#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1apz s PRO 3 N 0.00 4.02 0.35 1.43 0.04 -1.26 -5.07 135.00 134.50 1apz s PRO 3 Ca 0.00 0.80 0.05 0.00 0.04 0.00 0.00 61.00 61.89 1apz s PRO 3 Cb 0.00 -2.31 -0.01 0.00 0.04 0.00 0.00 34.50 32.22 1apz s PRO 3 CO 0.00 0.01 0.50 -0.51 0.04 0.00 0.00 177.00 177.03 1apz s LEU 4 N -3.35 3.95 0.86 -3.56 1.43 -1.26 -4.65 118.68 112.09 1apz s LEU 4 Ca 0.57 -0.08 -0.12 0.00 -1.03 0.00 0.00 54.13 53.47 1apz s LEU 4 Cb -0.10 -2.84 0.11 0.00 0.03 0.00 0.00 46.19 43.39 1apz s LEU 4 CO 0.21 -0.45 1.14 -2.84 0.23 0.00 0.00 176.35 174.64 1apz s PRO 5 N -4.22 1.60 -0.06 1.29 0.02 -1.26 -5.18 135.00 127.19 1apz s PRO 5 Ca 0.45 0.31 0.00 0.00 0.02 0.00 0.00 61.00 61.78 1apz s PRO 5 Cb -0.10 -1.89 0.02 0.00 0.02 0.00 0.00 34.50 32.56 1apz s PRO 5 CO 0.32 -1.89 -0.04 -1.17 -0.33 0.00 0.00 177.00 173.90 1apz s LEU 6 N -5.84 1.15 -0.18 -5.54 2.96 -1.26 -5.11 118.68 104.85 1apz s LEU 6 Ca 0.63 -0.14 0.01 0.00 -0.22 0.00 0.00 54.13 54.41 1apz s LEU 6 Cb -0.14 -0.49 0.02 0.00 0.50 0.00 0.00 46.19 46.08 1apz s LEU 6 CO 0.52 -0.09 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.58 1apz s VAL 7 N 1.23 2.05 -0.04 1.68 1.01 -1.26 -5.11 120.40 119.97 1apz s VAL 7 Ca -0.06 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 60.99 1apz s VAL 7 Cb -0.14 -1.87 0.00 0.00 0.00 0.00 0.00 36.38 34.38 1apz s VAL 7 CO -0.02 0.52 -0.13 -0.69 0.00 0.00 0.00 175.10 174.78 1apz s VAL 8 N 1.29 1.12 0.04 2.92 1.01 -1.26 -5.10 120.40 120.42 1apz s VAL 8 Ca 0.04 -0.53 -0.02 0.00 0.00 0.00 0.00 61.98 61.47 1apz s VAL 8 Cb -0.13 -0.98 -0.03 0.00 0.00 0.00 0.00 36.38 35.24 1apz s VAL 8 CO -0.13 0.34 0.01 0.54 0.00 0.00 0.00 175.10 175.85 1apz s ASN 9 N 0.20 0.35 0.34 3.32 4.22 -1.26 -5.14 114.94 116.97 1apz s ASN 9 Ca -0.05 -0.77 -0.26 0.00 -2.14 0.00 0.00 52.86 49.63 1apz s ASN 9 Cb -0.11 0.19 -0.09 0.00 1.28 0.00 0.00 41.25 42.52 1apz s ASN 9 CO 0.02 -0.52 1.05 0.42 -2.04 0.00 0.00 177.10 176.03 1apz s THR 10 N -3.07 3.70 0.18 0.54 -4.23 -1.26 -4.88 115.64 106.62 1apz s THR 10 Ca -0.01 1.46 0.00 0.00 -1.18 0.00 0.00 61.69 61.96 1apz s THR 10 Cb 0.02 -3.83 0.00 0.00 1.34 0.00 0.00 72.50 70.02 1apz s THR 10 CO -0.07 0.16 0.00 0.79 -0.54 0.00 0.00 174.62 174.97 1apz n TRP 11 N 0.48 -1.22 -0.85 3.99 7.02 -1.26 -4.52 117.44 121.08 1apz n TRP 11 Ca 0.02 0.67 -0.19 0.00 -1.02 0.00 0.00 57.50 56.98 1apz n TRP 11 Cb 0.48 -1.22 -0.07 0.00 -2.42 0.00 0.00 31.31 28.08 1apz n TRP 11 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 1apz n PRO 12 N -2.34 2.12 -2.46 -0.99 -0.04 -1.26 -4.73 135.00 125.30 1apz n PRO 12 Ca -0.02 -1.26 -0.41 0.00 -0.04 0.00 0.00 63.50 61.77 1apz n PRO 12 Cb 0.18 -2.24 0.01 0.00 -0.04 0.00 0.00 33.50 31.41 1apz n PRO 12 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1apz n PHE 13 N 3.33 2.62 -0.30 0.54 3.72 -1.26 -4.89 117.46 121.23 1apz n PHE 13 Ca 0.45 -2.68 0.09 0.00 -0.05 0.00 0.00 57.45 55.26 1apz n PHE 13 Cb 0.41 -1.55 0.18 0.00 -0.94 0.00 0.00 39.48 37.58 1apz n PHE 13 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1apz n LYS 14 N 1.57 -0.07 -0.07 -1.08 4.81 -1.26 -0.69 118.16 121.36 1apz n LYS 14 Ca 0.46 1.30 0.01 0.00 -0.87 0.00 0.00 58.31 59.20 1apz n LYS 14 Cb 0.29 -2.00 0.31 0.00 0.02 0.00 0.00 35.03 33.66 1apz n LYS 14 CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 1apz h ASN 15 N 0.00 0.61 -0.38 3.14 2.35 -1.99 -0.00 115.58 119.31 1apz h ASN 15 Ca 0.46 -0.06 -0.13 0.00 -0.55 0.00 0.00 56.30 56.02 1apz h ASN 15 Cb 0.83 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 39.04 1apz h ASN 15 CO -0.84 0.54 -0.28 0.00 -1.65 0.00 0.00 177.43 175.20 1apz h ALA 16 N 1.56 0.55 -0.77 -0.83 0.00 -1.16 0.10 119.26 118.71 1apz h ALA 16 Ca 0.17 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1apz h ALA 16 Cb 0.10 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1apz h ALA 16 CO -0.02 0.58 0.43 1.15 0.00 0.00 0.00 179.25 181.39 1apz h THR 17 N 0.68 1.23 -0.10 0.00 2.02 -1.25 -1.48 112.91 114.00 1apz h THR 17 Ca 0.07 -0.55 -0.01 0.00 0.77 0.00 0.00 66.41 66.69 1apz h THR 17 Cb 0.86 0.19 -0.00 0.00 -1.74 0.00 0.00 68.15 67.45 1apz h THR 17 CO 0.08 0.25 0.03 -0.08 0.37 0.00 0.00 175.52 176.17 1apz h GLU 18 N 1.07 0.16 -0.89 6.66 4.22 -0.66 -2.27 114.58 122.87 1apz h GLU 18 Ca 0.27 -0.03 0.03 0.00 0.08 0.00 0.00 59.36 59.72 1apz h GLU 18 Cb 0.02 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.19 1apz h GLU 18 CO -0.05 0.29 0.58 0.00 -2.18 0.00 0.00 179.01 177.65 1apz h ALA 19 N 0.86 1.17 -0.31 2.92 0.00 -0.43 -1.92 119.26 121.55 1apz h ALA 19 Ca 0.03 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1apz h ALA 19 Cb 0.20 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1apz h ALA 19 CO -0.00 0.43 -0.34 0.00 0.00 0.00 0.00 179.25 179.33 1apz h ALA 20 N 1.37 0.45 -0.53 0.00 0.00 -1.22 -3.02 119.26 116.31 1apz h ALA 20 Ca 0.35 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1apz h ALA 20 Cb 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1apz h ALA 20 CO -0.12 0.52 0.12 2.35 0.00 0.00 0.00 179.25 182.12 1apz h TRP 21 N 0.53 0.83 -0.16 0.00 2.91 -1.16 -2.26 115.95 116.64 1apz h TRP 21 Ca 0.04 -0.08 -0.06 0.00 1.13 0.00 0.00 58.89 59.93 1apz h TRP 21 Cb 0.93 -0.24 -0.01 0.00 -0.51 0.00 0.00 29.16 29.32 1apz h TRP 21 CO 0.07 0.71 -0.17 0.00 -1.03 0.00 0.00 178.44 178.02 1apz h ARG 22 N 0.78 0.27 0.78 2.65 3.08 -1.31 -2.10 114.38 118.53 1apz h ARG 22 Ca 0.17 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.11 1apz h ARG 22 Cb 0.30 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.32 1apz h ARG 22 CO -0.00 0.45 -0.37 0.00 -1.07 0.00 0.00 179.97 178.97 1apz h ALA 23 N 1.57 -1.04 -0.76 0.04 0.00 -1.29 -2.05 119.26 115.73 1apz h ALA 23 Ca 0.05 -0.23 0.13 0.00 0.00 0.00 0.00 54.91 54.86 1apz h ALA 23 Cb 0.46 0.40 -0.09 0.00 0.00 0.00 0.00 17.79 18.56 1apz h ALA 23 CO 0.03 -1.07 0.33 -0.07 0.00 0.00 0.00 179.25 178.47 1apz h LEU 24 N -1.08 0.36 -0.48 0.00 3.38 -1.41 0.04 115.31 116.12 1apz h LEU 24 Ca -0.11 0.10 0.04 0.00 0.09 0.00 0.00 57.88 58.00 1apz h LEU 24 Cb 0.81 0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.57 1apz h LEU 24 CO 0.18 0.15 0.25 0.00 0.09 0.00 0.00 178.44 179.11 1apz h ALA 25 N 1.53 0.61 0.00 1.53 0.00 -1.26 -1.14 119.26 120.52 1apz h ALA 25 Ca 0.41 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1apz h ALA 25 Cb 0.58 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1apz h ALA 25 CO -0.37 -0.09 0.00 0.43 0.00 0.00 0.00 179.25 179.22 1apz n SER 26 N -4.87 0.00 0.00 0.00 7.64 -0.37 -4.74 113.62 111.27 1apz n SER 26 Ca 0.03 -0.50 0.00 0.00 1.01 0.00 0.00 58.87 59.41 1apz n SER 26 Cb 0.11 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 1apz n SER 26 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1apz n GLY 27 N -0.15 0.56 3.60 0.23 0.00 -0.43 -5.07 105.19 103.92 1apz n GLY 27 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 1apz n GLY 27 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1apz s GLY 28 N -1.11 1.60 0.45 -0.02 0.00 -0.14 -4.95 107.32 103.14 1apz s GLY 28 Ca 0.00 0.04 0.08 0.00 0.00 0.00 0.00 44.72 44.84 1apz s GLY 28 CO 0.00 0.63 0.55 -1.35 0.00 0.00 0.00 173.10 172.93 1apz s SER 29 N -2.83 5.35 0.23 1.64 1.04 -1.26 -4.34 113.70 113.53 1apz s SER 29 Ca 0.67 -0.62 -0.06 0.00 0.48 0.00 0.00 55.95 56.41 1apz s SER 29 Cb -0.22 -0.41 0.39 0.00 0.10 0.00 0.00 66.02 65.88 1apz s SER 29 CO 0.61 -0.86 1.73 0.00 0.98 0.00 0.00 173.24 175.70 1apz h ALA 30 N 0.66 0.93 -0.38 5.32 0.00 -1.98 0.16 119.26 123.98 1apz h ALA 30 Ca -0.38 0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.67 1apz h ALA 30 Cb 1.28 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.14 1apz h ALA 30 CO 0.48 -0.22 0.17 -0.07 0.00 0.00 0.00 179.25 179.61 1apz h LEU 31 N 0.40 0.23 -0.91 0.00 3.38 -1.95 0.23 115.31 116.70 1apz h LEU 31 Ca 0.37 0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.28 1apz h LEU 31 Cb 0.54 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 1apz h LEU 31 CO -0.39 0.17 -0.13 0.44 0.09 0.00 0.00 178.44 178.63 1apz h ASP 32 N 0.35 0.65 -0.29 -0.43 3.32 -1.63 -0.73 116.42 117.66 1apz h ASP 32 Ca 0.16 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 57.00 1apz h ASP 32 Cb 0.09 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 1apz h ASP 32 CO -0.13 0.80 0.08 0.00 -1.72 0.00 0.00 179.24 178.27 1apz h ALA 33 N 1.26 0.38 -0.09 3.45 0.00 0.12 -0.45 119.26 123.92 1apz h ALA 33 Ca 0.10 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.71 1apz h ALA 33 Cb 0.57 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1apz h ALA 33 CO 0.04 0.03 -0.55 0.28 0.00 0.00 0.00 179.25 179.04 1apz h VAL 34 N 0.30 1.36 -0.10 0.00 2.07 -0.43 -1.74 116.25 117.72 1apz h VAL 34 Ca 0.09 -1.86 -0.17 0.00 0.82 0.00 0.00 66.70 65.59 1apz h VAL 34 Cb 0.27 1.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 1apz h VAL 34 CO -0.00 0.55 -0.66 -0.08 0.02 0.00 0.00 177.57 177.41 1apz h GLU 35 N 0.22 0.41 -0.19 1.57 4.81 -0.96 -2.65 114.58 117.78 1apz h GLU 35 Ca 0.00 -0.30 -0.18 0.00 -0.13 0.00 0.00 59.36 58.75 1apz h GLU 35 Cb 1.04 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.47 1apz h GLU 35 CO 0.09 0.93 -0.60 0.77 -0.73 0.00 0.00 179.01 179.46 1apz h SER 36 N 0.29 0.74 0.15 1.04 0.02 -0.92 -0.24 113.55 114.63 1apz h SER 36 Ca -0.02 -0.42 -0.01 0.00 -0.84 0.00 0.00 61.79 60.51 1apz h SER 36 Cb 1.21 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.54 1apz h SER 36 CO 0.11 1.17 -0.07 1.23 -1.14 0.00 0.00 176.83 178.13 1apz h GLY 37 N 0.93 -0.21 1.71 -3.77 0.00 -1.27 -2.15 103.07 98.31 1apz h GLY 37 Ca -0.00 0.08 -0.17 0.00 0.00 0.00 0.00 47.33 47.24 1apz h GLY 37 CO 0.12 -0.08 -0.69 0.00 0.00 0.00 0.00 176.54 175.89 1apz h ALA 39 N 1.07 1.41 -0.37 0.00 0.00 -1.05 -2.40 119.26 117.93 1apz h ALA 39 Ca -0.02 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 1apz h ALA 39 Cb 1.24 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1apz h ALA 39 CO 0.11 0.44 -0.12 1.98 0.00 0.00 0.00 179.25 181.67 1apz h MET 40 N 0.00 0.73 0.00 0.00 4.05 -1.17 -2.60 114.93 115.95 1apz h MET 40 Ca -0.00 -0.29 0.00 0.00 -0.28 0.00 0.00 59.70 59.12 1apz h MET 40 Cb 0.63 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.39 1apz h MET 40 CO 0.05 0.89 0.00 0.00 0.23 0.00 0.00 176.91 178.08 1apz h GLU 42 N 0.00 0.24 -0.11 0.00 5.08 -1.15 -1.78 114.58 116.87 1apz h GLU 42 Ca 0.00 -0.42 -0.10 0.00 -1.00 0.00 0.00 59.36 57.84 1apz h GLU 42 Cb 0.24 0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1apz h GLU 42 CO 0.00 1.09 -0.33 0.00 -1.00 0.00 0.00 179.01 178.77 1apz h ARG 43 N 0.07 0.41 0.00 2.33 3.08 -1.18 -3.23 114.38 115.86 1apz h ARG 43 Ca -0.31 -0.30 0.00 0.00 0.07 0.00 0.00 59.98 59.44 1apz h ARG 43 Cb 2.03 0.05 0.00 0.00 0.08 0.00 0.00 29.97 32.14 1apz h ARG 43 CO 0.13 0.92 0.00 0.93 -1.07 0.00 0.00 179.97 180.89 1apz h GLU 44 N -0.02 0.00 -5.75 0.04 5.08 -1.44 -3.47 114.58 109.02 1apz h GLU 44 Ca -0.01 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 57.99 1apz h GLU 44 Cb 0.95 0.00 0.15 0.00 0.50 0.00 0.00 28.75 30.36 1apz h GLU 44 CO 0.07 0.00 -0.74 1.04 -1.00 0.00 0.00 179.01 178.38 1apz n GLN 45 N -2.64 -7.12 -1.44 2.33 6.02 -0.73 -4.76 117.38 109.04 1apz n GLN 45 Ca 0.04 0.83 -0.46 0.00 -0.01 0.00 0.00 57.00 57.41 1apz n GLN 45 Cb 0.43 -5.86 -0.13 0.00 1.02 0.00 0.00 30.24 25.70 1apz n GLN 45 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1apz n ASP 47 N 10.17 0.00 -0.75 0.00 9.92 -1.26 -2.49 116.55 132.13 1apz n ASP 47 Ca 0.59 0.00 -0.08 0.00 -0.53 0.00 0.00 54.79 54.78 1apz n ASP 47 Cb 0.07 -0.82 -0.02 0.00 -0.64 0.00 0.00 41.12 39.71 1apz n ASP 47 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1apz n GLY 48 N -2.00 0.49 0.10 0.44 0.00 0.16 -4.84 105.19 99.54 1apz n GLY 48 Ca 0.00 -0.62 0.02 0.00 0.00 0.00 0.00 46.02 45.42 1apz n GLY 48 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1apz n SER 49 N 0.62 0.81 -4.02 1.61 3.41 -1.04 -3.92 113.62 111.09 1apz n SER 49 Ca -0.09 -0.90 -0.14 0.00 -0.26 0.00 0.00 58.87 57.48 1apz n SER 49 Cb 0.42 0.52 -0.12 0.00 -0.26 0.00 0.00 64.21 64.77 1apz n SER 49 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1apz s VAL 50 N -0.96 0.48 0.01 -3.33 1.01 -1.22 -5.05 120.40 111.34 1apz s VAL 50 Ca 0.04 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.26 1apz s VAL 50 Cb 0.04 -0.51 0.00 0.00 0.00 0.00 0.00 36.38 35.91 1apz s VAL 50 CO 0.13 -0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.64 1apz n GLY 51 N 2.01 -1.96 3.66 4.51 0.00 -1.26 -4.09 105.19 108.06 1apz n GLY 51 Ca -0.19 -1.38 -0.30 0.00 0.00 0.00 0.00 46.02 44.15 1apz n GLY 51 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1apz s PHE 52 N -0.28 0.87 -1.46 1.61 -0.71 -1.26 -4.41 117.98 112.34 1apz s PHE 52 Ca 0.00 0.51 -0.05 0.00 -1.04 0.00 0.00 56.93 56.36 1apz s PHE 52 Cb 0.00 -3.55 0.04 0.00 -1.21 0.00 0.00 43.02 38.30 1apz s PHE 52 CO 0.00 -3.55 0.57 0.41 -1.34 0.00 0.00 175.22 171.31 1apz n GLY 53 N -1.48 -0.29 3.58 1.99 0.00 0.30 -4.92 105.19 104.38 1apz n GLY 53 Ca 0.13 0.15 -0.09 0.00 0.00 0.00 0.00 46.02 46.20 1apz n GLY 53 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1apz s GLY 54 N -4.08 -0.42 -0.72 -0.02 0.00 -1.26 -4.53 107.32 96.30 1apz s GLY 54 Ca 0.20 0.38 -0.05 0.00 0.00 0.00 0.00 44.72 45.24 1apz s GLY 54 CO 0.88 0.12 0.49 1.44 0.00 0.00 0.00 173.10 176.04 1apz n SER 55 N -0.38 -3.75 -4.79 1.64 7.64 -1.25 -4.73 113.62 108.00 1apz n SER 55 Ca -0.11 -0.84 -0.35 0.00 1.01 0.00 0.00 58.87 58.58 1apz n SER 55 Cb 0.62 -1.28 -0.04 0.00 -1.01 0.00 0.00 64.21 62.51 1apz n SER 55 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1apz s PRO 56 N -4.86 3.99 0.00 1.43 0.04 -1.26 -4.64 135.00 129.69 1apz s PRO 56 Ca 0.07 1.46 0.00 0.00 0.04 0.00 0.00 61.00 62.57 1apz s PRO 56 Cb -0.04 -2.35 0.00 0.00 0.04 0.00 0.00 34.50 32.16 1apz s PRO 56 CO 0.74 -0.28 0.00 -0.40 0.04 0.00 0.00 177.00 177.09 1apz n ASP 57 N -0.47 -0.02 0.21 6.66 5.68 0.16 -4.80 116.55 123.97 1apz n ASP 57 Ca 0.07 -0.09 0.05 0.00 -0.50 0.00 0.00 54.79 54.32 1apz n ASP 57 Cb 0.51 0.00 0.44 0.00 -1.14 0.00 0.00 41.12 40.93 1apz n ASP 57 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1apz h GLU 58 N 0.00 0.00 -0.41 0.11 5.08 -1.97 -2.35 114.58 115.04 1apz h GLU 58 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1apz h GLU 58 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1apz h GLU 58 CO 0.00 0.30 0.00 1.28 -1.00 0.00 0.00 179.01 179.59 1apz n LEU 59 N -3.99 2.54 0.00 1.33 4.77 -1.26 -4.94 117.00 115.44 1apz n LEU 59 Ca -0.02 -1.21 0.00 0.00 -0.03 0.00 0.00 56.01 54.75 1apz n LEU 59 Cb 0.36 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1apz n LEU 59 CO 0.37 0.61 0.00 0.61 -1.33 0.00 0.00 177.39 177.64 1apz n GLY 60 N 1.28 1.76 3.80 -0.72 0.00 -0.88 -5.03 105.19 105.40 1apz n GLY 60 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1apz n GLY 60 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1apz s GLU 61 N -0.14 4.36 -0.07 1.61 2.12 -1.26 -4.58 118.70 120.74 1apz s GLU 61 Ca 0.00 0.95 -0.14 0.00 0.36 0.00 0.00 54.97 56.15 1apz s GLU 61 Cb 0.00 -3.09 -0.05 0.00 0.26 0.00 0.00 34.13 31.25 1apz s GLU 61 CO 0.00 0.51 0.34 0.99 -0.54 0.00 0.00 175.26 176.56 1apz s THR 62 N -1.31 5.19 -0.02 -1.70 2.01 -1.26 -0.67 115.64 117.88 1apz s THR 62 Ca 0.38 0.68 0.03 0.00 0.31 0.00 0.00 61.69 63.08 1apz s THR 62 Cb -0.20 -3.65 -0.00 0.00 0.01 0.00 0.00 72.50 68.66 1apz s THR 62 CO 0.23 0.51 -0.10 0.42 -0.69 0.00 0.00 174.62 174.99 1apz s THR 63 N -0.50 0.85 -0.12 -0.82 -4.23 -1.26 -4.71 115.64 104.85 1apz s THR 63 Ca 0.21 -0.41 -0.04 0.00 -1.18 0.00 0.00 61.69 60.26 1apz s THR 63 Cb -0.15 -0.74 -0.04 0.00 1.34 0.00 0.00 72.50 72.92 1apz s THR 63 CO 0.09 0.26 0.04 -0.76 -0.54 0.00 0.00 174.62 173.71 1apz s LEU 64 N 0.07 3.79 -0.10 4.79 1.43 -1.08 -4.86 118.68 122.72 1apz s LEU 64 Ca -0.01 0.19 0.00 0.00 -1.03 0.00 0.00 54.13 53.28 1apz s LEU 64 Cb -0.08 -1.90 -0.02 0.00 0.03 0.00 0.00 46.19 44.22 1apz s LEU 64 CO 0.00 0.34 -0.11 -1.81 0.23 0.00 0.00 176.35 175.00 1apz s ASP 65 N -0.61 4.25 0.08 2.29 1.01 -1.26 -2.13 116.67 120.30 1apz s ASP 65 Ca 0.11 -0.21 -0.19 0.00 0.71 0.00 0.00 52.55 52.97 1apz s ASP 65 Cb -0.12 -1.38 0.04 0.00 1.01 0.00 0.00 42.92 42.48 1apz s ASP 65 CO 0.02 0.24 0.45 0.00 0.21 0.00 0.00 175.17 176.10 1apz s ALA 66 N -0.11 -1.12 -0.00 5.23 0.00 -0.45 -4.95 121.76 120.35 1apz s ALA 66 Ca -0.01 0.28 -0.26 0.00 0.00 0.00 0.00 51.96 51.97 1apz s ALA 66 Cb -0.14 0.52 0.06 0.00 0.00 0.00 0.00 23.12 23.57 1apz s ALA 66 CO 0.03 -0.56 0.58 0.00 0.00 0.00 0.00 175.76 175.81 1apz s MET 67 N -3.04 1.02 0.00 0.00 0.23 -1.26 -1.02 119.30 115.23 1apz s MET 67 Ca -0.02 0.02 0.02 0.00 -1.03 0.00 0.00 55.69 54.67 1apz s MET 67 Cb 0.00 0.47 -0.01 0.00 -1.53 0.00 0.00 34.83 33.77 1apz s MET 67 CO -0.06 -0.34 -0.06 -1.50 -2.03 0.00 0.00 175.02 171.03 1apz s ILE 68 N -1.72 0.43 -0.04 3.16 2.07 0.06 -5.00 121.20 120.16 1apz s ILE 68 Ca -0.09 -0.35 -0.01 0.00 -1.41 0.00 0.00 60.65 58.78 1apz s ILE 68 Cb -0.01 -0.39 0.03 0.00 0.13 0.00 0.00 42.46 42.23 1apz s ILE 68 CO 0.04 0.04 0.08 -0.32 -1.91 0.00 0.00 174.94 172.88 1apz s MET 69 N -0.34 -0.01 -0.26 3.50 -2.45 -1.26 -1.68 119.30 116.80 1apz s MET 69 Ca 0.00 0.32 -0.21 0.00 -1.25 0.00 0.00 55.69 54.55 1apz s MET 69 Cb -0.03 -0.29 -0.02 0.00 1.25 0.00 0.00 34.83 35.74 1apz s MET 69 CO -0.00 -0.22 0.66 0.34 1.05 0.00 0.00 175.02 176.85 1apz s ASP 70 N 1.48 6.61 0.22 1.11 2.15 -0.72 -4.95 116.67 122.58 1apz s ASP 70 Ca -0.05 0.73 0.25 0.00 0.43 0.00 0.00 52.55 53.92 1apz s ASP 70 Cb -0.12 -2.35 0.87 0.00 -0.30 0.00 0.00 42.92 41.01 1apz s ASP 70 CO -0.04 -0.41 1.76 0.61 -0.17 0.00 0.00 175.17 176.92 1apz n GLY 71 N 4.13 -1.58 0.13 2.66 0.00 -1.26 -0.17 105.19 109.09 1apz n GLY 71 Ca 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 46.02 46.00 1apz n GLY 71 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1apz h THR 72 N 0.00 0.00 0.00 2.61 2.02 -1.97 -3.36 112.91 112.21 1apz h THR 72 Ca 0.00 -0.81 -0.04 0.00 0.77 0.00 0.00 66.41 66.34 1apz h THR 72 Cb 0.63 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.03 1apz h THR 72 CO 0.00 0.00 -0.73 0.71 0.37 0.00 0.00 175.52 175.87 1apz h THR 73 N -1.03 0.16 -4.67 3.16 1.35 -2.01 -3.47 112.91 106.41 1apz h THR 73 Ca -0.02 -1.27 -0.29 0.00 -0.55 0.00 0.00 66.41 64.27 1apz h THR 73 Cb 0.17 1.82 0.11 0.00 -1.73 0.00 0.00 68.15 68.51 1apz h THR 73 CO 0.04 0.09 -0.52 0.23 -0.25 0.00 0.00 175.52 175.11 1apz n MET 74 N -2.89 -5.87 -3.96 4.72 2.81 0.76 -5.02 117.12 107.68 1apz n MET 74 Ca -0.00 0.63 -0.27 0.00 -1.81 0.00 0.00 57.70 56.25 1apz n MET 74 Cb 0.61 -5.05 -0.03 0.00 -0.71 0.00 0.00 33.22 28.03 1apz n MET 74 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1apz s ASP 75 N -3.37 6.25 0.05 7.83 1.01 -1.15 -4.93 116.67 122.35 1apz s ASP 75 Ca 0.37 0.15 0.03 0.00 0.71 0.00 0.00 52.55 53.81 1apz s ASP 75 Cb -0.16 -1.86 -0.02 0.00 1.01 0.00 0.00 42.92 41.88 1apz s ASP 75 CO 0.55 0.07 -0.09 -0.69 0.21 0.00 0.00 175.17 175.22 1apz s VAL 76 N -1.70 0.65 -0.10 -1.27 1.01 -1.26 -1.76 120.40 115.97 1apz s VAL 76 Ca 0.34 -1.09 0.00 0.00 0.00 0.00 0.00 61.98 61.24 1apz s VAL 76 Cb -0.11 -0.69 0.02 0.00 0.00 0.00 0.00 36.38 35.60 1apz s VAL 76 CO 0.28 -0.32 -0.09 -0.83 0.00 0.00 0.00 175.10 174.14 1apz s GLY 77 N -1.54 0.80 0.04 4.51 0.00 -0.68 -4.29 107.32 106.16 1apz s GLY 77 Ca -0.08 -0.49 -0.06 0.00 0.00 0.00 0.00 44.72 44.09 1apz s GLY 77 CO 0.01 0.60 0.12 0.00 0.00 0.00 0.00 173.10 173.83 1apz s ALA 78 N 1.38 -0.12 0.00 3.20 0.00 -0.18 -0.76 121.76 125.28 1apz s ALA 78 Ca -0.01 -0.51 0.01 0.00 0.00 0.00 0.00 51.96 51.44 1apz s ALA 78 Cb -0.14 0.27 -0.00 0.00 0.00 0.00 0.00 23.12 23.25 1apz s ALA 78 CO -0.05 -0.34 -0.03 0.14 0.00 0.00 0.00 175.76 175.48 1apz s VAL 79 N -2.69 0.24 -0.00 0.00 -7.23 -0.19 -2.67 120.40 107.86 1apz s VAL 79 Ca -0.04 -0.24 0.02 0.00 -1.81 0.00 0.00 61.98 59.90 1apz s VAL 79 Cb -0.01 -0.23 -0.00 0.00 0.56 0.00 0.00 36.38 36.70 1apz s VAL 79 CO -0.05 -0.00 -0.06 -0.83 -0.31 0.00 0.00 175.10 173.85 1apz s GLY 80 N -0.26 0.29 -1.46 2.32 0.00 -1.02 -1.34 107.32 105.85 1apz s GLY 80 Ca -0.01 -0.25 -0.08 0.00 0.00 0.00 0.00 44.72 44.37 1apz s GLY 80 CO -0.00 -0.21 0.79 1.34 0.00 0.00 0.00 173.10 175.02 1apz n ASP 81 N 2.94 -5.46 -4.64 1.64 2.03 -1.20 -0.65 116.55 111.23 1apz n ASP 81 Ca -0.13 -0.46 -0.43 0.00 0.52 0.00 0.00 54.79 54.29 1apz n ASP 81 Cb 0.58 -4.38 -0.03 0.00 -0.72 0.00 0.00 41.12 36.57 1apz n ASP 81 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1apz s LEU 82 N -6.91 4.00 -0.13 -2.67 2.96 -0.90 -2.50 118.68 112.53 1apz s LEU 82 Ca 0.46 2.04 -0.05 0.00 -0.22 0.00 0.00 54.13 56.36 1apz s LEU 82 Cb -0.22 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.91 1apz s LEU 82 CO 0.57 -1.31 0.04 -0.13 -1.32 0.00 0.00 176.35 174.20 1apz s ARG 83 N 4.89 3.47 -1.60 1.98 0.52 -1.25 -2.62 118.95 124.33 1apz s ARG 83 Ca 0.82 -0.34 -0.04 0.00 -0.52 0.00 0.00 55.73 55.65 1apz s ARG 83 Cb -0.33 -3.02 0.01 0.00 0.52 0.00 0.00 34.95 32.13 1apz s ARG 83 CO 0.34 0.53 0.47 0.54 0.02 0.00 0.00 175.30 177.20 1apz n ARG 84 N 2.71 -4.18 -3.76 3.54 1.74 -1.26 -4.64 116.66 110.82 1apz n ARG 84 Ca -0.18 0.92 -0.18 0.00 -0.77 0.00 0.00 57.85 57.64 1apz n ARG 84 Cb 0.53 -5.74 -0.17 0.00 -1.02 0.00 0.00 32.46 26.06 1apz n ARG 84 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1apz s ILE 85 N -3.14 0.01 0.05 0.55 -1.09 -1.26 -1.01 121.20 115.30 1apz s ILE 85 Ca 0.24 0.27 -0.12 0.00 -2.23 0.00 0.00 60.65 58.81 1apz s ILE 85 Cb -0.11 -0.19 -0.32 0.00 -1.58 0.00 0.00 42.46 40.26 1apz s ILE 85 CO 0.30 0.16 1.06 0.11 -1.23 0.00 0.00 174.94 175.34 1apz h LYS 86 N 7.89 0.47 -4.08 2.79 1.57 -1.88 -3.40 116.57 119.93 1apz h LYS 86 Ca -0.28 -0.77 -0.74 0.00 -1.87 0.00 0.00 60.65 56.99 1apz h LYS 86 Cb 1.12 0.28 -0.14 0.00 0.08 0.00 0.00 32.23 33.57 1apz h LYS 86 CO 0.31 1.36 1.95 -1.71 -0.57 0.00 0.00 179.45 180.80 1apz n ASN 87 N -3.67 5.00 0.21 0.86 4.05 -1.26 -4.73 115.26 115.71 1apz n ASN 87 Ca -0.14 -3.03 -0.17 0.00 0.45 0.00 0.00 54.58 51.69 1apz n ASN 87 Cb 1.06 -1.54 -0.10 0.00 1.23 0.00 0.00 39.78 40.43 1apz n ASN 87 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1apz h ALA 88 N 6.30 -1.08 -0.04 5.20 0.00 -1.97 -1.48 119.26 126.19 1apz h ALA 88 Ca 0.39 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.16 1apz h ALA 88 Cb 0.72 0.81 -0.00 0.00 0.00 0.00 0.00 17.79 19.32 1apz h ALA 88 CO 1.53 -1.16 0.16 0.97 0.00 0.00 0.00 179.25 180.75 1apz h ILE 89 N -0.89 0.11 -0.17 0.00 6.09 -1.92 0.21 117.51 120.93 1apz h ILE 89 Ca -0.04 0.00 -0.19 0.00 -1.37 0.00 0.00 64.86 63.26 1apz h ILE 89 Cb 0.82 0.85 0.01 0.00 0.47 0.00 0.00 36.82 38.97 1apz h ILE 89 CO -0.16 0.00 -0.64 1.23 -3.07 0.00 0.00 178.15 175.50 1apz h GLY 90 N 0.00 0.81 1.62 8.18 0.00 -1.64 -2.55 103.07 109.49 1apz h GLY 90 Ca 0.02 -1.09 -0.14 0.00 0.00 0.00 0.00 47.33 46.12 1apz h GLY 90 CO -0.00 0.97 -0.51 -2.08 0.00 0.00 0.00 176.54 174.92 1apz h VAL 91 N 0.45 1.33 -0.54 4.60 2.07 -0.59 -2.91 116.25 120.65 1apz h VAL 91 Ca -0.03 -1.75 -0.10 0.00 0.82 0.00 0.00 66.70 65.64 1apz h VAL 91 Cb 1.27 1.78 -0.02 0.00 -1.52 0.00 0.00 31.29 32.80 1apz h VAL 91 CO 0.14 0.53 -0.06 0.00 0.02 0.00 0.00 177.57 178.20 1apz h ALA 92 N 1.14 0.74 -0.36 1.67 0.00 -1.37 -2.20 119.26 118.88 1apz h ALA 92 Ca 0.01 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 1apz h ALA 92 Cb 1.00 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1apz h ALA 92 CO 0.09 0.61 0.18 -0.09 0.00 0.00 0.00 179.25 180.04 1apz h ARG 93 N 0.88 0.49 -0.20 0.00 9.65 -1.35 -2.38 114.38 121.46 1apz h ARG 93 Ca 0.15 -0.05 -0.08 0.00 -1.10 0.00 0.00 59.98 58.90 1apz h ARG 93 Cb 0.61 -0.10 -0.00 0.00 -1.39 0.00 0.00 29.97 29.09 1apz h ARG 93 CO 0.04 0.38 -0.17 0.87 2.80 0.00 0.00 179.97 183.88 1apz h LYS 94 N 0.50 0.48 -0.34 0.20 1.79 -1.23 -1.99 116.57 115.98 1apz h LYS 94 Ca 0.13 -0.24 0.08 0.00 -2.18 0.00 0.00 60.65 58.44 1apz h LYS 94 Cb 0.04 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.68 1apz h LYS 94 CO -0.02 0.81 0.24 0.28 -1.08 0.00 0.00 179.45 179.68 1apz h VAL 95 N 0.16 0.87 -0.08 0.50 2.07 -0.99 0.36 116.25 119.14 1apz h VAL 95 Ca 0.04 -0.03 -0.24 0.00 0.82 0.00 0.00 66.70 67.29 1apz h VAL 95 Cb 0.71 0.79 0.01 0.00 -1.52 0.00 0.00 31.29 31.28 1apz h VAL 95 CO 0.04 0.01 -0.89 0.25 0.02 0.00 0.00 177.57 177.00 1apz h LEU 96 N 0.08 0.91 0.00 2.57 5.85 -1.19 -3.07 115.31 120.46 1apz h LEU 96 Ca 0.16 -0.65 0.00 0.00 0.84 0.00 0.00 57.88 58.22 1apz h LEU 96 Cb 0.53 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.29 1apz h LEU 96 CO -0.01 1.45 -1.04 -0.62 -0.34 0.00 0.00 178.44 177.88 1apz n GLU 97 N -3.89 0.23 0.00 1.25 1.02 -0.53 -4.45 120.64 114.28 1apz n GLU 97 Ca -0.09 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 1apz n GLU 97 Cb 0.81 -1.56 0.00 0.00 -0.02 0.00 0.00 31.44 30.66 1apz n GLU 97 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1apz n HIS 98 N -1.86 0.00 -3.95 -0.32 8.25 0.12 -5.05 115.22 112.41 1apz n HIS 98 Ca 0.02 -0.27 -0.08 0.00 -0.26 0.00 0.00 57.72 57.13 1apz n HIS 98 Cb 0.42 -0.03 -0.08 0.00 1.12 0.00 0.00 29.99 31.42 1apz n HIS 98 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1apz s THR 99 N -0.54 0.15 -2.68 1.59 -4.23 -1.16 -5.00 115.64 103.77 1apz s THR 99 Ca 0.00 -1.41 0.24 0.00 -1.18 0.00 0.00 61.69 59.34 1apz s THR 99 Cb 0.00 -1.47 0.34 0.00 1.34 0.00 0.00 72.50 72.71 1apz s THR 99 CO 0.00 -0.70 1.37 0.35 -0.54 0.00 0.00 174.62 175.09 1apz n THR 100 N -0.03 0.27 -1.96 3.99 -2.24 -1.26 -4.66 114.28 108.39 1apz n THR 100 Ca -0.14 -0.61 -0.30 0.00 -2.27 0.00 0.00 64.05 60.74 1apz n THR 100 Cb 0.62 1.14 0.20 0.00 -2.10 0.00 0.00 70.33 70.19 1apz n THR 100 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1apz s HIS 101 N -1.73 1.31 0.00 4.78 3.76 -1.26 -5.05 115.29 117.10 1apz s HIS 101 Ca 0.34 0.21 0.00 0.00 -0.15 0.00 0.00 55.06 55.46 1apz s HIS 101 Cb 0.21 -4.21 0.00 0.00 1.11 0.00 0.00 32.58 29.70 1apz s HIS 101 CO 0.31 -2.80 0.00 2.41 -0.85 0.00 0.00 174.74 173.81 1apz n THR 102 N -3.83 0.00 -4.43 1.30 -1.04 -1.26 -4.77 114.28 100.25 1apz n THR 102 Ca 0.17 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.94 1apz n THR 102 Cb 0.59 -0.70 -0.17 0.00 -1.82 0.00 0.00 70.33 68.24 1apz n THR 102 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1apz s LEU 103 N -5.03 1.53 -0.08 -4.42 2.96 -1.26 -1.01 118.68 111.37 1apz s LEU 103 Ca 0.00 -0.26 0.03 0.00 -0.22 0.00 0.00 54.13 53.68 1apz s LEU 103 Cb 0.00 -0.73 0.01 0.00 0.50 0.00 0.00 46.19 45.96 1apz s LEU 103 CO 0.00 0.00 -0.17 -0.76 -1.32 0.00 0.00 176.35 174.10 1apz s LEU 104 N 0.80 1.82 0.28 -0.68 1.02 -1.09 -5.03 118.68 115.80 1apz s LEU 104 Ca -0.12 -0.41 0.04 0.00 0.02 0.00 0.00 54.13 53.66 1apz s LEU 104 Cb -0.15 -1.07 -0.06 0.00 0.02 0.00 0.00 46.19 44.93 1apz s LEU 104 CO 0.02 0.08 0.00 0.68 0.02 0.00 0.00 176.35 177.15 1apz s VAL 105 N 0.58 1.26 0.00 -1.59 -7.23 -1.26 -2.42 120.40 109.74 1apz s VAL 105 Ca -0.15 -2.05 0.00 0.00 -1.81 0.00 0.00 61.98 57.97 1apz s VAL 105 Cb -0.17 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.24 1apz s VAL 105 CO 0.05 -0.20 0.00 0.61 -0.31 0.00 0.00 175.10 175.25 1apz n GLY 106 N -0.56 0.97 0.03 2.32 0.00 0.18 -2.26 105.19 105.87 1apz n GLY 106 Ca -0.04 -0.64 0.09 0.00 0.00 0.00 0.00 46.02 45.43 1apz n GLY 106 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1apz n GLU 107 N 0.00 0.05 0.10 1.61 0.00 -1.26 -1.89 120.64 119.26 1apz n GLU 107 Ca 0.00 0.25 -0.16 0.00 0.00 0.00 0.00 57.16 57.25 1apz n GLU 107 Cb 0.00 -1.59 -0.14 0.00 0.00 0.00 0.00 31.44 29.71 1apz n GLU 107 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.13 177.90 1apz h SER 108 N 0.00 0.44 0.73 -1.84 0.02 -1.92 -3.23 113.55 107.75 1apz h SER 108 Ca 0.00 -0.49 -0.06 0.00 -0.84 0.00 0.00 61.79 60.40 1apz h SER 108 Cb 0.33 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 1apz h SER 108 CO 0.00 1.39 -0.27 0.00 -1.14 0.00 0.00 176.83 176.80 1apz h ALA 109 N 0.55 1.09 -0.34 3.77 0.00 -0.93 -2.90 119.26 120.51 1apz h ALA 109 Ca -0.15 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.43 1apz h ALA 109 Cb 1.99 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.73 1apz h ALA 109 CO 0.20 0.34 -0.10 1.15 0.00 0.00 0.00 179.25 180.84 1apz h THR 110 N 0.00 1.28 -0.01 0.00 2.02 -1.56 -2.08 112.91 112.57 1apz h THR 110 Ca -0.00 -1.17 0.03 0.00 0.77 0.00 0.00 66.41 66.03 1apz h THR 110 Cb 0.71 1.35 -0.04 0.00 -1.74 0.00 0.00 68.15 68.43 1apz h THR 110 CO 0.04 0.38 -0.21 0.74 0.37 0.00 0.00 175.52 176.84 1apz h THR 111 N 0.44 0.51 -0.46 3.16 2.02 -1.54 -0.88 112.91 116.16 1apz h THR 111 Ca 0.08 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.36 1apz h THR 111 Cb 0.61 0.51 -0.10 0.00 -1.74 0.00 0.00 68.15 67.43 1apz h THR 111 CO 0.04 0.00 -0.23 0.15 0.37 0.00 0.00 175.52 175.85 1apz h PHE 112 N -0.33 -0.58 -0.46 3.16 3.57 -1.40 0.62 116.94 121.52 1apz h PHE 112 Ca 0.06 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.61 1apz h PHE 112 Cb 0.41 0.32 -0.02 0.00 2.79 0.00 0.00 35.95 39.45 1apz h PHE 112 CO -0.25 -0.31 0.27 0.00 -2.23 0.00 0.00 178.31 175.79 1apz h ALA 113 N 1.16 1.62 -0.44 2.41 0.00 -0.92 -0.77 119.26 122.32 1apz h ALA 113 Ca 0.22 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 1apz h ALA 113 Cb 0.47 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1apz h ALA 113 CO -0.54 0.33 -0.25 1.96 0.00 0.00 0.00 179.25 180.75 1apz h GLN 114 N 0.63 0.94 -0.12 0.00 4.20 0.47 0.15 115.11 121.38 1apz h GLN 114 Ca 0.17 -0.43 -0.01 0.00 0.06 0.00 0.00 58.65 58.44 1apz h GLN 114 Cb -0.02 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.74 1apz h GLN 114 CO -0.03 1.09 0.04 0.77 -0.67 0.00 0.00 178.83 180.02 1apz h SER 115 N 0.78 0.15 0.83 1.46 0.02 0.16 -0.83 113.55 116.11 1apz h SER 115 Ca 0.09 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1apz h SER 115 Cb 0.83 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.33 1apz h SER 115 CO 0.07 0.15 -0.23 0.23 -1.14 0.00 0.00 176.83 175.92 1apz n MET 116 N -4.47 0.03 0.00 3.45 2.81 -0.42 -4.92 117.12 113.60 1apz n MET 116 Ca -0.01 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 1apz n MET 116 Cb 0.12 -1.53 0.00 0.00 -0.71 0.00 0.00 33.22 31.10 1apz n MET 116 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1apz n GLY 117 N 1.48 1.59 3.79 3.03 0.00 -0.32 -5.08 105.19 109.68 1apz n GLY 117 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 1apz n GLY 117 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1apz s PHE 118 N -2.00 3.60 -0.15 1.61 0.40 0.46 -5.00 117.98 116.89 1apz s PHE 118 Ca 0.00 0.79 -0.29 0.00 -0.60 0.00 0.00 56.93 56.83 1apz s PHE 118 Cb 0.00 -2.30 -0.02 0.00 0.51 0.00 0.00 43.02 41.21 1apz s PHE 118 CO 0.00 0.46 1.39 0.42 0.70 0.00 0.00 175.22 178.19 1apz s ILE 119 N -0.34 4.05 -0.34 0.64 1.01 -1.26 -4.26 121.20 120.70 1apz s ILE 119 Ca 0.20 1.26 -0.29 0.00 0.00 0.00 0.00 60.65 61.83 1apz s ILE 119 Cb -0.15 -3.85 -0.00 0.00 0.01 0.00 0.00 42.46 38.47 1apz s ILE 119 CO 0.09 -0.15 1.49 0.21 0.00 0.00 0.00 174.94 176.58 1apz s ASN 120 N 2.54 6.33 0.14 3.58 3.84 -1.26 -4.65 114.94 125.46 1apz s ASN 120 Ca 0.61 1.12 -0.09 0.00 0.21 0.00 0.00 52.86 54.71 1apz s ASN 120 Cb -0.24 -2.54 -0.01 0.00 -0.55 0.00 0.00 41.25 37.91 1apz s ASN 120 CO 0.20 -1.39 0.25 -1.83 -2.79 0.00 0.00 177.10 171.55 1apz s GLU 121 N 4.88 1.07 0.07 0.43 -1.05 -0.18 -5.04 118.70 118.87 1apz s GLU 121 Ca 0.65 -1.12 -0.31 0.00 -0.15 0.00 0.00 54.97 54.04 1apz s GLU 121 Cb -0.18 0.36 -0.07 0.00 -0.44 0.00 0.00 34.13 33.81 1apz s GLU 121 CO 0.30 -0.38 1.34 0.34 0.95 0.00 0.00 175.26 177.82 1apz s ASP 122 N -2.94 6.90 0.00 0.83 2.15 -1.26 -4.06 116.67 118.29 1apz s ASP 122 Ca 0.14 2.18 0.26 0.00 0.43 0.00 0.00 52.55 55.57 1apz s ASP 122 Cb 0.04 -2.58 0.81 0.00 -0.30 0.00 0.00 42.92 40.89 1apz s ASP 122 CO -0.03 -0.62 1.61 0.18 -0.17 0.00 0.00 175.17 176.14 1apz n LEU 123 N 4.31 1.92 -4.84 -1.34 4.77 -1.26 -4.94 117.00 115.61 1apz n LEU 123 Ca 0.11 -0.67 -0.32 0.00 -0.03 0.00 0.00 56.01 55.11 1apz n LEU 123 Cb 0.44 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.50 1apz n LEU 123 CO 0.58 0.33 0.70 -0.44 -1.33 0.00 0.00 177.39 177.23 1apz s SER 124 N -1.93 6.28 -0.02 -1.43 0.01 -1.26 -0.54 113.70 114.82 1apz s SER 124 Ca 0.35 1.57 -0.11 0.00 1.31 0.00 0.00 55.95 59.07 1apz s SER 124 Cb 0.20 -2.50 0.01 0.00 0.21 0.00 0.00 66.02 63.95 1apz s SER 124 CO 0.32 -0.83 0.23 0.42 0.41 0.00 0.00 173.24 173.79 1apz s THR 125 N -2.79 0.06 0.53 1.44 -4.23 -1.26 -4.81 115.64 104.58 1apz s THR 125 Ca 0.58 -0.52 0.35 0.00 -1.18 0.00 0.00 61.69 60.92 1apz s THR 125 Cb -0.11 -0.51 0.54 0.00 1.34 0.00 0.00 72.50 73.75 1apz s THR 125 CO 0.41 -0.29 1.81 0.77 -0.54 0.00 0.00 174.62 176.78 1apz h SER 126 N 4.22 0.03 0.28 3.99 4.64 -1.98 0.47 113.55 125.20 1apz h SER 126 Ca -0.30 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.01 1apz h SER 126 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1apz h SER 126 CO 0.40 0.00 -0.13 0.00 -0.87 0.00 0.00 176.83 176.23 1apz h ALA 127 N 1.44 -0.38 0.00 5.18 0.00 -1.95 -0.99 119.26 122.56 1apz h ALA 127 Ca 0.55 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 55.19 1apz h ALA 127 Cb 2.15 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 20.07 1apz h ALA 127 CO -0.02 -0.59 -0.51 0.66 0.00 0.00 0.00 179.25 178.78 1apz h SER 128 N -0.62 0.00 -0.77 0.00 4.64 -1.36 -0.27 113.55 115.17 1apz h SER 128 Ca -0.04 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.26 1apz h SER 128 Cb 0.44 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.50 1apz h SER 128 CO 0.06 0.51 0.40 1.56 -0.87 0.00 0.00 176.83 178.50 1apz h GLN 129 N 0.00 1.09 0.10 4.77 4.20 0.03 -2.16 115.11 123.14 1apz h GLN 129 Ca -0.01 -0.14 -0.27 0.00 0.06 0.00 0.00 58.65 58.30 1apz h GLN 129 Cb 0.95 -0.21 0.01 0.00 0.30 0.00 0.00 27.48 28.53 1apz h GLN 129 CO 0.07 0.83 -1.16 0.00 -0.67 0.00 0.00 178.83 177.89 1apz h ALA 130 N 1.21 0.14 -0.36 3.87 0.00 -0.91 -3.03 119.26 120.18 1apz h ALA 130 Ca 0.27 -0.80 0.10 0.00 0.00 0.00 0.00 54.91 54.48 1apz h ALA 130 Cb 0.07 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1apz h ALA 130 CO -0.04 0.84 0.27 1.25 0.00 0.00 0.00 179.25 181.57 1apz h LEU 131 N 0.17 0.00 0.14 0.00 5.85 -0.73 -0.43 115.31 120.32 1apz h LEU 131 Ca -0.14 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 58.29 1apz h LEU 131 Cb 1.85 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.88 1apz h LEU 131 CO 0.20 0.00 -1.36 -0.74 -0.34 0.00 0.00 178.44 176.21 1apz h HIS 132 N 0.00 0.54 -0.19 1.25 2.76 -1.29 -2.94 115.15 115.28 1apz h HIS 132 Ca 0.17 -0.39 -0.19 0.00 -2.20 0.00 0.00 60.37 57.75 1apz h HIS 132 Cb 0.72 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 29.66 1apz h HIS 132 CO 0.00 1.34 -0.66 0.66 -1.30 0.00 0.00 177.93 177.98 1apz h SER 133 N 0.08 0.81 -0.77 3.26 4.64 -1.13 -0.57 113.55 119.87 1apz h SER 133 Ca -0.18 -0.48 -0.02 0.00 -0.47 0.00 0.00 61.79 60.64 1apz h SER 133 Cb 2.01 -0.24 -0.04 0.00 -0.31 0.00 0.00 62.40 63.83 1apz h SER 133 CO 0.20 1.26 0.40 0.44 -0.87 0.00 0.00 176.83 178.26 1apz h ASP 134 N 0.51 0.97 -0.25 4.97 3.32 -1.24 -0.74 116.42 123.96 1apz h ASP 134 Ca -0.02 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.93 1apz h ASP 134 Cb 1.25 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.54 1apz h ASP 134 CO 0.13 0.81 0.16 -0.25 -1.72 0.00 0.00 179.24 178.37 1apz h TRP 135 N 1.07 0.31 -0.45 4.55 7.01 -1.31 -2.27 115.95 124.86 1apz h TRP 135 Ca 0.27 0.01 -0.05 0.00 2.11 0.00 0.00 58.89 61.23 1apz h TRP 135 Cb 0.06 -0.10 -0.02 0.00 -2.10 0.00 0.00 29.16 27.00 1apz h TRP 135 CO 0.00 0.19 0.09 -0.07 -2.79 0.00 0.00 178.44 175.86 1apz h LEU 136 N 0.33 0.64 -1.30 0.65 3.38 -0.76 -1.38 115.31 116.87 1apz h LEU 136 Ca 0.10 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1apz h LEU 136 Cb -0.03 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1apz h LEU 136 CO -0.03 0.65 -0.19 0.00 0.09 0.00 0.00 178.44 178.97 1apz h ALA 137 N 1.44 1.06 -0.26 1.53 0.00 -0.73 -1.94 119.26 120.35 1apz h ALA 137 Ca 0.15 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1apz h ALA 137 Cb 0.28 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1apz h ALA 137 CO 0.00 0.23 0.00 0.54 0.00 0.00 0.00 179.25 180.02 1apz n ARG 138 N -3.40 2.28 -3.20 0.00 1.74 -0.89 -4.88 116.66 108.31 1apz n ARG 138 Ca -0.00 -1.23 -0.17 0.00 -0.77 0.00 0.00 57.85 55.67 1apz n ARG 138 Cb 0.38 -1.60 0.05 0.00 -1.02 0.00 0.00 32.46 30.27 1apz n ARG 138 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1apz n ASN 139 N 0.31 -5.17 -3.47 0.55 3.02 -0.73 -3.58 115.26 106.19 1apz n ASN 139 Ca 0.11 -0.36 -0.19 0.00 -0.03 0.00 0.00 54.58 54.12 1apz n ASN 139 Cb 0.50 -3.82 0.07 0.00 -0.61 0.00 0.00 39.78 35.92 1apz n ASN 139 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1apz s GLN 141 N -5.30 3.10 0.46 0.00 -1.52 -1.23 -3.77 119.66 111.39 1apz s GLN 141 Ca 0.17 -0.83 0.01 0.00 -1.95 0.00 0.00 55.36 52.76 1apz s GLN 141 Cb -0.03 -2.45 0.00 0.00 -0.22 0.00 0.00 33.01 30.31 1apz s GLN 141 CO 0.77 0.06 0.67 -1.25 -0.25 0.00 0.00 175.29 175.29 1apz s PRO 142 N 0.65 2.95 0.25 2.91 0.04 -1.26 -4.93 135.00 135.61 1apz s PRO 142 Ca -0.10 -0.61 0.02 0.00 0.04 0.00 0.00 61.00 60.34 1apz s PRO 142 Cb -0.16 -2.57 -0.04 0.00 0.04 0.00 0.00 34.50 31.77 1apz s PRO 142 CO 0.02 -0.34 0.18 0.54 0.04 0.00 0.00 177.00 177.45 1apz s ASN 143 N -4.26 0.73 -0.31 6.66 2.20 -1.25 -5.08 114.94 113.62 1apz s ASN 143 Ca 0.50 -1.53 0.08 0.00 -0.94 0.00 0.00 52.86 50.97 1apz s ASN 143 Cb -0.10 0.44 0.50 0.00 -2.00 0.00 0.00 41.25 40.09 1apz s ASN 143 CO 0.37 -0.92 1.46 -1.22 -2.94 0.00 0.00 177.10 173.86 1apz n TYR 144 N -0.40 1.35 -2.62 1.54 4.01 -1.26 -5.03 117.16 114.75 1apz n TYR 144 Ca 0.04 -1.76 -0.22 0.00 -0.16 0.00 0.00 57.90 55.81 1apz n TYR 144 Cb 0.65 -0.53 0.04 0.00 -0.31 0.00 0.00 39.34 39.19 1apz n TYR 144 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1apz s TRP 145 N -3.33 2.88 -0.11 -0.72 0.52 -1.26 -5.12 118.94 111.80 1apz s TRP 145 Ca 0.46 0.04 -0.30 0.00 0.02 0.00 0.00 56.10 56.32 1apz s TRP 145 Cb 0.41 -2.77 0.12 0.00 -1.15 0.00 0.00 33.47 30.08 1apz s TRP 145 CO -0.00 -0.90 0.97 -0.98 0.02 0.00 0.00 176.95 176.06 1apz s ARG 146 N -4.79 0.66 -1.33 4.98 1.70 -1.26 -4.95 118.95 113.95 1apz s ARG 146 Ca 0.57 -0.00 -0.03 0.00 -0.47 0.00 0.00 55.73 55.80 1apz s ARG 146 Cb -0.10 0.31 0.02 0.00 -0.57 0.00 0.00 34.95 34.60 1apz s ARG 146 CO 0.39 -0.24 0.85 0.09 -1.08 0.00 0.00 175.30 175.31 1apz n ASN 147 N 0.39 -2.44 -3.79 -2.89 3.02 -1.26 -4.99 115.26 103.30 1apz n ASN 147 Ca -0.09 -0.75 -0.13 0.00 -0.03 0.00 0.00 54.58 53.58 1apz n ASN 147 Cb 0.59 -4.32 -0.07 0.00 -0.61 0.00 0.00 39.78 35.38 1apz n ASN 147 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1apz s VAL 148 N -3.51 0.00 0.03 2.41 -7.23 -1.26 -4.51 120.40 106.32 1apz s VAL 148 Ca 0.17 -1.71 0.05 0.00 -1.81 0.00 0.00 61.98 58.69 1apz s VAL 148 Cb -0.08 -2.45 -0.02 0.00 0.56 0.00 0.00 36.38 34.39 1apz s VAL 148 CO 0.79 0.00 -0.16 0.27 -0.31 0.00 0.00 175.10 175.70 1apz s ILE 149 N -3.74 1.24 0.88 -0.62 -4.36 -0.02 -4.06 121.20 110.53 1apz s ILE 149 Ca 0.32 -0.93 -0.11 0.00 -0.26 0.00 0.00 60.65 59.66 1apz s ILE 149 Cb 0.02 -1.09 0.12 0.00 1.25 0.00 0.00 42.46 42.77 1apz s ILE 149 CO 0.15 0.14 1.09 -2.16 0.24 0.00 0.00 174.94 174.40 1apz s PRO 150 N -0.91 1.36 -0.18 0.37 0.04 -1.26 -1.94 135.00 132.48 1apz s PRO 150 Ca 0.04 0.93 -0.34 0.00 0.04 0.00 0.00 61.00 61.67 1apz s PRO 150 Cb -0.07 -1.81 -0.11 0.00 0.04 0.00 0.00 34.50 32.54 1apz s PRO 150 CO 0.01 -2.20 1.99 -3.47 0.04 0.00 0.00 177.00 173.37 1apz n ASP 151 N -3.87 3.03 0.17 6.66 2.03 -1.26 -4.83 116.55 118.49 1apz n ASP 151 Ca 0.07 0.75 0.15 0.00 0.52 0.00 0.00 54.79 56.29 1apz n ASP 151 Cb 0.55 -1.35 0.75 0.00 -0.72 0.00 0.00 41.12 40.34 1apz n ASP 151 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1apz h PRO 152 N 10.55 0.00 0.00 -0.67 0.11 -1.80 0.12 132.00 140.31 1apz h PRO 152 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1apz h PRO 152 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1apz h PRO 152 CO 0.97 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.63 1apz n SER 153 N -4.17 0.00 0.00 -2.05 3.41 -1.26 -4.27 113.62 105.29 1apz n SER 153 Ca 0.02 0.38 0.00 0.00 -0.26 0.00 0.00 58.87 59.01 1apz n SER 153 Cb 0.32 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 1apz n SER 153 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1apz n LYS 154 N -1.45 0.98 -4.55 4.33 5.02 -0.36 -5.07 118.16 117.06 1apz n LYS 154 Ca 0.06 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.10 1apz n LYS 154 Cb 0.24 -0.66 -0.11 0.00 -0.02 0.00 0.00 35.03 34.48 1apz n LYS 154 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1apz s TYR 155 N -1.32 2.35 0.78 2.13 2.02 0.27 -4.84 117.35 118.75 1apz s TYR 155 Ca 0.00 -0.66 -0.10 0.00 -0.37 0.00 0.00 57.07 55.95 1apz s TYR 155 Cb 0.00 -1.52 0.09 0.00 -0.40 0.00 0.00 41.96 40.12 1apz s TYR 155 CO 0.00 0.42 1.12 0.00 -1.57 0.00 0.00 175.55 175.52 1apz n GLY 157 N -3.18 -1.01 3.75 0.00 0.00 -1.26 -4.73 105.19 98.76 1apz n GLY 157 Ca 0.09 -1.65 -0.41 0.00 0.00 0.00 0.00 46.02 44.04 1apz n GLY 157 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1apz s PRO 158 N -1.97 4.32 0.63 1.61 0.02 -1.26 -5.05 135.00 133.30 1apz s PRO 158 Ca 0.00 2.22 -0.01 0.00 0.02 0.00 0.00 61.00 63.23 1apz s PRO 158 Cb 0.00 -3.12 0.07 0.00 0.02 0.00 0.00 34.50 31.47 1apz s PRO 158 CO 0.00 -0.32 0.89 0.71 -0.33 0.00 0.00 177.00 177.95 1apz s TYR 159 N -0.25 2.49 -0.24 6.54 2.02 -1.26 -4.49 117.35 122.15 1apz s TYR 159 Ca 0.56 -0.00 -0.29 0.00 -0.37 0.00 0.00 57.07 56.98 1apz s TYR 159 Cb -0.40 -2.92 0.16 0.00 -0.40 0.00 0.00 41.96 38.40 1apz s TYR 159 CO 0.44 -1.24 1.21 0.21 -1.57 0.00 0.00 175.55 174.60 1apz s LYS 160 N -4.98 0.30 0.23 -0.62 2.20 -0.82 -4.96 119.74 111.09 1apz s LYS 160 Ca 0.61 0.13 -0.30 0.00 -0.36 0.00 0.00 55.97 56.04 1apz s LYS 160 Cb -0.09 0.14 -0.09 0.00 -1.51 0.00 0.00 37.83 36.28 1apz s LYS 160 CO 0.41 -0.08 1.33 -1.25 -0.36 0.00 0.00 175.35 175.41 1apz s PRO 161 N -0.78 4.36 0.00 4.03 0.04 -1.26 -0.84 135.00 140.55 1apz s PRO 161 Ca 0.04 2.12 0.00 0.00 0.04 0.00 0.00 61.00 63.20 1apz s PRO 161 Cb -0.02 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.36 1apz s PRO 161 CO -0.05 -0.27 0.50 -0.35 0.04 0.00 0.00 177.00 176.86