#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3abk n SER 2 N 0.00 2.11 0.00 0.00 2.88 -1.26 -5.07 113.62 112.29 3abk n SER 2 Ca 0.00 -1.62 0.00 0.00 -1.33 0.00 0.00 58.87 55.92 3abk n SER 2 Cb 0.00 -0.07 0.00 0.00 -0.75 0.00 0.00 64.21 63.39 3abk n SER 2 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3abk n ALA 3 N 0.39 0.00 0.00 -1.46 0.00 -1.26 -4.16 120.51 114.02 3abk n ALA 3 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 3abk n ALA 3 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.73 3abk n ALA 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3abk n ALA 4 N 0.00 0.00 -1.06 0.00 0.00 -1.26 -5.12 120.51 113.07 3abk n ALA 4 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3abk n ALA 4 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3abk n ALA 4 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3abk n LYS 5 N 0.00 0.00 0.00 0.00 5.02 -1.26 -5.10 118.16 116.82 3abk n LYS 5 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3abk n LYS 5 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 3abk n LYS 5 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3abk n GLY 6 N 5.00 -2.20 0.00 0.72 0.00 -1.26 -5.17 105.19 102.29 3abk n GLY 6 Ca 0.00 0.70 0.00 0.00 0.00 0.00 0.00 46.02 46.72 3abk n GLY 6 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3abk n ASP 7 N -1.10 0.00 0.00 1.61 -0.08 -1.26 -5.06 116.55 110.67 3abk n ASP 7 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 3abk n ASP 7 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 3abk n ASP 7 CO 0.00 0.00 0.00 1.57 0.12 0.00 0.00 177.20 178.89 3abk n HIS 8 N 0.00 0.00 0.00 -0.67 -0.00 -1.26 -5.09 115.22 108.20 3abk n HIS 8 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 3abk n HIS 8 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 3abk n HIS 8 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3abk n GLY 9 N 0.00 -0.69 0.00 1.57 0.00 -1.26 -5.10 105.19 99.71 3abk n GLY 9 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3abk n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3abk n GLY 10 N -0.30 2.34 0.00 -0.02 0.00 -1.26 -5.30 105.19 100.65 3abk n GLY 10 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.75 3abk n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3abk n GLY 12 N 5.00 -0.41 0.31 -0.02 0.00 -1.26 -4.92 105.19 103.90 3abk n GLY 12 Ca 0.00 -1.64 -0.04 0.00 0.00 0.00 0.00 46.02 44.34 3abk n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3abk h ALA 13 N 0.00 1.03 -0.74 4.61 0.00 -2.05 -2.27 119.26 119.84 3abk h ALA 13 Ca 0.00 -0.06 0.12 0.00 0.00 0.00 0.00 54.91 54.98 3abk h ALA 13 Cb 0.00 -0.33 -0.09 0.00 0.00 0.00 0.00 17.79 17.38 3abk h ALA 13 CO 0.00 0.44 0.33 -0.09 0.00 0.00 0.00 179.25 179.93 3abk h ARG 14 N 1.10 0.49 -0.15 0.00 2.43 -1.98 0.92 114.38 117.20 3abk h ARG 14 Ca 0.30 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 59.30 3abk h ARG 14 Cb -0.13 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.32 3abk h ARG 14 CO -0.07 0.33 -0.45 1.15 -1.51 0.00 0.00 179.97 179.42 3abk h THR 15 N 0.51 1.35 -0.32 0.20 2.02 -1.86 0.51 112.91 115.32 3abk h THR 15 Ca 0.39 -1.72 -0.10 0.00 0.77 0.00 0.00 66.41 65.75 3abk h THR 15 Cb 0.53 2.04 -0.01 0.00 -1.74 0.00 0.00 68.15 68.96 3abk h THR 15 CO -0.35 0.52 -0.21 -0.50 0.37 0.00 0.00 175.52 175.36 3abk h TRP 16 N 0.20 0.68 -0.48 3.16 4.06 -1.16 0.78 115.95 123.17 3abk h TRP 16 Ca -0.01 -0.14 -0.13 0.00 2.06 0.00 0.00 58.89 60.67 3abk h TRP 16 Cb 1.07 -0.17 -0.01 0.00 -1.00 0.00 0.00 29.16 29.04 3abk h TRP 16 CO 0.10 0.77 -0.20 -0.09 -3.56 0.00 0.00 178.44 175.46 3abk h ARG 17 N 0.54 0.98 -0.74 0.49 2.43 -0.74 -0.83 114.38 116.51 3abk h ARG 17 Ca 0.08 -0.41 0.14 0.00 -0.81 0.00 0.00 59.98 58.99 3abk h ARG 17 Cb 0.65 -0.04 -0.10 0.00 -0.42 0.00 0.00 29.97 30.07 3abk h ARG 17 CO 0.05 1.08 0.27 0.35 -1.51 0.00 0.00 179.97 180.21 3abk h PHE 18 N 0.85 0.46 -0.16 2.20 -0.00 -0.31 -1.32 116.94 118.66 3abk h PHE 18 Ca 0.11 0.04 -0.16 0.00 -0.00 0.00 0.00 57.97 57.96 3abk h PHE 18 Cb 0.77 -0.09 -0.01 0.00 -0.00 0.00 0.00 35.95 36.62 3abk h PHE 18 CO 0.05 0.03 -0.57 -0.07 -0.00 0.00 0.00 178.31 177.75 3abk h LEU 19 N 0.40 0.58 0.17 0.59 3.38 -0.46 0.66 115.31 120.63 3abk h LEU 19 Ca 0.41 -0.32 0.01 0.00 0.09 0.00 0.00 57.88 58.08 3abk h LEU 19 Cb 0.64 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 3abk h LEU 19 CO -0.42 1.02 -0.24 0.74 0.09 0.00 0.00 178.44 179.63 3abk h THR 20 N 0.39 0.48 0.00 0.22 2.02 -0.70 -0.08 112.91 115.23 3abk h THR 20 Ca 0.00 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 3abk h THR 20 Cb 1.11 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 3abk h THR 20 CO 0.10 0.00 -1.06 -0.26 0.37 0.00 0.00 175.52 174.67 3abk h PHE 21 N -0.47 0.00 0.00 3.16 -1.00 -1.24 -0.33 116.94 117.06 3abk h PHE 21 Ca 0.01 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.70 3abk h PHE 21 Cb 0.47 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.01 3abk h PHE 21 CO -0.19 0.23 -1.97 0.41 -1.61 0.00 0.00 178.31 175.17 3abk n GLY 22 N 1.25 -1.05 0.90 -1.45 0.00 0.22 -4.39 105.19 100.67 3abk n GLY 22 Ca -0.03 -0.43 -0.02 0.00 0.00 0.00 0.00 46.02 45.54 3abk n GLY 22 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3abk n LEU 23 N -2.45 0.90 0.30 0.99 7.94 -0.41 -4.75 117.00 119.52 3abk n LEU 23 Ca -0.11 0.13 -0.15 0.00 -1.11 0.00 0.00 56.01 54.76 3abk n LEU 23 Cb 0.72 -0.30 -0.08 0.00 0.53 0.00 0.00 43.42 44.29 3abk n LEU 23 CO 0.45 -0.41 0.53 0.00 -1.11 0.00 0.00 177.39 176.84 3abk h ALA 24 N -0.15 -0.77 -0.59 1.96 0.00 -1.07 -0.80 119.26 117.85 3abk h ALA 24 Ca -0.04 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.58 3abk h ALA 24 Cb 0.48 0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 3abk h ALA 24 CO -0.02 -0.83 -0.01 -0.07 0.00 0.00 0.00 179.25 178.32 3abk h LEU 25 N -0.97 1.01 -0.88 0.00 3.38 -1.28 -2.26 115.31 114.31 3abk h LEU 25 Ca -0.08 -0.29 0.17 0.00 0.09 0.00 0.00 57.88 57.77 3abk h LEU 25 Cb 0.65 -0.27 -0.10 0.00 0.09 0.00 0.00 40.66 41.02 3abk h LEU 25 CO 0.13 1.07 0.46 -0.65 0.09 0.00 0.00 178.44 179.53 3abk h PRO 26 N 0.95 0.59 -0.61 1.13 0.11 -1.75 0.63 132.00 133.04 3abk h PRO 26 Ca 0.17 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.22 3abk h PRO 26 Cb 0.56 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.51 3abk h PRO 26 CO 0.03 0.39 0.29 0.77 -0.21 0.00 0.00 178.00 179.27 3abk h SER 27 N 0.61 0.81 -0.49 -2.05 0.02 -0.73 -0.81 113.55 110.90 3abk h SER 27 Ca 0.50 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 61.30 3abk h SER 27 Cb 0.76 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.07 3abk h SER 27 CO -0.39 0.72 0.26 0.58 -1.14 0.00 0.00 176.83 176.86 3abk h VAL 28 N 0.84 1.17 -0.51 2.27 2.07 -0.81 0.66 116.25 121.95 3abk h VAL 28 Ca 0.21 -0.45 0.04 0.00 0.82 0.00 0.00 66.70 67.31 3abk h VAL 28 Cb 0.13 0.58 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 3abk h VAL 28 CO -0.03 0.19 0.28 0.00 0.02 0.00 0.00 177.57 178.03 3abk h ALA 29 N 1.10 0.65 -0.73 1.67 0.00 -0.64 0.29 119.26 121.61 3abk h ALA 29 Ca 0.17 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 3abk h ALA 29 Cb 0.06 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3abk h ALA 29 CO -0.03 -0.05 0.39 -0.07 0.00 0.00 0.00 179.25 179.49 3abk h LEU 30 N 0.54 0.92 -0.78 0.00 3.38 -0.94 -0.71 115.31 117.72 3abk h LEU 30 Ca 0.22 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 3abk h LEU 30 Cb 0.09 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 3abk h LEU 30 CO -0.13 0.76 -0.13 0.00 0.09 0.00 0.00 178.44 179.03 3abk h THR 32 N 0.00 1.34 0.75 0.00 2.02 0.24 -1.74 112.91 115.51 3abk h THR 32 Ca -0.00 -1.70 -0.03 0.00 0.77 0.00 0.00 66.41 65.45 3abk h THR 32 Cb 0.82 2.00 0.00 0.00 -1.74 0.00 0.00 68.15 69.23 3abk h THR 32 CO 0.02 0.52 -0.42 0.25 0.37 0.00 0.00 175.52 176.26 3abk h LEU 33 N 0.22 -1.03 -0.74 2.58 7.12 -1.15 0.92 115.31 123.23 3abk h LEU 33 Ca -0.01 0.05 0.17 0.00 0.13 0.00 0.00 57.88 58.22 3abk h LEU 33 Cb 1.05 0.29 -0.12 0.00 -0.53 0.00 0.00 40.66 41.35 3abk h LEU 33 CO 0.09 -0.67 0.08 -1.13 -0.13 0.00 0.00 178.44 176.69 3abk h ASN 34 N -1.08 -0.18 0.29 1.25 -0.73 -1.25 -1.35 115.58 112.52 3abk h ASN 34 Ca -0.10 0.17 0.00 0.00 1.87 0.00 0.00 56.30 58.25 3abk h ASN 34 Cb 0.85 0.28 -0.03 0.00 0.27 0.00 0.00 38.32 39.69 3abk h ASN 34 CO 0.13 -0.12 -0.38 0.28 -0.37 0.00 0.00 177.43 176.96 3abk h SER 35 N 0.17 -1.06 -0.55 1.15 0.02 -1.32 -3.36 113.55 108.59 3abk h SER 35 Ca 0.41 0.10 -0.33 0.00 -0.84 0.00 0.00 61.79 61.13 3abk h SER 35 Cb 0.73 0.37 -0.12 0.00 0.14 0.00 0.00 62.40 63.52 3abk h SER 35 CO -0.59 -0.50 0.14 0.79 -1.14 0.00 0.00 176.83 175.53 3abk n TRP 36 N -5.47 0.99 0.00 3.45 5.03 0.31 -2.27 117.44 119.49 3abk n TRP 36 Ca -0.09 -1.73 0.00 0.00 3.03 0.00 0.00 57.50 58.71 3abk n TRP 36 Cb 0.37 -1.27 0.00 0.00 -1.03 0.00 0.00 31.31 29.39 3abk n TRP 36 CO 0.00 0.00 0.00 -0.11 -0.03 0.00 0.00 177.69 177.55 3abk n LEU 37 N 1.27 0.00 0.00 -0.99 7.94 -1.23 -4.86 117.00 119.13 3abk n LEU 37 Ca 0.39 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.29 3abk n LEU 37 Cb 0.65 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.60 3abk n LEU 37 CO 0.25 0.00 0.00 1.41 -1.11 0.00 0.00 177.39 177.94 3abk n HIS 38 N 0.00 0.00 -0.49 1.96 8.25 -1.11 -4.91 115.22 118.92 3abk n HIS 38 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3abk n HIS 38 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 3abk n HIS 38 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 3abk n SER 39 N 0.00 -0.59 -0.29 0.41 3.41 -0.96 -5.01 113.62 110.58 3abk n SER 39 Ca 0.00 -0.49 0.00 0.00 -0.26 0.00 0.00 58.87 58.12 3abk n SER 39 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3abk n SER 39 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3abk n GLY 40 N 3.12 -3.28 3.55 5.00 0.00 -1.26 -4.87 105.19 107.45 3abk n GLY 40 Ca 0.00 -1.09 -0.39 0.00 0.00 0.00 0.00 46.02 44.55 3abk n GLY 40 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3abk s HIS 41 N -2.29 1.72 0.27 1.61 3.76 -1.26 -5.00 115.29 114.09 3abk s HIS 41 Ca 0.00 0.70 -0.29 0.00 -0.15 0.00 0.00 55.06 55.32 3abk s HIS 41 Cb 0.00 -4.14 -0.10 0.00 1.11 0.00 0.00 32.58 29.45 3abk s HIS 41 CO 0.00 -2.29 1.28 1.03 -0.85 0.00 0.00 174.74 173.92 3abk s ARG 42 N 6.92 4.41 0.11 1.40 3.00 -1.26 -4.94 118.95 128.59 3abk s ARG 42 Ca 0.64 2.09 -0.30 0.00 0.00 0.00 0.00 55.73 58.16 3abk s ARG 42 Cb -0.12 -3.14 -0.06 0.00 0.00 0.00 0.00 34.95 31.63 3abk s ARG 42 CO 0.20 -0.17 1.06 -2.00 0.00 0.00 0.00 175.30 174.40 3abk s GLU 43 N -0.98 4.59 0.49 3.54 -6.30 -1.26 -4.95 118.70 113.83 3abk s GLU 43 Ca 0.52 1.61 -0.24 0.00 -2.50 0.00 0.00 54.97 54.36 3abk s GLU 43 Cb -0.37 -3.35 -0.07 0.00 0.00 0.00 0.00 34.13 30.34 3abk s GLU 43 CO 0.45 0.03 1.42 -0.98 0.02 0.00 0.00 175.26 176.19 3abk s ARG 44 N 0.21 3.45 0.52 4.30 1.70 -1.26 -4.97 118.95 122.91 3abk s ARG 44 Ca 0.51 2.38 -0.18 0.00 -0.47 0.00 0.00 55.73 57.97 3abk s ARG 44 Cb -0.26 -2.50 -0.07 0.00 -0.57 0.00 0.00 34.95 31.55 3abk s ARG 44 CO 0.31 -0.99 1.02 -1.25 -1.08 0.00 0.00 175.30 173.32 3abk s PRO 45 N -2.64 3.72 0.28 3.89 0.04 -1.26 -4.96 135.00 134.06 3abk s PRO 45 Ca 0.65 1.19 -0.30 0.00 0.04 0.00 0.00 61.00 62.58 3abk s PRO 45 Cb -0.43 -2.09 -0.13 0.00 0.04 0.00 0.00 34.50 31.89 3abk s PRO 45 CO 0.54 -0.48 1.32 0.00 0.04 0.00 0.00 177.00 178.42 3abk n ALA 46 N -1.43 0.99 -2.10 8.56 0.00 -1.26 -4.93 120.51 120.34 3abk n ALA 46 Ca 0.08 0.39 -0.41 0.00 0.00 0.00 0.00 53.44 53.50 3abk n ALA 46 Cb 0.53 -2.24 -0.03 0.00 0.00 0.00 0.00 19.45 17.71 3abk n ALA 46 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3abk s PHE 47 N -0.51 3.37 -0.07 0.00 2.19 -1.26 -5.03 117.98 116.66 3abk s PHE 47 Ca 0.63 1.31 -0.01 0.00 0.33 0.00 0.00 56.93 59.20 3abk s PHE 47 Cb -0.63 -3.50 0.03 0.00 -1.31 0.00 0.00 43.02 37.61 3abk s PHE 47 CO 0.55 -1.50 -0.02 0.42 1.83 0.00 0.00 175.22 176.50 3abk s ILE 48 N 0.23 0.50 -0.81 3.12 1.01 -1.26 -5.06 121.20 118.92 3abk s ILE 48 Ca 0.56 0.01 -0.06 0.00 0.00 0.00 0.00 60.65 61.16 3abk s ILE 48 Cb -0.34 -0.60 -0.08 0.00 0.01 0.00 0.00 42.46 41.45 3abk s ILE 48 CO 0.36 0.26 2.30 -0.81 0.00 0.00 0.00 174.94 177.05 3abk n PRO 49 N 4.83 2.11 -1.74 2.79 -0.04 -1.26 -4.94 135.00 136.76 3abk n PRO 49 Ca -0.12 -1.37 -0.42 0.00 -0.04 0.00 0.00 63.50 61.55 3abk n PRO 49 Cb 0.50 -2.36 -0.01 0.00 -0.04 0.00 0.00 33.50 31.60 3abk n PRO 49 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3abk n TYR 50 N 3.80 2.66 0.53 0.54 4.01 -1.26 -4.91 117.16 122.53 3abk n TYR 50 Ca 0.45 0.44 0.13 0.00 -0.16 0.00 0.00 57.90 58.76 3abk n TYR 50 Cb 0.24 -2.50 0.30 0.00 -0.31 0.00 0.00 39.34 37.07 3abk n TYR 50 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3abk h HIS 51 N 3.27 0.00 -0.09 -0.72 3.86 -2.00 -3.05 115.15 116.42 3abk h HIS 51 Ca -0.48 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.73 3abk h HIS 51 Cb 1.26 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.73 3abk h HIS 51 CO 0.53 0.00 0.00 -2.39 0.86 0.00 0.00 177.93 176.93 3abk n HIS 52 N -2.38 0.11 -4.38 2.45 1.44 -1.26 -4.83 115.22 106.37 3abk n HIS 52 Ca 0.05 -0.06 -0.19 0.00 -2.01 0.00 0.00 57.72 55.51 3abk n HIS 52 Cb 0.45 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.46 3abk n HIS 52 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 3abk s LEU 53 N -1.67 2.40 -1.53 2.39 1.43 -1.16 -4.73 118.68 115.81 3abk s LEU 53 Ca 0.33 -1.18 -0.13 0.00 -1.03 0.00 0.00 54.13 52.12 3abk s LEU 53 Cb 0.17 -0.51 0.08 0.00 0.03 0.00 0.00 46.19 45.97 3abk s LEU 53 CO 0.27 -0.39 0.95 0.54 0.23 0.00 0.00 176.35 177.95 3abk n ARG 54 N -0.50 -5.30 -1.65 1.70 3.00 -1.26 -4.86 116.66 107.79 3abk n ARG 54 Ca -0.06 0.58 -0.45 0.00 -0.01 0.00 0.00 57.85 57.91 3abk n ARG 54 Cb 0.63 -5.43 -0.03 0.00 0.00 0.00 0.00 32.46 27.63 3abk n ARG 54 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 3abk n ILE 55 N -4.64 0.96 -3.61 0.55 2.08 -1.26 -4.72 119.36 108.72 3abk n ILE 55 Ca 0.02 -0.24 -0.29 0.00 0.56 0.00 0.00 62.75 62.79 3abk n ILE 55 Cb 0.53 -1.36 -0.15 0.00 -0.75 0.00 0.00 39.64 37.92 3abk n ILE 55 CO 0.00 0.00 0.00 -0.13 0.56 0.00 0.00 176.55 176.98 3abk s ARG 56 N -0.43 0.46 -0.05 0.38 1.81 -1.26 -4.94 118.95 114.92 3abk s ARG 56 Ca 0.69 -0.87 0.19 0.00 -1.72 0.00 0.00 55.73 54.02 3abk s ARG 56 Cb -0.69 -1.53 -0.29 0.00 -0.45 0.00 0.00 34.95 31.99 3abk s ARG 56 CO 0.50 -1.03 0.37 0.25 -0.68 0.00 0.00 175.30 174.71 3abk n THR 57 N 4.92 0.19 -3.74 0.02 -2.24 -1.26 -4.95 114.28 107.22 3abk n THR 57 Ca -0.02 -0.49 -0.13 0.00 -2.27 0.00 0.00 64.05 61.14 3abk n THR 57 Cb 0.41 -0.03 -0.10 0.00 -2.10 0.00 0.00 70.33 68.51 3abk n THR 57 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3abk s LYS 58 N -3.20 0.47 0.51 -0.78 2.20 -1.26 -5.14 119.74 112.54 3abk s LYS 58 Ca -0.07 0.47 -0.23 0.00 -0.36 0.00 0.00 55.97 55.78 3abk s LYS 58 Cb 0.11 0.23 -0.06 0.00 -1.51 0.00 0.00 37.83 36.60 3abk s LYS 58 CO 0.79 -0.07 1.32 -2.14 -0.36 0.00 0.00 175.35 174.90 3abk s PRO 59 N 0.07 3.38 0.67 4.03 0.02 -1.26 -4.97 135.00 136.93 3abk s PRO 59 Ca -0.01 2.16 -0.16 0.00 0.02 0.00 0.00 61.00 63.01 3abk s PRO 59 Cb -0.03 -2.36 0.01 0.00 0.02 0.00 0.00 34.50 32.13 3abk s PRO 59 CO 0.01 -0.98 1.19 -0.06 -0.33 0.00 0.00 177.00 176.83 3abk s PHE 60 N -1.34 2.28 -0.15 6.54 0.40 -0.20 -4.90 117.98 120.62 3abk s PHE 60 Ca 0.68 1.56 0.00 0.00 -0.60 0.00 0.00 56.93 58.57 3abk s PHE 60 Cb -0.38 -3.41 0.00 0.00 0.51 0.00 0.00 43.02 39.74 3abk s PHE 60 CO 0.46 -2.28 0.91 0.43 0.70 0.00 0.00 175.22 175.45 3abk n SER 61 N -2.27 2.66 -3.72 1.36 7.64 -1.26 -3.91 113.62 114.12 3abk n SER 61 Ca 0.13 -1.97 -0.10 0.00 1.01 0.00 0.00 58.87 57.94 3abk n SER 61 Cb 0.50 -0.49 -0.04 0.00 -1.01 0.00 0.00 64.21 63.17 3abk n SER 61 CO 0.00 0.00 0.00 -1.66 -3.01 0.00 0.00 175.04 170.37 3abk s TRP 62 N -0.14 -0.12 0.00 1.43 -2.14 -1.26 -5.05 118.94 111.65 3abk s TRP 62 Ca 0.00 -0.21 0.00 0.00 2.66 0.00 0.00 56.10 58.55 3abk s TRP 62 Cb 0.00 0.35 0.00 0.00 -3.10 0.00 0.00 33.47 30.72 3abk s TRP 62 CO 0.00 -0.86 0.00 0.41 -2.66 0.00 0.00 176.95 173.84 3abk n GLY 63 N -0.31 2.93 0.74 3.67 0.00 -1.26 -1.54 105.19 109.42 3abk n GLY 63 Ca -0.11 -0.16 0.10 0.00 0.00 0.00 0.00 46.02 45.85 3abk n GLY 63 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3abk n ASP 64 N 2.26 2.21 0.00 1.61 5.75 -1.26 -4.89 116.55 122.23 3abk n ASP 64 Ca 0.00 -1.85 0.00 0.00 -0.01 0.00 0.00 54.79 52.93 3abk n ASP 64 Cb 0.00 -0.18 0.00 0.00 -1.03 0.00 0.00 41.12 39.91 3abk n ASP 64 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3abk n GLY 65 N 1.22 2.03 0.07 6.12 0.00 -0.59 -4.85 105.19 109.20 3abk n GLY 65 Ca 0.16 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.19 3abk n GLY 65 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3abk n ASN 66 N 0.00 1.35 -4.52 1.61 5.15 -1.26 -1.03 115.26 116.55 3abk n ASN 66 Ca 0.00 -1.26 -0.34 0.00 -0.60 0.00 0.00 54.58 52.38 3abk n ASN 66 Cb 0.00 -0.01 -0.12 0.00 -0.53 0.00 0.00 39.78 39.12 3abk n ASN 66 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 3abk s HIS 67 N -0.32 2.91 0.78 1.20 3.76 -1.26 -4.85 115.29 117.51 3abk s HIS 67 Ca 0.02 -0.17 -0.11 0.00 -0.15 0.00 0.00 55.06 54.66 3abk s HIS 67 Cb 0.01 -1.77 0.06 0.00 1.11 0.00 0.00 32.58 31.99 3abk s HIS 67 CO 0.02 0.16 1.08 0.95 -0.85 0.00 0.00 174.74 176.10 3abk s THR 68 N -0.38 3.36 0.29 1.30 -4.23 -1.26 -4.92 115.64 109.80 3abk s THR 68 Ca 0.05 0.44 0.00 0.00 -1.18 0.00 0.00 61.69 61.01 3abk s THR 68 Cb -0.12 -3.08 0.28 0.00 1.34 0.00 0.00 72.50 70.92 3abk s THR 68 CO 0.02 -0.58 1.90 0.15 -0.54 0.00 0.00 174.62 175.58 3abk h PHE 69 N -1.06 1.08 -0.82 3.99 3.04 -2.00 -2.21 116.94 118.96 3abk h PHE 69 Ca -0.46 0.03 -0.57 0.00 3.98 0.00 0.00 57.97 60.95 3abk h PHE 69 Cb 1.24 -0.36 -0.41 0.00 2.56 0.00 0.00 35.95 38.99 3abk h PHE 69 CO 0.53 0.56 -0.56 1.19 -2.02 0.00 0.00 178.31 178.01 3abk n PHE 70 N -4.50 2.85 -1.56 0.41 3.01 -1.26 -5.07 117.46 111.33 3abk n PHE 70 Ca 0.14 -2.37 -0.53 0.00 1.01 0.00 0.00 57.45 55.70 3abk n PHE 70 Cb 0.21 -0.50 -0.06 0.00 -0.01 0.00 0.00 39.48 39.12 3abk n PHE 70 CO 0.00 0.00 0.00 1.58 1.01 0.00 0.00 176.76 179.35 3abk n HIS 71 N -0.73 1.25 -4.07 1.38 -0.00 -0.83 -4.99 115.22 107.22 3abk n HIS 71 Ca 0.47 0.75 -0.32 0.00 0.46 0.00 0.00 57.72 59.07 3abk n HIS 71 Cb 0.91 -2.26 -0.15 0.00 -0.12 0.00 0.00 29.99 28.36 3abk n HIS 71 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 3abk s ASN 72 N 0.29 4.13 0.42 0.26 3.84 -1.26 -5.02 114.94 117.60 3abk s ASN 72 Ca 0.84 -1.22 0.21 0.00 0.21 0.00 0.00 52.86 52.90 3abk s ASN 72 Cb -1.02 -1.51 1.17 0.00 -0.55 0.00 0.00 41.25 39.34 3abk s ASN 72 CO 0.50 -0.15 1.79 -0.65 -2.79 0.00 0.00 177.10 175.80 3abk h PRO 73 N 7.82 0.32 -0.26 0.43 0.11 -1.94 0.11 132.00 138.59 3abk h PRO 73 Ca -0.25 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.75 3abk h PRO 73 Cb 1.06 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 3abk h PRO 73 CO 0.50 0.21 -0.24 0.00 -0.21 0.00 0.00 178.00 178.26 3abk h ARG 74 N 0.33 0.50 0.00 1.05 3.08 -1.95 -3.37 114.38 114.02 3abk h ARG 74 Ca 0.56 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 60.43 3abk h ARG 74 Cb 1.56 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.57 3abk h ARG 74 CO -0.23 0.70 -0.13 1.33 -1.07 0.00 0.00 179.97 180.57 3abk n VAL 75 N -4.13 0.00 -3.54 2.04 0.24 -0.90 -4.85 118.33 107.19 3abk n VAL 75 Ca -0.00 -0.29 -0.41 0.00 -2.04 0.00 0.00 64.34 61.60 3abk n VAL 75 Cb 0.40 0.88 -0.08 0.00 -1.47 0.00 0.00 33.84 33.57 3abk n VAL 75 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 3abk s ASN 76 N -0.83 5.72 0.55 -1.34 0.01 0.35 -5.02 114.94 114.38 3abk s ASN 76 Ca 0.00 -1.91 -0.17 0.00 -0.71 0.00 0.00 52.86 50.07 3abk s ASN 76 Cb 0.00 -2.02 -0.05 0.00 0.41 0.00 0.00 41.25 39.59 3abk s ASN 76 CO 0.00 -0.70 1.05 -2.16 -1.51 0.00 0.00 177.10 173.78 3abk s PRO 77 N 1.37 3.51 0.72 -0.60 0.04 -1.26 -4.72 135.00 134.06 3abk s PRO 77 Ca 0.06 1.25 -0.10 0.00 0.04 0.00 0.00 61.00 62.25 3abk s PRO 77 Cb -0.26 -2.06 0.04 0.00 0.04 0.00 0.00 34.50 32.26 3abk s PRO 77 CO -0.01 -0.66 1.09 -0.51 0.04 0.00 0.00 177.00 176.95 3abk s LEU 78 N -4.13 2.81 0.61 -3.56 1.43 0.24 -4.82 118.68 111.26 3abk s LEU 78 Ca 0.65 0.90 0.27 0.00 -1.03 0.00 0.00 54.13 54.92 3abk s LEU 78 Cb -0.16 -3.59 1.28 0.00 0.03 0.00 0.00 46.19 43.75 3abk s LEU 78 CO 0.31 -1.50 1.70 -0.65 0.23 0.00 0.00 176.35 176.44 3abk h PRO 79 N -0.71 0.00 -0.01 1.29 0.11 -1.88 0.64 132.00 131.43 3abk h PRO 79 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3abk h PRO 79 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3abk h PRO 79 CO 0.64 0.00 -0.13 0.25 -0.21 0.00 0.00 178.00 178.54 3abk n THR 80 N -3.39 0.00 0.00 -1.15 -2.24 -1.26 -4.89 114.28 101.35 3abk n THR 80 Ca 0.10 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 3abk n THR 80 Cb 0.86 0.68 0.00 0.00 -2.10 0.00 0.00 70.33 69.77 3abk n THR 80 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3abk n GLY 81 N 1.28 1.67 3.77 3.38 0.00 0.22 -5.05 105.19 110.46 3abk n GLY 81 Ca 0.15 -2.20 -0.40 0.00 0.00 0.00 0.00 46.02 43.57 3abk n GLY 81 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3abk s TYR 82 N -1.44 2.67 0.74 1.61 2.02 -1.26 -0.59 117.35 121.11 3abk s TYR 82 Ca 0.00 1.32 -0.11 0.00 -0.37 0.00 0.00 57.07 57.92 3abk s TYR 82 Cb 0.00 -3.81 0.04 0.00 -0.40 0.00 0.00 41.96 37.79 3abk s TYR 82 CO 0.00 -2.50 1.08 -1.21 -1.57 0.00 0.00 175.55 171.35 3abk s GLU 83 N -2.26 2.51 0.00 -0.62 2.02 -1.26 -4.89 118.70 114.19 3abk s GLU 83 Ca 0.57 1.07 0.20 0.00 0.02 0.00 0.00 54.97 56.84 3abk s GLU 83 Cb -0.41 -1.93 1.19 0.00 0.10 0.00 0.00 34.13 33.07 3abk s GLU 83 CO 0.54 -1.44 1.58 1.63 0.02 0.00 0.00 175.26 177.59