#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3flm n SER 2 N 0.00 0.81 0.12 7.83 2.88 -1.26 -4.77 113.62 119.22 3flm n SER 2 Ca 0.00 0.76 -0.23 0.00 -1.33 0.00 0.00 58.87 58.06 3flm n SER 2 Cb 0.00 -0.80 -0.15 0.00 -0.75 0.00 0.00 64.21 62.50 3flm n SER 2 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 3flm h VAL 3 N 5.74 1.34 -0.47 2.46 -1.51 -1.97 -3.32 116.25 118.53 3flm h VAL 3 Ca -0.19 -2.63 0.04 0.00 -1.23 0.00 0.00 66.70 62.70 3flm h VAL 3 Cb 1.26 3.06 -0.04 0.00 -2.13 0.00 0.00 31.29 33.44 3flm h VAL 3 CO 0.95 0.78 0.22 -1.28 -1.23 0.00 0.00 177.57 177.01 3flm h SER 4 N 0.02 0.30 0.41 4.19 0.87 -1.86 0.79 113.55 118.28 3flm h SER 4 Ca -0.22 0.03 -0.05 0.00 -1.23 0.00 0.00 61.79 60.32 3flm h SER 4 Cb 2.01 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 63.94 3flm h SER 4 CO 0.24 0.22 -0.26 0.00 -0.53 0.00 0.00 176.83 176.50 3flm h ALA 5 N 1.26 1.34 0.06 6.23 0.00 -1.85 -2.31 119.26 123.99 3flm h ALA 5 Ca 0.21 -0.23 -0.25 0.00 0.00 0.00 0.00 54.91 54.64 3flm h ALA 5 Cb 0.14 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3flm h ALA 5 CO -0.16 0.32 -1.20 0.35 0.00 0.00 0.00 179.25 178.56 3flm h PHE 6 N 0.00 0.22 0.00 0.00 3.57 -1.56 -3.21 116.94 115.96 3flm h PHE 6 Ca -0.00 -0.16 -0.08 0.00 3.53 0.00 0.00 57.97 61.26 3flm h PHE 6 Cb 0.53 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.25 3flm h PHE 6 CO 0.00 1.14 -0.39 -0.91 -2.23 0.00 0.00 178.31 175.92 3flm h ASN 7 N 0.03 0.00 -0.78 0.41 -0.26 -0.35 0.12 115.58 114.76 3flm h ASN 7 Ca -0.10 0.00 0.15 0.00 -0.56 0.00 0.00 56.30 55.79 3flm h ASN 7 Cb 1.89 0.00 -0.10 0.00 -1.06 0.00 0.00 38.32 39.05 3flm h ASN 7 CO 0.15 0.39 0.33 0.03 -1.06 0.00 0.00 177.43 177.28 3flm h ARG 8 N 0.00 0.46 0.00 0.81 2.47 -1.48 -1.52 114.38 115.12 3flm h ARG 8 Ca -0.00 -0.03 -0.26 0.00 -1.26 0.00 0.00 59.98 58.43 3flm h ARG 8 Cb 0.75 -0.10 -0.04 0.00 -1.65 0.00 0.00 29.97 28.93 3flm h ARG 8 CO 0.05 0.31 -1.44 0.00 0.56 0.00 0.00 179.97 179.45 3flm h ARG 9 N 0.48 0.00 -0.11 0.04 3.08 -1.32 -1.25 114.38 115.29 3flm h ARG 9 Ca 0.43 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.48 3flm h ARG 9 Cb 0.66 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 3flm h ARG 9 CO -0.40 0.65 0.07 2.35 -1.07 0.00 0.00 179.97 181.56 3flm h TRP 10 N 0.00 0.15 -0.68 3.04 2.91 -0.96 -1.93 115.95 118.48 3flm h TRP 10 Ca -0.18 -0.00 -0.00 0.00 1.13 0.00 0.00 58.89 59.83 3flm h TRP 10 Cb 1.90 -0.05 -0.03 0.00 -0.51 0.00 0.00 29.16 30.47 3flm h TRP 10 CO 0.00 0.14 0.42 0.00 -1.03 0.00 0.00 178.44 177.97 3flm h ALA 11 N 0.99 0.86 -0.99 2.65 0.00 -1.27 -2.64 119.26 118.87 3flm h ALA 11 Ca 0.04 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 54.97 3flm h ALA 11 Cb 0.04 -0.27 -0.07 0.00 0.00 0.00 0.00 17.79 17.48 3flm h ALA 11 CO -0.01 0.32 0.63 0.00 0.00 0.00 0.00 179.25 180.20 3flm h ALA 12 N 1.22 1.48 -0.11 0.00 0.00 -0.94 -1.74 119.26 119.17 3flm h ALA 12 Ca 0.24 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.04 3flm h ALA 12 Cb -0.05 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.48 3flm h ALA 12 CO -0.05 0.34 -0.34 0.28 0.00 0.00 0.00 179.25 179.48 3flm h VAL 13 N 1.08 1.39 -0.53 0.00 2.07 -1.18 -0.76 116.25 118.31 3flm h VAL 13 Ca 0.45 -1.66 0.09 0.00 0.82 0.00 0.00 66.70 66.40 3flm h VAL 13 Cb 0.31 2.16 -0.07 0.00 -1.52 0.00 0.00 31.29 32.16 3flm h VAL 13 CO -0.21 0.49 0.11 0.40 0.02 0.00 0.00 177.57 178.38 3flm h ILE 14 N -0.01 0.70 -0.23 4.57 2.04 -1.06 0.57 117.51 124.09 3flm h ILE 14 Ca -0.01 -0.08 -0.08 0.00 1.00 0.00 0.00 64.86 65.69 3flm h ILE 14 Cb 0.96 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 37.47 3flm h ILE 14 CO 0.07 0.04 -0.17 -0.07 0.00 0.00 0.00 178.15 178.03 3flm h LEU 15 N 0.24 0.54 -1.18 1.44 3.38 -1.25 -2.46 115.31 116.03 3flm h LEU 15 Ca 0.27 -0.44 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 3flm h LEU 15 Cb 0.37 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 3flm h LEU 15 CO -0.35 0.87 0.34 -0.08 0.09 0.00 0.00 178.44 179.32 3flm h GLU 16 N 0.22 0.91 -0.48 1.13 4.57 -0.80 -1.53 114.58 118.60 3flm h GLU 16 Ca 0.04 -0.10 0.09 0.00 -1.18 0.00 0.00 59.36 58.21 3flm h GLU 16 Cb 0.69 -0.18 -0.08 0.00 -0.16 0.00 0.00 28.75 29.03 3flm h GLU 16 CO 0.04 0.68 0.02 0.00 -1.18 0.00 0.00 179.01 178.58 3flm h ALA 17 N 1.46 0.47 -0.23 2.92 0.00 -0.42 -1.95 119.26 121.51 3flm h ALA 17 Ca 0.23 0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.32 3flm h ALA 17 Cb 0.05 0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 3flm h ALA 17 CO -0.04 -0.38 -0.08 -0.07 0.00 0.00 0.00 179.25 178.69 3flm h LEU 18 N 0.13 -0.27 -1.46 0.00 3.38 -1.06 -0.75 115.31 115.28 3flm h LEU 18 Ca 0.24 0.08 0.49 0.00 0.09 0.00 0.00 57.88 58.78 3flm h LEU 18 Cb 0.35 0.17 -0.13 0.00 0.09 0.00 0.00 40.66 41.14 3flm h LEU 18 CO -0.39 -0.10 0.96 0.41 0.09 0.00 0.00 178.44 179.41 3flm n THR 19 N -5.24 -0.22 1.62 0.22 -1.04 -0.74 0.17 114.28 109.06 3flm n THR 19 Ca -0.02 1.75 0.09 0.00 -2.04 0.00 0.00 64.05 63.84 3flm n THR 19 Cb 0.16 -2.88 0.54 0.00 -1.82 0.00 0.00 70.33 66.33 3flm n THR 19 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 3flm n ARG 20 N -4.60 0.81 -0.16 -2.82 5.12 -0.29 -3.48 116.66 111.24 3flm n ARG 20 Ca 0.41 0.00 0.04 0.00 -1.93 0.00 0.00 57.85 56.37 3flm n ARG 20 Cb 1.63 -1.35 0.05 0.00 -1.16 0.00 0.00 32.46 31.63 3flm n ARG 20 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 3flm n HIS 21 N -0.85 0.00 0.00 -1.55 8.25 0.13 -4.27 115.22 116.92 3flm n HIS 21 Ca 0.14 -0.49 0.00 0.00 -0.26 0.00 0.00 57.72 57.11 3flm n HIS 21 Cb 0.06 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.09 3flm n HIS 21 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3flm n GLY 22 N -0.66 0.75 3.66 -1.41 0.00 -1.23 -4.74 105.19 101.57 3flm n GLY 22 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 3flm n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3flm s VAL 23 N -2.00 4.52 0.00 1.61 1.01 -1.25 -4.53 120.40 119.76 3flm s VAL 23 Ca 0.00 1.83 0.00 0.00 0.00 0.00 0.00 61.98 63.81 3flm s VAL 23 Cb 0.00 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 32.20 3flm s VAL 23 CO 0.00 -0.13 0.00 0.54 0.00 0.00 0.00 175.10 175.51 3flm n ARG 24 N 6.21 0.95 -3.03 2.72 5.12 -1.26 -4.50 116.66 122.87 3flm n ARG 24 Ca 0.12 0.00 -0.40 0.00 -1.93 0.00 0.00 57.85 55.64 3flm n ARG 24 Cb 0.46 -0.93 -0.05 0.00 -1.16 0.00 0.00 32.46 30.78 3flm n ARG 24 CO 0.00 0.00 0.00 -1.01 -1.93 0.00 0.00 177.63 174.69 3flm s HIS 25 N -1.87 3.54 -0.05 -1.55 3.76 -1.26 0.45 115.29 118.32 3flm s HIS 25 Ca 0.00 1.23 0.02 0.00 -0.15 0.00 0.00 55.06 56.15 3flm s HIS 25 Cb 0.00 -2.83 0.02 0.00 1.11 0.00 0.00 32.58 30.87 3flm s HIS 25 CO 0.00 0.02 -0.08 -1.50 -0.85 0.00 0.00 174.74 172.33 3flm s ILE 26 N 1.07 0.79 -0.08 0.60 2.07 -0.65 -0.78 121.20 124.23 3flm s ILE 26 Ca 0.37 -0.29 0.02 0.00 -1.41 0.00 0.00 60.65 59.34 3flm s ILE 26 Cb -0.17 -0.75 -0.02 0.00 0.13 0.00 0.00 42.46 41.64 3flm s ILE 26 CO 0.17 0.27 -0.14 0.00 -1.91 0.00 0.00 174.94 173.33 3flm s ILE 28 N -0.32 0.17 -0.00 0.00 1.01 -0.12 -1.56 121.20 120.37 3flm s ILE 28 Ca 0.03 -1.40 0.04 0.00 0.00 0.00 0.00 60.65 59.32 3flm s ILE 28 Cb -0.13 -1.27 -0.01 0.00 0.01 0.00 0.00 42.46 41.06 3flm s ILE 28 CO 0.02 -0.77 -0.14 0.00 0.00 0.00 0.00 174.94 174.05 3flm s ALA 29 N -3.51 1.18 -0.19 9.38 0.00 -1.22 -3.03 121.76 124.38 3flm s ALA 29 Ca 0.03 -0.64 -0.25 0.00 0.00 0.00 0.00 51.96 51.10 3flm s ALA 29 Cb 0.04 -0.29 -0.11 0.00 0.00 0.00 0.00 23.12 22.76 3flm s ALA 29 CO -0.09 0.28 0.80 -2.30 0.00 0.00 0.00 175.76 174.46 3flm n PRO 30 N 2.63 0.00 -3.63 0.00 -0.02 -1.26 -4.84 135.00 127.87 3flm n PRO 30 Ca -0.15 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.28 3flm n PRO 30 Cb 0.55 -0.84 -0.07 0.00 -0.02 0.00 0.00 33.50 33.12 3flm n PRO 30 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3flm s GLY 31 N 1.12 -0.46 0.07 -1.23 0.00 -1.26 -4.90 107.32 100.66 3flm s GLY 31 Ca 0.56 2.64 -0.19 0.00 0.00 0.00 0.00 44.72 47.73 3flm s GLY 31 CO 0.41 2.53 1.32 0.23 0.00 0.00 0.00 173.10 177.59 3flm h SER 32 N 6.83 -1.01 0.04 1.64 0.87 -1.98 -3.27 113.55 116.66 3flm h SER 32 Ca -0.28 0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.40 3flm h SER 32 Cb 1.21 0.40 0.00 0.00 -0.44 0.00 0.00 62.40 63.56 3flm h SER 32 CO 0.16 -0.27 -0.34 -1.14 -0.53 0.00 0.00 176.83 174.71 3flm n ARG 33 N -4.22 1.31 -0.23 2.24 3.00 -1.26 -3.70 116.66 113.80 3flm n ARG 33 Ca -0.03 -1.02 0.11 0.00 -0.00 0.00 0.00 57.85 56.90 3flm n ARG 33 Cb 0.21 -1.48 0.27 0.00 0.00 0.00 0.00 32.46 31.46 3flm n ARG 33 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 3flm n SER 34 N 0.05 3.08 -0.25 6.15 3.41 -1.26 -4.47 113.62 120.32 3flm n SER 34 Ca 0.11 -1.95 0.21 0.00 -0.26 0.00 0.00 58.87 56.97 3flm n SER 34 Cb 0.46 -0.31 0.39 0.00 -0.26 0.00 0.00 64.21 64.49 3flm n SER 34 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3flm n THR 35 N 1.20 -0.32 0.05 6.66 -1.04 -1.23 -1.49 114.28 118.12 3flm n THR 35 Ca 0.19 1.56 -0.19 0.00 -2.04 0.00 0.00 64.05 63.57 3flm n THR 35 Cb 0.52 -2.47 -0.10 0.00 -1.82 0.00 0.00 70.33 66.46 3flm n THR 35 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3flm h LEU 36 N 0.00 0.85 0.03 -4.42 3.38 -1.90 -0.08 115.31 113.16 3flm h LEU 36 Ca 0.59 -0.70 -0.23 0.00 0.09 0.00 0.00 57.88 57.64 3flm h LEU 36 Cb 1.50 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.97 3flm h LEU 36 CO -0.61 1.50 -1.07 -0.07 0.09 0.00 0.00 178.44 178.28 3flm h LEU 37 N 0.35 0.12 0.73 1.67 3.38 -1.86 -0.72 115.31 118.98 3flm h LEU 37 Ca -0.13 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.68 3flm h LEU 37 Cb 1.72 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 42.44 3flm h LEU 37 CO 0.20 1.10 -0.35 0.74 0.09 0.00 0.00 178.44 180.22 3flm h THR 38 N 0.02 0.27 -0.52 0.22 2.02 -1.17 -1.80 112.91 111.96 3flm h THR 38 Ca -0.04 -0.05 -0.01 0.00 0.77 0.00 0.00 66.41 67.08 3flm h THR 38 Cb 1.82 0.29 -0.03 0.00 -1.74 0.00 0.00 68.15 68.49 3flm h THR 38 CO 0.15 0.01 0.28 -0.07 0.37 0.00 0.00 175.52 176.26 3flm h LEU 39 N -1.01 0.62 -0.81 2.58 3.38 -1.06 0.43 115.31 119.44 3flm h LEU 39 Ca -0.10 -0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.72 3flm h LEU 39 Cb 0.76 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 3flm h LEU 39 CO 0.16 0.51 -0.25 0.00 0.09 0.00 0.00 178.44 178.95 3flm h ALA 40 N 1.60 0.99 0.00 1.53 0.00 -0.86 -1.75 119.26 120.77 3flm h ALA 40 Ca 0.18 -0.36 -0.15 0.00 0.00 0.00 0.00 54.91 54.58 3flm h ALA 40 Cb 0.02 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3flm h ALA 40 CO -0.03 0.60 -0.70 0.00 0.00 0.00 0.00 179.25 179.12 3flm h ALA 41 N 1.19 0.83 -0.39 0.00 0.00 -0.73 -2.51 119.26 117.65 3flm h ALA 41 Ca 0.07 -0.63 -0.14 0.00 0.00 0.00 0.00 54.91 54.21 3flm h ALA 41 Cb 0.71 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3flm h ALA 41 CO 0.05 0.87 -0.31 0.00 0.00 0.00 0.00 179.25 179.87 3flm h ALA 42 N 1.30 0.71 0.00 0.00 0.00 -0.78 -2.93 119.26 117.57 3flm h ALA 42 Ca -0.01 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.48 3flm h ALA 42 Cb 1.24 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3flm h ALA 42 CO 0.09 0.67 0.00 0.39 0.00 0.00 0.00 179.25 180.40 3flm n GLU 43 N -4.08 0.89 -3.85 0.00 1.02 -0.67 -4.66 120.64 109.30 3flm n GLU 43 Ca -0.01 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.77 3flm n GLU 43 Cb 0.50 -1.43 -0.12 0.00 -0.02 0.00 0.00 31.44 30.36 3flm n GLU 43 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3flm s ASN 44 N -1.88 5.08 0.00 1.62 3.84 -1.03 -4.98 114.94 117.59 3flm s ASN 44 Ca 0.37 -0.19 0.22 0.00 0.21 0.00 0.00 52.86 53.48 3flm s ASN 44 Cb 0.17 -1.90 0.52 0.00 -0.55 0.00 0.00 41.25 39.49 3flm s ASN 44 CO 0.29 0.01 1.45 -1.54 -2.79 0.00 0.00 177.10 174.51 3flm n SER 45 N 4.65 3.40 0.04 -4.21 3.41 -1.26 -3.09 113.62 116.56 3flm n SER 45 Ca -0.16 -1.98 0.06 0.00 -0.26 0.00 0.00 58.87 56.53 3flm n SER 45 Cb 0.52 -0.31 0.29 0.00 -0.26 0.00 0.00 64.21 64.44 3flm n SER 45 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3flm n ALA 46 N 1.41 1.44 -2.79 7.33 0.00 -1.26 -4.88 120.51 121.76 3flm n ALA 46 Ca 0.20 0.01 -0.36 0.00 0.00 0.00 0.00 53.44 53.29 3flm n ALA 46 Cb 0.58 -1.21 -0.08 0.00 0.00 0.00 0.00 19.45 18.74 3flm n ALA 46 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3flm s PHE 47 N -3.10 3.38 -0.33 0.00 0.08 -1.18 -4.61 117.98 112.22 3flm s PHE 47 Ca 0.04 0.35 -0.26 0.00 0.12 0.00 0.00 56.93 57.17 3flm s PHE 47 Cb 0.07 -1.89 0.01 0.00 -0.57 0.00 0.00 43.02 40.64 3flm s PHE 47 CO 0.21 0.57 0.95 0.42 -0.10 0.00 0.00 175.22 177.28 3flm s ILE 48 N -0.85 4.61 0.10 0.64 1.01 0.17 -4.95 121.20 121.93 3flm s ILE 48 Ca 0.13 1.42 -0.25 0.00 0.00 0.00 0.00 60.65 61.95 3flm s ILE 48 Cb -0.12 -4.32 -0.06 0.00 0.01 0.00 0.00 42.46 37.97 3flm s ILE 48 CO 0.03 -0.43 0.79 -1.00 0.00 0.00 0.00 174.94 174.32 3flm s HIS 49 N 3.40 3.81 0.14 3.97 3.76 -1.26 -1.63 115.29 127.48 3flm s HIS 49 Ca 0.40 1.56 0.07 0.00 -0.15 0.00 0.00 55.06 56.94 3flm s HIS 49 Cb -0.13 -2.82 -0.04 0.00 1.11 0.00 0.00 32.58 30.71 3flm s HIS 49 CO 0.15 0.37 -0.16 -1.01 -0.85 0.00 0.00 174.74 173.24 3flm s HIS 50 N -0.49 1.62 0.02 1.40 3.76 0.81 -4.96 115.29 117.44 3flm s HIS 50 Ca 0.38 -0.51 -0.05 0.00 -0.15 0.00 0.00 55.06 54.74 3flm s HIS 50 Cb -0.22 -0.83 -0.01 0.00 1.11 0.00 0.00 32.58 32.63 3flm s HIS 50 CO 0.25 0.23 0.08 0.95 -0.85 0.00 0.00 174.74 175.40 3flm s THR 51 N -2.03 0.11 -0.13 1.30 -4.23 -1.26 -0.95 115.64 108.46 3flm s THR 51 Ca 0.12 -0.91 -0.30 0.00 -1.18 0.00 0.00 61.69 59.42 3flm s THR 51 Cb -0.06 -0.57 0.10 0.00 1.34 0.00 0.00 72.50 73.31 3flm s THR 51 CO 0.05 -0.50 0.85 -2.28 -0.54 0.00 0.00 174.62 172.20 3flm s HIS 52 N -1.87 -0.53 -0.23 3.99 5.04 -1.17 -4.96 115.29 115.56 3flm s HIS 52 Ca -0.11 0.98 0.21 0.00 -1.54 0.00 0.00 55.06 54.59 3flm s HIS 52 Cb -0.06 0.41 0.00 0.00 0.04 0.00 0.00 32.58 32.98 3flm s HIS 52 CO -0.01 -0.45 1.06 0.27 -2.34 0.00 0.00 174.74 173.27 3flm h PHE 53 N 3.05 0.00 -3.33 3.88 -5.15 -1.97 -3.40 116.94 110.01 3flm h PHE 53 Ca -0.24 0.00 -0.74 0.00 -0.20 0.00 0.00 57.97 56.80 3flm h PHE 53 Cb 1.15 0.00 -0.23 0.00 0.22 0.00 0.00 35.95 37.09 3flm h PHE 53 CO 0.34 0.14 -0.35 0.34 -2.00 0.00 0.00 178.31 176.78 3flm s ASP 54 N -5.57 6.09 0.54 -0.68 -1.08 -1.26 -4.97 116.67 109.74 3flm s ASP 54 Ca -0.00 -1.32 0.27 0.00 -0.52 0.00 0.00 52.55 50.99 3flm s ASP 54 Cb 0.09 -2.16 1.44 0.00 -1.46 0.00 0.00 42.92 40.83 3flm s ASP 54 CO 0.78 -0.62 1.97 -0.33 0.52 0.00 0.00 175.17 177.49 3flm h GLU 55 N 8.71 0.00 -0.31 4.34 3.07 -1.90 0.78 114.58 129.26 3flm h GLU 55 Ca -0.28 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.55 3flm h GLU 55 Cb 1.11 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.01 3flm h GLU 55 CO 0.86 0.00 0.08 -0.09 -1.40 0.00 0.00 179.01 178.46 3flm h ARG 56 N 0.00 0.49 -0.76 2.33 2.43 -1.89 -1.29 114.38 115.69 3flm h ARG 56 Ca 0.28 -0.11 0.04 0.00 -0.81 0.00 0.00 59.98 59.37 3flm h ARG 56 Cb 1.16 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 30.59 3flm h ARG 56 CO -0.00 0.55 0.47 0.78 -1.51 0.00 0.00 179.97 180.26 3flm h GLY 57 N 0.34 1.11 0.93 2.80 0.00 0.13 -1.89 103.07 106.49 3flm h GLY 57 Ca 0.10 -0.35 0.01 0.00 0.00 0.00 0.00 47.33 47.09 3flm h GLY 57 CO -0.00 0.28 0.13 -2.00 0.00 0.00 0.00 176.54 174.95 3flm h LEU 58 N 0.91 0.20 -0.46 3.11 5.85 -0.45 -0.39 115.31 124.08 3flm h LEU 58 Ca 0.31 0.01 0.06 0.00 0.84 0.00 0.00 57.88 59.10 3flm h LEU 58 Cb 0.06 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.00 3flm h LEU 58 CO -0.13 0.15 0.14 1.23 -0.34 0.00 0.00 178.44 179.50 3flm h GLY 59 N 0.27 0.59 2.00 3.75 0.00 -0.85 -0.80 103.07 108.02 3flm h GLY 59 Ca 0.09 -0.07 -0.04 0.00 0.00 0.00 0.00 47.33 47.31 3flm h GLY 59 CO -0.05 -0.01 -0.19 0.45 0.00 0.00 0.00 176.54 176.74 3flm h HIS 60 N 0.30 0.00 -0.21 5.60 3.86 -0.48 -0.88 115.15 123.34 3flm h HIS 60 Ca 0.22 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.36 3flm h HIS 60 Cb 0.24 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.71 3flm h HIS 60 CO -0.17 0.19 -0.14 1.25 0.86 0.00 0.00 177.93 179.92 3flm h LEU 61 N 0.00 0.49 -0.90 2.43 5.85 0.19 0.11 115.31 123.48 3flm h LEU 61 Ca -0.00 -0.44 -0.05 0.00 0.84 0.00 0.00 57.88 58.23 3flm h LEU 61 Cb 0.39 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 3flm h LEU 61 CO 0.02 0.82 0.19 0.00 -0.34 0.00 0.00 178.44 179.14 3flm h ALA 62 N 0.68 1.11 0.23 1.25 0.00 -0.94 -0.12 119.26 121.48 3flm h ALA 62 Ca 0.04 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3flm h ALA 62 Cb 0.65 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3flm h ALA 62 CO 0.04 0.61 -0.22 1.25 0.00 0.00 0.00 179.25 180.93 3flm h LEU 63 N 0.97 -0.57 0.00 0.00 5.85 -0.73 0.99 115.31 121.81 3flm h LEU 63 Ca 0.21 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.98 3flm h LEU 63 Cb 0.29 0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.51 3flm h LEU 63 CO -0.01 -0.32 0.00 0.61 -0.34 0.00 0.00 178.44 178.38 3flm n GLY 64 N -1.34 -2.25 0.31 3.75 0.00 0.34 -0.47 105.19 105.53 3flm n GLY 64 Ca -0.08 0.45 0.13 0.00 0.00 0.00 0.00 46.02 46.51 3flm n GLY 64 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3flm h LEU 65 N 0.00 0.22 -0.07 0.99 3.38 -0.70 -2.42 115.31 116.71 3flm h LEU 65 Ca 0.00 0.17 -0.06 0.00 0.09 0.00 0.00 57.88 58.08 3flm h LEU 65 Cb 0.00 0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3flm h LEU 65 CO 0.00 -0.05 -0.18 0.00 0.09 0.00 0.00 178.44 178.30 3flm h ALA 66 N 1.72 0.11 -0.60 1.53 0.00 -0.58 -2.21 119.26 119.23 3flm h ALA 66 Ca 0.55 -0.37 0.12 0.00 0.00 0.00 0.00 54.91 55.21 3flm h ALA 66 Cb 1.07 -0.01 -0.12 0.00 0.00 0.00 0.00 17.79 18.73 3flm h ALA 66 CO -0.56 0.05 -0.20 -0.22 0.00 0.00 0.00 179.25 178.31 3flm h LYS 67 N -0.27 -0.05 0.14 0.00 3.64 -0.43 0.38 116.57 119.98 3flm h LYS 67 Ca -0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 3flm h LYS 67 Cb 0.79 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 3flm h LYS 67 CO 0.04 -0.03 -0.07 0.28 -2.27 0.00 0.00 179.45 177.40 3flm h VAL 68 N -0.05 0.78 0.00 2.00 2.07 -1.46 -3.33 116.25 116.25 3flm h VAL 68 Ca 0.28 -1.21 -0.03 0.00 0.82 0.00 0.00 66.70 66.56 3flm h VAL 68 Cb 0.48 1.35 -0.00 0.00 -1.52 0.00 0.00 31.29 31.59 3flm h VAL 68 CO -0.64 0.22 -0.12 0.77 0.02 0.00 0.00 177.57 177.81 3flm h SER 69 N -0.92 0.00 -0.06 0.57 4.64 -1.34 -3.46 113.55 112.98 3flm h SER 69 Ca -0.02 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.27 3flm h SER 69 Cb 0.50 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 3flm h SER 69 CO 0.03 0.12 -0.02 0.29 -0.87 0.00 0.00 176.83 176.38 3flm n LYS 70 N -3.29 -0.79 -4.21 4.77 4.76 0.13 -4.99 118.16 114.54 3flm n LYS 70 Ca 0.00 0.29 -0.26 0.00 -2.87 0.00 0.00 58.31 55.48 3flm n LYS 70 Cb 0.36 -3.95 -0.07 0.00 -1.84 0.00 0.00 35.03 29.53 3flm n LYS 70 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 3flm s GLN 71 N -1.10 2.42 0.60 1.97 -2.07 -1.25 -4.97 119.66 115.25 3flm s GLN 71 Ca 0.00 -1.13 -0.17 0.00 -1.82 0.00 0.00 55.36 52.23 3flm s GLN 71 Cb 0.00 -2.35 -0.03 0.00 -1.09 0.00 0.00 33.01 29.54 3flm s GLN 71 CO 0.00 0.44 1.12 -1.25 -1.32 0.00 0.00 175.29 174.28 3flm s PRO 72 N -3.06 3.10 -0.03 9.60 0.04 -1.26 -4.62 135.00 138.76 3flm s PRO 72 Ca 0.28 1.50 0.04 0.00 0.04 0.00 0.00 61.00 62.86 3flm s PRO 72 Cb -0.09 -1.98 -0.00 0.00 0.04 0.00 0.00 34.50 32.47 3flm s PRO 72 CO 0.19 -1.03 -0.14 0.08 0.04 0.00 0.00 177.00 176.14 3flm s VAL 73 N -2.05 1.18 0.09 -0.36 1.01 -0.59 -4.31 120.40 115.37 3flm s VAL 73 Ca 0.70 -0.59 -0.02 0.00 0.00 0.00 0.00 61.98 62.07 3flm s VAL 73 Cb -0.22 -1.02 -0.05 0.00 0.00 0.00 0.00 36.38 35.09 3flm s VAL 73 CO 0.34 0.35 0.28 0.00 0.00 0.00 0.00 175.10 176.07 3flm s ALA 74 N 0.05 3.91 -0.00 5.51 0.00 0.04 -0.51 121.76 130.75 3flm s ALA 74 Ca -0.02 -0.70 0.04 0.00 0.00 0.00 0.00 51.96 51.27 3flm s ALA 74 Cb -0.10 -1.97 -0.01 0.00 0.00 0.00 0.00 23.12 21.04 3flm s ALA 74 CO 0.01 0.75 -0.13 0.08 0.00 0.00 0.00 175.76 176.47 3flm s VAL 75 N -1.56 1.02 -0.05 0.00 1.01 0.29 -1.45 120.40 119.65 3flm s VAL 75 Ca 0.37 -0.59 0.03 0.00 0.00 0.00 0.00 61.98 61.79 3flm s VAL 75 Cb -0.13 -0.86 0.00 0.00 0.00 0.00 0.00 36.38 35.40 3flm s VAL 75 CO 0.26 0.26 -0.15 -0.63 0.00 0.00 0.00 175.10 174.83 3flm s ILE 76 N -0.36 1.30 0.04 2.22 1.01 -0.60 0.20 121.20 125.01 3flm s ILE 76 Ca 0.05 -0.62 -0.09 0.00 0.00 0.00 0.00 60.65 59.99 3flm s ILE 76 Cb -0.05 -1.14 0.00 0.00 0.01 0.00 0.00 42.46 41.28 3flm s ILE 76 CO -0.00 0.38 0.19 0.68 0.00 0.00 0.00 174.94 176.19 3flm s VAL 77 N 0.29 0.11 0.93 2.92 -7.23 -1.15 -3.42 120.40 112.85 3flm s VAL 77 Ca -0.08 -0.91 -0.13 0.00 -1.81 0.00 0.00 61.98 59.04 3flm s VAL 77 Cb -0.13 -0.91 0.15 0.00 0.56 0.00 0.00 36.38 36.05 3flm s VAL 77 CO 0.03 -0.50 1.15 0.28 -0.31 0.00 0.00 175.10 175.75 3flm s THR 78 N -2.57 1.97 0.60 5.32 -1.32 -1.26 -1.23 115.64 117.15 3flm s THR 78 Ca -0.05 0.00 -0.10 0.00 -1.21 0.00 0.00 61.69 60.33 3flm s THR 78 Cb -0.01 -2.75 -0.03 0.00 -1.51 0.00 0.00 72.50 68.20 3flm s THR 78 CO -0.04 0.00 0.98 -0.94 -2.21 0.00 0.00 174.62 172.41 3flm s SER 79 N -4.09 6.08 0.00 8.08 1.04 -1.19 -4.07 113.70 119.55 3flm s SER 79 Ca 0.65 1.23 0.00 0.00 0.48 0.00 0.00 55.95 58.31 3flm s SER 79 Cb -0.14 -2.30 0.00 0.00 0.10 0.00 0.00 66.02 63.69 3flm s SER 79 CO 0.53 -0.89 0.00 0.61 0.98 0.00 0.00 173.24 174.47 3flm n GLY 80 N -2.68 -1.82 0.41 7.32 0.00 -1.26 -4.63 105.19 102.54 3flm n GLY 80 Ca 0.05 -1.90 0.21 0.00 0.00 0.00 0.00 46.02 44.38 3flm n GLY 80 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3flm h THR 81 N 0.00 0.25 -0.68 2.61 1.35 -1.93 0.63 112.91 115.14 3flm h THR 81 Ca 0.00 0.00 0.15 0.00 -0.55 0.00 0.00 66.41 66.01 3flm h THR 81 Cb 0.00 0.50 -0.11 0.00 -1.73 0.00 0.00 68.15 66.80 3flm h THR 81 CO 0.00 0.00 0.05 0.00 -0.25 0.00 0.00 175.52 175.32 3flm h ALA 82 N 1.24 0.74 -0.46 6.62 0.00 -1.82 0.14 119.26 125.72 3flm h ALA 82 Ca 0.24 0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.40 3flm h ALA 82 Cb 1.47 0.32 -0.05 0.00 0.00 0.00 0.00 17.79 19.53 3flm h ALA 82 CO -0.00 -0.38 0.17 0.28 0.00 0.00 0.00 179.25 179.31 3flm h VAL 83 N 0.16 0.85 -0.30 0.00 2.07 0.13 -2.02 116.25 117.15 3flm h VAL 83 Ca 0.37 -0.12 0.09 0.00 0.82 0.00 0.00 66.70 67.86 3flm h VAL 83 Cb 0.62 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 3flm h VAL 83 CO -0.55 0.06 0.29 0.00 0.02 0.00 0.00 177.57 177.39 3flm h ALA 84 N 1.30 2.03 0.00 1.67 0.00 -0.80 -1.25 119.26 122.21 3flm h ALA 84 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3flm h ALA 84 Cb 0.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3flm h ALA 84 CO -0.22 -0.44 0.00 0.09 0.00 0.00 0.00 179.25 178.68 3flm n ASN 85 N -3.92 0.00 0.00 0.00 3.02 -0.76 -1.29 115.26 112.31 3flm n ASN 85 Ca 0.04 0.12 0.13 0.00 -0.03 0.00 0.00 54.58 54.85 3flm n ASN 85 Cb 0.44 -0.33 0.60 0.00 -0.61 0.00 0.00 39.78 39.89 3flm n ASN 85 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3flm n LEU 86 N -1.33 0.00 0.08 3.41 4.77 -0.47 -3.57 117.00 119.89 3flm n LEU 86 Ca 0.08 0.47 -0.12 0.00 -0.03 0.00 0.00 56.01 56.40 3flm n LEU 86 Cb 0.15 -0.47 -0.07 0.00 -2.33 0.00 0.00 43.42 40.71 3flm n LEU 86 CO 0.14 -0.03 0.83 0.22 -1.33 0.00 0.00 177.39 177.22 3flm h TYR 87 N 0.00 -0.14 -0.40 -1.77 5.03 -1.39 -1.90 116.97 116.40 3flm h TYR 87 Ca 0.00 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 3flm h TYR 87 Cb 0.44 0.05 -0.02 0.00 1.55 0.00 0.00 36.73 38.75 3flm h TYR 87 CO 0.00 -0.09 0.26 -1.35 -1.32 0.00 0.00 178.16 175.66 3flm h PRO 88 N -0.13 0.53 -0.29 1.82 0.11 -1.83 -0.35 132.00 131.85 3flm h PRO 88 Ca -0.00 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.03 3flm h PRO 88 Cb 0.12 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.10 3flm h PRO 88 CO -0.01 0.36 -0.01 0.00 -0.21 0.00 0.00 178.00 178.13 3flm h ALA 89 N 1.14 1.45 0.31 -0.75 0.00 -1.81 -1.79 119.26 117.81 3flm h ALA 89 Ca 0.15 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3flm h ALA 89 Cb -0.05 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.61 3flm h ALA 89 CO -0.03 0.39 -0.15 1.25 0.00 0.00 0.00 179.25 180.71 3flm h LEU 90 N 0.42 -0.36 -0.74 0.00 5.85 -0.39 -1.89 115.31 118.22 3flm h LEU 90 Ca 0.09 -0.18 0.08 0.00 0.84 0.00 0.00 57.88 58.72 3flm h LEU 90 Cb 0.29 0.09 -0.11 0.00 0.37 0.00 0.00 40.66 41.31 3flm h LEU 90 CO 0.01 0.03 -0.54 0.40 -0.34 0.00 0.00 178.44 178.00 3flm h ILE 91 N -0.79 0.01 -0.91 4.05 2.04 -1.07 -1.57 117.51 119.27 3flm h ILE 91 Ca -0.04 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.94 3flm h ILE 91 Cb 0.51 0.01 -0.09 0.00 -0.74 0.00 0.00 36.82 36.52 3flm h ILE 91 CO 0.07 0.00 0.53 -0.08 0.00 0.00 0.00 178.15 178.67 3flm h GLU 92 N -0.17 0.78 -0.62 2.37 4.57 -1.12 0.33 114.58 120.72 3flm h GLU 92 Ca 0.15 -0.05 0.02 0.00 -1.18 0.00 0.00 59.36 58.30 3flm h GLU 92 Cb 0.51 -0.18 -0.03 0.00 -0.16 0.00 0.00 28.75 28.89 3flm h GLU 92 CO -0.79 0.52 0.41 0.00 -1.18 0.00 0.00 179.01 177.97 3flm h ALA 93 N 1.53 1.62 0.00 2.92 0.00 -0.53 0.74 119.26 125.54 3flm h ALA 93 Ca 0.47 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.27 3flm h ALA 93 Cb 0.54 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3flm h ALA 93 CO -0.30 0.33 -0.35 0.78 0.00 0.00 0.00 179.25 179.70 3flm h GLY 94 N 0.78 0.00 0.72 0.00 0.00 0.57 1.82 103.07 106.96 3flm h GLY 94 Ca 0.24 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.25 3flm h GLY 94 CO -0.06 0.00 -1.90 1.04 0.00 0.00 0.00 176.54 175.62 3flm n LEU 95 N -3.49 0.85 -0.01 3.11 4.77 0.11 -4.46 117.00 117.87 3flm n LEU 95 Ca -0.00 0.30 0.09 0.00 -0.03 0.00 0.00 56.01 56.37 3flm n LEU 95 Cb 0.51 0.13 -0.16 0.00 -2.33 0.00 0.00 43.42 41.57 3flm n LEU 95 CO 0.36 0.46 -0.75 0.35 -1.33 0.00 0.00 177.39 176.48 3flm n THR 96 N -3.01 0.17 0.00 -5.08 -2.24 0.22 -4.94 114.28 99.39 3flm n THR 96 Ca -0.22 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 3flm n THR 96 Cb 1.07 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 69.24 3flm n THR 96 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3flm n GLY 97 N 1.30 0.71 3.54 3.38 0.00 0.61 -4.99 105.19 109.74 3flm n GLY 97 Ca -0.06 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.52 3flm n GLY 97 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3flm n GLU 98 N -1.08 1.04 -2.85 1.61 4.71 -1.22 -1.81 120.64 121.03 3flm n GLU 98 Ca 0.00 0.37 -0.44 0.00 -0.01 0.00 0.00 57.16 57.08 3flm n GLU 98 Cb 0.00 -1.70 -0.01 0.00 -1.01 0.00 0.00 31.44 28.72 3flm n GLU 98 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 3flm s LYS 99 N -1.56 3.98 -0.21 3.49 1.02 -1.26 -2.93 119.74 122.27 3flm s LYS 99 Ca 0.61 -2.27 -0.29 0.00 0.02 0.00 0.00 55.97 54.04 3flm s LYS 99 Cb -0.69 -5.16 0.00 0.00 -0.52 0.00 0.00 37.83 31.47 3flm s LYS 99 CO 0.59 -1.89 1.02 -0.51 -0.92 0.00 0.00 175.35 173.63 3flm s LEU 100 N 2.47 4.13 -0.54 3.17 1.43 -1.25 -1.55 118.68 126.54 3flm s LEU 100 Ca 0.44 1.39 -0.15 0.00 -1.03 0.00 0.00 54.13 54.77 3flm s LEU 100 Cb -0.01 -3.52 0.13 0.00 0.03 0.00 0.00 46.19 42.81 3flm s LEU 100 CO -0.00 -0.62 0.49 -0.63 0.23 0.00 0.00 176.35 175.82 3flm s ILE 101 N 2.95 5.11 -0.75 -0.59 -1.09 0.34 -0.73 121.20 126.44 3flm s ILE 101 Ca 0.44 -1.54 -0.22 0.00 -2.23 0.00 0.00 60.65 57.10 3flm s ILE 101 Cb -0.16 -4.28 0.08 0.00 -1.58 0.00 0.00 42.46 36.52 3flm s ILE 101 CO 0.08 -0.86 1.06 -0.76 -1.23 0.00 0.00 174.94 173.23 3flm s LEU 102 N 1.56 4.36 -0.73 2.97 1.43 -0.46 -0.55 118.68 127.28 3flm s LEU 102 Ca 0.03 -1.20 -0.27 0.00 -1.03 0.00 0.00 54.13 51.67 3flm s LEU 102 Cb -0.29 -2.44 0.03 0.00 0.03 0.00 0.00 46.19 43.52 3flm s LEU 102 CO 0.03 -1.40 1.30 -0.76 0.23 0.00 0.00 176.35 175.74 3flm s LEU 103 N 3.98 3.18 -0.32 1.79 1.43 0.52 -1.46 118.68 127.80 3flm s LEU 103 Ca 0.27 -0.40 -0.14 0.00 -1.03 0.00 0.00 54.13 52.83 3flm s LEU 103 Cb -0.13 -2.59 -0.02 0.00 0.03 0.00 0.00 46.19 43.49 3flm s LEU 103 CO 0.05 -1.84 0.32 0.42 0.23 0.00 0.00 176.35 175.53 3flm s THR 104 N 5.82 5.21 0.53 5.49 -4.23 0.11 -2.95 115.64 125.61 3flm s THR 104 Ca 0.36 0.12 -0.18 0.00 -1.18 0.00 0.00 61.69 60.81 3flm s THR 104 Cb -0.08 -3.74 -0.06 0.00 1.34 0.00 0.00 72.50 69.95 3flm s THR 104 CO 0.16 0.01 1.05 0.00 -0.54 0.00 0.00 174.62 175.30 3flm s ALA 105 N 1.95 2.81 -0.02 3.99 0.00 -0.36 -0.28 121.76 129.85 3flm s ALA 105 Ca 0.11 0.54 -0.09 0.00 0.00 0.00 0.00 51.96 52.52 3flm s ALA 105 Cb -0.16 -3.25 0.01 0.00 0.00 0.00 0.00 23.12 19.71 3flm s ALA 105 CO 0.11 -0.54 0.19 0.34 0.00 0.00 0.00 175.76 175.86 3flm s ASP 106 N -2.29 -0.07 0.65 0.00 -1.08 -0.52 -3.17 116.67 110.20 3flm s ASP 106 Ca 0.66 -0.03 -0.17 0.00 -0.52 0.00 0.00 52.55 52.49 3flm s ASP 106 Cb -0.17 0.27 -0.00 0.00 -1.46 0.00 0.00 42.92 41.56 3flm s ASP 106 CO 0.27 -0.33 1.24 -0.13 0.52 0.00 0.00 175.17 176.73 3flm s ARG 107 N -1.10 2.58 0.75 4.34 1.81 -1.26 -2.17 118.95 123.90 3flm s ARG 107 Ca -0.12 1.88 -0.11 0.00 -1.72 0.00 0.00 55.73 55.66 3flm s ARG 107 Cb -0.06 -1.87 0.04 0.00 -0.45 0.00 0.00 34.95 32.61 3flm s ARG 107 CO 0.02 -1.53 1.08 -1.25 -0.68 0.00 0.00 175.30 172.94 3flm s PRO 108 N -3.53 2.50 0.01 3.54 0.04 -1.23 -4.62 135.00 131.71 3flm s PRO 108 Ca 0.78 0.83 0.29 0.00 0.04 0.00 0.00 61.00 62.94 3flm s PRO 108 Cb -0.32 -1.95 1.20 0.00 0.04 0.00 0.00 34.50 33.47 3flm s PRO 108 CO 0.39 -1.38 1.91 -0.35 0.04 0.00 0.00 177.00 177.61 3flm n PRO 109 N -3.30 0.01 0.33 0.56 -0.04 -1.26 -0.47 135.00 130.84 3flm n PRO 109 Ca 0.07 0.01 0.22 0.00 -0.04 0.00 0.00 63.50 63.76 3flm n PRO 109 Cb 0.55 -1.51 1.18 0.00 -0.04 0.00 0.00 33.50 33.67 3flm n PRO 109 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3flm h GLU 110 N 0.00 0.00 -0.60 0.54 3.07 -2.01 -2.92 114.58 112.66 3flm h GLU 110 Ca 0.00 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.84 3flm h GLU 110 Cb 0.51 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.41 3flm h GLU 110 CO 0.00 0.00 0.02 1.28 -1.40 0.00 0.00 179.01 178.91 3flm n LEU 111 N -3.19 5.77 -4.68 1.33 4.77 0.39 -4.92 117.00 116.47 3flm n LEU 111 Ca -0.03 -2.94 -0.35 0.00 -0.03 0.00 0.00 56.01 52.66 3flm n LEU 111 Cb 0.08 -0.69 -0.09 0.00 -2.33 0.00 0.00 43.42 40.39 3flm n LEU 111 CO 0.21 0.64 -0.25 -0.63 -1.33 0.00 0.00 177.39 176.03 3flm s ILE 112 N -2.78 4.77 -0.92 -0.08 -1.09 -1.11 -4.44 121.20 115.56 3flm s ILE 112 Ca 0.55 -0.05 -0.03 0.00 -2.23 0.00 0.00 60.65 58.89 3flm s ILE 112 Cb 0.42 -3.10 0.00 0.00 -1.58 0.00 0.00 42.46 38.20 3flm s ILE 112 CO 0.16 0.52 0.35 0.47 -1.23 0.00 0.00 174.94 175.21 3flm n ASP 113 N 2.96 -4.23 -0.90 3.58 8.00 -1.26 -4.88 116.55 119.82 3flm n ASP 113 Ca -0.18 -0.17 0.03 0.00 0.71 0.00 0.00 54.79 55.18 3flm n ASP 113 Cb 0.53 -3.11 0.03 0.00 -0.02 0.00 0.00 41.12 38.54 3flm n ASP 113 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3flm n GLY 115 N 0.08 1.53 3.54 0.00 0.00 -1.26 -5.01 105.19 104.07 3flm n GLY 115 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 3flm n GLY 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3flm n ALA 116 N 0.77 -1.96 -2.29 4.61 0.00 -1.26 -4.98 120.51 115.40 3flm n ALA 116 Ca -0.20 -0.79 -0.38 0.00 0.00 0.00 0.00 53.44 52.06 3flm n ALA 116 Cb 0.65 -2.02 -0.06 0.00 0.00 0.00 0.00 19.45 18.02 3flm n ALA 116 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3flm s ASN 117 N -2.40 7.02 -1.15 0.00 3.04 -1.26 -4.29 114.94 115.89 3flm s ASN 117 Ca 0.65 1.23 -0.10 0.00 0.04 0.00 0.00 52.86 54.67 3flm s ASN 117 Cb -0.22 -2.35 -0.03 0.00 -1.54 0.00 0.00 41.25 37.11 3flm s ASN 117 CO 0.62 0.25 0.82 1.67 -3.04 0.00 0.00 177.10 177.42 3flm n GLN 118 N 1.57 -2.68 -3.69 0.43 7.27 -1.26 -4.98 117.38 114.05 3flm n GLN 118 Ca -0.10 0.65 -0.13 0.00 0.07 0.00 0.00 57.00 57.50 3flm n GLN 118 Cb 0.51 -5.02 -0.13 0.00 2.41 0.00 0.00 30.24 28.02 3flm n GLN 118 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3flm s ALA 119 N -3.49 -0.63 0.28 1.69 0.00 -1.26 -4.07 121.76 114.28 3flm s ALA 119 Ca 0.33 1.04 -0.05 0.00 0.00 0.00 0.00 51.96 53.28 3flm s ALA 119 Cb -0.08 -0.90 -0.01 0.00 0.00 0.00 0.00 23.12 22.13 3flm s ALA 119 CO 0.80 -0.47 0.39 0.96 0.00 0.00 0.00 175.76 177.45 3flm s ILE 120 N 1.95 0.00 -0.37 0.00 -4.36 -1.26 -4.79 121.20 112.38 3flm s ILE 120 Ca -0.03 -1.65 -0.23 0.00 -0.26 0.00 0.00 60.65 58.48 3flm s ILE 120 Cb -0.11 -2.46 0.01 0.00 1.25 0.00 0.00 42.46 41.15 3flm s ILE 120 CO -0.09 0.00 0.79 -0.13 0.24 0.00 0.00 174.94 175.75 3flm s ARG 121 N -3.63 3.75 -0.22 0.37 0.52 -1.26 -4.91 118.95 113.56 3flm s ARG 121 Ca 0.30 0.31 -0.12 0.00 -0.52 0.00 0.00 55.73 55.70 3flm s ARG 121 Cb 0.01 -3.81 -0.18 0.00 0.52 0.00 0.00 34.95 31.49 3flm s ARG 121 CO 0.15 -0.86 0.00 1.04 0.02 0.00 0.00 175.30 175.65 3flm n GLN 122 N 6.44 0.63 -1.67 3.54 6.02 -1.26 -4.65 117.38 126.42 3flm n GLN 122 Ca 0.03 0.35 -0.46 0.00 -0.01 0.00 0.00 57.00 56.91 3flm n GLN 122 Cb 0.48 -1.63 -0.04 0.00 1.02 0.00 0.00 30.24 30.07 3flm n GLN 122 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 3flm n PRO 123 N -3.99 2.19 0.00 -1.09 -0.02 -1.26 -1.65 135.00 129.18 3flm n PRO 123 Ca -0.41 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 3flm n PRO 123 Cb 0.87 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 3flm n PRO 123 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3flm n GLY 124 N 3.59 2.12 0.53 -1.23 0.00 -1.26 -4.92 105.19 104.01 3flm n GLY 124 Ca 0.18 0.00 0.35 0.00 0.00 0.00 0.00 46.02 46.55 3flm n GLY 124 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3flm h MET 125 N 0.41 0.05 -0.55 1.61 2.86 -1.58 0.16 114.93 117.89 3flm h MET 125 Ca 0.00 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3flm h MET 125 Cb 0.00 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.65 3flm h MET 125 CO 0.00 0.03 0.00 1.19 1.06 0.00 0.00 176.91 179.19 3flm n PHE 126 N -4.24 1.00 -3.06 -0.22 3.72 -1.26 -5.03 117.46 108.37 3flm n PHE 126 Ca 0.27 -0.57 0.00 0.00 -0.05 0.00 0.00 57.45 57.09 3flm n PHE 126 Cb 1.25 -0.12 0.00 0.00 -0.94 0.00 0.00 39.48 39.67 3flm n PHE 126 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3flm n ALA 127 N 0.93 0.00 0.97 4.37 0.00 0.56 -2.28 120.51 125.06 3flm n ALA 127 Ca 0.21 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.78 3flm n ALA 127 Cb 0.68 0.00 0.49 0.00 0.00 0.00 0.00 19.45 20.63 3flm n ALA 127 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3flm n SER 128 N 0.84 0.20 -0.27 0.00 3.41 -1.26 -4.32 113.62 112.21 3flm n SER 128 Ca 0.00 0.28 0.02 0.00 -0.26 0.00 0.00 58.87 58.91 3flm n SER 128 Cb 0.00 -0.28 0.15 0.00 -0.26 0.00 0.00 64.21 63.82 3flm n SER 128 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 3flm h HIS 129 N 0.00 0.77 -4.16 7.33 -0.00 -1.88 -3.43 115.15 113.79 3flm h HIS 129 Ca 0.00 0.03 -0.50 0.00 -0.00 0.00 0.00 60.37 59.90 3flm h HIS 129 Cb 0.52 -0.23 0.14 0.00 -0.00 0.00 0.00 27.41 27.84 3flm h HIS 129 CO 0.00 0.32 0.27 -1.25 -0.00 0.00 0.00 177.93 177.27 3flm s PRO 130 N -6.05 1.59 0.02 2.45 0.04 -1.26 -4.68 135.00 127.12 3flm s PRO 130 Ca -0.12 0.98 -0.04 0.00 0.04 0.00 0.00 61.00 61.86 3flm s PRO 130 Cb 0.18 -1.83 -0.28 0.00 0.04 0.00 0.00 34.50 32.61 3flm s PRO 130 CO 0.77 -2.05 0.94 1.15 0.04 0.00 0.00 177.00 177.85 3flm h THR 131 N -1.42 1.26 -4.15 1.26 2.02 -0.17 -3.46 112.91 108.25 3flm h THR 131 Ca -0.47 -2.86 -0.53 0.00 0.77 0.00 0.00 66.41 63.32 3flm h THR 131 Cb 1.26 2.83 -0.30 0.00 -1.74 0.00 0.00 68.15 70.21 3flm h THR 131 CO 0.53 0.84 -0.83 -1.00 0.37 0.00 0.00 175.52 175.43 3flm s HIS 132 N -2.63 1.51 -0.05 3.16 3.76 -1.16 -5.05 115.29 114.83 3flm s HIS 132 Ca -0.08 -0.33 0.06 0.00 -0.15 0.00 0.00 55.06 54.56 3flm s HIS 132 Cb 0.07 -0.99 -0.01 0.00 1.11 0.00 0.00 32.58 32.75 3flm s HIS 132 CO 0.87 -0.07 -0.24 -1.12 -0.85 0.00 0.00 174.74 173.33 3flm s SER 133 N -0.23 3.17 -0.09 1.40 0.01 -1.26 -1.99 113.70 114.71 3flm s SER 133 Ca 0.03 -0.47 0.04 0.00 1.31 0.00 0.00 55.95 56.86 3flm s SER 133 Cb -0.08 -0.74 0.00 0.00 0.21 0.00 0.00 66.02 65.41 3flm s SER 133 CO 0.00 0.27 -0.22 -0.63 0.41 0.00 0.00 173.24 173.07 3flm s ILE 134 N -0.30 1.87 -0.43 1.44 1.01 -0.05 -4.91 121.20 119.83 3flm s ILE 134 Ca 0.01 -0.92 -0.05 0.00 0.00 0.00 0.00 60.65 59.69 3flm s ILE 134 Cb -0.13 -1.62 0.11 0.00 0.01 0.00 0.00 42.46 40.83 3flm s ILE 134 CO 0.02 0.52 0.26 -0.44 0.00 0.00 0.00 174.94 175.30 3flm s SER 135 N 0.33 5.41 0.37 3.58 0.01 -1.26 -1.98 113.70 120.16 3flm s SER 135 Ca -0.16 -2.00 -0.25 0.00 1.31 0.00 0.00 55.95 54.85 3flm s SER 135 Cb -0.17 -1.89 -0.09 0.00 0.21 0.00 0.00 66.02 64.08 3flm s SER 135 CO 0.07 -0.59 1.08 -0.76 0.41 0.00 0.00 173.24 173.45 3flm s LEU 136 N 1.20 4.24 0.91 2.44 1.43 -0.94 -4.96 118.68 123.00 3flm s LEU 136 Ca 0.07 2.14 -0.13 0.00 -1.03 0.00 0.00 54.13 55.19 3flm s LEU 136 Cb -0.24 -4.04 0.14 0.00 0.03 0.00 0.00 46.19 42.08 3flm s LEU 136 CO -0.03 -0.45 1.17 -2.16 0.23 0.00 0.00 176.35 175.10 3flm s PRO 137 N -2.24 1.16 -0.00 1.29 0.04 -1.26 -4.51 135.00 129.48 3flm s PRO 137 Ca 0.55 0.15 -0.34 0.00 0.04 0.00 0.00 61.00 61.39 3flm s PRO 137 Cb -0.26 -1.85 -0.13 0.00 0.04 0.00 0.00 34.50 32.30 3flm s PRO 137 CO 0.32 -2.16 1.77 -2.13 0.04 0.00 0.00 177.00 174.84 3flm n ARG 138 N -3.71 2.14 -1.69 4.56 0.63 -1.26 -4.65 116.66 112.68 3flm n ARG 138 Ca 0.08 0.78 -0.43 0.00 -0.92 0.00 0.00 57.85 57.36 3flm n ARG 138 Cb 0.60 -2.59 -0.03 0.00 0.45 0.00 0.00 32.46 30.88 3flm n ARG 138 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 3flm n PRO 139 N 5.44 2.64 -3.84 -0.14 -0.02 -1.26 -5.01 135.00 132.82 3flm n PRO 139 Ca 0.21 0.96 -0.12 0.00 -2.02 0.00 0.00 63.50 62.53 3flm n PRO 139 Cb 0.29 -2.82 -0.12 0.00 -0.02 0.00 0.00 33.50 30.83 3flm n PRO 139 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 3flm s THR 140 N 2.31 0.03 -1.48 3.45 -1.32 -1.26 -4.89 115.64 112.48 3flm s THR 140 Ca 0.81 -0.21 0.18 0.00 -1.21 0.00 0.00 61.69 61.25 3flm s THR 140 Cb -0.53 -0.28 0.33 0.00 -1.51 0.00 0.00 72.50 70.50 3flm s THR 140 CO 0.38 -0.12 1.52 0.00 -2.21 0.00 0.00 174.62 174.19 3flm n GLN 141 N 2.53 0.28 0.06 7.08 6.02 -1.26 -2.52 117.38 129.57 3flm n GLN 141 Ca -0.16 0.11 0.08 0.00 -0.01 0.00 0.00 57.00 57.02 3flm n GLN 141 Cb 0.58 -1.50 0.35 0.00 1.02 0.00 0.00 30.24 30.69 3flm n GLN 141 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 3flm n ASP 142 N -1.26 0.26 -4.39 1.08 8.00 -1.26 -4.51 116.55 114.47 3flm n ASP 142 Ca 0.09 0.58 -0.35 0.00 0.71 0.00 0.00 54.79 55.81 3flm n ASP 142 Cb 0.13 -0.63 -0.13 0.00 -0.02 0.00 0.00 41.12 40.48 3flm n ASP 142 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3flm s ILE 143 N -3.15 3.71 0.73 0.53 1.01 -1.05 -5.06 121.20 117.92 3flm s ILE 143 Ca 0.04 -0.39 -0.11 0.00 0.00 0.00 0.00 60.65 60.20 3flm s ILE 143 Cb 0.08 -2.68 0.03 0.00 0.01 0.00 0.00 42.46 39.90 3flm s ILE 143 CO 0.26 0.43 1.07 -2.16 0.00 0.00 0.00 174.94 174.54 3flm s PRO 144 N 1.15 2.61 0.37 2.79 0.04 -1.26 -4.89 135.00 135.82 3flm s PRO 144 Ca 0.02 1.04 0.07 0.00 0.04 0.00 0.00 61.00 62.18 3flm s PRO 144 Cb -0.14 -1.95 0.79 0.00 0.04 0.00 0.00 34.50 33.24 3flm s PRO 144 CO 0.00 -1.35 1.95 0.00 0.04 0.00 0.00 177.00 177.64 3flm h ALA 145 N -0.91 1.76 -0.54 8.56 0.00 -1.92 -2.23 119.26 123.99 3flm h ALA 145 Ca -0.44 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 3flm h ALA 145 Cb 1.22 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 3flm h ALA 145 CO 0.54 0.11 0.33 0.07 0.00 0.00 0.00 179.25 180.30 3flm h ARG 146 N 0.70 0.73 -0.27 0.00 0.11 -1.92 -0.74 114.38 112.98 3flm h ARG 146 Ca 0.32 -0.06 -0.02 0.00 0.10 0.00 0.00 59.98 60.32 3flm h ARG 146 Cb 0.34 -0.16 -0.01 0.00 1.11 0.00 0.00 29.97 31.26 3flm h ARG 146 CO -0.11 0.51 0.09 2.35 0.10 0.00 0.00 179.97 182.91 3flm h TRP 147 N 0.74 0.44 -0.30 4.08 7.01 -1.77 0.13 115.95 126.28 3flm h TRP 147 Ca 0.20 -0.04 -0.16 0.00 2.11 0.00 0.00 58.89 61.00 3flm h TRP 147 Cb -0.03 -0.13 -0.00 0.00 -2.10 0.00 0.00 29.16 26.90 3flm h TRP 147 CO 0.00 0.47 -0.42 1.25 -2.79 0.00 0.00 178.44 176.96 3flm h LEU 148 N 0.28 0.89 -0.62 0.65 5.85 -1.39 0.29 115.31 121.26 3flm h LEU 148 Ca 0.09 -0.50 -0.08 0.00 0.84 0.00 0.00 57.88 58.23 3flm h LEU 148 Cb 0.24 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 3flm h LEU 148 CO -0.00 1.22 0.09 1.62 -0.34 0.00 0.00 178.44 181.02 3flm h VAL 149 N 0.59 1.26 -0.66 1.05 3.04 -1.06 -2.77 116.25 117.70 3flm h VAL 149 Ca 0.03 -1.03 -0.00 0.00 -1.01 0.00 0.00 66.70 64.69 3flm h VAL 149 Cb 1.01 0.72 -0.03 0.00 -2.01 0.00 0.00 31.29 30.98 3flm h VAL 149 CO 0.10 0.38 0.41 0.28 -1.01 0.00 0.00 177.57 177.73 3flm h SER 150 N 0.95 0.78 -0.73 3.17 0.02 -0.34 0.17 113.55 117.57 3flm h SER 150 Ca 0.19 -0.05 0.13 0.00 -0.84 0.00 0.00 61.79 61.21 3flm h SER 150 Cb 0.45 -0.20 -0.05 0.00 0.14 0.00 0.00 62.40 62.75 3flm h SER 150 CO 0.02 0.60 0.48 0.74 -1.14 0.00 0.00 176.83 177.53 3flm h THR 151 N 0.89 0.84 0.04 -2.27 2.02 -0.40 0.14 112.91 114.17 3flm h THR 151 Ca 0.24 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.26 3flm h THR 151 Cb -0.04 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 66.70 3flm h THR 151 CO -0.05 0.08 -0.02 0.40 0.37 0.00 0.00 175.52 176.31 3flm h ILE 152 N 0.46 1.23 -0.97 3.11 1.08 -0.96 -2.75 117.51 118.71 3flm h ILE 152 Ca 0.35 -1.72 0.22 0.00 -0.39 0.00 0.00 64.86 63.32 3flm h ILE 152 Cb 0.72 2.24 -0.08 0.00 -3.07 0.00 0.00 36.82 36.63 3flm h ILE 152 CO -0.11 0.39 0.63 0.44 -0.69 0.00 0.00 178.15 178.80 3flm h ASP 153 N -0.92 0.46 -0.13 1.72 3.32 0.06 0.25 116.42 121.19 3flm h ASP 153 Ca -0.00 0.06 -0.15 0.00 0.02 0.00 0.00 57.03 56.96 3flm h ASP 153 Cb 0.67 -0.02 0.01 0.00 0.22 0.00 0.00 39.33 40.20 3flm h ASP 153 CO 0.01 0.15 -0.50 -0.74 -1.72 0.00 0.00 179.24 176.44 3flm h HIS 154 N 0.44 0.75 -0.09 4.55 -0.00 -0.80 0.98 115.15 120.99 3flm h HIS 154 Ca 0.53 -0.32 -0.01 0.00 -0.00 0.00 0.00 60.37 60.57 3flm h HIS 154 Cb 1.26 -0.12 -0.00 0.00 -0.00 0.00 0.00 27.41 28.55 3flm h HIS 154 CO -0.00 1.10 0.02 0.00 -0.00 0.00 0.00 177.93 179.04 3flm h ALA 155 N 0.51 0.11 -0.38 5.26 0.00 -0.29 -2.27 119.26 122.18 3flm h ALA 155 Ca -0.03 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.59 3flm h ALA 155 Cb 1.14 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 3flm h ALA 155 CO 0.11 -0.26 -0.39 -0.07 0.00 0.00 0.00 179.25 178.64 3flm h LEU 156 N -0.07 1.01 -0.62 0.00 -0.00 -0.96 -3.29 115.31 111.37 3flm h LEU 156 Ca 0.03 -0.46 -0.02 0.00 -0.00 0.00 0.00 57.88 57.42 3flm h LEU 156 Cb 0.25 -0.28 -0.03 0.00 -0.00 0.00 0.00 40.66 40.60 3flm h LEU 156 CO 0.00 1.27 0.29 1.23 -0.00 0.00 0.00 178.44 181.23 3flm h GLY 157 N 0.77 0.95 -2.61 0.83 0.00 -0.80 -2.84 103.07 99.38 3flm h GLY 157 Ca 0.06 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 46.92 3flm h GLY 157 CO 0.10 0.45 0.00 -1.30 0.00 0.00 0.00 176.54 175.79 3flm n THR 158 N -4.51 1.65 -3.24 4.70 -2.24 -0.86 -4.44 114.28 105.34 3flm n THR 158 Ca 0.04 -0.93 -0.44 0.00 -2.27 0.00 0.00 64.05 60.45 3flm n THR 158 Cb 0.13 -0.15 -0.07 0.00 -2.10 0.00 0.00 70.33 68.14 3flm n THR 158 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3flm s LEU 159 N -1.73 5.24 0.11 3.22 2.96 -1.07 -4.90 118.68 122.51 3flm s LEU 159 Ca 0.38 -1.09 -0.21 0.00 -0.22 0.00 0.00 54.13 53.00 3flm s LEU 159 Cb 0.27 -2.34 -0.08 0.00 0.50 0.00 0.00 46.19 44.54 3flm s LEU 159 CO 0.15 -0.81 1.74 -0.74 -1.32 0.00 0.00 176.35 175.38 3flm h HIS 160 N 8.91 0.07 -2.49 5.38 -0.00 -1.90 -3.48 115.15 121.64 3flm h HIS 160 Ca -0.28 0.01 0.09 0.00 -0.00 0.00 0.00 60.37 60.19 3flm h HIS 160 Cb 1.10 -0.01 -0.13 0.00 -0.00 0.00 0.00 27.41 28.37 3flm h HIS 160 CO 0.71 0.04 0.42 0.00 -0.00 0.00 0.00 177.93 179.09 3flm s ALA 161 N -6.19 -1.72 0.00 5.26 0.00 -1.26 -5.04 121.76 112.81 3flm s ALA 161 Ca -0.13 0.70 0.00 0.00 0.00 0.00 0.00 51.96 52.53 3flm s ALA 161 Cb 0.08 0.58 0.00 0.00 0.00 0.00 0.00 23.12 23.78 3flm s ALA 161 CO 0.68 -0.77 0.00 0.41 0.00 0.00 0.00 175.76 176.07 3flm n GLY 162 N -0.32 -2.89 3.84 0.00 0.00 -0.75 -4.67 105.19 100.41 3flm n GLY 162 Ca -0.10 -1.78 -0.32 0.00 0.00 0.00 0.00 46.02 43.82 3flm n GLY 162 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3flm s GLY 163 N -0.96 2.31 -0.06 -0.02 0.00 -1.26 -3.85 107.32 103.49 3flm s GLY 163 Ca 0.00 0.15 0.02 0.00 0.00 0.00 0.00 44.72 44.89 3flm s GLY 163 CO 0.00 0.38 -0.11 0.14 0.00 0.00 0.00 173.10 173.51 3flm s VAL 164 N -2.10 3.35 -0.42 1.40 1.01 0.09 0.55 120.40 124.27 3flm s VAL 164 Ca 0.57 -0.61 -0.05 0.00 0.00 0.00 0.00 61.98 61.89 3flm s VAL 164 Cb -0.10 -2.34 0.11 0.00 0.00 0.00 0.00 36.38 34.05 3flm s VAL 164 CO 0.17 0.59 0.23 -2.28 0.00 0.00 0.00 175.10 173.82 3flm s HIS 165 N -0.72 3.52 -0.46 5.22 2.46 -0.84 -1.35 115.29 123.12 3flm s HIS 165 Ca 0.11 -2.20 -0.16 0.00 0.47 0.00 0.00 55.06 53.28 3flm s HIS 165 Cb -0.11 -3.22 0.05 0.00 -0.13 0.00 0.00 32.58 29.17 3flm s HIS 165 CO 0.01 -0.96 0.42 0.42 -2.47 0.00 0.00 174.74 172.16 3flm s ILE 166 N 1.22 5.15 -0.07 0.89 1.09 -0.54 -0.87 121.20 128.08 3flm s ILE 166 Ca 0.07 -0.75 -0.26 0.00 -1.10 0.00 0.00 60.65 58.61 3flm s ILE 166 Cb -0.23 -4.10 -0.03 0.00 -1.06 0.00 0.00 42.46 37.04 3flm s ILE 166 CO -0.03 -0.53 0.85 0.21 -0.10 0.00 0.00 174.94 175.33 3flm s ASN 167 N 2.28 7.13 -0.29 3.58 2.47 -0.84 -0.71 114.94 128.56 3flm s ASN 167 Ca 0.08 1.37 0.01 0.00 0.42 0.00 0.00 52.86 54.74 3flm s ASN 167 Cb -0.21 -2.49 0.08 0.00 -1.45 0.00 0.00 41.25 37.19 3flm s ASN 167 CO 0.10 -0.25 0.03 0.00 -3.72 0.00 0.00 177.10 173.25 3flm s PRO 169 N 1.33 4.26 -0.05 0.00 0.04 -1.26 -1.43 135.00 137.89 3flm s PRO 169 Ca 0.04 1.85 0.03 0.00 0.04 0.00 0.00 61.00 62.96 3flm s PRO 169 Cb -0.18 -2.85 0.00 0.00 0.04 0.00 0.00 34.50 31.51 3flm s PRO 169 CO -0.13 -0.15 -0.15 -0.06 0.04 0.00 0.00 177.00 176.56 3flm s PHE 170 N -1.34 1.53 0.30 0.56 0.08 -0.92 -4.38 117.98 113.80 3flm s PHE 170 Ca 0.53 -0.47 -0.29 0.00 0.12 0.00 0.00 56.93 56.82 3flm s PHE 170 Cb -0.31 -1.06 -0.10 0.00 -0.57 0.00 0.00 43.02 40.98 3flm s PHE 170 CO 0.40 -0.19 1.23 0.00 -0.10 0.00 0.00 175.22 176.56 3flm s ALA 171 N 0.24 3.47 -0.20 5.36 0.00 -1.26 -3.52 121.76 125.83 3flm s ALA 171 Ca -0.07 1.11 -0.22 0.00 0.00 0.00 0.00 51.96 52.78 3flm s ALA 171 Cb -0.12 -3.42 -0.02 0.00 0.00 0.00 0.00 23.12 19.56 3flm s ALA 171 CO 0.02 -0.45 0.68 -1.21 0.00 0.00 0.00 175.76 174.81 3flm s GLU 172 N -1.48 4.21 0.44 0.00 2.02 -1.26 -4.71 118.70 117.92 3flm s GLU 172 Ca 0.48 0.71 0.02 0.00 0.02 0.00 0.00 54.97 56.20 3flm s GLU 172 Cb -0.36 -3.59 -0.01 0.00 0.10 0.00 0.00 34.13 30.26 3flm s GLU 172 CO 0.47 -0.31 0.09 -0.35 0.02 0.00 0.00 175.26 175.18 3flm n PRO 173 N 5.26 0.67 -4.98 0.39 -0.04 -1.26 -5.06 135.00 129.98 3flm n PRO 173 Ca 0.00 -3.46 -0.32 0.00 -0.04 0.00 0.00 63.50 59.67 3flm n PRO 173 Cb 0.49 1.51 -0.15 0.00 -0.04 0.00 0.00 33.50 35.31 3flm n PRO 173 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 3flm s LEU 174 N 0.00 2.43 -0.30 1.53 2.34 -1.26 -4.20 118.68 119.22 3flm s LEU 174 Ca 0.13 -0.43 -0.23 0.00 0.06 0.00 0.00 54.13 53.66 3flm s LEU 174 Cb 0.01 -1.52 0.03 0.00 -0.56 0.00 0.00 46.19 44.15 3flm s LEU 174 CO 0.09 0.17 0.42 -0.62 -1.06 0.00 0.00 176.35 175.35 3flm n GLU 177 N 3.47 -1.58 -2.95 1.48 -0.58 -1.26 -4.95 120.64 114.28 3flm n GLU 177 Ca -0.18 1.39 -0.44 0.00 -0.42 0.00 0.00 57.16 57.50 3flm n GLU 177 Cb 0.53 -2.30 0.00 0.00 -0.57 0.00 0.00 31.44 29.10 3flm n GLU 177 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 3flm n MET 178 N 0.30 3.66 -0.05 3.49 2.81 -1.26 -4.73 117.12 121.35 3flm n MET 178 Ca -0.03 -4.08 0.00 0.00 -1.81 0.00 0.00 57.70 51.78 3flm n MET 178 Cb 0.56 -2.79 0.00 0.00 -0.71 0.00 0.00 33.22 30.29 3flm n MET 178 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 3flm n ASP 179 N 3.70 0.00 -1.94 7.83 5.68 -1.26 -4.93 116.55 125.63 3flm n ASP 179 Ca 0.32 -0.09 -0.06 0.00 -0.50 0.00 0.00 54.79 54.46 3flm n ASP 179 Cb 0.39 0.00 0.29 0.00 -1.14 0.00 0.00 41.12 40.66 3flm n ASP 179 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 3flm n ASP 180 N -0.26 4.65 0.10 -1.12 9.92 -1.26 -4.65 116.55 123.92 3flm n ASP 180 Ca 0.00 -3.27 -0.04 0.00 -0.53 0.00 0.00 54.79 50.95 3flm n ASP 180 Cb 0.00 -0.74 0.02 0.00 -0.64 0.00 0.00 41.12 39.76 3flm n ASP 180 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 3flm h THR 181 N 2.47 1.54 0.00 -3.53 2.02 -1.87 -2.34 112.91 111.21 3flm h THR 181 Ca 0.28 -2.78 0.00 0.00 0.77 0.00 0.00 66.41 64.68 3flm h THR 181 Cb 2.31 2.51 0.00 0.00 -1.74 0.00 0.00 68.15 71.23 3flm h THR 181 CO 0.73 0.79 0.00 0.61 0.37 0.00 0.00 175.52 178.02 3flm n GLY 182 N 0.85 -1.26 0.12 2.16 0.00 -1.26 -4.71 105.19 101.09 3flm n GLY 182 Ca -0.00 0.03 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 3flm n GLY 182 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3flm n LEU 183 N -2.03 2.13 -0.34 0.99 7.94 -0.88 -2.38 117.00 122.43 3flm n LEU 183 Ca 0.03 0.34 0.04 0.00 -1.11 0.00 0.00 56.01 55.31 3flm n LEU 183 Cb 0.24 -1.01 0.19 0.00 0.53 0.00 0.00 43.42 43.37 3flm n LEU 183 CO 0.19 0.49 1.21 0.77 -1.11 0.00 0.00 177.39 178.94 3flm h SER 184 N -0.65 0.88 -1.02 1.96 4.64 -1.84 -2.58 113.55 114.95 3flm h SER 184 Ca -0.40 0.03 0.26 0.00 -0.47 0.00 0.00 61.79 61.22 3flm h SER 184 Cb 1.56 -0.15 -0.12 0.00 -0.31 0.00 0.00 62.40 63.38 3flm h SER 184 CO -0.13 0.52 0.61 -0.25 -0.87 0.00 0.00 176.83 176.71 3flm h TRP 185 N 0.99 0.94 -0.04 4.77 7.01 -1.77 -1.86 115.95 125.99 3flm h TRP 185 Ca 0.44 0.03 -0.18 0.00 2.11 0.00 0.00 58.89 61.29 3flm h TRP 185 Cb 0.32 -0.27 -0.01 0.00 -2.10 0.00 0.00 29.16 27.10 3flm h TRP 185 CO -0.02 0.04 -0.77 1.96 -2.79 0.00 0.00 178.44 176.86 3flm h GLN 186 N 0.52 0.30 0.00 2.65 4.20 -1.32 -3.27 115.11 118.19 3flm h GLN 186 Ca 0.65 -0.27 0.00 0.00 0.06 0.00 0.00 58.65 59.09 3flm h GLN 186 Cb 1.33 0.06 0.00 0.00 0.30 0.00 0.00 27.48 29.17 3flm h GLN 186 CO -0.46 0.93 0.00 1.96 -0.67 0.00 0.00 178.83 180.60 3flm h GLN 187 N 0.19 0.00 0.00 1.46 4.20 -1.21 -1.81 115.11 117.95 3flm h GLN 187 Ca -0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.68 3flm h GLN 187 Cb 1.35 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.13 3flm h GLN 187 CO 0.12 0.00 0.22 0.54 -0.67 0.00 0.00 178.83 179.04 3flm n ARG 188 N -2.84 0.07 0.14 1.46 5.12 -1.03 0.46 116.66 120.03 3flm n ARG 188 Ca 0.03 0.52 0.12 0.00 -1.93 0.00 0.00 57.85 56.59 3flm n ARG 188 Cb 0.41 -1.96 0.27 0.00 -1.16 0.00 0.00 32.46 30.03 3flm n ARG 188 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 3flm h LEU 189 N 0.00 0.00 0.00 0.55 3.38 -1.56 -3.48 115.31 114.20 3flm h LEU 189 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3flm h LEU 189 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3flm h LEU 189 CO 0.00 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.15 3flm n GLY 190 N 1.23 2.74 0.68 0.83 0.00 0.17 -2.12 105.19 108.72 3flm n GLY 190 Ca 0.04 -0.32 0.04 0.00 0.00 0.00 0.00 46.02 45.79 3flm n GLY 190 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3flm n ASP 191 N 4.08 1.93 0.08 1.61 5.68 -1.26 -3.14 116.55 125.53 3flm n ASP 191 Ca 0.00 -2.10 0.21 0.00 -0.50 0.00 0.00 54.79 52.40 3flm n ASP 191 Cb 0.00 -0.30 0.73 0.00 -1.14 0.00 0.00 41.12 40.41 3flm n ASP 191 CO 0.00 0.00 0.00 -0.25 -1.33 0.00 0.00 177.20 175.62 3flm h TRP 192 N 1.71 0.00 0.00 2.11 7.01 -1.84 -2.36 115.95 122.58 3flm h TRP 192 Ca 0.00 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 3flm h TRP 192 Cb 0.58 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.64 3flm h TRP 192 CO 0.26 0.00 0.00 0.91 -2.79 0.00 0.00 178.44 176.82 3flm n TRP 193 N -3.65 0.53 0.15 2.65 7.02 -1.19 -2.02 117.44 120.93 3flm n TRP 193 Ca 0.08 0.18 0.02 0.00 -1.02 0.00 0.00 57.50 56.76 3flm n TRP 193 Cb 0.67 -0.79 0.01 0.00 -2.42 0.00 0.00 31.31 28.77 3flm n TRP 193 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 3flm n GLN 194 N -1.96 1.17 -1.54 -0.99 3.00 -0.90 -5.02 117.38 111.14 3flm n GLN 194 Ca 0.04 -0.53 -0.29 0.00 -0.01 0.00 0.00 57.00 56.21 3flm n GLN 194 Cb 0.30 -0.96 0.17 0.00 0.00 0.00 0.00 30.24 29.74 3flm n GLN 194 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 3flm s ASP 195 N -0.57 2.92 -0.04 1.08 2.15 -0.86 -5.03 116.67 116.33 3flm s ASP 195 Ca 0.04 0.74 0.06 0.00 0.43 0.00 0.00 52.55 53.81 3flm s ASP 195 Cb 0.03 -1.13 0.09 0.00 -0.30 0.00 0.00 42.92 41.61 3flm s ASP 195 CO 0.07 -2.89 1.00 -0.90 -0.17 0.00 0.00 175.17 172.28 3flm n ASP 196 N -3.96 1.81 -4.26 -0.34 5.75 -1.26 -5.05 116.55 109.25 3flm n ASP 196 Ca 0.10 -2.24 -0.19 0.00 -0.01 0.00 0.00 54.79 52.45 3flm n ASP 196 Cb 0.59 -0.14 -0.11 0.00 -1.03 0.00 0.00 41.12 40.43 3flm n ASP 196 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3flm s LYS 197 N -1.43 1.07 1.09 0.11 1.02 -1.26 -4.90 119.74 115.43 3flm s LYS 197 Ca 0.10 -1.26 -0.16 0.00 0.02 0.00 0.00 55.97 54.67 3flm s LYS 197 Cb 0.09 -1.01 0.13 0.00 -0.52 0.00 0.00 37.83 36.52 3flm s LYS 197 CO 0.01 0.20 0.34 -2.30 -0.92 0.00 0.00 175.35 172.68 3flm n PRO 198 N 0.53 -1.49 0.06 -1.68 -0.02 -1.26 -4.94 135.00 126.21 3flm n PRO 198 Ca -0.15 -0.41 -0.03 0.00 -2.02 0.00 0.00 63.50 60.89 3flm n PRO 198 Cb 0.57 -1.86 -0.01 0.00 -0.02 0.00 0.00 33.50 32.18 3flm n PRO 198 CO 0.00 0.00 0.00 2.35 1.98 0.00 0.00 175.50 179.83 3flm h TRP 199 N -2.10 -0.15 -3.34 6.00 2.91 -1.95 -3.43 115.95 113.88 3flm h TRP 199 Ca -0.53 -0.00 -0.60 0.00 1.13 0.00 0.00 58.89 58.88 3flm h TRP 199 Cb 1.34 0.05 -0.12 0.00 -0.51 0.00 0.00 29.16 29.92 3flm h TRP 199 CO 0.24 -0.10 -0.45 -1.17 -1.03 0.00 0.00 178.44 175.93 3flm s LEU 200 N -4.80 4.19 -0.73 0.65 2.96 -1.26 -5.07 118.68 114.63 3flm s LEU 200 Ca -0.02 0.26 -0.13 0.00 -0.22 0.00 0.00 54.13 54.02 3flm s LEU 200 Cb 0.00 -2.16 0.19 0.00 0.50 0.00 0.00 46.19 44.73 3flm s LEU 200 CO 0.07 0.13 0.66 -0.13 -1.32 0.00 0.00 176.35 175.76 3flm s ARG 201 N 0.56 3.32 -0.37 1.98 0.52 -1.26 -4.74 118.95 118.96 3flm s ARG 201 Ca 0.10 -2.27 -0.02 0.00 -0.52 0.00 0.00 55.73 53.02 3flm s ARG 201 Cb -0.12 -4.31 0.09 0.00 0.52 0.00 0.00 34.95 31.12 3flm s ARG 201 CO 0.01 -1.28 0.12 -2.00 0.02 0.00 0.00 175.30 172.16 3flm s GLU 202 N 0.52 2.08 -0.33 3.54 2.12 -1.26 -5.01 118.70 120.36 3flm s GLU 202 Ca 0.14 -1.65 0.16 0.00 0.36 0.00 0.00 54.97 53.98 3flm s GLU 202 Cb -0.16 -3.42 0.43 0.00 0.26 0.00 0.00 34.13 31.24 3flm s GLU 202 CO -0.05 -0.91 0.91 0.00 -0.54 0.00 0.00 175.26 174.66 3flm n ALA 203 N 4.57 3.00 -1.71 6.30 0.00 -1.26 -3.39 120.51 128.02 3flm n ALA 203 Ca -0.05 -3.13 -0.39 0.00 0.00 0.00 0.00 53.44 49.86 3flm n ALA 203 Cb 0.42 -0.94 0.03 0.00 0.00 0.00 0.00 19.45 18.96 3flm n ALA 203 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3flm n PRO 204 N 0.01 1.67 -3.92 0.00 -0.04 -1.26 -4.96 135.00 126.49 3flm n PRO 204 Ca 0.12 0.61 -0.33 0.00 -0.04 0.00 0.00 63.50 63.86 3flm n PRO 204 Cb 0.78 -2.45 -0.05 0.00 -0.04 0.00 0.00 33.50 31.75 3flm n PRO 204 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3flm s ARG 205 N -2.62 3.42 -0.20 0.54 0.52 -1.26 -4.96 118.95 114.39 3flm s ARG 205 Ca 0.68 -0.35 0.01 0.00 -0.52 0.00 0.00 55.73 55.55 3flm s ARG 205 Cb -0.45 -3.08 0.03 0.00 0.52 0.00 0.00 34.95 31.97 3flm s ARG 205 CO 0.52 0.66 -0.17 -1.17 0.02 0.00 0.00 175.30 175.16 3flm s LEU 206 N -2.02 2.44 -0.28 2.53 2.96 -1.26 -5.11 118.68 117.95 3flm s LEU 206 Ca 0.28 -0.77 -0.21 0.00 -0.22 0.00 0.00 54.13 53.20 3flm s LEU 206 Cb -0.13 -1.51 0.11 0.00 0.50 0.00 0.00 46.19 45.16 3flm s LEU 206 CO 0.20 -0.04 0.87 -0.70 -1.32 0.00 0.00 176.35 175.36 3flm s GLU 207 N 1.27 0.61 0.67 1.98 2.12 -1.26 -4.86 118.70 119.23 3flm s GLU 207 Ca 0.02 0.84 -0.14 0.00 0.36 0.00 0.00 54.97 56.05 3flm s GLU 207 Cb -0.14 0.23 0.01 0.00 0.26 0.00 0.00 34.13 34.48 3flm s GLU 207 CO -0.11 -0.09 1.10 -1.12 -0.54 0.00 0.00 175.26 174.50 3flm s SER 208 N 0.77 5.06 0.31 -1.70 0.01 -0.18 -4.96 113.70 113.02 3flm s SER 208 Ca -0.03 1.94 -0.08 0.00 1.31 0.00 0.00 55.95 59.09 3flm s SER 208 Cb -0.05 -2.54 -0.06 0.00 0.21 0.00 0.00 66.02 63.58 3flm s SER 208 CO -0.09 -1.66 0.62 -1.83 0.41 0.00 0.00 173.24 170.69 3flm s GLU 209 N -4.26 3.73 -0.08 12.44 -1.05 -1.26 -4.90 118.70 123.32 3flm s GLU 209 Ca 0.65 0.24 -0.39 0.00 -0.15 0.00 0.00 54.97 55.32 3flm s GLU 209 Cb -0.19 -2.56 -0.17 0.00 -0.44 0.00 0.00 34.13 30.77 3flm s GLU 209 CO 0.44 0.17 1.50 1.17 0.95 0.00 0.00 175.26 179.49 3flm n LYS 210 N -0.81 1.05 -2.16 -4.83 4.81 -1.26 -4.86 118.16 110.11 3flm n LYS 210 Ca 0.00 0.38 -0.43 0.00 -0.87 0.00 0.00 58.31 57.40 3flm n LYS 210 Cb 0.53 -2.03 -0.02 0.00 0.02 0.00 0.00 35.03 33.53 3flm n LYS 210 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 3flm s GLN 211 N 1.78 3.85 0.06 1.64 -1.52 -1.26 -4.89 119.66 119.31 3flm s GLN 211 Ca 0.91 1.64 0.19 0.00 -1.95 0.00 0.00 55.36 56.16 3flm s GLN 211 Cb -1.03 -4.00 0.81 0.00 -0.22 0.00 0.00 33.01 28.56 3flm s GLN 211 CO 0.56 -1.22 1.61 0.54 -0.25 0.00 0.00 175.29 176.53 3flm n ARG 212 N 7.54 0.05 -0.64 2.91 1.74 -1.26 -2.27 116.66 124.73 3flm n ARG 212 Ca 0.18 0.23 0.03 0.00 -0.77 0.00 0.00 57.85 57.52 3flm n ARG 212 Cb 0.45 -1.58 0.26 0.00 -1.02 0.00 0.00 32.46 30.57 3flm n ARG 212 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3flm n ASP 213 N -1.67 3.79 -0.15 0.55 5.68 -1.26 -4.66 116.55 118.83 3flm n ASP 213 Ca 0.04 -3.22 -0.08 0.00 -0.50 0.00 0.00 54.79 51.03 3flm n ASP 213 Cb 0.23 -0.61 0.07 0.00 -1.14 0.00 0.00 41.12 39.67 3flm n ASP 213 CO 0.00 0.00 0.00 -0.25 -1.33 0.00 0.00 177.20 175.62 3flm h TRP 214 N 1.82 1.01 0.00 2.11 -0.00 -1.88 -2.31 115.95 116.71 3flm h TRP 214 Ca 0.10 -0.19 -0.00 0.00 -0.00 0.00 0.00 58.89 58.80 3flm h TRP 214 Cb 1.67 -0.26 -0.00 0.00 -0.00 0.00 0.00 29.16 30.57 3flm h TRP 214 CO 0.77 0.95 -0.01 0.74 -0.00 0.00 0.00 178.44 180.89 3flm h PHE 215 N 0.83 0.00 0.00 2.65 -1.00 -1.85 0.75 116.94 118.33 3flm h PHE 215 Ca 0.14 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.89 3flm h PHE 215 Cb 0.61 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.16 3flm h PHE 215 CO 0.04 0.01 -0.24 0.35 -1.61 0.00 0.00 178.31 176.86 3flm h PHE 216 N 0.00 0.00 0.00 -0.55 3.57 -1.78 -3.39 116.94 114.79 3flm h PHE 216 Ca -0.00 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 3flm h PHE 216 Cb 0.10 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.84 3flm h PHE 216 CO 0.00 0.62 -0.15 -1.49 -2.23 0.00 0.00 178.31 175.06 3flm h TRP 217 N -1.00 0.00 0.00 0.41 4.06 -0.93 -2.18 115.95 116.30 3flm h TRP 217 Ca -0.05 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.90 3flm h TRP 217 Cb 0.65 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.81 3flm h TRP 217 CO 0.10 0.15 0.00 2.89 -3.56 0.00 0.00 178.44 178.02 3flm n ARG 218 N -3.67 0.59 -0.49 0.49 1.85 0.25 -1.28 116.66 114.40 3flm n ARG 218 Ca -0.02 0.02 0.09 0.00 -1.00 0.00 0.00 57.85 56.94 3flm n ARG 218 Cb 0.27 -1.50 0.30 0.00 -1.05 0.00 0.00 32.46 30.48 3flm n ARG 218 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 3flm n GLN 219 N -1.06 3.41 -2.91 2.89 6.02 -0.82 -4.95 117.38 119.97 3flm n GLN 219 Ca 0.15 -2.71 -0.16 0.00 -0.01 0.00 0.00 57.00 54.26 3flm n GLN 219 Cb 0.09 -1.75 0.01 0.00 1.02 0.00 0.00 30.24 29.60 3flm n GLN 219 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3flm n LYS 220 N 0.73 0.95 -2.96 -1.09 4.76 -0.40 -4.99 118.16 115.16 3flm n LYS 220 Ca 0.22 -2.17 -0.44 0.00 -2.87 0.00 0.00 58.31 53.05 3flm n LYS 220 Cb 0.79 0.19 -0.03 0.00 -1.84 0.00 0.00 35.03 34.14 3flm n LYS 220 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3flm s ARG 221 N -3.47 3.32 0.11 1.97 0.52 -1.26 -4.98 118.95 115.16 3flm s ARG 221 Ca 0.22 -1.40 0.02 0.00 -0.52 0.00 0.00 55.73 54.05 3flm s ARG 221 Cb -0.02 -4.53 -0.04 0.00 0.52 0.00 0.00 34.95 30.88 3flm s ARG 221 CO 0.14 -1.71 0.20 0.20 0.02 0.00 0.00 175.30 174.15 3flm s GLY 222 N 3.57 1.93 -0.07 -3.53 0.00 -1.26 0.01 107.32 107.97 3flm s GLY 222 Ca 0.24 -0.99 0.04 0.00 0.00 0.00 0.00 44.72 44.01 3flm s GLY 222 CO 0.00 -0.98 -0.20 0.14 0.00 0.00 0.00 173.10 172.06 3flm s VAL 223 N -1.60 2.50 -0.33 1.40 1.01 -0.25 -4.14 120.40 118.97 3flm s VAL 223 Ca 0.33 -0.90 -0.12 0.00 0.00 0.00 0.00 61.98 61.29 3flm s VAL 223 Cb -0.12 -1.96 -0.02 0.00 0.00 0.00 0.00 36.38 34.29 3flm s VAL 223 CO 0.27 0.56 0.22 -0.69 0.00 0.00 0.00 175.10 175.46 3flm s VAL 224 N -0.16 5.16 -0.16 2.92 1.01 -0.49 -0.74 120.40 127.93 3flm s VAL 224 Ca -0.02 -0.24 -0.08 0.00 0.00 0.00 0.00 61.98 61.63 3flm s VAL 224 Cb -0.14 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 3flm s VAL 224 CO 0.04 0.01 0.12 -0.69 0.00 0.00 0.00 175.10 174.58 3flm s VAL 225 N 1.70 5.30 -0.10 2.92 1.01 0.17 -0.77 120.40 130.63 3flm s VAL 225 Ca 0.06 0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.21 3flm s VAL 225 Cb -0.17 -3.37 0.01 0.00 0.00 0.00 0.00 36.38 32.85 3flm s VAL 225 CO 0.10 0.52 -0.21 0.00 0.00 0.00 0.00 175.10 175.50 3flm s ALA 226 N -0.21 2.00 0.00 5.51 0.00 0.01 -0.84 121.76 128.23 3flm s ALA 226 Ca 0.10 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 51.18 3flm s ALA 226 Cb -0.12 -0.81 0.00 0.00 0.00 0.00 0.00 23.12 22.20 3flm s ALA 226 CO 0.01 0.17 0.00 0.41 0.00 0.00 0.00 175.76 176.35 3flm n GLY 227 N 3.73 6.56 3.66 0.00 0.00 -0.71 -1.95 105.19 116.48 3flm n GLY 227 Ca -0.20 -1.94 -0.48 0.00 0.00 0.00 0.00 46.02 43.40 3flm n GLY 227 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3flm n ARG 228 N 0.00 2.09 -3.04 1.61 0.63 -1.04 -4.27 116.66 112.64 3flm n ARG 228 Ca 0.00 0.75 -0.09 0.00 -0.92 0.00 0.00 57.85 57.59 3flm n ARG 228 Cb 0.00 -2.67 -0.02 0.00 0.45 0.00 0.00 32.46 30.22 3flm n ARG 228 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3flm n MET 229 N 6.91 0.40 -1.80 -0.14 0.00 -1.23 -3.79 117.12 117.48 3flm n MET 229 Ca 0.24 -1.71 -0.30 0.00 0.00 0.00 0.00 57.70 55.93 3flm n MET 229 Cb 0.30 1.61 0.04 0.00 0.00 0.00 0.00 33.22 35.17 3flm n MET 229 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 3flm s SER 230 N -2.31 5.56 0.22 3.17 1.04 -1.26 -4.84 113.70 115.29 3flm s SER 230 Ca 0.18 1.31 -0.08 0.00 0.48 0.00 0.00 55.95 57.84 3flm s SER 230 Cb -0.00 -2.19 0.33 0.00 0.10 0.00 0.00 66.02 64.26 3flm s SER 230 CO 0.13 -1.29 1.75 0.00 0.98 0.00 0.00 173.24 174.81 3flm h ALA 231 N -0.61 0.90 -0.99 5.32 0.00 -1.89 0.19 119.26 122.17 3flm h ALA 231 Ca -0.45 0.08 0.07 0.00 0.00 0.00 0.00 54.91 54.61 3flm h ALA 231 Cb 1.23 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.99 3flm h ALA 231 CO 0.62 -0.16 0.64 0.93 0.00 0.00 0.00 179.25 181.28 3flm h GLU 232 N 0.47 1.12 -0.53 0.00 4.39 -1.93 -2.73 114.58 115.37 3flm h GLU 232 Ca 0.34 -0.07 -0.03 0.00 0.34 0.00 0.00 59.36 59.94 3flm h GLU 232 Cb 0.43 -0.25 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 3flm h GLU 232 CO -0.32 0.74 0.21 0.93 -1.16 0.00 0.00 179.01 179.42 3flm h GLU 233 N 1.16 0.79 -0.88 2.33 5.08 -1.10 -1.68 114.58 120.27 3flm h GLU 233 Ca 0.43 -0.14 0.08 0.00 -1.00 0.00 0.00 59.36 58.72 3flm h GLU 233 Cb 0.17 -0.13 -0.06 0.00 0.50 0.00 0.00 28.75 29.24 3flm h GLU 233 CO -0.17 0.69 0.57 0.78 -1.00 0.00 0.00 179.01 179.88 3flm h GLY 234 N 0.71 1.28 0.81 -3.84 0.00 -0.54 0.95 103.07 102.44 3flm h GLY 234 Ca 0.18 -0.39 -0.15 0.00 0.00 0.00 0.00 47.33 46.97 3flm h GLY 234 CO -0.01 0.25 -0.58 0.50 0.00 0.00 0.00 176.54 176.70 3flm h LYS 235 N 0.94 0.44 -0.69 4.80 1.57 -1.28 -1.87 116.57 120.47 3flm h LYS 235 Ca 0.39 -0.44 0.01 0.00 -1.87 0.00 0.00 60.65 58.75 3flm h LYS 235 Cb 0.29 0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.68 3flm h LYS 235 CO -0.16 1.09 0.46 0.87 -0.57 0.00 0.00 179.45 181.14 3flm h LYS 236 N -0.05 0.89 -0.35 3.15 1.57 -0.14 0.73 116.57 122.36 3flm h LYS 236 Ca -0.07 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.63 3flm h LYS 236 Cb 1.27 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.36 3flm h LYS 236 CO 0.12 0.59 0.11 0.28 -0.57 0.00 0.00 179.45 179.98 3flm h VAL 237 N 0.92 1.21 -0.60 0.50 2.07 -0.89 -0.30 116.25 119.16 3flm h VAL 237 Ca 0.26 -0.68 0.03 0.00 0.82 0.00 0.00 66.70 67.12 3flm h VAL 237 Cb -0.08 0.99 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 3flm h VAL 237 CO -0.06 0.24 0.36 0.00 0.02 0.00 0.00 177.57 178.13 3flm h ALA 238 N 0.95 0.78 0.05 1.67 0.00 -0.34 -0.70 119.26 121.67 3flm h ALA 238 Ca 0.11 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 3flm h ALA 238 Cb 0.25 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3flm h ALA 238 CO -0.00 0.09 -0.10 -0.07 0.00 0.00 0.00 179.25 179.17 3flm h LEU 239 N 0.70 -0.28 -0.98 0.00 -0.00 -0.81 -2.87 115.31 111.09 3flm h LEU 239 Ca 0.24 0.03 0.33 0.00 -0.00 0.00 0.00 57.88 58.48 3flm h LEU 239 Cb 0.04 0.10 -0.16 0.00 -0.00 0.00 0.00 40.66 40.63 3flm h LEU 239 CO -0.11 -0.11 0.41 -0.25 -0.00 0.00 0.00 178.44 178.38 3flm h TRP 240 N -0.16 0.64 -0.10 1.13 7.01 -0.90 0.64 115.95 124.21 3flm h TRP 240 Ca -0.01 0.05 -0.17 0.00 2.11 0.00 0.00 58.89 60.87 3flm h TRP 240 Cb 0.15 -0.12 -0.01 0.00 -2.10 0.00 0.00 29.16 27.09 3flm h TRP 240 CO -0.22 -0.33 -0.67 0.00 -2.79 0.00 0.00 178.44 174.43 3flm h ALA 241 N 1.91 0.66 0.09 2.65 0.00 -1.08 -2.33 119.26 121.16 3flm h ALA 241 Ca 0.72 -0.58 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 3flm h ALA 241 Cb 1.71 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.43 3flm h ALA 241 CO -0.72 0.74 -0.04 0.37 0.00 0.00 0.00 179.25 179.59 3flm h GLN 242 N 0.29 -0.11 -0.99 0.00 4.15 -0.80 -2.34 115.11 115.31 3flm h GLN 242 Ca -0.02 0.01 0.30 0.00 0.77 0.00 0.00 58.65 59.70 3flm h GLN 242 Cb 1.23 0.03 -0.18 0.00 0.21 0.00 0.00 27.48 28.77 3flm h GLN 242 CO 0.12 0.42 0.13 1.15 -1.93 0.00 0.00 178.83 178.71 3flm h THR 243 N -0.80 0.03 0.00 2.39 2.02 -0.90 0.11 112.91 115.76 3flm h THR 243 Ca -0.01 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.16 3flm h THR 243 Cb 0.59 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.01 3flm h THR 243 CO 0.02 0.00 -0.09 -0.07 0.37 0.00 0.00 175.52 175.76 3flm h LEU 244 N 0.02 0.00 0.00 2.58 3.38 -1.42 -0.48 115.31 119.39 3flm h LEU 244 Ca 0.64 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.60 3flm h LEU 244 Cb 1.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.16 3flm h LEU 244 CO -0.88 0.01 0.00 0.61 0.09 0.00 0.00 178.44 178.26 3flm n GLY 245 N 1.20 0.53 3.94 0.83 0.00 0.03 -4.49 105.19 107.22 3flm n GLY 245 Ca 0.04 -0.39 -0.27 0.00 0.00 0.00 0.00 46.02 45.40 3flm n GLY 245 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3flm s TRP 246 N -2.00 3.49 0.37 1.61 0.51 -0.96 -3.16 118.94 118.80 3flm s TRP 246 Ca 0.00 0.14 -0.22 0.00 -2.12 0.00 0.00 56.10 53.90 3flm s TRP 246 Cb 0.00 -1.68 -0.10 0.00 -0.81 0.00 0.00 33.47 30.88 3flm s TRP 246 CO 0.00 0.53 0.90 -2.14 -0.51 0.00 0.00 176.95 175.73 3flm s PRO 247 N -3.10 4.30 -0.30 4.98 0.02 -1.26 -4.59 135.00 135.06 3flm s PRO 247 Ca 0.35 1.10 -0.04 0.00 0.02 0.00 0.00 61.00 62.43 3flm s PRO 247 Cb -0.11 -2.44 0.03 0.00 0.02 0.00 0.00 34.50 32.01 3flm s PRO 247 CO 0.28 0.11 0.02 -1.17 -0.33 0.00 0.00 177.00 175.92 3flm s LEU 248 N -2.75 3.82 -0.34 -5.54 2.96 -1.26 -1.40 118.68 114.17 3flm s LEU 248 Ca 0.56 -1.05 -0.25 0.00 -0.22 0.00 0.00 54.13 53.17 3flm s LEU 248 Cb -0.12 -1.76 0.01 0.00 0.50 0.00 0.00 46.19 44.81 3flm s LEU 248 CO 0.17 -0.23 0.85 -0.63 -1.32 0.00 0.00 176.35 175.19 3flm s ILE 249 N 1.35 4.69 -0.21 6.68 1.09 0.05 -4.24 121.20 130.60 3flm s ILE 249 Ca -0.02 1.14 -0.00 0.00 -1.10 0.00 0.00 60.65 60.67 3flm s ILE 249 Cb -0.19 -4.25 0.02 0.00 -1.06 0.00 0.00 42.46 36.99 3flm s ILE 249 CO -0.00 -0.41 -0.14 -0.83 -0.10 0.00 0.00 174.94 173.46 3flm s GLY 250 N 1.77 1.50 0.40 6.18 0.00 -1.26 -0.81 107.32 115.10 3flm s GLY 250 Ca 0.35 -1.30 -0.04 0.00 0.00 0.00 0.00 44.72 43.73 3flm s GLY 250 CO 0.16 0.38 0.67 -0.35 0.00 0.00 0.00 173.10 173.96 3flm s ASP 251 N 1.31 6.33 0.19 1.64 2.15 -0.82 -4.81 116.67 122.66 3flm s ASP 251 Ca 0.03 0.75 0.07 0.00 0.43 0.00 0.00 52.55 53.84 3flm s ASP 251 Cb -0.15 -2.17 0.40 0.00 -0.30 0.00 0.00 42.92 40.71 3flm s ASP 251 CO -0.09 -0.41 1.08 0.52 -0.17 0.00 0.00 175.17 176.10 3flm n VAL 252 N -1.80 0.82 0.27 1.11 0.31 -1.26 -0.90 118.33 116.88 3flm n VAL 252 Ca -0.01 0.64 0.08 0.00 -0.01 0.00 0.00 64.34 65.04 3flm n VAL 252 Cb 0.55 -1.64 0.14 0.00 -0.91 0.00 0.00 33.84 31.98 3flm n VAL 252 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3flm n LEU 253 N -1.73 2.81 -0.02 7.52 4.32 -1.26 -4.49 117.00 124.14 3flm n LEU 253 Ca -0.00 -1.44 0.00 0.00 -0.02 0.00 0.00 56.01 54.55 3flm n LEU 253 Cb 0.29 -0.15 -0.13 0.00 -1.62 0.00 0.00 43.42 41.80 3flm n LEU 253 CO 0.03 0.61 -0.73 -1.54 -1.22 0.00 0.00 177.39 174.54 3flm n SER 254 N 0.96 0.30 -3.48 -1.43 3.41 -0.08 -3.57 113.62 109.74 3flm n SER 254 Ca 0.13 0.13 -0.25 0.00 -0.26 0.00 0.00 58.87 58.62 3flm n SER 254 Cb 0.46 1.02 0.04 0.00 -0.26 0.00 0.00 64.21 65.47 3flm n SER 254 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3flm n GLN 255 N -2.64 -5.86 0.00 4.33 6.02 -1.26 -3.94 117.38 114.03 3flm n GLN 255 Ca -0.16 0.75 0.11 0.00 -0.01 0.00 0.00 57.00 57.70 3flm n GLN 255 Cb 0.86 -5.66 0.10 0.00 1.02 0.00 0.00 30.24 26.55 3flm n GLN 255 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3flm n THR 256 N -4.65 0.00 0.00 5.09 -2.24 -1.26 -0.73 114.28 110.49 3flm n THR 256 Ca -0.02 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 3flm n THR 256 Cb 0.57 0.74 0.00 0.00 -2.10 0.00 0.00 70.33 69.54 3flm n THR 256 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3flm n GLY 257 N 1.45 3.19 3.55 3.38 0.00 -1.24 -4.54 105.19 110.98 3flm n GLY 257 Ca 0.07 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.88 3flm n GLY 257 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3flm n GLN 258 N -2.00 -6.81 -0.36 1.61 6.02 -1.26 -4.61 117.38 109.98 3flm n GLN 258 Ca 0.00 0.80 0.32 0.00 -0.01 0.00 0.00 57.00 58.11 3flm n GLN 258 Cb 0.00 -5.77 0.67 0.00 1.02 0.00 0.00 30.24 26.16 3flm n GLN 258 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 3flm h PRO 259 N -2.18 0.13 -2.38 -1.09 0.13 -1.86 -1.60 132.00 123.15 3flm h PRO 259 Ca -0.59 -0.01 -0.74 0.00 -0.87 0.00 0.00 66.00 63.79 3flm h PRO 259 Cb 1.35 -0.03 -0.32 0.00 0.13 0.00 0.00 31.00 32.14 3flm h PRO 259 CO 0.54 0.09 0.49 1.28 -0.23 0.00 0.00 178.00 180.16 3flm n LEU 260 N -4.36 6.27 -4.49 1.56 4.77 -1.26 -4.99 117.00 114.50 3flm n LEU 260 Ca 0.28 -5.43 -0.33 0.00 -0.03 0.00 0.00 56.01 50.50 3flm n LEU 260 Cb 1.19 -1.01 0.13 0.00 -2.33 0.00 0.00 43.42 41.39 3flm n LEU 260 CO 0.34 2.05 0.13 -0.81 -1.33 0.00 0.00 177.39 177.77 3flm n PRO 261 N 0.24 -0.26 -1.37 3.23 -0.04 -0.60 -3.15 135.00 133.04 3flm n PRO 261 Ca 0.38 -0.03 -0.13 0.00 -0.04 0.00 0.00 63.50 63.69 3flm n PRO 261 Cb 0.31 -1.99 -0.05 0.00 -0.04 0.00 0.00 33.50 31.73 3flm n PRO 261 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3flm n ALA 263 N 1.24 0.55 0.31 0.00 0.00 -1.19 0.36 120.51 121.78 3flm n ALA 263 Ca -0.13 0.67 0.18 0.00 0.00 0.00 0.00 53.44 54.17 3flm n ALA 263 Cb 0.55 -0.61 0.99 0.00 0.00 0.00 0.00 19.45 20.39 3flm n ALA 263 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 3flm h ASP 264 N 0.00 0.00 0.00 0.00 3.58 -1.84 0.19 116.42 118.34 3flm h ASP 264 Ca 0.50 0.00 -0.14 0.00 0.42 0.00 0.00 57.03 57.80 3flm h ASP 264 Cb 1.23 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.26 3flm h ASP 264 CO -0.54 0.02 -0.81 -0.07 -2.88 0.00 0.00 179.24 174.97 3flm h LEU 265 N 0.00 0.00 -0.66 2.28 3.38 0.61 -3.39 115.31 117.52 3flm h LEU 265 Ca -0.00 -0.62 0.00 0.00 0.09 0.00 0.00 57.88 57.35 3flm h LEU 265 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3flm h LEU 265 CO 0.00 1.28 0.00 4.11 0.09 0.00 0.00 178.44 183.92 3flm h TRP 266 N -1.00 0.00 0.00 1.13 5.08 -1.07 -1.92 115.95 118.17 3flm h TRP 266 Ca -0.22 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.75 3flm h TRP 266 Cb 1.14 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.30 3flm h TRP 266 CO 0.13 0.00 0.07 -0.07 -1.28 0.00 0.00 178.44 177.29 3flm h LEU 267 N 0.00 0.00 -1.32 0.11 3.38 -0.83 -2.50 115.31 114.15 3flm h LEU 267 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3flm h LEU 267 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 3flm h LEU 267 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 3flm n GLY 268 N -1.14 0.47 3.69 0.83 0.00 -0.72 -4.60 105.19 103.72 3flm n GLY 268 Ca -0.03 -0.50 -0.38 0.00 0.00 0.00 0.00 46.02 45.12 3flm n GLY 268 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3flm s ASN 269 N -1.73 6.51 0.53 1.61 3.84 -0.94 -4.61 114.94 120.16 3flm s ASN 269 Ca 0.34 0.60 0.19 0.00 0.21 0.00 0.00 52.86 54.21 3flm s ASN 269 Cb 0.19 -2.25 1.37 0.00 -0.55 0.00 0.00 41.25 40.02 3flm s ASN 269 CO 0.29 -0.05 2.15 0.00 -2.79 0.00 0.00 177.10 176.71 3flm h ALA 270 N 7.14 1.97 0.00 1.71 0.00 -1.88 -0.85 119.26 127.34 3flm h ALA 270 Ca -0.38 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3flm h ALA 270 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3flm h ALA 270 CO 0.73 -0.05 0.00 0.87 0.00 0.00 0.00 179.25 180.80 3flm h LYS 271 N 0.00 0.00 0.01 0.00 1.57 -1.93 -1.47 116.57 114.74 3flm h LYS 271 Ca 0.02 0.00 -0.39 0.00 -1.87 0.00 0.00 60.65 58.41 3flm h LYS 271 Cb 0.09 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.33 3flm h LYS 271 CO -0.00 0.00 -2.44 0.00 -0.57 0.00 0.00 179.45 176.44 3flm n ALA 272 N -1.95 1.40 -0.23 3.86 0.00 -0.36 -3.14 120.51 120.09 3flm n ALA 272 Ca 0.01 -1.09 0.04 0.00 0.00 0.00 0.00 53.44 52.40 3flm n ALA 272 Cb 0.27 -0.15 0.16 0.00 0.00 0.00 0.00 19.45 19.72 3flm n ALA 272 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3flm h THR 273 N 0.01 0.60 -0.28 0.00 1.35 -1.38 -1.18 112.91 112.03 3flm h THR 273 Ca -0.57 -0.11 -0.08 0.00 -0.55 0.00 0.00 66.41 65.10 3flm h THR 273 Cb 1.93 0.25 -0.02 0.00 -1.73 0.00 0.00 68.15 68.59 3flm h THR 273 CO -0.07 0.06 -0.17 0.28 -0.25 0.00 0.00 175.52 175.37 3flm h SER 274 N 0.32 0.50 -0.14 5.36 0.02 -1.42 -0.38 113.55 117.82 3flm h SER 274 Ca 0.38 -0.15 -0.15 0.00 -0.84 0.00 0.00 61.79 61.03 3flm h SER 274 Cb 0.60 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 3flm h SER 274 CO -0.44 0.69 -0.44 -0.33 -1.14 0.00 0.00 176.83 175.17 3flm h GLU 275 N 0.46 0.69 0.00 3.45 5.08 -1.41 -3.18 114.58 119.67 3flm h GLU 275 Ca 0.08 -0.38 -0.07 0.00 -1.00 0.00 0.00 59.36 57.98 3flm h GLU 275 Cb 0.57 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 3flm h GLU 275 CO 0.04 1.00 -0.35 -0.07 -1.00 0.00 0.00 179.01 178.63 3flm h LEU 276 N 0.56 0.00 -2.47 1.33 3.38 -0.14 -0.35 115.31 117.61 3flm h LEU 276 Ca 0.04 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.02 3flm h LEU 276 Cb 0.99 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.74 3flm h LEU 276 CO 0.09 0.35 0.08 1.56 0.09 0.00 0.00 178.44 180.61 3flm h GLN 277 N 0.00 0.00 0.00 1.13 4.20 -1.09 -1.19 115.11 118.16 3flm h GLN 277 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3flm h GLN 277 Cb 0.63 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.41 3flm h GLN 277 CO 0.05 0.00 0.00 1.04 -0.67 0.00 0.00 178.83 179.25 3flm n GLN 278 N -3.62 0.36 -2.38 1.46 6.02 -0.14 -4.81 117.38 114.27 3flm n GLN 278 Ca -0.02 0.03 -0.43 0.00 -0.01 0.00 0.00 57.00 56.58 3flm n GLN 278 Cb 0.17 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 29.91 3flm n GLN 278 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3flm s ALA 279 N -2.61 3.59 -0.16 -1.58 0.00 -0.45 -4.86 121.76 115.68 3flm s ALA 279 Ca 0.25 0.61 0.19 0.00 0.00 0.00 0.00 51.96 53.01 3flm s ALA 279 Cb 0.18 -3.59 -0.27 0.00 0.00 0.00 0.00 23.12 19.45 3flm s ALA 279 CO 0.43 -1.00 0.17 1.04 0.00 0.00 0.00 175.76 176.39 3flm n GLN 280 N 5.96 0.68 -4.46 0.00 6.02 0.10 -4.25 117.38 121.43 3flm n GLN 280 Ca 0.13 -0.05 -0.22 0.00 -0.01 0.00 0.00 57.00 56.85 3flm n GLN 280 Cb 0.45 -1.52 -0.14 0.00 1.02 0.00 0.00 30.24 30.05 3flm n GLN 280 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.06 174.55 3flm s ILE 281 N -2.72 1.36 -0.08 5.09 2.07 -1.19 0.23 121.20 125.96 3flm s ILE 281 Ca -0.10 -1.11 0.05 0.00 -1.41 0.00 0.00 60.65 58.09 3flm s ILE 281 Cb 0.08 -1.21 -0.01 0.00 0.13 0.00 0.00 42.46 41.45 3flm s ILE 281 CO 0.85 0.08 -0.25 -0.69 -1.91 0.00 0.00 174.94 173.02 3flm s VAL 282 N -0.85 2.06 -0.27 4.00 1.01 -0.33 -1.09 120.40 124.93 3flm s VAL 282 Ca 0.04 -1.05 -0.02 0.00 0.00 0.00 0.00 61.98 60.95 3flm s VAL 282 Cb -0.08 -1.76 0.03 0.00 0.00 0.00 0.00 36.38 34.57 3flm s VAL 282 CO 0.02 0.57 -0.03 -0.69 0.00 0.00 0.00 175.10 174.96 3flm s VAL 283 N 0.06 3.00 -0.19 2.92 1.01 0.08 -0.06 120.40 127.22 3flm s VAL 283 Ca -0.10 -1.10 -0.05 0.00 0.00 0.00 0.00 61.98 60.73 3flm s VAL 283 Cb -0.16 -2.59 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 3flm s VAL 283 CO 0.06 0.10 0.00 -1.58 0.00 0.00 0.00 175.10 173.69 3flm s GLN 284 N 1.32 3.70 -0.18 2.72 0.74 0.52 -0.65 119.66 127.82 3flm s GLN 284 Ca -0.01 -0.49 -0.02 0.00 0.05 0.00 0.00 55.36 54.89 3flm s GLN 284 Cb -0.18 -3.07 -0.01 0.00 1.10 0.00 0.00 33.01 30.85 3flm s GLN 284 CO -0.03 0.11 -0.08 -0.51 -0.55 0.00 0.00 175.29 174.24 3flm s LEU 285 N 0.74 2.85 0.07 3.68 2.01 -0.02 -0.96 118.68 127.05 3flm s LEU 285 Ca 0.00 -0.35 0.00 0.00 0.01 0.00 0.00 54.13 53.79 3flm s LEU 285 Cb -0.14 -1.69 0.00 0.00 0.01 0.00 0.00 46.19 44.37 3flm s LEU 285 CO 0.02 0.06 0.00 0.61 1.01 0.00 0.00 176.35 178.05 3flm n GLY 286 N 4.24 -1.42 0.00 -3.19 0.00 0.89 -1.74 105.19 103.98 3flm n GLY 286 Ca -0.18 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.38 3flm n GLY 286 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3flm n SER 287 N -1.70 0.00 -3.58 1.61 3.41 -1.25 -4.50 113.62 107.61 3flm n SER 287 Ca 0.00 -0.65 -0.20 0.00 -0.26 0.00 0.00 58.87 57.76 3flm n SER 287 Cb 0.13 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.14 3flm n SER 287 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3flm n SER 288 N -1.45 -1.71 -4.66 4.04 7.64 -1.26 -2.49 113.62 113.74 3flm n SER 288 Ca 0.00 -0.72 -0.43 0.00 1.01 0.00 0.00 58.87 58.72 3flm n SER 288 Cb 0.00 -4.56 -0.01 0.00 -1.01 0.00 0.00 64.21 58.63 3flm n SER 288 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3flm n LEU 289 N -4.23 2.85 -0.09 -3.43 7.99 -1.26 -4.73 117.00 114.11 3flm n LEU 289 Ca -0.28 1.19 -0.12 0.00 -0.01 0.00 0.00 56.01 56.79 3flm n LEU 289 Cb 0.67 -1.41 -0.05 0.00 -0.11 0.00 0.00 43.42 42.53 3flm n LEU 289 CO 0.65 -0.84 -0.57 0.41 -1.51 0.00 0.00 177.39 175.53 3flm n THR 290 N 0.37 1.47 -1.58 -5.08 -1.04 -1.26 -4.92 114.28 102.24 3flm n THR 290 Ca 0.07 0.09 -0.43 0.00 -2.04 0.00 0.00 64.05 61.73 3flm n THR 290 Cb 0.34 -2.26 -0.00 0.00 -1.82 0.00 0.00 70.33 66.59 3flm n THR 290 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3flm n GLY 291 N 1.51 -0.41 0.30 3.41 0.00 -1.26 -4.83 105.19 103.91 3flm n GLY 291 Ca -0.19 0.23 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 3flm n GLY 291 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3flm h LYS 292 N 1.68 1.02 -0.20 1.61 3.64 -1.95 0.39 116.57 122.77 3flm h LYS 292 Ca -0.41 -0.34 -0.13 0.00 -1.27 0.00 0.00 60.65 58.50 3flm h LYS 292 Cb 1.35 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 33.07 3flm h LYS 292 CO 0.58 1.02 -0.43 0.00 -2.27 0.00 0.00 179.45 178.35 3flm h ARG 293 N 0.93 0.49 -0.04 1.90 2.47 -1.91 -2.50 114.38 115.72 3flm h ARG 293 Ca 0.16 -0.26 -0.19 0.00 -1.26 0.00 0.00 59.98 58.43 3flm h ARG 293 Cb 0.59 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.91 3flm h ARG 293 CO 0.04 0.83 -0.79 1.25 0.56 0.00 0.00 179.97 181.86 3flm h LEU 294 N 0.40 0.42 -0.40 3.04 5.85 -1.85 0.36 115.31 123.12 3flm h LEU 294 Ca 0.03 -0.29 0.05 0.00 0.84 0.00 0.00 57.88 58.51 3flm h LEU 294 Cb 0.92 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.78 3flm h LEU 294 CO 0.08 1.05 0.12 -0.07 -0.34 0.00 0.00 178.44 179.27 3flm h LEU 295 N 0.22 0.09 -0.36 2.25 3.38 -0.79 -2.24 115.31 117.85 3flm h LEU 295 Ca -0.04 0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.86 3flm h LEU 295 Cb 1.38 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.18 3flm h LEU 295 CO 0.13 0.09 -0.25 1.56 0.09 0.00 0.00 178.44 180.05 3flm h GLN 296 N 0.26 0.81 -0.62 1.13 4.20 -0.98 -1.29 115.11 118.63 3flm h GLN 296 Ca 0.19 -0.39 0.07 0.00 0.06 0.00 0.00 58.65 58.58 3flm h GLN 296 Cb 0.20 -0.01 -0.06 0.00 0.30 0.00 0.00 27.48 27.92 3flm h GLN 296 CO -0.22 1.02 0.31 2.35 -0.67 0.00 0.00 178.83 181.63 3flm h TRP 297 N 0.60 0.57 -0.47 2.96 7.01 -0.18 -1.19 115.95 125.25 3flm h TRP 297 Ca 0.07 0.03 -0.07 0.00 2.11 0.00 0.00 58.89 61.03 3flm h TRP 297 Cb 0.82 -0.16 -0.02 0.00 -2.10 0.00 0.00 29.16 27.70 3flm h TRP 297 CO 0.06 0.25 0.03 0.37 -2.79 0.00 0.00 178.44 176.36 3flm h GLN 298 N 0.58 0.76 -0.21 2.65 -0.00 -1.19 -1.93 115.11 115.77 3flm h GLN 298 Ca 0.29 -0.19 -0.02 0.00 -0.00 0.00 0.00 58.65 58.73 3flm h GLN 298 Cb 0.23 -0.10 -0.01 0.00 0.00 0.00 0.00 27.48 27.60 3flm h GLN 298 CO -0.21 0.75 0.03 0.00 0.00 0.00 0.00 178.83 179.41 3flm h ALA 299 N 1.31 1.68 -0.07 3.38 0.00 -0.04 -3.26 119.26 122.25 3flm h ALA 299 Ca 0.15 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3flm h ALA 299 Cb 0.40 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3flm h ALA 299 CO 0.01 0.25 0.00 -1.13 0.00 0.00 0.00 179.25 178.38 3flm n SER 300 N -4.40 2.33 -4.81 0.00 3.41 -0.82 -4.94 113.62 104.39 3flm n SER 300 Ca 0.00 -1.65 -0.33 0.00 -0.26 0.00 0.00 58.87 56.63 3flm n SER 300 Cb 0.16 -0.04 -0.05 0.00 -0.26 0.00 0.00 64.21 64.02 3flm n SER 300 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3flm n GLU 302 N -0.84 1.59 -0.66 0.00 1.02 -1.26 -5.04 120.64 115.45 3flm n GLU 302 Ca 0.08 -3.67 -0.29 0.00 -0.02 0.00 0.00 57.16 53.26 3flm n GLU 302 Cb 0.53 -1.70 0.21 0.00 -0.02 0.00 0.00 31.44 30.47 3flm n GLU 302 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3flm s PRO 303 N -2.90 -0.10 0.15 3.49 0.04 -1.26 -4.93 135.00 129.50 3flm s PRO 303 Ca 0.38 1.07 -0.14 0.00 0.04 0.00 0.00 61.00 62.35 3flm s PRO 303 Cb 0.38 -1.63 0.03 0.00 0.04 0.00 0.00 34.50 33.32 3flm s PRO 303 CO -0.06 -3.24 1.70 1.49 0.04 0.00 0.00 177.00 176.93 3flm h GLU 304 N -2.28 0.73 -4.14 4.56 4.57 0.26 -3.44 114.58 114.84 3flm h GLU 304 Ca -0.54 -0.14 -0.30 0.00 -1.18 0.00 0.00 59.36 57.20 3flm h GLU 304 Cb 1.31 -0.12 -0.29 0.00 -0.16 0.00 0.00 28.75 29.49 3flm h GLU 304 CO 0.48 0.66 -0.75 -1.21 -1.18 0.00 0.00 179.01 177.01 3flm s GLU 305 N -5.54 0.32 -0.22 1.92 2.02 -0.97 -4.86 118.70 111.37 3flm s GLU 305 Ca -0.13 -0.13 -0.05 0.00 0.02 0.00 0.00 54.97 54.69 3flm s GLU 305 Cb 0.11 -0.32 -0.01 0.00 0.10 0.00 0.00 34.13 34.01 3flm s GLU 305 CO 0.77 0.07 -0.02 -0.47 0.02 0.00 0.00 175.26 175.64 3flm s TYR 306 N -0.02 2.99 -0.04 1.61 6.14 -1.02 -1.18 117.35 125.82 3flm s TYR 306 Ca 0.01 -0.79 0.02 0.00 0.64 0.00 0.00 57.07 56.95 3flm s TYR 306 Cb -0.02 -2.12 -0.03 0.00 0.42 0.00 0.00 41.96 40.20 3flm s TYR 306 CO -0.00 -0.48 -0.08 -1.58 0.64 0.00 0.00 175.55 174.05 3flm s TRP 307 N 1.44 2.89 -0.14 4.97 0.52 0.91 -1.35 118.94 128.19 3flm s TRP 307 Ca 0.05 -0.02 0.01 0.00 0.02 0.00 0.00 56.10 56.17 3flm s TRP 307 Cb -0.14 -1.66 0.02 0.00 -1.15 0.00 0.00 33.47 30.53 3flm s TRP 307 CO -0.01 0.33 -0.18 0.42 0.02 0.00 0.00 176.95 177.53 3flm s ILE 308 N -0.88 1.79 -0.26 2.03 1.01 -0.60 -0.35 121.20 123.93 3flm s ILE 308 Ca 0.14 -0.80 -0.10 0.00 0.00 0.00 0.00 60.65 59.89 3flm s ILE 308 Cb -0.11 -1.62 -0.05 0.00 0.01 0.00 0.00 42.46 40.69 3flm s ILE 308 CO 0.04 0.50 0.16 -0.69 0.00 0.00 0.00 174.94 174.95 3flm s VAL 309 N 1.11 5.18 0.00 2.92 1.01 -0.13 0.27 120.40 130.75 3flm s VAL 309 Ca -0.02 0.12 -0.28 0.00 0.00 0.00 0.00 61.98 61.80 3flm s VAL 309 Cb -0.14 -3.45 0.09 0.00 0.00 0.00 0.00 36.38 32.88 3flm s VAL 309 CO -0.06 0.29 0.77 -0.62 0.00 0.00 0.00 175.10 175.48 3flm s ASP 310 N 1.53 -0.51 -0.05 3.32 -1.08 -0.93 -0.07 116.67 118.88 3flm s ASP 310 Ca 0.07 0.28 -0.00 0.00 -0.52 0.00 0.00 52.55 52.37 3flm s ASP 310 Cb -0.15 0.48 0.04 0.00 -1.46 0.00 0.00 42.92 41.82 3flm s ASP 310 CO 0.08 -0.67 1.76 -0.67 0.52 0.00 0.00 175.17 176.20 3flm n ASP 311 N 0.22 4.89 -3.73 -0.34 -0.08 -1.07 -1.29 116.55 115.14 3flm n ASP 311 Ca -0.14 -2.42 -0.14 0.00 -1.51 0.00 0.00 54.79 50.58 3flm n ASP 311 Cb 0.61 -0.96 -0.08 0.00 2.34 0.00 0.00 41.12 43.02 3flm n ASP 311 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 3flm s ILE 312 N -0.35 0.05 0.34 5.18 2.07 -1.26 -4.87 121.20 122.36 3flm s ILE 312 Ca 0.05 -0.45 0.03 0.00 -1.41 0.00 0.00 60.65 58.86 3flm s ILE 312 Cb 0.04 -0.69 -0.02 0.00 0.13 0.00 0.00 42.46 41.91 3flm s ILE 312 CO 0.00 -0.25 0.51 -1.61 -1.91 0.00 0.00 174.94 171.69 3flm s GLU 313 N -1.49 3.33 0.00 3.50 2.02 -1.26 -4.81 118.70 119.99 3flm s GLU 313 Ca -0.12 -0.58 0.00 0.00 0.02 0.00 0.00 54.97 54.29 3flm s GLU 313 Cb -0.04 -2.72 0.00 0.00 0.10 0.00 0.00 34.13 31.47 3flm s GLU 313 CO 0.04 0.12 0.00 0.41 0.02 0.00 0.00 175.26 175.85 3flm n GLY 314 N -1.73 2.74 3.76 -1.39 0.00 -1.26 -4.98 105.19 102.34 3flm n GLY 314 Ca -0.04 -1.88 -0.38 0.00 0.00 0.00 0.00 46.02 43.72 3flm n GLY 314 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3flm s ARG 315 N -3.28 3.69 0.00 1.61 0.52 -1.26 -4.92 118.95 115.30 3flm s ARG 315 Ca 0.00 2.00 0.00 0.00 -0.52 0.00 0.00 55.73 57.21 3flm s ARG 315 Cb 0.00 -2.49 0.00 0.00 0.52 0.00 0.00 34.95 32.98 3flm s ARG 315 CO 0.00 -0.67 0.59 1.28 0.02 0.00 0.00 175.30 176.52 3flm n LEU 316 N -0.40 0.95 -4.27 2.53 4.77 -1.26 -4.97 117.00 114.35 3flm n LEU 316 Ca 0.07 -0.95 -0.44 0.00 -0.03 0.00 0.00 56.01 54.66 3flm n LEU 316 Cb 0.46 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.49 3flm n LEU 316 CO 0.51 0.24 0.14 -0.62 -1.33 0.00 0.00 177.39 176.33 3flm s ASP 317 N -0.35 6.09 0.00 -1.43 -1.08 -1.26 -4.92 116.67 113.73 3flm s ASP 317 Ca 0.00 -2.04 0.12 0.00 -0.52 0.00 0.00 52.55 50.11 3flm s ASP 317 Cb 0.00 -2.13 0.65 0.00 -1.46 0.00 0.00 42.92 39.98 3flm s ASP 317 CO 0.00 -0.73 1.27 -0.81 0.52 0.00 0.00 175.17 175.42 3flm n PRO 318 N 4.83 0.23 0.07 4.34 -0.04 -1.26 -1.55 135.00 141.61 3flm n PRO 318 Ca -0.06 0.13 0.12 0.00 -0.04 0.00 0.00 63.50 63.65 3flm n PRO 318 Cb 0.41 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.42 3flm n PRO 318 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3flm n ALA 319 N -1.22 2.87 -2.46 0.55 0.00 -1.26 -5.03 120.51 113.96 3flm n ALA 319 Ca 0.07 -0.29 -0.07 0.00 0.00 0.00 0.00 53.44 53.14 3flm n ALA 319 Cb 0.08 -1.08 0.03 0.00 0.00 0.00 0.00 19.45 18.49 3flm n ALA 319 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3flm n HIS 320 N -2.31 -1.00 -2.59 0.00 -0.00 -0.60 -4.99 115.22 103.73 3flm n HIS 320 Ca 0.01 0.39 -0.33 0.00 -0.00 0.00 0.00 57.72 57.80 3flm n HIS 320 Cb 0.49 -3.27 -0.05 0.00 -0.00 0.00 0.00 29.99 27.16 3flm n HIS 320 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 3flm s HIS 321 N -3.16 3.34 0.30 4.41 3.76 -1.26 -4.99 115.29 117.69 3flm s HIS 321 Ca 0.09 1.54 -0.30 0.00 -0.15 0.00 0.00 55.06 56.24 3flm s HIS 321 Cb -0.01 -2.84 -0.12 0.00 1.11 0.00 0.00 32.58 30.72 3flm s HIS 321 CO 0.32 -0.30 1.51 -2.13 -0.85 0.00 0.00 174.74 173.29 3flm n ARG 322 N -1.12 2.48 0.00 1.40 0.00 -1.26 -4.81 116.66 113.36 3flm n ARG 322 Ca 0.07 0.88 0.00 0.00 -0.00 0.00 0.00 57.85 58.80 3flm n ARG 322 Cb 0.54 -2.61 0.00 0.00 0.00 0.00 0.00 32.46 30.39 3flm n ARG 322 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3flm n GLY 323 N 1.78 -0.53 3.16 5.14 0.00 -1.26 -2.44 105.19 111.05 3flm n GLY 323 Ca 0.08 -0.60 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 3flm n GLY 323 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3flm s ARG 324 N -1.84 0.70 -0.25 1.61 0.52 -0.45 -4.93 118.95 114.32 3flm s ARG 324 Ca 0.00 -0.79 -0.01 0.00 -0.52 0.00 0.00 55.73 54.41 3flm s ARG 324 Cb 0.00 0.28 0.07 0.00 0.52 0.00 0.00 34.95 35.83 3flm s ARG 324 CO 0.00 -0.20 0.03 0.50 0.02 0.00 0.00 175.30 175.65 3flm s ARG 325 N -3.03 0.98 -0.15 3.54 6.06 -1.26 -1.56 118.95 123.53 3flm s ARG 325 Ca -0.01 -0.84 -0.04 0.00 -2.50 0.00 0.00 55.73 52.34 3flm s ARG 325 Cb 0.01 -2.26 -0.03 0.00 0.06 0.00 0.00 34.95 32.74 3flm s ARG 325 CO -0.06 -0.75 -0.03 -0.51 -2.50 0.00 0.00 175.30 171.45 3flm s LEU 326 N 1.61 3.33 -0.38 -0.88 1.43 0.14 -4.99 118.68 118.95 3flm s LEU 326 Ca 0.01 -0.09 -0.14 0.00 -1.03 0.00 0.00 54.13 52.89 3flm s LEU 326 Cb -0.18 -1.80 0.00 0.00 0.03 0.00 0.00 46.19 44.24 3flm s LEU 326 CO -0.13 0.19 0.28 -0.63 0.23 0.00 0.00 176.35 176.29 3flm s ILE 327 N 0.26 5.26 -0.09 -0.59 1.09 -1.26 -2.20 121.20 123.67 3flm s ILE 327 Ca -0.02 -0.44 -0.30 0.00 -1.10 0.00 0.00 60.65 58.79 3flm s ILE 327 Cb -0.14 -3.84 0.10 0.00 -1.06 0.00 0.00 42.46 37.53 3flm s ILE 327 CO 0.03 -0.18 0.86 0.00 -0.10 0.00 0.00 174.94 175.55 3flm s ALA 328 N 1.72 -1.85 0.02 9.38 0.00 -0.41 -1.01 121.76 129.60 3flm s ALA 328 Ca 0.06 1.39 -0.35 0.00 0.00 0.00 0.00 51.96 53.06 3flm s ALA 328 Cb -0.18 -0.28 -0.14 0.00 0.00 0.00 0.00 23.12 22.52 3flm s ALA 328 CO 0.10 -0.39 1.68 -1.71 0.00 0.00 0.00 175.76 175.44 3flm n ASN 329 N 0.64 2.97 -0.07 0.00 2.85 -1.26 -2.61 115.26 117.77 3flm n ASN 329 Ca -0.13 1.05 -0.10 0.00 -0.11 0.00 0.00 54.58 55.28 3flm n ASN 329 Cb 0.58 -1.35 -0.03 0.00 1.24 0.00 0.00 39.78 40.22 3flm n ASN 329 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 3flm h ILE 330 N 4.41 1.16 -0.67 -1.44 2.04 -1.94 0.29 117.51 121.37 3flm h ILE 330 Ca -0.47 -0.49 0.13 0.00 1.00 0.00 0.00 64.86 65.03 3flm h ILE 330 Cb 1.28 1.03 -0.13 0.00 -0.74 0.00 0.00 36.82 38.26 3flm h ILE 330 CO 0.90 0.17 -0.23 0.00 0.00 0.00 0.00 178.15 178.99 3flm h ALA 331 N 0.95 0.30 -0.40 1.87 0.00 -1.94 0.82 119.26 120.86 3flm h ALA 331 Ca 0.08 0.24 -0.07 0.00 0.00 0.00 0.00 54.91 55.16 3flm h ALA 331 Cb 0.16 0.62 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 3flm h ALA 331 CO -0.01 -0.50 -0.03 -0.44 0.00 0.00 0.00 179.25 178.27 3flm h ASP 332 N -0.05 0.71 -0.22 0.00 3.32 -1.44 -2.40 116.42 116.34 3flm h ASP 332 Ca 0.30 -0.33 0.05 0.00 0.02 0.00 0.00 57.03 57.08 3flm h ASP 332 Cb 0.53 -0.19 -0.06 0.00 0.22 0.00 0.00 39.33 39.83 3flm h ASP 332 CO -0.71 0.87 -0.15 -0.25 -1.72 0.00 0.00 179.24 177.27 3flm h TRP 333 N 0.54 -0.38 -0.90 4.55 7.01 0.99 0.47 115.95 128.23 3flm h TRP 333 Ca 0.11 0.03 0.12 0.00 2.11 0.00 0.00 58.89 61.25 3flm h TRP 333 Cb 0.52 0.20 -0.08 0.00 -2.10 0.00 0.00 29.16 27.70 3flm h TRP 333 CO 0.04 -0.22 0.53 -0.07 -2.79 0.00 0.00 178.44 175.93 3flm h LEU 334 N -0.15 0.75 -1.15 0.65 3.38 -0.66 -0.07 115.31 118.06 3flm h LEU 334 Ca 0.12 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.13 3flm h LEU 334 Cb 0.34 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 3flm h LEU 334 CO -0.31 0.39 0.28 -0.33 0.09 0.00 0.00 178.44 178.57 3flm h GLU 335 N 0.84 0.88 0.00 1.13 5.08 -0.47 -2.48 114.58 119.56 3flm h GLU 335 Ca 0.45 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 3flm h GLU 335 Cb 0.48 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.56 3flm h GLU 335 CO -0.28 0.69 0.00 -0.11 -1.00 0.00 0.00 179.01 178.32 3flm n LEU 336 N -4.34 0.00 -3.15 1.33 7.94 -0.15 -3.99 117.00 114.64 3flm n LEU 336 Ca 0.06 0.44 -0.18 0.00 -1.11 0.00 0.00 56.01 55.21 3flm n LEU 336 Cb 0.14 -0.44 -0.03 0.00 0.53 0.00 0.00 43.42 43.62 3flm n LEU 336 CO 0.38 -0.00 -0.21 1.41 -1.11 0.00 0.00 177.39 177.86 3flm n HIS 337 N -1.44 0.42 -1.10 1.96 8.25 -0.58 -4.86 115.22 117.88 3flm n HIS 337 Ca 0.09 -3.78 -0.30 0.00 -0.26 0.00 0.00 57.72 53.47 3flm n HIS 337 Cb 0.31 -0.42 0.15 0.00 1.12 0.00 0.00 29.99 31.14 3flm n HIS 337 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3flm s PRO 338 N -2.52 1.15 0.28 -0.41 0.04 -0.96 -4.80 135.00 127.78 3flm s PRO 338 Ca 0.40 0.94 0.02 0.00 0.04 0.00 0.00 61.00 62.40 3flm s PRO 338 Cb 0.35 -1.79 -0.03 0.00 0.04 0.00 0.00 34.50 33.07 3flm s PRO 338 CO -0.08 -2.35 0.45 0.00 0.04 0.00 0.00 177.00 175.06 3flm s ALA 339 N -2.86 3.81 -0.13 8.56 0.00 -1.26 -5.05 121.76 124.84 3flm s ALA 339 Ca 0.64 -1.04 0.02 0.00 0.00 0.00 0.00 51.96 51.58 3flm s ALA 339 Cb -0.19 -1.93 -0.00 0.00 0.00 0.00 0.00 23.12 21.00 3flm s ALA 339 CO 0.58 0.15 -0.19 -2.00 0.00 0.00 0.00 175.76 174.29 3flm s GLU 340 N -4.04 3.15 0.29 0.00 2.12 -1.26 -5.00 118.70 113.95 3flm s GLU 340 Ca 0.37 -0.81 -0.30 0.00 0.36 0.00 0.00 54.97 54.60 3flm s GLU 340 Cb -0.10 -2.47 -0.13 0.00 0.26 0.00 0.00 34.13 31.69 3flm s GLU 340 CO 0.32 0.10 1.40 1.17 -0.54 0.00 0.00 175.26 177.71 3flm n LYS 341 N 3.78 2.21 -3.56 4.30 3.00 -1.25 -4.35 118.16 122.29 3flm n LYS 341 Ca -0.19 0.78 -0.14 0.00 -0.00 0.00 0.00 58.31 58.76 3flm n LYS 341 Cb 0.52 -2.44 -0.05 0.00 0.00 0.00 0.00 35.03 33.07 3flm n LYS 341 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 3flm s ARG 342 N -1.01 1.06 -0.04 1.64 3.52 -0.19 -4.98 118.95 118.95 3flm s ARG 342 Ca 0.62 -0.22 -0.28 0.00 -0.13 0.00 0.00 55.73 55.72 3flm s ARG 342 Cb -0.59 0.49 -0.03 0.00 -1.56 0.00 0.00 34.95 33.26 3flm s ARG 342 CO 0.54 -0.39 0.90 -0.65 -0.81 0.00 0.00 175.30 174.90 3flm s GLN 343 N -2.48 4.50 -0.29 5.12 -1.52 -1.26 -3.64 119.66 120.09 3flm s GLN 343 Ca -0.05 1.25 -0.39 0.00 -1.95 0.00 0.00 55.36 54.22 3flm s GLN 343 Cb -0.01 -3.47 -0.14 0.00 -0.22 0.00 0.00 33.01 29.17 3flm s GLN 343 CO -0.02 -0.06 1.88 -2.30 -0.25 0.00 0.00 175.29 174.55 3flm n PRO 344 N 4.04 1.18 0.00 2.91 -0.02 -1.26 -4.76 135.00 137.09 3flm n PRO 344 Ca 0.04 0.41 0.14 0.00 -2.02 0.00 0.00 63.50 62.08 3flm n PRO 344 Cb 0.51 -2.21 0.62 0.00 -0.02 0.00 0.00 33.50 32.39 3flm n PRO 344 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 3flm n TRP 345 N 6.66 0.00 -3.35 6.00 4.27 -1.19 -4.75 117.44 125.08 3flm n TRP 345 Ca 0.31 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.49 3flm n TRP 345 Cb 0.16 -0.11 -0.09 0.00 -1.36 0.00 0.00 31.31 29.92 3flm n TRP 345 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 3flm n VAL 347 N 5.34 1.66 1.00 0.00 0.31 -1.26 -4.54 118.33 120.83 3flm n VAL 347 Ca -0.09 -0.41 0.12 0.00 -0.01 0.00 0.00 64.34 63.94 3flm n VAL 347 Cb 0.46 -1.83 0.16 0.00 -0.91 0.00 0.00 33.84 31.72 3flm n VAL 347 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3flm n GLU 348 N -3.85 0.00 -0.05 5.55 1.02 -1.26 -4.49 120.64 117.55 3flm n GLU 348 Ca -0.34 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 56.64 3flm n GLU 348 Cb 0.90 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 30.69 3flm n GLU 348 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3flm h ILE 349 N 0.00 1.64 -0.58 -3.67 1.08 -1.90 -2.97 117.51 111.11 3flm h ILE 349 Ca 0.00 -2.36 0.08 0.00 -0.39 0.00 0.00 64.86 62.19 3flm h ILE 349 Cb 0.50 3.22 -0.03 0.00 -3.07 0.00 0.00 36.82 37.44 3flm h ILE 349 CO 0.00 0.60 0.39 -0.65 -0.69 0.00 0.00 178.15 177.79 3flm h PRO 350 N -0.88 0.46 0.34 2.37 0.11 -1.83 -2.43 132.00 130.13 3flm h PRO 350 Ca -0.07 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.01 3flm h PRO 350 Cb 1.15 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 3flm h PRO 350 CO 0.00 0.30 -0.41 -0.09 -0.21 0.00 0.00 178.00 177.60 3flm h ARG 351 N 0.47 -0.74 0.00 1.05 2.43 -1.78 -2.92 114.38 112.89 3flm h ARG 351 Ca 0.26 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.48 3flm h ARG 351 Cb 0.41 0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 3flm h ARG 351 CO -0.07 -0.49 0.13 -0.07 -1.51 0.00 0.00 179.97 177.96 3flm h LEU 352 N -0.76 0.00 0.02 3.80 3.38 -1.29 -2.84 115.31 117.61 3flm h LEU 352 Ca -0.04 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.63 3flm h LEU 352 Cb 0.68 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.38 3flm h LEU 352 CO -0.08 0.00 -1.68 0.00 0.09 0.00 0.00 178.44 176.76 3flm h ALA 353 N 1.72 0.70 -0.04 1.53 0.00 -1.27 -1.91 119.26 119.98 3flm h ALA 353 Ca 0.00 -1.41 0.00 0.00 0.00 0.00 0.00 54.91 53.50 3flm h ALA 353 Cb 0.27 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 3flm h ALA 353 CO 0.00 1.53 0.03 1.49 0.00 0.00 0.00 179.25 182.29 3flm h GLU 354 N 0.01 0.06 -0.56 0.00 4.81 -1.39 -1.38 114.58 116.13 3flm h GLU 354 Ca -0.28 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.93 3flm h GLU 354 Cb 2.00 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 31.34 3flm h GLU 354 CO 0.09 0.04 0.29 1.96 -0.73 0.00 0.00 179.01 180.66 3flm h GLN 355 N 0.06 0.77 0.05 1.92 4.20 -1.57 -0.07 115.11 120.47 3flm h GLN 355 Ca 0.02 -0.08 0.01 0.00 0.06 0.00 0.00 58.65 58.65 3flm h GLN 355 Cb -0.00 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.60 3flm h GLN 355 CO -0.00 0.58 -0.24 0.00 -0.67 0.00 0.00 178.83 178.50 3flm h ALA 356 N 1.55 -0.75 -0.68 3.87 0.00 -1.20 0.29 119.26 122.33 3flm h ALA 356 Ca 0.20 -0.05 0.14 0.00 0.00 0.00 0.00 54.91 55.19 3flm h ALA 356 Cb 0.04 0.65 -0.10 0.00 0.00 0.00 0.00 17.79 18.39 3flm h ALA 356 CO -0.03 -0.81 0.17 1.98 0.00 0.00 0.00 179.25 180.57 3flm h MET 357 N -0.33 0.29 -0.41 0.00 -1.53 -0.78 0.26 114.93 112.42 3flm h MET 357 Ca -0.00 -0.02 -0.15 0.00 -3.44 0.00 0.00 59.70 56.09 3flm h MET 357 Cb 0.34 -0.06 -0.01 0.00 -0.55 0.00 0.00 31.60 31.31 3flm h MET 357 CO -0.13 0.19 -0.32 1.96 0.14 0.00 0.00 176.91 178.75 3flm h GLN 358 N 0.29 0.94 -0.30 0.39 4.20 -0.93 0.70 115.11 120.41 3flm h GLN 358 Ca 0.37 -0.47 0.07 0.00 0.06 0.00 0.00 58.65 58.68 3flm h GLN 358 Cb 0.58 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.29 3flm h GLN 358 CO -0.45 1.13 -0.21 0.00 -0.67 0.00 0.00 178.83 178.63 3flm h ALA 359 N 0.80 -0.02 0.20 3.87 0.00 0.70 -2.79 119.26 122.02 3flm h ALA 359 Ca 0.08 0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.10 3flm h ALA 359 Cb 0.91 0.46 -0.04 0.00 0.00 0.00 0.00 17.79 19.13 3flm h ALA 359 CO 0.08 -0.61 -0.38 0.28 0.00 0.00 0.00 179.25 178.62 3flm h VAL 360 N -0.18 0.21 -0.90 0.00 2.07 0.16 -3.20 116.25 114.41 3flm h VAL 360 Ca 0.16 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.82 3flm h VAL 360 Cb 0.42 0.21 -0.15 0.00 -1.52 0.00 0.00 31.29 30.26 3flm h VAL 360 CO -0.41 0.00 -0.35 -0.38 0.02 0.00 0.00 177.57 176.46 3flm n ILE 361 N -5.46 -0.47 0.00 4.57 5.41 0.22 0.79 119.36 124.42 3flm n ILE 361 Ca -0.08 2.11 0.00 0.00 1.00 0.00 0.00 62.75 65.78 3flm n ILE 361 Cb 0.37 -2.79 0.00 0.00 -0.71 0.00 0.00 39.64 36.51 3flm n ILE 361 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3flm n ALA 362 N -3.53 0.97 -1.56 -1.39 0.00 -1.07 -1.18 120.51 112.75 3flm n ALA 362 Ca 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.50 3flm n ALA 362 Cb 0.36 -0.85 0.18 0.00 0.00 0.00 0.00 19.45 19.15 3flm n ALA 362 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3flm n ARG 363 N -1.29 1.92 0.00 0.00 5.12 0.24 -4.73 116.66 117.92 3flm n ARG 363 Ca 0.00 -3.33 0.13 0.00 -1.93 0.00 0.00 57.85 52.72 3flm n ARG 363 Cb 0.05 -1.80 0.43 0.00 -1.16 0.00 0.00 32.46 29.98 3flm n ARG 363 CO 0.00 0.00 0.00 2.89 -1.93 0.00 0.00 177.63 178.59 3flm n ARG 364 N -1.08 0.07 -0.08 5.56 1.85 -0.33 -4.37 116.66 118.28 3flm n ARG 364 Ca 0.30 -0.03 -0.15 0.00 -1.00 0.00 0.00 57.85 56.98 3flm n ARG 364 Cb 0.90 -1.50 -0.12 0.00 -1.05 0.00 0.00 32.46 30.70 3flm n ARG 364 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 3flm h ASP 365 N 0.06 0.00 -1.35 2.89 3.32 -1.85 -3.48 116.42 116.01 3flm h ASP 365 Ca 0.00 -0.82 -0.65 0.00 0.02 0.00 0.00 57.03 55.58 3flm h ASP 365 Cb 0.49 0.00 0.13 0.00 0.22 0.00 0.00 39.33 40.17 3flm h ASP 365 CO 0.00 1.08 -0.62 0.00 -1.72 0.00 0.00 179.24 177.97 3flm n ALA 366 N -2.82 -2.72 -2.92 3.45 0.00 -1.26 -4.89 120.51 109.36 3flm n ALA 366 Ca -0.14 0.32 -0.44 0.00 0.00 0.00 0.00 53.44 53.18 3flm n ALA 366 Cb 0.49 -1.60 -0.01 0.00 0.00 0.00 0.00 19.45 18.34 3flm n ALA 366 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3flm s PHE 367 N -1.24 3.29 0.01 0.00 5.36 -1.26 -4.73 117.98 119.41 3flm s PHE 367 Ca 0.62 -1.76 0.00 0.00 -0.96 0.00 0.00 56.93 54.83 3flm s PHE 367 Cb -0.81 -4.32 -0.00 0.00 -0.34 0.00 0.00 43.02 37.54 3flm s PHE 367 CO 0.58 -1.46 0.01 0.41 -1.46 0.00 0.00 175.22 173.30 3flm n GLY 368 N 4.83 4.02 0.20 13.12 0.00 -1.26 -5.01 105.19 121.09 3flm n GLY 368 Ca 0.31 -1.72 -0.01 0.00 0.00 0.00 0.00 46.02 44.61 3flm n GLY 368 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3flm h GLU 369 N 0.00 0.22 -0.05 1.61 4.11 -1.94 0.05 114.58 118.58 3flm h GLU 369 Ca -0.01 -0.09 -0.20 0.00 0.07 0.00 0.00 59.36 59.13 3flm h GLU 369 Cb 0.03 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 3flm h GLU 369 CO 0.01 0.55 -0.82 0.00 0.07 0.00 0.00 179.01 178.82 3flm h ALA 370 N 1.45 0.48 0.12 1.06 0.00 -1.92 -0.75 119.26 119.69 3flm h ALA 370 Ca 0.02 -0.65 -0.01 0.00 0.00 0.00 0.00 54.91 54.27 3flm h ALA 370 Cb 0.72 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3flm h ALA 370 CO 0.05 0.79 -0.06 1.96 0.00 0.00 0.00 179.25 181.99 3flm h GLN 371 N 0.27 -0.16 -0.94 0.00 7.50 -1.69 -1.94 115.11 118.15 3flm h GLN 371 Ca -0.05 0.01 0.16 0.00 0.50 0.00 0.00 58.65 59.27 3flm h GLN 371 Cb 1.43 0.04 -0.10 0.00 0.05 0.00 0.00 27.48 28.90 3flm h GLN 371 CO 0.14 0.12 0.55 1.25 -1.50 0.00 0.00 178.83 179.39 3flm h LEU 372 N -0.43 0.71 -0.64 1.46 5.85 -0.98 0.30 115.31 121.59 3flm h LEU 372 Ca -0.02 0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.85 3flm h LEU 372 Cb 0.35 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.28 3flm h LEU 372 CO 0.03 0.30 0.34 0.00 -0.34 0.00 0.00 178.44 178.77 3flm h ALA 373 N 1.59 0.85 -0.32 1.25 0.00 -0.95 -1.45 119.26 120.23 3flm h ALA 373 Ca 0.52 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.41 3flm h ALA 373 Cb 0.71 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3flm h ALA 373 CO -0.35 -0.01 0.03 1.25 0.00 0.00 0.00 179.25 180.17 3flm h HIS 374 N 0.62 0.59 -0.50 0.00 -0.00 0.25 -2.79 115.15 113.33 3flm h HIS 374 Ca 0.29 -0.09 0.00 0.00 -0.00 0.00 0.00 60.37 60.57 3flm h HIS 374 Cb 0.21 -0.16 0.00 0.00 -0.00 0.00 0.00 27.41 27.46 3flm h HIS 374 CO -0.09 0.65 0.00 0.54 -0.00 0.00 0.00 177.93 179.03 3flm n ARG 375 N -4.58 3.13 0.32 5.26 1.74 0.44 -4.46 116.66 118.52 3flm n ARG 375 Ca -0.02 -2.20 0.12 0.00 -0.77 0.00 0.00 57.85 54.98 3flm n ARG 375 Cb 0.24 -1.76 0.65 0.00 -1.02 0.00 0.00 32.46 30.57 3flm n ARG 375 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 3flm h ILE 376 N 3.14 0.00 0.00 0.55 6.09 -0.97 -1.45 117.51 124.87 3flm h ILE 376 Ca 0.00 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.48 3flm h ILE 376 Cb 1.19 0.53 -0.00 0.00 0.47 0.00 0.00 36.82 39.01 3flm h ILE 376 CO 0.19 0.00 -0.05 0.00 -3.07 0.00 0.00 178.15 175.22 3flm h ASP 378 N 0.00 -0.49 0.37 0.00 3.32 -1.63 -2.90 116.42 115.10 3flm h ASP 378 Ca -0.00 0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.14 3flm h ASP 378 Cb 0.99 0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.78 3flm h ASP 378 CO 0.01 -0.20 0.00 -1.22 -1.72 0.00 0.00 179.24 176.10 3flm n TYR 379 N -5.30 0.00 -1.76 4.55 4.01 -1.13 -4.90 117.16 112.62 3flm n TYR 379 Ca -0.03 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.29 3flm n TYR 379 Cb 0.22 -0.31 -0.03 0.00 -0.31 0.00 0.00 39.34 38.91 3flm n TYR 379 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3flm s LEU 380 N -2.63 4.39 0.38 7.72 1.43 -1.10 -4.92 118.68 123.96 3flm s LEU 380 Ca 0.16 2.71 -0.25 0.00 -1.03 0.00 0.00 54.13 55.72 3flm s LEU 380 Cb 0.12 -3.57 -0.09 0.00 0.03 0.00 0.00 46.19 42.68 3flm s LEU 380 CO 0.28 -0.98 1.06 -2.16 0.23 0.00 0.00 176.35 174.78 3flm s PRO 381 N 2.56 4.23 0.08 1.29 0.04 -1.26 -4.90 135.00 137.03 3flm s PRO 381 Ca 0.79 1.55 -0.30 0.00 0.04 0.00 0.00 61.00 63.08 3flm s PRO 381 Cb -0.45 -2.63 -0.06 0.00 0.04 0.00 0.00 34.50 31.40 3flm s PRO 381 CO 0.35 -0.10 1.18 -2.00 0.04 0.00 0.00 177.00 176.48 3flm s GLU 382 N -2.36 4.45 -1.69 4.56 2.12 -1.26 -1.55 118.70 122.98 3flm s GLU 382 Ca 0.56 1.76 -0.01 0.00 0.36 0.00 0.00 54.97 57.64 3flm s GLU 382 Cb -0.23 -3.34 0.00 0.00 0.26 0.00 0.00 34.13 30.82 3flm s GLU 382 CO 0.29 -0.21 0.10 1.04 -0.54 0.00 0.00 175.26 175.94 3flm n GLN 383 N 3.71 -2.12 0.00 4.30 1.13 -1.26 -4.91 117.38 118.22 3flm n GLN 383 Ca 0.08 0.96 0.00 0.00 -1.94 0.00 0.00 57.00 56.10 3flm n GLN 383 Cb 0.46 -5.61 0.00 0.00 0.11 0.00 0.00 30.24 25.20 3flm n GLN 383 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3flm n GLY 384 N -1.10 2.92 3.54 1.08 0.00 -0.60 -4.56 105.19 106.48 3flm n GLY 384 Ca -0.22 -1.92 -0.16 0.00 0.00 0.00 0.00 46.02 43.72 3flm n GLY 384 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3flm s GLN 385 N 3.22 0.95 -0.15 1.61 -2.07 -1.10 -4.56 119.66 117.57 3flm s GLN 385 Ca 0.00 0.51 -0.03 0.00 -1.82 0.00 0.00 55.36 54.02 3flm s GLN 385 Cb 0.00 0.45 -0.03 0.00 -1.09 0.00 0.00 33.01 32.35 3flm s GLN 385 CO 0.00 -0.24 -0.04 -1.17 -1.32 0.00 0.00 175.29 172.53 3flm s LEU 386 N -0.60 3.28 -0.26 2.60 2.96 0.86 -1.37 118.68 126.15 3flm s LEU 386 Ca -0.07 -0.10 -0.00 0.00 -0.22 0.00 0.00 54.13 53.74 3flm s LEU 386 Cb -0.02 -1.78 0.04 0.00 0.50 0.00 0.00 46.19 44.93 3flm s LEU 386 CO 0.06 0.20 -0.07 0.12 -1.32 0.00 0.00 176.35 175.34 3flm s PHE 387 N 0.20 3.14 0.00 5.38 5.36 0.41 -0.85 117.98 131.62 3flm s PHE 387 Ca -0.02 -1.84 0.03 0.00 -0.96 0.00 0.00 56.93 54.14 3flm s PHE 387 Cb -0.14 -2.02 -0.03 0.00 -0.34 0.00 0.00 43.02 40.48 3flm s PHE 387 CO 0.03 -0.79 -0.04 0.54 -1.46 0.00 0.00 175.22 173.49 3flm s VAL 388 N 1.25 3.85 0.00 3.12 0.11 0.63 -1.42 120.40 127.94 3flm s VAL 388 Ca -0.03 -0.71 0.00 0.00 -2.93 0.00 0.00 61.98 58.31 3flm s VAL 388 Cb -0.18 -2.69 0.00 0.00 -1.53 0.00 0.00 36.38 31.98 3flm s VAL 388 CO -0.05 0.38 0.00 0.61 -3.33 0.00 0.00 175.10 172.72 3flm n GLY 389 N 1.48 1.24 2.85 6.54 0.00 -0.83 -4.37 105.19 112.10 3flm n GLY 389 Ca -0.15 -1.77 -0.30 0.00 0.00 0.00 0.00 46.02 43.81 3flm n GLY 389 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3flm s ASN 390 N -1.00 4.08 -0.09 1.61 0.01 -1.26 -4.86 114.94 113.43 3flm s ASN 390 Ca 0.00 -2.99 -0.30 0.00 -0.71 0.00 0.00 52.86 48.86 3flm s ASN 390 Cb 0.00 -1.41 0.11 0.00 0.41 0.00 0.00 41.25 40.36 3flm s ASN 390 CO 0.00 -0.22 0.93 -0.55 -1.51 0.00 0.00 177.10 175.75 3flm s SER 391 N -0.22 -0.39 0.21 -1.22 0.15 -1.26 -4.97 113.70 105.99 3flm s SER 391 Ca 0.19 0.27 -0.09 0.00 0.70 0.00 0.00 55.95 57.01 3flm s SER 391 Cb -0.22 0.35 0.23 0.00 -1.71 0.00 0.00 66.02 64.68 3flm s SER 391 CO -0.03 -0.47 1.81 0.25 1.20 0.00 0.00 173.24 176.00 3flm h LEU 392 N 2.38 0.54 -1.72 3.45 5.85 -2.00 0.23 115.31 124.04 3flm h LEU 392 Ca -0.20 0.03 0.33 0.00 0.84 0.00 0.00 57.88 58.88 3flm h LEU 392 Cb 1.19 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 42.07 3flm h LEU 392 CO 0.32 0.35 0.81 1.62 -0.34 0.00 0.00 178.44 181.20 3flm h VAL 393 N 0.68 0.41 0.00 1.05 3.04 -1.95 0.69 116.25 120.17 3flm h VAL 393 Ca 0.29 -0.05 -0.10 0.00 -1.01 0.00 0.00 66.70 65.83 3flm h VAL 393 Cb 0.18 0.25 -0.02 0.00 -2.01 0.00 0.00 31.29 29.69 3flm h VAL 393 CO -0.18 0.03 -0.63 -0.37 -1.01 0.00 0.00 177.57 175.40 3flm h VAL 394 N 0.15 0.67 -0.42 1.51 -1.51 -0.89 -0.77 116.25 114.99 3flm h VAL 394 Ca 0.61 -1.99 -0.02 0.00 -1.23 0.00 0.00 66.70 64.06 3flm h VAL 394 Cb 2.07 2.27 -0.02 0.00 -2.13 0.00 0.00 31.29 33.48 3flm h VAL 394 CO -0.15 0.38 0.16 0.03 -1.23 0.00 0.00 177.57 176.77 3flm h ARG 395 N 0.00 0.59 -0.32 5.19 3.08 0.72 -2.56 114.38 121.07 3flm h ARG 395 Ca -0.03 -0.08 -0.17 0.00 0.07 0.00 0.00 59.98 59.78 3flm h ARG 395 Cb 1.36 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 31.30 3flm h ARG 395 CO 0.05 0.49 -0.45 -0.07 -1.07 0.00 0.00 179.97 178.92 3flm h LEU 396 N 0.59 0.92 -0.57 3.04 3.38 -0.66 -0.23 115.31 121.78 3flm h LEU 396 Ca 0.14 -0.45 0.02 0.00 0.09 0.00 0.00 57.88 57.69 3flm h LEU 396 Cb 0.12 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 3flm h LEU 396 CO -0.01 1.23 0.35 0.40 0.09 0.00 0.00 178.44 180.49 3flm h ILE 397 N 0.68 1.07 -0.16 1.22 2.04 -0.91 0.45 117.51 121.89 3flm h ILE 397 Ca 0.04 -0.24 -0.17 0.00 1.00 0.00 0.00 64.86 65.50 3flm h ILE 397 Cb 1.04 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 3flm h ILE 397 CO 0.10 0.13 -0.59 -0.78 0.00 0.00 0.00 178.15 177.01 3flm h ASP 398 N 0.69 0.60 0.12 1.72 3.58 -1.28 -1.37 116.42 120.47 3flm h ASP 398 Ca 0.23 -0.34 -0.17 0.00 0.42 0.00 0.00 57.03 57.17 3flm h ASP 398 Cb 0.01 -0.17 0.01 0.00 1.72 0.00 0.00 39.33 40.91 3flm h ASP 398 CO -0.09 1.06 -0.79 0.00 -2.88 0.00 0.00 179.24 176.53 3flm h ALA 399 N 0.95 -0.04 -0.02 -0.78 0.00 -0.55 -3.41 119.26 115.41 3flm h ALA 399 Ca -0.00 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.18 3flm h ALA 399 Cb 1.14 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3flm h ALA 399 CO 0.11 0.39 -0.15 1.28 0.00 0.00 0.00 179.25 180.88 3flm n LEU 400 N -4.17 2.09 -4.71 0.00 4.77 0.15 -4.06 117.00 111.07 3flm n LEU 400 Ca -0.15 -0.90 -0.30 0.00 -0.03 0.00 0.00 56.01 54.64 3flm n LEU 400 Cb 0.78 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.79 3flm n LEU 400 CO 0.45 0.38 -0.24 -0.55 -1.33 0.00 0.00 177.39 176.10 3flm s SER 401 N -1.66 4.10 -0.20 -1.43 0.15 -0.52 -4.52 113.70 109.62 3flm s SER 401 Ca 0.17 -1.45 -0.04 0.00 0.70 0.00 0.00 55.95 55.33 3flm s SER 401 Cb 0.14 0.04 0.07 0.00 -1.71 0.00 0.00 66.02 64.56 3flm s SER 401 CO 0.30 -0.68 0.09 -1.58 1.20 0.00 0.00 173.24 172.58 3flm s GLN 402 N -3.84 0.18 -0.03 5.44 0.74 -1.26 -4.53 119.66 116.36 3flm s GLN 402 Ca 0.23 -0.23 -0.18 0.00 0.05 0.00 0.00 55.36 55.23 3flm s GLN 402 Cb 0.05 -1.75 -0.05 0.00 1.10 0.00 0.00 33.01 32.35 3flm s GLN 402 CO 0.12 -0.74 0.49 -0.51 -0.55 0.00 0.00 175.29 174.11 3flm s LEU 403 N 2.08 4.41 0.29 3.68 1.43 -1.26 -4.94 118.68 124.37 3flm s LEU 403 Ca 0.03 1.01 -0.29 0.00 -1.03 0.00 0.00 54.13 53.84 3flm s LEU 403 Cb -0.16 -2.74 -0.10 0.00 0.03 0.00 0.00 46.19 43.22 3flm s LEU 403 CO -0.14 0.17 1.39 -2.16 0.23 0.00 0.00 176.35 175.84 3flm s PRO 404 N -0.37 4.29 0.05 1.29 0.04 -1.26 -3.67 135.00 135.36 3flm s PRO 404 Ca 0.27 2.28 -0.38 0.00 0.04 0.00 0.00 61.00 63.21 3flm s PRO 404 Cb -0.17 -3.09 -0.19 0.00 0.04 0.00 0.00 34.50 31.09 3flm s PRO 404 CO 0.14 -0.33 1.02 0.00 0.04 0.00 0.00 177.00 177.87 3flm n ALA 405 N 1.58 -3.14 -0.79 8.56 0.00 -1.26 -1.53 120.51 123.93 3flm n ALA 405 Ca 0.04 0.56 0.00 0.00 0.00 0.00 0.00 53.44 54.04 3flm n ALA 405 Cb 0.41 -1.78 0.00 0.00 0.00 0.00 0.00 19.45 18.08 3flm n ALA 405 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3flm n GLY 406 N 1.70 0.32 3.65 0.00 0.00 0.09 -4.87 105.19 106.09 3flm n GLY 406 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 3flm n GLY 406 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3flm s TYR 407 N -1.91 3.35 -0.23 1.61 6.14 -0.58 -4.84 117.35 120.88 3flm s TYR 407 Ca 0.00 1.12 -0.35 0.00 0.64 0.00 0.00 57.07 58.49 3flm s TYR 407 Cb 0.00 -3.00 -0.11 0.00 0.42 0.00 0.00 41.96 39.27 3flm s TYR 407 CO 0.00 -0.33 2.03 -2.30 0.64 0.00 0.00 175.55 175.60 3flm n PRO 408 N 5.66 1.59 -4.13 4.97 -0.02 -1.26 -4.78 135.00 137.03 3flm n PRO 408 Ca 0.04 0.52 -0.23 0.00 -2.02 0.00 0.00 63.50 61.81 3flm n PRO 408 Cb 0.48 -2.59 -0.05 0.00 -0.02 0.00 0.00 33.50 31.33 3flm n PRO 408 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3flm s VAL 409 N 5.87 4.32 0.04 -1.45 1.01 -1.26 -0.10 120.40 128.82 3flm s VAL 409 Ca 1.01 -1.40 -0.15 0.00 0.00 0.00 0.00 61.98 61.44 3flm s VAL 409 Cb -0.76 -3.30 0.02 0.00 0.00 0.00 0.00 36.38 32.35 3flm s VAL 409 CO 0.50 -0.30 0.33 -0.31 0.00 0.00 0.00 175.10 175.33 3flm s TYR 410 N -2.06 -0.15 -0.07 5.22 2.02 -0.03 -4.92 117.35 117.36 3flm s TYR 410 Ca 0.32 0.04 -0.30 0.00 -0.37 0.00 0.00 57.07 56.76 3flm s TYR 410 Cb -0.08 0.13 0.09 0.00 -0.40 0.00 0.00 41.96 41.69 3flm s TYR 410 CO 0.24 -0.52 0.78 -1.54 -1.57 0.00 0.00 175.55 172.94 3flm s SER 411 N -2.03 -0.56 -0.97 2.29 1.04 -1.26 -0.27 113.70 111.94 3flm s SER 411 Ca -0.05 0.56 -0.01 0.00 0.48 0.00 0.00 55.95 56.93 3flm s SER 411 Cb -0.01 0.47 0.30 0.00 0.10 0.00 0.00 66.02 66.88 3flm s SER 411 CO -0.03 -0.55 1.40 0.59 0.98 0.00 0.00 173.24 175.64 3flm n ASN 412 N 0.75 6.08 -1.82 7.02 3.02 -1.26 -4.88 115.26 124.16 3flm n ASN 412 Ca -0.16 -3.49 -0.18 0.00 -0.03 0.00 0.00 54.58 50.73 3flm n ASN 412 Cb 0.58 -1.12 0.17 0.00 -0.61 0.00 0.00 39.78 38.80 3flm n ASN 412 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3flm n ARG 413 N 0.90 2.19 0.00 3.52 5.12 -1.26 -3.45 116.66 123.68 3flm n ARG 413 Ca 0.31 -3.17 0.00 0.00 -1.93 0.00 0.00 57.85 53.06 3flm n ARG 413 Cb 0.33 -2.06 0.00 0.00 -1.16 0.00 0.00 32.46 29.58 3flm n ARG 413 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3flm n GLY 414 N -1.10 -0.88 0.90 -0.13 0.00 -1.26 -4.40 105.19 98.32 3flm n GLY 414 Ca 0.49 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.61 3flm n GLY 414 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3flm n ALA 415 N -1.64 2.43 -3.73 4.61 0.00 -1.26 -4.99 120.51 115.92 3flm n ALA 415 Ca 0.00 -0.82 -0.26 0.00 0.00 0.00 0.00 53.44 52.36 3flm n ALA 415 Cb 0.00 -0.71 0.06 0.00 0.00 0.00 0.00 19.45 18.80 3flm n ALA 415 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3flm n SER 416 N 1.19 -5.45 -4.82 0.00 7.64 -1.22 -4.96 113.62 106.00 3flm n SER 416 Ca 0.14 -0.65 -0.29 0.00 1.01 0.00 0.00 58.87 59.08 3flm n SER 416 Cb 0.52 -4.54 0.10 0.00 -1.01 0.00 0.00 64.21 59.29 3flm n SER 416 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3flm s GLY 417 N -3.38 1.60 -0.36 0.23 0.00 -1.26 -4.91 107.32 99.24 3flm s GLY 417 Ca 0.58 -0.37 0.06 0.00 0.00 0.00 0.00 44.72 44.99 3flm s GLY 417 CO 0.77 0.10 1.59 0.29 0.00 0.00 0.00 173.10 175.85 3flm n ILE 418 N -3.49 2.80 0.93 0.90 -5.35 -1.26 -4.73 119.36 109.15 3flm n ILE 418 Ca 0.07 -2.75 0.10 0.00 -0.27 0.00 0.00 62.75 59.89 3flm n ILE 418 Cb 0.58 -0.51 -0.07 0.00 -1.74 0.00 0.00 39.64 37.90 3flm n ILE 418 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 3flm n ASP 419 N -1.08 1.30 -0.78 7.28 5.75 -1.26 -4.60 116.55 123.16 3flm n ASP 419 Ca 0.43 -1.15 0.00 0.00 -0.01 0.00 0.00 54.79 54.06 3flm n ASP 419 Cb 1.13 0.81 -0.00 0.00 -1.03 0.00 0.00 41.12 42.02 3flm n ASP 419 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3flm n GLY 420 N 1.42 0.70 0.31 6.12 0.00 -1.26 -4.53 105.19 107.95 3flm n GLY 420 Ca 0.05 -0.21 0.01 0.00 0.00 0.00 0.00 46.02 45.88 3flm n GLY 420 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3flm h LEU 421 N 0.24 0.76 -0.56 0.99 3.38 -1.89 0.40 115.31 118.62 3flm h LEU 421 Ca -0.10 0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.75 3flm h LEU 421 Cb 1.46 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 42.07 3flm h LEU 421 CO 0.00 0.48 -0.44 -0.07 0.09 0.00 0.00 178.44 178.50 3flm h LEU 422 N 0.89 0.71 0.00 1.67 3.38 -1.88 -1.88 115.31 118.20 3flm h LEU 422 Ca 0.37 -0.33 -0.17 0.00 0.09 0.00 0.00 57.88 57.83 3flm h LEU 422 Cb 0.21 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3flm h LEU 422 CO -0.19 1.05 -0.82 0.77 0.09 0.00 0.00 178.44 179.34 3flm h SER 423 N 0.54 0.00 -0.59 -0.43 4.64 -1.82 -0.21 113.55 115.67 3flm h SER 423 Ca 0.04 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.34 3flm h SER 423 Cb 0.97 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.03 3flm h SER 423 CO 0.09 0.80 0.30 0.74 -0.87 0.00 0.00 176.83 177.88 3flm h THR 424 N 0.00 1.20 -0.47 2.95 2.02 -0.14 -2.90 112.91 115.58 3flm h THR 424 Ca -0.01 -0.57 -0.04 0.00 0.77 0.00 0.00 66.41 66.56 3flm h THR 424 Cb 1.62 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 68.41 3flm h THR 424 CO 0.10 0.24 0.14 0.00 0.37 0.00 0.00 175.52 176.37 3flm h ALA 425 N 1.45 0.62 -0.06 6.16 0.00 -0.35 0.12 119.26 127.19 3flm h ALA 425 Ca 0.22 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.95 3flm h ALA 425 Cb 0.09 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3flm h ALA 425 CO -0.03 0.27 0.04 0.00 0.00 0.00 0.00 179.25 179.54 3flm h ALA 426 N 1.00 2.00 0.04 0.00 0.00 -0.95 -0.02 119.26 121.32 3flm h ALA 426 Ca 0.15 -0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.85 3flm h ALA 426 Cb 0.28 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.07 3flm h ALA 426 CO -0.00 -0.01 -0.82 0.78 0.00 0.00 0.00 179.25 179.20 3flm h GLY 427 N 0.05 0.54 1.02 0.00 0.00 -0.82 -0.73 103.07 103.14 3flm h GLY 427 Ca 0.03 -1.03 -0.04 0.00 0.00 0.00 0.00 47.33 46.29 3flm h GLY 427 CO -0.00 0.91 0.31 -2.08 0.00 0.00 0.00 176.54 175.67 3flm h VAL 428 N 0.01 1.24 -0.18 4.60 2.07 0.31 -1.30 116.25 123.00 3flm h VAL 428 Ca -0.11 -0.74 -0.04 0.00 0.82 0.00 0.00 66.70 66.63 3flm h VAL 428 Cb 1.54 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 3flm h VAL 428 CO 0.16 0.30 -0.04 -0.61 0.02 0.00 0.00 177.57 177.40 3flm h GLN 429 N 1.01 0.35 -0.12 1.57 -0.00 -0.83 -3.14 115.11 113.95 3flm h GLN 429 Ca 0.24 -0.13 -0.06 0.00 -0.00 0.00 0.00 58.65 58.70 3flm h GLN 429 Cb 0.18 -0.02 -0.01 0.00 0.00 0.00 0.00 27.48 27.62 3flm h GLN 429 CO -0.02 0.60 -0.21 0.00 0.00 0.00 0.00 178.83 179.20 3flm h ARG 430 N 0.07 0.20 -0.07 1.69 3.08 -0.94 -1.75 114.38 116.67 3flm h ARG 430 Ca 0.05 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 3flm h ARG 430 Cb 0.47 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.49 3flm h ARG 430 CO 0.02 0.41 -0.02 0.00 -1.07 0.00 0.00 179.97 179.30 3flm h ALA 431 N 1.60 0.10 -0.00 0.04 0.00 -1.19 -3.29 119.26 116.52 3flm h ALA 431 Ca 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3flm h ALA 431 Cb 0.48 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3flm h ALA 431 CO 0.03 -0.17 -0.72 -1.13 0.00 0.00 0.00 179.25 177.26 3flm n SER 432 N -4.80 0.74 0.00 0.00 3.41 -1.19 -4.89 113.62 106.89 3flm n SER 432 Ca -0.07 -0.60 0.00 0.00 -0.26 0.00 0.00 58.87 57.94 3flm n SER 432 Cb 0.24 0.58 0.00 0.00 -0.26 0.00 0.00 64.21 64.77 3flm n SER 432 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3flm n GLY 433 N 1.50 0.52 3.86 5.00 0.00 -0.66 -5.01 105.19 110.39 3flm n GLY 433 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 3flm n GLY 433 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3flm s LYS 434 N -0.43 3.93 0.43 1.61 1.02 -1.25 -4.64 119.74 120.41 3flm s LYS 434 Ca 0.00 0.63 -0.25 0.00 0.02 0.00 0.00 55.97 56.37 3flm s LYS 434 Cb 0.00 -2.39 -0.10 0.00 -0.52 0.00 0.00 37.83 34.82 3flm s LYS 434 CO 0.00 0.06 1.18 -0.35 -0.92 0.00 0.00 175.35 175.32 3flm n PRO 435 N -0.77 1.70 -3.78 -1.68 -0.04 -1.26 -4.73 135.00 124.43 3flm n PRO 435 Ca 0.03 0.61 -0.13 0.00 -0.04 0.00 0.00 63.50 63.97 3flm n PRO 435 Cb 0.53 -2.28 -0.14 0.00 -0.04 0.00 0.00 33.50 31.58 3flm n PRO 435 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 3flm s THR 436 N -1.23 -0.03 -0.10 0.52 2.01 -0.82 -2.70 115.64 113.29 3flm s THR 436 Ca 0.63 0.09 -0.02 0.00 0.31 0.00 0.00 61.69 62.70 3flm s THR 436 Cb -0.52 -0.23 -0.03 0.00 0.01 0.00 0.00 72.50 71.73 3flm s THR 436 CO 0.57 0.04 0.00 -0.22 -0.69 0.00 0.00 174.62 174.32 3flm s LEU 437 N 0.66 3.57 -0.04 4.42 2.96 -0.47 -1.32 118.68 128.45 3flm s LEU 437 Ca -0.05 0.12 0.01 0.00 -0.22 0.00 0.00 54.13 53.99 3flm s LEU 437 Cb -0.06 -1.82 0.02 0.00 0.50 0.00 0.00 46.19 44.82 3flm s LEU 437 CO -0.03 0.35 -0.03 0.00 -1.32 0.00 0.00 176.35 175.31 3flm s ALA 438 N -0.71 0.59 0.12 5.97 0.00 -0.34 0.16 121.76 127.55 3flm s ALA 438 Ca 0.11 -0.01 0.09 0.00 0.00 0.00 0.00 51.96 52.16 3flm s ALA 438 Cb -0.12 -0.40 -0.04 0.00 0.00 0.00 0.00 23.12 22.56 3flm s ALA 438 CO 0.02 -0.04 -0.18 0.42 0.00 0.00 0.00 175.76 175.99 3flm s ILE 439 N 0.96 2.83 0.20 0.00 1.01 -0.51 -0.53 121.20 125.16 3flm s ILE 439 Ca -0.11 -1.54 -0.17 0.00 0.00 0.00 0.00 60.65 58.84 3flm s ILE 439 Cb -0.14 -2.30 0.03 0.00 0.01 0.00 0.00 42.46 40.05 3flm s ILE 439 CO -0.00 0.08 0.52 0.54 0.00 0.00 0.00 174.94 176.07 3flm s VAL 440 N -1.19 0.03 0.39 2.92 0.11 -0.69 -1.97 120.40 120.00 3flm s VAL 440 Ca 0.18 -0.80 -0.06 0.00 -2.93 0.00 0.00 61.98 58.37 3flm s VAL 440 Cb -0.10 -1.59 -0.05 0.00 -1.53 0.00 0.00 36.38 33.10 3flm s VAL 440 CO 0.10 -0.12 0.70 -0.83 -3.33 0.00 0.00 175.10 171.62 3flm s GLY 441 N -2.88 1.73 0.31 6.54 0.00 -1.26 0.40 107.32 112.16 3flm s GLY 441 Ca 0.10 -0.46 0.06 0.00 0.00 0.00 0.00 44.72 44.42 3flm s GLY 441 CO -0.03 -0.31 1.60 1.29 0.00 0.00 0.00 173.10 175.66 3flm h ASP 442 N 1.00 -0.12 -0.09 1.64 2.03 -1.84 0.32 116.42 119.35 3flm h ASP 442 Ca -0.47 0.24 -0.01 0.00 -0.73 0.00 0.00 57.03 56.06 3flm h ASP 442 Cb 1.20 0.35 -0.00 0.00 -0.83 0.00 0.00 39.33 40.05 3flm h ASP 442 CO 0.63 -0.29 0.03 0.25 -1.03 0.00 0.00 179.24 178.84 3flm h LEU 443 N 0.09 0.13 -0.45 0.15 6.46 -1.93 0.12 115.31 119.89 3flm h LEU 443 Ca 0.63 -0.18 0.06 0.00 -0.12 0.00 0.00 57.88 58.27 3flm h LEU 443 Cb 1.39 -0.03 -0.05 0.00 -0.73 0.00 0.00 40.66 41.24 3flm h LEU 443 CO -0.79 0.28 0.16 0.28 -0.62 0.00 0.00 178.44 177.76 3flm h SER 444 N -0.02 0.18 -0.33 1.25 0.02 -1.49 0.02 113.55 113.17 3flm h SER 444 Ca 0.03 0.05 -0.09 0.00 -0.84 0.00 0.00 61.79 60.94 3flm h SER 444 Cb 0.19 0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 3flm h SER 444 CO -0.00 0.13 -0.12 0.00 -1.14 0.00 0.00 176.83 175.70 3flm h ALA 445 N 1.29 0.99 -0.35 3.77 0.00 0.62 -1.65 119.26 123.93 3flm h ALA 445 Ca 0.21 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 3flm h ALA 445 Cb 0.20 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3flm h ALA 445 CO -0.21 0.60 0.03 -0.07 0.00 0.00 0.00 179.25 179.60 3flm h LEU 446 N 0.69 0.58 -0.53 0.00 3.38 -0.71 -1.99 115.31 116.73 3flm h LEU 446 Ca 0.12 -0.29 0.10 0.00 0.09 0.00 0.00 57.88 57.90 3flm h LEU 446 Cb 0.60 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 41.11 3flm h LEU 446 CO 0.04 0.72 0.09 0.22 0.09 0.00 0.00 178.44 179.60 3flm h TYR 447 N 0.42 0.14 -0.64 1.13 5.03 -0.18 -1.72 116.97 121.15 3flm h TYR 447 Ca 0.10 0.03 -0.41 0.00 2.58 0.00 0.00 58.73 61.04 3flm h TYR 447 Cb 0.41 0.02 -0.25 0.00 1.55 0.00 0.00 36.73 38.46 3flm h TYR 447 CO 0.03 -0.03 -0.03 -3.47 -1.32 0.00 0.00 178.16 173.33 3flm n ASP 448 N -5.14 4.31 -0.25 -2.11 2.03 -0.70 -4.78 116.55 109.92 3flm n ASP 448 Ca 0.07 -3.77 0.05 0.00 0.52 0.00 0.00 54.79 51.65 3flm n ASP 448 Cb 0.27 -0.64 0.18 0.00 -0.72 0.00 0.00 41.12 40.21 3flm n ASP 448 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 3flm h LEU 449 N 1.53 0.22 0.00 -2.67 5.85 -0.51 0.35 115.31 120.08 3flm h LEU 449 Ca 0.37 0.11 0.00 0.00 0.84 0.00 0.00 57.88 59.21 3flm h LEU 449 Cb 1.53 0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.67 3flm h LEU 449 CO 0.79 0.07 0.00 -0.46 -0.34 0.00 0.00 178.44 178.51 3flm n ASN 450 N -5.04 0.00 0.00 1.25 0.23 -1.26 -1.59 115.26 108.85 3flm n ASN 450 Ca 0.14 0.01 0.14 0.00 -0.53 0.00 0.00 54.58 54.33 3flm n ASN 450 Cb 0.41 -0.23 0.71 0.00 -2.08 0.00 0.00 39.78 38.59 3flm n ASN 450 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3flm n ALA 451 N -1.23 2.39 -0.30 -2.53 0.00 0.11 -1.67 120.51 117.28 3flm n ALA 451 Ca 0.07 -0.13 0.19 0.00 0.00 0.00 0.00 53.44 53.56 3flm n ALA 451 Cb 0.09 -1.45 0.46 0.00 0.00 0.00 0.00 19.45 18.54 3flm n ALA 451 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3flm h LEU 452 N 0.00 0.53 -0.89 0.00 3.38 -1.48 0.71 115.31 117.56 3flm h LEU 452 Ca 0.00 0.07 0.12 0.00 0.09 0.00 0.00 57.88 58.16 3flm h LEU 452 Cb 0.25 -0.02 -0.08 0.00 0.09 0.00 0.00 40.66 40.90 3flm h LEU 452 CO 0.00 0.17 0.52 0.00 0.09 0.00 0.00 178.44 179.21 3flm h ALA 453 N 1.62 1.32 -0.32 1.53 0.00 -1.55 0.15 119.26 122.01 3flm h ALA 453 Ca 0.55 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.45 3flm h ALA 453 Cb 1.22 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 3flm h ALA 453 CO -0.28 0.08 -0.02 -0.07 0.00 0.00 0.00 179.25 178.96 3flm h LEU 454 N 0.81 0.58 -2.41 0.00 3.38 0.15 -2.85 115.31 114.96 3flm h LEU 454 Ca 0.45 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3flm h LEU 454 Cb 0.50 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3flm h LEU 454 CO -0.29 0.77 0.00 -0.07 0.09 0.00 0.00 178.44 178.94 3flm h LEU 455 N 0.38 0.00 -1.98 1.67 3.38 0.76 0.70 115.31 120.22 3flm h LEU 455 Ca 0.09 0.00 0.40 0.00 0.09 0.00 0.00 57.88 58.46 3flm h LEU 455 Cb 0.48 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.17 3flm h LEU 455 CO 0.02 0.00 0.99 0.03 0.09 0.00 0.00 178.44 179.57 3flm h ARG 456 N 0.00 0.01 -4.38 1.13 3.08 -0.74 -3.35 114.38 110.13 3flm h ARG 456 Ca 0.00 -0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.38 3flm h ARG 456 Cb 0.15 -0.00 -0.38 0.00 0.08 0.00 0.00 29.97 29.82 3flm h ARG 456 CO 0.00 0.01 -0.62 -0.65 -1.07 0.00 0.00 179.97 177.63 3flm s GLN 457 N -4.94 1.80 0.02 0.04 -1.52 0.24 -4.69 119.66 110.61 3flm s GLN 457 Ca -0.05 -2.00 0.01 0.00 -1.95 0.00 0.00 55.36 51.37 3flm s GLN 457 Cb 0.24 -3.39 -0.02 0.00 -0.22 0.00 0.00 33.01 29.62 3flm s GLN 457 CO 0.83 -1.02 -0.05 0.14 -0.25 0.00 0.00 175.29 174.93 3flm s VAL 458 N 0.76 0.32 -2.36 1.09 -7.23 -1.26 -4.95 120.40 106.76 3flm s VAL 458 Ca 0.11 -0.82 0.28 0.00 -1.81 0.00 0.00 61.98 59.74 3flm s VAL 458 Cb -0.21 -0.40 0.62 0.00 0.56 0.00 0.00 36.38 36.95 3flm s VAL 458 CO -0.05 -0.33 1.84 -1.54 -0.31 0.00 0.00 175.10 174.70 3flm n SER 459 N 1.83 1.15 -3.70 4.85 3.41 -1.26 -4.63 113.62 115.27 3flm n SER 459 Ca -0.21 -1.40 -0.05 0.00 -0.26 0.00 0.00 58.87 56.94 3flm n SER 459 Cb 0.56 -0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.48 3flm n SER 459 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3flm s ALA 460 N -1.99 -1.63 0.41 7.33 0.00 -1.26 -4.85 121.76 119.78 3flm s ALA 460 Ca 0.40 0.27 -0.26 0.00 0.00 0.00 0.00 51.96 52.37 3flm s ALA 460 Cb 0.21 0.64 -0.09 0.00 0.00 0.00 0.00 23.12 23.88 3flm s ALA 460 CO 0.34 -0.96 1.33 -1.25 0.00 0.00 0.00 175.76 175.22 3flm s PRO 461 N -3.36 3.91 -0.11 0.00 0.04 -1.22 -4.02 135.00 130.25 3flm s PRO 461 Ca 0.10 2.21 0.01 0.00 0.04 0.00 0.00 61.00 63.36 3flm s PRO 461 Cb -0.02 -2.74 0.02 0.00 0.04 0.00 0.00 34.50 31.80 3flm s PRO 461 CO -0.00 -0.56 -0.12 -1.17 0.04 0.00 0.00 177.00 175.19 3flm s LEU 462 N -2.49 1.52 -0.27 -3.56 0.20 -0.61 -1.95 118.68 111.52 3flm s LEU 462 Ca 0.58 -0.38 -0.13 0.00 0.69 0.00 0.00 54.13 54.88 3flm s LEU 462 Cb -0.39 -0.99 -0.04 0.00 -0.43 0.00 0.00 46.19 44.33 3flm s LEU 462 CO 0.50 -0.05 0.29 -0.69 -0.29 0.00 0.00 176.35 176.12 3flm s VAL 463 N 1.33 5.24 -0.42 1.68 1.01 -0.44 -1.21 120.40 127.58 3flm s VAL 463 Ca -0.01 0.41 -0.11 0.00 0.00 0.00 0.00 61.98 62.27 3flm s VAL 463 Cb -0.14 -3.63 0.06 0.00 0.00 0.00 0.00 36.38 32.68 3flm s VAL 463 CO -0.06 0.21 0.28 -0.22 0.00 0.00 0.00 175.10 175.31 3flm s LEU 464 N 1.86 5.16 0.06 3.92 2.96 -0.69 -1.20 118.68 130.76 3flm s LEU 464 Ca 0.12 -1.31 -0.27 0.00 -0.22 0.00 0.00 54.13 52.44 3flm s LEU 464 Cb -0.16 -2.05 -0.05 0.00 0.50 0.00 0.00 46.19 44.43 3flm s LEU 464 CO 0.10 -0.53 0.85 -0.63 -1.32 0.00 0.00 176.35 174.83 3flm s ILE 465 N 1.52 4.66 -0.27 6.68 1.01 0.32 -0.72 121.20 134.41 3flm s ILE 465 Ca 0.03 1.82 0.02 0.00 0.00 0.00 0.00 60.65 62.52 3flm s ILE 465 Cb -0.22 -4.21 0.07 0.00 0.01 0.00 0.00 42.46 38.11 3flm s ILE 465 CO 0.05 0.33 -0.05 -0.69 0.00 0.00 0.00 174.94 174.58 3flm s VAL 466 N 0.06 1.85 -0.81 2.92 1.01 -0.57 -1.71 120.40 123.15 3flm s VAL 466 Ca 0.43 -1.58 -0.25 0.00 0.00 0.00 0.00 61.98 60.58 3flm s VAL 466 Cb -0.22 -2.12 0.05 0.00 0.00 0.00 0.00 36.38 34.09 3flm s VAL 466 CO 0.26 -0.20 1.28 -0.69 0.00 0.00 0.00 175.10 175.75 3flm s VAL 467 N 1.22 3.90 -0.21 2.92 1.01 0.16 -1.52 120.40 127.88 3flm s VAL 467 Ca -0.03 -0.09 -0.13 0.00 0.00 0.00 0.00 61.98 61.72 3flm s VAL 467 Cb -0.19 -4.92 -0.04 0.00 0.00 0.00 0.00 36.38 31.22 3flm s VAL 467 CO -0.07 -1.81 0.29 0.21 0.00 0.00 0.00 175.10 173.71 3flm s ASN 468 N 4.06 6.32 -0.32 3.32 2.47 -0.84 -2.82 114.94 127.12 3flm s ASN 468 Ca 0.36 0.36 0.08 0.00 0.42 0.00 0.00 52.86 54.09 3flm s ASN 468 Cb -0.07 -2.17 0.46 0.00 -1.45 0.00 0.00 41.25 38.01 3flm s ASN 468 CO 0.07 0.01 1.16 -0.46 -3.72 0.00 0.00 177.10 174.15 3flm n ASN 469 N 4.21 4.44 -1.70 -4.21 0.23 -1.26 -1.80 115.26 115.17 3flm n ASN 469 Ca -0.12 -3.54 0.00 0.00 -0.53 0.00 0.00 54.58 50.39 3flm n ASN 469 Cb 0.52 -0.39 0.00 0.00 -2.08 0.00 0.00 39.78 37.83 3flm n ASN 469 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 3flm n ASN 470 N -0.62 -9.16 -0.68 0.53 0.23 -1.26 -4.45 115.26 99.85 3flm n ASN 470 Ca 0.38 1.34 0.07 0.00 -0.53 0.00 0.00 54.58 55.84 3flm n ASN 470 Cb 0.88 -5.22 0.22 0.00 -2.08 0.00 0.00 39.78 33.57 3flm n ASN 470 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 3flm n ASN 494 N -0.89 3.20 -4.91 0.53 3.02 -1.26 -5.06 115.26 109.90 3flm n ASN 494 Ca 0.00 -3.16 -0.31 0.00 -0.03 0.00 0.00 54.58 51.08 3flm n ASN 494 Cb 0.00 -0.52 -0.04 0.00 -0.61 0.00 0.00 39.78 38.61 3flm n ASN 494 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3flm s VAL 495 N -2.91 5.19 0.09 2.41 0.11 -1.26 -5.11 120.40 118.92 3flm s VAL 495 Ca 0.39 -0.09 0.01 0.00 -2.93 0.00 0.00 61.98 59.36 3flm s VAL 495 Cb 0.33 -3.65 -0.04 0.00 -1.53 0.00 0.00 36.38 31.49 3flm s VAL 495 CO 0.06 -0.00 -0.04 -1.00 -3.33 0.00 0.00 175.10 170.78 3flm s HIS 496 N -1.70 0.79 -2.36 1.54 3.76 -1.26 -5.06 115.29 111.02 3flm s HIS 496 Ca 0.40 -0.99 0.22 0.00 -0.15 0.00 0.00 55.06 54.53 3flm s HIS 496 Cb -0.12 -0.49 0.66 0.00 1.11 0.00 0.00 32.58 33.75 3flm s HIS 496 CO 0.26 -0.25 1.51 1.19 -0.85 0.00 0.00 174.74 176.60 3flm n PHE 497 N -0.01 0.26 0.02 1.40 3.01 -1.26 -4.28 117.46 116.60 3flm n PHE 497 Ca -0.12 -0.13 -0.10 0.00 1.01 0.00 0.00 57.45 58.11 3flm n PHE 497 Cb 0.61 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 40.04 3flm n PHE 497 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 3flm h GLU 498 N 2.81 -0.21 0.00 -1.08 4.81 -1.97 -1.35 114.58 117.59 3flm h GLU 498 Ca 0.00 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 3flm h GLU 498 Cb 0.62 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.04 3flm h GLU 498 CO 0.00 -0.14 0.00 0.72 -0.73 0.00 0.00 179.01 178.86 3flm n HIS 499 N -5.29 0.55 -0.08 0.92 8.25 -1.26 -0.76 115.22 117.54 3flm n HIS 499 Ca -0.04 0.21 -0.15 0.00 -0.26 0.00 0.00 57.72 57.49 3flm n HIS 499 Cb 0.21 -0.84 -0.11 0.00 1.12 0.00 0.00 29.99 30.37 3flm n HIS 499 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3flm h ALA 500 N 2.35 0.09 -0.81 -1.41 0.00 -1.67 -0.33 119.26 117.48 3flm h ALA 500 Ca 0.00 -0.68 0.20 0.00 0.00 0.00 0.00 54.91 54.42 3flm h ALA 500 Cb 0.34 0.27 -0.13 0.00 0.00 0.00 0.00 17.79 18.26 3flm h ALA 500 CO 0.00 0.26 0.13 0.00 0.00 0.00 0.00 179.25 179.63 3flm h ALA 501 N -0.31 1.02 -0.14 0.00 0.00 -1.12 -2.43 119.26 116.29 3flm h ALA 501 Ca -0.11 0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 3flm h ALA 501 Cb 0.98 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 3flm h ALA 501 CO -0.07 -0.43 0.01 0.00 0.00 0.00 0.00 179.25 178.76 3flm h ALA 502 N 1.73 0.19 -0.97 0.00 0.00 -0.81 -0.75 119.26 118.65 3flm h ALA 502 Ca 0.48 -0.19 0.23 0.00 0.00 0.00 0.00 54.91 55.43 3flm h ALA 502 Cb 0.89 -0.05 -0.18 0.00 0.00 0.00 0.00 17.79 18.45 3flm h ALA 502 CO -0.65 -0.12 -0.11 1.98 0.00 0.00 0.00 179.25 180.36 3flm h MET 503 N -0.00 0.01 -0.57 0.00 4.05 -0.59 -2.69 114.93 115.13 3flm h MET 503 Ca 0.04 -0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.46 3flm h MET 503 Cb 0.35 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.15 3flm h MET 503 CO 0.01 0.01 0.00 1.19 0.23 0.00 0.00 176.91 178.34 3flm n PHE 504 N -5.55 0.75 -3.21 1.39 3.72 -0.99 -4.93 117.46 108.63 3flm n PHE 504 Ca 0.19 -0.38 -0.14 0.00 -0.05 0.00 0.00 57.45 57.07 3flm n PHE 504 Cb 0.61 -0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.23 3flm n PHE 504 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3flm n GLU 505 N 1.58 -5.51 -4.66 -1.08 1.02 -0.40 -4.85 120.64 106.74 3flm n GLU 505 Ca 0.22 0.73 -0.34 0.00 -0.02 0.00 0.00 57.16 57.75 3flm n GLU 505 Cb 0.62 -5.37 -0.11 0.00 -0.02 0.00 0.00 31.44 26.56 3flm n GLU 505 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3flm s LEU 506 N -5.69 3.11 0.55 -4.62 1.43 -0.52 -5.00 118.68 107.92 3flm s LEU 506 Ca 0.02 -0.05 -0.22 0.00 -1.03 0.00 0.00 54.13 52.85 3flm s LEU 506 Cb -0.00 -1.67 -0.05 0.00 0.03 0.00 0.00 46.19 44.50 3flm s LEU 506 CO 0.62 0.36 1.37 0.29 0.23 0.00 0.00 176.35 179.23 3flm n LYS 507 N 2.22 1.72 -3.95 1.70 5.02 -1.25 -4.43 118.16 119.19 3flm n LYS 507 Ca -0.18 0.63 -0.14 0.00 -2.02 0.00 0.00 58.31 56.60 3flm n LYS 507 Cb 0.53 -2.59 -0.15 0.00 -0.02 0.00 0.00 35.03 32.80 3flm n LYS 507 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 3flm s TYR 508 N -1.28 0.20 0.08 2.13 5.04 -1.26 -0.15 117.35 122.11 3flm s TYR 508 Ca 0.72 -0.01 0.03 0.00 -2.44 0.00 0.00 57.07 55.37 3flm s TYR 508 Cb -0.41 -0.20 -0.03 0.00 0.35 0.00 0.00 41.96 41.66 3flm s TYR 508 CO 0.49 -0.04 -0.10 -1.01 -1.34 0.00 0.00 175.55 173.55 3flm s HIS 509 N 0.31 0.99 -0.52 4.97 3.76 -0.58 -4.98 115.29 119.23 3flm s HIS 509 Ca -0.03 -0.62 0.06 0.00 -0.15 0.00 0.00 55.06 54.32 3flm s HIS 509 Cb -0.05 -0.55 0.20 0.00 1.11 0.00 0.00 32.58 33.29 3flm s HIS 509 CO -0.01 -0.02 0.50 -2.13 -0.85 0.00 0.00 174.74 172.23 3flm n ARG 510 N 0.80 1.18 -1.68 1.40 0.63 -1.26 -0.80 116.66 116.92 3flm n ARG 510 Ca -0.18 -3.80 -0.39 0.00 -0.92 0.00 0.00 57.85 52.56 3flm n ARG 510 Cb 0.57 -1.83 0.03 0.00 0.45 0.00 0.00 32.46 31.69 3flm n ARG 510 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 3flm n PRO 511 N 1.88 1.50 -0.02 -0.14 -0.04 -1.26 -4.95 135.00 131.99 3flm n PRO 511 Ca 0.25 0.55 0.10 0.00 -0.04 0.00 0.00 63.50 64.36 3flm n PRO 511 Cb 0.45 -2.35 0.10 0.00 -0.04 0.00 0.00 33.50 31.65 3flm n PRO 511 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3flm n GLN 512 N -0.59 1.84 -3.87 0.54 6.02 -1.26 -4.69 117.38 115.37 3flm n GLN 512 Ca 0.10 -1.74 -0.02 0.00 -0.01 0.00 0.00 57.00 55.33 3flm n GLN 512 Cb 0.43 -1.39 0.01 0.00 1.02 0.00 0.00 30.24 30.31 3flm n GLN 512 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3flm s ASN 513 N -1.63 -0.02 0.58 1.08 2.20 -1.26 -5.02 114.94 110.88 3flm s ASN 513 Ca 0.25 -0.51 0.28 0.00 -0.94 0.00 0.00 52.86 51.93 3flm s ASN 513 Cb 0.17 0.40 1.54 0.00 -2.00 0.00 0.00 41.25 41.36 3flm s ASN 513 CO 0.25 -0.79 2.01 -0.50 -2.94 0.00 0.00 177.10 175.13 3flm h TRP 514 N 2.00 0.00 0.08 1.54 4.06 -1.96 0.22 115.95 121.89 3flm h TRP 514 Ca -0.26 0.00 -0.14 0.00 2.06 0.00 0.00 58.89 60.55 3flm h TRP 514 Cb 1.21 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 29.39 3flm h TRP 514 CO 1.19 0.00 -0.58 1.96 -3.56 0.00 0.00 178.44 177.45 3flm h GLN 515 N 0.00 0.26 -0.86 0.49 4.20 -1.99 -2.63 115.11 114.57 3flm h GLN 515 Ca 0.16 -0.38 0.08 0.00 0.06 0.00 0.00 58.65 58.57 3flm h GLN 515 Cb 0.82 0.13 -0.06 0.00 0.30 0.00 0.00 27.48 28.67 3flm h GLN 515 CO -0.00 1.14 0.56 0.93 -0.67 0.00 0.00 178.83 180.79 3flm h GLU 516 N -0.44 0.89 -0.31 1.46 5.08 -1.58 -2.60 114.58 117.08 3flm h GLU 516 Ca -0.09 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.16 3flm h GLU 516 Cb 1.40 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 3flm h GLU 516 CO 0.11 0.59 0.00 1.25 -1.00 0.00 0.00 179.01 179.96 3flm h LEU 517 N 0.92 0.54 -1.55 1.33 5.85 -1.08 -2.32 115.31 119.00 3flm h LEU 517 Ca 0.38 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 3flm h LEU 517 Cb 0.30 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 3flm h LEU 517 CO -0.15 0.71 0.15 -0.33 -0.34 0.00 0.00 178.44 178.48 3flm h GLU 518 N 0.35 0.45 0.58 1.25 5.08 -1.37 -2.41 114.58 118.50 3flm h GLU 518 Ca 0.09 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 3flm h GLU 518 Cb 0.43 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.60 3flm h GLU 518 CO 0.02 0.36 -0.28 1.15 -1.00 0.00 0.00 179.01 179.26 3flm h THR 519 N 0.45 0.02 -0.62 1.13 2.02 -1.42 -2.70 112.91 111.79 3flm h THR 519 Ca 0.12 -0.44 0.08 0.00 0.77 0.00 0.00 66.41 66.94 3flm h THR 519 Cb 0.06 0.03 -0.09 0.00 -1.74 0.00 0.00 68.15 66.41 3flm h THR 519 CO -0.02 0.00 -0.29 0.00 0.37 0.00 0.00 175.52 175.59 3flm n ALA 520 N -2.72 -0.20 0.22 6.16 0.00 -0.88 -0.20 120.51 122.90 3flm n ALA 520 Ca -0.10 0.58 0.07 0.00 0.00 0.00 0.00 53.44 53.99 3flm n ALA 520 Cb 0.31 -0.20 0.53 0.00 0.00 0.00 0.00 19.45 20.08 3flm n ALA 520 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 3flm h PHE 521 N 0.00 0.00 0.35 0.00 0.04 -1.46 -3.19 116.94 112.68 3flm h PHE 521 Ca 0.17 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.92 3flm h PHE 521 Cb 0.32 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.48 3flm h PHE 521 CO -0.58 0.23 -0.17 0.00 -0.60 0.00 0.00 178.31 177.20 3flm h ALA 522 N 1.77 -0.47 -0.53 2.45 0.00 -0.23 -2.58 119.26 119.66 3flm h ALA 522 Ca -0.00 -0.15 0.11 0.00 0.00 0.00 0.00 54.91 54.86 3flm h ALA 522 Cb 0.48 0.18 -0.10 0.00 0.00 0.00 0.00 17.79 18.35 3flm h ALA 522 CO 0.03 -0.67 -0.15 0.22 0.00 0.00 0.00 179.25 178.68 3flm h ASP 523 N -0.64 -0.54 1.10 0.00 3.58 -1.55 -3.32 116.42 115.03 3flm h ASP 523 Ca -0.05 0.17 0.00 0.00 0.42 0.00 0.00 57.03 57.57 3flm h ASP 523 Cb 0.46 0.35 0.00 0.00 1.72 0.00 0.00 39.33 41.86 3flm h ASP 523 CO 0.08 -0.19 0.00 0.00 -2.88 0.00 0.00 179.24 176.25 3flm h ALA 524 N 1.49 1.00 0.00 -0.78 0.00 -1.44 -2.21 119.26 117.32 3flm h ALA 524 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3flm h ALA 524 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3flm h ALA 524 CO -0.56 0.00 0.00 0.91 0.00 0.00 0.00 179.25 179.60 3flm n TRP 525 N -2.91 0.00 0.20 0.00 5.03 -1.23 -4.24 117.44 114.29 3flm n TRP 525 Ca 0.01 0.00 0.10 0.00 3.03 0.00 0.00 57.50 60.64 3flm n TRP 525 Cb 0.32 -0.32 0.13 0.00 -1.03 0.00 0.00 31.31 30.41 3flm n TRP 525 CO 0.00 0.00 0.00 0.07 -0.03 0.00 0.00 177.69 177.73 3flm h ARG 526 N 0.00 0.00 -3.89 -0.99 0.11 -1.65 -3.45 114.38 104.51 3flm h ARG 526 Ca 0.00 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 59.96 3flm h ARG 526 Cb 0.31 0.00 -0.17 0.00 1.11 0.00 0.00 29.97 31.23 3flm h ARG 526 CO 0.00 0.11 -0.54 0.95 0.10 0.00 0.00 179.97 180.58 3flm s THR 527 N -3.16 0.15 -0.74 0.08 -4.23 -1.26 -4.99 115.64 101.48 3flm s THR 527 Ca 0.06 -1.23 -0.11 0.00 -1.18 0.00 0.00 61.69 59.23 3flm s THR 527 Cb 0.06 -1.03 -0.09 0.00 1.34 0.00 0.00 72.50 72.77 3flm s THR 527 CO 0.69 -0.68 1.92 -2.65 -0.54 0.00 0.00 174.62 173.36 3flm n PRO 528 N 0.58 1.61 -3.99 3.99 -0.02 -1.26 -3.42 135.00 132.50 3flm n PRO 528 Ca -0.18 -1.46 -0.10 0.00 -2.02 0.00 0.00 63.50 59.75 3flm n PRO 528 Cb 0.59 -2.55 -0.06 0.00 -0.02 0.00 0.00 33.50 31.46 3flm n PRO 528 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3flm s THR 529 N 4.19 0.03 -0.21 3.45 -4.23 -1.26 -4.39 115.64 113.22 3flm s THR 529 Ca 0.42 -1.42 -0.10 0.00 -1.18 0.00 0.00 61.69 59.41 3flm s THR 529 Cb 0.11 -2.03 -0.05 0.00 1.34 0.00 0.00 72.50 71.86 3flm s THR 529 CO 0.03 -0.14 0.14 -0.89 -0.54 0.00 0.00 174.62 173.22 3flm s THR 530 N -4.00 5.38 -0.24 3.99 2.01 -1.26 -1.58 115.64 119.94 3flm s THR 530 Ca 0.21 0.18 -0.06 0.00 0.31 0.00 0.00 61.69 62.33 3flm s THR 530 Cb 0.02 -3.48 -0.02 0.00 0.01 0.00 0.00 72.50 69.03 3flm s THR 530 CO 0.05 0.41 0.04 -0.89 -0.69 0.00 0.00 174.62 173.53 3flm s THR 531 N 0.62 4.02 0.04 -0.82 2.01 -0.35 -3.83 115.64 117.33 3flm s THR 531 Ca 0.08 -0.29 -0.23 0.00 0.31 0.00 0.00 61.69 61.56 3flm s THR 531 Cb -0.12 -2.88 -0.06 0.00 0.01 0.00 0.00 72.50 69.45 3flm s THR 531 CO 0.00 0.35 0.68 -0.69 -0.69 0.00 0.00 174.62 174.27 3flm s VAL 532 N 1.57 4.77 -0.32 3.82 1.01 0.78 -1.70 120.40 130.33 3flm s VAL 532 Ca 0.06 1.44 0.01 0.00 0.00 0.00 0.00 61.98 63.49 3flm s VAL 532 Cb -0.15 -4.02 0.10 0.00 0.00 0.00 0.00 36.38 32.31 3flm s VAL 532 CO 0.02 0.42 0.07 -0.63 0.00 0.00 0.00 175.10 174.97 3flm s ILE 533 N -0.32 1.54 -0.22 2.22 1.01 0.11 -1.53 121.20 124.01 3flm s ILE 533 Ca 0.34 -1.80 -0.19 0.00 0.00 0.00 0.00 60.65 59.00 3flm s ILE 533 Cb -0.20 -2.12 -0.03 0.00 0.01 0.00 0.00 42.46 40.12 3flm s ILE 533 CO 0.20 -0.60 0.55 -0.70 0.00 0.00 0.00 174.94 174.39 3flm s GLU 534 N 1.29 4.16 -0.41 2.79 2.12 0.02 -1.50 118.70 127.16 3flm s GLU 534 Ca 0.09 0.44 -0.13 0.00 0.36 0.00 0.00 54.97 55.73 3flm s GLU 534 Cb -0.18 -3.59 0.03 0.00 0.26 0.00 0.00 34.13 30.65 3flm s GLU 534 CO -0.16 -0.23 0.28 1.41 -0.54 0.00 0.00 175.26 176.02 3flm s MET 535 N 1.90 2.90 0.08 4.30 1.75 -0.57 -4.06 119.30 125.59 3flm s MET 535 Ca 0.24 -1.11 -0.30 0.00 -1.25 0.00 0.00 55.69 53.27 3flm s MET 535 Cb -0.16 -3.91 -0.06 0.00 2.84 0.00 0.00 34.83 33.55 3flm s MET 535 CO 0.09 -0.79 1.11 0.08 -0.65 0.00 0.00 175.02 174.87 3flm s VAL 536 N 1.62 4.22 0.22 10.11 1.01 -1.26 -1.99 120.40 134.32 3flm s VAL 536 Ca 0.04 1.67 -0.01 0.00 0.00 0.00 0.00 61.98 63.68 3flm s VAL 536 Cb -0.20 -4.07 -0.04 0.00 0.00 0.00 0.00 36.38 32.07 3flm s VAL 536 CO 0.08 0.18 0.17 0.68 0.00 0.00 0.00 175.10 176.20 3flm s VAL 537 N 0.66 0.00 0.76 2.92 -7.23 -0.75 -4.99 120.40 111.78 3flm s VAL 537 Ca 0.54 -1.96 -0.11 0.00 -1.81 0.00 0.00 61.98 58.64 3flm s VAL 537 Cb -0.27 -2.49 0.05 0.00 0.56 0.00 0.00 36.38 34.23 3flm s VAL 537 CO 0.30 0.00 1.09 0.20 -0.31 0.00 0.00 175.10 176.38 3flm s ASN 538 N -3.18 4.65 0.00 4.85 0.01 -1.26 -4.33 114.94 115.69 3flm s ASN 538 Ca 0.38 1.80 0.17 0.00 -0.71 0.00 0.00 52.86 54.50 3flm s ASN 538 Cb 0.06 -2.52 0.74 0.00 0.41 0.00 0.00 41.25 39.94 3flm s ASN 538 CO 0.14 -1.94 1.52 -0.90 -1.51 0.00 0.00 177.10 174.41 3flm n ASP 539 N -3.42 0.00 0.00 -1.22 5.68 -1.26 -4.29 116.55 112.04 3flm n ASP 539 Ca 0.09 0.38 0.00 0.00 -0.50 0.00 0.00 54.79 54.75 3flm n ASP 539 Cb 0.53 -0.44 0.00 0.00 -1.14 0.00 0.00 41.12 40.07 3flm n ASP 539 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3flm n THR 540 N -1.44 0.00 -0.00 2.12 -2.24 -1.26 -4.78 114.28 106.68 3flm n THR 540 Ca 0.05 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.72 3flm n THR 540 Cb 0.18 -0.20 -0.05 0.00 -2.10 0.00 0.00 70.33 68.16 3flm n THR 540 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3flm h ASP 541 N 0.00 0.11 -0.22 3.42 5.19 -1.99 -0.08 116.42 122.85 3flm h ASP 541 Ca 0.00 -0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.42 3flm h ASP 541 Cb 0.34 -0.03 -0.02 0.00 0.18 0.00 0.00 39.33 39.80 3flm h ASP 541 CO 0.00 0.08 0.12 1.23 -3.12 0.00 0.00 179.24 177.55 3flm h GLY 542 N 0.14 0.30 1.53 2.75 0.00 -1.89 0.51 103.07 106.40 3flm h GLY 542 Ca 0.04 -0.09 -0.12 0.00 0.00 0.00 0.00 47.33 47.16 3flm h GLY 542 CO -0.01 0.08 -0.37 0.00 0.00 0.00 0.00 176.54 176.24 3flm h ALA 543 N 1.11 0.92 -0.35 3.60 0.00 -1.72 -3.03 119.26 119.79 3flm h ALA 543 Ca 0.09 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 3flm h ALA 543 Cb 0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3flm h ALA 543 CO -0.05 0.62 0.17 1.96 0.00 0.00 0.00 179.25 181.95 3flm h GLN 544 N 0.44 0.50 -0.60 0.00 4.20 -0.35 0.73 115.11 120.04 3flm h GLN 544 Ca 0.05 -0.07 0.05 0.00 0.06 0.00 0.00 58.65 58.74 3flm h GLN 544 Cb 0.85 -0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.48 3flm h GLN 544 CO 0.07 0.45 0.32 1.15 -0.67 0.00 0.00 178.83 180.15 3flm h THR 545 N 0.42 0.95 0.18 -0.54 2.02 0.04 0.68 112.91 116.67 3flm h THR 545 Ca 0.12 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 67.09 3flm h THR 545 Cb 0.12 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 66.84 3flm h THR 545 CO -0.01 0.11 -0.09 0.25 0.37 0.00 0.00 175.52 176.15 3flm h LEU 546 N 0.59 -0.21 -0.62 2.58 5.85 -1.32 0.31 115.31 122.50 3flm h LEU 546 Ca 0.27 -0.09 0.12 0.00 0.84 0.00 0.00 57.88 59.02 3flm h LEU 546 Cb 0.17 0.05 -0.12 0.00 0.37 0.00 0.00 40.66 41.14 3flm h LEU 546 CO -0.18 -0.04 -0.19 -0.61 -0.34 0.00 0.00 178.44 177.08 3flm h GLN 547 N -0.37 -0.04 -0.26 1.25 4.15 -0.25 0.96 115.11 120.55 3flm h GLN 547 Ca -0.03 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.36 3flm h GLN 547 Cb 0.28 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.97 3flm h GLN 547 CO 0.04 -0.03 0.01 1.96 -1.93 0.00 0.00 178.83 178.89 3flm h GLN 548 N -0.04 0.45 -0.12 1.69 4.20 -0.67 -0.69 115.11 119.93 3flm h GLN 548 Ca 0.29 -0.14 -0.07 0.00 0.06 0.00 0.00 58.65 58.80 3flm h GLN 548 Cb 0.49 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 3flm h GLN 548 CO -0.65 0.61 -0.22 -0.07 -0.67 0.00 0.00 178.83 177.82 3flm h LEU 549 N 0.24 0.19 -0.13 1.46 3.38 -0.43 -1.87 115.31 118.15 3flm h LEU 549 Ca 0.07 -0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.02 3flm h LEU 549 Cb 0.40 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 3flm h LEU 549 CO 0.01 0.43 -0.01 0.25 0.09 0.00 0.00 178.44 179.21 3flm h LEU 550 N 0.18 -0.07 0.30 1.67 6.46 0.19 -2.85 115.31 121.20 3flm h LEU 550 Ca 0.03 0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 57.81 3flm h LEU 550 Cb 0.51 0.06 0.00 0.00 -0.73 0.00 0.00 40.66 40.49 3flm h LEU 550 CO 0.03 -0.01 -0.16 0.00 -0.62 0.00 0.00 178.44 177.68 3flm h ALA 551 N 1.11 -0.42 -0.16 1.25 0.00 -0.76 0.81 119.26 121.08 3flm h ALA 551 Ca 0.06 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.93 3flm h ALA 551 Cb 0.08 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3flm h ALA 551 CO -0.11 -0.74 0.12 0.37 0.00 0.00 0.00 179.25 178.89 3flm h GLN 552 N -0.43 0.00 0.19 0.00 4.15 -1.41 0.02 115.11 117.62 3flm h GLN 552 Ca -0.04 0.00 -0.34 0.00 0.77 0.00 0.00 58.65 59.05 3flm h GLN 552 Cb 0.34 0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.04 3flm h GLN 552 CO 0.06 0.00 -1.63 0.28 -1.93 0.00 0.00 178.83 175.60 3flm h VAL 553 N 0.00 1.08 0.00 2.39 2.07 -1.22 -2.98 116.25 117.59 3flm h VAL 553 Ca 0.08 -2.63 0.00 0.00 0.82 0.00 0.00 66.70 64.96 3flm h VAL 553 Cb 0.31 2.83 0.00 0.00 -1.52 0.00 0.00 31.29 32.91 3flm h VAL 553 CO -0.00 0.84 0.01 -1.54 0.02 0.00 0.00 177.57 176.90 3flm n SER 554 N -3.59 0.00 -0.00 0.57 3.41 0.24 -1.97 113.62 112.29 3flm n SER 554 Ca -0.21 0.36 0.07 0.00 -0.26 0.00 0.00 58.87 58.84 3flm n SER 554 Cb 1.08 -0.36 -0.10 0.00 -0.26 0.00 0.00 64.21 64.56 3flm n SER 554 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3flm n HIS 555 N -1.36 0.00 1.75 7.33 8.25 -0.38 -4.73 115.22 126.09 3flm n HIS 555 Ca 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.60 3flm n HIS 555 Cb 0.01 -0.16 0.83 0.00 1.12 0.00 0.00 29.99 31.79 3flm n HIS 555 CO 0.00 0.00 0.00 1.47 0.64 0.00 0.00 176.34 178.45