#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wte s ASN 2 N 0.00 5.11 0.21 7.83 6.03 -1.26 -4.91 114.94 127.94 1wte s ASN 2 Ca 0.00 0.10 -0.12 0.00 -1.03 0.00 0.00 52.86 51.81 1wte s ASN 2 Cb 0.00 -0.90 0.27 0.00 -3.03 0.00 0.00 41.25 37.59 1wte s ASN 2 CO 0.00 -1.30 1.66 0.50 -2.03 0.00 0.00 177.10 175.93 1wte h LYS 3 N -0.14 0.09 0.00 3.55 3.64 -2.00 -2.12 116.57 119.59 1wte h LYS 3 Ca -0.42 -0.01 -0.24 0.00 -1.27 0.00 0.00 60.65 58.71 1wte h LYS 3 Cb 1.30 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 33.11 1wte h LYS 3 CO 0.54 0.06 -0.98 1.96 -2.27 0.00 0.00 179.45 178.75 1wte h GLN 4 N 0.09 0.52 -0.55 1.90 1.08 -1.99 -1.93 115.11 114.23 1wte h GLN 4 Ca 0.31 -0.56 0.04 0.00 -1.45 0.00 0.00 58.65 56.98 1wte h GLN 4 Cb 0.49 0.16 -0.04 0.00 -0.05 0.00 0.00 27.48 28.04 1wte h GLN 4 CO -0.53 1.19 0.31 0.93 -0.95 0.00 0.00 178.83 179.78 1wte h GLU 5 N 0.29 0.58 -0.02 1.46 5.08 -1.89 -0.54 114.58 119.54 1wte h GLU 5 Ca -0.10 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 1wte h GLU 5 Cb 1.62 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.74 1wte h GLU 5 CO 0.18 0.38 -0.04 0.28 -1.00 0.00 0.00 179.01 178.81 1wte h VAL 6 N 0.60 1.43 0.28 3.13 2.07 -1.31 -1.50 116.25 120.95 1wte h VAL 6 Ca 0.23 -1.32 0.00 0.00 0.82 0.00 0.00 66.70 66.43 1wte h VAL 6 Cb 0.08 2.26 -0.02 0.00 -1.52 0.00 0.00 31.29 32.09 1wte h VAL 6 CO -0.13 0.35 -0.27 0.40 0.02 0.00 0.00 177.57 177.95 1wte h ILE 7 N -0.45 0.44 -0.32 4.57 2.04 -1.26 0.68 117.51 123.20 1wte h ILE 7 Ca 0.00 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.81 1wte h ILE 7 Cb 0.59 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 1wte h ILE 7 CO 0.01 0.00 -0.01 -0.07 0.00 0.00 0.00 178.15 178.08 1wte h LEU 8 N -0.57 0.57 -0.73 1.44 3.38 -1.17 -0.25 115.31 117.96 1wte h LEU 8 Ca -0.01 -0.32 -0.14 0.00 0.09 0.00 0.00 57.88 57.50 1wte h LEU 8 Cb 0.52 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1wte h LEU 8 CO -0.05 0.75 -0.56 0.11 0.09 0.00 0.00 178.44 178.78 1wte h LYS 9 N 0.37 0.21 -0.37 1.13 1.57 -1.16 -2.04 116.57 116.27 1wte h LYS 9 Ca 0.09 -0.13 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 1wte h LYS 9 Cb 0.47 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 1wte h LYS 9 CO 0.02 0.71 0.13 0.28 -0.57 0.00 0.00 179.45 180.02 1wte h VAL 10 N 0.16 1.20 -0.76 0.50 2.07 -0.78 -2.54 116.25 116.10 1wte h VAL 10 Ca -0.00 -0.63 0.12 0.00 0.82 0.00 0.00 66.70 67.00 1wte h VAL 10 Cb 1.04 0.93 -0.08 0.00 -1.52 0.00 0.00 31.29 31.66 1wte h VAL 10 CO 0.09 0.22 0.36 -0.61 0.02 0.00 0.00 177.57 177.65 1wte h GLN 11 N 0.44 0.55 -0.73 1.57 4.15 -0.70 -0.40 115.11 119.99 1wte h GLN 11 Ca 0.12 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.47 1wte h GLN 11 Cb 0.22 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.75 1wte h GLN 11 CO -0.01 0.36 0.33 0.93 -1.93 0.00 0.00 178.83 178.52 1wte h GLU 12 N 0.57 1.07 -0.36 1.69 5.08 -1.11 -0.75 114.58 120.76 1wte h GLU 12 Ca 0.40 -0.17 -0.03 0.00 -1.00 0.00 0.00 59.36 58.55 1wte h GLU 12 Cb 0.51 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1wte h GLU 12 CO -0.33 0.86 0.11 0.00 -1.00 0.00 0.00 179.01 178.65 1wte h ALA 14 N 0.96 1.10 -0.36 0.00 0.00 -0.95 -1.10 119.26 118.90 1wte h ALA 14 Ca 0.12 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 1wte h ALA 14 Cb 0.25 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1wte h ALA 14 CO -0.00 0.59 0.01 0.00 0.00 0.00 0.00 179.25 179.84 1wte h ALA 15 N 1.36 0.49 -0.44 0.00 0.00 -0.94 -0.16 119.26 119.58 1wte h ALA 15 Ca 0.02 -0.24 0.07 0.00 0.00 0.00 0.00 54.91 54.76 1wte h ALA 15 Cb 0.80 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.40 1wte h ALA 15 CO 0.06 0.24 0.09 2.35 0.00 0.00 0.00 179.25 182.00 1wte h TRP 16 N 0.45 0.15 -0.43 0.00 7.01 -1.03 -2.80 115.95 119.31 1wte h TRP 16 Ca 0.10 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.10 1wte h TRP 16 Cb 0.44 -0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 27.48 1wte h TRP 16 CO 0.03 0.02 0.15 2.35 -2.79 0.00 0.00 178.44 178.20 1wte h TRP 17 N 0.23 0.67 -0.64 2.65 7.01 -0.81 -2.14 115.95 122.92 1wte h TRP 17 Ca 0.21 -0.06 0.13 0.00 2.11 0.00 0.00 58.89 61.28 1wte h TRP 17 Cb 0.26 -0.20 -0.10 0.00 -2.10 0.00 0.00 29.16 27.03 1wte h TRP 17 CO -0.20 0.60 0.10 0.82 -2.79 0.00 0.00 178.44 176.96 1wte h ILE 18 N 0.55 0.56 -0.65 2.65 2.04 -0.92 -0.58 117.51 121.15 1wte h ILE 18 Ca 0.14 -0.07 -0.02 0.00 1.00 0.00 0.00 64.86 65.90 1wte h ILE 18 Cb 0.23 0.32 -0.03 0.00 -0.74 0.00 0.00 36.82 36.60 1wte h ILE 18 CO -0.01 0.04 0.30 -0.07 0.00 0.00 0.00 178.15 178.42 1wte h LEU 19 N 0.21 0.83 0.08 1.44 3.38 -1.20 -0.19 115.31 119.85 1wte h LEU 19 Ca 0.34 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 1wte h LEU 19 Cb 0.55 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1wte h LEU 19 CO -0.47 0.71 -0.04 -0.33 0.09 0.00 0.00 178.44 178.39 1wte h GLU 20 N 0.91 -0.11 0.00 1.13 4.39 -0.50 -1.30 114.58 119.10 1wte h GLU 20 Ca 0.22 0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.88 1wte h GLU 20 Cb 0.10 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 1wte h GLU 20 CO -0.03 -0.07 -0.26 0.00 -1.16 0.00 0.00 179.01 177.49 1wte h ARG 21 N -0.11 0.00 -0.49 2.33 2.47 -0.95 -2.40 114.38 115.23 1wte h ARG 21 Ca -0.01 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.64 1wte h ARG 21 Cb 0.09 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.39 1wte h ARG 21 CO 0.01 0.26 0.03 1.96 0.56 0.00 0.00 179.97 182.79 1wte h GLN 22 N 0.00 0.84 0.00 0.04 1.08 -0.92 -3.12 115.11 113.03 1wte h GLN 22 Ca -0.00 -0.25 -0.00 0.00 -1.45 0.00 0.00 58.65 56.94 1wte h GLN 22 Cb 0.48 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 27.83 1wte h GLN 22 CO 0.03 0.87 -0.01 0.66 -0.95 0.00 0.00 178.83 179.43 1wte h SER 23 N 0.70 0.00 -0.71 1.46 4.64 -0.75 -0.82 113.55 118.08 1wte h SER 23 Ca 0.14 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.53 1wte h SER 23 Cb 0.47 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.49 1wte h SER 23 CO 0.02 0.01 0.38 0.50 -0.87 0.00 0.00 176.83 176.87 1wte h LYS 24 N 0.00 0.66 0.18 4.77 1.63 -1.41 -0.43 116.57 121.98 1wte h LYS 24 Ca -0.00 -0.04 -0.31 0.00 -0.85 0.00 0.00 60.65 59.45 1wte h LYS 24 Cb 0.54 -0.15 0.03 0.00 -0.60 0.00 0.00 32.23 32.06 1wte h LYS 24 CO 0.00 0.44 -1.36 -0.07 -3.45 0.00 0.00 179.45 175.02 1wte h LEU 25 N 0.68 0.82 -0.14 5.20 3.38 -1.25 -2.05 115.31 121.95 1wte h LEU 25 Ca 0.33 -0.82 -0.18 0.00 0.09 0.00 0.00 57.88 57.30 1wte h LEU 25 Cb 0.26 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1wte h LEU 25 CO -0.21 1.63 -0.87 0.71 0.09 0.00 0.00 178.44 179.78 1wte h THR 26 N 0.20 1.57 -0.09 0.22 1.35 -1.34 -3.02 112.91 111.80 1wte h THR 26 Ca -0.21 -3.06 0.00 0.00 -0.55 0.00 0.00 66.41 62.59 1wte h THR 26 Cb 2.04 2.68 0.00 0.00 -1.73 0.00 0.00 68.15 71.14 1wte h THR 26 CO 0.25 0.86 0.00 0.29 -0.25 0.00 0.00 175.52 176.67 1wte n LYS 27 N -3.41 1.77 -3.73 4.72 5.02 -0.18 -4.97 118.16 117.38 1wte n LYS 27 Ca 0.00 -1.14 -0.25 0.00 -2.02 0.00 0.00 58.31 54.90 1wte n LYS 27 Cb 0.86 -1.45 0.02 0.00 -0.02 0.00 0.00 35.03 34.44 1wte n LYS 27 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1wte n LEU 28 N 0.37 -2.95 -4.44 -0.35 4.77 -1.14 -4.89 117.00 108.37 1wte n LEU 28 Ca 0.18 -0.92 -0.44 0.00 -0.03 0.00 0.00 56.01 54.80 1wte n LEU 28 Cb 0.38 -2.51 -0.03 0.00 -2.33 0.00 0.00 43.42 38.93 1wte n LEU 28 CO 0.15 0.41 0.82 -0.04 -1.33 0.00 0.00 177.39 177.40 1wte s MET 29 N -6.03 3.33 0.00 3.23 -1.94 -0.78 -4.77 119.30 112.33 1wte s MET 29 Ca 0.16 -1.33 0.00 0.00 -1.71 0.00 0.00 55.69 52.81 1wte s MET 29 Cb -0.05 -4.56 0.00 0.00 2.01 0.00 0.00 34.83 32.23 1wte s MET 29 CO 0.84 -1.76 0.54 -1.13 -0.01 0.00 0.00 175.02 173.50 1wte n SER 30 N 6.98 1.06 0.16 3.03 3.41 -1.26 -4.76 113.62 122.25 1wte n SER 30 Ca 0.08 -1.14 0.12 0.00 -0.26 0.00 0.00 58.87 57.67 1wte n SER 30 Cb 0.47 0.00 0.57 0.00 -0.26 0.00 0.00 64.21 64.99 1wte n SER 30 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1wte h GLU 31 N 0.00 0.00 -0.01 4.33 4.39 -2.01 -2.37 114.58 118.90 1wte h GLU 31 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1wte h GLU 31 Cb 0.12 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 1wte h GLU 31 CO 0.00 0.00 -0.02 0.25 -1.16 0.00 0.00 179.01 178.08 1wte n THR 32 N -2.33 0.00 -2.90 1.13 -2.24 -1.26 -4.86 114.28 101.82 1wte n THR 32 Ca 0.00 -0.20 -0.43 0.00 -2.27 0.00 0.00 64.05 61.15 1wte n THR 32 Cb 0.15 0.35 -0.05 0.00 -2.10 0.00 0.00 70.33 68.69 1wte n THR 32 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1wte s MET 33 N -2.05 3.34 0.49 -0.78 0.00 -0.89 -5.04 119.30 114.35 1wte s MET 33 Ca 0.38 -0.27 -0.12 0.00 0.00 0.00 0.00 55.69 55.67 1wte s MET 33 Cb 0.21 -4.03 -0.06 0.00 0.00 0.00 0.00 34.83 30.95 1wte s MET 33 CO 0.36 -1.36 0.89 -1.54 0.00 0.00 0.00 175.02 173.37 1wte s SER 34 N 2.64 6.49 -0.05 1.11 1.04 -1.26 -5.07 113.70 118.59 1wte s SER 34 Ca 0.29 1.31 0.01 0.00 0.48 0.00 0.00 55.95 58.04 1wte s SER 34 Cb -0.13 -2.41 0.02 0.00 0.10 0.00 0.00 66.02 63.61 1wte s SER 34 CO 0.20 -0.56 -0.05 -0.63 0.98 0.00 0.00 173.24 173.18 1wte s ILE 35 N -2.63 0.60 -0.54 -1.02 1.01 -1.26 -5.06 121.20 112.30 1wte s ILE 35 Ca 0.54 -0.14 -0.21 0.00 0.00 0.00 0.00 60.65 60.83 1wte s ILE 35 Cb -0.10 -0.63 0.06 0.00 0.01 0.00 0.00 42.46 41.80 1wte s ILE 35 CO 0.36 0.25 0.78 0.21 0.00 0.00 0.00 174.94 176.54 1wte s ASN 36 N 1.01 6.26 0.00 3.58 3.84 -1.26 -4.95 114.94 123.42 1wte s ASN 36 Ca -0.09 -0.74 0.20 0.00 0.21 0.00 0.00 52.86 52.44 1wte s ASN 36 Cb -0.14 -2.36 0.88 0.00 -0.55 0.00 0.00 41.25 39.07 1wte s ASN 36 CO -0.00 -1.09 1.66 -0.81 -2.79 0.00 0.00 177.10 174.06 1wte n PRO 37 N 6.83 0.00 0.11 0.43 -0.04 -1.26 -2.29 135.00 138.78 1wte n PRO 37 Ca -0.03 0.15 0.06 0.00 -0.04 0.00 0.00 63.50 63.63 1wte n PRO 37 Cb 0.46 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.43 1wte n PRO 37 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1wte h PHE 38 N 0.00 0.00 0.00 0.54 -1.00 -1.96 -3.35 116.94 111.18 1wte h PHE 38 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1wte h PHE 38 Cb 0.35 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.91 1wte h PHE 38 CO 0.00 0.31 -0.82 0.52 -1.61 0.00 0.00 178.31 176.71 1wte h MET 39 N 0.00 0.00 -0.62 1.51 2.86 -1.89 -3.41 114.93 113.39 1wte h MET 39 Ca -0.05 0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.67 1wte h MET 39 Cb 1.28 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.88 1wte h MET 39 CO 0.03 0.00 0.27 1.79 1.06 0.00 0.00 176.91 180.06 1wte h THR 40 N 0.00 0.83 -0.32 2.22 1.35 -1.69 -1.52 112.91 113.79 1wte h THR 40 Ca 0.00 -0.17 -0.05 0.00 -0.55 0.00 0.00 66.41 65.64 1wte h THR 40 Cb 0.83 0.31 -0.02 0.00 -1.73 0.00 0.00 68.15 67.54 1wte h THR 40 CO 0.00 0.09 -0.03 1.55 -0.25 0.00 0.00 175.52 176.88 1wte h PRO 41 N 0.48 0.50 0.18 4.72 0.13 -1.85 -2.17 132.00 134.00 1wte h PRO 41 Ca 0.30 -0.11 -0.01 0.00 -0.87 0.00 0.00 66.00 65.31 1wte h PRO 41 Cb 0.32 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.38 1wte h PRO 41 CO -0.26 0.55 -0.09 0.35 -0.23 0.00 0.00 178.00 178.32 1wte h PHE 42 N 0.48 -0.23 -0.39 1.56 3.57 -1.65 -2.99 116.94 117.28 1wte h PHE 42 Ca 0.10 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.65 1wte h PHE 42 Cb 0.36 0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.13 1wte h PHE 42 CO 0.01 0.01 0.13 0.82 -2.23 0.00 0.00 178.31 177.05 1wte h ILE 43 N -0.44 0.86 -0.70 1.41 1.08 -1.24 -0.36 117.51 118.12 1wte h ILE 43 Ca -0.03 -0.10 0.15 0.00 -0.39 0.00 0.00 64.86 64.50 1wte h ILE 43 Cb 0.34 0.56 -0.11 0.00 -3.07 0.00 0.00 36.82 34.54 1wte h ILE 43 CO 0.04 0.05 0.14 0.15 -0.69 0.00 0.00 178.15 177.85 1wte h PHE 44 N 0.28 0.22 0.06 1.37 3.57 -1.41 -1.91 116.94 119.11 1wte h PHE 44 Ca 0.18 0.04 -0.23 0.00 3.53 0.00 0.00 57.97 61.50 1wte h PHE 44 Cb 0.18 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 1wte h PHE 44 CO -0.16 -0.09 -1.21 -0.44 -2.23 0.00 0.00 178.31 174.18 1wte h ASP 45 N 0.25 0.19 -0.89 0.41 5.19 -1.31 0.29 116.42 120.55 1wte h ASP 45 Ca 0.39 -0.75 0.20 0.00 -0.62 0.00 0.00 57.03 56.24 1wte h ASP 45 Cb 0.65 -0.06 -0.11 0.00 0.18 0.00 0.00 39.33 39.98 1wte h ASP 45 CO -0.50 1.51 0.42 0.22 -3.12 0.00 0.00 179.24 177.77 1wte h TYR 46 N -0.63 0.71 -0.57 4.55 3.20 -1.10 -2.03 116.97 121.10 1wte h TYR 46 Ca -0.29 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.62 1wte h TYR 46 Cb 1.51 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.60 1wte h TYR 46 CO 0.13 0.04 0.00 0.72 -1.64 0.00 0.00 178.16 177.41 1wte n HIS 47 N -4.97 1.06 -3.72 -3.82 8.25 -0.72 -4.99 115.22 106.30 1wte n HIS 47 Ca 0.21 -0.58 -0.24 0.00 -0.26 0.00 0.00 57.72 56.85 1wte n HIS 47 Cb 0.58 -0.13 0.03 0.00 1.12 0.00 0.00 29.99 31.59 1wte n HIS 47 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1wte n SER 48 N 0.98 -2.20 -4.88 0.41 7.64 -0.77 -4.97 113.62 109.82 1wte n SER 48 Ca 0.22 -0.90 -0.31 0.00 1.01 0.00 0.00 58.87 58.89 1wte n SER 48 Cb 0.71 -3.76 -0.05 0.00 -1.01 0.00 0.00 64.21 60.10 1wte n SER 48 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1wte s LEU 49 N -6.61 4.15 -0.05 -3.43 1.43 0.07 -5.03 118.68 109.20 1wte s LEU 49 Ca 0.13 0.84 0.15 0.00 -1.03 0.00 0.00 54.13 54.22 1wte s LEU 49 Cb -0.04 -3.61 -0.23 0.00 0.03 0.00 0.00 46.19 42.34 1wte s LEU 49 CO 0.83 -0.09 0.28 0.59 0.23 0.00 0.00 176.35 178.19 1wte n ASN 50 N -0.32 1.46 -2.20 2.29 3.02 -1.26 -4.82 115.26 113.42 1wte n ASN 50 Ca -0.00 0.00 -0.07 0.00 -0.03 0.00 0.00 54.58 54.48 1wte n ASN 50 Cb 0.53 1.52 0.01 0.00 -0.61 0.00 0.00 39.78 41.23 1wte n ASN 50 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1wte n ASP 51 N -2.15 -1.40 -0.30 6.41 3.85 -1.26 -4.80 116.55 116.90 1wte n ASP 51 Ca -0.07 -2.09 -0.05 0.00 -0.71 0.00 0.00 54.79 51.87 1wte n ASP 51 Cb 0.53 2.36 0.07 0.00 -1.35 0.00 0.00 41.12 42.73 1wte n ASP 51 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.20 176.34 1wte h PHE 52 N 1.65 1.20 -0.74 2.11 3.57 -1.35 -2.49 116.94 120.90 1wte h PHE 52 Ca -0.21 -0.07 -0.01 0.00 3.53 0.00 0.00 57.97 61.21 1wte h PHE 52 Cb 0.81 -0.37 -0.04 0.00 2.79 0.00 0.00 35.95 39.15 1wte h PHE 52 CO 0.00 0.89 0.44 -0.44 -2.23 0.00 0.00 178.31 176.97 1wte h ASP 53 N 1.17 0.89 0.36 0.41 3.32 -1.97 0.63 116.42 121.23 1wte h ASP 53 Ca 0.28 -0.05 -0.11 0.00 0.02 0.00 0.00 57.03 57.16 1wte h ASP 53 Cb 0.17 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 1wte h ASP 53 CO -0.03 0.69 -0.48 -0.33 -1.72 0.00 0.00 179.24 177.37 1wte h GLU 54 N 1.02 0.14 -0.05 3.56 5.08 -1.87 0.02 114.58 122.47 1wte h GLU 54 Ca 0.27 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1wte h GLU 54 Cb -0.03 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 1wte h GLU 54 CO -0.05 0.59 -0.02 1.25 -1.00 0.00 0.00 179.01 179.79 1wte h LEU 55 N 0.11 0.11 -0.66 1.33 5.85 -0.91 -2.22 115.31 118.92 1wte h LEU 55 Ca 0.00 -0.38 0.03 0.00 0.84 0.00 0.00 57.88 58.37 1wte h LEU 55 Cb 0.89 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.85 1wte h LEU 55 CO 0.07 0.47 0.41 0.58 -0.34 0.00 0.00 178.44 179.62 1wte h VAL 56 N -0.25 1.08 -0.94 1.05 2.07 -0.74 -1.60 116.25 116.92 1wte h VAL 56 Ca 0.01 -0.27 0.09 0.00 0.82 0.00 0.00 66.70 67.35 1wte h VAL 56 Cb 0.42 0.21 -0.07 0.00 -1.52 0.00 0.00 31.29 30.33 1wte h VAL 56 CO 0.01 0.15 0.60 -0.08 0.02 0.00 0.00 177.57 178.26 1wte h GLU 57 N 0.80 0.95 -0.18 1.57 4.81 -0.94 -0.18 114.58 121.41 1wte h GLU 57 Ca 0.27 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.35 1wte h GLU 57 Cb 0.03 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.19 1wte h GLU 57 CO -0.11 0.63 -0.25 0.00 -0.73 0.00 0.00 179.01 178.54 1wte h ALA 58 N 1.53 0.27 -0.31 2.92 0.00 -0.72 -1.74 119.26 121.21 1wte h ALA 58 Ca 0.43 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1wte h ALA 58 Cb 0.36 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1wte h ALA 58 CO -0.19 0.25 0.01 0.82 0.00 0.00 0.00 179.25 180.14 1wte h ILE 59 N 0.13 1.25 -0.73 0.00 2.04 -1.04 -2.45 117.51 116.72 1wte h ILE 59 Ca 0.02 -0.92 0.03 0.00 1.00 0.00 0.00 64.86 65.00 1wte h ILE 59 Cb 0.83 1.25 -0.05 0.00 -0.74 0.00 0.00 36.82 38.11 1wte h ILE 59 CO 0.06 0.30 0.45 0.40 0.00 0.00 0.00 178.15 179.36 1wte h ILE 60 N 0.34 1.09 -0.64 -0.67 2.04 -1.06 0.16 117.51 118.77 1wte h ILE 60 Ca 0.09 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.62 1wte h ILE 60 Cb 0.42 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.60 1wte h ILE 60 CO 0.01 0.16 0.28 0.00 0.00 0.00 0.00 178.15 178.60 1wte h ALA 61 N 1.32 0.83 -0.45 1.87 0.00 -1.18 -0.07 119.26 121.58 1wte h ALA 61 Ca 0.30 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1wte h ALA 61 Cb 0.04 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1wte h ALA 61 CO -0.12 0.42 0.23 -0.22 0.00 0.00 0.00 179.25 179.56 1wte h LYS 62 N 0.89 0.64 -0.63 0.00 3.64 -1.13 -2.19 116.57 117.79 1wte h LYS 62 Ca 0.22 -0.09 -0.05 0.00 -1.27 0.00 0.00 60.65 59.46 1wte h LYS 62 Cb 0.17 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 1wte h LYS 62 CO -0.02 0.53 0.20 1.25 -2.27 0.00 0.00 179.45 179.14 1wte h HIS 63 N 0.59 0.98 -0.40 1.91 2.76 -0.60 -0.95 115.15 119.44 1wte h HIS 63 Ca 0.16 -0.08 -0.03 0.00 -2.20 0.00 0.00 60.37 58.21 1wte h HIS 63 Cb 0.09 -0.29 -0.02 0.00 1.55 0.00 0.00 27.41 28.74 1wte h HIS 63 CO -0.01 0.78 0.12 -0.07 -1.30 0.00 0.00 177.93 177.45 1wte h LEU 64 N 0.93 0.59 -0.21 0.26 3.38 -0.91 -0.39 115.31 118.95 1wte h LEU 64 Ca 0.21 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1wte h LEU 64 Cb 0.26 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1wte h LEU 64 CO -0.01 0.64 0.10 0.24 0.09 0.00 0.00 178.44 179.50 1wte h MET 65 N 0.50 0.30 -0.48 1.13 2.86 -1.18 0.49 114.93 118.55 1wte h MET 65 Ca 0.13 -0.05 0.09 0.00 -2.06 0.00 0.00 59.70 57.81 1wte h MET 65 Cb 0.27 -0.05 -0.08 0.00 0.06 0.00 0.00 31.60 31.80 1wte h MET 65 CO -0.00 0.33 0.02 1.15 1.06 0.00 0.00 176.91 179.46 1wte h THR 66 N 0.20 0.64 -0.93 2.22 2.02 -1.12 -2.07 112.91 113.88 1wte h THR 66 Ca 0.07 -0.05 0.03 0.00 0.77 0.00 0.00 66.41 67.23 1wte h THR 66 Cb 0.13 0.50 -0.05 0.00 -1.74 0.00 0.00 68.15 66.98 1wte h THR 66 CO -0.01 0.02 0.61 1.23 0.37 0.00 0.00 175.52 177.75 1wte h GLY 67 N 0.13 1.33 0.83 2.16 0.00 -0.85 -1.06 103.07 105.61 1wte h GLY 67 Ca 0.24 -0.47 0.01 0.00 0.00 0.00 0.00 47.33 47.11 1wte h GLY 67 CO -0.39 0.43 -0.13 0.45 0.00 0.00 0.00 176.54 176.90 1wte h HIS 68 N 1.20 -0.33 -0.54 5.60 3.86 -0.65 -0.16 115.15 124.13 1wte h HIS 68 Ca 0.36 0.00 0.04 0.00 -1.16 0.00 0.00 60.37 59.61 1wte h HIS 68 Cb -0.04 0.13 -0.04 0.00 1.06 0.00 0.00 27.41 28.52 1wte h HIS 68 CO -0.00 -0.20 0.30 -0.44 0.86 0.00 0.00 177.93 178.45 1wte h ASP 69 N -0.28 0.45 0.42 2.45 3.32 -1.21 -0.09 116.42 121.48 1wte h ASP 69 Ca 0.01 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 1wte h ASP 69 Cb 0.27 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.75 1wte h ASP 69 CO -0.04 0.31 -0.20 0.74 -1.72 0.00 0.00 179.24 178.33 1wte h THR 70 N 0.58 0.58 -0.87 0.35 2.02 -1.15 -2.23 112.91 112.18 1wte h THR 70 Ca 0.23 -0.25 0.11 0.00 0.77 0.00 0.00 66.41 67.27 1wte h THR 70 Cb 0.09 0.70 -0.08 0.00 -1.74 0.00 0.00 68.15 67.12 1wte h THR 70 CO -0.13 0.05 0.51 1.23 0.37 0.00 0.00 175.52 177.54 1wte h GLY 71 N -0.71 1.38 1.37 2.16 0.00 -0.93 -2.25 103.07 104.10 1wte h GLY 71 Ca -0.06 -0.34 -0.15 0.00 0.00 0.00 0.00 47.33 46.79 1wte h GLY 71 CO 0.09 0.12 -0.43 -2.75 0.00 0.00 0.00 176.54 173.58 1wte h PHE 72 N 0.83 0.83 -0.41 5.60 3.57 -0.89 -0.21 116.94 126.26 1wte h PHE 72 Ca 0.43 -0.25 -0.03 0.00 3.53 0.00 0.00 57.97 61.65 1wte h PHE 72 Cb 0.42 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.97 1wte h PHE 72 CO -0.05 0.99 0.15 0.78 -2.23 0.00 0.00 178.31 177.95 1wte h GLY 73 N 0.96 0.67 1.51 2.40 0.00 -1.14 -0.67 103.07 106.80 1wte h GLY 73 Ca 0.04 -0.38 -0.05 0.00 0.00 0.00 0.00 47.33 46.94 1wte h GLY 73 CO 0.09 0.36 0.03 0.50 0.00 0.00 0.00 176.54 177.52 1wte h LYS 74 N 0.52 0.62 -0.05 4.80 1.57 -1.18 -2.43 116.57 120.41 1wte h LYS 74 Ca 0.13 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1wte h LYS 74 Cb 0.23 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.44 1wte h LYS 74 CO -0.01 0.61 0.02 1.25 -0.57 0.00 0.00 179.45 180.76 1wte h LEU 75 N 0.59 0.06 -0.31 2.94 5.85 -0.50 0.45 115.31 124.39 1wte h LEU 75 Ca 0.13 -0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.75 1wte h LEU 75 Cb 0.33 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 1wte h LEU 75 CO 0.01 0.18 0.08 0.40 -0.34 0.00 0.00 178.44 178.77 1wte h ILE 76 N -0.06 0.87 0.27 4.05 1.08 -1.04 -1.02 117.51 121.66 1wte h ILE 76 Ca 0.02 -0.07 -0.01 0.00 -0.39 0.00 0.00 64.86 64.40 1wte h ILE 76 Cb 0.14 0.66 0.00 0.00 -3.07 0.00 0.00 36.82 34.55 1wte h ILE 76 CO -0.00 0.04 -0.13 -0.78 -0.69 0.00 0.00 178.15 176.59 1wte h ASP 77 N 0.20 -0.30 0.98 1.72 -0.00 -1.38 -0.98 116.42 116.66 1wte h ASP 77 Ca 0.14 -0.22 -0.17 0.00 -0.00 0.00 0.00 57.03 56.78 1wte h ASP 77 Cb 0.14 0.08 -0.03 0.00 -0.00 0.00 0.00 39.33 39.52 1wte h ASP 77 CO -0.17 0.17 -1.09 -0.33 -0.00 0.00 0.00 179.24 177.81 1wte h GLU 78 N -0.89 0.00 0.00 0.28 5.08 -0.96 -3.38 114.58 114.70 1wte h GLU 78 Ca -0.04 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1wte h GLU 78 Cb 0.51 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1wte h GLU 78 CO 0.06 0.49 -0.77 1.63 -1.00 0.00 0.00 179.01 179.42 1wte n LYS 79 N -3.09 0.07 0.06 2.33 4.01 -0.77 -4.67 118.16 116.11 1wte n LYS 79 Ca -0.05 0.03 -0.13 0.00 -0.51 0.00 0.00 58.31 57.65 1wte n LYS 79 Cb 0.85 -0.61 -0.09 0.00 -0.51 0.00 0.00 35.03 34.67 1wte n LYS 79 CO 0.00 0.00 0.00 0.82 -1.11 0.00 0.00 177.40 177.11 1wte h ILE 80 N -0.12 1.03 0.00 -0.18 2.04 -1.21 0.20 117.51 119.27 1wte h ILE 80 Ca -0.05 -0.82 0.02 0.00 1.00 0.00 0.00 64.86 65.01 1wte h ILE 80 Cb 0.70 1.53 -0.03 0.00 -0.74 0.00 0.00 36.82 38.28 1wte h ILE 80 CO -0.03 0.19 -0.14 -0.07 0.00 0.00 0.00 178.15 178.10 1wte h LEU 81 N -0.59 -0.41 -0.26 1.44 4.07 -1.35 0.20 115.31 118.41 1wte h LEU 81 Ca -0.02 0.06 -0.10 0.00 0.08 0.00 0.00 57.88 57.90 1wte h LEU 81 Cb 0.45 0.17 -0.00 0.00 1.08 0.00 0.00 40.66 42.36 1wte h LEU 81 CO 0.03 -0.20 -0.24 -0.65 -1.08 0.00 0.00 178.44 176.30 1wte h PRO 82 N -0.24 0.62 -0.03 1.13 0.11 -1.69 -1.75 132.00 130.15 1wte h PRO 82 Ca 0.05 -0.32 -0.19 0.00 0.11 0.00 0.00 66.00 65.65 1wte h PRO 82 Cb 0.30 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.41 1wte h PRO 82 CO -0.14 0.92 -0.79 0.00 -0.21 0.00 0.00 178.00 177.78 1wte h ARG 83 N 0.34 0.27 0.03 1.05 3.08 -0.84 -2.68 114.38 115.63 1wte h ARG 83 Ca 0.04 -0.25 -0.38 0.00 0.07 0.00 0.00 59.98 59.46 1wte h ARG 83 Cb 0.80 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.86 1wte h ARG 83 CO 0.06 0.93 -2.16 0.28 -1.07 0.00 0.00 179.97 178.01 1wte n VAL 84 N -3.76 1.58 0.65 2.04 0.31 0.69 -4.63 118.33 115.21 1wte n VAL 84 Ca -0.04 -0.44 0.08 0.00 -0.01 0.00 0.00 64.34 63.93 1wte n VAL 84 Cb 0.74 -1.74 0.07 0.00 -0.91 0.00 0.00 33.84 32.01 1wte n VAL 84 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1wte n PHE 85 N -3.80 0.01 -1.06 3.52 3.72 -0.70 -4.90 117.46 114.25 1wte n PHE 85 Ca -0.42 -0.01 -0.02 0.00 -0.05 0.00 0.00 57.45 56.94 1wte n PHE 85 Cb 0.92 -0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.45 1wte n PHE 85 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wte n GLY 86 N 0.91 0.54 3.77 1.37 0.00 -0.98 -4.97 105.19 105.83 1wte n GLY 86 Ca 0.10 -0.34 -0.40 0.00 0.00 0.00 0.00 46.02 45.38 1wte n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wte s ALA 87 N -1.93 3.40 -0.47 4.61 0.00 -0.99 -4.84 121.76 121.55 1wte s ALA 87 Ca 0.00 1.14 -0.25 0.00 0.00 0.00 0.00 51.96 52.85 1wte s ALA 87 Cb 0.00 -3.43 0.03 0.00 0.00 0.00 0.00 23.12 19.71 1wte s ALA 87 CO 0.00 -0.55 0.90 0.71 0.00 0.00 0.00 175.76 176.82 1wte s TYR 88 N -1.20 2.92 -0.02 0.00 1.51 -0.36 -3.97 117.35 116.23 1wte s TYR 88 Ca 0.50 0.30 -0.30 0.00 -1.01 0.00 0.00 57.07 56.56 1wte s TYR 88 Cb -0.37 -3.93 -0.05 0.00 -0.11 0.00 0.00 41.96 37.51 1wte s TYR 88 CO 0.48 -1.11 1.40 0.21 -1.11 0.00 0.00 175.55 175.42 1wte s LYS 89 N 3.69 4.27 -1.21 -0.62 2.47 -1.26 -1.10 119.74 125.98 1wte s LYS 89 Ca 0.35 1.95 -0.17 0.00 -1.56 0.00 0.00 55.97 56.53 1wte s LYS 89 Cb -0.11 -3.61 -0.02 0.00 -1.46 0.00 0.00 37.83 32.63 1wte s LYS 89 CO 0.25 -0.60 2.06 1.28 0.16 0.00 0.00 175.35 178.50 1wte n LEU 90 N 5.57 5.54 0.00 5.43 4.32 -0.39 -4.70 117.00 132.77 1wte n LEU 90 Ca 0.13 -3.67 -0.21 0.00 -0.02 0.00 0.00 56.01 52.24 1wte n LEU 90 Cb 0.44 -1.51 0.12 0.00 -1.62 0.00 0.00 43.42 40.84 1wte n LEU 90 CO 0.58 0.35 0.54 -0.90 -1.22 0.00 0.00 177.39 176.75 1wte n ASP 91 N 7.35 0.89 -0.23 -1.43 5.68 -1.26 -4.82 116.55 122.73 1wte n ASP 91 Ca 0.50 -1.83 -0.02 0.00 -0.50 0.00 0.00 54.79 52.94 1wte n ASP 91 Cb 0.41 -0.62 0.09 0.00 -1.14 0.00 0.00 41.12 39.86 1wte n ASP 91 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 1wte h LYS 92 N 0.00 0.67 -0.25 0.11 3.64 -2.00 -1.40 116.57 117.35 1wte h LYS 92 Ca -0.30 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 58.97 1wte h LYS 92 Cb 1.03 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.69 1wte h LYS 92 CO 0.29 0.45 -0.11 0.77 -2.27 0.00 0.00 179.45 178.58 1wte h SER 93 N 0.69 0.53 -0.58 4.20 0.02 -1.95 -1.55 113.55 114.91 1wte h SER 93 Ca 0.29 -0.40 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 1wte h SER 93 Cb 0.16 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 1wte h SER 93 CO -0.17 0.81 0.37 0.22 -1.14 0.00 0.00 176.83 176.92 1wte h TYR 94 N 0.24 0.75 -0.66 3.45 3.20 -1.78 -2.04 116.97 120.13 1wte h TYR 94 Ca 0.06 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.85 1wte h TYR 94 Cb 0.61 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.60 1wte h TYR 94 CO 0.06 0.50 0.10 0.00 -1.64 0.00 0.00 178.16 177.18 1wte h ARG 95 N 0.79 1.09 -0.78 1.82 3.08 -1.08 -1.94 114.38 117.36 1wte h ARG 95 Ca 0.21 -0.30 -0.04 0.00 0.07 0.00 0.00 59.98 59.92 1wte h ARG 95 Cb -0.05 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 29.84 1wte h ARG 95 CO -0.04 1.01 0.33 0.00 -1.07 0.00 0.00 179.97 180.20 1wte h ALA 96 N 1.04 1.10 0.00 0.04 0.00 -1.11 -3.17 119.26 117.17 1wte h ALA 96 Ca 0.20 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1wte h ALA 96 Cb 0.45 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1wte h ALA 96 CO 0.01 0.65 0.00 0.00 0.00 0.00 0.00 179.25 179.91 1wte n ALA 97 N -2.43 2.24 -3.59 0.00 0.00 -0.78 -4.64 120.51 111.31 1wte n ALA 97 Ca 0.07 -0.08 -0.29 0.00 0.00 0.00 0.00 53.44 53.14 1wte n ALA 97 Cb 0.17 -1.44 -0.13 0.00 0.00 0.00 0.00 19.45 18.05 1wte n ALA 97 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1wte s ASN 98 N -3.24 3.41 0.54 0.00 0.01 -0.78 -5.09 114.94 109.79 1wte s ASN 98 Ca 0.13 -2.12 -0.21 0.00 -0.71 0.00 0.00 52.86 49.95 1wte s ASN 98 Cb 0.17 -0.65 -0.06 0.00 0.41 0.00 0.00 41.25 41.12 1wte s ASN 98 CO 0.51 -0.33 1.22 -0.62 -1.51 0.00 0.00 177.10 176.37 1wte n GLU 99 N 4.17 1.45 -0.99 -0.60 -0.58 -1.26 -1.48 120.64 121.35 1wte n GLU 99 Ca 0.07 0.54 -0.16 0.00 -0.42 0.00 0.00 57.16 57.18 1wte n GLU 99 Cb 0.38 -2.40 0.19 0.00 -0.57 0.00 0.00 31.44 29.03 1wte n GLU 99 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 1wte n PRO 100 N -0.86 2.45 0.02 3.49 -0.04 -1.26 -5.01 135.00 133.79 1wte n PRO 100 Ca 0.11 -2.57 0.08 0.00 -0.04 0.00 0.00 63.50 61.08 1wte n PRO 100 Cb 0.44 -2.03 0.35 0.00 -0.04 0.00 0.00 33.50 32.23 1wte n PRO 100 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1wte n PHE 101 N -0.65 0.15 0.39 0.54 0.99 -0.55 -2.22 117.46 116.12 1wte n PHE 101 Ca 0.46 0.06 0.14 0.00 -0.00 0.00 0.00 57.45 58.11 1wte n PHE 101 Cb 1.42 -0.60 0.50 0.00 -1.00 0.00 0.00 39.48 39.80 1wte n PHE 101 CO 0.00 0.00 0.00 0.97 -0.00 0.00 0.00 176.76 177.73 1wte h ILE 102 N 0.00 0.00 -3.96 4.37 2.10 -1.77 -3.44 117.51 114.81 1wte h ILE 102 Ca 0.00 -0.42 -0.50 0.00 1.08 0.00 0.00 64.86 65.02 1wte h ILE 102 Cb 0.28 1.30 0.05 0.00 -1.09 0.00 0.00 36.82 37.35 1wte h ILE 102 CO 0.00 0.00 0.48 -1.00 -1.08 0.00 0.00 178.15 176.55 1wte s HIS 103 N -3.36 3.08 0.21 2.19 3.76 -0.94 -4.93 115.29 115.30 1wte s HIS 103 Ca 0.05 1.57 0.35 0.00 -0.15 0.00 0.00 55.06 56.88 1wte s HIS 103 Cb 0.09 -3.33 1.71 0.00 1.11 0.00 0.00 32.58 32.17 1wte s HIS 103 CO 0.50 -1.19 2.06 -1.35 -0.85 0.00 0.00 174.74 173.90 1wte h PRO 104 N 2.51 0.00 -0.03 8.40 0.11 -1.91 -1.69 132.00 139.38 1wte h PRO 104 Ca -0.49 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.63 1wte h PRO 104 Cb 1.23 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1wte h PRO 104 CO 0.62 0.00 0.04 0.00 -0.21 0.00 0.00 178.00 178.45 1wte n PHE 106 N -3.64 0.00 -0.23 0.00 3.01 -0.64 -3.94 117.46 112.03 1wte n PHE 106 Ca -0.02 0.00 0.17 0.00 1.01 0.00 0.00 57.45 58.61 1wte n PHE 106 Cb 0.12 -0.03 0.49 0.00 -0.01 0.00 0.00 39.48 40.06 1wte n PHE 106 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1wte h ASP 107 N 1.23 0.44 0.03 4.37 3.32 -1.42 -1.66 116.42 122.74 1wte h ASP 107 Ca 0.00 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1wte h ASP 107 Cb 0.30 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1wte h ASP 107 CO 0.00 0.19 -0.02 -0.62 -1.72 0.00 0.00 179.24 177.07 1wte n GLU 108 N -4.52 1.33 -3.65 3.56 -0.58 -1.25 -4.84 120.64 110.69 1wte n GLU 108 Ca 0.18 -0.58 -0.37 0.00 -0.42 0.00 0.00 57.16 55.97 1wte n GLU 108 Cb 0.63 -1.49 -0.10 0.00 -0.57 0.00 0.00 31.44 29.91 1wte n GLU 108 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1wte s ILE 109 N -2.06 5.24 -0.06 -3.67 -1.09 -0.63 -4.56 121.20 114.37 1wte s ILE 109 Ca 0.40 0.14 -0.11 0.00 -2.23 0.00 0.00 60.65 58.85 1wte s ILE 109 Cb 0.21 -3.46 -0.30 0.00 -1.58 0.00 0.00 42.46 37.33 1wte s ILE 109 CO 0.37 0.31 0.63 0.44 -1.23 0.00 0.00 174.94 175.46 1wte h ASP 110 N 7.88 0.60 -5.10 3.58 3.32 -1.37 -3.43 116.42 121.90 1wte h ASP 110 Ca -0.37 -0.94 -0.12 0.00 0.02 0.00 0.00 57.03 55.63 1wte h ASP 110 Cb 1.18 -0.19 -0.17 0.00 0.22 0.00 0.00 39.33 40.37 1wte h ASP 110 CO 0.61 1.80 -0.48 -1.00 -1.72 0.00 0.00 179.24 178.44 1wte s HIS 111 N -2.57 0.18 -0.20 4.55 3.76 -1.00 -1.26 115.29 118.75 1wte s HIS 111 Ca -0.17 -0.50 -0.08 0.00 -0.15 0.00 0.00 55.06 54.16 1wte s HIS 111 Cb 0.05 -0.12 -0.04 0.00 1.11 0.00 0.00 32.58 33.58 1wte s HIS 111 CO 0.84 -0.41 0.08 0.08 -0.85 0.00 0.00 174.74 174.49 1wte s VAL 112 N -2.85 4.91 -0.25 -0.90 1.01 -0.26 -1.12 120.40 120.93 1wte s VAL 112 Ca -0.03 0.01 -0.06 0.00 0.00 0.00 0.00 61.98 61.90 1wte s VAL 112 Cb 0.00 -3.23 -0.01 0.00 0.00 0.00 0.00 36.38 33.14 1wte s VAL 112 CO -0.06 0.43 0.04 -0.63 0.00 0.00 0.00 175.10 174.89 1wte s ILE 113 N 0.54 3.95 -0.44 2.22 1.09 0.80 -1.23 121.20 128.15 1wte s ILE 113 Ca 0.04 -0.41 -0.16 0.00 -1.10 0.00 0.00 60.65 59.02 1wte s ILE 113 Cb -0.13 -2.89 0.04 0.00 -1.06 0.00 0.00 42.46 38.42 1wte s ILE 113 CO 0.01 0.29 0.41 -1.58 -0.10 0.00 0.00 174.94 173.96 1wte s GLN 114 N 1.54 3.04 0.43 2.79 2.00 -1.26 -1.24 119.66 126.96 1wte s GLN 114 Ca 0.05 -0.97 -0.22 0.00 -2.00 0.00 0.00 55.36 52.22 1wte s GLN 114 Cb -0.15 -4.02 -0.09 0.00 0.80 0.00 0.00 33.01 29.55 1wte s GLN 114 CO 0.01 -0.90 1.03 1.03 -0.50 0.00 0.00 175.29 175.96 1wte s ARG 115 N 1.95 4.06 0.59 1.67 1.81 0.40 -4.97 118.95 124.47 1wte s ARG 115 Ca 0.09 1.39 0.37 0.00 -1.72 0.00 0.00 55.73 55.86 1wte s ARG 115 Cb -0.19 -2.34 1.81 0.00 -0.45 0.00 0.00 34.95 33.77 1wte s ARG 115 CO 0.11 -0.21 2.15 -0.44 -0.68 0.00 0.00 175.30 176.23 1wte h ASP 116 N 2.10 0.00 -0.13 0.23 3.32 -1.98 -1.66 116.42 118.31 1wte h ASP 116 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 1wte h ASP 116 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1wte h ASP 116 CO 0.61 0.02 0.00 -0.90 -1.72 0.00 0.00 179.24 177.25 1wte n ASP 117 N -3.17 0.79 0.00 6.45 5.68 -1.26 -4.94 116.55 120.10 1wte n ASP 117 Ca -0.01 -1.84 0.00 0.00 -0.50 0.00 0.00 54.79 52.44 1wte n ASP 117 Cb 0.20 -0.08 0.00 0.00 -1.14 0.00 0.00 41.12 40.10 1wte n ASP 117 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1wte n GLY 118 N 0.81 2.69 3.74 6.12 0.00 -0.62 -5.05 105.19 112.87 1wte n GLY 118 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 1wte n GLY 118 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wte n ARG 119 N -2.00 1.62 -4.17 1.61 1.74 -1.26 -4.77 116.66 109.44 1wte n ARG 119 Ca 0.00 0.60 -0.26 0.00 -0.77 0.00 0.00 57.85 57.42 1wte n ARG 119 Cb 0.00 -2.55 -0.17 0.00 -1.02 0.00 0.00 32.46 28.72 1wte n ARG 119 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1wte s ILE 120 N -1.30 1.09 -0.06 0.55 1.01 -1.26 -0.45 121.20 120.77 1wte s ILE 120 Ca 0.73 -0.37 0.04 0.00 0.00 0.00 0.00 60.65 61.05 1wte s ILE 120 Cb -0.42 -1.06 -0.00 0.00 0.01 0.00 0.00 42.46 40.99 1wte s ILE 120 CO 0.48 0.37 -0.20 -1.61 0.00 0.00 0.00 174.94 173.98 1wte s GLU 121 N 1.29 2.23 0.06 2.79 2.02 -0.37 -0.82 118.70 125.91 1wte s GLU 121 Ca -0.03 -0.72 -0.16 0.00 0.02 0.00 0.00 54.97 54.08 1wte s GLU 121 Cb -0.14 -1.85 -0.06 0.00 0.10 0.00 0.00 34.13 32.18 1wte s GLU 121 CO -0.04 0.24 0.50 -0.51 0.02 0.00 0.00 175.26 175.47 1wte s LEU 122 N 0.12 4.46 -0.10 1.80 1.43 -0.60 -0.14 118.68 125.66 1wte s LEU 122 Ca -0.08 1.10 0.03 0.00 -1.03 0.00 0.00 54.13 54.15 1wte s LEU 122 Cb -0.14 -2.87 0.01 0.00 0.03 0.00 0.00 46.19 43.22 1wte s LEU 122 CO 0.04 0.25 -0.19 -0.22 0.23 0.00 0.00 176.35 176.46 1wte s LEU 123 N -1.31 1.92 -0.24 1.79 2.96 -0.28 0.52 118.68 124.03 1wte s LEU 123 Ca 0.29 -0.48 -0.05 0.00 -0.22 0.00 0.00 54.13 53.67 1wte s LEU 123 Cb -0.17 -1.22 -0.00 0.00 0.50 0.00 0.00 46.19 45.30 1wte s LEU 123 CO 0.17 0.09 -0.00 -0.55 -1.32 0.00 0.00 176.35 174.74 1wte s SER 124 N 0.61 4.59 -0.07 3.68 0.15 0.37 -1.03 113.70 122.00 1wte s SER 124 Ca -0.14 -0.50 -0.01 0.00 0.70 0.00 0.00 55.95 56.00 1wte s SER 124 Cb -0.17 -1.78 -0.03 0.00 -1.71 0.00 0.00 66.02 62.33 1wte s SER 124 CO 0.04 -0.07 0.01 -0.22 1.20 0.00 0.00 173.24 174.20 1wte s LEU 125 N 1.48 3.60 0.09 3.45 2.96 -1.26 -1.88 118.68 127.13 1wte s LEU 125 Ca 0.04 0.12 0.03 0.00 -0.22 0.00 0.00 54.13 54.11 1wte s LEU 125 Cb -0.15 -1.89 -0.04 0.00 0.50 0.00 0.00 46.19 44.61 1wte s LEU 125 CO -0.01 0.35 -0.09 -0.54 -1.32 0.00 0.00 176.35 174.74 1wte s LYS 126 N -1.06 0.83 0.01 1.98 -0.14 0.35 -4.95 119.74 116.76 1wte s LYS 126 Ca 0.15 -1.16 -0.25 0.00 -1.36 0.00 0.00 55.97 53.35 1wte s LYS 126 Cb -0.11 -0.48 -0.18 0.00 -1.68 0.00 0.00 37.83 35.38 1wte s LYS 126 CO 0.04 0.07 1.37 0.00 -0.76 0.00 0.00 175.35 176.07 1wte h ALA 127 N 3.52 -0.10 -2.92 5.17 0.00 -1.94 -0.94 119.26 122.06 1wte h ALA 127 Ca -0.37 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.37 1wte h ALA 127 Cb 1.19 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1wte h ALA 127 CO 0.54 -0.38 0.34 0.41 0.00 0.00 0.00 179.25 180.16 1wte n GLY 128 N -0.20 0.90 0.32 0.00 0.00 -1.26 -0.98 105.19 103.97 1wte n GLY 128 Ca -0.08 -1.24 0.08 0.00 0.00 0.00 0.00 46.02 44.78 1wte n GLY 128 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1wte h LYS 129 N 0.00 0.38 -0.00 1.61 2.10 -1.89 -2.69 116.57 116.08 1wte h LYS 129 Ca -0.33 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.30 1wte h LYS 129 Cb 1.24 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 32.48 1wte h LYS 129 CO 0.42 0.25 -0.22 0.91 -2.00 0.00 0.00 179.45 178.81 1wte n TRP 130 N -4.48 0.00 -0.12 0.07 5.03 -1.26 -4.18 117.44 112.50 1wte n TRP 130 Ca 0.05 0.00 0.01 0.00 3.03 0.00 0.00 57.50 60.58 1wte n TRP 130 Cb 0.19 -0.21 0.29 0.00 -1.03 0.00 0.00 31.31 30.55 1wte n TRP 130 CO 0.00 0.00 0.00 1.15 -0.03 0.00 0.00 177.69 178.81 1wte h THR 131 N 0.60 1.18 -3.49 -0.99 2.02 -1.89 -3.42 112.91 106.91 1wte h THR 131 Ca 0.00 -0.45 -0.66 0.00 0.77 0.00 0.00 66.41 66.07 1wte h THR 131 Cb 0.45 0.41 -0.15 0.00 -1.74 0.00 0.00 68.15 67.11 1wte h THR 131 CO 0.00 0.20 -0.73 0.27 0.37 0.00 0.00 175.52 175.63 1wte s ILE 132 N -5.53 3.42 0.29 3.11 -4.36 -1.26 -5.09 121.20 111.78 1wte s ILE 132 Ca -0.10 -1.27 0.00 0.00 -0.26 0.00 0.00 60.65 59.02 1wte s ILE 132 Cb 0.17 -2.61 -0.00 0.00 1.25 0.00 0.00 42.46 41.26 1wte s ILE 132 CO 0.77 0.09 0.01 0.00 0.24 0.00 0.00 174.94 176.05 1wte n GLN 133 N 0.63 1.22 -0.06 0.37 0.00 -1.26 -4.95 117.38 113.32 1wte n GLN 133 Ca -0.13 -2.11 -0.08 0.00 0.00 0.00 0.00 57.00 54.68 1wte n GLN 133 Cb 0.52 0.64 -0.02 0.00 0.00 0.00 0.00 30.24 31.39 1wte n GLN 133 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.06 178.31 1wte h LEU 134 N 0.00 -0.13 -0.48 2.61 5.85 -1.99 -1.85 115.31 119.32 1wte h LEU 134 Ca -0.23 0.06 0.09 0.00 0.84 0.00 0.00 57.88 58.64 1wte h LEU 134 Cb 0.73 0.11 -0.08 0.00 0.37 0.00 0.00 40.66 41.79 1wte h LEU 134 CO 0.39 -0.03 -0.02 0.74 -0.34 0.00 0.00 178.44 179.17 1wte h THR 135 N 0.06 0.60 -0.35 1.05 2.02 -1.99 -0.88 112.91 113.41 1wte h THR 135 Ca 0.11 -0.03 -0.06 0.00 0.77 0.00 0.00 66.41 67.21 1wte h THR 135 Cb 0.15 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.06 1wte h THR 135 CO -0.21 0.02 -0.00 0.24 0.37 0.00 0.00 175.52 175.94 1wte h MET 136 N 0.09 0.63 -0.89 6.66 2.86 -1.92 -2.20 114.93 120.16 1wte h MET 136 Ca 0.24 -0.20 0.06 0.00 -2.06 0.00 0.00 59.70 57.75 1wte h MET 136 Cb 0.36 -0.06 -0.06 0.00 0.06 0.00 0.00 31.60 31.90 1wte h MET 136 CO -0.42 0.74 0.55 0.00 1.06 0.00 0.00 176.91 178.84 1wte h ALA 137 N 0.86 1.23 -0.16 6.32 0.00 -0.82 0.34 119.26 127.04 1wte h ALA 137 Ca 0.10 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1wte h ALA 137 Cb 0.46 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1wte h ALA 137 CO 0.02 0.30 -0.22 0.28 0.00 0.00 0.00 179.25 179.64 1wte h VAL 138 N 1.01 1.35 -0.92 0.00 2.07 -1.10 -1.36 116.25 117.30 1wte h VAL 138 Ca 0.39 -1.43 0.07 0.00 0.82 0.00 0.00 66.70 66.54 1wte h VAL 138 Cb 0.18 1.91 -0.06 0.00 -1.52 0.00 0.00 31.29 31.80 1wte h VAL 138 CO -0.18 0.43 0.58 -0.61 0.02 0.00 0.00 177.57 177.81 1wte h GLN 139 N 0.05 1.02 -0.46 1.57 5.75 -1.11 -1.68 115.11 120.25 1wte h GLN 139 Ca 0.02 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.45 1wte h GLN 139 Cb 0.78 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 29.08 1wte h GLN 139 CO 0.05 0.68 0.25 -0.07 -2.65 0.00 0.00 178.83 177.09 1wte h LEU 140 N 1.05 0.57 -0.39 -2.39 3.38 -0.78 -0.85 115.31 115.92 1wte h LEU 140 Ca 0.40 -0.09 0.08 0.00 0.09 0.00 0.00 57.88 58.36 1wte h LEU 140 Cb 0.18 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 40.71 1wte h LEU 140 CO -0.18 0.50 -0.12 -1.13 0.09 0.00 0.00 178.44 177.60 1wte h ASN 141 N 0.60 -0.44 -0.01 -0.43 -0.73 -0.90 0.12 115.58 113.80 1wte h ASN 141 Ca 0.16 0.13 0.01 0.00 1.87 0.00 0.00 56.30 58.47 1wte h ASN 141 Cb 0.05 0.27 -0.01 0.00 0.27 0.00 0.00 38.32 38.90 1wte h ASN 141 CO -0.03 -0.16 -0.06 0.50 -0.37 0.00 0.00 177.43 177.32 1wte h LYS 142 N -0.03 -0.10 -0.25 6.67 3.64 -1.04 -0.39 116.57 125.06 1wte h LYS 142 Ca 0.19 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.59 1wte h LYS 142 Cb 0.32 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 1wte h LYS 142 CO -0.42 -0.07 0.14 0.00 -2.27 0.00 0.00 179.45 176.83 1wte h ALA 143 N 0.89 0.30 -0.57 5.00 0.00 -0.92 -2.03 119.26 121.93 1wte h ALA 143 Ca 0.03 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1wte h ALA 143 Cb 0.14 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1wte h ALA 143 CO -0.07 -0.26 0.11 0.74 0.00 0.00 0.00 179.25 179.77 1wte h PHE 144 N 0.29 0.93 -0.63 0.00 0.05 -0.85 -1.90 116.94 114.82 1wte h PHE 144 Ca 0.10 -0.10 -0.02 0.00 3.82 0.00 0.00 57.97 61.77 1wte h PHE 144 Cb 0.01 -0.27 -0.03 0.00 2.00 0.00 0.00 35.95 37.66 1wte h PHE 144 CO -0.08 0.79 0.32 1.25 -0.18 0.00 0.00 178.31 180.41 1wte h HIS 145 N 0.85 0.90 -0.42 -0.55 2.76 -0.90 -1.49 115.15 116.30 1wte h HIS 145 Ca 0.18 -0.04 -0.09 0.00 -2.20 0.00 0.00 60.37 58.23 1wte h HIS 145 Cb 0.35 -0.28 -0.02 0.00 1.55 0.00 0.00 27.41 29.01 1wte h HIS 145 CO 0.02 0.66 -0.10 1.49 -1.30 0.00 0.00 177.93 178.70 1wte h GLU 146 N 0.87 0.75 0.21 5.26 4.81 -0.96 -0.64 114.58 124.87 1wte h GLU 146 Ca 0.22 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 1wte h GLU 146 Cb 0.09 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1wte h GLU 146 CO -0.03 0.83 -0.10 0.82 -0.73 0.00 0.00 179.01 179.80 1wte h ILE 147 N 0.68 0.86 -0.70 2.32 2.04 -1.06 -0.07 117.51 121.58 1wte h ILE 147 Ca 0.12 -0.33 0.09 0.00 1.00 0.00 0.00 64.86 65.74 1wte h ILE 147 Cb 0.57 1.06 -0.07 0.00 -0.74 0.00 0.00 36.82 37.64 1wte h ILE 147 CO 0.04 0.08 0.34 0.40 0.00 0.00 0.00 178.15 179.01 1wte h ILE 148 N -0.44 0.84 0.14 -0.67 2.04 -1.13 0.18 117.51 118.47 1wte h ILE 148 Ca -0.03 -0.20 -0.20 0.00 1.00 0.00 0.00 64.86 65.43 1wte h ILE 148 Cb 0.34 0.21 0.02 0.00 -0.74 0.00 0.00 36.82 36.64 1wte h ILE 148 CO 0.05 0.11 -0.94 0.78 0.00 0.00 0.00 178.15 178.15 1wte h ASN 149 N 0.59 0.45 0.54 1.72 2.35 -1.05 -3.29 115.58 116.90 1wte h ASN 149 Ca 0.34 -0.93 -0.16 0.00 -0.55 0.00 0.00 56.30 55.01 1wte h ASN 149 Cb 0.36 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.56 1wte h ASN 149 CO -0.27 1.44 -1.58 0.59 -1.65 0.00 0.00 177.43 175.96 1wte n ASN 150 N -4.09 0.63 -3.00 5.81 5.03 -0.05 -4.49 115.26 115.11 1wte n ASN 150 Ca -0.16 0.27 -0.23 0.00 0.87 0.00 0.00 54.58 55.33 1wte n ASN 150 Cb 0.84 0.54 -0.03 0.00 -1.02 0.00 0.00 39.78 40.11 1wte n ASN 150 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1wte n TYR 151 N -2.76 2.43 0.31 3.10 4.02 0.64 -4.92 117.16 119.97 1wte n TYR 151 Ca -0.11 -3.83 0.20 0.00 -0.01 0.00 0.00 57.90 54.15 1wte n TYR 151 Cb 0.82 -0.44 0.92 0.00 -0.02 0.00 0.00 39.34 40.62 1wte n TYR 151 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1wte h PRO 152 N 2.97 0.00 -0.01 -0.72 0.13 -1.62 -2.90 132.00 129.84 1wte h PRO 152 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1wte h PRO 152 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1wte h PRO 152 CO 0.69 0.00 -0.11 0.41 -0.23 0.00 0.00 178.00 178.75 1wte n GLY 153 N -0.45 -0.60 0.18 1.56 0.00 -1.26 -4.11 105.19 100.51 1wte n GLY 153 Ca -0.01 -0.35 0.12 0.00 0.00 0.00 0.00 46.02 45.79 1wte n GLY 153 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1wte h VAL 154 N 1.17 0.00 -2.31 1.61 3.04 -1.89 -3.47 116.25 114.40 1wte h VAL 154 Ca 0.00 -0.86 0.16 0.00 -1.01 0.00 0.00 66.70 64.99 1wte h VAL 154 Cb 0.41 1.83 -0.10 0.00 -2.01 0.00 0.00 31.29 31.42 1wte h VAL 154 CO 0.00 0.00 0.49 0.00 -1.01 0.00 0.00 177.57 177.05 1wte s ALA 155 N -3.19 -1.71 0.14 3.17 0.00 -1.26 -4.94 121.76 113.97 1wte s ALA 155 Ca 0.08 0.36 0.05 0.00 0.00 0.00 0.00 51.96 52.45 1wte s ALA 155 Cb 0.07 0.58 -0.12 0.00 0.00 0.00 0.00 23.12 23.66 1wte s ALA 155 CO 0.66 -0.95 1.32 -0.44 0.00 0.00 0.00 175.76 176.35 1wte h ASP 156 N 2.00 0.09 -4.83 0.00 3.32 -1.29 -3.49 116.42 112.23 1wte h ASP 156 Ca -0.24 -0.08 0.24 0.00 0.02 0.00 0.00 57.03 56.97 1wte h ASP 156 Cb 1.23 -0.03 -0.15 0.00 0.22 0.00 0.00 39.33 40.60 1wte h ASP 156 CO 0.27 0.99 0.73 0.54 -1.72 0.00 0.00 179.24 180.05 1wte s ASN 157 N -6.81 -0.16 -0.05 6.45 4.22 -1.25 -5.02 114.94 112.32 1wte s ASN 157 Ca -0.00 -0.08 0.05 0.00 -2.14 0.00 0.00 52.86 50.69 1wte s ASN 157 Cb 0.10 0.23 -0.02 0.00 1.28 0.00 0.00 41.25 42.84 1wte s ASN 157 CO 0.82 -0.39 -0.21 -0.63 -2.04 0.00 0.00 177.10 174.66 1wte s ILE 158 N -2.63 2.48 -0.06 0.54 1.01 -0.20 -1.55 121.20 120.79 1wte s ILE 158 Ca 0.10 -0.93 0.05 0.00 0.00 0.00 0.00 60.65 59.87 1wte s ILE 158 Cb 0.01 -1.93 -0.01 0.00 0.01 0.00 0.00 42.46 40.54 1wte s ILE 158 CO -0.04 0.58 -0.22 -0.69 0.00 0.00 0.00 174.94 174.57 1wte s VAL 159 N -0.45 1.79 -0.31 2.92 1.01 0.18 -2.27 120.40 123.27 1wte s VAL 159 Ca 0.05 -0.91 -0.13 0.00 0.00 0.00 0.00 61.98 60.99 1wte s VAL 159 Cb -0.12 -1.53 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 1wte s VAL 159 CO 0.01 0.50 0.24 -0.69 0.00 0.00 0.00 175.10 175.17 1wte s VAL 160 N -0.00 5.27 -0.09 2.92 1.01 -0.21 -0.48 120.40 128.83 1wte s VAL 160 Ca -0.06 0.02 -0.11 0.00 0.00 0.00 0.00 61.98 61.82 1wte s VAL 160 Cb -0.13 -3.65 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 1wte s VAL 160 CO 0.04 0.09 0.27 -0.83 0.00 0.00 0.00 175.10 174.67 1wte s GLY 161 N 1.73 2.29 -0.23 4.51 0.00 -0.79 -1.32 107.32 113.52 1wte s GLY 161 Ca 0.08 -0.44 0.02 0.00 0.00 0.00 0.00 44.72 44.37 1wte s GLY 161 CO 0.11 0.01 -0.12 0.14 0.00 0.00 0.00 173.10 173.23 1wte s VAL 162 N -0.68 1.99 -0.62 1.40 1.01 -0.17 -0.49 120.40 122.84 1wte s VAL 162 Ca 0.18 -1.32 0.25 0.00 0.00 0.00 0.00 61.98 61.10 1wte s VAL 162 Cb -0.14 -2.03 0.30 0.00 0.00 0.00 0.00 36.38 34.51 1wte s VAL 162 CO 0.07 0.14 1.73 2.19 0.00 0.00 0.00 175.10 179.23 1wte h PHE 163 N 7.86 0.00 -3.86 5.22 -5.15 -0.70 -0.79 116.94 119.52 1wte h PHE 163 Ca -0.27 0.00 -0.27 0.00 -0.20 0.00 0.00 57.97 57.23 1wte h PHE 163 Cb 1.08 0.00 -0.18 0.00 0.22 0.00 0.00 35.95 37.06 1wte h PHE 163 CO 0.56 0.00 -0.72 1.52 -2.00 0.00 0.00 178.31 177.67 1wte s TYR 164 N -3.15 0.85 0.00 6.09 -0.85 -0.15 -4.33 117.35 115.80 1wte s TYR 164 Ca 0.09 -0.67 0.00 0.00 -0.52 0.00 0.00 57.07 55.97 1wte s TYR 164 Cb 0.10 -0.49 0.00 0.00 0.38 0.00 0.00 41.96 41.95 1wte s TYR 164 CO 0.61 -0.08 0.00 0.41 -1.52 0.00 0.00 175.55 174.96 1wte n GLY 165 N 0.76 -1.90 3.34 5.49 0.00 -1.26 -4.43 105.19 107.19 1wte n GLY 165 Ca -0.18 -2.01 -0.12 0.00 0.00 0.00 0.00 46.02 43.71 1wte n GLY 165 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wte s ASN 166 N -4.00 0.23 0.20 1.61 6.03 -1.26 -2.92 114.94 114.83 1wte s ASN 166 Ca 0.00 -1.28 -0.04 0.00 -1.03 0.00 0.00 52.86 50.51 1wte s ASN 166 Cb 0.00 0.47 0.16 0.00 -3.03 0.00 0.00 41.25 38.85 1wte s ASN 166 CO 0.00 -0.98 1.57 0.77 -2.03 0.00 0.00 177.10 176.43 1wte h SER 167 N 2.44 0.70 -0.81 3.54 4.64 -1.98 -2.73 113.55 119.35 1wte h SER 167 Ca -0.32 -0.31 0.01 0.00 -0.47 0.00 0.00 61.79 60.71 1wte h SER 167 Cb 1.25 -0.20 -0.04 0.00 -0.31 0.00 0.00 62.40 63.10 1wte h SER 167 CO 0.46 1.01 0.54 -0.74 -0.87 0.00 0.00 176.83 177.22 1wte h HIS 168 N 0.55 1.01 0.00 4.77 6.17 -2.00 -2.24 115.15 123.42 1wte h HIS 168 Ca 0.05 0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.15 1wte h HIS 168 Cb 0.90 -0.34 0.00 0.00 2.52 0.00 0.00 27.41 30.49 1wte h HIS 168 CO 0.04 0.63 0.00 0.41 0.71 0.00 0.00 177.93 179.72 1wte n GLY 169 N -1.41 -1.31 3.76 5.26 0.00 -1.04 -4.90 105.19 105.54 1wte n GLY 169 Ca 0.09 -0.09 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1wte n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wte s LEU 170 N -2.94 3.73 0.91 0.99 1.43 -0.84 -4.86 118.68 117.11 1wte s LEU 170 Ca 0.14 2.40 -0.14 0.00 -1.03 0.00 0.00 54.13 55.50 1wte s LEU 170 Cb 0.16 -4.53 0.15 0.00 0.03 0.00 0.00 46.19 42.00 1wte s LEU 170 CO 0.44 -1.48 1.20 0.42 0.23 0.00 0.00 176.35 177.16 1wte s THR 171 N -1.57 1.97 -0.18 5.49 -4.23 -1.26 -4.94 115.64 110.91 1wte s THR 171 Ca 0.75 0.00 0.23 0.00 -1.18 0.00 0.00 61.69 61.49 1wte s THR 171 Cb -0.31 -2.88 0.23 0.00 1.34 0.00 0.00 72.50 70.89 1wte s THR 171 CO 0.34 0.00 1.71 -2.24 -0.54 0.00 0.00 174.62 173.89 1wte h ASP 172 N -1.47 0.00 0.40 3.99 -0.00 -1.95 -2.90 116.42 114.48 1wte h ASP 172 Ca -0.47 0.00 -0.07 0.00 -0.00 0.00 0.00 57.03 56.49 1wte h ASP 172 Cb 1.30 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.62 1wte h ASP 172 CO 0.55 0.00 -0.35 0.11 -0.00 0.00 0.00 179.24 179.55 1wte h LYS 173 N 0.00 0.00 0.00 4.15 1.79 -1.92 0.63 116.57 121.22 1wte h LYS 173 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1wte h LYS 173 Cb 0.05 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.70 1wte h LYS 173 CO 0.00 0.35 0.00 1.88 -1.08 0.00 0.00 179.45 180.60 1wte h TYR 174 N 0.00 0.00 0.14 -1.35 -1.99 -1.89 -1.76 116.97 110.12 1wte h TYR 174 Ca -0.00 0.00 -0.32 0.00 2.00 0.00 0.00 58.73 60.41 1wte h TYR 174 Cb 0.65 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.38 1wte h TYR 174 CO 0.00 0.00 -1.62 0.00 -0.00 0.00 0.00 178.16 176.54 1wte h ARG 175 N 0.00 0.30 -0.95 4.88 3.08 -1.12 -3.39 114.38 117.18 1wte h ARG 175 Ca 0.00 -0.52 0.07 0.00 0.07 0.00 0.00 59.98 59.60 1wte h ARG 175 Cb 0.55 0.19 -0.07 0.00 0.08 0.00 0.00 29.97 30.72 1wte h ARG 175 CO 0.00 1.25 0.60 0.82 -1.07 0.00 0.00 179.97 181.57 1wte h ILE 176 N -0.11 1.05 0.00 2.04 1.08 -0.88 -0.80 117.51 119.89 1wte h ILE 176 Ca -0.34 -0.37 -0.02 0.00 -0.39 0.00 0.00 64.86 63.75 1wte h ILE 176 Cb 1.92 -0.13 -0.00 0.00 -3.07 0.00 0.00 36.82 35.54 1wte h ILE 176 CO 0.10 0.20 -0.08 0.17 -0.69 0.00 0.00 178.15 177.85 1wte h LEU 177 N 1.08 0.00 -0.21 1.44 8.10 -1.47 -0.67 115.31 123.57 1wte h LEU 177 Ca 0.42 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.41 1wte h LEU 177 Cb 0.22 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.44 1wte h LEU 177 CO -0.19 0.08 -0.03 0.54 -4.11 0.00 0.00 178.44 174.73 1wte n ARG 178 N -3.58 0.93 -0.71 0.17 1.74 -0.38 -3.99 116.66 110.83 1wte n ARG 178 Ca -0.02 -0.21 0.00 0.00 -0.77 0.00 0.00 57.85 56.85 1wte n ARG 178 Cb 0.20 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.15 1wte n ARG 178 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wte n GLY 179 N 1.15 0.61 3.53 -0.13 0.00 -0.26 -0.58 105.19 109.51 1wte n GLY 179 Ca 0.19 -0.33 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 1wte n GLY 179 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wte s ILE 180 N -2.00 4.85 -0.40 -0.61 1.01 -0.76 -4.15 121.20 119.14 1wte s ILE 180 Ca 0.00 0.22 0.02 0.00 0.00 0.00 0.00 60.65 60.89 1wte s ILE 180 Cb 0.00 -4.17 0.15 0.00 0.01 0.00 0.00 42.46 38.45 1wte s ILE 180 CO 0.00 -0.52 0.26 0.21 0.00 0.00 0.00 174.94 174.88 1wte s ASN 181 N 1.95 2.88 0.00 3.58 2.47 -1.26 -3.11 114.94 121.45 1wte s ASN 181 Ca 0.23 -2.55 0.25 0.00 0.42 0.00 0.00 52.86 51.21 1wte s ASN 181 Cb -0.14 -0.61 0.48 0.00 -1.45 0.00 0.00 41.25 39.52 1wte s ASN 181 CO 0.18 -0.26 1.39 0.35 -3.72 0.00 0.00 177.10 175.04 1wte n THR 182 N 3.58 0.00 0.00 -5.21 -2.24 -1.26 -4.89 114.28 104.26 1wte n THR 182 Ca 0.15 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1wte n THR 182 Cb 0.39 0.46 0.00 0.00 -2.10 0.00 0.00 70.33 69.07 1wte n THR 182 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wte n GLY 183 N 1.44 1.69 3.75 3.38 0.00 -1.26 -5.05 105.19 109.14 1wte n GLY 183 Ca 0.08 -0.38 -0.36 0.00 0.00 0.00 0.00 46.02 45.37 1wte n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wte s ALA 184 N -2.55 2.50 0.07 4.61 0.00 -1.26 -4.92 121.76 120.21 1wte s ALA 184 Ca 0.00 1.02 -0.31 0.00 0.00 0.00 0.00 51.96 52.68 1wte s ALA 184 Cb 0.00 -3.46 -0.07 0.00 0.00 0.00 0.00 23.12 19.59 1wte s ALA 184 CO 0.00 -1.25 1.36 1.21 0.00 0.00 0.00 175.76 177.08 1wte s ASN 185 N -1.60 6.88 -0.01 0.00 3.04 -1.26 -4.91 114.94 117.07 1wte s ASN 185 Ca 0.78 2.20 0.02 0.00 0.04 0.00 0.00 52.86 55.90 1wte s ASN 185 Cb -0.31 -2.58 0.03 0.00 -1.54 0.00 0.00 41.25 36.85 1wte s ASN 185 CO 0.34 -0.64 0.94 1.41 -3.04 0.00 0.00 177.10 176.11 1wte n HIS 186 N 4.39 0.00 -3.64 0.43 8.25 -1.26 -5.04 115.22 118.35 1wte n HIS 186 Ca 0.11 -0.46 -0.21 0.00 -0.26 0.00 0.00 57.72 56.90 1wte n HIS 186 Cb 0.43 -0.05 0.05 0.00 1.12 0.00 0.00 29.99 31.55 1wte n HIS 186 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1wte n ASN 187 N -0.50 -2.31 -4.97 0.41 3.02 -1.26 -5.00 115.26 104.64 1wte n ASN 187 Ca 0.01 -0.73 -0.21 0.00 -0.03 0.00 0.00 54.58 53.62 1wte n ASN 187 Cb 0.33 -4.43 0.00 0.00 -0.61 0.00 0.00 39.78 35.07 1wte n ASN 187 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1wte s VAL 188 N -3.51 4.09 -0.08 2.41 -7.23 -1.26 -5.05 120.40 109.77 1wte s VAL 188 Ca 0.13 -0.75 0.04 0.00 -1.81 0.00 0.00 61.98 59.59 1wte s VAL 188 Cb -0.06 -3.46 -0.01 0.00 0.56 0.00 0.00 36.38 33.40 1wte s VAL 188 CO 0.78 -0.25 -0.21 -0.63 -0.31 0.00 0.00 175.10 174.48 1wte s ILE 189 N -2.35 2.37 -0.16 -0.62 1.01 -1.26 -4.95 121.20 115.23 1wte s ILE 189 Ca 0.46 -0.94 -0.29 0.00 0.00 0.00 0.00 60.65 59.89 1wte s ILE 189 Cb -0.10 -1.91 -0.05 0.00 0.01 0.00 0.00 42.46 40.42 1wte s ILE 189 CO 0.34 0.56 1.87 -0.62 0.00 0.00 0.00 174.94 177.10 1wte s ASP 190 N 0.00 6.12 -0.09 3.58 -1.08 -1.26 -3.52 116.67 120.42 1wte s ASP 190 Ca -0.07 1.93 0.16 0.00 -0.52 0.00 0.00 52.55 54.05 1wte s ASP 190 Cb -0.15 -2.53 0.35 0.00 -1.46 0.00 0.00 42.92 39.13 1wte s ASP 190 CO 0.05 -1.42 1.16 2.30 0.52 0.00 0.00 175.17 177.78 1wte n ILE 191 N 6.62 0.97 0.34 4.11 -5.35 0.25 -4.91 119.36 121.40 1wte n ILE 191 Ca 0.22 -1.77 0.14 0.00 -0.27 0.00 0.00 62.75 61.08 1wte n ILE 191 Cb 0.44 0.36 0.48 0.00 -1.74 0.00 0.00 39.64 39.18 1wte n ILE 191 CO 0.00 0.00 0.00 0.08 -1.76 0.00 0.00 176.55 174.87 1wte h ARG 192 N 0.74 0.00 0.00 6.28 0.11 -1.80 -1.31 114.38 118.39 1wte h ARG 192 Ca -0.09 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 59.95 1wte h ARG 192 Cb 1.42 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.49 1wte h ARG 192 CO 0.04 0.00 -0.16 -0.44 0.10 0.00 0.00 179.97 179.51 1wte h ASP 193 N 0.00 0.00 -0.00 0.08 3.32 -1.92 -3.28 116.42 114.62 1wte h ASP 193 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1wte h ASP 193 Cb 0.63 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.18 1wte h ASP 193 CO 0.00 0.16 -0.20 0.29 -1.72 0.00 0.00 179.24 177.77 1wte n LYS 194 N -4.04 2.78 -4.06 3.56 4.76 -0.56 -4.95 118.16 115.65 1wte n LYS 194 Ca -0.02 -0.40 -0.28 0.00 -2.87 0.00 0.00 58.31 54.73 1wte n LYS 194 Cb 0.24 -0.97 -0.17 0.00 -1.84 0.00 0.00 35.03 32.30 1wte n LYS 194 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1wte s VAL 195 N -1.26 1.27 0.05 -0.18 1.01 -0.80 -1.03 120.40 119.46 1wte s VAL 195 Ca 0.05 -0.46 0.05 0.00 0.00 0.00 0.00 61.98 61.63 1wte s VAL 195 Cb 0.06 -1.23 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 1wte s VAL 195 CO 0.21 0.41 -0.14 -1.00 0.00 0.00 0.00 175.10 174.58 1wte s HIS 196 N 1.47 1.24 -0.15 5.22 3.76 -0.96 -4.64 115.29 121.23 1wte s HIS 196 Ca 0.02 -0.38 -0.01 0.00 -0.15 0.00 0.00 55.06 54.54 1wte s HIS 196 Cb -0.13 -0.72 -0.01 0.00 1.11 0.00 0.00 32.58 32.82 1wte s HIS 196 CO -0.07 0.04 -0.10 0.08 -0.85 0.00 0.00 174.74 173.84 1wte s VAL 197 N -0.96 3.17 -0.04 -0.90 1.01 -1.26 -1.04 120.40 120.38 1wte s VAL 197 Ca 0.01 -0.60 0.05 0.00 0.00 0.00 0.00 61.98 61.43 1wte s VAL 197 Cb -0.08 -2.36 -0.01 0.00 0.00 0.00 0.00 36.38 33.93 1wte s VAL 197 CO 0.02 0.50 -0.19 -0.31 0.00 0.00 0.00 175.10 175.12 1wte s TYR 198 N 0.62 1.82 0.03 5.22 4.12 -0.43 -4.98 117.35 123.76 1wte s TYR 198 Ca -0.06 -0.51 0.07 0.00 0.02 0.00 0.00 57.07 56.59 1wte s TYR 198 Cb -0.15 -1.22 -0.02 0.00 -1.52 0.00 0.00 41.96 39.05 1wte s TYR 198 CO 0.03 -0.16 -0.20 0.00 0.02 0.00 0.00 175.55 175.24 1wte s ALA 199 N -0.05 1.71 0.00 3.71 0.00 -1.26 -0.99 121.76 124.88 1wte s ALA 199 Ca -0.02 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 50.93 1wte s ALA 199 Cb -0.11 -0.35 0.00 0.00 0.00 0.00 0.00 23.12 22.65 1wte s ALA 199 CO 0.02 0.39 0.00 0.41 0.00 0.00 0.00 175.76 176.58 1wte n GLY 200 N 2.00 3.32 0.29 0.00 0.00 -0.30 -2.19 105.19 108.31 1wte n GLY 200 Ca -0.17 -0.14 0.07 0.00 0.00 0.00 0.00 46.02 45.78 1wte n GLY 200 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1wte h LYS 201 N 0.00 0.50 -0.62 1.61 3.64 -1.88 -1.53 116.57 118.28 1wte h LYS 201 Ca 0.00 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 1wte h LYS 201 Cb 0.00 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.68 1wte h LYS 201 CO 0.00 0.33 0.26 0.93 -2.27 0.00 0.00 179.45 178.70 1wte h GLU 202 N 0.51 0.91 0.10 1.90 3.07 -1.81 -0.95 114.58 118.32 1wte h GLU 202 Ca 0.45 -0.16 0.01 0.00 -0.50 0.00 0.00 59.36 59.17 1wte h GLU 202 Cb 0.69 -0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 28.42 1wte h GLU 202 CO -0.40 0.76 -0.17 0.35 -1.40 0.00 0.00 179.01 178.15 1wte h PHE 203 N 0.86 -0.46 -0.90 4.33 3.57 -1.22 1.00 116.94 124.12 1wte h PHE 203 Ca 0.21 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.70 1wte h PHE 203 Cb 0.18 0.19 -0.04 0.00 2.79 0.00 0.00 35.95 39.06 1wte h PHE 203 CO 0.01 -0.26 0.50 -1.49 -2.23 0.00 0.00 178.31 174.84 1wte h TRP 204 N -0.34 1.22 -0.12 0.41 4.06 -1.34 0.17 115.95 120.01 1wte h TRP 204 Ca 0.02 -0.03 -0.02 0.00 2.06 0.00 0.00 58.89 60.93 1wte h TRP 204 Cb 0.36 -0.39 -0.00 0.00 -1.00 0.00 0.00 29.16 28.12 1wte h TRP 204 CO -0.18 0.84 0.00 1.03 -3.56 0.00 0.00 178.44 176.57 1wte h SER 205 N 1.25 0.21 -0.44 -3.49 0.87 -1.10 -1.43 113.55 109.42 1wte h SER 205 Ca 0.32 -0.31 0.09 0.00 -1.23 0.00 0.00 61.79 60.66 1wte h SER 205 Cb 0.01 -0.06 -0.08 0.00 -0.44 0.00 0.00 62.40 61.84 1wte h SER 205 CO -0.05 0.46 -0.06 -0.25 -0.53 0.00 0.00 176.83 176.40 1wte h TRP 206 N -0.05 -0.14 -0.49 2.24 7.01 -0.56 0.25 115.95 124.21 1wte h TRP 206 Ca 0.03 0.04 0.09 0.00 2.11 0.00 0.00 58.89 61.16 1wte h TRP 206 Cb 0.36 0.13 -0.08 0.00 -2.10 0.00 0.00 29.16 27.47 1wte h TRP 206 CO 0.03 -0.15 0.02 1.25 -2.79 0.00 0.00 178.44 176.81 1wte h LEU 207 N 0.05 -0.16 -4.54 0.65 6.46 -0.53 -3.22 115.31 114.02 1wte h LEU 207 Ca 0.22 0.11 -0.70 0.00 -0.12 0.00 0.00 57.88 57.38 1wte h LEU 207 Cb 0.33 0.19 -0.31 0.00 -0.73 0.00 0.00 40.66 40.14 1wte h LEU 207 CO -0.41 -0.05 0.63 -3.20 -0.62 0.00 0.00 178.44 174.79 1wte n ASN 208 N -5.20 7.02 -3.24 1.25 5.15 -0.55 -4.91 115.26 114.78 1wte n ASN 208 Ca 0.05 -3.80 -0.23 0.00 -0.60 0.00 0.00 54.58 50.00 1wte n ASN 208 Cb 0.26 -0.91 0.02 0.00 -0.53 0.00 0.00 39.78 38.62 1wte n ASN 208 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1wte n ASN 209 N -0.66 -4.82 0.00 1.20 3.02 -1.02 -2.00 115.26 110.99 1wte n ASN 209 Ca 0.54 -0.36 0.00 0.00 -0.03 0.00 0.00 54.58 54.73 1wte n ASN 209 Cb 0.47 -3.93 0.00 0.00 -0.61 0.00 0.00 39.78 35.71 1wte n ASN 209 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wte n GLY 210 N -1.36 0.73 3.55 7.41 0.00 0.82 -5.01 105.19 111.34 1wte n GLY 210 Ca -0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 1wte n GLY 210 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wte s GLU 211 N -0.54 2.75 0.59 1.61 0.41 -0.85 -4.87 118.70 117.81 1wte s GLU 211 Ca 0.00 0.32 0.29 0.00 -0.41 0.00 0.00 54.97 55.17 1wte s GLU 211 Cb 0.00 -4.44 1.61 0.00 -1.78 0.00 0.00 34.13 29.52 1wte s GLU 211 CO 0.00 -2.67 2.04 0.00 -0.49 0.00 0.00 175.26 174.14 1wte h ALA 212 N 13.55 1.89 -0.17 5.21 0.00 -1.90 -2.60 119.26 135.25 1wte h ALA 212 Ca -0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1wte h ALA 212 Cb 1.12 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1wte h ALA 212 CO 1.24 -0.42 0.00 0.39 0.00 0.00 0.00 179.25 180.46 1wte n GLU 213 N -3.74 1.88 -0.28 0.00 -0.58 -1.26 -4.49 120.64 112.16 1wte n GLU 213 Ca 0.03 -1.31 0.00 0.00 -0.42 0.00 0.00 57.16 55.47 1wte n GLU 213 Cb 0.42 -1.43 0.13 0.00 -0.57 0.00 0.00 31.44 29.99 1wte n GLU 213 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 1wte h THR 214 N 2.73 1.00 -0.97 2.62 2.02 -1.80 -1.18 112.91 117.33 1wte h THR 214 Ca 0.00 -0.29 0.15 0.00 0.77 0.00 0.00 66.41 67.04 1wte h THR 214 Cb 0.59 0.08 -0.09 0.00 -1.74 0.00 0.00 68.15 67.00 1wte h THR 214 CO 0.00 0.16 0.61 0.06 0.37 0.00 0.00 175.52 176.71 1wte h GLN 215 N 0.85 0.78 -0.17 6.66 3.07 -1.85 -1.11 115.11 123.34 1wte h GLN 215 Ca 0.35 -0.05 -0.12 0.00 0.09 0.00 0.00 58.65 58.92 1wte h GLN 215 Cb 0.20 -0.18 -0.01 0.00 0.08 0.00 0.00 27.48 27.57 1wte h GLN 215 CO -0.18 0.52 -0.42 0.45 0.09 0.00 0.00 178.83 179.29 1wte h HIS 216 N 0.81 0.46 -0.40 0.06 3.86 -1.55 -2.25 115.15 116.14 1wte h HIS 216 Ca 0.50 -0.13 -0.13 0.00 -1.16 0.00 0.00 60.37 59.45 1wte h HIS 216 Cb 0.71 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.07 1wte h HIS 216 CO -0.00 0.75 -0.28 -1.49 0.86 0.00 0.00 177.93 177.77 1wte h TRP 217 N 0.32 0.98 0.03 2.45 6.55 -0.94 -1.49 115.95 123.85 1wte h TRP 217 Ca 0.03 -0.25 -0.00 0.00 0.95 0.00 0.00 58.89 59.62 1wte h TRP 217 Cb 0.87 -0.22 0.00 0.00 -0.86 0.00 0.00 29.16 28.95 1wte h TRP 217 CO 0.02 1.02 -0.01 0.28 -1.05 0.00 0.00 178.44 178.70 1wte h VAL 218 N 0.72 0.99 -0.83 1.49 2.07 -1.18 -1.85 116.25 117.66 1wte h VAL 218 Ca 0.09 -0.07 0.06 0.00 0.82 0.00 0.00 66.70 67.60 1wte h VAL 218 Cb 0.82 1.04 -0.06 0.00 -1.52 0.00 0.00 31.29 31.57 1wte h VAL 218 CO 0.07 0.02 0.51 0.25 0.02 0.00 0.00 177.57 178.44 1wte h LEU 219 N -0.07 0.81 -0.68 2.57 6.46 -1.34 -2.46 115.31 120.61 1wte h LEU 219 Ca -0.00 0.01 -0.07 0.00 -0.12 0.00 0.00 57.88 57.70 1wte h LEU 219 Cb 0.06 -0.16 -0.03 0.00 -0.73 0.00 0.00 40.66 39.80 1wte h LEU 219 CO 0.01 0.53 0.16 -0.08 -0.62 0.00 0.00 178.44 178.43 1wte h GLU 220 N 0.95 1.09 -0.69 1.25 4.81 -1.11 -0.59 114.58 120.28 1wte h GLU 220 Ca 0.36 -0.26 0.04 0.00 -0.13 0.00 0.00 59.36 59.37 1wte h GLU 220 Cb 0.14 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.33 1wte h GLU 220 CO -0.16 0.97 0.41 0.78 -0.73 0.00 0.00 179.01 180.28 1wte h GLY 221 N 1.02 1.00 0.94 1.92 0.00 -1.00 -1.51 103.07 105.43 1wte h GLY 221 Ca 0.21 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.24 1wte h GLY 221 CO 0.00 0.23 0.08 -2.22 0.00 0.00 0.00 176.54 174.63 1wte h ILE 222 N 0.79 1.10 -0.10 2.60 2.04 -0.95 -2.01 117.51 120.98 1wte h ILE 222 Ca 0.29 -0.27 0.03 0.00 1.00 0.00 0.00 64.86 65.91 1wte h ILE 222 Cb 0.10 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 1wte h ILE 222 CO -0.14 0.09 -0.09 -0.33 0.00 0.00 0.00 178.15 177.68 1wte h GLU 223 N 0.15 -0.10 -0.52 2.37 5.08 -0.93 -0.26 114.58 120.37 1wte h GLU 223 Ca 0.05 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.51 1wte h GLU 223 Cb 0.07 0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.28 1wte h GLU 223 CO -0.01 -0.07 0.12 0.00 -1.00 0.00 0.00 179.01 178.05 1wte h ARG 224 N -0.11 0.25 -0.62 2.33 3.08 -1.26 0.85 114.38 118.90 1wte h ARG 224 Ca 0.07 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.10 1wte h ARG 224 Cb 0.21 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.17 1wte h ARG 224 CO -0.17 0.16 0.38 0.00 -1.07 0.00 0.00 179.97 179.28 1wte h ALA 225 N 1.40 0.79 -0.06 0.04 0.00 -0.62 -0.15 119.26 120.66 1wte h ALA 225 Ca 0.26 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1wte h ALA 225 Cb 0.36 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1wte h ALA 225 CO -0.33 0.25 0.03 0.28 0.00 0.00 0.00 179.25 179.48 1wte h VAL 226 N 0.84 1.13 -0.41 0.00 2.07 -0.72 -1.32 116.25 117.83 1wte h VAL 226 Ca 0.22 -0.38 0.06 0.00 0.82 0.00 0.00 66.70 67.42 1wte h VAL 226 Cb -0.04 1.28 -0.05 0.00 -1.52 0.00 0.00 31.29 30.96 1wte h VAL 226 CO -0.04 0.11 0.11 0.50 0.02 0.00 0.00 177.57 178.27 1wte h LYS 227 N -0.05 0.25 -0.11 1.57 3.64 -0.46 -2.06 116.57 119.35 1wte h LYS 227 Ca 0.02 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.28 1wte h LYS 227 Cb 0.15 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 1wte h LYS 227 CO -0.00 0.17 -0.40 1.49 -2.27 0.00 0.00 179.45 178.43 1wte h GLU 228 N 0.26 0.23 0.00 1.90 4.57 -0.89 -3.09 114.58 117.56 1wte h GLU 228 Ca 0.19 -0.11 -0.04 0.00 -1.18 0.00 0.00 59.36 58.23 1wte h GLU 228 Cb 0.21 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.79 1wte h GLU 228 CO -0.23 0.60 -0.19 0.00 -1.18 0.00 0.00 179.01 178.01 1wte h ALA 229 N 1.39 1.08 -6.02 2.92 0.00 -0.50 -3.48 119.26 114.65 1wte h ALA 229 Ca 0.02 -0.17 -0.25 0.00 0.00 0.00 0.00 54.91 54.51 1wte h ALA 229 Cb 0.80 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.57 1wte h ALA 229 CO 0.06 0.24 -0.56 -3.47 0.00 0.00 0.00 179.25 175.52 1wte n ASP 230 N -3.44 -6.33 -0.09 0.00 4.64 -1.17 -4.93 116.55 105.23 1wte n ASP 230 Ca -0.00 -0.54 0.03 0.00 -1.38 0.00 0.00 54.79 52.89 1wte n ASP 230 Cb 0.37 -3.63 -0.01 0.00 -1.04 0.00 0.00 41.12 36.82 1wte n ASP 230 CO 0.00 0.00 0.00 2.30 -0.82 0.00 0.00 177.20 178.68 1wte n ILE 231 N -2.39 0.00 0.25 5.18 -5.35 -1.26 -4.75 119.36 111.04 1wte n ILE 231 Ca -0.14 -0.43 0.12 0.00 -0.27 0.00 0.00 62.75 62.03 1wte n ILE 231 Cb 0.59 1.05 0.65 0.00 -1.74 0.00 0.00 39.64 40.19 1wte n ILE 231 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1wte h LYS 232 N 0.45 0.00 0.00 6.28 3.64 -1.96 -2.43 116.57 122.55 1wte h LYS 232 Ca 0.00 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.20 1wte h LYS 232 Cb 0.16 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 1wte h LYS 232 CO 0.00 0.15 -1.09 0.39 -2.27 0.00 0.00 179.45 176.63 1wte n GLU 233 N -3.55 0.54 0.27 1.90 -0.58 -1.26 -4.42 120.64 113.53 1wte n GLU 233 Ca -0.01 0.56 0.15 0.00 -0.42 0.00 0.00 57.16 57.44 1wte n GLU 233 Cb 0.29 -1.73 0.69 0.00 -0.57 0.00 0.00 31.44 30.12 1wte n GLU 233 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 1wte h LYS 234 N -1.00 0.00 0.00 3.49 2.10 -1.87 -2.96 116.57 116.33 1wte h LYS 234 Ca -0.27 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.36 1wte h LYS 234 Cb 1.11 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.43 1wte h LYS 234 CO -0.16 0.08 -0.13 -0.91 -2.00 0.00 0.00 179.45 176.32 1wte h ASN 235 N 0.00 0.00 0.06 7.07 -0.26 -1.64 -2.80 115.58 118.01 1wte h ASN 235 Ca -0.00 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1wte h ASN 235 Cb 0.49 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.75 1wte h ASN 235 CO 0.01 0.13 -0.03 0.11 -1.06 0.00 0.00 177.43 176.59 1wte h LYS 236 N 0.00 -0.08 -0.49 0.81 1.57 -1.75 0.26 116.57 116.90 1wte h LYS 236 Ca -0.00 0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 58.67 1wte h LYS 236 Cb 0.67 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.98 1wte h LYS 236 CO 0.02 0.06 -0.13 0.22 -0.57 0.00 0.00 179.45 179.04 1wte h ASP 237 N -0.20 0.92 -0.55 0.86 3.58 -1.76 -2.36 116.42 116.91 1wte h ASP 237 Ca -0.01 -0.30 0.04 0.00 0.42 0.00 0.00 57.03 57.18 1wte h ASP 237 Cb 0.17 -0.25 -0.04 0.00 1.72 0.00 0.00 39.33 40.93 1wte h ASP 237 CO 0.01 1.05 0.30 -0.07 -2.88 0.00 0.00 179.24 177.66 1wte h LEU 238 N 0.82 0.46 -0.54 2.28 4.07 -1.12 -1.45 115.31 119.83 1wte h LEU 238 Ca 0.13 0.02 -0.13 0.00 0.08 0.00 0.00 57.88 57.98 1wte h LEU 238 Cb 0.67 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 42.32 1wte h LEU 238 CO 0.05 0.32 -0.22 0.40 -1.08 0.00 0.00 178.44 177.91 1wte h ILE 239 N 0.59 1.27 -0.51 1.22 2.04 -0.42 -1.67 117.51 120.03 1wte h ILE 239 Ca 0.23 -1.38 0.07 0.00 1.00 0.00 0.00 64.86 64.79 1wte h ILE 239 Cb 0.10 1.14 -0.06 0.00 -0.74 0.00 0.00 36.82 37.26 1wte h ILE 239 CO -0.14 0.47 0.19 -0.08 0.00 0.00 0.00 178.15 178.59 1wte h GLU 240 N 0.82 0.36 0.00 2.37 4.81 -1.16 -1.43 114.58 120.34 1wte h GLU 240 Ca 0.11 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.24 1wte h GLU 240 Cb 0.78 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 1wte h GLU 240 CO 0.07 0.24 -0.37 0.87 -0.73 0.00 0.00 179.01 179.08 1wte h LYS 241 N 0.37 0.00 -0.39 1.92 1.57 -1.10 -0.85 116.57 118.10 1wte h LYS 241 Ca 0.24 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.00 1wte h LYS 241 Cb 0.26 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 1wte h LYS 241 CO -0.24 0.37 0.15 0.35 -0.57 0.00 0.00 179.45 179.51 1wte h PHE 242 N 0.00 0.59 -0.07 -1.35 3.57 -0.87 -2.00 116.94 116.81 1wte h PHE 242 Ca -0.00 -0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.46 1wte h PHE 242 Cb 0.66 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.21 1wte h PHE 242 CO 0.00 0.53 0.01 -0.22 -2.23 0.00 0.00 178.31 176.39 1wte h LYS 243 N 0.48 0.03 -0.66 1.11 3.64 -0.78 -1.58 116.57 118.82 1wte h LYS 243 Ca 0.13 -0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.59 1wte h LYS 243 Cb 0.19 -0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 31.94 1wte h LYS 243 CO -0.01 0.02 0.32 0.93 -2.27 0.00 0.00 179.45 178.44 1wte h GLU 244 N 0.03 0.55 -0.48 1.90 5.08 -1.09 -1.38 114.58 119.19 1wte h GLU 244 Ca 0.03 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.40 1wte h GLU 244 Cb 0.03 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 1wte h GLU 244 CO -0.05 0.37 0.23 1.25 -1.00 0.00 0.00 179.01 179.81 1wte h HIS 245 N 0.57 0.42 -0.26 4.33 2.76 -1.07 -2.28 115.15 119.61 1wte h HIS 245 Ca 0.32 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.43 1wte h HIS 245 Cb 0.31 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 29.14 1wte h HIS 245 CO -0.11 0.20 -0.12 0.28 -1.30 0.00 0.00 177.93 176.87 1wte h VAL 246 N 0.46 1.30 -0.89 5.26 2.07 -0.53 -3.19 116.25 120.73 1wte h VAL 246 Ca 0.22 -1.20 -0.01 0.00 0.82 0.00 0.00 66.70 66.52 1wte h VAL 246 Cb 0.14 1.53 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 1wte h VAL 246 CO -0.16 0.38 0.53 0.00 0.02 0.00 0.00 177.57 178.33 1wte h ALA 247 N 0.73 1.14 0.00 1.67 0.00 -1.06 0.02 119.26 121.76 1wte h ALA 247 Ca 0.06 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1wte h ALA 247 Cb 0.63 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1wte h ALA 247 CO 0.04 0.60 0.12 0.87 0.00 0.00 0.00 179.25 180.88 1wte h LYS 248 N 1.23 0.00 0.00 0.00 1.57 -1.40 -0.34 116.57 117.63 1wte h LYS 248 Ca 0.32 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 59.02 1wte h LYS 248 Cb -0.04 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1wte h LYS 248 CO -0.06 0.00 -0.36 0.87 -0.57 0.00 0.00 179.45 179.33 1wte h LYS 249 N 0.00 0.00 0.00 3.15 1.57 -1.06 -3.35 116.57 116.88 1wte h LYS 249 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1wte h LYS 249 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1wte h LYS 249 CO 0.00 0.36 -1.04 0.66 -0.57 0.00 0.00 179.45 178.87 1wte n TYR 250 N -3.75 0.00 -0.00 -1.35 4.02 -0.58 -4.87 117.16 110.63 1wte n TYR 250 Ca -0.01 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.79 1wte n TYR 250 Cb 0.45 -0.10 -0.03 0.00 -0.02 0.00 0.00 39.34 39.63 1wte n TYR 250 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 1wte h ASN 251 N 0.00 -0.47 -0.61 7.72 -0.26 -1.25 -1.18 115.58 119.53 1wte h ASN 251 Ca 0.00 0.09 -0.04 0.00 -0.56 0.00 0.00 56.30 55.78 1wte h ASN 251 Cb 0.24 0.22 -0.03 0.00 -1.06 0.00 0.00 38.32 37.69 1wte h ASN 251 CO 0.00 -0.20 0.23 -0.33 -1.06 0.00 0.00 177.43 176.07 1wte h GLU 252 N -0.19 0.96 0.00 0.81 5.08 -1.87 -1.44 114.58 117.94 1wte h GLU 252 Ca 0.09 -0.17 -0.16 0.00 -1.00 0.00 0.00 59.36 58.12 1wte h GLU 252 Cb 0.32 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1wte h GLU 252 CO -0.24 0.81 -0.76 1.96 -1.00 0.00 0.00 179.01 179.78 1wte h GLN 253 N 0.94 0.00 0.00 2.33 7.50 -1.76 -3.39 115.11 120.72 1wte h GLN 253 Ca 0.21 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.36 1wte h GLN 253 Cb 0.23 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.76 1wte h GLN 253 CO -0.01 0.76 -0.70 1.33 -1.50 0.00 0.00 178.83 178.70 1wte n VAL 254 N -3.44 0.00 -2.65 -0.54 0.24 -0.50 -4.86 118.33 106.58 1wte n VAL 254 Ca 0.00 -0.23 -0.41 0.00 -2.04 0.00 0.00 64.34 61.66 1wte n VAL 254 Cb 0.79 0.68 -0.05 0.00 -1.47 0.00 0.00 33.84 33.79 1wte n VAL 254 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1wte s LEU 255 N -2.74 4.54 0.44 1.34 1.02 -0.57 0.02 118.68 122.73 1wte s LEU 255 Ca -0.00 1.97 -0.04 0.00 0.02 0.00 0.00 54.13 56.08 1wte s LEU 255 Cb 0.02 -3.60 -0.04 0.00 0.02 0.00 0.00 46.19 42.59 1wte s LEU 255 CO 0.13 -0.06 0.72 0.20 0.02 0.00 0.00 176.35 177.36 1wte s ASN 256 N -0.44 6.29 0.37 2.29 0.02 0.15 -4.89 114.94 118.73 1wte s ASN 256 Ca 0.46 0.80 0.13 0.00 -1.02 0.00 0.00 52.86 53.23 1wte s ASN 256 Cb -0.27 -2.19 0.94 0.00 0.02 0.00 0.00 41.25 39.76 1wte s ASN 256 CO 0.33 -0.49 1.83 0.00 0.02 0.00 0.00 177.10 178.79 1wte h ALA 257 N 0.44 2.00 0.00 0.60 0.00 -1.97 0.12 119.26 120.46 1wte h ALA 257 Ca -0.48 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1wte h ALA 257 Cb 1.21 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1wte h ALA 257 CO 0.62 -0.32 0.00 -0.40 0.00 0.00 0.00 179.25 179.15 1wte n ASP 258 N -4.60 0.00 0.00 0.00 3.85 -1.26 -4.86 116.55 109.68 1wte n ASP 258 Ca 0.21 -1.24 0.00 0.00 -0.71 0.00 0.00 54.79 53.05 1wte n ASP 258 Cb 0.65 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.42 1wte n ASP 258 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1wte n GLY 259 N 0.47 0.88 3.86 6.12 0.00 0.43 -4.99 105.19 111.97 1wte n GLY 259 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 1wte n GLY 259 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1wte s THR 260 N -3.48 2.08 0.13 2.61 -4.23 -1.26 -0.96 115.64 110.53 1wte s THR 260 Ca 0.00 0.02 0.09 0.00 -1.18 0.00 0.00 61.69 60.62 1wte s THR 260 Cb 0.00 -2.94 -0.04 0.00 1.34 0.00 0.00 72.50 70.86 1wte s THR 260 CO 0.00 -0.03 -0.15 0.00 -0.54 0.00 0.00 174.62 173.90 1wte s ALA 261 N -3.47 2.78 -0.60 3.99 0.00 -1.26 -0.67 121.76 122.52 1wte s ALA 261 Ca 0.62 -1.36 -0.24 0.00 0.00 0.00 0.00 51.96 50.98 1wte s ALA 261 Cb -0.12 -0.70 0.05 0.00 0.00 0.00 0.00 23.12 22.34 1wte s ALA 261 CO 0.50 0.58 0.99 -0.65 0.00 0.00 0.00 175.76 177.18 1wte s GLN 262 N -2.29 3.25 0.39 0.00 -0.21 0.10 -4.90 119.66 116.00 1wte s GLN 262 Ca 0.20 -0.44 0.07 0.00 0.02 0.00 0.00 55.36 55.21 1wte s GLN 262 Cb -0.10 -4.12 0.81 0.00 1.00 0.00 0.00 33.01 30.59 1wte s GLN 262 CO 0.12 -1.66 1.99 -1.49 -2.12 0.00 0.00 175.29 172.13 1wte h TRP 263 N 9.47 0.44 -0.07 0.91 -0.00 -1.98 -2.01 115.95 122.72 1wte h TRP 263 Ca -0.27 -0.01 -0.09 0.00 -0.00 0.00 0.00 58.89 58.51 1wte h TRP 263 Cb 1.07 -0.14 -0.01 0.00 -0.00 0.00 0.00 29.16 30.08 1wte h TRP 263 CO 0.95 0.37 -0.39 0.45 -0.00 0.00 0.00 178.44 179.82 1wte h HIS 264 N 0.45 0.17 -0.44 0.49 3.86 -1.94 -0.17 115.15 117.56 1wte h HIS 264 Ca 0.11 -0.04 -0.14 0.00 -1.16 0.00 0.00 60.37 59.14 1wte h HIS 264 Cb 0.12 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.54 1wte h HIS 264 CO 0.00 0.52 -0.29 0.87 0.86 0.00 0.00 177.93 179.89 1wte h LYS 265 N 0.12 0.96 -0.16 2.45 1.79 -1.72 -1.64 116.57 118.37 1wte h LYS 265 Ca 0.01 -0.44 -0.00 0.00 -2.18 0.00 0.00 60.65 58.03 1wte h LYS 265 Cb 0.75 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.38 1wte h LYS 265 CO 0.06 1.11 0.09 1.25 -1.08 0.00 0.00 179.45 180.87 1wte h LEU 266 N 0.81 0.20 -0.16 2.94 5.85 -1.14 -1.68 115.31 122.13 1wte h LEU 266 Ca 0.09 -0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.76 1wte h LEU 266 Cb 0.87 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.82 1wte h LEU 266 CO 0.08 0.23 -0.03 0.25 -0.34 0.00 0.00 178.44 178.62 1wte h LEU 267 N 0.16 -0.14 -0.39 2.25 5.85 -1.03 -1.81 115.31 120.20 1wte h LEU 267 Ca 0.06 0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.88 1wte h LEU 267 Cb 0.07 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.14 1wte h LEU 267 CO -0.01 -0.05 0.08 -0.08 -0.34 0.00 0.00 178.44 178.05 1wte h GLU 268 N 0.01 0.20 -0.65 1.25 4.81 -1.09 -0.27 114.58 118.84 1wte h GLU 268 Ca 0.08 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.33 1wte h GLU 268 Cb 0.11 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.40 1wte h GLU 268 CO -0.16 0.13 0.39 0.52 -0.73 0.00 0.00 179.01 179.17 1wte h MET 269 N 0.21 0.74 0.11 1.92 2.86 -1.15 -3.12 114.93 116.50 1wte h MET 269 Ca 0.19 -0.04 -0.28 0.00 -2.06 0.00 0.00 59.70 57.50 1wte h MET 269 Cb 0.22 -0.17 0.02 0.00 0.06 0.00 0.00 31.60 31.73 1wte h MET 269 CO -0.24 0.49 -1.20 0.82 1.06 0.00 0.00 176.91 177.84 1wte h ILE 270 N 0.76 1.37 -0.23 -1.22 2.04 -0.75 -3.37 117.51 116.11 1wte h ILE 270 Ca 0.27 -2.64 0.00 0.00 1.00 0.00 0.00 64.86 63.49 1wte h ILE 270 Cb 0.06 2.73 0.00 0.00 -0.74 0.00 0.00 36.82 38.87 1wte h ILE 270 CO -0.13 0.79 0.00 0.59 0.00 0.00 0.00 178.15 179.40 1wte n ASN 271 N -3.71 1.96 0.00 1.72 4.13 -0.16 -5.11 115.26 114.10 1wte n ASN 271 Ca -0.11 -1.79 0.00 0.00 1.68 0.00 0.00 54.58 54.36 1wte n ASN 271 Cb 0.97 -0.15 0.00 0.00 -1.54 0.00 0.00 39.78 39.06 1wte n ASN 271 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70