#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2crn n SER 2 N 0.00 5.66 -4.75 1.61 2.88 -1.26 -4.93 113.62 112.83 2crn n SER 2 Ca 0.00 -2.62 -0.33 0.00 -1.33 0.00 0.00 58.87 54.59 2crn n SER 2 Cb 0.00 -1.16 0.07 0.00 -0.75 0.00 0.00 64.21 62.36 2crn n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2crn s SER 3 N 1.48 4.76 0.03 -3.46 1.04 -1.26 -5.05 113.70 111.25 2crn s SER 3 Ca 0.20 2.09 0.09 0.00 0.48 0.00 0.00 55.95 58.82 2crn s SER 3 Cb 0.13 -2.56 -0.03 0.00 0.10 0.00 0.00 66.02 63.66 2crn s SER 3 CO -0.01 -1.87 -0.26 -0.83 0.98 0.00 0.00 173.24 171.25 2crn s GLY 4 N -2.47 1.38 -1.65 7.32 0.00 -1.26 -4.72 107.32 105.91 2crn s GLY 4 Ca 0.69 -1.24 -0.11 0.00 0.00 0.00 0.00 44.72 44.06 2crn s GLY 4 CO 0.44 -1.10 0.42 -1.14 0.00 0.00 0.00 173.10 171.71 2crn n SER 5 N 1.92 -1.00 -4.36 1.64 3.41 -1.26 -4.86 113.62 109.12 2crn n SER 5 Ca -0.17 -1.16 -0.46 0.00 -0.26 0.00 0.00 58.87 56.82 2crn n SER 5 Cb 0.52 -2.12 -0.02 0.00 -0.26 0.00 0.00 64.21 62.33 2crn n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2crn s SER 6 N -3.82 6.71 -0.44 4.04 0.01 -1.26 -4.81 113.70 114.12 2crn s SER 6 Ca 0.40 -2.48 0.07 0.00 1.31 0.00 0.00 55.95 55.25 2crn s SER 6 Cb -0.23 -2.26 0.33 0.00 0.21 0.00 0.00 66.02 64.07 2crn s SER 6 CO 0.97 -0.72 1.11 0.61 0.41 0.00 0.00 173.24 175.63 2crn n GLY 7 N 4.42 0.94 0.14 3.44 0.00 -1.26 -4.98 105.19 107.89 2crn n GLY 7 Ca 0.15 -0.15 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 2crn n GLY 7 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2crn n SER 8 N 0.24 2.08 -4.77 1.61 2.88 -1.26 -4.93 113.62 109.48 2crn n SER 8 Ca 0.07 0.18 -0.38 0.00 -1.33 0.00 0.00 58.87 57.41 2crn n SER 8 Cb 0.71 -0.81 -0.02 0.00 -0.75 0.00 0.00 64.21 63.35 2crn n SER 8 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2crn s SER 9 N -6.96 6.44 -0.30 -3.46 0.01 -1.26 -4.95 113.70 103.22 2crn s SER 9 Ca -0.25 2.36 -0.29 0.00 1.31 0.00 0.00 55.95 59.08 2crn s SER 9 Cb 0.07 -2.61 -0.02 0.00 0.21 0.00 0.00 66.02 63.67 2crn s SER 9 CO 0.72 -0.74 1.66 -2.16 0.41 0.00 0.00 173.24 173.14 2crn s PRO 10 N -2.37 3.56 0.00 12.44 0.04 -1.26 -4.82 135.00 142.59 2crn s PRO 10 Ca 0.58 1.45 0.00 0.00 0.04 0.00 0.00 61.00 63.08 2crn s PRO 10 Cb -0.31 -4.10 0.00 0.00 0.04 0.00 0.00 34.50 30.13 2crn s PRO 10 CO 0.38 -1.58 0.00 0.43 0.04 0.00 0.00 177.00 176.27 2crn n SER 11 N 9.30 0.00 0.21 6.66 7.64 -1.26 -4.69 113.62 131.48 2crn n SER 11 Ca 0.20 0.00 0.11 0.00 1.01 0.00 0.00 58.87 60.19 2crn n SER 11 Cb 0.46 0.00 0.18 0.00 -1.01 0.00 0.00 64.21 63.84 2crn n SER 11 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2crn h LEU 12 N 0.00 0.00 -0.55 -3.43 -0.00 -2.01 -3.21 115.31 106.10 2crn h LEU 12 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 57.88 57.72 2crn h LEU 12 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.65 2crn h LEU 12 CO 0.00 0.06 -0.70 -0.07 -0.00 0.00 0.00 178.44 177.74 2crn h LEU 13 N 0.00 0.19 -0.77 1.67 -0.00 -1.93 -3.13 115.31 111.34 2crn h LEU 13 Ca -0.00 -0.13 0.09 0.00 -0.00 0.00 0.00 57.88 57.84 2crn h LEU 13 Cb 1.02 -0.06 -0.11 0.00 -0.00 0.00 0.00 40.66 41.51 2crn h LEU 13 CO 0.01 0.83 -0.53 -0.33 -0.00 0.00 0.00 178.44 178.41 2crn h GLU 14 N 0.11 -0.14 -0.37 1.13 5.08 -1.83 1.95 114.58 120.50 2crn h GLU 14 Ca -0.02 0.01 -0.16 0.00 -1.00 0.00 0.00 59.36 58.20 2crn h GLU 14 Cb 1.24 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.51 2crn h GLU 14 CO 0.10 -0.09 -0.39 -1.00 -1.00 0.00 0.00 179.01 176.63 2crn h PRO 15 N -0.15 0.91 0.00 2.33 0.13 -1.78 -0.45 132.00 133.00 2crn h PRO 15 Ca 0.16 -0.48 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2crn h PRO 15 Cb 0.51 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.65 2crn h PRO 15 CO -0.81 1.13 0.00 1.28 -0.23 0.00 0.00 178.00 179.37 2crn n LEU 16 N -4.05 0.57 -0.10 1.56 4.77 -0.44 -2.42 117.00 116.88 2crn n LEU 16 Ca -0.02 0.61 -0.23 0.00 -0.03 0.00 0.00 56.01 56.34 2crn n LEU 16 Cb 0.54 -0.50 -0.12 0.00 -2.33 0.00 0.00 43.42 41.01 2crn n LEU 16 CO 0.48 -0.40 -1.10 0.18 -1.33 0.00 0.00 177.39 175.22 2crn n LEU 17 N -2.10 2.33 0.30 2.23 4.77 0.65 -3.02 117.00 122.16 2crn n LEU 17 Ca 0.03 0.21 0.18 0.00 -0.03 0.00 0.00 56.01 56.40 2crn n LEU 17 Cb 0.27 -0.93 0.93 0.00 -2.33 0.00 0.00 43.42 41.36 2crn n LEU 17 CO 0.22 0.66 1.08 0.00 -1.33 0.00 0.00 177.39 178.01 2crn h ALA 18 N -0.43 1.14 0.00 -1.18 0.00 -1.08 -1.36 119.26 116.35 2crn h ALA 18 Ca -0.54 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.26 2crn h ALA 18 Cb 1.70 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.48 2crn h ALA 18 CO -0.20 0.05 -0.36 0.52 0.00 0.00 0.00 179.25 179.26 2crn h MET 19 N 0.00 0.00 0.00 0.00 2.86 -1.65 -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 0.21 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.87 2crn h MET 19 CO 0.00 0.36 0.00 0.41 1.06 0.00 0.00 176.91 178.74 2crn n GLY 20 N 0.52 1.01 3.77 8.32 0.00 -0.51 -5.11 105.19 113.19 2crn n GLY 20 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.74 2.80 0.00 1.61 0.08 -1.17 -4.99 117.98 115.57 2crn s PHE 21 Ca 0.00 1.32 0.00 0.00 0.12 0.00 0.00 56.93 58.37 2crn s PHE 21 Cb 0.00 -3.81 0.00 0.00 -0.57 0.00 0.00 43.02 38.64 2crn s PHE 21 CO 0.00 -2.36 0.00 -0.35 -0.10 0.00 0.00 175.22 172.41 2crn n PRO 22 N 0.47 0.24 -0.08 0.24 -0.04 -1.26 -4.07 135.00 130.51 2crn n PRO 22 Ca 0.01 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.39 2crn n PRO 22 Cb 0.41 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.83 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 0.26 -1.02 0.52 2.07 -1.95 -2.93 116.25 112.31 2crn h VAL 23 Ca 0.00 -1.30 0.24 0.00 0.82 0.00 0.00 66.70 66.47 2crn h VAL 23 Cb 0.00 0.59 -0.10 0.00 -1.52 0.00 0.00 31.29 30.26 2crn h VAL 23 CO 0.00 0.09 0.64 1.12 0.02 0.00 0.00 177.57 179.43 2crn h HIS 24 N -1.00 0.82 0.18 1.57 -0.00 -1.99 0.15 115.15 114.89 2crn h HIS 24 Ca -0.07 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.31 2crn h HIS 24 Cb 0.63 -0.24 0.00 0.00 -0.00 0.00 0.00 27.41 27.80 2crn h HIS 24 CO -0.11 0.10 -0.09 1.15 -0.00 0.00 0.00 177.93 178.98 2crn h THR 25 N 0.51 0.48 -0.94 6.12 2.02 -1.96 -2.89 112.91 116.25 2crn h THR 25 Ca 0.60 -1.05 0.24 0.00 0.77 0.00 0.00 66.41 66.98 2crn h THR 25 Cb 1.31 0.84 -0.06 0.00 -1.74 0.00 0.00 68.15 68.50 2crn h THR 25 CO -0.35 0.14 0.64 0.00 0.37 0.00 0.00 175.52 176.32 2crn h ALA 26 N -0.69 2.51 -0.27 6.16 0.00 -1.21 0.79 119.26 126.56 2crn h ALA 26 Ca -0.02 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 2crn h ALA 26 Cb 0.41 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2crn h ALA 26 CO 0.04 -0.81 -0.28 -0.07 0.00 0.00 0.00 179.25 178.13 2crn h LEU 27 N 0.22 0.72 -0.04 0.00 3.38 -0.77 -2.24 115.31 116.58 2crn h LEU 27 Ca 0.48 -0.48 0.02 0.00 0.09 0.00 0.00 57.88 57.99 2crn h LEU 27 Cb 1.50 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 42.03 2crn h LEU 27 CO -0.12 1.05 -0.06 0.11 0.09 0.00 0.00 178.44 179.50 2crn h LYS 28 N 0.40 -0.09 -0.86 1.13 1.57 -0.63 -0.18 116.57 117.91 2crn h LYS 28 Ca 0.04 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 2crn h LYS 28 Cb 0.85 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.14 2crn h LYS 28 CO 0.07 -0.06 0.50 0.00 -0.57 0.00 0.00 179.45 179.40 2crn h ALA 29 N 0.94 1.28 0.71 3.86 0.00 -1.45 -0.53 119.26 124.06 2crn h ALA 29 Ca 0.04 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2crn h ALA 29 Cb 0.15 -0.35 0.01 0.00 0.00 0.00 0.00 17.79 17.60 2crn h ALA 29 CO -0.10 0.61 -0.34 -0.07 0.00 0.00 0.00 179.25 179.36 2crn h LEU 30 N 1.18 -0.80 -2.13 0.00 3.38 -0.91 0.73 115.31 116.77 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 -0.03 0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 2crn h LEU 30 CO -0.06 -0.49 0.08 0.00 0.09 0.00 0.00 178.44 178.06 2crn h ALA 31 N -0.90 1.95 -0.02 1.53 0.00 -0.96 0.43 119.26 121.29 2crn h ALA 31 Ca -0.10 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2crn h ALA 31 Cb 0.76 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2crn h ALA 31 CO 0.16 -0.13 -0.13 0.00 0.00 0.00 0.00 179.25 179.15 2crn h ALA 32 N 1.93 0.04 0.00 0.00 0.00 -0.84 -3.26 119.26 117.13 2crn h ALA 32 Ca 0.05 -0.39 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 2crn h ALA 32 Cb 0.21 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2crn h ALA 32 CO -0.00 -0.03 -0.43 1.79 0.00 0.00 0.00 179.25 180.58 2crn h THR 33 N -0.50 0.96 0.00 0.00 1.35 -0.33 -3.47 112.91 110.91 2crn h THR 33 Ca -0.01 -1.72 0.00 0.00 -0.55 0.00 0.00 66.41 64.13 2crn h THR 33 Cb 0.81 2.03 0.00 0.00 -1.73 0.00 0.00 68.15 69.26 2crn h THR 33 CO 0.03 0.42 0.00 0.61 -0.25 0.00 0.00 175.52 176.33 2crn n GLY 34 N 0.38 1.54 4.39 5.82 0.00 0.13 -4.48 105.19 112.97 2crn n GLY 34 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.50 -1.26 -0.02 1.61 1.74 0.30 -4.83 116.66 113.71 2crn n ARG 35 Ca 0.00 0.17 -0.17 0.00 -0.77 0.00 0.00 57.85 57.07 2crn n ARG 35 Cb 0.00 -4.34 -0.14 0.00 -1.02 0.00 0.00 32.46 26.97 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 -1.34 0.14 -1.65 5.56 1.57 -1.83 -3.49 116.57 115.52 2crn h LYS 36 Ca -0.62 -0.24 0.15 0.00 -1.87 0.00 0.00 60.65 58.07 2crn h LYS 36 Cb 1.39 0.09 -0.21 0.00 0.08 0.00 0.00 32.23 33.59 2crn h LYS 36 CO 0.80 1.12 0.65 -0.08 -0.57 0.00 0.00 179.45 181.37 2crn s THR 37 N -2.33 0.00 0.19 -0.16 -1.32 -1.26 -5.02 115.64 105.73 2crn s THR 37 Ca -0.17 0.00 -0.15 0.00 -1.21 0.00 0.00 61.69 60.16 2crn s THR 37 Cb -0.00 -1.00 0.15 0.00 -1.51 0.00 0.00 72.50 70.13 2crn s THR 37 CO 0.75 0.00 1.66 0.00 -2.21 0.00 0.00 174.62 174.82 2crn h ALA 38 N 2.21 0.40 -0.48 11.08 0.00 -1.95 -1.49 119.26 129.04 2crn h ALA 38 Ca -0.15 0.18 0.09 0.00 0.00 0.00 0.00 54.91 55.03 2crn h ALA 38 Cb 1.19 0.33 -0.09 0.00 0.00 0.00 0.00 17.79 19.22 2crn h ALA 38 CO 0.28 -0.42 -0.08 0.93 0.00 0.00 0.00 179.25 179.95 2crn h GLU 39 N 0.05 0.03 -0.68 0.00 5.08 -1.97 -1.30 114.58 115.78 2crn h GLU 39 Ca 0.25 -0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.75 2crn h GLU 39 Cb 0.38 -0.01 -0.12 0.00 0.50 0.00 0.00 28.75 29.51 2crn h GLU 39 CO -0.48 0.02 -0.05 0.93 -1.00 0.00 0.00 179.01 178.43 2crn h GLU 40 N 0.03 0.07 -0.80 2.33 4.39 -1.67 0.14 114.58 119.07 2crn h GLU 40 Ca 0.23 -0.00 0.12 0.00 0.34 0.00 0.00 59.36 60.05 2crn h GLU 40 Cb 0.35 -0.02 -0.09 0.00 -0.10 0.00 0.00 28.75 28.90 2crn h GLU 40 CO -0.46 0.05 0.40 0.00 -1.16 0.00 0.00 179.01 177.83 2crn h ALA 41 N 1.65 1.15 -0.90 3.43 0.00 -1.07 -0.39 119.26 123.13 2crn h ALA 41 Ca 0.35 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.35 2crn h ALA 41 Cb 0.59 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 2crn h ALA 41 CO -0.63 -0.07 0.59 -0.07 0.00 0.00 0.00 179.25 179.07 2crn h LEU 42 N 0.62 1.03 -1.47 0.00 -0.00 -0.54 0.88 115.31 115.82 2crn h LEU 42 Ca 0.42 -0.03 -0.06 0.00 -0.00 0.00 0.00 57.88 58.21 2crn h LEU 42 Cb 0.53 -0.26 -0.01 0.00 -0.00 0.00 0.00 40.66 40.93 2crn h LEU 42 CO -0.33 0.75 -0.27 0.00 -0.00 0.00 0.00 178.44 178.60 2crn h ALA 43 N 1.44 1.45 0.00 1.53 0.00 -0.54 0.20 119.26 123.34 2crn h ALA 43 Ca 0.33 -0.24 -0.23 0.00 0.00 0.00 0.00 54.91 54.76 2crn h ALA 43 Cb -0.14 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 2crn h ALA 43 CO -0.07 0.33 -1.29 2.35 0.00 0.00 0.00 179.25 180.57 2crn h TRP 44 N 0.00 0.00 0.10 0.00 7.01 -0.65 -3.21 115.95 119.21 2crn h TRP 44 Ca -0.00 0.00 -0.28 0.00 2.11 0.00 0.00 58.89 60.72 2crn h TRP 44 Cb 0.51 0.00 0.02 0.00 -2.10 0.00 0.00 29.16 27.59 2crn h TRP 44 CO 0.00 0.93 -1.19 -0.07 -2.79 0.00 0.00 178.44 175.32 2crn h LEU 45 N 0.00 0.71 -1.48 0.65 3.38 -0.51 -1.25 115.31 116.80 2crn h LEU 45 Ca -0.14 -0.66 -0.03 0.00 0.09 0.00 0.00 57.88 57.15 2crn h LEU 45 Cb 1.83 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 42.35 2crn h LEU 45 CO 0.10 1.48 -0.14 0.45 0.09 0.00 0.00 178.44 180.41 2crn h HIS 46 N 0.22 0.00 0.00 1.13 3.86 -1.09 0.65 115.15 119.92 2crn h HIS 46 Ca -0.16 0.00 -0.18 0.00 -1.16 0.00 0.00 60.37 58.88 2crn h HIS 46 Cb 1.86 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 30.30 2crn h HIS 46 CO 0.09 0.14 -1.75 -0.25 0.86 0.00 0.00 177.93 177.02 2crn n ASP 47 N -3.37 0.48 -0.09 2.45 8.00 -1.21 -4.36 116.55 118.44 2crn n ASP 47 Ca -0.00 0.21 -0.12 0.00 0.71 0.00 0.00 54.79 55.59 2crn n ASP 47 Cb 0.34 0.74 -0.05 0.00 -0.02 0.00 0.00 41.12 42.13 2crn n ASP 47 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2crn n HIS 48 N -2.72 0.69 -0.53 1.24 8.25 -0.48 -4.25 115.22 117.42 2crn n HIS 48 Ca -0.14 0.30 0.40 0.00 -0.26 0.00 0.00 57.72 58.02 2crn n HIS 48 Cb 0.85 -0.82 0.63 0.00 1.12 0.00 0.00 29.99 31.77 2crn n HIS 48 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2crn n ASN 50 N -3.68 5.25 -3.60 0.00 3.02 -1.26 -4.79 115.26 110.20 2crn n ASN 50 Ca 0.35 -3.01 -0.11 0.00 -0.03 0.00 0.00 54.58 51.77 2crn n ASN 50 Cb 1.53 -1.53 -0.06 0.00 -0.61 0.00 0.00 39.78 39.10 2crn n ASN 50 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2crn s ASP 51 N 2.27 -0.50 0.19 6.41 1.01 -0.98 -5.00 116.67 120.07 2crn s ASP 51 Ca 0.41 0.80 0.21 0.00 0.71 0.00 0.00 52.55 54.69 2crn s ASP 51 Cb -0.01 0.76 0.88 0.00 1.01 0.00 0.00 42.92 45.56 2crn s ASP 51 CO -0.00 -0.28 1.64 -0.81 0.21 0.00 0.00 175.17 175.93 2crn n PRO 52 N 1.70 0.14 0.04 8.23 -0.04 -1.26 -2.11 135.00 141.70 2crn n PRO 52 Ca -0.13 0.38 0.11 0.00 -0.04 0.00 0.00 63.50 63.82 2crn n PRO 52 Cb 0.56 -1.77 0.05 0.00 -0.04 0.00 0.00 33.50 32.30 2crn n PRO 52 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2crn n SER 53 N -2.04 0.63 -4.00 3.54 3.41 -1.26 -4.60 113.62 109.30 2crn n SER 53 Ca 0.02 -0.08 -0.32 0.00 -0.26 0.00 0.00 58.87 58.24 2crn n SER 53 Cb 0.21 0.66 -0.11 0.00 -0.26 0.00 0.00 64.21 64.71 2crn n SER 53 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2crn s LEU 54 N -4.15 4.93 -0.33 1.04 1.43 -0.90 -5.06 118.68 115.65 2crn s LEU 54 Ca 0.03 -3.36 -0.29 0.00 -1.03 0.00 0.00 54.13 49.48 2crn s LEU 54 Cb 0.14 -1.75 0.00 0.00 0.03 0.00 0.00 46.19 44.61 2crn s LEU 54 CO 0.79 -0.21 1.36 -1.81 0.23 0.00 0.00 176.35 176.70 2crn s ASP 55 N -0.36 6.54 0.09 2.29 1.01 -1.26 -4.56 116.67 120.41 2crn s ASP 55 Ca 0.21 1.11 -0.10 0.00 0.71 0.00 0.00 52.55 54.48 2crn s ASP 55 Cb -0.15 -2.54 0.01 0.00 1.01 0.00 0.00 42.92 41.25 2crn s ASP 55 CO -0.08 -1.21 0.23 -1.81 0.21 0.00 0.00 175.17 172.51 2crn s ASP 56 N 3.28 0.05 0.13 0.27 1.01 -1.26 -5.03 116.67 115.11 2crn s ASP 56 Ca 0.59 -0.54 0.19 0.00 0.71 0.00 0.00 52.55 53.49 2crn s ASP 56 Cb -0.16 0.35 0.80 0.00 1.01 0.00 0.00 42.92 44.92 2crn s ASP 56 CO 0.27 -0.72 1.59 -0.81 0.21 0.00 0.00 175.17 175.70 2crn n PRO 57 N 0.04 0.10 -1.81 8.23 -0.04 -1.26 -4.58 135.00 135.68 2crn n PRO 57 Ca -0.16 0.34 -0.20 0.00 -0.04 0.00 0.00 63.50 63.44 2crn n PRO 57 Cb 0.62 -1.69 -0.07 0.00 -0.04 0.00 0.00 33.50 32.32 2crn n PRO 57 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2crn s ILE 58 N -3.16 3.24 0.07 0.52 -1.09 -1.26 -4.90 121.20 114.60 2crn s ILE 58 Ca 0.05 -0.27 -0.31 0.00 -2.23 0.00 0.00 60.65 57.90 2crn s ILE 58 Cb 0.09 -3.75 -0.08 0.00 -1.58 0.00 0.00 42.46 37.14 2crn s ILE 58 CO 0.33 -0.47 1.65 -0.94 -1.23 0.00 0.00 174.94 174.27 2crn s SER 59 N 8.87 6.61 0.00 3.58 1.04 -1.26 -4.84 113.70 127.69 2crn s SER 59 Ca 0.80 2.48 0.00 0.00 0.48 0.00 0.00 55.95 59.70 2crn s SER 59 Cb -0.08 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.48 2crn s SER 59 CO 0.08 -0.88 0.00 0.61 0.98 0.00 0.00 173.24 174.02 2crn n GLY 60 N 3.99 0.43 3.66 7.32 0.00 -1.26 -5.08 105.19 114.24 2crn n GLY 60 Ca 0.16 -1.81 -0.29 0.00 0.00 0.00 0.00 46.02 44.08 2crn n GLY 60 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2crn s PRO 61 N 1.32 0.01 0.13 1.61 0.04 -1.26 -4.93 135.00 131.93 2crn s PRO 61 Ca 0.00 0.38 -0.29 0.00 0.04 0.00 0.00 61.00 61.12 2crn s PRO 61 Cb 0.00 -1.70 -0.06 0.00 0.04 0.00 0.00 34.50 32.78 2crn s PRO 61 CO 0.00 -2.98 1.58 0.77 0.04 0.00 0.00 177.00 176.41 2crn h SER 62 N -2.07 -1.38 0.38 6.66 0.02 -2.06 -2.98 113.55 112.12 2crn h SER 62 Ca -0.53 0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 60.58 2crn h SER 62 Cb 1.33 0.56 0.00 0.00 0.14 0.00 0.00 62.40 64.44 2crn h SER 62 CO 0.53 -0.43 -0.18 -1.28 -1.14 0.00 0.00 176.83 174.33 2crn h SER 63 N -0.49 -0.44 0.00 3.07 0.87 -2.06 -3.56 113.55 110.95 2crn h SER 63 Ca 0.08 -0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.50 2crn h SER 63 Cb 0.63 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.70 2crn h SER 63 CO -0.42 -0.06 0.00 0.61 -0.53 0.00 0.00 176.83 176.43