#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pn0 n ILE 7 N 0.00 0.00 0.00 -0.18 -5.35 -1.26 -4.83 119.36 107.74 2pn0 n ILE 7 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 2pn0 n ILE 7 Cb 0.00 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 37.90 2pn0 n ILE 7 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2pn0 n ILE 9 N 0.00 0.00 -1.77 7.28 3.06 -0.82 -0.56 119.36 126.56 2pn0 n ILE 9 Ca 0.00 0.00 -0.33 0.00 -2.50 0.00 0.00 62.75 59.92 2pn0 n ILE 9 Cb 0.00 0.00 0.04 0.00 0.54 0.00 0.00 39.64 40.22 2pn0 n ILE 9 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 2pn0 s SER 10 N 0.00 5.22 0.29 9.51 1.04 -1.26 -0.98 113.70 127.51 2pn0 s SER 10 Ca 0.00 1.93 -0.02 0.00 0.48 0.00 0.00 55.95 58.33 2pn0 s SER 10 Cb 0.00 -2.54 0.42 0.00 0.10 0.00 0.00 66.02 63.99 2pn0 s SER 10 CO 0.00 -1.56 1.95 0.77 0.98 0.00 0.00 173.24 175.39 2pn0 h SER 11 N -0.01 0.96 -0.21 7.02 4.64 -1.28 0.88 113.55 125.55 2pn0 h SER 11 Ca -0.46 -0.04 -0.00 0.00 -0.47 0.00 0.00 61.79 60.82 2pn0 h SER 11 Cb 1.24 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 63.08 2pn0 h SER 11 CO 0.55 0.71 0.13 0.25 -0.87 0.00 0.00 176.83 177.60 2pn0 h LEU 12 N 1.12 0.25 -0.33 5.97 5.85 -1.92 0.78 115.31 127.03 2pn0 h LEU 12 Ca 0.30 -0.04 -0.19 0.00 0.84 0.00 0.00 57.88 58.79 2pn0 h LEU 12 Cb -0.09 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 40.88 2pn0 h LEU 12 CO -0.06 0.21 -0.67 0.44 -0.34 0.00 0.00 178.44 178.02 2pn0 h ASP 13 N 0.26 0.76 -0.36 1.25 3.32 -1.85 -0.07 116.42 119.74 2pn0 h ASP 13 Ca 0.07 -0.46 0.04 0.00 0.02 0.00 0.00 57.03 56.70 2pn0 h ASP 13 Cb 0.01 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.30 2pn0 h ASP 13 CO -0.01 1.23 0.14 0.00 -1.72 0.00 0.00 179.24 178.87 2pn0 h ALA 14 N 0.77 0.42 -0.47 3.45 0.00 -0.71 0.75 119.26 123.48 2pn0 h ALA 14 Ca -0.02 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 2pn0 h ALA 14 Cb 1.26 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 2pn0 h ALA 14 CO 0.13 -0.25 -0.23 1.05 0.00 0.00 0.00 179.25 179.96 2pn0 h GLU 15 N 0.30 0.98 -0.41 0.00 4.11 -0.75 -1.43 114.58 117.39 2pn0 h GLU 15 Ca 0.16 -0.43 -0.03 0.00 0.07 0.00 0.00 59.36 59.13 2pn0 h GLU 15 Cb 0.11 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 2pn0 h GLU 15 CO -0.15 1.11 0.14 0.00 0.07 0.00 0.00 179.01 180.18 2pn0 h ARG 16 N 0.84 0.64 -0.35 1.06 3.08 -0.81 -1.71 114.38 117.12 2pn0 h ARG 16 Ca 0.10 -0.13 -0.13 0.00 0.07 0.00 0.00 59.98 59.89 2pn0 h ARG 16 Cb 0.81 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.76 2pn0 h ARG 16 CO 0.07 0.62 -0.30 -0.07 -1.07 0.00 0.00 179.97 179.23 2pn0 h LEU 17 N 0.52 0.78 -0.54 3.04 3.38 -0.80 -0.67 115.31 121.03 2pn0 h LEU 17 Ca 0.13 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2pn0 h LEU 17 Cb 0.25 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 2pn0 h LEU 17 CO -0.01 1.03 0.35 -0.33 0.09 0.00 0.00 178.44 179.58 2pn0 h GLU 18 N 0.64 0.72 -0.49 1.13 4.39 -1.11 0.70 114.58 120.56 2pn0 h GLU 18 Ca 0.08 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 2pn0 h GLU 18 Cb 0.82 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 29.29 2pn0 h GLU 18 CO 0.07 0.48 0.25 0.82 -1.16 0.00 0.00 179.01 179.46 2pn0 h ILE 19 N 0.73 1.18 -0.33 3.13 2.04 -1.03 -0.95 117.51 122.29 2pn0 h ILE 19 Ca 0.20 -0.50 0.03 0.00 1.00 0.00 0.00 64.86 65.58 2pn0 h ILE 19 Cb -0.08 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 36.59 2pn0 h ILE 19 CO -0.04 0.20 0.14 0.25 0.00 0.00 0.00 178.15 178.70 2pn0 h LEU 20 N 0.64 0.19 -0.72 1.44 5.85 -0.68 -0.46 115.31 121.57 2pn0 h LEU 20 Ca 0.17 0.02 -0.13 0.00 0.84 0.00 0.00 57.88 58.78 2pn0 h LEU 20 Cb 0.10 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2pn0 h LEU 20 CO -0.02 0.15 -0.47 -0.07 -0.34 0.00 0.00 178.44 177.68 2pn0 h LEU 21 N 0.30 0.42 -0.58 2.25 4.07 -0.58 -1.64 115.31 119.55 2pn0 h LEU 21 Ca 0.14 -0.20 -0.05 0.00 0.08 0.00 0.00 57.88 57.85 2pn0 h LEU 21 Cb 0.08 -0.12 -0.02 0.00 1.08 0.00 0.00 40.66 41.68 2pn0 h LEU 21 CO -0.12 0.83 0.18 -0.33 -1.08 0.00 0.00 178.44 177.92 2pn0 h GLU 22 N 0.31 0.91 -0.57 1.13 5.08 -0.86 -2.54 114.58 118.04 2pn0 h GLU 22 Ca 0.02 -0.20 -0.04 0.00 -1.00 0.00 0.00 59.36 58.14 2pn0 h GLU 22 Cb 0.95 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 30.05 2pn0 h GLU 22 CO 0.08 0.82 0.21 1.15 -1.00 0.00 0.00 179.01 180.26 2pn0 h THR 23 N 0.82 1.21 -0.53 1.13 2.02 -0.73 -2.93 112.91 113.90 2pn0 h THR 23 Ca 0.19 -0.70 0.00 0.00 0.77 0.00 0.00 66.41 66.67 2pn0 h THR 23 Cb 0.29 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 67.26 2pn0 h THR 23 CO -0.00 0.27 0.00 0.18 0.37 0.00 0.00 175.52 176.34 2pn0 n LEU 24 N -4.31 4.15 -0.39 2.58 4.77 -0.65 -4.63 117.00 118.52 2pn0 n LEU 24 Ca 0.05 -2.10 0.35 0.00 -0.03 0.00 0.00 56.01 54.28 2pn0 n LEU 24 Cb 0.18 -0.54 0.62 0.00 -2.33 0.00 0.00 43.42 41.35 2pn0 n LEU 24 CO 0.39 0.67 1.15 0.77 -1.33 0.00 0.00 177.39 179.04 2pn0 h SER 25 N 3.39 0.29 0.00 -1.43 4.64 -1.26 -0.27 113.55 118.91 2pn0 h SER 25 Ca 0.00 0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 2pn0 h SER 25 Cb 1.31 0.20 0.00 0.00 -0.31 0.00 0.00 62.40 63.60 2pn0 h SER 25 CO 0.22 -0.32 0.00 0.00 -0.87 0.00 0.00 176.83 175.87 2pn0 n GLN 26 N -4.99 0.90 -3.83 4.77 1.13 -1.26 -4.60 117.38 109.49 2pn0 n GLN 26 Ca 0.38 0.00 -0.30 0.00 -1.94 0.00 0.00 57.00 55.14 2pn0 n GLN 26 Cb 1.38 -1.36 -0.14 0.00 0.11 0.00 0.00 30.24 30.23 2pn0 n GLN 26 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 2pn0 s ASN 27 N -1.74 4.06 -1.59 1.08 -0.87 -0.11 -5.01 114.94 110.75 2pn0 s ASN 27 Ca 0.31 -2.60 -0.10 0.00 -1.57 0.00 0.00 52.86 48.90 2pn0 s ASN 27 Cb 0.14 -1.30 -0.08 0.00 -0.02 0.00 0.00 41.25 39.99 2pn0 s ASN 27 CO 0.24 -0.28 2.94 0.00 -2.57 0.00 0.00 177.10 177.42 2pn0 n ALA 28 N 3.61 7.52 -1.70 0.60 0.00 -1.26 -4.93 120.51 124.36 2pn0 n ALA 28 Ca 0.06 -3.54 -0.41 0.00 0.00 0.00 0.00 53.44 49.54 2pn0 n ALA 28 Cb 0.35 -3.33 0.01 0.00 0.00 0.00 0.00 19.45 16.48 2pn0 n ALA 28 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 2pn0 n PHE 29 N 3.44 2.17 -1.89 0.00 1.16 -1.26 -4.90 117.46 116.18 2pn0 n PHE 29 Ca 0.77 0.52 -0.39 0.00 -1.87 0.00 0.00 57.45 56.49 2pn0 n PHE 29 Cb 0.24 -2.39 0.02 0.00 -1.61 0.00 0.00 39.48 35.74 2pn0 n PHE 29 CO 0.00 0.00 0.00 -1.25 -1.87 0.00 0.00 176.76 173.64 2pn0 s PRO 30 N -2.08 3.46 0.00 3.97 0.04 -1.26 -1.91 135.00 137.22 2pn0 s PRO 30 Ca 0.59 2.20 0.00 0.00 0.04 0.00 0.00 61.00 63.83 2pn0 s PRO 30 Cb -0.53 -2.44 0.00 0.00 0.04 0.00 0.00 34.50 31.57 2pn0 s PRO 30 CO 0.60 -0.92 0.00 0.41 0.04 0.00 0.00 177.00 177.12 2pn0 n GLY 31 N 0.64 0.91 0.22 0.56 0.00 -1.26 -4.85 105.19 101.41 2pn0 n GLY 31 Ca 0.08 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.95 2pn0 n GLY 31 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2pn0 h ARG 32 N 2.68 -0.48 -0.99 1.61 2.43 -1.74 0.38 114.38 118.27 2pn0 h ARG 32 Ca 0.00 0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.24 2pn0 h ARG 32 Cb 0.00 0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 29.61 2pn0 h ARG 32 CO 0.00 -0.30 0.65 -0.44 -1.51 0.00 0.00 179.97 178.37 2pn0 h ASP 33 N -0.53 1.09 -0.53 -3.80 3.32 -1.92 0.34 116.42 114.40 2pn0 h ASP 33 Ca -0.05 -0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.87 2pn0 h ASP 33 Cb 0.40 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 2pn0 h ASP 33 CO 0.08 0.75 -0.12 0.44 -1.72 0.00 0.00 179.24 178.67 2pn0 h ASP 34 N 1.26 1.02 -0.35 6.45 3.32 -1.93 -0.38 116.42 125.81 2pn0 h ASP 34 Ca 0.40 -0.36 -0.07 0.00 0.02 0.00 0.00 57.03 57.02 2pn0 h ASP 34 Cb -0.00 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.26 2pn0 h ASP 34 CO -0.12 1.14 -0.05 0.25 -1.72 0.00 0.00 179.24 178.74 2pn0 h LEU 35 N 0.88 0.65 -0.77 1.55 5.85 -0.42 -1.15 115.31 121.91 2pn0 h LEU 35 Ca 0.14 -0.34 -0.04 0.00 0.84 0.00 0.00 57.88 58.47 2pn0 h LEU 35 Cb 0.69 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 2pn0 h LEU 35 CO 0.05 0.84 0.31 -0.08 -0.34 0.00 0.00 178.44 179.22 2pn0 h GLU 36 N 0.45 1.15 -0.60 1.25 4.81 -0.83 0.10 114.58 120.92 2pn0 h GLU 36 Ca 0.09 -0.21 -0.00 0.00 -0.13 0.00 0.00 59.36 59.11 2pn0 h GLU 36 Cb 0.53 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 2pn0 h GLU 36 CO 0.03 0.94 0.36 0.00 -0.73 0.00 0.00 179.01 179.60 2pn0 h ALA 37 N 1.16 0.76 -0.36 2.92 0.00 -0.96 -0.02 119.26 122.77 2pn0 h ALA 37 Ca 0.26 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2pn0 h ALA 37 Cb 0.21 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2pn0 h ALA 37 CO -0.02 0.25 0.15 1.49 0.00 0.00 0.00 179.25 181.11 2pn0 h GLU 38 N 0.81 0.53 -0.71 0.00 4.81 -0.60 -2.99 114.58 116.43 2pn0 h GLU 38 Ca 0.21 -0.09 -0.04 0.00 -0.13 0.00 0.00 59.36 59.31 2pn0 h GLU 38 Cb -0.01 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.25 2pn0 h GLU 38 CO -0.04 0.51 0.27 -0.07 -0.73 0.00 0.00 179.01 178.95 2pn0 h LEU 39 N 0.43 0.98 -1.92 1.64 3.38 -0.50 -1.72 115.31 117.60 2pn0 h LEU 39 Ca 0.12 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2pn0 h LEU 39 Cb 0.18 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 2pn0 h LEU 39 CO -0.01 0.89 -0.09 0.00 0.09 0.00 0.00 178.44 179.31 2pn0 h ALA 40 N 1.25 1.67 -0.17 1.53 0.00 -0.86 -2.61 119.26 120.06 2pn0 h ALA 40 Ca 0.24 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2pn0 h ALA 40 Cb 0.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2pn0 h ALA 40 CO -0.02 0.12 0.00 2.89 0.00 0.00 0.00 179.25 182.24 2pn0 n ARG 41 N -4.17 1.77 -1.24 0.00 1.85 -1.11 -5.04 116.66 108.71 2pn0 n ARG 41 Ca -0.03 -1.58 -0.35 0.00 -1.00 0.00 0.00 57.85 54.90 2pn0 n ARG 41 Cb 0.18 -1.21 0.11 0.00 -1.05 0.00 0.00 32.46 30.48 2pn0 n ARG 41 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2pn0 n ALA 42 N 0.45 -0.15 -2.62 2.89 0.00 -0.66 -4.73 120.51 115.68 2pn0 n ALA 42 Ca 0.08 -0.26 -0.43 0.00 0.00 0.00 0.00 53.44 52.84 2pn0 n ALA 42 Cb 0.33 -2.18 -0.03 0.00 0.00 0.00 0.00 19.45 17.57 2pn0 n ALA 42 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2pn0 s GLU 43 N -3.70 3.41 -0.30 0.00 2.02 0.28 -4.96 118.70 115.45 2pn0 s GLU 43 Ca 0.73 -0.04 -0.22 0.00 0.02 0.00 0.00 54.97 55.46 2pn0 s GLU 43 Cb -0.32 -4.03 -0.00 0.00 0.10 0.00 0.00 34.13 29.87 2pn0 s GLU 43 CO 0.51 -1.56 0.73 0.08 0.02 0.00 0.00 175.26 175.03 2pn0 s VAL 44 N 4.37 4.85 0.29 2.63 1.01 -1.26 -1.94 120.40 130.35 2pn0 s VAL 44 Ca 0.36 1.09 0.03 0.00 0.00 0.00 0.00 61.98 63.46 2pn0 s VAL 44 Cb -0.10 -4.09 -0.01 0.00 0.00 0.00 0.00 36.38 32.18 2pn0 s VAL 44 CO 0.22 -0.19 0.12 1.33 0.00 0.00 0.00 175.10 176.57 2pn0 n VAL 45 N 5.46 0.00 -2.99 2.92 0.24 -0.16 -4.86 118.33 118.94 2pn0 n VAL 45 Ca 0.02 -1.75 -0.25 0.00 -2.04 0.00 0.00 64.34 60.32 2pn0 n VAL 45 Cb 0.48 0.65 -0.00 0.00 -1.47 0.00 0.00 33.84 33.50 2pn0 n VAL 45 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 2pn0 s ASP 46 N -2.83 6.20 0.48 -1.34 1.47 -1.26 -0.76 116.67 118.63 2pn0 s ASP 46 Ca 0.16 0.64 0.15 0.00 1.18 0.00 0.00 52.55 54.68 2pn0 s ASP 46 Cb 0.01 -2.05 1.14 0.00 -0.34 0.00 0.00 42.92 41.68 2pn0 s ASP 46 CO 0.12 -0.49 2.06 -0.65 0.68 0.00 0.00 175.17 176.89 2pn0 h PRO 47 N 0.46 0.22 0.00 2.11 0.11 -1.95 -1.17 132.00 131.77 2pn0 h PRO 47 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2pn0 h PRO 47 Cb 1.22 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2pn0 h PRO 47 CO 0.61 0.14 0.00 0.93 -0.21 0.00 0.00 178.00 179.47 2pn0 h GLU 48 N 0.23 0.00 0.00 1.05 3.07 -2.02 -1.80 114.58 115.10 2pn0 h GLU 48 Ca 0.15 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.01 2pn0 h GLU 48 Cb 0.30 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.21 2pn0 h GLU 48 CO -0.03 0.00 -0.11 1.49 -1.40 0.00 0.00 179.01 178.96 2pn0 h GLU 49 N 0.00 0.00 -5.37 2.33 4.57 -1.60 -3.46 114.58 111.05 2pn0 h GLU 49 Ca 0.00 0.00 -0.61 0.00 -1.18 0.00 0.00 59.36 57.57 2pn0 h GLU 49 Cb 0.11 0.00 -0.12 0.00 -0.16 0.00 0.00 28.75 28.58 2pn0 h GLU 49 CO 0.00 0.00 -0.15 0.42 -1.18 0.00 0.00 179.01 178.10 2pn0 s ILE 50 N -3.16 5.16 0.68 2.32 1.01 -0.68 -5.04 121.20 121.48 2pn0 s ILE 50 Ca 0.08 0.75 -0.16 0.00 0.00 0.00 0.00 60.65 61.32 2pn0 s ILE 50 Cb 0.09 -3.76 0.01 0.00 0.01 0.00 0.00 42.46 38.82 2pn0 s ILE 50 CO 0.65 0.19 1.22 -2.84 0.00 0.00 0.00 174.94 174.16 2pn0 s PRO 51 N 1.69 2.43 0.00 2.79 0.02 -1.26 -4.88 135.00 135.78 2pn0 s PRO 51 Ca 0.19 1.81 0.15 0.00 0.02 0.00 0.00 61.00 63.17 2pn0 s PRO 51 Cb -0.15 -1.86 0.84 0.00 0.02 0.00 0.00 34.50 33.35 2pn0 s PRO 51 CO 0.09 -1.63 1.36 -0.35 -0.33 0.00 0.00 177.00 176.14 2pn0 n PRO 52 N -2.31 0.37 0.00 5.54 -0.04 -1.26 -2.09 135.00 135.20 2pn0 n PRO 52 Ca 0.14 0.06 0.14 0.00 -0.04 0.00 0.00 63.50 63.80 2pn0 n PRO 52 Cb 0.50 -1.50 0.55 0.00 -0.04 0.00 0.00 33.50 33.01 2pn0 n PRO 52 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2pn0 n THR 53 N -1.12 0.00 -3.93 0.52 -2.24 -1.26 -4.43 114.28 101.82 2pn0 n THR 53 Ca 0.10 -0.08 -0.36 0.00 -2.27 0.00 0.00 64.05 61.45 2pn0 n THR 53 Cb 0.08 0.02 -0.08 0.00 -2.10 0.00 0.00 70.33 68.25 2pn0 n THR 53 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2pn0 s VAL 54 N -2.49 5.16 -0.12 2.28 1.01 -0.89 -0.98 120.40 124.38 2pn0 s VAL 54 Ca 0.28 0.09 -0.30 0.00 0.00 0.00 0.00 61.98 62.05 2pn0 s VAL 54 Cb 0.20 -3.29 -0.02 0.00 0.00 0.00 0.00 36.38 33.27 2pn0 s VAL 54 CO 0.49 0.53 1.21 -0.69 0.00 0.00 0.00 175.10 176.64 2pn0 s VAL 55 N -0.28 4.32 0.00 2.92 1.01 0.25 -4.96 120.40 123.66 2pn0 s VAL 55 Ca 0.10 1.61 0.00 0.00 0.00 0.00 0.00 61.98 63.69 2pn0 s VAL 55 Cb -0.12 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.22 2pn0 s VAL 55 CO 0.01 -0.07 0.00 0.35 0.00 0.00 0.00 175.10 175.39 2pn0 n THR 56 N 5.00 0.00 -0.03 3.92 -2.24 -1.26 -0.95 114.28 118.72 2pn0 n THR 56 Ca 0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 2pn0 n THR 56 Cb 0.46 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 2pn0 n THR 56 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2pn0 n ASN 58 N 0.00 0.00 -4.75 3.42 3.02 0.14 -4.80 115.26 112.29 2pn0 n ASN 58 Ca 0.00 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.15 2pn0 n ASN 58 Cb 0.00 -0.04 -0.05 0.00 -0.61 0.00 0.00 39.78 39.09 2pn0 n ASN 58 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2pn0 s SER 59 N -0.03 7.33 -0.21 6.41 0.01 -1.25 -4.73 113.70 121.24 2pn0 s SER 59 Ca 0.00 2.18 -0.17 0.00 1.31 0.00 0.00 55.95 59.27 2pn0 s SER 59 Cb 0.00 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 63.57 2pn0 s SER 59 CO 0.00 -0.11 0.44 -0.89 0.41 0.00 0.00 173.24 173.09 2pn0 s THR 60 N -0.97 5.16 -0.23 1.44 2.01 0.23 -1.17 115.64 122.11 2pn0 s THR 60 Ca 0.45 0.78 -0.06 0.00 0.31 0.00 0.00 61.69 63.17 2pn0 s THR 60 Cb -0.30 -3.77 -0.02 0.00 0.01 0.00 0.00 72.50 68.41 2pn0 s THR 60 CO 0.38 0.21 0.04 -0.69 -0.69 0.00 0.00 174.62 173.87 2pn0 s VAL 61 N 1.53 4.09 -0.21 3.82 1.01 0.68 -0.89 120.40 130.43 2pn0 s VAL 61 Ca 0.20 -0.25 -0.15 0.00 0.00 0.00 0.00 61.98 61.78 2pn0 s VAL 61 Cb -0.15 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 33.30 2pn0 s VAL 61 CO 0.09 0.38 0.37 -0.60 0.00 0.00 0.00 175.10 175.33 2pn0 s ARG 62 N 1.42 4.15 0.09 2.72 3.52 -0.10 -1.44 118.95 129.31 2pn0 s ARG 62 Ca 0.05 0.13 0.05 0.00 -0.13 0.00 0.00 55.73 55.84 2pn0 s ARG 62 Cb -0.15 -3.55 -0.04 0.00 -1.56 0.00 0.00 34.95 29.66 2pn0 s ARG 62 CO 0.02 -0.05 -0.03 -0.06 -0.81 0.00 0.00 175.30 174.38 2pn0 s PHE 63 N 1.34 2.92 -0.08 5.12 0.08 0.65 -0.39 117.98 127.63 2pn0 s PHE 63 Ca 0.17 -0.06 0.04 0.00 0.12 0.00 0.00 56.93 57.20 2pn0 s PHE 63 Cb -0.15 -1.52 -0.01 0.00 -0.57 0.00 0.00 43.02 40.77 2pn0 s PHE 63 CO 0.08 0.46 -0.20 0.50 -0.10 0.00 0.00 175.22 175.96 2pn0 s ARG 64 N -2.24 2.79 0.04 0.44 3.52 -0.25 -1.75 118.95 121.49 2pn0 s ARG 64 Ca 0.24 -0.80 -0.30 0.00 -0.13 0.00 0.00 55.73 54.73 2pn0 s ARG 64 Cb -0.12 -2.34 -0.07 0.00 -1.56 0.00 0.00 34.95 30.87 2pn0 s ARG 64 CO 0.17 0.38 1.50 0.08 -0.81 0.00 0.00 175.30 176.61 2pn0 s VAL 65 N -0.12 3.41 0.52 7.11 1.01 0.51 -0.27 120.40 132.57 2pn0 s VAL 65 Ca -0.03 0.84 -0.23 0.00 0.00 0.00 0.00 61.98 62.56 2pn0 s VAL 65 Cb -0.14 -3.54 -0.06 0.00 0.00 0.00 0.00 36.38 32.64 2pn0 s VAL 65 CO 0.04 0.00 1.38 1.21 0.00 0.00 0.00 175.10 177.73 2pn0 n GLU 66 N 5.34 1.85 -1.34 2.72 0.00 0.29 -1.31 120.64 128.19 2pn0 n GLU 66 Ca 0.14 0.67 -0.12 0.00 0.00 0.00 0.00 57.16 57.86 2pn0 n GLU 66 Cb 0.42 -2.58 -0.05 0.00 0.00 0.00 0.00 31.44 29.23 2pn0 n GLU 66 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 2pn0 n SER 67 N -0.75 -5.30 -4.19 4.31 3.41 -1.26 -4.94 113.62 104.90 2pn0 n SER 67 Ca 0.09 0.29 -0.11 0.00 -0.26 0.00 0.00 58.87 58.87 2pn0 n SER 67 Cb 0.44 -3.82 -0.10 0.00 -0.26 0.00 0.00 64.21 60.46 2pn0 n SER 67 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2pn0 s SER 68 N -2.52 0.46 0.00 4.04 0.15 -0.43 -5.03 113.70 110.37 2pn0 s SER 68 Ca 0.00 -1.27 0.24 0.00 0.70 0.00 0.00 55.95 55.62 2pn0 s SER 68 Cb 0.00 0.28 0.26 0.00 -1.71 0.00 0.00 66.02 64.85 2pn0 s SER 68 CO 0.00 -0.74 1.26 0.00 1.20 0.00 0.00 173.24 174.96 2pn0 n ALA 69 N -0.19 3.30 -1.95 5.45 0.00 -1.26 -4.62 120.51 121.24 2pn0 n ALA 69 Ca -0.03 -0.58 -0.41 0.00 0.00 0.00 0.00 53.44 52.42 2pn0 n ALA 69 Cb 0.64 -0.90 -0.03 0.00 0.00 0.00 0.00 19.45 19.17 2pn0 n ALA 69 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2pn0 s GLU 70 N -2.42 4.33 0.04 0.00 2.12 -1.26 -4.87 118.70 116.64 2pn0 s GLU 70 Ca 0.22 2.18 0.03 0.00 0.36 0.00 0.00 54.97 57.75 2pn0 s GLU 70 Cb 0.19 -3.15 -0.02 0.00 0.26 0.00 0.00 34.13 31.40 2pn0 s GLU 70 CO 0.52 -0.34 -0.09 -1.21 -0.54 0.00 0.00 175.26 173.60 2pn0 s GLU 71 N -0.18 0.58 0.00 4.30 2.02 -1.26 -0.37 118.70 123.79 2pn0 s GLU 71 Ca 0.58 -0.76 0.00 0.00 0.02 0.00 0.00 54.97 54.81 2pn0 s GLU 71 Cb -0.39 -0.40 0.00 0.00 0.10 0.00 0.00 34.13 33.43 2pn0 s GLU 71 CO 0.40 0.08 0.00 1.97 0.02 0.00 0.00 175.26 177.73 2pn0 n PHE 72 N 1.51 0.00 -3.64 1.61 1.16 -0.72 -5.00 117.46 112.39 2pn0 n PHE 72 Ca -0.22 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.27 2pn0 n PHE 72 Cb 0.55 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.35 2pn0 n PHE 72 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 2pn0 s LEU 74 N 0.00 -0.45 -0.23 5.98 1.43 -0.52 -0.25 118.68 124.64 2pn0 s LEU 74 Ca 0.00 0.86 -0.07 0.00 -1.03 0.00 0.00 54.13 53.89 2pn0 s LEU 74 Cb 0.00 1.87 -0.03 0.00 0.03 0.00 0.00 46.19 48.06 2pn0 s LEU 74 CO 0.00 -0.15 0.07 -0.89 0.23 0.00 0.00 176.35 175.61 2pn0 s THR 75 N 0.26 4.44 -0.20 5.49 2.01 -0.08 -0.23 115.64 127.34 2pn0 s THR 75 Ca 0.03 -0.13 -0.29 0.00 0.31 0.00 0.00 61.69 61.60 2pn0 s THR 75 Cb -0.05 -3.06 0.00 0.00 0.01 0.00 0.00 72.50 69.40 2pn0 s THR 75 CO -0.07 0.36 1.05 -0.22 -0.69 0.00 0.00 174.62 175.05 2pn0 s LEU 76 N 1.34 4.14 0.16 4.42 2.96 -0.32 -1.10 118.68 130.28 2pn0 s LEU 76 Ca 0.05 1.43 0.03 0.00 -0.22 0.00 0.00 54.13 55.43 2pn0 s LEU 76 Cb -0.15 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.95 2pn0 s LEU 76 CO 0.04 -0.63 -0.05 0.68 -1.32 0.00 0.00 176.35 175.07 2pn0 s VAL 77 N 2.96 0.95 0.62 1.68 -7.23 -0.12 0.24 120.40 119.50 2pn0 s VAL 77 Ca 0.46 -2.02 -0.15 0.00 -1.81 0.00 0.00 61.98 58.46 2pn0 s VAL 77 Cb -0.16 -1.99 -0.02 0.00 0.56 0.00 0.00 36.38 34.77 2pn0 s VAL 77 CO 0.09 -0.62 1.08 -0.31 -0.31 0.00 0.00 175.10 175.03 2pn0 s TYR 78 N -3.47 2.86 0.35 2.82 2.02 -1.26 -1.44 117.35 119.23 2pn0 s TYR 78 Ca 0.20 1.52 0.13 0.00 -0.37 0.00 0.00 57.07 58.55 2pn0 s TYR 78 Cb 0.04 -3.06 1.00 0.00 -0.40 0.00 0.00 41.96 39.55 2pn0 s TYR 78 CO 0.02 -1.33 1.72 -1.35 -1.57 0.00 0.00 175.55 173.04 2pn0 h PRO 79 N 0.21 0.45 0.00 -1.71 0.11 -1.97 -0.03 132.00 129.07 2pn0 h PRO 79 Ca -0.47 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 2pn0 h PRO 79 Cb 1.23 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 2pn0 h PRO 79 CO 0.56 0.30 -0.01 1.57 -0.21 0.00 0.00 178.00 180.21 2pn0 h LYS 80 N 0.47 0.00 -0.45 1.05 2.10 -2.04 -2.77 116.57 114.94 2pn0 h LYS 80 Ca 0.66 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.31 2pn0 h LYS 80 Cb 1.44 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.77 2pn0 h LYS 80 CO -0.46 0.01 0.00 -0.25 -2.00 0.00 0.00 179.45 176.75 2pn0 n ASP 81 N -3.30 3.21 -4.77 7.07 8.00 -0.02 -4.94 116.55 121.79 2pn0 n ASP 81 Ca -0.03 -1.97 -0.35 0.00 0.71 0.00 0.00 54.79 53.15 2pn0 n ASP 81 Cb 0.11 -0.30 0.02 0.00 -0.02 0.00 0.00 41.12 40.93 2pn0 n ASP 81 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2pn0 s VAL 82 N -1.02 3.06 0.13 2.53 1.01 -1.05 -4.97 120.40 120.09 2pn0 s VAL 82 Ca 0.31 0.61 0.02 0.00 0.00 0.00 0.00 61.98 62.92 2pn0 s VAL 82 Cb 0.16 -3.20 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 2pn0 s VAL 82 CO 0.22 -0.19 0.12 -0.90 0.00 0.00 0.00 175.10 174.35 2pn0 n ASP 83 N -1.67 -0.31 -1.08 3.32 5.68 -1.26 -5.06 116.55 116.16 2pn0 n ASP 83 Ca 0.12 -1.81 0.08 0.00 -0.50 0.00 0.00 54.79 52.68 2pn0 n ASP 83 Cb 0.51 0.69 0.25 0.00 -1.14 0.00 0.00 41.12 41.43 2pn0 n ASP 83 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2pn0 n THR 84 N -0.23 0.92 0.19 2.12 -2.24 -1.26 -4.40 114.28 109.37 2pn0 n THR 84 Ca 0.02 -0.77 0.07 0.00 -2.27 0.00 0.00 64.05 61.10 2pn0 n THR 84 Cb 0.23 0.26 0.26 0.00 -2.10 0.00 0.00 70.33 68.97 2pn0 n THR 84 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2pn0 h SER 85 N 3.14 0.00 0.00 3.42 4.64 -1.97 -3.47 113.55 119.31 2pn0 h SER 85 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2pn0 h SER 85 Cb 0.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 2pn0 h SER 85 CO 0.06 0.33 0.00 0.61 -0.87 0.00 0.00 176.83 176.95 2pn0 n GLY 86 N 0.65 0.92 0.00 -0.77 0.00 -1.26 -4.93 105.19 99.80 2pn0 n GLY 86 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.12 2pn0 n GLY 86 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2pn0 n GLU 87 N -2.00 0.83 -3.94 1.61 0.00 -1.26 -4.96 120.64 110.92 2pn0 n GLU 87 Ca 0.00 -0.06 -0.29 0.00 0.00 0.00 0.00 57.16 56.81 2pn0 n GLU 87 Cb 0.00 -1.39 -0.04 0.00 0.00 0.00 0.00 31.44 30.01 2pn0 n GLU 87 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 2pn0 s LYS 88 N -2.92 3.38 -0.03 5.31 -0.14 -1.26 -0.90 119.74 123.18 2pn0 s LYS 88 Ca 0.02 -0.53 -0.01 0.00 -1.36 0.00 0.00 55.97 54.09 2pn0 s LYS 88 Cb 0.13 -2.98 0.03 0.00 -1.68 0.00 0.00 37.83 33.34 2pn0 s LYS 88 CO 0.76 0.57 0.05 -1.50 -0.76 0.00 0.00 175.35 174.47 2pn0 s ILE 89 N -1.60 -0.08 0.43 2.17 2.07 -0.26 -4.84 121.20 119.09 2pn0 s ILE 89 Ca 0.34 0.27 -0.24 0.00 -1.41 0.00 0.00 60.65 59.61 2pn0 s ILE 89 Cb -0.12 -0.12 -0.08 0.00 0.13 0.00 0.00 42.46 42.27 2pn0 s ILE 89 CO 0.28 0.11 1.14 -0.55 -1.91 0.00 0.00 174.94 174.00 2pn0 s SER 90 N 1.38 6.42 0.64 4.50 0.15 -1.26 -0.95 113.70 124.58 2pn0 s SER 90 Ca -0.05 2.25 0.37 0.00 0.70 0.00 0.00 55.95 59.22 2pn0 s SER 90 Cb -0.13 -2.60 2.09 0.00 -1.71 0.00 0.00 66.02 63.67 2pn0 s SER 90 CO -0.03 -0.74 2.26 -0.29 1.20 0.00 0.00 173.24 175.64 2pn0 h ILE 91 N 2.09 0.20 0.00 6.45 6.09 -1.51 -0.62 117.51 130.22 2pn0 h ILE 91 Ca -0.49 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.00 2pn0 h ILE 91 Cb 1.24 0.94 0.00 0.00 0.47 0.00 0.00 36.82 39.46 2pn0 h ILE 91 CO 0.61 0.00 -0.27 -0.07 -3.07 0.00 0.00 178.15 175.36 2pn0 h LEU 92 N 0.00 0.00-10.20 2.19 3.38 -1.89 -2.80 115.31 105.99 2pn0 h LEU 92 Ca 0.01 -0.04 -0.49 0.00 0.09 0.00 0.00 57.88 57.46 2pn0 h LEU 92 Cb 0.15 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.91 2pn0 h LEU 92 CO -0.00 0.02 0.27 0.00 0.09 0.00 0.00 178.44 178.82 2pn0 s ALA 93 N -3.19 3.19 0.32 1.53 0.00 -0.24 -4.77 121.76 118.60 2pn0 s ALA 93 Ca 0.07 -0.02 -0.27 0.00 0.00 0.00 0.00 51.96 51.74 2pn0 s ALA 93 Cb 0.10 -2.94 -0.14 0.00 0.00 0.00 0.00 23.12 20.15 2pn0 s ALA 93 CO 0.67 -0.20 0.93 -2.30 0.00 0.00 0.00 175.76 174.86 2pn0 n PRO 94 N -1.62 1.18 0.00 0.00 -0.02 -1.26 -0.92 135.00 132.36 2pn0 n PRO 94 Ca 0.05 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 2pn0 n PRO 94 Cb 0.54 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 2pn0 n PRO 94 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2pn0 n VAL 95 N -0.02 0.00 -0.18 -1.45 0.31 -1.26 -4.60 118.33 111.13 2pn0 n VAL 95 Ca 0.10 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.43 2pn0 n VAL 95 Cb 0.33 0.00 0.08 0.00 -0.91 0.00 0.00 33.84 33.35 2pn0 n VAL 95 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2pn0 h GLY 96 N 0.00 0.63 2.00 2.92 0.00 -1.48 -1.01 103.07 106.13 2pn0 h GLY 96 Ca 0.00 0.03 -0.04 0.00 0.00 0.00 0.00 47.33 47.32 2pn0 h GLY 96 CO 0.00 -0.13 -0.19 1.48 0.00 0.00 0.00 176.54 177.70 2pn0 h SER 97 N 0.18 0.00 1.34 0.19 4.64 -0.75 -2.27 113.55 116.87 2pn0 h SER 97 Ca 0.28 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.50 2pn0 h SER 97 Cb 0.43 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.50 2pn0 h SER 97 CO -0.42 0.19 -0.69 0.00 -0.87 0.00 0.00 176.83 175.04 2pn0 h ALA 98 N 1.81 0.68 -0.29 5.18 0.00 -1.51 -3.36 119.26 121.78 2pn0 h ALA 98 Ca -0.00 -0.48 -0.08 0.00 0.00 0.00 0.00 54.91 54.34 2pn0 h ALA 98 Cb 0.36 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2pn0 h ALA 98 CO 0.02 0.61 -0.17 -0.07 0.00 0.00 0.00 179.25 179.64 2pn0 h LEU 99 N 0.00 0.50 -9.33 0.00 3.38 -0.61 -3.41 115.31 105.84 2pn0 h LEU 99 Ca -0.04 -0.15 -0.63 0.00 0.09 0.00 0.00 57.88 57.15 2pn0 h LEU 99 Cb 1.38 -0.14 0.04 0.00 0.09 0.00 0.00 40.66 42.03 2pn0 h LEU 99 CO 0.05 0.70 0.85 -0.11 0.09 0.00 0.00 178.44 180.02 2pn0 n LEU 100 N -4.17 2.84 0.00 1.67 7.94 -1.24 -1.77 117.00 122.26 2pn0 n LEU 100 Ca 0.00 1.05 0.00 0.00 -1.11 0.00 0.00 56.01 55.96 2pn0 n LEU 100 Cb 0.36 -1.32 0.00 0.00 0.53 0.00 0.00 43.42 42.99 2pn0 n LEU 100 CO 0.41 -0.37 0.00 0.61 -1.11 0.00 0.00 177.39 176.93 2pn0 n GLY 101 N 3.69 1.92 3.58 -3.96 0.00 -0.13 -5.00 105.19 105.29 2pn0 n GLY 101 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 2pn0 n GLY 101 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2pn0 s LEU 102 N 0.00 0.87 0.05 0.99 1.43 -0.73 -4.67 118.68 116.62 2pn0 s LEU 102 Ca 0.00 1.01 -0.03 0.00 -1.03 0.00 0.00 54.13 54.08 2pn0 s LEU 102 Cb 0.00 -2.92 -0.03 0.00 0.03 0.00 0.00 46.19 43.28 2pn0 s LEU 102 CO 0.00 -3.88 0.03 0.00 0.23 0.00 0.00 176.35 172.73 2pn0 s ALA 103 N -2.83 0.23 0.21 4.21 0.00 -1.26 -0.58 121.76 121.74 2pn0 s ALA 103 Ca 0.68 -0.91 -0.31 0.00 0.00 0.00 0.00 51.96 51.42 2pn0 s ALA 103 Cb -0.16 0.28 -0.15 0.00 0.00 0.00 0.00 23.12 23.09 2pn0 s ALA 103 CO 0.58 -0.35 1.14 0.94 0.00 0.00 0.00 175.76 178.07 2pn0 n GLN 104 N 0.40 1.28 0.00 0.00 7.27 -0.15 -1.25 117.38 124.94 2pn0 n GLN 104 Ca -0.16 0.46 0.00 0.00 0.07 0.00 0.00 57.00 57.36 2pn0 n GLN 104 Cb 0.60 -1.93 0.00 0.00 2.41 0.00 0.00 30.24 31.32 2pn0 n GLN 104 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2pn0 n GLY 105 N 1.82 3.34 3.77 1.69 0.00 0.89 -5.01 105.19 111.69 2pn0 n GLY 105 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 2pn0 n GLY 105 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2pn0 s ASP 106 N -0.75 6.41 -0.01 1.61 1.01 -0.38 -4.72 116.67 119.85 2pn0 s ASP 106 Ca 0.00 2.52 0.03 0.00 0.71 0.00 0.00 52.55 55.80 2pn0 s ASP 106 Cb 0.00 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 41.27 2pn0 s ASP 106 CO 0.00 -0.77 -0.06 -1.61 0.21 0.00 0.00 175.17 172.94 2pn0 s GLU 107 N -2.25 2.61 0.18 8.23 2.02 -1.26 -0.98 118.70 127.25 2pn0 s GLU 107 Ca 0.57 -0.68 -0.03 0.00 0.02 0.00 0.00 54.97 54.84 2pn0 s GLU 107 Cb -0.35 -2.54 -0.03 0.00 0.10 0.00 0.00 34.13 31.31 2pn0 s GLU 107 CO 0.44 0.61 0.17 0.96 0.02 0.00 0.00 175.26 177.46 2pn0 s ILE 108 N -0.99 0.04 0.05 -1.63 -4.36 -0.48 -4.99 121.20 108.84 2pn0 s ILE 108 Ca 0.17 -1.82 0.01 0.00 -0.26 0.00 0.00 60.65 58.74 2pn0 s ILE 108 Cb -0.11 -2.24 -0.03 0.00 1.25 0.00 0.00 42.46 41.33 2pn0 s ILE 108 CO 0.07 -0.18 -0.05 -1.61 0.24 0.00 0.00 174.94 173.41 2pn0 s GLU 109 N -4.08 0.57 0.21 0.37 2.02 -1.26 -0.84 118.70 115.69 2pn0 s GLU 109 Ca 0.30 -0.97 -0.07 0.00 0.02 0.00 0.00 54.97 54.25 2pn0 s GLU 109 Cb 0.06 -0.06 -0.02 0.00 0.10 0.00 0.00 34.13 34.21 2pn0 s GLU 109 CO 0.07 -0.03 0.29 1.67 0.02 0.00 0.00 175.26 177.29 2pn0 s TRP 110 N -2.52 0.71 0.42 1.61 -2.14 -0.78 -4.97 118.94 111.27 2pn0 s TRP 110 Ca -0.02 -1.01 -0.26 0.00 2.66 0.00 0.00 56.10 57.47 2pn0 s TRP 110 Cb -0.02 -0.17 -0.08 0.00 -3.10 0.00 0.00 33.47 30.09 2pn0 s TRP 110 CO -0.04 -0.79 1.34 -2.14 -2.66 0.00 0.00 176.95 172.66 2pn0 s PRO 111 N -4.07 3.86 -0.08 3.25 0.02 -1.26 -0.17 135.00 136.56 2pn0 s PRO 111 Ca 0.28 2.22 -0.16 0.00 0.02 0.00 0.00 61.00 63.37 2pn0 s PRO 111 Cb 0.03 -2.71 -0.05 0.00 0.02 0.00 0.00 34.50 31.80 2pn0 s PRO 111 CO 0.09 -0.61 0.41 0.21 -0.33 0.00 0.00 177.00 176.77 2pn0 s LYS 112 N -2.33 4.14 0.18 5.54 2.20 -0.18 -4.59 119.74 124.70 2pn0 s LYS 112 Ca 0.59 0.36 -0.33 0.00 -0.36 0.00 0.00 55.97 56.23 2pn0 s LYS 112 Cb -0.39 -3.34 -0.14 0.00 -1.51 0.00 0.00 37.83 32.45 2pn0 s LYS 112 CO 0.51 0.40 1.52 -2.30 -0.36 0.00 0.00 175.35 175.12 2pn0 n PRO 113 N 2.85 2.09 0.00 4.03 -0.02 -1.26 -0.71 135.00 141.98 2pn0 n PRO 113 Ca -0.11 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 2pn0 n PRO 113 Cb 0.52 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 2pn0 n PRO 113 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2pn0 n GLY 114 N 2.98 2.08 0.00 -1.23 0.00 -1.26 -4.95 105.19 102.81 2pn0 n GLY 114 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2pn0 n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pn0 n GLY 115 N -2.00 3.64 7.00 -0.02 0.00 0.11 -5.15 105.19 108.77 2pn0 n GLY 115 Ca 0.00 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.21 2pn0 n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pn0 n GLY 116 N -1.32 -1.85 3.28 -0.02 0.00 -1.26 -4.44 105.19 99.58 2pn0 n GLY 116 Ca 0.00 -1.36 -0.21 0.00 0.00 0.00 0.00 46.02 44.44 2pn0 n GLY 116 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2pn0 s VAL 117 N 0.00 1.60 -0.30 1.61 -7.23 -1.26 -1.01 120.40 113.80 2pn0 s VAL 117 Ca 0.00 -1.66 -0.10 0.00 -1.81 0.00 0.00 61.98 58.41 2pn0 s VAL 117 Cb 0.00 -1.58 -0.01 0.00 0.56 0.00 0.00 36.38 35.35 2pn0 s VAL 117 CO 0.00 -0.22 0.15 -0.22 -0.31 0.00 0.00 175.10 174.50 2pn0 s LEU 118 N -2.22 4.05 -0.19 1.32 2.96 0.77 -4.67 118.68 120.69 2pn0 s LEU 118 Ca 0.09 -0.44 -0.06 0.00 -0.22 0.00 0.00 54.13 53.50 2pn0 s LEU 118 Cb -0.08 -2.01 -0.03 0.00 0.50 0.00 0.00 46.19 44.57 2pn0 s LEU 118 CO 0.04 -0.17 0.04 -0.60 -1.32 0.00 0.00 176.35 174.35 2pn0 s ARG 119 N 1.63 3.83 0.09 1.98 3.52 -1.26 -1.87 118.95 126.87 2pn0 s ARG 119 Ca 0.05 -0.42 0.04 0.00 -0.13 0.00 0.00 55.73 55.27 2pn0 s ARG 119 Cb -0.17 -3.17 -0.03 0.00 -1.56 0.00 0.00 34.95 30.02 2pn0 s ARG 119 CO 0.07 0.16 -0.10 0.14 -0.81 0.00 0.00 175.30 174.75 2pn0 s VAL 120 N 0.65 0.94 -0.10 7.11 -7.23 -0.02 -0.54 120.40 121.20 2pn0 s VAL 120 Ca 0.02 -1.56 0.02 0.00 -1.81 0.00 0.00 61.98 58.65 2pn0 s VAL 120 Cb -0.13 -1.27 -0.01 0.00 0.56 0.00 0.00 36.38 35.52 2pn0 s VAL 120 CO 0.02 -0.50 -0.17 -0.60 -0.31 0.00 0.00 175.10 173.54 2pn0 s ARG 121 N -2.57 3.06 -0.26 4.82 3.52 0.63 -1.38 118.95 126.77 2pn0 s ARG 121 Ca 0.03 -0.75 -0.29 0.00 -0.13 0.00 0.00 55.73 54.59 2pn0 s ARG 121 Cb -0.04 -2.46 -0.02 0.00 -1.56 0.00 0.00 34.95 30.86 2pn0 s ARG 121 CO 0.00 0.30 1.67 0.42 -0.81 0.00 0.00 175.30 176.89 2pn0 s ILE 122 N 0.10 3.62 -0.05 4.11 1.01 -0.15 -1.09 121.20 128.74 2pn0 s ILE 122 Ca -0.08 0.68 0.15 0.00 0.00 0.00 0.00 60.65 61.40 2pn0 s ILE 122 Cb -0.15 -3.69 -0.23 0.00 0.01 0.00 0.00 42.46 38.40 2pn0 s ILE 122 CO 0.05 -0.34 0.28 1.33 0.00 0.00 0.00 174.94 176.26 2pn0 n VAL 123 N 6.74 0.22 -3.69 2.92 0.24 0.47 -0.08 118.33 125.15 2pn0 n VAL 123 Ca 0.20 -0.42 -0.14 0.00 -2.04 0.00 0.00 64.34 61.94 2pn0 n VAL 123 Cb 0.46 -0.02 -0.09 0.00 -1.47 0.00 0.00 33.84 32.72 2pn0 n VAL 123 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2pn0 s GLU 124 N -2.93 0.68 -0.10 7.34 2.12 -1.11 -4.88 118.70 119.83 2pn0 s GLU 124 Ca -0.06 0.30 0.02 0.00 0.36 0.00 0.00 54.97 55.60 2pn0 s GLU 124 Cb 0.09 0.32 0.01 0.00 0.26 0.00 0.00 34.13 34.81 2pn0 s GLU 124 CO 0.64 -0.15 -0.17 0.08 -0.54 0.00 0.00 175.26 175.12 2pn0 s VAL 125 N -0.53 1.55 0.04 3.70 1.01 -1.26 -0.92 120.40 123.98 2pn0 s VAL 125 Ca -0.07 -0.70 -0.06 0.00 0.00 0.00 0.00 61.98 61.16 2pn0 s VAL 125 Cb -0.03 -1.39 -0.01 0.00 0.00 0.00 0.00 36.38 34.95 2pn0 s VAL 125 CO 0.04 0.45 0.11 0.42 0.00 0.00 0.00 175.10 176.12 2pn0 s THR 126 N 0.74 0.13 -2.82 3.92 -4.23 -0.07 -4.78 115.64 108.53 2pn0 s THR 126 Ca -0.12 -1.04 0.25 0.00 -1.18 0.00 0.00 61.69 59.61 2pn0 s THR 126 Cb -0.16 -0.86 0.32 0.00 1.34 0.00 0.00 72.50 73.14 2pn0 s THR 126 CO 0.02 -0.57 1.44 -1.22 -0.54 0.00 0.00 174.62 173.75