#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r1j s GLN 4 N 0.00 4.46 0.38 -2.82 0.74 -1.26 -5.04 119.66 116.13 2r1j s GLN 4 Ca 0.00 1.64 -0.04 0.00 0.05 0.00 0.00 55.36 57.01 2r1j s GLN 4 Cb 0.00 -3.41 -0.04 0.00 1.10 0.00 0.00 33.01 30.66 2r1j s GLN 4 CO 0.00 -0.22 0.65 -0.51 -0.55 0.00 0.00 175.29 174.67 2r1j s LEU 5 N 1.21 3.87 0.26 3.68 1.43 -1.26 -4.99 118.68 122.89 2r1j s LEU 5 Ca 0.56 0.75 -0.03 0.00 -1.03 0.00 0.00 54.13 54.37 2r1j s LEU 5 Cb -0.26 -3.63 0.37 0.00 0.03 0.00 0.00 46.19 42.70 2r1j s LEU 5 CO 0.28 -0.38 1.90 -0.03 0.23 0.00 0.00 176.35 178.35 2r1j h MET 6 N 0.85 1.20 -0.98 1.70 1.85 -1.84 -1.62 114.93 116.09 2r1j h MET 6 Ca -0.48 -0.07 0.13 0.00 -0.61 0.00 0.00 59.70 58.67 2r1j h MET 6 Cb 1.20 -0.27 -0.09 0.00 0.43 0.00 0.00 31.60 32.88 2r1j h MET 6 CO 0.63 0.79 0.61 0.78 -0.40 0.00 0.00 176.91 179.32 2r1j h GLY 7 N 1.23 1.63 1.37 1.39 0.00 -1.79 0.12 103.07 107.03 2r1j h GLY 7 Ca 0.41 -0.40 -0.11 0.00 0.00 0.00 0.00 47.33 47.23 2r1j h GLY 7 CO -0.14 0.12 -0.21 0.83 0.00 0.00 0.00 176.54 177.14 2r1j h GLU 8 N 0.93 0.73 -0.46 4.80 5.08 -1.42 -1.79 114.58 122.46 2r1j h GLU 8 Ca 0.50 -0.29 -0.12 0.00 -1.00 0.00 0.00 59.36 58.45 2r1j h GLU 8 Cb 0.55 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2r1j h GLU 8 CO -0.29 0.88 -0.21 0.00 -1.00 0.00 0.00 179.01 178.40 2r1j h ARG 9 N 0.64 0.92 -0.16 2.33 3.08 -1.00 -1.59 114.38 118.60 2r1j h ARG 9 Ca 0.09 -0.38 -0.01 0.00 0.07 0.00 0.00 59.98 59.76 2r1j h ARG 9 Cb 0.70 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.71 2r1j h ARG 9 CO 0.05 1.03 0.08 0.82 -1.07 0.00 0.00 179.97 180.88 2r1j h ILE 10 N 0.80 1.13 -0.62 2.04 2.04 -0.79 -1.21 117.51 120.90 2r1j h ILE 10 Ca 0.11 -0.38 -0.04 0.00 1.00 0.00 0.00 64.86 65.54 2r1j h ILE 10 Cb 0.76 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 37.90 2r1j h ILE 10 CO 0.06 0.12 0.22 -0.09 0.00 0.00 0.00 178.15 178.46 2r1j h ARG 11 N 0.13 0.95 -0.82 2.37 2.43 -1.29 -1.09 114.38 117.06 2r1j h ARG 11 Ca 0.06 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 2r1j h ARG 11 Cb 0.13 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 29.49 2r1j h ARG 11 CO -0.01 0.83 0.53 0.00 -1.51 0.00 0.00 179.97 179.81 2r1j h ALA 12 N 1.08 1.04 -0.35 2.80 0.00 -1.09 0.10 119.26 122.85 2r1j h ALA 12 Ca 0.20 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.92 2r1j h ALA 12 Cb 0.25 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2r1j h ALA 12 CO -0.01 0.47 -0.30 0.00 0.00 0.00 0.00 179.25 179.40 2r1j h ARG 13 N 1.12 0.74 -0.61 0.00 2.47 -0.96 -1.47 114.38 115.67 2r1j h ARG 13 Ca 0.30 -0.34 -0.07 0.00 -1.26 0.00 0.00 59.98 58.61 2r1j h ARG 13 Cb -0.11 -0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.17 2r1j h ARG 13 CO -0.06 0.95 0.09 -0.09 0.56 0.00 0.00 179.97 181.42 2r1j h ARG 14 N 0.63 1.01 -0.26 0.04 2.43 -0.59 -2.48 114.38 115.16 2r1j h ARG 14 Ca 0.07 -0.28 -0.02 0.00 -0.81 0.00 0.00 59.98 58.95 2r1j h ARG 14 Cb 0.83 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.25 2r1j h ARG 14 CO 0.07 0.95 0.08 0.87 -1.51 0.00 0.00 179.97 180.43 2r1j h LYS 15 N 0.92 0.37 -0.29 0.20 1.79 -0.52 -1.05 116.57 117.98 2r1j h LYS 15 Ca 0.18 -0.05 -0.06 0.00 -2.18 0.00 0.00 60.65 58.55 2r1j h LYS 15 Cb 0.44 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.00 2r1j h LYS 15 CO 0.01 0.33 -0.08 -0.22 -1.08 0.00 0.00 179.45 178.42 2r1j h LYS 16 N 0.37 0.47 0.00 3.15 1.63 -0.82 -1.89 116.57 119.48 2r1j h LYS 16 Ca 0.09 -0.12 -0.01 0.00 -0.85 0.00 0.00 60.65 59.77 2r1j h LYS 16 Cb 0.12 -0.06 -0.00 0.00 -0.60 0.00 0.00 32.23 31.70 2r1j h LYS 16 CO -0.01 0.56 -0.03 -0.07 -3.45 0.00 0.00 179.45 176.45 2r1j h LEU 17 N 0.44 0.00 1.39 5.20 3.38 -0.99 -3.48 115.31 121.25 2r1j h LEU 17 Ca 0.09 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.74 2r1j h LEU 17 Cb 0.41 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.18 2r1j h LEU 17 CO 0.02 0.03 -0.45 0.29 0.09 0.00 0.00 178.44 178.42 2r1j n LYS 18 N -3.11 -2.70 -4.21 1.13 5.02 -0.58 -5.03 118.16 108.68 2r1j n LYS 18 Ca 0.04 0.74 -0.24 0.00 -2.02 0.00 0.00 58.31 56.83 2r1j n LYS 18 Cb 0.53 -5.16 -0.06 0.00 -0.02 0.00 0.00 35.03 30.32 2r1j n LYS 18 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2r1j s ILE 19 N -2.93 3.84 0.72 -0.18 -4.36 -1.22 -5.06 121.20 112.01 2r1j s ILE 19 Ca 0.13 -1.61 -0.11 0.00 -0.26 0.00 0.00 60.65 58.80 2r1j s ILE 19 Cb -0.06 -3.03 0.02 0.00 1.25 0.00 0.00 42.46 40.65 2r1j s ILE 19 CO 0.16 -0.29 1.07 -0.13 0.24 0.00 0.00 174.94 176.00 2r1j s ARG 20 N -3.51 2.72 0.25 0.37 1.81 -1.26 -4.77 118.95 114.56 2r1j s ARG 20 Ca 0.31 0.78 -0.05 0.00 -1.72 0.00 0.00 55.73 55.05 2r1j s ARG 20 Cb -0.08 -1.98 0.32 0.00 -0.45 0.00 0.00 34.95 32.76 2r1j s ARG 20 CO 0.21 -1.21 1.91 1.96 -0.68 0.00 0.00 175.30 177.49 2r1j h GLN 21 N -0.79 1.23 -0.84 3.54 4.20 -2.00 -1.91 115.11 118.55 2r1j h GLN 21 Ca -0.45 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.17 2r1j h GLN 21 Cb 1.23 -0.28 -0.04 0.00 0.30 0.00 0.00 27.48 28.69 2r1j h GLN 21 CO 0.59 0.82 0.46 0.00 -0.67 0.00 0.00 178.83 180.02 2r1j h ALA 22 N 1.40 1.23 -0.49 3.87 0.00 -1.93 0.66 119.26 123.99 2r1j h ALA 22 Ca 0.39 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 55.11 2r1j h ALA 22 Cb -0.02 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 2r1j h ALA 22 CO -0.12 0.62 0.06 0.00 0.00 0.00 0.00 179.25 179.82 2r1j h ALA 23 N 1.33 0.66 -0.51 0.00 0.00 -1.78 -0.97 119.26 117.99 2r1j h ALA 23 Ca 0.30 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 2r1j h ALA 23 Cb 0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2r1j h ALA 23 CO -0.05 0.41 -0.02 1.25 0.00 0.00 0.00 179.25 180.84 2r1j h LEU 24 N 0.70 0.85 -0.60 0.00 5.85 -0.94 -2.50 115.31 118.66 2r1j h LEU 24 Ca 0.15 -0.22 0.02 0.00 0.84 0.00 0.00 57.88 58.66 2r1j h LEU 24 Cb 0.42 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 2r1j h LEU 24 CO 0.01 0.92 0.38 1.23 -0.34 0.00 0.00 178.44 180.64 2r1j h GLY 25 N 0.99 0.86 1.01 3.75 0.00 -0.40 -1.90 103.07 107.37 2r1j h GLY 25 Ca 0.15 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.19 2r1j h GLY 25 CO 0.03 0.26 0.54 1.70 0.00 0.00 0.00 176.54 179.07 2r1j h LYS 26 N 0.76 1.11 -0.46 4.80 3.64 -0.89 0.13 116.57 125.67 2r1j h LYS 26 Ca 0.23 -0.08 -0.03 0.00 -1.27 0.00 0.00 60.65 59.50 2r1j h LYS 26 Cb -0.02 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.53 2r1j h LYS 26 CO -0.08 0.75 0.16 0.52 -2.27 0.00 0.00 179.45 178.53 2r1j h MET 27 N 1.14 0.66 0.00 1.90 2.86 -0.96 -3.21 114.93 117.33 2r1j h MET 27 Ca 0.30 -0.10 -0.20 0.00 -2.06 0.00 0.00 59.70 57.64 2r1j h MET 27 Cb -0.10 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.41 2r1j h MET 27 CO -0.06 0.57 -1.40 0.28 1.06 0.00 0.00 176.91 177.36 2r1j h VAL 28 N 0.65 0.72 0.00 -2.22 2.07 -0.85 -3.49 116.25 113.14 2r1j h VAL 28 Ca 0.16 -2.34 0.00 0.00 0.82 0.00 0.00 66.70 65.34 2r1j h VAL 28 Cb 0.17 2.24 0.00 0.00 -1.52 0.00 0.00 31.29 32.19 2r1j h VAL 28 CO -0.01 0.41 0.00 0.61 0.02 0.00 0.00 177.57 178.60 2r1j n GLY 29 N 1.43 1.45 3.38 2.17 0.00 0.35 -4.87 105.19 109.10 2r1j n GLY 29 Ca -0.10 -0.02 -0.20 0.00 0.00 0.00 0.00 46.02 45.70 2r1j n GLY 29 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2r1j s VAL 30 N -2.00 0.54 0.72 1.61 -7.23 -0.69 -5.04 120.40 108.31 2r1j s VAL 30 Ca 0.00 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.06 2r1j s VAL 30 Cb 0.00 -2.55 0.02 0.00 0.56 0.00 0.00 36.38 34.42 2r1j s VAL 30 CO 0.00 0.00 1.09 -0.94 -0.31 0.00 0.00 175.10 174.94 2r1j s SER 31 N -3.42 5.25 0.41 4.85 1.04 -1.26 -3.98 113.70 116.58 2r1j s SER 31 Ca 0.34 1.27 0.11 0.00 0.48 0.00 0.00 55.95 58.14 2r1j s SER 31 Cb 0.06 -2.08 0.87 0.00 0.10 0.00 0.00 66.02 64.96 2r1j s SER 31 CO 0.16 -1.48 1.96 -0.55 0.98 0.00 0.00 173.24 174.30 2r1j h ASN 32 N -0.75 0.19 -0.70 7.02 -1.07 -1.86 -2.43 115.58 115.97 2r1j h ASN 32 Ca -0.45 -0.03 -0.05 0.00 0.07 0.00 0.00 56.30 55.83 2r1j h ASN 32 Cb 1.25 -0.05 -0.03 0.00 -2.07 0.00 0.00 38.32 37.42 2r1j h ASN 32 CO 0.62 0.31 0.23 0.58 0.07 0.00 0.00 177.43 179.23 2r1j h VAL 33 N 0.20 1.26 -0.88 6.14 2.07 -1.92 -1.35 116.25 121.76 2r1j h VAL 33 Ca 0.04 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.68 2r1j h VAL 33 Cb 0.30 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 2r1j h VAL 33 CO 0.02 0.34 0.55 0.00 0.02 0.00 0.00 177.57 178.50 2r1j h ALA 34 N 1.11 1.12 -0.32 1.67 0.00 -1.81 0.92 119.26 121.95 2r1j h ALA 34 Ca 0.23 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.06 2r1j h ALA 34 Cb 0.30 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2r1j h ALA 34 CO -0.01 0.55 0.19 0.82 0.00 0.00 0.00 179.25 180.81 2r1j h ILE 35 N 1.20 1.05 -0.69 0.00 1.08 -1.25 -0.14 117.51 118.76 2r1j h ILE 35 Ca 0.32 -0.14 0.04 0.00 -0.39 0.00 0.00 64.86 64.69 2r1j h ILE 35 Cb -0.09 0.62 -0.05 0.00 -3.07 0.00 0.00 36.82 34.24 2r1j h ILE 35 CO -0.06 0.07 0.42 -1.28 -0.69 0.00 0.00 178.15 176.61 2r1j h SER 36 N 0.40 0.67 -0.52 1.72 0.87 -0.79 0.18 113.55 116.07 2r1j h SER 36 Ca 0.12 0.01 -0.08 0.00 -1.23 0.00 0.00 61.79 60.61 2r1j h SER 36 Cb -0.02 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 61.78 2r1j h SER 36 CO -0.05 0.46 0.05 1.56 -0.53 0.00 0.00 176.83 178.32 2r1j h GLN 37 N 0.80 0.94 -0.48 2.24 4.20 -0.33 -1.93 115.11 120.55 2r1j h GLN 37 Ca 0.28 -0.25 -0.12 0.00 0.06 0.00 0.00 58.65 58.63 2r1j h GLN 37 Cb 0.06 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 2r1j h GLN 37 CO -0.13 0.89 -0.15 -1.49 -0.67 0.00 0.00 178.83 177.29 2r1j h TRP 38 N 0.88 1.07 -0.26 2.96 6.55 -0.45 -0.79 115.95 125.91 2r1j h TRP 38 Ca 0.17 -0.24 -0.09 0.00 0.95 0.00 0.00 58.89 59.68 2r1j h TRP 38 Cb 0.44 -0.26 -0.01 0.00 -0.86 0.00 0.00 29.16 28.47 2r1j h TRP 38 CO 0.03 1.04 -0.23 0.93 -1.05 0.00 0.00 178.44 179.16 2r1j h GLU 39 N 0.80 0.48 -0.12 0.49 5.08 -0.75 -2.33 114.58 118.23 2r1j h GLU 39 Ca 0.12 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2r1j h GLU 39 Cb 0.72 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.93 2r1j h GLU 39 CO 0.05 0.68 0.00 0.54 -1.00 0.00 0.00 179.01 179.29 2r1j n ARG 40 N -4.14 1.47 -2.28 2.33 1.74 -0.75 -3.96 116.66 111.08 2r1j n ARG 40 Ca -0.00 -0.71 -0.20 0.00 -0.77 0.00 0.00 57.85 56.17 2r1j n ARG 40 Cb 0.39 -1.33 -0.02 0.00 -1.02 0.00 0.00 32.46 30.48 2r1j n ARG 40 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2r1j n SER 41 N -0.05 -5.61 0.06 0.55 7.64 -0.88 -4.89 113.62 110.44 2r1j n SER 41 Ca 0.14 0.04 -0.16 0.00 1.01 0.00 0.00 58.87 59.90 2r1j n SER 41 Cb 0.23 -4.67 -0.07 0.00 -1.01 0.00 0.00 64.21 58.69 2r1j n SER 41 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 2r1j h GLU 42 N 0.00 0.53 -4.45 1.43 4.81 -1.40 -3.47 114.58 112.03 2r1j h GLU 42 Ca -0.46 -0.57 -0.22 0.00 -0.13 0.00 0.00 59.36 57.98 2r1j h GLU 42 Cb 1.34 0.16 -0.14 0.00 0.63 0.00 0.00 28.75 30.74 2r1j h GLU 42 CO 0.56 1.20 -0.53 0.95 -0.73 0.00 0.00 179.01 180.45 2r1j s THR 43 N -3.29 0.00 0.05 0.32 -4.23 -1.17 -5.04 115.64 102.28 2r1j s THR 43 Ca -0.07 -1.91 0.09 0.00 -1.18 0.00 0.00 61.69 58.62 2r1j s THR 43 Cb 0.08 -2.46 -0.03 0.00 1.34 0.00 0.00 72.50 71.43 2r1j s THR 43 CO 0.89 0.00 -0.24 -1.61 -0.54 0.00 0.00 174.62 173.12 2r1j s GLU 44 N -4.10 1.59 0.52 3.99 2.02 -1.26 -4.22 118.70 117.25 2r1j s GLU 44 Ca 0.36 -1.07 -0.22 0.00 0.02 0.00 0.00 54.97 54.06 2r1j s GLU 44 Cb 0.06 -1.78 -0.06 0.00 0.10 0.00 0.00 34.13 32.45 2r1j s GLU 44 CO 0.12 0.45 1.35 -1.25 0.02 0.00 0.00 175.26 175.96 2r1j s PRO 45 N -1.31 3.28 0.90 0.39 0.04 -1.26 -5.02 135.00 132.03 2r1j s PRO 45 Ca 0.10 2.22 -0.15 0.00 0.04 0.00 0.00 61.00 63.21 2r1j s PRO 45 Cb -0.10 -2.33 0.22 0.00 0.04 0.00 0.00 34.50 32.33 2r1j s PRO 45 CO 0.02 -1.07 0.95 0.27 0.04 0.00 0.00 177.00 177.21 2r1j n ASN 46 N -0.85 -1.12 0.26 6.66 0.23 -1.26 -4.61 115.26 114.57 2r1j n ASN 46 Ca 0.09 -1.17 -0.16 0.00 -0.53 0.00 0.00 54.58 52.81 2r1j n ASN 46 Cb 0.45 -0.81 -0.08 0.00 -2.08 0.00 0.00 39.78 37.26 2r1j n ASN 46 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2r1j h GLY 47 N -1.93 -0.85 1.02 4.83 0.00 -1.99 0.33 103.07 104.48 2r1j h GLY 47 Ca -0.33 0.39 -0.02 0.00 0.00 0.00 0.00 47.33 47.37 2r1j h GLY 47 CO 0.23 -0.31 0.48 -2.09 0.00 0.00 0.00 176.54 174.85 2r1j h GLU 48 N -0.77 1.21 -0.06 4.80 4.81 -2.00 -2.39 114.58 120.19 2r1j h GLU 48 Ca -0.04 -0.14 -0.13 0.00 -0.13 0.00 0.00 59.36 58.92 2r1j h GLU 48 Cb 0.67 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 2r1j h GLU 48 CO -0.01 0.88 -0.54 -0.91 -0.73 0.00 0.00 179.01 177.70 2r1j h ASN 49 N 1.22 0.18 -0.38 1.04 2.35 -1.88 -1.83 115.58 116.28 2r1j h ASN 49 Ca 0.31 -0.09 -0.04 0.00 -0.55 0.00 0.00 56.30 55.92 2r1j h ASN 49 Cb 0.02 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 2r1j h ASN 49 CO -0.05 0.69 0.08 0.25 -1.65 0.00 0.00 177.43 176.74 2r1j h LEU 50 N 0.13 0.58 -0.40 1.61 5.85 -0.54 0.13 115.31 122.66 2r1j h LEU 50 Ca 0.00 -0.25 -0.04 0.00 0.84 0.00 0.00 57.88 58.43 2r1j h LEU 50 Cb 1.00 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.86 2r1j h LEU 50 CO 0.08 0.68 0.08 -0.07 -0.34 0.00 0.00 178.44 178.87 2r1j h LEU 51 N 0.46 0.63 -0.87 2.25 -0.00 -1.31 -0.12 115.31 116.36 2r1j h LEU 51 Ca 0.12 -0.25 -0.04 0.00 -0.00 0.00 0.00 57.88 57.71 2r1j h LEU 51 Cb 0.33 -0.17 -0.03 0.00 -0.00 0.00 0.00 40.66 40.79 2r1j h LEU 51 CO 0.00 0.71 0.31 0.00 -0.00 0.00 0.00 178.44 179.47 2r1j h ALA 52 N 0.94 1.10 -0.60 1.53 0.00 -1.19 -2.19 119.26 118.86 2r1j h ALA 52 Ca 0.12 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 2r1j h ALA 52 Cb 0.34 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2r1j h ALA 52 CO 0.00 0.64 0.05 1.25 0.00 0.00 0.00 179.25 181.20 2r1j h LEU 53 N 1.12 0.99 -1.09 0.00 5.85 -0.52 -1.75 115.31 119.90 2r1j h LEU 53 Ca 0.26 -0.28 -0.04 0.00 0.84 0.00 0.00 57.88 58.66 2r1j h LEU 53 Cb 0.20 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 2r1j h LEU 53 CO -0.02 1.02 0.22 0.77 -0.34 0.00 0.00 178.44 180.09 2r1j h SER 54 N 0.92 0.80 -0.27 1.25 4.64 -0.59 -0.78 113.55 119.51 2r1j h SER 54 Ca 0.18 -0.11 -0.10 0.00 -0.47 0.00 0.00 61.79 61.28 2r1j h SER 54 Cb 0.49 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2r1j h SER 54 CO 0.02 0.73 -0.24 0.11 -0.87 0.00 0.00 176.83 176.58 2r1j h LYS 55 N 0.85 0.64 -0.36 4.77 1.57 -1.16 -1.34 116.57 121.54 2r1j h LYS 55 Ca 0.20 -0.33 -0.03 0.00 -1.87 0.00 0.00 60.65 58.62 2r1j h LYS 55 Cb 0.19 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 2r1j h LYS 55 CO -0.02 0.93 0.10 0.00 -0.57 0.00 0.00 179.45 179.89 2r1j h ALA 56 N 0.70 1.50 -0.08 3.86 0.00 -0.95 -2.16 119.26 122.14 2r1j h ALA 56 Ca 0.05 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2r1j h ALA 56 Cb 0.79 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2r1j h ALA 56 CO 0.06 0.37 0.00 1.28 0.00 0.00 0.00 179.25 180.96 2r1j n LEU 57 N -4.35 1.65 -3.54 0.00 4.77 -0.33 -4.96 117.00 110.24 2r1j n LEU 57 Ca 0.02 -0.61 -0.19 0.00 -0.03 0.00 0.00 56.01 55.20 2r1j n LEU 57 Cb 0.17 -0.04 0.07 0.00 -2.33 0.00 0.00 43.42 41.29 2r1j n LEU 57 CO 0.37 0.31 0.06 0.00 -1.33 0.00 0.00 177.39 176.80 2r1j n GLN 58 N 0.30 -6.15 -4.02 3.23 6.02 -0.67 -4.97 117.38 111.10 2r1j n GLN 58 Ca 0.18 0.77 -0.12 0.00 -0.01 0.00 0.00 57.00 57.81 2r1j n GLN 58 Cb 0.36 -5.64 -0.03 0.00 1.02 0.00 0.00 30.24 25.94 2r1j n GLN 58 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2r1j s SER 60 N -3.15 6.37 0.33 0.00 1.04 -1.26 -4.37 113.70 112.66 2r1j s SER 60 Ca 0.26 0.97 0.04 0.00 0.48 0.00 0.00 55.95 57.70 2r1j s SER 60 Cb -0.01 -2.26 0.57 0.00 0.10 0.00 0.00 66.02 64.42 2r1j s SER 60 CO 0.16 -0.47 1.84 -0.65 0.98 0.00 0.00 173.24 175.10 2r1j h PRO 61 N 0.76 0.50 -0.67 4.02 0.11 -1.92 -2.44 132.00 132.37 2r1j h PRO 61 Ca -0.47 -0.12 -0.05 0.00 0.11 0.00 0.00 66.00 65.46 2r1j h PRO 61 Cb 1.20 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 2r1j h PRO 61 CO 0.63 0.58 0.21 -0.44 -0.21 0.00 0.00 178.00 178.76 2r1j h ASP 62 N 0.48 0.95 -0.17 -2.05 3.45 -1.98 -0.68 116.42 116.42 2r1j h ASP 62 Ca 0.10 -0.17 0.01 0.00 0.43 0.00 0.00 57.03 57.40 2r1j h ASP 62 Cb 0.41 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 38.92 2r1j h ASP 62 CO 0.02 0.89 0.09 0.22 -1.57 0.00 0.00 179.24 178.89 2r1j h TYR 63 N 0.98 0.18 -0.32 4.55 3.20 -1.74 0.52 116.97 124.34 2r1j h TYR 63 Ca 0.22 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 2r1j h TYR 63 Cb 0.28 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 2r1j h TYR 63 CO 0.02 0.11 0.14 -0.07 -1.64 0.00 0.00 178.16 176.72 2r1j h LEU 64 N 0.20 0.43 -0.13 2.82 3.38 -1.24 0.73 115.31 121.50 2r1j h LEU 64 Ca 0.06 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 2r1j h LEU 64 Cb -0.00 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2r1j h LEU 64 CO -0.03 0.45 0.06 -0.07 0.09 0.00 0.00 178.44 178.94 2r1j h LEU 65 N 0.38 0.17 -2.12 1.67 3.38 -0.87 -3.38 115.31 114.53 2r1j h LEU 65 Ca 0.11 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2r1j h LEU 65 Cb 0.15 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2r1j h LEU 65 CO -0.01 0.26 -0.22 2.29 0.09 0.00 0.00 178.44 180.85 2r1j n LYS 66 N -4.91 0.64 -1.28 1.13 2.85 0.15 -4.68 118.16 112.05 2r1j n LYS 66 Ca -0.05 -1.30 0.00 0.00 -1.05 0.00 0.00 58.31 55.91 2r1j n LYS 66 Cb 0.10 -0.78 0.00 0.00 -0.65 0.00 0.00 35.03 33.70 2r1j n LYS 66 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2r1j n GLY 67 N -0.38 -4.53 3.69 2.58 0.00 0.26 -4.97 105.19 101.83 2r1j n GLY 67 Ca 0.04 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.50 2r1j n GLY 67 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54