#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pfg s ALA 2 N 0.00 1.03 -0.24 0.00 0.00 -1.25 -1.11 121.76 120.19 1pfg s ALA 2 Ca 0.00 -0.61 0.02 0.00 0.00 0.00 0.00 51.96 51.37 1pfg s ALA 2 Cb 0.00 -0.22 0.05 0.00 0.00 0.00 0.00 23.12 22.95 1pfg s ALA 2 CO 0.00 0.23 -0.10 -1.14 0.00 0.00 0.00 175.76 174.75 1pfg s GLN 3 N -0.55 2.12 0.72 0.00 0.74 0.57 -4.88 119.66 118.38 1pfg s GLN 3 Ca 0.03 -1.15 -0.12 0.00 0.05 0.00 0.00 55.36 54.17 1pfg s GLN 3 Cb -0.06 -2.73 0.03 0.00 1.10 0.00 0.00 33.01 31.36 1pfg s GLN 3 CO 0.00 -0.53 1.09 0.99 -0.55 0.00 0.00 175.29 176.29 1pfg s THR 4 N 1.23 3.45 -1.21 -0.34 2.01 -1.26 0.09 115.64 119.60 1pfg s THR 4 Ca -0.06 0.53 -0.05 0.00 0.31 0.00 0.00 61.69 62.41 1pfg s THR 4 Cb -0.19 -3.06 0.05 0.00 0.01 0.00 0.00 72.50 69.31 1pfg s THR 4 CO -0.06 -0.56 0.13 0.59 -0.69 0.00 0.00 174.62 174.03 1pfg n ASN 5 N -3.12 0.08 -4.76 3.53 4.13 -0.74 -4.86 115.26 109.52 1pfg n ASN 5 Ca 0.09 -0.93 -0.30 0.00 1.68 0.00 0.00 54.58 55.12 1pfg n ASN 5 Cb 0.53 -1.17 0.12 0.00 -1.54 0.00 0.00 39.78 37.72 1pfg n ASN 5 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1pfg s ALA 6 N -3.61 1.86 0.62 5.41 0.00 0.19 -4.99 121.76 121.25 1pfg s ALA 6 Ca 0.19 -0.21 -0.18 0.00 0.00 0.00 0.00 51.96 51.75 1pfg s ALA 6 Cb -0.11 -3.13 -0.02 0.00 0.00 0.00 0.00 23.12 19.86 1pfg s ALA 6 CO 0.74 -2.09 1.24 -2.14 0.00 0.00 0.00 175.76 173.51 1pfg s PRO 7 N -5.08 2.77 0.50 0.00 0.02 -1.26 -4.78 135.00 127.16 1pfg s PRO 7 Ca 0.62 1.91 0.15 0.00 0.02 0.00 0.00 61.00 63.70 1pfg s PRO 7 Cb -0.16 -1.89 1.20 0.00 0.02 0.00 0.00 34.50 33.66 1pfg s PRO 7 CO 0.55 -1.39 2.11 0.11 -0.33 0.00 0.00 177.00 178.06 1pfg h TRP 8 N 0.68 0.03 -0.12 6.54 5.08 -1.92 0.19 115.95 126.44 1pfg h TRP 8 Ca -0.50 0.00 -0.19 0.00 1.08 0.00 0.00 58.89 59.27 1pfg h TRP 8 Cb 1.31 -0.01 -0.00 0.00 -3.00 0.00 0.00 29.16 27.46 1pfg h TRP 8 CO 0.45 0.05 -0.71 0.78 -1.28 0.00 0.00 178.44 177.73 1pfg h GLY 9 N 0.13 0.61 0.81 11.11 0.00 -1.91 0.71 103.07 114.53 1pfg h GLY 9 Ca 0.01 -0.83 -0.02 0.00 0.00 0.00 0.00 47.33 46.48 1pfg h GLY 9 CO 0.00 0.74 -0.23 1.41 0.00 0.00 0.00 176.54 178.46 1pfg h LEU 10 N 0.39 -0.55 -1.42 3.11 3.38 -1.62 -0.87 115.31 117.73 1pfg h LEU 10 Ca -0.03 -0.06 0.08 0.00 0.09 0.00 0.00 57.88 57.96 1pfg h LEU 10 Cb 1.30 0.14 -0.05 0.00 0.09 0.00 0.00 40.66 42.14 1pfg h LEU 10 CO 0.13 -0.26 0.47 0.00 0.09 0.00 0.00 178.44 178.88 1pfg h ALA 11 N -0.45 1.78 -0.04 1.53 0.00 -0.32 -2.88 119.26 118.89 1pfg h ALA 11 Ca -0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1pfg h ALA 11 Cb 0.58 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1pfg h ALA 11 CO 0.11 0.09 -0.01 -0.09 0.00 0.00 0.00 179.25 179.35 1pfg h ARG 12 N 0.68 0.07 0.00 0.00 9.65 0.69 -2.28 114.38 123.19 1pfg h ARG 12 Ca 0.32 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.17 1pfg h ARG 12 Cb 0.37 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.94 1pfg h ARG 12 CO -0.11 0.43 0.41 0.82 2.80 0.00 0.00 179.97 184.32 1pfg h ILE 13 N -0.29 0.00 0.00 1.20 5.03 -0.94 -1.06 117.51 121.45 1pfg h ILE 13 Ca 0.01 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.75 1pfg h ILE 13 Cb 0.40 0.54 0.00 0.00 -3.03 0.00 0.00 36.82 34.73 1pfg h ILE 13 CO 0.00 0.00 -0.00 -1.54 -0.68 0.00 0.00 178.15 175.93 1pfg n SER 14 N -2.73 2.19 -4.36 1.72 3.41 -1.00 -1.89 113.62 110.95 1pfg n SER 14 Ca -0.02 -2.66 -0.21 0.00 -0.26 0.00 0.00 58.87 55.72 1pfg n SER 14 Cb 0.45 -0.26 -0.11 0.00 -0.26 0.00 0.00 64.21 64.03 1pfg n SER 14 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1pfg s SER 15 N -2.15 2.84 -0.03 4.04 0.15 -0.40 -4.78 113.70 113.37 1pfg s SER 15 Ca 0.20 -0.94 0.14 0.00 0.70 0.00 0.00 55.95 56.05 1pfg s SER 15 Cb 0.17 -0.18 0.41 0.00 -1.71 0.00 0.00 66.02 64.72 1pfg s SER 15 CO 0.02 -0.05 1.35 1.07 1.20 0.00 0.00 173.24 176.82 1pfg n THR 16 N -0.06 1.21 -3.72 6.45 5.66 -1.26 -4.90 114.28 117.65 1pfg n THR 16 Ca -0.10 -1.11 -0.12 0.00 -3.05 0.00 0.00 64.05 59.66 1pfg n THR 16 Cb 0.58 0.39 -0.11 0.00 -1.55 0.00 0.00 70.33 69.64 1pfg n THR 16 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1pfg s SER 17 N -1.10 -0.43 0.80 1.09 1.04 -1.26 -5.10 113.70 108.74 1pfg s SER 17 Ca 0.31 0.79 -0.11 0.00 0.48 0.00 0.00 55.95 57.42 1pfg s SER 17 Cb 0.18 0.74 0.07 0.00 0.10 0.00 0.00 66.02 67.11 1pfg s SER 17 CO 0.18 -0.16 1.09 -2.16 0.98 0.00 0.00 173.24 173.17 1pfg s PRO 18 N 0.77 2.05 0.00 4.02 0.04 -1.26 -4.28 135.00 136.35 1pfg s PRO 18 Ca -0.05 1.02 0.00 0.00 0.04 0.00 0.00 61.00 62.01 1pfg s PRO 18 Cb -0.06 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.60 1pfg s PRO 18 CO -0.06 -1.74 0.00 0.41 0.04 0.00 0.00 177.00 175.65 1pfg n GLY 19 N -1.33 1.11 3.92 0.56 0.00 -1.26 -5.11 105.19 103.07 1pfg n GLY 19 Ca 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 1pfg n GLY 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1pfg s THR 20 N -1.02 2.06 0.00 2.61 -4.23 -1.26 -5.02 115.64 108.77 1pfg s THR 20 Ca 0.00 -0.08 0.00 0.00 -1.18 0.00 0.00 61.69 60.43 1pfg s THR 20 Cb 0.00 -2.98 0.00 0.00 1.34 0.00 0.00 72.50 70.86 1pfg s THR 20 CO 0.00 0.00 0.30 -1.54 -0.54 0.00 0.00 174.62 172.84 1pfg n SER 21 N -3.35 0.46 -4.48 3.99 3.41 -1.26 -4.80 113.62 107.60 1pfg n SER 21 Ca 0.10 -1.08 -0.31 0.00 -0.26 0.00 0.00 58.87 57.32 1pfg n SER 21 Cb 0.60 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.43 1pfg n SER 21 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1pfg s THR 22 N -0.08 2.94 -0.21 6.66 2.01 -1.26 0.56 115.64 126.25 1pfg s THR 22 Ca 0.00 -1.04 -0.07 0.00 0.31 0.00 0.00 61.69 60.89 1pfg s THR 22 Cb 0.00 -2.22 -0.04 0.00 0.01 0.00 0.00 72.50 70.25 1pfg s THR 22 CO 0.00 0.40 0.06 -0.47 -0.69 0.00 0.00 174.62 173.92 1pfg s TYR 23 N -0.89 3.16 -0.17 4.92 5.04 0.11 -4.12 117.35 125.39 1pfg s TYR 23 Ca 0.14 -0.16 -0.02 0.00 -2.44 0.00 0.00 57.07 54.60 1pfg s TYR 23 Cb -0.11 -2.14 -0.01 0.00 0.35 0.00 0.00 41.96 40.05 1pfg s TYR 23 CO 0.05 -0.08 -0.10 0.71 -1.34 0.00 0.00 175.55 174.78 1pfg s TYR 24 N 0.92 2.87 0.08 4.97 2.02 -1.25 0.21 117.35 127.17 1pfg s TYR 24 Ca 0.04 -0.86 -0.11 0.00 -0.37 0.00 0.00 57.07 55.76 1pfg s TYR 24 Cb -0.14 -1.96 0.01 0.00 -0.40 0.00 0.00 41.96 39.47 1pfg s TYR 24 CO 0.03 -0.41 0.25 1.52 -1.57 0.00 0.00 175.55 175.37 1pfg s TYR 25 N 0.91 0.02 0.60 2.71 -0.85 -0.26 -4.78 117.35 115.71 1pfg s TYR 25 Ca -0.02 -0.33 -0.19 0.00 -0.52 0.00 0.00 57.07 56.00 1pfg s TYR 25 Cb -0.15 0.03 -0.03 0.00 0.38 0.00 0.00 41.96 42.20 1pfg s TYR 25 CO -0.00 -0.55 1.26 0.34 -1.52 0.00 0.00 175.55 175.09 1pfg s ASP 26 N -2.56 4.99 0.44 -0.18 -1.08 -1.26 -0.56 116.67 116.46 1pfg s ASP 26 Ca 0.01 2.54 0.24 0.00 -0.52 0.00 0.00 52.55 54.82 1pfg s ASP 26 Cb 0.02 -2.61 0.87 0.00 -1.46 0.00 0.00 42.92 39.74 1pfg s ASP 26 CO -0.08 -1.74 1.80 -0.33 0.52 0.00 0.00 175.17 175.34 1pfg h GLU 27 N 0.86 0.00 -0.51 4.34 3.07 -2.00 -2.91 114.58 117.43 1pfg h GLU 27 Ca -0.51 0.00 0.14 0.00 -0.50 0.00 0.00 59.36 58.50 1pfg h GLU 27 Cb 1.31 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.20 1pfg h GLU 27 CO 0.55 0.21 0.36 0.66 -1.40 0.00 0.00 179.01 179.39 1pfg h SER 28 N 0.00 0.02 -7.09 1.42 4.64 -1.98 -3.45 113.55 107.11 1pfg h SER 28 Ca -0.00 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.70 1pfg h SER 28 Cb 0.79 -0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 62.66 1pfg h SER 28 CO 0.03 0.01 -0.97 0.00 -0.87 0.00 0.00 176.83 175.03 1pfg n ALA 29 N -2.63 -2.00 -0.03 5.18 0.00 -1.10 -0.73 120.51 119.20 1pfg n ALA 29 Ca 0.09 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1pfg n ALA 29 Cb 0.57 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 19.21 1pfg n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pfg n GLY 30 N -2.57 1.70 3.77 0.00 0.00 -1.26 -0.21 105.19 106.62 1pfg n GLY 30 Ca -0.32 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.33 1pfg n GLY 30 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1pfg s GLN 31 N -0.42 3.80 0.00 1.61 -2.07 0.09 -2.17 119.66 120.50 1pfg s GLN 31 Ca 0.00 1.73 0.00 0.00 -1.82 0.00 0.00 55.36 55.27 1pfg s GLN 31 Cb 0.00 -2.41 0.00 0.00 -1.09 0.00 0.00 33.01 29.51 1pfg s GLN 31 CO 0.00 -0.51 0.00 0.41 -1.32 0.00 0.00 175.29 173.87 1pfg n GLY 32 N 0.41 2.99 3.99 2.60 0.00 -1.26 -4.79 105.19 109.13 1pfg n GLY 32 Ca 0.07 -0.69 -0.21 0.00 0.00 0.00 0.00 46.02 45.20 1pfg n GLY 32 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pfg s SER 33 N 0.18 5.10 0.03 1.61 1.04 -0.92 -1.01 113.70 119.72 1pfg s SER 33 Ca 0.00 -0.27 0.02 0.00 0.48 0.00 0.00 55.95 56.18 1pfg s SER 33 Cb 0.00 -0.49 -0.02 0.00 0.10 0.00 0.00 66.02 65.61 1pfg s SER 33 CO 0.00 -1.27 -0.06 0.00 0.98 0.00 0.00 173.24 172.89 1pfg s VAL 35 N -1.11 0.80 -0.03 0.00 1.01 -0.48 -0.96 120.40 119.64 1pfg s VAL 35 Ca -0.08 -0.38 -0.26 0.00 0.00 0.00 0.00 61.98 61.26 1pfg s VAL 35 Cb -0.08 -1.01 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 1pfg s VAL 35 CO 0.00 0.13 0.80 -0.31 0.00 0.00 0.00 175.10 175.73 1pfg s TYR 36 N 1.77 3.63 -0.40 5.22 2.02 -0.86 -2.20 117.35 126.53 1pfg s TYR 36 Ca 0.02 1.43 -0.05 0.00 -0.37 0.00 0.00 57.07 58.10 1pfg s TYR 36 Cb -0.14 -2.91 0.10 0.00 -0.40 0.00 0.00 41.96 38.60 1pfg s TYR 36 CO -0.07 0.08 0.21 0.08 -1.57 0.00 0.00 175.55 174.28 1pfg s VAL 37 N 0.75 3.58 -0.48 0.71 1.01 -0.78 0.91 120.40 126.10 1pfg s VAL 37 Ca 0.42 -1.79 -0.16 0.00 0.00 0.00 0.00 61.98 60.45 1pfg s VAL 37 Cb -0.19 -3.33 0.07 0.00 0.00 0.00 0.00 36.38 32.93 1pfg s VAL 37 CO 0.22 -0.59 0.45 -0.63 0.00 0.00 0.00 175.10 174.55 1pfg s ILE 38 N 1.25 5.16 0.00 2.22 1.01 -0.94 -2.46 121.20 127.43 1pfg s ILE 38 Ca 0.05 -0.96 0.00 0.00 0.00 0.00 0.00 60.65 59.74 1pfg s ILE 38 Cb -0.23 -4.17 0.00 0.00 0.01 0.00 0.00 42.46 38.07 1pfg s ILE 38 CO -0.02 -0.64 0.00 -0.67 0.00 0.00 0.00 174.94 173.61 1pfg n ASP 39 N 5.41 1.74 -0.11 3.58 2.03 -0.74 -4.45 116.55 124.01 1pfg n ASP 39 Ca -0.11 0.00 0.14 0.00 0.52 0.00 0.00 54.79 55.33 1pfg n ASP 39 Cb 0.44 0.00 0.53 0.00 -0.72 0.00 0.00 41.12 41.37 1pfg n ASP 39 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1pfg n THR 40 N 0.00 0.00 0.00 5.18 -2.24 -1.26 -0.80 114.28 115.16 1pfg n THR 40 Ca 0.00 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 1pfg n THR 40 Cb 0.00 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.21 1pfg n THR 40 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pfg n GLY 41 N 1.34 0.77 3.29 3.38 0.00 -1.26 -4.07 105.19 108.64 1pfg n GLY 41 Ca 0.12 -2.05 0.03 0.00 0.00 0.00 0.00 46.02 44.12 1pfg n GLY 41 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pfg s ILE 42 N -1.59 -0.57 -1.07 -0.61 1.01 -1.26 -3.84 121.20 113.27 1pfg s ILE 42 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 60.65 60.40 1pfg s ILE 42 Cb 0.00 -1.00 -0.18 0.00 0.01 0.00 0.00 42.46 41.29 1pfg s ILE 42 CO 0.00 0.00 2.01 1.21 0.00 0.00 0.00 174.94 178.16 1pfg n GLU 43 N 5.24 0.81 0.22 2.79 2.13 -1.26 -4.61 120.64 125.96 1pfg n GLU 43 Ca -0.07 -2.02 0.15 0.00 0.66 0.00 0.00 57.16 55.88 1pfg n GLU 43 Cb 0.52 -3.75 0.62 0.00 0.27 0.00 0.00 31.44 29.10 1pfg n GLU 43 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1pfg h ALA 44 N 10.58 1.81 -0.00 4.31 0.00 -1.96 -0.06 119.26 133.94 1pfg h ALA 44 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1pfg h ALA 44 Cb 0.95 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1pfg h ALA 44 CO 1.19 -0.67 -0.00 -1.13 0.00 0.00 0.00 179.25 178.63 1pfg n SER 45 N -3.06 0.02 -4.68 0.00 3.41 -1.26 -4.53 113.62 103.52 1pfg n SER 45 Ca 0.03 -0.27 -0.49 0.00 -0.26 0.00 0.00 58.87 57.88 1pfg n SER 45 Cb 0.66 -0.24 -0.05 0.00 -0.26 0.00 0.00 64.21 64.32 1pfg n SER 45 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 1pfg n HIS 46 N -1.24 2.21 -0.04 7.33 -0.00 -0.04 -4.76 115.22 118.69 1pfg n HIS 46 Ca 0.16 0.19 0.23 0.00 0.46 0.00 0.00 57.72 58.76 1pfg n HIS 46 Cb 0.23 -2.58 0.72 0.00 -0.12 0.00 0.00 29.99 28.23 1pfg n HIS 46 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1pfg h PRO 47 N 7.72 0.00 0.00 1.57 0.11 -1.90 0.74 132.00 140.24 1pfg h PRO 47 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1pfg h PRO 47 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1pfg h PRO 47 CO 0.92 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.64 1pfg h GLU 48 N 0.00 0.00 -0.22 1.05 4.39 -1.96 -0.82 114.58 117.03 1pfg h GLU 48 Ca 0.30 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.00 1pfg h GLU 48 Cb 1.29 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.94 1pfg h GLU 48 CO -0.00 0.00 0.00 1.19 -1.16 0.00 0.00 179.01 179.04 1pfg n PHE 49 N -2.35 0.26 -1.78 4.33 3.72 0.26 -1.71 117.46 120.19 1pfg n PHE 49 Ca 0.01 -0.14 0.00 0.00 -0.05 0.00 0.00 57.45 57.27 1pfg n PHE 49 Cb 0.19 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.73 1pfg n PHE 49 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1pfg n GLU 50 N 1.34 -2.16 -0.15 -1.08 1.02 -0.31 0.18 120.64 119.48 1pfg n GLU 50 Ca 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 1pfg n GLU 50 Cb 0.57 -3.50 0.00 0.00 -0.02 0.00 0.00 31.44 28.49 1pfg n GLU 50 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1pfg n GLY 51 N -0.30 0.61 1.05 0.62 0.00 -1.26 -4.92 105.19 100.98 1pfg n GLY 51 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1pfg n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pfg n ARG 52 N -2.00 2.63 -4.43 1.61 1.74 0.48 -4.92 116.66 111.77 1pfg n ARG 52 Ca 0.00 -1.62 -0.24 0.00 -0.77 0.00 0.00 57.85 55.22 1pfg n ARG 52 Cb 0.00 -1.66 -0.11 0.00 -1.02 0.00 0.00 32.46 29.67 1pfg n ARG 52 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1pfg s ALA 53 N -1.75 2.56 -0.30 7.54 0.00 -1.25 -0.12 121.76 128.44 1pfg s ALA 53 Ca 0.29 -1.76 -0.23 0.00 0.00 0.00 0.00 51.96 50.26 1pfg s ALA 53 Cb 0.19 -0.26 0.18 0.00 0.00 0.00 0.00 23.12 23.24 1pfg s ALA 53 CO 0.13 0.30 1.33 1.14 0.00 0.00 0.00 175.76 178.66 1pfg s GLN 54 N -3.22 0.13 0.07 0.00 -2.07 -0.38 -4.83 119.66 109.35 1pfg s GLN 54 Ca 0.25 0.17 -0.31 0.00 -1.82 0.00 0.00 55.36 53.66 1pfg s GLN 54 Cb -0.06 0.05 -0.06 0.00 -1.09 0.00 0.00 33.01 31.86 1pfg s GLN 54 CO 0.12 -0.02 1.22 -1.64 -1.32 0.00 0.00 175.29 173.65 1pfg s MET 55 N 0.31 4.42 -0.01 9.60 -1.94 -1.26 -0.47 119.30 129.94 1pfg s MET 55 Ca 0.03 1.81 0.07 0.00 -1.71 0.00 0.00 55.69 55.88 1pfg s MET 55 Cb -0.04 -3.34 -0.10 0.00 2.01 0.00 0.00 34.83 33.36 1pfg s MET 55 CO -0.13 -0.28 0.14 0.28 -0.01 0.00 0.00 175.02 175.01 1pfg n VAL 56 N 3.93 0.03 -3.65 -6.03 0.31 0.42 -4.80 118.33 108.54 1pfg n VAL 56 Ca 0.09 -0.16 -0.03 0.00 -0.01 0.00 0.00 64.34 64.24 1pfg n VAL 56 Cb 0.46 0.27 -0.07 0.00 -0.91 0.00 0.00 33.84 33.60 1pfg n VAL 56 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1pfg s LYS 57 N -2.44 0.24 0.46 5.55 2.47 -1.15 -5.04 119.74 119.83 1pfg s LYS 57 Ca -0.02 0.35 0.06 0.00 -1.56 0.00 0.00 55.97 54.80 1pfg s LYS 57 Cb 0.04 0.08 -0.02 0.00 -1.46 0.00 0.00 37.83 36.48 1pfg s LYS 57 CO 0.27 -0.04 0.28 0.99 0.16 0.00 0.00 175.35 177.02 1pfg s THR 58 N 0.68 2.13 -0.13 3.43 2.01 -1.26 -0.80 115.64 121.70 1pfg s THR 58 Ca -0.02 -1.57 0.15 0.00 0.31 0.00 0.00 61.69 60.57 1pfg s THR 58 Cb -0.04 -2.70 0.29 0.00 0.01 0.00 0.00 72.50 70.07 1pfg s THR 58 CO -0.12 0.00 1.15 -1.22 -0.69 0.00 0.00 174.62 173.74 1pfg n TYR 59 N -1.47 0.00 -3.94 4.92 4.01 -0.22 -4.84 117.16 115.62 1pfg n TYR 59 Ca -0.01 -0.98 0.00 0.00 -0.16 0.00 0.00 57.90 56.75 1pfg n TYR 59 Cb 0.64 -0.16 0.00 0.00 -0.31 0.00 0.00 39.34 39.51 1pfg n TYR 59 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1pfg n TYR 60 N -1.14 0.00 -0.06 -0.72 4.01 -1.26 -5.05 117.16 112.94 1pfg n TYR 60 Ca 0.14 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.90 1pfg n TYR 60 Cb 0.68 0.00 0.32 0.00 -0.31 0.00 0.00 39.34 40.03 1pfg n TYR 60 CO 0.00 0.00 0.00 1.88 -0.46 0.00 0.00 176.86 178.28 1pfg h TYR 61 N 0.94 0.64 -4.10 -0.72 0.05 -2.00 -3.46 116.97 108.33 1pfg h TYR 61 Ca 0.00 -0.02 -0.10 0.00 0.05 0.00 0.00 58.73 58.66 1pfg h TYR 61 Cb 0.00 -0.21 -0.02 0.00 1.01 0.00 0.00 36.73 37.52 1pfg h TYR 61 CO 0.00 0.49 -0.08 0.45 -1.05 0.00 0.00 178.16 177.97 1pfg n SER 62 N -4.38 2.13 0.00 3.88 2.88 -1.26 -5.03 113.62 111.85 1pfg n SER 62 Ca 0.04 -1.35 0.00 0.00 -1.33 0.00 0.00 58.87 56.23 1pfg n SER 62 Cb 0.13 0.06 0.00 0.00 -0.75 0.00 0.00 64.21 63.65 1pfg n SER 62 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1pfg n SER 63 N -1.11 2.55 -4.66 -3.46 3.41 -1.26 -4.74 113.62 104.35 1pfg n SER 63 Ca -0.03 -0.13 -0.39 0.00 -0.26 0.00 0.00 58.87 58.06 1pfg n SER 63 Cb 0.10 0.78 0.04 0.00 -0.26 0.00 0.00 64.21 64.87 1pfg n SER 63 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1pfg n ARG 64 N -1.03 1.21 -3.03 4.33 0.63 -1.26 -4.54 116.66 112.97 1pfg n ARG 64 Ca 0.00 0.45 -0.41 0.00 -0.92 0.00 0.00 57.85 56.97 1pfg n ARG 64 Cb 0.00 -2.28 -0.05 0.00 0.45 0.00 0.00 32.46 30.58 1pfg n ARG 64 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1pfg s ASP 65 N -1.07 6.70 -0.12 6.15 -1.08 -1.26 -4.74 116.67 121.25 1pfg s ASP 65 Ca 0.73 0.86 0.15 0.00 -0.52 0.00 0.00 52.55 53.76 1pfg s ASP 65 Cb -0.44 -2.38 0.41 0.00 -1.46 0.00 0.00 42.92 39.05 1pfg s ASP 65 CO 0.49 -0.40 1.31 0.61 0.52 0.00 0.00 175.17 177.70 1pfg n GLY 66 N 3.93 3.87 0.68 2.66 0.00 -1.26 -4.72 105.19 110.34 1pfg n GLY 66 Ca 0.01 -0.86 -0.03 0.00 0.00 0.00 0.00 46.02 45.15 1pfg n GLY 66 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1pfg n ASN 67 N -0.48 1.31 0.00 1.61 2.85 -1.26 -4.92 115.26 114.37 1pfg n ASN 67 Ca 0.17 0.19 0.00 0.00 -0.11 0.00 0.00 54.58 54.83 1pfg n ASN 67 Cb 0.71 -0.46 0.00 0.00 1.24 0.00 0.00 39.78 41.27 1pfg n ASN 67 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1pfg n GLY 68 N 2.73 3.69 0.40 8.20 0.00 -1.26 -4.91 105.19 114.04 1pfg n GLY 68 Ca -0.05 -0.92 -0.08 0.00 0.00 0.00 0.00 46.02 44.98 1pfg n GLY 68 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1pfg h HIS 69 N 0.00 -1.43 -0.46 1.61 2.76 -1.95 0.15 115.15 115.84 1pfg h HIS 69 Ca 0.00 0.10 -0.07 0.00 -2.20 0.00 0.00 60.37 58.20 1pfg h HIS 69 Cb 0.00 0.73 -0.02 0.00 1.55 0.00 0.00 27.41 29.67 1pfg h HIS 69 CO 0.00 -0.41 -0.01 0.78 -1.30 0.00 0.00 177.93 176.99 1pfg h GLY 70 N -0.13 0.81 1.24 5.26 0.00 -1.92 0.33 103.07 108.66 1pfg h GLY 70 Ca 0.20 -0.54 -0.13 0.00 0.00 0.00 0.00 47.33 46.87 1pfg h GLY 70 CO -0.81 0.50 -0.25 -0.84 0.00 0.00 0.00 176.54 175.14 1pfg h THR 71 N 0.71 1.27 0.34 4.70 2.02 -1.42 2.09 112.91 122.62 1pfg h THR 71 Ca 0.14 -1.40 -0.02 0.00 0.77 0.00 0.00 66.41 65.91 1pfg h THR 71 Cb 0.44 1.22 -0.00 0.00 -1.74 0.00 0.00 68.15 68.07 1pfg h THR 71 CO 0.02 0.47 -0.20 -0.74 0.37 0.00 0.00 175.52 175.44 1pfg h HIS 72 N 0.74 -0.54 -0.50 3.16 6.17 0.63 1.18 115.15 126.00 1pfg h HIS 72 Ca 0.09 -0.01 0.10 0.00 0.71 0.00 0.00 60.37 61.27 1pfg h HIS 72 Cb 0.80 0.19 -0.10 0.00 2.52 0.00 0.00 27.41 30.82 1pfg h HIS 72 CO 0.05 -0.31 -0.22 0.00 0.71 0.00 0.00 177.93 178.16 1pfg h ALA 74 N 1.23 0.21 -0.77 0.00 0.00 0.38 -0.70 119.26 119.61 1pfg h ALA 74 Ca 0.23 0.17 0.10 0.00 0.00 0.00 0.00 54.91 55.41 1pfg h ALA 74 Cb 0.47 0.42 -0.12 0.00 0.00 0.00 0.00 17.79 18.56 1pfg h ALA 74 CO -0.57 -0.50 -0.49 0.78 0.00 0.00 0.00 179.25 178.48 1pfg h GLY 75 N -0.06 -0.53 2.00 0.00 0.00 0.28 0.20 103.07 104.96 1pfg h GLY 75 Ca 0.22 0.65 -0.10 0.00 0.00 0.00 0.00 47.33 48.10 1pfg h GLY 75 CO -0.49 -0.10 -0.46 -0.84 0.00 0.00 0.00 176.54 174.64 1pfg h THR 76 N -0.13 1.23 0.00 4.70 2.02 0.15 0.51 112.91 121.38 1pfg h THR 76 Ca 0.20 -1.65 -0.11 0.00 0.77 0.00 0.00 66.41 65.61 1pfg h THR 76 Cb 0.53 1.92 -0.02 0.00 -1.74 0.00 0.00 68.15 68.84 1pfg h THR 76 CO -0.82 0.46 -0.54 1.62 0.37 0.00 0.00 175.52 176.61 1pfg h VAL 77 N 0.00 1.02 0.00 3.16 3.04 0.06 -1.33 116.25 122.20 1pfg h VAL 77 Ca -0.00 -2.18 -0.07 0.00 -1.01 0.00 0.00 66.70 63.43 1pfg h VAL 77 Cb 0.88 2.32 -0.07 0.00 -2.01 0.00 0.00 31.29 32.42 1pfg h VAL 77 CO 0.06 0.53 -0.03 0.61 -1.01 0.00 0.00 177.57 177.73 1pfg n GLY 78 N 0.90 -0.12 3.87 3.17 0.00 -0.06 -2.13 105.19 110.81 1pfg n GLY 78 Ca 0.01 -0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 1pfg n GLY 78 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pfg s SER 79 N -0.37 6.60 0.23 1.61 1.04 0.17 -4.64 113.70 118.34 1pfg s SER 79 Ca 0.04 1.07 -0.15 0.00 0.48 0.00 0.00 55.95 57.39 1pfg s SER 79 Cb 0.14 -2.29 0.28 0.00 0.10 0.00 0.00 66.02 64.25 1pfg s SER 79 CO -0.04 -0.25 1.57 -0.09 0.98 0.00 0.00 173.24 175.41 1pfg h ARG 80 N 1.85 -0.03 0.00 4.02 2.43 -1.57 -2.33 114.38 118.75 1pfg h ARG 80 Ca -0.47 0.00 -0.42 0.00 -0.81 0.00 0.00 59.98 58.28 1pfg h ARG 80 Cb 1.18 0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 30.67 1pfg h ARG 80 CO 0.66 -0.02 -2.49 2.41 -1.51 0.00 0.00 179.97 179.02 1pfg n THR 81 N -5.50 1.51 1.61 0.20 -1.04 -1.26 -4.41 114.28 105.39 1pfg n THR 81 Ca 0.10 -0.51 0.06 0.00 -2.04 0.00 0.00 64.05 61.66 1pfg n THR 81 Cb 0.41 -1.59 0.25 0.00 -1.82 0.00 0.00 70.33 67.58 1pfg n THR 81 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1pfg n TYR 82 N -3.61 0.14 -4.42 -1.42 4.01 -1.25 -4.73 117.16 105.88 1pfg n TYR 82 Ca -0.49 -0.07 -0.23 0.00 -0.16 0.00 0.00 57.90 56.96 1pfg n TYR 82 Cb 0.95 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.88 1pfg n TYR 82 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1pfg s GLY 83 N -1.26 1.69 -0.01 2.72 0.00 -0.88 -4.22 107.32 105.37 1pfg s GLY 83 Ca 0.18 -1.75 -0.23 0.00 0.00 0.00 0.00 44.72 42.93 1pfg s GLY 83 CO 0.14 -1.83 1.05 -2.08 0.00 0.00 0.00 173.10 170.38 1pfg h VAL 84 N 2.57 0.54 -3.59 1.40 2.07 -1.30 -3.40 116.25 114.53 1pfg h VAL 84 Ca -0.40 -0.68 -0.74 0.00 0.82 0.00 0.00 66.70 65.69 1pfg h VAL 84 Cb 1.24 0.82 -0.30 0.00 -1.52 0.00 0.00 31.29 31.52 1pfg h VAL 84 CO 0.58 0.11 -0.18 -0.69 0.02 0.00 0.00 177.57 177.41 1pfg s VAL 85 N -4.18 4.63 -2.00 2.57 1.01 -0.90 -4.93 120.40 116.59 1pfg s VAL 85 Ca -0.13 -2.49 0.19 0.00 0.00 0.00 0.00 61.98 59.55 1pfg s VAL 85 Cb 0.01 -3.95 0.55 0.00 0.00 0.00 0.00 36.38 33.00 1pfg s VAL 85 CO 0.47 -0.92 1.55 0.29 0.00 0.00 0.00 175.10 176.49 1pfg n LYS 86 N 4.01 0.65 -0.08 2.72 5.02 -1.14 -3.14 118.16 126.20 1pfg n LYS 86 Ca 0.06 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.36 1pfg n LYS 86 Cb 0.42 -1.46 0.01 0.00 -0.02 0.00 0.00 35.03 33.98 1pfg n LYS 86 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1pfg n LYS 87 N -0.96 1.02 -1.12 1.97 5.02 0.71 -4.56 118.16 120.24 1pfg n LYS 87 Ca 0.14 -1.08 -0.30 0.00 -2.02 0.00 0.00 58.31 55.06 1pfg n LYS 87 Cb 0.07 -0.75 0.13 0.00 -0.02 0.00 0.00 35.03 34.46 1pfg n LYS 87 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1pfg s THR 88 N -0.58 2.76 -0.14 -0.18 -1.32 -1.19 -3.78 115.64 111.21 1pfg s THR 88 Ca 0.03 0.25 -0.04 0.00 -1.21 0.00 0.00 61.69 60.71 1pfg s THR 88 Cb 0.03 -2.65 -0.03 0.00 -1.51 0.00 0.00 72.50 68.34 1pfg s THR 88 CO 0.00 -0.32 0.01 -1.58 -2.21 0.00 0.00 174.62 170.52 1pfg s GLN 89 N -4.86 3.55 -0.06 7.08 2.00 -1.16 -4.92 119.66 121.28 1pfg s GLN 89 Ca 0.63 -0.42 0.04 0.00 -2.00 0.00 0.00 55.36 53.62 1pfg s GLN 89 Cb -0.19 -2.98 -0.02 0.00 0.80 0.00 0.00 33.01 30.63 1pfg s GLN 89 CO 0.57 0.42 -0.19 -0.51 -0.50 0.00 0.00 175.29 175.08 1pfg s LEU 90 N -0.08 2.46 -0.06 3.68 1.43 0.83 -1.39 118.68 125.55 1pfg s LEU 90 Ca 0.04 -0.34 0.05 0.00 -1.03 0.00 0.00 54.13 52.85 1pfg s LEU 90 Cb -0.13 -1.49 -0.00 0.00 0.03 0.00 0.00 46.19 44.60 1pfg s LEU 90 CO 0.02 0.28 -0.21 -0.36 0.23 0.00 0.00 176.35 176.31 1pfg s PHE 91 N -0.36 2.13 -0.10 0.29 0.40 -0.93 -1.25 117.98 118.16 1pfg s PHE 91 Ca 0.03 -0.69 -0.09 0.00 -0.60 0.00 0.00 56.93 55.58 1pfg s PHE 91 Cb -0.12 -1.42 -0.04 0.00 0.51 0.00 0.00 43.02 41.94 1pfg s PHE 91 CO 0.02 -0.25 0.19 0.20 0.70 0.00 0.00 175.22 176.09 1pfg s GLY 92 N 0.08 2.22 -0.10 4.36 0.00 0.38 -1.87 107.32 112.39 1pfg s GLY 92 Ca -0.08 -0.56 -0.00 0.00 0.00 0.00 0.00 44.72 44.08 1pfg s GLY 92 CO 0.04 -0.27 -0.07 0.14 0.00 0.00 0.00 173.10 172.95 1pfg s VAL 93 N -1.02 0.93 -0.45 1.40 1.01 -1.03 -0.44 120.40 120.80 1pfg s VAL 93 Ca 0.17 -0.24 -0.12 0.00 0.00 0.00 0.00 61.98 61.79 1pfg s VAL 93 Cb -0.13 -0.96 0.08 0.00 0.00 0.00 0.00 36.38 35.37 1pfg s VAL 93 CO 0.06 0.35 0.32 -0.75 0.00 0.00 0.00 175.10 175.08 1pfg s LYS 94 N 1.66 2.74 -0.03 2.72 2.20 0.02 -1.78 119.74 127.27 1pfg s LYS 94 Ca 0.03 -1.45 0.13 0.00 -0.36 0.00 0.00 55.97 54.32 1pfg s LYS 94 Cb -0.13 -3.93 -0.20 0.00 -1.51 0.00 0.00 37.83 32.06 1pfg s LYS 94 CO -0.07 -1.01 0.26 1.33 -0.36 0.00 0.00 175.35 175.50 1pfg n VAL 95 N 5.03 0.10 -4.27 4.02 0.24 0.02 -1.06 118.33 122.42 1pfg n VAL 95 Ca -0.11 -0.33 -0.35 0.00 -2.04 0.00 0.00 64.34 61.51 1pfg n VAL 95 Cb 0.43 0.09 -0.10 0.00 -1.47 0.00 0.00 33.84 32.79 1pfg n VAL 95 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1pfg s LEU 96 N -4.05 3.58 1.37 1.34 1.43 -0.59 -4.44 118.68 117.32 1pfg s LEU 96 Ca -0.05 0.07 -0.22 0.00 -1.03 0.00 0.00 54.13 52.90 1pfg s LEU 96 Cb 0.08 -1.85 0.35 0.00 0.03 0.00 0.00 46.19 44.79 1pfg s LEU 96 CO 0.55 0.27 0.97 1.51 0.23 0.00 0.00 176.35 179.88 1pfg s ASP 97 N -0.23 -0.61 0.00 2.29 3.84 0.53 -4.27 116.67 118.22 1pfg s ASP 97 Ca 0.06 0.86 0.00 0.00 -0.00 0.00 0.00 52.55 53.47 1pfg s ASP 97 Cb -0.12 -1.22 0.00 0.00 -1.38 0.00 0.00 42.92 40.19 1pfg s ASP 97 CO 0.02 -5.09 0.79 0.47 -0.00 0.00 0.00 175.17 171.37 1pfg n ASP 98 N -5.44 0.04 -0.20 2.11 8.00 -1.26 -0.53 116.55 119.27 1pfg n ASP 98 Ca 0.12 -1.63 0.05 0.00 0.71 0.00 0.00 54.79 54.04 1pfg n ASP 98 Cb 0.60 -0.02 -0.01 0.00 -0.02 0.00 0.00 41.12 41.66 1pfg n ASP 98 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1pfg n ASN 99 N -0.47 1.13 0.00 -2.24 3.02 -1.26 -4.23 115.26 111.22 1pfg n ASN 99 Ca 0.00 -1.07 0.00 0.00 -0.03 0.00 0.00 54.58 53.48 1pfg n ASN 99 Cb 0.01 0.56 0.00 0.00 -0.61 0.00 0.00 39.78 39.74 1pfg n ASN 99 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pfg n GLY 100 N 0.99 0.84 3.76 7.41 0.00 0.31 -5.08 105.19 113.42 1pfg n GLY 100 Ca 0.04 -0.25 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 1pfg n GLY 100 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pfg s SER 101 N -2.22 4.82 0.06 1.61 1.04 -1.25 -4.80 113.70 112.96 1pfg s SER 101 Ca 0.00 -0.70 -0.27 0.00 0.48 0.00 0.00 55.95 55.46 1pfg s SER 101 Cb 0.00 -0.79 0.07 0.00 0.10 0.00 0.00 66.02 65.40 1pfg s SER 101 CO 0.00 -0.30 0.65 -0.83 0.98 0.00 0.00 173.24 173.73 1pfg s GLY 102 N -3.88 -0.59 0.40 7.32 0.00 -1.26 0.20 107.32 109.50 1pfg s GLY 102 Ca 0.38 0.87 -0.02 0.00 0.00 0.00 0.00 44.72 45.96 1pfg s GLY 102 CO 0.23 0.51 0.64 1.20 0.00 0.00 0.00 173.10 175.68 1pfg s GLN 103 N -2.63 3.52 0.16 2.90 -0.21 -1.26 -4.97 119.66 117.17 1pfg s GLN 103 Ca -0.04 -0.11 -0.07 0.00 0.02 0.00 0.00 55.36 55.16 1pfg s GLN 103 Cb -0.01 -2.55 0.03 0.00 1.00 0.00 0.00 33.01 31.48 1pfg s GLN 103 CO -0.03 0.02 1.47 1.88 -2.12 0.00 0.00 175.29 176.50 1pfg h TYR 104 N 0.60 0.88 -0.89 0.91 0.05 -1.99 -1.67 116.97 114.86 1pfg h TYR 104 Ca -0.49 -0.31 -0.02 0.00 0.05 0.00 0.00 58.73 57.97 1pfg h TYR 104 Cb 1.21 -0.17 -0.04 0.00 1.01 0.00 0.00 36.73 38.74 1pfg h TYR 104 CO 0.54 1.08 0.49 0.66 -1.05 0.00 0.00 178.16 179.88 1pfg h SER 105 N 0.55 1.11 0.65 3.88 4.64 -1.97 1.67 113.55 124.07 1pfg h SER 105 Ca 0.02 -0.10 -0.09 0.00 -0.47 0.00 0.00 61.79 61.14 1pfg h SER 105 Cb 1.10 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.89 1pfg h SER 105 CO 0.11 0.89 -0.44 0.71 -0.87 0.00 0.00 176.83 177.23 1pfg h THR 106 N 1.24 1.13 -0.03 2.95 1.35 -1.88 0.50 112.91 118.18 1pfg h THR 106 Ca 0.31 -1.62 -0.20 0.00 -0.55 0.00 0.00 66.41 64.35 1pfg h THR 106 Cb 0.03 1.92 -0.00 0.00 -1.73 0.00 0.00 68.15 68.36 1pfg h THR 106 CO -0.05 0.43 -0.84 0.16 -0.25 0.00 0.00 175.52 174.97 1pfg h ILE 107 N 0.00 1.41 -0.07 6.82 -0.00 -0.95 0.68 117.51 125.41 1pfg h ILE 107 Ca -0.00 -2.36 0.01 0.00 -0.00 0.00 0.00 64.86 62.51 1pfg h ILE 107 Cb 0.88 2.30 -0.01 0.00 -0.00 0.00 0.00 36.82 39.99 1pfg h ILE 107 CO 0.06 0.70 -0.01 0.40 -0.00 0.00 0.00 178.15 179.30 1pfg h ILE 108 N 0.22 0.94 -0.31 0.16 2.04 0.33 0.14 117.51 121.03 1pfg h ILE 108 Ca -0.05 -0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.87 1pfg h ILE 108 Cb 1.45 0.93 -0.07 0.00 -0.74 0.00 0.00 36.82 38.39 1pfg h ILE 108 CO 0.14 0.00 -0.16 0.00 0.00 0.00 0.00 178.15 178.13 1pfg h ALA 109 N 1.06 0.08 -0.41 1.87 0.00 0.03 0.21 119.26 122.11 1pfg h ALA 109 Ca 0.03 0.11 0.10 0.00 0.00 0.00 0.00 54.91 55.16 1pfg h ALA 109 Cb 0.04 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1pfg h ALA 109 CO -0.06 -0.55 0.29 0.78 0.00 0.00 0.00 179.25 179.70 1pfg h GLY 110 N -0.12 0.11 0.48 0.00 0.00 0.16 0.98 103.07 104.68 1pfg h GLY 110 Ca 0.16 -0.03 -0.10 0.00 0.00 0.00 0.00 47.33 47.36 1pfg h GLY 110 CO -0.38 0.02 -0.40 -0.33 0.00 0.00 0.00 176.54 175.44 1pfg h MET 111 N 0.08 0.21 0.00 4.80 2.07 0.20 -1.44 114.93 120.85 1pfg h MET 111 Ca 0.19 -0.27 -0.01 0.00 -2.07 0.00 0.00 59.70 57.54 1pfg h MET 111 Cb 0.66 0.09 -0.00 0.00 -1.87 0.00 0.00 31.60 30.48 1pfg h MET 111 CO -0.02 1.05 -0.03 -0.44 1.07 0.00 0.00 176.91 178.54 1pfg h ASP 112 N -0.50 0.00 0.31 1.22 3.45 -0.46 -2.44 116.42 118.00 1pfg h ASP 112 Ca -0.06 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.38 1pfg h ASP 112 Cb 1.22 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.99 1pfg h ASP 112 CO 0.08 0.03 -0.15 0.15 -1.57 0.00 0.00 179.24 177.78 1pfg h PHE 113 N 0.00 -0.38 -0.02 4.55 3.04 -0.56 -2.03 116.94 121.54 1pfg h PHE 113 Ca -0.00 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.93 1pfg h PHE 113 Cb 0.07 0.13 -0.00 0.00 2.56 0.00 0.00 35.95 38.70 1pfg h PHE 113 CO 0.00 -0.03 -0.04 -0.24 -2.02 0.00 0.00 178.31 175.97 1pfg h VAL 114 N -0.89 1.04 -0.57 1.41 3.04 -1.00 0.17 116.25 119.44 1pfg h VAL 114 Ca -0.04 -0.19 0.02 0.00 -1.01 0.00 0.00 66.70 65.48 1pfg h VAL 114 Cb 0.52 1.08 -0.03 0.00 -2.01 0.00 0.00 31.29 30.85 1pfg h VAL 114 CO 0.07 0.06 0.38 0.00 -1.01 0.00 0.00 177.57 177.07 1pfg h ALA 115 N 1.94 1.66 0.00 3.17 0.00 -1.10 -0.76 119.26 124.16 1pfg h ALA 115 Ca 0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1pfg h ALA 115 Cb 0.09 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1pfg h ALA 115 CO 0.01 0.29 -0.24 1.03 0.00 0.00 0.00 179.25 180.33 1pfg h SER 116 N 0.71 0.00 -0.62 0.00 0.87 -0.12 -3.39 113.55 110.99 1pfg h SER 116 Ca 0.22 -0.38 0.14 0.00 -1.23 0.00 0.00 61.79 60.54 1pfg h SER 116 Cb 0.02 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 61.95 1pfg h SER 116 CO -0.06 0.83 0.43 -0.78 -0.53 0.00 0.00 176.83 176.72 1pfg h ASP 117 N -1.00 0.21 -0.16 6.23 3.58 -0.78 0.58 116.42 125.09 1pfg h ASP 117 Ca -0.04 0.01 0.03 0.00 0.42 0.00 0.00 57.03 57.44 1pfg h ASP 117 Cb 0.56 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.57 1pfg h ASP 117 CO -0.03 0.12 0.11 0.07 -2.88 0.00 0.00 179.24 176.63 1pfg h LYS 118 N 0.23 0.09 0.00 0.28 2.10 -1.33 -0.47 116.57 117.47 1pfg h LYS 118 Ca 0.30 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.94 1pfg h LYS 118 Cb 0.86 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.17 1pfg h LYS 118 CO -0.06 0.06 0.00 0.09 -2.00 0.00 0.00 179.45 177.54 1pfg n ASN 119 N -4.51 0.00 -1.97 7.07 4.13 0.20 -1.75 115.26 118.44 1pfg n ASN 119 Ca 0.00 0.43 -0.14 0.00 1.68 0.00 0.00 54.58 56.55 1pfg n ASN 119 Cb 0.17 -0.44 0.05 0.00 -1.54 0.00 0.00 39.78 38.02 1pfg n ASN 119 CO 0.00 0.00 0.00 -0.46 0.28 0.00 0.00 177.26 177.08 1pfg n ASN 120 N -1.44 3.68 -4.30 6.41 0.23 -0.19 -4.98 115.26 114.66 1pfg n ASN 120 Ca 0.01 -3.36 -0.16 0.00 -0.53 0.00 0.00 54.58 50.54 1pfg n ASN 120 Cb 0.04 -0.39 -0.10 0.00 -2.08 0.00 0.00 39.78 37.25 1pfg n ASN 120 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1pfg s ARG 121 N -3.44 1.32 -0.88 -3.83 0.52 -0.71 -5.08 118.95 106.83 1pfg s ARG 121 Ca 0.44 -1.68 -0.09 0.00 -0.52 0.00 0.00 55.73 53.87 1pfg s ARG 121 Cb 0.39 -0.38 0.23 0.00 0.52 0.00 0.00 34.95 35.70 1pfg s ARG 121 CO 0.00 -0.19 0.81 1.21 0.02 0.00 0.00 175.30 177.15 1pfg s ASN 122 N -3.28 6.58 -0.62 0.23 2.47 -1.26 -4.87 114.94 114.19 1pfg s ASN 122 Ca 0.31 -3.09 0.06 0.00 0.42 0.00 0.00 52.86 50.56 1pfg s ASN 122 Cb 0.07 -2.12 0.26 0.00 -1.45 0.00 0.00 41.25 38.01 1pfg s ASN 122 CO 0.10 -0.41 0.75 0.00 -3.72 0.00 0.00 177.10 173.81 1pfg h PRO 124 N 4.09 0.31 -0.01 0.00 0.11 -1.76 -2.72 132.00 132.02 1pfg h PRO 124 Ca 0.19 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1pfg h PRO 124 Cb 0.66 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.70 1pfg h PRO 124 CO 0.82 0.20 -0.43 1.63 -0.21 0.00 0.00 178.00 180.01 1pfg n LYS 125 N -4.49 0.84 0.00 1.05 4.76 -0.18 -4.97 118.16 115.17 1pfg n LYS 125 Ca 0.22 -0.61 0.00 0.00 -2.87 0.00 0.00 58.31 55.05 1pfg n LYS 125 Cb 0.85 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 32.55 1pfg n LYS 125 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1pfg n GLY 126 N 1.40 2.22 3.16 0.72 0.00 -1.03 -4.04 105.19 107.61 1pfg n GLY 126 Ca 0.10 -1.82 -0.12 0.00 0.00 0.00 0.00 46.02 44.18 1pfg n GLY 126 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pfg s VAL 127 N -1.56 -0.02 0.25 1.61 1.01 -1.26 -2.13 120.40 118.30 1pfg s VAL 127 Ca 0.00 0.08 0.09 0.00 0.00 0.00 0.00 61.98 62.14 1pfg s VAL 127 Cb 0.00 -0.45 -0.05 0.00 0.00 0.00 0.00 36.38 35.88 1pfg s VAL 127 CO 0.00 0.03 -0.13 -0.69 0.00 0.00 0.00 175.10 174.31 1pfg s VAL 128 N 0.85 1.92 -0.03 2.92 1.01 -0.13 -1.46 120.40 125.49 1pfg s VAL 128 Ca -0.06 -2.23 -0.03 0.00 0.00 0.00 0.00 61.98 59.67 1pfg s VAL 128 Cb -0.07 -2.26 0.01 0.00 0.00 0.00 0.00 36.38 34.06 1pfg s VAL 128 CO -0.06 -0.44 0.07 0.00 0.00 0.00 0.00 175.10 174.67 1pfg s ALA 129 N -2.85 -0.17 -0.19 5.51 0.00 0.43 -2.02 121.76 122.46 1pfg s ALA 129 Ca 0.27 0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.41 1pfg s ALA 129 Cb -0.00 -0.11 0.05 0.00 0.00 0.00 0.00 23.12 23.06 1pfg s ALA 129 CO 0.11 -0.04 -0.07 0.45 0.00 0.00 0.00 175.76 176.21 1pfg s SER 130 N -0.02 3.23 -0.57 0.00 0.15 0.26 -1.77 113.70 114.99 1pfg s SER 130 Ca -0.01 -0.85 -0.02 0.00 0.70 0.00 0.00 55.95 55.77 1pfg s SER 130 Cb -0.01 -1.06 0.15 0.00 -1.71 0.00 0.00 66.02 63.39 1pfg s SER 130 CO 0.00 -0.19 0.37 -0.76 1.20 0.00 0.00 173.24 173.87 1pfg s LEU 131 N 1.52 5.19 -1.25 3.45 1.02 -0.28 -2.22 118.68 126.11 1pfg s LEU 131 Ca -0.01 -2.66 -0.07 0.00 0.02 0.00 0.00 54.13 51.41 1pfg s LEU 131 Cb -0.16 -1.84 0.18 0.00 0.02 0.00 0.00 46.19 44.39 1pfg s LEU 131 CO -0.08 -0.41 1.97 -1.20 0.02 0.00 0.00 176.35 176.66 1pfg n SER 132 N 3.74 6.28 -3.73 2.29 7.64 -1.26 -2.50 113.62 126.08 1pfg n SER 132 Ca 0.05 -3.20 -0.06 0.00 1.01 0.00 0.00 58.87 56.68 1pfg n SER 132 Cb 0.38 -1.40 -0.02 0.00 -1.01 0.00 0.00 64.21 62.17 1pfg n SER 132 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 1pfg s LEU 133 N -1.34 -0.25 0.00 -3.43 -0.00 -1.26 -4.92 118.68 107.48 1pfg s LEU 133 Ca 0.43 -0.39 0.00 0.00 -0.00 0.00 0.00 54.13 54.17 1pfg s LEU 133 Cb 0.12 2.33 0.00 0.00 -0.00 0.00 0.00 46.19 48.64 1pfg s LEU 133 CO -0.02 -1.00 0.00 0.61 -0.00 0.00 0.00 176.35 175.94 1pfg n GLY 134 N -0.44 0.24 0.00 -3.48 0.00 -1.26 -4.59 105.19 95.67 1pfg n GLY 134 Ca -0.07 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.84 1pfg n GLY 134 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pfg n GLY 135 N -0.67 2.64 3.76 -0.02 0.00 -1.17 -4.99 105.19 104.73 1pfg n GLY 135 Ca 0.00 -0.74 -0.33 0.00 0.00 0.00 0.00 46.02 44.95 1pfg n GLY 135 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pfg s GLY 136 N -0.18 2.14 0.15 -0.02 0.00 -1.26 0.22 107.32 108.37 1pfg s GLY 136 Ca 0.00 0.61 -0.34 0.00 0.00 0.00 0.00 44.72 44.99 1pfg s GLY 136 CO 0.00 0.97 1.17 2.98 0.00 0.00 0.00 173.10 178.22 1pfg n TYR 137 N -2.64 1.24 -3.75 1.90 9.36 -0.64 -3.72 117.16 118.91 1pfg n TYR 137 Ca 0.11 0.70 -0.12 0.00 3.32 0.00 0.00 57.90 61.91 1pfg n TYR 137 Cb 0.52 -2.27 -0.11 0.00 -0.63 0.00 0.00 39.34 36.85 1pfg n TYR 137 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1pfg s SER 138 N 0.04 -0.35 0.00 2.98 0.15 -1.26 -4.85 113.70 110.41 1pfg s SER 138 Ca 0.75 0.66 0.28 0.00 0.70 0.00 0.00 55.95 58.35 1pfg s SER 138 Cb -0.89 0.63 1.10 0.00 -1.71 0.00 0.00 66.02 65.15 1pfg s SER 138 CO 0.52 -0.13 1.81 -1.54 1.20 0.00 0.00 173.24 175.09 1pfg n SER 139 N 3.35 0.25 -0.00 5.45 3.41 -1.26 -1.48 113.62 123.34 1pfg n SER 139 Ca -0.17 -0.04 -0.11 0.00 -0.26 0.00 0.00 58.87 58.29 1pfg n SER 139 Cb 0.57 -0.19 -0.14 0.00 -0.26 0.00 0.00 64.21 64.19 1pfg n SER 139 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1pfg h SER 140 N 0.16 0.09 -0.06 4.04 0.02 -1.97 -2.15 113.55 113.69 1pfg h SER 140 Ca 0.00 -0.18 -0.07 0.00 -0.84 0.00 0.00 61.79 60.71 1pfg h SER 140 Cb 0.44 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.93 1pfg h SER 140 CO 0.00 1.16 -0.14 0.58 -1.14 0.00 0.00 176.83 177.28 1pfg h VAL 141 N 0.02 1.22 -0.03 2.27 2.07 -1.77 0.57 116.25 120.59 1pfg h VAL 141 Ca -0.27 -0.97 -0.19 0.00 0.82 0.00 0.00 66.70 66.09 1pfg h VAL 141 Cb 1.99 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 32.96 1pfg h VAL 141 CO 0.09 0.31 -0.79 0.78 0.02 0.00 0.00 177.57 177.98 1pfg h ASN 142 N 0.36 0.36 0.03 0.57 4.21 -1.28 -1.94 115.58 117.89 1pfg h ASN 142 Ca 0.07 -0.26 -0.00 0.00 1.21 0.00 0.00 56.30 57.32 1pfg h ASN 142 Cb 0.47 -0.11 0.00 0.00 -1.12 0.00 0.00 38.32 37.56 1pfg h ASN 142 CO 0.03 1.01 -0.01 -1.28 -1.29 0.00 0.00 177.43 175.89 1pfg h SER 143 N 0.18 -0.03 -0.38 5.81 0.87 -0.66 0.47 113.55 119.81 1pfg h SER 143 Ca -0.04 -0.22 0.06 0.00 -1.23 0.00 0.00 61.79 60.36 1pfg h SER 143 Cb 1.38 0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 63.30 1pfg h SER 143 CO 0.13 0.20 0.07 0.00 -0.53 0.00 0.00 176.83 176.70 1pfg h ALA 144 N 0.71 0.41 -0.47 6.23 0.00 0.54 1.40 119.26 128.07 1pfg h ALA 144 Ca -0.00 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1pfg h ALA 144 Cb 0.24 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1pfg h ALA 144 CO 0.01 -0.33 0.19 0.00 0.00 0.00 0.00 179.25 179.11 1pfg h ALA 145 N 1.29 0.61 -0.11 0.00 0.00 -1.10 0.32 119.26 120.27 1pfg h ALA 145 Ca 0.18 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 1pfg h ALA 145 Cb 0.22 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1pfg h ALA 145 CO -0.24 0.21 -0.50 0.00 0.00 0.00 0.00 179.25 178.72 1pfg h ALA 146 N 1.03 0.95 -0.07 0.00 0.00 0.20 0.40 119.26 121.77 1pfg h ALA 146 Ca 0.16 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 1pfg h ALA 146 Cb 0.19 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1pfg h ALA 146 CO -0.01 0.66 0.03 0.00 0.00 0.00 0.00 179.25 179.93 1pfg h ARG 147 N 0.23 0.11 -0.29 0.00 3.08 0.27 0.18 114.38 117.96 1pfg h ARG 147 Ca 0.01 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.09 1pfg h ARG 147 Cb 0.96 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.95 1pfg h ARG 147 CO 0.08 0.21 0.03 1.25 -1.07 0.00 0.00 179.97 180.47 1pfg h LEU 148 N -0.03 -0.06 -0.78 3.04 5.85 -0.07 0.55 115.31 123.82 1pfg h LEU 148 Ca 0.02 0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.72 1pfg h LEU 148 Cb 0.15 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 1pfg h LEU 148 CO -0.00 0.01 0.05 -0.61 -0.34 0.00 0.00 178.44 177.54 1pfg h GLN 149 N 0.12 0.97 0.00 1.25 5.75 0.19 -2.37 115.11 121.02 1pfg h GLN 149 Ca 0.14 -0.27 -0.14 0.00 -0.15 0.00 0.00 58.65 58.23 1pfg h GLN 149 Cb 0.17 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.59 1pfg h GLN 149 CO -0.21 0.93 -0.66 0.66 -2.65 0.00 0.00 178.83 176.91 1pfg h SER 150 N 0.90 0.00 0.14 -0.69 4.64 -0.04 -1.67 113.55 116.83 1pfg h SER 150 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1pfg h SER 150 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1pfg h SER 150 CO 0.02 0.66 0.00 -1.54 -0.87 0.00 0.00 176.83 175.09 1pfg n SER 151 N -3.46 0.00 0.00 4.97 3.41 0.19 -4.81 113.62 113.91 1pfg n SER 151 Ca 0.00 0.15 0.00 0.00 -0.26 0.00 0.00 58.87 58.76 1pfg n SER 151 Cb 0.72 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1pfg n SER 151 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pfg n GLY 152 N -0.62 1.48 3.68 5.00 0.00 -0.64 -5.06 105.19 109.03 1pfg n GLY 152 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 1pfg n GLY 152 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pfg s VAL 153 N -2.00 3.84 -0.78 1.61 1.01 -1.06 -4.67 120.40 118.35 1pfg s VAL 153 Ca 0.00 -1.33 -0.16 0.00 0.00 0.00 0.00 61.98 60.49 1pfg s VAL 153 Cb 0.00 -2.92 0.18 0.00 0.00 0.00 0.00 36.38 33.64 1pfg s VAL 153 CO 0.00 -0.08 0.78 -0.32 0.00 0.00 0.00 175.10 175.48 1pfg s MET 154 N -2.88 3.45 -0.32 2.72 1.75 -0.53 -4.40 119.30 119.09 1pfg s MET 154 Ca 0.28 -2.11 -0.29 0.00 -1.25 0.00 0.00 55.69 52.32 1pfg s MET 154 Cb -0.10 -4.47 0.01 0.00 2.84 0.00 0.00 34.83 33.11 1pfg s MET 154 CO 0.19 -1.41 1.25 0.08 -0.65 0.00 0.00 175.02 174.48 1pfg s VAL 155 N 1.08 4.21 -0.14 10.11 1.01 -1.26 -0.43 120.40 134.98 1pfg s VAL 155 Ca 0.18 1.36 -0.07 0.00 0.00 0.00 0.00 61.98 63.44 1pfg s VAL 155 Cb -0.14 -4.25 -0.04 0.00 0.00 0.00 0.00 36.38 31.95 1pfg s VAL 155 CO -0.06 -0.54 0.10 0.00 0.00 0.00 0.00 175.10 174.61 1pfg s ALA 156 N 4.28 3.66 -0.09 5.51 0.00 -0.73 -2.28 121.76 132.11 1pfg s ALA 156 Ca 0.53 -0.69 -0.01 0.00 0.00 0.00 0.00 51.96 51.79 1pfg s ALA 156 Cb -0.15 -1.93 0.03 0.00 0.00 0.00 0.00 23.12 21.07 1pfg s ALA 156 CO 0.23 0.44 -0.05 0.08 0.00 0.00 0.00 175.76 176.46 1pfg s VAL 157 N -0.46 0.76 0.18 0.00 1.01 -0.51 -1.13 120.40 120.26 1pfg s VAL 157 Ca 0.11 -0.13 -0.32 0.00 0.00 0.00 0.00 61.98 61.64 1pfg s VAL 157 Cb -0.12 -0.83 -0.11 0.00 0.00 0.00 0.00 36.38 35.32 1pfg s VAL 157 CO 0.02 0.32 1.71 0.00 0.00 0.00 0.00 175.10 177.14 1pfg s ALA 158 N 1.74 3.87 0.54 5.51 0.00 -1.04 0.21 121.76 132.58 1pfg s ALA 158 Ca 0.04 1.50 0.26 0.00 0.00 0.00 0.00 51.96 53.76 1pfg s ALA 158 Cb -0.13 -3.69 1.60 0.00 0.00 0.00 0.00 23.12 20.90 1pfg s ALA 158 CO -0.06 -0.95 2.18 0.00 0.00 0.00 0.00 175.76 176.93 1pfg h ALA 159 N 7.17 1.57 0.00 0.00 0.00 0.30 -3.40 119.26 124.90 1pfg h ALA 159 Ca -0.43 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1pfg h ALA 159 Cb 1.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1pfg h ALA 159 CO 0.95 0.05 0.00 0.41 0.00 0.00 0.00 179.25 180.65 1pfg n GLY 160 N -1.21 1.82 0.76 0.00 0.00 -1.26 -4.71 105.19 100.59 1pfg n GLY 160 Ca -0.03 -2.13 0.06 0.00 0.00 0.00 0.00 46.02 43.92 1pfg n GLY 160 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1pfg n ASN 161 N 0.00 1.53 -1.42 1.61 3.02 -1.26 -2.16 115.26 116.57 1pfg n ASN 161 Ca 0.00 -3.28 0.09 0.00 -0.03 0.00 0.00 54.58 51.36 1pfg n ASN 161 Cb 0.00 -0.45 0.33 0.00 -0.61 0.00 0.00 39.78 39.05 1pfg n ASN 161 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1pfg n ASN 162 N -0.71 4.57 -3.41 6.41 5.03 -1.15 -4.71 115.26 121.29 1pfg n ASN 162 Ca 0.15 -2.54 -0.22 0.00 0.87 0.00 0.00 54.58 52.83 1pfg n ASN 162 Cb 0.80 -0.55 -0.02 0.00 -1.02 0.00 0.00 39.78 38.99 1pfg n ASN 162 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1pfg n ASN 163 N 0.76 -2.79 -1.68 6.41 5.15 0.29 -4.85 115.26 118.54 1pfg n ASN 163 Ca 0.24 -0.38 0.00 0.00 -0.60 0.00 0.00 54.58 53.84 1pfg n ASN 163 Cb 0.88 -2.37 0.00 0.00 -0.53 0.00 0.00 39.78 37.76 1pfg n ASN 163 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1pfg n ALA 164 N -3.39 0.00 -2.65 5.20 0.00 -1.26 -4.80 120.51 113.61 1pfg n ALA 164 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.03 1pfg n ALA 164 Cb 0.52 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.93 1pfg n ALA 164 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1pfg s ASP 165 N -0.75 6.87 0.00 0.00 2.15 -1.25 0.11 116.67 123.81 1pfg s ASP 165 Ca 0.00 1.09 0.00 0.00 0.43 0.00 0.00 52.55 54.07 1pfg s ASP 165 Cb 0.00 -2.45 0.00 0.00 -0.30 0.00 0.00 42.92 40.17 1pfg s ASP 165 CO 0.00 -0.54 0.35 0.00 -0.17 0.00 0.00 175.17 174.81 1pfg n ALA 166 N 6.04 1.34 0.11 3.66 0.00 0.23 -3.62 120.51 128.28 1pfg n ALA 166 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1pfg n ALA 166 Cb 0.47 -0.90 0.31 0.00 0.00 0.00 0.00 19.45 19.34 1pfg n ALA 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pfg h ARG 167 N 0.00 0.21 -0.67 0.00 3.08 -1.92 -2.73 114.38 112.36 1pfg h ARG 167 Ca 0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1pfg h ARG 167 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.03 1pfg h ARG 167 CO 0.00 0.48 0.00 0.09 -1.07 0.00 0.00 179.97 179.47 1pfg n ASN 168 N -4.14 3.55 -4.23 7.04 5.03 -1.24 -4.78 115.26 116.49 1pfg n ASN 168 Ca -0.01 -2.42 -0.25 0.00 0.87 0.00 0.00 54.58 52.77 1pfg n ASN 168 Cb 0.38 -0.53 -0.14 0.00 -1.02 0.00 0.00 39.78 38.46 1pfg n ASN 168 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 1pfg s TYR 169 N -1.90 1.72 -0.13 3.10 1.51 -1.03 -1.63 117.35 118.99 1pfg s TYR 169 Ca 0.33 -0.37 0.01 0.00 -1.01 0.00 0.00 57.07 56.03 1pfg s TYR 169 Cb 0.23 -1.03 0.02 0.00 -0.11 0.00 0.00 41.96 41.07 1pfg s TYR 169 CO 0.13 0.08 -0.15 -1.12 -1.11 0.00 0.00 175.55 173.37 1pfg s SER 170 N -1.15 2.60 0.00 2.29 0.01 0.13 -1.02 113.70 116.57 1pfg s SER 170 Ca 0.07 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 56.86 1pfg s SER 170 Cb -0.09 -1.16 0.00 0.00 0.21 0.00 0.00 66.02 64.98 1pfg s SER 170 CO 0.02 -0.01 0.00 -2.65 0.41 0.00 0.00 173.24 171.01 1pfg n PRO 171 N 4.41 0.00 -0.34 12.44 -0.02 -1.26 -3.05 135.00 147.18 1pfg n PRO 171 Ca -0.18 0.00 0.15 0.00 -2.02 0.00 0.00 63.50 61.44 1pfg n PRO 171 Cb 0.51 0.00 0.29 0.00 -0.02 0.00 0.00 33.50 34.28 1pfg n PRO 171 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pfg n ALA 172 N 0.00 0.51 -0.25 3.55 0.00 -1.23 0.56 120.51 123.64 1pfg n ALA 172 Ca 0.00 1.04 0.03 0.00 0.00 0.00 0.00 53.44 54.51 1pfg n ALA 172 Cb 0.00 -0.76 0.25 0.00 0.00 0.00 0.00 19.45 18.93 1pfg n ALA 172 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1pfg n SER 173 N -5.44 4.02 -4.42 0.00 3.41 -0.18 -4.52 113.62 106.49 1pfg n SER 173 Ca 0.23 -2.65 -0.44 0.00 -0.26 0.00 0.00 58.87 55.75 1pfg n SER 173 Cb 0.76 -0.63 -0.04 0.00 -0.26 0.00 0.00 64.21 64.04 1pfg n SER 173 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1pfg s GLU 174 N -2.14 3.25 0.40 4.33 2.56 0.19 -4.81 118.70 122.48 1pfg s GLU 174 Ca 0.36 -1.37 0.17 0.00 0.00 0.00 0.00 54.97 54.13 1pfg s GLU 174 Cb 0.27 -4.45 1.06 0.00 2.00 0.00 0.00 34.13 33.02 1pfg s GLU 174 CO 0.10 -1.68 1.81 -1.00 -0.56 0.00 0.00 175.26 173.94 1pfg h PRO 175 N 9.11 0.42 0.00 4.30 0.13 -1.83 0.12 132.00 144.25 1pfg h PRO 175 Ca -0.14 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1pfg h PRO 175 Cb 1.06 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.10 1pfg h PRO 175 CO 1.11 0.28 0.00 -1.13 -0.23 0.00 0.00 178.00 178.02 1pfg n SER 176 N -4.57 0.58 -0.90 1.44 3.41 -1.26 -4.72 113.62 107.60 1pfg n SER 176 Ca 0.22 0.72 0.00 0.00 -0.26 0.00 0.00 58.87 59.55 1pfg n SER 176 Cb 0.76 -0.82 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 1pfg n SER 176 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1pfg n VAL 177 N -2.23 0.00 -3.91 -3.33 0.24 0.41 -5.01 118.33 104.50 1pfg n VAL 177 Ca -0.00 0.00 -0.28 0.00 -2.04 0.00 0.00 64.34 62.01 1pfg n VAL 177 Cb 0.10 -1.22 -0.12 0.00 -1.47 0.00 0.00 33.84 31.12 1pfg n VAL 177 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1pfg s THR 179 N -1.19 2.66 -0.10 0.00 2.01 -1.25 -1.42 115.64 116.34 1pfg s THR 179 Ca 0.23 0.54 0.02 0.00 0.31 0.00 0.00 61.69 62.79 1pfg s THR 179 Cb -0.09 -3.34 -0.01 0.00 0.01 0.00 0.00 72.50 69.06 1pfg s THR 179 CO -0.13 0.08 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.02 1pfg s VAL 180 N 0.19 2.72 0.47 3.82 1.01 0.57 -2.33 120.40 126.85 1pfg s VAL 180 Ca 0.61 -0.80 0.07 0.00 0.00 0.00 0.00 61.98 61.87 1pfg s VAL 180 Cb -0.42 -2.10 0.03 0.00 0.00 0.00 0.00 36.38 33.89 1pfg s VAL 180 CO 0.41 0.55 0.64 -0.83 0.00 0.00 0.00 175.10 175.87 1pfg s GLY 181 N 0.12 1.90 0.07 4.51 0.00 0.13 0.94 107.32 115.00 1pfg s GLY 181 Ca -0.08 -1.71 0.05 0.00 0.00 0.00 0.00 44.72 42.98 1pfg s GLY 181 CO 0.05 -1.46 -0.04 0.00 0.00 0.00 0.00 173.10 171.65 1pfg s ALA 182 N -2.46 3.15 0.25 3.20 0.00 -1.26 -0.38 121.76 124.26 1pfg s ALA 182 Ca 0.57 -1.11 0.11 0.00 0.00 0.00 0.00 51.96 51.52 1pfg s ALA 182 Cb -0.09 -1.12 -0.05 0.00 0.00 0.00 0.00 23.12 21.86 1pfg s ALA 182 CO 0.35 0.66 -0.18 -1.54 0.00 0.00 0.00 175.76 175.05 1pfg s SER 183 N -2.03 3.25 0.47 0.00 1.04 0.12 -0.65 113.70 115.91 1pfg s SER 183 Ca 0.22 -1.02 0.07 0.00 0.48 0.00 0.00 55.95 55.71 1pfg s SER 183 Cb -0.11 -0.24 0.08 0.00 0.10 0.00 0.00 66.02 65.84 1pfg s SER 183 CO 0.14 -0.02 0.65 -0.90 0.98 0.00 0.00 173.24 174.09 1pfg n ASP 184 N -0.49 1.64 0.00 7.02 5.68 -0.01 -1.68 116.55 128.70 1pfg n ASP 184 Ca -0.06 -2.20 0.13 0.00 -0.50 0.00 0.00 54.79 52.15 1pfg n ASP 184 Cb 0.60 -0.35 0.71 0.00 -1.14 0.00 0.00 41.12 40.94 1pfg n ASP 184 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 1pfg n ARG 185 N -2.04 0.58 -0.46 0.11 1.85 -1.26 -2.16 116.66 113.28 1pfg n ARG 185 Ca 0.13 0.02 0.11 0.00 -1.00 0.00 0.00 57.85 57.11 1pfg n ARG 185 Cb 0.48 -1.50 0.33 0.00 -1.05 0.00 0.00 32.46 30.72 1pfg n ARG 185 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1pfg n TYR 186 N -1.15 1.16 -1.08 2.89 4.02 -1.26 -4.52 117.16 117.21 1pfg n TYR 186 Ca 0.16 -0.52 -0.03 0.00 -0.01 0.00 0.00 57.90 57.49 1pfg n TYR 186 Cb 0.15 -0.09 -0.01 0.00 -0.02 0.00 0.00 39.34 39.37 1pfg n TYR 186 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 1pfg n ASP 187 N 1.45 -3.34 -4.89 7.72 10.43 -0.92 -4.86 116.55 122.14 1pfg n ASP 187 Ca 0.25 0.07 -0.31 0.00 2.57 0.00 0.00 54.79 57.37 1pfg n ASP 187 Cb 0.71 -1.08 -0.04 0.00 1.84 0.00 0.00 41.12 42.55 1pfg n ASP 187 CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 1pfg s ARG 188 N -2.22 3.68 0.36 -1.24 0.52 -1.26 0.10 118.95 118.89 1pfg s ARG 188 Ca 0.00 0.04 -0.28 0.00 -0.52 0.00 0.00 55.73 54.97 1pfg s ARG 188 Cb 0.00 -2.73 -0.11 0.00 0.52 0.00 0.00 34.95 32.63 1pfg s ARG 188 CO 0.00 0.35 1.50 0.50 0.02 0.00 0.00 175.30 177.67 1pfg s ARG 189 N -2.97 4.12 0.32 3.54 3.52 0.23 -0.83 118.95 126.87 1pfg s ARG 189 Ca 0.44 2.57 -0.29 0.00 -0.13 0.00 0.00 55.73 58.31 1pfg s ARG 189 Cb -0.11 -2.98 -0.11 0.00 -1.56 0.00 0.00 34.95 30.19 1pfg s ARG 189 CO 0.25 -0.54 1.46 -1.12 -0.81 0.00 0.00 175.30 174.53 1pfg s SER 190 N -0.04 6.52 0.52 -2.12 0.01 0.18 -4.59 113.70 114.19 1pfg s SER 190 Ca 0.55 2.85 0.30 0.00 1.31 0.00 0.00 55.95 60.96 1pfg s SER 190 Cb -0.47 -2.65 1.64 0.00 0.21 0.00 0.00 66.02 64.76 1pfg s SER 190 CO 0.60 -0.76 1.91 0.77 0.41 0.00 0.00 173.24 176.17 1pfg h SER 191 N 4.00 0.00 0.00 2.44 4.64 -1.89 0.12 113.55 122.85 1pfg h SER 191 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1pfg h SER 191 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1pfg h SER 191 CO 0.71 0.00 -1.28 2.22 -0.87 0.00 0.00 176.83 177.61 1pfg n PHE 192 N -2.65 0.00 -1.67 4.77 1.16 -1.26 -4.75 117.46 113.06 1pfg n PHE 192 Ca -0.02 0.00 -0.45 0.00 -1.87 0.00 0.00 57.45 55.11 1pfg n PHE 192 Cb 0.16 -0.15 -0.03 0.00 -1.61 0.00 0.00 39.48 37.85 1pfg n PHE 192 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1pfg n SER 193 N -1.72 2.91 -4.68 5.98 2.88 0.40 0.10 113.62 119.50 1pfg n SER 193 Ca 0.01 1.12 -0.29 0.00 -1.33 0.00 0.00 58.87 58.39 1pfg n SER 193 Cb 0.39 -1.43 0.17 0.00 -0.75 0.00 0.00 64.21 62.59 1pfg n SER 193 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 1pfg s ASN 194 N 0.50 2.74 0.00 -3.46 0.02 -0.92 -3.14 114.94 110.68 1pfg s ASN 194 Ca 0.71 1.29 0.00 0.00 -1.02 0.00 0.00 52.86 53.84 1pfg s ASN 194 Cb -0.65 -1.96 0.00 0.00 0.02 0.00 0.00 41.25 38.66 1pfg s ASN 194 CO 0.46 -3.07 0.00 0.00 0.02 0.00 0.00 177.10 174.51 1pfg n TYR 195 N -4.15 -0.60 0.00 2.20 4.11 0.31 -4.81 117.16 114.22 1pfg n TYR 195 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.96 1pfg n TYR 195 Cb 0.57 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.91 1pfg n TYR 195 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1pfg n GLY 196 N 0.00 1.60 0.04 -7.48 0.00 -1.26 0.75 105.19 98.83 1pfg n GLY 196 Ca 0.00 -2.12 0.12 0.00 0.00 0.00 0.00 46.02 44.02 1pfg n GLY 196 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1pfg n SER 197 N 0.00 0.26 0.03 1.61 3.41 -1.24 -2.59 113.62 115.10 1pfg n SER 197 Ca 0.00 0.54 0.11 0.00 -0.26 0.00 0.00 58.87 59.26 1pfg n SER 197 Cb 0.00 -0.60 0.06 0.00 -0.26 0.00 0.00 64.21 63.40 1pfg n SER 197 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1pfg n VAL 198 N -1.75 0.18 -2.26 -3.33 3.14 -1.26 -4.88 118.33 108.17 1pfg n VAL 198 Ca 0.05 -0.23 -0.37 0.00 -2.96 0.00 0.00 64.34 60.84 1pfg n VAL 198 Cb 0.31 0.18 -0.01 0.00 -1.06 0.00 0.00 33.84 33.26 1pfg n VAL 198 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 1pfg s LEU 199 N -3.89 3.97 -0.02 6.55 1.02 -1.07 -4.58 118.68 120.66 1pfg s LEU 199 Ca 0.05 2.29 0.13 0.00 0.02 0.00 0.00 54.13 56.61 1pfg s LEU 199 Cb 0.14 -4.29 -0.20 0.00 0.02 0.00 0.00 46.19 41.86 1pfg s LEU 199 CO 0.78 -0.96 0.29 0.47 0.02 0.00 0.00 176.35 176.95 1pfg n ASP 200 N -0.61 2.03 -3.61 2.29 9.92 -0.99 -4.69 116.55 120.89 1pfg n ASP 200 Ca 0.08 -0.00 0.02 0.00 -0.53 0.00 0.00 54.79 54.36 1pfg n ASP 200 Cb 0.48 1.59 -0.00 0.00 -0.64 0.00 0.00 41.12 42.55 1pfg n ASP 200 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 1pfg s ILE 201 N -2.90 0.00 0.06 0.53 2.07 -1.24 -4.75 121.20 114.97 1pfg s ILE 201 Ca -0.05 -0.18 0.07 0.00 -1.41 0.00 0.00 60.65 59.08 1pfg s ILE 201 Cb 0.08 -1.97 -0.03 0.00 0.13 0.00 0.00 42.46 40.67 1pfg s ILE 201 CO 0.54 0.00 -0.18 -0.36 -1.91 0.00 0.00 174.94 173.03 1pfg s PHE 202 N -2.36 2.56 0.23 3.50 0.40 -0.04 0.22 117.98 122.49 1pfg s PHE 202 Ca 0.14 -0.25 0.01 0.00 -0.60 0.00 0.00 56.93 56.23 1pfg s PHE 202 Cb 0.05 -1.44 -0.05 0.00 0.51 0.00 0.00 43.02 42.09 1pfg s PHE 202 CO -0.04 0.28 0.08 0.20 0.70 0.00 0.00 175.22 176.45 1pfg s GLY 203 N -1.59 1.55 0.09 4.36 0.00 0.48 -0.28 107.32 111.93 1pfg s GLY 203 Ca 0.15 -1.77 -0.32 0.00 0.00 0.00 0.00 44.72 42.79 1pfg s GLY 203 CO 0.06 -1.53 1.82 -1.05 0.00 0.00 0.00 173.10 172.40 1pfg n PRO 204 N -0.37 2.62 0.00 2.90 -0.02 -1.26 -0.70 135.00 138.17 1pfg n PRO 204 Ca -0.01 0.95 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 1pfg n PRO 204 Cb 0.66 -2.83 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 1pfg n PRO 204 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pfg n GLY 205 N 4.17 0.82 3.66 -1.23 0.00 -0.68 -3.03 105.19 108.91 1pfg n GLY 205 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 1pfg n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pfg s THR 206 N -0.13 4.81 -0.74 2.61 2.01 -0.88 0.24 115.64 123.57 1pfg s THR 206 Ca 0.00 -0.03 -0.02 0.00 0.31 0.00 0.00 61.69 61.95 1pfg s THR 206 Cb 0.00 -3.15 0.00 0.00 0.01 0.00 0.00 72.50 69.36 1pfg s THR 206 CO 0.00 0.49 0.66 -1.54 -0.69 0.00 0.00 174.62 173.54 1pfg n SER 207 N 3.28 -6.78 -4.33 3.53 3.41 -1.21 -4.63 113.62 106.89 1pfg n SER 207 Ca -0.17 -0.33 -0.41 0.00 -0.26 0.00 0.00 58.87 57.70 1pfg n SER 207 Cb 0.53 -4.02 -0.10 0.00 -0.26 0.00 0.00 64.21 60.36 1pfg n SER 207 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1pfg s ILE 208 N -2.92 4.54 -0.03 -1.33 -1.09 0.24 -4.81 121.20 115.80 1pfg s ILE 208 Ca 0.03 -1.12 -0.30 0.00 -2.23 0.00 0.00 60.65 57.03 1pfg s ILE 208 Cb -0.01 -3.67 -0.05 0.00 -1.58 0.00 0.00 42.46 37.15 1pfg s ILE 208 CO 0.80 -0.41 1.54 -0.22 -1.23 0.00 0.00 174.94 175.43 1pfg s LEU 209 N 1.52 4.31 0.00 2.97 2.96 -1.26 -1.60 118.68 127.58 1pfg s LEU 209 Ca 0.03 2.18 0.00 0.00 -0.22 0.00 0.00 54.13 56.12 1pfg s LEU 209 Cb -0.22 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 42.93 1pfg s LEU 209 CO 0.05 -0.84 0.00 -0.24 -1.32 0.00 0.00 176.35 173.99 1pfg n SER 210 N 6.36 0.00 -4.78 3.68 2.88 0.17 -4.83 113.62 117.08 1pfg n SER 210 Ca 0.16 -0.95 -0.34 0.00 -1.33 0.00 0.00 58.87 56.40 1pfg n SER 210 Cb 0.43 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.89 1pfg n SER 210 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1pfg s THR 211 N -2.45 3.43 0.07 2.46 -4.23 -1.26 -0.89 115.64 112.76 1pfg s THR 211 Ca 0.00 0.81 -0.01 0.00 -1.18 0.00 0.00 61.69 61.30 1pfg s THR 211 Cb 0.00 -3.31 -0.04 0.00 1.34 0.00 0.00 72.50 70.50 1pfg s THR 211 CO 0.00 -0.27 0.00 0.86 -0.54 0.00 0.00 174.62 174.67 1pfg s TRP 212 N -2.04 0.59 0.81 3.99 -0.11 -0.38 -3.17 118.94 118.62 1pfg s TRP 212 Ca 0.69 -1.09 -0.12 0.00 1.22 0.00 0.00 56.10 56.80 1pfg s TRP 212 Cb -0.20 -0.39 0.08 0.00 -1.50 0.00 0.00 33.47 31.46 1pfg s TRP 212 CO 0.30 -0.43 1.16 0.96 -4.62 0.00 0.00 176.95 174.32 1pfg s ILE 213 N -3.95 2.46 0.00 5.86 -4.36 -1.26 -1.71 121.20 118.24 1pfg s ILE 213 Ca 0.11 0.18 0.00 0.00 -0.26 0.00 0.00 60.65 60.68 1pfg s ILE 213 Cb 0.08 -2.52 0.00 0.00 1.25 0.00 0.00 42.46 41.27 1pfg s ILE 213 CO -0.07 -0.17 0.00 0.61 0.24 0.00 0.00 174.94 175.55 1pfg n GLY 214 N -0.04 0.73 2.17 6.27 0.00 -1.26 -2.83 105.19 110.23 1pfg n GLY 214 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 1pfg n GLY 214 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pfg n GLY 215 N -2.12 0.08 0.00 -0.02 0.00 -1.17 -5.02 105.19 96.95 1pfg n GLY 215 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.49 1pfg n GLY 215 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1pfg n SER 216 N 0.34 0.58 -3.77 1.61 3.41 -0.69 -4.93 113.62 110.16 1pfg n SER 216 Ca -0.10 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.41 1pfg n SER 216 Cb 0.56 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.46 1pfg n SER 216 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1pfg s THR 217 N 1.75 0.07 -0.27 6.66 -4.23 -1.26 -1.25 115.64 117.11 1pfg s THR 217 Ca 0.00 -0.90 -0.26 0.00 -1.18 0.00 0.00 61.69 59.35 1pfg s THR 217 Cb 0.00 -1.45 0.14 0.00 1.34 0.00 0.00 72.50 72.53 1pfg s THR 217 CO 0.00 -0.31 1.11 -0.60 -0.54 0.00 0.00 174.62 174.28 1pfg s ARG 218 N -3.87 0.42 0.05 3.99 3.52 -0.07 -4.81 118.95 118.18 1pfg s ARG 218 Ca 0.08 0.44 -0.24 0.00 -0.13 0.00 0.00 55.73 55.88 1pfg s ARG 218 Cb 0.02 0.20 -0.06 0.00 -1.56 0.00 0.00 34.95 33.56 1pfg s ARG 218 CO -0.07 -0.06 0.72 -1.12 -0.81 0.00 0.00 175.30 173.95 1pfg s SER 219 N 0.01 7.16 0.31 -2.12 0.01 -1.25 -0.66 113.70 117.16 1pfg s SER 219 Ca 0.04 1.39 0.03 0.00 1.31 0.00 0.00 55.95 58.72 1pfg s SER 219 Cb -0.04 -2.44 -0.03 0.00 0.21 0.00 0.00 66.02 63.72 1pfg s SER 219 CO -0.07 0.07 0.29 0.27 0.41 0.00 0.00 173.24 174.21 1pfg s ILE 220 N -0.24 0.00 0.05 1.44 -4.36 -0.62 -4.76 121.20 112.71 1pfg s ILE 220 Ca 0.36 -1.91 0.08 0.00 -0.26 0.00 0.00 60.65 58.92 1pfg s ILE 220 Cb -0.20 -2.52 -0.03 0.00 1.25 0.00 0.00 42.46 40.96 1pfg s ILE 220 CO 0.22 0.00 -0.23 -0.44 0.24 0.00 0.00 174.94 174.73 1pfg s SER 221 N -3.30 2.74 0.00 4.36 0.01 -1.26 0.82 113.70 117.07 1pfg s SER 221 Ca 0.38 -0.57 0.00 0.00 1.31 0.00 0.00 55.95 57.07 1pfg s SER 221 Cb 0.03 -0.23 0.00 0.00 0.21 0.00 0.00 66.02 66.03 1pfg s SER 221 CO 0.23 0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.67 1pfg n GLY 222 N 1.72 2.06 0.00 3.44 0.00 0.14 -4.86 105.19 107.69 1pfg n GLY 222 Ca -0.17 -0.88 0.10 0.00 0.00 0.00 0.00 46.02 45.06 1pfg n GLY 222 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1pfg n THR 223 N -0.69 0.49 0.10 2.61 -2.24 -1.26 -2.34 114.28 110.95 1pfg n THR 223 Ca 0.00 0.12 -0.05 0.00 -2.27 0.00 0.00 64.05 61.85 1pfg n THR 223 Cb 0.00 -0.78 0.04 0.00 -2.10 0.00 0.00 70.33 67.49 1pfg n THR 223 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1pfg h SER 224 N 0.00 0.12 0.61 3.42 0.02 -1.91 -1.74 113.55 114.07 1pfg h SER 224 Ca 0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1pfg h SER 224 Cb 0.26 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.76 1pfg h SER 224 CO 0.00 0.86 -0.85 0.23 -1.14 0.00 0.00 176.83 175.93 1pfg n MET 225 N -3.66 0.28 -0.04 3.45 2.81 -0.99 -4.03 117.12 114.95 1pfg n MET 225 Ca -0.02 0.03 -0.18 0.00 -1.81 0.00 0.00 57.70 55.72 1pfg n MET 225 Cb 0.75 -1.63 -0.13 0.00 -0.71 0.00 0.00 33.22 31.50 1pfg n MET 225 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1pfg h ALA 226 N 2.54 0.07 -0.82 3.04 0.00 -1.44 -3.35 119.26 119.30 1pfg h ALA 226 Ca 0.00 -0.80 0.07 0.00 0.00 0.00 0.00 54.91 54.18 1pfg h ALA 226 Cb 0.73 0.26 -0.10 0.00 0.00 0.00 0.00 17.79 18.69 1pfg h ALA 226 CO 0.00 0.38 -0.48 2.41 0.00 0.00 0.00 179.25 181.56 1pfg n THR 227 N -4.34 -0.55 -0.04 0.00 -1.04 -0.66 -0.49 114.28 107.16 1pfg n THR 227 Ca -0.18 2.23 0.22 0.00 -2.04 0.00 0.00 64.05 64.27 1pfg n THR 227 Cb 0.67 -2.78 0.69 0.00 -1.82 0.00 0.00 70.33 67.10 1pfg n THR 227 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1pfg h PRO 228 N 0.00 0.01 -0.46 -2.82 0.13 -1.75 0.53 132.00 127.63 1pfg h PRO 228 Ca 0.13 -0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.15 1pfg h PRO 228 Cb 0.33 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.45 1pfg h PRO 228 CO -0.77 0.00 -0.15 0.45 -0.23 0.00 0.00 178.00 177.31 1pfg h HIS 229 N 0.01 0.98 0.04 1.56 3.86 -0.91 0.67 115.15 121.36 1pfg h HIS 229 Ca 0.29 -0.20 -0.22 0.00 -1.16 0.00 0.00 60.37 59.07 1pfg h HIS 229 Cb 1.15 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 29.37 1pfg h HIS 229 CO -0.00 0.96 -1.02 -0.39 0.86 0.00 0.00 177.93 178.34 1pfg h VAL 230 N 0.78 1.56 0.13 2.45 -1.51 -0.37 0.90 116.25 120.19 1pfg h VAL 230 Ca 0.12 -2.96 -0.01 0.00 -1.23 0.00 0.00 66.70 62.62 1pfg h VAL 230 Cb 0.67 2.71 0.00 0.00 -2.13 0.00 0.00 31.29 32.54 1pfg h VAL 230 CO 0.05 0.86 -0.06 0.00 -1.23 0.00 0.00 177.57 177.19 1pfg h ALA 231 N 0.86 -0.17 0.00 5.19 0.00 0.54 1.05 119.26 126.73 1pfg h ALA 231 Ca -0.06 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 1pfg h ALA 231 Cb 1.71 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.55 1pfg h ALA 231 CO 0.15 -0.57 -0.54 0.78 0.00 0.00 0.00 179.25 179.07 1pfg h GLY 232 N -0.23 0.00 0.52 0.00 0.00 0.25 0.80 103.07 104.41 1pfg h GLY 232 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.30 1pfg h GLY 232 CO 0.03 0.00 -0.05 -2.00 0.00 0.00 0.00 176.54 174.52 1pfg h LEU 233 N 0.00 0.09 -0.21 3.11 5.85 -0.39 -0.34 115.31 123.43 1pfg h LEU 233 Ca -0.01 -0.54 0.05 0.00 0.84 0.00 0.00 57.88 58.22 1pfg h LEU 233 Cb 1.01 -0.03 -0.07 0.00 0.37 0.00 0.00 40.66 41.94 1pfg h LEU 233 CO 0.07 0.62 -0.42 0.00 -0.34 0.00 0.00 178.44 178.36 1pfg h ALA 234 N 0.48 -0.55 -0.31 1.25 0.00 0.12 0.44 119.26 120.68 1pfg h ALA 234 Ca 0.00 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1pfg h ALA 234 Cb 0.60 0.82 -0.03 0.00 0.00 0.00 0.00 17.79 19.18 1pfg h ALA 234 CO 0.01 -0.91 0.13 0.00 0.00 0.00 0.00 179.25 178.48 1pfg h ALA 235 N 0.19 0.36 -0.59 0.00 0.00 -0.81 0.24 119.26 118.65 1pfg h ALA 235 Ca 0.09 0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.11 1pfg h ALA 235 Cb 0.61 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.32 1pfg h ALA 235 CO -0.45 -0.26 0.24 -0.92 0.00 0.00 0.00 179.25 177.87 1pfg h TYR 236 N 0.28 0.43 -0.02 0.00 3.20 -0.63 -1.01 116.97 119.22 1pfg h TYR 236 Ca 0.13 0.03 -0.24 0.00 3.14 0.00 0.00 58.73 61.79 1pfg h TYR 236 Cb 0.07 -0.10 0.01 0.00 1.54 0.00 0.00 36.73 38.25 1pfg h TYR 236 CO -0.11 0.14 -0.94 -0.07 -1.64 0.00 0.00 178.16 175.53 1pfg h LEU 237 N 0.44 0.68 -0.45 2.82 3.38 -0.35 -1.33 115.31 120.50 1pfg h LEU 237 Ca 0.29 -0.53 0.09 0.00 0.09 0.00 0.00 57.88 57.82 1pfg h LEU 237 Cb 0.32 -0.21 -0.08 0.00 0.09 0.00 0.00 40.66 40.79 1pfg h LEU 237 CO -0.27 1.32 -0.03 0.24 0.09 0.00 0.00 178.44 179.79 1pfg h MET 238 N 0.31 0.08 0.00 1.13 2.86 -0.17 0.85 114.93 119.99 1pfg h MET 238 Ca -0.09 -0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.47 1pfg h MET 238 Cb 1.58 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 33.21 1pfg h MET 238 CO 0.17 0.05 -0.36 1.79 1.06 0.00 0.00 176.91 179.63 1pfg h THR 239 N 0.08 0.91 0.00 2.22 1.35 -1.12 0.94 112.91 117.30 1pfg h THR 239 Ca 0.22 -1.40 0.00 0.00 -0.55 0.00 0.00 66.41 64.68 1pfg h THR 239 Cb 0.33 1.84 0.00 0.00 -1.73 0.00 0.00 68.15 68.59 1pfg h THR 239 CO -0.39 0.35 0.00 0.18 -0.25 0.00 0.00 175.52 175.40 1pfg n LEU 240 N -3.62 0.00 -1.48 3.87 4.32 -0.23 -4.88 117.00 114.99 1pfg n LEU 240 Ca -0.01 0.00 -0.16 0.00 -0.02 0.00 0.00 56.01 55.83 1pfg n LEU 240 Cb 0.47 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 42.20 1pfg n LEU 240 CO 0.36 0.00 -0.15 0.61 -1.22 0.00 0.00 177.39 176.99 1pfg n GLY 241 N 0.39 1.46 0.10 -0.72 0.00 0.33 -4.87 105.19 101.87 1pfg n GLY 241 Ca 0.16 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 1pfg n GLY 241 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pfg h LYS 242 N 0.00 0.12 0.00 1.61 1.57 -1.45 -3.48 116.57 114.94 1pfg h LYS 242 Ca -0.33 -0.16 -0.18 0.00 -1.87 0.00 0.00 60.65 58.11 1pfg h LYS 242 Cb 1.04 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 33.36 1pfg h LYS 242 CO 0.47 0.99 -0.13 -2.37 -0.57 0.00 0.00 179.45 177.85 1pfg n THR 243 N -3.53 0.00 -4.61 -0.16 5.66 -1.26 -5.04 114.28 105.34 1pfg n THR 243 Ca -0.03 -1.05 -0.28 0.00 -3.05 0.00 0.00 64.05 59.65 1pfg n THR 243 Cb 0.88 0.60 -0.09 0.00 -1.55 0.00 0.00 70.33 70.17 1pfg n THR 243 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1pfg s THR 244 N -2.66 1.20 0.12 1.09 -4.23 -1.26 -4.46 115.64 105.44 1pfg s THR 244 Ca 0.17 -2.00 -0.21 0.00 -1.18 0.00 0.00 61.69 58.47 1pfg s THR 244 Cb -0.00 -2.50 -0.05 0.00 1.34 0.00 0.00 72.50 71.28 1pfg s THR 244 CO 0.12 0.00 1.70 0.00 -0.54 0.00 0.00 174.62 175.90 1pfg h ALA 245 N 1.70 0.04 -0.08 3.99 0.00 -1.88 0.39 119.26 123.41 1pfg h ALA 245 Ca -0.41 0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.57 1pfg h ALA 245 Cb 1.28 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 1pfg h ALA 245 CO 0.70 -0.52 0.07 0.00 0.00 0.00 0.00 179.25 179.50 1pfg h ALA 246 N 1.05 1.83 0.00 0.00 0.00 -1.85 -3.21 119.26 117.08 1pfg h ALA 246 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1pfg h ALA 246 Cb 0.17 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1pfg h ALA 246 CO -0.17 -0.11 -0.02 -1.13 0.00 0.00 0.00 179.25 177.83 1pfg n SER 247 N -4.14 1.71 -0.12 0.00 3.41 -0.90 -4.76 113.62 108.82 1pfg n SER 247 Ca -0.01 -2.04 0.25 0.00 -0.26 0.00 0.00 58.87 56.81 1pfg n SER 247 Cb 0.17 -0.08 0.70 0.00 -0.26 0.00 0.00 64.21 64.74 1pfg n SER 247 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pfg h ALA 248 N 0.00 2.68 -0.01 7.33 0.00 -0.25 -1.93 119.26 127.09 1pfg h ALA 248 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1pfg h ALA 248 Cb 0.68 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1pfg h ALA 248 CO 0.00 -0.90 -0.06 0.00 0.00 0.00 0.00 179.25 178.29 1pfg h ARG 250 N -0.64 1.16 -0.22 0.00 1.12 -1.79 -0.55 114.38 113.47 1pfg h ARG 250 Ca -0.01 -0.07 -0.03 0.00 -1.11 0.00 0.00 59.98 58.77 1pfg h ARG 250 Cb 0.78 -0.26 -0.01 0.00 -0.01 0.00 0.00 29.97 30.47 1pfg h ARG 250 CO 0.01 0.77 0.04 -0.92 -3.11 0.00 0.00 179.97 176.76 1pfg h TYR 251 N 1.19 0.38 -0.98 2.20 5.03 -1.34 0.17 116.97 123.62 1pfg h TYR 251 Ca 0.34 -0.05 0.10 0.00 2.58 0.00 0.00 58.73 61.69 1pfg h TYR 251 Cb -0.10 -0.11 -0.07 0.00 1.55 0.00 0.00 36.73 38.00 1pfg h TYR 251 CO -0.01 0.49 0.63 0.82 -1.32 0.00 0.00 178.16 178.77 1pfg h ILE 252 N 0.17 0.99 -0.15 1.81 2.04 -0.76 -1.21 117.51 120.39 1pfg h ILE 252 Ca 0.07 -0.36 -0.06 0.00 1.00 0.00 0.00 64.86 65.51 1pfg h ILE 252 Cb 0.31 -0.14 -0.00 0.00 -0.74 0.00 0.00 36.82 36.25 1pfg h ILE 252 CO 0.00 0.19 -0.14 0.00 0.00 0.00 0.00 178.15 178.21 1pfg h ALA 253 N 1.51 0.22 -0.43 1.87 0.00 -0.62 -1.67 119.26 120.14 1pfg h ALA 253 Ca 0.46 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1pfg h ALA 253 Cb 0.36 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1pfg h ALA 253 CO -0.21 0.09 0.08 -0.44 0.00 0.00 0.00 179.25 178.77 1pfg h ASP 254 N -0.00 0.60 -0.00 0.00 3.45 -0.49 -3.16 116.42 116.82 1pfg h ASP 254 Ca 0.03 -0.10 0.00 0.00 0.43 0.00 0.00 57.03 57.39 1pfg h ASP 254 Cb 0.66 -0.16 0.00 0.00 -0.56 0.00 0.00 39.33 39.27 1pfg h ASP 254 CO 0.03 0.62 -0.02 0.35 -1.57 0.00 0.00 179.24 178.65 1pfg n THR 255 N -4.30 0.00 -0.81 0.35 -2.24 -0.47 -4.98 114.28 101.83 1pfg n THR 255 Ca 0.03 -0.31 -0.30 0.00 -2.27 0.00 0.00 64.05 61.20 1pfg n THR 255 Cb 0.22 0.76 0.26 0.00 -2.10 0.00 0.00 70.33 69.47 1pfg n THR 255 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1pfg s ALA 256 N -2.04 0.08 -0.09 6.98 0.00 -0.64 -4.69 121.76 121.36 1pfg s ALA 256 Ca 0.34 -0.86 -0.23 0.00 0.00 0.00 0.00 51.96 51.21 1pfg s ALA 256 Cb 0.21 -2.92 -0.03 0.00 0.00 0.00 0.00 23.12 20.37 1pfg s ALA 256 CO 0.34 -3.96 0.71 -0.80 0.00 0.00 0.00 175.76 172.05 1pfg s ASN 257 N -3.57 6.95 0.31 0.00 0.02 -0.25 -4.86 114.94 113.54 1pfg s ASN 257 Ca 0.70 1.15 0.11 0.00 -1.02 0.00 0.00 52.86 53.80 1pfg s ASN 257 Cb -0.12 -2.41 -0.06 0.00 0.02 0.00 0.00 41.25 38.69 1pfg s ASN 257 CO 0.57 -0.17 -0.15 -0.54 0.02 0.00 0.00 177.10 176.83 1pfg s LYS 258 N 1.11 1.76 0.00 -0.60 1.02 -1.26 -0.94 119.74 120.83 1pfg s LYS 258 Ca 0.37 -1.82 0.00 0.00 0.02 0.00 0.00 55.97 54.53 1pfg s LYS 258 Cb -0.17 -1.76 0.00 0.00 -0.52 0.00 0.00 37.83 35.37 1pfg s LYS 258 CO 0.16 0.25 0.00 0.41 -0.92 0.00 0.00 175.35 175.26 1pfg n GLY 259 N -0.70 0.00 0.19 -3.33 0.00 -0.37 -4.83 105.19 96.15 1pfg n GLY 259 Ca -0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.85 1pfg n GLY 259 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1pfg h ASP 260 N 0.00 0.64 -4.04 1.61 3.45 -1.80 -3.46 116.42 112.82 1pfg h ASP 260 Ca 0.00 -0.41 -0.46 0.00 0.43 0.00 0.00 57.03 56.59 1pfg h ASP 260 Cb 0.00 -0.19 0.01 0.00 -0.56 0.00 0.00 39.33 38.59 1pfg h ASP 260 CO 0.00 1.17 0.37 -0.76 -1.57 0.00 0.00 179.24 178.45 1pfg s LEU 261 N -8.14 3.96 0.38 1.55 1.43 -1.26 -4.92 118.68 111.69 1pfg s LEU 261 Ca -0.07 1.86 0.08 0.00 -1.03 0.00 0.00 54.13 54.97 1pfg s LEU 261 Cb 0.10 -4.46 -0.05 0.00 0.03 0.00 0.00 46.19 41.81 1pfg s LEU 261 CO 0.86 -0.55 0.14 -0.94 0.23 0.00 0.00 176.35 176.10 1pfg s SER 262 N -1.96 4.44 0.00 2.29 1.04 0.29 -4.58 113.70 115.22 1pfg s SER 262 Ca 0.63 -1.00 0.00 0.00 0.48 0.00 0.00 55.95 56.06 1pfg s SER 262 Cb -0.15 -0.54 0.00 0.00 0.10 0.00 0.00 66.02 65.43 1pfg s SER 262 CO 0.19 -0.44 0.00 -3.20 0.98 0.00 0.00 173.24 170.77 1pfg n ASN 263 N -1.17 -0.18 -4.69 7.02 5.15 -1.26 -0.60 115.26 119.52 1pfg n ASN 263 Ca -0.02 0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.54 1pfg n ASN 263 Cb 0.63 -0.03 -0.03 0.00 -0.53 0.00 0.00 39.78 39.82 1pfg n ASN 263 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1pfg s ILE 264 N -3.39 4.88 0.39 -1.44 -1.09 -1.26 -4.76 121.20 114.53 1pfg s ILE 264 Ca 0.00 1.83 -0.25 0.00 -2.23 0.00 0.00 60.65 60.00 1pfg s ILE 264 Cb 0.00 -4.22 -0.09 0.00 -1.58 0.00 0.00 42.46 36.57 1pfg s ILE 264 CO 0.00 0.09 1.06 -2.84 -1.23 0.00 0.00 174.94 172.02 1pfg s PRO 265 N 1.63 4.20 0.09 2.79 0.02 -1.26 -4.97 135.00 137.49 1pfg s PRO 265 Ca 0.44 1.56 -0.36 0.00 0.02 0.00 0.00 61.00 62.67 1pfg s PRO 265 Cb -0.18 -2.61 -0.15 0.00 0.02 0.00 0.00 34.50 31.58 1pfg s PRO 265 CO 0.19 -0.13 1.49 0.34 -0.33 0.00 0.00 177.00 178.56 1pfg n PHE 266 N 0.05 1.91 0.00 6.54 7.35 -1.26 -1.44 117.46 130.62 1pfg n PHE 266 Ca 0.04 0.44 0.00 0.00 -0.76 0.00 0.00 57.45 57.17 1pfg n PHE 266 Cb 0.49 -2.45 0.00 0.00 0.35 0.00 0.00 39.48 37.87 1pfg n PHE 266 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1pfg n GLY 267 N 3.09 1.31 3.76 7.13 0.00 -1.26 -5.02 105.19 114.19 1pfg n GLY 267 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 1pfg n GLY 267 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pfg s THR 268 N -1.63 4.76 0.47 2.61 2.01 -0.52 -3.62 115.64 119.73 1pfg s THR 268 Ca 0.00 -0.09 -0.22 0.00 0.31 0.00 0.00 61.69 61.69 1pfg s THR 268 Cb 0.00 -3.04 -0.08 0.00 0.01 0.00 0.00 72.50 69.39 1pfg s THR 268 CO 0.00 0.60 1.10 -0.69 -0.69 0.00 0.00 174.62 174.94 1pfg s VAL 269 N -0.95 3.40 -0.79 3.82 1.01 -1.26 -4.71 120.40 120.92 1pfg s VAL 269 Ca 0.14 0.97 0.02 0.00 0.00 0.00 0.00 61.98 63.12 1pfg s VAL 269 Cb -0.12 -3.45 0.23 0.00 0.00 0.00 0.00 36.38 33.05 1pfg s VAL 269 CO 0.03 -0.10 0.81 -3.20 0.00 0.00 0.00 175.10 172.65 1pfg n ASN 270 N -0.71 4.11 -3.86 3.32 4.05 -1.26 -4.94 115.26 115.97 1pfg n ASN 270 Ca 0.08 -3.31 -0.17 0.00 0.45 0.00 0.00 54.58 51.64 1pfg n ASN 270 Cb 0.50 -0.87 -0.16 0.00 1.23 0.00 0.00 39.78 40.48 1pfg n ASN 270 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1pfg s LEU 271 N -2.03 1.43 -0.10 1.20 1.43 -1.26 -1.23 118.68 118.12 1pfg s LEU 271 Ca 0.32 -0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.39 1pfg s LEU 271 Cb 0.04 -0.23 0.02 0.00 0.03 0.00 0.00 46.19 46.04 1pfg s LEU 271 CO -0.06 -0.05 -0.12 -0.22 0.23 0.00 0.00 176.35 176.13 1pfg s LEU 272 N 0.68 1.54 0.13 1.79 2.96 -0.12 -0.86 118.68 124.81 1pfg s LEU 272 Ca -0.07 -0.36 -0.34 0.00 -0.22 0.00 0.00 54.13 53.14 1pfg s LEU 272 Cb -0.10 -0.96 -0.17 0.00 0.50 0.00 0.00 46.19 45.46 1pfg s LEU 272 CO -0.01 -0.03 1.04 0.00 -1.32 0.00 0.00 176.35 176.03 1pfg n ALA 273 N 4.37 -1.86 -3.63 5.97 0.00 0.61 -1.09 120.51 124.89 1pfg n ALA 273 Ca -0.18 0.50 -0.10 0.00 0.00 0.00 0.00 53.44 53.66 1pfg n ALA 273 Cb 0.51 -1.89 -0.07 0.00 0.00 0.00 0.00 19.45 17.99 1pfg n ALA 273 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1pfg s TYR 274 N -0.25 -0.96 -1.62 0.00 5.04 -1.26 -4.45 117.35 113.85 1pfg s TYR 274 Ca 0.77 2.04 0.23 0.00 -2.44 0.00 0.00 57.07 57.67 1pfg s TYR 274 Cb -0.97 0.50 0.17 0.00 0.35 0.00 0.00 41.96 42.01 1pfg s TYR 274 CO 0.54 -0.47 1.19 0.27 -1.34 0.00 0.00 175.55 175.74 1pfg n ASN 275 N 3.75 1.39 -3.63 4.32 0.23 -0.79 -4.66 115.26 115.87 1pfg n ASN 275 Ca -0.18 -1.11 -0.27 0.00 -0.53 0.00 0.00 54.58 52.48 1pfg n ASN 275 Cb 0.58 0.50 0.02 0.00 -2.08 0.00 0.00 39.78 38.79 1pfg n ASN 275 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1pfg n ASN 276 N -0.67 -4.63 -4.67 0.53 3.02 -1.26 -4.79 115.26 102.79 1pfg n ASN 276 Ca 0.08 -0.60 -0.42 0.00 -0.03 0.00 0.00 54.58 53.61 1pfg n ASN 276 Cb 0.39 -3.74 -0.03 0.00 -0.61 0.00 0.00 39.78 35.80 1pfg n ASN 276 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1pfg s TYR 277 N -3.17 2.49 -0.25 3.10 5.04 -1.26 -4.93 117.35 118.37 1pfg s TYR 277 Ca 0.54 0.60 -0.03 0.00 -2.44 0.00 0.00 57.07 55.75 1pfg s TYR 277 Cb -0.27 -3.73 0.02 0.00 0.35 0.00 0.00 41.96 38.33 1pfg s TYR 277 CO 0.67 -2.84 -0.03 1.14 -1.34 0.00 0.00 175.55 173.14 1pfg s GLN 278 N 3.37 2.97 0.00 4.97 -2.07 -1.26 -5.04 119.66 122.60 1pfg s GLN 278 Ca 0.65 -0.89 0.00 0.00 -1.82 0.00 0.00 55.36 53.30 1pfg s GLN 278 Cb -0.30 -3.05 0.00 0.00 -1.09 0.00 0.00 33.01 28.57 1pfg s GLN 278 CO 0.25 -0.37 0.30 0.00 -1.32 0.00 0.00 175.29 174.14