#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o8t h GLN 2 N 0.00 -0.43 -5.36 -0.78 -0.00 -2.04 -3.49 115.11 103.01 1o8t h GLN 2 Ca 0.00 0.03 -0.22 0.00 -0.00 0.00 0.00 58.65 58.45 1o8t h GLN 2 Cb 0.00 0.10 0.18 0.00 0.00 0.00 0.00 27.48 27.76 1o8t h GLN 2 CO 0.00 -0.26 -0.77 1.04 0.00 0.00 0.00 178.83 178.84 1o8t n GLN 3 N -5.07 -2.11 -0.00 1.69 6.02 -1.26 -4.77 117.38 111.88 1o8t n GLN 3 Ca -0.06 0.89 0.10 0.00 -0.01 0.00 0.00 57.00 57.92 1o8t n GLN 3 Cb 0.19 -5.69 0.53 0.00 1.02 0.00 0.00 30.24 26.28 1o8t n GLN 3 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1o8t h PRO 4 N -0.94 0.32 0.07 -1.09 0.13 -1.95 -2.62 132.00 125.93 1o8t h PRO 4 Ca -0.55 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 64.56 1o8t h PRO 4 Cb 1.28 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1o8t h PRO 4 CO 0.42 0.21 -0.03 0.37 -0.23 0.00 0.00 178.00 178.73 1o8t h GLN 5 N 0.33 -0.09 0.00 0.86 -0.00 -2.04 -3.46 115.11 110.70 1o8t h GLN 5 Ca 0.20 0.01 -0.12 0.00 -0.00 0.00 0.00 58.65 58.74 1o8t h GLN 5 Cb 0.37 0.02 0.06 0.00 0.00 0.00 0.00 27.48 27.94 1o8t h GLN 5 CO -0.05 0.44 0.02 1.04 0.00 0.00 0.00 178.83 180.29 1o8t n GLN 6 N -4.85 -1.94 -2.22 1.69 6.02 -0.99 -4.92 117.38 110.17 1o8t n GLN 6 Ca -0.08 -0.53 -0.43 0.00 -0.01 0.00 0.00 57.00 55.95 1o8t n GLN 6 Cb 0.29 -0.53 -0.02 0.00 1.02 0.00 0.00 30.24 30.99 1o8t n GLN 6 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1o8t s ASP 7 N -2.42 6.81 0.74 1.08 2.15 -1.26 -4.98 116.67 118.79 1o8t s ASP 7 Ca 0.22 1.97 -0.11 0.00 0.43 0.00 0.00 52.55 55.06 1o8t s ASP 7 Cb -0.03 -2.54 0.04 0.00 -0.30 0.00 0.00 42.92 40.10 1o8t s ASP 7 CO 0.17 -0.83 1.09 -1.61 -0.17 0.00 0.00 175.17 173.83 1o8t s GLU 8 N 3.63 2.42 -0.15 4.34 0.41 -1.26 -4.95 118.70 123.12 1o8t s GLU 8 Ca 0.64 1.19 -0.29 0.00 -0.41 0.00 0.00 54.97 56.10 1o8t s GLU 8 Cb -0.28 -1.91 -0.04 0.00 -1.78 0.00 0.00 34.13 30.12 1o8t s GLU 8 CO 0.22 -1.52 1.61 1.41 -0.49 0.00 0.00 175.26 176.49 1o8t s MET 9 N -4.77 3.96 0.57 1.61 1.75 -1.26 -4.99 119.30 116.17 1o8t s MET 9 Ca 0.62 1.86 -0.18 0.00 -1.25 0.00 0.00 55.69 56.74 1o8t s MET 9 Cb -0.17 -4.00 -0.05 0.00 2.84 0.00 0.00 34.83 33.45 1o8t s MET 9 CO 0.53 -1.09 1.08 -1.25 -0.65 0.00 0.00 175.02 173.64 1o8t s PRO 10 N 4.36 3.33 0.20 4.11 0.04 -1.26 -5.01 135.00 140.78 1o8t s PRO 10 Ca 0.71 1.38 -0.30 0.00 0.04 0.00 0.00 61.00 62.83 1o8t s PRO 10 Cb -0.28 -2.02 -0.08 0.00 0.04 0.00 0.00 34.50 32.16 1o8t s PRO 10 CO 0.28 -0.82 1.19 0.45 0.04 0.00 0.00 177.00 178.13 1o8t s SER 11 N -2.31 7.10 0.16 6.66 0.15 -1.26 -4.91 113.70 119.29 1o8t s SER 11 Ca 0.67 2.24 0.21 0.00 0.70 0.00 0.00 55.95 59.78 1o8t s SER 11 Cb -0.19 -2.61 0.87 0.00 -1.71 0.00 0.00 66.02 62.38 1o8t s SER 11 CO 0.31 -0.34 1.65 -0.81 1.20 0.00 0.00 173.24 175.25 1o8t n PRO 12 N 2.30 0.13 0.00 5.44 -0.04 -1.26 -1.84 135.00 139.73 1o8t n PRO 12 Ca 0.04 0.33 0.00 0.00 -0.04 0.00 0.00 63.50 63.82 1o8t n PRO 12 Cb 0.45 -1.73 0.00 0.00 -0.04 0.00 0.00 33.50 32.18 1o8t n PRO 12 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1o8t n THR 13 N -1.97 0.00 -0.06 0.52 -2.24 -1.26 -4.42 114.28 104.85 1o8t n THR 13 Ca 0.03 0.45 -0.04 0.00 -2.27 0.00 0.00 64.05 62.22 1o8t n THR 13 Cb 0.24 -0.90 -0.13 0.00 -2.10 0.00 0.00 70.33 67.44 1o8t n THR 13 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1o8t n PHE 14 N -0.63 0.00 0.28 4.78 -0.00 -1.26 -4.44 117.46 116.19 1o8t n PHE 14 Ca 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 57.45 57.58 1o8t n PHE 14 Cb 0.00 -0.68 0.79 0.00 -0.00 0.00 0.00 39.48 39.59 1o8t n PHE 14 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 1o8t h LEU 15 N 0.00 0.00 -0.81 -2.13 7.12 -1.76 -2.44 115.31 115.29 1o8t h LEU 15 Ca -0.32 0.00 0.05 0.00 0.13 0.00 0.00 57.88 57.74 1o8t h LEU 15 Cb 1.67 0.00 -0.05 0.00 -0.53 0.00 0.00 40.66 41.74 1o8t h LEU 15 CO 0.02 0.07 0.51 0.74 -0.13 0.00 0.00 178.44 179.64 1o8t h THR 16 N 0.00 1.07 0.31 1.05 2.02 -1.58 -2.77 112.91 113.02 1o8t h THR 16 Ca -0.00 -0.33 -0.02 0.00 0.77 0.00 0.00 66.41 66.84 1o8t h THR 16 Cb 0.18 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.63 1o8t h THR 16 CO 0.01 0.17 -0.15 1.56 0.37 0.00 0.00 175.52 177.48 1o8t h GLN 17 N 0.95 -0.41 -0.52 6.66 4.20 -1.72 -3.21 115.11 121.07 1o8t h GLN 17 Ca 0.34 0.03 0.09 0.00 0.06 0.00 0.00 58.65 59.17 1o8t h GLN 17 Cb 0.10 0.09 -0.09 0.00 0.30 0.00 0.00 27.48 27.88 1o8t h GLN 17 CO -0.15 -0.20 -0.17 0.28 -0.67 0.00 0.00 178.83 177.92 1o8t n VAL 18 N -5.23 -0.25 -0.05 -0.54 0.31 -1.05 0.37 118.33 111.89 1o8t n VAL 18 Ca -0.10 1.21 -0.08 0.00 -0.01 0.00 0.00 64.34 65.36 1o8t n VAL 18 Cb 0.22 -1.63 -0.01 0.00 -0.91 0.00 0.00 33.84 31.50 1o8t n VAL 18 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1o8t h LYS 19 N 0.00 -0.21 0.00 5.55 1.57 -1.60 -0.30 116.57 121.59 1o8t h LYS 19 Ca 0.21 0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.97 1o8t h LYS 19 Cb 0.34 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 1o8t h LYS 19 CO -0.53 -0.14 -0.19 0.93 -0.57 0.00 0.00 179.45 178.96 1o8t h GLU 20 N -0.22 0.00 -0.48 3.15 3.07 -0.22 -2.32 114.58 117.56 1o8t h GLU 20 Ca 0.14 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.96 1o8t h GLU 20 Cb 0.43 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.32 1o8t h GLU 20 CO -0.38 0.19 0.15 0.77 -1.40 0.00 0.00 179.01 178.34 1o8t h SER 21 N 0.00 0.65 0.34 1.42 0.02 -0.04 -2.38 113.55 113.56 1o8t h SER 21 Ca -0.00 -0.09 -0.13 0.00 -0.84 0.00 0.00 61.79 60.72 1o8t h SER 21 Cb 0.35 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 1o8t h SER 21 CO 0.02 0.62 -0.54 0.25 -1.14 0.00 0.00 176.83 176.05 1o8t h LEU 22 N 0.70 0.24 0.72 5.07 7.12 -0.82 -2.69 115.31 125.65 1o8t h LEU 22 Ca 0.16 -0.12 -0.03 0.00 0.13 0.00 0.00 57.88 58.02 1o8t h LEU 22 Cb 0.21 -0.07 0.00 0.00 -0.53 0.00 0.00 40.66 40.27 1o8t h LEU 22 CO -0.01 0.73 -0.39 0.28 -0.13 0.00 0.00 178.44 178.93 1o8t h SER 23 N 0.17 -0.95 0.35 1.25 0.02 -1.36 -0.66 113.55 112.37 1o8t h SER 23 Ca 0.00 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1o8t h SER 23 Cb 1.01 0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.81 1o8t h SER 23 CO 0.08 -0.63 0.00 0.28 -1.14 0.00 0.00 176.83 175.42 1o8t h SER 24 N -1.02 0.00 0.09 3.07 0.02 -1.58 -2.43 113.55 111.69 1o8t h SER 24 Ca -0.09 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.61 1o8t h SER 24 Cb 0.81 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.37 1o8t h SER 24 CO 0.13 0.00 -1.00 0.22 -1.14 0.00 0.00 176.83 175.04 1o8t h TYR 25 N 0.00 0.84 -0.58 3.45 3.20 -1.00 -3.30 116.97 119.58 1o8t h TYR 25 Ca 0.00 -0.52 -0.05 0.00 3.14 0.00 0.00 58.73 61.30 1o8t h TYR 25 Cb 0.18 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.35 1o8t h TYR 25 CO 0.00 1.37 0.15 2.35 -1.64 0.00 0.00 178.16 180.38 1o8t h TRP 26 N 0.07 0.92 -0.91 -3.82 -0.00 -0.65 0.64 115.95 112.20 1o8t h TRP 26 Ca -0.15 -0.09 0.10 0.00 -0.00 0.00 0.00 58.89 58.75 1o8t h TRP 26 Cb 1.71 -0.27 -0.12 0.00 -0.00 0.00 0.00 29.16 30.48 1o8t h TRP 26 CO 0.14 0.77 -0.54 0.93 -0.00 0.00 0.00 178.44 179.73 1o8t h GLU 27 N 0.86 -0.05 0.00 2.65 3.07 -1.60 0.13 114.58 119.63 1o8t h GLU 27 Ca 0.19 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.05 1o8t h GLU 27 Cb 0.30 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.23 1o8t h GLU 27 CO -0.00 -0.04 -0.62 0.45 -1.40 0.00 0.00 179.01 177.40 1o8t n SER 28 N -5.31 0.62 -0.25 1.42 2.88 -1.19 -4.06 113.62 107.73 1o8t n SER 28 Ca 0.03 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.56 1o8t n SER 28 Cb 0.30 0.23 0.20 0.00 -0.75 0.00 0.00 64.21 64.18 1o8t n SER 28 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1o8t h ALA 29 N 2.65 1.36 -0.27 -1.46 0.00 0.17 -2.85 119.26 118.86 1o8t h ALA 29 Ca 0.00 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.88 1o8t h ALA 29 Cb 0.68 -0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 1o8t h ALA 29 CO 0.00 0.55 -0.13 0.87 0.00 0.00 0.00 179.25 180.54 1o8t h LYS 30 N 1.08 -0.09 -1.03 0.00 1.57 -1.52 0.10 116.57 116.67 1o8t h LYS 30 Ca 0.28 0.01 0.26 0.00 -1.87 0.00 0.00 60.65 59.33 1o8t h LYS 30 Cb -0.05 0.02 -0.11 0.00 0.08 0.00 0.00 32.23 32.17 1o8t h LYS 30 CO -0.05 -0.06 0.64 1.15 -0.57 0.00 0.00 179.45 180.56 1o8t h THR 31 N -0.09 0.51 -0.59 -0.16 2.02 -1.75 0.47 112.91 113.31 1o8t h THR 31 Ca 0.14 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 67.14 1o8t h THR 31 Cb 0.31 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.70 1o8t h THR 31 CO -0.33 0.09 0.28 0.00 0.37 0.00 0.00 175.52 175.93 1o8t h ALA 32 N 1.67 0.76 -0.37 6.16 0.00 -0.99 -0.79 119.26 125.70 1o8t h ALA 32 Ca 0.63 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 55.48 1o8t h ALA 32 Cb 1.41 -0.23 -0.09 0.00 0.00 0.00 0.00 17.79 18.88 1o8t h ALA 32 CO -0.38 0.33 -0.29 0.00 0.00 0.00 0.00 179.25 178.90 1o8t h ALA 33 N 1.12 -0.13 -0.65 0.00 0.00 0.43 0.63 119.26 120.66 1o8t h ALA 33 Ca 0.20 0.11 -0.07 0.00 0.00 0.00 0.00 54.91 55.15 1o8t h ALA 33 Cb 0.12 0.64 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 1o8t h ALA 33 CO -0.03 -0.69 0.15 1.96 0.00 0.00 0.00 179.25 180.64 1o8t h GLN 34 N -0.24 1.04 0.00 0.00 4.20 -1.36 -1.90 115.11 116.85 1o8t h GLN 34 Ca 0.17 -0.24 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 1o8t h GLN 34 Cb 0.51 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.15 1o8t h GLN 34 CO -0.51 0.93 -0.06 -0.97 -0.67 0.00 0.00 178.83 177.55 1o8t h ASN 35 N 0.99 0.00 -0.42 1.46 -1.24 0.56 -1.61 115.58 115.31 1o8t h ASN 35 Ca 0.21 0.00 0.05 0.00 0.71 0.00 0.00 56.30 57.27 1o8t h ASN 35 Cb 0.37 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 39.37 1o8t h ASN 35 CO 0.00 0.06 0.14 0.25 -1.29 0.00 0.00 177.43 176.60 1o8t h LEU 36 N 0.00 0.15 -1.01 0.34 6.46 0.10 0.17 115.31 121.51 1o8t h LEU 36 Ca -0.00 0.05 -0.05 0.00 -0.12 0.00 0.00 57.88 57.76 1o8t h LEU 36 Cb 0.14 0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 40.08 1o8t h LEU 36 CO 0.01 0.12 0.18 0.22 -0.62 0.00 0.00 178.44 178.34 1o8t h TYR 37 N 0.31 0.91 0.25 1.25 3.20 -1.35 -2.99 116.97 118.55 1o8t h TYR 37 Ca 0.20 -0.07 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 1o8t h TYR 37 Cb 0.19 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.18 1o8t h TYR 37 CO -0.16 0.74 -0.22 0.93 -1.64 0.00 0.00 178.16 177.81 1o8t h GLU 38 N 0.86 -0.48 0.00 1.82 3.07 -0.44 -2.35 114.58 117.07 1o8t h GLU 38 Ca 0.19 0.03 0.00 0.00 -0.50 0.00 0.00 59.36 59.09 1o8t h GLU 38 Cb 0.26 0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.28 1o8t h GLU 38 CO -0.01 -0.32 0.00 1.63 -1.40 0.00 0.00 179.01 178.91 1o8t n LYS 39 N -5.35 0.02 0.07 2.33 5.02 0.34 -2.76 118.16 117.83 1o8t n LYS 39 Ca -0.09 0.44 -0.12 0.00 -2.02 0.00 0.00 58.31 56.52 1o8t n LYS 39 Cb 0.26 -1.55 -0.08 0.00 -0.02 0.00 0.00 35.03 33.63 1o8t n LYS 39 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1o8t h THR 40 N 0.00 0.95 -0.56 -0.18 1.35 -1.30 -3.25 112.91 109.92 1o8t h THR 40 Ca 0.00 -0.92 -0.09 0.00 -0.55 0.00 0.00 66.41 64.85 1o8t h THR 40 Cb 0.08 1.48 -0.02 0.00 -1.73 0.00 0.00 68.15 67.96 1o8t h THR 40 CO 0.00 0.20 -0.01 0.22 -0.25 0.00 0.00 175.52 175.69 1o8t h TYR 41 N -0.70 1.05 -3.87 4.73 3.20 -1.62 -3.44 116.97 116.32 1o8t h TYR 41 Ca -0.02 -0.17 -0.51 0.00 3.14 0.00 0.00 58.73 61.16 1o8t h TYR 41 Cb 0.50 -0.28 0.04 0.00 1.54 0.00 0.00 36.73 38.54 1o8t h TYR 41 CO 0.06 0.94 0.54 -0.51 -1.64 0.00 0.00 178.16 177.55 1o8t s LEU 42 N -9.26 4.40 -0.16 2.82 1.43 -1.14 -4.95 118.68 111.82 1o8t s LEU 42 Ca -0.11 2.44 0.05 0.00 -1.03 0.00 0.00 54.13 55.49 1o8t s LEU 42 Cb 0.14 -3.75 0.40 0.00 0.03 0.00 0.00 46.19 43.00 1o8t s LEU 42 CO 0.84 -0.44 1.25 -0.81 0.23 0.00 0.00 176.35 177.42 1o8t n PRO 43 N 0.71 2.55 0.20 1.29 -0.04 -1.26 -4.39 135.00 134.07 1o8t n PRO 43 Ca 0.01 -1.59 0.14 0.00 -0.04 0.00 0.00 63.50 62.02 1o8t n PRO 43 Cb 0.44 -1.80 0.67 0.00 -0.04 0.00 0.00 33.50 32.77 1o8t n PRO 43 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1o8t h ALA 44 N 2.52 1.00 -0.53 0.55 0.00 -1.92 -3.33 119.26 117.55 1o8t h ALA 44 Ca 0.11 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.07 1o8t h ALA 44 Cb 1.50 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 19.22 1o8t h ALA 44 CO 0.36 0.00 -0.38 0.28 0.00 0.00 0.00 179.25 179.51 1o8t h VAL 45 N 0.00 0.00 0.00 0.00 2.07 -1.88 0.19 116.25 116.63 1o8t h VAL 45 Ca 0.00 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 1o8t h VAL 45 Cb 0.24 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.00 1o8t h VAL 45 CO 0.00 0.00 -0.20 -0.78 0.02 0.00 0.00 177.57 176.61 1o8t h ASP 46 N -0.08 0.00 -0.40 0.57 3.58 -1.97 -2.85 116.42 115.28 1o8t h ASP 46 Ca 0.09 0.00 -0.09 0.00 0.42 0.00 0.00 57.03 57.45 1o8t h ASP 46 Cb 0.30 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.34 1o8t h ASP 46 CO -0.54 0.20 -0.11 -0.08 -2.88 0.00 0.00 179.24 175.83 1o8t h GLU 47 N 0.00 0.78 0.00 0.28 4.22 -1.14 -2.89 114.58 115.83 1o8t h GLU 47 Ca -0.00 -0.30 -0.00 0.00 0.08 0.00 0.00 59.36 59.13 1o8t h GLU 47 Cb 0.36 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 1o8t h GLU 47 CO 0.03 0.91 -0.01 -0.22 -2.18 0.00 0.00 179.01 177.54 1o8t h LYS 48 N 0.59 0.00 0.44 1.92 1.63 -0.49 0.21 116.57 120.87 1o8t h LYS 48 Ca 0.10 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.88 1o8t h LYS 48 Cb 0.63 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.27 1o8t h LYS 48 CO 0.04 0.01 -0.21 -0.07 -3.45 0.00 0.00 179.45 175.77 1o8t h LEU 49 N 0.00 -0.50 -1.64 5.20 -0.00 -1.51 -1.25 115.31 115.61 1o8t h LEU 49 Ca -0.00 0.02 -0.03 0.00 -0.00 0.00 0.00 57.88 57.87 1o8t h LEU 49 Cb 0.02 0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 40.81 1o8t h LEU 49 CO 0.00 -0.32 -0.12 -0.09 -0.00 0.00 0.00 178.44 177.92 1o8t h ARG 50 N -0.68 0.08 0.57 1.13 2.43 -1.57 -2.03 114.38 114.30 1o8t h ARG 50 Ca -0.06 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 1o8t h ARG 50 Cb 0.45 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.97 1o8t h ARG 50 CO 0.10 0.20 -0.48 0.22 -1.51 0.00 0.00 179.97 178.50 1o8t h ASP 51 N 0.08 -1.28 0.54 -3.80 1.82 -0.49 -0.14 116.42 113.15 1o8t h ASP 51 Ca 0.02 0.09 -0.04 0.00 -0.39 0.00 0.00 57.03 56.72 1o8t h ASP 51 Cb 0.26 0.41 -0.01 0.00 0.68 0.00 0.00 39.33 40.67 1o8t h ASP 51 CO 0.02 -0.67 -0.17 -0.07 -1.61 0.00 0.00 179.24 176.74 1o8t h LEU 52 N -1.03 0.00 -0.03 2.28 3.38 -1.11 -2.82 115.31 115.99 1o8t h LEU 52 Ca -0.07 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1o8t h LEU 52 Cb 0.87 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.62 1o8t h LEU 52 CO -0.01 0.17 -0.01 1.88 0.09 0.00 0.00 178.44 180.56 1o8t h TYR 53 N 0.00 0.07 -0.43 1.13 -1.99 -0.82 -0.66 116.97 114.28 1o8t h TYR 53 Ca -0.00 -0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.71 1o8t h TYR 53 Cb 0.48 -0.02 -0.02 0.00 2.00 0.00 0.00 36.73 39.18 1o8t h TYR 53 CO 0.00 0.42 0.25 1.03 -0.00 0.00 0.00 178.16 179.86 1o8t h SER 54 N -0.30 0.52 -0.06 3.88 0.87 -0.92 -2.14 113.55 115.40 1o8t h SER 54 Ca 0.01 -0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.50 1o8t h SER 54 Cb 0.40 -0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 62.22 1o8t h SER 54 CO 0.00 0.44 0.03 0.50 -0.53 0.00 0.00 176.83 177.27 1o8t h LYS 55 N 0.57 0.09 0.00 2.24 3.64 -1.51 -2.51 116.57 119.08 1o8t h LYS 55 Ca 0.15 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 1o8t h LYS 55 Cb 0.01 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1o8t h LYS 55 CO -0.03 0.15 0.00 0.66 -2.27 0.00 0.00 179.45 177.96 1o8t h SER 56 N 0.01 0.00 0.49 4.20 4.64 -0.97 -1.83 113.55 120.09 1o8t h SER 56 Ca 0.02 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.33 1o8t h SER 56 Cb 0.09 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 1o8t h SER 56 CO -0.00 0.00 -0.32 0.74 -0.87 0.00 0.00 176.83 176.38 1o8t h THR 57 N 0.00 0.35 0.11 2.95 2.02 -0.92 -1.00 112.91 116.43 1o8t h THR 57 Ca 0.00 0.00 -0.31 0.00 0.77 0.00 0.00 66.41 66.87 1o8t h THR 57 Cb 0.12 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 66.87 1o8t h THR 57 CO 0.00 0.00 -1.63 0.00 0.37 0.00 0.00 175.52 174.26 1o8t h ALA 58 N -0.33 0.28 0.58 6.16 0.00 -1.68 -3.26 119.26 121.02 1o8t h ALA 58 Ca -0.05 -1.22 -0.03 0.00 0.00 0.00 0.00 54.91 53.60 1o8t h ALA 58 Cb 0.64 0.60 0.01 0.00 0.00 0.00 0.00 17.79 19.03 1o8t h ALA 58 CO 0.05 1.00 -0.28 0.00 0.00 0.00 0.00 179.25 180.02 1o8t h ALA 59 N -0.06 -1.08 0.00 0.00 0.00 -1.43 -3.02 119.26 113.66 1o8t h ALA 59 Ca -0.36 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1o8t h ALA 59 Cb 1.82 0.30 0.00 0.00 0.00 0.00 0.00 17.79 19.91 1o8t h ALA 59 CO 0.04 -1.03 0.00 1.98 0.00 0.00 0.00 179.25 180.24 1o8t h MET 60 N -0.86 0.00 0.00 0.00 4.05 -1.35 -2.25 114.93 114.52 1o8t h MET 60 Ca -0.08 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.34 1o8t h MET 60 Cb 0.60 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.40 1o8t h MET 60 CO 0.13 0.00 0.00 0.77 0.23 0.00 0.00 176.91 178.04 1o8t h SER 61 N 0.00 0.00 0.00 1.39 0.02 -1.48 -0.04 113.55 113.44 1o8t h SER 61 Ca 0.00 0.00 -0.45 0.00 -0.84 0.00 0.00 61.79 60.50 1o8t h SER 61 Cb 0.08 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.55 1o8t h SER 61 CO 0.00 0.00 -2.49 0.35 -1.14 0.00 0.00 176.83 173.55 1o8t n THR 62 N -2.76 1.46 0.30 -2.27 -2.24 -0.85 -4.31 114.28 103.61 1o8t n THR 62 Ca 0.00 -0.38 0.18 0.00 -2.27 0.00 0.00 64.05 61.58 1o8t n THR 62 Cb 0.21 -1.84 0.87 0.00 -2.10 0.00 0.00 70.33 67.47 1o8t n THR 62 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1o8t h TYR 63 N -0.91 0.00 0.44 4.78 3.20 -1.57 -0.40 116.97 122.51 1o8t h TYR 63 Ca -0.67 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.18 1o8t h TYR 63 Cb 1.61 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.88 1o8t h TYR 63 CO -0.08 0.00 -0.21 1.15 -1.64 0.00 0.00 178.16 177.38 1o8t h THR 64 N 0.00 0.25 -0.63 1.81 2.02 -1.20 0.64 112.91 115.81 1o8t h THR 64 Ca 0.00 -0.59 -0.06 0.00 0.77 0.00 0.00 66.41 66.53 1o8t h THR 64 Cb 0.25 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 67.02 1o8t h THR 64 CO 0.00 0.05 0.14 1.23 0.37 0.00 0.00 175.52 177.31 1o8t h GLY 65 N -1.06 1.06 0.84 2.16 0.00 -1.72 -1.36 103.07 102.99 1o8t h GLY 65 Ca -0.06 -0.65 -0.04 0.00 0.00 0.00 0.00 47.33 46.58 1o8t h GLY 65 CO 0.10 0.61 -0.40 -2.22 0.00 0.00 0.00 176.54 174.62 1o8t h ILE 66 N 0.94 0.01 -0.10 2.60 2.04 -1.10 0.86 117.51 122.76 1o8t h ILE 66 Ca 0.20 -0.18 0.04 0.00 1.00 0.00 0.00 64.86 65.92 1o8t h ILE 66 Cb 0.35 0.01 -0.06 0.00 -0.74 0.00 0.00 36.82 36.38 1o8t h ILE 66 CO 0.00 0.00 -0.41 0.15 0.00 0.00 0.00 178.15 177.89 1o8t h PHE 67 N -1.30 -1.16 0.00 1.37 3.57 0.33 0.07 116.94 119.82 1o8t h PHE 67 Ca -0.11 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.43 1o8t h PHE 67 Cb 0.86 0.53 0.00 0.00 2.79 0.00 0.00 35.95 40.12 1o8t h PHE 67 CO -0.00 -0.47 0.00 1.15 -2.23 0.00 0.00 178.31 176.76 1o8t h THR 68 N -0.50 0.00 0.51 4.41 2.02 -1.31 -3.02 112.91 115.02 1o8t h THR 68 Ca 0.07 -0.23 -0.02 0.00 0.77 0.00 0.00 66.41 67.01 1o8t h THR 68 Cb 0.62 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 68.20 1o8t h THR 68 CO -0.37 0.00 -0.39 -0.78 0.37 0.00 0.00 175.52 174.35 1o8t h ASP 69 N 0.00 -1.01 0.74 4.18 1.82 0.13 0.19 116.42 122.47 1o8t h ASP 69 Ca 0.00 0.07 -0.05 0.00 -0.39 0.00 0.00 57.03 56.66 1o8t h ASP 69 Cb 0.23 0.32 -0.01 0.00 0.68 0.00 0.00 39.33 40.55 1o8t h ASP 69 CO 0.00 -0.57 -0.24 -0.61 -1.61 0.00 0.00 179.24 176.21 1o8t h GLN 70 N -0.88 0.00 0.27 0.28 4.15 -1.49 -1.92 115.11 115.52 1o8t h GLN 70 Ca -0.06 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.35 1o8t h GLN 70 Cb 0.74 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.44 1o8t h GLN 70 CO 0.01 0.24 -0.13 0.28 -1.93 0.00 0.00 178.83 177.30 1o8t h VAL 71 N 0.00 0.75 -0.75 2.39 2.07 -1.33 -2.01 116.25 117.37 1o8t h VAL 71 Ca -0.00 -0.69 0.08 0.00 0.82 0.00 0.00 66.70 66.90 1o8t h VAL 71 Cb 0.67 1.10 -0.05 0.00 -1.52 0.00 0.00 31.29 31.50 1o8t h VAL 71 CO 0.03 0.14 0.49 -0.07 0.02 0.00 0.00 177.57 178.18 1o8t h LEU 72 N -0.75 0.65 -1.01 2.57 3.38 -0.57 -0.04 115.31 119.54 1o8t h LEU 72 Ca -0.04 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.00 1o8t h LEU 72 Cb 0.50 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.05 1o8t h LEU 72 CO 0.06 0.41 0.66 -1.28 0.09 0.00 0.00 178.44 178.38 1o8t h SER 73 N 0.74 1.07 0.97 -0.43 0.87 -1.13 0.86 113.55 116.50 1o8t h SER 73 Ca 0.33 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.89 1o8t h SER 73 Cb 0.33 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.06 1o8t h SER 73 CO -0.12 0.70 0.00 0.58 -0.53 0.00 0.00 176.83 177.47 1o8t h VAL 74 N 1.22 0.00 -0.57 2.23 2.07 -0.26 -2.92 116.25 118.03 1o8t h VAL 74 Ca 0.42 -0.40 -0.06 0.00 0.82 0.00 0.00 66.70 67.48 1o8t h VAL 74 Cb 0.10 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1o8t h VAL 74 CO -0.15 0.00 0.09 0.25 0.02 0.00 0.00 177.57 177.78 1o8t h LEU 75 N 0.00 0.86 -0.04 2.57 6.46 -0.44 0.99 115.31 125.72 1o8t h LEU 75 Ca 0.00 -0.18 -0.02 0.00 -0.12 0.00 0.00 57.88 57.55 1o8t h LEU 75 Cb 0.49 -0.23 0.00 0.00 -0.73 0.00 0.00 40.66 40.19 1o8t h LEU 75 CO 0.00 0.87 -0.06 0.11 -0.62 0.00 0.00 178.44 178.73 1o8t h LYS 76 N 0.86 0.11 0.53 1.25 1.57 -1.51 -0.79 116.57 118.58 1o8t h LYS 76 Ca 0.18 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.87 1o8t h LYS 76 Cb 0.38 0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.70 1o8t h LYS 76 CO 0.01 0.64 -0.25 0.78 -0.57 0.00 0.00 179.45 180.05 1o8t h GLY 77 N -0.41 -0.74 0.67 3.86 0.00 -1.56 -3.37 103.07 101.53 1o8t h GLY 77 Ca 0.00 0.28 -0.03 0.00 0.00 0.00 0.00 47.33 47.57 1o8t h GLY 77 CO 0.01 -0.27 -0.32 -2.09 0.00 0.00 0.00 176.54 173.87 1o8t h GLU 78 N -1.03 -0.87 0.00 4.80 4.22 -0.96 -3.52 114.58 117.22 1o8t h GLU 78 Ca -0.07 0.06 0.00 0.00 0.08 0.00 0.00 59.36 59.43 1o8t h GLU 78 Cb 0.55 0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.99 1o8t h GLU 78 CO 0.12 -0.58 0.00 -1.91 -2.18 0.00 0.00 179.01 174.46