#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 6.83 -1.16 1.61 0.15 -1.26 -4.00 113.70 115.87 2crn s SER 2 Ca 0.00 1.00 -0.05 0.00 0.70 0.00 0.00 55.95 57.60 2crn s SER 2 Cb 0.00 -2.37 0.01 0.00 -1.71 0.00 0.00 66.02 61.94 2crn s SER 2 CO 0.00 -0.17 0.99 -0.24 1.20 0.00 0.00 173.24 175.02 2crn n SER 3 N 4.29 -4.31 -3.97 5.45 2.88 -1.26 -4.96 113.62 111.74 2crn n SER 3 Ca -0.02 -0.51 -0.36 0.00 -1.33 0.00 0.00 58.87 56.65 2crn n SER 3 Cb 0.51 -4.59 -0.05 0.00 -0.75 0.00 0.00 64.21 59.33 2crn n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2crn n GLY 4 N -1.55 4.44 3.76 0.46 0.00 -1.26 -5.06 105.19 105.98 2crn n GLY 4 Ca -0.10 -2.64 -0.30 0.00 0.00 0.00 0.00 46.02 42.98 2crn n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2crn s SER 5 N -0.82 2.48 -0.55 1.61 0.01 -1.26 -4.85 113.70 110.32 2crn s SER 5 Ca 0.31 0.65 -0.16 0.00 1.31 0.00 0.00 55.95 58.05 2crn s SER 5 Cb -0.01 -0.95 0.13 0.00 0.21 0.00 0.00 66.02 65.39 2crn s SER 5 CO -0.06 -3.16 0.52 -0.55 0.41 0.00 0.00 173.24 170.40 2crn s SER 6 N -4.22 6.19 0.00 2.44 0.15 -1.26 -4.94 113.70 112.06 2crn s SER 6 Ca 0.69 -1.77 0.00 0.00 0.70 0.00 0.00 55.95 55.57 2crn s SER 6 Cb -0.10 -2.22 0.00 0.00 -1.71 0.00 0.00 66.02 61.99 2crn s SER 6 CO 0.54 -0.88 0.00 0.61 1.20 0.00 0.00 173.24 174.72 2crn n GLY 7 N 5.24 4.51 3.36 9.45 0.00 -1.26 -5.10 105.19 121.39 2crn n GLY 7 Ca -0.13 -1.22 -0.40 0.00 0.00 0.00 0.00 46.02 44.27 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 0.00 -2.22 -4.79 1.61 2.88 -1.26 -4.90 113.62 104.94 2crn n SER 8 Ca 0.00 0.76 -0.35 0.00 -1.33 0.00 0.00 58.87 57.95 2crn n SER 8 Cb 0.00 -1.00 -0.05 0.00 -0.75 0.00 0.00 64.21 62.41 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 -1.04 6.81 0.00 -3.46 0.01 -1.26 -4.92 113.70 109.84 2crn s SER 9 Ca 0.62 1.91 0.16 0.00 1.31 0.00 0.00 55.95 59.95 2crn s SER 9 Cb -0.53 -2.57 0.93 0.00 0.21 0.00 0.00 66.02 64.06 2crn s SER 9 CO 0.61 -0.45 1.35 -0.81 0.41 0.00 0.00 173.24 174.34 2crn n PRO 10 N -0.26 0.47 -0.03 12.44 -0.04 -1.26 -3.16 135.00 143.17 2crn n PRO 10 Ca 0.06 0.01 -0.13 0.00 -0.04 0.00 0.00 63.50 63.39 2crn n PRO 10 Cb 0.51 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.37 2crn n PRO 10 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2crn h SER 11 N 0.00 0.11 0.58 3.54 0.87 -1.99 0.42 113.55 117.09 2crn h SER 11 Ca 0.00 -0.57 0.00 0.00 -1.23 0.00 0.00 61.79 59.99 2crn h SER 11 Cb 0.01 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 61.94 2crn h SER 11 CO 0.00 0.66 0.00 0.18 -0.53 0.00 0.00 176.83 177.14 2crn n LEU 12 N -4.72 0.31 -0.06 2.23 7.99 -1.19 -2.46 117.00 119.09 2crn n LEU 12 Ca -0.08 0.58 -0.04 0.00 -0.01 0.00 0.00 56.01 56.46 2crn n LEU 12 Cb 0.33 -0.54 -0.14 0.00 -0.11 0.00 0.00 43.42 42.96 2crn n LEU 12 CO 0.36 -0.40 -0.97 0.18 -1.51 0.00 0.00 177.39 175.04 2crn n LEU 13 N -1.84 0.00 -0.30 2.23 7.99 -1.15 -4.19 117.00 119.74 2crn n LEU 13 Ca 0.03 0.00 -0.11 0.00 -0.01 0.00 0.00 56.01 55.92 2crn n LEU 13 Cb 0.19 0.31 -0.08 0.00 -0.11 0.00 0.00 43.42 43.74 2crn n LEU 13 CO 0.16 0.31 0.51 -0.33 -1.51 0.00 0.00 177.39 176.53 2crn h GLU 14 N 0.00 -0.15 -0.37 3.23 4.39 0.18 1.97 114.58 123.83 2crn h GLU 14 Ca -0.34 0.01 -0.16 0.00 0.34 0.00 0.00 59.36 59.21 2crn h GLU 14 Cb 1.74 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 30.42 2crn h GLU 14 CO 0.02 -0.10 -0.39 -1.00 -1.16 0.00 0.00 179.01 176.38 2crn h PRO 15 N -0.16 0.91 0.00 2.33 0.13 -1.81 -0.25 132.00 133.14 2crn h PRO 15 Ca 0.15 -0.48 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 31.65 2crn h PRO 15 CO -0.80 1.13 0.00 1.28 -0.23 0.00 0.00 178.00 179.38 2crn n LEU 16 N -4.05 0.57 -0.11 1.56 4.77 -0.48 -2.41 117.00 116.84 2crn n LEU 16 Ca -0.02 0.61 -0.25 0.00 -0.03 0.00 0.00 56.01 56.33 2crn n LEU 16 Cb 0.54 -0.50 -0.11 0.00 -2.33 0.00 0.00 43.42 41.02 2crn n LEU 16 CO 0.48 -0.40 -1.12 0.18 -1.33 0.00 0.00 177.39 175.20 2crn n LEU 17 N -2.10 2.21 0.27 2.23 4.77 0.66 -3.10 117.00 121.94 2crn n LEU 17 Ca 0.03 0.26 0.18 0.00 -0.03 0.00 0.00 56.01 56.45 2crn n LEU 17 Cb 0.27 -0.91 0.90 0.00 -2.33 0.00 0.00 43.42 41.35 2crn n LEU 17 CO 0.22 0.60 1.04 0.00 -1.33 0.00 0.00 177.39 177.92 2crn h ALA 18 N -0.55 1.00 0.00 -1.18 0.00 -1.06 -1.21 119.26 116.25 2crn h ALA 18 Ca -0.56 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.26 2crn h ALA 18 Cb 1.64 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.42 2crn h ALA 18 CO -0.25 0.00 -0.43 0.52 0.00 0.00 0.00 179.25 179.09 2crn h MET 19 N 0.00 0.00 0.00 0.00 2.86 -1.65 -3.48 114.93 112.66 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 0.43 0.00 0.41 1.06 0.00 0.00 176.91 178.81 2crn n GLY 20 N 0.96 2.23 3.75 8.32 0.00 -0.46 -5.11 105.19 114.89 2crn n GLY 20 Ca 0.02 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.20 2crn n GLY 20 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2crn n PHE 21 N 0.00 2.76 -0.18 1.61 3.72 -1.18 -4.95 117.46 119.24 2crn n PHE 21 Ca 0.00 0.46 0.00 0.00 -0.05 0.00 0.00 57.45 57.86 2crn n PHE 21 Cb 0.00 -2.50 0.00 0.00 -0.94 0.00 0.00 39.48 36.04 2crn n PHE 21 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 2crn n PRO 22 N 0.62 0.24 -0.09 -1.08 -0.04 -1.26 -4.11 135.00 129.28 2crn n PRO 22 Ca 0.03 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.35 2crn n PRO 22 Cb 0.38 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.77 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 0.54 -0.95 0.52 2.07 -1.94 -2.97 116.25 112.63 2crn h VAL 23 Ca 0.00 -1.66 0.24 0.00 0.82 0.00 0.00 66.70 66.10 2crn h VAL 23 Cb 0.00 1.28 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 2crn h VAL 23 CO 0.00 0.18 0.64 1.12 0.02 0.00 0.00 177.57 179.54 2crn h HIS 24 N -1.00 0.39 0.04 1.57 -0.00 -1.99 0.86 115.15 115.02 2crn h HIS 24 Ca -0.18 0.01 -0.00 0.00 -0.00 0.00 0.00 60.37 60.20 2crn h HIS 24 Cb 0.91 -0.12 0.00 0.00 -0.00 0.00 0.00 27.41 28.21 2crn h HIS 24 CO -0.03 0.08 -0.02 1.15 -0.00 0.00 0.00 177.93 179.11 2crn h THR 25 N 0.27 0.37 -0.94 6.12 2.02 -1.95 -3.02 112.91 115.77 2crn h THR 25 Ca 0.49 -1.21 0.27 0.00 0.77 0.00 0.00 66.41 66.73 2crn h THR 25 Cb 1.46 0.68 -0.04 0.00 -1.74 0.00 0.00 68.15 68.51 2crn h THR 25 CO -0.15 0.12 0.67 0.00 0.37 0.00 0.00 175.52 176.53 2crn h ALA 26 N -0.80 2.78 -0.17 6.16 0.00 -1.27 0.12 119.26 126.10 2crn h ALA 26 Ca -0.01 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.73 2crn h ALA 26 Cb 0.24 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2crn h ALA 26 CO 0.01 -1.06 -0.50 -0.07 0.00 0.00 0.00 179.25 177.63 2crn h LEU 27 N 0.07 0.74 -0.12 0.00 3.38 -0.94 -2.24 115.31 116.20 2crn h LEU 27 Ca 0.46 -0.59 0.03 0.00 0.09 0.00 0.00 57.88 57.87 2crn h LEU 27 Cb 1.72 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 42.22 2crn h LEU 27 CO -0.04 1.20 -0.06 0.11 0.09 0.00 0.00 178.44 179.73 2crn h LYS 28 N 0.31 -0.05 -0.46 1.13 1.57 -0.63 0.09 116.57 118.53 2crn h LYS 28 Ca -0.01 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 2crn h LYS 28 Cb 1.12 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.42 2crn h LYS 28 CO 0.11 -0.04 0.19 0.00 -0.57 0.00 0.00 179.45 179.14 2crn h ALA 29 N 1.05 0.60 0.67 3.86 0.00 -1.51 -1.35 119.26 122.58 2crn h ALA 29 Ca 0.07 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2crn h ALA 29 Cb 0.16 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2crn h ALA 29 CO -0.16 0.19 -0.47 -0.07 0.00 0.00 0.00 179.25 178.75 2crn h LEU 30 N 0.60 -1.21 -1.71 0.00 3.38 -1.04 0.20 115.31 115.54 2crn h LEU 30 Ca 0.15 0.08 0.11 0.00 0.09 0.00 0.00 57.88 58.31 2crn h LEU 30 Cb 0.18 0.37 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 2crn h LEU 30 CO -0.01 -0.69 0.39 0.00 0.09 0.00 0.00 178.44 178.22 2crn h ALA 31 N -0.93 2.11 0.35 1.53 0.00 -0.98 -0.46 119.26 120.88 2crn h ALA 31 Ca -0.09 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2crn h ALA 31 Cb 0.89 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2crn h ALA 31 CO 0.05 -0.25 -0.17 0.00 0.00 0.00 0.00 179.25 178.88 2crn h ALA 32 N 1.71 -0.63 -0.38 0.00 0.00 -0.67 -3.39 119.26 115.90 2crn h ALA 32 Ca 0.27 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2crn h ALA 32 Cb 0.64 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2crn h ALA 32 CO -0.07 -0.60 0.00 0.25 0.00 0.00 0.00 179.25 178.84 2crn n THR 33 N -4.18 0.00 0.00 0.00 -2.24 0.66 -4.92 114.28 103.59 2crn n THR 33 Ca -0.06 1.44 0.00 0.00 -2.27 0.00 0.00 64.05 63.16 2crn n THR 33 Cb 0.18 -2.34 0.00 0.00 -2.10 0.00 0.00 70.33 66.08 2crn n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2crn n GLY 34 N -0.95 0.00 2.52 3.38 0.00 -0.33 -4.91 105.19 104.90 2crn n GLY 34 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.82 0.20 1.61 3.00 -0.35 -4.77 116.66 113.53 2crn n ARG 35 Ca 0.00 0.01 -0.09 0.00 -0.01 0.00 0.00 57.85 57.75 2crn n ARG 35 Cb 0.00 -4.34 -0.05 0.00 0.00 0.00 0.00 32.46 28.08 2crn n ARG 35 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.63 178.50 2crn h LYS 36 N -0.04 -0.55 -3.01 5.56 1.79 -1.91 -3.50 116.57 114.92 2crn h LYS 36 Ca -0.03 0.04 -0.03 0.00 -2.18 0.00 0.00 60.65 58.45 2crn h LYS 36 Cb 0.98 0.13 0.01 0.00 -1.58 0.00 0.00 32.23 31.76 2crn h LYS 36 CO 0.04 -0.35 0.28 -0.08 -1.08 0.00 0.00 179.45 178.26 2crn s THR 37 N -3.51 0.00 -0.01 -0.16 -1.32 -1.26 -5.07 115.64 104.31 2crn s THR 37 Ca -0.09 -1.00 -0.24 0.00 -1.21 0.00 0.00 61.69 59.15 2crn s THR 37 Cb 0.01 -2.99 -0.17 0.00 -1.51 0.00 0.00 72.50 67.85 2crn s THR 37 CO 0.28 0.00 1.15 0.00 -2.21 0.00 0.00 174.62 173.84 2crn h ALA 38 N 2.00 -0.29 -0.64 11.08 0.00 -1.93 -3.16 119.26 126.32 2crn h ALA 38 Ca -0.34 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 54.45 2crn h ALA 38 Cb 1.25 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 19.05 2crn h ALA 38 CO 0.43 -0.44 -0.53 1.49 0.00 0.00 0.00 179.25 180.20 2crn h GLU 39 N -0.73 -0.22 -1.03 0.00 4.22 -1.98 0.43 114.58 115.27 2crn h GLU 39 Ca -0.03 0.01 0.29 0.00 0.08 0.00 0.00 59.36 59.71 2crn h GLU 39 Cb 0.50 0.05 -0.13 0.00 0.50 0.00 0.00 28.75 29.67 2crn h GLU 39 CO 0.05 -0.15 0.62 0.93 -2.18 0.00 0.00 179.01 178.28 2crn h GLU 40 N -0.23 0.42 -0.22 1.92 3.07 -1.98 0.52 114.58 118.08 2crn h GLU 40 Ca 0.14 -0.03 -0.15 0.00 -0.50 0.00 0.00 59.36 58.82 2crn h GLU 40 Cb 0.54 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.35 2crn h GLU 40 CO -0.73 0.28 -0.48 0.00 -1.40 0.00 0.00 179.01 176.68 2crn h ALA 41 N 1.73 0.76 -0.49 3.43 0.00 -0.20 -3.03 119.26 121.47 2crn h ALA 41 Ca 0.67 -0.48 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 2crn h ALA 41 Cb 1.51 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 2crn h ALA 41 CO -0.47 0.67 0.18 -0.07 0.00 0.00 0.00 179.25 179.55 2crn h LEU 42 N 0.46 0.64 -1.30 0.00 -0.00 0.20 0.85 115.31 116.16 2crn h LEU 42 Ca 0.02 -0.08 -0.07 0.00 -0.00 0.00 0.00 57.88 57.76 2crn h LEU 42 Cb 1.00 -0.16 -0.01 0.00 -0.00 0.00 0.00 40.66 41.49 2crn h LEU 42 CO 0.09 0.59 -0.32 0.00 -0.00 0.00 0.00 178.44 178.81 2crn h ALA 43 N 1.50 1.23 0.00 1.53 0.00 -1.23 -1.02 119.26 121.27 2crn h ALA 43 Ca 0.17 -0.29 -0.26 0.00 0.00 0.00 0.00 54.91 54.53 2crn h ALA 43 Cb 0.16 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 2crn h ALA 43 CO -0.01 0.40 -1.52 2.35 0.00 0.00 0.00 179.25 180.46 2crn h TRP 44 N 0.00 0.00 -0.02 0.00 7.01 -1.27 -3.28 115.95 118.39 2crn h TRP 44 Ca -0.00 0.00 -0.23 0.00 2.11 0.00 0.00 58.89 60.76 2crn h TRP 44 Cb 0.66 0.00 0.01 0.00 -2.10 0.00 0.00 29.16 27.73 2crn h TRP 44 CO 0.00 0.96 -0.94 -0.07 -2.79 0.00 0.00 178.44 175.60 2crn h LEU 45 N 0.00 0.68 -1.46 0.65 3.38 -0.66 0.14 115.31 118.03 2crn h LEU 45 Ca -0.22 -0.53 -0.05 0.00 0.09 0.00 0.00 57.88 57.18 2crn h LEU 45 Cb 1.92 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 42.46 2crn h LEU 45 CO 0.09 1.32 -0.22 0.45 0.09 0.00 0.00 178.44 180.17 2crn h HIS 46 N 0.31 0.00 0.02 1.13 3.86 -1.33 -2.13 115.15 117.01 2crn h HIS 46 Ca -0.09 0.00 -0.34 0.00 -1.16 0.00 0.00 60.37 58.78 2crn h HIS 46 Cb 1.58 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 29.99 2crn h HIS 46 CO 0.07 0.22 -2.09 -3.47 0.86 0.00 0.00 177.93 173.52 2crn n ASP 47 N -3.62 0.98 -2.44 2.45 -0.08 -1.19 -4.33 116.55 108.32 2crn n ASP 47 Ca -0.01 0.16 -0.34 0.00 -1.51 0.00 0.00 54.79 53.09 2crn n ASP 47 Cb 0.35 0.08 0.06 0.00 2.34 0.00 0.00 41.12 43.95 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 -3.06 3.12 -0.04 -0.67 8.25 0.47 -4.41 115.22 118.88 2crn n HIS 48 Ca -0.29 -2.76 -0.05 0.00 -0.26 0.00 0.00 57.72 54.36 2crn n HIS 48 Cb 1.08 -1.16 -0.04 0.00 1.12 0.00 0.00 29.99 30.99 2crn n HIS 48 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2crn h ASN 50 N -0.00 0.71 -1.40 0.00 4.21 -1.84 -3.41 115.58 113.85 2crn h ASN 50 Ca -0.17 0.00 -0.63 0.00 1.21 0.00 0.00 56.30 56.70 2crn h ASN 50 Cb 1.27 -0.15 0.14 0.00 -1.12 0.00 0.00 38.32 38.45 2crn h ASN 50 CO -0.03 0.49 -0.78 0.47 -1.29 0.00 0.00 177.43 176.30 2crn n ASP 51 N -4.67 -2.22 -0.04 5.81 8.00 -1.26 -4.88 116.55 117.29 2crn n ASP 51 Ca 0.07 0.92 -0.13 0.00 0.71 0.00 0.00 54.79 56.37 2crn n ASP 51 Cb 0.09 -0.90 -0.08 0.00 -0.02 0.00 0.00 41.12 40.21 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 0.58 0.24 0.00 -0.24 0.13 -1.98 -2.94 132.00 127.78 2crn h PRO 52 Ca -0.33 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2crn h PRO 52 Cb 1.42 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.56 2crn h PRO 52 CO 0.50 0.65 0.00 0.45 -0.23 0.00 0.00 178.00 179.38 2crn n SER 53 N -4.66 0.44 -2.19 1.44 2.88 -1.26 -1.56 113.62 108.71 2crn n SER 53 Ca -0.07 0.71 -0.26 0.00 -1.33 0.00 0.00 58.87 57.92 2crn n SER 53 Cb 0.32 -0.76 0.02 0.00 -0.75 0.00 0.00 64.21 63.03 2crn n SER 53 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2crn n LEU 54 N -2.10 5.02 -4.75 2.46 4.77 -1.11 -5.06 117.00 116.23 2crn n LEU 54 Ca -0.01 -4.88 -0.41 0.00 -0.03 0.00 0.00 56.01 50.67 2crn n LEU 54 Cb 0.03 -0.42 -0.02 0.00 -2.33 0.00 0.00 43.42 40.68 2crn n LEU 54 CO 0.08 2.12 1.10 -1.81 -1.33 0.00 0.00 177.39 177.54 2crn s ASP 55 N -3.47 6.64 0.15 -1.43 1.01 -0.60 -4.70 116.67 114.27 2crn s ASP 55 Ca 0.51 2.69 0.09 0.00 0.71 0.00 0.00 52.55 56.55 2crn s ASP 55 Cb 0.41 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.67 2crn s ASP 55 CO -0.04 -0.70 -0.20 -1.81 0.21 0.00 0.00 175.17 172.63 2crn s ASP 56 N 0.26 2.72 0.17 0.27 1.01 -1.26 -5.05 116.67 114.79 2crn s ASP 56 Ca 0.58 -0.80 -0.07 0.00 0.71 0.00 0.00 52.55 52.97 2crn s ASP 56 Cb -0.42 -0.16 0.05 0.00 1.01 0.00 0.00 42.92 43.40 2crn s ASP 56 CO 0.45 0.02 1.52 1.55 0.21 0.00 0.00 175.17 178.92 2crn h PRO 57 N 3.53 0.80 -5.52 8.23 0.13 -1.97 -3.45 132.00 133.75 2crn h PRO 57 Ca -0.44 -0.42 -0.78 0.00 -0.87 0.00 0.00 66.00 63.49 2crn h PRO 57 Cb 1.20 0.01 0.02 0.00 0.13 0.00 0.00 31.00 32.36 2crn h PRO 57 CO 0.47 1.05 0.40 -0.89 -0.23 0.00 0.00 178.00 178.80 2crn n ILE 58 N -4.04 0.00 -0.07 -3.56 5.41 -1.26 -4.88 119.36 110.95 2crn n ILE 58 Ca -0.02 0.00 -0.07 0.00 1.00 0.00 0.00 62.75 63.66 2crn n ILE 58 Cb 0.54 -0.28 -0.03 0.00 -0.71 0.00 0.00 39.64 39.16 2crn n ILE 58 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 2crn h SER 59 N 3.87 0.00 0.00 4.38 0.02 -2.03 -3.50 113.55 116.28 2crn h SER 59 Ca -0.43 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.40 2crn h SER 59 Cb 1.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.82 2crn h SER 59 CO 0.78 0.85 0.00 0.61 -1.14 0.00 0.00 176.83 177.93 2crn n GLY 60 N 1.61 1.41 3.60 -3.77 0.00 -1.26 -5.00 105.19 101.78 2crn n GLY 60 Ca -0.10 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 44.71 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 0.00 3.43 0.06 1.61 0.04 -1.26 -4.93 135.00 133.95 2crn s PRO 61 Ca 0.00 1.33 -0.28 0.00 0.04 0.00 0.00 61.00 62.10 2crn s PRO 61 Cb 0.00 -4.15 0.09 0.00 0.04 0.00 0.00 34.50 30.48 2crn s PRO 61 CO 0.00 -1.74 1.05 -1.54 0.04 0.00 0.00 177.00 174.81 2crn s SER 62 N 5.44 -0.17 0.07 6.66 1.04 -1.26 -5.18 113.70 120.30 2crn s SER 62 Ca 0.75 -0.24 0.07 0.00 0.48 0.00 0.00 55.95 57.01 2crn s SER 62 Cb -0.21 0.36 -0.03 0.00 0.10 0.00 0.00 66.02 66.25 2crn s SER 62 CO 0.33 -0.65 -0.18 -0.94 0.98 0.00 0.00 173.24 172.78 2crn s SER 63 N -2.83 2.19 0.00 7.02 1.04 -1.26 -5.25 113.70 114.61 2crn s SER 63 Ca 0.11 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 55.95 2crn s SER 63 Cb 0.00 -0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.00 2crn s SER 63 CO -0.02 0.05 0.00 0.61 0.98 0.00 0.00 173.24 174.86