#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o8t s GLN 2 N 0.00 4.55 -0.06 1.09 0.74 -1.26 -4.99 119.66 119.74 1o8t s GLN 2 Ca 0.00 1.33 -0.15 0.00 0.05 0.00 0.00 55.36 56.59 1o8t s GLN 2 Cb 0.00 -3.45 -0.11 0.00 1.10 0.00 0.00 33.01 30.56 1o8t s GLN 2 CO 0.00 0.00 0.62 1.96 -0.55 0.00 0.00 175.29 177.32 1o8t h GLN 3 N 6.64 -0.28 -2.87 1.67 7.50 -2.10 -3.35 115.11 122.31 1o8t h GLN 3 Ca -0.41 0.02 -0.65 0.00 0.50 0.00 0.00 58.65 58.11 1o8t h GLN 3 Cb 1.22 0.06 -0.00 0.00 0.05 0.00 0.00 27.48 28.81 1o8t h GLN 3 CO 0.75 0.01 3.37 -0.35 -1.50 0.00 0.00 178.83 181.10 1o8t n PRO 4 N -4.96 3.72 -2.23 1.46 -0.04 -1.26 -4.93 135.00 126.76 1o8t n PRO 4 Ca -0.06 -2.31 -0.43 0.00 -0.04 0.00 0.00 63.50 60.66 1o8t n PRO 4 Cb 0.21 -2.72 -0.02 0.00 -0.04 0.00 0.00 33.50 30.92 1o8t n PRO 4 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1o8t s GLN 5 N 1.58 3.57 -0.78 0.54 -1.52 -1.26 -4.90 119.66 116.89 1o8t s GLN 5 Ca 0.67 1.19 -0.24 0.00 -1.95 0.00 0.00 55.36 55.03 1o8t s GLN 5 Cb 0.19 -4.06 -0.18 0.00 -0.22 0.00 0.00 33.01 28.74 1o8t s GLN 5 CO -0.06 -1.57 1.89 1.04 -0.25 0.00 0.00 175.29 176.34 1o8t n GLN 6 N 8.05 1.19 -2.12 2.91 3.00 -1.26 -4.87 117.38 124.27 1o8t n GLN 6 Ca 0.18 -1.87 -0.32 0.00 -0.01 0.00 0.00 57.00 54.99 1o8t n GLN 6 Cb 0.47 -3.14 -0.04 0.00 0.00 0.00 0.00 30.24 27.53 1o8t n GLN 6 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1o8t s ASP 7 N 5.96 5.35 -1.03 1.08 1.01 -1.26 -4.90 116.67 122.88 1o8t s ASP 7 Ca 0.64 -0.49 -0.24 0.00 0.71 0.00 0.00 52.55 53.17 1o8t s ASP 7 Cb 0.09 -2.55 -0.06 0.00 1.01 0.00 0.00 42.92 41.41 1o8t s ASP 7 CO 0.17 -2.50 1.92 -1.61 0.21 0.00 0.00 175.17 173.36 1o8t s GLU 8 N 6.77 2.60 0.91 8.23 8.01 -1.26 -4.95 118.70 139.00 1o8t s GLU 8 Ca 0.66 -0.72 -0.12 0.00 0.01 0.00 0.00 54.97 54.80 1o8t s GLU 8 Cb -0.08 -5.16 0.14 0.00 -4.31 0.00 0.00 34.13 24.73 1o8t s GLU 8 CO 0.04 -3.56 1.09 -1.64 0.01 0.00 0.00 175.26 171.20 1o8t s MET 9 N 6.66 1.13 0.17 1.61 -1.94 -1.26 -4.95 119.30 120.71 1o8t s MET 9 Ca 0.68 0.83 -0.18 0.00 -1.71 0.00 0.00 55.69 55.31 1o8t s MET 9 Cb -0.04 -1.79 0.10 0.00 2.01 0.00 0.00 34.83 35.11 1o8t s MET 9 CO 0.05 -2.33 1.65 -1.35 -0.01 0.00 0.00 175.02 173.03 1o8t h PRO 10 N -1.62 -0.06 -7.39 2.03 0.11 -2.05 -3.41 132.00 119.61 1o8t h PRO 10 Ca -0.50 0.00 -0.48 0.00 0.11 0.00 0.00 66.00 65.13 1o8t h PRO 10 Cb 1.29 0.01 0.13 0.00 0.11 0.00 0.00 31.00 32.54 1o8t h PRO 10 CO 0.54 -0.04 0.30 -1.54 -0.21 0.00 0.00 178.00 177.04 1o8t s SER 11 N -5.17 3.94 -0.64 -2.05 1.04 -1.26 -4.85 113.70 104.70 1o8t s SER 11 Ca -0.14 1.32 -0.31 0.00 0.48 0.00 0.00 55.95 57.30 1o8t s SER 11 Cb 0.14 -2.01 -0.14 0.00 0.10 0.00 0.00 66.02 64.11 1o8t s SER 11 CO 0.70 -2.32 2.45 -2.65 0.98 0.00 0.00 173.24 172.41 1o8t n PRO 12 N -3.66 0.62 -2.18 4.02 -0.02 -1.26 -4.85 135.00 127.67 1o8t n PRO 12 Ca 0.07 0.07 -0.41 0.00 -2.02 0.00 0.00 63.50 61.21 1o8t n PRO 12 Cb 0.56 -2.39 -0.03 0.00 -0.02 0.00 0.00 33.50 31.63 1o8t n PRO 12 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1o8t s THR 13 N 9.50 3.60 -2.00 3.45 2.01 -1.26 -4.83 115.64 126.10 1o8t s THR 13 Ca 1.16 0.53 0.27 0.00 0.31 0.00 0.00 61.69 63.95 1o8t s THR 13 Cb -0.81 -4.04 0.32 0.00 0.01 0.00 0.00 72.50 67.98 1o8t s THR 13 CO 0.42 -0.82 1.58 0.33 -0.69 0.00 0.00 174.62 175.44 1o8t n PHE 14 N 10.52 0.00 -0.29 4.92 7.35 -1.26 -4.12 117.46 134.58 1o8t n PHE 14 Ca 0.18 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.82 1o8t n PHE 14 Cb 0.49 -0.08 0.07 0.00 0.35 0.00 0.00 39.48 40.31 1o8t n PHE 14 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 1o8t h LEU 15 N 1.67 1.04 -0.53 -2.13 5.85 -1.93 -1.82 115.31 117.46 1o8t h LEU 15 Ca 0.00 -0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.62 1o8t h LEU 15 Cb 0.53 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 1o8t h LEU 15 CO 0.00 0.88 0.29 0.74 -0.34 0.00 0.00 178.44 180.01 1o8t h THR 16 N 1.12 0.99 0.27 1.05 2.02 -1.95 -2.86 112.91 113.55 1o8t h THR 16 Ca 0.27 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 67.25 1o8t h THR 16 Cb 0.12 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 66.91 1o8t h THR 16 CO -0.03 0.10 -0.13 -0.61 0.37 0.00 0.00 175.52 175.22 1o8t h GLN 17 N 0.56 -0.35 -0.51 6.66 5.75 -1.73 -3.21 115.11 122.28 1o8t h GLN 17 Ca 0.23 0.02 0.09 0.00 -0.15 0.00 0.00 58.65 58.84 1o8t h GLN 17 Cb 0.10 0.08 -0.09 0.00 1.07 0.00 0.00 27.48 28.64 1o8t h GLN 17 CO -0.14 -0.16 -0.16 0.28 -2.65 0.00 0.00 178.83 176.00 1o8t n VAL 18 N -5.20 -0.24 -0.07 2.39 0.31 -0.71 0.45 118.33 115.25 1o8t n VAL 18 Ca -0.10 1.19 -0.07 0.00 -0.01 0.00 0.00 64.34 65.35 1o8t n VAL 18 Cb 0.20 -1.61 -0.01 0.00 -0.91 0.00 0.00 33.84 31.51 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 -0.16 -0.09 5.55 1.57 -1.59 -0.02 116.57 121.83 1o8t h LYS 19 Ca 0.22 0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.96 1o8t h LYS 19 Cb 0.34 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 1o8t h LYS 19 CO -0.52 -0.10 -0.15 0.93 -0.57 0.00 0.00 179.45 179.03 1o8t h GLU 20 N -0.16 0.14 -0.68 3.15 3.07 -0.15 -2.27 114.58 117.67 1o8t h GLU 20 Ca 0.16 -0.03 -0.04 0.00 -0.50 0.00 0.00 59.36 58.95 1o8t h GLU 20 Cb 0.40 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.26 1o8t h GLU 20 CO -0.40 0.30 0.28 1.03 -1.40 0.00 0.00 179.01 178.83 1o8t h SER 21 N 0.14 0.91 -0.15 1.42 0.87 -0.07 -1.42 113.55 115.24 1o8t h SER 21 Ca 0.03 -0.12 -0.09 0.00 -1.23 0.00 0.00 61.79 60.38 1o8t h SER 21 Cb 0.36 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1o8t h SER 21 CO 0.02 0.80 -0.25 -0.07 -0.53 0.00 0.00 176.83 176.80 1o8t h LEU 22 N 0.98 0.49 -0.21 2.23 4.07 -0.68 -2.64 115.31 119.53 1o8t h LEU 22 Ca 0.23 -0.53 0.01 0.00 0.08 0.00 0.00 57.88 57.67 1o8t h LEU 22 Cb 0.17 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 41.75 1o8t h LEU 22 CO -0.02 0.93 0.10 -1.28 -1.08 0.00 0.00 178.44 177.09 1o8t h SER 23 N 0.06 0.16 0.41 -0.43 0.87 -1.29 -0.86 113.55 112.46 1o8t h SER 23 Ca 0.01 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1o8t h SER 23 Cb 0.83 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.77 1o8t h SER 23 CO 0.06 0.12 0.00 0.77 -0.53 0.00 0.00 176.83 177.25 1o8t h SER 24 N 0.22 0.00 0.30 6.23 4.64 -1.31 -2.35 113.55 121.27 1o8t h SER 24 Ca 0.09 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.08 1o8t h SER 24 Cb 0.02 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.14 1o8t h SER 24 CO -0.06 0.00 -1.44 0.22 -0.87 0.00 0.00 176.83 174.68 1o8t h TYR 25 N 0.00 0.94 -0.74 4.77 5.03 -0.81 -3.32 116.97 122.84 1o8t h TYR 25 Ca 0.00 -0.68 -0.06 0.00 2.58 0.00 0.00 58.73 60.57 1o8t h TYR 25 Cb 0.20 -0.04 -0.03 0.00 1.55 0.00 0.00 36.73 38.41 1o8t h TYR 25 CO 0.00 1.53 0.24 -1.49 -1.32 0.00 0.00 178.16 177.12 1o8t h TRP 26 N 0.15 1.18 -0.89 -3.82 -0.00 -0.78 0.38 115.95 112.17 1o8t h TRP 26 Ca -0.24 -0.11 0.08 0.00 -0.00 0.00 0.00 58.89 58.62 1o8t h TRP 26 Cb 2.13 -0.34 -0.11 0.00 -0.00 0.00 0.00 29.16 30.84 1o8t h TRP 26 CO 0.12 0.92 -0.58 1.49 -0.00 0.00 0.00 178.44 180.39 1o8t h GLU 27 N 1.10 -0.07 -0.00 0.49 4.22 -1.60 0.13 114.58 118.85 1o8t h GLU 27 Ca 0.24 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.69 1o8t h GLU 27 Cb 0.29 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1o8t h GLU 27 CO -0.01 -0.04 -0.37 0.43 -2.18 0.00 0.00 179.01 176.84 1o8t n SER 28 N -5.25 0.51 0.25 1.04 7.64 -1.20 -4.02 113.62 112.60 1o8t n SER 28 Ca 0.01 -0.27 0.08 0.00 1.01 0.00 0.00 58.87 59.70 1o8t n SER 28 Cb 0.27 0.11 0.62 0.00 -1.01 0.00 0.00 64.21 64.20 1o8t n SER 28 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1o8t h ALA 29 N 3.15 1.94 0.04 -0.43 0.00 0.15 -3.04 119.26 121.07 1o8t h ALA 29 Ca 0.00 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1o8t h ALA 29 Cb 0.49 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 1o8t h ALA 29 CO 0.00 0.04 -0.32 0.87 0.00 0.00 0.00 179.25 179.84 1o8t h LYS 30 N 0.00 -0.48 -1.05 0.00 6.56 -1.66 -0.94 116.57 118.99 1o8t h LYS 30 Ca -0.00 0.03 0.28 0.00 -1.06 0.00 0.00 60.65 59.90 1o8t h LYS 30 Cb 0.06 0.11 -0.10 0.00 -0.57 0.00 0.00 32.23 31.73 1o8t h LYS 30 CO 0.00 -0.32 0.68 1.79 -2.06 0.00 0.00 179.45 179.54 1o8t h THR 31 N -0.50 0.50 -0.63 -0.16 1.35 -1.82 0.44 112.91 112.09 1o8t h THR 31 Ca 0.05 -0.13 -0.02 0.00 -0.55 0.00 0.00 66.41 65.76 1o8t h THR 31 Cb 0.57 0.08 -0.03 0.00 -1.73 0.00 0.00 68.15 67.04 1o8t h THR 31 CO -0.24 0.07 0.30 0.00 -0.25 0.00 0.00 175.52 175.39 1o8t h ALA 32 N 1.63 0.81 -0.21 6.62 0.00 -1.28 -0.62 119.26 126.20 1o8t h ALA 32 Ca 0.61 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.43 1o8t h ALA 32 Cb 1.56 -0.25 -0.07 0.00 0.00 0.00 0.00 17.79 19.03 1o8t h ALA 32 CO -0.31 0.38 -0.43 0.00 0.00 0.00 0.00 179.25 178.89 1o8t h ALA 33 N 1.13 -0.56 -0.42 0.00 0.00 0.39 0.43 119.26 120.24 1o8t h ALA 33 Ca 0.22 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 1o8t h ALA 33 Cb 0.13 0.83 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1o8t h ALA 33 CO -0.03 -0.91 0.01 1.96 0.00 0.00 0.00 179.25 180.28 1o8t h GLN 34 N -0.45 0.66 -0.01 0.00 4.20 -1.44 -2.02 115.11 116.06 1o8t h GLN 34 Ca 0.09 -0.16 -0.02 0.00 0.06 0.00 0.00 58.65 58.63 1o8t h GLN 34 Cb 0.61 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.30 1o8t h GLN 34 CO -0.45 0.67 -0.08 -0.97 -0.67 0.00 0.00 178.83 177.33 1o8t h ASN 35 N 0.63 0.01 -0.47 1.46 -0.73 0.57 -1.58 115.58 115.47 1o8t h ASN 35 Ca 0.13 -0.00 0.05 0.00 1.87 0.00 0.00 56.30 58.35 1o8t h ASN 35 Cb 0.38 -0.00 -0.05 0.00 0.27 0.00 0.00 38.32 38.92 1o8t h ASN 35 CO 0.01 0.10 0.19 0.25 -0.37 0.00 0.00 177.43 177.61 1o8t h LEU 36 N 0.01 0.23 -0.95 0.34 5.85 0.55 0.13 115.31 121.47 1o8t h LEU 36 Ca 0.00 0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 1o8t h LEU 36 Cb 0.16 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 1o8t h LEU 36 CO 0.01 0.16 0.22 1.88 -0.34 0.00 0.00 178.44 180.37 1o8t h TYR 37 N 0.38 1.00 0.01 1.25 -1.99 -1.36 -3.02 116.97 113.25 1o8t h TYR 37 Ca 0.22 -0.08 0.02 0.00 2.00 0.00 0.00 58.73 60.88 1o8t h TYR 37 Cb 0.19 -0.30 -0.02 0.00 2.00 0.00 0.00 36.73 38.60 1o8t h TYR 37 CO -0.14 0.79 -0.11 1.49 -0.00 0.00 0.00 178.16 180.20 1o8t h GLU 38 N 0.95 -0.18 0.00 4.88 4.22 -0.07 -1.60 114.58 122.78 1o8t h GLU 38 Ca 0.22 0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.67 1o8t h GLU 38 Cb 0.25 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1o8t h GLU 38 CO -0.01 -0.12 0.00 1.63 -2.18 0.00 0.00 179.01 178.33 1o8t n LYS 39 N -5.24 0.12 -0.05 1.92 5.02 0.22 -1.94 118.16 118.21 1o8t n LYS 39 Ca -0.06 0.61 -0.13 0.00 -2.02 0.00 0.00 58.31 56.71 1o8t n LYS 39 Cb 0.16 -1.89 -0.11 0.00 -0.02 0.00 0.00 35.03 33.17 1o8t n LYS 39 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1o8t h THR 40 N 0.00 1.58 -0.56 -0.18 2.02 -1.25 -3.33 112.91 111.19 1o8t h THR 40 Ca 0.00 -1.89 -0.08 0.00 0.77 0.00 0.00 66.41 65.21 1o8t h THR 40 Cb 0.01 2.83 -0.02 0.00 -1.74 0.00 0.00 68.15 69.24 1o8t h THR 40 CO 0.00 0.48 0.03 1.88 0.37 0.00 0.00 175.52 178.28 1o8t h TYR 41 N -0.84 1.05 -3.58 3.16 0.05 -1.35 -3.44 116.97 112.02 1o8t h TYR 41 Ca -0.00 -0.17 -0.52 0.00 0.05 0.00 0.00 58.73 58.09 1o8t h TYR 41 Cb 0.79 -0.28 -0.03 0.00 1.01 0.00 0.00 36.73 38.23 1o8t h TYR 41 CO 0.21 0.94 0.09 -0.51 -1.05 0.00 0.00 178.16 177.83 1o8t s LEU 42 N -9.41 4.29 -0.20 3.88 2.01 -0.82 -4.99 118.68 113.45 1o8t s LEU 42 Ca -0.12 1.36 0.05 0.00 0.01 0.00 0.00 54.13 55.42 1o8t s LEU 42 Cb 0.13 -3.66 0.42 0.00 0.01 0.00 0.00 46.19 43.09 1o8t s LEU 42 CO 0.84 -0.01 1.37 -0.81 1.01 0.00 0.00 176.35 178.75 1o8t n PRO 43 N 0.51 2.44 0.20 1.29 -0.04 -1.26 -4.43 135.00 133.71 1o8t n PRO 43 Ca -0.01 -1.75 0.14 0.00 -0.04 0.00 0.00 63.50 61.85 1o8t n PRO 43 Cb 0.52 -1.80 0.67 0.00 -0.04 0.00 0.00 33.50 32.85 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 2.26 1.00 -0.92 0.55 0.00 -1.94 -3.16 119.26 117.06 1o8t h ALA 44 Ca 0.19 0.00 0.17 0.00 0.00 0.00 0.00 54.91 55.26 1o8t h ALA 44 Cb 1.72 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 19.41 1o8t h ALA 44 CO 0.46 0.00 0.51 -0.24 0.00 0.00 0.00 179.25 179.98 1o8t h VAL 45 N 0.00 0.71 -0.26 0.00 3.04 -1.85 0.54 116.25 118.44 1o8t h VAL 45 Ca 0.00 -0.23 -0.11 0.00 -1.01 0.00 0.00 66.70 65.34 1o8t h VAL 45 Cb 0.24 -0.03 -0.01 0.00 -2.01 0.00 0.00 31.29 29.48 1o8t h VAL 45 CO 0.00 0.12 -0.31 -0.78 -1.01 0.00 0.00 177.57 175.59 1o8t h ASP 46 N 0.68 0.55 -0.47 3.17 3.58 -1.94 -2.96 116.42 119.03 1o8t h ASP 46 Ca 0.51 -0.21 -0.12 0.00 0.42 0.00 0.00 57.03 57.63 1o8t h ASP 46 Cb 0.76 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.65 1o8t h ASP 46 CO -0.38 0.84 -0.16 -0.08 -2.88 0.00 0.00 179.24 176.58 1o8t h GLU 47 N 0.46 0.97 -0.53 0.28 4.57 -1.15 -2.84 114.58 116.33 1o8t h GLU 47 Ca 0.06 -0.38 0.13 0.00 -1.18 0.00 0.00 59.36 57.99 1o8t h GLU 47 Cb 0.77 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.29 1o8t h GLU 47 CO 0.06 1.05 0.37 -0.22 -1.18 0.00 0.00 179.01 179.10 1o8t h LYS 48 N 0.85 0.11 0.81 1.92 1.63 -0.92 0.46 116.57 121.43 1o8t h LYS 48 Ca 0.12 -0.01 -0.04 0.00 -0.85 0.00 0.00 60.65 59.88 1o8t h LYS 48 Cb 0.72 -0.02 0.01 0.00 -0.60 0.00 0.00 32.23 32.33 1o8t h LYS 48 CO 0.06 0.07 -0.39 -0.07 -3.45 0.00 0.00 179.45 175.67 1o8t h LEU 49 N 0.11 -0.92 -1.54 5.20 4.07 -1.49 -1.72 115.31 119.03 1o8t h LEU 49 Ca 0.25 0.02 -0.03 0.00 0.08 0.00 0.00 57.88 58.20 1o8t h LEU 49 Cb 0.86 0.24 -0.01 0.00 1.08 0.00 0.00 40.66 42.83 1o8t h LEU 49 CO -0.03 -0.57 -0.06 -0.09 -1.08 0.00 0.00 178.44 176.61 1o8t h ARG 50 N -1.26 0.22 0.34 1.13 9.65 -1.48 -2.23 114.38 120.75 1o8t h ARG 50 Ca -0.11 -0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 58.73 1o8t h ARG 50 Cb 0.84 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.36 1o8t h ARG 50 CO 0.18 0.30 -0.34 -0.44 2.80 0.00 0.00 179.97 182.47 1o8t h ASP 51 N 0.22 -0.93 0.36 -3.80 3.32 0.09 0.17 116.42 115.85 1o8t h ASP 51 Ca 0.05 0.08 -0.04 0.00 0.02 0.00 0.00 57.03 57.14 1o8t h ASP 51 Cb 0.25 0.32 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 1o8t h ASP 51 CO 0.01 -0.48 -0.20 -0.07 -1.72 0.00 0.00 179.24 176.78 1o8t h LEU 52 N -0.71 0.00 -0.04 1.55 4.07 -1.16 -2.56 115.31 116.45 1o8t h LEU 52 Ca -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.93 1o8t h LEU 52 Cb 0.64 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.38 1o8t h LEU 52 CO -0.07 0.20 -0.01 0.22 -1.08 0.00 0.00 178.44 177.70 1o8t h TYR 53 N 0.00 0.09 -0.22 1.13 3.20 -0.75 -0.10 116.97 120.32 1o8t h TYR 53 Ca -0.00 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 1o8t h TYR 53 Cb 0.43 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 1o8t h TYR 53 CO 0.00 0.43 0.13 1.03 -1.64 0.00 0.00 178.16 178.11 1o8t h SER 54 N -0.27 0.27 -0.66 -2.11 0.87 -0.82 -2.69 113.55 108.14 1o8t h SER 54 Ca 0.01 -0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.50 1o8t h SER 54 Cb 0.40 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.26 1o8t h SER 54 CO 0.00 0.24 0.34 0.50 -0.53 0.00 0.00 176.83 177.39 1o8t h LYS 55 N 0.27 0.93 0.00 2.24 3.64 -1.48 -2.34 116.57 119.82 1o8t h LYS 55 Ca 0.08 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1o8t h LYS 55 Cb 0.03 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1o8t h LYS 55 CO -0.01 0.72 0.00 0.77 -2.27 0.00 0.00 179.45 178.65 1o8t h SER 56 N 0.90 0.00 0.75 4.20 0.02 -0.76 -1.46 113.55 117.20 1o8t h SER 56 Ca 0.23 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.15 1o8t h SER 56 Cb 0.07 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.61 1o8t h SER 56 CO -0.03 0.00 -0.45 0.74 -1.14 0.00 0.00 176.83 175.95 1o8t h THR 57 N 0.00 0.00 0.12 -2.27 2.02 -1.10 -1.86 112.91 109.83 1o8t h THR 57 Ca 0.00 0.00 -0.32 0.00 0.77 0.00 0.00 66.41 66.86 1o8t h THR 57 Cb 0.12 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.52 1o8t h THR 57 CO 0.00 0.00 -1.71 0.00 0.37 0.00 0.00 175.52 174.18 1o8t h ALA 58 N -1.27 0.30 0.81 6.16 0.00 -1.72 -3.25 119.26 120.28 1o8t h ALA 58 Ca -0.10 -1.25 -0.04 0.00 0.00 0.00 0.00 54.91 53.52 1o8t h ALA 58 Cb 0.89 0.61 0.01 0.00 0.00 0.00 0.00 17.79 19.30 1o8t h ALA 58 CO 0.11 1.06 -0.39 0.00 0.00 0.00 0.00 179.25 180.03 1o8t h ALA 59 N -0.02 -1.16 0.00 0.00 0.00 -1.39 -3.12 119.26 113.56 1o8t h ALA 59 Ca -0.37 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.29 1o8t h ALA 59 Cb 1.89 0.42 -0.00 0.00 0.00 0.00 0.00 17.79 20.09 1o8t h ALA 59 CO 0.06 -1.08 -0.07 1.98 0.00 0.00 0.00 179.25 180.13 1o8t h MET 60 N -1.20 0.00 0.00 0.00 4.05 -1.47 -1.58 114.93 114.74 1o8t h MET 60 Ca -0.11 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.31 1o8t h MET 60 Cb 0.83 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.63 1o8t h MET 60 CO 0.18 0.07 0.00 1.03 0.23 0.00 0.00 176.91 178.43 1o8t h SER 61 N 0.00 0.00 0.00 1.39 0.87 -1.48 0.40 113.55 114.73 1o8t h SER 61 Ca -0.00 0.00 -0.34 0.00 -1.23 0.00 0.00 61.79 60.22 1o8t h SER 61 Cb 0.15 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.06 1o8t h SER 61 CO 0.01 0.00 -2.01 0.41 -0.53 0.00 0.00 176.83 174.71 1o8t n THR 62 N -2.55 1.52 0.30 2.23 -1.04 -0.63 -4.24 114.28 109.88 1o8t n THR 62 Ca 0.01 -0.22 0.18 0.00 -2.04 0.00 0.00 64.05 61.97 1o8t n THR 62 Cb 0.20 -2.00 0.85 0.00 -1.82 0.00 0.00 70.33 67.56 1o8t n THR 62 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 1o8t h TYR 63 N -1.00 0.00 0.52 -1.42 3.20 -1.45 -0.75 116.97 116.07 1o8t h TYR 63 Ca -0.51 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.33 1o8t h TYR 63 Cb 1.42 0.00 0.01 0.00 1.54 0.00 0.00 36.73 39.70 1o8t h TYR 63 CO -0.12 0.00 -0.25 1.15 -1.64 0.00 0.00 178.16 177.30 1o8t h THR 64 N 0.00 0.00 -0.62 1.81 2.02 -1.11 0.59 112.91 115.60 1o8t h THR 64 Ca 0.00 -0.46 -0.05 0.00 0.77 0.00 0.00 66.41 66.67 1o8t h THR 64 Cb 0.25 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.63 1o8t h THR 64 CO 0.00 0.00 0.19 1.23 0.37 0.00 0.00 175.52 177.31 1o8t h GLY 65 N -1.16 1.01 0.83 2.16 0.00 -1.71 -1.63 103.07 102.57 1o8t h GLY 65 Ca -0.07 -0.57 -0.03 0.00 0.00 0.00 0.00 47.33 46.65 1o8t h GLY 65 CO 0.12 0.54 -0.33 -2.22 0.00 0.00 0.00 176.54 174.64 1o8t h ILE 66 N 0.91 0.19 -0.24 2.60 1.08 -1.17 0.92 117.51 121.80 1o8t h ILE 66 Ca 0.20 -0.22 0.06 0.00 -0.39 0.00 0.00 64.86 64.51 1o8t h ILE 66 Cb 0.27 0.24 -0.07 0.00 -3.07 0.00 0.00 36.82 34.19 1o8t h ILE 66 CO -0.01 0.02 -0.30 0.15 -0.69 0.00 0.00 178.15 177.32 1o8t h PHE 67 N -1.11 -0.83 0.00 1.37 3.57 0.25 0.42 116.94 120.60 1o8t h PHE 67 Ca -0.10 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.43 1o8t h PHE 67 Cb 0.74 0.40 -0.00 0.00 2.79 0.00 0.00 35.95 39.88 1o8t h PHE 67 CO -0.00 -0.37 -0.11 1.79 -2.23 0.00 0.00 178.31 177.38 1o8t h THR 68 N -0.31 0.56 0.40 4.41 1.35 -1.33 -2.66 112.91 115.33 1o8t h THR 68 Ca 0.13 -0.51 -0.01 0.00 -0.55 0.00 0.00 66.41 65.48 1o8t h THR 68 Cb 0.52 1.33 -0.02 0.00 -1.73 0.00 0.00 68.15 68.25 1o8t h THR 68 CO -0.42 0.11 -0.32 -0.78 -0.25 0.00 0.00 175.52 173.86 1o8t h ASP 69 N 0.00 -0.85 0.70 5.36 3.58 0.15 0.23 116.42 125.59 1o8t h ASP 69 Ca -0.00 0.07 -0.06 0.00 0.42 0.00 0.00 57.03 57.45 1o8t h ASP 69 Cb 0.32 0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.64 1o8t h ASP 69 CO 0.01 -0.48 -0.29 1.56 -2.88 0.00 0.00 179.24 177.17 1o8t h GLN 70 N -0.72 0.00 0.28 0.28 7.50 -1.39 -1.71 115.11 119.35 1o8t h GLN 70 Ca -0.03 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.10 1o8t h GLN 70 Cb 0.63 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.16 1o8t h GLN 70 CO -0.01 0.29 -0.14 0.28 -1.50 0.00 0.00 178.83 177.74 1o8t h VAL 71 N 0.00 0.71 -0.75 -0.54 2.07 -1.08 -2.38 116.25 114.27 1o8t h VAL 71 Ca -0.00 -0.68 0.08 0.00 0.82 0.00 0.00 66.70 66.92 1o8t h VAL 71 Cb 0.71 1.05 -0.05 0.00 -1.52 0.00 0.00 31.29 31.49 1o8t h VAL 71 CO 0.04 0.13 0.49 -0.07 0.02 0.00 0.00 177.57 178.18 1o8t h LEU 72 N -0.77 0.66 -1.24 2.57 4.07 -0.50 -0.13 115.31 119.97 1o8t h LEU 72 Ca -0.04 0.01 0.06 0.00 0.08 0.00 0.00 57.88 57.99 1o8t h LEU 72 Cb 0.50 -0.13 -0.05 0.00 1.08 0.00 0.00 40.66 42.06 1o8t h LEU 72 CO 0.06 0.41 0.54 0.77 -1.08 0.00 0.00 178.44 179.15 1o8t h SER 73 N 0.75 0.82 1.01 -0.43 4.64 -1.13 0.14 113.55 119.36 1o8t h SER 73 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 1o8t h SER 73 Cb 0.34 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1o8t h SER 73 CO -0.12 0.54 0.00 0.58 -0.87 0.00 0.00 176.83 176.96 1o8t h VAL 74 N 0.94 0.00 -0.61 0.95 2.07 -0.49 -2.89 116.25 116.22 1o8t h VAL 74 Ca 0.35 -0.45 -0.06 0.00 0.82 0.00 0.00 66.70 67.36 1o8t h VAL 74 Cb 0.17 1.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 1o8t h VAL 74 CO -0.12 0.00 0.12 0.25 0.02 0.00 0.00 177.57 177.85 1o8t h LEU 75 N 0.00 0.91 -0.41 2.57 5.85 -0.48 0.28 115.31 124.04 1o8t h LEU 75 Ca 0.00 -0.19 -0.17 0.00 0.84 0.00 0.00 57.88 58.36 1o8t h LEU 75 Cb 0.51 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.29 1o8t h LEU 75 CO 0.00 0.90 -0.54 0.11 -0.34 0.00 0.00 178.44 178.57 1o8t h LYS 76 N 0.92 0.73 0.00 1.25 6.56 -1.51 -2.99 116.57 121.53 1o8t h LYS 76 Ca 0.19 -0.46 0.00 0.00 -1.06 0.00 0.00 60.65 59.33 1o8t h LYS 76 Cb 0.36 0.05 0.00 0.00 -0.57 0.00 0.00 32.23 32.07 1o8t h LYS 76 CO 0.00 1.08 0.00 0.41 -2.06 0.00 0.00 179.45 178.88 1o8t n GLY 77 N 0.30 -1.08 2.58 3.86 0.00 -1.05 -4.77 105.19 105.04 1o8t n GLY 77 Ca -0.04 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.98 1o8t n GLY 77 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1o8t n GLU 78 N -1.60 1.39 -0.86 1.61 0.00 -0.47 -5.12 120.64 115.59 1o8t n GLU 78 Ca 0.00 -2.75 0.00 0.00 0.00 0.00 0.00 57.16 54.41 1o8t n GLU 78 Cb 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 31.44 30.53 1o8t n GLU 78 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22