#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 -0.06 0.43 1.61 1.04 -1.26 -5.18 113.70 110.28 2crn s SER 2 Ca 0.00 -0.17 0.07 0.00 0.48 0.00 0.00 55.95 56.33 2crn s SER 2 Cb 0.00 0.29 -0.03 0.00 0.10 0.00 0.00 66.02 66.38 2crn s SER 2 CO 0.00 -0.50 0.27 -0.94 0.98 0.00 0.00 173.24 173.06 2crn s SER 3 N -1.71 4.67 0.52 7.02 1.04 -1.26 -5.05 113.70 118.93 2crn s SER 3 Ca -0.10 -0.98 0.00 0.00 0.48 0.00 0.00 55.95 55.35 2crn s SER 3 Cb -0.04 -0.40 0.00 0.00 0.10 0.00 0.00 66.02 65.68 2crn s SER 3 CO -0.00 -0.65 0.00 0.61 0.98 0.00 0.00 173.24 174.18 2crn n GLY 4 N -1.41 -3.33 3.02 7.32 0.00 -1.26 -5.00 105.19 104.53 2crn n GLY 4 Ca 0.00 -1.10 -0.13 0.00 0.00 0.00 0.00 46.02 44.80 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 -6.54 -0.21 0.52 1.61 1.04 -1.26 -5.15 113.70 103.71 2crn s SER 5 Ca 0.00 0.44 -0.19 0.00 0.48 0.00 0.00 55.95 56.68 2crn s SER 5 Cb 0.00 0.34 -0.07 0.00 0.10 0.00 0.00 66.02 66.39 2crn s SER 5 CO 0.00 -0.15 1.05 -0.44 0.98 0.00 0.00 173.24 174.68 2crn s SER 6 N 1.10 6.15 0.33 7.02 0.01 -1.26 -4.86 113.70 122.18 2crn s SER 6 Ca -0.08 1.93 0.00 0.00 1.31 0.00 0.00 55.95 59.11 2crn s SER 6 Cb -0.10 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.58 2crn s SER 6 CO -0.07 -0.92 0.00 0.61 0.41 0.00 0.00 173.24 173.27 2crn n GLY 7 N -0.37 -1.38 3.64 3.44 0.00 -1.26 -4.99 105.19 104.28 2crn n GLY 7 Ca 0.09 -0.88 -0.04 0.00 0.00 0.00 0.00 46.02 45.20 2crn n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2crn s SER 8 N -5.61 -0.48 0.15 1.61 1.04 -1.26 -5.17 113.70 103.97 2crn s SER 8 Ca 0.00 0.80 0.03 0.00 0.48 0.00 0.00 55.95 57.26 2crn s SER 8 Cb 0.00 1.09 -0.04 0.00 0.10 0.00 0.00 66.02 67.17 2crn s SER 8 CO 0.00 -0.13 0.26 -0.44 0.98 0.00 0.00 173.24 173.91 2crn s SER 9 N 1.02 6.20 -0.62 7.02 0.01 -1.26 -5.03 113.70 121.04 2crn s SER 9 Ca -0.05 0.13 -0.26 0.00 1.31 0.00 0.00 55.95 57.07 2crn s SER 9 Cb -0.04 -1.83 -0.02 0.00 0.21 0.00 0.00 66.02 64.33 2crn s SER 9 CO -0.13 0.06 1.87 -2.16 0.41 0.00 0.00 173.24 173.29 2crn s PRO 10 N -3.18 2.62 0.09 12.44 0.04 -1.26 -4.65 135.00 141.10 2crn s PRO 10 Ca 0.34 0.59 0.00 0.00 0.04 0.00 0.00 61.00 61.97 2crn s PRO 10 Cb -0.11 -4.41 0.00 0.00 0.04 0.00 0.00 34.50 30.02 2crn s PRO 10 CO 0.28 -2.76 0.00 0.43 0.04 0.00 0.00 177.00 174.99 2crn n SER 11 N 12.81 0.35 0.09 6.66 7.64 -1.26 -4.59 113.62 135.32 2crn n SER 11 Ca 0.21 0.15 -0.14 0.00 1.01 0.00 0.00 58.87 60.09 2crn n SER 11 Cb 0.52 -0.04 -0.10 0.00 -1.01 0.00 0.00 64.21 63.59 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 0.44 -0.61 -3.43 3.38 -2.01 -3.27 115.31 109.81 2crn h LEU 12 Ca 0.00 -0.42 -0.15 0.00 0.09 0.00 0.00 57.88 57.40 2crn h LEU 12 Cb 0.30 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2crn h LEU 12 CO 0.00 1.28 -0.67 -0.07 0.09 0.00 0.00 178.44 179.08 2crn h LEU 13 N 0.13 0.16 -0.74 1.67 -0.00 -1.91 -3.12 115.31 111.49 2crn h LEU 13 Ca -0.11 -0.10 0.08 0.00 -0.00 0.00 0.00 57.88 57.75 2crn h LEU 13 Cb 1.80 -0.05 -0.11 0.00 -0.00 0.00 0.00 40.66 42.31 2crn h LEU 13 CO 0.18 0.78 -0.53 -0.33 -0.00 0.00 0.00 178.44 178.54 2crn h GLU 14 N 0.10 -0.16 -0.37 1.13 4.39 -1.81 1.97 114.58 119.83 2crn h GLU 14 Ca -0.01 0.01 -0.16 0.00 0.34 0.00 0.00 59.36 59.54 2crn h GLU 14 Cb 1.19 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.87 2crn h GLU 14 CO 0.10 -0.10 -0.39 -1.00 -1.16 0.00 0.00 179.01 176.45 2crn h PRO 15 N -0.16 0.90 0.00 2.33 0.13 -1.73 -0.28 132.00 133.18 2crn h PRO 15 Ca 0.15 -0.47 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2crn h PRO 15 Cb 0.51 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.66 2crn h PRO 15 CO -0.80 1.12 0.00 1.28 -0.23 0.00 0.00 178.00 179.38 2crn n LEU 16 N -4.05 0.60 -0.11 1.56 4.77 -0.48 -2.42 117.00 116.86 2crn n LEU 16 Ca -0.02 0.62 -0.24 0.00 -0.03 0.00 0.00 56.01 56.33 2crn n LEU 16 Cb 0.55 -0.51 -0.11 0.00 -2.33 0.00 0.00 43.42 41.02 2crn n LEU 16 CO 0.48 -0.42 -1.11 0.18 -1.33 0.00 0.00 177.39 175.20 2crn n LEU 17 N -2.13 2.22 0.29 2.23 4.77 0.66 -2.89 117.00 122.15 2crn n LEU 17 Ca 0.03 0.25 0.20 0.00 -0.03 0.00 0.00 56.01 56.46 2crn n LEU 17 Cb 0.27 -0.91 0.97 0.00 -2.33 0.00 0.00 43.42 41.42 2crn n LEU 17 CO 0.22 0.61 1.08 0.00 -1.33 0.00 0.00 177.39 177.96 2crn h ALA 18 N -0.54 1.00 0.00 -1.18 0.00 -1.06 -1.30 119.26 116.18 2crn h ALA 18 Ca -0.55 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.23 2crn h ALA 18 Cb 1.65 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.42 2crn h ALA 18 CO -0.24 0.00 -0.59 0.52 0.00 0.00 0.00 179.25 178.94 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 0.17 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.83 2crn h MET 19 CO 0.00 0.59 0.00 0.41 1.06 0.00 0.00 176.91 178.97 2crn n GLY 20 N 0.93 1.14 3.77 8.32 0.00 -0.49 -5.11 105.19 113.75 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 -0.62 2.95 0.00 1.61 0.08 -1.14 -4.99 117.98 115.87 2crn s PHE 21 Ca 0.00 1.39 0.00 0.00 0.12 0.00 0.00 56.93 58.44 2crn s PHE 21 Cb 0.00 -3.71 0.00 0.00 -0.57 0.00 0.00 43.02 38.74 2crn s PHE 21 CO 0.00 -2.01 0.00 -0.35 -0.10 0.00 0.00 175.22 172.76 2crn n PRO 22 N 0.61 0.24 -0.08 0.24 -0.04 -1.26 -4.02 135.00 130.70 2crn n PRO 22 Ca 0.01 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.38 2crn n PRO 22 Cb 0.42 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.84 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 0.28 -1.02 0.52 2.07 -1.95 -2.97 116.25 112.29 2crn h VAL 23 Ca 0.00 -1.34 0.25 0.00 0.82 0.00 0.00 66.70 66.43 2crn h VAL 23 Cb 0.00 0.66 -0.10 0.00 -1.52 0.00 0.00 31.29 30.33 2crn h VAL 23 CO 0.00 0.09 0.65 1.12 0.02 0.00 0.00 177.57 179.45 2crn h HIS 24 N -1.00 0.74 0.17 1.57 -0.00 -1.99 0.15 115.15 114.79 2crn h HIS 24 Ca -0.09 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.30 2crn h HIS 24 Cb 0.68 -0.22 0.00 0.00 -0.00 0.00 0.00 27.41 27.88 2crn h HIS 24 CO -0.11 0.09 -0.08 1.15 -0.00 0.00 0.00 177.93 178.98 2crn h THR 25 N 0.46 0.44 -0.94 6.12 2.02 -1.94 -2.87 112.91 116.21 2crn h THR 25 Ca 0.59 -1.04 0.24 0.00 0.77 0.00 0.00 66.41 66.97 2crn h THR 25 Cb 1.37 0.77 -0.06 0.00 -1.74 0.00 0.00 68.15 68.48 2crn h THR 25 CO -0.32 0.13 0.64 0.00 0.37 0.00 0.00 175.52 176.34 2crn h ALA 26 N -0.73 2.51 -0.20 6.16 0.00 -1.24 0.27 119.26 126.03 2crn h ALA 26 Ca -0.02 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2crn h ALA 26 Cb 0.39 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2crn h ALA 26 CO 0.04 -0.81 -0.20 -0.07 0.00 0.00 0.00 179.25 178.21 2crn h LEU 27 N 0.22 0.52 -0.19 0.00 3.38 -0.78 -2.10 115.31 116.36 2crn h LEU 27 Ca 0.48 -0.48 0.04 0.00 0.09 0.00 0.00 57.88 58.01 2crn h LEU 27 Cb 1.49 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 42.06 2crn h LEU 27 CO -0.12 0.89 -0.07 0.11 0.09 0.00 0.00 178.44 179.34 2crn h LYS 28 N 0.16 -0.04 -0.68 1.13 1.57 -0.72 0.27 116.57 118.26 2crn h LYS 28 Ca 0.03 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 2crn h LYS 28 Cb 0.75 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.03 2crn h LYS 28 CO 0.05 -0.03 0.36 0.00 -0.57 0.00 0.00 179.45 179.26 2crn h ALA 29 N 1.14 0.87 0.44 3.86 0.00 -1.46 -0.60 119.26 123.51 2crn h ALA 29 Ca 0.10 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2crn h ALA 29 Cb 0.19 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2crn h ALA 29 CO -0.22 0.40 -0.23 -0.07 0.00 0.00 0.00 179.25 179.14 2crn h LEU 30 N 0.94 -0.55 -1.59 0.00 3.38 -0.82 0.10 115.31 116.77 2crn h LEU 30 Ca 0.24 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.23 2crn h LEU 30 Cb 0.06 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2crn h LEU 30 CO -0.04 -0.38 0.23 0.00 0.09 0.00 0.00 178.44 178.34 2crn h ALA 31 N -0.06 1.69 0.25 1.53 0.00 -0.87 0.12 119.26 121.93 2crn h ALA 31 Ca -0.06 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2crn h ALA 31 Cb 0.48 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2crn h ALA 31 CO 0.08 0.27 -0.12 0.00 0.00 0.00 0.00 179.25 179.49 2crn h ALA 32 N 1.74 -0.34 -0.21 0.00 0.00 -0.71 -3.29 119.26 116.45 2crn h ALA 32 Ca 0.14 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2crn h ALA 32 Cb -0.02 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2crn h ALA 32 CO -0.03 -0.48 0.11 1.79 0.00 0.00 0.00 179.25 180.65 2crn h THR 33 N -0.75 1.11 0.00 0.00 1.35 -0.61 -3.47 112.91 110.54 2crn h THR 33 Ca -0.03 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 2crn h THR 33 Cb 0.50 0.93 0.00 0.00 -1.73 0.00 0.00 68.15 67.85 2crn h THR 33 CO 0.06 0.11 0.00 0.61 -0.25 0.00 0.00 175.52 176.04 2crn n GLY 34 N -0.93 0.67 3.67 5.82 0.00 0.21 -4.76 105.19 109.88 2crn n GLY 34 Ca -0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.64 0.02 1.61 1.74 0.07 -4.81 116.66 113.64 2crn n ARG 35 Ca 0.00 0.08 -0.02 0.00 -0.77 0.00 0.00 57.85 57.15 2crn n ARG 35 Cb 0.00 -4.57 -0.01 0.00 -1.02 0.00 0.00 32.46 26.86 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 -0.51 -0.10 -3.16 5.56 1.57 -1.86 -3.50 116.57 114.58 2crn h LYS 36 Ca -0.35 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.46 2crn h LYS 36 Cb 1.21 0.02 -0.08 0.00 0.08 0.00 0.00 32.23 33.47 2crn h LYS 36 CO 0.52 -0.07 0.13 -0.08 -0.57 0.00 0.00 179.45 179.39 2crn s THR 37 N -1.77 0.01 0.08 -0.16 -1.32 -1.26 -5.06 115.64 106.16 2crn s THR 37 Ca -0.01 -0.85 -0.30 0.00 -1.21 0.00 0.00 61.69 59.31 2crn s THR 37 Cb 0.00 -1.77 -0.16 0.00 -1.51 0.00 0.00 72.50 69.06 2crn s THR 37 CO 0.04 -0.03 1.65 0.00 -2.21 0.00 0.00 174.62 174.07 2crn h ALA 38 N 2.08 -0.65 -0.89 11.08 0.00 -1.95 -2.88 119.26 126.05 2crn h ALA 38 Ca -0.25 -0.13 0.17 0.00 0.00 0.00 0.00 54.91 54.71 2crn h ALA 38 Cb 1.26 0.32 -0.17 0.00 0.00 0.00 0.00 17.79 19.21 2crn h ALA 38 CO 0.30 -0.88 -0.26 0.93 0.00 0.00 0.00 179.25 179.35 2crn h GLU 39 N -0.65 -0.01 -0.54 0.00 5.08 -1.97 0.32 114.58 116.80 2crn h GLU 39 Ca -0.05 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.42 2crn h GLU 39 Cb 0.54 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.70 2crn h GLU 39 CO 0.05 -0.01 -0.03 0.93 -1.00 0.00 0.00 179.01 178.96 2crn h GLU 40 N -0.01 0.09 -0.98 2.33 4.39 -1.93 0.16 114.58 118.63 2crn h GLU 40 Ca 0.40 -0.01 0.13 0.00 0.34 0.00 0.00 59.36 60.23 2crn h GLU 40 Cb 0.64 -0.02 -0.09 0.00 -0.10 0.00 0.00 28.75 29.18 2crn h GLU 40 CO -0.92 0.06 0.60 0.00 -1.16 0.00 0.00 179.01 177.60 2crn h ALA 41 N 1.49 1.49 -0.82 3.43 0.00 -0.27 -0.63 119.26 123.96 2crn h ALA 41 Ca 0.27 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 2crn h ALA 41 Cb 0.42 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2crn h ALA 41 CO -0.47 0.16 0.44 -0.07 0.00 0.00 0.00 179.25 179.31 2crn h LEU 42 N 0.93 1.02 -1.90 0.00 -0.00 -0.47 0.84 115.31 115.72 2crn h LEU 42 Ca 0.50 -0.09 -0.02 0.00 -0.00 0.00 0.00 57.88 58.26 2crn h LEU 42 Cb 0.54 -0.26 -0.00 0.00 -0.00 0.00 0.00 40.66 40.93 2crn h LEU 42 CO -0.28 0.83 -0.10 0.00 -0.00 0.00 0.00 178.44 178.88 2crn h ALA 43 N 1.33 1.21 0.00 1.53 0.00 -0.59 -0.45 119.26 122.29 2crn h ALA 43 Ca 0.29 -0.09 -0.28 0.00 0.00 0.00 0.00 54.91 54.82 2crn h ALA 43 Cb 0.04 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 2crn h ALA 43 CO -0.04 0.13 -1.77 1.87 0.00 0.00 0.00 179.25 179.43 2crn n TRP 44 N -3.51 0.84 0.06 0.00 -0.00 -0.57 -4.10 117.44 110.17 2crn n TRP 44 Ca -0.01 0.30 -0.16 0.00 -0.00 0.00 0.00 57.50 57.62 2crn n TRP 44 Cb 0.24 -1.14 -0.07 0.00 -0.00 0.00 0.00 31.31 30.34 2crn n TRP 44 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 2crn h LEU 45 N 0.00 0.69 -1.71 5.87 3.38 -0.46 -0.83 115.31 122.25 2crn h LEU 45 Ca -0.31 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.10 2crn h LEU 45 Cb 1.98 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 42.52 2crn h LEU 45 CO 0.07 1.37 0.00 0.45 0.09 0.00 0.00 178.44 180.41 2crn h HIS 46 N 0.29 0.00 0.00 1.13 3.86 -1.26 -1.67 115.15 117.50 2crn h HIS 46 Ca -0.11 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 58.99 2crn h HIS 46 Cb 1.66 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 30.11 2crn h HIS 46 CO 0.08 0.00 -1.76 -3.47 0.86 0.00 0.00 177.93 173.64 2crn n ASP 47 N -2.57 1.79 -2.05 2.45 -0.08 -1.17 -4.51 116.55 110.41 2crn n ASP 47 Ca -0.01 0.00 -0.26 0.00 -1.51 0.00 0.00 54.79 53.01 2crn n ASP 47 Cb 0.11 1.26 0.10 0.00 2.34 0.00 0.00 41.12 44.93 2crn n ASP 47 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 2crn n HIS 48 N -2.22 2.74 -3.64 -0.67 8.25 -0.33 -4.99 115.22 114.36 2crn n HIS 48 Ca -0.11 -2.43 -0.23 0.00 -0.26 0.00 0.00 57.72 54.68 2crn n HIS 48 Cb 0.63 -0.96 -0.01 0.00 1.12 0.00 0.00 29.99 30.77 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 -1.75 -2.42 -4.87 0.00 5.15 -1.26 -4.90 115.26 105.20 2crn n ASN 50 Ca 0.03 -0.79 -0.37 0.00 -0.60 0.00 0.00 54.58 52.85 2crn n ASN 50 Cb 0.63 -2.06 -0.06 0.00 -0.53 0.00 0.00 39.78 37.76 2crn n ASN 50 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2crn s ASP 51 N -2.98 6.47 0.00 1.20 -1.08 -1.26 -4.98 116.67 114.04 2crn s ASP 51 Ca 0.62 0.57 0.15 0.00 -0.52 0.00 0.00 52.55 53.36 2crn s ASP 51 Cb -0.35 -2.11 0.69 0.00 -1.46 0.00 0.00 42.92 39.69 2crn s ASP 51 CO 0.76 0.39 1.43 -0.81 0.52 0.00 0.00 175.17 177.47 2crn n PRO 52 N 1.95 0.11 -0.00 4.34 -0.04 -1.26 -2.12 135.00 137.98 2crn n PRO 52 Ca -0.19 0.20 0.07 0.00 -0.04 0.00 0.00 63.50 63.53 2crn n PRO 52 Cb 0.54 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.41 2crn n PRO 52 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2crn n SER 53 N -1.38 1.14 -3.99 3.54 2.88 -1.26 -4.77 113.62 109.78 2crn n SER 53 Ca 0.05 -0.46 -0.32 0.00 -1.33 0.00 0.00 58.87 56.82 2crn n SER 53 Cb 0.14 1.29 -0.11 0.00 -0.75 0.00 0.00 64.21 64.78 2crn n SER 53 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2crn s LEU 54 N -3.25 4.90 0.59 2.46 1.43 -0.90 -5.09 118.68 118.82 2crn s LEU 54 Ca 0.01 -3.44 -0.20 0.00 -1.03 0.00 0.00 54.13 49.47 2crn s LEU 54 Cb 0.10 -1.73 -0.03 0.00 0.03 0.00 0.00 46.19 44.56 2crn s LEU 54 CO 0.58 -0.19 1.31 1.51 0.23 0.00 0.00 176.35 179.79 2crn s ASP 55 N -0.53 5.01 -0.16 2.29 -4.77 -1.26 -4.40 116.67 112.84 2crn s ASP 55 Ca 0.22 2.65 -0.26 0.00 -3.30 0.00 0.00 52.55 51.86 2crn s ASP 55 Cb -0.14 -2.62 0.07 0.00 -1.09 0.00 0.00 42.92 39.14 2crn s ASP 55 CO -0.09 -1.73 0.66 1.51 0.70 0.00 0.00 175.17 176.22 2crn s ASP 56 N -1.22 -0.66 0.00 2.11 -4.77 -1.26 -4.96 116.67 105.90 2crn s ASP 56 Ca 0.77 1.05 0.15 0.00 -3.30 0.00 0.00 52.55 51.22 2crn s ASP 56 Cb -0.38 1.00 0.88 0.00 -1.09 0.00 0.00 42.92 43.33 2crn s ASP 56 CO 0.42 -0.39 1.37 -0.81 0.70 0.00 0.00 175.17 176.46 2crn n PRO 57 N 1.94 0.40 -2.45 2.11 -0.04 -1.26 -4.65 135.00 131.05 2crn n PRO 57 Ca -0.16 0.05 -0.41 0.00 -0.04 0.00 0.00 63.50 62.93 2crn n PRO 57 Cb 0.56 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.49 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 -2.18 3.81 -0.26 0.52 1.01 -1.26 -4.99 121.20 117.85 2crn s ILE 58 Ca 0.21 0.65 -0.07 0.00 0.00 0.00 0.00 60.65 61.44 2crn s ILE 58 Cb 0.11 -4.58 -0.02 0.00 0.01 0.00 0.00 42.46 37.98 2crn s ILE 58 CO 0.20 -1.34 0.07 -0.55 0.00 0.00 0.00 174.94 173.32 2crn s SER 59 N 4.12 5.11 0.00 3.58 0.15 -1.26 -4.99 113.70 120.40 2crn s SER 59 Ca 0.47 -0.35 0.00 0.00 0.70 0.00 0.00 55.95 56.77 2crn s SER 59 Cb -0.09 -1.91 0.00 0.00 -1.71 0.00 0.00 66.02 62.31 2crn s SER 59 CO 0.23 -0.08 0.00 0.61 1.20 0.00 0.00 173.24 175.20 2crn n GLY 60 N 4.91 2.39 3.73 9.45 0.00 -1.26 -5.05 105.19 119.35 2crn n GLY 60 Ca -0.16 -1.87 -0.30 0.00 0.00 0.00 0.00 46.02 43.69 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 -3.25 1.51 0.21 1.61 0.04 -1.26 -5.07 135.00 128.80 2crn s PRO 61 Ca 0.00 0.91 0.08 0.00 0.04 0.00 0.00 61.00 62.03 2crn s PRO 61 Cb 0.00 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.67 2crn s PRO 61 CO 0.00 -2.09 0.05 0.45 0.04 0.00 0.00 177.00 175.45 2crn s SER 62 N -3.41 4.93 0.32 6.66 0.15 -1.26 -5.13 113.70 115.96 2crn s SER 62 Ca 0.63 -0.40 0.03 0.00 0.70 0.00 0.00 55.95 56.91 2crn s SER 62 Cb -0.18 -1.09 -0.02 0.00 -1.71 0.00 0.00 66.02 63.02 2crn s SER 62 CO 0.57 0.04 0.48 -0.55 1.20 0.00 0.00 173.24 174.98 2crn s SER 63 N -3.29 6.18 0.00 5.45 0.15 -1.26 -5.32 113.70 115.61 2crn s SER 63 Ca 0.30 0.16 0.00 0.00 0.70 0.00 0.00 55.95 57.11 2crn s SER 63 Cb -0.08 -1.74 0.00 0.00 -1.71 0.00 0.00 66.02 62.48 2crn s SER 63 CO 0.21 -0.29 0.00 0.61 1.20 0.00 0.00 173.24 174.96