#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g6k h ALA -2 N 0.00 0.77 -2.67 4.61 0.00 -1.98 -3.46 119.26 116.54 3g6k h ALA -2 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.65 3g6k h ALA -2 Cb 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 17.61 3g6k h ALA -2 CO 0.00 0.00 -0.72 -1.64 0.00 0.00 0.00 179.25 176.89 3g6k s MET -1 N -3.25 0.72 0.43 0.00 1.00 -1.26 -5.13 119.30 111.81 3g6k s MET -1 Ca 0.05 -1.09 -0.25 0.00 0.00 0.00 0.00 55.69 54.40 3g6k s MET -1 Cb 0.08 -0.29 -0.08 0.00 0.00 0.00 0.00 34.83 34.54 3g6k s MET -1 CO 0.71 0.02 1.23 0.08 0.00 0.00 0.00 175.02 177.07 3g6k s VAL 0 N -2.59 2.86 0.46 -6.03 1.01 -1.26 -4.98 120.40 109.87 3g6k s VAL 0 Ca 0.03 0.71 -0.23 0.00 0.00 0.00 0.00 61.98 62.48 3g6k s VAL 0 Cb -0.02 -3.40 -0.09 0.00 0.00 0.00 0.00 36.38 32.88 3g6k s VAL 0 CO -0.02 0.06 1.11 0.23 0.00 0.00 0.00 175.10 176.48 3g6k n MET 1 N -0.13 1.48 -1.97 2.72 0.00 -1.26 -5.03 117.12 112.93 3g6k n MET 1 Ca 0.05 0.54 -0.30 0.00 0.00 0.00 0.00 57.70 57.99 3g6k n MET 1 Cb 0.46 -2.22 0.04 0.00 0.00 0.00 0.00 33.22 31.50 3g6k n MET 1 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 3g6k s ARG 2 N -2.28 2.87 0.25 0.03 0.52 -1.26 -4.75 118.95 114.32 3g6k s ARG 2 Ca 0.65 0.38 -0.06 0.00 -0.52 0.00 0.00 55.73 56.18 3g6k s ARG 2 Cb -0.50 -2.06 0.27 0.00 0.52 0.00 0.00 34.95 33.17 3g6k s ARG 2 CO 0.55 -0.98 1.92 1.25 0.02 0.00 0.00 175.30 178.05 3g6k h LEU 3 N -0.57 1.11 -1.11 2.53 5.85 -1.89 -0.56 115.31 120.66 3g6k h LEU 3 Ca -0.45 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.22 3g6k h LEU 3 Cb 1.25 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.99 3g6k h LEU 3 CO 0.63 0.79 0.26 1.23 -0.34 0.00 0.00 178.44 181.01 3g6k h GLY 4 N 1.30 0.95 0.97 3.75 0.00 -1.92 0.13 103.07 108.24 3g6k h GLY 4 Ca 0.37 -0.47 -0.06 0.00 0.00 0.00 0.00 47.33 47.17 3g6k h GLY 4 CO -0.09 0.45 0.07 -0.55 0.00 0.00 0.00 176.54 176.42 3g6k h ASP 5 N 0.88 0.73 -0.51 0.19 3.32 -1.53 -0.65 116.42 118.85 3g6k h ASP 5 Ca 0.21 -0.26 -0.05 0.00 0.02 0.00 0.00 57.03 56.94 3g6k h ASP 5 Cb 0.15 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 3g6k h ASP 5 CO -0.02 0.81 0.11 0.00 -1.72 0.00 0.00 179.24 178.42 3g6k h ALA 6 N 0.95 0.68 -0.46 3.45 0.00 -0.67 -0.94 119.26 122.26 3g6k h ALA 6 Ca 0.14 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 3g6k h ALA 6 Cb 0.39 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3g6k h ALA 6 CO 0.01 0.39 0.11 0.00 0.00 0.00 0.00 179.25 179.76 3g6k h ALA 7 N 0.99 0.61 -0.64 0.00 0.00 -0.89 -0.76 119.26 118.57 3g6k h ALA 7 Ca 0.16 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 3g6k h ALA 7 Cb 0.36 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3g6k h ALA 7 CO 0.00 0.30 0.06 1.49 0.00 0.00 0.00 179.25 181.10 3g6k h GLU 8 N 0.62 1.09 -0.34 0.00 4.81 -1.03 -0.95 114.58 118.78 3g6k h GLU 8 Ca 0.14 -0.31 0.06 0.00 -0.13 0.00 0.00 59.36 59.12 3g6k h GLU 8 Cb 0.33 -0.12 -0.06 0.00 0.63 0.00 0.00 28.75 29.54 3g6k h GLU 8 CO 0.00 1.02 -0.03 1.25 -0.73 0.00 0.00 179.01 180.52 3g6k h LEU 9 N 1.01 -0.20 -0.88 1.64 5.85 -0.94 -0.05 115.31 121.73 3g6k h LEU 9 Ca 0.19 0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.93 3g6k h LEU 9 Cb 0.50 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 3g6k h LEU 9 CO 0.02 -0.06 0.08 0.00 -0.34 0.00 0.00 178.44 178.14 3g6k h TYR 11 N 0.86 0.68 -0.48 0.00 3.20 -0.85 -0.72 116.97 119.67 3g6k h TYR 11 Ca 0.17 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.94 3g6k h TYR 11 Cb 0.40 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.43 3g6k h TYR 11 CO 0.02 0.49 -0.08 -0.91 -1.64 0.00 0.00 178.16 176.05 3g6k h ASN 12 N 0.67 0.89 0.03 -2.11 2.35 -0.49 -0.06 115.58 116.86 3g6k h ASN 12 Ca 0.18 -0.34 -0.15 0.00 -0.55 0.00 0.00 56.30 55.43 3g6k h ASN 12 Cb 0.03 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 3g6k h ASN 12 CO -0.03 1.03 -0.51 0.17 -1.65 0.00 0.00 177.43 176.43 3g6k h LEU 13 N 0.74 0.59 -0.37 1.61 8.10 -0.86 -0.72 115.31 124.40 3g6k h LEU 13 Ca 0.13 -0.30 -0.10 0.00 0.11 0.00 0.00 57.88 57.72 3g6k h LEU 13 Cb 0.61 -0.17 -0.01 0.00 -0.44 0.00 0.00 40.66 40.66 3g6k h LEU 13 CO 0.04 1.00 -0.15 0.74 -4.11 0.00 0.00 178.44 175.96 3g6k h THR 14 N 0.42 1.28 -0.88 0.15 2.02 -0.96 -0.96 112.91 113.98 3g6k h THR 14 Ca 0.02 -1.26 -0.01 0.00 0.77 0.00 0.00 66.41 65.92 3g6k h THR 14 Cb 1.04 1.31 -0.04 0.00 -1.74 0.00 0.00 68.15 68.72 3g6k h THR 14 CO 0.10 0.42 0.50 0.28 0.37 0.00 0.00 175.52 177.18 3g6k h SER 15 N 0.55 1.08 -0.73 4.18 0.02 -0.91 -0.92 113.55 116.83 3g6k h SER 15 Ca 0.09 -0.09 -0.03 0.00 -0.84 0.00 0.00 61.79 60.91 3g6k h SER 15 Cb 0.69 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 3g6k h SER 15 CO 0.05 0.86 0.32 0.28 -1.14 0.00 0.00 176.83 177.20 3g6k h SER 16 N 1.22 0.98 -0.42 3.07 0.02 -0.89 -2.10 113.55 115.43 3g6k h SER 16 Ca 0.31 -0.15 -0.02 0.00 -0.84 0.00 0.00 61.79 61.09 3g6k h SER 16 Cb 0.00 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.27 3g6k h SER 16 CO -0.05 0.86 0.21 0.22 -1.14 0.00 0.00 176.83 176.93 3g6k h TYR 17 N 1.03 0.61 0.00 3.45 3.20 -0.66 -1.93 116.97 122.67 3g6k h TYR 17 Ca 0.25 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.09 3g6k h TYR 17 Cb 0.17 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.25 3g6k h TYR 17 CO 0.01 0.49 -0.00 -0.07 -1.64 0.00 0.00 178.16 176.96 3g6k h LEU 18 N 0.54 0.00 -0.41 2.82 3.38 -0.81 -2.01 115.31 118.83 3g6k h LEU 18 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3g6k h LEU 18 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3g6k h LEU 18 CO -0.02 0.00 -0.31 0.00 0.09 0.00 0.00 178.44 178.21 3g6k n GLN 19 N -3.14 0.69 -1.74 1.13 6.02 -0.74 -4.91 117.38 114.70 3g6k n GLN 19 Ca -0.03 -0.41 -0.42 0.00 -0.01 0.00 0.00 57.00 56.14 3g6k n GLN 19 Cb 0.10 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.84 3g6k n GLN 19 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3g6k s ILE 20 N -2.59 2.03 -0.82 5.09 1.01 -0.76 -4.91 121.20 120.25 3g6k s ILE 20 Ca 0.22 0.02 -0.24 0.00 0.00 0.00 0.00 60.65 60.66 3g6k s ILE 20 Cb 0.19 -3.01 0.06 0.00 0.01 0.00 0.00 42.46 39.71 3g6k s ILE 20 CO 0.55 0.00 1.21 0.00 0.00 0.00 0.00 174.94 176.71 3g6k s ALA 21 N 1.00 2.93 0.09 9.38 0.00 -1.26 -4.99 121.76 128.91 3g6k s ALA 21 Ca 0.73 -1.93 0.07 0.00 0.00 0.00 0.00 51.96 50.83 3g6k s ALA 21 Cb -0.49 -4.19 -0.04 0.00 0.00 0.00 0.00 23.12 18.40 3g6k s ALA 21 CO 0.34 -3.19 -0.11 0.00 0.00 0.00 0.00 175.76 172.81 3g6k s ALA 22 N 4.64 2.90 0.64 0.00 0.00 -1.26 -5.10 121.76 123.58 3g6k s ALA 22 Ca 0.34 -1.22 -0.17 0.00 0.00 0.00 0.00 51.96 50.91 3g6k s ALA 22 Cb -0.08 -0.89 -0.01 0.00 0.00 0.00 0.00 23.12 22.14 3g6k s ALA 22 CO 0.04 0.63 1.16 -1.21 0.00 0.00 0.00 175.76 176.38 3g6k s GLU 23 N -2.02 2.81 0.57 0.00 2.02 -1.26 -4.84 118.70 115.98 3g6k s GLU 23 Ca 0.20 1.62 0.35 0.00 0.02 0.00 0.00 54.97 57.16 3g6k s GLU 23 Cb -0.11 -1.93 1.64 0.00 0.10 0.00 0.00 34.13 33.83 3g6k s GLU 23 CO 0.12 -1.29 2.09 0.66 0.02 0.00 0.00 175.26 176.87 3g6k h SER 24 N 0.40 0.00 -0.57 -0.19 4.64 -2.00 -1.66 113.55 114.17 3g6k h SER 24 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3g6k h SER 24 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 3g6k h SER 24 CO 0.54 0.03 0.00 -0.90 -0.87 0.00 0.00 176.83 175.63 3g6k n ASP 25 N -3.19 5.62 -4.93 4.97 5.75 -1.26 -4.80 116.55 118.70 3g6k n ASP 25 Ca -0.01 -2.91 -0.26 0.00 -0.01 0.00 0.00 54.79 51.61 3g6k n ASP 25 Cb 0.24 -0.67 -0.02 0.00 -1.03 0.00 0.00 41.12 39.63 3g6k n ASP 25 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 3g6k s SER 26 N -0.85 6.36 0.22 -1.12 1.04 -0.63 -5.00 113.70 113.73 3g6k s SER 26 Ca 0.54 0.47 -0.08 0.00 0.48 0.00 0.00 55.95 57.36 3g6k s SER 26 Cb 0.41 -2.04 0.26 0.00 0.10 0.00 0.00 66.02 64.75 3g6k s SER 26 CO 0.16 -0.18 1.84 0.40 0.98 0.00 0.00 173.24 176.45 3g6k h ILE 27 N 1.18 1.04 -0.65 -1.02 2.04 -1.94 -2.15 117.51 116.00 3g6k h ILE 27 Ca -0.49 -0.29 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 3g6k h ILE 27 Cb 1.20 0.10 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 3g6k h ILE 27 CO 0.65 0.16 0.36 0.40 0.00 0.00 0.00 178.15 179.72 3g6k h ILE 28 N 0.86 1.20 -0.85 -0.67 2.04 -1.94 0.04 117.51 118.19 3g6k h ILE 28 Ca 0.33 -0.50 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 3g6k h ILE 28 Cb 0.13 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 36.52 3g6k h ILE 28 CO -0.16 0.22 0.40 0.00 0.00 0.00 0.00 178.15 178.61 3g6k h ALA 29 N 1.18 1.10 -0.61 1.87 0.00 -1.73 0.58 119.26 121.64 3g6k h ALA 29 Ca 0.23 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3g6k h ALA 29 Cb 0.03 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 3g6k h ALA 29 CO -0.04 0.67 0.19 0.37 0.00 0.00 0.00 179.25 180.44 3g6k h GLN 30 N 1.21 0.92 -0.28 0.00 4.15 -0.91 -1.89 115.11 118.32 3g6k h GLN 30 Ca 0.29 -0.18 -0.14 0.00 0.77 0.00 0.00 58.65 59.40 3g6k h GLN 30 Cb 0.13 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.67 3g6k h GLN 30 CO -0.04 0.80 -0.39 1.15 -1.93 0.00 0.00 178.83 178.42 3g6k h THR 31 N 0.90 1.29 -0.53 2.39 2.02 -0.09 -1.07 112.91 117.81 3g6k h THR 31 Ca 0.20 -1.56 0.03 0.00 0.77 0.00 0.00 66.41 65.86 3g6k h THR 31 Cb 0.26 1.50 -0.04 0.00 -1.74 0.00 0.00 68.15 68.13 3g6k h THR 31 CO -0.01 0.50 0.31 1.56 0.37 0.00 0.00 175.52 178.25 3g6k h GLN 32 N 0.54 0.59 -0.90 6.66 4.20 -0.58 0.72 115.11 126.34 3g6k h GLN 32 Ca 0.05 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 3g6k h GLN 32 Cb 0.91 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 28.52 3g6k h GLN 32 CO 0.08 0.39 0.49 0.00 -0.67 0.00 0.00 178.83 179.12 3g6k h ARG 33 N 0.60 1.26 -0.75 1.46 3.08 -1.10 -1.39 114.38 117.55 3g6k h ARG 33 Ca 0.22 -0.15 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 3g6k h ARG 33 Cb 0.06 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 29.83 3g6k h ARG 33 CO -0.12 0.92 0.25 0.00 -1.07 0.00 0.00 179.97 179.96 3g6k h ALA 34 N 1.27 1.03 -0.28 0.04 0.00 -0.44 -1.65 119.26 119.23 3g6k h ALA 34 Ca 0.32 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3g6k h ALA 34 Cb 0.03 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3g6k h ALA 34 CO -0.05 0.66 0.18 0.82 0.00 0.00 0.00 179.25 180.86 3g6k h ILE 35 N 1.11 1.08 -0.35 0.00 2.04 -0.47 -1.36 117.51 119.56 3g6k h ILE 35 Ca 0.24 -0.17 -0.04 0.00 1.00 0.00 0.00 64.86 65.90 3g6k h ILE 35 Cb 0.28 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 3g6k h ILE 35 CO -0.01 0.08 0.05 0.78 0.00 0.00 0.00 178.15 179.04 3g6k h ASN 36 N 0.37 0.49 -0.36 1.72 2.35 -0.86 0.14 115.58 119.44 3g6k h ASN 36 Ca 0.10 -0.08 -0.09 0.00 -0.55 0.00 0.00 56.30 55.68 3g6k h ASN 36 Cb -0.03 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.21 3g6k h ASN 36 CO -0.02 0.53 -0.14 0.74 -1.65 0.00 0.00 177.43 176.89 3g6k h THR 37 N 0.51 1.28 -0.55 2.81 2.02 -1.09 -1.55 112.91 116.35 3g6k h THR 37 Ca 0.12 -1.24 -0.01 0.00 0.77 0.00 0.00 66.41 66.04 3g6k h THR 37 Cb 0.26 1.33 -0.03 0.00 -1.74 0.00 0.00 68.15 67.97 3g6k h THR 37 CO 0.00 0.41 0.29 0.74 0.37 0.00 0.00 175.52 177.33 3g6k h THR 38 N 0.52 1.19 -0.92 3.16 2.02 -0.74 -1.79 112.91 116.35 3g6k h THR 38 Ca 0.09 -0.50 -0.01 0.00 0.77 0.00 0.00 66.41 66.75 3g6k h THR 38 Cb 0.67 0.52 -0.04 0.00 -1.74 0.00 0.00 68.15 67.56 3g6k h THR 38 CO 0.05 0.21 0.53 0.11 0.37 0.00 0.00 175.52 176.78 3g6k h LYS 39 N 0.73 1.26 -0.54 6.66 1.57 -0.58 -1.83 116.57 123.85 3g6k h LYS 39 Ca 0.19 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.80 3g6k h LYS 39 Cb 0.07 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.10 3g6k h LYS 39 CO -0.03 0.90 0.17 1.03 -0.57 0.00 0.00 179.45 180.96 3g6k h SER 40 N 1.28 0.78 -0.54 0.86 0.87 -0.88 0.14 113.55 116.06 3g6k h SER 40 Ca 0.33 -0.20 0.05 0.00 -1.23 0.00 0.00 61.79 60.73 3g6k h SER 40 Cb -0.01 -0.20 -0.05 0.00 -0.44 0.00 0.00 62.40 61.70 3g6k h SER 40 CO -0.06 0.78 0.27 0.40 -0.53 0.00 0.00 176.83 177.69 3g6k h ILE 41 N 0.74 0.95 0.01 2.23 2.04 -0.97 0.35 117.51 122.86 3g6k h ILE 41 Ca 0.17 -0.18 -0.00 0.00 1.00 0.00 0.00 64.86 65.85 3g6k h ILE 41 Cb 0.27 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 3g6k h ILE 41 CO -0.01 0.10 -0.00 -0.07 0.00 0.00 0.00 178.15 178.16 3g6k h LEU 42 N 0.52 -0.01 -0.15 1.44 3.38 -0.99 -1.10 115.31 118.41 3g6k h LEU 42 Ca 0.24 -0.73 -0.23 0.00 0.09 0.00 0.00 57.88 57.25 3g6k h LEU 42 Cb 0.15 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.91 3g6k h LEU 42 CO -0.17 0.73 -0.81 0.40 0.09 0.00 0.00 178.44 178.69 3g6k h ILE 43 N -0.77 1.28 0.06 1.22 2.04 -0.75 -0.27 117.51 120.32 3g6k h ILE 43 Ca -0.00 -2.01 -0.33 0.00 1.00 0.00 0.00 64.86 63.52 3g6k h ILE 43 Cb 0.74 2.03 -0.04 0.00 -0.74 0.00 0.00 36.82 38.81 3g6k h ILE 43 CO 0.00 0.64 -1.91 0.59 0.00 0.00 0.00 178.15 177.47 3g6k n ASN 44 N -3.92 1.45 -0.03 1.72 3.02 0.10 -4.45 115.26 113.14 3g6k n ASN 44 Ca -0.08 0.28 -0.01 0.00 -0.03 0.00 0.00 54.58 54.74 3g6k n ASN 44 Cb 0.76 -0.39 -0.08 0.00 -0.61 0.00 0.00 39.78 39.46 3g6k n ASN 44 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3g6k n GLU 45 N -3.24 1.52 -0.06 3.52 1.02 -0.94 -4.69 120.64 117.76 3g6k n GLU 45 Ca -0.26 -0.04 -0.06 0.00 -0.02 0.00 0.00 57.16 56.78 3g6k n GLU 45 Cb 1.05 -1.26 -0.02 0.00 -0.02 0.00 0.00 31.44 31.19 3g6k n GLU 45 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 3g6k n THR 46 N -2.17 1.05 0.04 2.62 -1.04 -0.46 -4.48 114.28 109.83 3g6k n THR 46 Ca -0.10 0.25 0.03 0.00 -2.04 0.00 0.00 64.05 62.19 3g6k n THR 46 Cb 0.60 -2.10 0.42 0.00 -1.82 0.00 0.00 70.33 67.44 3g6k n THR 46 CO 0.00 0.00 0.00 -0.26 -0.64 0.00 0.00 175.07 174.17 3g6k h PHE 47 N -0.70 0.44 0.00 -1.42 0.04 -1.23 -0.44 116.94 113.62 3g6k h PHE 47 Ca 0.00 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.75 3g6k h PHE 47 Cb 0.67 -0.14 -0.00 0.00 2.20 0.00 0.00 35.95 38.68 3g6k h PHE 47 CO -0.29 0.33 -0.05 -1.35 -0.60 0.00 0.00 178.31 176.36 3g6k h PRO 48 N 0.45 0.00 0.02 1.51 0.11 -1.82 -3.30 132.00 128.97 3g6k h PRO 48 Ca 0.12 0.00 -0.39 0.00 0.11 0.00 0.00 66.00 65.83 3g6k h PRO 48 Cb 0.06 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.11 3g6k h PRO 48 CO -0.02 0.05 -2.31 1.63 -0.21 0.00 0.00 178.00 177.14 3g6k n LYS 49 N -3.35 0.65 -4.73 1.05 5.02 -0.28 -4.96 118.16 111.55 3g6k n LYS 49 Ca -0.02 0.24 -0.24 0.00 -2.02 0.00 0.00 58.31 56.27 3g6k n LYS 49 Cb 0.19 -1.56 -0.16 0.00 -0.02 0.00 0.00 35.03 33.48 3g6k n LYS 49 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 3g6k s TRP 50 N -2.51 1.47 -0.07 2.13 0.51 -0.56 -5.12 118.94 114.79 3g6k s TRP 50 Ca -0.33 -0.35 -0.30 0.00 -2.12 0.00 0.00 56.10 52.99 3g6k s TRP 50 Cb 0.10 -0.98 -0.02 0.00 -0.81 0.00 0.00 33.47 31.76 3g6k s TRP 50 CO 0.60 -0.10 1.08 0.45 -0.51 0.00 0.00 176.95 178.47 3g6k s SER 51 N -0.11 7.19 0.00 2.95 0.15 -1.26 -4.29 113.70 118.33 3g6k s SER 51 Ca 0.01 1.66 0.31 0.00 0.70 0.00 0.00 55.95 58.63 3g6k s SER 51 Cb -0.09 -2.56 1.67 0.00 -1.71 0.00 0.00 66.02 63.33 3g6k s SER 51 CO 0.01 -0.47 2.12 -0.81 1.20 0.00 0.00 173.24 175.28 3g6k n PRO 52 N 4.88 0.71 -0.03 5.44 -0.04 -1.26 -3.10 135.00 141.60 3g6k n PRO 52 Ca 0.09 -0.03 0.05 0.00 -0.04 0.00 0.00 63.50 63.57 3g6k n PRO 52 Cb 0.48 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.28 3g6k n PRO 52 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3g6k n LEU 53 N -1.12 0.07 -0.13 1.53 4.77 -1.26 -4.59 117.00 116.27 3g6k n LEU 53 Ca 0.19 0.03 0.04 0.00 -0.03 0.00 0.00 56.01 56.24 3g6k n LEU 53 Cb 0.19 0.14 0.07 0.00 -2.33 0.00 0.00 43.42 41.49 3g6k n LEU 53 CO 0.21 0.13 0.55 -0.46 -1.33 0.00 0.00 177.39 176.49 3g6k n ASN 54 N -2.44 2.30 0.00 -1.43 0.23 -1.26 -4.93 115.26 107.74 3g6k n ASN 54 Ca -0.12 -2.40 0.00 0.00 -0.53 0.00 0.00 54.58 51.53 3g6k n ASN 54 Cb 0.74 -0.19 0.00 0.00 -2.08 0.00 0.00 39.78 38.25 3g6k n ASN 54 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3g6k n GLY 55 N -0.70 0.31 0.25 4.83 0.00 -1.26 -4.94 105.19 103.68 3g6k n GLY 55 Ca 0.07 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.17 3g6k n GLY 55 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3g6k h GLU 56 N 3.98 0.00 -5.31 1.61 5.08 -1.73 -3.34 114.58 114.87 3g6k h GLU 56 Ca 0.00 0.00 -0.65 0.00 -1.00 0.00 0.00 59.36 57.71 3g6k h GLU 56 Cb 0.00 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 29.00 3g6k h GLU 56 CO 0.00 0.08 -0.74 0.42 -1.00 0.00 0.00 179.01 177.77 3g6k s ILE 57 N -4.80 3.26 0.21 3.13 1.01 -1.18 -0.32 121.20 122.51 3g6k s ILE 57 Ca -0.04 -0.59 0.10 0.00 0.00 0.00 0.00 60.65 60.12 3g6k s ILE 57 Cb 0.16 -2.39 -0.04 0.00 0.01 0.00 0.00 42.46 40.20 3g6k s ILE 57 CO 0.66 0.52 -0.10 -0.55 0.00 0.00 0.00 174.94 175.46 3g6k s SER 58 N 0.36 4.15 -0.23 3.58 0.15 -0.56 -4.72 113.70 116.43 3g6k s SER 58 Ca -0.09 -0.67 -0.05 0.00 0.70 0.00 0.00 55.95 55.84 3g6k s SER 58 Cb -0.15 -0.65 -0.01 0.00 -1.71 0.00 0.00 66.02 63.49 3g6k s SER 58 CO 0.05 0.08 -0.01 0.12 1.20 0.00 0.00 173.24 174.68 3g6k s PHE 59 N -1.89 2.99 -0.14 3.44 5.36 -0.35 -1.00 117.98 126.39 3g6k s PHE 59 Ca 0.26 -0.79 -0.28 0.00 -0.96 0.00 0.00 56.93 55.16 3g6k s PHE 59 Cb -0.08 -2.14 -0.01 0.00 -0.34 0.00 0.00 43.02 40.45 3g6k s PHE 59 CO 0.15 -0.50 0.94 0.45 -1.46 0.00 0.00 175.22 174.81 3g6k s SER 60 N 1.52 7.12 -0.03 6.13 0.15 0.12 -0.76 113.70 127.95 3g6k s SER 60 Ca 0.06 1.38 -0.01 0.00 0.70 0.00 0.00 55.95 58.08 3g6k s SER 60 Cb -0.14 -2.52 0.03 0.00 -1.71 0.00 0.00 66.02 61.68 3g6k s SER 60 CO -0.01 -0.45 0.07 -0.47 1.20 0.00 0.00 173.24 173.58 3g6k s TYR 61 N 2.15 -0.04 -0.06 3.44 5.04 -0.10 -4.66 117.35 123.11 3g6k s TYR 61 Ca 0.44 0.23 0.09 0.00 -2.44 0.00 0.00 57.07 55.40 3g6k s TYR 61 Cb -0.17 -0.15 0.14 0.00 0.35 0.00 0.00 41.96 42.13 3g6k s TYR 61 CO 0.15 -0.10 1.07 0.27 -1.34 0.00 0.00 175.55 175.60 3g6k n ASN 62 N 3.98 1.15 0.00 4.32 6.94 -1.26 -4.08 115.26 126.32 3g6k n ASN 62 Ca -0.25 -2.54 0.00 0.00 -0.02 0.00 0.00 54.58 51.78 3g6k n ASN 62 Cb 0.52 -0.31 0.00 0.00 -2.36 0.00 0.00 39.78 37.63 3g6k n ASN 62 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3g6k n GLY 63 N -0.71 1.48 3.87 4.83 0.00 -1.26 -4.85 105.19 108.55 3g6k n GLY 63 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 3g6k n GLY 63 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g6k s GLY 64 N -2.00 1.67 0.37 -0.02 0.00 -1.26 -4.55 107.32 101.53 3g6k s GLY 64 Ca 0.00 -0.91 0.08 0.00 0.00 0.00 0.00 44.72 43.89 3g6k s GLY 64 CO 0.00 -0.24 1.90 0.07 0.00 0.00 0.00 173.10 174.82 3g6k h LYS 65 N -1.53 0.31 0.06 2.90 2.10 -1.97 -0.16 116.57 118.28 3g6k h LYS 65 Ca -0.46 -0.07 -0.11 0.00 -2.00 0.00 0.00 60.65 58.01 3g6k h LYS 65 Cb 1.28 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 3g6k h LYS 65 CO 0.50 0.43 -0.51 -0.44 -2.00 0.00 0.00 179.45 177.42 3g6k h ASP 66 N 0.29 0.20 0.79 7.07 3.32 -1.93 -1.34 116.42 124.83 3g6k h ASP 66 Ca 0.06 -0.93 -0.05 0.00 0.02 0.00 0.00 57.03 56.13 3g6k h ASP 66 Cb 0.38 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 3g6k h ASP 66 CO 0.02 1.23 -0.24 0.00 -1.72 0.00 0.00 179.24 178.53 3g6k h GLN 68 N 0.00 0.27 -0.46 0.00 4.15 -1.03 0.86 115.11 118.91 3g6k h GLN 68 Ca -0.00 -0.11 0.06 0.00 0.77 0.00 0.00 58.65 59.36 3g6k h GLN 68 Cb 0.70 -0.01 -0.05 0.00 0.21 0.00 0.00 27.48 28.33 3g6k h GLN 68 CO 0.03 0.59 0.16 0.28 -1.93 0.00 0.00 178.83 177.97 3g6k h VAL 69 N -0.06 0.86 -0.79 2.39 2.07 -1.03 -1.31 116.25 118.38 3g6k h VAL 69 Ca 0.03 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 3g6k h VAL 69 Cb 0.50 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 3g6k h VAL 69 CO 0.02 0.06 0.43 0.25 0.02 0.00 0.00 177.57 178.35 3g6k h LEU 70 N 0.34 0.99 -0.59 2.57 5.85 -1.03 -1.17 115.31 122.26 3g6k h LEU 70 Ca 0.21 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 3g6k h LEU 70 Cb 0.21 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 3g6k h LEU 70 CO -0.22 0.79 0.33 0.25 -0.34 0.00 0.00 178.44 179.25 3g6k h LEU 71 N 1.11 0.74 -0.61 2.25 5.85 -0.11 0.26 115.31 124.79 3g6k h LEU 71 Ca 0.28 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.93 3g6k h LEU 71 Cb 0.03 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 3g6k h LEU 71 CO -0.05 0.62 0.39 -0.07 -0.34 0.00 0.00 178.44 178.99 3g6k h LEU 72 N 0.80 0.66 -0.70 2.25 3.38 -0.73 0.06 115.31 121.04 3g6k h LEU 72 Ca 0.21 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 58.04 3g6k h LEU 72 Cb 0.04 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3g6k h LEU 72 CO -0.03 0.47 -0.40 -0.07 0.09 0.00 0.00 178.44 178.50 3g6k h LEU 73 N 0.79 0.57 -0.20 1.67 3.38 -0.79 -1.30 115.31 119.43 3g6k h LEU 73 Ca 0.24 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3g6k h LEU 73 Cb -0.04 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3g6k h LEU 73 CO -0.07 0.91 0.02 0.22 0.09 0.00 0.00 178.44 179.60 3g6k h TYR 74 N 0.45 0.36 -0.76 1.13 3.20 -0.17 0.09 116.97 121.27 3g6k h TYR 74 Ca 0.04 -0.06 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 3g6k h TYR 74 Cb 0.89 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 39.03 3g6k h TYR 74 CO 0.03 0.51 0.47 -0.07 -1.64 0.00 0.00 178.16 177.46 3g6k h LEU 75 N 0.11 0.91 -0.58 2.82 3.38 -0.92 0.07 115.31 121.10 3g6k h LEU 75 Ca 0.06 -0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.02 3g6k h LEU 75 Cb 0.35 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.82 3g6k h LEU 75 CO 0.01 0.70 0.31 -1.28 0.09 0.00 0.00 178.44 178.27 3g6k h SER 76 N 1.04 0.46 0.11 -0.43 0.87 -0.98 -1.92 113.55 112.70 3g6k h SER 76 Ca 0.27 0.03 -0.11 0.00 -1.23 0.00 0.00 61.79 60.75 3g6k h SER 76 Cb -0.05 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 61.84 3g6k h SER 76 CO -0.05 0.31 -0.39 0.00 -0.53 0.00 0.00 176.83 176.17 3g6k h LEU 78 N 0.31 0.36 -0.23 0.00 3.38 -0.60 0.11 115.31 118.64 3g6k h LEU 78 Ca 0.03 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 3g6k h LEU 78 Cb 0.82 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 3g6k h LEU 78 CO 0.07 0.27 0.14 -0.25 0.09 0.00 0.00 178.44 178.76 3g6k h TRP 79 N 0.43 0.31 -0.61 1.13 2.91 -1.05 -1.88 115.95 117.19 3g6k h TRP 79 Ca 0.12 -0.00 -0.03 0.00 1.13 0.00 0.00 58.89 60.10 3g6k h TRP 79 Cb -0.04 -0.10 -0.03 0.00 -0.51 0.00 0.00 29.16 28.48 3g6k h TRP 79 CO -0.05 0.24 0.25 1.49 -1.03 0.00 0.00 178.44 179.34 3g6k h GLU 80 N 0.29 0.91 -0.37 2.65 4.81 -0.80 0.17 114.58 122.24 3g6k h GLU 80 Ca 0.08 -0.16 -0.05 0.00 -0.13 0.00 0.00 59.36 59.10 3g6k h GLU 80 Cb 0.02 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.24 3g6k h GLU 80 CO -0.02 0.77 0.04 -0.92 -0.73 0.00 0.00 179.01 178.15 3g6k h TYR 81 N 0.85 0.67 0.06 0.92 3.20 -0.64 0.48 116.97 122.51 3g6k h TYR 81 Ca 0.20 -0.10 -0.37 0.00 3.14 0.00 0.00 58.73 61.60 3g6k h TYR 81 Cb 0.20 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.24 3g6k h TYR 81 CO 0.01 0.69 -2.17 0.66 -1.64 0.00 0.00 178.16 175.71 3g6k n TYR 82 N -4.53 0.72 -0.08 -3.82 4.01 -0.72 -1.84 117.16 110.90 3g6k n TYR 82 Ca -0.01 0.16 -0.23 0.00 -0.16 0.00 0.00 57.90 57.66 3g6k n TYR 82 Cb 0.25 -1.10 -0.12 0.00 -0.31 0.00 0.00 39.34 38.06 3g6k n TYR 82 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 3g6k n ILE 83 N -3.32 1.60 -0.00 -0.72 2.08 0.57 -3.34 119.36 116.22 3g6k n ILE 83 Ca -0.36 -0.32 -0.18 0.00 0.56 0.00 0.00 62.75 62.45 3g6k n ILE 83 Cb 1.04 -1.86 -0.14 0.00 -0.75 0.00 0.00 39.64 37.92 3g6k n ILE 83 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 3g6k h VAL 84 N -0.61 1.52 -0.00 1.39 2.07 -1.25 -3.33 116.25 116.03 3g6k h VAL 84 Ca -0.46 -2.44 0.00 0.00 0.82 0.00 0.00 66.70 64.61 3g6k h VAL 84 Cb 1.62 3.16 0.00 0.00 -1.52 0.00 0.00 31.29 34.55 3g6k h VAL 84 CO -0.16 0.66 -0.29 0.29 0.02 0.00 0.00 177.57 178.09 3g6k n LYS 85 N -4.27 0.57 -3.68 1.57 5.02 0.14 -4.97 118.16 112.53 3g6k n LYS 85 Ca -0.15 -0.31 -0.26 0.00 -2.02 0.00 0.00 58.31 55.58 3g6k n LYS 85 Cb 0.71 -1.49 0.06 0.00 -0.02 0.00 0.00 35.03 34.29 3g6k n LYS 85 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3g6k n LEU 86 N -0.95 -3.15 -4.81 -0.35 7.99 -1.21 -4.96 117.00 109.57 3g6k n LEU 86 Ca 0.11 -0.60 -0.33 0.00 -0.01 0.00 0.00 56.01 55.17 3g6k n LEU 86 Cb 0.33 -2.90 -0.00 0.00 -0.11 0.00 0.00 43.42 40.74 3g6k n LEU 86 CO 0.28 0.60 0.71 -0.44 -1.51 0.00 0.00 177.39 177.03 3g6k s SER 87 N -3.30 5.98 0.24 -1.43 0.01 -0.76 -4.97 113.70 109.47 3g6k s SER 87 Ca 0.61 1.81 -0.30 0.00 1.31 0.00 0.00 55.95 59.38 3g6k s SER 87 Cb -0.28 -2.54 -0.09 0.00 0.21 0.00 0.00 66.02 63.32 3g6k s SER 87 CO 0.75 -1.03 1.03 -1.58 0.41 0.00 0.00 173.24 172.82 3g6k s GLN 88 N -3.92 4.73 0.00 12.44 0.74 -1.26 -4.81 119.66 127.57 3g6k s GLN 88 Ca 0.64 1.65 0.00 0.00 0.05 0.00 0.00 55.36 57.70 3g6k s GLN 88 Cb -0.15 -3.24 0.00 0.00 1.10 0.00 0.00 33.01 30.71 3g6k s GLN 88 CO 0.33 0.32 0.00 -1.13 -0.55 0.00 0.00 175.29 174.26 3g6k n SER 89 N 1.51 0.00 -4.48 6.67 3.41 -1.26 -5.12 113.62 114.35 3g6k n SER 89 Ca -0.01 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.31 3g6k n SER 89 Cb 0.46 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.30 3g6k n SER 89 CO 0.00 0.00 0.00 -2.84 -0.16 0.00 0.00 175.04 172.04 3g6k s PRO 99 N 3.48 1.75 -0.03 4.33 0.02 -1.26 -5.28 135.00 138.02 3g6k s PRO 99 Ca 0.00 -1.25 -0.30 0.00 0.02 0.00 0.00 61.00 59.47 3g6k s PRO 99 Cb 0.00 -2.07 -0.04 0.00 0.02 0.00 0.00 34.50 32.41 3g6k s PRO 99 CO 0.00 0.46 1.31 -1.17 -0.33 0.00 0.00 177.00 177.27 3g6k s LEU 100 N -2.30 4.30 -0.08 -5.54 2.96 -1.26 -4.91 118.68 111.86 3g6k s LEU 100 Ca 0.19 1.98 0.17 0.00 -0.22 0.00 0.00 54.13 56.24 3g6k s LEU 100 Cb -0.10 -3.56 -0.25 0.00 0.50 0.00 0.00 46.19 42.78 3g6k s LEU 100 CO 0.10 -0.66 0.27 0.35 -1.32 0.00 0.00 176.35 175.09 3g6k n THR 101 N 4.65 0.42 -3.85 3.68 -2.24 -1.26 -4.80 114.28 110.87 3g6k n THR 101 Ca 0.12 -0.51 -0.12 0.00 -2.27 0.00 0.00 64.05 61.27 3g6k n THR 101 Cb 0.45 -0.15 -0.10 0.00 -2.10 0.00 0.00 70.33 68.43 3g6k n THR 101 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3g6k s LYS 102 N -2.92 0.51 -0.26 -0.78 -0.14 -1.26 -4.34 119.74 110.55 3g6k s LYS 102 Ca -0.07 -0.35 -0.15 0.00 -1.36 0.00 0.00 55.97 54.04 3g6k s LYS 102 Cb 0.09 0.21 -0.04 0.00 -1.68 0.00 0.00 37.83 36.42 3g6k s LYS 102 CO 0.71 -0.12 0.38 -1.17 -0.76 0.00 0.00 175.35 174.38 3g6k s LEU 103 N -1.34 4.06 0.10 3.17 2.96 0.27 -4.71 118.68 123.18 3g6k s LEU 103 Ca -0.14 0.32 -0.31 0.00 -0.22 0.00 0.00 54.13 53.79 3g6k s LEU 103 Cb -0.07 -2.44 -0.10 0.00 0.50 0.00 0.00 46.19 44.08 3g6k s LEU 103 CO 0.02 -0.17 1.90 -2.84 -1.32 0.00 0.00 176.35 173.94 3g6k s PRO 104 N 1.95 4.13 0.04 0.98 0.02 -1.26 -0.34 135.00 140.52 3g6k s PRO 104 Ca 0.16 2.63 0.02 0.00 0.02 0.00 0.00 61.00 63.82 3g6k s PRO 104 Cb -0.16 -3.80 -0.02 0.00 0.02 0.00 0.00 34.50 30.54 3g6k s PRO 104 CO 0.09 -0.89 -0.07 0.99 -0.33 0.00 0.00 177.00 176.79 3g6k s THR 105 N 3.37 0.52 -0.04 0.99 2.01 -0.39 -1.21 115.64 120.88 3g6k s THR 105 Ca 0.84 -0.97 0.00 0.00 0.31 0.00 0.00 61.69 61.87 3g6k s THR 105 Cb -0.45 -0.57 0.03 0.00 0.01 0.00 0.00 72.50 71.51 3g6k s THR 105 CO 0.39 -0.32 -0.01 0.54 -0.69 0.00 0.00 174.62 174.52 3g6k s VAL 106 N -1.23 0.29 -0.12 3.82 0.11 0.06 -1.06 120.40 122.27 3g6k s VAL 106 Ca -0.09 0.04 0.03 0.00 -2.93 0.00 0.00 61.98 59.03 3g6k s VAL 106 Cb -0.09 -0.38 0.01 0.00 -1.53 0.00 0.00 36.38 34.39 3g6k s VAL 106 CO 0.00 0.18 -0.21 0.12 -3.33 0.00 0.00 175.10 171.87 3g6k s PHE 107 N 1.12 2.42 -0.48 1.54 5.36 0.06 -0.93 117.98 127.07 3g6k s PHE 107 Ca -0.08 -1.13 -0.21 0.00 -0.96 0.00 0.00 56.93 54.54 3g6k s PHE 107 Cb -0.14 -1.66 0.04 0.00 -0.34 0.00 0.00 43.02 40.92 3g6k s PHE 107 CO -0.02 -0.51 0.72 0.42 -1.46 0.00 0.00 175.22 174.38 3g6k s ILE 108 N 0.71 4.72 0.25 3.12 -1.09 -1.26 -1.19 121.20 126.46 3g6k s ILE 108 Ca -0.11 0.03 -0.07 0.00 -2.23 0.00 0.00 60.65 58.27 3g6k s ILE 108 Cb -0.16 -4.32 -0.06 0.00 -1.58 0.00 0.00 42.46 36.34 3g6k s ILE 108 CO 0.01 -0.78 0.54 -0.62 -1.23 0.00 0.00 174.94 172.86 3g6k s ASP 109 N 2.39 6.54 0.06 3.58 2.15 -1.26 -4.92 116.67 125.21 3g6k s ASP 109 Ca 0.23 0.82 -0.02 0.00 0.43 0.00 0.00 52.55 54.01 3g6k s ASP 109 Cb -0.15 -2.19 -0.03 0.00 -0.30 0.00 0.00 42.92 40.25 3g6k s ASP 109 CO 0.18 -0.12 0.01 -1.00 -0.17 0.00 0.00 175.17 174.07 3g6k s HIS 110 N -1.92 0.44 -0.63 -5.34 3.76 -1.26 -4.35 115.29 105.98 3g6k s HIS 110 Ca 0.46 -0.95 0.23 0.00 -0.15 0.00 0.00 55.06 54.64 3g6k s HIS 110 Cb -0.11 -0.32 0.91 0.00 1.11 0.00 0.00 32.58 34.17 3g6k s HIS 110 CO 0.25 -0.40 1.69 -0.40 -0.85 0.00 0.00 174.74 175.03 3g6k n ASP 111 N 0.14 0.55 -0.77 1.40 5.68 -1.09 -2.31 116.55 120.15 3g6k n ASP 111 Ca -0.15 0.62 0.03 0.00 -0.50 0.00 0.00 54.79 54.79 3g6k n ASP 111 Cb 0.61 -0.74 0.20 0.00 -1.14 0.00 0.00 41.12 40.05 3g6k n ASP 111 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 3g6k n ASP 112 N -2.09 2.49 -4.77 -1.12 5.75 -1.26 -5.01 116.55 110.55 3g6k n ASP 112 Ca 0.03 -3.56 -0.39 0.00 -0.01 0.00 0.00 54.79 50.87 3g6k n ASP 112 Cb 0.25 -0.56 -0.06 0.00 -1.03 0.00 0.00 41.12 39.73 3g6k n ASP 112 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3g6k s THR 113 N -3.11 4.00 0.26 2.12 2.01 -0.98 -0.63 115.64 119.32 3g6k s THR 113 Ca 0.40 1.84 -0.31 0.00 0.31 0.00 0.00 61.69 63.93 3g6k s THR 113 Cb 0.36 -4.10 -0.12 0.00 0.01 0.00 0.00 72.50 68.65 3g6k s THR 113 CO 0.00 0.30 1.55 0.49 -0.69 0.00 0.00 174.62 176.27 3g6k n PHE 114 N 0.96 2.61 -0.10 4.92 3.72 -1.26 -4.82 117.46 123.49 3g6k n PHE 114 Ca 0.00 0.29 0.03 0.00 -0.05 0.00 0.00 57.45 57.72 3g6k n PHE 114 Cb 0.48 -2.56 0.35 0.00 -0.94 0.00 0.00 39.48 36.81 3g6k n PHE 114 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 3g6k h LYS 115 N 4.85 0.72 -0.82 -1.08 1.63 -1.99 -1.08 116.57 118.81 3g6k h LYS 115 Ca -0.46 -0.04 0.01 0.00 -0.85 0.00 0.00 60.65 59.31 3g6k h LYS 115 Cb 1.24 -0.16 -0.04 0.00 -0.60 0.00 0.00 32.23 32.67 3g6k h LYS 115 CO 0.80 0.48 0.54 1.15 -3.45 0.00 0.00 179.45 178.97 3g6k h THR 116 N 0.74 1.21 -0.22 1.00 2.02 -1.90 -0.56 112.91 115.21 3g6k h THR 116 Ca 0.22 -0.38 -0.15 0.00 0.77 0.00 0.00 66.41 66.86 3g6k h THR 116 Cb -0.03 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.38 3g6k h THR 116 CO -0.05 0.20 -0.46 0.25 0.37 0.00 0.00 175.52 175.83 3g6k h LEU 117 N 1.11 0.78 -0.41 2.58 5.85 -1.61 -0.50 115.31 123.11 3g6k h LEU 117 Ca 0.30 -0.55 0.07 0.00 0.84 0.00 0.00 57.88 58.54 3g6k h LEU 117 Cb -0.13 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 40.62 3g6k h LEU 117 CO -0.07 1.19 0.06 -0.33 -0.34 0.00 0.00 178.44 178.96 3g6k h GLU 118 N 0.41 0.18 -0.65 1.25 4.39 -0.82 0.69 114.58 120.02 3g6k h GLU 118 Ca 0.00 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 3g6k h GLU 118 Cb 1.07 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.65 3g6k h GLU 118 CO 0.10 0.12 0.31 -0.91 -1.16 0.00 0.00 179.01 177.47 3g6k h ASN 119 N 0.18 0.85 -0.39 1.42 2.35 -0.99 -2.06 115.58 116.95 3g6k h ASN 119 Ca 0.20 -0.13 -0.13 0.00 -0.55 0.00 0.00 56.30 55.69 3g6k h ASN 119 Cb 0.26 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 3g6k h ASN 119 CO -0.28 0.75 -0.25 0.15 -1.65 0.00 0.00 177.43 176.14 3g6k h PHE 120 N 0.90 1.04 -0.55 1.19 3.57 -0.53 -0.51 116.94 122.05 3g6k h PHE 120 Ca 0.22 -0.26 0.01 0.00 3.53 0.00 0.00 57.97 61.48 3g6k h PHE 120 Cb 0.12 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 38.59 3g6k h PHE 120 CO 0.00 1.05 0.35 0.82 -2.23 0.00 0.00 178.31 178.30 3g6k h ILE 121 N 0.77 1.10 -0.40 1.41 2.04 -0.79 0.45 117.51 122.10 3g6k h ILE 121 Ca 0.10 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.68 3g6k h ILE 121 Cb 0.81 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.21 3g6k h ILE 121 CO 0.07 0.13 0.13 -0.08 0.00 0.00 0.00 178.15 178.40 3g6k h GLU 122 N 0.70 0.61 -0.04 2.37 4.81 -0.99 -0.02 114.58 122.03 3g6k h GLU 122 Ca 0.21 -0.13 -0.18 0.00 -0.13 0.00 0.00 59.36 59.13 3g6k h GLU 122 Cb -0.03 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 3g6k h GLU 122 CO -0.07 0.61 -0.75 0.93 -0.73 0.00 0.00 179.01 178.99 3g6k h GLU 123 N 0.50 0.27 0.00 1.92 4.39 -0.88 -2.53 114.58 118.25 3g6k h GLU 123 Ca 0.13 -0.24 -0.10 0.00 0.34 0.00 0.00 59.36 59.49 3g6k h GLU 123 Cb 0.24 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 3g6k h GLU 123 CO -0.01 0.91 -0.47 1.79 -1.16 0.00 0.00 179.01 180.07 3g6k h THR 124 N 0.18 0.90 -0.58 1.13 1.35 -0.86 -1.77 112.91 113.26 3g6k h THR 124 Ca -0.03 -1.96 -0.02 0.00 -0.55 0.00 0.00 66.41 63.85 3g6k h THR 124 Cb 1.33 2.23 -0.03 0.00 -1.73 0.00 0.00 68.15 69.95 3g6k h THR 124 CO 0.12 0.46 0.28 0.77 -0.25 0.00 0.00 175.52 176.89 3g6k h SER 125 N 0.00 0.73 -0.03 5.36 4.64 -0.70 0.05 113.55 123.60 3g6k h SER 125 Ca -0.00 -0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.24 3g6k h SER 125 Cb 1.19 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 63.09 3g6k h SER 125 CO 0.06 0.62 -0.01 -0.07 -0.87 0.00 0.00 176.83 176.56 3g6k h LEU 126 N 0.81 0.07 -0.62 5.97 3.38 -1.14 -0.26 115.31 123.51 3g6k h LEU 126 Ca 0.20 -0.40 0.01 0.00 0.09 0.00 0.00 57.88 57.79 3g6k h LEU 126 Cb 0.09 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 3g6k h LEU 126 CO -0.03 0.45 0.41 -0.09 0.09 0.00 0.00 178.44 179.27 3g6k h ARG 127 N -0.32 0.80 -0.48 1.13 2.43 -0.93 -2.76 114.38 114.25 3g6k h ARG 127 Ca 0.01 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3g6k h ARG 127 Cb 0.42 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 3g6k h ARG 127 CO 0.00 0.53 0.00 0.66 -1.51 0.00 0.00 179.97 179.65 3g6k n TYR 128 N -4.67 0.64 -3.74 2.20 4.01 -0.03 -4.61 117.16 110.96 3g6k n TYR 128 Ca 0.05 -0.32 -0.22 0.00 -0.16 0.00 0.00 57.90 57.25 3g6k n TYR 128 Cb 0.03 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.09 3g6k n TYR 128 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 3g6k n SER 129 N 1.08 -1.25 -4.77 7.72 7.64 -0.78 -4.73 113.62 118.54 3g6k n SER 129 Ca 0.18 -0.84 -0.40 0.00 1.01 0.00 0.00 58.87 58.83 3g6k n SER 129 Cb 0.47 -3.95 -0.06 0.00 -1.01 0.00 0.00 64.21 59.66 3g6k n SER 129 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3g6k s LEU 130 N -6.73 4.61 -0.65 -3.43 1.43 -0.18 -0.56 118.68 113.17 3g6k s LEU 130 Ca 0.04 1.73 -0.17 0.00 -1.03 0.00 0.00 54.13 54.69 3g6k s LEU 130 Cb -0.02 -3.39 0.13 0.00 0.03 0.00 0.00 46.19 42.95 3g6k s LEU 130 CO 0.82 0.19 0.70 -0.55 0.23 0.00 0.00 176.35 177.74 3g6k s SER 131 N -1.16 6.32 -0.32 2.29 0.15 0.54 -4.75 113.70 116.77 3g6k s SER 131 Ca 0.37 -1.79 -0.16 0.00 0.70 0.00 0.00 55.95 55.06 3g6k s SER 131 Cb -0.24 -2.27 -0.02 0.00 -1.71 0.00 0.00 66.02 61.78 3g6k s SER 131 CO 0.28 -0.95 0.44 -0.22 1.20 0.00 0.00 173.24 173.98 3g6k s LEU 132 N 1.98 4.26 -0.15 3.45 2.96 -1.26 -1.27 118.68 128.65 3g6k s LEU 132 Ca 0.12 0.05 -0.16 0.00 -0.22 0.00 0.00 54.13 53.92 3g6k s LEU 132 Cb -0.22 -2.48 -0.04 0.00 0.50 0.00 0.00 46.19 43.95 3g6k s LEU 132 CO 0.01 -0.35 0.40 -0.47 -1.32 0.00 0.00 176.35 174.63 3g6k s TYR 133 N 2.20 3.47 -0.14 5.38 5.04 -0.23 -5.00 117.35 128.07 3g6k s TYR 133 Ca 0.16 0.75 0.02 0.00 -2.44 0.00 0.00 57.07 55.56 3g6k s TYR 133 Cb -0.16 -2.47 0.01 0.00 0.35 0.00 0.00 41.96 39.68 3g6k s TYR 133 CO 0.12 0.17 -0.21 -1.21 -1.34 0.00 0.00 175.55 173.08 3g6k s GLU 134 N 0.67 3.06 1.05 4.97 2.02 -1.26 -0.76 118.70 128.45 3g6k s GLU 134 Ca 0.22 -0.83 -0.12 0.00 0.02 0.00 0.00 54.97 54.25 3g6k s GLU 134 Cb -0.14 -2.48 0.22 0.00 0.10 0.00 0.00 34.13 31.83 3g6k s GLU 134 CO 0.08 -0.01 1.07 -1.54 0.02 0.00 0.00 175.26 174.87 3g6k s SER 135 N 0.83 2.11 -0.31 -0.19 1.04 -0.34 -4.90 113.70 111.94 3g6k s SER 135 Ca -0.06 1.35 -0.29 0.00 0.48 0.00 0.00 55.95 57.43 3g6k s SER 135 Cb -0.15 -2.05 -0.00 0.00 0.10 0.00 0.00 66.02 63.91 3g6k s SER 135 CO -0.02 -3.47 1.37 -0.62 0.98 0.00 0.00 173.24 171.48 3g6k s ASP 136 N -3.11 6.56 0.41 7.02 -1.08 -1.26 -4.18 116.67 121.03 3g6k s ASP 136 Ca 0.66 1.20 0.14 0.00 -0.52 0.00 0.00 52.55 54.03 3g6k s ASP 136 Cb -0.21 -2.54 1.00 0.00 -1.46 0.00 0.00 42.92 39.72 3g6k s ASP 136 CO 0.60 -1.18 1.89 -0.09 0.52 0.00 0.00 175.17 176.91 3g6k h ARG 137 N 9.80 0.47 -0.35 4.34 2.43 -1.91 -2.60 114.38 126.56 3g6k h ARG 137 Ca -0.28 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.87 3g6k h ARG 137 Cb 1.11 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.55 3g6k h ARG 137 CO 1.04 0.31 0.00 -0.25 -1.51 0.00 0.00 179.97 179.56 3g6k n ASP 138 N -4.51 4.32 -4.71 -3.80 8.00 -1.26 -2.66 116.55 111.94 3g6k n ASP 138 Ca 0.16 -2.94 -0.35 0.00 0.71 0.00 0.00 54.79 52.37 3g6k n ASP 138 Cb 0.56 -0.57 -0.08 0.00 -0.02 0.00 0.00 41.12 41.01 3g6k n ASP 138 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3g6k s LYS 139 N -2.71 4.15 -0.56 -1.24 2.20 -0.98 -5.06 119.74 115.52 3g6k s LYS 139 Ca 0.45 -0.24 -0.28 0.00 -0.36 0.00 0.00 55.97 55.53 3g6k s LYS 139 Cb 0.35 -3.40 0.03 0.00 -1.51 0.00 0.00 37.83 33.30 3g6k s LYS 139 CO 0.11 0.27 1.16 0.00 -0.36 0.00 0.00 175.35 176.53 3g6k s GLU 141 N 4.79 1.04 0.81 0.00 -1.05 -1.26 -5.14 118.70 117.90 3g6k s GLU 141 Ca 0.42 -0.03 -0.12 0.00 -0.15 0.00 0.00 54.97 55.10 3g6k s GLU 141 Cb -0.08 0.48 0.08 0.00 -0.44 0.00 0.00 34.13 34.17 3g6k s GLU 141 CO 0.26 -0.36 1.10 0.95 0.95 0.00 0.00 175.26 178.16 3g6k s THR 142 N -1.92 2.97 0.27 1.83 -4.23 -1.26 -4.83 115.64 108.47 3g6k s THR 142 Ca -0.08 0.32 -0.02 0.00 -1.18 0.00 0.00 61.69 60.73 3g6k s THR 142 Cb -0.01 -3.04 0.27 0.00 1.34 0.00 0.00 72.50 71.06 3g6k s THR 142 CO 0.03 -0.41 1.88 -0.03 -0.54 0.00 0.00 174.62 175.54 3g6k h MET 143 N -1.14 1.13 -0.67 3.99 4.05 -2.01 -0.73 114.93 119.54 3g6k h MET 143 Ca -0.47 -0.07 -0.05 0.00 -0.28 0.00 0.00 59.70 58.83 3g6k h MET 143 Cb 1.27 -0.25 -0.03 0.00 -0.80 0.00 0.00 31.60 31.79 3g6k h MET 143 CO 0.59 0.74 0.22 0.00 0.23 0.00 0.00 176.91 178.70 3g6k h ALA 144 N 1.47 0.88 -0.37 0.39 0.00 -1.94 -0.70 119.26 118.98 3g6k h ALA 144 Ca 0.44 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 55.03 3g6k h ALA 144 Cb 0.20 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3g6k h ALA 144 CO -0.18 0.54 -0.23 0.93 0.00 0.00 0.00 179.25 180.31 3g6k h GLU 145 N 0.97 0.73 -0.62 0.00 5.08 -1.78 0.22 114.58 119.18 3g6k h GLU 145 Ca 0.22 -0.29 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 3g6k h GLU 145 Cb 0.28 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 3g6k h GLU 145 CO -0.01 0.90 0.08 0.00 -1.00 0.00 0.00 179.01 178.98 3g6k h ALA 146 N 1.10 0.97 0.00 3.43 0.00 -0.67 -2.23 119.26 121.86 3g6k h ALA 146 Ca 0.09 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 3g6k h ALA 146 Cb 0.72 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3g6k h ALA 146 CO 0.06 0.64 -0.46 0.74 0.00 0.00 0.00 179.25 180.23 3g6k h PHE 147 N 0.96 0.00 -0.63 0.00 0.04 -0.85 -1.59 116.94 114.87 3g6k h PHE 147 Ca 0.19 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.91 3g6k h PHE 147 Cb 0.44 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.56 3g6k h PHE 147 CO 0.03 0.46 0.20 1.49 -0.60 0.00 0.00 178.31 179.89 3g6k h GLU 148 N 0.00 0.97 -0.38 1.51 4.57 -0.51 -0.14 114.58 120.60 3g6k h GLU 148 Ca -0.00 -0.20 -0.02 0.00 -1.18 0.00 0.00 59.36 57.95 3g6k h GLU 148 Cb 0.86 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 29.29 3g6k h GLU 148 CO 0.06 0.85 0.16 1.15 -1.18 0.00 0.00 179.01 180.05 3g6k h THR 149 N 0.90 1.19 -0.52 0.32 2.02 -1.20 -2.27 112.91 113.34 3g6k h THR 149 Ca 0.20 -0.57 0.08 0.00 0.77 0.00 0.00 66.41 66.89 3g6k h THR 149 Cb 0.28 0.86 -0.07 0.00 -1.74 0.00 0.00 68.15 67.48 3g6k h THR 149 CO -0.01 0.21 0.16 0.15 0.37 0.00 0.00 175.52 176.40 3g6k h PHE 150 N 0.47 0.27 0.00 3.16 3.57 -0.89 -1.21 116.94 122.31 3g6k h PHE 150 Ca 0.13 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 3g6k h PHE 150 Cb 0.18 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 38.87 3g6k h PHE 150 CO -0.00 0.05 -0.12 -0.07 -2.23 0.00 0.00 178.31 175.95 3g6k h LEU 151 N 0.32 0.00 -0.49 0.59 3.38 -0.79 0.06 115.31 118.37 3g6k h LEU 151 Ca 0.26 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.07 3g6k h LEU 151 Cb 0.32 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 3g6k h LEU 151 CO -0.29 0.12 -0.46 1.56 0.09 0.00 0.00 178.44 179.45 3g6k h GLN 152 N 0.00 0.71 -0.17 1.13 4.20 -0.66 -2.11 115.11 118.21 3g6k h GLN 152 Ca -0.00 -0.40 -0.19 0.00 0.06 0.00 0.00 58.65 58.12 3g6k h GLN 152 Cb 0.46 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.27 3g6k h GLN 152 CO 0.02 1.02 -0.66 0.28 -0.67 0.00 0.00 178.83 178.82 3g6k h VAL 153 N 0.57 1.32 -2.32 -0.54 2.07 -0.65 -3.37 116.25 113.32 3g6k h VAL 153 Ca 0.03 -1.92 -0.59 0.00 0.82 0.00 0.00 66.70 65.04 3g6k h VAL 153 Cb 1.02 1.89 -0.41 0.00 -1.52 0.00 0.00 31.29 32.27 3g6k h VAL 153 CO 0.10 0.60 -0.72 0.49 0.02 0.00 0.00 177.57 178.06 3g6k n PHE 154 N -3.93 2.46 0.49 1.57 3.72 -0.06 -4.93 117.46 116.78 3g6k n PHE 154 Ca -0.05 -4.01 0.07 0.00 -0.05 0.00 0.00 57.45 53.42 3g6k n PHE 154 Cb 0.67 -0.47 0.31 0.00 -0.94 0.00 0.00 39.48 39.05 3g6k n PHE 154 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 3g6k n PRO 155 N 1.29 0.01 0.07 -1.08 -0.04 -0.80 -1.71 135.00 132.73 3g6k n PRO 155 Ca 0.26 0.26 0.11 0.00 -0.04 0.00 0.00 63.50 64.09 3g6k n PRO 155 Cb 0.43 -1.51 0.44 0.00 -0.04 0.00 0.00 33.50 32.81 3g6k n PRO 155 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 3g6k n GLU 156 N -1.53 0.12 -2.19 0.54 0.00 -1.26 -4.81 120.64 111.51 3g6k n GLU 156 Ca 0.03 0.28 -0.42 0.00 0.00 0.00 0.00 57.16 57.06 3g6k n GLU 156 Cb 0.17 -1.70 -0.03 0.00 0.00 0.00 0.00 31.44 29.88 3g6k n GLU 156 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 3g6k s THR 157 N -3.15 3.56 -0.02 3.84 2.01 -0.69 -4.19 115.64 117.00 3g6k s THR 157 Ca 0.07 1.01 0.09 0.00 0.31 0.00 0.00 61.69 63.18 3g6k s THR 157 Cb 0.11 -3.65 -0.14 0.00 0.01 0.00 0.00 72.50 68.83 3g6k s THR 157 CO 0.41 0.02 0.18 0.29 -0.69 0.00 0.00 174.62 174.83 3g6k n LYS 158 N 5.02 0.56 -3.68 4.92 5.02 0.56 -4.98 118.16 125.57 3g6k n LYS 158 Ca 0.13 -0.08 -0.14 0.00 -2.02 0.00 0.00 58.31 56.20 3g6k n LYS 158 Cb 0.43 -1.22 -0.08 0.00 -0.02 0.00 0.00 35.03 34.14 3g6k n LYS 158 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3g6k s ALA 159 N -2.59 -1.20 -0.04 7.82 0.00 -0.62 -1.19 121.76 123.95 3g6k s ALA 159 Ca -0.04 1.01 0.02 0.00 0.00 0.00 0.00 51.96 52.96 3g6k s ALA 159 Cb 0.06 -0.33 0.01 0.00 0.00 0.00 0.00 23.12 22.86 3g6k s ALA 159 CO 0.38 -0.27 -0.09 0.42 0.00 0.00 0.00 175.76 176.20 3g6k s ILE 160 N -0.61 0.85 0.09 0.00 1.01 0.02 -1.49 121.20 121.07 3g6k s ILE 160 Ca -0.07 -0.36 -0.25 0.00 0.00 0.00 0.00 60.65 59.98 3g6k s ILE 160 Cb -0.03 -0.78 -0.06 0.00 0.01 0.00 0.00 42.46 41.59 3g6k s ILE 160 CO 0.04 0.28 0.75 -0.69 0.00 0.00 0.00 174.94 175.32 3g6k s VAL 161 N 0.45 4.60 -0.02 2.92 1.01 -0.17 -0.87 120.40 128.32 3g6k s VAL 161 Ca -0.08 1.62 0.01 0.00 0.00 0.00 0.00 61.98 63.53 3g6k s VAL 161 Cb -0.12 -4.10 0.01 0.00 0.00 0.00 0.00 36.38 32.17 3g6k s VAL 161 CO 0.01 0.44 -0.05 -0.63 0.00 0.00 0.00 175.10 174.88 3g6k s ILE 162 N -0.54 0.45 -0.37 2.22 1.01 0.29 -0.70 121.20 123.56 3g6k s ILE 162 Ca 0.37 -0.16 -0.00 0.00 0.00 0.00 0.00 60.65 60.85 3g6k s ILE 162 Cb -0.21 -0.44 0.32 0.00 0.01 0.00 0.00 42.46 42.14 3g6k s ILE 162 CO 0.24 0.17 1.88 0.61 0.00 0.00 0.00 174.94 177.83 3g6k n GLY 163 N 3.48 4.27 3.79 6.18 0.00 -1.26 -4.30 105.19 117.35 3g6k n GLY 163 Ca -0.19 -1.19 -0.35 0.00 0.00 0.00 0.00 46.02 44.28 3g6k n GLY 163 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3g6k s ILE 164 N -2.70 3.93 0.20 -0.61 2.07 -1.26 -4.47 121.20 118.35 3g6k s ILE 164 Ca 0.39 1.34 0.11 0.00 -1.41 0.00 0.00 60.65 61.08 3g6k s ILE 164 Cb 0.31 -3.63 -0.04 0.00 0.13 0.00 0.00 42.46 39.23 3g6k s ILE 164 CO 0.02 -0.12 -0.23 -0.13 -1.91 0.00 0.00 174.94 172.57 3g6k s ARG 165 N -2.81 1.49 0.54 3.50 0.52 -1.26 -3.47 118.95 117.46 3g6k s ARG 165 Ca 0.61 -1.53 0.21 0.00 -0.52 0.00 0.00 55.73 54.50 3g6k s ARG 165 Cb -0.17 -1.75 1.41 0.00 0.52 0.00 0.00 34.95 34.96 3g6k s ARG 165 CO 0.22 0.37 2.13 0.45 0.02 0.00 0.00 175.30 178.49 3g6k h HIS 166 N 3.12 0.00 0.00 -0.53 3.86 -1.27 -0.62 115.15 119.71 3g6k h HIS 166 Ca -0.45 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.76 3g6k h HIS 166 Cb 1.21 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.68 3g6k h HIS 166 CO 0.70 0.00 0.00 0.25 0.86 0.00 0.00 177.93 179.74 3g6k n THR 167 N -4.33 0.48 -1.56 2.45 -2.24 -1.26 -3.48 114.28 104.34 3g6k n THR 167 Ca 0.00 0.08 -0.31 0.00 -2.27 0.00 0.00 64.05 61.55 3g6k n THR 167 Cb 0.22 -0.74 0.05 0.00 -2.10 0.00 0.00 70.33 67.76 3g6k n THR 167 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3g6k s ASP 168 N -3.28 5.30 0.23 3.42 1.01 -0.24 -4.92 116.67 118.19 3g6k s ASP 168 Ca 0.10 1.60 -0.31 0.00 0.71 0.00 0.00 52.55 54.65 3g6k s ASP 168 Cb 0.14 -2.46 -0.14 0.00 1.01 0.00 0.00 42.92 41.47 3g6k s ASP 168 CO 0.43 -1.49 1.36 -2.65 0.21 0.00 0.00 175.17 173.04 3g6k n PRO 169 N -3.16 1.89 -1.39 8.23 -0.02 -1.26 -0.77 135.00 138.52 3g6k n PRO 169 Ca 0.07 0.67 -0.13 0.00 -2.02 0.00 0.00 63.50 62.09 3g6k n PRO 169 Cb 0.54 -2.30 -0.06 0.00 -0.02 0.00 0.00 33.50 31.66 3g6k n PRO 169 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3g6k n PHE 170 N 1.82 0.00 0.79 6.00 3.72 -1.26 -4.88 117.46 123.65 3g6k n PHE 170 Ca 0.12 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.65 3g6k n PHE 170 Cb 0.30 -2.61 0.37 0.00 -0.94 0.00 0.00 39.48 36.60 3g6k n PHE 170 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3g6k n GLY 171 N -0.75 -1.48 0.32 1.37 0.00 0.05 -4.47 105.19 100.23 3g6k n GLY 171 Ca -0.13 -0.18 -0.00 0.00 0.00 0.00 0.00 46.02 45.71 3g6k n GLY 171 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3g6k h GLU 172 N 0.00 0.96 -0.59 1.61 4.81 -1.78 -2.94 114.58 116.65 3g6k h GLU 172 Ca 0.00 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3g6k h GLU 172 Cb 0.63 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.79 3g6k h GLU 172 CO 0.00 0.64 0.00 0.72 -0.73 0.00 0.00 179.01 179.64 3g6k n HIS 173 N -4.61 0.78 -1.81 0.92 8.25 -1.26 -4.99 115.22 112.51 3g6k n HIS 173 Ca 0.12 -0.40 -0.33 0.00 -0.26 0.00 0.00 57.72 56.84 3g6k n HIS 173 Cb 0.15 -0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.30 3g6k n HIS 173 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3g6k s LEU 174 N -1.18 3.41 0.16 2.41 1.43 -1.11 -5.06 118.68 118.74 3g6k s LEU 174 Ca 0.44 1.98 0.08 0.00 -1.03 0.00 0.00 54.13 55.60 3g6k s LEU 174 Cb 0.24 -4.55 -0.04 0.00 0.03 0.00 0.00 46.19 41.87 3g6k s LEU 174 CO 0.32 -1.56 -0.18 -0.54 0.23 0.00 0.00 176.35 174.63 3g6k s LYS 175 N -4.08 1.25 0.44 1.70 1.02 -1.26 -5.05 119.74 113.75 3g6k s LYS 175 Ca 0.67 -1.40 0.13 0.00 0.02 0.00 0.00 55.97 55.39 3g6k s LYS 175 Cb -0.20 -1.27 1.03 0.00 -0.52 0.00 0.00 37.83 36.86 3g6k s LYS 175 CO 0.41 0.26 2.00 -1.35 -0.92 0.00 0.00 175.35 175.74 3g6k h PRO 176 N 3.25 0.39 -3.46 -1.68 0.11 -1.92 -3.39 132.00 125.29 3g6k h PRO 176 Ca -0.42 -0.02 -0.45 0.00 0.11 0.00 0.00 66.00 65.22 3g6k h PRO 176 Cb 1.21 -0.09 -0.39 0.00 0.11 0.00 0.00 31.00 31.84 3g6k h PRO 176 CO 0.51 0.26 -0.76 0.42 -0.21 0.00 0.00 178.00 178.22 3g6k s ILE 177 N -5.38 0.22 0.03 4.15 1.01 -1.26 0.09 121.20 120.06 3g6k s ILE 177 Ca -0.08 -0.03 -0.28 0.00 0.00 0.00 0.00 60.65 60.27 3g6k s ILE 177 Cb 0.19 -0.58 0.07 0.00 0.01 0.00 0.00 42.46 42.15 3g6k s ILE 177 CO 0.74 0.03 0.64 0.00 0.00 0.00 0.00 174.94 176.35 3g6k s GLN 178 N 2.02 1.13 0.74 2.79 -2.07 -0.78 -5.00 119.66 118.48 3g6k s GLN 178 Ca 0.03 -0.03 -0.13 0.00 -1.82 0.00 0.00 55.36 53.41 3g6k s GLN 178 Cb -0.14 0.53 0.04 0.00 -1.09 0.00 0.00 33.01 32.35 3g6k s GLN 178 CO -0.06 -0.41 1.13 0.15 -1.32 0.00 0.00 175.29 174.78 3g6k s LYS 179 N -2.15 2.29 1.03 9.60 1.02 -1.26 0.19 119.74 130.46 3g6k s LYS 179 Ca -0.07 1.44 -0.12 0.00 0.02 0.00 0.00 55.97 57.25 3g6k s LYS 179 Cb -0.00 -1.88 0.21 0.00 -0.52 0.00 0.00 37.83 35.63 3g6k s LYS 179 CO 0.01 -1.66 1.08 0.95 -0.92 0.00 0.00 175.35 174.82 3g6k s THR 180 N -2.44 2.15 0.88 2.17 -4.23 -0.45 -4.71 115.64 109.01 3g6k s THR 180 Ca 0.67 0.05 -0.12 0.00 -1.18 0.00 0.00 61.69 61.11 3g6k s THR 180 Cb -0.22 -2.17 0.12 0.00 1.34 0.00 0.00 72.50 71.57 3g6k s THR 180 CO 0.48 -0.06 1.10 -1.81 -0.54 0.00 0.00 174.62 173.79 3g6k s ASP 181 N -2.73 3.72 0.51 3.99 1.01 -1.26 -4.93 116.67 116.99 3g6k s ASP 181 Ca 0.67 1.31 0.19 0.00 0.71 0.00 0.00 52.55 55.43 3g6k s ASP 181 Cb -0.23 -1.99 1.31 0.00 1.01 0.00 0.00 42.92 43.01 3g6k s ASP 181 CO 0.61 -2.46 2.12 0.00 0.21 0.00 0.00 175.17 175.65 3g6k h ALA 182 N -1.43 1.76 -0.13 5.23 0.00 -1.96 -1.94 119.26 120.81 3g6k h ALA 182 Ca -0.49 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.36 3g6k h ALA 182 Cb 1.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3g6k h ALA 182 CO 0.58 0.08 0.00 0.27 0.00 0.00 0.00 179.25 180.18 3g6k n ASN 183 N -4.28 1.31 -4.94 0.00 6.94 -1.26 -4.87 115.26 108.17 3g6k n ASN 183 Ca -0.03 -1.64 -0.20 0.00 -0.02 0.00 0.00 54.58 52.70 3g6k n ASN 183 Cb 0.15 -0.08 -0.02 0.00 -2.36 0.00 0.00 39.78 37.47 3g6k n ASN 183 CO 0.00 0.00 0.00 0.26 -1.03 0.00 0.00 177.26 176.49 3g6k s TRP 184 N -1.84 3.10 0.72 -2.53 0.52 -0.73 -4.96 118.94 113.21 3g6k s TRP 184 Ca 0.32 -0.21 -0.16 0.00 0.02 0.00 0.00 56.10 56.07 3g6k s TRP 184 Cb 0.17 -1.85 0.02 0.00 -1.15 0.00 0.00 33.47 30.66 3g6k s TRP 184 CO 0.26 0.14 1.08 -0.35 0.02 0.00 0.00 176.95 178.09 3g6k n PRO 185 N -1.51 0.57 -2.97 4.98 -0.04 -1.26 -4.88 135.00 129.89 3g6k n PRO 185 Ca -0.02 0.26 -0.43 0.00 -0.04 0.00 0.00 63.50 63.26 3g6k n PRO 185 Cb 0.58 -2.33 -0.05 0.00 -0.04 0.00 0.00 33.50 31.66 3g6k n PRO 185 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3g6k s ASP 186 N -1.67 6.41 0.28 3.54 2.15 -1.26 -4.75 116.67 121.36 3g6k s ASP 186 Ca 0.75 -0.11 -0.18 0.00 0.43 0.00 0.00 52.55 53.44 3g6k s ASP 186 Cb -0.34 -2.38 0.01 0.00 -0.30 0.00 0.00 42.92 39.91 3g6k s ASP 186 CO 0.48 -0.90 0.65 0.72 -0.17 0.00 0.00 175.17 175.95 3g6k s PHE 187 N 3.25 0.02 -0.00 -5.34 -0.71 -1.26 -5.00 117.98 108.93 3g6k s PHE 187 Ca 0.29 -0.46 -0.22 0.00 -1.04 0.00 0.00 56.93 55.51 3g6k s PHE 187 Cb -0.12 0.55 -0.05 0.00 -1.21 0.00 0.00 43.02 42.19 3g6k s PHE 187 CO 0.22 -1.19 0.64 0.71 -1.34 0.00 0.00 175.22 174.27 3g6k s TYR 188 N -3.82 3.68 -0.09 3.49 2.02 -0.33 -1.34 117.35 120.95 3g6k s TYR 188 Ca 0.15 1.26 -0.24 0.00 -0.37 0.00 0.00 57.07 57.87 3g6k s TYR 188 Cb -0.04 -2.68 -0.03 0.00 -0.40 0.00 0.00 41.96 38.81 3g6k s TYR 188 CO 0.08 0.30 0.74 1.03 -1.57 0.00 0.00 175.55 176.13 3g6k s ARG 189 N -0.03 4.41 -0.29 -0.62 0.52 0.13 -0.80 118.95 122.27 3g6k s ARG 189 Ca 0.33 0.93 -0.06 0.00 -0.52 0.00 0.00 55.73 56.41 3g6k s ARG 189 Cb -0.19 -3.48 0.01 0.00 0.52 0.00 0.00 34.95 31.82 3g6k s ARG 189 CO 0.18 -0.03 0.06 -0.51 0.02 0.00 0.00 175.30 175.03 3g6k s LEU 190 N 1.10 3.77 -0.55 2.53 1.43 -0.05 -1.87 118.68 125.04 3g6k s LEU 190 Ca 0.38 -0.74 0.06 0.00 -1.03 0.00 0.00 54.13 52.80 3g6k s LEU 190 Cb -0.18 -1.85 0.21 0.00 0.03 0.00 0.00 46.19 44.41 3g6k s LEU 190 CO 0.17 -0.19 0.55 0.00 0.23 0.00 0.00 176.35 177.12 3g6k n GLN 191 N 4.84 1.44 -0.12 1.70 6.02 0.11 -0.55 117.38 130.82 3g6k n GLN 191 Ca -0.15 -3.98 0.09 0.00 -0.01 0.00 0.00 57.00 52.96 3g6k n GLN 191 Cb 0.48 -1.90 0.30 0.00 1.02 0.00 0.00 30.24 30.14 3g6k n GLN 191 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 3g6k n PRO 192 N 1.67 1.85 -0.15 -1.09 -0.05 -1.26 -3.74 135.00 132.23 3g6k n PRO 192 Ca 0.25 -1.29 0.07 0.00 -0.05 0.00 0.00 63.50 62.48 3g6k n PRO 192 Cb 0.44 -1.38 0.15 0.00 -0.05 0.00 0.00 33.50 32.66 3g6k n PRO 192 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 175.50 175.34 3g6k n LEU 193 N 0.52 2.87 -0.21 1.53 7.94 -1.26 -4.40 117.00 123.99 3g6k n LEU 193 Ca 0.16 -1.68 0.05 0.00 -1.11 0.00 0.00 56.01 53.42 3g6k n LEU 193 Cb 0.36 -0.20 0.32 0.00 0.53 0.00 0.00 43.42 44.42 3g6k n LEU 193 CO 0.12 0.67 1.22 -0.07 -1.11 0.00 0.00 177.39 178.23 3g6k h LEU 194 N 2.64 0.74 -0.31 -1.96 3.38 -1.64 -1.16 115.31 116.99 3g6k h LEU 194 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3g6k h LEU 194 Cb 0.73 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.32 3g6k h LEU 194 CO 0.00 0.48 0.00 0.00 0.09 0.00 0.00 178.44 179.01 3g6k n HIS 195 N -4.47 0.01 -2.71 1.13 1.44 -1.26 -0.98 115.22 108.36 3g6k n HIS 195 Ca 0.11 -0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.41 3g6k n HIS 195 Cb 0.19 0.00 -0.05 0.00 0.12 0.00 0.00 29.99 30.25 3g6k n HIS 195 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 3g6k s TRP 196 N -1.99 3.90 0.45 -1.40 0.52 -0.44 -5.02 118.94 114.96 3g6k s TRP 196 Ca 0.43 1.86 0.07 0.00 0.02 0.00 0.00 56.10 58.49 3g6k s TRP 196 Cb 0.21 -3.03 -0.00 0.00 -1.15 0.00 0.00 33.47 29.50 3g6k s TRP 196 CO 0.35 0.29 0.40 0.54 0.02 0.00 0.00 176.95 178.55 3g6k s ASN 197 N -0.85 4.95 0.24 2.95 2.20 -1.26 -4.72 114.94 118.44 3g6k s ASN 197 Ca 0.43 -0.86 -0.07 0.00 -0.94 0.00 0.00 52.86 51.42 3g6k s ASN 197 Cb -0.26 -0.33 0.26 0.00 -2.00 0.00 0.00 41.25 38.92 3g6k s ASN 197 CO 0.32 -0.78 1.89 0.25 -2.94 0.00 0.00 177.10 175.84 3g6k h LEU 198 N 0.93 0.97 -1.32 3.54 5.85 -1.95 -1.19 115.31 122.14 3g6k h LEU 198 Ca -0.40 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.30 3g6k h LEU 198 Cb 1.27 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 42.05 3g6k h LEU 198 CO 0.57 0.67 0.33 0.00 -0.34 0.00 0.00 178.44 179.67 3g6k h ALA 199 N 1.36 1.49 -0.31 1.25 0.00 -1.86 -1.46 119.26 119.72 3g6k h ALA 199 Ca 0.35 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 3g6k h ALA 199 Cb -0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3g6k h ALA 199 CO -0.11 0.44 -0.12 -0.91 0.00 0.00 0.00 179.25 178.55 3g6k h ASN 200 N 0.81 0.64 -0.15 0.00 -0.26 -1.59 -1.87 115.58 113.17 3g6k h ASN 200 Ca 0.21 -0.39 0.03 0.00 -0.56 0.00 0.00 56.30 55.59 3g6k h ASN 200 Cb 0.00 -0.18 -0.03 0.00 -1.06 0.00 0.00 38.32 37.06 3g6k h ASN 200 CO -0.04 0.89 -0.03 0.40 -1.06 0.00 0.00 177.43 177.59 3g6k h ILE 201 N 0.39 0.86 -0.55 2.81 1.08 -0.84 -1.91 117.51 119.35 3g6k h ILE 201 Ca 0.07 -0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.50 3g6k h ILE 201 Cb 0.63 0.85 -0.02 0.00 -3.07 0.00 0.00 36.82 35.21 3g6k h ILE 201 CO 0.04 0.00 0.18 -0.50 -0.69 0.00 0.00 178.15 177.18 3g6k h TRP 202 N 0.01 0.89 -0.10 1.37 -0.00 -1.24 -0.55 115.95 116.33 3g6k h TRP 202 Ca 0.07 -0.09 0.01 0.00 -0.00 0.00 0.00 58.89 58.88 3g6k h TRP 202 Cb 0.10 -0.26 -0.01 0.00 -0.00 0.00 0.00 29.16 29.00 3g6k h TRP 202 CO -0.18 0.75 0.03 1.03 -0.00 0.00 0.00 178.44 180.07 3g6k h SER 203 N 0.77 0.02 -0.24 -3.49 0.87 -1.12 0.15 113.55 110.52 3g6k h SER 203 Ca 0.18 0.01 -0.09 0.00 -1.23 0.00 0.00 61.79 60.66 3g6k h SER 203 Cb 0.28 0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.25 3g6k h SER 203 CO -0.01 0.03 -0.22 0.15 -0.53 0.00 0.00 176.83 176.25 3g6k h PHE 204 N 0.07 0.68 -0.65 2.24 3.57 -1.26 -1.97 116.94 119.61 3g6k h PHE 204 Ca 0.04 -0.20 -0.07 0.00 3.53 0.00 0.00 57.97 61.27 3g6k h PHE 204 Cb 0.03 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.60 3g6k h PHE 204 CO -0.10 0.89 0.13 1.25 -2.23 0.00 0.00 178.31 178.25 3g6k h LEU 205 N 0.27 1.01 -0.49 0.59 5.85 -0.92 -0.92 115.31 120.70 3g6k h LEU 205 Ca 0.04 -0.25 -0.10 0.00 0.84 0.00 0.00 57.88 58.42 3g6k h LEU 205 Cb 0.77 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 3g6k h LEU 205 CO 0.06 1.00 -0.08 -0.07 -0.34 0.00 0.00 178.44 179.00 3g6k h LEU 206 N 0.98 0.91 -1.57 2.25 3.38 -0.97 -2.87 115.31 117.43 3g6k h LEU 206 Ca 0.20 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 3g6k h LEU 206 Cb 0.40 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3g6k h LEU 206 CO 0.01 1.04 -0.03 0.22 0.09 0.00 0.00 178.44 179.77 3g6k h TYR 207 N 0.77 0.24 0.00 1.13 3.20 -1.06 -3.04 116.97 118.21 3g6k h TYR 207 Ca 0.13 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 3g6k h TYR 207 Cb 0.62 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.81 3g6k h TYR 207 CO 0.05 0.28 -0.06 0.66 -1.64 0.00 0.00 178.16 177.44 3g6k h SER 208 N 0.24 0.00 -0.82 -2.11 4.64 -0.93 -0.33 113.55 114.24 3g6k h SER 208 Ca 0.06 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.03 3g6k h SER 208 Cb 0.21 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.16 3g6k h SER 208 CO 0.01 0.06 -0.31 -3.20 -0.87 0.00 0.00 176.83 172.51 3g6k n ASN 209 N -3.97 -5.02 -4.84 4.97 5.15 -1.15 -4.45 115.26 105.95 3g6k n ASN 209 Ca -0.03 0.41 -0.32 0.00 -0.60 0.00 0.00 54.58 54.04 3g6k n ASN 209 Cb 0.15 -4.01 -0.03 0.00 -0.53 0.00 0.00 39.78 35.36 3g6k n ASN 209 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3g6k s GLU 210 N -3.44 3.90 0.32 1.20 0.41 -1.26 -4.91 118.70 114.90 3g6k s GLU 210 Ca 0.00 0.98 -0.29 0.00 -0.41 0.00 0.00 54.97 55.25 3g6k s GLU 210 Cb 0.00 -2.13 -0.10 0.00 -1.78 0.00 0.00 34.13 30.12 3g6k s GLU 210 CO 0.00 -0.32 1.39 -1.25 -0.49 0.00 0.00 175.26 174.59 3g6k s PRO 211 N -4.07 4.28 0.00 0.39 0.04 -1.26 -5.00 135.00 129.38 3g6k s PRO 211 Ca 0.59 2.32 0.05 0.00 0.04 0.00 0.00 61.00 64.01 3g6k s PRO 211 Cb -0.10 -3.06 -0.03 0.00 0.04 0.00 0.00 34.50 31.35 3g6k s PRO 211 CO 0.32 -0.33 -0.16 0.42 0.04 0.00 0.00 177.00 177.29 3g6k s ILE 212 N -0.80 2.96 0.14 0.56 1.01 -1.26 -5.07 121.20 118.74 3g6k s ILE 212 Ca 0.53 -0.98 -0.35 0.00 0.00 0.00 0.00 60.65 59.86 3g6k s ILE 212 Cb -0.42 -2.21 -0.14 0.00 0.01 0.00 0.00 42.46 39.69 3g6k s ILE 212 CO 0.52 0.44 1.53 0.00 0.00 0.00 0.00 174.94 177.43 3g6k n GLU 214 N 3.28 0.23 -0.10 0.00 -0.58 -1.26 -1.93 120.64 120.29 3g6k n GLU 214 Ca 0.17 0.10 0.07 0.00 -0.42 0.00 0.00 57.16 57.08 3g6k n GLU 214 Cb 0.27 -1.50 0.41 0.00 -0.57 0.00 0.00 31.44 30.05 3g6k n GLU 214 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3g6k h LEU 215 N 0.00 0.53 -0.99 -4.62 3.38 -1.96 -1.62 115.31 110.03 3g6k h LEU 215 Ca 0.00 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 3g6k h LEU 215 Cb 0.24 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3g6k h LEU 215 CO 0.00 0.35 -0.14 1.88 0.09 0.00 0.00 178.44 180.62 3g6k h TYR 216 N 0.61 0.61 -0.21 1.13 0.05 -1.58 -1.60 116.97 115.97 3g6k h TYR 216 Ca 0.25 -0.10 0.04 0.00 0.05 0.00 0.00 58.73 58.96 3g6k h TYR 216 Cb 0.21 -0.16 -0.01 0.00 1.01 0.00 0.00 36.73 37.78 3g6k h TYR 216 CO -0.00 0.68 0.15 -0.09 -1.05 0.00 0.00 178.16 177.85 3g6k h ARG 217 N 0.52 0.13 -0.48 4.88 9.65 -1.46 0.83 114.38 128.44 3g6k h ARG 217 Ca 0.09 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.96 3g6k h ARG 217 Cb 0.55 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.10 3g6k h ARG 217 CO 0.03 0.08 0.00 0.66 2.80 0.00 0.00 179.97 183.55 3g6k n TYR 218 N -4.50 0.66 0.00 2.20 4.01 -0.63 -4.01 117.16 114.90 3g6k n TYR 218 Ca 0.01 -0.32 0.00 0.00 -0.16 0.00 0.00 57.90 57.43 3g6k n TYR 218 Cb 0.20 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.21 3g6k n TYR 218 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3g6k n GLY 219 N 1.19 0.74 3.78 2.72 0.00 -0.75 -4.66 105.19 108.21 3g6k n GLY 219 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 3g6k n GLY 219 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g6k s PHE 220 N -2.00 3.08 0.00 1.61 0.08 -1.06 -1.00 117.98 118.70 3g6k s PHE 220 Ca 0.00 1.60 0.00 0.00 0.12 0.00 0.00 56.93 58.65 3g6k s PHE 220 Cb 0.00 -3.17 0.00 0.00 -0.57 0.00 0.00 43.02 39.28 3g6k s PHE 220 CO 0.00 -0.90 0.16 0.25 -0.10 0.00 0.00 175.22 174.62 3g6k n THR 221 N -0.46 0.00 -3.65 0.64 -2.24 -1.26 -3.86 114.28 103.44 3g6k n THR 221 Ca 0.07 -0.36 -0.07 0.00 -2.27 0.00 0.00 64.05 61.42 3g6k n THR 221 Cb 0.50 1.13 -0.08 0.00 -2.10 0.00 0.00 70.33 69.78 3g6k n THR 221 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3g6k s SER 222 N -0.40 -0.87 -0.60 3.42 0.15 -1.26 -4.91 113.70 109.24 3g6k s SER 222 Ca 0.00 1.40 -0.09 0.00 0.70 0.00 0.00 55.95 57.96 3g6k s SER 222 Cb 0.00 1.33 0.15 0.00 -1.71 0.00 0.00 66.02 65.79 3g6k s SER 222 CO 0.00 -0.23 0.47 -0.76 1.20 0.00 0.00 173.24 173.92 3g6k s LEU 223 N 1.68 5.86 0.00 3.45 1.43 -1.26 -4.87 118.68 124.97 3g6k s LEU 223 Ca -0.10 -2.33 0.00 0.00 -1.03 0.00 0.00 54.13 50.68 3g6k s LEU 223 Cb -0.06 -2.03 0.00 0.00 0.03 0.00 0.00 46.19 44.13 3g6k s LEU 223 CO -0.19 -0.59 0.00 0.61 0.23 0.00 0.00 176.35 176.41 3g6k n GLY 224 N 4.35 1.58 3.87 -3.19 0.00 -1.26 -5.09 105.19 105.45 3g6k n GLY 224 Ca 0.01 -1.76 -0.30 0.00 0.00 0.00 0.00 46.02 43.97 3g6k n GLY 224 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g6k s ASN 225 N -1.00 4.91 0.43 1.61 2.20 -1.26 -4.69 114.94 117.14 3g6k s ASN 225 Ca 0.00 1.04 0.16 0.00 -0.94 0.00 0.00 52.86 53.12 3g6k s ASN 225 Cb 0.00 -1.72 0.97 0.00 -2.00 0.00 0.00 41.25 38.50 3g6k s ASN 225 CO 0.00 -1.67 1.95 -0.37 -2.94 0.00 0.00 177.10 174.07 3g6k h VAL 226 N -0.89 1.09 0.22 3.54 -1.51 -1.19 -2.00 116.25 115.52 3g6k h VAL 226 Ca -0.46 -0.82 -0.32 0.00 -1.23 0.00 0.00 66.70 63.87 3g6k h VAL 226 Cb 1.28 1.45 0.03 0.00 -2.13 0.00 0.00 31.29 31.92 3g6k h VAL 226 CO 0.64 0.23 -1.45 -0.08 -1.23 0.00 0.00 177.57 175.68 3g6k h GLU 227 N 0.00 0.47 0.00 5.19 4.22 -1.93 -3.38 114.58 119.15 3g6k h GLU 227 Ca -0.00 -0.80 0.00 0.00 0.08 0.00 0.00 59.36 58.64 3g6k h GLU 227 Cb 0.43 0.30 0.00 0.00 0.50 0.00 0.00 28.75 29.98 3g6k h GLU 227 CO 0.03 1.38 -0.64 1.05 -2.18 0.00 0.00 179.01 178.65 3g6k h GLU 228 N 0.05 0.00 -5.63 1.92 4.11 -1.89 -3.44 114.58 109.70 3g6k h GLU 228 Ca -0.26 0.00 -0.60 0.00 0.07 0.00 0.00 59.36 58.57 3g6k h GLU 228 Cb 2.07 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 31.23 3g6k h GLU 228 CO 0.23 0.00 -0.30 0.99 0.07 0.00 0.00 179.01 180.00 3g6k s THR 229 N -3.31 5.26 0.20 -1.06 2.01 -0.77 -0.74 115.64 117.24 3g6k s THR 229 Ca 0.02 0.60 0.06 0.00 0.31 0.00 0.00 61.69 62.68 3g6k s THR 229 Cb 0.08 -3.64 -0.05 0.00 0.01 0.00 0.00 72.50 68.90 3g6k s THR 229 CO 0.75 0.44 -0.09 -0.76 -0.69 0.00 0.00 174.62 174.27 3g6k s LEU 230 N 0.03 2.47 0.65 4.42 1.43 -0.34 -4.93 118.68 122.41 3g6k s LEU 230 Ca 0.18 -1.08 -0.17 0.00 -1.03 0.00 0.00 54.13 52.03 3g6k s LEU 230 Cb -0.14 -0.49 -0.03 0.00 0.03 0.00 0.00 46.19 45.57 3g6k s LEU 230 CO 0.06 -0.31 0.99 -2.65 0.23 0.00 0.00 176.35 174.67 3g6k n PRO 231 N -0.36 0.78 -2.30 1.29 -0.02 -1.26 -4.43 135.00 128.70 3g6k n PRO 231 Ca -0.08 0.31 -0.42 0.00 -2.02 0.00 0.00 63.50 61.29 3g6k n PRO 231 Cb 0.62 -2.21 -0.03 0.00 -0.02 0.00 0.00 33.50 31.85 3g6k n PRO 231 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3g6k s ASN 232 N -1.39 6.89 0.59 2.55 3.84 -0.17 -4.53 114.94 122.72 3g6k s ASN 232 Ca 0.76 1.95 0.30 0.00 0.21 0.00 0.00 52.86 56.09 3g6k s ASN 232 Cb -0.39 -2.55 1.84 0.00 -0.55 0.00 0.00 41.25 39.60 3g6k s ASN 232 CO 0.47 -0.73 2.25 1.55 -2.79 0.00 0.00 177.10 177.85 3g6k h PRO 233 N 8.10 0.00 0.00 0.43 0.13 -1.90 0.03 132.00 138.80 3g6k h PRO 233 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3g6k h PRO 233 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3g6k h PRO 233 CO 0.92 0.01 0.00 0.72 -0.23 0.00 0.00 178.00 179.42 3g6k n HIS 234 N -3.79 0.00 -0.38 1.56 8.25 -1.26 -2.22 115.22 117.38 3g6k n HIS 234 Ca -0.03 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.52 3g6k n HIS 234 Cb 0.09 -0.49 0.27 0.00 1.12 0.00 0.00 29.99 30.98 3g6k n HIS 234 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3g6k n LEU 235 N -1.49 3.75 -4.75 2.41 4.77 -0.00 -4.99 117.00 116.70 3g6k n LEU 235 Ca 0.05 -2.11 -0.41 0.00 -0.03 0.00 0.00 56.01 53.50 3g6k n LEU 235 Cb 0.22 -0.42 -0.03 0.00 -2.33 0.00 0.00 43.42 40.86 3g6k n LEU 235 CO 0.18 0.87 0.92 -0.60 -1.33 0.00 0.00 177.39 177.42 3g6k s ARG 236 N -1.21 4.46 0.10 3.23 3.52 -0.94 -0.82 118.95 127.29 3g6k s ARG 236 Ca 0.41 1.97 -0.25 0.00 -0.13 0.00 0.00 55.73 57.73 3g6k s ARG 236 Cb 0.23 -3.19 -0.06 0.00 -1.56 0.00 0.00 34.95 30.36 3g6k s ARG 236 CO 0.25 -0.10 0.78 0.15 -0.81 0.00 0.00 175.30 175.57 3g6k s LYS 237 N -0.65 4.53 0.14 5.12 1.02 0.12 -4.89 119.74 125.13 3g6k s LYS 237 Ca 0.52 1.12 -0.10 0.00 0.02 0.00 0.00 55.97 57.53 3g6k s LYS 237 Cb -0.35 -3.32 0.00 0.00 -0.52 0.00 0.00 37.83 33.64 3g6k s LYS 237 CO 0.40 0.40 0.29 0.34 -0.92 0.00 0.00 175.35 175.86 3g6k s ASP 238 N -0.49 0.01 0.39 2.83 -1.08 -1.26 -4.69 116.67 112.37 3g6k s ASP 238 Ca 0.38 -0.70 0.21 0.00 -0.52 0.00 0.00 52.55 51.92 3g6k s ASP 238 Cb -0.22 0.42 0.33 0.00 -1.46 0.00 0.00 42.92 41.99 3g6k s ASP 238 CO 0.25 -0.85 1.58 0.11 0.52 0.00 0.00 175.17 176.78 3g6k h LYS 239 N 2.56 0.00 0.00 4.34 1.57 -2.02 -3.37 116.57 119.65 3g6k h LYS 239 Ca -0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 3g6k h LYS 239 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.54 3g6k h LYS 239 CO 0.50 0.18 -1.77 0.27 -0.57 0.00 0.00 179.45 178.05 3g6k n ASN 240 N -3.16 0.28 -4.96 0.86 6.94 -1.26 -4.97 115.26 108.99 3g6k n ASN 240 Ca 0.03 -0.20 -0.22 0.00 -0.02 0.00 0.00 54.58 54.17 3g6k n ASN 240 Cb 0.58 1.78 0.02 0.00 -2.36 0.00 0.00 39.78 39.80 3g6k n ASN 240 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3g6k s SER 241 N -4.16 5.58 0.04 0.53 1.04 -1.26 -5.04 113.70 110.43 3g6k s SER 241 Ca -0.05 0.15 -0.30 0.00 0.48 0.00 0.00 55.95 56.23 3g6k s SER 241 Cb 0.14 -1.23 -0.07 0.00 0.10 0.00 0.00 66.02 64.96 3g6k s SER 241 CO 0.88 -0.90 1.63 -0.89 0.98 0.00 0.00 173.24 174.94 3g6k s THR 242 N -2.65 3.22 0.48 2.02 2.01 -1.26 -4.94 115.64 114.52 3g6k s THR 242 Ca 0.52 0.59 -0.24 0.00 0.31 0.00 0.00 61.69 62.88 3g6k s THR 242 Cb -0.10 -3.38 -0.07 0.00 0.01 0.00 0.00 72.50 68.95 3g6k s THR 242 CO 0.38 -0.01 1.40 -2.65 -0.69 0.00 0.00 174.62 173.05 3g6k n PRO 243 N 5.85 2.05 -2.87 4.92 -0.02 -1.26 -4.97 135.00 138.69 3g6k n PRO 243 Ca 0.16 0.74 -0.35 0.00 -2.02 0.00 0.00 63.50 62.03 3g6k n PRO 243 Cb 0.41 -2.60 -0.07 0.00 -0.02 0.00 0.00 33.50 31.23 3g6k n PRO 243 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3g6k s LEU 244 N -2.86 4.15 0.10 2.45 1.43 -1.26 -5.06 118.68 117.63 3g6k s LEU 244 Ca 0.65 1.66 0.04 0.00 -1.03 0.00 0.00 54.13 55.45 3g6k s LEU 244 Cb -0.44 -4.19 -0.04 0.00 0.03 0.00 0.00 46.19 41.55 3g6k s LEU 244 CO 0.55 -0.19 0.09 -0.54 0.23 0.00 0.00 176.35 176.49 3g6k s LYS 245 N -2.61 2.87 -0.20 1.70 1.02 -1.26 -5.10 119.74 116.17 3g6k s LYS 245 Ca 0.55 -0.74 -0.12 0.00 0.02 0.00 0.00 55.97 55.68 3g6k s LYS 245 Cb -0.14 -2.70 -0.05 0.00 -0.52 0.00 0.00 37.83 34.42 3g6k s LYS 245 CO 0.18 0.55 0.20 -1.17 -0.92 0.00 0.00 175.35 174.19 3g6k s LEU 246 N -2.54 4.20 0.00 3.17 2.96 -1.26 -4.92 118.68 120.28 3g6k s LEU 246 Ca 0.29 0.31 0.27 0.00 -0.22 0.00 0.00 54.13 54.78 3g6k s LEU 246 Cb -0.12 -2.20 0.89 0.00 0.50 0.00 0.00 46.19 45.26 3g6k s LEU 246 CO 0.22 0.12 1.65 0.59 -1.32 0.00 0.00 176.35 177.61 3g6k n ASN 247 N 3.73 1.10 -0.61 3.68 3.02 -1.26 -4.36 115.26 120.56 3g6k n ASN 247 Ca -0.14 -1.03 0.06 0.00 -0.03 0.00 0.00 54.58 53.44 3g6k n ASN 247 Cb 0.52 0.08 0.14 0.00 -0.61 0.00 0.00 39.78 39.90 3g6k n ASN 247 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3g6k n PHE 248 N -0.45 0.00 -0.32 3.10 3.72 -1.26 -4.74 117.46 117.51 3g6k n PHE 248 Ca 0.14 -1.03 -0.02 0.00 -0.05 0.00 0.00 57.45 56.49 3g6k n PHE 248 Cb 0.34 -0.18 0.10 0.00 -0.94 0.00 0.00 39.48 38.80 3g6k n PHE 248 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 3g6k h GLU 249 N 0.63 1.09 -0.34 -1.08 4.81 -2.01 -2.19 114.58 115.49 3g6k h GLU 249 Ca -0.04 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.09 3g6k h GLU 249 Cb 1.20 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 30.32 3g6k h GLU 249 CO 0.02 0.72 0.06 2.35 -0.73 0.00 0.00 179.01 181.43 3g6k h TRP 250 N 1.12 0.59 -0.87 0.92 7.01 -1.95 -0.83 115.95 121.95 3g6k h TRP 250 Ca 0.33 -0.08 -0.01 0.00 2.11 0.00 0.00 58.89 61.24 3g6k h TRP 250 Cb -0.06 -0.16 -0.04 0.00 -2.10 0.00 0.00 29.16 26.79 3g6k h TRP 250 CO -0.02 0.62 0.49 0.93 -2.79 0.00 0.00 178.44 177.67 3g6k h GLU 251 N 0.40 1.20 -0.27 2.65 3.07 -1.85 0.11 114.58 119.89 3g6k h GLU 251 Ca 0.10 -0.13 -0.07 0.00 -0.50 0.00 0.00 59.36 58.77 3g6k h GLU 251 Cb 0.34 -0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 28.00 3g6k h GLU 251 CO 0.01 0.87 -0.10 0.82 -1.40 0.00 0.00 179.01 179.20 3g6k h ILE 252 N 1.20 1.29 -0.16 3.13 2.04 -1.21 -1.46 117.51 122.34 3g6k h ILE 252 Ca 0.31 -1.16 -0.08 0.00 1.00 0.00 0.00 64.86 64.93 3g6k h ILE 252 Cb 0.00 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 3g6k h ILE 252 CO -0.05 0.36 -0.24 -0.33 0.00 0.00 0.00 178.15 177.90 3g6k h GLU 253 N 0.28 0.29 -0.39 2.37 5.08 -0.76 -2.97 114.58 118.49 3g6k h GLU 253 Ca 0.06 -0.10 -0.08 0.00 -1.00 0.00 0.00 59.36 58.24 3g6k h GLU 253 Cb 0.60 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.77 3g6k h GLU 253 CO 0.03 0.52 0.04 0.09 -1.00 0.00 0.00 179.01 178.69 3g6k n ASN 254 N -4.16 3.84 -4.71 1.42 4.13 0.34 -5.04 115.26 111.08 3g6k n ASN 254 Ca -0.01 -3.22 -0.33 0.00 1.68 0.00 0.00 54.58 52.70 3g6k n ASN 254 Cb 0.36 -0.61 0.12 0.00 -1.54 0.00 0.00 39.78 38.11 3g6k n ASN 254 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3g6k s ARG 255 N -2.95 1.77 0.07 3.52 1.70 -0.56 -4.83 118.95 117.68 3g6k s ARG 255 Ca 0.46 1.71 -0.31 0.00 -0.47 0.00 0.00 55.73 57.12 3g6k s ARG 255 Cb 0.38 -1.80 -0.08 0.00 -0.57 0.00 0.00 34.95 32.88 3g6k s ARG 255 CO 0.08 -2.10 1.56 -0.47 -1.08 0.00 0.00 175.30 173.29 3g6k s TYR 256 N -2.18 2.68 0.35 5.89 5.04 -0.13 -4.94 117.35 124.06 3g6k s TYR 256 Ca 0.72 0.52 -0.26 0.00 -2.44 0.00 0.00 57.07 55.62 3g6k s TYR 256 Cb -0.28 -3.87 -0.10 0.00 0.35 0.00 0.00 41.96 38.07 3g6k s TYR 256 CO 0.50 -3.37 1.00 0.15 -1.34 0.00 0.00 175.55 172.48 3g6k s LYS 257 N 2.24 4.44 0.37 4.97 1.02 -1.26 -4.63 119.74 126.88 3g6k s LYS 257 Ca 0.70 1.44 0.07 0.00 0.02 0.00 0.00 55.97 58.21 3g6k s LYS 257 Cb -0.38 -2.74 -0.01 0.00 -0.52 0.00 0.00 37.83 34.18 3g6k s LYS 257 CO 0.31 0.12 0.46 -1.01 -0.92 0.00 0.00 175.35 174.31 3g6k s HIS 258 N -1.59 2.95 0.00 3.18 3.76 -1.26 -5.06 115.29 117.27 3g6k s HIS 258 Ca 0.52 -0.32 0.00 0.00 -0.15 0.00 0.00 55.06 55.12 3g6k s HIS 258 Cb -0.21 -2.09 0.00 0.00 1.11 0.00 0.00 32.58 31.39 3g6k s HIS 258 CO 0.27 -0.11 0.00 0.27 -0.85 0.00 0.00 174.74 174.32 3g6k n ASN 259 N -1.65 1.42 0.20 1.40 0.23 -1.26 -4.87 115.26 110.73 3g6k n ASN 259 Ca 0.02 -0.76 0.04 0.00 -0.53 0.00 0.00 54.58 53.36 3g6k n ASN 259 Cb 0.59 0.00 0.42 0.00 -2.08 0.00 0.00 39.78 38.71 3g6k n ASN 259 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3g6k h GLU 260 N 0.00 0.00 0.02 -3.83 4.39 -2.01 -0.61 114.58 112.54 3g6k h GLU 260 Ca 0.00 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.44 3g6k h GLU 260 Cb 0.00 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.67 3g6k h GLU 260 CO 0.00 0.32 -1.01 0.28 -1.16 0.00 0.00 179.01 177.44 3g6k h VAL 261 N 0.00 1.30 -0.00 3.13 2.07 -1.96 -1.83 116.25 118.96 3g6k h VAL 261 Ca -0.00 -2.25 0.00 0.00 0.82 0.00 0.00 66.70 65.27 3g6k h VAL 261 Cb 0.59 2.46 0.00 0.00 -1.52 0.00 0.00 31.29 32.82 3g6k h VAL 261 CO 0.04 0.69 -0.77 0.35 0.02 0.00 0.00 177.57 177.90 3g6k n THR 262 N -3.90 0.00 -1.65 2.57 -2.24 -1.06 -4.61 114.28 103.38 3g6k n THR 262 Ca -0.11 -0.06 -0.38 0.00 -2.27 0.00 0.00 64.05 61.22 3g6k n THR 262 Cb 0.87 0.90 0.05 0.00 -2.10 0.00 0.00 70.33 70.05 3g6k n THR 262 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 3g6k n LYS 263 N -1.14 1.12 -4.06 -0.78 2.85 -0.26 -4.78 118.16 111.11 3g6k n LYS 263 Ca 0.06 0.42 -0.35 0.00 -1.05 0.00 0.00 58.31 57.39 3g6k n LYS 263 Cb 0.36 -2.27 -0.11 0.00 -0.65 0.00 0.00 35.03 32.36 3g6k n LYS 263 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3g6k s ALA 264 N -1.43 3.21 0.33 0.58 0.00 -1.26 -4.59 121.76 118.60 3g6k s ALA 264 Ca 0.74 -0.88 -0.28 0.00 0.00 0.00 0.00 51.96 51.55 3g6k s ALA 264 Cb -0.43 -1.85 -0.09 0.00 0.00 0.00 0.00 23.12 20.75 3g6k s ALA 264 CO 0.48 0.00 1.17 -2.00 0.00 0.00 0.00 175.76 175.41 3g6k s GLU 265 N 0.71 4.38 0.31 0.00 2.56 -1.26 -4.99 118.70 120.42 3g6k s GLU 265 Ca 0.02 1.92 -0.29 0.00 0.00 0.00 0.00 54.97 56.61 3g6k s GLU 265 Cb -0.14 -2.99 -0.12 0.00 2.00 0.00 0.00 34.13 32.88 3g6k s GLU 265 CO 0.02 -0.06 1.48 -2.30 -0.56 0.00 0.00 175.26 173.85 3g6k n PRO 266 N 0.72 2.46 -3.81 4.30 -0.02 -1.26 -4.95 135.00 132.44 3g6k n PRO 266 Ca 0.01 0.87 -0.34 0.00 -2.02 0.00 0.00 63.50 62.02 3g6k n PRO 266 Cb 0.45 -2.58 -0.11 0.00 -0.02 0.00 0.00 33.50 31.23 3g6k n PRO 266 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3g6k s ILE 267 N -0.43 3.24 0.59 4.25 1.01 -1.26 -5.11 121.20 123.48 3g6k s ILE 267 Ca 0.61 -2.98 -0.16 0.00 0.00 0.00 0.00 60.65 58.12 3g6k s ILE 267 Cb -0.54 -3.17 -0.04 0.00 0.01 0.00 0.00 42.46 38.73 3g6k s ILE 267 CO 0.54 -0.82 1.06 -2.84 0.00 0.00 0.00 174.94 172.88 3g6k s PRO 268 N -0.00 3.34 0.44 2.79 0.02 -1.26 -4.54 135.00 135.79 3g6k s PRO 268 Ca 0.16 1.22 -0.24 0.00 0.02 0.00 0.00 61.00 62.16 3g6k s PRO 268 Cb -0.22 -2.04 -0.10 0.00 0.02 0.00 0.00 34.50 32.17 3g6k s PRO 268 CO -0.03 -0.79 1.09 1.51 -0.33 0.00 0.00 177.00 178.45 3g6k n ILE 269 N -1.95 2.61 -2.44 2.83 3.06 -1.26 -4.89 119.36 117.31 3g6k n ILE 269 Ca 0.09 -0.50 -0.38 0.00 -2.50 0.00 0.00 62.75 59.46 3g6k n ILE 269 Cb 0.53 -1.29 -0.03 0.00 0.54 0.00 0.00 39.64 39.39 3g6k n ILE 269 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3g6k s ALA 270 N -1.27 3.15 0.29 1.51 0.00 -1.26 -4.90 121.76 119.28 3g6k s ALA 270 Ca 0.64 0.83 0.03 0.00 0.00 0.00 0.00 51.96 53.45 3g6k s ALA 270 Cb -0.53 -3.32 0.60 0.00 0.00 0.00 0.00 23.12 19.87 3g6k s ALA 270 CO 0.56 -0.33 1.83 -0.44 0.00 0.00 0.00 175.76 177.39 3g6k h ASP 271 N 2.73 0.89 0.51 0.00 3.45 -1.99 -1.11 116.42 120.90 3g6k h ASP 271 Ca -0.48 0.05 -0.07 0.00 0.43 0.00 0.00 57.03 56.96 3g6k h ASP 271 Cb 1.22 -0.12 -0.01 0.00 -0.56 0.00 0.00 39.33 39.86 3g6k h ASP 271 CO 0.63 0.46 -0.35 1.05 -1.57 0.00 0.00 179.24 179.45 3g6k h GLU 272 N 0.95 0.00 0.04 3.56 4.11 -2.01 -1.90 114.58 119.32 3g6k h GLU 272 Ca 0.50 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.69 3g6k h GLU 272 Cb 0.55 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 3g6k h GLU 272 CO -0.27 0.35 -1.19 -0.44 0.07 0.00 0.00 179.01 177.53 3g6k h ASP 273 N 0.00 0.13 -0.55 3.06 3.32 -1.63 -3.15 116.42 117.60 3g6k h ASP 273 Ca -0.00 -0.15 -0.09 0.00 0.02 0.00 0.00 57.03 56.81 3g6k h ASP 273 Cb 0.70 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.19 3g6k h ASP 273 CO 0.05 1.12 -0.02 0.25 -1.72 0.00 0.00 179.24 178.92 3g6k h LEU 274 N 0.02 0.96 -0.64 1.55 5.85 -0.89 -0.42 115.31 121.74 3g6k h LEU 274 Ca -0.09 -0.31 0.03 0.00 0.84 0.00 0.00 57.88 58.34 3g6k h LEU 274 Cb 1.87 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 42.60 3g6k h LEU 274 CO 0.14 1.04 0.39 0.58 -0.34 0.00 0.00 178.44 180.26 3g6k h VAL 275 N 0.85 1.07 -0.29 1.05 2.07 -1.43 0.61 116.25 120.19 3g6k h VAL 275 Ca 0.15 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 3g6k h VAL 275 Cb 0.56 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 3g6k h VAL 275 CO 0.03 0.14 0.13 0.11 0.02 0.00 0.00 177.57 178.00 3g6k h LYS 276 N 0.77 0.42 -0.32 1.57 1.57 -1.41 -2.74 116.57 116.44 3g6k h LYS 276 Ca 0.26 -0.07 -0.13 0.00 -1.87 0.00 0.00 60.65 58.84 3g6k h LYS 276 Cb 0.03 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 3g6k h LYS 276 CO -0.11 0.42 -0.30 0.82 -0.57 0.00 0.00 179.45 179.71 3g6k h ILE 277 N 0.32 1.29 0.00 1.86 2.04 -0.68 -2.95 117.51 119.39 3g6k h ILE 277 Ca 0.10 -1.47 0.00 0.00 1.00 0.00 0.00 64.86 64.48 3g6k h ILE 277 Cb 0.15 1.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.75 3g6k h ILE 277 CO -0.01 0.48 0.00 -0.33 0.00 0.00 0.00 178.15 178.29 3g6k h GLU 278 N 0.53 0.00 -0.62 2.37 5.08 -0.86 -2.57 114.58 118.52 3g6k h GLU 278 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3g6k h GLU 278 Cb 0.88 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.13 3g6k h GLU 278 CO 0.08 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.18 3g6k n ASN 279 N -2.44 5.32 0.03 1.42 5.03 -1.04 -4.45 115.26 119.14 3g6k n ASN 279 Ca 0.02 -2.77 0.13 0.00 0.87 0.00 0.00 54.58 52.83 3g6k n ASN 279 Cb 0.25 -0.65 0.50 0.00 -1.02 0.00 0.00 39.78 38.85 3g6k n ASN 279 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 3g6k n LEU 280 N 0.74 0.32 -1.92 3.41 4.77 -0.97 -4.94 117.00 118.41 3g6k n LEU 280 Ca 0.26 0.45 -0.14 0.00 -0.03 0.00 0.00 56.01 56.56 3g6k n LEU 280 Cb 1.08 -0.41 -0.03 0.00 -2.33 0.00 0.00 43.42 41.74 3g6k n LEU 280 CO 0.29 -0.04 -0.15 1.41 -1.33 0.00 0.00 177.39 177.57 3g6k n HIS 281 N -1.75 -0.85 -3.82 -1.77 8.25 -1.26 -4.94 115.22 109.09 3g6k n HIS 281 Ca 0.06 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.40 3g6k n HIS 281 Cb 0.37 -2.81 -0.09 0.00 1.12 0.00 0.00 29.99 28.58 3g6k n HIS 281 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 3g6k s GLU 282 N -4.11 0.60 0.22 -0.41 0.41 -1.26 -5.17 118.70 108.98 3g6k s GLU 282 Ca 0.00 -0.35 0.10 0.00 -0.41 0.00 0.00 54.97 54.31 3g6k s GLU 282 Cb 0.00 0.26 -0.04 0.00 -1.78 0.00 0.00 34.13 32.56 3g6k s GLU 282 CO 0.00 -0.16 -0.10 0.34 -0.49 0.00 0.00 175.26 174.85 3g6k s ASP 283 N -1.48 4.17 0.02 -0.19 2.15 -1.26 -5.01 116.67 115.07 3g6k s ASP 283 Ca -0.13 -0.68 0.03 0.00 0.43 0.00 0.00 52.55 52.20 3g6k s ASP 283 Cb -0.06 -0.66 -0.01 0.00 -0.30 0.00 0.00 42.92 41.89 3g6k s ASP 283 CO 0.02 0.07 -0.09 -0.31 -0.17 0.00 0.00 175.17 174.69 3g6k s TYR 284 N -1.97 0.76 0.69 -5.34 2.02 -1.26 -0.70 117.35 111.55 3g6k s TYR 284 Ca 0.27 -0.28 -0.16 0.00 -0.37 0.00 0.00 57.07 56.52 3g6k s TYR 284 Cb -0.08 -0.46 0.02 0.00 -0.40 0.00 0.00 41.96 41.04 3g6k s TYR 284 CO 0.16 -0.02 1.23 0.71 -1.57 0.00 0.00 175.55 176.05 3g6k s TYR 285 N -0.69 2.11 0.94 2.71 2.02 0.00 -4.65 117.35 119.79 3g6k s TYR 285 Ca -0.02 1.56 -0.11 0.00 -0.37 0.00 0.00 57.07 58.14 3g6k s TYR 285 Cb -0.06 -3.52 0.16 0.00 -0.40 0.00 0.00 41.96 38.13 3g6k s TYR 285 CO 0.00 -2.62 1.11 -1.25 -1.57 0.00 0.00 175.55 171.22 3g6k s PRO 286 N -3.70 0.88 0.54 -1.71 0.04 -1.26 -3.72 135.00 126.06 3g6k s PRO 286 Ca 0.77 1.26 0.21 0.00 0.04 0.00 0.00 61.00 63.27 3g6k s PRO 286 Cb -0.31 -1.73 1.42 0.00 0.04 0.00 0.00 34.50 33.91 3g6k s PRO 286 CO 0.42 -2.63 2.13 0.78 0.04 0.00 0.00 177.00 177.74 3g6k h GLY 287 N -1.86 0.00 0.88 0.56 0.00 -0.97 -1.27 103.07 100.41 3g6k h GLY 287 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 3g6k h GLY 287 CO 0.47 0.00 0.00 -2.67 0.00 0.00 0.00 176.54 174.34 3g6k n TRP 288 N -4.33 0.00 1.35 5.60 2.14 -1.26 -1.19 117.44 119.75 3g6k n TRP 288 Ca -0.00 0.00 0.15 0.00 2.07 0.00 0.00 57.50 59.72 3g6k n TRP 288 Cb 0.22 0.00 0.71 0.00 -0.81 0.00 0.00 31.31 31.42 3g6k n TRP 288 CO 0.00 0.00 0.00 0.66 2.07 0.00 0.00 177.69 180.42 3g6k n TYR 289 N -0.94 0.00 -3.75 -2.67 4.02 -0.48 -4.68 117.16 108.66 3g6k n TYR 289 Ca 0.13 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.66 3g6k n TYR 289 Cb 0.06 -0.30 -0.10 0.00 -0.02 0.00 0.00 39.34 38.98 3g6k n TYR 289 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 3g6k s LEU 290 N -2.63 3.96 0.00 7.72 2.96 -0.34 -4.93 118.68 125.42 3g6k s LEU 290 Ca 0.26 0.06 0.00 0.00 -0.22 0.00 0.00 54.13 54.23 3g6k s LEU 290 Cb 0.20 -2.05 0.00 0.00 0.50 0.00 0.00 46.19 44.84 3g6k s LEU 290 CO 0.48 0.07 0.65 1.33 -1.32 0.00 0.00 176.35 177.56 3g6k n VAL 291 N 4.24 0.41 -3.41 1.68 0.24 -1.26 -4.76 118.33 115.48 3g6k n VAL 291 Ca -0.15 -0.56 -0.42 0.00 -2.04 0.00 0.00 64.34 61.16 3g6k n VAL 291 Cb 0.52 0.91 -0.09 0.00 -1.47 0.00 0.00 33.84 33.71 3g6k n VAL 291 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3g6k s ASP 292 N -0.41 6.15 0.53 -1.34 -1.08 -1.26 -4.36 116.67 114.89 3g6k s ASP 292 Ca 0.00 -0.70 0.21 0.00 -0.52 0.00 0.00 52.55 51.55 3g6k s ASP 292 Cb 0.00 -2.19 1.43 0.00 -1.46 0.00 0.00 42.92 40.70 3g6k s ASP 292 CO 0.00 -0.47 2.16 0.44 0.52 0.00 0.00 175.17 177.82 3g6k h ASP 293 N 8.64 0.00 0.51 -0.34 3.32 -2.00 -0.98 116.42 125.57 3g6k h ASP 293 Ca -0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.78 3g6k h ASP 293 Cb 1.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.67 3g6k h ASP 293 CO 0.74 0.04 0.00 0.11 -1.72 0.00 0.00 179.24 178.41 3g6k h LYS 294 N 0.00 0.00 -0.09 3.56 1.57 -1.96 -2.64 116.57 117.00 3g6k h LYS 294 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3g6k h LYS 294 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 3g6k h LYS 294 CO 0.00 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.16 3g6k n LEU 295 N -2.60 2.33 -0.29 2.94 4.77 -0.38 -4.68 117.00 119.09 3g6k n LEU 295 Ca 0.00 -1.19 0.07 0.00 -0.03 0.00 0.00 56.01 54.86 3g6k n LEU 295 Cb 0.18 -0.05 0.28 0.00 -2.33 0.00 0.00 43.42 41.50 3g6k n LEU 295 CO 0.19 0.47 1.24 -0.08 -1.33 0.00 0.00 177.39 177.87 3g6k h GLU 296 N 2.65 0.89 -0.71 3.23 4.81 -1.43 -1.61 114.58 122.42 3g6k h GLU 296 Ca 0.00 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 59.04 3g6k h GLU 296 Cb 0.61 -0.20 -0.08 0.00 0.63 0.00 0.00 28.75 29.71 3g6k h GLU 296 CO 0.00 0.59 0.17 0.54 -0.73 0.00 0.00 179.01 179.58 3g6k n ARG 297 N -4.53 4.10 0.27 1.92 1.74 -1.26 -4.04 116.66 114.85 3g6k n ARG 297 Ca 0.15 -3.02 0.16 0.00 -0.77 0.00 0.00 57.85 54.37 3g6k n ARG 297 Cb 0.29 -2.22 0.61 0.00 -1.02 0.00 0.00 32.46 30.12 3g6k n ARG 297 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3g6k h ALA 298 N 3.16 1.00 -0.86 7.54 0.00 -1.61 -3.36 119.26 125.15 3g6k h ALA 298 Ca 0.17 -0.03 -0.72 0.00 0.00 0.00 0.00 54.91 54.33 3g6k h ALA 298 Cb 2.18 -0.01 -0.11 0.00 0.00 0.00 0.00 17.79 19.86 3g6k h ALA 298 CO 0.64 0.04 2.20 0.41 0.00 0.00 0.00 179.25 182.54 3g6k n GLY 299 N 0.13 3.64 2.97 0.00 0.00 -1.26 -4.62 105.19 106.05 3g6k n GLY 299 Ca 0.01 -1.75 -0.10 0.00 0.00 0.00 0.00 46.02 44.18 3g6k n GLY 299 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g6k s ARG 300 N 2.60 0.25 0.36 1.61 1.81 -1.26 -1.20 118.95 123.13 3g6k s ARG 300 Ca 0.47 -0.40 -0.28 0.00 -1.72 0.00 0.00 55.73 53.80 3g6k s ARG 300 Cb 0.06 0.09 -0.11 0.00 -0.45 0.00 0.00 34.95 34.54 3g6k s ARG 300 CO 0.01 -0.04 1.47 0.42 -0.68 0.00 0.00 175.30 176.47 3g6k s ILE 301 N -1.02 2.15 0.10 1.52 -1.09 0.08 -4.90 121.20 118.04 3g6k s ILE 301 Ca -0.11 0.15 -0.31 0.00 -2.23 0.00 0.00 60.65 58.15 3g6k s ILE 301 Cb -0.07 -3.09 -0.07 0.00 -1.58 0.00 0.00 42.46 37.65 3g6k s ILE 301 CO -0.00 0.03 1.25 -0.75 -1.23 0.00 0.00 174.94 174.24 3g6k s LYS 302 N -1.95 4.41 0.20 2.79 2.20 -1.26 -5.03 119.74 121.09 3g6k s LYS 302 Ca 0.53 1.87 0.10 0.00 -0.36 0.00 0.00 55.97 58.12 3g6k s LYS 302 Cb -0.46 -3.30 -0.04 0.00 -1.51 0.00 0.00 37.83 32.52 3g6k s LYS 302 CO 0.61 -0.28 -0.21 0.15 -0.36 0.00 0.00 175.35 175.25 3g6k s LYS 303 N 0.85 1.46 0.00 4.03 -0.14 -1.26 -5.22 119.74 119.45 3g6k s LYS 303 Ca 0.59 -1.52 0.30 0.00 -1.36 0.00 0.00 55.97 53.99 3g6k s LYS 303 Cb -0.32 -1.65 1.54 0.00 -1.68 0.00 0.00 37.83 35.71 3g6k s LYS 303 CO 0.31 0.34 2.02 1.17 -0.76 0.00 0.00 175.35 178.43