#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wyl n SER 2 N 0.00 1.66 -4.70 1.61 7.64 -1.26 -4.97 113.62 113.61 1wyl n SER 2 Ca 0.00 0.14 -0.39 0.00 1.01 0.00 0.00 58.87 59.63 1wyl n SER 2 Cb 0.00 -0.47 -0.06 0.00 -1.01 0.00 0.00 64.21 62.67 1wyl n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1wyl s SER 3 N -6.41 6.70 0.46 6.43 0.01 -1.26 -5.07 113.70 114.56 1wyl s SER 3 Ca -0.25 0.84 0.00 0.00 1.31 0.00 0.00 55.95 57.85 1wyl s SER 3 Cb 0.09 -2.31 0.00 0.00 0.21 0.00 0.00 66.02 64.01 1wyl s SER 3 CO 0.34 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.51 1wyl n GLY 4 N 3.46 0.21 0.80 3.44 0.00 -1.26 -5.07 105.19 106.77 1wyl n GLY 4 Ca -0.05 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.12 1wyl n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wyl n SER 5 N -2.42 1.03 -4.17 1.61 3.41 -1.26 -5.07 113.62 106.76 1wyl n SER 5 Ca 0.00 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.35 1wyl n SER 5 Cb 0.00 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 63.79 1wyl n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1wyl s SER 6 N -4.65 2.25 -0.27 4.04 0.01 -1.26 -5.08 113.70 108.73 1wyl s SER 6 Ca 0.00 -0.36 -0.28 0.00 1.31 0.00 0.00 55.95 56.62 1wyl s SER 6 Cb 0.00 -0.46 -0.05 0.00 0.21 0.00 0.00 66.02 65.72 1wyl s SER 6 CO 0.00 0.19 2.23 -0.83 0.41 0.00 0.00 173.24 175.24 1wyl s GLY 7 N -0.19 0.37 0.34 3.44 0.00 -1.26 -4.91 107.32 105.11 1wyl s GLY 7 Ca 0.01 0.63 -0.04 0.00 0.00 0.00 0.00 44.72 45.32 1wyl s GLY 7 CO 0.01 3.83 0.50 -1.08 0.00 0.00 0.00 173.10 176.36 1wyl s THR 8 N 8.88 0.00 0.65 0.90 -1.32 -1.26 -5.01 115.64 118.47 1wyl s THR 8 Ca 0.99 -1.54 0.32 0.00 -1.21 0.00 0.00 61.69 60.25 1wyl s THR 8 Cb -0.30 -2.63 0.34 0.00 -1.51 0.00 0.00 72.50 68.41 1wyl s THR 8 CO 0.34 0.00 2.03 1.56 -2.21 0.00 0.00 174.62 176.33 1wyl h GLN 9 N 2.12 0.00 -0.41 7.08 7.50 -2.01 -2.35 115.11 127.04 1wyl h GLN 9 Ca -0.28 0.00 0.09 0.00 0.50 0.00 0.00 58.65 58.95 1wyl h GLN 9 Cb 1.24 0.00 -0.09 0.00 0.05 0.00 0.00 27.48 28.68 1wyl h GLN 9 CO 0.39 0.00 -0.26 1.49 -1.50 0.00 0.00 178.83 178.95 1wyl h GLU 10 N 0.00 -0.18 -0.64 1.46 4.57 -1.95 0.22 114.58 118.07 1wyl h GLU 10 Ca 0.04 0.01 0.05 0.00 -1.18 0.00 0.00 59.36 58.28 1wyl h GLU 10 Cb 0.58 0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 29.17 1wyl h GLU 10 CO -0.00 -0.12 0.42 1.49 -1.18 0.00 0.00 179.01 179.63 1wyl h GLU 11 N -0.18 0.67 0.54 1.92 4.81 -1.77 -2.24 114.58 118.33 1wyl h GLU 11 Ca 0.19 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.36 1wyl h GLU 11 Cb 0.49 -0.15 0.01 0.00 0.63 0.00 0.00 28.75 29.73 1wyl h GLU 11 CO -0.52 0.44 -0.26 1.25 -0.73 0.00 0.00 179.01 179.19 1wyl h LEU 12 N 0.69 -0.61 -0.04 1.64 5.85 -0.92 -2.54 115.31 119.37 1wyl h LEU 12 Ca 0.27 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.98 1wyl h LEU 12 Cb 0.20 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 1wyl h LEU 12 CO -0.08 -0.21 -0.08 0.25 -0.34 0.00 0.00 178.44 177.98 1wyl h LEU 13 N -1.15 -0.26 -0.84 2.25 5.85 -0.53 0.21 115.31 120.84 1wyl h LEU 13 Ca -0.07 0.03 0.13 0.00 0.84 0.00 0.00 57.88 58.81 1wyl h LEU 13 Cb 0.59 0.10 -0.14 0.00 0.37 0.00 0.00 40.66 41.59 1wyl h LEU 13 CO 0.12 -0.06 -0.39 0.03 -0.34 0.00 0.00 178.44 177.80 1wyl h ARG 14 N -0.07 -0.07 -0.58 1.25 3.08 -1.55 0.33 114.38 116.77 1wyl h ARG 14 Ca 0.01 0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.16 1wyl h ARG 14 Cb 0.09 0.02 -0.08 0.00 0.08 0.00 0.00 29.97 30.08 1wyl h ARG 14 CO -0.08 -0.05 0.15 2.35 -1.07 0.00 0.00 179.97 181.28 1wyl h TRP 15 N -0.07 0.24 -0.68 3.04 7.01 -0.97 -0.18 115.95 124.35 1wyl h TRP 15 Ca 0.29 0.03 0.01 0.00 2.11 0.00 0.00 58.89 61.33 1wyl h TRP 15 Cb 0.57 -0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.58 1wyl h TRP 15 CO -0.80 0.01 0.45 0.00 -2.79 0.00 0.00 178.44 175.31 1wyl h GLN 17 N 0.91 0.00 0.18 0.00 4.20 0.86 0.14 115.11 121.40 1wyl h GLN 17 Ca 0.25 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.65 1wyl h GLN 17 Cb -0.09 0.00 0.02 0.00 0.30 0.00 0.00 27.48 27.71 1wyl h GLN 17 CO -0.06 0.13 -1.40 0.93 -0.67 0.00 0.00 178.83 177.76 1wyl h GLU 18 N 0.00 0.38 -0.09 1.46 5.08 -0.80 -2.24 114.58 118.37 1wyl h GLU 18 Ca -0.00 -0.65 -0.08 0.00 -1.00 0.00 0.00 59.36 57.63 1wyl h GLU 18 Cb 0.23 0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1wyl h GLU 18 CO 0.02 1.30 -0.24 1.96 -1.00 0.00 0.00 179.01 181.05 1wyl h GLN 19 N 0.10 0.33 -0.07 2.33 1.08 -0.89 -3.22 115.11 114.77 1wyl h GLN 19 Ca -0.21 -0.23 -0.12 0.00 -1.45 0.00 0.00 58.65 56.65 1wyl h GLN 19 Cb 2.06 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 29.51 1wyl h GLN 19 CO 0.23 0.84 -0.48 1.79 -0.95 0.00 0.00 178.83 180.25 1wyl h THR 20 N -0.13 1.34 -1.75 -0.54 1.35 -0.86 -3.42 112.91 108.89 1wyl h THR 20 Ca -0.00 -1.68 -0.59 0.00 -0.55 0.00 0.00 66.41 63.59 1wyl h THR 20 Cb 0.85 1.82 0.16 0.00 -1.73 0.00 0.00 68.15 69.25 1wyl h THR 20 CO 0.05 0.49 -1.00 0.00 -0.25 0.00 0.00 175.52 174.82 1wyl n ALA 21 N -2.47 -2.97 0.00 6.62 0.00 -0.84 -2.24 120.51 118.62 1wyl n ALA 21 Ca -0.02 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1wyl n ALA 21 Cb 0.52 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.58 1wyl n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wyl n GLY 22 N 2.32 2.95 3.71 0.00 0.00 -1.26 -5.02 105.19 107.89 1wyl n GLY 22 Ca 0.09 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.94 1wyl n GLY 22 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1wyl s TYR 23 N -1.05 2.90 -0.56 1.61 6.14 -0.95 -4.92 117.35 120.51 1wyl s TYR 23 Ca 0.00 0.65 -0.27 0.00 0.64 0.00 0.00 57.07 58.09 1wyl s TYR 23 Cb 0.00 -3.84 -0.02 0.00 0.42 0.00 0.00 41.96 38.52 1wyl s TYR 23 CO 0.00 -3.16 1.83 -1.25 0.64 0.00 0.00 175.55 173.62 1wyl s PRO 24 N 1.72 2.76 0.00 4.97 0.04 -1.26 -2.97 135.00 140.27 1wyl s PRO 24 Ca 0.69 0.74 0.00 0.00 0.04 0.00 0.00 61.00 62.47 1wyl s PRO 24 Cb -0.39 -4.35 0.00 0.00 0.04 0.00 0.00 34.50 29.80 1wyl s PRO 24 CO 0.31 -2.56 0.00 0.41 0.04 0.00 0.00 177.00 175.19 1wyl n GLY 25 N 5.63 3.15 3.60 0.56 0.00 -1.26 -5.06 105.19 111.82 1wyl n GLY 25 Ca 0.21 -1.10 -0.43 0.00 0.00 0.00 0.00 46.02 44.70 1wyl n GLY 25 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wyl s VAL 26 N -0.05 3.25 -0.52 1.61 1.01 -1.16 -4.91 120.40 119.64 1wyl s VAL 26 Ca 0.00 0.26 0.05 0.00 0.00 0.00 0.00 61.98 62.29 1wyl s VAL 26 Cb 0.00 -3.33 0.20 0.00 0.00 0.00 0.00 36.38 33.25 1wyl s VAL 26 CO 0.00 -0.20 0.48 1.57 0.00 0.00 0.00 175.10 176.94 1wyl n HIS 27 N 10.85 0.95 -1.54 5.22 -0.00 -1.26 -4.78 115.22 124.65 1wyl n HIS 27 Ca 0.26 -3.75 -0.38 0.00 0.46 0.00 0.00 57.72 54.31 1wyl n HIS 27 Cb 0.46 -0.21 -0.05 0.00 -0.12 0.00 0.00 29.99 30.06 1wyl n HIS 27 CO 0.00 0.00 0.00 0.28 0.46 0.00 0.00 176.34 177.08 1wyl n VAL 28 N 2.03 -0.02 -0.06 3.57 0.31 -1.26 -4.71 118.33 118.19 1wyl n VAL 28 Ca 0.25 -0.63 -0.05 0.00 -0.01 0.00 0.00 64.34 63.90 1wyl n VAL 28 Cb 0.45 -2.41 -0.10 0.00 -0.91 0.00 0.00 33.84 30.87 1wyl n VAL 28 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1wyl n SER 29 N 14.50 1.88 -3.63 4.52 3.41 -1.26 -4.84 113.62 128.19 1wyl n SER 29 Ca 0.41 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.90 1wyl n SER 29 Cb 0.45 0.90 -0.07 0.00 -0.26 0.00 0.00 64.21 65.23 1wyl n SER 29 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1wyl s ASP 30 N -4.45 -0.67 -0.28 4.04 1.01 -1.26 -5.04 116.67 110.01 1wyl s ASP 30 Ca -0.06 1.28 -0.06 0.00 0.71 0.00 0.00 52.55 54.42 1wyl s ASP 30 Cb 0.04 1.30 -0.19 0.00 1.01 0.00 0.00 42.92 45.08 1wyl s ASP 30 CO 0.52 -0.22 2.92 0.18 0.21 0.00 0.00 175.17 178.79 1wyl n LEU 31 N 2.67 4.83 0.09 1.23 4.32 -1.26 -2.91 117.00 125.97 1wyl n LEU 31 Ca -0.14 -2.88 0.00 0.00 -0.02 0.00 0.00 56.01 52.97 1wyl n LEU 31 Cb 0.56 -1.19 0.00 0.00 -1.62 0.00 0.00 43.42 41.17 1wyl n LEU 31 CO 0.02 1.30 -0.04 -0.24 -1.22 0.00 0.00 177.39 177.22 1wyl n SER 32 N 2.87 0.39 0.00 -1.43 2.88 -1.26 -4.89 113.62 112.19 1wyl n SER 32 Ca 0.41 0.28 0.00 0.00 -1.33 0.00 0.00 58.87 58.23 1wyl n SER 32 Cb 0.62 0.04 0.00 0.00 -0.75 0.00 0.00 64.21 64.12 1wyl n SER 32 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1wyl n SER 33 N -3.39 4.23 0.12 -3.46 7.64 -1.24 -4.46 113.62 113.05 1wyl n SER 33 Ca 0.00 0.00 0.20 0.00 1.01 0.00 0.00 58.87 60.08 1wyl n SER 33 Cb 0.04 0.61 0.72 0.00 -1.01 0.00 0.00 64.21 64.56 1wyl n SER 33 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 1wyl h SER 34 N 0.00 0.00 0.00 6.43 0.87 -1.89 0.52 113.55 119.48 1wyl h SER 34 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1wyl h SER 34 Cb 0.48 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 1wyl h SER 34 CO 0.00 0.00 -1.04 0.79 -0.53 0.00 0.00 176.83 176.05 1wyl n TRP 35 N -3.49 0.00 0.01 2.24 7.02 -1.26 -4.43 117.44 117.53 1wyl n TRP 35 Ca 0.07 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.68 1wyl n TRP 35 Cb 0.66 -0.12 0.59 0.00 -2.42 0.00 0.00 31.31 30.02 1wyl n TRP 35 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1wyl h ALA 36 N 1.96 2.16 -0.50 6.99 0.00 -0.12 -1.64 119.26 128.10 1wyl h ALA 36 Ca 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1wyl h ALA 36 Cb 0.48 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1wyl h ALA 36 CO 0.00 -0.27 0.32 0.22 0.00 0.00 0.00 179.25 179.52 1wyl h ASP 37 N 0.20 0.54 0.00 0.00 3.58 -1.77 -3.33 116.42 115.65 1wyl h ASP 37 Ca 0.21 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.66 1wyl h ASP 37 Cb 0.57 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.50 1wyl h ASP 37 CO -0.04 0.39 0.00 0.61 -2.88 0.00 0.00 179.24 177.32 1wyl n GLY 38 N -1.24 3.35 0.31 -0.78 0.00 -0.62 -4.14 105.19 102.07 1wyl n GLY 38 Ca 0.03 -1.02 0.12 0.00 0.00 0.00 0.00 46.02 45.15 1wyl n GLY 38 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wyl h LEU 39 N 0.00 -0.13 -0.64 0.99 3.38 -1.84 -1.71 115.31 115.35 1wyl h LEU 39 Ca 0.00 0.21 0.06 0.00 0.09 0.00 0.00 57.88 58.24 1wyl h LEU 39 Cb 0.00 0.31 -0.08 0.00 0.09 0.00 0.00 40.66 40.99 1wyl h LEU 39 CO 0.00 -0.19 -0.38 0.00 0.09 0.00 0.00 178.44 177.96 1wyl n ALA 40 N -2.81 -0.41 -0.16 1.53 0.00 -1.26 0.18 120.51 117.57 1wyl n ALA 40 Ca 0.20 0.55 0.07 0.00 0.00 0.00 0.00 53.44 54.26 1wyl n ALA 40 Cb 0.66 -0.02 0.38 0.00 0.00 0.00 0.00 19.45 20.47 1wyl n ALA 40 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1wyl h LEU 41 N 0.00 0.62 -0.45 0.00 3.38 -1.62 -1.54 115.31 115.69 1wyl h LEU 41 Ca 0.10 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 1wyl h LEU 41 Cb 0.26 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1wyl h LEU 41 CO -0.61 0.40 0.15 0.00 0.09 0.00 0.00 178.44 178.47 1wyl h ALA 43 N 1.00 -0.39 -0.84 0.00 0.00 0.48 0.81 119.26 120.30 1wyl h ALA 43 Ca 0.15 -0.15 0.15 0.00 0.00 0.00 0.00 54.91 55.06 1wyl h ALA 43 Cb 0.26 0.15 -0.10 0.00 0.00 0.00 0.00 17.79 18.10 1wyl h ALA 43 CO -0.01 -0.63 0.42 1.25 0.00 0.00 0.00 179.25 180.29 1wyl h LEU 44 N -0.58 0.49 0.46 0.00 5.85 -1.30 0.30 115.31 120.53 1wyl h LEU 44 Ca -0.04 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 1wyl h LEU 44 Cb 0.42 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.48 1wyl h LEU 44 CO 0.07 0.19 -0.22 0.58 -0.34 0.00 0.00 178.44 178.72 1wyl h VAL 45 N 0.59 0.21 0.17 1.05 2.07 -1.24 -1.65 116.25 117.45 1wyl h VAL 45 Ca 0.46 -0.56 0.01 0.00 0.82 0.00 0.00 66.70 67.43 1wyl h VAL 45 Cb 0.68 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 1wyl h VAL 45 CO -0.38 0.04 -0.51 1.88 0.02 0.00 0.00 177.57 178.63 1wyl h TYR 46 N -1.09 -1.45 0.21 1.57 0.05 -0.51 -2.36 116.97 113.40 1wyl h TYR 46 Ca -0.06 0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.76 1wyl h TYR 46 Cb 0.55 0.61 -0.04 0.00 1.01 0.00 0.00 36.73 38.85 1wyl h TYR 46 CO 0.01 -0.59 -0.53 -0.09 -1.05 0.00 0.00 178.16 175.91 1wyl h ARG 47 N -0.77 -0.79 -0.82 4.88 1.12 -0.53 -2.41 114.38 115.06 1wyl h ARG 47 Ca -0.01 0.05 0.14 0.00 -1.11 0.00 0.00 59.98 59.05 1wyl h ARG 47 Cb 0.76 0.18 -0.14 0.00 -0.01 0.00 0.00 29.97 30.76 1wyl h ARG 47 CO -0.25 -0.53 -0.29 1.28 -3.11 0.00 0.00 179.97 177.07 1wyl n LEU 48 N -5.51 -0.47 -4.08 3.80 4.77 -0.62 -3.39 117.00 111.50 1wyl n LEU 48 Ca -0.09 1.42 -0.33 0.00 -0.03 0.00 0.00 56.01 56.98 1wyl n LEU 48 Cb 0.43 -0.35 -0.14 0.00 -2.33 0.00 0.00 43.42 41.03 1wyl n LEU 48 CO 0.18 -1.30 -0.30 -1.10 -1.33 0.00 0.00 177.39 173.54 1wyl s GLN 49 N -5.84 1.90 0.54 3.23 -0.21 -0.90 -4.96 119.66 113.42 1wyl s GLN 49 Ca -0.12 -1.68 0.32 0.00 0.02 0.00 0.00 55.36 53.90 1wyl s GLN 49 Cb 0.18 -3.27 1.35 0.00 1.00 0.00 0.00 33.01 32.27 1wyl s GLN 49 CO 0.60 -0.87 1.98 -1.00 -2.12 0.00 0.00 175.29 173.88 1wyl h PRO 50 N 7.83 0.00 -0.25 2.91 0.13 -1.56 -3.17 132.00 137.88 1wyl h PRO 50 Ca -0.12 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.01 1wyl h PRO 50 Cb 1.04 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 1wyl h PRO 50 CO 0.57 0.04 0.12 0.78 -0.23 0.00 0.00 178.00 179.28 1wyl h GLY 51 N 1.89 0.39 -2.10 1.56 0.00 -1.92 -3.44 103.07 99.44 1wyl h GLY 51 Ca -0.00 -0.19 -0.55 0.00 0.00 0.00 0.00 47.33 46.59 1wyl h GLY 51 CO 0.01 0.18 0.03 1.04 0.00 0.00 0.00 176.54 177.80 1wyl n LEU 52 N -4.82 3.06 -4.06 3.11 4.77 -1.20 -4.95 117.00 112.91 1wyl n LEU 52 Ca -0.03 0.62 -0.21 0.00 -0.03 0.00 0.00 56.01 56.36 1wyl n LEU 52 Cb 0.10 -1.39 0.16 0.00 -2.33 0.00 0.00 43.42 39.95 1wyl n LEU 52 CO 0.35 -2.23 -0.07 0.00 -1.33 0.00 0.00 177.39 174.11 1wyl n LEU 53 N -1.79 -1.45 -4.55 2.23 -0.00 -1.26 -5.01 117.00 105.16 1wyl n LEU 53 Ca 0.12 -0.37 -0.27 0.00 -0.00 0.00 0.00 56.01 55.49 1wyl n LEU 53 Cb 0.50 -0.80 -0.10 0.00 -0.00 0.00 0.00 43.42 43.02 1wyl n LEU 53 CO 0.49 -3.29 -0.43 -1.61 -0.00 0.00 0.00 177.39 172.55 1wyl s GLU 54 N -3.52 1.97 -0.65 1.47 2.02 -1.26 -4.95 118.70 113.78 1wyl s GLU 54 Ca 0.40 -1.30 -0.26 0.00 0.02 0.00 0.00 54.97 53.83 1wyl s GLU 54 Cb -0.07 -2.11 -0.02 0.00 0.10 0.00 0.00 34.13 32.02 1wyl s GLU 54 CO 0.39 0.43 1.87 -1.25 0.02 0.00 0.00 175.26 176.73 1wyl s PRO 55 N -2.77 2.62 -0.01 0.39 0.04 -1.26 -4.74 135.00 129.27 1wyl s PRO 55 Ca 0.24 0.50 0.14 0.00 0.04 0.00 0.00 61.00 61.92 1wyl s PRO 55 Cb -0.09 -4.47 -0.20 0.00 0.04 0.00 0.00 34.50 29.79 1wyl s PRO 55 CO 0.14 -2.81 0.40 0.45 0.04 0.00 0.00 177.00 175.22 1wyl n SER 56 N 12.89 1.40 -0.04 6.66 2.88 -1.26 -4.56 113.62 131.59 1wyl n SER 56 Ca 0.23 -0.27 -0.05 0.00 -1.33 0.00 0.00 58.87 57.45 1wyl n SER 56 Cb 0.51 1.44 -0.05 0.00 -0.75 0.00 0.00 64.21 65.36 1wyl n SER 56 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1wyl n GLU 57 N -1.77 1.53 -0.20 -1.46 -0.58 -1.26 -4.60 120.64 112.29 1wyl n GLU 57 Ca -0.01 0.02 0.19 0.00 -0.42 0.00 0.00 57.16 56.95 1wyl n GLU 57 Cb 0.32 -1.17 0.54 0.00 -0.57 0.00 0.00 31.44 30.56 1wyl n GLU 57 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1wyl h LEU 58 N 0.00 0.34 -1.11 -4.62 4.07 -1.93 0.16 115.31 112.22 1wyl h LEU 58 Ca -0.19 0.03 0.20 0.00 0.08 0.00 0.00 57.88 58.00 1wyl h LEU 58 Cb 1.35 -0.03 -0.10 0.00 1.08 0.00 0.00 40.66 42.96 1wyl h LEU 58 CO -0.01 0.15 0.62 0.06 -1.08 0.00 0.00 178.44 178.17 1wyl h GLN 59 N 0.34 0.67 0.02 1.13 3.07 -1.81 -2.90 115.11 115.63 1wyl h GLN 59 Ca 0.43 -0.04 -0.38 0.00 0.09 0.00 0.00 58.65 58.75 1wyl h GLN 59 Cb 1.14 -0.15 -0.06 0.00 0.08 0.00 0.00 27.48 28.49 1wyl h GLN 59 CO -0.14 0.44 -2.38 0.41 0.09 0.00 0.00 178.83 177.25 1wyl n GLY 60 N -1.37 -0.43 2.95 0.06 0.00 0.01 -5.00 105.19 101.41 1wyl n GLY 60 Ca 0.23 -0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 1wyl n GLY 60 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wyl n LEU 61 N -3.27 -5.78 -4.57 0.99 4.77 0.34 -4.92 117.00 104.56 1wyl n LEU 61 Ca -0.43 0.17 -0.30 0.00 -0.03 0.00 0.00 56.01 55.42 1wyl n LEU 61 Cb 1.01 -0.73 0.23 0.00 -2.33 0.00 0.00 43.42 41.60 1wyl n LEU 61 CO 0.30 -5.75 0.60 -0.83 -1.33 0.00 0.00 177.39 170.38 1wyl s GLY 62 N -0.98 1.56 0.25 -0.72 0.00 -1.26 -4.83 107.32 101.33 1wyl s GLY 62 Ca 0.39 -0.76 -0.06 0.00 0.00 0.00 0.00 44.72 44.29 1wyl s GLY 62 CO 0.81 0.07 1.93 0.00 0.00 0.00 0.00 173.10 175.90 1wyl h ALA 63 N -2.53 1.29 0.01 3.20 0.00 -1.91 -2.88 119.26 116.43 1wyl h ALA 63 Ca -0.48 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.36 1wyl h ALA 63 Cb 1.31 -0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1wyl h ALA 63 CO 0.40 0.65 -0.01 1.25 0.00 0.00 0.00 179.25 181.54 1wyl h LEU 64 N 1.35 -0.02 -1.71 0.00 5.85 -1.90 -3.27 115.31 115.62 1wyl h LEU 64 Ca 0.37 -0.77 0.51 0.00 0.84 0.00 0.00 57.88 58.83 1wyl h LEU 64 Cb -0.14 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 40.79 1wyl h LEU 64 CO -0.09 0.80 1.13 -0.33 -0.34 0.00 0.00 178.44 179.61 1wyl h GLU 65 N -0.87 0.02 0.00 1.25 4.39 -1.89 -1.24 114.58 116.23 1wyl h GLU 65 Ca -0.00 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1wyl h GLU 65 Cb 0.78 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.43 1wyl h GLU 65 CO 0.00 0.01 0.00 0.00 -1.16 0.00 0.00 179.01 177.87 1wyl n ALA 66 N -2.72 -0.28 -0.48 3.43 0.00 -1.10 -3.35 120.51 116.02 1wyl n ALA 66 Ca 0.41 0.00 0.39 0.00 0.00 0.00 0.00 53.44 54.24 1wyl n ALA 66 Cb 1.74 0.00 0.65 0.00 0.00 0.00 0.00 19.45 21.84 1wyl n ALA 66 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1wyl n THR 67 N -1.87 -0.20 -0.01 0.00 -1.04 -0.52 0.46 114.28 111.10 1wyl n THR 67 Ca 0.00 1.63 -0.09 0.00 -2.04 0.00 0.00 64.05 63.55 1wyl n THR 67 Cb 0.00 -2.68 -0.03 0.00 -1.82 0.00 0.00 70.33 65.80 1wyl n THR 67 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1wyl h ALA 68 N 1.40 -0.20 0.97 2.41 0.00 -1.41 -0.49 119.26 121.94 1wyl h ALA 68 Ca 0.83 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.74 1wyl h ALA 68 Cb 2.78 0.48 0.01 0.00 0.00 0.00 0.00 17.79 21.06 1wyl h ALA 68 CO -0.37 -0.69 -0.47 2.35 0.00 0.00 0.00 179.25 180.07 1wyl h TRP 69 N -0.29 -1.21 -0.76 0.00 7.01 -0.04 -2.52 115.95 118.14 1wyl h TRP 69 Ca 0.11 -0.03 0.09 0.00 2.11 0.00 0.00 58.89 61.18 1wyl h TRP 69 Cb 0.46 0.40 -0.12 0.00 -2.10 0.00 0.00 29.16 27.80 1wyl h TRP 69 CO -0.36 -0.75 -0.50 0.00 -2.79 0.00 0.00 178.44 174.04 1wyl h ALA 70 N -1.29 -0.39 -0.32 2.65 0.00 -1.39 1.28 119.26 119.80 1wyl h ALA 70 Ca -0.13 0.12 0.09 0.00 0.00 0.00 0.00 54.91 54.99 1wyl h ALA 70 Cb 1.00 1.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.91 1wyl h ALA 70 CO 0.22 -0.88 0.38 -0.07 0.00 0.00 0.00 179.25 178.90 1wyl h LEU 71 N -0.14 0.00 0.00 0.00 3.38 -1.06 0.75 115.31 118.24 1wyl h LEU 71 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1wyl h LEU 71 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1wyl h LEU 71 CO -0.81 0.00 -0.03 0.50 0.09 0.00 0.00 178.44 178.20 1wyl h LYS 72 N 0.00 0.00 -0.15 1.13 3.64 0.19 -2.74 116.57 118.64 1wyl h LYS 72 Ca 0.15 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.58 1wyl h LYS 72 Cb 0.91 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.72 1wyl h LYS 72 CO -0.00 0.00 0.52 0.28 -2.27 0.00 0.00 179.45 177.98 1wyl h VAL 73 N -0.18 0.08 0.18 2.00 2.07 -0.45 0.42 116.25 120.37 1wyl h VAL 73 Ca 0.00 0.00 -0.34 0.00 0.82 0.00 0.00 66.70 67.18 1wyl h VAL 73 Cb 0.03 0.51 0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1wyl h VAL 73 CO 0.00 0.00 -1.65 0.00 0.02 0.00 0.00 177.57 175.94 1wyl h ALA 74 N 1.10 0.14 0.00 1.67 0.00 -0.98 -1.86 119.26 119.33 1wyl h ALA 74 Ca 0.07 -1.09 0.00 0.00 0.00 0.00 0.00 54.91 53.89 1wyl h ALA 74 Cb 1.11 0.36 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1wyl h ALA 74 CO -0.00 1.00 0.00 1.49 0.00 0.00 0.00 179.25 181.74 1wyl h GLU 75 N 0.10 0.00 0.00 0.00 4.22 0.01 2.03 114.58 120.94 1wyl h GLU 75 Ca -0.30 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.14 1wyl h GLU 75 Cb 2.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.34 1wyl h GLU 75 CO 0.19 0.00 -0.41 0.09 -2.18 0.00 0.00 179.01 176.70 1wyl n ASN 76 N -2.85 1.05 0.01 1.04 3.02 0.38 -3.95 115.26 113.97 1wyl n ASN 76 Ca 0.04 0.34 -0.00 0.00 -0.03 0.00 0.00 54.58 54.93 1wyl n ASN 76 Cb 0.47 -0.68 -0.00 0.00 -0.61 0.00 0.00 39.78 38.96 1wyl n ASN 76 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1wyl h GLU 77 N -0.56 -0.02 -0.03 3.52 4.39 -1.51 -3.32 114.58 117.05 1wyl h GLU 77 Ca 0.00 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.71 1wyl h GLU 77 Cb 0.41 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.06 1wyl h GLU 77 CO 0.00 -0.02 0.06 -0.07 -1.16 0.00 0.00 179.01 177.83 1wyl h LEU 78 N -0.08 0.00 0.26 1.33 3.38 -1.39 -3.45 115.31 115.35 1wyl h LEU 78 Ca -0.00 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 1wyl h LEU 78 Cb 0.02 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 1wyl h LEU 78 CO 0.00 0.00 -0.10 0.61 0.09 0.00 0.00 178.44 179.04 1wyl n GLY 79 N -1.23 0.67 3.56 0.83 0.00 0.62 -4.91 105.19 104.74 1wyl n GLY 79 Ca -0.02 -0.15 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 1wyl n GLY 79 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wyl s ILE 80 N -1.80 3.87 0.10 -0.61 -1.09 0.24 -4.82 121.20 117.10 1wyl s ILE 80 Ca 0.00 -0.81 -0.35 0.00 -2.23 0.00 0.00 60.65 57.26 1wyl s ILE 80 Cb 0.00 -4.94 -0.18 0.00 -1.58 0.00 0.00 42.46 35.76 1wyl s ILE 80 CO 0.00 -1.81 0.97 0.41 -1.23 0.00 0.00 174.94 173.27 1wyl n THR 81 N 6.98 0.76 -2.05 2.92 -1.04 -1.26 -3.92 114.28 116.67 1wyl n THR 81 Ca 0.35 -0.19 -0.40 0.00 -2.04 0.00 0.00 64.05 61.78 1wyl n THR 81 Cb 0.50 -0.26 -0.03 0.00 -1.82 0.00 0.00 70.33 68.72 1wyl n THR 81 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1wyl s PRO 82 N -0.34 2.83 0.16 -2.82 0.04 -1.26 -4.84 135.00 128.77 1wyl s PRO 82 Ca 0.79 0.80 0.05 0.00 0.04 0.00 0.00 61.00 62.68 1wyl s PRO 82 Cb -1.06 -4.33 -0.05 0.00 0.04 0.00 0.00 34.50 29.11 1wyl s PRO 82 CO 0.55 -2.48 1.36 -0.24 0.04 0.00 0.00 177.00 176.23 1wyl h VAL 83 N 6.85 1.57 -3.82 -0.36 3.04 -1.94 -3.45 116.25 118.12 1wyl h VAL 83 Ca -0.28 -2.87 -0.68 0.00 -1.01 0.00 0.00 66.70 61.86 1wyl h VAL 83 Cb 1.16 2.60 -0.20 0.00 -2.01 0.00 0.00 31.29 32.83 1wyl h VAL 83 CO 1.17 0.83 -0.82 -0.69 -1.01 0.00 0.00 177.57 177.05 1wyl s VAL 84 N -3.04 2.72 -0.01 1.51 1.01 -1.26 -5.01 120.40 116.31 1wyl s VAL 84 Ca -0.01 -1.47 -0.29 0.00 0.00 0.00 0.00 61.98 60.20 1wyl s VAL 84 Cb 0.10 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 34.24 1wyl s VAL 84 CO 0.82 0.16 0.96 -0.44 0.00 0.00 0.00 175.10 176.60 1wyl s SER 85 N -1.95 7.33 0.48 3.32 0.01 -1.26 -4.89 113.70 116.73 1wyl s SER 85 Ca 0.16 1.61 0.43 0.00 1.31 0.00 0.00 55.95 59.46 1wyl s SER 85 Cb -0.10 -2.56 1.52 0.00 0.21 0.00 0.00 66.02 65.09 1wyl s SER 85 CO 0.08 -0.26 1.39 0.00 0.41 0.00 0.00 173.24 174.86 1wyl n ALA 86 N 3.99 1.63 0.06 1.44 0.00 -1.26 0.10 120.51 126.46 1wyl n ALA 86 Ca 0.06 0.61 -0.12 0.00 0.00 0.00 0.00 53.44 53.99 1wyl n ALA 86 Cb 0.51 -1.01 -0.08 0.00 0.00 0.00 0.00 19.45 18.87 1wyl n ALA 86 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1wyl h GLN 87 N 0.00 -0.19 -0.72 0.00 5.75 -1.96 -3.11 115.11 114.88 1wyl h GLN 87 Ca 0.83 0.01 0.09 0.00 -0.15 0.00 0.00 58.65 59.43 1wyl h GLN 87 Cb 3.26 0.04 -0.07 0.00 1.07 0.00 0.00 27.48 31.78 1wyl h GLN 87 CO -0.07 0.24 0.37 0.00 -2.65 0.00 0.00 178.83 176.72 1wyl h ALA 88 N -0.04 0.99 -0.22 3.38 0.00 0.30 0.24 119.26 123.91 1wyl h ALA 88 Ca -0.02 0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.99 1wyl h ALA 88 Cb 0.52 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.17 1wyl h ALA 88 CO 0.03 -0.01 -0.31 0.28 0.00 0.00 0.00 179.25 179.24 1wyl h VAL 89 N 0.64 0.29 0.16 0.00 2.07 -1.41 0.15 116.25 118.15 1wyl h VAL 89 Ca 0.35 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.86 1wyl h VAL 89 Cb 0.33 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.40 1wyl h VAL 89 CO -0.25 0.00 -0.08 0.58 0.02 0.00 0.00 177.57 177.84 1wyl h VAL 90 N -0.33 0.97 0.00 2.57 2.07 -1.38 -2.93 116.25 117.22 1wyl h VAL 90 Ca 0.12 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.69 1wyl h VAL 90 Cb 0.53 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 1wyl h VAL 90 CO -0.40 0.21 0.25 0.00 0.02 0.00 0.00 177.57 177.64 1wyl n ALA 91 N -2.46 0.70 -1.16 1.67 0.00 0.79 -4.72 120.51 115.33 1wyl n ALA 91 Ca -0.09 0.14 -0.09 0.00 0.00 0.00 0.00 53.44 53.40 1wyl n ALA 91 Cb 0.26 -0.89 -0.04 0.00 0.00 0.00 0.00 19.45 18.78 1wyl n ALA 91 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wyl n GLY 92 N -1.28 0.87 0.20 0.00 0.00 0.51 -4.75 105.19 100.73 1wyl n GLY 92 Ca -0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.09 1wyl n GLY 92 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1wyl h SER 93 N 0.00 0.00 -3.45 1.61 0.02 -1.84 -3.37 113.55 106.52 1wyl h SER 93 Ca -0.19 0.00 -0.62 0.00 -0.84 0.00 0.00 61.79 60.15 1wyl h SER 93 Cb 0.74 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 62.87 1wyl h SER 93 CO 0.27 0.28 -0.68 -1.81 -1.14 0.00 0.00 176.83 173.75 1wyl s ASP 94 N -6.26 3.96 0.36 3.07 1.01 -1.26 -4.94 116.67 112.62 1wyl s ASP 94 Ca 0.02 -3.20 0.15 0.00 0.71 0.00 0.00 52.55 50.23 1wyl s ASP 94 Cb 0.09 -1.32 0.69 0.00 1.01 0.00 0.00 42.92 43.39 1wyl s ASP 94 CO 0.67 -0.18 1.77 1.55 0.21 0.00 0.00 175.17 179.18 1wyl h PRO 95 N 6.08 0.00 0.27 8.23 0.13 -1.91 -3.22 132.00 141.58 1wyl h PRO 95 Ca 0.06 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.18 1wyl h PRO 95 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1wyl h PRO 95 CO 0.60 0.41 -0.13 -0.07 -0.23 0.00 0.00 178.00 178.58 1wyl h LEU 96 N 0.00 -0.31 -0.02 1.56 4.07 -1.96 -2.78 115.31 115.87 1wyl h LEU 96 Ca -0.00 -0.13 0.02 0.00 0.08 0.00 0.00 57.88 57.85 1wyl h LEU 96 Cb 0.80 0.08 -0.06 0.00 1.08 0.00 0.00 40.66 42.56 1wyl h LEU 96 CO 0.05 -0.05 -0.53 1.23 -1.08 0.00 0.00 178.44 178.06 1wyl h GLY 97 N -0.58 -1.13 -0.44 0.83 0.00 -1.96 -1.79 103.07 98.02 1wyl h GLY 97 Ca -0.04 0.67 0.07 0.00 0.00 0.00 0.00 47.33 48.03 1wyl h GLY 97 CO 0.06 -0.23 -0.49 -2.00 0.00 0.00 0.00 176.54 173.88 1wyl h LEU 98 N -0.65 -1.66 -0.78 3.11 5.85 -1.61 0.36 115.31 119.93 1wyl h LEU 98 Ca 0.01 0.24 0.18 0.00 0.84 0.00 0.00 57.88 59.16 1wyl h LEU 98 Cb 0.71 0.71 -0.14 0.00 0.37 0.00 0.00 40.66 42.32 1wyl h LEU 98 CO -0.37 -0.37 0.03 0.40 -0.34 0.00 0.00 178.44 177.80 1wyl h ILE 99 N -0.31 0.32 -0.50 4.05 2.04 -1.18 0.24 117.51 122.17 1wyl h ILE 99 Ca 0.13 -0.04 -0.12 0.00 1.00 0.00 0.00 64.86 65.83 1wyl h ILE 99 Cb 0.58 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 1wyl h ILE 99 CO -0.64 0.02 -0.15 0.00 0.00 0.00 0.00 178.15 177.39 1wyl h ALA 100 N 1.73 0.80 0.03 1.87 0.00 -0.10 -2.46 119.26 121.13 1wyl h ALA 100 Ca 0.44 -0.36 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1wyl h ALA 100 Cb 0.79 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1wyl h ALA 100 CO -0.68 0.66 -0.15 -0.92 0.00 0.00 0.00 179.25 178.17 1wyl h TYR 101 N 0.85 -0.38 -0.56 0.00 3.20 0.29 -2.65 116.97 117.72 1wyl h TYR 101 Ca 0.13 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.01 1wyl h TYR 101 Cb 0.70 0.16 -0.03 0.00 1.54 0.00 0.00 36.73 39.11 1wyl h TYR 101 CO 0.04 -0.22 0.36 -0.07 -1.64 0.00 0.00 178.16 176.64 1wyl h LEU 102 N -0.26 0.65 -1.47 2.82 3.38 -1.14 -1.83 115.31 117.47 1wyl h LEU 102 Ca 0.04 -0.03 0.21 0.00 0.09 0.00 0.00 57.88 58.20 1wyl h LEU 102 Cb 0.31 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 1wyl h LEU 102 CO -0.12 0.48 0.87 0.28 0.09 0.00 0.00 178.44 180.03 1wyl h SER 103 N 0.76 0.00 -0.08 -0.43 0.02 -1.07 0.69 113.55 113.43 1wyl h SER 103 Ca 0.20 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 61.00 1wyl h SER 103 Cb -0.07 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.47 1wyl h SER 103 CO -0.04 0.00 -0.55 0.45 -1.14 0.00 0.00 176.83 175.54 1wyl h HIS 104 N 0.00 0.72 -0.10 3.45 3.86 -1.25 -1.57 115.15 120.26 1wyl h HIS 104 Ca 0.35 -0.33 -0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1wyl h HIS 104 Cb 2.08 -0.11 -0.00 0.00 1.06 0.00 0.00 27.41 30.44 1wyl h HIS 104 CO 0.00 1.12 0.05 0.74 0.86 0.00 0.00 177.93 180.70 1wyl h PHE 105 N 0.11 0.14 0.54 2.45 -1.00 0.30 -2.05 116.94 117.43 1wyl h PHE 105 Ca -0.05 -0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.70 1wyl h PHE 105 Cb 1.21 -0.04 0.01 0.00 3.61 0.00 0.00 35.95 40.73 1wyl h PHE 105 CO 0.12 0.18 -0.26 1.25 -1.61 0.00 0.00 178.31 177.99 1wyl h HIS 106 N 0.06 -0.67 -0.68 -0.55 2.76 -1.53 0.68 115.15 115.22 1wyl h HIS 106 Ca 0.03 -0.02 0.20 0.00 -2.20 0.00 0.00 60.37 58.38 1wyl h HIS 106 Cb 0.09 0.22 -0.03 0.00 1.55 0.00 0.00 27.41 29.24 1wyl h HIS 106 CO -0.04 -0.35 0.70 1.03 -1.30 0.00 0.00 177.93 177.97 1wyl h SER 107 N -0.96 0.00 0.21 3.26 0.87 -1.30 1.23 113.55 116.86 1wyl h SER 107 Ca -0.07 0.00 -0.30 0.00 -1.23 0.00 0.00 61.79 60.18 1wyl h SER 107 Cb 0.63 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.53 1wyl h SER 107 CO 0.12 0.00 -2.08 0.00 -0.53 0.00 0.00 176.83 174.35 1wyl n ALA 108 N -2.37 1.63 -2.03 6.23 0.00 -0.77 -4.40 120.51 118.80 1wyl n ALA 108 Ca 0.14 -1.04 -0.25 0.00 0.00 0.00 0.00 53.44 52.28 1wyl n ALA 108 Cb 0.94 -0.48 0.02 0.00 0.00 0.00 0.00 19.45 19.93 1wyl n ALA 108 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1wyl n PHE 109 N -2.81 2.87 -2.64 0.00 3.01 0.23 -4.84 117.46 113.28 1wyl n PHE 109 Ca -0.24 -2.38 -0.36 0.00 1.01 0.00 0.00 57.45 55.47 1wyl n PHE 109 Cb 1.06 -0.39 0.00 0.00 -0.01 0.00 0.00 39.48 40.14 1wyl n PHE 109 CO 0.00 0.00 0.00 0.36 1.01 0.00 0.00 176.76 178.13 1wyl n LYS 110 N -0.69 4.47 -3.41 -1.08 2.85 0.37 -4.79 118.16 115.88 1wyl n LYS 110 Ca 0.45 -4.60 -0.26 0.00 -1.05 0.00 0.00 58.31 52.84 1wyl n LYS 110 Cb 0.90 -2.37 -0.02 0.00 -0.65 0.00 0.00 35.03 32.89 1wyl n LYS 110 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 1wyl s SER 111 N -2.02 6.36 -0.22 -5.58 1.04 -1.26 -5.03 113.70 106.99 1wyl s SER 111 Ca 0.44 0.54 -0.35 0.00 0.48 0.00 0.00 55.95 57.05 1wyl s SER 111 Cb 0.25 -2.07 0.15 0.00 0.10 0.00 0.00 66.02 64.45 1wyl s SER 111 CO -0.16 -0.22 1.25 -0.83 0.98 0.00 0.00 173.24 174.26 1wyl s GLY 112 N -3.57 -0.24 -0.79 7.32 0.00 -1.26 -5.09 107.32 103.68 1wyl s GLY 112 Ca 0.41 1.78 -0.25 0.00 0.00 0.00 0.00 44.72 46.66 1wyl s GLY 112 CO 0.33 0.62 1.91 2.56 0.00 0.00 0.00 173.10 178.52 1wyl s PRO 113 N -2.19 2.58 -0.48 2.90 0.04 -1.26 -4.91 135.00 131.69 1wyl s PRO 113 Ca 0.10 0.07 -0.29 0.00 0.04 0.00 0.00 61.00 60.92 1wyl s PRO 113 Cb -0.01 -4.79 -0.09 0.00 0.04 0.00 0.00 34.50 29.64 1wyl s PRO 113 CO -0.04 -3.12 2.38 0.43 0.04 0.00 0.00 177.00 176.68 1wyl n SER 114 N 13.50 2.21 0.33 6.66 7.64 -1.26 -4.84 113.62 137.86 1wyl n SER 114 Ca 0.32 -0.13 -0.19 0.00 1.01 0.00 0.00 58.87 59.89 1wyl n SER 114 Cb 0.49 -1.44 -0.10 0.00 -1.01 0.00 0.00 64.21 62.15 1wyl n SER 114 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 1wyl h SER 115 N 16.53 -1.36 0.00 6.43 0.87 -2.07 -3.58 113.55 130.37 1wyl h SER 115 Ca -0.25 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.41 1wyl h SER 115 Cb 1.28 0.44 0.00 0.00 -0.44 0.00 0.00 62.40 63.67 1wyl h SER 115 CO 1.13 -0.69 0.00 0.61 -0.53 0.00 0.00 176.83 177.34