0.08 0.00 0.54 -1.72 0.00 0.00 179.24 177.53 3a2k n ARG 422 N -5.09 0.49 -2.31 3.56 1.74 -0.59 -4.36 116.66 110.09 3a2k n ARG 422 Ca -0.09 0.04 -0.41 0.00 -0.77 0.00 0.00 57.85 56.62 3a2k n ARG 422 Cb 0.27 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.17 3a2k n ARG 422 CO 0.00 0.00 0.00 -0.46 -1.52 0.00 0.00 177.63 175.65 3a2k s TRP 423 N -2.19 3.34 0.05 -1.55 -0.11 0.16 -4.70 118.94 113.95 3a2k s TRP 423 Ca 0.25 1.55 -0.21 0.00 1.22 0.00 0.00 56.10 58.90 3a2k s TRP 423 Cb 0.13 -3.47 -0.06 0.00 -1.50 0.00 0.00 33.47 28.57 3a2k s TRP 423 CO 0.24 -1.18 0.63 -1.25 -4.62 0.00 0.00 176.95 170.77 3a2k s PRO 424 N -1.45 4.33 0.20 5.86 0.04 -1.26 -4.19 135.00 138.52 3a2k s PRO 424 Ca 0.47 0.83 0.08 0.00 0.04 0.00 0.00 61.00 62.42 3a2k s PRO 424 Cb -0.35 -3.30 -0.04 0.00 0.04 0.00 0.00 34.50 30.85 3a2k s PRO 424 CO 0.45 0.48 -0.00 0.42 0.04 0.00 0.00 177.00 178.39 3a2k s ILE 425 N -0.62 3.64 -0.17 0.56 1.09 0.44 -4.25 121.20 121.89 3a2k s ILE 425 Ca 0.32 -1.54 0.00 0.00 -1.10 0.00 0.00 60.65 58.33 3a2k s ILE 425 Cb -0.20 -2.85 0.04 0.00 -1.06 0.00 0.00 42.46 38.39 3a2k s ILE 425 CO 0.20 -0.17 -0.09 -0.69 -0.10 0.00 0.00 174.94 174.09 3a2k s VAL 426 N -1.86 1.40 0.36 2.92 1.01 -1.02 -1.21 120.40 122.00 3a2k s VAL 426 Ca 0.28 -0.76 0.08 0.00 0.00 0.00 0.00 61.98 61.58 3a2k s VAL 426 Cb -0.09 -1.48 -0.05 0.00 0.00 0.00 0.00 36.38 34.77 3a2k s VAL 426 CO 0.19 0.22 0.09 -1.83 0.00 0.00 0.00 175.10 173.76 3a2k s GLU 427 N 1.52 2.20 0.56 2.72 -1.05 0.15 0.41 118.70 125.20 3a2k s GLU 427 Ca 0.01 -1.71 0.03 0.00 -0.15 0.00 0.00 54.97 53.15 3a2k s GLU 427 Cb -0.15 -2.01 0.05 0.00 -0.44 0.00 0.00 34.13 31.59 3a2k s GLU 427 CO -0.08 0.07 0.78 0.16 0.95 0.00 0.00 175.26 177.13 3a2k s ASP 428 N -3.79 5.15 0.30 0.83 -4.77 -0.60 -1.15 116.67 112.65 3a2k s ASP 428 Ca 0.37 -0.28 0.05 0.00 -3.30 0.00 0.00 52.55 49.39 3a2k s ASP 428 Cb 0.00 -0.50 0.80 0.00 -1.09 0.00 0.00 42.92 42.13 3a2k s ASP 428 CO 0.21 -1.23 1.63 0.00 0.70 0.00 0.00 175.17 176.48 3a2k h ALA 429 N 0.09 1.39 0.00 2.11 0.00 -0.76 0.34 119.26 122.43 3a2k h ALA 429 Ca -0.39 0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3a2k h ALA 429 Cb 1.29 0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.42 3a2k h ALA 429 CO 0.47 -0.53 0.00 -0.25 0.00 0.00 0.00 179.25 178.94 3a2k n ASP 430 N -5.25 0.00 0.00 0.00 8.00 -1.26 -4.85 116.55 113.20 3a2k n ASP 430 Ca 0.24 -0.58 0.00 0.00 0.71 0.00 0.00 54.79 55.16 3a2k n ASP 430 Cb 0.77 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.85 3a2k n ASP 430 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3a2k n GLY 431 N 0.22 0.84 3.71 0.44 0.00 0.12 -5.03 105.19 105.49 3a2k n GLY 431 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 3a2k n GLY 431 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3a2k s ARG 432 N -0.26 4.29 0.01 1.61 0.52 -1.26 -4.76 118.95 119.11 3a2k s ARG 432 Ca 0.00 2.13 -0.30 0.00 -0.52 0.00 0.00 55.73 57.04 3a2k s ARG 432 Cb 0.00 -3.29 -0.03 0.00 0.52 0.00 0.00 34.95 32.15 3a2k s ARG 432 CO 0.00 -0.50 0.98 0.42 0.02 0.00 0.00 175.30 176.21 3a2k s ILE 433 N 1.36 4.83 -0.19 1.52 1.01 -1.26 -1.55 121.20 126.91 3a2k s ILE 433 Ca 0.66 2.06 0.02 0.00 0.00 0.00 0.00 60.65 63.39 3a2k s ILE 433 Cb -0.38 -4.32 -0.13 0.00 0.01 0.00 0.00 42.46 37.64 3a2k s ILE 433 CO 0.30 0.18 -0.15 0.18 0.00 0.00 0.00 174.94 175.45 3a2k n LEU 434 N 3.77 2.78 -3.63 2.97 4.77 0.17 -4.77 117.00 123.05 3a2k n LEU 434 Ca 0.06 -0.10 -0.03 0.00 -0.03 0.00 0.00 56.01 55.91 3a2k n LEU 434 Cb 0.51 -0.60 -0.06 0.00 -2.33 0.00 0.00 43.42 40.94 3a2k n LEU 434 CO 0.52 0.79 0.60 0.86 -1.33 0.00 0.00 177.39 178.83 3a2k s TRP 435 N -2.38 -0.68 -0.47 -1.77 -0.00 -1.16 -1.40 118.94 111.08 3a2k s TRP 435 Ca -0.24 1.35 -0.07 0.00 -0.00 0.00 0.00 56.10 57.14 3a2k s TRP 435 Cb 0.06 0.41 0.12 0.00 -0.00 0.00 0.00 33.47 34.07 3a2k s TRP 435 CO 0.45 -0.34 0.32 0.08 -0.00 0.00 0.00 176.95 177.46 3a2k s VAL 436 N 1.47 3.92 -0.12 5.86 1.01 0.84 -2.45 120.40 130.93 3a2k s VAL 436 Ca -0.09 -1.97 -0.13 0.00 0.00 0.00 0.00 61.98 59.79 3a2k s VAL 436 Cb -0.04 -3.61 -0.06 0.00 0.00 0.00 0.00 36.38 32.67 3a2k s VAL 436 CO -0.16 -0.76 0.44 -2.65 0.00 0.00 0.00 175.10 171.97 3a2k n PRO 437 N 4.70 0.00 -1.81 2.72 -0.02 -1.26 -1.08 135.00 138.25 3a2k n PRO 437 Ca -0.05 0.00 -0.18 0.00 -2.02 0.00 0.00 63.50 61.25 3a2k n PRO 437 Cb 0.41 -0.44 -0.06 0.00 -0.02 0.00 0.00 33.50 33.40 3a2k n PRO 437 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3a2k n GLY 438 N 1.06 1.04 1.89 -1.23 0.00 -1.19 -4.65 105.19 102.11 3a2k n GLY 438 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 3a2k n GLY 438 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3a2k n LEU 439 N -2.44 -0.01 -3.59 0.99 4.77 -0.24 -4.97 117.00 111.51 3a2k n LEU 439 Ca -0.19 0.07 -0.13 0.00 -0.03 0.00 0.00 56.01 55.73 3a2k n LEU 439 Cb 0.62 0.05 -0.06 0.00 -2.33 0.00 0.00 43.42 41.69 3a2k n LEU 439 CO 0.27 -0.49 0.61 -0.75 -1.33 0.00 0.00 177.39 175.70 3a2k s LYS 440 N -2.00 0.73 -0.05 3.23 2.47 -0.48 -5.01 119.74 118.62 3a2k s LYS 440 Ca 0.00 0.49 -0.01 0.00 -1.56 0.00 0.00 55.97 54.89 3a2k s LYS 440 Cb 0.00 0.35 -0.04 0.00 -1.46 0.00 0.00 37.83 36.68 3a2k s LYS 440 CO 0.00 -0.16 0.03 0.15 0.16 0.00 0.00 175.35 175.53 3a2k s LYS 441 N -0.41 2.98 0.00 4.03 1.02 -1.26 -0.11 119.74 125.99 3a2k s LYS 441 Ca -0.02 -0.46 0.00 0.00 0.02 0.00 0.00 55.97 55.51 3a2k s LYS 441 Cb -0.03 -2.80 0.00 0.00 -0.52 0.00 0.00 37.83 34.48 3a2k s LYS 441 CO 0.01 0.68 0.00 -1.13 -0.92 0.00 0.00 175.35 173.99 3a2k n SER 442 N 1.73 0.00 -0.21 2.83 3.41 -0.49 -2.60 113.62 118.29 3a2k n SER 442 Ca -0.16 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.48 3a2k n SER 442 Cb 0.53 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.50 3a2k n SER 442 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3a2k n ALA 443 N -3.00 2.54 -1.13 7.33 0.00 -0.20 -0.52 120.51 125.53 3a2k n ALA 443 Ca 0.00 -0.48 -0.06 0.00 0.00 0.00 0.00 53.44 52.91 3a2k n ALA 443 Cb 0.00 -0.21 0.27 0.00 0.00 0.00 0.00 19.45 19.51 3a2k n ALA 443 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3a2k n PHE 444 N 0.07 2.11 -2.16 0.00 0.99 -1.26 -4.91 117.46 112.30 3a2k n PHE 444 Ca 0.03 -1.30 -0.42 0.00 -0.00 0.00 0.00 57.45 55.76 3a2k n PHE 444 Cb 0.14 -0.64 -0.03 0.00 -1.00 0.00 0.00 39.48 37.96 3a2k n PHE 444 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 176.76 174.76 3a2k s GLU 445 N -3.05 4.25 -0.13 -1.08 2.12 -1.26 -4.83 118.70 114.71 3a2k s GLU 445 Ca 0.52 2.03 -0.30 0.00 0.36 0.00 0.00 54.97 57.59 3a2k s GLU 445 Cb 0.43 -3.66 -0.07 0.00 0.26 0.00 0.00 34.13 31.08 3a2k s GLU 445 CO 0.10 -0.65 2.12 0.00 -0.54 0.00 0.00 175.26 176.29 3a2k n ALA 446 N 5.80 1.62 -1.36 6.30 0.00 0.25 -4.95 120.51 128.17 3a2k n ALA 446 Ca 0.14 -0.05 -0.29 0.00 0.00 0.00 0.00 53.44 53.24 3a2k n ALA 446 Cb 0.43 -2.80 0.19 0.00 0.00 0.00 0.00 19.45 17.28 3a2k n ALA 446 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 3a2k s GLN 447 N 5.57 0.02 0.00 0.00 -2.07 -1.26 -4.77 119.66 117.15 3a2k s GLN 447 Ca 0.97 0.08 0.02 0.00 -1.82 0.00 0.00 55.36 54.61 3a2k s GLN 447 Cb -0.42 -1.73 0.13 0.00 -1.09 0.00 0.00 33.01 29.90 3a2k s GLN 447 CO 0.39 -2.91 0.54 -1.71 -1.32 0.00 0.00 175.29 170.29 3a2k n ASN 448 N -4.22 0.00 -0.00 12.60 5.15 -1.26 -4.63 115.26 122.90 3a2k n ASN 448 Ca 0.10 -0.76 -0.00 0.00 -0.60 0.00 0.00 54.58 53.32 3a2k n ASN 448 Cb 0.59 0.00 -0.00 0.00 -0.53 0.00 0.00 39.78 39.84 3a2k n ASN 448 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 3a2k n ARG 449 N -0.58 -0.00 -3.60 1.20 0.63 -1.26 -4.35 116.66 108.70 3a2k n ARG 449 Ca 0.02 0.01 -0.14 0.00 -0.92 0.00 0.00 57.85 56.82 3a2k n ARG 449 Cb 0.01 -0.01 -0.06 0.00 0.45 0.00 0.00 32.46 32.84 3a2k n ARG 449 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 3a2k s GLY 450 N -3.22 -0.43 0.00 5.14 0.00 -1.26 -5.03 107.32 102.51 3a2k s GLY 450 Ca -0.00 1.98 -0.01 0.00 0.00 0.00 0.00 44.72 46.70 3a2k s GLY 450 CO 0.00 1.46 0.88 -1.06 0.00 0.00 0.00 173.10 174.39 3a2k n GLN 451 N 1.86 0.40 0.00 2.90 6.02 -1.26 -4.64 117.38 122.65 3a2k n GLN 451 Ca -0.14 -0.11 0.00 0.00 -0.01 0.00 0.00 57.00 56.74 3a2k n GLN 451 Cb 0.56 -1.46 0.00 0.00 1.02 0.00 0.00 30.24 30.36 3a2k n GLN 451 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3a2k n ALA 452 N 2.22 0.00 -2.45 -1.58 0.00 -1.26 -4.86 120.51 112.58 3a2k n ALA 452 Ca 0.05 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.22 3a2k n ALA 452 Cb 0.19 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.50 3a2k n ALA 452 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3a2k s ARG 453 N 0.00 1.48 0.05 0.00 3.52 -1.26 -4.80 118.95 117.94 3a2k s ARG 453 Ca 0.00 -0.99 0.03 0.00 -0.13 0.00 0.00 55.73 54.65 3a2k s ARG 453 Cb 0.00 -1.62 -0.03 0.00 -1.56 0.00 0.00 34.95 31.75 3a2k s ARG 453 CO 0.00 0.41 -0.10 0.71 -0.81 0.00 0.00 175.30 175.51 3a2k s TYR 454 N -0.81 0.90 -0.00 5.12 2.02 -1.04 -4.29 117.35 119.26 3a2k s TYR 454 Ca 0.09 -0.47 0.05 0.00 -0.37 0.00 0.00 57.07 56.37 3a2k s TYR 454 Cb -0.09 -0.52 -0.03 0.00 -0.40 0.00 0.00 41.96 40.92 3a2k s TYR 454 CO 0.02 -0.02 -0.14 0.42 -1.57 0.00 0.00 175.55 174.26 3a2k s ILE 455 N -1.28 3.12 -0.08 2.71 1.01 -0.75 -1.20 121.20 124.73 3a2k s ILE 455 Ca -0.06 -0.91 0.02 0.00 0.00 0.00 0.00 60.65 59.70 3a2k s ILE 455 Cb -0.10 -2.30 0.01 0.00 0.01 0.00 0.00 42.46 40.09 3a2k s ILE 455 CO 0.01 0.44 -0.14 -0.22 0.00 0.00 0.00 174.94 175.03 3a2k s LEU 456 N -1.19 1.71 -0.20 2.97 1.98 0.16 -2.39 118.68 121.72 3a2k s LEU 456 Ca 0.14 -0.36 0.01 0.00 -2.89 0.00 0.00 54.13 51.03 3a2k s LEU 456 Cb -0.11 -0.95 0.02 0.00 0.66 0.00 0.00 46.19 45.81 3a2k s LEU 456 CO 0.04 0.05 -0.17 -0.76 -1.89 0.00 0.00 176.35 173.62 3a2k s LEU 457 N 0.69 2.39 -0.19 -0.68 2.01 -0.59 -1.64 118.68 120.68 3a2k s LEU 457 Ca -0.14 -0.72 -0.03 0.00 0.01 0.00 0.00 54.13 53.25 3a2k s LEU 457 Cb -0.16 -1.52 -0.01 0.00 0.01 0.00 0.00 46.19 44.51 3a2k s LEU 457 CO 0.03 -0.03 -0.06 -1.10 1.01 0.00 0.00 176.35 176.21 3a2k s GLN 458 N 1.29 3.45 -0.20 1.70 -1.52 -0.29 -0.80 119.66 123.28 3a2k s GLN 458 Ca 0.03 -0.61 -0.12 0.00 -1.95 0.00 0.00 55.36 52.72 3a2k s GLN 458 Cb -0.14 -2.91 -0.05 0.00 -0.22 0.00 0.00 33.01 29.69 3a2k s GLN 458 CO -0.11 -0.01 0.20 -0.47 -0.25 0.00 0.00 175.29 174.66 3a2k s TYR 459 N 0.98 3.39 0.22 0.91 6.04 0.34 -0.72 117.35 128.51 3a2k s TYR 459 Ca -0.00 0.38 -0.16 0.00 0.04 0.00 0.00 57.07 57.34 3a2k s TYR 459 Cb -0.15 -2.27 0.01 0.00 -1.04 0.00 0.00 41.96 38.51 3a2k s TYR 459 CO 0.00 0.17 0.51 -1.14 -1.54 0.00 0.00 175.55 173.56 3a2k s GLN 460 N 0.71 1.46 0.00 4.97 0.74 -0.29 -4.81 119.66 122.44 3a2k s GLN 460 Ca 0.11 -1.03 0.00 0.00 0.05 0.00 0.00 55.36 54.49 3a2k s GLN 460 Cb -0.13 0.50 0.00 0.00 1.10 0.00 0.00 33.01 34.49 3a2k s GLN 460 CO 0.02 -0.62 0.00 0.00 -0.55 0.00 0.00 175.29 174.15 3a2k n ALA 461 N -0.36 0.00 0.03 1.58 0.00 -1.26 -0.19 120.51 120.31 3a2k n ALA 461 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3a2k n ALA 461 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 3a2k n ALA 461 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17