#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nsf s THR 2 N 0.00 4.22 0.35 2.03 -1.32 -1.26 -5.07 115.64 114.59 2nsf s THR 2 Ca 0.00 0.89 0.06 0.00 -1.21 0.00 0.00 61.69 61.43 2nsf s THR 2 Cb 0.00 -3.57 -0.01 0.00 -1.51 0.00 0.00 72.50 67.42 2nsf s THR 2 CO 0.00 -0.78 0.49 0.42 -2.21 0.00 0.00 174.62 172.54 2nsf s THR 3 N -2.81 3.94 0.27 5.08 -4.23 -1.26 -4.84 115.64 111.78 2nsf s THR 3 Ca 0.59 -0.97 0.00 0.00 -1.18 0.00 0.00 61.69 60.14 2nsf s THR 3 Cb -0.13 -3.36 0.27 0.00 1.34 0.00 0.00 72.50 70.61 2nsf s THR 3 CO 0.44 -0.15 1.81 0.15 -0.54 0.00 0.00 174.62 176.33 2nsf h PHE 4 N 0.83 1.01 0.00 3.99 3.57 -1.96 -1.97 116.94 122.42 2nsf h PHE 4 Ca -0.45 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.06 2nsf h PHE 4 Cb 1.26 -0.31 -0.00 0.00 2.79 0.00 0.00 35.95 39.68 2nsf h PHE 4 CO 0.42 0.35 -0.10 0.45 -2.23 0.00 0.00 178.31 177.21 2nsf h HIS 5 N 0.86 0.00 0.00 0.41 3.86 -1.95 -2.24 115.15 116.09 2nsf h HIS 5 Ca 0.49 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.70 2nsf h HIS 5 Cb 0.56 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.03 2nsf h HIS 5 CO -0.03 0.10 -0.02 -0.25 0.86 0.00 0.00 177.93 178.58 2nsf n ASP 6 N -4.39 0.48 -4.78 2.45 8.00 -0.74 -4.88 116.55 112.69 2nsf n ASP 6 Ca -0.03 0.52 -0.34 0.00 0.71 0.00 0.00 54.79 55.65 2nsf n ASP 6 Cb 0.17 -0.64 0.00 0.00 -0.02 0.00 0.00 41.12 40.64 2nsf n ASP 6 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2nsf s LEU 7 N -3.88 3.69 0.60 0.64 1.43 -0.85 -4.99 118.68 115.32 2nsf s LEU 7 Ca 0.12 2.07 -0.19 0.00 -1.03 0.00 0.00 54.13 55.11 2nsf s LEU 7 Cb 0.15 -4.57 -0.03 0.00 0.03 0.00 0.00 46.19 41.77 2nsf s LEU 7 CO 0.57 -1.20 1.21 -2.84 0.23 0.00 0.00 176.35 174.32 2nsf s PRO 8 N -3.47 2.96 0.25 1.29 0.02 -1.26 -4.80 135.00 129.99 2nsf s PRO 8 Ca 0.70 1.82 -0.04 0.00 0.02 0.00 0.00 61.00 63.50 2nsf s PRO 8 Cb -0.21 -1.93 0.49 0.00 0.02 0.00 0.00 34.50 32.87 2nsf s PRO 8 CO 0.29 -1.21 1.67 -0.07 -0.33 0.00 0.00 177.00 177.34 2nsf h LEU 9 N 0.86 -0.06 -1.10 -5.54 3.38 -1.96 -1.10 115.31 109.79 2nsf h LEU 9 Ca -0.50 0.16 0.04 0.00 0.09 0.00 0.00 57.88 57.67 2nsf h LEU 9 Cb 1.30 0.24 -0.06 0.00 0.09 0.00 0.00 40.66 42.23 2nsf h LEU 9 CO 0.55 -0.08 0.61 -0.33 0.09 0.00 0.00 178.44 179.28 2nsf h GLU 10 N 0.22 1.11 -0.04 1.13 4.39 -1.99 -0.29 114.58 119.11 2nsf h GLU 10 Ca 0.43 -0.07 -0.13 0.00 0.34 0.00 0.00 59.36 59.94 2nsf h GLU 10 Cb 0.77 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 2nsf h GLU 10 CO -0.56 0.73 -0.57 0.93 -1.16 0.00 0.00 179.01 178.39 2nsf h GLU 11 N 1.14 0.12 -0.17 2.33 5.08 -1.58 -1.50 114.58 120.01 2nsf h GLU 11 Ca 0.38 -0.08 -0.17 0.00 -1.00 0.00 0.00 59.36 58.49 2nsf h GLU 11 Cb 0.07 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 2nsf h GLU 11 CO -0.13 0.66 -0.60 0.00 -1.00 0.00 0.00 179.01 177.94 2nsf h ARG 12 N 0.09 0.58 -0.55 2.33 3.08 -0.69 -1.88 114.38 117.34 2nsf h ARG 12 Ca -0.00 -0.39 -0.10 0.00 0.07 0.00 0.00 59.98 59.56 2nsf h ARG 12 Cb 1.03 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 31.11 2nsf h ARG 12 CO 0.08 1.01 -0.04 1.25 -1.07 0.00 0.00 179.97 181.19 2nsf h LEU 13 N 0.43 0.98 -0.61 3.04 5.85 -0.90 -1.85 115.31 122.25 2nsf h LEU 13 Ca -0.00 -0.33 -0.01 0.00 0.84 0.00 0.00 57.88 58.38 2nsf h LEU 13 Cb 1.16 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.90 2nsf h LEU 13 CO 0.11 1.07 0.32 0.74 -0.34 0.00 0.00 178.44 180.35 2nsf h THR 14 N 0.87 1.20 -0.57 1.05 2.02 -1.15 -0.53 112.91 115.80 2nsf h THR 14 Ca 0.15 -0.53 -0.05 0.00 0.77 0.00 0.00 66.41 66.75 2nsf h THR 14 Cb 0.59 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 67.41 2nsf h THR 14 CO 0.04 0.22 0.16 -0.07 0.37 0.00 0.00 175.52 176.24 2nsf h LEU 15 N 0.83 0.81 -0.41 2.58 3.38 -1.13 0.27 115.31 121.64 2nsf h LEU 15 Ca 0.21 -0.14 -0.13 0.00 0.09 0.00 0.00 57.88 57.92 2nsf h LEU 15 Cb 0.06 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2nsf h LEU 15 CO -0.03 0.78 -0.25 0.00 0.09 0.00 0.00 178.44 179.02 2nsf h ALA 16 N 1.33 0.58 -0.46 1.53 0.00 -0.93 -0.98 119.26 120.34 2nsf h ALA 16 Ca 0.19 -0.40 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 2nsf h ALA 16 Cb 0.27 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2nsf h ALA 16 CO -0.01 0.58 -0.06 0.00 0.00 0.00 0.00 179.25 179.77 2nsf h ARG 17 N 0.71 0.84 -0.63 0.00 3.08 -0.71 -1.37 114.38 116.31 2nsf h ARG 17 Ca 0.08 -0.30 -0.02 0.00 0.07 0.00 0.00 59.98 59.81 2nsf h ARG 17 Cb 0.83 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.79 2nsf h ARG 17 CO 0.07 0.93 0.30 -0.07 -1.07 0.00 0.00 179.97 180.13 2nsf h LEU 18 N 0.68 0.83 -0.99 3.04 3.38 -0.39 -1.06 115.31 120.81 2nsf h LEU 18 Ca 0.12 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 2nsf h LEU 18 Cb 0.58 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2nsf h LEU 18 CO 0.03 0.73 0.03 1.23 0.09 0.00 0.00 178.44 180.55 2nsf h GLY 19 N 0.87 0.82 0.98 0.83 0.00 -1.04 -0.82 103.07 104.71 2nsf h GLY 19 Ca 0.22 -0.52 -0.09 0.00 0.00 0.00 0.00 47.33 46.94 2nsf h GLY 19 CO -0.03 0.48 -0.11 -0.84 0.00 0.00 0.00 176.54 176.05 2nsf h THR 20 N 0.72 1.28 -0.41 4.70 2.02 -0.83 0.29 112.91 120.67 2nsf h THR 20 Ca 0.15 -1.20 -0.07 0.00 0.77 0.00 0.00 66.41 66.05 2nsf h THR 20 Cb 0.40 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 68.02 2nsf h THR 20 CO 0.01 0.40 -0.04 0.28 0.37 0.00 0.00 175.52 176.55 2nsf h SER 21 N 0.59 0.66 -0.22 4.18 0.02 -0.95 0.10 113.55 117.93 2nsf h SER 21 Ca 0.10 -0.16 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 2nsf h SER 21 Cb 0.64 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 2nsf h SER 21 CO 0.04 0.75 0.06 -0.74 -1.14 0.00 0.00 176.83 175.80 2nsf h HIS 22 N 0.64 0.37 -0.35 3.45 6.17 -0.88 -1.00 115.15 123.54 2nsf h HIS 22 Ca 0.12 -0.04 -0.01 0.00 0.71 0.00 0.00 60.37 61.16 2nsf h HIS 22 Cb 0.46 -0.10 -0.02 0.00 2.52 0.00 0.00 27.41 30.27 2nsf h HIS 22 CO 0.02 0.45 0.20 -0.92 0.71 0.00 0.00 177.93 178.39 2nsf h TYR 23 N 0.18 0.48 -0.43 5.26 3.20 -0.59 -2.72 116.97 122.34 2nsf h TYR 23 Ca 0.07 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.92 2nsf h TYR 23 Cb 0.26 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.36 2nsf h TYR 23 CO 0.01 0.37 0.23 0.77 -1.64 0.00 0.00 178.16 177.90 2nsf h SER 24 N 0.45 0.52 -0.46 -2.11 0.02 -0.61 -1.04 113.55 110.33 2nsf h SER 24 Ca 0.12 -0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 60.98 2nsf h SER 24 Cb 0.04 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 2nsf h SER 24 CO -0.02 0.43 0.07 0.03 -1.14 0.00 0.00 176.83 176.19 2nsf h ARG 25 N 0.60 0.83 -0.35 3.45 3.08 -0.89 -0.71 114.38 120.39 2nsf h ARG 25 Ca 0.16 -0.20 -0.15 0.00 0.07 0.00 0.00 59.98 59.86 2nsf h ARG 25 Cb 0.02 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2nsf h ARG 25 CO -0.03 0.79 -0.38 1.96 -1.07 0.00 0.00 179.97 181.25 2nsf h GLN 26 N 0.79 0.83 -0.57 0.04 1.08 -0.97 -2.48 115.11 113.83 2nsf h GLN 26 Ca 0.16 -0.43 -0.08 0.00 -1.45 0.00 0.00 58.65 56.86 2nsf h GLN 26 Cb 0.38 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.79 2nsf h GLN 26 CO 0.01 1.06 0.06 1.25 -0.95 0.00 0.00 178.83 180.26 2nsf h LEU 27 N 0.68 0.90 -1.48 1.46 5.85 -0.93 -2.24 115.31 119.56 2nsf h LEU 27 Ca 0.06 -0.22 -0.04 0.00 0.84 0.00 0.00 57.88 58.53 2nsf h LEU 27 Cb 0.94 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 2nsf h LEU 27 CO 0.09 0.93 -0.05 -1.28 -0.34 0.00 0.00 178.44 177.79 2nsf h SER 28 N 0.88 0.25 0.58 1.25 0.87 -0.95 -2.38 113.55 114.06 2nsf h SER 28 Ca 0.17 -0.04 -0.14 0.00 -1.23 0.00 0.00 61.79 60.56 2nsf h SER 28 Cb 0.44 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.32 2nsf h SER 28 CO 0.02 0.35 -0.63 -0.07 -0.53 0.00 0.00 176.83 175.97 2nsf h LEU 29 N 0.27 0.05 -9.68 2.23 3.38 -0.95 -3.43 115.31 107.18 2nsf h LEU 29 Ca 0.06 -0.03 -0.52 0.00 0.09 0.00 0.00 57.88 57.48 2nsf h LEU 29 Cb 0.27 -0.02 0.02 0.00 0.09 0.00 0.00 40.66 41.02 2nsf h LEU 29 CO 0.01 0.67 0.55 -0.69 0.09 0.00 0.00 178.44 179.07 2nsf s VAL 30 N -3.61 3.56 0.34 1.22 1.01 -0.90 -5.02 120.40 117.01 2nsf s VAL 30 Ca -0.02 1.34 -0.13 0.00 0.00 0.00 0.00 61.98 63.17 2nsf s VAL 30 Cb 0.12 -3.86 -0.08 0.00 0.00 0.00 0.00 36.38 32.57 2nsf s VAL 30 CO 0.77 0.23 0.74 -1.81 0.00 0.00 0.00 175.10 175.03 2nsf s ASP 31 N 0.02 6.68 0.34 3.32 1.01 -1.26 -4.97 116.67 121.81 2nsf s ASP 31 Ca 0.52 1.21 0.08 0.00 0.71 0.00 0.00 52.55 55.07 2nsf s ASP 31 Cb -0.32 -2.35 0.77 0.00 1.01 0.00 0.00 42.92 42.03 2nsf s ASP 31 CO 0.37 -0.26 1.85 0.78 0.21 0.00 0.00 175.17 178.12 2nsf h ASN 32 N 1.94 0.71 0.56 0.27 4.21 -1.95 0.20 115.58 121.53 2nsf h ASN 32 Ca -0.48 0.05 0.00 0.00 1.21 0.00 0.00 56.30 57.08 2nsf h ASN 32 Cb 1.18 -0.09 0.00 0.00 -1.12 0.00 0.00 38.32 38.29 2nsf h ASN 32 CO 0.65 0.35 0.00 0.00 -1.29 0.00 0.00 177.43 177.14 2nsf n ALA 33 N -2.41 1.55 1.08 -0.83 0.00 -1.26 -2.32 120.51 116.31 2nsf n ALA 33 Ca 0.18 0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.82 2nsf n ALA 33 Cb 0.47 -1.34 0.14 0.00 0.00 0.00 0.00 19.45 18.72 2nsf n ALA 33 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2nsf n GLU 34 N -2.10 0.76 -0.16 0.00 1.02 0.71 -4.31 120.64 116.57 2nsf n GLU 34 Ca 0.02 -0.56 0.01 0.00 -0.02 0.00 0.00 57.16 56.61 2nsf n GLU 34 Cb 0.18 -1.49 0.29 0.00 -0.02 0.00 0.00 31.44 30.41 2nsf n GLU 34 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 2nsf h PHE 35 N 1.38 0.83 0.00 -0.32 -1.00 -1.42 -2.20 116.94 114.20 2nsf h PHE 35 Ca 0.00 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.80 2nsf h PHE 35 Cb 0.60 -0.28 0.00 0.00 3.61 0.00 0.00 35.95 39.89 2nsf h PHE 35 CO 0.00 0.52 0.00 0.41 -1.61 0.00 0.00 178.31 177.63 2nsf n GLY 36 N -1.43 -1.20 3.88 -1.45 0.00 -1.26 -1.52 105.19 102.21 2nsf n GLY 36 Ca 0.07 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 2nsf n GLY 36 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nsf s GLU 37 N -2.82 3.17 0.46 1.61 2.02 -0.83 -4.77 118.70 117.55 2nsf s GLU 37 Ca 0.16 0.49 -0.25 0.00 0.02 0.00 0.00 54.97 55.39 2nsf s GLU 37 Cb 0.15 -2.10 -0.08 0.00 0.10 0.00 0.00 34.13 32.21 2nsf s GLU 37 CO 0.40 -0.77 1.40 -1.01 0.02 0.00 0.00 175.26 175.30 2nsf s HIS 38 N -3.21 2.46 0.35 1.61 3.76 -1.26 -1.07 115.29 117.93 2nsf s HIS 38 Ca 0.56 1.30 -0.01 0.00 -0.15 0.00 0.00 55.06 56.76 2nsf s HIS 38 Cb -0.11 -3.87 0.07 0.00 1.11 0.00 0.00 32.58 29.78 2nsf s HIS 38 CO 0.51 -2.84 0.48 -1.13 -0.85 0.00 0.00 174.74 170.91 2nsf n SER 39 N -0.32 0.58 0.00 1.40 3.41 -0.01 -4.56 113.62 114.12 2nsf n SER 39 Ca 0.06 -1.51 0.15 0.00 -0.26 0.00 0.00 58.87 57.32 2nsf n SER 39 Cb 0.43 -0.31 0.84 0.00 -0.26 0.00 0.00 64.21 64.90 2nsf n SER 39 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2nsf n LEU 40 N 0.00 0.00 -4.57 1.04 4.77 -0.79 -4.65 117.00 112.80 2nsf n LEU 40 Ca 0.08 0.16 -0.39 0.00 -0.03 0.00 0.00 56.01 55.83 2nsf n LEU 40 Cb 0.27 -0.16 -0.11 0.00 -2.33 0.00 0.00 43.42 41.10 2nsf n LEU 40 CO 0.19 -0.00 -0.12 -0.76 -1.33 0.00 0.00 177.39 175.36 2nsf s LEU 41 N -2.31 4.16 0.16 2.23 1.43 -1.26 -5.04 118.68 118.04 2nsf s LEU 41 Ca 0.37 -0.09 -0.34 0.00 -1.03 0.00 0.00 54.13 53.04 2nsf s LEU 41 Cb 0.21 -2.17 -0.14 0.00 0.03 0.00 0.00 46.19 44.12 2nsf s LEU 41 CO 0.42 -0.12 1.48 1.21 0.23 0.00 0.00 176.35 179.57 2nsf n GLU 42 N 5.12 1.88 -0.23 1.70 2.13 -1.26 -1.65 120.64 128.33 2nsf n GLU 42 Ca -0.13 0.68 0.00 0.00 0.66 0.00 0.00 57.16 58.37 2nsf n GLU 42 Cb 0.51 -2.39 0.00 0.00 0.27 0.00 0.00 31.44 29.83 2nsf n GLU 42 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2nsf n GLY 43 N 2.98 1.56 3.15 8.31 0.00 -1.26 -5.02 105.19 114.90 2nsf n GLY 43 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 2nsf n GLY 43 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2nsf s TRP 44 N -2.88 2.46 0.85 1.61 0.52 -0.66 -5.08 118.94 115.77 2nsf s TRP 44 Ca 0.00 -1.18 -0.13 0.00 0.02 0.00 0.00 56.10 54.81 2nsf s TRP 44 Cb 0.00 -1.69 0.12 0.00 -1.15 0.00 0.00 33.47 30.75 2nsf s TRP 44 CO 0.00 -0.54 1.21 0.95 0.02 0.00 0.00 176.95 178.59 2nsf s THR 45 N 0.77 2.02 0.34 2.01 -4.23 -1.26 -0.83 115.64 114.46 2nsf s THR 45 Ca -0.09 -0.03 0.02 0.00 -1.18 0.00 0.00 61.69 60.40 2nsf s THR 45 Cb -0.16 -2.99 0.25 0.00 1.34 0.00 0.00 72.50 70.94 2nsf s THR 45 CO 0.00 0.00 1.99 0.03 -0.54 0.00 0.00 174.62 176.10 2nsf h ARG 46 N -1.21 0.84 -0.86 3.99 3.08 -0.53 -2.10 114.38 117.58 2nsf h ARG 46 Ca -0.45 -0.06 0.06 0.00 0.07 0.00 0.00 59.98 59.59 2nsf h ARG 46 Cb 1.30 -0.18 -0.06 0.00 0.08 0.00 0.00 29.97 31.10 2nsf h ARG 46 CO 0.56 0.58 0.54 0.77 -1.07 0.00 0.00 179.97 181.34 2nsf h SER 47 N 0.86 0.85 -0.34 7.04 0.02 -1.55 0.17 113.55 120.60 2nsf h SER 47 Ca 0.23 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.18 2nsf h SER 47 Cb -0.05 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.31 2nsf h SER 47 CO -0.04 0.55 0.17 0.45 -1.14 0.00 0.00 176.83 176.81 2nsf h HIS 48 N 0.98 0.48 -0.30 3.45 3.86 -1.68 -0.92 115.15 121.04 2nsf h HIS 48 Ca 0.37 -0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.54 2nsf h HIS 48 Cb 0.16 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 2nsf h HIS 48 CO -0.03 0.41 0.11 1.25 0.86 0.00 0.00 177.93 180.53 2nsf h LEU 49 N 0.41 0.42 -0.83 2.43 5.85 -1.06 -0.56 115.31 121.97 2nsf h LEU 49 Ca 0.12 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 2nsf h LEU 49 Cb 0.10 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 2nsf h LEU 49 CO -0.02 0.49 0.47 0.40 -0.34 0.00 0.00 178.44 179.44 2nsf h ILE 50 N 0.32 1.24 -0.23 4.05 2.04 -0.59 -1.44 117.51 122.91 2nsf h ILE 50 Ca 0.10 -0.58 -0.02 0.00 1.00 0.00 0.00 64.86 65.36 2nsf h ILE 50 Cb 0.21 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 2nsf h ILE 50 CO -0.01 0.26 0.06 0.00 0.00 0.00 0.00 178.15 178.47 2nsf h ALA 51 N 1.25 0.30 -0.57 1.87 0.00 -1.00 -2.90 119.26 118.21 2nsf h ALA 51 Ca 0.29 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 55.14 2nsf h ALA 51 Cb 0.01 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.65 2nsf h ALA 51 CO -0.05 -0.06 0.21 1.25 0.00 0.00 0.00 179.25 180.60 2nsf h HIS 52 N 0.20 0.37 -0.87 0.00 -0.00 -0.66 -0.23 115.15 113.95 2nsf h HIS 52 Ca 0.07 0.03 0.02 0.00 -0.00 0.00 0.00 60.37 60.49 2nsf h HIS 52 Cb 0.25 -0.08 -0.05 0.00 -0.00 0.00 0.00 27.41 27.54 2nsf h HIS 52 CO 0.01 0.10 0.57 0.28 -0.00 0.00 0.00 177.93 178.90 2nsf h VAL 53 N 0.40 1.19 -0.19 5.26 2.07 -1.18 0.54 116.25 124.34 2nsf h VAL 53 Ca 0.28 -0.39 -0.08 0.00 0.82 0.00 0.00 66.70 67.34 2nsf h VAL 53 Cb 0.33 -0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.05 2nsf h VAL 53 CO -0.28 0.21 -0.19 0.00 0.02 0.00 0.00 177.57 177.33 2nsf h ALA 54 N 1.47 0.28 0.00 1.67 0.00 -1.11 -2.34 119.26 119.24 2nsf h ALA 54 Ca 0.33 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2nsf h ALA 54 Cb -0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2nsf h ALA 54 CO -0.09 0.20 -0.18 1.88 0.00 0.00 0.00 179.25 181.07 2nsf h TYR 55 N 0.14 0.00 -0.31 0.00 0.05 -0.62 -1.69 116.97 114.53 2nsf h TYR 55 Ca 0.03 0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.66 2nsf h TYR 55 Cb 0.73 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.47 2nsf h TYR 55 CO 0.08 0.18 -0.41 -0.97 -1.05 0.00 0.00 178.16 175.99 2nsf h ASN 56 N 0.00 0.89 -0.65 3.88 -0.73 -0.73 -0.36 115.58 117.88 2nsf h ASN 56 Ca -0.00 -0.50 0.02 0.00 1.87 0.00 0.00 56.30 57.68 2nsf h ASN 56 Cb 0.39 -0.25 -0.04 0.00 0.27 0.00 0.00 38.32 38.69 2nsf h ASN 56 CO 0.02 1.22 0.42 0.00 -0.37 0.00 0.00 177.43 178.72 2nsf h ALA 57 N 0.70 0.83 -0.71 1.57 0.00 -0.79 -0.52 119.26 120.35 2nsf h ALA 57 Ca 0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2nsf h ALA 57 Cb 1.01 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2nsf h ALA 57 CO 0.10 0.22 0.32 0.82 0.00 0.00 0.00 179.25 180.70 2nsf h ILE 58 N 0.85 1.24 -0.56 0.00 2.04 -1.20 -1.57 117.51 118.31 2nsf h ILE 58 Ca 0.25 -0.71 -0.04 0.00 1.00 0.00 0.00 64.86 65.35 2nsf h ILE 58 Cb -0.05 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.39 2nsf h ILE 58 CO -0.07 0.29 0.18 0.00 0.00 0.00 0.00 178.15 178.55 2nsf h ALA 59 N 1.15 1.26 0.00 1.87 0.00 -0.29 -1.87 119.26 121.39 2nsf h ALA 59 Ca 0.24 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 2nsf h ALA 59 Cb 0.16 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2nsf h ALA 59 CO -0.03 0.53 -0.53 -0.07 0.00 0.00 0.00 179.25 179.15 2nsf h LEU 60 N 0.81 0.00 -0.87 0.00 3.38 -0.75 -2.60 115.31 115.28 2nsf h LEU 60 Ca 0.19 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.10 2nsf h LEU 60 Cb 0.23 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 2nsf h LEU 60 CO -0.01 0.53 0.20 0.00 0.09 0.00 0.00 178.44 179.24 2nsf h ASN 62 N 0.99 0.53 -0.47 0.00 2.35 -1.05 -0.05 115.58 117.89 2nsf h ASN 62 Ca 0.22 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.92 2nsf h ASN 62 Cb 0.30 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 2nsf h ASN 62 CO -0.01 0.38 0.13 -0.07 -1.65 0.00 0.00 177.43 176.21 2nsf h LEU 63 N 0.65 0.76 -0.84 1.61 3.38 -1.35 -0.19 115.31 119.32 2nsf h LEU 63 Ca 0.21 -0.13 -0.12 0.00 0.09 0.00 0.00 57.88 57.93 2nsf h LEU 63 Cb 0.01 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2nsf h LEU 63 CO -0.09 0.74 -0.48 0.24 0.09 0.00 0.00 178.44 178.95 2nsf h MET 64 N 0.78 0.24 -0.33 1.13 2.86 -0.67 -0.07 114.93 118.88 2nsf h MET 64 Ca 0.17 -0.13 -0.12 0.00 -2.06 0.00 0.00 59.70 57.56 2nsf h MET 64 Cb 0.29 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.95 2nsf h MET 64 CO -0.00 0.67 -0.27 1.25 1.06 0.00 0.00 176.91 179.62 2nsf h HIS 65 N 0.19 0.90 -0.50 -0.22 -0.00 -0.41 -0.46 115.15 114.66 2nsf h HIS 65 Ca 0.01 -0.25 0.03 0.00 -0.00 0.00 0.00 60.37 60.16 2nsf h HIS 65 Cb 0.92 -0.19 -0.04 0.00 -0.00 0.00 0.00 27.41 28.10 2nsf h HIS 65 CO 0.02 1.01 0.28 2.35 -0.00 0.00 0.00 177.93 181.59 2nsf h TRP 66 N 0.52 0.53 -0.39 5.26 2.91 -0.83 0.16 115.95 124.11 2nsf h TRP 66 Ca 0.06 0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.08 2nsf h TRP 66 Cb 0.83 -0.16 -0.02 0.00 -0.51 0.00 0.00 29.16 29.30 2nsf h TRP 66 CO 0.07 0.29 0.17 0.00 -1.03 0.00 0.00 178.44 177.93 2nsf h ALA 67 N 1.24 0.51 0.00 2.65 0.00 -0.77 0.44 119.26 123.33 2nsf h ALA 67 Ca 0.21 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 2nsf h ALA 67 Cb 0.05 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2nsf h ALA 67 CO -0.11 0.10 -0.39 -0.91 0.00 0.00 0.00 179.25 177.94 2nsf h ASN 68 N 0.49 0.00 0.00 0.00 4.21 -0.82 -3.33 115.58 116.13 2nsf h ASN 68 Ca 0.13 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.64 2nsf h ASN 68 Cb 0.17 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.37 2nsf h ASN 68 CO -0.01 0.39 -1.57 0.35 -1.29 0.00 0.00 177.43 175.30 2nsf n THR 69 N -3.27 0.00 -0.95 2.81 -2.24 0.02 -4.98 114.28 105.67 2nsf n THR 69 Ca 0.02 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2nsf n THR 69 Cb 0.64 0.26 0.00 0.00 -2.10 0.00 0.00 70.33 69.13 2nsf n THR 69 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2nsf n GLY 70 N 1.60 0.87 3.54 3.38 0.00 0.16 -5.00 105.19 109.73 2nsf n GLY 70 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 2nsf n GLY 70 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nsf s GLU 71 N -0.05 3.57 -0.25 1.61 2.02 -1.18 -5.00 118.70 119.42 2nsf s GLU 71 Ca 0.00 -0.59 -0.39 0.00 0.02 0.00 0.00 54.97 54.01 2nsf s GLU 71 Cb 0.00 -3.78 -0.15 0.00 0.10 0.00 0.00 34.13 30.30 2nsf s GLU 71 CO 0.00 -0.40 1.79 -1.91 0.02 0.00 0.00 175.26 174.76 2nsf n GLU 72 N 5.10 1.35 -3.49 1.61 2.13 -1.26 -4.10 120.64 121.97 2nsf n GLU 72 Ca -0.13 0.49 -0.29 0.00 0.66 0.00 0.00 57.16 57.90 2nsf n GLU 72 Cb 0.50 -2.22 -0.13 0.00 0.27 0.00 0.00 31.44 29.86 2nsf n GLU 72 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 2nsf s THR 73 N 3.78 0.03 0.88 6.31 2.01 -1.26 -5.01 115.64 122.37 2nsf s THR 73 Ca 0.98 -1.26 -0.12 0.00 0.31 0.00 0.00 61.69 61.61 2nsf s THR 73 Cb -1.00 -1.04 0.11 0.00 0.01 0.00 0.00 72.50 70.58 2nsf s THR 73 CO 0.63 -0.86 1.09 -0.81 -0.69 0.00 0.00 174.62 173.97 2nsf n PRO 74 N 4.60 -0.21 -0.07 4.92 -0.04 -1.26 -3.91 135.00 139.04 2nsf n PRO 74 Ca 0.04 0.01 -0.07 0.00 -0.04 0.00 0.00 63.50 63.43 2nsf n PRO 74 Cb 0.39 -2.34 -0.01 0.00 -0.04 0.00 0.00 33.50 31.51 2nsf n PRO 74 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 2nsf h MET 75 N -1.50 0.06 -5.41 0.54 2.86 -1.81 -3.44 114.93 106.24 2nsf h MET 75 Ca -0.44 -0.00 -0.42 0.00 -2.06 0.00 0.00 59.70 56.78 2nsf h MET 75 Cb 1.28 -0.01 -0.20 0.00 0.06 0.00 0.00 31.60 32.73 2nsf h MET 75 CO 0.42 0.04 -0.77 0.71 1.06 0.00 0.00 176.91 178.37 2nsf s TYR 76 N -6.19 1.30 0.22 -0.22 2.02 -1.26 -4.40 117.35 108.82 2nsf s TYR 76 Ca -0.13 -0.49 -0.07 0.00 -0.37 0.00 0.00 57.07 56.00 2nsf s TYR 76 Cb 0.11 -0.71 0.19 0.00 -0.40 0.00 0.00 41.96 41.15 2nsf s TYR 76 CO 0.69 0.09 1.80 0.28 -1.57 0.00 0.00 175.55 176.85 2nsf h VAL 77 N 4.02 1.26 -2.17 0.71 2.07 -1.95 -3.46 116.25 116.72 2nsf h VAL 77 Ca -0.41 -0.78 0.17 0.00 0.82 0.00 0.00 66.70 66.51 2nsf h VAL 77 Cb 1.19 0.25 -0.12 0.00 -1.52 0.00 0.00 31.29 31.09 2nsf h VAL 77 CO 0.44 0.32 0.55 -0.94 0.02 0.00 0.00 177.57 177.96 2nsf s SER 78 N -6.34 -0.23 0.24 0.57 1.04 -1.26 -4.99 113.70 102.73 2nsf s SER 78 Ca -0.12 -0.20 -0.07 0.00 0.48 0.00 0.00 55.95 56.04 2nsf s SER 78 Cb 0.16 0.39 0.23 0.00 0.10 0.00 0.00 66.02 66.90 2nsf s SER 78 CO 0.84 -0.69 1.88 -0.65 0.98 0.00 0.00 173.24 175.59 2nsf h PRO 79 N 2.00 1.28 -0.34 4.02 0.11 -2.00 -1.28 132.00 135.80 2nsf h PRO 79 Ca -0.23 -0.12 -0.01 0.00 0.11 0.00 0.00 66.00 65.75 2nsf h PRO 79 Cb 1.23 -0.27 -0.02 0.00 0.11 0.00 0.00 31.00 32.06 2nsf h PRO 79 CO 0.28 0.90 0.19 0.93 -0.21 0.00 0.00 178.00 180.09 2nsf h GLU 80 N 1.30 0.48 -0.74 1.05 3.07 -1.99 -1.71 114.58 116.04 2nsf h GLU 80 Ca 0.34 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.36 59.12 2nsf h GLU 80 Cb -0.04 -0.10 -0.03 0.00 -0.84 0.00 0.00 28.75 27.74 2nsf h GLU 80 CO -0.06 0.39 0.36 0.00 -1.40 0.00 0.00 179.01 178.30 2nsf h ALA 81 N 1.06 1.25 -0.16 3.43 0.00 -1.83 0.16 119.26 123.17 2nsf h ALA 81 Ca 0.12 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2nsf h ALA 81 Cb 0.05 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2nsf h ALA 81 CO -0.02 0.58 0.08 -0.09 0.00 0.00 0.00 179.25 179.80 2nsf h ARG 82 N 1.04 0.23 -0.41 0.00 2.43 -0.91 -1.27 114.38 115.49 2nsf h ARG 82 Ca 0.26 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.32 2nsf h ARG 82 Cb 0.09 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 2nsf h ARG 82 CO -0.03 0.27 -0.02 -0.91 -1.51 0.00 0.00 179.97 177.76 2nsf h ASN 83 N 0.14 0.72 -0.43 -3.80 2.35 -0.92 -2.76 115.58 110.88 2nsf h ASN 83 Ca 0.06 -0.32 -0.04 0.00 -0.55 0.00 0.00 56.30 55.45 2nsf h ASN 83 Cb 0.11 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 2nsf h ASN 83 CO -0.01 0.87 0.14 -0.33 -1.65 0.00 0.00 177.43 176.45 2nsf h GLU 84 N 0.56 0.74 -0.04 0.81 5.08 -0.58 -1.10 114.58 120.05 2nsf h GLU 84 Ca 0.11 -0.13 -0.18 0.00 -1.00 0.00 0.00 59.36 58.16 2nsf h GLU 84 Cb 0.51 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 2nsf h GLU 84 CO 0.02 0.65 -0.77 1.05 -1.00 0.00 0.00 179.01 178.96 2nsf h GLU 85 N 0.72 0.28 -0.60 2.33 4.11 -1.19 -1.60 114.58 118.63 2nsf h GLU 85 Ca 0.17 -0.26 -0.08 0.00 0.07 0.00 0.00 59.36 59.26 2nsf h GLU 85 Cb 0.23 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 2nsf h GLU 85 CO -0.01 0.93 0.08 0.82 0.07 0.00 0.00 179.01 180.89 2nsf h ILE 86 N 0.18 1.26 -0.52 -1.06 2.04 -1.17 0.14 117.51 118.38 2nsf h ILE 86 Ca -0.03 -1.02 -0.01 0.00 1.00 0.00 0.00 64.86 64.80 2nsf h ILE 86 Cb 1.36 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 38.12 2nsf h ILE 86 CO 0.12 0.38 0.29 0.00 0.00 0.00 0.00 178.15 178.94 2nsf h ALA 87 N 1.14 0.67 0.21 1.87 0.00 -1.01 -1.33 119.26 120.80 2nsf h ALA 87 Ca 0.18 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2nsf h ALA 87 Cb 0.44 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2nsf h ALA 87 CO 0.01 0.18 -0.10 -0.92 0.00 0.00 0.00 179.25 178.43 2nsf h TYR 88 N 0.70 -0.26 -0.85 0.00 3.20 -0.85 -3.08 116.97 115.83 2nsf h TYR 88 Ca 0.19 -0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.18 2nsf h TYR 88 Cb 0.04 0.09 -0.06 0.00 1.54 0.00 0.00 36.73 38.33 2nsf h TYR 88 CO -0.02 0.01 0.55 0.78 -1.64 0.00 0.00 178.16 177.85 2nsf h GLY 89 N -0.51 1.12 2.00 1.82 0.00 -0.63 -0.85 103.07 106.01 2nsf h GLY 89 Ca -0.03 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.01 2nsf h GLY 89 CO 0.05 0.11 0.00 1.48 0.00 0.00 0.00 176.54 178.18 2nsf h SER 90 N 0.68 0.00 0.83 0.19 4.64 -1.14 -2.04 113.55 116.70 2nsf h SER 90 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 2nsf h SER 90 Cb 0.66 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 2nsf h SER 90 CO -0.18 0.00 -0.84 0.35 -0.87 0.00 0.00 176.83 175.29 2nsf n THR 91 N -2.60 0.41 -1.45 2.95 -2.24 -0.33 -4.73 114.28 106.30 2nsf n THR 91 Ca -0.01 -0.37 -0.34 0.00 -2.27 0.00 0.00 64.05 61.07 2nsf n THR 91 Cb 0.12 -0.14 0.09 0.00 -2.10 0.00 0.00 70.33 68.30 2nsf n THR 91 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2nsf s LEU 92 N -4.57 3.30 0.60 3.22 1.43 -0.77 -4.98 118.68 116.92 2nsf s LEU 92 Ca 0.03 2.29 -0.17 0.00 -1.03 0.00 0.00 54.13 55.25 2nsf s LEU 92 Cb 0.12 -4.58 -0.03 0.00 0.03 0.00 0.00 46.19 41.73 2nsf s LEU 92 CO 0.76 -2.20 1.13 0.54 0.23 0.00 0.00 176.35 176.80 2nsf s ASN 93 N -2.15 5.37 0.22 2.29 4.22 -1.26 -4.83 114.94 118.80 2nsf s ASN 93 Ca 0.73 2.11 -0.12 0.00 -2.14 0.00 0.00 52.86 53.44 2nsf s ASN 93 Cb -0.27 -2.57 0.28 0.00 1.28 0.00 0.00 41.25 39.97 2nsf s ASN 93 CO 0.45 -1.46 1.62 -0.65 -2.04 0.00 0.00 177.10 175.03 2nsf h PRO 94 N 0.61 0.01 -0.08 3.55 0.11 -1.93 -1.23 132.00 133.03 2nsf h PRO 94 Ca -0.48 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.57 2nsf h PRO 94 Cb 1.26 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 2nsf h PRO 94 CO 0.55 0.01 -0.20 -0.44 -0.21 0.00 0.00 178.00 177.72 2nsf h ASP 95 N 0.02 0.12 -0.37 -2.05 3.32 -1.97 -0.86 116.42 114.63 2nsf h ASP 95 Ca 0.33 -0.03 -0.12 0.00 0.02 0.00 0.00 57.03 57.24 2nsf h ASP 95 Cb 0.52 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.02 2nsf h ASP 95 CO -0.68 0.33 -0.19 0.00 -1.72 0.00 0.00 179.24 176.99 2nsf h ALA 96 N 1.68 0.84 -0.22 3.45 0.00 -1.61 -1.57 119.26 121.84 2nsf h ALA 96 Ca 0.02 -0.37 -0.16 0.00 0.00 0.00 0.00 54.91 54.41 2nsf h ALA 96 Cb 0.42 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2nsf h ALA 96 CO 0.03 0.64 -0.50 -0.07 0.00 0.00 0.00 179.25 179.35 2nsf h LEU 97 N 0.75 0.67 -0.88 0.00 3.38 -0.80 -1.21 115.31 117.23 2nsf h LEU 97 Ca 0.11 -0.34 -0.08 0.00 0.09 0.00 0.00 57.88 57.66 2nsf h LEU 97 Cb 0.72 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2nsf h LEU 97 CO 0.06 1.05 -0.06 0.03 0.09 0.00 0.00 178.44 179.60 2nsf h ARG 98 N 0.48 0.76 -0.35 1.13 3.08 -0.98 -0.83 114.38 117.67 2nsf h ARG 98 Ca 0.02 -0.23 -0.15 0.00 0.07 0.00 0.00 59.98 59.69 2nsf h ARG 98 Cb 1.05 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.01 2nsf h ARG 98 CO 0.10 0.82 -0.38 -0.91 -1.07 0.00 0.00 179.97 178.52 2nsf h ASN 99 N 0.70 0.90 -0.44 7.04 2.35 -1.07 -1.40 115.58 123.65 2nsf h ASN 99 Ca 0.13 -0.40 -0.04 0.00 -0.55 0.00 0.00 56.30 55.44 2nsf h ASN 99 Cb 0.52 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.62 2nsf h ASN 99 CO 0.03 1.17 0.14 0.25 -1.65 0.00 0.00 177.43 177.37 2nsf h LEU 100 N 0.69 0.64 0.20 1.61 5.85 -0.96 -0.20 115.31 123.15 2nsf h LEU 100 Ca 0.06 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.56 2nsf h LEU 100 Cb 0.95 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.81 2nsf h LEU 100 CO 0.09 0.68 -0.10 -0.74 -0.34 0.00 0.00 178.44 178.03 2nsf h HIS 101 N 0.57 -0.27 -0.46 1.25 2.76 -1.05 -0.10 115.15 117.85 2nsf h HIS 101 Ca 0.14 -0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.35 2nsf h HIS 101 Cb 0.27 0.09 -0.04 0.00 1.55 0.00 0.00 27.41 29.28 2nsf h HIS 101 CO 0.01 -0.17 0.22 1.49 -1.30 0.00 0.00 177.93 178.18 2nsf h GLU 102 N -0.28 0.42 -0.31 5.26 4.81 -1.09 -1.28 114.58 122.11 2nsf h GLU 102 Ca -0.02 -0.03 -0.13 0.00 -0.13 0.00 0.00 59.36 59.05 2nsf h GLU 102 Cb 0.22 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.50 2nsf h GLU 102 CO 0.04 0.28 -0.32 1.25 -0.73 0.00 0.00 179.01 179.52 2nsf h HIS 103 N 0.43 0.93 -0.51 0.92 2.76 -0.92 -2.00 115.15 116.76 2nsf h HIS 103 Ca 0.20 -0.28 -0.05 0.00 -2.20 0.00 0.00 60.37 58.04 2nsf h HIS 103 Cb 0.13 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 28.87 2nsf h HIS 103 CO -0.11 1.05 0.09 0.66 -1.30 0.00 0.00 177.93 178.32 2nsf h SER 104 N 0.53 0.74 -0.01 3.26 4.64 -0.87 -0.43 113.55 121.41 2nsf h SER 104 Ca 0.05 -0.14 -0.00 0.00 -0.47 0.00 0.00 61.79 61.23 2nsf h SER 104 Cb 0.90 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 62.80 2nsf h SER 104 CO 0.08 0.75 0.00 0.58 -0.87 0.00 0.00 176.83 177.37 2nsf h VAL 105 N 0.76 1.14 -0.95 0.95 2.07 -1.15 -2.11 116.25 116.96 2nsf h VAL 105 Ca 0.16 -0.43 0.02 0.00 0.82 0.00 0.00 66.70 67.27 2nsf h VAL 105 Cb 0.32 1.42 -0.05 0.00 -1.52 0.00 0.00 31.29 31.46 2nsf h VAL 105 CO 0.00 0.11 0.63 0.00 0.02 0.00 0.00 177.57 178.33 2nsf h ALA 106 N 0.83 1.22 -0.23 1.67 0.00 -0.99 -1.93 119.26 119.82 2nsf h ALA 106 Ca 0.00 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 2nsf h ALA 106 Cb 0.18 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2nsf h ALA 106 CO -0.00 0.58 -0.40 0.00 0.00 0.00 0.00 179.25 179.43 2nsf h ARG 107 N 1.27 0.53 -0.39 0.00 2.47 -1.00 -2.13 114.38 115.13 2nsf h ARG 107 Ca 0.36 -0.26 -0.15 0.00 -1.26 0.00 0.00 59.98 58.67 2nsf h ARG 107 Cb -0.12 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.20 2nsf h ARG 107 CO -0.09 0.84 -0.34 1.25 0.56 0.00 0.00 179.97 182.20 2nsf h LEU 108 N 0.44 0.93 -0.62 3.04 5.85 -1.08 -1.59 115.31 122.29 2nsf h LEU 108 Ca 0.04 -0.40 -0.04 0.00 0.84 0.00 0.00 57.88 58.32 2nsf h LEU 108 Cb 0.88 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 2nsf h LEU 108 CO 0.08 1.18 0.24 -0.78 -0.34 0.00 0.00 178.44 178.81 2nsf h ASP 109 N 0.74 0.87 -0.57 1.25 3.58 -1.21 -1.11 116.42 119.97 2nsf h ASP 109 Ca 0.07 -0.18 -0.01 0.00 0.42 0.00 0.00 57.03 57.33 2nsf h ASP 109 Cb 0.91 -0.23 -0.03 0.00 1.72 0.00 0.00 39.33 41.71 2nsf h ASP 109 CO 0.08 0.81 0.32 0.58 -2.88 0.00 0.00 179.24 178.15 2nsf h VAL 110 N 0.87 1.19 -0.62 2.25 2.07 -1.26 0.49 116.25 121.24 2nsf h VAL 110 Ca 0.21 -0.47 0.07 0.00 0.82 0.00 0.00 66.70 67.33 2nsf h VAL 110 Cb 0.22 0.45 -0.06 0.00 -1.52 0.00 0.00 31.29 30.38 2nsf h VAL 110 CO -0.01 0.20 0.30 0.00 0.02 0.00 0.00 177.57 178.07 2nsf h ALA 111 N 1.15 0.82 -0.30 1.67 0.00 -0.75 -0.72 119.26 121.12 2nsf h ALA 111 Ca 0.20 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.10 2nsf h ALA 111 Cb 0.04 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2nsf h ALA 111 CO -0.03 -0.07 -0.04 -1.49 0.00 0.00 0.00 179.25 177.62 2nsf h TRP 112 N 0.54 0.61 -0.30 0.00 6.55 -0.67 -2.80 115.95 119.88 2nsf h TRP 112 Ca 0.29 -0.12 -0.01 0.00 0.95 0.00 0.00 58.89 60.00 2nsf h TRP 112 Cb 0.26 -0.15 -0.02 0.00 -0.86 0.00 0.00 29.16 28.39 2nsf h TRP 112 CO -0.11 0.72 0.15 0.00 -1.05 0.00 0.00 178.44 178.14 2nsf h ARG 113 N 0.33 0.41 -0.34 0.49 3.08 -0.32 -2.48 114.38 115.55 2nsf h ARG 113 Ca 0.08 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2nsf h ARG 113 Cb 0.50 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.46 2nsf h ARG 113 CO 0.02 0.32 0.00 0.39 -1.07 0.00 0.00 179.97 179.63 2nsf n GLU 114 N -4.44 2.12 -2.49 0.04 1.02 -0.33 -4.93 120.64 111.64 2nsf n GLU 114 Ca 0.01 -1.71 -0.42 0.00 -0.02 0.00 0.00 57.16 55.03 2nsf n GLU 114 Cb 0.11 -1.44 -0.03 0.00 -0.02 0.00 0.00 31.44 30.06 2nsf n GLU 114 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2nsf s THR 115 N -1.56 4.08 0.67 2.62 2.01 -0.94 -5.02 115.64 117.50 2nsf s THR 115 Ca 0.35 1.58 -0.11 0.00 0.31 0.00 0.00 61.69 63.82 2nsf s THR 115 Cb 0.19 -4.01 -0.01 0.00 0.01 0.00 0.00 72.50 68.68 2nsf s THR 115 CO 0.27 0.17 1.05 -0.94 -0.69 0.00 0.00 174.62 174.49 2nsf s SER 116 N 0.66 5.58 0.15 3.53 1.04 -1.26 -4.93 113.70 118.48 2nsf s SER 116 Ca 0.55 1.60 -0.18 0.00 0.48 0.00 0.00 55.95 58.40 2nsf s SER 116 Cb -0.28 -2.50 0.06 0.00 0.10 0.00 0.00 66.02 63.40 2nsf s SER 116 CO 0.31 -1.31 1.68 -0.08 0.98 0.00 0.00 173.24 174.82 2nsf h GLU 117 N -0.50 0.00 -0.65 4.02 4.81 -2.01 -2.23 114.58 118.02 2nsf h GLU 117 Ca -0.44 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.73 2nsf h GLU 117 Cb 1.21 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.56 2nsf h GLU 117 CO 0.58 0.00 0.17 -0.44 -0.73 0.00 0.00 179.01 178.59 2nsf h ASP 118 N 0.00 0.95 -0.19 1.04 3.32 -2.00 -2.90 116.42 116.65 2nsf h ASP 118 Ca 0.16 -0.18 0.02 0.00 0.02 0.00 0.00 57.03 57.05 2nsf h ASP 118 Cb 0.25 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2nsf h ASP 118 CO -0.35 0.91 0.13 0.00 -1.72 0.00 0.00 179.24 178.21 2nsf h ALA 119 N 1.21 1.96 -0.07 3.45 0.00 -1.68 -2.13 119.26 122.01 2nsf h ALA 119 Ca 0.21 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.13 2nsf h ALA 119 Cb 0.32 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2nsf h ALA 119 CO -0.00 0.02 0.07 -1.49 0.00 0.00 0.00 179.25 177.85 2nsf h TRP 120 N 0.17 0.00 -0.26 0.00 4.06 -1.27 -1.57 115.95 117.08 2nsf h TRP 120 Ca 0.08 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.03 2nsf h TRP 120 Cb 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.25 2nsf h TRP 120 CO -0.00 0.00 0.00 -1.13 -3.56 0.00 0.00 178.44 173.75 2nsf n SER 121 N -3.97 3.09 -4.74 -3.49 3.41 -0.80 -1.38 113.62 105.73 2nsf n SER 121 Ca -0.01 -1.91 -0.41 0.00 -0.26 0.00 0.00 58.87 56.27 2nsf n SER 121 Cb 0.17 -0.16 -0.02 0.00 -0.26 0.00 0.00 64.21 63.94 2nsf n SER 121 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2nsf s HIS 122 N -1.44 2.98 0.10 7.33 5.04 -0.59 -4.58 115.29 124.14 2nsf s HIS 122 Ca 0.31 0.96 -0.30 0.00 -1.54 0.00 0.00 55.06 54.49 2nsf s HIS 122 Cb 0.19 -3.86 -0.06 0.00 0.04 0.00 0.00 32.58 28.89 2nsf s HIS 122 CO 0.27 -2.85 1.11 -1.21 -2.34 0.00 0.00 174.74 169.71 2nsf s GLU 123 N -0.29 4.54 0.24 2.88 2.02 -1.26 -0.22 118.70 126.61 2nsf s GLU 123 Ca 0.61 1.67 0.01 0.00 0.02 0.00 0.00 54.97 57.28 2nsf s GLU 123 Cb -0.43 -3.34 -0.05 0.00 0.10 0.00 0.00 34.13 30.42 2nsf s GLU 123 CO 0.43 -0.05 0.11 0.14 0.02 0.00 0.00 175.26 175.91 2nsf s VAL 124 N 0.43 0.35 -0.09 2.63 -7.23 0.72 -4.91 120.40 112.31 2nsf s VAL 124 Ca 0.53 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.72 2nsf s VAL 124 Cb -0.28 -2.58 -0.02 0.00 0.56 0.00 0.00 36.38 34.06 2nsf s VAL 124 CO 0.31 0.00 -0.14 -0.22 -0.31 0.00 0.00 175.10 174.75 2nsf s LEU 125 N -3.27 2.72 0.73 1.32 2.96 -1.26 -1.32 118.68 120.57 2nsf s LEU 125 Ca 0.38 -0.26 -0.09 0.00 -0.22 0.00 0.00 54.13 53.94 2nsf s LEU 125 Cb 0.07 -1.58 0.06 0.00 0.50 0.00 0.00 46.19 45.24 2nsf s LEU 125 CO 0.13 0.26 1.07 0.42 -1.32 0.00 0.00 176.35 176.92 2nsf s THR 126 N -0.23 2.49 0.39 3.68 -4.23 -0.11 -4.59 115.64 113.04 2nsf s THR 126 Ca 0.01 -0.04 0.33 0.00 -1.18 0.00 0.00 61.69 60.81 2nsf s THR 126 Cb -0.13 -3.11 0.36 0.00 1.34 0.00 0.00 72.50 70.95 2nsf s THR 126 CO 0.03 -0.14 2.12 0.00 -0.54 0.00 0.00 174.62 176.09 2nsf h ALA 127 N -0.73 1.13 -0.19 3.99 0.00 -2.00 -1.47 119.26 120.00 2nsf h ALA 127 Ca -0.45 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2nsf h ALA 127 Cb 1.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2nsf h ALA 127 CO 0.63 0.07 0.00 1.04 0.00 0.00 0.00 179.25 180.99 2nsf n GLN 128 N -3.34 1.67 -0.64 0.00 1.13 -1.26 -4.92 117.38 110.02 2nsf n GLN 128 Ca -0.01 -1.01 0.00 0.00 -1.94 0.00 0.00 57.00 54.03 2nsf n GLN 128 Cb 0.22 -1.35 0.00 0.00 0.11 0.00 0.00 30.24 29.22 2nsf n GLN 128 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2nsf n GLY 129 N 1.07 0.67 3.79 1.08 0.00 -0.55 -5.05 105.19 106.20 2nsf n GLY 129 Ca 0.15 -0.09 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 2nsf n GLY 129 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2nsf s ARG 130 N -0.47 4.34 -0.42 1.61 0.52 -1.26 -4.81 118.95 118.46 2nsf s ARG 130 Ca 0.00 0.88 -0.18 0.00 -0.52 0.00 0.00 55.73 55.91 2nsf s ARG 130 Cb 0.00 -3.26 0.02 0.00 0.52 0.00 0.00 34.95 32.23 2nsf s ARG 130 CO 0.00 0.59 0.47 0.99 0.02 0.00 0.00 175.30 177.37 2nsf s THR 131 N -1.02 5.05 0.14 0.02 2.01 -1.26 -0.93 115.64 119.64 2nsf s THR 131 Ca 0.32 -0.22 0.01 0.00 0.31 0.00 0.00 61.69 62.10 2nsf s THR 131 Cb -0.21 -4.05 -0.04 0.00 0.01 0.00 0.00 72.50 68.21 2nsf s THR 131 CO 0.21 -0.42 -0.00 0.68 -0.69 0.00 0.00 174.62 174.40 2nsf s VAL 132 N 2.25 0.50 0.60 3.82 -7.23 -0.43 -4.95 120.40 114.95 2nsf s VAL 132 Ca 0.14 -1.94 -0.16 0.00 -1.81 0.00 0.00 61.98 58.22 2nsf s VAL 132 Cb -0.16 -1.97 -0.03 0.00 0.56 0.00 0.00 36.38 34.78 2nsf s VAL 132 CO 0.14 -0.59 1.06 -2.16 -0.31 0.00 0.00 175.10 173.24 2nsf s PRO 133 N -3.93 3.28 0.53 4.82 0.04 -1.26 -0.20 135.00 138.28 2nsf s PRO 133 Ca 0.20 1.21 0.26 0.00 0.04 0.00 0.00 61.00 62.70 2nsf s PRO 133 Cb 0.06 -2.03 1.40 0.00 0.04 0.00 0.00 34.50 33.97 2nsf s PRO 133 CO 0.01 -0.84 1.99 0.00 0.04 0.00 0.00 177.00 178.19 2nsf h ALA 134 N 0.38 2.52 0.00 8.56 0.00 -0.45 0.09 119.26 130.35 2nsf h ALA 134 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2nsf h ALA 134 Cb 1.22 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2nsf h ALA 134 CO 0.57 -0.68 0.10 0.66 0.00 0.00 0.00 179.25 179.91 2nsf h SER 135 N 0.01 0.00 -0.03 0.00 4.64 -1.51 -1.31 113.55 115.35 2nsf h SER 135 Ca 0.27 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.60 2nsf h SER 135 Cb 1.06 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.15 2nsf h SER 135 CO -0.01 0.00 0.05 -0.08 -0.87 0.00 0.00 176.83 175.93 2nsf h GLU 136 N 0.00 0.00 0.00 4.77 4.57 -1.27 -1.35 114.58 121.30 2nsf h GLU 136 Ca 0.00 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 2nsf h GLU 136 Cb 0.21 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.79 2nsf h GLU 136 CO 0.00 0.00 -0.09 1.79 -1.18 0.00 0.00 179.01 179.53 2nsf h THR 137 N 0.00 0.70 -0.54 0.32 1.35 -1.45 0.15 112.91 113.44 2nsf h THR 137 Ca 0.01 -0.35 -0.11 0.00 -0.55 0.00 0.00 66.41 65.41 2nsf h THR 137 Cb 0.12 1.21 -0.02 0.00 -1.73 0.00 0.00 68.15 67.74 2nsf h THR 137 CO -0.00 0.09 -0.10 -0.07 -0.25 0.00 0.00 175.52 175.19 2nsf h LEU 138 N 0.00 1.01 -0.08 3.87 3.38 -1.47 -0.13 115.31 121.89 2nsf h LEU 138 Ca -0.00 -0.35 -0.09 0.00 0.09 0.00 0.00 57.88 57.53 2nsf h LEU 138 Cb 0.21 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2nsf h LEU 138 CO 0.01 1.12 -0.30 -0.25 0.09 0.00 0.00 178.44 179.11 2nsf h TRP 139 N 0.88 0.46 -0.60 1.13 2.91 -1.38 -2.38 115.95 116.97 2nsf h TRP 139 Ca 0.14 -0.19 0.04 0.00 1.13 0.00 0.00 58.89 60.00 2nsf h TRP 139 Cb 0.66 -0.07 -0.04 0.00 -0.51 0.00 0.00 29.16 29.19 2nsf h TRP 139 CO 0.05 0.92 0.35 0.52 -1.03 0.00 0.00 178.44 179.25 2nsf h MET 140 N -0.14 0.66 -0.55 2.65 2.86 -0.69 -1.03 114.93 118.69 2nsf h MET 140 Ca -0.02 -0.04 -0.11 0.00 -2.06 0.00 0.00 59.70 57.47 2nsf h MET 140 Cb 0.94 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 32.44 2nsf h MET 140 CO 0.06 0.44 -0.09 -0.09 1.06 0.00 0.00 176.91 178.29 2nsf h ARG 141 N 0.68 1.02 -0.71 1.72 9.65 -1.07 -2.87 114.38 122.81 2nsf h ARG 141 Ca 0.25 -0.36 0.04 0.00 -1.10 0.00 0.00 59.98 58.80 2nsf h ARG 141 Cb 0.07 -0.07 -0.05 0.00 -1.39 0.00 0.00 29.97 28.54 2nsf h ARG 141 CO -0.13 1.05 0.44 0.77 2.80 0.00 0.00 179.97 184.90 2nsf h SER 142 N 0.91 0.71 -0.65 -3.80 0.02 -0.83 -0.84 113.55 109.07 2nsf h SER 142 Ca 0.15 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 61.15 2nsf h SER 142 Cb 0.65 -0.15 -0.05 0.00 0.14 0.00 0.00 62.40 62.99 2nsf h SER 142 CO 0.04 0.48 0.37 0.03 -1.14 0.00 0.00 176.83 176.62 2nsf h ARG 143 N 0.85 0.68 0.52 3.45 3.08 -1.04 -1.72 114.38 120.20 2nsf h ARG 143 Ca 0.29 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.27 2nsf h ARG 143 Cb 0.05 -0.15 0.01 0.00 0.08 0.00 0.00 29.97 29.95 2nsf h ARG 143 CO -0.12 0.45 -0.25 0.93 -1.07 0.00 0.00 179.97 179.91 2nsf h GLU 144 N 0.70 -0.68 -0.53 0.04 4.39 -1.13 -2.61 114.58 114.75 2nsf h GLU 144 Ca 0.28 0.05 -0.11 0.00 0.34 0.00 0.00 59.36 59.91 2nsf h GLU 144 Cb 0.13 0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 2nsf h GLU 144 CO -0.16 -0.38 -0.11 -0.39 -1.16 0.00 0.00 179.01 176.80 2nsf h VAL 145 N -0.89 1.27 -0.17 3.13 -1.51 -1.13 0.14 116.25 117.09 2nsf h VAL 145 Ca -0.07 -1.27 -0.16 0.00 -1.23 0.00 0.00 66.70 63.97 2nsf h VAL 145 Cb 0.61 0.97 -0.01 0.00 -2.13 0.00 0.00 31.29 30.73 2nsf h VAL 145 CO 0.12 0.45 -0.55 -0.50 -1.23 0.00 0.00 177.57 175.86 2nsf h TRP 146 N 0.90 0.65 0.10 5.19 4.06 -1.42 -2.50 115.95 122.93 2nsf h TRP 146 Ca 0.14 -0.23 -0.22 0.00 2.06 0.00 0.00 58.89 60.64 2nsf h TRP 146 Cb 0.68 -0.12 0.00 0.00 -1.00 0.00 0.00 29.16 28.71 2nsf h TRP 146 CO 0.04 0.95 -1.09 0.82 -3.56 0.00 0.00 178.44 175.60 2nsf h ILE 147 N 0.40 1.23 0.00 1.49 2.04 -1.45 -3.32 117.51 117.90 2nsf h ILE 147 Ca 0.01 -2.41 0.00 0.00 1.00 0.00 0.00 64.86 63.46 2nsf h ILE 147 Cb 1.08 2.87 0.00 0.00 -0.74 0.00 0.00 36.82 40.03 2nsf h ILE 147 CO 0.10 0.66 0.00 0.45 0.00 0.00 0.00 178.15 179.36 2nsf h HIS 148 N -0.46 0.00 -0.48 1.37 3.86 -0.81 -0.54 115.15 118.09 2nsf h HIS 148 Ca -0.23 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 58.92 2nsf h HIS 148 Cb 1.61 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 30.06 2nsf h HIS 148 CO 0.16 0.00 0.08 0.00 0.86 0.00 0.00 177.93 179.03 2nsf h ALA 149 N 2.11 1.24 -0.21 2.45 0.00 -1.54 -2.22 119.26 121.10 2nsf h ALA 149 Ca 0.00 -0.21 -0.15 0.00 0.00 0.00 0.00 54.91 54.55 2nsf h ALA 149 Cb 0.25 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2nsf h ALA 149 CO 0.00 0.52 -0.47 0.28 0.00 0.00 0.00 179.25 179.58 2nsf h VAL 150 N 0.72 1.31 0.00 0.00 2.07 -1.24 -3.18 116.25 115.93 2nsf h VAL 150 Ca 0.16 -1.69 -0.00 0.00 0.82 0.00 0.00 66.70 65.98 2nsf h VAL 150 Cb 0.32 1.85 -0.00 0.00 -1.52 0.00 0.00 31.29 31.94 2nsf h VAL 150 CO 0.00 0.53 -0.01 0.44 0.02 0.00 0.00 177.57 178.56 2nsf h ASP 151 N 0.39 0.00 0.17 0.57 3.32 -1.18 -1.95 116.42 117.74 2nsf h ASP 151 Ca -0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 2nsf h ASP 151 Cb 1.08 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.63 2nsf h ASP 151 CO 0.10 0.01 -0.03 -0.07 -1.72 0.00 0.00 179.24 177.53 2nsf h LEU 152 N 0.00 0.00 0.25 1.55 3.38 -1.39 -2.10 115.31 117.00 2nsf h LEU 152 Ca -0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 2nsf h LEU 152 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2nsf h LEU 152 CO 0.00 0.03 -0.12 0.61 0.09 0.00 0.00 178.44 179.06 2nsf n GLY 153 N -0.99 0.30 0.00 0.83 0.00 -0.73 -4.79 105.19 99.81 2nsf n GLY 153 Ca -0.02 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.34 2nsf n GLY 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nsf n ALA 154 N -1.63 0.00 -0.18 4.61 0.00 -1.26 -5.02 120.51 117.03 2nsf n ALA 154 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2nsf n ALA 154 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2nsf n ALA 154 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2nsf n VAL 155 N 0.00 0.00 -2.19 0.00 0.24 -1.26 -5.07 118.33 110.05 2nsf n VAL 155 Ca 0.00 -0.41 -0.36 0.00 -2.04 0.00 0.00 64.34 61.53 2nsf n VAL 155 Cb 0.00 1.18 0.00 0.00 -1.47 0.00 0.00 33.84 33.56 2nsf n VAL 155 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2nsf s ALA 156 N -0.01 2.81 0.24 2.33 0.00 -1.26 -5.05 121.76 120.82 2nsf s ALA 156 Ca 0.00 0.93 0.00 0.00 0.00 0.00 0.00 51.96 52.90 2nsf s ALA 156 Cb 0.00 -3.40 -0.05 0.00 0.00 0.00 0.00 23.12 19.68 2nsf s ALA 156 CO 0.00 -0.81 0.11 0.95 0.00 0.00 0.00 175.76 176.01 2nsf s THR 157 N -1.61 0.35 0.17 0.00 -4.23 -1.26 -4.60 115.64 104.46 2nsf s THR 157 Ca 0.69 -2.00 0.22 0.00 -1.18 0.00 0.00 61.69 59.42 2nsf s THR 157 Cb -0.28 -2.58 0.20 0.00 1.34 0.00 0.00 72.50 71.18 2nsf s THR 157 CO 0.33 -0.01 1.82 -0.26 -0.54 0.00 0.00 174.62 175.95 2nsf h PHE 158 N 2.48 0.00 0.00 3.99 0.04 -1.93 -2.42 116.94 119.10 2nsf h PHE 158 Ca -0.37 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.38 2nsf h PHE 158 Cb 1.25 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.40 2nsf h PHE 158 CO 0.42 0.27 -0.07 0.78 -0.60 0.00 0.00 178.31 179.10 2nsf h GLY 159 N 1.94 0.00 2.00 -1.45 0.00 -1.95 -2.12 103.07 101.49 2nsf h GLY 159 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 2nsf h GLY 159 CO 0.03 0.00 -0.13 -0.55 0.00 0.00 0.00 176.54 175.90 2nsf h ASP 160 N 0.00 0.00 -3.13 0.19 3.32 -1.84 -3.45 116.42 111.51 2nsf h ASP 160 Ca -0.00 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.50 2nsf h ASP 160 Cb 0.37 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 2nsf h ASP 160 CO 0.01 0.13 0.65 -0.63 -1.72 0.00 0.00 179.24 177.68 2nsf s ILE 161 N -3.46 4.20 0.22 0.35 1.01 -0.80 -4.97 121.20 117.76 2nsf s ILE 161 Ca 0.03 1.55 -0.31 0.00 0.00 0.00 0.00 60.65 61.92 2nsf s ILE 161 Cb 0.08 -4.00 -0.15 0.00 0.01 0.00 0.00 42.46 38.41 2nsf s ILE 161 CO 0.63 0.04 1.12 -2.65 0.00 0.00 0.00 174.94 174.08 2nsf n PRO 162 N 4.78 1.32 -0.35 2.79 -0.02 -1.26 -4.71 135.00 137.54 2nsf n PRO 162 Ca 0.10 0.47 0.11 0.00 -2.02 0.00 0.00 63.50 62.15 2nsf n PRO 162 Cb 0.46 -1.93 0.29 0.00 -0.02 0.00 0.00 33.50 32.31 2nsf n PRO 162 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2nsf h GLU 163 N 2.91 0.83 -0.44 -0.52 4.81 -1.95 -0.51 114.58 119.72 2nsf h GLU 163 Ca -0.42 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 58.78 2nsf h GLU 163 Cb 1.34 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 30.50 2nsf h GLU 163 CO 0.67 0.55 0.29 -0.24 -0.73 0.00 0.00 179.01 179.55 2nsf h VAL 164 N 0.86 1.07 -0.05 0.32 3.04 -1.89 0.24 116.25 119.84 2nsf h VAL 164 Ca 0.54 -0.18 -0.23 0.00 -1.01 0.00 0.00 66.70 65.82 2nsf h VAL 164 Cb 0.73 0.49 0.02 0.00 -2.01 0.00 0.00 31.29 30.52 2nsf h VAL 164 CO -0.33 0.10 -0.85 0.40 -1.01 0.00 0.00 177.57 175.88 2nsf h ILE 165 N 0.53 1.31 -0.56 3.17 2.04 -1.46 -2.52 117.51 120.03 2nsf h ILE 165 Ca 0.17 -2.11 -0.04 0.00 1.00 0.00 0.00 64.86 63.89 2nsf h ILE 165 Cb 0.04 2.30 -0.02 0.00 -0.74 0.00 0.00 36.82 38.39 2nsf h ILE 165 CO -0.04 0.65 0.19 -0.07 0.00 0.00 0.00 178.15 178.88 2nsf h LEU 166 N 0.32 0.79 -0.76 1.44 3.38 -0.63 -0.70 115.31 119.15 2nsf h LEU 166 Ca -0.09 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.65 2nsf h LEU 166 Cb 1.51 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 42.02 2nsf h LEU 166 CO 0.17 0.77 0.35 0.03 0.09 0.00 0.00 178.44 179.85 2nsf h ARG 167 N 0.77 1.10 -0.36 1.13 3.08 -0.60 -0.35 114.38 119.14 2nsf h ARG 167 Ca 0.18 -0.17 -0.11 0.00 0.07 0.00 0.00 59.98 59.95 2nsf h ARG 167 Cb 0.25 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 2nsf h ARG 167 CO -0.01 0.87 -0.22 1.15 -1.07 0.00 0.00 179.97 180.69 2nsf h THR 168 N 1.07 1.27 -0.42 2.04 2.02 -1.20 -2.49 112.91 115.20 2nsf h THR 168 Ca 0.26 -1.30 -0.09 0.00 0.77 0.00 0.00 66.41 66.05 2nsf h THR 168 Cb 0.14 1.23 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 2nsf h THR 168 CO -0.03 0.43 -0.10 -0.07 0.37 0.00 0.00 175.52 176.12 2nsf h LEU 169 N 0.61 0.81 -0.59 2.58 3.38 -0.69 0.13 115.31 121.55 2nsf h LEU 169 Ca 0.09 -0.36 0.02 0.00 0.09 0.00 0.00 57.88 57.71 2nsf h LEU 169 Cb 0.70 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 2nsf h LEU 169 CO 0.05 0.99 0.38 0.00 0.09 0.00 0.00 178.44 179.95 2nsf h ALA 170 N 0.85 0.75 -0.11 1.53 0.00 -0.94 0.02 119.26 121.38 2nsf h ALA 170 Ca 0.11 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2nsf h ALA 170 Cb 0.63 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 2nsf h ALA 170 CO 0.04 0.14 -0.03 0.00 0.00 0.00 0.00 179.25 179.40 2nsf h ALA 171 N 1.23 0.15 -0.24 0.00 0.00 -1.36 -2.75 119.26 116.29 2nsf h ALA 171 Ca 0.23 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2nsf h ALA 171 Cb -0.04 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2nsf h ALA 171 CO -0.07 -0.12 0.13 1.49 0.00 0.00 0.00 179.25 180.68 2nsf h GLU 172 N -0.12 0.33 -0.42 0.00 4.81 -0.74 0.12 114.58 118.56 2nsf h GLU 172 Ca 0.03 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2nsf h GLU 172 Cb 0.44 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 2nsf h GLU 172 CO 0.01 0.30 0.27 0.82 -0.73 0.00 0.00 179.01 179.68 2nsf h ILE 173 N 0.27 1.12 0.00 2.32 2.04 -1.07 0.12 117.51 122.32 2nsf h ILE 173 Ca 0.08 -0.26 -0.10 0.00 1.00 0.00 0.00 64.86 65.59 2nsf h ILE 173 Cb 0.07 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 2nsf h ILE 173 CO -0.01 0.12 -0.46 0.71 0.00 0.00 0.00 178.15 178.51 2nsf h THR 174 N 0.57 1.13 -0.37 -0.27 1.35 -1.36 -1.24 112.91 112.72 2nsf h THR 174 Ca 0.15 -1.68 -0.14 0.00 -0.55 0.00 0.00 66.41 64.19 2nsf h THR 174 Cb -0.03 1.96 -0.01 0.00 -1.73 0.00 0.00 68.15 68.34 2nsf h THR 174 CO -0.03 0.45 -0.33 1.56 -0.25 0.00 0.00 175.52 176.92 2nsf h GLN 175 N 0.00 0.88 -0.14 4.72 4.20 -0.28 -0.69 115.11 123.80 2nsf h GLN 175 Ca -0.00 -0.45 -0.00 0.00 0.06 0.00 0.00 58.65 58.25 2nsf h GLN 175 Cb 0.92 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.70 2nsf h GLN 175 CO 0.06 1.10 0.07 -0.22 -0.67 0.00 0.00 178.83 179.17 2nsf h LYS 176 N 0.69 0.20 -0.56 1.46 3.64 -0.41 -0.50 116.57 121.09 2nsf h LYS 176 Ca 0.06 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.46 2nsf h LYS 176 Cb 0.91 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.65 2nsf h LYS 176 CO 0.08 0.24 0.31 -1.49 -2.27 0.00 0.00 179.45 176.32 2nsf h TRP 177 N 0.12 0.57 -0.38 1.91 6.55 -1.14 -2.12 115.95 121.47 2nsf h TRP 177 Ca 0.05 0.02 0.03 0.00 0.95 0.00 0.00 58.89 59.94 2nsf h TRP 177 Cb 0.10 -0.18 -0.03 0.00 -0.86 0.00 0.00 29.16 28.19 2nsf h TRP 177 CO -0.03 0.29 0.17 1.15 -1.05 0.00 0.00 178.44 178.97 2nsf h THR 178 N 0.60 0.95 0.00 1.49 2.02 -0.80 0.19 112.91 117.36 2nsf h THR 178 Ca 0.24 -0.12 -0.00 0.00 0.77 0.00 0.00 66.41 67.30 2nsf h THR 178 Cb 0.11 0.57 -0.00 0.00 -1.74 0.00 0.00 68.15 67.09 2nsf h THR 178 CO -0.14 0.06 -0.01 0.77 0.37 0.00 0.00 175.52 176.57 2nsf h SER 179 N 0.35 0.00 -0.02 4.18 4.64 -0.55 -0.86 113.55 121.29 2nsf h SER 179 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 2nsf h SER 179 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 2nsf h SER 179 CO -0.13 0.01 -0.01 0.00 -0.87 0.00 0.00 176.83 175.83 2nsf n GLN 180 N -4.32 1.91 -1.22 4.77 6.02 -0.62 -4.92 117.38 119.00 2nsf n GLN 180 Ca -0.03 -1.33 -0.07 0.00 -0.01 0.00 0.00 57.00 55.55 2nsf n GLN 180 Cb 0.10 -1.47 -0.03 0.00 1.02 0.00 0.00 30.24 29.85 2nsf n GLN 180 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2nsf n GLY 181 N 1.25 0.95 3.92 1.08 0.00 -0.33 -5.01 105.19 107.05 2nsf n GLY 181 Ca 0.17 -0.65 -0.26 0.00 0.00 0.00 0.00 46.02 45.28 2nsf n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nsf s ALA 182 N -2.25 3.61 -0.83 4.61 0.00 0.53 -4.53 121.76 122.90 2nsf s ALA 182 Ca 0.00 -0.71 -0.03 0.00 0.00 0.00 0.00 51.96 51.22 2nsf s ALA 182 Cb 0.00 -2.28 0.00 0.00 0.00 0.00 0.00 23.12 20.85 2nsf s ALA 182 CO 0.00 -0.01 0.71 0.41 0.00 0.00 0.00 175.76 176.87 2nsf n GLY 183 N -1.62 -0.04 3.68 0.00 0.00 -1.26 -2.14 105.19 103.81 2nsf n GLY 183 Ca -0.03 -0.09 -0.45 0.00 0.00 0.00 0.00 46.02 45.46 2nsf n GLY 183 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2nsf n GLU 184 N -3.23 2.47 0.00 1.61 1.02 -1.25 -1.36 120.64 119.90 2nsf n GLU 184 Ca -0.08 0.90 0.00 0.00 -0.02 0.00 0.00 57.16 57.95 2nsf n GLU 184 Cb 0.57 -2.74 0.00 0.00 -0.02 0.00 0.00 31.44 29.25 2nsf n GLU 184 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2nsf n GLY 185 N 4.00 2.46 3.69 0.62 0.00 -0.51 -4.72 105.19 110.74 2nsf n GLY 185 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2nsf n GLY 185 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2nsf s LEU 186 N 0.00 4.26 -0.05 0.99 2.96 -0.47 -0.78 118.68 125.59 2nsf s LEU 186 Ca 0.00 1.45 0.02 0.00 -0.22 0.00 0.00 54.13 55.37 2nsf s LEU 186 Cb 0.00 -3.44 0.02 0.00 0.50 0.00 0.00 46.19 43.27 2nsf s LEU 186 CO 0.00 -0.37 -0.08 -0.69 -1.32 0.00 0.00 176.35 173.89 2nsf s VAL 187 N 1.73 0.80 0.01 1.68 1.01 -0.40 -2.26 120.40 122.96 2nsf s VAL 187 Ca 0.46 -0.27 -0.16 0.00 0.00 0.00 0.00 61.98 62.00 2nsf s VAL 187 Cb -0.18 -0.77 -0.06 0.00 0.00 0.00 0.00 36.38 35.37 2nsf s VAL 187 CO 0.19 0.28 0.45 -0.76 0.00 0.00 0.00 175.10 175.26 2nsf s LEU 188 N 0.83 4.48 -0.15 3.92 1.43 -0.68 -1.04 118.68 127.47 2nsf s LEU 188 Ca -0.12 1.03 0.00 0.00 -1.03 0.00 0.00 54.13 54.01 2nsf s LEU 188 Cb -0.15 -2.67 0.02 0.00 0.03 0.00 0.00 46.19 43.42 2nsf s LEU 188 CO 0.01 0.29 -0.14 -0.22 0.23 0.00 0.00 176.35 176.53 2nsf s LEU 189 N -0.97 1.67 -0.78 1.79 2.96 0.18 -0.25 118.68 123.28 2nsf s LEU 189 Ca 0.25 -0.48 -0.23 0.00 -0.22 0.00 0.00 54.13 53.45 2nsf s LEU 189 Cb -0.17 -1.17 0.07 0.00 0.50 0.00 0.00 46.19 45.42 2nsf s LEU 189 CO 0.15 -0.06 1.15 -0.62 -1.32 0.00 0.00 176.35 175.65 2nsf s ASP 190 N 1.48 6.30 0.11 3.68 -1.08 0.10 -2.03 116.67 125.22 2nsf s ASP 190 Ca 0.05 -1.10 -0.19 0.00 -0.52 0.00 0.00 52.55 50.78 2nsf s ASP 190 Cb -0.13 -2.47 -0.07 0.00 -1.46 0.00 0.00 42.92 38.79 2nsf s ASP 190 CO -0.10 -1.49 1.72 -0.08 0.52 0.00 0.00 175.17 175.73 2nsf h GLU 191 N 9.60 0.31 -0.95 4.34 4.81 -1.54 0.12 114.58 131.27 2nsf h GLU 191 Ca -0.14 -0.04 0.12 0.00 -0.13 0.00 0.00 59.36 59.18 2nsf h GLU 191 Cb 1.05 -0.06 -0.08 0.00 0.63 0.00 0.00 28.75 30.29 2nsf h GLU 191 CO 1.23 0.28 0.61 -1.35 -0.73 0.00 0.00 179.01 179.05 2nsf h PRO 192 N 0.26 0.88 -0.20 0.92 0.11 -1.90 -2.06 132.00 130.01 2nsf h PRO 192 Ca 0.08 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.14 2nsf h PRO 192 Cb 0.06 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 30.97 2nsf h PRO 192 CO -0.01 0.58 0.00 -1.13 -0.21 0.00 0.00 178.00 177.23 2nsf n SER 193 N -4.58 3.22 -3.86 -2.05 3.41 -1.13 -4.97 113.62 103.66 2nsf n SER 193 Ca 0.18 -2.00 -0.26 0.00 -0.26 0.00 0.00 58.87 56.53 2nsf n SER 193 Cb 0.36 -0.12 0.01 0.00 -0.26 0.00 0.00 64.21 64.21 2nsf n SER 193 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2nsf n SER 194 N 1.42 -2.18 -4.29 4.04 2.88 0.35 -4.97 113.62 110.87 2nsf n SER 194 Ca 0.17 -0.86 -0.34 0.00 -1.33 0.00 0.00 58.87 56.50 2nsf n SER 194 Cb 0.60 -3.70 -0.14 0.00 -0.75 0.00 0.00 64.21 60.22 2nsf n SER 194 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2nsf s THR 195 N -3.60 3.04 0.04 2.46 2.01 -0.80 -4.96 115.64 113.83 2nsf s THR 195 Ca 0.25 -0.62 -0.09 0.00 0.31 0.00 0.00 61.69 61.53 2nsf s THR 195 Cb -0.13 -2.34 -0.05 0.00 0.01 0.00 0.00 72.50 69.99 2nsf s THR 195 CO 0.84 0.47 0.35 -0.13 -0.69 0.00 0.00 174.62 175.47 2nsf s ARG 196 N 1.10 3.71 -0.51 4.92 0.52 -1.26 -0.73 118.95 126.70 2nsf s ARG 196 Ca 0.01 0.11 0.03 0.00 -0.52 0.00 0.00 55.73 55.36 2nsf s ARG 196 Cb -0.15 -3.05 0.15 0.00 0.52 0.00 0.00 34.95 32.42 2nsf s ARG 196 CO -0.02 0.61 0.33 0.71 0.02 0.00 0.00 175.30 176.94 2nsf s TYR 197 N -1.32 2.29 0.61 -0.53 2.02 0.66 -4.98 117.35 116.11 2nsf s TYR 197 Ca 0.30 -2.69 -0.13 0.00 -0.37 0.00 0.00 57.07 54.17 2nsf s TYR 197 Cb -0.14 -1.96 -0.03 0.00 -0.40 0.00 0.00 41.96 39.42 2nsf s TYR 197 CO 0.16 -0.73 1.03 -1.25 -1.57 0.00 0.00 175.55 173.20 2nsf s PRO 198 N -0.22 3.42 0.00 -1.71 0.04 -1.26 -1.68 135.00 133.60 2nsf s PRO 198 Ca 0.22 0.96 0.00 0.00 0.04 0.00 0.00 61.00 62.23 2nsf s PRO 198 Cb -0.14 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.35 2nsf s PRO 198 CO -0.08 -0.71 0.00 0.00 0.04 0.00 0.00 177.00 176.25 2nsf n ALA 199 N -2.43 0.00 -1.77 8.56 0.00 -0.96 -4.68 120.51 119.24 2nsf n ALA 199 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.13 2nsf n ALA 199 Cb 0.54 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.96 2nsf n ALA 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2nsf s ALA 200 N -2.47 3.15 0.49 0.00 0.00 -0.91 -4.76 121.76 117.26 2nsf s ALA 200 Ca 0.00 0.93 -0.22 0.00 0.00 0.00 0.00 51.96 52.67 2nsf s ALA 200 Cb 0.00 -3.37 -0.06 0.00 0.00 0.00 0.00 23.12 19.69 2nsf s ALA 200 CO 0.00 -0.48 1.24 -1.25 0.00 0.00 0.00 175.76 175.27 2nsf s PRO 201 N -2.30 3.51 0.26 0.00 0.04 -1.26 -1.42 135.00 133.82 2nsf s PRO 201 Ca 0.57 1.95 -0.10 0.00 0.04 0.00 0.00 61.00 63.45 2nsf s PRO 201 Cb -0.30 -2.34 -0.01 0.00 0.04 0.00 0.00 34.50 31.90 2nsf s PRO 201 CO 0.37 -0.80 0.44 0.20 0.04 0.00 0.00 177.00 177.25 2nsf s GLY 202 N -1.21 0.75 0.08 0.56 0.00 -1.26 -4.18 107.32 102.06 2nsf s GLY 202 Ca 0.67 -1.05 0.12 0.00 0.00 0.00 0.00 44.72 44.46 2nsf s GLY 202 CO 0.40 -0.75 1.03 0.06 0.00 0.00 0.00 173.10 173.83 2nsf h GLN 203 N 2.27 0.00 -4.61 2.90 -0.00 -1.96 -3.42 115.11 110.30 2nsf h GLN 203 Ca -0.28 0.00 -0.70 0.00 -0.00 0.00 0.00 58.65 57.68 2nsf h GLN 203 Cb 1.25 0.00 -0.31 0.00 -0.00 0.00 0.00 27.48 28.42 2nsf h GLN 203 CO 0.38 0.64 -0.58 -0.51 -0.00 0.00 0.00 178.83 178.75 2nsf s ASP 204 N -6.31 5.29 0.13 0.06 1.01 -1.26 -5.07 116.67 110.52 2nsf s ASP 204 Ca -0.01 -1.43 -0.30 0.00 0.71 0.00 0.00 52.55 51.52 2nsf s ASP 204 Cb 0.09 -1.85 -0.06 0.00 1.01 0.00 0.00 42.92 42.10 2nsf s ASP 204 CO 0.81 -0.41 1.04 -0.70 0.21 0.00 0.00 175.17 176.12 2nsf s GLU 205 N 1.32 4.63 -0.16 8.23 2.12 -1.26 -4.42 118.70 129.16 2nsf s GLU 205 Ca 0.01 1.59 -0.01 0.00 0.36 0.00 0.00 54.97 56.92 2nsf s GLU 205 Cb -0.21 -3.34 0.04 0.00 0.26 0.00 0.00 34.13 30.88 2nsf s GLU 205 CO 0.00 0.11 -0.04 0.08 -0.54 0.00 0.00 175.26 174.87 2nsf s VAL 206 N 0.03 0.98 -0.28 3.70 1.01 0.04 -4.95 120.40 120.93 2nsf s VAL 206 Ca 0.49 -0.53 -0.11 0.00 0.00 0.00 0.00 61.98 61.84 2nsf s VAL 206 Cb -0.26 -1.17 -0.04 0.00 0.00 0.00 0.00 36.38 34.90 2nsf s VAL 206 CO 0.32 0.12 0.18 -0.69 0.00 0.00 0.00 175.10 175.03 2nsf s VAL 207 N 1.69 5.15 -0.32 2.92 1.01 -1.26 -1.28 120.40 128.32 2nsf s VAL 207 Ca 0.01 0.08 -0.10 0.00 0.00 0.00 0.00 61.98 61.98 2nsf s VAL 207 Cb -0.15 -3.47 -0.00 0.00 0.00 0.00 0.00 36.38 32.76 2nsf s VAL 207 CO -0.08 0.24 0.15 -0.69 0.00 0.00 0.00 175.10 174.73 2nsf s VAL 208 N 1.73 4.54 0.25 2.92 1.01 -0.21 -1.14 120.40 129.50 2nsf s VAL 208 Ca 0.07 -0.51 0.10 0.00 0.00 0.00 0.00 61.98 61.64 2nsf s VAL 208 Cb -0.16 -3.35 -0.05 0.00 0.00 0.00 0.00 36.38 32.82 2nsf s VAL 208 CO 0.10 0.02 -0.17 -0.94 0.00 0.00 0.00 175.10 174.11 2nsf s SER 209 N 1.59 3.19 0.00 3.32 1.04 -0.43 -0.65 113.70 121.77 2nsf s SER 209 Ca 0.04 -1.03 0.00 0.00 0.48 0.00 0.00 55.95 55.44 2nsf s SER 209 Cb -0.17 -0.24 0.00 0.00 0.10 0.00 0.00 66.02 65.71 2nsf s SER 209 CO 0.06 -0.05 0.00 0.61 0.98 0.00 0.00 173.24 174.84 2nsf n GLY 210 N -0.53 -0.78 3.83 7.32 0.00 -0.86 -1.57 105.19 112.60 2nsf n GLY 210 Ca -0.06 -0.90 -0.29 0.00 0.00 0.00 0.00 46.02 44.77 2nsf n GLY 210 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nsf s SER 211 N -4.00 3.92 0.19 1.61 1.04 -1.26 -1.45 113.70 113.75 2nsf s SER 211 Ca 0.00 0.89 -0.12 0.00 0.48 0.00 0.00 55.95 57.20 2nsf s SER 211 Cb 0.00 -1.43 0.14 0.00 0.10 0.00 0.00 66.02 64.83 2nsf s SER 211 CO 0.00 -2.29 1.84 0.25 0.98 0.00 0.00 173.24 174.03 2nsf h LEU 212 N -1.32 0.67 -1.11 2.42 5.85 -1.94 -1.10 115.31 118.78 2nsf h LEU 212 Ca -0.49 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.22 2nsf h LEU 212 Cb 1.33 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 42.17 2nsf h LEU 212 CO 0.64 0.47 0.43 0.00 -0.34 0.00 0.00 178.44 179.64 2nsf h ALA 213 N 1.26 1.33 -0.35 1.25 0.00 -1.92 -1.50 119.26 119.32 2nsf h ALA 213 Ca 0.24 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2nsf h ALA 213 Cb -0.03 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 2nsf h ALA 213 CO -0.08 0.56 0.08 0.78 0.00 0.00 0.00 179.25 180.59 2nsf h GLY 214 N 1.08 0.60 2.00 0.00 0.00 -1.53 -1.37 103.07 103.85 2nsf h GLY 214 Ca 0.27 -0.38 -0.13 0.00 0.00 0.00 0.00 47.33 47.09 2nsf h GLY 214 CO -0.05 0.35 -0.61 0.16 0.00 0.00 0.00 176.54 176.39 2nsf h ILE 215 N 0.41 1.33 -0.20 2.60 3.07 -1.00 -2.35 117.51 121.36 2nsf h ILE 215 Ca 0.11 -2.19 -0.19 0.00 1.55 0.00 0.00 64.86 64.14 2nsf h ILE 215 Cb 0.30 2.22 0.01 0.00 -0.27 0.00 0.00 36.82 39.08 2nsf h ILE 215 CO 0.00 0.60 -0.63 0.58 -1.05 0.00 0.00 178.15 177.65 2nsf h VAL 216 N 0.00 1.29 -0.73 0.16 2.07 -1.20 0.20 116.25 118.04 2nsf h VAL 216 Ca -0.01 -1.84 0.01 0.00 0.82 0.00 0.00 66.70 65.69 2nsf h VAL 216 Cb 1.17 1.86 -0.04 0.00 -1.52 0.00 0.00 31.29 32.76 2nsf h VAL 216 CO 0.08 0.59 0.48 -0.09 0.02 0.00 0.00 177.57 178.64 2nsf h ARG 217 N 0.53 0.93 0.15 1.57 2.43 -1.19 0.46 114.38 119.26 2nsf h ARG 217 Ca -0.02 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 2nsf h ARG 217 Cb 1.26 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.60 2nsf h ARG 217 CO 0.14 0.62 -0.07 -0.92 -1.51 0.00 0.00 179.97 178.22 2nsf h TYR 218 N 0.96 -0.19 -0.13 2.20 3.20 -1.26 0.27 116.97 122.03 2nsf h TYR 218 Ca 0.27 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.11 2nsf h TYR 218 Cb -0.08 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 2nsf h TYR 218 CO -0.03 0.01 -0.03 0.00 -1.64 0.00 0.00 178.16 176.48 2nsf h ALA 219 N 0.46 1.71 0.00 1.82 0.00 -0.37 -1.13 119.26 121.76 2nsf h ALA 219 Ca -0.02 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2nsf h ALA 219 Cb 0.29 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2nsf h ALA 219 CO 0.03 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.50 2nsf n ALA 220 N -2.50 2.54 -1.48 0.00 0.00 0.13 -4.74 120.51 114.45 2nsf n ALA 220 Ca -0.01 -0.13 -0.07 0.00 0.00 0.00 0.00 53.44 53.23 2nsf n ALA 220 Cb 0.18 -1.33 -0.02 0.00 0.00 0.00 0.00 19.45 18.27 2nsf n ALA 220 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nsf n GLY 221 N 0.70 0.70 1.17 0.00 0.00 -0.43 -4.87 105.19 102.47 2nsf n GLY 221 Ca 0.15 -0.67 0.08 0.00 0.00 0.00 0.00 46.02 45.58 2nsf n GLY 221 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nsf n ARG 222 N -2.48 3.44 0.00 1.61 1.74 0.07 -5.03 116.66 116.01 2nsf n ARG 222 Ca -0.08 -2.78 0.00 0.00 -0.77 0.00 0.00 57.85 54.22 2nsf n ARG 222 Cb 0.34 -1.83 0.00 0.00 -1.02 0.00 0.00 32.46 29.95 2nsf n ARG 222 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2nsf n GLY 223 N 0.21 4.08 0.54 -0.13 0.00 -1.23 -4.87 105.19 103.79 2nsf n GLY 223 Ca 0.22 -1.50 0.05 0.00 0.00 0.00 0.00 46.02 44.78 2nsf n GLY 223 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2nsf n SER 224 N 0.00 2.62 0.26 1.61 7.64 -1.26 -2.83 113.62 121.67 2nsf n SER 224 Ca 0.00 -1.88 0.16 0.00 1.01 0.00 0.00 58.87 58.17 2nsf n SER 224 Cb 0.00 -0.16 0.90 0.00 -1.01 0.00 0.00 64.21 63.94 2nsf n SER 224 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2nsf h ASP 225 N 1.85 0.00 -0.66 6.43 3.32 -1.93 -2.26 116.42 123.16 2nsf h ASP 225 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2nsf h ASP 225 Cb 0.65 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.20 2nsf h ASP 225 CO 0.00 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.13 2nsf n GLY 226 N -1.34 2.57 3.15 2.75 0.00 -1.26 -4.98 105.19 106.09 2nsf n GLY 226 Ca -0.01 -0.82 -0.10 0.00 0.00 0.00 0.00 46.02 45.09 2nsf n GLY 226 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2nsf s VAL 227 N -1.63 0.23 0.14 1.61 -7.23 -0.85 -4.25 120.40 108.42 2nsf s VAL 227 Ca 0.50 -1.90 0.02 0.00 -1.81 0.00 0.00 61.98 58.79 2nsf s VAL 227 Cb 0.30 -1.93 -0.04 0.00 0.56 0.00 0.00 36.38 35.27 2nsf s VAL 227 CO 0.27 -0.60 -0.04 0.42 -0.31 0.00 0.00 175.10 174.84 2nsf s THR 228 N -3.95 0.76 0.03 5.32 -4.23 -0.61 -4.95 115.64 108.00 2nsf s THR 228 Ca 0.20 -1.98 0.05 0.00 -1.18 0.00 0.00 61.69 58.78 2nsf s THR 228 Cb 0.07 -1.92 -0.03 0.00 1.34 0.00 0.00 72.50 71.96 2nsf s THR 228 CO -0.01 -0.66 -0.11 -0.55 -0.54 0.00 0.00 174.62 172.75 2nsf s SER 229 N -3.13 4.31 0.33 3.99 0.15 -1.26 -1.32 113.70 116.78 2nsf s SER 229 Ca 0.18 -0.26 0.26 0.00 0.70 0.00 0.00 55.95 56.83 2nsf s SER 229 Cb 0.05 -0.89 1.13 0.00 -1.71 0.00 0.00 66.02 64.60 2nsf s SER 229 CO 0.00 0.26 1.77 0.77 1.20 0.00 0.00 173.24 177.25 2nsf h SER 230 N 4.45 0.00 -0.29 5.45 4.64 -1.47 -1.63 113.55 124.70 2nsf h SER 230 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2nsf h SER 230 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2nsf h SER 230 CO 0.51 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.82 2nsf n THR 231 N -2.41 0.44 0.00 2.95 -2.24 -1.26 -4.96 114.28 106.81 2nsf n THR 231 Ca 0.01 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 61.07 2nsf n THR 231 Cb 0.20 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.44 2nsf n THR 231 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2nsf n GLY 232 N 1.21 2.01 2.70 3.38 0.00 -0.61 -5.00 105.19 108.88 2nsf n GLY 232 Ca 0.16 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.99 2nsf n GLY 232 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2nsf s GLU 233 N -0.38 -0.04 -0.22 1.61 2.56 -1.26 -4.80 118.70 116.16 2nsf s GLU 233 Ca 0.00 0.32 -0.29 0.00 0.00 0.00 0.00 54.97 55.00 2nsf s GLU 233 Cb 0.00 -0.47 0.00 0.00 2.00 0.00 0.00 34.13 35.67 2nsf s GLU 233 CO 0.00 -0.29 1.12 0.08 -0.56 0.00 0.00 175.26 175.61 2nsf s VAL 234 N 1.90 4.54 0.65 3.70 1.01 -1.26 -4.77 120.40 126.16 2nsf s VAL 234 Ca 0.02 1.85 -0.11 0.00 0.00 0.00 0.00 61.98 63.73 2nsf s VAL 234 Cb -0.12 -4.22 -0.02 0.00 0.00 0.00 0.00 36.38 32.02 2nsf s VAL 234 CO -0.03 -0.19 1.05 -2.16 0.00 0.00 0.00 175.10 173.76 2nsf s PRO 235 N 3.34 3.34 0.03 2.72 0.04 -1.26 -4.99 135.00 138.23 2nsf s PRO 235 Ca 0.48 0.72 -0.30 0.00 0.04 0.00 0.00 61.00 61.93 2nsf s PRO 235 Cb -0.17 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.27 2nsf s PRO 235 CO 0.10 -0.75 1.21 -1.21 0.04 0.00 0.00 177.00 176.39 2nsf s GLU 236 N -5.20 4.41 0.79 4.56 0.41 -1.26 -5.00 118.70 117.42 2nsf s GLU 236 Ca 0.56 1.75 -0.11 0.00 -0.41 0.00 0.00 54.97 56.77 2nsf s GLU 236 Cb -0.11 -3.40 0.07 0.00 -1.78 0.00 0.00 34.13 28.90 2nsf s GLU 236 CO 0.54 -0.31 1.09 -1.25 -0.49 0.00 0.00 175.26 174.83 2nsf s PRO 237 N 1.37 2.12 0.67 0.39 0.04 -1.26 -4.99 135.00 133.34 2nsf s PRO 237 Ca 0.58 0.95 -0.17 0.00 0.04 0.00 0.00 61.00 62.40 2nsf s PRO 237 Cb -0.28 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.36 2nsf s PRO 237 CO 0.28 -1.67 1.22 -2.14 0.04 0.00 0.00 177.00 174.72 2nsf s PRO 238 N -4.98 2.52 0.65 0.56 0.02 -1.26 -4.94 135.00 127.57 2nsf s PRO 238 Ca 0.61 1.82 -0.17 0.00 0.02 0.00 0.00 61.00 63.27 2nsf s PRO 238 Cb -0.16 -1.87 -0.00 0.00 0.02 0.00 0.00 34.50 32.48 2nsf s PRO 238 CO 0.56 -1.56 1.25 -0.98 -0.33 0.00 0.00 177.00 175.93 2nsf s ARG 239 N -3.64 2.55 0.00 5.54 1.70 -1.26 -4.89 118.95 118.96 2nsf s ARG 239 Ca 0.76 1.92 0.00 0.00 -0.47 0.00 0.00 55.73 57.94 2nsf s ARG 239 Cb -0.31 -1.86 0.00 0.00 -0.57 0.00 0.00 34.95 32.21 2nsf s ARG 239 CO 0.40 -1.55 0.00 1.87 -1.08 0.00 0.00 175.30 174.94