#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2crn s SER 2 N 0.00 -0.09 0.13 1.61 1.04 -1.26 -5.06 113.70 110.07 2crn s SER 2 Ca 0.00 -0.64 -0.33 0.00 0.48 0.00 0.00 55.95 55.47 2crn s SER 2 Cb 0.00 0.57 -0.11 0.00 0.10 0.00 0.00 66.02 66.58 2crn s SER 2 CO 0.00 -1.09 1.55 0.28 0.98 0.00 0.00 173.24 174.96 2crn h SER 3 N 2.00 -1.76 0.00 7.02 0.02 -2.10 -3.47 113.55 115.25 2crn h SER 3 Ca -0.26 0.23 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 2crn h SER 3 Cb 1.23 0.71 0.00 0.00 0.14 0.00 0.00 62.40 64.48 2crn h SER 3 CO 0.32 -0.44 0.00 0.61 -1.14 0.00 0.00 176.83 176.18 2crn n GLY 4 N -1.41 2.06 3.75 -3.77 0.00 -1.26 -5.07 105.19 99.50 2crn n GLY 4 Ca -0.04 -0.59 -0.40 0.00 0.00 0.00 0.00 46.02 44.99 2crn n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2crn s SER 5 N -4.00 7.51 0.31 1.61 1.04 -1.26 -5.05 113.70 113.86 2crn s SER 5 Ca 0.00 2.04 0.04 0.00 0.48 0.00 0.00 55.95 58.51 2crn s SER 5 Cb 0.00 -2.61 -0.04 0.00 0.10 0.00 0.00 66.02 63.47 2crn s SER 5 CO 0.00 0.04 0.18 -0.55 0.98 0.00 0.00 173.24 173.89 2crn s SER 6 N -0.98 1.57 -0.02 7.02 0.15 -1.26 -5.08 113.70 115.10 2crn s SER 6 Ca 0.43 -1.59 -0.25 0.00 0.70 0.00 0.00 55.95 55.24 2crn s SER 6 Cb -0.28 0.43 -0.19 0.00 -1.71 0.00 0.00 66.02 64.27 2crn s SER 6 CO 0.35 -0.92 1.21 1.23 1.20 0.00 0.00 173.24 176.31 2crn h GLY 7 N 2.19 -0.11 -5.17 9.45 0.00 -2.08 -3.44 103.07 103.91 2crn h GLY 7 Ca -0.32 0.04 -0.68 0.00 0.00 0.00 0.00 47.33 46.37 2crn h GLY 7 CO 0.50 -0.04 -0.76 -0.56 0.00 0.00 0.00 176.54 175.68 2crn s SER 8 N -5.54 4.11 -0.16 0.19 0.01 -1.26 -5.12 113.70 105.93 2crn s SER 8 Ca -0.15 -0.21 -0.20 0.00 1.31 0.00 0.00 55.95 56.70 2crn s SER 8 Cb 0.02 -1.14 0.05 0.00 0.21 0.00 0.00 66.02 65.16 2crn s SER 8 CO 0.62 0.29 0.53 -0.55 0.41 0.00 0.00 173.24 174.54 2crn s SER 9 N -0.38 -0.53 0.00 2.44 0.15 -1.26 -5.02 113.70 109.09 2crn s SER 9 Ca 0.04 0.93 0.12 0.00 0.70 0.00 0.00 55.95 57.75 2crn s SER 9 Cb -0.12 0.95 0.71 0.00 -1.71 0.00 0.00 66.02 65.85 2crn s SER 9 CO 0.02 -0.26 1.14 -0.81 1.20 0.00 0.00 173.24 174.53 2crn n PRO 10 N 2.41 0.49 0.00 5.44 -0.04 -1.26 -4.06 135.00 137.98 2crn n PRO 10 Ca -0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 2crn n PRO 10 Cb 0.56 -1.38 0.00 0.00 -0.04 0.00 0.00 33.50 32.64 2crn n PRO 10 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2crn n SER 11 N -0.88 0.00 0.11 3.54 3.41 -1.26 0.39 113.62 118.92 2crn n SER 11 Ca 0.09 0.76 0.07 0.00 -0.26 0.00 0.00 58.87 59.53 2crn n SER 11 Cb 0.04 -0.26 0.36 0.00 -0.26 0.00 0.00 64.21 64.09 2crn n SER 11 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2crn n LEU 12 N -1.61 0.34 0.05 1.04 4.32 -1.26 -0.54 117.00 119.34 2crn n LEU 12 Ca 0.00 0.65 -0.05 0.00 -0.02 0.00 0.00 56.01 56.58 2crn n LEU 12 Cb 0.00 -0.68 -0.10 0.00 -1.62 0.00 0.00 43.42 41.02 2crn n LEU 12 CO 0.00 -0.76 -0.04 -0.07 -1.22 0.00 0.00 177.39 175.29 2crn h LEU 13 N 0.00 0.00 -0.83 2.23 -0.00 -1.43 -3.30 115.31 111.98 2crn h LEU 13 Ca 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 57.88 57.97 2crn h LEU 13 Cb 0.06 0.00 -0.12 0.00 -0.00 0.00 0.00 40.66 40.61 2crn h LEU 13 CO 0.00 0.88 -0.53 -0.33 -0.00 0.00 0.00 178.44 178.46 2crn h GLU 14 N 0.00 -0.10 -0.37 1.13 4.39 0.25 1.99 114.58 121.87 2crn h GLU 14 Ca -0.10 0.01 -0.16 0.00 0.34 0.00 0.00 59.36 59.45 2crn h GLU 14 Cb 1.76 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 30.43 2crn h GLU 14 CO 0.10 -0.07 -0.39 -1.00 -1.16 0.00 0.00 179.01 176.49 2crn h PRO 15 N -0.10 0.91 0.00 2.33 0.13 -1.74 0.04 132.00 133.57 2crn h PRO 15 Ca 0.18 -0.48 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2crn h PRO 15 Cb 0.49 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.64 2crn h PRO 15 CO -0.85 1.13 0.00 1.28 -0.23 0.00 0.00 178.00 179.33 2crn n LEU 16 N -4.05 0.46 -0.12 1.56 4.77 -0.35 -2.40 117.00 116.86 2crn n LEU 16 Ca -0.02 0.59 -0.26 0.00 -0.03 0.00 0.00 56.01 56.29 2crn n LEU 16 Cb 0.55 -0.50 -0.11 0.00 -2.33 0.00 0.00 43.42 41.03 2crn n LEU 16 CO 0.48 -0.35 -1.22 0.18 -1.33 0.00 0.00 177.39 175.16 2crn n LEU 17 N -1.98 2.11 0.28 2.23 4.77 0.66 -3.09 117.00 121.98 2crn n LEU 17 Ca 0.04 0.28 0.19 0.00 -0.03 0.00 0.00 56.01 56.49 2crn n LEU 17 Cb 0.26 -0.88 0.93 0.00 -2.33 0.00 0.00 43.42 41.41 2crn n LEU 17 CO 0.21 0.58 1.05 0.00 -1.33 0.00 0.00 177.39 177.90 2crn h ALA 18 N -0.70 1.00 0.00 -1.18 0.00 -1.02 -1.07 119.26 116.29 2crn h ALA 18 Ca -0.60 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.21 2crn h ALA 18 Cb 1.61 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.39 2crn h ALA 18 CO -0.31 0.00 -0.48 0.52 0.00 0.00 0.00 179.25 178.98 2crn h MET 19 N 0.00 0.00 0.00 0.00 2.86 -1.66 -3.47 114.93 112.66 2crn h MET 19 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2crn h MET 19 Cb 0.14 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.80 2crn h MET 19 CO 0.00 0.48 0.00 0.41 1.06 0.00 0.00 176.91 178.86 2crn n GLY 20 N 0.87 1.46 3.77 8.32 0.00 -0.40 -5.11 105.19 114.09 2crn n GLY 20 Ca 0.01 -0.13 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 2crn n GLY 20 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2crn s PHE 21 N -0.36 2.87 0.00 1.61 0.08 -1.18 -4.70 117.98 116.30 2crn s PHE 21 Ca 0.00 1.31 0.00 0.00 0.12 0.00 0.00 56.93 58.36 2crn s PHE 21 Cb 0.00 -3.82 0.00 0.00 -0.57 0.00 0.00 43.02 38.63 2crn s PHE 21 CO 0.00 -2.31 0.00 -0.35 -0.10 0.00 0.00 175.22 172.46 2crn n PRO 22 N 0.68 0.23 -0.08 0.24 -0.04 -1.26 -4.00 135.00 130.78 2crn n PRO 22 Ca 0.00 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.37 2crn n PRO 22 Cb 0.41 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.82 2crn n PRO 22 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2crn h VAL 23 N -0.89 0.39 -0.98 0.52 2.07 -1.95 -2.85 116.25 112.56 2crn h VAL 23 Ca 0.00 -1.42 0.22 0.00 0.82 0.00 0.00 66.70 66.32 2crn h VAL 23 Cb 0.00 0.86 -0.09 0.00 -1.52 0.00 0.00 31.29 30.55 2crn h VAL 23 CO 0.00 0.13 0.63 1.12 0.02 0.00 0.00 177.57 179.47 2crn h HIS 24 N -1.00 0.72 0.13 1.57 -0.00 -1.99 0.15 115.15 114.73 2crn h HIS 24 Ca -0.09 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.30 2crn h HIS 24 Cb 0.66 -0.22 0.00 0.00 -0.00 0.00 0.00 27.41 27.85 2crn h HIS 24 CO -0.05 0.14 -0.06 1.15 -0.00 0.00 0.00 177.93 179.11 2crn h THR 25 N 0.50 0.70 -0.81 6.12 2.02 -1.94 -2.86 112.91 116.64 2crn h THR 25 Ca 0.54 -1.23 0.20 0.00 0.77 0.00 0.00 66.41 66.69 2crn h THR 25 Cb 1.21 1.24 -0.05 0.00 -1.74 0.00 0.00 68.15 68.80 2crn h THR 25 CO -0.27 0.20 0.56 0.00 0.37 0.00 0.00 175.52 176.38 2crn h ALA 26 N -0.52 2.39 -0.20 6.16 0.00 -1.16 -0.44 119.26 125.48 2crn h ALA 26 Ca -0.02 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 2crn h ALA 26 Cb 0.47 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 2crn h ALA 26 CO 0.03 -0.63 -0.23 -0.07 0.00 0.00 0.00 179.25 178.35 2crn h LEU 27 N 0.24 0.55 -0.17 0.00 3.38 -0.77 -2.28 115.31 116.26 2crn h LEU 27 Ca 0.41 -0.49 0.04 0.00 0.09 0.00 0.00 57.88 57.92 2crn h LEU 27 Cb 1.21 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 2crn h LEU 27 CO -0.10 0.93 -0.07 0.11 0.09 0.00 0.00 178.44 179.40 2crn h LYS 28 N 0.19 -0.05 -0.86 1.13 1.57 -0.85 -0.03 116.57 117.67 2crn h LYS 28 Ca 0.03 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 2crn h LYS 28 Cb 0.78 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.06 2crn h LYS 28 CO 0.06 -0.03 0.50 0.00 -0.57 0.00 0.00 179.45 179.41 2crn h ALA 29 N 1.11 1.10 0.58 3.86 0.00 -1.47 -0.52 119.26 123.92 2crn h ALA 29 Ca 0.09 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2crn h ALA 29 Cb 0.19 -0.35 0.01 0.00 0.00 0.00 0.00 17.79 17.64 2crn h ALA 29 CO -0.20 0.58 -0.28 -0.07 0.00 0.00 0.00 179.25 179.27 2crn h LEU 30 N 1.19 -0.66 -1.52 0.00 3.38 -0.79 -0.17 115.31 116.74 2crn h LEU 30 Ca 0.31 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.31 2crn h LEU 30 Cb -0.02 0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2crn h LEU 30 CO -0.05 -0.44 0.35 0.00 0.09 0.00 0.00 178.44 178.39 2crn h ALA 31 N -0.42 1.71 0.68 1.53 0.00 -0.92 0.23 119.26 122.07 2crn h ALA 31 Ca -0.08 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 2crn h ALA 31 Cb 0.62 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.23 2crn h ALA 31 CO 0.13 0.23 -0.33 0.00 0.00 0.00 0.00 179.25 179.29 2crn h ALA 32 N 1.69 -0.96 -0.15 0.00 0.00 -0.82 -3.30 119.26 115.72 2crn h ALA 32 Ca 0.21 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.95 2crn h ALA 32 Cb 0.06 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2crn h ALA 32 CO -0.05 -0.89 -0.06 1.79 0.00 0.00 0.00 179.25 180.03 2crn h THR 33 N -1.18 0.79 0.00 0.00 1.35 -0.90 -3.46 112.91 109.50 2crn h THR 33 Ca -0.09 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 2crn h THR 33 Cb 0.70 0.79 0.00 0.00 -1.73 0.00 0.00 68.15 67.92 2crn h THR 33 CO 0.15 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.03 2crn n GLY 34 N -1.20 0.35 3.92 5.82 0.00 -0.04 -4.83 105.19 109.21 2crn n GLY 34 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 2crn n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2crn n ARG 35 N 0.00 -0.85 -0.06 1.61 1.74 0.60 -4.81 116.66 114.89 2crn n ARG 35 Ca 0.00 0.09 -0.03 0.00 -0.77 0.00 0.00 57.85 57.14 2crn n ARG 35 Cb 0.00 -3.33 -0.01 0.00 -1.02 0.00 0.00 32.46 28.10 2crn n ARG 35 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2crn h LYS 36 N -0.92 0.00 -3.22 5.56 1.79 -1.88 -3.51 116.57 114.40 2crn h LYS 36 Ca -0.50 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 57.90 2crn h LYS 36 Cb 1.10 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.74 2crn h LYS 36 CO 0.64 0.00 0.19 -0.08 -1.08 0.00 0.00 179.45 179.13 2crn s THR 37 N -1.94 0.00 -0.03 -0.16 -1.32 -1.26 -5.07 115.64 105.86 2crn s THR 37 Ca -0.09 -1.11 -0.26 0.00 -1.21 0.00 0.00 61.69 59.02 2crn s THR 37 Cb 0.01 -2.91 -0.20 0.00 -1.51 0.00 0.00 72.50 67.89 2crn s THR 37 CO 0.13 0.00 1.18 0.00 -2.21 0.00 0.00 174.62 173.72 2crn h ALA 38 N 2.01 -0.04 -0.39 11.08 0.00 -1.98 -3.28 119.26 126.66 2crn h ALA 38 Ca -0.32 -0.26 0.06 0.00 0.00 0.00 0.00 54.91 54.38 2crn h ALA 38 Cb 1.25 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.97 2crn h ALA 38 CO 0.42 -0.25 -0.49 1.49 0.00 0.00 0.00 179.25 180.42 2crn h GLU 39 N -0.59 -0.36 -0.98 0.00 4.81 -1.97 0.59 114.58 116.08 2crn h GLU 39 Ca -0.00 0.02 0.32 0.00 -0.13 0.00 0.00 59.36 59.57 2crn h GLU 39 Cb 0.54 0.08 -0.17 0.00 0.63 0.00 0.00 28.75 29.83 2crn h GLU 39 CO 0.01 -0.24 0.27 0.93 -0.73 0.00 0.00 179.01 179.25 2crn h GLU 40 N -0.37 0.05 -0.62 1.92 3.07 -1.99 0.87 114.58 117.52 2crn h GLU 40 Ca 0.11 -0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.94 2crn h GLU 40 Cb 0.60 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.47 2crn h GLU 40 CO -0.58 0.03 0.29 0.00 -1.40 0.00 0.00 179.01 177.36 2crn h ALA 41 N 1.95 0.80 -0.75 3.43 0.00 -0.96 -2.48 119.26 121.27 2crn h ALA 41 Ca 0.69 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 55.55 2crn h ALA 41 Cb 1.60 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 19.10 2crn h ALA 41 CO -0.81 0.37 0.49 -0.07 0.00 0.00 0.00 179.25 179.23 2crn h LEU 42 N 0.85 0.61 -1.11 0.00 -0.00 0.13 0.11 115.31 115.89 2crn h LEU 42 Ca 0.21 0.01 -0.09 0.00 -0.00 0.00 0.00 57.88 58.02 2crn h LEU 42 Cb 0.13 -0.12 -0.01 0.00 -0.00 0.00 0.00 40.66 40.67 2crn h LEU 42 CO -0.03 0.37 -0.42 0.00 -0.00 0.00 0.00 178.44 178.36 2crn h ALA 43 N 1.62 1.20 0.00 1.53 0.00 -0.96 -0.23 119.26 122.42 2crn h ALA 43 Ca 0.34 -0.38 -0.14 0.00 0.00 0.00 0.00 54.91 54.72 2crn h ALA 43 Cb 0.42 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2crn h ALA 43 CO -0.12 0.53 -0.95 2.35 0.00 0.00 0.00 179.25 181.05 2crn h TRP 44 N 0.00 0.00 0.09 0.00 7.01 -0.73 -3.20 115.95 119.12 2crn h TRP 44 Ca -0.00 0.00 -0.28 0.00 2.11 0.00 0.00 58.89 60.71 2crn h TRP 44 Cb 0.79 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.84 2crn h TRP 44 CO 0.00 0.58 -1.41 -0.07 -2.79 0.00 0.00 178.44 174.75 2crn h LEU 45 N 0.00 0.31 -1.15 0.65 3.38 -0.66 -1.96 115.31 115.88 2crn h LEU 45 Ca -0.08 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2crn h LEU 45 Cb 1.51 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 42.16 2crn h LEU 45 CO 0.06 1.33 0.00 0.45 0.09 0.00 0.00 178.44 180.38 2crn h HIS 46 N 0.05 0.00 0.00 1.13 3.86 -1.15 0.20 115.15 119.24 2crn h HIS 46 Ca -0.19 0.00 -0.32 0.00 -1.16 0.00 0.00 60.37 58.70 2crn h HIS 46 Cb 1.97 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 30.38 2crn h HIS 46 CO 0.05 0.00 -2.21 -3.47 0.86 0.00 0.00 177.93 173.16 2crn n ASP 47 N -3.07 0.16 -0.08 2.45 -0.08 -1.21 -4.48 116.55 110.24 2crn n ASP 47 Ca 0.01 0.08 -0.14 0.00 -1.51 0.00 0.00 54.79 53.23 2crn n ASP 47 Cb 0.35 0.91 -0.09 0.00 2.34 0.00 0.00 41.12 44.63 2crn n ASP 47 CO 0.00 0.00 0.00 0.45 0.12 0.00 0.00 177.20 177.77 2crn h HIS 48 N 0.00 0.00 -0.88 -0.67 3.86 -1.26 -3.36 115.15 112.84 2crn h HIS 48 Ca -0.44 0.00 0.33 0.00 -1.16 0.00 0.00 60.37 59.10 2crn h HIS 48 Cb 2.07 0.00 -0.12 0.00 1.06 0.00 0.00 27.41 30.42 2crn h HIS 48 CO 0.00 0.93 0.53 0.00 0.86 0.00 0.00 177.93 180.25 2crn h ASN 50 N 0.00 -0.16 -1.70 0.00 -1.24 -1.78 -3.44 115.58 107.25 2crn h ASN 50 Ca 0.64 0.00 -0.61 0.00 0.71 0.00 0.00 56.30 57.05 2crn h ASN 50 Cb 1.89 0.04 0.16 0.00 0.73 0.00 0.00 38.32 41.14 2crn h ASN 50 CO -0.46 -0.11 -0.97 0.47 -1.29 0.00 0.00 177.43 175.06 2crn n ASP 51 N -5.17 -2.96 0.16 1.15 8.00 0.44 -4.85 116.55 113.32 2crn n ASP 51 Ca -0.08 0.77 0.00 0.00 0.71 0.00 0.00 54.79 56.19 2crn n ASP 51 Cb 0.10 -0.86 0.26 0.00 -0.02 0.00 0.00 41.12 40.60 2crn n ASP 51 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 2crn h PRO 52 N 0.27 0.02 0.00 -0.24 0.13 -1.86 -2.85 132.00 127.47 2crn h PRO 52 Ca -0.37 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 2crn h PRO 52 Cb 1.43 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.56 2crn h PRO 52 CO 0.45 0.50 0.05 0.43 -0.23 0.00 0.00 178.00 179.21 2crn n SER 53 N -3.96 0.31 -3.86 1.44 7.64 -1.26 -3.35 113.62 110.57 2crn n SER 53 Ca -0.02 0.62 -0.28 0.00 1.01 0.00 0.00 58.87 60.20 2crn n SER 53 Cb 0.51 -0.64 -0.12 0.00 -1.01 0.00 0.00 64.21 62.94 2crn n SER 53 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2crn s LEU 54 N -3.82 4.48 0.19 -3.43 1.43 -1.08 -4.97 118.68 111.49 2crn s LEU 54 Ca -0.01 -3.69 -0.10 0.00 -1.03 0.00 0.00 54.13 49.29 2crn s LEU 54 Cb 0.03 -1.54 0.26 0.00 0.03 0.00 0.00 46.19 44.98 2crn s LEU 54 CO 0.11 -0.11 1.18 -0.67 0.23 0.00 0.00 176.35 177.09 2crn n ASP 55 N 2.18 -0.39 -3.60 2.29 2.03 -1.21 -4.60 116.55 113.24 2crn n ASP 55 Ca 0.19 1.32 -0.12 0.00 0.52 0.00 0.00 54.79 56.69 2crn n ASP 55 Cb 0.36 -0.35 -0.06 0.00 -0.72 0.00 0.00 41.12 40.35 2crn n ASP 55 CO 0.00 0.00 0.00 1.51 -1.92 0.00 0.00 177.20 176.79 2crn s ASP 56 N -5.24 -0.54 -0.02 1.67 -4.77 -1.26 -5.07 116.67 101.44 2crn s ASP 56 Ca -0.11 0.87 -0.25 0.00 -3.30 0.00 0.00 52.55 49.76 2crn s ASP 56 Cb 0.18 0.83 -0.20 0.00 -1.09 0.00 0.00 42.92 42.64 2crn s ASP 56 CO 0.57 -0.30 1.23 1.55 0.70 0.00 0.00 175.17 178.92 2crn h PRO 57 N 3.80 -0.05 -6.35 2.11 0.13 -1.89 -3.43 132.00 126.31 2crn h PRO 57 Ca -0.26 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.33 2crn h PRO 57 Cb 1.16 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2crn h PRO 57 CO 0.19 0.41 0.75 0.42 -0.23 0.00 0.00 178.00 179.54 2crn s ILE 58 N -4.22 4.00 -0.35 -3.56 -1.09 -1.26 -4.37 121.20 110.35 2crn s ILE 58 Ca -0.15 1.36 0.07 0.00 -2.23 0.00 0.00 60.65 59.69 2crn s ILE 58 Cb 0.02 -3.87 0.50 0.00 -1.58 0.00 0.00 42.46 37.52 2crn s ILE 58 CO 0.65 0.01 1.51 -1.20 -1.23 0.00 0.00 174.94 174.67 2crn n SER 59 N 5.15 3.55 -2.87 3.58 7.64 -1.26 -4.80 113.62 124.60 2crn n SER 59 Ca 0.12 -3.78 -0.02 0.00 1.01 0.00 0.00 58.87 56.19 2crn n SER 59 Cb 0.45 -0.64 0.01 0.00 -1.01 0.00 0.00 64.21 63.02 2crn n SER 59 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2crn s GLY 60 N -2.58 -1.36 -0.69 0.23 0.00 -1.26 -5.10 107.32 96.55 2crn s GLY 60 Ca 0.49 -0.02 -0.26 0.00 0.00 0.00 0.00 44.72 44.93 2crn s GLY 60 CO 0.01 3.78 1.89 2.56 0.00 0.00 0.00 173.10 181.33 2crn s PRO 61 N 1.22 2.60 0.03 2.90 0.04 -1.26 -4.93 135.00 135.60 2crn s PRO 61 Ca 0.24 0.36 -0.06 0.00 0.04 0.00 0.00 61.00 61.58 2crn s PRO 61 Cb 0.01 -4.58 -0.01 0.00 0.04 0.00 0.00 34.50 29.96 2crn s PRO 61 CO -0.07 -2.92 0.12 0.45 0.04 0.00 0.00 177.00 174.62 2crn s SER 62 N 8.10 0.14 -0.29 6.66 0.15 -1.26 -5.14 113.70 122.06 2crn s SER 62 Ca 0.68 -0.47 -0.04 0.00 0.70 0.00 0.00 55.95 56.82 2crn s SER 62 Cb -0.11 0.24 0.03 0.00 -1.71 0.00 0.00 66.02 64.46 2crn s SER 62 CO 0.15 -0.50 0.02 -0.55 1.20 0.00 0.00 173.24 173.56 2crn s SER 63 N -2.04 4.85 0.00 5.45 0.15 -1.26 -5.25 113.70 115.59 2crn s SER 63 Ca -0.06 -0.94 0.00 0.00 0.70 0.00 0.00 55.95 55.65 2crn s SER 63 Cb -0.02 -1.78 0.00 0.00 -1.71 0.00 0.00 66.02 62.52 2crn s SER 63 CO -0.04 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 174.81