#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g6k s MET 1 N 0.00 3.04 0.57 5.55 1.00 -0.68 -4.98 119.30 123.79 3g6k s MET 1 Ca 0.00 -0.47 -0.20 0.00 0.00 0.00 0.00 55.69 55.01 3g6k s MET 1 Cb 0.00 -2.84 -0.04 0.00 0.00 0.00 0.00 34.83 31.94 3g6k s MET 1 CO 0.00 0.66 1.23 0.54 0.00 0.00 0.00 175.02 177.45 3g6k n ARG 2 N 1.39 1.38 -0.12 2.03 1.74 -1.26 -3.95 116.66 117.86 3g6k n ARG 2 Ca -0.14 0.52 -0.05 0.00 -0.77 0.00 0.00 57.85 57.40 3g6k n ARG 2 Cb 0.53 -2.44 0.03 0.00 -1.02 0.00 0.00 32.46 29.56 3g6k n ARG 2 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3g6k h LEU 3 N 1.05 -0.02 -1.43 0.55 5.85 -1.84 -0.22 115.31 119.24 3g6k h LEU 3 Ca -0.50 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.30 3g6k h LEU 3 Cb 1.33 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.43 3g6k h LEU 3 CO 0.55 0.02 0.36 1.23 -0.34 0.00 0.00 178.44 180.26 3g6k h GLY 4 N 0.19 0.79 1.01 3.75 0.00 -1.91 0.12 103.07 107.03 3g6k h GLY 4 Ca 0.19 -0.30 -0.12 0.00 0.00 0.00 0.00 47.33 47.10 3g6k h GLY 4 CO -0.26 0.30 -0.22 -0.55 0.00 0.00 0.00 176.54 175.80 3g6k h ASP 5 N 0.76 0.83 -0.55 0.19 3.32 -1.64 -0.35 116.42 118.98 3g6k h ASP 5 Ca 0.20 -0.42 -0.00 0.00 0.02 0.00 0.00 57.03 56.83 3g6k h ASP 5 Cb -0.07 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.22 3g6k h ASP 5 CO -0.04 1.08 0.34 0.00 -1.72 0.00 0.00 179.24 178.90 3g6k h ALA 6 N 0.78 0.70 -0.47 3.45 0.00 -0.59 -0.47 119.26 122.67 3g6k h ALA 6 Ca 0.08 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3g6k h ALA 6 Cb 0.78 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 3g6k h ALA 6 CO 0.06 0.17 0.14 0.00 0.00 0.00 0.00 179.25 179.62 3g6k h ALA 7 N 1.18 0.61 -0.62 0.00 0.00 -0.64 -0.47 119.26 119.32 3g6k h ALA 7 Ca 0.20 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 3g6k h ALA 7 Cb -0.04 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 3g6k h ALA 7 CO -0.04 0.28 0.07 1.49 0.00 0.00 0.00 179.25 181.05 3g6k h GLU 8 N 0.62 1.03 -0.26 0.00 4.81 -0.96 0.50 114.58 120.32 3g6k h GLU 8 Ca 0.15 -0.28 0.02 0.00 -0.13 0.00 0.00 59.36 59.12 3g6k h GLU 8 Cb 0.29 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 3g6k h GLU 8 CO -0.00 0.96 0.12 1.25 -0.73 0.00 0.00 179.01 180.61 3g6k h LEU 9 N 0.96 0.16 -0.96 1.64 5.85 -0.84 0.32 115.31 122.45 3g6k h LEU 9 Ca 0.19 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.86 3g6k h LEU 9 Cb 0.45 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 3g6k h LEU 9 CO 0.02 0.13 0.01 0.00 -0.34 0.00 0.00 178.44 178.26 3g6k h TYR 11 N 0.72 0.75 -0.40 0.00 3.20 -0.51 -0.82 116.97 119.90 3g6k h TYR 11 Ca 0.14 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.91 3g6k h TYR 11 Cb 0.42 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.43 3g6k h TYR 11 CO 0.02 0.49 -0.20 -0.91 -1.64 0.00 0.00 178.16 175.93 3g6k h ASN 12 N 0.78 0.86 0.34 -2.11 2.35 -0.23 0.27 115.58 117.84 3g6k h ASN 12 Ca 0.21 -0.41 -0.16 0.00 -0.55 0.00 0.00 56.30 55.40 3g6k h ASN 12 Cb -0.05 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.07 3g6k h ASN 12 CO -0.04 1.08 -0.64 0.17 -1.65 0.00 0.00 177.43 176.34 3g6k h LEU 13 N 0.65 0.33 -0.27 1.61 8.10 -0.81 -0.29 115.31 124.64 3g6k h LEU 13 Ca 0.09 -0.20 -0.14 0.00 0.11 0.00 0.00 57.88 57.74 3g6k h LEU 13 Cb 0.75 -0.10 -0.00 0.00 -0.44 0.00 0.00 40.66 40.87 3g6k h LEU 13 CO 0.06 0.89 -0.37 0.74 -4.11 0.00 0.00 178.44 175.65 3g6k h THR 14 N 0.21 1.30 -0.87 0.15 2.02 -1.03 -0.22 112.91 114.47 3g6k h THR 14 Ca -0.01 -1.56 -0.02 0.00 0.77 0.00 0.00 66.41 65.58 3g6k h THR 14 Cb 1.17 1.65 -0.04 0.00 -1.74 0.00 0.00 68.15 69.19 3g6k h THR 14 CO 0.10 0.50 0.45 0.28 0.37 0.00 0.00 175.52 177.22 3g6k h SER 15 N 0.48 1.12 -0.30 4.18 0.02 -0.83 -0.80 113.55 117.41 3g6k h SER 15 Ca 0.03 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.86 3g6k h SER 15 Cb 0.96 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 3g6k h SER 15 CO 0.09 0.92 0.16 0.28 -1.14 0.00 0.00 176.83 177.13 3g6k h SER 16 N 1.23 0.38 -0.85 3.07 0.02 -0.87 -2.01 113.55 114.53 3g6k h SER 16 Ca 0.30 -0.10 0.01 0.00 -0.84 0.00 0.00 61.79 61.16 3g6k h SER 16 Cb 0.07 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.47 3g6k h SER 16 CO -0.04 0.38 0.56 0.22 -1.14 0.00 0.00 176.83 176.80 3g6k h TYR 17 N 0.36 1.06 0.00 3.45 3.20 -0.60 -1.62 116.97 122.81 3g6k h TYR 17 Ca 0.10 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.00 3g6k h TYR 17 Cb 0.09 -0.36 -0.00 0.00 1.54 0.00 0.00 36.73 38.00 3g6k h TYR 17 CO -0.03 0.65 -0.01 -0.07 -1.64 0.00 0.00 178.16 177.06 3g6k h LEU 18 N 1.13 0.00 -0.71 2.82 3.38 -0.74 -2.19 115.31 119.00 3g6k h LEU 18 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 3g6k h LEU 18 Cb -0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.64 3g6k h LEU 18 CO -0.08 0.01 -0.29 0.00 0.09 0.00 0.00 178.44 178.18 3g6k n GLN 19 N -3.16 1.04 -1.68 1.13 6.02 -0.63 -4.91 117.38 115.19 3g6k n GLN 19 Ca -0.02 -0.71 -0.45 0.00 -0.01 0.00 0.00 57.00 55.82 3g6k n GLN 19 Cb 0.18 -1.49 -0.04 0.00 1.02 0.00 0.00 30.24 29.91 3g6k n GLN 19 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 3g6k n ILE 20 N -0.36 0.01 -2.41 5.09 5.41 -0.83 -4.90 119.36 121.36 3g6k n ILE 20 Ca 0.12 -0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.45 3g6k n ILE 20 Cb 0.39 -1.67 -0.02 0.00 -0.71 0.00 0.00 39.64 37.63 3g6k n ILE 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3g6k s ALA 21 N 1.02 2.93 0.01 -1.39 0.00 -1.26 -4.98 121.76 118.08 3g6k s ALA 21 Ca 0.78 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 52.24 3g6k s ALA 21 Cb -0.63 -4.03 -0.01 0.00 0.00 0.00 0.00 23.12 18.46 3g6k s ALA 21 CO 0.36 -2.68 -0.02 0.00 0.00 0.00 0.00 175.76 173.42 3g6k s ALA 22 N 5.65 0.15 0.59 0.00 0.00 -1.26 -5.09 121.76 121.79 3g6k s ALA 22 Ca 0.54 -0.20 -0.15 0.00 0.00 0.00 0.00 51.96 52.15 3g6k s ALA 22 Cb -0.11 0.00 -0.04 0.00 0.00 0.00 0.00 23.12 22.97 3g6k s ALA 22 CO 0.28 -0.00 1.05 -1.21 0.00 0.00 0.00 175.76 175.87 3g6k s GLU 23 N -0.37 3.38 0.56 0.00 0.41 -1.26 -4.79 118.70 116.64 3g6k s GLU 23 Ca -0.03 1.15 0.29 0.00 -0.41 0.00 0.00 54.97 55.97 3g6k s GLU 23 Cb -0.03 -2.04 1.68 0.00 -1.78 0.00 0.00 34.13 31.96 3g6k s GLU 23 CO -0.00 -0.75 2.18 0.66 -0.49 0.00 0.00 175.26 176.86 3g6k h SER 24 N 0.43 0.00 -0.35 -0.19 4.64 -2.01 -1.55 113.55 114.52 3g6k h SER 24 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 3g6k h SER 24 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3g6k h SER 24 CO 0.58 0.05 0.00 -0.90 -0.87 0.00 0.00 176.83 175.69 3g6k n ASP 25 N -3.74 2.61 -4.89 4.97 5.75 -1.26 -4.50 116.55 115.48 3g6k n ASP 25 Ca -0.02 -1.90 -0.29 0.00 -0.01 0.00 0.00 54.79 52.57 3g6k n ASP 25 Cb 0.15 -0.23 0.00 0.00 -1.03 0.00 0.00 41.12 40.01 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 -1.36 6.26 0.23 -1.12 1.04 -0.58 -4.94 113.70 113.24 3g6k s SER 26 Ca 0.35 1.09 -0.06 0.00 0.48 0.00 0.00 55.95 57.81 3g6k s SER 26 Cb 0.19 -2.32 0.31 0.00 0.10 0.00 0.00 66.02 64.31 3g6k s SER 26 CO 0.27 -0.66 1.83 0.40 0.98 0.00 0.00 173.24 176.06 3g6k h ILE 27 N 0.09 1.00 -0.19 -1.02 2.04 -1.92 -1.61 117.51 115.90 3g6k h ILE 27 Ca -0.46 -0.29 -0.00 0.00 1.00 0.00 0.00 64.86 65.10 3g6k h ILE 27 Cb 1.20 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 3g6k h ILE 27 CO 0.62 0.16 0.11 0.40 0.00 0.00 0.00 178.15 179.44 3g6k h ILE 28 N 0.85 1.09 -1.01 -0.67 2.04 -1.93 0.01 117.51 117.90 3g6k h ILE 28 Ca 0.35 -0.24 0.02 0.00 1.00 0.00 0.00 64.86 65.99 3g6k h ILE 28 Cb 0.20 0.90 -0.05 0.00 -0.74 0.00 0.00 36.82 37.13 3g6k h ILE 28 CO -0.19 0.09 0.67 0.00 0.00 0.00 0.00 178.15 178.72 3g6k h ALA 29 N 1.01 1.29 -0.58 1.87 0.00 -1.70 0.10 119.26 121.25 3g6k h ALA 29 Ca 0.07 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3g6k h ALA 29 Cb 0.04 -0.40 -0.03 0.00 0.00 0.00 0.00 17.79 17.41 3g6k h ALA 29 CO -0.01 0.65 0.23 0.37 0.00 0.00 0.00 179.25 180.49 3g6k h GLN 30 N 1.35 0.84 -0.32 0.00 4.15 -0.92 -1.67 115.11 118.54 3g6k h GLN 30 Ca 0.37 -0.13 -0.15 0.00 0.77 0.00 0.00 58.65 59.52 3g6k h GLN 30 Cb -0.13 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.40 3g6k h GLN 30 CO -0.09 0.69 -0.40 1.15 -1.93 0.00 0.00 178.83 178.25 3g6k h THR 31 N 0.83 1.28 -0.61 2.39 2.02 -0.29 -0.83 112.91 117.70 3g6k h THR 31 Ca 0.20 -1.58 0.03 0.00 0.77 0.00 0.00 66.41 65.83 3g6k h THR 31 Cb 0.16 1.46 -0.04 0.00 -1.74 0.00 0.00 68.15 67.99 3g6k h THR 31 CO -0.02 0.52 0.37 1.56 0.37 0.00 0.00 175.52 178.32 3g6k h GLN 32 N 0.64 0.70 -0.81 6.66 4.20 -0.47 0.18 115.11 126.22 3g6k h GLN 32 Ca 0.05 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 3g6k h GLN 32 Cb 0.96 -0.16 -0.04 0.00 0.30 0.00 0.00 27.48 28.55 3g6k h GLN 32 CO 0.09 0.46 0.49 0.00 -0.67 0.00 0.00 178.83 179.20 3g6k h ARG 33 N 0.72 1.10 -0.79 1.46 3.08 -1.05 -1.24 114.38 117.66 3g6k h ARG 33 Ca 0.25 -0.10 -0.03 0.00 0.07 0.00 0.00 59.98 60.17 3g6k h ARG 33 Cb 0.05 -0.23 -0.04 0.00 0.08 0.00 0.00 29.97 29.83 3g6k h ARG 33 CO -0.11 0.77 0.37 0.00 -1.07 0.00 0.00 179.97 179.93 3g6k h ALA 34 N 1.26 1.02 -0.24 0.04 0.00 -0.32 -1.81 119.26 119.22 3g6k h ALA 34 Ca 0.29 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.05 3g6k h ALA 34 Cb -0.04 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 3g6k h ALA 34 CO -0.05 0.59 0.12 0.82 0.00 0.00 0.00 179.25 180.72 3g6k h ILE 35 N 1.12 1.00 -0.52 0.00 2.04 -0.34 -1.36 117.51 119.44 3g6k h ILE 35 Ca 0.27 -0.09 -0.05 0.00 1.00 0.00 0.00 64.86 65.99 3g6k h ILE 35 Cb 0.13 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 3g6k h ILE 35 CO -0.03 0.05 0.14 0.78 0.00 0.00 0.00 178.15 179.08 3g6k h ASN 36 N 0.26 0.74 -0.38 1.72 2.35 -0.89 0.13 115.58 119.51 3g6k h ASN 36 Ca 0.10 -0.12 -0.03 0.00 -0.55 0.00 0.00 56.30 55.69 3g6k h ASN 36 Cb 0.02 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.18 3g6k h ASN 36 CO -0.06 0.72 0.10 0.74 -1.65 0.00 0.00 177.43 177.29 3g6k h THR 37 N 0.77 1.22 -0.67 2.81 2.02 -1.16 -1.09 112.91 116.81 3g6k h THR 37 Ca 0.17 -0.73 -0.01 0.00 0.77 0.00 0.00 66.41 66.61 3g6k h THR 37 Cb 0.27 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 67.64 3g6k h THR 37 CO -0.00 0.25 0.38 0.74 0.37 0.00 0.00 175.52 177.26 3g6k h THR 38 N 0.46 1.20 -0.64 3.16 2.02 -0.82 -1.47 112.91 116.83 3g6k h THR 38 Ca 0.12 -0.49 -0.02 0.00 0.77 0.00 0.00 66.41 66.79 3g6k h THR 38 Cb 0.28 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 66.97 3g6k h THR 38 CO -0.00 0.22 0.32 0.11 0.37 0.00 0.00 175.52 176.53 3g6k h LYS 39 N 0.91 0.91 -0.45 6.66 1.57 -0.56 -1.59 116.57 124.03 3g6k h LYS 39 Ca 0.24 -0.13 -0.03 0.00 -1.87 0.00 0.00 60.65 58.86 3g6k h LYS 39 Cb 0.01 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.13 3g6k h LYS 39 CO -0.04 0.72 0.18 1.03 -0.57 0.00 0.00 179.45 180.77 3g6k h SER 40 N 0.88 0.62 -0.73 0.86 0.87 -0.97 0.18 113.55 115.27 3g6k h SER 40 Ca 0.22 -0.17 0.04 0.00 -1.23 0.00 0.00 61.79 60.65 3g6k h SER 40 Cb 0.10 -0.16 -0.05 0.00 -0.44 0.00 0.00 62.40 61.85 3g6k h SER 40 CO -0.03 0.62 0.44 0.40 -0.53 0.00 0.00 176.83 177.73 3g6k h ILE 41 N 0.59 1.06 0.25 2.23 2.04 -0.94 0.09 117.51 122.82 3g6k h ILE 41 Ca 0.15 -0.29 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 3g6k h ILE 41 Cb 0.19 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.41 3g6k h ILE 41 CO -0.01 0.16 -0.12 -0.07 0.00 0.00 0.00 178.15 178.10 3g6k h LEU 42 N 0.85 -0.28 -0.29 1.44 3.38 -0.93 -0.71 115.31 118.77 3g6k h LEU 42 Ca 0.30 -0.21 -0.18 0.00 0.09 0.00 0.00 57.88 57.88 3g6k h LEU 42 Cb 0.08 0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3g6k h LEU 42 CO -0.13 0.22 -0.53 0.40 0.09 0.00 0.00 178.44 178.49 3g6k h ILE 43 N -0.96 1.28 0.00 1.22 2.04 -0.68 0.47 117.51 120.87 3g6k h ILE 43 Ca -0.03 -1.71 -0.19 0.00 1.00 0.00 0.00 64.86 63.92 3g6k h ILE 43 Cb 0.47 1.62 -0.03 0.00 -0.74 0.00 0.00 36.82 38.14 3g6k h ILE 43 CO 0.06 0.56 -1.79 0.59 0.00 0.00 0.00 178.15 177.56 3g6k n ASN 44 N -4.03 0.46 -0.03 1.72 3.02 0.00 -4.37 115.26 112.04 3g6k n ASN 44 Ca -0.04 0.20 -0.02 0.00 -0.03 0.00 0.00 54.58 54.69 3g6k n ASN 44 Cb 0.62 0.73 -0.05 0.00 -0.61 0.00 0.00 39.78 40.47 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 -2.73 2.51 -0.09 3.52 1.02 -0.92 -4.73 120.64 119.22 3g6k n GLU 45 Ca -0.15 -0.01 -0.11 0.00 -0.02 0.00 0.00 57.16 56.87 3g6k n GLU 45 Cb 0.88 -1.16 -0.04 0.00 -0.02 0.00 0.00 31.44 31.10 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 -2.15 1.50 0.14 2.62 -1.04 -0.32 -4.40 114.28 110.63 3g6k n THR 46 Ca -0.09 0.10 0.06 0.00 -2.04 0.00 0.00 64.05 62.08 3g6k n THR 46 Cb 0.62 -2.31 0.54 0.00 -1.82 0.00 0.00 70.33 67.36 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 -1.00 0.23 0.00 -1.42 0.04 -1.08 -0.12 116.94 113.59 3g6k h PHE 47 Ca -0.06 0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.69 3g6k h PHE 47 Cb 1.02 -0.08 -0.00 0.00 2.20 0.00 0.00 35.95 39.09 3g6k h PHE 47 CO -0.38 0.15 -0.11 -1.35 -0.60 0.00 0.00 178.31 176.02 3g6k h PRO 48 N 0.25 0.00 0.10 1.51 0.11 -1.81 -3.24 132.00 128.91 3g6k h PRO 48 Ca 0.07 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.85 3g6k h PRO 48 Cb -0.02 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.07 3g6k h PRO 48 CO -0.01 0.11 -1.77 0.87 -0.21 0.00 0.00 178.00 176.98 3g6k h LYS 49 N 0.00 0.20 -4.66 1.05 1.57 -1.28 -3.47 116.57 109.97 3g6k h LYS 49 Ca -0.00 -0.35 -0.46 0.00 -1.87 0.00 0.00 60.65 57.97 3g6k h LYS 49 Cb 0.23 0.13 -0.32 0.00 0.08 0.00 0.00 32.23 32.35 3g6k h LYS 49 CO 0.01 1.17 -0.80 -1.58 -0.57 0.00 0.00 179.45 177.68 3g6k s TRP 50 N -2.51 1.15 -0.01 -1.35 0.51 -0.44 -5.11 118.94 111.18 3g6k s TRP 50 Ca -0.24 -0.32 -0.30 0.00 -2.12 0.00 0.00 56.10 53.12 3g6k s TRP 50 Cb 0.06 -0.82 -0.04 0.00 -0.81 0.00 0.00 33.47 31.86 3g6k s TRP 50 CO 0.73 -0.15 1.21 0.45 -0.51 0.00 0.00 176.95 178.68 3g6k s SER 51 N 0.30 7.06 0.00 2.95 0.15 -1.26 -4.22 113.70 118.67 3g6k s SER 51 Ca -0.06 1.90 0.13 0.00 0.70 0.00 0.00 55.95 58.62 3g6k s SER 51 Cb -0.11 -2.57 0.77 0.00 -1.71 0.00 0.00 66.02 62.41 3g6k s SER 51 CO 0.01 -0.55 1.36 -0.81 1.20 0.00 0.00 173.24 174.46 3g6k n PRO 52 N 4.76 0.82 -0.01 5.44 -0.04 -1.26 -3.70 135.00 141.01 3g6k n PRO 52 Ca 0.10 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.61 3g6k n PRO 52 Cb 0.46 -1.25 -0.09 0.00 -0.04 0.00 0.00 33.50 32.59 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 -0.75 0.00 -0.28 1.53 4.77 -1.26 -4.71 117.00 116.30 3g6k n LEU 53 Ca 0.10 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.12 3g6k n LEU 53 Cb 0.04 0.03 0.09 0.00 -2.33 0.00 0.00 43.42 41.25 3g6k n LEU 53 CO 0.07 0.03 0.57 -0.46 -1.33 0.00 0.00 177.39 176.27 3g6k n ASN 54 N -1.94 2.50 0.00 -1.43 0.23 -1.26 -4.96 115.26 108.41 3g6k n ASN 54 Ca -0.04 -2.24 0.00 0.00 -0.53 0.00 0.00 54.58 51.78 3g6k n ASN 54 Cb 0.35 -0.18 0.00 0.00 -2.08 0.00 0.00 39.78 37.87 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 -0.32 0.83 0.25 4.83 0.00 -1.26 -4.93 105.19 104.59 3g6k n GLY 55 Ca 0.08 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.18 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 3.93 0.00 -5.46 1.61 5.08 -1.73 -3.33 114.58 114.69 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 -0.24 0.00 0.50 0.00 0.00 28.75 29.01 3g6k h GLU 56 CO 0.00 0.07 -0.72 0.42 -1.00 0.00 0.00 179.01 177.77 3g6k s ILE 57 N -4.79 3.40 0.24 3.13 1.01 -1.24 -0.25 121.20 122.70 3g6k s ILE 57 Ca -0.04 -0.54 0.11 0.00 0.00 0.00 0.00 60.65 60.17 3g6k s ILE 57 Cb 0.16 -2.44 -0.05 0.00 0.01 0.00 0.00 42.46 40.14 3g6k s ILE 57 CO 0.65 0.53 -0.13 -0.55 0.00 0.00 0.00 174.94 175.44 3g6k s SER 58 N 0.17 3.97 -0.21 3.58 0.15 -0.54 -4.70 113.70 116.11 3g6k s SER 58 Ca -0.05 -0.80 -0.03 0.00 0.70 0.00 0.00 55.95 55.78 3g6k s SER 58 Cb -0.14 -0.53 -0.00 0.00 -1.71 0.00 0.00 66.02 63.63 3g6k s SER 58 CO 0.04 0.06 -0.08 0.12 1.20 0.00 0.00 173.24 174.58 3g6k s PHE 59 N -2.14 2.92 -0.24 3.44 5.36 -0.45 -0.66 117.98 126.20 3g6k s PHE 59 Ca 0.28 -1.10 -0.25 0.00 -0.96 0.00 0.00 56.93 54.89 3g6k s PHE 59 Cb -0.07 -2.06 -0.00 0.00 -0.34 0.00 0.00 43.02 40.55 3g6k s PHE 59 CO 0.15 -0.61 0.85 -1.54 -1.46 0.00 0.00 175.22 172.62 3g6k s SER 60 N 1.43 6.86 -0.03 6.13 1.04 0.24 -0.50 113.70 128.86 3g6k s SER 60 Ca 0.06 1.07 0.01 0.00 0.48 0.00 0.00 55.95 57.57 3g6k s SER 60 Cb -0.14 -2.45 0.02 0.00 0.10 0.00 0.00 66.02 63.55 3g6k s SER 60 CO -0.06 -0.53 -0.03 -0.47 0.98 0.00 0.00 173.24 173.13 3g6k s TYR 61 N 2.88 0.59 -0.06 5.02 5.04 -0.13 -4.58 117.35 126.11 3g6k s TYR 61 Ca 0.36 -0.13 0.08 0.00 -2.44 0.00 0.00 57.07 54.94 3g6k s TYR 61 Cb -0.15 -0.54 0.13 0.00 0.35 0.00 0.00 41.96 41.74 3g6k s TYR 61 CO 0.07 -0.14 1.01 0.27 -1.34 0.00 0.00 175.55 175.42 3g6k n ASN 62 N 3.89 1.33 0.00 4.32 6.94 -1.26 -4.09 115.26 126.39 3g6k n ASN 62 Ca -0.24 -2.36 0.00 0.00 -0.02 0.00 0.00 54.58 51.96 3g6k n ASN 62 Cb 0.52 -0.25 0.00 0.00 -2.36 0.00 0.00 39.78 37.69 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 -0.70 1.39 3.88 4.83 0.00 -1.26 -4.82 105.19 108.51 3g6k n GLY 63 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.86 1.69 0.35 -0.02 0.00 -1.26 -4.56 107.32 101.67 3g6k s GLY 64 Ca 0.00 -0.96 0.09 0.00 0.00 0.00 0.00 44.72 43.84 3g6k s GLY 64 CO 0.00 -0.28 1.84 0.07 0.00 0.00 0.00 173.10 174.72 3g6k h LYS 65 N -1.54 0.22 0.03 2.90 2.10 -1.97 -0.32 116.57 118.00 3g6k h LYS 65 Ca -0.45 -0.07 -0.05 0.00 -2.00 0.00 0.00 60.65 58.08 3g6k h LYS 65 Cb 1.28 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 3g6k h LYS 65 CO 0.48 0.46 -0.22 -0.44 -2.00 0.00 0.00 179.45 177.73 3g6k h ASP 66 N 0.20 0.11 0.72 7.07 3.32 -1.93 -1.48 116.42 124.44 3g6k h ASP 66 Ca 0.03 -0.98 -0.04 0.00 0.02 0.00 0.00 57.03 56.06 3g6k h ASP 66 Cb 0.54 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.05 3g6k h ASP 66 CO 0.04 1.10 -0.19 0.00 -1.72 0.00 0.00 179.24 178.47 3g6k h GLN 68 N 0.00 0.14 -0.44 0.00 4.15 -1.04 0.11 115.11 118.03 3g6k h GLN 68 Ca -0.00 -0.06 0.06 0.00 0.77 0.00 0.00 58.65 59.42 3g6k h GLN 68 Cb 0.60 -0.01 -0.05 0.00 0.21 0.00 0.00 27.48 28.23 3g6k h GLN 68 CO 0.02 0.49 0.13 0.28 -1.93 0.00 0.00 178.83 177.82 3g6k h VAL 69 N -0.22 0.82 -0.71 2.39 2.07 -1.09 -1.01 116.25 118.50 3g6k h VAL 69 Ca 0.02 -0.10 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 3g6k h VAL 69 Cb 0.44 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 3g6k h VAL 69 CO 0.01 0.05 0.43 0.25 0.02 0.00 0.00 177.57 178.33 3g6k h LEU 70 N 0.28 0.85 -0.45 2.57 5.85 -1.08 -1.19 115.31 122.15 3g6k h LEU 70 Ca 0.21 -0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 3g6k h LEU 70 Cb 0.23 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 3g6k h LEU 70 CO -0.24 0.65 0.16 0.25 -0.34 0.00 0.00 178.44 178.91 3g6k h LEU 71 N 0.98 0.63 -0.66 2.25 5.85 0.09 0.34 115.31 124.78 3g6k h LEU 71 Ca 0.26 -0.19 0.01 0.00 0.84 0.00 0.00 57.88 58.80 3g6k h LEU 71 Cb -0.04 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.79 3g6k h LEU 71 CO -0.05 0.65 0.43 -0.07 -0.34 0.00 0.00 178.44 179.07 3g6k h LEU 72 N 0.58 0.74 -0.59 2.25 3.38 -0.76 0.64 115.31 121.54 3g6k h LEU 72 Ca 0.15 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 3g6k h LEU 72 Cb 0.23 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 3g6k h LEU 72 CO -0.01 0.53 -0.09 -0.07 0.09 0.00 0.00 178.44 178.90 3g6k h LEU 73 N 0.88 1.02 -0.37 1.67 3.38 -0.81 -0.95 115.31 120.13 3g6k h LEU 73 Ca 0.25 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 3g6k h LEU 73 Cb -0.08 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.38 3g6k h LEU 73 CO -0.06 1.12 0.11 0.22 0.09 0.00 0.00 178.44 179.92 3g6k h TYR 74 N 0.91 0.59 -0.60 1.13 3.20 -0.01 -0.69 116.97 121.50 3g6k h TYR 74 Ca 0.15 -0.06 -0.05 0.00 3.14 0.00 0.00 58.73 61.91 3g6k h TYR 74 Cb 0.65 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.72 3g6k h TYR 74 CO 0.04 0.57 0.17 -0.07 -1.64 0.00 0.00 178.16 177.24 3g6k h LEU 75 N 0.44 0.86 -0.76 2.82 3.38 -0.74 0.10 115.31 121.42 3g6k h LEU 75 Ca 0.12 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3g6k h LEU 75 Cb 0.26 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 3g6k h LEU 75 CO -0.00 0.82 0.49 -1.28 0.09 0.00 0.00 178.44 178.55 3g6k h SER 76 N 0.89 0.88 0.13 -0.43 0.87 -0.81 -1.01 113.55 114.08 3g6k h SER 76 Ca 0.20 -0.03 -0.14 0.00 -1.23 0.00 0.00 61.79 60.59 3g6k h SER 76 Cb 0.28 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 3g6k h SER 76 CO -0.01 0.65 -0.48 0.00 -0.53 0.00 0.00 176.83 176.47 3g6k h LEU 78 N 0.33 0.92 -0.39 0.00 3.38 -0.37 0.62 115.31 119.79 3g6k h LEU 78 Ca 0.02 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 3g6k h LEU 78 Cb 0.97 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 3g6k h LEU 78 CO 0.08 0.80 0.20 -0.25 0.09 0.00 0.00 178.44 179.36 3g6k h TRP 79 N 0.97 0.56 -0.78 1.13 2.91 -0.87 -0.75 115.95 119.12 3g6k h TRP 79 Ca 0.24 -0.02 -0.03 0.00 1.13 0.00 0.00 58.89 60.21 3g6k h TRP 79 Cb 0.14 -0.18 -0.04 0.00 -0.51 0.00 0.00 29.16 28.58 3g6k h TRP 79 CO 0.01 0.46 0.38 1.49 -1.03 0.00 0.00 178.44 179.75 3g6k h GLU 80 N 0.50 1.12 -0.36 2.65 4.81 -0.89 0.79 114.58 123.19 3g6k h GLU 80 Ca 0.14 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 3g6k h GLU 80 Cb 0.11 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 3g6k h GLU 80 CO -0.02 0.86 0.24 -0.92 -0.73 0.00 0.00 179.01 178.44 3g6k h TYR 81 N 1.10 0.45 -0.33 0.92 3.20 -0.77 -1.50 116.97 120.04 3g6k h TYR 81 Ca 0.27 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.17 3g6k h TYR 81 Cb 0.11 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.20 3g6k h TYR 81 CO 0.01 0.28 0.16 -0.92 -1.64 0.00 0.00 178.16 176.05 3g6k h TYR 82 N 0.48 0.30 -0.30 -3.82 3.20 -0.64 0.12 116.97 116.31 3g6k h TYR 82 Ca 0.13 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 3g6k h TYR 82 Cb -0.06 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 3g6k h TYR 82 CO -0.05 0.16 0.13 0.82 -1.64 0.00 0.00 178.16 177.58 3g6k h ILE 83 N 0.33 1.17 0.02 1.81 1.08 -0.55 0.56 117.51 121.93 3g6k h ILE 83 Ca 0.14 -0.51 -0.23 0.00 -0.39 0.00 0.00 64.86 63.86 3g6k h ILE 83 Cb 0.05 0.95 0.02 0.00 -3.07 0.00 0.00 36.82 34.77 3g6k h ILE 83 CO -0.10 0.18 -0.93 0.58 -0.69 0.00 0.00 178.15 177.20 3g6k h VAL 84 N 0.34 1.33 0.00 1.67 2.07 -1.12 -3.32 116.25 117.23 3g6k h VAL 84 Ca 0.10 -2.23 -0.35 0.00 0.82 0.00 0.00 66.70 65.04 3g6k h VAL 84 Cb 0.16 2.51 -0.06 0.00 -1.52 0.00 0.00 31.29 32.38 3g6k h VAL 84 CO -0.01 0.67 -2.21 0.29 0.02 0.00 0.00 177.57 176.33 3g6k n LYS 85 N -3.97 0.67 -0.02 1.57 4.76 0.39 -4.78 118.16 116.79 3g6k n LYS 85 Ca -0.11 0.07 -0.02 0.00 -2.87 0.00 0.00 58.31 55.38 3g6k n LYS 85 Cb 0.83 -1.59 -0.03 0.00 -1.84 0.00 0.00 35.03 32.40 3g6k n LYS 85 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3g6k n LEU 86 N -2.84 0.21 0.05 -0.35 4.77 0.01 -4.80 117.00 114.04 3g6k n LEU 86 Ca -0.29 -0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.55 3g6k n LEU 86 Cb 1.13 0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 42.26 3g6k n LEU 86 CO 0.43 0.12 0.24 0.77 -1.33 0.00 0.00 177.39 177.62 3g6k h SER 87 N 0.00 0.61 -3.43 -1.43 4.64 -1.16 -3.40 113.55 109.39 3g6k h SER 87 Ca -0.10 -0.45 -0.54 0.00 -0.47 0.00 0.00 61.79 60.23 3g6k h SER 87 Cb 1.21 -0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 63.08 3g6k h SER 87 CO 0.00 1.23 0.12 -1.10 -0.87 0.00 0.00 176.83 176.22 3g6k s GLN 88 N -3.45 4.47 0.48 4.77 -0.21 -1.26 -0.13 119.66 124.32 3g6k s GLN 88 Ca -0.07 1.03 0.03 0.00 0.02 0.00 0.00 55.36 56.37 3g6k s GLN 88 Cb 0.09 -3.30 0.09 0.00 1.00 0.00 0.00 33.01 30.89 3g6k s GLN 88 CO 0.87 0.46 0.65 -1.13 -2.12 0.00 0.00 175.29 174.02 3g6k n SER 89 N 2.16 1.18 0.12 5.90 3.41 -0.97 -4.82 113.62 120.60 3g6k n SER 89 Ca -0.05 -1.92 0.11 0.00 -0.26 0.00 0.00 58.87 56.74 3g6k n SER 89 Cb 0.50 -0.40 0.48 0.00 -0.26 0.00 0.00 64.21 64.53 3g6k n SER 89 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g6k n GLN 90 N -2.15 0.16 -5.21 4.33 3.00 -1.26 -4.74 117.38 111.51 3g6k n GLN 90 Ca 0.12 0.47 -0.32 0.00 -0.01 0.00 0.00 57.00 57.26 3g6k n GLN 90 Cb 0.42 -1.85 -0.16 0.00 0.00 0.00 0.00 30.24 28.65 3g6k n GLN 90 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 3g6k s PHE 91 N -3.34 2.50 0.06 1.08 0.08 -1.26 -5.09 117.98 112.01 3g6k s PHE 91 Ca 0.03 -0.78 -0.36 0.00 0.12 0.00 0.00 56.93 55.94 3g6k s PHE 91 Cb 0.08 -1.64 -0.15 0.00 -0.57 0.00 0.00 43.02 40.74 3g6k s PHE 91 CO 0.32 -0.25 1.49 -3.47 -0.10 0.00 0.00 175.22 173.21 3g6k n ASP 92 N 3.10 2.31 0.00 1.36 2.03 -1.26 -2.24 116.55 121.84 3g6k n ASP 92 Ca -0.18 1.09 0.00 0.00 0.52 0.00 0.00 54.79 56.22 3g6k n ASP 92 Cb 0.52 -1.27 0.00 0.00 -0.72 0.00 0.00 41.12 39.65 3g6k n ASP 92 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3g6k n GLY 93 N 3.10 0.95 3.17 0.27 0.00 -1.26 -5.04 105.19 106.39 3g6k n GLY 93 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 3g6k n GLY 93 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3g6k s LYS 94 N -0.63 3.03 0.32 1.61 2.47 -0.95 -5.11 119.74 120.47 3g6k s LYS 94 Ca 0.00 -0.85 0.09 0.00 -1.56 0.00 0.00 55.97 53.65 3g6k s LYS 94 Cb 0.00 -2.45 -0.06 0.00 -1.46 0.00 0.00 37.83 33.86 3g6k s LYS 94 CO 0.00 -0.02 -0.10 -0.06 0.16 0.00 0.00 175.35 175.33 3g6k s PHE 95 N 0.84 2.25 -0.06 4.03 0.08 -1.26 -2.28 117.98 121.58 3g6k s PHE 95 Ca -0.06 -0.54 -0.01 0.00 0.12 0.00 0.00 56.93 56.44 3g6k s PHE 95 Cb -0.15 -1.26 -0.03 0.00 -0.57 0.00 0.00 43.02 41.01 3g6k s PHE 95 CO -0.02 0.50 0.01 -1.01 -0.10 0.00 0.00 175.22 174.60 3g6k s HIS 96 N -2.73 3.14 0.70 0.36 3.76 0.82 -4.89 115.29 116.45 3g6k s HIS 96 Ca 0.31 0.16 -0.13 0.00 -0.15 0.00 0.00 55.06 55.25 3g6k s HIS 96 Cb 0.02 -1.75 0.02 0.00 1.11 0.00 0.00 32.58 31.98 3g6k s HIS 96 CO 0.15 0.47 1.10 -0.98 -0.85 0.00 0.00 174.74 174.62 3g6k s ARG 97 N -1.14 2.65 -0.04 1.40 1.70 -1.26 -4.58 118.95 117.68 3g6k s ARG 97 Ca 0.16 1.26 -0.33 0.00 -0.47 0.00 0.00 55.73 56.35 3g6k s ARG 97 Cb -0.11 -1.94 -0.11 0.00 -0.57 0.00 0.00 34.95 32.21 3g6k s ARG 97 CO 0.05 -1.35 1.88 0.34 -1.08 0.00 0.00 175.30 175.15 3g6k n PHE 98 N -2.84 2.38 0.43 5.89 -0.00 -1.26 -4.89 117.46 117.17 3g6k n PHE 98 Ca 0.10 -0.07 0.12 0.00 -0.00 0.00 0.00 57.45 57.59 3g6k n PHE 98 Cb 0.53 -2.69 0.16 0.00 -0.00 0.00 0.00 39.48 37.48 3g6k n PHE 98 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.76 175.76 3g6k h PRO 99 N 9.29 0.00 -5.44 -7.13 0.13 -2.00 -3.47 132.00 123.38 3g6k h PRO 99 Ca -0.49 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.01 3g6k h PRO 99 Cb 1.26 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.28 3g6k h PRO 99 CO 0.94 0.00 -0.51 -1.17 -0.23 0.00 0.00 178.00 177.04 3g6k s LEU 100 N -4.77 4.16 -0.11 1.56 2.96 -1.26 -5.00 118.68 116.22 3g6k s LEU 100 Ca 0.05 0.28 0.18 0.00 -0.22 0.00 0.00 54.13 54.43 3g6k s LEU 100 Cb 0.11 -2.04 -0.27 0.00 0.50 0.00 0.00 46.19 44.49 3g6k s LEU 100 CO 0.72 0.27 0.24 0.35 -1.32 0.00 0.00 176.35 176.60 3g6k n THR 101 N 2.91 0.70 -3.94 3.68 -2.24 -1.26 -4.41 114.28 109.71 3g6k n THR 101 Ca -0.18 -0.64 -0.10 0.00 -2.27 0.00 0.00 64.05 60.87 3g6k n THR 101 Cb 0.53 -0.26 -0.10 0.00 -2.10 0.00 0.00 70.33 68.40 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 -2.88 0.45 -0.31 -0.78 -0.14 -1.26 -4.18 119.74 110.64 3g6k s LYS 102 Ca -0.08 -0.63 -0.13 0.00 -1.36 0.00 0.00 55.97 53.77 3g6k s LYS 102 Cb 0.09 0.17 -0.03 0.00 -1.68 0.00 0.00 37.83 36.38 3g6k s LYS 102 CO 0.80 -0.10 0.28 -1.17 -0.76 0.00 0.00 175.35 174.40 3g6k s LEU 103 N -1.71 4.25 0.09 3.17 2.96 -0.28 -4.76 118.68 122.41 3g6k s LEU 103 Ca -0.11 -0.12 -0.31 0.00 -0.22 0.00 0.00 54.13 53.37 3g6k s LEU 103 Cb -0.06 -2.23 -0.11 0.00 0.50 0.00 0.00 46.19 44.30 3g6k s LEU 103 CO -0.02 -0.19 1.86 -2.65 -1.32 0.00 0.00 176.35 174.04 3g6k n PRO 104 N 5.20 2.75 -4.06 0.98 -0.02 -1.26 -0.23 135.00 138.36 3g6k n PRO 104 Ca -0.12 1.00 -0.13 0.00 -2.02 0.00 0.00 63.50 62.24 3g6k n PRO 104 Cb 0.51 -2.91 -0.12 0.00 -0.02 0.00 0.00 33.50 30.96 3g6k n PRO 104 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3g6k s THR 105 N 3.13 0.41 -0.04 3.45 2.01 -0.37 -1.34 115.64 122.89 3g6k s THR 105 Ca 0.84 -0.80 0.01 0.00 0.31 0.00 0.00 61.69 62.05 3g6k s THR 105 Cb -0.49 -0.46 0.02 0.00 0.01 0.00 0.00 72.50 71.58 3g6k s THR 105 CO 0.39 -0.27 -0.05 0.54 -0.69 0.00 0.00 174.62 174.54 3g6k s VAL 106 N -1.03 0.58 -0.12 3.82 0.11 0.34 -1.37 120.40 122.72 3g6k s VAL 106 Ca -0.08 -0.16 0.02 0.00 -2.93 0.00 0.00 61.98 58.84 3g6k s VAL 106 Cb -0.08 -0.59 0.01 0.00 -1.53 0.00 0.00 36.38 34.19 3g6k s VAL 106 CO 0.00 0.23 -0.19 0.12 -3.33 0.00 0.00 175.10 171.93 3g6k s PHE 107 N 0.83 2.36 -0.51 1.54 5.36 0.13 -0.96 117.98 126.73 3g6k s PHE 107 Ca -0.12 -1.15 -0.21 0.00 -0.96 0.00 0.00 56.93 54.49 3g6k s PHE 107 Cb -0.14 -1.64 0.05 0.00 -0.34 0.00 0.00 43.02 40.95 3g6k s PHE 107 CO 0.01 -0.55 0.72 0.42 -1.46 0.00 0.00 175.22 174.36 3g6k s ILE 108 N 0.87 4.72 0.33 3.12 -1.09 -1.26 -1.15 121.20 126.74 3g6k s ILE 108 Ca -0.07 -0.14 -0.15 0.00 -2.23 0.00 0.00 60.65 58.06 3g6k s ILE 108 Cb -0.15 -4.35 -0.09 0.00 -1.58 0.00 0.00 42.46 36.28 3g6k s ILE 108 CO -0.01 -0.86 0.74 -0.62 -1.23 0.00 0.00 174.94 172.96 3g6k s ASP 109 N 2.60 6.76 0.08 3.58 2.15 -1.26 -4.92 116.67 125.66 3g6k s ASP 109 Ca 0.21 1.28 0.01 0.00 0.43 0.00 0.00 52.55 54.48 3g6k s ASP 109 Cb -0.16 -2.37 -0.04 0.00 -0.30 0.00 0.00 42.92 40.05 3g6k s ASP 109 CO 0.16 -0.22 -0.06 -1.00 -0.17 0.00 0.00 175.17 173.88 3g6k s HIS 110 N -2.00 0.77 -1.35 -5.34 3.76 -1.26 -4.29 115.29 105.57 3g6k s HIS 110 Ca 0.54 -0.90 0.20 0.00 -0.15 0.00 0.00 55.06 54.75 3g6k s HIS 110 Cb -0.10 -0.47 0.99 0.00 1.11 0.00 0.00 32.58 34.11 3g6k s HIS 110 CO 0.18 -0.19 1.63 -0.40 -0.85 0.00 0.00 174.74 175.11 3g6k n ASP 111 N 0.18 0.00 -0.33 1.40 5.68 -1.17 -2.52 116.55 119.78 3g6k n ASP 111 Ca -0.14 0.09 0.08 0.00 -0.50 0.00 0.00 54.79 54.32 3g6k n ASP 111 Cb 0.60 -0.32 0.16 0.00 -1.14 0.00 0.00 41.12 40.41 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 -1.32 1.96 -4.77 -1.12 5.75 -1.26 -5.04 116.55 110.75 3g6k n ASP 112 Ca 0.09 -3.32 -0.38 0.00 -0.01 0.00 0.00 54.79 51.16 3g6k n ASP 112 Cb 0.17 -0.45 -0.05 0.00 -1.03 0.00 0.00 41.12 39.76 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 -2.80 3.79 0.30 2.12 2.01 -1.05 -0.35 115.64 119.66 3g6k s THR 113 Ca 0.33 1.60 -0.30 0.00 0.31 0.00 0.00 61.69 63.63 3g6k s THR 113 Cb 0.31 -3.94 -0.12 0.00 0.01 0.00 0.00 72.50 68.76 3g6k s THR 113 CO -0.02 0.23 1.53 0.49 -0.69 0.00 0.00 174.62 176.16 3g6k n PHE 114 N 0.72 2.72 -0.23 4.92 3.72 -1.26 -4.79 117.46 123.26 3g6k n PHE 114 Ca 0.01 0.33 -0.01 0.00 -0.05 0.00 0.00 57.45 57.74 3g6k n PHE 114 Cb 0.48 -2.55 0.21 0.00 -0.94 0.00 0.00 39.48 36.67 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 4.25 1.03 -0.77 -1.08 1.63 -1.99 -1.25 116.57 118.39 3g6k h LYS 115 Ca -0.47 -0.09 -0.01 0.00 -0.85 0.00 0.00 60.65 59.23 3g6k h LYS 115 Cb 1.24 -0.22 -0.04 0.00 -0.60 0.00 0.00 32.23 32.61 3g6k h LYS 115 CO 0.75 0.72 0.42 1.15 -3.45 0.00 0.00 179.45 179.05 3g6k h THR 116 N 1.05 1.23 -0.24 1.00 2.02 -1.91 -0.45 112.91 115.61 3g6k h THR 116 Ca 0.27 -0.56 -0.12 0.00 0.77 0.00 0.00 66.41 66.77 3g6k h THR 116 Cb -0.04 0.18 -0.00 0.00 -1.74 0.00 0.00 68.15 66.55 3g6k h THR 116 CO -0.05 0.25 -0.34 0.25 0.37 0.00 0.00 175.52 176.00 3g6k h LEU 117 N 1.08 0.71 -0.51 2.58 5.85 -1.69 -1.13 115.31 122.19 3g6k h LEU 117 Ca 0.27 -0.51 0.09 0.00 0.84 0.00 0.00 57.88 58.57 3g6k h LEU 117 Cb 0.02 -0.20 -0.07 0.00 0.37 0.00 0.00 40.66 40.78 3g6k h LEU 117 CO -0.04 1.08 0.10 -0.33 -0.34 0.00 0.00 178.44 178.91 3g6k h GLU 118 N 0.35 0.23 -0.75 1.25 4.39 -0.82 0.40 114.58 119.63 3g6k h GLU 118 Ca 0.02 -0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.66 3g6k h GLU 118 Cb 0.92 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.49 3g6k h GLU 118 CO 0.08 0.15 0.28 -0.91 -1.16 0.00 0.00 179.01 177.45 3g6k h ASN 119 N 0.24 1.06 -0.39 1.42 2.35 -0.96 -2.15 115.58 117.15 3g6k h ASN 119 Ca 0.26 -0.18 -0.14 0.00 -0.55 0.00 0.00 56.30 55.68 3g6k h ASN 119 Cb 0.35 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 3g6k h ASN 119 CO -0.34 0.96 -0.29 0.15 -1.65 0.00 0.00 177.43 176.26 3g6k h PHE 120 N 1.10 1.06 -0.45 1.19 3.57 -0.52 -0.86 116.94 122.03 3g6k h PHE 120 Ca 0.25 -0.28 0.01 0.00 3.53 0.00 0.00 57.97 61.48 3g6k h PHE 120 Cb 0.24 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 3g6k h PHE 120 CO 0.02 1.09 0.29 0.82 -2.23 0.00 0.00 178.31 178.30 3g6k h ILE 121 N 0.77 1.10 -0.35 1.41 2.04 -0.74 0.90 117.51 122.64 3g6k h ILE 121 Ca 0.09 -0.20 -0.05 0.00 1.00 0.00 0.00 64.86 65.70 3g6k h ILE 121 Cb 0.86 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 3g6k h ILE 121 CO 0.08 0.11 0.03 -0.33 0.00 0.00 0.00 178.15 178.04 3g6k h GLU 122 N 0.59 0.59 -0.48 2.37 5.08 -1.02 -0.73 114.58 120.99 3g6k h GLU 122 Ca 0.17 -0.17 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 3g6k h GLU 122 Cb -0.05 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 3g6k h GLU 122 CO -0.05 0.68 -0.15 0.93 -1.00 0.00 0.00 179.01 179.42 3g6k h GLU 123 N 0.41 0.94 0.00 2.33 4.39 -1.00 -2.55 114.58 119.10 3g6k h GLU 123 Ca 0.10 -0.38 -0.06 0.00 0.34 0.00 0.00 59.36 59.37 3g6k h GLU 123 Cb 0.39 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 3g6k h GLU 123 CO 0.01 1.04 -0.27 1.79 -1.16 0.00 0.00 179.01 180.42 3g6k h THR 124 N 0.79 0.57 -0.58 1.13 1.35 -0.80 -1.44 112.91 113.93 3g6k h THR 124 Ca 0.12 -1.39 -0.04 0.00 -0.55 0.00 0.00 66.41 64.55 3g6k h THR 124 Cb 0.71 1.96 -0.03 0.00 -1.73 0.00 0.00 68.15 69.06 3g6k h THR 124 CO 0.05 0.27 0.22 0.77 -0.25 0.00 0.00 175.52 176.57 3g6k h SER 125 N 0.00 0.79 -0.19 5.36 4.64 -0.85 -0.43 113.55 122.87 3g6k h SER 125 Ca -0.00 -0.11 -0.06 0.00 -0.47 0.00 0.00 61.79 61.15 3g6k h SER 125 Cb 0.94 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 62.82 3g6k h SER 125 CO 0.04 0.72 -0.12 -0.07 -0.87 0.00 0.00 176.83 176.52 3g6k h LEU 126 N 0.84 0.43 -0.41 5.97 3.38 -1.13 -0.98 115.31 123.41 3g6k h LEU 126 Ca 0.20 -0.44 0.06 0.00 0.09 0.00 0.00 57.88 57.79 3g6k h LEU 126 Cb 0.19 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 3g6k h LEU 126 CO -0.02 0.78 0.10 -0.09 0.09 0.00 0.00 178.44 179.30 3g6k h ARG 127 N 0.09 0.23 -0.44 1.13 2.43 -0.88 -2.94 114.38 114.00 3g6k h ARG 127 Ca 0.04 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 3g6k h ARG 127 Cb 0.63 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 3g6k h ARG 127 CO 0.03 0.15 0.00 0.66 -1.51 0.00 0.00 179.97 179.30 3g6k n TYR 128 N -5.08 0.57 -3.63 2.20 4.01 -0.20 -1.69 117.16 113.34 3g6k n TYR 128 Ca 0.03 -0.29 -0.21 0.00 -0.16 0.00 0.00 57.90 57.27 3g6k n TYR 128 Cb 0.18 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.26 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 1.11 -1.90 -4.81 7.72 7.64 -0.95 -4.71 113.62 117.71 3g6k n SER 129 Ca 0.19 -0.75 -0.35 0.00 1.01 0.00 0.00 58.87 58.97 3g6k n SER 129 Cb 0.49 -4.40 -0.06 0.00 -1.01 0.00 0.00 64.21 59.23 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 -6.66 4.25 -0.61 -3.43 1.43 -0.42 -1.12 118.68 112.14 3g6k s LEU 130 Ca 0.07 1.54 -0.16 0.00 -1.03 0.00 0.00 54.13 54.56 3g6k s LEU 130 Cb -0.04 -3.88 0.15 0.00 0.03 0.00 0.00 46.19 42.45 3g6k s LEU 130 CO 0.79 -0.07 0.57 -0.55 0.23 0.00 0.00 176.35 177.31 3g6k s SER 131 N -1.80 6.31 -0.22 2.29 0.15 0.68 -4.74 113.70 116.37 3g6k s SER 131 Ca 0.49 -1.95 -0.18 0.00 0.70 0.00 0.00 55.95 55.00 3g6k s SER 131 Cb -0.15 -2.22 -0.03 0.00 -1.71 0.00 0.00 66.02 61.91 3g6k s SER 131 CO 0.20 -0.82 0.52 -0.22 1.20 0.00 0.00 173.24 174.12 3g6k s LEU 132 N 1.39 4.11 -0.20 3.45 2.96 -1.26 -1.23 118.68 127.90 3g6k s LEU 132 Ca 0.07 0.62 -0.09 0.00 -0.22 0.00 0.00 54.13 54.51 3g6k s LEU 132 Cb -0.25 -2.69 -0.05 0.00 0.50 0.00 0.00 46.19 43.70 3g6k s LEU 132 CO 0.01 -0.22 0.10 -0.47 -1.32 0.00 0.00 176.35 174.46 3g6k s TYR 133 N 1.86 3.33 -0.08 5.38 5.04 -0.47 -4.99 117.35 127.43 3g6k s TYR 133 Ca 0.23 0.20 0.03 0.00 -2.44 0.00 0.00 57.07 55.09 3g6k s TYR 133 Cb -0.15 -2.14 -0.02 0.00 0.35 0.00 0.00 41.96 40.00 3g6k s TYR 133 CO 0.09 0.21 -0.16 -1.21 -1.34 0.00 0.00 175.55 173.14 3g6k s GLU 134 N 0.44 2.81 0.96 4.97 2.02 -1.26 -0.70 118.70 127.95 3g6k s GLU 134 Ca 0.06 -0.73 -0.13 0.00 0.02 0.00 0.00 54.97 54.20 3g6k s GLU 134 Cb -0.12 -2.43 0.17 0.00 0.10 0.00 0.00 34.13 31.85 3g6k s GLU 134 CO -0.00 0.44 1.12 -1.54 0.02 0.00 0.00 175.26 175.30 3g6k s SER 135 N -0.27 3.03 -0.39 -0.19 1.04 -0.30 -4.94 113.70 111.69 3g6k s SER 135 Ca 0.01 1.02 -0.29 0.00 0.48 0.00 0.00 55.95 57.18 3g6k s SER 135 Cb -0.13 -1.62 0.01 0.00 0.10 0.00 0.00 66.02 64.39 3g6k s SER 135 CO 0.03 -2.86 1.26 -0.62 0.98 0.00 0.00 173.24 172.03 3g6k s ASP 136 N -3.81 6.59 0.55 7.02 -1.08 -1.26 -4.25 116.67 120.44 3g6k s ASP 136 Ca 0.65 0.86 0.36 0.00 -0.52 0.00 0.00 52.55 53.90 3g6k s ASP 136 Cb -0.16 -2.54 1.72 0.00 -1.46 0.00 0.00 42.92 40.48 3g6k s ASP 136 CO 0.55 -1.21 2.08 -0.09 0.52 0.00 0.00 175.17 177.02 3g6k h ARG 137 N 9.56 0.00 -0.53 4.34 2.43 -1.92 -2.85 114.38 125.41 3g6k h ARG 137 Ca -0.25 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 3g6k h ARG 137 Cb 1.08 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 3g6k h ARG 137 CO 1.08 0.00 0.00 -0.25 -1.51 0.00 0.00 179.97 179.29 3g6k n ASP 138 N -2.94 4.49 -4.70 -3.80 8.00 -1.26 -3.07 116.55 113.28 3g6k n ASP 138 Ca -0.01 -2.54 -0.35 0.00 0.71 0.00 0.00 54.79 52.60 3g6k n ASP 138 Cb 0.19 -0.54 -0.09 0.00 -0.02 0.00 0.00 41.12 40.66 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 -2.01 4.12 -0.53 -1.24 2.20 -1.08 -5.05 119.74 116.15 3g6k s LYS 139 Ca 0.46 -0.26 -0.28 0.00 -0.36 0.00 0.00 55.97 55.53 3g6k s LYS 139 Cb 0.31 -3.38 0.02 0.00 -1.51 0.00 0.00 37.83 33.28 3g6k s LYS 139 CO 0.20 0.27 1.27 0.00 -0.36 0.00 0.00 175.35 176.73 3g6k s GLU 141 N 4.99 1.13 0.79 0.00 -1.05 -1.26 -5.14 118.70 118.16 3g6k s GLU 141 Ca 0.49 -0.03 -0.11 0.00 -0.15 0.00 0.00 54.97 55.17 3g6k s GLU 141 Cb -0.09 0.53 0.06 0.00 -0.44 0.00 0.00 34.13 34.19 3g6k s GLU 141 CO 0.28 -0.41 1.10 0.95 0.95 0.00 0.00 175.26 178.12 3g6k s THR 142 N -2.16 3.13 0.24 1.83 -4.23 -1.26 -4.85 115.64 108.34 3g6k s THR 142 Ca -0.06 0.37 -0.06 0.00 -1.18 0.00 0.00 61.69 60.75 3g6k s THR 142 Cb -0.00 -3.12 0.21 0.00 1.34 0.00 0.00 72.50 70.92 3g6k s THR 142 CO 0.01 -0.48 1.87 -0.03 -0.54 0.00 0.00 174.62 175.45 3g6k h MET 143 N -1.05 1.03 -0.77 3.99 4.05 -2.01 -1.10 114.93 119.07 3g6k h MET 143 Ca -0.47 -0.06 0.05 0.00 -0.28 0.00 0.00 59.70 58.94 3g6k h MET 143 Cb 1.26 -0.23 -0.05 0.00 -0.80 0.00 0.00 31.60 31.78 3g6k h MET 143 CO 0.59 0.68 0.48 0.00 0.23 0.00 0.00 176.91 178.89 3g6k h ALA 144 N 1.38 1.04 -0.22 0.39 0.00 -1.93 -0.77 119.26 119.14 3g6k h ALA 144 Ca 0.36 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.15 3g6k h ALA 144 Cb 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3g6k h ALA 144 CO -0.13 0.23 -0.33 0.93 0.00 0.00 0.00 179.25 179.95 3g6k h GLU 145 N 0.90 0.46 -0.49 0.00 5.08 -1.77 0.35 114.58 119.10 3g6k h GLU 145 Ca 0.33 -0.20 -0.10 0.00 -1.00 0.00 0.00 59.36 58.39 3g6k h GLU 145 Cb 0.10 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 3g6k h GLU 145 CO -0.15 0.73 -0.09 0.00 -1.00 0.00 0.00 179.01 178.51 3g6k h ALA 146 N 1.26 0.92 -0.01 3.43 0.00 -0.66 -2.27 119.26 121.94 3g6k h ALA 146 Ca 0.05 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.50 3g6k h ALA 146 Cb 0.77 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3g6k h ALA 146 CO 0.06 0.63 -0.62 0.74 0.00 0.00 0.00 179.25 180.06 3g6k h PHE 147 N 0.80 0.03 -0.41 0.00 0.04 -0.75 -1.85 116.94 114.80 3g6k h PHE 147 Ca 0.13 -0.01 0.03 0.00 2.80 0.00 0.00 57.97 60.92 3g6k h PHE 147 Cb 0.60 -0.01 -0.03 0.00 2.20 0.00 0.00 35.95 38.71 3g6k h PHE 147 CO 0.03 0.64 0.22 1.49 -0.60 0.00 0.00 178.31 180.09 3g6k h GLU 148 N 0.02 0.43 -0.59 1.51 4.57 -0.52 -0.39 114.58 119.61 3g6k h GLU 148 Ca -0.01 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 58.12 3g6k h GLU 148 Cb 1.11 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 29.58 3g6k h GLU 148 CO 0.08 0.28 0.24 1.15 -1.18 0.00 0.00 179.01 179.59 3g6k h THR 149 N 0.44 1.22 -0.63 0.32 2.02 -1.23 -2.05 112.91 113.01 3g6k h THR 149 Ca 0.17 -0.69 0.05 0.00 0.77 0.00 0.00 66.41 66.71 3g6k h THR 149 Cb 0.06 0.58 -0.05 0.00 -1.74 0.00 0.00 68.15 67.00 3g6k h THR 149 CO -0.11 0.27 0.35 0.15 0.37 0.00 0.00 175.52 176.55 3g6k h PHE 150 N 0.81 0.65 0.00 3.16 3.57 -0.90 -1.75 116.94 122.48 3g6k h PHE 150 Ca 0.20 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.67 3g6k h PHE 150 Cb 0.19 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 3g6k h PHE 150 CO 0.01 0.33 -0.22 -0.07 -2.23 0.00 0.00 178.31 176.12 3g6k h LEU 151 N 0.66 0.00 -0.64 0.59 3.38 -0.79 0.29 115.31 118.81 3g6k h LEU 151 Ca 0.27 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.11 3g6k h LEU 151 Cb 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3g6k h LEU 151 CO -0.16 0.22 -0.31 1.56 0.09 0.00 0.00 178.44 179.84 3g6k h GLN 152 N 0.00 0.72 -0.29 1.13 4.20 -0.62 -2.14 115.11 118.11 3g6k h GLN 152 Ca -0.00 -0.33 -0.17 0.00 0.06 0.00 0.00 58.65 58.21 3g6k h GLN 152 Cb 0.71 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.48 3g6k h GLN 152 CO 0.03 0.94 -0.49 0.28 -0.67 0.00 0.00 178.83 178.92 3g6k h VAL 153 N 0.61 1.28 -2.26 -0.54 2.07 -0.69 -3.37 116.25 113.36 3g6k h VAL 153 Ca 0.07 -1.69 -0.59 0.00 0.82 0.00 0.00 66.70 65.31 3g6k h VAL 153 Cb 0.83 1.58 -0.41 0.00 -1.52 0.00 0.00 31.29 31.77 3g6k h VAL 153 CO 0.07 0.55 -0.72 0.49 0.02 0.00 0.00 177.57 177.98 3g6k n PHE 154 N -4.01 2.55 0.49 1.57 3.72 0.01 -4.93 117.46 116.87 3g6k n PHE 154 Ca -0.03 -4.01 0.06 0.00 -0.05 0.00 0.00 57.45 53.42 3g6k n PHE 154 Cb 0.59 -0.49 0.30 0.00 -0.94 0.00 0.00 39.48 38.94 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 1.18 0.03 0.08 -1.08 -0.04 -0.81 -1.66 135.00 132.70 3g6k n PRO 155 Ca 0.27 0.25 0.11 0.00 -0.04 0.00 0.00 63.50 64.09 3g6k n PRO 155 Cb 0.43 -1.50 0.45 0.00 -0.04 0.00 0.00 33.50 32.84 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 -1.46 0.15 -2.19 0.54 0.00 -1.26 -4.80 120.64 111.61 3g6k n GLU 156 Ca 0.04 0.28 -0.42 0.00 0.00 0.00 0.00 57.16 57.06 3g6k n GLU 156 Cb 0.15 -1.73 -0.03 0.00 0.00 0.00 0.00 31.44 29.83 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 -3.16 3.66 -0.03 3.84 2.01 -0.66 -4.17 115.64 117.13 3g6k s THR 157 Ca 0.08 1.04 0.10 0.00 0.31 0.00 0.00 61.69 63.21 3g6k s THR 157 Cb 0.11 -3.67 -0.15 0.00 0.01 0.00 0.00 72.50 68.81 3g6k s THR 157 CO 0.43 -0.01 0.18 0.29 -0.69 0.00 0.00 174.62 174.83 3g6k n LYS 158 N 5.51 0.76 -3.71 4.92 5.02 0.66 -4.99 118.16 126.33 3g6k n LYS 158 Ca 0.14 -0.07 -0.14 0.00 -2.02 0.00 0.00 58.31 56.21 3g6k n LYS 158 Cb 0.43 -1.24 -0.08 0.00 -0.02 0.00 0.00 35.03 34.12 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 -2.60 -1.03 -0.04 7.82 0.00 -0.77 -1.34 121.76 123.81 3g6k s ALA 159 Ca -0.04 0.69 0.01 0.00 0.00 0.00 0.00 51.96 52.62 3g6k s ALA 159 Cb 0.06 -0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.11 3g6k s ALA 159 CO 0.41 -0.27 -0.05 0.42 0.00 0.00 0.00 175.76 176.27 3g6k s ILE 160 N -1.01 0.53 0.06 0.00 1.01 -0.22 -1.47 121.20 120.09 3g6k s ILE 160 Ca -0.11 -0.14 -0.23 0.00 0.00 0.00 0.00 60.65 60.17 3g6k s ILE 160 Cb -0.04 -0.54 -0.06 0.00 0.01 0.00 0.00 42.46 41.83 3g6k s ILE 160 CO 0.05 0.21 0.71 -0.69 0.00 0.00 0.00 174.94 175.22 3g6k s VAL 161 N 0.77 4.71 -0.03 2.92 1.01 0.16 -0.95 120.40 128.99 3g6k s VAL 161 Ca -0.10 1.51 0.02 0.00 0.00 0.00 0.00 61.98 63.41 3g6k s VAL 161 Cb -0.13 -4.05 0.01 0.00 0.00 0.00 0.00 36.38 32.21 3g6k s VAL 161 CO 0.00 0.42 -0.07 -0.63 0.00 0.00 0.00 175.10 174.83 3g6k s ILE 162 N -0.37 0.64 -0.27 2.22 1.01 0.08 -0.59 121.20 123.91 3g6k s ILE 162 Ca 0.35 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.76 3g6k s ILE 162 Cb -0.20 -0.61 0.24 0.00 0.01 0.00 0.00 42.46 41.90 3g6k s ILE 162 CO 0.22 0.22 1.81 0.61 0.00 0.00 0.00 174.94 177.80 3g6k n GLY 163 N 3.61 3.73 3.78 6.18 0.00 -1.26 -4.31 105.19 116.91 3g6k n GLY 163 Ca -0.21 -0.86 -0.36 0.00 0.00 0.00 0.00 46.02 44.59 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 -1.96 3.73 0.24 -0.61 2.07 -1.26 -4.46 121.20 118.94 3g6k s ILE 164 Ca 0.28 1.29 0.11 0.00 -1.41 0.00 0.00 60.65 60.92 3g6k s ILE 164 Cb 0.23 -3.64 -0.05 0.00 0.13 0.00 0.00 42.46 39.13 3g6k s ILE 164 CO 0.01 -0.03 -0.16 -0.13 -1.91 0.00 0.00 174.94 172.73 3g6k s ARG 165 N -2.61 1.81 0.55 3.50 0.52 -1.26 -3.56 118.95 117.90 3g6k s ARG 165 Ca 0.59 -1.56 0.23 0.00 -0.52 0.00 0.00 55.73 54.47 3g6k s ARG 165 Cb -0.21 -1.92 1.54 0.00 0.52 0.00 0.00 34.95 34.87 3g6k s ARG 165 CO 0.26 0.37 2.19 0.45 0.02 0.00 0.00 175.30 178.60 3g6k h HIS 166 N 2.55 0.00 -0.00 -0.53 3.86 -1.26 -0.97 115.15 118.79 3g6k h HIS 166 Ca -0.43 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.78 3g6k h HIS 166 Cb 1.24 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.71 3g6k h HIS 166 CO 0.73 0.01 -0.03 0.25 0.86 0.00 0.00 177.93 179.75 3g6k n THR 167 N -4.17 0.00 -1.40 2.45 -2.24 -1.26 -2.50 114.28 105.16 3g6k n THR 167 Ca -0.03 -0.02 -0.31 0.00 -2.27 0.00 0.00 64.05 61.42 3g6k n THR 167 Cb 0.09 -0.36 0.08 0.00 -2.10 0.00 0.00 70.33 68.04 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 -2.39 4.82 0.16 3.42 1.01 -0.37 -4.89 116.67 118.43 3g6k s ASP 168 Ca 0.34 1.71 -0.34 0.00 0.71 0.00 0.00 52.55 54.97 3g6k s ASP 168 Cb 0.21 -2.48 -0.14 0.00 1.01 0.00 0.00 42.92 41.52 3g6k s ASP 168 CO 0.44 -1.81 1.59 -2.65 0.21 0.00 0.00 175.17 172.95 3g6k n PRO 169 N -3.37 2.21 -1.48 8.23 -0.02 -1.26 -0.46 135.00 138.84 3g6k n PRO 169 Ca 0.08 0.80 -0.17 0.00 -2.02 0.00 0.00 63.50 62.19 3g6k n PRO 169 Cb 0.53 -2.57 -0.07 0.00 -0.02 0.00 0.00 33.50 31.37 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 3.47 0.00 0.93 6.00 3.72 -1.26 -4.83 117.46 125.49 3g6k n PHE 170 Ca 0.17 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.69 3g6k n PHE 170 Cb 0.29 -3.16 0.32 0.00 -0.94 0.00 0.00 39.48 35.99 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 -0.14 -1.34 3.76 1.37 0.00 0.39 -4.76 105.19 104.46 3g6k n GLY 171 Ca -0.17 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 3g6k n GLY 171 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3g6k s GLU 172 N -3.03 4.35 -0.69 1.61 1.03 -1.04 -2.60 118.70 118.33 3g6k s GLU 172 Ca 0.11 2.19 0.00 0.00 0.03 0.00 0.00 54.97 57.30 3g6k s GLU 172 Cb 0.17 -3.11 0.00 0.00 -0.80 0.00 0.00 34.13 30.39 3g6k s GLU 172 CO 0.66 -0.25 0.00 0.72 -1.33 0.00 0.00 175.26 175.07 3g6k n HIS 173 N 1.59 -0.12 -0.79 4.83 8.25 -1.26 -4.99 115.22 122.73 3g6k n HIS 173 Ca 0.03 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.16 3g6k n HIS 173 Cb 0.42 -2.10 0.12 0.00 1.12 0.00 0.00 29.99 29.55 3g6k n HIS 173 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3g6k n LEU 174 N -0.86 -0.50 -4.48 2.41 4.77 -1.07 -5.05 117.00 112.22 3g6k n LEU 174 Ca -0.07 0.30 -0.26 0.00 -0.03 0.00 0.00 56.01 55.96 3g6k n LEU 174 Cb 0.42 -1.18 -0.10 0.00 -2.33 0.00 0.00 43.42 40.22 3g6k n LEU 174 CO 0.10 -3.68 -0.48 -0.54 -1.33 0.00 0.00 177.39 171.46 3g6k s LYS 175 N -3.58 1.71 0.52 3.23 -0.14 -1.26 -5.04 119.74 115.18 3g6k s LYS 175 Ca 0.56 -1.56 0.18 0.00 -1.36 0.00 0.00 55.97 53.79 3g6k s LYS 175 Cb -0.21 -1.89 1.31 0.00 -1.68 0.00 0.00 37.83 35.36 3g6k s LYS 175 CO 0.68 0.38 2.13 -1.35 -0.76 0.00 0.00 175.35 176.43 3g6k h PRO 176 N 2.74 0.00 -3.61 -1.68 0.11 -1.92 -3.39 132.00 124.24 3g6k h PRO 176 Ca -0.44 0.00 -0.43 0.00 0.11 0.00 0.00 66.00 65.24 3g6k h PRO 176 Cb 1.23 0.00 -0.38 0.00 0.11 0.00 0.00 31.00 31.95 3g6k h PRO 176 CO 0.54 0.04 -0.76 0.42 -0.21 0.00 0.00 178.00 178.03 3g6k s ILE 177 N -4.88 0.29 -0.13 4.15 1.01 -1.26 -0.10 121.20 120.28 3g6k s ILE 177 Ca -0.05 0.13 -0.30 0.00 0.00 0.00 0.00 60.65 60.44 3g6k s ILE 177 Cb 0.16 -0.50 0.10 0.00 0.01 0.00 0.00 42.46 42.23 3g6k s ILE 177 CO 0.65 0.21 0.83 0.00 0.00 0.00 0.00 174.94 176.63 3g6k s GLN 178 N 2.00 0.82 0.72 2.79 -2.07 -0.73 -5.00 119.66 118.19 3g6k s GLN 178 Ca 0.05 0.32 -0.15 0.00 -1.82 0.00 0.00 55.36 53.76 3g6k s GLN 178 Cb -0.13 0.39 0.04 0.00 -1.09 0.00 0.00 33.01 32.22 3g6k s GLN 178 CO -0.05 -0.23 1.17 0.15 -1.32 0.00 0.00 175.29 175.01 3g6k s LYS 179 N -0.87 2.24 1.00 9.60 1.02 -1.26 -0.08 119.74 131.39 3g6k s LYS 179 Ca -0.05 1.63 -0.11 0.00 0.02 0.00 0.00 55.97 57.46 3g6k s LYS 179 Cb -0.01 -1.86 0.19 0.00 -0.52 0.00 0.00 37.83 35.63 3g6k s LYS 179 CO 0.05 -1.73 1.09 0.95 -0.92 0.00 0.00 175.35 174.78 3g6k s THR 180 N -2.14 2.26 0.84 2.17 -4.23 -0.57 -4.74 115.64 109.23 3g6k s THR 180 Ca 0.72 0.08 -0.12 0.00 -1.18 0.00 0.00 61.69 61.19 3g6k s THR 180 Cb -0.26 -2.27 0.10 0.00 1.34 0.00 0.00 72.50 71.40 3g6k s THR 180 CO 0.45 -0.11 1.11 -1.81 -0.54 0.00 0.00 174.62 173.72 3g6k s ASP 181 N -2.86 4.09 0.55 3.99 1.01 -1.26 -4.92 116.67 117.26 3g6k s ASP 181 Ca 0.66 1.21 0.25 0.00 0.71 0.00 0.00 52.55 55.37 3g6k s ASP 181 Cb -0.22 -1.88 1.56 0.00 1.01 0.00 0.00 42.92 43.39 3g6k s ASP 181 CO 0.60 -2.21 2.18 0.00 0.21 0.00 0.00 175.17 175.95 3g6k h ALA 182 N -1.26 1.62 -0.00 5.23 0.00 -1.96 -1.79 119.26 121.10 3g6k h ALA 182 Ca -0.48 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3g6k h ALA 182 Cb 1.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3g6k h ALA 182 CO 0.60 0.04 -0.15 0.27 0.00 0.00 0.00 179.25 180.01 3g6k n ASN 183 N -4.03 0.42 -4.97 0.00 6.94 -1.26 -4.86 115.26 107.49 3g6k n ASN 183 Ca -0.03 -0.37 -0.21 0.00 -0.02 0.00 0.00 54.58 53.95 3g6k n ASN 183 Cb 0.12 -0.09 0.00 0.00 -2.36 0.00 0.00 39.78 37.45 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 -2.63 3.22 0.76 -2.53 0.52 -0.67 -4.95 118.94 112.65 3g6k s TRP 184 Ca 0.24 0.04 -0.15 0.00 0.02 0.00 0.00 56.10 56.25 3g6k s TRP 184 Cb 0.19 -2.09 0.04 0.00 -1.15 0.00 0.00 33.47 30.46 3g6k s TRP 184 CO 0.52 -0.12 1.06 -0.35 0.02 0.00 0.00 176.95 178.08 3g6k n PRO 185 N -1.83 0.37 -2.91 4.98 -0.04 -1.26 -4.88 135.00 129.43 3g6k n PRO 185 Ca -0.01 0.19 -0.43 0.00 -0.04 0.00 0.00 63.50 63.22 3g6k n PRO 185 Cb 0.58 -2.31 -0.05 0.00 -0.04 0.00 0.00 33.50 31.67 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 -1.84 6.48 0.25 3.54 2.15 -1.26 -4.75 116.67 121.25 3g6k s ASP 186 Ca 0.73 0.11 -0.19 0.00 0.43 0.00 0.00 52.55 53.63 3g6k s ASP 186 Cb -0.32 -2.41 0.02 0.00 -0.30 0.00 0.00 42.92 39.91 3g6k s ASP 186 CO 0.51 -0.91 0.63 0.72 -0.17 0.00 0.00 175.17 175.95 3g6k s PHE 187 N 3.39 -0.09 0.00 -5.34 -0.71 -1.26 -5.01 117.98 108.97 3g6k s PHE 187 Ca 0.33 -0.32 -0.23 0.00 -1.04 0.00 0.00 56.93 55.66 3g6k s PHE 187 Cb -0.12 0.54 -0.05 0.00 -1.21 0.00 0.00 43.02 42.19 3g6k s PHE 187 CO 0.22 -1.12 0.71 0.71 -1.34 0.00 0.00 175.22 174.40 3g6k s TYR 188 N -3.92 3.68 -0.07 3.49 2.02 -0.45 -1.52 117.35 120.58 3g6k s TYR 188 Ca 0.12 1.35 -0.25 0.00 -0.37 0.00 0.00 57.07 57.92 3g6k s TYR 188 Cb -0.04 -2.76 -0.03 0.00 -0.40 0.00 0.00 41.96 38.73 3g6k s TYR 188 CO 0.05 0.24 0.79 1.03 -1.57 0.00 0.00 175.55 176.09 3g6k s ARG 189 N 0.14 4.43 -0.31 -0.62 0.52 0.89 -1.06 118.95 122.94 3g6k s ARG 189 Ca 0.36 1.02 -0.06 0.00 -0.52 0.00 0.00 55.73 56.54 3g6k s ARG 189 Cb -0.19 -3.48 0.03 0.00 0.52 0.00 0.00 34.95 31.83 3g6k s ARG 189 CO 0.20 -0.05 0.08 -0.51 0.02 0.00 0.00 175.30 175.05 3g6k s LEU 190 N 1.14 4.02 -0.55 2.53 1.43 -0.12 -1.78 118.68 125.34 3g6k s LEU 190 Ca 0.41 -0.94 0.06 0.00 -1.03 0.00 0.00 54.13 52.62 3g6k s LEU 190 Cb -0.18 -1.85 0.22 0.00 0.03 0.00 0.00 46.19 44.40 3g6k s LEU 190 CO 0.19 -0.25 0.56 0.00 0.23 0.00 0.00 176.35 177.07 3g6k n GLN 191 N 4.82 1.49 -0.05 1.70 6.02 0.85 -0.74 117.38 131.46 3g6k n GLN 191 Ca -0.14 -4.00 0.10 0.00 -0.01 0.00 0.00 57.00 52.95 3g6k n GLN 191 Cb 0.46 -1.90 0.43 0.00 1.02 0.00 0.00 30.24 30.25 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 1.62 1.51 -0.22 -1.09 -0.05 -1.26 -3.87 135.00 131.65 3g6k n PRO 192 Ca 0.25 -0.77 0.06 0.00 -0.05 0.00 0.00 63.50 63.00 3g6k n PRO 192 Cb 0.44 -1.37 0.18 0.00 -0.05 0.00 0.00 33.50 32.70 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 -0.01 3.11 -0.02 1.53 7.94 -1.26 -4.39 117.00 123.90 3g6k n LEU 193 Ca 0.16 -2.06 -0.02 0.00 -1.11 0.00 0.00 56.01 52.98 3g6k n LEU 193 Cb 0.25 -0.28 0.24 0.00 0.53 0.00 0.00 43.42 44.16 3g6k n LEU 193 CO 0.12 0.76 0.86 -0.07 -1.11 0.00 0.00 177.39 177.95 3g6k h LEU 194 N 2.29 0.54 -0.23 -1.96 3.38 -1.67 -1.62 115.31 116.04 3g6k h LEU 194 Ca 0.00 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3g6k h LEU 194 Cb 0.80 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.41 3g6k h LEU 194 CO 0.01 0.67 -0.00 0.00 0.09 0.00 0.00 178.44 179.22 3g6k n HIS 195 N -4.21 0.00 -2.63 1.13 1.44 -1.26 -0.98 115.22 108.71 3g6k n HIS 195 Ca 0.01 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.31 3g6k n HIS 195 Cb 0.31 -0.01 -0.05 0.00 0.12 0.00 0.00 29.99 30.37 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 -2.01 3.75 0.51 -1.40 0.52 -0.61 -5.02 118.94 114.68 3g6k s TRP 196 Ca 0.45 1.75 0.08 0.00 0.02 0.00 0.00 56.10 58.40 3g6k s TRP 196 Cb 0.22 -3.14 0.04 0.00 -1.15 0.00 0.00 33.47 29.44 3g6k s TRP 196 CO 0.36 -0.10 0.57 0.54 0.02 0.00 0.00 176.95 178.34 3g6k s ASN 197 N -0.48 5.05 0.25 2.95 2.20 -1.26 -4.70 114.94 118.94 3g6k s ASN 197 Ca 0.46 -0.87 -0.05 0.00 -0.94 0.00 0.00 52.86 51.46 3g6k s ASN 197 Cb -0.27 0.00 0.27 0.00 -2.00 0.00 0.00 41.25 39.25 3g6k s ASN 197 CO 0.34 -1.05 1.81 0.25 -2.94 0.00 0.00 177.10 175.51 3g6k h LEU 198 N 0.58 0.96 -0.99 3.54 5.85 -1.95 -1.51 115.31 121.79 3g6k h LEU 198 Ca -0.36 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.18 3g6k h LEU 198 Cb 1.29 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 42.03 3g6k h LEU 198 CO 0.49 0.88 0.31 0.00 -0.34 0.00 0.00 178.44 179.78 3g6k h ALA 199 N 1.26 1.20 -0.26 1.25 0.00 -1.86 -1.00 119.26 119.84 3g6k h ALA 199 Ca 0.23 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3g6k h ALA 199 Cb 0.23 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3g6k h ALA 199 CO -0.02 0.59 0.12 -0.91 0.00 0.00 0.00 179.25 179.04 3g6k h ASN 200 N 1.03 0.35 -0.15 0.00 -0.26 -1.74 -0.96 115.58 113.86 3g6k h ASN 200 Ca 0.24 -0.13 0.02 0.00 -0.56 0.00 0.00 56.30 55.87 3g6k h ASN 200 Cb 0.15 -0.09 -0.02 0.00 -1.06 0.00 0.00 38.32 37.31 3g6k h ASN 200 CO -0.03 0.39 0.04 0.40 -1.06 0.00 0.00 177.43 177.17 3g6k h ILE 201 N 0.29 0.95 -0.51 2.81 1.08 -0.71 -2.11 117.51 119.31 3g6k h ILE 201 Ca 0.09 -0.04 -0.08 0.00 -0.39 0.00 0.00 64.86 64.44 3g6k h ILE 201 Cb 0.13 0.83 -0.02 0.00 -3.07 0.00 0.00 36.82 34.70 3g6k h ILE 201 CO -0.01 0.02 -0.01 -0.50 -0.69 0.00 0.00 178.15 176.96 3g6k h TRP 202 N 0.11 1.00 -0.22 1.37 -0.00 -1.12 -0.64 115.95 116.44 3g6k h TRP 202 Ca 0.06 -0.17 0.02 0.00 -0.00 0.00 0.00 58.89 58.79 3g6k h TRP 202 Cb 0.05 -0.26 -0.02 0.00 -0.00 0.00 0.00 29.16 28.93 3g6k h TRP 202 CO -0.12 0.92 0.10 1.03 -0.00 0.00 0.00 178.44 180.38 3g6k h SER 203 N 0.78 0.15 -0.23 -3.49 0.87 -0.99 -0.12 113.55 110.51 3g6k h SER 203 Ca 0.15 0.01 -0.10 0.00 -1.23 0.00 0.00 61.79 60.61 3g6k h SER 203 Cb 0.53 -0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.47 3g6k h SER 203 CO 0.03 0.12 -0.25 0.15 -0.53 0.00 0.00 176.83 176.34 3g6k h PHE 204 N 0.22 0.71 -0.55 2.24 3.57 -1.31 -1.88 116.94 119.93 3g6k h PHE 204 Ca 0.09 -0.22 -0.10 0.00 3.53 0.00 0.00 57.97 61.28 3g6k h PHE 204 Cb 0.03 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.60 3g6k h PHE 204 CO -0.10 0.92 -0.05 1.25 -2.23 0.00 0.00 178.31 178.11 3g6k h LEU 205 N 0.29 0.97 -0.44 0.59 5.85 -0.94 -0.97 115.31 120.66 3g6k h LEU 205 Ca 0.04 -0.28 -0.11 0.00 0.84 0.00 0.00 57.88 58.36 3g6k h LEU 205 Cb 0.81 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 3g6k h LEU 205 CO 0.06 1.05 -0.14 -0.07 -0.34 0.00 0.00 178.44 179.00 3g6k h LEU 206 N 0.89 0.88 -1.50 2.25 3.38 -1.04 -2.89 115.31 117.29 3g6k h LEU 206 Ca 0.15 -0.38 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 3g6k h LEU 206 Cb 0.58 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3g6k h LEU 206 CO 0.04 1.06 0.05 0.22 0.09 0.00 0.00 178.44 179.89 3g6k h TYR 207 N 0.70 0.38 0.00 1.13 3.20 -1.03 -3.01 116.97 118.33 3g6k h TYR 207 Ca 0.11 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.94 3g6k h TYR 207 Cb 0.69 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.84 3g6k h TYR 207 CO 0.05 0.35 -0.08 0.66 -1.64 0.00 0.00 178.16 177.50 3g6k h SER 208 N 0.37 0.00 -1.64 -2.11 4.64 -0.96 -0.45 113.55 113.41 3g6k h SER 208 Ca 0.09 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 61.02 3g6k h SER 208 Cb 0.17 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.16 3g6k h SER 208 CO -0.00 0.08 -0.41 -3.20 -0.87 0.00 0.00 176.83 172.43 3g6k n ASN 209 N -3.89 -5.40 -4.87 4.97 5.15 -1.14 -4.50 115.26 105.58 3g6k n ASN 209 Ca -0.02 0.28 -0.31 0.00 -0.60 0.00 0.00 54.58 53.93 3g6k n ASN 209 Cb 0.17 -4.54 -0.03 0.00 -0.53 0.00 0.00 39.78 34.85 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 -4.15 3.83 0.35 1.20 0.41 -1.26 -4.90 118.70 114.17 3g6k s GLU 210 Ca 0.00 0.58 -0.28 0.00 -0.41 0.00 0.00 54.97 54.85 3g6k s GLU 210 Cb 0.00 -2.35 -0.10 0.00 -1.78 0.00 0.00 34.13 29.90 3g6k s GLU 210 CO 0.00 -0.06 1.36 -1.25 -0.49 0.00 0.00 175.26 174.82 3g6k s PRO 211 N -3.81 4.24 0.00 0.39 0.04 -1.26 -5.00 135.00 129.61 3g6k s PRO 211 Ca 0.53 2.32 0.07 0.00 0.04 0.00 0.00 61.00 63.96 3g6k s PRO 211 Cb -0.10 -3.01 -0.03 0.00 0.04 0.00 0.00 34.50 31.40 3g6k s PRO 211 CO 0.30 -0.32 -0.22 0.42 0.04 0.00 0.00 177.00 177.22 3g6k s ILE 212 N -1.14 2.43 0.09 0.56 1.01 -1.26 -5.07 121.20 117.81 3g6k s ILE 212 Ca 0.51 -1.11 -0.35 0.00 0.00 0.00 0.00 60.65 59.70 3g6k s ILE 212 Cb -0.42 -1.93 -0.15 0.00 0.01 0.00 0.00 42.46 39.98 3g6k s ILE 212 CO 0.56 0.49 1.50 0.00 0.00 0.00 0.00 174.94 177.49 3g6k n GLU 214 N 3.35 0.06 -0.28 0.00 -0.58 -1.26 -1.89 120.64 120.05 3g6k n GLU 214 Ca 0.18 0.25 0.11 0.00 -0.42 0.00 0.00 57.16 57.28 3g6k n GLU 214 Cb 0.24 -1.61 0.35 0.00 -0.57 0.00 0.00 31.44 29.85 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 0.70 -1.06 -4.62 3.38 -1.95 -1.54 115.31 110.22 3g6k h LEU 215 Ca 0.00 0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 3g6k h LEU 215 Cb 0.35 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 3g6k h LEU 215 CO 0.00 0.37 0.06 1.88 0.09 0.00 0.00 178.44 180.84 3g6k h TYR 216 N 0.75 0.76 -0.15 1.13 0.05 -1.57 -1.71 116.97 116.23 3g6k h TYR 216 Ca 0.44 -0.08 0.04 0.00 0.05 0.00 0.00 58.73 59.19 3g6k h TYR 216 Cb 0.64 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 38.16 3g6k h TYR 216 CO -0.00 0.68 0.12 -0.09 -1.05 0.00 0.00 178.16 177.82 3g6k h ARG 217 N 0.70 0.00 -0.38 4.88 9.65 -1.44 0.84 114.38 128.63 3g6k h ARG 217 Ca 0.15 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.03 3g6k h ARG 217 Cb 0.35 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.93 3g6k h ARG 217 CO 0.01 0.00 0.00 0.66 2.80 0.00 0.00 179.97 183.44 3g6k n TYR 218 N -4.34 0.50 0.00 2.20 4.01 -0.66 -4.03 117.16 114.85 3g6k n TYR 218 Ca 0.01 -0.25 0.00 0.00 -0.16 0.00 0.00 57.90 57.50 3g6k n TYR 218 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.27 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 1.32 0.85 3.78 2.72 0.00 -0.81 -4.64 105.19 108.42 3g6k n GLY 219 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 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 3.24 0.00 1.61 0.08 -1.11 -1.11 117.98 118.69 3g6k s PHE 220 Ca 0.00 1.64 0.00 0.00 0.12 0.00 0.00 56.93 58.69 3g6k s PHE 220 Cb 0.00 -3.13 0.00 0.00 -0.57 0.00 0.00 43.02 39.32 3g6k s PHE 220 CO 0.00 -0.66 0.00 0.25 -0.10 0.00 0.00 175.22 174.71 3g6k n THR 221 N -0.12 0.00 -3.67 0.64 -2.24 -1.26 -3.89 114.28 103.73 3g6k n THR 221 Ca 0.05 -0.44 -0.08 0.00 -2.27 0.00 0.00 64.05 61.31 3g6k n THR 221 Cb 0.50 0.98 -0.09 0.00 -2.10 0.00 0.00 70.33 69.62 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 -0.93 -0.60 -0.84 3.42 0.15 -1.25 -4.93 113.70 108.71 3g6k s SER 222 Ca 0.00 1.12 -0.13 0.00 0.70 0.00 0.00 55.95 57.63 3g6k s SER 222 Cb 0.00 1.19 0.22 0.00 -1.71 0.00 0.00 66.02 65.73 3g6k s SER 222 CO 0.00 -0.22 0.78 -0.76 1.20 0.00 0.00 173.24 174.24 3g6k s LEU 223 N 1.90 6.68 0.00 3.45 1.43 -1.26 -4.90 118.68 125.97 3g6k s LEU 223 Ca -0.07 -2.76 0.00 0.00 -1.03 0.00 0.00 54.13 50.26 3g6k s LEU 223 Cb -0.09 -2.19 0.00 0.00 0.03 0.00 0.00 46.19 43.94 3g6k s LEU 223 CO -0.15 -0.54 0.00 0.61 0.23 0.00 0.00 176.35 176.50 3g6k n GLY 224 N 3.86 0.82 3.85 -3.19 0.00 -1.26 -5.07 105.19 104.21 3g6k n GLY 224 Ca 0.14 -1.66 -0.30 0.00 0.00 0.00 0.00 46.02 44.20 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 5.04 0.49 1.61 2.20 -1.26 -4.69 114.94 117.32 3g6k s ASN 225 Ca 0.00 1.21 0.26 0.00 -0.94 0.00 0.00 52.86 53.39 3g6k s ASN 225 Cb 0.00 -1.98 1.23 0.00 -2.00 0.00 0.00 41.25 38.50 3g6k s ASN 225 CO 0.00 -1.61 1.97 -0.37 -2.94 0.00 0.00 177.10 174.15 3g6k h VAL 226 N -0.84 0.55 0.15 3.54 -1.51 -1.00 -1.83 116.25 115.32 3g6k h VAL 226 Ca -0.46 -0.79 -0.29 0.00 -1.23 0.00 0.00 66.70 63.93 3g6k h VAL 226 Cb 1.26 1.53 0.01 0.00 -2.13 0.00 0.00 31.29 31.96 3g6k h VAL 226 CO 0.62 0.16 -1.29 -0.08 -1.23 0.00 0.00 177.57 175.75 3g6k h GLU 227 N 0.00 0.34 0.00 5.19 4.22 -1.92 -3.37 114.58 119.03 3g6k h GLU 227 Ca -0.00 -0.57 0.00 0.00 0.08 0.00 0.00 59.36 58.87 3g6k h GLU 227 Cb 0.52 0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.98 3g6k h GLU 227 CO 0.02 1.27 -1.53 -0.85 -2.18 0.00 0.00 179.01 175.74 3g6k n GLU 228 N -3.58 0.60 -3.61 1.92 0.28 -1.03 -4.78 120.64 110.45 3g6k n GLU 228 Ca -0.10 -0.06 -0.36 0.00 -0.16 0.00 0.00 57.16 56.48 3g6k n GLU 228 Cb 1.04 -1.64 -0.07 0.00 1.43 0.00 0.00 31.44 32.19 3g6k n GLU 228 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 3g6k s THR 229 N -3.43 5.35 0.27 3.84 2.01 -0.72 -0.85 115.64 122.11 3g6k s THR 229 Ca -0.04 0.40 0.11 0.00 0.31 0.00 0.00 61.69 62.47 3g6k s THR 229 Cb 0.12 -3.57 -0.05 0.00 0.01 0.00 0.00 72.50 69.01 3g6k s THR 229 CO 0.86 0.40 -0.17 -0.76 -0.69 0.00 0.00 174.62 174.26 3g6k s LEU 230 N 0.46 2.59 0.67 4.42 1.43 -0.37 -4.92 118.68 122.97 3g6k s LEU 230 Ca 0.13 -1.05 -0.17 0.00 -1.03 0.00 0.00 54.13 52.01 3g6k s LEU 230 Cb -0.12 -0.98 -0.02 0.00 0.03 0.00 0.00 46.19 45.10 3g6k s LEU 230 CO 0.02 -0.04 0.93 -2.65 0.23 0.00 0.00 176.35 174.83 3g6k n PRO 231 N -0.58 0.65 -2.27 1.29 -0.02 -1.26 -4.43 135.00 128.39 3g6k n PRO 231 Ca -0.06 0.27 -0.42 0.00 -2.02 0.00 0.00 63.50 61.27 3g6k n PRO 231 Cb 0.60 -2.16 -0.03 0.00 -0.02 0.00 0.00 33.50 31.89 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 -1.46 6.87 0.56 2.55 3.84 -0.27 -4.61 114.94 122.42 3g6k s ASN 232 Ca 0.74 1.99 0.32 0.00 0.21 0.00 0.00 52.86 56.13 3g6k s ASN 232 Cb -0.38 -2.55 1.66 0.00 -0.55 0.00 0.00 41.25 39.43 3g6k s ASN 232 CO 0.49 -0.74 2.13 1.55 -2.79 0.00 0.00 177.10 177.73 3g6k h PRO 233 N 8.15 0.00 0.00 0.43 0.13 -1.89 -0.37 132.00 138.45 3g6k h PRO 233 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 3g6k h PRO 233 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3g6k h PRO 233 CO 0.92 0.07 0.00 0.72 -0.23 0.00 0.00 178.00 179.48 3g6k n HIS 234 N -3.43 0.18 -0.17 1.56 8.25 -1.26 -2.15 115.22 118.21 3g6k n HIS 234 Ca -0.02 0.07 0.10 0.00 -0.26 0.00 0.00 57.72 57.61 3g6k n HIS 234 Cb 0.21 -0.61 0.25 0.00 1.12 0.00 0.00 29.99 30.96 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 -1.67 3.55 -4.74 2.41 4.77 -0.15 -4.98 117.00 116.19 3g6k n LEU 235 Ca 0.03 -1.87 -0.41 0.00 -0.03 0.00 0.00 56.01 53.73 3g6k n LEU 235 Cb 0.20 -0.36 -0.03 0.00 -2.33 0.00 0.00 43.42 40.89 3g6k n LEU 235 CO 0.16 0.86 1.03 -0.60 -1.33 0.00 0.00 177.39 177.51 3g6k s ARG 236 N -1.09 4.34 0.13 3.23 3.52 -0.91 -0.72 118.95 127.46 3g6k s ARG 236 Ca 0.40 2.17 -0.28 0.00 -0.13 0.00 0.00 55.73 57.89 3g6k s ARG 236 Cb 0.21 -3.15 -0.07 0.00 -1.56 0.00 0.00 34.95 30.38 3g6k s ARG 236 CO 0.28 -0.31 0.87 0.15 -0.81 0.00 0.00 175.30 175.48 3g6k s LYS 237 N -0.39 4.65 -0.14 5.12 1.02 0.36 -4.88 119.74 125.49 3g6k s LYS 237 Ca 0.57 1.30 -0.11 0.00 0.02 0.00 0.00 55.97 57.75 3g6k s LYS 237 Cb -0.39 -3.33 0.04 0.00 -0.52 0.00 0.00 37.83 33.64 3g6k s LYS 237 CO 0.42 0.38 0.36 0.34 -0.92 0.00 0.00 175.35 175.92 3g6k s ASP 238 N -0.52 -0.39 0.28 2.83 -1.08 -1.26 -4.70 116.67 111.83 3g6k s ASP 238 Ca 0.41 0.73 0.01 0.00 -0.52 0.00 0.00 52.55 53.18 3g6k s ASP 238 Cb -0.23 0.70 0.67 0.00 -1.46 0.00 0.00 42.92 42.60 3g6k s ASP 238 CO 0.28 -0.14 1.63 0.11 0.52 0.00 0.00 175.17 177.57 3g6k h LYS 239 N 6.11 0.16 -0.59 4.34 1.57 -2.02 -2.13 116.57 124.01 3g6k h LYS 239 Ca -0.30 -0.01 -0.43 0.00 -1.87 0.00 0.00 60.65 58.04 3g6k h LYS 239 Cb 1.18 -0.04 -0.35 0.00 0.08 0.00 0.00 32.23 33.11 3g6k h LYS 239 CO 0.30 0.10 -0.78 0.27 -0.57 0.00 0.00 179.45 178.77 3g6k n ASN 240 N -5.28 4.12 -4.88 0.86 6.94 -1.26 -4.90 115.26 110.86 3g6k n ASN 240 Ca 0.20 -3.67 -0.35 0.00 -0.02 0.00 0.00 54.58 50.75 3g6k n ASN 240 Cb 0.66 -0.38 -0.05 0.00 -2.36 0.00 0.00 39.78 37.65 3g6k n ASN 240 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 3g6k s SER 241 N -3.52 6.51 0.11 0.53 0.15 -0.80 -5.09 113.70 111.58 3g6k s SER 241 Ca 0.47 0.58 -0.31 0.00 0.70 0.00 0.00 55.95 57.39 3g6k s SER 241 Cb 0.40 -2.10 -0.08 0.00 -1.71 0.00 0.00 66.02 62.53 3g6k s SER 241 CO 0.01 0.25 1.36 0.28 1.20 0.00 0.00 173.24 176.35 3g6k s THR 242 N -1.30 3.38 0.26 6.45 -1.32 -1.26 -4.80 115.64 117.04 3g6k s THR 242 Ca 0.28 1.00 -0.30 0.00 -1.21 0.00 0.00 61.69 61.45 3g6k s THR 242 Cb -0.13 -3.64 -0.14 0.00 -1.51 0.00 0.00 72.50 67.08 3g6k s THR 242 CO 0.16 0.08 1.22 -2.65 -2.21 0.00 0.00 174.62 171.22 3g6k n PRO 243 N 3.86 1.68 -2.83 7.08 -0.02 -1.26 -4.95 135.00 138.55 3g6k n PRO 243 Ca 0.11 0.59 -0.36 0.00 -2.02 0.00 0.00 63.50 61.82 3g6k n PRO 243 Cb 0.43 -2.12 -0.06 0.00 -0.02 0.00 0.00 33.50 31.72 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 0.10 4.27 0.14 2.45 1.43 -1.26 -5.04 118.68 120.77 3g6k s LEU 244 Ca 0.64 1.75 -0.26 0.00 -1.03 0.00 0.00 54.13 55.23 3g6k s LEU 244 Cb -0.69 -4.06 -0.07 0.00 0.03 0.00 0.00 46.19 41.40 3g6k s LEU 244 CO 0.56 -0.11 0.80 -1.59 0.23 0.00 0.00 176.35 176.24 3g6k s LYS 245 N -2.26 4.59 -0.23 1.70 -2.85 -1.26 -5.05 119.74 114.38 3g6k s LYS 245 Ca 0.51 1.19 -0.20 0.00 -1.00 0.00 0.00 55.97 56.48 3g6k s LYS 245 Cb -0.17 -3.29 -0.02 0.00 -2.06 0.00 0.00 37.83 32.29 3g6k s LYS 245 CO 0.21 0.48 0.60 -1.17 0.10 0.00 0.00 175.35 175.57 3g6k s LEU 246 N -0.83 4.09 0.00 2.77 2.96 -1.26 -4.89 118.68 121.53 3g6k s LEU 246 Ca 0.38 0.71 0.28 0.00 -0.22 0.00 0.00 54.13 55.27 3g6k s LEU 246 Cb -0.23 -2.81 1.06 0.00 0.50 0.00 0.00 46.19 44.70 3g6k s LEU 246 CO 0.26 -0.31 1.76 0.59 -1.32 0.00 0.00 176.35 177.33 3g6k n ASN 247 N 5.38 0.61 -0.60 3.68 3.02 -1.26 -4.37 115.26 121.72 3g6k n ASN 247 Ca -0.02 -0.60 0.06 0.00 -0.03 0.00 0.00 54.58 53.99 3g6k n ASN 247 Cb 0.49 -0.02 0.14 0.00 -0.61 0.00 0.00 39.78 39.79 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 -0.92 0.00 -0.10 3.10 3.72 -1.26 -4.76 117.46 117.24 3g6k n PHE 248 Ca 0.13 -1.09 -0.07 0.00 -0.05 0.00 0.00 57.45 56.37 3g6k n PHE 248 Cb 0.30 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.65 3g6k n PHE 248 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 3g6k h GLU 249 N 0.66 0.34 -0.28 -1.08 5.08 -2.01 -1.81 114.58 115.49 3g6k h GLU 249 Ca -0.04 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.31 3g6k h GLU 249 Cb 1.18 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.33 3g6k h GLU 249 CO 0.02 0.23 0.17 2.35 -1.00 0.00 0.00 179.01 180.78 3g6k h TRP 250 N 0.35 0.32 -0.93 4.33 7.01 -1.95 -0.80 115.95 124.29 3g6k h TRP 250 Ca 0.14 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.14 3g6k h TRP 250 Cb 0.05 -0.11 -0.05 0.00 -2.10 0.00 0.00 29.16 26.96 3g6k h TRP 250 CO -0.10 0.20 0.56 0.93 -2.79 0.00 0.00 178.44 177.24 3g6k h GLU 251 N 0.35 1.27 -0.24 2.65 3.07 -1.85 0.79 114.58 120.62 3g6k h GLU 251 Ca 0.11 -0.12 -0.12 0.00 -0.50 0.00 0.00 59.36 58.73 3g6k h GLU 251 Cb -0.02 -0.27 -0.00 0.00 -0.84 0.00 0.00 28.75 27.63 3g6k h GLU 251 CO -0.04 0.89 -0.33 0.82 -1.40 0.00 0.00 179.01 178.95 3g6k h ILE 252 N 1.29 1.32 0.00 3.13 2.04 -1.05 -1.48 117.51 122.76 3g6k h ILE 252 Ca 0.33 -1.52 -0.09 0.00 1.00 0.00 0.00 64.86 64.58 3g6k h ILE 252 Cb -0.05 1.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 3g6k h ILE 252 CO -0.06 0.48 -0.43 -0.33 0.00 0.00 0.00 178.15 177.80 3g6k h GLU 253 N 0.35 0.00 -0.20 2.37 5.08 -0.76 -3.02 114.58 118.40 3g6k h GLU 253 Ca 0.03 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.33 3g6k h GLU 253 Cb 0.91 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.12 3g6k h GLU 253 CO 0.08 0.43 -0.08 0.09 -1.00 0.00 0.00 179.01 178.53 3g6k n ASN 254 N -3.95 2.84 -4.71 1.42 4.13 0.24 -5.05 115.26 110.18 3g6k n ASN 254 Ca -0.02 -3.38 -0.34 0.00 1.68 0.00 0.00 54.58 52.53 3g6k n ASN 254 Cb 0.47 -0.55 0.11 0.00 -1.54 0.00 0.00 39.78 38.27 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 -3.02 1.85 0.09 3.52 1.70 -0.56 -4.83 118.95 117.71 3g6k s ARG 255 Ca 0.40 1.81 -0.31 0.00 -0.47 0.00 0.00 55.73 57.17 3g6k s ARG 255 Cb 0.35 -1.79 -0.09 0.00 -0.57 0.00 0.00 34.95 32.85 3g6k s ARG 255 CO 0.03 -2.06 1.71 -0.47 -1.08 0.00 0.00 175.30 173.42 3g6k s TYR 256 N -1.99 2.37 0.17 5.89 5.04 -0.18 -4.91 117.35 123.74 3g6k s TYR 256 Ca 0.75 0.22 -0.30 0.00 -2.44 0.00 0.00 57.07 55.30 3g6k s TYR 256 Cb -0.30 -4.03 -0.07 0.00 0.35 0.00 0.00 41.96 37.90 3g6k s TYR 256 CO 0.48 -4.18 0.96 0.15 -1.34 0.00 0.00 175.55 171.62 3g6k s LYS 257 N 2.58 4.76 0.16 4.97 1.02 -1.26 -4.67 119.74 127.30 3g6k s LYS 257 Ca 0.76 1.49 0.03 0.00 0.02 0.00 0.00 55.97 58.27 3g6k s LYS 257 Cb -0.42 -3.33 -0.04 0.00 -0.52 0.00 0.00 37.83 33.53 3g6k s LYS 257 CO 0.34 0.34 0.26 -1.01 -0.92 0.00 0.00 175.35 174.35 3g6k s HIS 258 N -0.55 3.41 0.00 3.18 3.76 -1.26 -5.10 115.29 118.73 3g6k s HIS 258 Ca 0.44 0.08 0.00 0.00 -0.15 0.00 0.00 55.06 55.44 3g6k s HIS 258 Cb -0.25 -1.63 0.00 0.00 1.11 0.00 0.00 32.58 31.81 3g6k s HIS 258 CO 0.31 0.51 0.00 0.27 -0.85 0.00 0.00 174.74 174.99 3g6k n ASN 259 N -0.55 0.55 -0.20 1.40 0.23 -1.26 -4.84 115.26 110.59 3g6k n ASN 259 Ca -0.07 -0.29 -0.08 0.00 -0.53 0.00 0.00 54.58 53.61 3g6k n ASN 259 Cb 0.54 0.00 0.06 0.00 -2.08 0.00 0.00 39.78 38.30 3g6k n ASN 259 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 3g6k h GLU 260 N 0.00 1.04 0.00 -3.83 4.81 -2.00 -0.98 114.58 113.61 3g6k h GLU 260 Ca 0.00 -0.30 -0.11 0.00 -0.13 0.00 0.00 59.36 58.83 3g6k h GLU 260 Cb 0.00 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 3g6k h GLU 260 CO 0.00 0.99 -0.50 0.28 -0.73 0.00 0.00 179.01 179.04 3g6k h VAL 261 N 0.96 1.20 -0.01 0.32 2.07 -2.01 -3.36 116.25 115.43 3g6k h VAL 261 Ca 0.18 -1.82 0.00 0.00 0.82 0.00 0.00 66.70 65.88 3g6k h VAL 261 Cb 0.49 2.03 0.00 0.00 -1.52 0.00 0.00 31.29 32.28 3g6k h VAL 261 CO 0.02 0.49 -0.33 0.35 0.02 0.00 0.00 177.57 178.12 3g6k n THR 262 N -3.71 0.00 -0.82 2.57 -2.24 -1.06 -4.85 114.28 104.17 3g6k n THR 262 Ca -0.01 -0.33 -0.31 0.00 -2.27 0.00 0.00 64.05 61.13 3g6k n THR 262 Cb 0.56 1.08 0.15 0.00 -2.10 0.00 0.00 70.33 70.03 3g6k n THR 262 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3g6k s LYS 263 N -1.66 1.23 -0.02 -0.78 2.47 -0.40 -4.81 119.74 115.77 3g6k s LYS 263 Ca 0.07 1.44 0.02 0.00 -1.56 0.00 0.00 55.97 55.94 3g6k s LYS 263 Cb 0.09 -1.76 0.00 0.00 -1.46 0.00 0.00 37.83 34.70 3g6k s LYS 263 CO 0.34 -2.45 -0.06 0.00 0.16 0.00 0.00 175.35 173.34 3g6k s ALA 264 N -2.70 0.60 0.55 3.13 0.00 -1.26 -5.02 121.76 117.05 3g6k s ALA 264 Ca 0.66 -0.20 -0.16 0.00 0.00 0.00 0.00 51.96 52.26 3g6k s ALA 264 Cb -0.22 -0.24 -0.06 0.00 0.00 0.00 0.00 23.12 22.60 3g6k s ALA 264 CO 0.58 0.09 1.01 -2.00 0.00 0.00 0.00 175.76 175.44 3g6k s GLU 265 N 0.23 3.70 0.34 0.00 2.56 -1.26 -4.99 118.70 119.27 3g6k s GLU 265 Ca -0.03 1.06 -0.29 0.00 0.00 0.00 0.00 54.97 55.71 3g6k s GLU 265 Cb -0.07 -2.09 -0.12 0.00 2.00 0.00 0.00 34.13 33.85 3g6k s GLU 265 CO -0.00 -0.49 1.50 -2.30 -0.56 0.00 0.00 175.26 173.41 3g6k n PRO 266 N -1.76 2.59 -3.71 4.30 -0.02 -1.26 -4.83 135.00 130.31 3g6k n PRO 266 Ca 0.07 0.91 -0.38 0.00 -2.02 0.00 0.00 63.50 62.09 3g6k n PRO 266 Cb 0.54 -2.64 -0.10 0.00 -0.02 0.00 0.00 33.50 31.27 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 -0.68 3.61 0.47 4.25 1.01 -1.26 -5.10 121.20 123.50 3g6k s ILE 267 Ca 0.58 -2.14 -0.21 0.00 0.00 0.00 0.00 60.65 58.88 3g6k s ILE 267 Cb -0.50 -3.43 -0.08 0.00 0.01 0.00 0.00 42.46 38.46 3g6k s ILE 267 CO 0.58 -0.75 1.05 -2.84 0.00 0.00 0.00 174.94 172.98 3g6k s PRO 268 N 0.99 3.87 0.35 2.79 0.02 -1.26 -4.49 135.00 137.27 3g6k s PRO 268 Ca 0.09 1.42 -0.28 0.00 0.02 0.00 0.00 61.00 62.25 3g6k s PRO 268 Cb -0.23 -2.21 -0.11 0.00 0.02 0.00 0.00 34.50 31.98 3g6k s PRO 268 CO -0.03 -0.38 1.40 -1.50 -0.33 0.00 0.00 177.00 176.16 3g6k s ILE 269 N -1.88 2.38 0.42 2.83 2.07 -1.26 -4.94 121.20 120.82 3g6k s ILE 269 Ca 0.65 0.38 -0.26 0.00 -1.41 0.00 0.00 60.65 60.01 3g6k s ILE 269 Cb -0.18 -3.24 -0.09 0.00 0.13 0.00 0.00 42.46 39.08 3g6k s ILE 269 CO 0.22 0.09 1.36 0.00 -1.91 0.00 0.00 174.94 174.70 3g6k s ALA 270 N -1.08 3.26 0.31 1.50 0.00 -1.26 -4.84 121.76 119.65 3g6k s ALA 270 Ca 0.51 1.33 0.04 0.00 0.00 0.00 0.00 51.96 53.85 3g6k s ALA 270 Cb -0.43 -3.53 0.65 0.00 0.00 0.00 0.00 23.12 19.81 3g6k s ALA 270 CO 0.58 -0.98 1.86 -0.44 0.00 0.00 0.00 175.76 176.78 3g6k h ASP 271 N 2.53 0.82 -0.07 0.00 3.45 -1.99 -0.51 116.42 120.65 3g6k h ASP 271 Ca -0.50 0.04 -0.04 0.00 0.43 0.00 0.00 57.03 56.95 3g6k h ASP 271 Cb 1.25 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 39.88 3g6k h ASP 271 CO 0.62 0.44 -0.06 1.05 -1.57 0.00 0.00 179.24 179.72 3g6k h GLU 272 N 0.88 0.32 0.04 3.56 4.11 -2.00 -1.21 114.58 120.29 3g6k h GLU 272 Ca 0.46 -0.06 -0.23 0.00 0.07 0.00 0.00 59.36 59.60 3g6k h GLU 272 Cb 0.53 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 3g6k h GLU 272 CO -0.22 0.40 -1.02 -0.44 0.07 0.00 0.00 179.01 177.79 3g6k h ASP 273 N 0.31 0.36 -0.67 3.06 3.32 -1.58 -2.71 116.42 118.51 3g6k h ASP 273 Ca 0.07 -0.33 -0.02 0.00 0.02 0.00 0.00 57.03 56.76 3g6k h ASP 273 Cb 0.31 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 3g6k h ASP 273 CO 0.01 1.18 0.33 0.25 -1.72 0.00 0.00 179.24 179.29 3g6k h LEU 274 N 0.12 0.86 -0.65 1.55 5.85 -0.71 -1.00 115.31 121.33 3g6k h LEU 274 Ca -0.08 -0.12 0.06 0.00 0.84 0.00 0.00 57.88 58.57 3g6k h LEU 274 Cb 1.70 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 42.45 3g6k h LEU 274 CO 0.16 0.74 0.37 0.58 -0.34 0.00 0.00 178.44 179.95 3g6k h VAL 275 N 0.92 0.98 -0.58 1.05 2.07 -1.23 0.12 116.25 119.58 3g6k h VAL 275 Ca 0.23 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 3g6k h VAL 275 Cb 0.10 0.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.08 3g6k h VAL 275 CO -0.03 0.12 0.30 0.11 0.02 0.00 0.00 177.57 178.09 3g6k h LYS 276 N 0.68 0.82 -0.23 1.57 1.57 -1.10 -1.24 116.57 118.65 3g6k h LYS 276 Ca 0.29 -0.11 -0.17 0.00 -1.87 0.00 0.00 60.65 58.79 3g6k h LYS 276 Cb 0.17 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 3g6k h LYS 276 CO -0.17 0.65 -0.54 0.82 -0.57 0.00 0.00 179.45 179.63 3g6k h ILE 277 N 0.79 1.30 -0.47 1.86 2.04 -0.54 -2.94 117.51 119.55 3g6k h ILE 277 Ca 0.20 -1.76 -0.03 0.00 1.00 0.00 0.00 64.86 64.27 3g6k h ILE 277 Cb 0.08 1.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 3g6k h ILE 277 CO -0.03 0.56 0.19 -0.33 0.00 0.00 0.00 178.15 178.54 3g6k h GLU 278 N 0.53 0.67 0.00 2.37 5.08 -0.49 -2.74 114.58 120.00 3g6k h GLU 278 Ca 0.01 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3g6k h GLU 278 Cb 1.11 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.24 3g6k h GLU 278 CO 0.11 0.56 0.00 -0.91 -1.00 0.00 0.00 179.01 177.77 3g6k h ASN 279 N 0.67 0.00 0.67 1.42 2.35 -1.04 -2.62 115.58 117.02 3g6k h ASN 279 Ca 0.16 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.85 3g6k h ASN 279 Cb 0.14 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 3g6k h ASN 279 CO -0.02 0.00 -0.29 -0.07 -1.65 0.00 0.00 177.43 175.40 3g6k h LEU 280 N 0.00 0.00 0.71 1.61 3.38 -1.53 -3.47 115.31 116.02 3g6k h LEU 280 Ca 0.00 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.57 3g6k h LEU 280 Cb 0.28 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.05 3g6k h LEU 280 CO 0.00 0.29 -0.60 1.41 0.09 0.00 0.00 178.44 179.64 3g6k n HIS 281 N -3.62 -1.96 -3.87 1.13 8.25 -0.99 -4.97 115.22 109.19 3g6k n HIS 281 Ca -0.01 0.54 -0.10 0.00 -0.26 0.00 0.00 57.72 57.89 3g6k n HIS 281 Cb 0.42 -3.99 -0.09 0.00 1.12 0.00 0.00 29.99 27.45 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 -5.86 0.65 0.19 -0.41 0.41 -1.26 -5.17 118.70 107.26 3g6k s GLU 282 Ca 0.36 -0.64 0.09 0.00 -0.41 0.00 0.00 54.97 54.36 3g6k s GLU 282 Cb -0.17 0.27 -0.04 0.00 -1.78 0.00 0.00 34.13 32.40 3g6k s GLU 282 CO 0.44 -0.18 -0.08 0.34 -0.49 0.00 0.00 175.26 175.29 3g6k s ASP 283 N -2.05 4.32 0.02 -0.19 2.15 -1.26 -4.96 116.67 114.69 3g6k s ASP 283 Ca -0.06 -0.59 0.03 0.00 0.43 0.00 0.00 52.55 52.37 3g6k s ASP 283 Cb -0.01 -0.75 -0.02 0.00 -0.30 0.00 0.00 42.92 41.84 3g6k s ASP 283 CO -0.04 0.09 -0.10 -0.31 -0.17 0.00 0.00 175.17 174.64 3g6k s TYR 284 N -1.81 0.88 0.69 -5.34 2.02 -1.26 -0.49 117.35 112.04 3g6k s TYR 284 Ca 0.26 -0.28 -0.16 0.00 -0.37 0.00 0.00 57.07 56.52 3g6k s TYR 284 Cb -0.08 -0.54 0.02 0.00 -0.40 0.00 0.00 41.96 40.95 3g6k s TYR 284 CO 0.16 -0.01 1.22 0.71 -1.57 0.00 0.00 175.55 176.06 3g6k s TYR 285 N -0.66 2.14 0.89 2.71 2.02 0.11 -4.66 117.35 119.89 3g6k s TYR 285 Ca -0.00 1.56 -0.11 0.00 -0.37 0.00 0.00 57.07 58.15 3g6k s TYR 285 Cb -0.06 -3.50 0.13 0.00 -0.40 0.00 0.00 41.96 38.13 3g6k s TYR 285 CO 0.00 -2.55 1.10 -1.25 -1.57 0.00 0.00 175.55 171.28 3g6k s PRO 286 N -3.73 1.30 0.58 -1.71 0.04 -1.26 -3.74 135.00 126.48 3g6k s PRO 286 Ca 0.76 1.14 0.28 0.00 0.04 0.00 0.00 61.00 63.22 3g6k s PRO 286 Cb -0.30 -1.79 1.75 0.00 0.04 0.00 0.00 34.50 34.20 3g6k s PRO 286 CO 0.42 -2.30 2.24 0.78 0.04 0.00 0.00 177.00 178.18 3g6k h GLY 287 N -1.61 0.00 0.78 0.56 0.00 -0.97 -1.08 103.07 100.76 3g6k h GLY 287 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 3g6k h GLY 287 CO 0.49 0.00 0.00 -2.67 0.00 0.00 0.00 176.54 174.36 3g6k n TRP 288 N -3.92 0.00 1.36 5.60 2.14 -1.26 -1.02 117.44 120.35 3g6k n TRP 288 Ca -0.03 0.00 0.14 0.00 2.07 0.00 0.00 57.50 59.68 3g6k n TRP 288 Cb 0.09 0.00 0.65 0.00 -0.81 0.00 0.00 31.31 31.24 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 -0.89 0.00 -3.71 -2.67 4.02 -0.41 -4.69 117.16 108.81 3g6k n TYR 289 Ca 0.13 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.65 3g6k n TYR 289 Cb 0.06 -0.25 -0.11 0.00 -0.02 0.00 0.00 39.34 39.02 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 -2.58 3.85 0.00 7.72 2.96 -0.19 -4.91 118.68 125.53 3g6k s LEU 290 Ca 0.27 -0.03 0.00 0.00 -0.22 0.00 0.00 54.13 54.15 3g6k s LEU 290 Cb 0.20 -2.04 0.00 0.00 0.50 0.00 0.00 46.19 44.85 3g6k s LEU 290 CO 0.49 0.01 0.53 1.33 -1.32 0.00 0.00 176.35 177.39 3g6k n VAL 291 N 4.64 0.11 -2.81 1.68 0.24 -1.26 -4.78 118.33 116.15 3g6k n VAL 291 Ca -0.15 -0.53 -0.43 0.00 -2.04 0.00 0.00 64.34 61.19 3g6k n VAL 291 Cb 0.52 0.99 -0.04 0.00 -1.47 0.00 0.00 33.84 33.84 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 -0.11 6.26 0.39 -1.34 -1.08 -1.26 -4.42 116.67 115.12 3g6k s ASP 292 Ca 0.00 -0.57 0.12 0.00 -0.52 0.00 0.00 52.55 51.58 3g6k s ASP 292 Cb 0.00 -2.45 0.94 0.00 -1.46 0.00 0.00 42.92 39.95 3g6k s ASP 292 CO 0.00 -1.37 1.88 0.44 0.52 0.00 0.00 175.17 176.64 3g6k h ASP 293 N 9.48 0.53 0.66 -0.34 3.32 -2.00 -1.14 116.42 126.94 3g6k h ASP 293 Ca -0.27 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.81 3g6k h ASP 293 Cb 1.07 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.55 3g6k h ASP 293 CO 1.14 0.26 0.00 0.07 -1.72 0.00 0.00 179.24 178.99 3g6k h LYS 294 N 0.56 0.00 -0.30 3.56 2.10 -1.97 -2.47 116.57 118.05 3g6k h LYS 294 Ca 0.43 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.08 3g6k h LYS 294 Cb 0.84 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.17 3g6k h LYS 294 CO -0.18 0.00 0.00 1.28 -2.00 0.00 0.00 179.45 178.55 3g6k n LEU 295 N -2.37 3.36 -0.16 7.07 4.77 -0.43 -4.62 117.00 124.62 3g6k n LEU 295 Ca 0.01 -1.37 0.05 0.00 -0.03 0.00 0.00 56.01 54.66 3g6k n LEU 295 Cb 0.21 -0.19 0.33 0.00 -2.33 0.00 0.00 43.42 41.45 3g6k n LEU 295 CO 0.19 0.68 1.21 -0.08 -1.33 0.00 0.00 177.39 178.07 3g6k h GLU 296 N 4.55 0.77 -0.54 3.23 4.81 -1.48 -1.69 114.58 124.24 3g6k h GLU 296 Ca 0.00 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.11 3g6k h GLU 296 Cb 0.99 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 30.16 3g6k h GLU 296 CO 0.00 0.51 0.08 0.54 -0.73 0.00 0.00 179.01 179.41 3g6k n ARG 297 N -4.46 3.95 0.21 1.92 1.74 -1.26 -3.94 116.66 114.81 3g6k n ARG 297 Ca 0.09 -3.07 0.15 0.00 -0.77 0.00 0.00 57.85 54.24 3g6k n ARG 297 Cb 0.15 -2.13 0.65 0.00 -1.02 0.00 0.00 32.46 30.11 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 2.94 1.00 -0.99 7.54 0.00 -1.62 -3.36 119.26 124.78 3g6k h ALA 298 Ca 0.09 0.00 -0.73 0.00 0.00 0.00 0.00 54.91 54.27 3g6k h ALA 298 Cb 1.95 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 19.60 3g6k h ALA 298 CO 0.50 0.00 2.03 0.41 0.00 0.00 0.00 179.25 182.19 3g6k n GLY 299 N -0.29 3.95 2.99 0.00 0.00 -1.26 -4.64 105.19 105.94 3g6k n GLY 299 Ca 0.01 -1.89 -0.13 0.00 0.00 0.00 0.00 46.02 44.01 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 1.80 0.15 0.32 1.61 1.81 -1.26 -1.23 118.95 122.15 3g6k s ARG 300 Ca 0.44 0.38 -0.29 0.00 -1.72 0.00 0.00 55.73 54.54 3g6k s ARG 300 Cb 0.06 -0.09 -0.12 0.00 -0.45 0.00 0.00 34.95 34.35 3g6k s ARG 300 CO -0.00 -0.13 1.45 -0.89 -0.68 0.00 0.00 175.30 175.05 3g6k n ILE 301 N 3.88 1.53 -2.36 1.52 2.08 -0.03 -4.90 119.36 121.08 3g6k n ILE 301 Ca -0.22 -0.38 -0.42 0.00 0.56 0.00 0.00 62.75 62.28 3g6k n ILE 301 Cb 0.54 -1.77 -0.03 0.00 -0.75 0.00 0.00 39.64 37.63 3g6k n ILE 301 CO 0.00 0.00 0.00 -0.75 0.56 0.00 0.00 176.55 176.36 3g6k s LYS 302 N -1.27 4.40 0.29 0.38 2.20 -1.26 -5.01 119.74 119.47 3g6k s LYS 302 Ca 0.60 1.84 0.05 0.00 -0.36 0.00 0.00 55.97 58.10 3g6k s LYS 302 Cb -0.54 -3.33 -0.06 0.00 -1.51 0.00 0.00 37.83 32.40 3g6k s LYS 302 CO 0.56 -0.31 -0.01 0.15 -0.36 0.00 0.00 175.35 175.39 3g6k s LYS 303 N 1.09 1.58 0.00 4.03 -0.14 -1.26 -5.21 119.74 119.83 3g6k s LYS 303 Ca 0.60 -1.83 0.00 0.00 -1.36 0.00 0.00 55.97 53.38 3g6k s LYS 303 Cb -0.31 -1.02 0.00 0.00 -1.68 0.00 0.00 37.83 34.81 3g6k s LYS 303 CO 0.29 -0.05 0.00 1.63 -0.76 0.00 0.00 175.35 176.46