#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1itf n ASP 2 N 0.00 6.33 0.04 0.00 8.00 -1.26 -4.80 116.55 124.85 1itf n ASP 2 Ca 0.00 -3.38 -0.02 0.00 0.71 0.00 0.00 54.79 52.11 1itf n ASP 2 Cb 0.00 -1.29 -0.01 0.00 -0.02 0.00 0.00 41.12 39.81 1itf n ASP 2 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1itf h LEU 3 N 5.60 -0.10-10.37 0.64 4.07 -2.02 -3.46 115.31 109.66 1itf h LEU 3 Ca 0.20 0.00 -0.45 0.00 0.08 0.00 0.00 57.88 57.71 1itf h LEU 3 Cb 0.64 0.03 0.16 0.00 1.08 0.00 0.00 40.66 42.56 1itf h LEU 3 CO 1.31 0.05 0.21 -2.16 -1.08 0.00 0.00 178.44 176.77 1itf s PRO 4 N -1.93 0.53 -1.07 1.13 0.04 -1.26 -4.95 135.00 127.49 1itf s PRO 4 Ca -0.02 0.50 -0.02 0.00 0.04 0.00 0.00 61.00 61.50 1itf s PRO 4 Cb 0.00 -1.75 0.30 0.00 0.04 0.00 0.00 34.50 33.09 1itf s PRO 4 CO 0.05 -2.66 1.81 0.00 0.04 0.00 0.00 177.00 176.25 1itf n GLN 5 N -4.12 5.18 -3.13 4.56 10.64 -1.26 -4.66 117.38 124.59 1itf n GLN 5 Ca 0.05 -4.53 -0.17 0.00 -1.83 0.00 0.00 57.00 50.52 1itf n GLN 5 Cb 0.57 -2.50 -0.02 0.00 -0.86 0.00 0.00 30.24 27.44 1itf n GLN 5 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 1itf n THR 6 N 0.40 -0.14 -4.28 -0.39 -2.24 -1.26 -5.11 114.28 101.26 1itf n THR 6 Ca 0.44 -4.21 -0.13 0.00 -2.27 0.00 0.00 64.05 57.88 1itf n THR 6 Cb 0.27 -0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.43 1itf n THR 6 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1itf n HIS 7 N 0.28 0.22 -1.68 4.78 1.44 -1.26 -5.13 115.22 113.87 1itf n HIS 7 Ca 0.23 -1.26 -0.29 0.00 -2.01 0.00 0.00 57.72 54.39 1itf n HIS 7 Cb 0.67 -0.05 0.17 0.00 0.12 0.00 0.00 29.99 30.90 1itf n HIS 7 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 1itf s SER 8 N -2.26 3.01 -0.61 4.39 0.01 -1.26 -5.04 113.70 111.95 1itf s SER 8 Ca 0.07 0.57 0.05 0.00 1.31 0.00 0.00 55.95 57.94 1itf s SER 8 Cb 0.00 -0.83 0.17 0.00 0.21 0.00 0.00 66.02 65.57 1itf s SER 8 CO 0.05 -2.82 0.45 0.00 0.41 0.00 0.00 173.24 171.33 1itf n LEU 9 N -3.88 1.86 0.09 2.44 -0.00 -1.26 -4.93 117.00 111.33 1itf n LEU 9 Ca 0.12 -4.94 -0.18 0.00 -0.00 0.00 0.00 56.01 51.01 1itf n LEU 9 Cb 0.60 -0.31 -0.11 0.00 -0.00 0.00 0.00 43.42 43.60 1itf n LEU 9 CO 0.50 1.80 0.01 1.23 -0.00 0.00 0.00 177.39 180.93 1itf h GLY 10 N 5.43 0.50 0.90 1.47 0.00 -1.96 -2.93 103.07 106.47 1itf h GLY 10 Ca 0.19 -1.06 0.00 0.00 0.00 0.00 0.00 47.33 46.46 1itf h GLY 10 CO 0.60 0.93 -0.07 1.48 0.00 0.00 0.00 176.54 179.49 1itf h SER 11 N 0.19 -0.18 -0.45 0.19 4.64 -1.91 0.57 113.55 116.59 1itf h SER 11 Ca -0.14 0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 61.15 1itf h SER 11 Cb 1.84 0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 63.97 1itf h SER 11 CO 0.21 -0.11 0.11 -0.09 -0.87 0.00 0.00 176.83 176.08 1itf h ARG 12 N -0.15 0.80 -0.28 4.77 2.43 -1.99 -1.87 114.38 118.10 1itf h ARG 12 Ca 0.01 -0.17 -0.11 0.00 -0.81 0.00 0.00 59.98 58.90 1itf h ARG 12 Cb 0.15 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1itf h ARG 12 CO -0.03 0.73 -0.27 -0.09 -1.51 0.00 0.00 179.97 178.81 1itf h ARG 13 N 0.77 0.55 -0.49 0.20 2.43 -1.24 -0.88 114.38 115.73 1itf h ARG 13 Ca 0.17 -0.22 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 1itf h ARG 13 Cb 0.31 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.81 1itf h ARG 13 CO 0.00 0.77 0.24 1.15 -1.51 0.00 0.00 179.97 180.62 1itf h THR 14 N 0.48 1.19 -0.14 0.20 2.02 0.89 -0.04 112.91 117.51 1itf h THR 14 Ca 0.06 -0.52 -0.10 0.00 0.77 0.00 0.00 66.41 66.62 1itf h THR 14 Cb 0.72 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 1itf h THR 14 CO 0.06 0.21 -0.37 -0.07 0.37 0.00 0.00 175.52 175.71 1itf h LEU 15 N 0.64 0.30 -0.84 2.58 3.38 -1.14 -2.08 115.31 118.16 1itf h LEU 15 Ca 0.17 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 1itf h LEU 15 Cb 0.11 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1itf h LEU 15 CO -0.02 0.65 0.08 -0.03 0.09 0.00 0.00 178.44 179.21 1itf h MET 16 N 0.25 0.95 -0.73 1.13 4.05 -0.50 -1.62 114.93 118.45 1itf h MET 16 Ca 0.03 -0.24 -0.04 0.00 -0.28 0.00 0.00 59.70 59.16 1itf h MET 16 Cb 0.77 -0.12 -0.03 0.00 -0.80 0.00 0.00 31.60 31.42 1itf h MET 16 CO 0.06 0.89 0.28 -0.07 0.23 0.00 0.00 176.91 178.30 1itf h LEU 17 N 0.89 1.02 -1.29 3.39 3.38 -0.58 -1.93 115.31 120.18 1itf h LEU 17 Ca 0.18 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1itf h LEU 17 Cb 0.42 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1itf h LEU 17 CO 0.01 0.92 0.32 -0.07 0.09 0.00 0.00 178.44 179.71 1itf h LEU 18 N 1.05 0.71 -0.56 1.67 3.38 -0.76 0.12 115.31 120.94 1itf h LEU 18 Ca 0.24 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 58.07 1itf h LEU 18 Cb 0.22 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1itf h LEU 18 CO -0.02 0.58 0.01 0.00 0.09 0.00 0.00 178.44 179.10 1itf h ALA 19 N 1.54 0.75 -0.01 1.53 0.00 -0.62 -2.21 119.26 120.24 1itf h ALA 19 Ca 0.21 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 1itf h ALA 19 Cb 0.03 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1itf h ALA 19 CO -0.03 0.57 -0.55 1.96 0.00 0.00 0.00 179.25 181.19 1itf h GLN 20 N 0.86 0.03 0.00 0.00 4.20 -0.65 -2.77 115.11 116.78 1itf h GLN 20 Ca 0.16 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.79 1itf h GLN 20 Cb 0.53 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 1itf h GLN 20 CO 0.03 0.58 -0.30 0.52 -0.67 0.00 0.00 178.83 178.98 1itf h MET 21 N 0.02 0.00 -6.25 1.46 2.86 -0.39 -3.44 114.93 109.19 1itf h MET 21 Ca -0.00 0.00 -0.68 0.00 -2.06 0.00 0.00 59.70 56.95 1itf h MET 21 Cb 0.99 0.00 0.04 0.00 0.06 0.00 0.00 31.60 32.69 1itf h MET 21 CO 0.07 0.30 0.66 -2.13 1.06 0.00 0.00 176.91 176.87 1itf n ARG 22 N -3.79 1.31 -0.03 1.72 0.63 -0.87 -4.79 116.66 110.84 1itf n ARG 22 Ca -0.01 0.47 -0.01 0.00 -0.92 0.00 0.00 57.85 57.38 1itf n ARG 22 Cb 0.39 -2.15 -0.06 0.00 0.45 0.00 0.00 32.46 31.09 1itf n ARG 22 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1itf n LYS 23 N 3.72 2.05 -4.44 -0.14 5.02 -1.26 -5.05 118.16 118.06 1itf n LYS 23 Ca 0.21 -0.02 -0.21 0.00 -2.02 0.00 0.00 58.31 56.26 1itf n LYS 23 Cb 0.19 -1.19 -0.10 0.00 -0.02 0.00 0.00 35.03 33.90 1itf n LYS 23 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1itf s ILE 24 N -2.29 1.11 0.12 -0.18 -4.36 -1.26 -5.13 121.20 109.21 1itf s ILE 24 Ca -0.03 -2.00 -0.25 0.00 -0.26 0.00 0.00 60.65 58.10 1itf s ILE 24 Cb 0.03 -2.76 -0.07 0.00 1.25 0.00 0.00 42.46 40.91 1itf s ILE 24 CO 0.31 0.00 0.78 -0.44 0.24 0.00 0.00 174.94 175.84 1itf s SER 25 N -3.48 7.33 0.25 4.36 0.01 -1.26 -4.95 113.70 115.96 1itf s SER 25 Ca 0.36 1.58 -0.06 0.00 1.31 0.00 0.00 55.95 59.14 1itf s SER 25 Cb 0.08 -2.49 0.25 0.00 0.21 0.00 0.00 66.02 64.07 1itf s SER 25 CO 0.15 0.12 1.90 0.25 0.41 0.00 0.00 173.24 176.07 1itf h LEU 26 N 4.90 1.13 -0.95 2.44 5.85 -1.92 -1.39 115.31 125.38 1itf h LEU 26 Ca -0.46 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.20 1itf h LEU 26 Cb 1.21 -0.29 -0.05 0.00 0.37 0.00 0.00 40.66 41.90 1itf h LEU 26 CO 0.68 0.86 0.58 -0.26 -0.34 0.00 0.00 178.44 179.96 1itf h PHE 27 N 1.31 1.24 -0.07 1.25 0.04 -2.00 0.12 116.94 118.82 1itf h PHE 27 Ca 0.34 -0.00 0.01 0.00 2.80 0.00 0.00 57.97 61.12 1itf h PHE 27 Cb -0.07 -0.41 -0.00 0.00 2.20 0.00 0.00 35.95 37.67 1itf h PHE 27 CO 0.00 0.82 0.05 0.77 -0.60 0.00 0.00 178.31 179.36 1itf h SER 28 N 1.30 0.07 -1.96 2.17 0.02 -1.67 -1.89 113.55 111.59 1itf h SER 28 Ca 0.34 -0.00 -0.75 0.00 -0.84 0.00 0.00 61.79 60.54 1itf h SER 28 Cb -0.06 -0.02 -0.29 0.00 0.14 0.00 0.00 62.40 62.17 1itf h SER 28 CO -0.06 0.05 0.84 0.00 -1.14 0.00 0.00 176.83 176.51 1itf n LEU 30 N -0.51 1.85 -0.03 0.00 4.32 -0.71 -3.60 117.00 118.32 1itf n LEU 30 Ca 0.52 -0.92 -0.00 0.00 -0.02 0.00 0.00 56.01 55.58 1itf n LEU 30 Cb 0.28 -0.25 -0.14 0.00 -1.62 0.00 0.00 43.42 41.70 1itf n LEU 30 CO 0.49 0.43 -0.78 0.29 -1.22 0.00 0.00 177.39 176.60 1itf n LYS 31 N 0.43 0.66 -0.39 3.23 5.02 -1.26 -4.30 118.16 121.55 1itf n LYS 31 Ca 0.11 -0.01 0.06 0.00 -2.02 0.00 0.00 58.31 56.45 1itf n LYS 31 Cb 0.31 -1.60 0.19 0.00 -0.02 0.00 0.00 35.03 33.91 1itf n LYS 31 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1itf n ASP 32 N -2.62 2.68 -4.67 4.39 9.92 -1.24 -5.00 116.55 120.02 1itf n ASP 32 Ca -0.17 -3.33 -0.41 0.00 -0.53 0.00 0.00 54.79 50.36 1itf n ASP 32 Cb 0.87 -0.51 -0.05 0.00 -0.64 0.00 0.00 41.12 40.79 1itf n ASP 32 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1itf s ARG 33 N -2.99 4.26 -0.08 -1.24 3.52 -1.24 -4.75 118.95 116.44 1itf s ARG 33 Ca 0.38 0.85 -0.04 0.00 -0.13 0.00 0.00 55.73 56.79 1itf s ARG 33 Cb 0.33 -3.58 0.04 0.00 -1.56 0.00 0.00 34.95 30.18 1itf s ARG 33 CO 0.02 -0.29 0.18 -1.58 -0.81 0.00 0.00 175.30 172.82 1itf s HIS 34 N 2.05 -0.22 -0.24 5.12 5.65 -1.26 -5.07 115.29 121.32 1itf s HIS 34 Ca 0.34 0.57 -0.29 0.00 0.25 0.00 0.00 55.06 55.93 1itf s HIS 34 Cb -0.16 -0.01 -0.02 0.00 -1.18 0.00 0.00 32.58 31.20 1itf s HIS 34 CO 0.11 -0.17 1.62 0.34 -0.65 0.00 0.00 174.74 176.00 1itf s ASP 35 N 0.95 6.33 -0.02 9.88 -1.08 -1.26 -4.89 116.67 126.57 1itf s ASP 35 Ca -0.07 1.55 -0.25 0.00 -0.52 0.00 0.00 52.55 53.27 1itf s ASP 35 Cb -0.09 -2.53 -0.18 0.00 -1.46 0.00 0.00 42.92 38.66 1itf s ASP 35 CO -0.05 -1.31 1.20 -0.26 0.52 0.00 0.00 175.17 175.26 1itf h PHE 36 N 10.94 -0.13 0.00 -5.34 0.04 -1.99 -3.49 116.94 116.97 1itf h PHE 36 Ca -0.33 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.43 1itf h PHE 36 Cb 1.15 0.04 0.00 0.00 2.20 0.00 0.00 35.95 39.35 1itf h PHE 36 CO 0.92 0.30 0.00 0.41 -0.60 0.00 0.00 178.31 179.33 1itf n GLY 37 N 0.13 0.68 3.73 -1.45 0.00 -1.26 -5.05 105.19 101.97 1itf n GLY 37 Ca -0.09 -0.74 -0.41 0.00 0.00 0.00 0.00 46.02 44.78 1itf n GLY 37 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1itf s PHE 38 N -0.84 3.39 -1.27 1.61 5.36 -1.26 -4.81 117.98 120.16 1itf s PHE 38 Ca 0.00 1.32 -0.19 0.00 -0.96 0.00 0.00 56.93 57.10 1itf s PHE 38 Cb 0.00 -3.48 0.07 0.00 -0.34 0.00 0.00 43.02 39.27 1itf s PHE 38 CO 0.00 -1.44 1.71 -1.25 -1.46 0.00 0.00 175.22 172.78 1itf s PRO 39 N 0.24 3.92 0.19 10.12 0.04 -1.26 -4.68 135.00 143.58 1itf s PRO 39 Ca 0.56 -1.89 0.23 0.00 0.04 0.00 0.00 61.00 59.94 1itf s PRO 39 Cb -0.33 -5.52 0.17 0.00 0.04 0.00 0.00 34.50 28.87 1itf s PRO 39 CO 0.34 -2.28 1.21 0.37 0.04 0.00 0.00 177.00 176.68 1itf h GLN 40 N 7.84 0.00 -0.34 4.56 -0.00 -1.97 -3.31 115.11 121.89 1itf h GLN 40 Ca 0.42 0.00 0.04 0.00 -0.00 0.00 0.00 58.65 59.11 1itf h GLN 40 Cb 0.89 0.00 -0.02 0.00 0.00 0.00 0.00 27.48 28.35 1itf h GLN 40 CO 1.45 0.00 0.23 1.49 0.00 0.00 0.00 178.83 182.00 1itf h GLU 41 N 0.00 0.30 -0.90 1.69 4.57 -2.02 0.32 114.58 118.54 1itf h GLU 41 Ca 0.00 -0.02 -0.25 0.00 -1.18 0.00 0.00 59.36 57.91 1itf h GLU 41 Cb 0.90 -0.07 -0.15 0.00 -0.16 0.00 0.00 28.75 29.27 1itf h GLU 41 CO 0.00 0.20 0.32 -1.91 -1.18 0.00 0.00 179.01 176.43 1itf n GLU 42 N -4.48 2.51 -0.08 1.92 2.13 -1.24 -3.82 120.64 117.57 1itf n GLU 42 Ca 0.03 -2.18 0.01 0.00 0.66 0.00 0.00 57.16 55.69 1itf n GLU 42 Cb 0.19 -1.91 0.01 0.00 0.27 0.00 0.00 31.44 30.01 1itf n GLU 42 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1itf n PHE 43 N -0.31 0.00 0.00 4.31 3.01 0.11 -4.86 117.46 119.73 1itf n PHE 43 Ca 0.35 -0.26 0.00 0.00 1.01 0.00 0.00 57.45 58.55 1itf n PHE 43 Cb 1.21 -0.04 0.00 0.00 -0.01 0.00 0.00 39.48 40.64 1itf n PHE 43 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1itf n GLY 44 N -0.31 0.15 3.74 1.37 0.00 -1.19 -4.68 105.19 104.27 1itf n GLY 44 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1itf n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1itf s ASN 45 N -0.37 6.68 -1.36 1.61 4.22 -1.26 -1.83 114.94 122.62 1itf s ASN 45 Ca 0.00 2.63 0.00 0.00 -2.14 0.00 0.00 52.86 53.35 1itf s ASN 45 Cb 0.00 -2.62 0.00 0.00 1.28 0.00 0.00 41.25 39.91 1itf s ASN 45 CO 0.00 -0.69 0.00 1.67 -2.04 0.00 0.00 177.10 176.04 1itf n GLN 46 N 2.54 -1.19 -2.71 3.55 -0.06 -1.26 -4.89 117.38 113.37 1itf n GLN 46 Ca 0.07 0.79 -0.06 0.00 -2.00 0.00 0.00 57.00 55.81 1itf n GLN 46 Cb 0.40 -5.11 0.08 0.00 -4.06 0.00 0.00 30.24 21.56 1itf n GLN 46 CO 0.00 0.00 0.00 1.19 -0.20 0.00 0.00 177.06 178.05 1itf n PHE 47 N -3.75 -0.51 -3.55 3.69 3.72 -0.76 -4.82 117.46 111.47 1itf n PHE 47 Ca -0.18 -2.23 -0.16 0.00 -0.05 0.00 0.00 57.45 54.84 1itf n PHE 47 Cb 0.61 0.59 -0.06 0.00 -0.94 0.00 0.00 39.48 39.69 1itf n PHE 47 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 176.76 177.85 1itf s GLN 48 N -1.66 1.03 -0.36 -1.08 -2.07 -1.26 -4.43 119.66 109.83 1itf s GLN 48 Ca 0.23 0.03 -0.08 0.00 -1.82 0.00 0.00 55.36 53.72 1itf s GLN 48 Cb 0.41 0.48 0.01 0.00 -1.09 0.00 0.00 33.01 32.82 1itf s GLN 48 CO -0.04 -0.34 0.27 1.17 -1.32 0.00 0.00 175.29 175.03 1itf n LYS 49 N 0.73 -2.94 -3.44 9.60 4.81 -1.26 -4.16 118.16 121.49 1itf n LYS 49 Ca -0.19 2.45 -0.20 0.00 -0.87 0.00 0.00 58.31 59.50 1itf n LYS 49 Cb 0.58 -5.38 0.06 0.00 0.02 0.00 0.00 35.03 30.31 1itf n LYS 49 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1itf n ALA 50 N 0.27 -2.39 0.03 3.14 0.00 -1.26 -4.88 120.51 115.41 1itf n ALA 50 Ca 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1itf n ALA 50 Cb 0.22 -4.49 0.00 0.00 0.00 0.00 0.00 19.45 15.18 1itf n ALA 50 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1itf n GLU 51 N -3.72 0.00 -0.21 0.00 1.02 -1.25 -4.57 120.64 111.91 1itf n GLU 51 Ca -0.13 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.07 1itf n GLU 51 Cb 0.63 0.00 0.18 0.00 -0.02 0.00 0.00 31.44 32.22 1itf n GLU 51 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1itf n THR 52 N -2.64 0.56 -0.31 2.62 -2.24 -1.26 -4.32 114.28 106.70 1itf n THR 52 Ca 0.00 -0.54 0.05 0.00 -2.27 0.00 0.00 64.05 61.29 1itf n THR 52 Cb 0.00 0.25 0.19 0.00 -2.10 0.00 0.00 70.33 68.68 1itf n THR 52 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1itf h ILE 53 N 2.34 0.87 -0.32 2.28 2.04 -1.90 1.26 117.51 124.08 1itf h ILE 53 Ca 0.00 -0.27 -0.13 0.00 1.00 0.00 0.00 64.86 65.46 1itf h ILE 53 Cb 0.55 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 1itf h ILE 53 CO 0.01 0.14 -0.33 1.55 0.00 0.00 0.00 178.15 179.52 1itf h PRO 54 N 0.79 0.71 -0.13 2.37 0.13 -1.86 0.16 132.00 134.17 1itf h PRO 54 Ca 0.43 -0.34 -0.04 0.00 -0.87 0.00 0.00 66.00 65.19 1itf h PRO 54 Cb 0.46 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.58 1itf h PRO 54 CO -0.28 0.94 -0.08 0.28 -0.23 0.00 0.00 178.00 178.64 1itf h VAL 55 N 0.60 1.33 -0.50 1.56 2.07 -1.33 -2.39 116.25 117.58 1itf h VAL 55 Ca 0.06 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.44 1itf h VAL 55 Cb 0.86 1.81 -0.02 0.00 -1.52 0.00 0.00 31.29 32.41 1itf h VAL 55 CO 0.07 0.33 0.32 -0.07 0.02 0.00 0.00 177.57 178.25 1itf h LEU 56 N -0.07 0.58 -0.20 2.57 3.38 0.16 -0.37 115.31 121.36 1itf h LEU 56 Ca 0.03 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1itf h LEU 56 Cb 0.56 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1itf h LEU 56 CO 0.02 0.44 0.12 -0.74 0.09 0.00 0.00 178.44 178.37 1itf h HIS 57 N 0.68 0.26 -0.03 1.13 2.76 -0.40 0.82 115.15 120.37 1itf h HIS 57 Ca 0.18 0.00 -0.10 0.00 -2.20 0.00 0.00 60.37 58.25 1itf h HIS 57 Cb -0.06 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 28.80 1itf h HIS 57 CO 0.00 0.19 -0.46 1.49 -1.30 0.00 0.00 177.93 177.85 1itf h GLU 58 N 0.25 0.06 -0.72 5.26 4.57 -0.91 -2.10 114.58 120.99 1itf h GLU 58 Ca 0.07 -0.03 -0.07 0.00 -1.18 0.00 0.00 59.36 58.15 1itf h GLU 58 Cb 0.00 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.56 1itf h GLU 58 CO -0.01 0.51 0.18 1.98 -1.18 0.00 0.00 179.01 180.49 1itf h MET 59 N 0.05 1.14 -0.40 1.92 4.05 -0.35 0.11 114.93 121.46 1itf h MET 59 Ca 0.00 -0.27 -0.08 0.00 -0.28 0.00 0.00 59.70 59.07 1itf h MET 59 Cb 0.83 -0.15 -0.02 0.00 -0.80 0.00 0.00 31.60 31.46 1itf h MET 59 CO 0.06 1.00 -0.07 0.82 0.23 0.00 0.00 176.91 178.95 1itf h ILE 60 N 1.08 1.24 -0.14 1.77 1.08 -0.50 -0.53 117.51 121.52 1itf h ILE 60 Ca 0.23 -1.05 -0.13 0.00 -0.39 0.00 0.00 64.86 63.51 1itf h ILE 60 Cb 0.37 1.02 -0.01 0.00 -3.07 0.00 0.00 36.82 35.13 1itf h ILE 60 CO 0.00 0.36 -0.49 -0.61 -0.69 0.00 0.00 178.15 176.72 1itf h GLN 61 N 0.63 0.36 -0.34 2.37 5.75 -0.71 0.33 115.11 123.51 1itf h GLN 61 Ca 0.12 -0.20 -0.17 0.00 -0.15 0.00 0.00 58.65 58.25 1itf h GLN 61 Cb 0.50 0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.07 1itf h GLN 61 CO 0.03 0.77 -0.44 1.96 -2.65 0.00 0.00 178.83 178.50 1itf h GLN 62 N 0.29 0.90 0.00 1.69 1.08 -0.28 -1.43 115.11 117.35 1itf h GLN 62 Ca 0.01 -0.51 -0.09 0.00 -1.45 0.00 0.00 58.65 56.62 1itf h GLN 62 Cb 0.97 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.42 1itf h GLN 62 CO 0.08 1.16 -0.41 0.82 -0.95 0.00 0.00 178.83 179.53 1itf h ILE 63 N 0.70 0.81 -0.29 2.54 2.04 -0.99 0.41 117.51 122.73 1itf h ILE 63 Ca 0.04 -1.79 -0.10 0.00 1.00 0.00 0.00 64.86 64.01 1itf h ILE 63 Cb 1.04 2.14 -0.01 0.00 -0.74 0.00 0.00 36.82 39.26 1itf h ILE 63 CO 0.10 0.40 -0.19 0.15 0.00 0.00 0.00 178.15 178.61 1itf h PHE 64 N 0.00 0.75 0.12 1.37 3.57 -0.03 -1.68 116.94 121.05 1itf h PHE 64 Ca -0.00 -0.20 -0.28 0.00 3.53 0.00 0.00 57.97 61.01 1itf h PHE 64 Cb 1.11 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 39.68 1itf h PHE 64 CO 0.00 0.90 -1.34 -0.91 -2.23 0.00 0.00 178.31 174.73 1itf h ASN 65 N 0.39 0.41 -0.23 0.41 4.21 -1.24 0.17 115.58 119.70 1itf h ASN 65 Ca 0.06 -0.47 -0.00 0.00 1.21 0.00 0.00 56.30 57.09 1itf h ASN 65 Cb 0.73 -0.13 -0.01 0.00 -1.12 0.00 0.00 38.32 37.79 1itf h ASN 65 CO 0.05 1.38 0.14 0.25 -1.29 0.00 0.00 177.43 177.96 1itf h LEU 66 N 0.07 0.28 0.00 1.61 5.85 -0.92 -1.16 115.31 121.04 1itf h LEU 66 Ca -0.17 -0.01 -0.26 0.00 0.84 0.00 0.00 57.88 58.28 1itf h LEU 66 Cb 1.99 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 42.90 1itf h LEU 66 CO 0.19 0.22 -2.05 0.49 -0.34 0.00 0.00 178.44 176.95 1itf n PHE 67 N -4.49 0.33 0.24 1.25 3.01 -0.64 -4.15 117.46 113.02 1itf n PHE 67 Ca 0.01 0.11 0.12 0.00 1.01 0.00 0.00 57.45 58.70 1itf n PHE 67 Cb 0.08 -0.96 0.57 0.00 -0.01 0.00 0.00 39.48 39.16 1itf n PHE 67 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1itf h SER 68 N 0.00 0.00 -3.32 4.37 0.87 -0.24 -3.06 113.55 112.18 1itf h SER 68 Ca -0.35 0.00 -0.58 0.00 -1.23 0.00 0.00 61.79 59.63 1itf h SER 68 Cb 1.89 0.00 0.15 0.00 -0.44 0.00 0.00 62.40 64.00 1itf h SER 68 CO 0.04 0.15 0.07 0.35 -0.53 0.00 0.00 176.83 176.90 1itf n THR 69 N -3.34 3.04 0.31 2.23 -2.24 -0.48 -4.59 114.28 109.21 1itf n THR 69 Ca -0.00 -0.50 0.17 0.00 -2.27 0.00 0.00 64.05 61.45 1itf n THR 69 Cb 0.36 -1.09 0.99 0.00 -2.10 0.00 0.00 70.33 68.50 1itf n THR 69 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1itf h LYS 70 N 0.82 0.00 -0.13 -0.78 5.09 -1.92 0.42 116.57 120.07 1itf h LYS 70 Ca -0.47 0.00 -0.13 0.00 0.09 0.00 0.00 60.65 60.14 1itf h LYS 70 Cb 1.36 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.69 1itf h LYS 70 CO 0.52 0.01 -0.42 -0.44 -2.09 0.00 0.00 179.45 177.03 1itf h ASP 71 N 0.00 0.60 0.96 7.07 3.32 -1.92 -1.79 116.42 124.67 1itf h ASP 71 Ca -0.00 -0.60 -0.21 0.00 0.02 0.00 0.00 57.03 56.24 1itf h ASP 71 Cb 0.03 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.38 1itf h ASP 71 CO 0.00 1.10 -1.01 -1.28 -1.72 0.00 0.00 179.24 176.33 1itf h SER 72 N 0.14 0.03 -0.41 6.45 0.87 -1.55 -0.69 113.55 118.39 1itf h SER 72 Ca -0.02 -0.03 -0.08 0.00 -1.23 0.00 0.00 61.79 60.43 1itf h SER 72 Cb 1.05 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.98 1itf h SER 72 CO 0.09 1.02 -0.01 -1.28 -0.53 0.00 0.00 176.83 176.12 1itf h SER 73 N 0.01 0.78 1.31 6.23 0.87 -0.08 -0.92 113.55 121.74 1itf h SER 73 Ca -0.02 -0.19 -0.10 0.00 -1.23 0.00 0.00 61.79 60.25 1itf h SER 73 Cb 1.77 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 63.51 1itf h SER 73 CO 0.13 0.85 -0.72 0.00 -0.53 0.00 0.00 176.83 176.56 1itf h ALA 74 N 1.24 0.69 -0.00 6.23 0.00 -1.34 -3.26 119.26 122.82 1itf h ALA 74 Ca 0.14 -0.47 -0.10 0.00 0.00 0.00 0.00 54.91 54.49 1itf h ALA 74 Cb 0.47 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1itf h ALA 74 CO 0.02 0.58 -0.48 0.00 0.00 0.00 0.00 179.25 179.38 1itf h ALA 75 N 1.57 1.21 -1.63 0.00 0.00 -0.43 -3.45 119.26 116.53 1itf h ALA 75 Ca -0.04 -0.43 -0.61 0.00 0.00 0.00 0.00 54.91 53.82 1itf h ALA 75 Cb 1.36 -0.08 -0.13 0.00 0.00 0.00 0.00 17.79 18.94 1itf h ALA 75 CO 0.05 0.60 -0.59 -1.58 0.00 0.00 0.00 179.25 177.72 1itf s TRP 76 N -3.95 2.39 0.21 0.00 0.52 -0.41 -5.01 118.94 112.69 1itf s TRP 76 Ca -0.02 -0.73 -0.31 0.00 0.02 0.00 0.00 56.10 55.06 1itf s TRP 76 Cb 0.14 -1.69 -0.10 0.00 -1.15 0.00 0.00 33.47 30.66 1itf s TRP 76 CO 0.74 0.37 1.46 -0.51 0.02 0.00 0.00 176.95 179.03 1itf s ASP 77 N -3.69 6.66 0.45 2.95 1.01 -1.26 -4.80 116.67 117.99 1itf s ASP 77 Ca 0.33 2.61 0.17 0.00 0.71 0.00 0.00 52.55 56.37 1itf s ASP 77 Cb 0.09 -2.61 1.03 0.00 1.01 0.00 0.00 42.92 42.44 1itf s ASP 77 CO 0.17 -0.72 1.97 1.05 0.21 0.00 0.00 175.17 177.85 1itf h GLU 78 N 5.70 0.00 0.09 8.23 4.11 -1.96 0.20 114.58 130.95 1itf h GLU 78 Ca -0.45 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 58.79 1itf h GLU 78 Cb 1.21 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.48 1itf h GLU 78 CO 0.82 0.21 -0.81 1.15 0.07 0.00 0.00 179.01 180.45 1itf h THR 79 N 0.00 1.45 -0.55 -1.06 2.02 -1.96 0.22 112.91 113.03 1itf h THR 79 Ca -0.00 -2.37 -0.04 0.00 0.77 0.00 0.00 66.41 64.77 1itf h THR 79 Cb 0.39 2.92 -0.03 0.00 -1.74 0.00 0.00 68.15 69.70 1itf h THR 79 CO 0.03 0.68 0.19 -0.07 0.37 0.00 0.00 175.52 176.72 1itf h LEU 80 N -0.18 0.74 -0.58 2.58 3.38 -1.89 -1.09 115.31 118.27 1itf h LEU 80 Ca -0.13 -0.11 -0.16 0.00 0.09 0.00 0.00 57.88 57.58 1itf h LEU 80 Cb 1.57 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 42.12 1itf h LEU 80 CO 0.15 0.69 -0.61 -0.07 0.09 0.00 0.00 178.44 178.70 1itf h LEU 81 N 0.80 0.40 -0.11 1.67 3.38 -0.60 -0.97 115.31 119.86 1itf h LEU 81 Ca 0.19 -0.23 0.03 0.00 0.09 0.00 0.00 57.88 57.96 1itf h LEU 81 Cb 0.20 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1itf h LEU 81 CO -0.01 0.91 -0.09 0.44 0.09 0.00 0.00 178.44 179.77 1itf h ASP 82 N 0.26 -0.28 -0.25 -0.43 3.32 0.66 0.36 116.42 120.05 1itf h ASP 82 Ca -0.01 0.06 -0.07 0.00 0.02 0.00 0.00 57.03 57.03 1itf h ASP 82 Cb 1.13 0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.81 1itf h ASP 82 CO 0.10 -0.12 -0.06 0.11 -1.72 0.00 0.00 179.24 177.55 1itf h LYS 83 N -0.10 0.62 -0.15 3.56 6.56 -1.23 -1.61 116.57 124.21 1itf h LYS 83 Ca 0.07 -0.17 -0.02 0.00 -1.06 0.00 0.00 60.65 59.48 1itf h LYS 83 Cb 0.21 -0.07 -0.01 0.00 -0.57 0.00 0.00 32.23 31.79 1itf h LYS 83 CO -0.18 0.68 0.02 0.35 -2.06 0.00 0.00 179.45 178.26 1itf h PHE 84 N 0.58 0.21 0.01 -1.35 3.57 0.30 -0.24 116.94 120.01 1itf h PHE 84 Ca 0.11 -0.00 -0.20 0.00 3.53 0.00 0.00 57.97 61.41 1itf h PHE 84 Cb 0.46 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 1itf h PHE 84 CO 0.02 0.21 -0.89 1.88 -2.23 0.00 0.00 178.31 177.30 1itf h TYR 85 N 0.21 0.31 -0.25 0.41 0.05 0.56 -1.51 116.97 116.75 1itf h TYR 85 Ca 0.05 -0.17 -0.13 0.00 0.05 0.00 0.00 58.73 58.53 1itf h TYR 85 Cb 0.12 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 37.82 1itf h TYR 85 CO 0.00 0.99 -0.39 1.15 -1.05 0.00 0.00 178.16 178.86 1itf h THR 86 N 0.11 1.30 0.00 -2.88 2.02 -0.49 0.02 112.91 113.00 1itf h THR 86 Ca -0.05 -1.55 -0.14 0.00 0.77 0.00 0.00 66.41 65.44 1itf h THR 86 Cb 1.52 1.53 -0.02 0.00 -1.74 0.00 0.00 68.15 69.44 1itf h THR 86 CO 0.14 0.49 -0.69 -0.33 0.37 0.00 0.00 175.52 175.50 1itf h GLU 87 N 0.48 0.00 -0.18 6.66 3.07 -1.07 0.54 114.58 124.08 1itf h GLU 87 Ca 0.04 0.00 -0.22 0.00 -0.50 0.00 0.00 59.36 58.69 1itf h GLU 87 Cb 0.89 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.81 1itf h GLU 87 CO 0.08 0.69 -0.74 -0.07 -1.40 0.00 0.00 179.01 177.57 1itf h LEU 88 N 0.00 0.95 -0.12 1.33 3.38 -0.97 -0.77 115.31 119.11 1itf h LEU 88 Ca -0.01 -0.61 -0.22 0.00 0.09 0.00 0.00 57.88 57.13 1itf h LEU 88 Cb 1.37 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 1itf h LEU 88 CO 0.09 1.41 -1.00 1.88 0.09 0.00 0.00 178.44 180.91 1itf h TYR 89 N 0.56 0.31 -0.22 1.13 -1.99 -0.98 -0.20 116.97 115.57 1itf h TYR 89 Ca -0.04 -0.19 -0.05 0.00 2.00 0.00 0.00 58.73 60.45 1itf h TYR 89 Cb 1.36 -0.02 -0.01 0.00 2.00 0.00 0.00 36.73 40.06 1itf h TYR 89 CO 0.09 1.07 -0.05 0.37 -0.00 0.00 0.00 178.16 179.64 1itf h GLN 90 N 0.08 0.42 0.00 4.88 5.75 -0.89 0.10 115.11 125.46 1itf h GLN 90 Ca -0.06 -0.16 -0.06 0.00 -0.15 0.00 0.00 58.65 58.22 1itf h GLN 90 Cb 1.68 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 30.20 1itf h GLN 90 CO 0.15 0.65 -0.27 0.37 -2.65 0.00 0.00 178.83 177.09 1itf h GLN 91 N 0.15 0.00 -0.11 1.69 5.75 -1.17 -0.89 115.11 120.53 1itf h GLN 91 Ca 0.06 0.00 -0.18 0.00 -0.15 0.00 0.00 58.65 58.38 1itf h GLN 91 Cb 0.50 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.04 1itf h GLN 91 CO 0.02 0.27 -0.67 -0.07 -2.65 0.00 0.00 178.83 175.73 1itf h LEU 92 N 0.00 0.53 -0.02 -2.39 3.38 -0.45 0.74 115.31 117.11 1itf h LEU 92 Ca -0.00 -0.33 -0.26 0.00 0.09 0.00 0.00 57.88 57.38 1itf h LEU 92 Cb 0.62 -0.16 0.02 0.00 0.09 0.00 0.00 40.66 41.23 1itf h LEU 92 CO 0.03 1.06 -1.02 0.78 0.09 0.00 0.00 178.44 179.38 1itf h ASN 93 N 0.33 0.92 -0.55 -0.43 4.21 -0.37 0.10 115.58 119.80 1itf h ASN 93 Ca -0.02 -0.72 -0.09 0.00 1.21 0.00 0.00 56.30 56.67 1itf h ASN 93 Cb 1.24 -0.28 -0.02 0.00 -1.12 0.00 0.00 38.32 38.13 1itf h ASN 93 CO 0.12 1.53 -0.01 -0.78 -1.29 0.00 0.00 177.43 177.00 1itf h ASP 94 N 0.41 0.98 -0.44 5.81 1.82 -1.16 0.19 116.42 124.03 1itf h ASP 94 Ca -0.12 -0.27 -0.13 0.00 -0.39 0.00 0.00 57.03 56.11 1itf h ASP 94 Cb 1.67 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 41.40 1itf h ASP 94 CO 0.20 1.04 -0.25 -0.07 -1.61 0.00 0.00 179.24 178.55 1itf h LEU 95 N 0.92 0.99 -1.29 2.28 3.38 -0.83 -2.81 115.31 117.94 1itf h LEU 95 Ca 0.16 -0.41 -0.07 0.00 0.09 0.00 0.00 57.88 57.65 1itf h LEU 95 Cb 0.55 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1itf h LEU 95 CO 0.03 1.18 -0.34 -0.08 0.09 0.00 0.00 178.44 179.32 1itf h GLU 96 N 0.79 0.00 -0.57 1.13 4.81 -0.66 -3.16 114.58 116.91 1itf h GLU 96 Ca 0.09 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.44 1itf h GLU 96 Cb 0.83 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 30.10 1itf h GLU 96 CO 0.07 0.34 -0.07 0.00 -0.73 0.00 0.00 179.01 178.62 1itf h ALA 97 N 1.66 0.47 -0.48 2.92 0.00 -0.68 0.56 119.26 123.71 1itf h ALA 97 Ca -0.00 0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.12 1itf h ALA 97 Cb 0.66 0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 1itf h ALA 97 CO 0.04 -0.42 0.30 0.00 0.00 0.00 0.00 179.25 179.18 1itf h VAL 99 N 0.61 1.06 0.48 0.00 2.07 -0.79 -2.83 116.25 116.86 1itf h VAL 99 Ca 0.18 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 67.41 1itf h VAL 99 Cb -0.03 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1itf h VAL 99 CO -0.06 0.08 -0.23 0.40 0.02 0.00 0.00 177.57 177.78 1itf h ILE 100 N 0.09 0.37 -3.00 4.57 1.08 0.12 -3.45 117.51 117.29 1itf h ILE 100 Ca 0.02 -0.46 -0.18 0.00 -0.39 0.00 0.00 64.86 63.86 1itf h ILE 100 Cb 0.12 0.52 0.06 0.00 -3.07 0.00 0.00 36.82 34.45 1itf h ILE 100 CO 0.00 0.06 0.15 0.00 -0.69 0.00 0.00 178.15 177.67 1itf n GLN 101 N -5.25 -0.37 0.08 2.37 3.00 -0.85 -4.99 117.38 111.36 1itf n GLN 101 Ca -0.10 -0.87 -0.14 0.00 -0.01 0.00 0.00 57.00 55.88 1itf n GLN 101 Cb 0.31 -0.50 -0.06 0.00 0.00 0.00 0.00 30.24 29.99 1itf n GLN 101 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.06 177.84 1itf h GLY 102 N -0.62 0.42 -3.37 1.08 0.00 -1.88 -3.46 103.07 95.24 1itf h GLY 102 Ca -0.17 -0.78 -0.58 0.00 0.00 0.00 0.00 47.33 45.80 1itf h GLY 102 CO 0.13 0.69 0.14 3.33 0.00 0.00 0.00 176.54 180.83 1itf n VAL 103 N -3.70 2.81 0.00 4.60 0.24 -1.26 -3.59 118.33 117.43 1itf n VAL 103 Ca -0.07 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.73 1itf n VAL 103 Cb 0.87 -1.16 0.00 0.00 -1.47 0.00 0.00 33.84 32.08 1itf n VAL 103 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1itf n GLY 104 N 1.22 2.66 2.60 7.63 0.00 -1.26 -4.16 105.19 113.87 1itf n GLY 104 Ca 0.11 -0.83 -0.21 0.00 0.00 0.00 0.00 46.02 45.09 1itf n GLY 104 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1itf s VAL 105 N 0.00 -0.11 0.00 1.61 -7.23 -1.24 -3.81 120.40 109.63 1itf s VAL 105 Ca 0.00 -1.57 0.00 0.00 -1.81 0.00 0.00 61.98 58.60 1itf s VAL 105 Cb 0.00 -0.86 0.00 0.00 0.56 0.00 0.00 36.38 36.08 1itf s VAL 105 CO 0.00 -0.80 0.62 0.41 -0.31 0.00 0.00 175.10 175.02 1itf n THR 106 N 3.76 0.32 0.00 5.32 -1.04 -1.26 -4.71 114.28 116.66 1itf n THR 106 Ca 0.16 -0.60 0.00 0.00 -2.04 0.00 0.00 64.05 61.57 1itf n THR 106 Cb 0.44 0.92 0.00 0.00 -1.82 0.00 0.00 70.33 69.87 1itf n THR 106 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1itf n GLU 107 N -0.16 2.35 -2.67 -2.82 -0.58 -1.26 -5.06 120.64 110.44 1itf n GLU 107 Ca 0.00 0.00 -0.40 0.00 -0.42 0.00 0.00 57.16 56.34 1itf n GLU 107 Cb 0.12 -0.73 -0.05 0.00 -0.57 0.00 0.00 31.44 30.21 1itf n GLU 107 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 1itf s THR 108 N -1.26 4.06 1.04 2.62 -4.23 -1.26 -5.04 115.64 111.56 1itf s THR 108 Ca 0.00 1.93 -0.15 0.00 -1.18 0.00 0.00 61.69 62.29 1itf s THR 108 Cb 0.00 -4.23 0.21 0.00 1.34 0.00 0.00 72.50 69.82 1itf s THR 108 CO 0.00 0.40 1.16 -2.16 -0.54 0.00 0.00 174.62 173.48 1itf s PRO 109 N -0.81 0.11 0.00 3.99 0.04 -1.26 -4.86 135.00 132.21 1itf s PRO 109 Ca 0.44 0.05 0.00 0.00 0.04 0.00 0.00 61.00 61.54 1itf s PRO 109 Cb -0.27 -1.74 0.00 0.00 0.04 0.00 0.00 34.50 32.53 1itf s PRO 109 CO 0.33 -2.84 0.85 1.28 0.04 0.00 0.00 177.00 176.66 1itf n LEU 110 N -4.17 0.00 0.15 -3.56 7.99 -1.26 -2.49 117.00 113.66 1itf n LEU 110 Ca 0.10 0.36 0.18 0.00 -0.01 0.00 0.00 56.01 56.65 1itf n LEU 110 Cb 0.59 -0.36 0.69 0.00 -0.11 0.00 0.00 43.42 44.23 1itf n LEU 110 CO 0.51 -0.36 1.16 0.00 -1.51 0.00 0.00 177.39 177.19 1itf h MET 111 N 0.00 0.00 -0.71 3.23 -0.00 -2.02 0.02 114.93 115.45 1itf h MET 111 Ca 0.00 0.00 0.17 0.00 -0.00 0.00 0.00 59.70 59.87 1itf h MET 111 Cb 0.20 0.00 -0.04 0.00 -0.00 0.00 0.00 31.60 31.77 1itf h MET 111 CO 0.00 0.00 0.49 1.57 -0.00 0.00 0.00 176.91 178.97 1itf h LYS 112 N 0.00 0.19 -0.43 -0.10 2.10 -1.84 0.15 116.57 116.63 1itf h LYS 112 Ca 0.16 -0.01 -0.09 0.00 -2.00 0.00 0.00 60.65 58.70 1itf h LYS 112 Cb 1.21 -0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 32.49 1itf h LYS 112 CO -0.00 0.12 -0.11 1.49 -2.00 0.00 0.00 179.45 178.95 1itf h GLU 113 N 0.19 0.77 -0.25 0.07 4.57 -1.28 -2.44 114.58 116.21 1itf h GLU 113 Ca 0.35 -0.25 -0.03 0.00 -1.18 0.00 0.00 59.36 58.25 1itf h GLU 113 Cb 1.08 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.60 1itf h GLU 113 CO -0.06 0.85 0.03 0.22 -1.18 0.00 0.00 179.01 178.86 1itf h ASP 114 N 0.69 0.33 -0.66 1.04 3.58 -0.87 0.29 116.42 120.82 1itf h ASP 114 Ca 0.12 -0.04 -0.05 0.00 0.42 0.00 0.00 57.03 57.47 1itf h ASP 114 Cb 0.58 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 41.52 1itf h ASP 114 CO 0.04 0.37 0.20 -1.28 -2.88 0.00 0.00 179.24 175.68 1itf h SER 115 N 0.35 0.96 -0.27 2.28 0.87 -1.24 0.88 113.55 117.40 1itf h SER 115 Ca 0.08 -0.21 -0.10 0.00 -1.23 0.00 0.00 61.79 60.34 1itf h SER 115 Cb 0.20 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.89 1itf h SER 115 CO 0.00 0.92 -0.16 0.40 -0.53 0.00 0.00 176.83 177.46 1itf h ILE 116 N 0.96 1.26 -0.46 2.23 2.04 -1.05 -2.28 117.51 120.22 1itf h ILE 116 Ca 0.21 -1.21 -0.03 0.00 1.00 0.00 0.00 64.86 64.83 1itf h ILE 116 Cb 0.31 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 1itf h ILE 116 CO -0.01 0.40 0.15 -0.07 0.00 0.00 0.00 178.15 178.63 1itf h LEU 117 N 0.63 0.60 -0.39 1.44 3.38 0.53 0.27 115.31 121.77 1itf h LEU 117 Ca 0.10 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 1itf h LEU 117 Cb 0.62 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1itf h LEU 117 CO 0.04 0.57 -0.04 0.00 0.09 0.00 0.00 178.44 179.10 1itf h ALA 118 N 1.52 0.53 0.00 1.53 0.00 -0.38 -2.06 119.26 120.39 1itf h ALA 118 Ca 0.15 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 1itf h ALA 118 Cb 0.18 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1itf h ALA 118 CO -0.01 0.34 -0.31 0.28 0.00 0.00 0.00 179.25 179.56 1itf h VAL 119 N 0.53 1.01 -0.30 0.00 2.07 -0.81 -1.91 116.25 116.83 1itf h VAL 119 Ca 0.11 -1.13 -0.14 0.00 0.82 0.00 0.00 66.70 66.36 1itf h VAL 119 Cb 0.53 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 1itf h VAL 119 CO 0.03 0.30 -0.37 0.08 0.02 0.00 0.00 177.57 177.63 1itf h ARG 120 N 0.00 0.70 -0.07 1.57 0.11 0.03 -0.95 114.38 115.77 1itf h ARG 120 Ca -0.00 -0.35 -0.15 0.00 0.10 0.00 0.00 59.98 59.58 1itf h ARG 120 Cb 0.62 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.69 1itf h ARG 120 CO 0.04 0.96 -0.63 -0.22 0.10 0.00 0.00 179.97 180.22 1itf h LYS 121 N 0.58 0.25 0.01 0.08 1.63 -1.05 -0.55 116.57 117.52 1itf h LYS 121 Ca 0.05 -0.18 -0.00 0.00 -0.85 0.00 0.00 60.65 59.67 1itf h LYS 121 Cb 0.90 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.56 1itf h LYS 121 CO 0.08 0.80 -0.00 -0.92 -3.45 0.00 0.00 179.45 175.96 1itf h TYR 122 N 0.18 -0.01 0.00 1.91 3.20 -1.05 -2.06 116.97 119.15 1itf h TYR 122 Ca -0.01 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.80 1itf h TYR 122 Cb 1.15 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.41 1itf h TYR 122 CO 0.02 0.21 -0.30 0.74 -1.64 0.00 0.00 178.16 177.19 1itf h PHE 123 N -0.22 0.00 -0.55 -3.82 -1.00 -1.15 -2.13 116.94 108.08 1itf h PHE 123 Ca -0.00 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.72 1itf h PHE 123 Cb 0.22 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.75 1itf h PHE 123 CO -0.00 0.30 0.12 0.37 -1.61 0.00 0.00 178.31 177.49 1itf h GLN 124 N 0.00 0.89 -0.57 1.51 -0.00 -0.80 -0.51 115.11 115.64 1itf h GLN 124 Ca -0.00 -0.22 -0.09 0.00 -0.00 0.00 0.00 58.65 58.33 1itf h GLN 124 Cb 0.68 -0.11 -0.02 0.00 0.00 0.00 0.00 27.48 28.03 1itf h GLN 124 CO 0.04 0.84 -0.01 -0.09 0.00 0.00 0.00 178.83 179.61 1itf h ARG 125 N 0.78 0.99 -0.68 1.69 9.65 -1.00 -1.85 114.38 123.97 1itf h ARG 125 Ca 0.17 -0.31 -0.01 0.00 -1.10 0.00 0.00 59.98 58.74 1itf h ARG 125 Cb 0.36 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.81 1itf h ARG 125 CO 0.00 0.98 0.38 0.82 2.80 0.00 0.00 179.97 184.96 1itf h ILE 126 N 0.91 1.20 -0.39 1.20 2.04 -0.92 -0.50 117.51 121.05 1itf h ILE 126 Ca 0.16 -0.47 -0.13 0.00 1.00 0.00 0.00 64.86 65.42 1itf h ILE 126 Cb 0.54 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1itf h ILE 126 CO 0.03 0.22 -0.28 0.74 0.00 0.00 0.00 178.15 178.85 1itf h THR 127 N 0.94 1.27 -0.43 -0.27 2.02 -0.53 -2.00 112.91 113.91 1itf h THR 127 Ca 0.24 -1.43 -0.12 0.00 0.77 0.00 0.00 66.41 65.88 1itf h THR 127 Cb -0.00 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.67 1itf h THR 127 CO -0.04 0.48 -0.20 0.25 0.37 0.00 0.00 175.52 176.38 1itf h LEU 128 N 0.71 0.86 -1.06 2.58 6.46 -0.70 -1.45 115.31 122.72 1itf h LEU 128 Ca 0.08 -0.31 -0.04 0.00 -0.12 0.00 0.00 57.88 57.50 1itf h LEU 128 Cb 0.83 -0.24 -0.03 0.00 -0.73 0.00 0.00 40.66 40.49 1itf h LEU 128 CO 0.07 1.04 0.24 0.22 -0.62 0.00 0.00 178.44 179.39 1itf h TYR 129 N 0.74 0.92 -0.47 1.25 3.20 -0.93 0.18 116.97 121.86 1itf h TYR 129 Ca 0.11 -0.06 -0.10 0.00 3.14 0.00 0.00 58.73 61.82 1itf h TYR 129 Cb 0.73 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.70 1itf h TYR 129 CO 0.04 0.71 -0.09 -0.07 -1.64 0.00 0.00 178.16 177.12 1itf h LEU 130 N 0.89 0.89 -1.22 2.82 3.38 -1.00 -1.71 115.31 119.36 1itf h LEU 130 Ca 0.21 -0.35 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 1itf h LEU 130 Cb 0.19 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1itf h LEU 130 CO -0.02 1.03 -0.25 0.11 0.09 0.00 0.00 178.44 179.41 1itf h LYS 131 N 0.74 0.00 -0.05 1.13 1.57 -0.64 0.58 116.57 119.90 1itf h LYS 131 Ca 0.12 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.86 1itf h LYS 131 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.94 1itf h LYS 131 CO 0.04 0.25 -0.15 1.49 -0.57 0.00 0.00 179.45 180.51 1itf h GLU 132 N 0.00 0.18 -0.06 3.15 4.57 -0.20 -2.97 114.58 119.25 1itf h GLU 132 Ca -0.00 -0.14 0.00 0.00 -1.18 0.00 0.00 59.36 58.04 1itf h GLU 132 Cb 0.71 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.32 1itf h GLU 132 CO 0.03 0.76 0.00 1.63 -1.18 0.00 0.00 179.01 180.25 1itf n LYS 133 N -4.61 1.26 -3.60 1.92 4.01 -0.68 -4.89 118.16 111.57 1itf n LYS 133 Ca -0.08 -0.39 -0.25 0.00 -0.51 0.00 0.00 58.31 57.08 1itf n LYS 133 Cb 0.40 -1.32 0.07 0.00 -0.51 0.00 0.00 35.03 33.67 1itf n LYS 133 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1itf n LYS 134 N -0.39 -7.32 -3.33 1.97 5.02 -0.11 -2.41 118.16 111.58 1itf n LYS 134 Ca 0.14 0.80 -0.16 0.00 -2.02 0.00 0.00 58.31 57.07 1itf n LYS 134 Cb 0.15 -5.81 0.08 0.00 -0.02 0.00 0.00 35.03 29.43 1itf n LYS 134 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1itf n TYR 135 N -4.92 -2.20 -2.60 2.13 4.01 0.18 -4.98 117.16 108.79 1itf n TYR 135 Ca 0.00 0.89 -0.33 0.00 -0.16 0.00 0.00 57.90 58.31 1itf n TYR 135 Cb 0.56 -4.74 -0.05 0.00 -0.31 0.00 0.00 39.34 34.80 1itf n TYR 135 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1itf s SER 136 N -4.06 6.65 0.41 7.72 0.15 -1.01 -4.90 113.70 118.67 1itf s SER 136 Ca 0.12 1.72 0.11 0.00 0.70 0.00 0.00 55.95 58.61 1itf s SER 136 Cb -0.02 -2.54 0.88 0.00 -1.71 0.00 0.00 66.02 62.64 1itf s SER 136 CO 0.71 -0.56 1.96 1.55 1.20 0.00 0.00 173.24 178.10 1itf h PRO 137 N 1.49 0.18 -0.00 5.44 0.13 -1.93 0.15 132.00 137.45 1itf h PRO 137 Ca -0.48 -0.03 -0.25 0.00 -0.87 0.00 0.00 66.00 64.36 1itf h PRO 137 Cb 1.19 -0.03 0.02 0.00 0.13 0.00 0.00 31.00 32.31 1itf h PRO 137 CO 0.60 0.29 -0.97 0.00 -0.23 0.00 0.00 178.00 177.70 1itf h ALA 139 N 0.39 1.36 -0.15 0.00 0.00 -1.72 -0.19 119.26 118.95 1itf h ALA 139 Ca -0.12 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.49 1itf h ALA 139 Cb 1.64 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 1itf h ALA 139 CO 0.19 0.48 -0.56 -1.49 0.00 0.00 0.00 179.25 177.88 1itf h TRP 140 N 0.76 0.56 -0.50 0.00 4.06 -0.65 -0.59 115.95 119.58 1itf h TRP 140 Ca 0.18 -0.20 -0.07 0.00 2.06 0.00 0.00 58.89 60.86 1itf h TRP 140 Cb 0.17 -0.10 -0.02 0.00 -1.00 0.00 0.00 29.16 28.20 1itf h TRP 140 CO 0.01 0.90 0.04 1.49 -3.56 0.00 0.00 178.44 177.32 1itf h GLU 141 N 0.34 0.81 -0.33 0.49 4.57 -0.23 0.40 114.58 120.64 1itf h GLU 141 Ca 0.00 -0.20 -0.10 0.00 -1.18 0.00 0.00 59.36 57.88 1itf h GLU 141 Cb 1.08 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.56 1itf h GLU 141 CO 0.10 0.79 -0.18 0.28 -1.18 0.00 0.00 179.01 178.82 1itf h VAL 142 N 0.77 1.29 0.00 0.32 2.07 -0.79 -2.20 116.25 117.70 1itf h VAL 142 Ca 0.15 -1.30 -0.03 0.00 0.82 0.00 0.00 66.70 66.35 1itf h VAL 142 Cb 0.41 1.42 -0.00 0.00 -1.52 0.00 0.00 31.29 31.60 1itf h VAL 142 CO 0.01 0.42 -0.14 0.58 0.02 0.00 0.00 177.57 178.47 1itf h VAL 143 N 0.47 0.38 -0.06 2.57 2.07 -0.67 0.05 116.25 121.05 1itf h VAL 143 Ca 0.07 -0.83 -0.04 0.00 0.82 0.00 0.00 66.70 66.72 1itf h VAL 143 Cb 0.72 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 32.10 1itf h VAL 143 CO 0.05 0.14 -0.12 -0.09 0.02 0.00 0.00 177.57 177.57 1itf h ARG 144 N 0.00 0.19 -0.13 1.57 2.43 0.19 0.20 114.38 118.84 1itf h ARG 144 Ca -0.00 -0.12 -0.11 0.00 -0.81 0.00 0.00 59.98 58.93 1itf h ARG 144 Cb 0.61 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.16 1itf h ARG 144 CO 0.02 0.70 -0.42 0.00 -1.51 0.00 0.00 179.97 178.76 1itf h ALA 145 N 0.49 1.05 -0.08 2.80 0.00 -1.24 -0.92 119.26 121.36 1itf h ALA 145 Ca 0.00 -0.42 -0.16 0.00 0.00 0.00 0.00 54.91 54.33 1itf h ALA 145 Cb 0.69 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1itf h ALA 145 CO 0.03 0.61 -0.65 0.93 0.00 0.00 0.00 179.25 180.16 1itf h GLU 146 N 0.24 0.32 -0.19 0.00 4.39 -0.92 -1.17 114.58 117.25 1itf h GLU 146 Ca 0.02 -0.23 -0.19 0.00 0.34 0.00 0.00 59.36 59.30 1itf h GLU 146 Cb 0.85 0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.54 1itf h GLU 146 CO 0.07 0.86 -0.63 0.82 -1.16 0.00 0.00 179.01 178.97 1itf h ILE 147 N 0.23 1.31 -0.33 3.13 1.08 -0.33 -0.93 117.51 121.66 1itf h ILE 147 Ca -0.01 -1.87 -0.06 0.00 -0.39 0.00 0.00 64.86 62.52 1itf h ILE 147 Cb 1.19 1.83 -0.02 0.00 -3.07 0.00 0.00 36.82 36.75 1itf h ILE 147 CO 0.11 0.59 -0.07 -0.03 -0.69 0.00 0.00 178.15 178.05 1itf h MET 148 N 0.50 0.54 0.35 2.37 4.05 -1.05 0.17 114.93 121.86 1itf h MET 148 Ca -0.01 -0.14 -0.02 0.00 -0.28 0.00 0.00 59.70 59.25 1itf h MET 148 Cb 1.22 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.96 1itf h MET 148 CO 0.13 0.62 -0.17 -0.09 0.23 0.00 0.00 176.91 177.62 1itf h ARG 149 N 0.50 -0.45 -0.90 0.39 9.65 -0.97 0.11 114.38 122.71 1itf h ARG 149 Ca 0.10 0.03 0.05 0.00 -1.10 0.00 0.00 59.98 59.06 1itf h ARG 149 Cb 0.44 0.10 -0.06 0.00 -1.39 0.00 0.00 29.97 29.06 1itf h ARG 149 CO 0.02 -0.17 0.59 0.66 2.80 0.00 0.00 179.97 183.88 1itf h SER 150 N -1.01 0.93 -0.23 -3.80 4.64 -1.16 0.28 113.55 113.20 1itf h SER 150 Ca -0.05 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.09 1itf h SER 150 Cb 0.50 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1itf h SER 150 CO 0.08 0.61 -0.57 0.15 -0.87 0.00 0.00 176.83 176.23 1itf h PHE 151 N 1.06 1.05 0.00 4.77 3.57 -1.00 -1.81 116.94 124.58 1itf h PHE 151 Ca 0.38 -0.38 -0.08 0.00 3.53 0.00 0.00 57.97 61.42 1itf h PHE 151 Cb 0.14 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 1itf h PHE 151 CO -0.00 1.20 -0.37 1.03 -2.23 0.00 0.00 178.31 177.94 1itf h SER 152 N 0.63 0.00 -0.10 0.41 0.87 0.10 -0.86 113.55 114.59 1itf h SER 152 Ca 0.01 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.48 1itf h SER 152 Cb 1.18 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 1itf h SER 152 CO 0.12 0.37 -0.26 -0.07 -0.53 0.00 0.00 176.83 176.47 1itf h LEU 153 N 0.00 0.41 -0.59 2.23 3.38 -0.27 0.20 115.31 120.67 1itf h LEU 153 Ca -0.00 -0.58 -0.10 0.00 0.09 0.00 0.00 57.88 57.28 1itf h LEU 153 Cb 0.71 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1itf h LEU 153 CO 0.05 0.92 -0.03 0.28 0.09 0.00 0.00 178.44 179.74 1itf h SER 154 N -0.09 1.05 0.67 -0.43 0.02 -1.17 -2.92 113.55 110.69 1itf h SER 154 Ca -0.00 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 1itf h SER 154 Cb 0.86 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 63.12 1itf h SER 154 CO 0.06 1.12 -0.34 0.35 -1.14 0.00 0.00 176.83 176.88 1itf n THR 155 N -4.17 0.01 0.27 -2.27 -2.24 -0.34 -3.63 114.28 101.90 1itf n THR 155 Ca 0.02 -0.01 0.14 0.00 -2.27 0.00 0.00 64.05 61.94 1itf n THR 155 Cb 0.37 -0.01 0.75 0.00 -2.10 0.00 0.00 70.33 69.34 1itf n THR 155 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 1itf h ASN 156 N 0.00 0.00 -0.62 3.42 -0.73 -0.39 -2.48 115.58 114.79 1itf h ASN 156 Ca 0.00 0.00 0.17 0.00 1.87 0.00 0.00 56.30 58.34 1itf h ASN 156 Cb 0.50 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 39.07 1itf h ASN 156 CO 0.00 0.10 0.44 -0.07 -0.37 0.00 0.00 177.43 177.53 1itf h LEU 157 N 0.00 0.08 -0.58 0.34 -0.00 -1.68 0.57 115.31 114.04 1itf h LEU 157 Ca -0.00 0.00 0.06 0.00 -0.00 0.00 0.00 57.88 57.94 1itf h LEU 157 Cb 0.37 -0.01 -0.05 0.00 -0.00 0.00 0.00 40.66 40.97 1itf h LEU 157 CO 0.01 0.04 0.30 -0.61 -0.00 0.00 0.00 178.44 178.18 1itf h GLN 158 N 0.08 0.55 0.00 1.13 4.15 -1.72 -3.28 115.11 116.02 1itf h GLN 158 Ca 0.30 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.69 1itf h GLN 158 Cb 1.07 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.64 1itf h GLN 158 CO -0.03 0.36 -0.06 1.49 -1.93 0.00 0.00 178.83 178.67 1itf h GLU 159 N 0.56 0.00 -0.13 1.69 4.81 -0.97 -3.47 114.58 117.08 1itf h GLU 159 Ca 0.26 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 1itf h GLU 159 Cb 0.18 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.56 1itf h GLU 159 CO -0.18 0.00 0.00 0.43 -0.73 0.00 0.00 179.01 178.53 1itf n SER 160 N -2.92 0.00 -4.67 1.04 7.64 0.17 -4.72 113.62 110.16 1itf n SER 160 Ca -0.01 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.45 1itf n SER 160 Cb 0.03 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.20 1itf n SER 160 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1itf s LEU 161 N -0.01 4.31 0.42 -3.43 1.43 -1.26 -4.87 118.68 115.26 1itf s LEU 161 Ca 0.00 2.17 0.10 0.00 -1.03 0.00 0.00 54.13 55.37 1itf s LEU 161 Cb 0.00 -3.54 0.92 0.00 0.03 0.00 0.00 46.19 43.59 1itf s LEU 161 CO 0.00 -0.86 2.02 -0.09 0.23 0.00 0.00 176.35 177.66 1itf h ARG 162 N 8.86 0.50 -5.96 1.70 2.43 -1.98 -3.34 114.38 116.58 1itf h ARG 162 Ca -0.38 -0.03 -0.45 0.00 -0.81 0.00 0.00 59.98 58.31 1itf h ARG 162 Cb 1.17 -0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 30.54 1itf h ARG 162 CO 0.94 0.33 1.11 0.45 -1.51 0.00 0.00 179.97 181.29 1itf s SER 163 N -6.48 5.69 -0.57 -3.80 0.15 -1.26 -4.79 113.70 102.64 1itf s SER 163 Ca -0.08 -0.67 0.02 0.00 0.70 0.00 0.00 55.95 55.92 1itf s SER 163 Cb 0.18 -2.56 0.43 0.00 -1.71 0.00 0.00 66.02 62.36 1itf s SER 163 CO 0.74 -2.20 1.64 2.29 1.20 0.00 0.00 173.24 176.91 1itf n LYS 164 N 9.00 3.09 0.00 5.44 2.85 -1.26 -5.21 118.16 132.07 1itf n LYS 164 Ca 0.29 -3.80 0.14 0.00 -1.05 0.00 0.00 58.31 53.89 1itf n LYS 164 Cb 0.49 -2.28 0.44 0.00 -0.65 0.00 0.00 35.03 33.03 1itf n LYS 164 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44