#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qfl s ILE 5 N 0.00 4.53 0.18 2.46 -1.09 -1.26 0.11 121.20 126.13 1qfl s ILE 5 Ca 0.00 -0.12 0.10 0.00 -2.23 0.00 0.00 60.65 58.39 1qfl s ILE 5 Cb 0.00 -3.04 -0.04 0.00 -1.58 0.00 0.00 42.46 37.79 1qfl s ILE 5 CO 0.00 0.44 -0.21 0.68 -1.23 0.00 0.00 174.94 174.63 1qfl s VAL 6 N 0.59 2.03 -0.71 2.92 -7.23 -0.38 -0.73 120.40 116.89 1qfl s VAL 6 Ca 0.02 -1.96 -0.17 0.00 -1.81 0.00 0.00 61.98 58.07 1qfl s VAL 6 Cb -0.13 -1.95 0.15 0.00 0.56 0.00 0.00 36.38 35.01 1qfl s VAL 6 CO 0.02 -0.23 0.75 -0.63 -0.31 0.00 0.00 175.10 174.70 1qfl s ILE 7 N -1.87 5.12 0.21 -0.62 1.01 -0.43 -1.98 121.20 122.64 1qfl s ILE 7 Ca 0.18 -1.63 -0.09 0.00 0.00 0.00 0.00 60.65 59.10 1qfl s ILE 7 Cb -0.07 -4.50 0.14 0.00 0.01 0.00 0.00 42.46 38.04 1qfl s ILE 7 CO 0.08 -1.11 1.82 0.00 0.00 0.00 0.00 174.94 175.73 1qfl h ALA 8 N 8.64 0.91 -2.97 9.38 0.00 -0.75 0.61 119.26 135.09 1qfl h ALA 8 Ca -0.10 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1qfl h ALA 8 Cb 1.07 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 1qfl h ALA 8 CO 0.98 0.11 0.15 -1.54 0.00 0.00 0.00 179.25 178.95 1qfl s SER 9 N -5.65 -0.01 0.19 0.00 1.04 -1.23 -3.94 113.70 104.10 1qfl s SER 9 Ca -0.13 -0.96 -0.23 0.00 0.48 0.00 0.00 55.95 55.11 1qfl s SER 9 Cb 0.16 0.75 0.06 0.00 0.10 0.00 0.00 66.02 67.09 1qfl s SER 9 CO 0.76 -1.45 0.67 0.00 0.98 0.00 0.00 173.24 174.20 1qfl s ALA 10 N -3.21 -1.50 -0.05 5.32 0.00 -1.26 0.21 121.76 121.27 1qfl s ALA 10 Ca 0.16 0.27 -0.29 0.00 0.00 0.00 0.00 51.96 52.10 1qfl s ALA 10 Cb -0.04 0.84 0.11 0.00 0.00 0.00 0.00 23.12 24.03 1qfl s ALA 10 CO 0.10 -0.86 0.92 0.00 0.00 0.00 0.00 175.76 175.93 1qfl s ALA 11 N -3.75 -1.86 0.06 0.00 0.00 -0.68 -4.75 121.76 110.79 1qfl s ALA 11 Ca 0.05 1.18 -0.09 0.00 0.00 0.00 0.00 51.96 53.09 1qfl s ALA 11 Cb -0.03 0.13 0.00 0.00 0.00 0.00 0.00 23.12 23.23 1qfl s ALA 11 CO -0.06 -0.59 0.20 -0.98 0.00 0.00 0.00 175.76 174.33 1qfl s ARG 12 N -2.59 0.77 0.62 0.00 1.70 -0.66 -0.62 118.95 118.17 1qfl s ARG 12 Ca 0.03 -0.79 -0.04 0.00 -0.47 0.00 0.00 55.73 54.47 1qfl s ARG 12 Cb -0.01 0.32 0.13 0.00 -0.57 0.00 0.00 34.95 34.82 1qfl s ARG 12 CO -0.06 -0.24 0.84 0.25 -1.08 0.00 0.00 175.30 175.02 1qfl n THR 13 N 0.31 0.00 -1.75 4.99 -2.24 0.73 -1.76 114.28 114.56 1qfl n THR 13 Ca -0.17 -1.07 -0.31 0.00 -2.27 0.00 0.00 64.05 60.23 1qfl n THR 13 Cb 0.61 -1.19 0.03 0.00 -2.10 0.00 0.00 70.33 67.67 1qfl n THR 13 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qfl s ALA 14 N -3.35 2.79 -0.20 6.98 0.00 -1.26 -4.73 121.76 121.98 1qfl s ALA 14 Ca 0.53 0.11 -0.15 0.00 0.00 0.00 0.00 51.96 52.45 1qfl s ALA 14 Cb -0.02 -3.16 -0.04 0.00 0.00 0.00 0.00 23.12 19.89 1qfl s ALA 14 CO 0.36 -1.00 0.36 0.08 0.00 0.00 0.00 175.76 175.56 1qfl s VAL 15 N -2.95 5.22 0.43 0.00 1.01 -1.26 -4.65 120.40 118.20 1qfl s VAL 15 Ca 0.58 0.63 0.01 0.00 0.00 0.00 0.00 61.98 63.21 1qfl s VAL 15 Cb -0.14 -3.69 -0.00 0.00 0.00 0.00 0.00 36.38 32.55 1qfl s VAL 15 CO 0.51 0.27 0.63 -0.83 0.00 0.00 0.00 175.10 175.68 1qfl s GLY 16 N 1.02 1.57 0.64 4.51 0.00 -0.61 -2.78 107.32 111.67 1qfl s GLY 16 Ca 0.17 -1.12 -0.05 0.00 0.00 0.00 0.00 44.72 43.72 1qfl s GLY 16 CO 0.07 -0.97 0.94 -0.56 0.00 0.00 0.00 173.10 172.58 1qfl s SER 17 N -4.21 5.14 -0.11 1.64 0.01 -1.26 -2.33 113.70 112.58 1qfl s SER 17 Ca 0.48 0.47 -0.29 0.00 1.31 0.00 0.00 55.95 57.92 1qfl s SER 17 Cb -0.10 -1.28 -0.06 0.00 0.21 0.00 0.00 66.02 64.80 1qfl s SER 17 CO 0.37 -1.35 1.91 0.12 0.41 0.00 0.00 173.24 174.70 1qfl s PHE 18 N -3.09 1.54 -1.07 2.43 5.36 -0.94 -1.49 117.98 120.72 1qfl s PHE 18 Ca 0.57 0.15 0.00 0.00 -0.96 0.00 0.00 56.93 56.70 1qfl s PHE 18 Cb -0.11 -4.06 0.00 0.00 -0.34 0.00 0.00 43.02 38.52 1qfl s PHE 18 CO 0.44 -4.28 0.00 0.09 -1.46 0.00 0.00 175.22 170.01 1qfl n ASN 19 N 8.92 -4.40 0.00 6.13 3.02 -1.26 -4.98 115.26 122.69 1qfl n ASN 19 Ca 0.22 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 55.02 1qfl n ASN 19 Cb 0.43 -2.79 0.00 0.00 -0.61 0.00 0.00 39.78 36.81 1qfl n ASN 19 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1qfl n GLY 20 N -1.50 0.67 0.35 7.41 0.00 -0.56 -4.54 105.19 107.02 1qfl n GLY 20 Ca -0.10 -0.01 0.17 0.00 0.00 0.00 0.00 46.02 46.08 1qfl n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qfl h ALA 21 N -1.38 2.36 -0.13 4.61 0.00 -1.94 -2.55 119.26 120.22 1qfl h ALA 21 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1qfl h ALA 21 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1qfl h ALA 21 CO 0.00 -0.50 0.00 1.19 0.00 0.00 0.00 179.25 179.94 1qfl n PHE 22 N -4.38 0.15 -0.13 0.00 3.72 -1.26 -4.78 117.46 110.78 1qfl n PHE 22 Ca 0.07 -0.14 0.07 0.00 -0.05 0.00 0.00 57.45 57.40 1qfl n PHE 22 Cb 0.48 -0.01 0.13 0.00 -0.94 0.00 0.00 39.48 39.15 1qfl n PHE 22 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1qfl n ALA 23 N 0.74 0.23 -1.34 4.37 0.00 -0.96 0.17 120.51 123.72 1qfl n ALA 23 Ca 0.09 0.39 0.03 0.00 0.00 0.00 0.00 53.44 53.95 1qfl n ALA 23 Cb 0.37 -0.31 0.20 0.00 0.00 0.00 0.00 19.45 19.71 1qfl n ALA 23 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1qfl n ASN 24 N -4.24 2.52 -4.53 0.00 3.02 -1.26 -4.11 115.26 106.66 1qfl n ASN 24 Ca 0.10 -3.56 -0.37 0.00 -0.03 0.00 0.00 54.58 50.72 1qfl n ASN 24 Cb 0.32 -0.56 -0.12 0.00 -0.61 0.00 0.00 39.78 38.82 1qfl n ASN 24 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1qfl s THR 25 N -3.11 4.87 0.30 3.41 2.01 0.46 -5.06 115.64 118.52 1qfl s THR 25 Ca 0.40 0.02 -0.29 0.00 0.31 0.00 0.00 61.69 62.13 1qfl s THR 25 Cb 0.36 -3.30 -0.10 0.00 0.01 0.00 0.00 72.50 69.48 1qfl s THR 25 CO 0.00 0.30 1.24 -2.84 -0.69 0.00 0.00 174.62 172.63 1qfl s PRO 26 N 1.64 4.45 0.34 4.92 0.02 -1.26 -4.79 135.00 140.32 1qfl s PRO 26 Ca 0.07 2.07 0.11 0.00 0.02 0.00 0.00 61.00 63.26 1qfl s PRO 26 Cb -0.15 -3.12 0.91 0.00 0.02 0.00 0.00 34.50 32.16 1qfl s PRO 26 CO 0.07 -0.06 1.75 0.00 -0.33 0.00 0.00 177.00 178.44 1qfl h ALA 27 N 3.68 1.89 0.00 -1.55 0.00 -1.91 -0.84 119.26 120.53 1qfl h ALA 27 Ca -0.48 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 1qfl h ALA 27 Cb 1.22 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 1qfl h ALA 27 CO 0.67 -0.32 -0.02 1.12 0.00 0.00 0.00 179.25 180.71 1qfl h HIS 28 N 0.57 0.00 0.03 0.00 2.07 -1.91 -1.11 115.15 114.80 1qfl h HIS 28 Ca 0.61 0.00 -0.25 0.00 -2.85 0.00 0.00 60.37 57.89 1qfl h HIS 28 Cb 1.22 0.00 0.01 0.00 2.57 0.00 0.00 27.41 31.21 1qfl h HIS 28 CO -0.00 0.02 -1.03 0.93 -3.07 0.00 0.00 177.93 174.77 1qfl h GLU 29 N 0.00 0.47 -0.13 5.12 5.08 -1.52 -1.52 114.58 122.08 1qfl h GLU 29 Ca -0.00 -0.55 -0.19 0.00 -1.00 0.00 0.00 59.36 57.62 1qfl h GLU 29 Cb 0.22 0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 1qfl h GLU 29 CO 0.00 1.19 -0.69 -0.07 -1.00 0.00 0.00 179.01 178.44 1qfl h LEU 30 N 0.25 0.67 -0.15 1.33 3.38 -1.36 -2.90 115.31 116.52 1qfl h LEU 30 Ca -0.11 -0.41 0.04 0.00 0.09 0.00 0.00 57.88 57.49 1qfl h LEU 30 Cb 1.69 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 42.20 1qfl h LEU 30 CO 0.18 1.17 -0.12 1.23 0.09 0.00 0.00 178.44 180.99 1qfl h GLY 31 N 1.00 -0.01 -0.03 0.83 0.00 -1.21 -2.10 103.07 101.54 1qfl h GLY 31 Ca -0.03 0.15 0.06 0.00 0.00 0.00 0.00 47.33 47.52 1qfl h GLY 31 CO 0.13 -0.13 -0.34 0.00 0.00 0.00 0.00 176.54 176.20 1qfl h ALA 32 N 0.96 -0.31 -0.31 3.60 0.00 -1.25 -0.65 119.26 121.30 1qfl h ALA 32 Ca 0.10 0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.13 1qfl h ALA 32 Cb 0.28 0.68 -0.08 0.00 0.00 0.00 0.00 17.79 18.67 1qfl h ALA 32 CO -0.24 -0.78 -0.35 1.15 0.00 0.00 0.00 179.25 179.04 1qfl h THR 33 N -0.33 0.22 -0.71 0.00 2.02 -1.20 -1.59 112.91 111.32 1qfl h THR 33 Ca 0.13 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.32 1qfl h THR 33 Cb 0.55 0.22 -0.04 0.00 -1.74 0.00 0.00 68.15 67.14 1qfl h THR 33 CO -0.45 0.00 0.46 0.58 0.37 0.00 0.00 175.52 176.48 1qfl h VAL 34 N -0.32 1.19 0.11 3.16 2.07 -0.80 -0.52 116.25 121.14 1qfl h VAL 34 Ca 0.14 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.31 1qfl h VAL 34 Cb 0.56 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 1qfl h VAL 34 CO -0.49 0.18 -0.11 0.40 0.02 0.00 0.00 177.57 177.57 1qfl h ILE 35 N 0.96 0.75 -0.51 4.57 2.04 -0.75 -1.03 117.51 123.53 1qfl h ILE 35 Ca 0.26 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.07 1qfl h ILE 35 Cb -0.10 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 36.70 1qfl h ILE 35 CO -0.05 0.00 0.13 0.28 0.00 0.00 0.00 178.15 178.51 1qfl h SER 36 N -0.25 0.71 0.48 1.72 0.02 -1.08 -2.37 113.55 112.78 1qfl h SER 36 Ca 0.00 -0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 60.82 1qfl h SER 36 Cb 0.24 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.59 1qfl h SER 36 CO -0.03 0.70 -0.26 0.00 -1.14 0.00 0.00 176.83 176.09 1qfl h ALA 37 N 1.40 -0.69 -0.70 3.77 0.00 -0.28 -0.66 119.26 122.10 1qfl h ALA 37 Ca 0.17 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 55.08 1qfl h ALA 37 Cb 0.26 0.31 -0.10 0.00 0.00 0.00 0.00 17.79 18.26 1qfl h ALA 37 CO -0.00 -0.90 0.16 -0.39 0.00 0.00 0.00 179.25 178.12 1qfl h VAL 38 N -0.69 0.55 0.56 0.00 -1.51 -1.04 0.39 116.25 114.51 1qfl h VAL 38 Ca -0.06 -0.09 -0.02 0.00 -1.23 0.00 0.00 66.70 65.30 1qfl h VAL 38 Cb 0.55 0.26 -0.01 0.00 -2.13 0.00 0.00 31.29 29.96 1qfl h VAL 38 CO 0.08 0.05 -0.39 -0.07 -1.23 0.00 0.00 177.57 176.01 1qfl h LEU 39 N 0.27 -1.00 -0.18 4.19 4.07 -1.14 -2.06 115.31 119.47 1qfl h LEU 39 Ca 0.39 0.07 0.04 0.00 0.08 0.00 0.00 57.88 58.45 1qfl h LEU 39 Cb 0.63 0.31 -0.07 0.00 1.08 0.00 0.00 40.66 42.61 1qfl h LEU 39 CO -0.48 -0.58 -0.47 -0.33 -1.08 0.00 0.00 178.44 175.50 1qfl h GLU 40 N -0.91 -0.48 -1.01 1.13 5.08 0.12 0.26 114.58 118.78 1qfl h GLU 40 Ca -0.06 0.03 0.23 0.00 -1.00 0.00 0.00 59.36 58.55 1qfl h GLU 40 Cb 0.76 0.11 -0.11 0.00 0.50 0.00 0.00 28.75 30.01 1qfl h GLU 40 CO 0.04 -0.32 0.62 0.00 -1.00 0.00 0.00 179.01 178.34 1qfl h ARG 41 N -0.50 0.58 0.00 2.33 3.08 -0.21 -1.48 114.38 118.17 1qfl h ARG 41 Ca 0.07 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1qfl h ARG 41 Cb 0.64 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1qfl h ARG 41 CO -0.44 0.38 -1.00 0.00 -1.07 0.00 0.00 179.97 177.84 1qfl n ALA 42 N -2.37 2.97 -1.10 0.04 0.00 -0.64 -4.96 120.51 114.45 1qfl n ALA 42 Ca 0.25 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1qfl n ALA 42 Cb 0.71 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 19.11 1qfl n ALA 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qfl n GLY 43 N 1.30 0.80 3.66 0.00 0.00 0.81 -4.89 105.19 106.87 1qfl n GLY 43 Ca 0.01 -0.64 -0.35 0.00 0.00 0.00 0.00 46.02 45.04 1qfl n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qfl s VAL 44 N -2.00 4.53 0.45 1.61 1.01 -0.53 -5.02 120.40 120.45 1qfl s VAL 44 Ca 0.00 -0.14 -0.21 0.00 0.00 0.00 0.00 61.98 61.63 1qfl s VAL 44 Cb 0.00 -2.97 -0.10 0.00 0.00 0.00 0.00 36.38 33.30 1qfl s VAL 44 CO 0.00 0.54 0.98 0.00 0.00 0.00 0.00 175.10 176.62 1qfl s ALA 45 N -0.26 2.99 0.26 5.51 0.00 -1.26 -4.35 121.76 124.64 1qfl s ALA 45 Ca 0.07 0.46 -0.02 0.00 0.00 0.00 0.00 51.96 52.47 1qfl s ALA 45 Cb -0.12 -3.18 0.52 0.00 0.00 0.00 0.00 23.12 20.34 1qfl s ALA 45 CO 0.02 -0.01 1.73 0.00 0.00 0.00 0.00 175.76 177.50 1qfl h ALA 46 N 1.79 1.19 0.00 0.00 0.00 -1.95 -0.78 119.26 119.50 1qfl h ALA 46 Ca -0.49 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1qfl h ALA 46 Cb 1.19 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1qfl h ALA 46 CO 0.60 -0.19 0.15 0.78 0.00 0.00 0.00 179.25 180.59 1qfl h GLY 47 N 0.49 0.00 -1.27 0.00 0.00 -1.92 -2.14 103.07 98.23 1qfl h GLY 47 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.78 1qfl h GLY 47 CO -0.41 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.31 1qfl n GLU 48 N -2.78 2.02 -2.69 4.80 1.02 -0.30 -4.90 120.64 117.81 1qfl n GLU 48 Ca -0.02 -1.50 -0.42 0.00 -0.02 0.00 0.00 57.16 55.20 1qfl n GLU 48 Cb 0.20 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 30.12 1qfl n GLU 48 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1qfl s VAL 49 N -1.91 4.77 -0.16 2.62 1.01 -0.81 -4.54 120.40 121.39 1qfl s VAL 49 Ca 0.34 2.02 -0.18 0.00 0.00 0.00 0.00 61.98 64.16 1qfl s VAL 49 Cb 0.20 -4.30 -0.23 0.00 0.00 0.00 0.00 36.38 32.06 1qfl s VAL 49 CO 0.31 0.18 0.38 0.78 0.00 0.00 0.00 175.10 176.75 1qfl h ASN 50 N 6.64 0.18 -5.05 3.32 4.21 -1.36 -3.41 115.58 120.11 1qfl h ASN 50 Ca -0.41 -0.72 -0.10 0.00 1.21 0.00 0.00 56.30 56.28 1qfl h ASN 50 Cb 1.22 -0.06 -0.17 0.00 -1.12 0.00 0.00 38.32 38.19 1qfl h ASN 50 CO 0.75 1.55 -0.24 -0.70 -1.29 0.00 0.00 177.43 177.50 1qfl s GLU 51 N -2.42 0.80 -0.15 0.81 2.12 -1.18 -1.44 118.70 117.24 1qfl s GLU 51 Ca -0.24 -0.47 0.01 0.00 0.36 0.00 0.00 54.97 54.63 1qfl s GLU 51 Cb 0.05 0.35 0.00 0.00 0.26 0.00 0.00 34.13 34.79 1qfl s GLU 51 CO 0.68 -0.25 -0.18 0.08 -0.54 0.00 0.00 175.26 175.04 1qfl s VAL 52 N -2.42 2.39 -0.28 3.70 1.01 -0.17 -1.43 120.40 123.21 1qfl s VAL 52 Ca -0.06 -0.86 0.03 0.00 0.00 0.00 0.00 61.98 61.09 1qfl s VAL 52 Cb -0.01 -1.99 0.07 0.00 0.00 0.00 0.00 36.38 34.45 1qfl s VAL 52 CO -0.02 0.53 -0.06 -0.63 0.00 0.00 0.00 175.10 174.92 1qfl s ILE 53 N 0.84 2.09 -0.17 2.22 1.01 -0.72 -0.67 121.20 125.80 1qfl s ILE 53 Ca -0.05 -1.76 0.00 0.00 0.00 0.00 0.00 60.65 58.84 1qfl s ILE 53 Cb -0.15 -2.31 0.04 0.00 0.01 0.00 0.00 42.46 40.04 1qfl s ILE 53 CO -0.01 -0.19 -0.11 -0.76 0.00 0.00 0.00 174.94 173.87 1qfl s LEU 54 N 1.10 1.96 0.31 2.97 1.43 -0.51 -1.25 118.68 124.68 1qfl s LEU 54 Ca -0.03 -0.71 -0.28 0.00 -1.03 0.00 0.00 54.13 52.08 1qfl s LEU 54 Cb -0.20 -1.16 -0.09 0.00 0.03 0.00 0.00 46.19 44.78 1qfl s LEU 54 CO -0.06 -0.12 1.09 -0.83 0.23 0.00 0.00 176.35 176.65 1qfl s GLY 55 N 1.47 2.98 -0.30 -3.19 0.00 -0.30 -1.99 107.32 105.98 1qfl s GLY 55 Ca 0.01 0.84 -0.10 0.00 0.00 0.00 0.00 44.72 45.47 1qfl s GLY 55 CO -0.09 1.40 0.87 1.62 0.00 0.00 0.00 173.10 176.90 1qfl s GLN 56 N -1.75 0.36 0.26 2.90 0.74 -0.91 -1.51 119.66 119.76 1qfl s GLN 56 Ca 0.48 0.76 0.20 0.00 0.05 0.00 0.00 55.36 56.85 1qfl s GLN 56 Cb -0.29 0.44 0.09 0.00 1.10 0.00 0.00 33.01 34.35 1qfl s GLN 56 CO 0.37 -0.28 1.26 0.28 -0.55 0.00 0.00 175.29 176.37 1qfl h VAL 57 N 5.64 0.30 -2.15 1.34 2.07 -1.84 -3.42 116.25 118.19 1qfl h VAL 57 Ca -0.17 -1.48 -0.56 0.00 0.82 0.00 0.00 66.70 65.31 1qfl h VAL 57 Cb 1.14 1.96 -0.41 0.00 -1.52 0.00 0.00 31.29 32.46 1qfl h VAL 57 CO 0.07 0.17 -0.83 0.18 0.02 0.00 0.00 177.57 177.18 1qfl n LEU 58 N -2.97 2.77 -0.15 2.57 4.77 -1.26 -4.88 117.00 117.85 1qfl n LEU 58 Ca -0.00 -5.31 0.14 0.00 -0.03 0.00 0.00 56.01 50.81 1qfl n LEU 58 Cb 0.64 -0.10 0.58 0.00 -2.33 0.00 0.00 43.42 42.22 1qfl n LEU 58 CO 0.39 2.22 0.85 -0.81 -1.33 0.00 0.00 177.39 178.71 1qfl n PRO 59 N 0.42 0.76 -1.57 3.23 -0.04 -1.26 -4.73 135.00 131.81 1qfl n PRO 59 Ca 0.28 -0.30 -0.55 0.00 -0.04 0.00 0.00 63.50 62.89 1qfl n PRO 59 Cb 0.48 -1.49 -0.07 0.00 -0.04 0.00 0.00 33.50 32.38 1qfl n PRO 59 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1qfl n ALA 60 N -0.86 -1.87 0.00 0.55 0.00 -1.26 -0.64 120.51 116.43 1qfl n ALA 60 Ca 0.15 0.54 0.00 0.00 0.00 0.00 0.00 53.44 54.13 1qfl n ALA 60 Cb 0.29 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 17.77 1qfl n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qfl n GLY 61 N 2.24 2.99 0.00 0.00 0.00 -1.26 -4.50 105.19 104.66 1qfl n GLY 61 Ca 0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.33 1qfl n GLY 61 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1qfl n GLU 62 N -2.00 0.10 0.00 1.61 2.13 0.19 -5.02 120.64 117.65 1qfl n GLU 62 Ca 0.00 0.08 0.00 0.00 0.66 0.00 0.00 57.16 57.90 1qfl n GLU 62 Cb 0.00 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.21 1qfl n GLU 62 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1qfl n GLY 63 N 0.91 0.83 3.58 8.31 0.00 -1.26 -4.88 105.19 112.69 1qfl n GLY 63 Ca 0.07 -1.88 -0.45 0.00 0.00 0.00 0.00 46.02 43.76 1qfl n GLY 63 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1qfl n GLN 64 N 1.13 1.28 -0.81 1.61 6.02 -1.26 -3.92 117.38 121.44 1qfl n GLN 64 Ca 0.00 0.45 0.00 0.00 -0.01 0.00 0.00 57.00 57.44 1qfl n GLN 64 Cb 0.00 -1.83 0.00 0.00 1.02 0.00 0.00 30.24 29.43 1qfl n GLN 64 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1qfl n ASN 65 N 1.39 0.00 0.29 1.08 5.15 -1.26 -4.62 115.26 117.29 1qfl n ASN 65 Ca 0.11 0.00 0.17 0.00 -0.60 0.00 0.00 54.58 54.26 1qfl n ASN 65 Cb 0.31 0.00 0.86 0.00 -0.53 0.00 0.00 39.78 40.41 1qfl n ASN 65 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1qfl h PRO 66 N 0.30 0.00 -0.43 1.20 0.11 -1.90 -0.40 132.00 130.88 1qfl h PRO 66 Ca 0.00 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.04 1qfl h PRO 66 Cb 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.09 1qfl h PRO 66 CO 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.79 1qfl h ALA 67 N 1.48 0.58 -0.43 -0.75 0.00 -1.89 -0.69 119.26 117.56 1qfl h ALA 67 Ca 0.04 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1qfl h ALA 67 Cb 0.63 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1qfl h ALA 67 CO -0.00 0.37 0.12 -0.09 0.00 0.00 0.00 179.25 179.65 1qfl h ARG 68 N 0.60 0.68 -0.70 0.00 9.65 -1.35 -2.02 114.38 121.25 1qfl h ARG 68 Ca 0.12 -0.15 0.03 0.00 -1.10 0.00 0.00 59.98 58.88 1qfl h ARG 68 Cb 0.48 -0.09 -0.04 0.00 -1.39 0.00 0.00 29.97 28.93 1qfl h ARG 68 CO 0.02 0.67 0.46 1.96 2.80 0.00 0.00 179.97 185.89 1qfl h GLN 69 N 0.56 0.83 -0.01 0.20 4.20 -1.25 -0.48 115.11 119.16 1qfl h GLN 69 Ca 0.14 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.80 1qfl h GLN 69 Cb 0.29 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 27.88 1qfl h GLN 69 CO -0.00 0.55 -0.00 0.00 -0.67 0.00 0.00 178.83 178.70 1qfl h ALA 70 N 1.59 0.01 0.22 3.87 0.00 -0.66 -1.77 119.26 122.52 1qfl h ALA 70 Ca 0.28 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1qfl h ALA 70 Cb 0.05 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 1qfl h ALA 70 CO -0.08 -0.31 -0.53 0.00 0.00 0.00 0.00 179.25 178.34 1qfl h ALA 71 N 0.64 -1.04 -0.51 0.00 0.00 -0.79 0.14 119.26 117.69 1qfl h ALA 71 Ca 0.00 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 54.84 1qfl h ALA 71 Cb 0.37 0.86 -0.05 0.00 0.00 0.00 0.00 17.79 18.97 1qfl h ALA 71 CO 0.00 -1.15 0.21 0.52 0.00 0.00 0.00 179.25 178.83 1qfl h MET 72 N -0.82 0.39 -0.64 0.00 2.07 -1.18 -1.58 114.93 113.17 1qfl h MET 72 Ca -0.02 -0.02 -0.01 0.00 -2.07 0.00 0.00 59.70 57.57 1qfl h MET 72 Cb 0.79 -0.09 -0.03 0.00 -1.87 0.00 0.00 31.60 30.40 1qfl h MET 72 CO -0.23 0.26 0.35 -0.22 1.07 0.00 0.00 176.91 178.14 1qfl h LYS 73 N 0.41 0.87 0.00 1.72 3.64 -0.72 -1.16 116.57 121.34 1qfl h LYS 73 Ca 0.24 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1qfl h LYS 73 Cb 0.23 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1qfl h LYS 73 CO -0.22 0.64 0.00 0.00 -2.27 0.00 0.00 179.45 177.60 1qfl n ALA 74 N -2.44 2.57 -0.01 5.00 0.00 0.43 -4.89 120.51 121.17 1qfl n ALA 74 Ca 0.06 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1qfl n ALA 74 Cb 0.10 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.17 1qfl n ALA 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qfl n GLY 75 N 0.77 0.23 3.65 0.00 0.00 -0.44 -4.66 105.19 104.73 1qfl n GLY 75 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 1qfl n GLY 75 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qfl s VAL 76 N -2.02 3.77 1.03 1.61 1.01 -0.76 -4.61 120.40 120.43 1qfl s VAL 76 Ca 0.00 0.91 -0.16 0.00 0.00 0.00 0.00 61.98 62.72 1qfl s VAL 76 Cb 0.00 -3.68 0.05 0.00 0.00 0.00 0.00 36.38 32.75 1qfl s VAL 76 CO 0.00 -0.19 0.07 -0.81 0.00 0.00 0.00 175.10 174.17 1qfl n PRO 77 N 7.28 -0.87 0.19 2.72 -0.04 -1.26 -4.12 135.00 138.90 1qfl n PRO 77 Ca 0.17 -0.23 0.14 0.00 -0.04 0.00 0.00 63.50 63.55 1qfl n PRO 77 Cb 0.44 -1.70 0.59 0.00 -0.04 0.00 0.00 33.50 32.79 1qfl n PRO 77 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 1qfl h GLN 78 N -1.74 0.00 -0.20 0.54 3.07 -1.98 -3.04 115.11 111.75 1qfl h GLN 78 Ca -0.48 0.00 -0.17 0.00 0.09 0.00 0.00 58.65 58.09 1qfl h GLN 78 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.89 1qfl h GLN 78 CO 0.35 0.00 -0.53 1.49 0.09 0.00 0.00 178.83 180.23 1qfl h GLU 79 N 0.00 0.72 0.00 0.06 4.81 -1.98 -3.45 114.58 114.74 1qfl h GLU 79 Ca 0.00 -0.50 -0.21 0.00 -0.13 0.00 0.00 59.36 58.52 1qfl h GLU 79 Cb 0.37 0.08 0.12 0.00 0.63 0.00 0.00 28.75 29.96 1qfl h GLU 79 CO 0.00 1.12 -0.10 0.00 -0.73 0.00 0.00 179.01 179.30 1qfl n ALA 80 N -2.56 -3.01 -2.27 2.92 0.00 -1.15 -5.05 120.51 109.39 1qfl n ALA 80 Ca -0.06 -0.88 -0.15 0.00 0.00 0.00 0.00 53.44 52.36 1qfl n ALA 80 Cb 0.62 -0.08 -0.10 0.00 0.00 0.00 0.00 19.45 19.88 1qfl n ALA 80 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1qfl s THR 81 N -1.63 0.67 0.02 0.00 -4.23 -0.52 -5.01 115.64 104.93 1qfl s THR 81 Ca 0.38 -1.99 -0.14 0.00 -1.18 0.00 0.00 61.69 58.76 1qfl s THR 81 Cb -0.07 -2.29 0.02 0.00 1.34 0.00 0.00 72.50 71.51 1qfl s THR 81 CO 0.32 -0.32 0.30 0.00 -0.54 0.00 0.00 174.62 174.38 1qfl s ALA 82 N -3.67 -0.72 -0.06 3.99 0.00 -1.26 -1.00 121.76 119.04 1qfl s ALA 82 Ca 0.28 0.15 -0.28 0.00 0.00 0.00 0.00 51.96 52.11 1qfl s ALA 82 Cb 0.06 0.20 0.06 0.00 0.00 0.00 0.00 23.12 23.45 1qfl s ALA 82 CO 0.07 -0.34 0.63 1.67 0.00 0.00 0.00 175.76 177.79 1qfl s TRP 83 N -1.96 -0.60 0.12 0.00 1.48 0.16 -4.66 118.94 113.48 1qfl s TRP 83 Ca -0.09 1.06 0.03 0.00 -1.06 0.00 0.00 56.10 56.04 1qfl s TRP 83 Cb -0.03 0.35 -0.04 0.00 -1.16 0.00 0.00 33.47 32.60 1qfl s TRP 83 CO 0.00 -0.56 0.18 0.20 -4.06 0.00 0.00 176.95 172.71 1qfl s GLY 84 N -1.09 1.86 0.02 3.67 0.00 -1.26 -1.43 107.32 109.09 1qfl s GLY 84 Ca -0.10 -1.06 -0.10 0.00 0.00 0.00 0.00 44.72 43.46 1qfl s GLY 84 CO 0.08 -1.05 0.21 -3.16 0.00 0.00 0.00 173.10 169.18 1qfl s MET 85 N -2.89 0.64 -0.08 2.90 0.23 -0.84 -4.94 119.30 114.32 1qfl s MET 85 Ca 0.32 -0.46 -0.00 0.00 -1.03 0.00 0.00 55.69 54.51 1qfl s MET 85 Cb -0.11 0.27 0.03 0.00 -1.53 0.00 0.00 34.83 33.48 1qfl s MET 85 CO 0.25 -0.18 -0.03 1.21 -2.03 0.00 0.00 175.02 174.25 1qfl s ASN 86 N -1.72 1.61 -0.28 -1.18 2.47 -1.26 -2.13 114.94 112.44 1qfl s ASN 86 Ca -0.10 -0.16 0.19 0.00 0.42 0.00 0.00 52.86 53.22 1qfl s ASN 86 Cb -0.04 -0.56 0.49 0.00 -1.45 0.00 0.00 41.25 39.69 1qfl s ASN 86 CO -0.01 -0.14 1.09 1.67 -3.72 0.00 0.00 177.10 176.00 1qfl n GLN 87 N 4.82 1.95 0.00 0.43 7.27 -1.26 -4.98 117.38 125.62 1qfl n GLN 87 Ca -0.13 -3.60 0.00 0.00 0.07 0.00 0.00 57.00 53.35 1qfl n GLN 87 Cb 0.50 -1.66 0.00 0.00 2.41 0.00 0.00 30.24 31.49 1qfl n GLN 87 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1qfl n LEU 88 N -0.51 0.00 0.00 1.69 4.77 -1.26 -2.32 117.00 119.37 1qfl n LEU 88 Ca 0.14 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 1qfl n LEU 88 Cb 0.82 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.91 1qfl n LEU 88 CO 0.17 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 1qfl n GLY 90 N 0.00 0.00 0.00 -0.72 0.00 -1.26 -4.44 105.19 98.76 1qfl n GLY 90 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1qfl n GLY 90 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1qfl n SER 91 N 0.00 0.00 -0.33 1.61 7.64 -0.98 -0.72 113.62 120.84 1qfl n SER 91 Ca 0.00 0.91 0.08 0.00 1.01 0.00 0.00 58.87 60.87 1qfl n SER 91 Cb 0.00 -0.41 0.18 0.00 -1.01 0.00 0.00 64.21 62.97 1qfl n SER 91 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1qfl n GLY 92 N -0.98 -1.46 0.14 0.23 0.00 -1.00 -0.73 105.19 101.39 1qfl n GLY 92 Ca 0.00 0.97 -0.20 0.00 0.00 0.00 0.00 46.02 46.79 1qfl n GLY 92 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1qfl h LEU 93 N 0.00 0.59 -0.93 0.99 5.85 -1.63 -3.30 115.31 116.88 1qfl h LEU 93 Ca 0.49 -0.85 0.12 0.00 0.84 0.00 0.00 57.88 58.48 1qfl h LEU 93 Cb 0.85 -0.19 -0.08 0.00 0.37 0.00 0.00 40.66 41.61 1qfl h LEU 93 CO -0.93 1.38 0.56 -0.09 -0.34 0.00 0.00 178.44 179.02 1qfl h ARG 94 N -0.11 0.85 -0.98 1.25 9.65 0.83 -0.77 114.38 125.10 1qfl h ARG 94 Ca -0.13 -0.05 0.11 0.00 -1.10 0.00 0.00 59.98 58.81 1qfl h ARG 94 Cb 1.58 -0.19 -0.08 0.00 -1.39 0.00 0.00 29.97 29.89 1qfl h ARG 94 CO 0.16 0.56 0.61 0.00 2.80 0.00 0.00 179.97 184.11 1qfl h ALA 95 N 1.52 1.46 -0.69 2.80 0.00 -1.02 -0.90 119.26 122.44 1qfl h ALA 95 Ca 0.47 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.33 1qfl h ALA 95 Cb 0.49 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1qfl h ALA 95 CO -0.28 0.23 0.17 0.28 0.00 0.00 0.00 179.25 179.65 1qfl h VAL 96 N 0.99 1.26 -0.69 0.00 2.07 -1.26 -1.53 116.25 117.09 1qfl h VAL 96 Ca 0.48 -0.96 -0.06 0.00 0.82 0.00 0.00 66.70 66.98 1qfl h VAL 96 Cb 0.45 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 1qfl h VAL 96 CO -0.26 0.37 0.19 0.00 0.02 0.00 0.00 177.57 177.89 1qfl h ALA 97 N 1.08 0.91 -0.60 1.67 0.00 -1.26 0.41 119.26 121.47 1qfl h ALA 97 Ca 0.22 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1qfl h ALA 97 Cb 0.37 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1qfl h ALA 97 CO 0.00 0.61 0.01 -0.07 0.00 0.00 0.00 179.25 179.80 1qfl h LEU 98 N 1.03 1.03 -0.40 0.00 3.38 -0.84 -1.53 115.31 117.98 1qfl h LEU 98 Ca 0.22 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 1qfl h LEU 98 Cb 0.33 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1qfl h LEU 98 CO -0.00 1.08 0.11 1.23 0.09 0.00 0.00 178.44 180.95 1qfl h GLY 99 N 0.95 0.68 0.08 0.83 0.00 -0.93 0.12 103.07 104.81 1qfl h GLY 99 Ca 0.17 -0.41 0.11 0.00 0.00 0.00 0.00 47.33 47.20 1qfl h GLY 99 CO 0.03 0.38 -0.00 1.98 0.00 0.00 0.00 176.54 178.93 1qfl h MET 100 N 0.50 0.11 -0.68 4.80 1.85 -0.65 0.53 114.93 121.39 1qfl h MET 100 Ca 0.13 -0.01 -0.03 0.00 -0.61 0.00 0.00 59.70 59.18 1qfl h MET 100 Cb 0.28 -0.03 -0.03 0.00 0.43 0.00 0.00 31.60 32.26 1qfl h MET 100 CO -0.00 0.07 0.28 1.96 -0.40 0.00 0.00 176.91 178.83 1qfl h GLN 101 N 0.12 0.99 -0.53 0.39 4.20 -0.89 0.13 115.11 119.52 1qfl h GLN 101 Ca 0.28 -0.16 0.10 0.00 0.06 0.00 0.00 58.65 58.93 1qfl h GLN 101 Cb 0.43 -0.17 -0.08 0.00 0.30 0.00 0.00 27.48 27.96 1qfl h GLN 101 CO -0.46 0.80 0.06 1.96 -0.67 0.00 0.00 178.83 180.52 1qfl h GLN 102 N 0.98 0.17 0.07 1.46 1.08 0.11 -1.66 115.11 117.32 1qfl h GLN 102 Ca 0.23 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.42 1qfl h GLN 102 Cb 0.17 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.56 1qfl h GLN 102 CO -0.02 0.12 -0.03 0.82 -0.95 0.00 0.00 178.83 178.76 1qfl h ILE 103 N 0.18 1.19 -1.00 2.54 2.04 -0.65 -1.30 117.51 120.52 1qfl h ILE 103 Ca 0.27 -0.98 0.25 0.00 1.00 0.00 0.00 64.86 65.40 1qfl h ILE 103 Cb 0.40 1.82 -0.08 0.00 -0.74 0.00 0.00 36.82 38.22 1qfl h ILE 103 CO -0.40 0.24 0.66 0.00 0.00 0.00 0.00 178.15 178.65 1qfl h ALA 104 N 0.33 2.33 -0.23 1.87 0.00 -0.33 0.22 119.26 123.45 1qfl h ALA 104 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1qfl h ALA 104 Cb 0.47 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1qfl h ALA 104 CO 0.02 -0.68 0.00 0.25 0.00 0.00 0.00 179.25 178.84 1qfl n THR 105 N -4.53 0.29 -2.55 0.00 -2.24 -0.67 -4.93 114.28 99.66 1qfl n THR 105 Ca 0.23 -0.44 -0.13 0.00 -2.27 0.00 0.00 64.05 61.44 1qfl n THR 105 Cb 0.85 0.50 0.01 0.00 -2.10 0.00 0.00 70.33 69.59 1qfl n THR 105 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qfl n GLY 106 N 1.21 -0.05 0.02 3.38 0.00 0.77 -4.90 105.19 105.61 1qfl n GLY 106 Ca 0.16 -0.29 0.11 0.00 0.00 0.00 0.00 46.02 46.00 1qfl n GLY 106 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1qfl n ASP 107 N -0.60 0.46 -3.50 1.61 8.00 -0.50 -4.98 116.55 117.04 1qfl n ASP 107 Ca -0.09 -0.23 -0.11 0.00 0.71 0.00 0.00 54.79 55.06 1qfl n ASP 107 Cb 0.58 1.29 -0.02 0.00 -0.02 0.00 0.00 41.12 42.95 1qfl n ASP 107 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1qfl s ALA 108 N -3.30 -1.45 -0.18 2.24 0.00 -1.14 -5.00 121.76 112.92 1qfl s ALA 108 Ca -0.01 0.31 -0.02 0.00 0.00 0.00 0.00 51.96 52.25 1qfl s ALA 108 Cb 0.14 0.86 -0.11 0.00 0.00 0.00 0.00 23.12 24.02 1qfl s ALA 108 CO 0.86 -0.79 -0.18 0.43 0.00 0.00 0.00 175.76 176.08 1qfl n SER 109 N -0.37 2.26 -3.93 0.00 7.64 -1.26 -4.05 113.62 113.90 1qfl n SER 109 Ca -0.15 -0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.50 1qfl n SER 109 Cb 0.64 -0.36 -0.17 0.00 -1.01 0.00 0.00 64.21 63.32 1qfl n SER 109 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1qfl s ILE 110 N -2.35 0.78 0.01 0.44 1.01 -1.26 -4.11 121.20 115.72 1qfl s ILE 110 Ca -0.25 -0.25 0.03 0.00 0.00 0.00 0.00 60.65 60.18 1qfl s ILE 110 Cb 0.07 -0.77 -0.01 0.00 0.01 0.00 0.00 42.46 41.76 1qfl s ILE 110 CO 0.39 0.29 -0.09 -0.63 0.00 0.00 0.00 174.94 174.90 1qfl s ILE 111 N 0.95 0.66 -0.19 2.92 -1.09 -0.98 -0.91 121.20 122.57 1qfl s ILE 111 Ca -0.10 -0.54 -0.05 0.00 -2.23 0.00 0.00 60.65 57.74 1qfl s ILE 111 Cb -0.15 -0.59 -0.03 0.00 -1.58 0.00 0.00 42.46 40.12 1qfl s ILE 111 CO 0.00 0.06 -0.01 -0.69 -1.23 0.00 0.00 174.94 173.08 1qfl s VAL 112 N -0.46 3.96 0.02 2.92 1.01 -0.51 -0.46 120.40 126.87 1qfl s VAL 112 Ca 0.01 -0.31 -0.00 0.00 0.00 0.00 0.00 61.98 61.67 1qfl s VAL 112 Cb -0.05 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.54 1qfl s VAL 112 CO 0.00 0.44 -0.02 0.00 0.00 0.00 0.00 175.10 175.52 1qfl s ALA 113 N 0.87 0.09 0.00 5.51 0.00 -0.40 -1.76 121.76 126.06 1qfl s ALA 113 Ca 0.01 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 51.51 1qfl s ALA 113 Cb -0.14 0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.09 1qfl s ALA 113 CO 0.02 -0.13 0.00 0.41 0.00 0.00 0.00 175.76 176.06 1qfl n GLY 114 N 1.91 -0.69 3.44 0.00 0.00 -0.38 0.06 105.19 109.53 1qfl n GLY 114 Ca -0.21 -0.28 -0.10 0.00 0.00 0.00 0.00 46.02 45.42 1qfl n GLY 114 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1qfl s GLY 115 N 0.00 -0.24 0.05 -0.02 0.00 -0.05 -1.15 107.32 105.91 1qfl s GLY 115 Ca 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 44.72 44.67 1qfl s GLY 115 CO 0.00 -0.21 -0.03 -3.16 0.00 0.00 0.00 173.10 169.70 1qfl s MET 116 N -3.83 0.60 -0.23 2.90 0.23 -0.57 -1.08 119.30 117.32 1qfl s MET 116 Ca 0.06 -1.17 -0.27 0.00 -1.03 0.00 0.00 55.69 53.28 1qfl s MET 116 Cb -0.00 0.18 0.12 0.00 -1.53 0.00 0.00 34.83 33.60 1qfl s MET 116 CO -0.08 -0.10 0.98 -2.00 -2.03 0.00 0.00 175.02 171.80 1qfl s GLU 117 N -3.70 0.59 -0.41 3.16 2.56 -0.70 -4.21 118.70 115.99 1qfl s GLU 117 Ca 0.05 0.45 0.02 0.00 0.00 0.00 0.00 54.97 55.49 1qfl s GLU 117 Cb 0.06 0.28 0.12 0.00 2.00 0.00 0.00 34.13 36.60 1qfl s GLU 117 CO -0.09 -0.12 0.19 0.45 -0.56 0.00 0.00 175.26 175.13 1qfl s SER 118 N -0.28 3.89 0.27 -1.70 0.15 -1.26 -2.39 113.70 112.37 1qfl s SER 118 Ca 0.01 -2.40 0.04 0.00 0.70 0.00 0.00 55.95 54.30 1qfl s SER 118 Cb -0.03 -1.10 0.37 0.00 -1.71 0.00 0.00 66.02 63.55 1qfl s SER 118 CO -0.02 -0.31 1.65 0.24 1.20 0.00 0.00 173.24 176.01 1qfl h MET 119 N 7.09 0.32 -0.40 5.44 0.00 -1.93 -3.02 114.93 122.43 1qfl h MET 119 Ca -0.05 -0.16 0.04 0.00 0.00 0.00 0.00 59.70 59.53 1qfl h MET 119 Cb 0.95 0.00 -0.04 0.00 0.00 0.00 0.00 31.60 32.52 1qfl h MET 119 CO 0.50 0.70 0.18 0.77 0.00 0.00 0.00 176.91 179.06 1qfl h SER 120 N 0.27 0.23 0.00 1.22 0.02 -1.86 -1.73 113.55 111.71 1qfl h SER 120 Ca 0.02 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1qfl h SER 120 Cb 0.87 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.41 1qfl h SER 120 CO 0.07 0.17 0.00 0.23 -1.14 0.00 0.00 176.83 176.16 1qfl n MET 121 N -4.96 0.96 -2.43 3.45 2.81 -1.15 -4.84 117.12 110.96 1qfl n MET 121 Ca 0.02 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.49 1qfl n MET 121 Cb 0.12 -1.19 -0.03 0.00 -0.71 0.00 0.00 33.22 31.41 1qfl n MET 121 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1qfl s ALA 122 N -2.00 3.48 0.72 3.04 0.00 -0.65 -4.97 121.76 121.39 1qfl s ALA 122 Ca 0.17 0.69 -0.06 0.00 0.00 0.00 0.00 51.96 52.76 1qfl s ALA 122 Cb 0.08 -3.51 0.08 0.00 0.00 0.00 0.00 23.12 19.77 1qfl s ALA 122 CO 0.13 -0.72 1.03 -1.25 0.00 0.00 0.00 175.76 174.96 1qfl s PRO 123 N 2.02 1.97 0.06 0.00 0.04 -1.26 -4.68 135.00 133.15 1qfl s PRO 123 Ca 0.57 -0.44 -0.05 0.00 0.04 0.00 0.00 61.00 61.12 1qfl s PRO 123 Cb -0.26 -2.18 -0.05 0.00 0.04 0.00 0.00 34.50 32.05 1qfl s PRO 123 CO 0.24 -1.37 0.30 -1.01 0.04 0.00 0.00 177.00 175.20 1qfl s HIS 124 N -3.27 3.54 0.19 0.56 3.76 -1.26 -1.70 115.29 117.11 1qfl s HIS 124 Ca 0.62 0.52 -0.10 0.00 -0.15 0.00 0.00 55.06 55.96 1qfl s HIS 124 Cb -0.09 -1.96 -0.01 0.00 1.11 0.00 0.00 32.58 31.63 1qfl s HIS 124 CO 0.45 0.55 0.34 0.00 -0.85 0.00 0.00 174.74 175.24 1qfl s ALA 126 N -3.99 -1.67 -0.28 0.00 0.00 -1.26 0.53 121.76 115.10 1qfl s ALA 126 Ca 0.20 1.50 -0.25 0.00 0.00 0.00 0.00 51.96 53.41 1qfl s ALA 126 Cb 0.02 -0.45 -0.00 0.00 0.00 0.00 0.00 23.12 22.69 1qfl s ALA 126 CO 0.03 -0.34 0.84 -1.58 0.00 0.00 0.00 175.76 174.71 1qfl s HIS 127 N -0.57 3.25 -0.05 0.00 2.46 -1.26 -4.90 115.29 114.23 1qfl s HIS 127 Ca -0.07 1.02 0.07 0.00 0.47 0.00 0.00 55.06 56.54 1qfl s HIS 127 Cb -0.02 -3.19 0.10 0.00 -0.13 0.00 0.00 32.58 29.34 1qfl s HIS 127 CO 0.06 -0.51 1.01 1.28 -2.47 0.00 0.00 174.74 174.11 1qfl n LEU 128 N 6.18 0.95 -0.04 8.88 4.77 -1.26 -4.80 117.00 131.67 1qfl n LEU 128 Ca 0.06 -1.70 -0.06 0.00 -0.03 0.00 0.00 56.01 54.28 1qfl n LEU 128 Cb 0.48 -0.15 0.14 0.00 -2.33 0.00 0.00 43.42 41.55 1qfl n LEU 128 CO 0.50 0.40 0.72 0.03 -1.33 0.00 0.00 177.39 177.71 1qfl h ARG 129 N 0.00 0.65 0.00 3.23 3.08 -2.07 -2.87 114.38 116.40 1qfl h ARG 129 Ca 0.00 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 59.77 1qfl h ARG 129 Cb 1.17 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 31.18 1qfl h ARG 129 CO 0.00 0.83 -0.12 0.78 -1.07 0.00 0.00 179.97 180.39 1qfl h GLY 130 N 0.99 0.00 0.00 0.04 0.00 -2.03 -3.49 103.07 98.58 1qfl h GLY 130 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1qfl h GLY 130 CO 0.05 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.20 1qfl n GLY 131 N 0.62 -0.67 2.96 4.60 0.00 -1.08 -4.87 105.19 106.74 1qfl n GLY 131 Ca 0.02 -1.67 -0.31 0.00 0.00 0.00 0.00 46.02 44.06 1qfl n GLY 131 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qfl s VAL 132 N -2.37 1.93 0.26 1.61 1.01 -1.26 -4.98 120.40 116.59 1qfl s VAL 132 Ca 0.00 -2.02 -0.04 0.00 0.00 0.00 0.00 61.98 59.92 1qfl s VAL 132 Cb 0.00 -2.38 0.18 0.00 0.00 0.00 0.00 36.38 34.18 1qfl s VAL 132 CO 0.00 -0.54 1.85 0.11 0.00 0.00 0.00 175.10 176.52 1qfl h LYS 133 N 7.75 1.03 -2.26 2.72 1.79 -2.02 -3.45 116.57 122.13 1qfl h LYS 133 Ca -0.08 -0.16 -0.07 0.00 -2.18 0.00 0.00 60.65 58.16 1qfl h LYS 133 Cb 1.02 -0.18 -0.21 0.00 -1.58 0.00 0.00 32.23 31.28 1qfl h LYS 133 CO 0.50 0.82 0.03 1.41 -1.08 0.00 0.00 179.45 181.13 1qfl s MET 134 N -5.52 0.80 0.00 3.15 0.00 -1.26 -5.16 119.30 111.32 1qfl s MET 134 Ca -0.11 0.61 0.00 0.00 0.00 0.00 0.00 55.69 56.19 1qfl s MET 134 Cb 0.16 0.38 0.00 0.00 0.00 0.00 0.00 34.83 35.38 1qfl s MET 134 CO 0.81 -0.16 0.00 0.41 0.00 0.00 0.00 175.02 176.09 1qfl n GLY 135 N 2.15 2.24 3.81 2.11 0.00 -1.26 -5.03 105.19 109.20 1qfl n GLY 135 Ca -0.16 -1.91 -0.32 0.00 0.00 0.00 0.00 46.02 43.64 1qfl n GLY 135 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1qfl s ASP 136 N 0.00 5.56 0.06 1.61 1.01 -1.26 -5.04 116.67 118.61 1qfl s ASP 136 Ca 0.00 1.75 -0.03 0.00 0.71 0.00 0.00 52.55 54.98 1qfl s ASP 136 Cb 0.00 -2.52 -0.03 0.00 1.01 0.00 0.00 42.92 41.38 1qfl s ASP 136 CO 0.00 -1.32 0.03 0.72 0.21 0.00 0.00 175.17 174.81 1qfl s PHE 137 N -2.69 0.41 -0.08 4.23 -0.12 -1.26 -5.16 117.98 113.32 1qfl s PHE 137 Ca 0.61 -0.92 -0.12 0.00 -0.05 0.00 0.00 56.93 56.45 1qfl s PHE 137 Cb -0.15 -0.30 -0.05 0.00 -0.63 0.00 0.00 43.02 41.89 1qfl s PHE 137 CO 0.44 -0.41 0.30 0.15 -0.05 0.00 0.00 175.22 175.65 1qfl s LYS 138 N -3.79 3.86 -0.30 1.99 1.02 -1.26 -5.06 119.74 116.19 1qfl s LYS 138 Ca 0.05 0.17 -0.16 0.00 0.02 0.00 0.00 55.97 56.06 1qfl s LYS 138 Cb 0.06 -3.26 -0.02 0.00 -0.52 0.00 0.00 37.83 34.09 1qfl s LYS 138 CO -0.10 0.60 0.41 -1.64 -0.92 0.00 0.00 175.35 173.71 1qfl s MET 139 N -0.68 3.83 -0.04 1.68 -1.94 -1.26 -4.73 119.30 116.16 1qfl s MET 139 Ca 0.19 -0.09 -0.21 0.00 -1.71 0.00 0.00 55.69 53.88 1qfl s MET 139 Cb -0.14 -3.72 -0.05 0.00 2.01 0.00 0.00 34.83 32.93 1qfl s MET 139 CO 0.08 -0.42 0.60 0.42 -0.01 0.00 0.00 175.02 175.69 1qfl s ILE 140 N 2.15 5.00 -0.59 2.53 1.09 0.19 -4.76 121.20 126.81 1qfl s ILE 140 Ca 0.16 1.23 -0.28 0.00 -1.10 0.00 0.00 60.65 60.66 1qfl s ILE 140 Cb -0.16 -3.93 0.01 0.00 -1.06 0.00 0.00 42.46 37.32 1qfl s ILE 140 CO 0.11 0.36 1.46 -0.62 -0.10 0.00 0.00 174.94 176.14 1qfl s ASP 141 N 0.22 6.02 0.50 3.58 -1.08 -1.26 -0.01 116.67 124.65 1qfl s ASP 141 Ca 0.32 0.20 0.17 0.00 -0.52 0.00 0.00 52.55 52.71 1qfl s ASP 141 Cb -0.17 -2.55 1.22 0.00 -1.46 0.00 0.00 42.92 39.96 1qfl s ASP 141 CO 0.16 -1.81 2.09 0.71 0.52 0.00 0.00 175.17 176.84 1qfl h THR 142 N 6.39 0.94 -0.69 1.71 1.35 -1.63 -1.53 112.91 119.45 1qfl h THR 142 Ca -0.27 -0.04 -0.01 0.00 -0.55 0.00 0.00 66.41 65.54 1qfl h THR 142 Cb 1.10 0.83 -0.03 0.00 -1.73 0.00 0.00 68.15 68.31 1qfl h THR 142 CO 1.19 0.02 0.38 -0.03 -0.25 0.00 0.00 175.52 176.84 1qfl h MET 143 N 0.11 0.96 0.02 4.72 1.85 -1.84 -0.97 114.93 119.78 1qfl h MET 143 Ca 0.10 -0.11 -0.00 0.00 -0.61 0.00 0.00 59.70 59.08 1qfl h MET 143 Cb 0.27 -0.19 0.00 0.00 0.43 0.00 0.00 31.60 32.11 1qfl h MET 143 CO -0.01 0.71 -0.01 0.82 -0.40 0.00 0.00 176.91 178.02 1qfl h ILE 144 N 0.94 1.41 0.80 1.77 1.08 -1.75 -0.63 117.51 121.14 1qfl h ILE 144 Ca 0.24 -1.41 -0.04 0.00 -0.39 0.00 0.00 64.86 63.26 1qfl h ILE 144 Cb 0.03 2.34 0.01 0.00 -3.07 0.00 0.00 36.82 36.13 1qfl h ILE 144 CO -0.04 0.36 -0.39 0.50 -0.69 0.00 0.00 178.15 177.89 1qfl h LYS 145 N -0.65 -1.04 0.00 2.37 1.63 -1.35 -0.91 116.57 116.62 1qfl h LYS 145 Ca -0.00 0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.87 1qfl h LYS 145 Cb 0.61 0.24 0.00 0.00 -0.60 0.00 0.00 32.23 32.47 1qfl h LYS 145 CO 0.01 -0.68 0.00 -0.25 -3.45 0.00 0.00 179.45 175.07 1qfl n ASP 146 N -5.51 0.40 0.00 4.20 8.00 -0.37 -3.99 116.55 119.27 1qfl n ASP 146 Ca -0.14 0.54 0.00 0.00 0.71 0.00 0.00 54.79 55.90 1qfl n ASP 146 Cb 0.43 -0.65 0.00 0.00 -0.02 0.00 0.00 41.12 40.89 1qfl n ASP 146 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qfl n GLY 147 N 1.35 0.00 0.42 0.44 0.00 -0.32 -4.91 105.19 102.18 1qfl n GLY 147 Ca 0.06 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.15 1qfl n GLY 147 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1qfl n LEU 148 N -2.46 2.71 -3.96 0.99 4.77 -0.58 -5.00 117.00 113.47 1qfl n LEU 148 Ca 0.00 -3.50 -0.29 0.00 -0.03 0.00 0.00 56.01 52.20 1qfl n LEU 148 Cb 0.47 -0.49 -0.17 0.00 -2.33 0.00 0.00 43.42 40.90 1qfl n LEU 148 CO 0.00 1.06 -0.46 -0.89 -1.33 0.00 0.00 177.39 175.77 1qfl s THR 149 N -3.06 1.30 0.06 -5.08 2.01 -0.45 -2.30 115.64 108.11 1qfl s THR 149 Ca 0.36 -0.50 -0.33 0.00 0.31 0.00 0.00 61.69 61.52 1qfl s THR 149 Cb 0.33 -1.29 -0.12 0.00 0.01 0.00 0.00 72.50 71.43 1qfl s THR 149 CO -0.01 0.38 1.75 -0.67 -0.69 0.00 0.00 174.62 175.38 1qfl n ASP 150 N 4.85 3.44 0.05 3.53 2.03 0.39 -4.84 116.55 126.01 1qfl n ASP 150 Ca -0.14 1.02 0.11 0.00 0.52 0.00 0.00 54.79 56.30 1qfl n ASP 150 Cb 0.50 -1.43 0.46 0.00 -0.72 0.00 0.00 41.12 39.92 1qfl n ASP 150 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1qfl n ALA 151 N 5.18 1.97 -0.05 -1.67 0.00 -1.26 -0.56 120.51 124.11 1qfl n ALA 151 Ca 0.19 -0.03 -0.21 0.00 0.00 0.00 0.00 53.44 53.40 1qfl n ALA 151 Cb 0.31 -1.38 -0.13 0.00 0.00 0.00 0.00 19.45 18.25 1qfl n ALA 151 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1qfl n PHE 152 N -1.84 0.76 0.73 0.00 3.72 -1.26 -4.54 117.46 115.04 1qfl n PHE 152 Ca 0.05 0.17 0.08 0.00 -0.05 0.00 0.00 57.45 57.70 1qfl n PHE 152 Cb 0.28 -1.10 -0.02 0.00 -0.94 0.00 0.00 39.48 37.71 1qfl n PHE 152 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1qfl n TYR 153 N -3.49 0.00 -0.87 1.38 4.02 -1.23 -4.98 117.16 112.00 1qfl n TYR 153 Ca -0.38 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.51 1qfl n TYR 153 Cb 1.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.32 1qfl n TYR 153 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1qfl n GLY 154 N 1.20 0.44 4.01 2.72 0.00 0.27 -5.00 105.19 108.82 1qfl n GLY 154 Ca 0.06 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.91 1qfl n GLY 154 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1qfl s TYR 155 N -2.20 2.71 0.66 1.61 -0.85 -1.25 -4.71 117.35 113.32 1qfl s TYR 155 Ca 0.00 -0.38 -0.11 0.00 -0.52 0.00 0.00 57.07 56.05 1qfl s TYR 155 Cb 0.00 -2.41 -0.01 0.00 0.38 0.00 0.00 41.96 39.92 1qfl s TYR 155 CO 0.00 -0.52 1.05 -1.58 -1.52 0.00 0.00 175.55 172.97 1qfl s HIS 156 N -2.42 3.24 0.37 -3.49 5.65 -1.26 0.15 115.29 117.53 1qfl s HIS 156 Ca 0.56 1.40 0.07 0.00 0.25 0.00 0.00 55.06 57.33 1qfl s HIS 156 Cb -0.10 -2.85 0.78 0.00 -1.18 0.00 0.00 32.58 29.23 1qfl s HIS 156 CO 0.34 -1.06 1.97 0.52 -0.65 0.00 0.00 174.74 175.86 1qfl h MET 157 N -0.46 0.68 -0.70 2.88 0.00 -1.84 -0.52 114.93 114.97 1qfl h MET 157 Ca -0.44 -0.04 0.15 0.00 0.00 0.00 0.00 59.70 59.37 1qfl h MET 157 Cb 1.21 -0.15 -0.12 0.00 0.00 0.00 0.00 31.60 32.53 1qfl h MET 157 CO 0.58 0.45 0.01 0.78 0.00 0.00 0.00 176.91 178.74 1qfl h GLY 158 N 0.70 0.78 1.01 8.32 0.00 -1.92 0.58 103.07 112.54 1qfl h GLY 158 Ca 0.30 0.09 -0.02 0.00 0.00 0.00 0.00 47.33 47.70 1qfl h GLY 158 CO -0.10 -0.25 0.36 -0.84 0.00 0.00 0.00 176.54 175.71 1qfl h THR 159 N 0.12 1.22 -0.64 4.70 2.02 -1.45 -0.82 112.91 118.07 1qfl h THR 159 Ca 0.38 -0.60 0.08 0.00 0.77 0.00 0.00 66.41 67.04 1qfl h THR 159 Cb 0.65 0.34 -0.04 0.00 -1.74 0.00 0.00 68.15 67.35 1qfl h THR 159 CO -0.61 0.26 0.42 0.71 0.37 0.00 0.00 175.52 176.67 1qfl h THR 160 N 0.97 0.94 -0.17 3.16 1.35 -0.86 0.32 112.91 118.62 1qfl h THR 160 Ca 0.24 -0.18 -0.03 0.00 -0.55 0.00 0.00 66.41 65.89 1qfl h THR 160 Cb 0.08 0.37 -0.01 0.00 -1.73 0.00 0.00 68.15 66.86 1qfl h THR 160 CO -0.03 0.10 -0.01 0.00 -0.25 0.00 0.00 175.52 175.32 1qfl h ALA 161 N 1.67 0.23 -0.85 6.62 0.00 -0.01 -2.60 119.26 124.32 1qfl h ALA 161 Ca 0.29 -0.21 0.09 0.00 0.00 0.00 0.00 54.91 55.08 1qfl h ALA 161 Cb 0.43 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.10 1qfl h ALA 161 CO -0.09 -0.05 0.55 0.93 0.00 0.00 0.00 179.25 180.59 1qfl h GLU 162 N 0.04 0.80 -0.92 0.00 4.39 0.83 0.65 114.58 120.37 1qfl h GLU 162 Ca 0.05 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1qfl h GLU 162 Cb 0.40 -0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 28.83 1qfl h GLU 162 CO 0.01 0.53 0.53 -0.91 -1.16 0.00 0.00 179.01 178.01 1qfl h ASN 163 N 0.82 1.13 -0.26 1.42 2.35 -0.48 -1.83 115.58 118.73 1qfl h ASN 163 Ca 0.39 -0.08 -0.19 0.00 -0.55 0.00 0.00 56.30 55.86 1qfl h ASN 163 Cb 0.41 -0.29 0.00 0.00 0.05 0.00 0.00 38.32 38.50 1qfl h ASN 163 CO -0.16 0.88 -0.59 0.58 -1.65 0.00 0.00 177.43 176.49 1qfl h VAL 164 N 1.28 1.27 0.23 2.81 2.07 -0.77 -2.39 116.25 120.75 1qfl h VAL 164 Ca 0.33 -1.78 0.01 0.00 0.82 0.00 0.00 66.70 66.08 1qfl h VAL 164 Cb -0.02 1.69 -0.04 0.00 -1.52 0.00 0.00 31.29 31.41 1qfl h VAL 164 CO -0.06 0.58 -0.45 0.00 0.02 0.00 0.00 177.57 177.66 1qfl h ALA 165 N 0.66 -0.88 -0.31 1.67 0.00 -0.49 0.16 119.26 120.07 1qfl h ALA 165 Ca 0.00 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.83 1qfl h ALA 165 Cb 1.21 0.73 -0.03 0.00 0.00 0.00 0.00 17.79 19.70 1qfl h ALA 165 CO 0.13 -1.06 0.12 0.87 0.00 0.00 0.00 179.25 179.32 1qfl h LYS 166 N -0.76 0.26 -0.88 0.00 1.57 -1.41 0.17 116.57 115.52 1qfl h LYS 166 Ca -0.01 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1qfl h LYS 166 Cb 0.74 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.95 1qfl h LYS 166 CO -0.20 0.17 0.47 0.37 -0.57 0.00 0.00 179.45 179.70 1qfl h GLN 167 N 0.27 1.23 -0.44 3.15 4.15 -1.18 -2.52 115.11 119.77 1qfl h GLN 167 Ca 0.14 -0.15 0.00 0.00 0.77 0.00 0.00 58.65 59.40 1qfl h GLN 167 Cb 0.09 -0.24 0.00 0.00 0.21 0.00 0.00 27.48 27.54 1qfl h GLN 167 CO -0.13 0.91 0.00 0.91 -1.93 0.00 0.00 178.83 178.60 1qfl n TRP 168 N -4.32 0.58 -3.90 3.99 7.02 0.55 -4.96 117.44 116.39 1qfl n TRP 168 Ca 0.09 -0.29 -0.35 0.00 -1.02 0.00 0.00 57.50 55.93 1qfl n TRP 168 Cb 0.11 0.00 0.01 0.00 -2.42 0.00 0.00 31.31 29.01 1qfl n TRP 168 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 1qfl n GLN 169 N 1.12 -1.26 -3.36 -0.99 6.02 0.41 -4.91 117.38 114.40 1qfl n GLN 169 Ca 0.19 0.30 -0.45 0.00 -0.01 0.00 0.00 57.00 57.03 1qfl n GLN 169 Cb 0.50 -3.64 -0.06 0.00 1.02 0.00 0.00 30.24 28.05 1qfl n GLN 169 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1qfl s LEU 170 N -6.95 6.08 1.15 1.08 1.43 -0.16 -5.03 118.68 116.28 1qfl s LEU 170 Ca 0.36 -1.82 -0.13 0.00 -1.03 0.00 0.00 54.13 51.52 1qfl s LEU 170 Cb -0.16 -2.17 0.26 0.00 0.03 0.00 0.00 46.19 44.16 1qfl s LEU 170 CO 0.91 -0.82 0.97 -1.54 0.23 0.00 0.00 176.35 176.10 1qfl n SER 171 N 5.17 -1.54 -0.14 2.29 3.41 -1.26 -4.79 113.62 116.76 1qfl n SER 171 Ca -0.13 -0.09 -0.09 0.00 -0.26 0.00 0.00 58.87 58.30 1qfl n SER 171 Cb 0.40 -1.27 -0.01 0.00 -0.26 0.00 0.00 64.21 63.08 1qfl n SER 171 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1qfl h ARG 172 N -2.57 0.63 -0.43 4.33 9.65 -1.97 -2.47 114.38 121.55 1qfl h ARG 172 Ca -0.59 -0.13 -0.04 0.00 -1.10 0.00 0.00 59.98 58.12 1qfl h ARG 172 Cb 1.33 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 29.79 1qfl h ARG 172 CO 0.47 0.62 0.10 -0.44 2.80 0.00 0.00 179.97 183.52 1qfl h ASP 173 N 0.52 0.60 -0.24 -3.80 3.32 -1.95 0.20 116.42 115.07 1qfl h ASP 173 Ca 0.13 -0.09 -0.11 0.00 0.02 0.00 0.00 57.03 56.98 1qfl h ASP 173 Cb 0.24 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 1qfl h ASP 173 CO -0.01 0.60 -0.29 -0.08 -1.72 0.00 0.00 179.24 177.74 1qfl h GLU 174 N 0.63 0.62 -0.09 3.56 4.81 -1.88 0.10 114.58 122.33 1qfl h GLU 174 Ca 0.14 -0.35 -0.04 0.00 -0.13 0.00 0.00 59.36 58.99 1qfl h GLU 174 Cb 0.24 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 1qfl h GLU 174 CO -0.00 0.95 -0.08 1.96 -0.73 0.00 0.00 179.01 181.10 1qfl h GLN 175 N 0.32 0.21 -0.55 1.92 4.20 -1.18 -2.29 115.11 117.74 1qfl h GLN 175 Ca 0.03 -0.11 0.10 0.00 0.06 0.00 0.00 58.65 58.73 1qfl h GLN 175 Cb 0.86 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.57 1qfl h GLN 175 CO 0.07 0.63 0.12 -0.44 -0.67 0.00 0.00 178.83 178.55 1qfl h ASP 176 N -0.21 0.02 -0.14 1.46 3.32 -0.64 0.47 116.42 120.71 1qfl h ASP 176 Ca 0.01 0.10 0.04 0.00 0.02 0.00 0.00 57.03 57.21 1qfl h ASP 176 Cb 0.59 0.13 -0.05 0.00 0.22 0.00 0.00 39.33 40.22 1qfl h ASP 176 CO 0.02 0.03 -0.17 0.00 -1.72 0.00 0.00 179.24 177.40 1qfl h ALA 177 N 1.43 -0.09 -0.69 3.45 0.00 -0.89 -1.49 119.26 120.96 1qfl h ALA 177 Ca 0.28 0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.34 1qfl h ALA 177 Cb 0.39 0.34 -0.07 0.00 0.00 0.00 0.00 17.79 18.45 1qfl h ALA 177 CO -0.36 -0.62 0.32 0.35 0.00 0.00 0.00 179.25 178.95 1qfl h PHE 178 N -0.21 0.57 0.40 0.00 3.04 -0.63 -2.06 116.94 118.06 1qfl h PHE 178 Ca 0.10 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 62.06 1qfl h PHE 178 Cb 0.35 -0.15 -0.00 0.00 2.56 0.00 0.00 35.95 38.71 1qfl h PHE 178 CO -0.28 0.18 -0.22 0.00 -2.02 0.00 0.00 178.31 175.97 1qfl h ALA 179 N 1.44 -0.58 -0.24 2.41 0.00 -0.15 -1.97 119.26 120.17 1qfl h ALA 179 Ca 0.35 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.20 1qfl h ALA 179 Cb 0.40 0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.39 1qfl h ALA 179 CO -0.29 -0.83 -0.18 0.28 0.00 0.00 0.00 179.25 178.23 1qfl h VAL 180 N -0.58 0.51 -0.24 0.00 2.07 -1.04 -1.03 116.25 115.94 1qfl h VAL 180 Ca -0.05 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.53 1qfl h VAL 180 Cb 0.47 0.51 -0.06 0.00 -1.52 0.00 0.00 31.29 30.68 1qfl h VAL 180 CO 0.07 0.00 -0.19 0.00 0.02 0.00 0.00 177.57 177.47 1qfl h ALA 181 N 0.97 -0.03 -0.01 1.67 0.00 -1.30 0.16 119.26 120.71 1qfl h ALA 181 Ca 0.14 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1qfl h ALA 181 Cb 0.37 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 1qfl h ALA 181 CO -0.34 -0.60 0.01 1.03 0.00 0.00 0.00 179.25 179.34 1qfl h SER 182 N -0.18 0.01 0.06 0.00 0.87 -0.63 0.41 113.55 114.09 1qfl h SER 182 Ca 0.14 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.69 1qfl h SER 182 Cb 0.39 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 1qfl h SER 182 CO -0.35 0.01 -0.03 1.56 -0.53 0.00 0.00 176.83 177.49 1qfl h GLN 183 N 0.02 -0.08 -0.58 2.24 1.08 0.50 0.15 115.11 118.44 1qfl h GLN 183 Ca 0.00 0.01 0.07 0.00 -1.45 0.00 0.00 58.65 57.28 1qfl h GLN 183 Cb 0.00 0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 27.39 1qfl h GLN 183 CO -0.00 0.43 0.25 -0.91 -0.95 0.00 0.00 178.83 177.65 1qfl h ASN 184 N -0.63 0.31 0.33 1.46 -0.26 -0.62 0.54 115.58 116.71 1qfl h ASN 184 Ca -0.01 0.05 -0.10 0.00 -0.56 0.00 0.00 56.30 55.69 1qfl h ASN 184 Cb 0.54 0.01 -0.01 0.00 -1.06 0.00 0.00 38.32 37.79 1qfl h ASN 184 CO 0.01 0.20 -0.42 0.11 -1.06 0.00 0.00 177.43 176.27 1qfl h LYS 185 N 0.47 0.13 0.02 0.81 1.57 -0.19 0.23 116.57 119.60 1qfl h LYS 185 Ca 0.28 -0.06 -0.21 0.00 -1.87 0.00 0.00 60.65 58.78 1qfl h LYS 185 Cb 0.27 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 1qfl h LYS 185 CO -0.24 0.54 -0.94 0.00 -0.57 0.00 0.00 179.45 178.24 1qfl h ALA 186 N 1.46 0.44 -0.15 3.86 0.00 0.62 -2.68 119.26 122.81 1qfl h ALA 186 Ca 0.01 -0.76 -0.20 0.00 0.00 0.00 0.00 54.91 53.96 1qfl h ALA 186 Cb 0.80 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.53 1qfl h ALA 186 CO 0.06 0.94 -0.69 1.49 0.00 0.00 0.00 179.25 181.05 1qfl h GLU 187 N 0.11 0.73 -0.26 0.00 4.22 0.17 -2.01 114.58 117.54 1qfl h GLU 187 Ca -0.06 -0.59 -0.00 0.00 0.08 0.00 0.00 59.36 58.79 1qfl h GLU 187 Cb 1.59 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.95 1qfl h GLU 187 CO 0.15 1.20 0.16 0.00 -2.18 0.00 0.00 179.01 178.33 1qfl h ALA 188 N 0.54 0.34 -0.43 2.92 0.00 -0.58 -0.24 119.26 121.80 1qfl h ALA 188 Ca -0.04 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 1qfl h ALA 188 Cb 1.32 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1qfl h ALA 188 CO 0.14 -0.15 -0.16 0.00 0.00 0.00 0.00 179.25 179.08 1qfl h ALA 189 N 1.05 0.90 -0.42 0.00 0.00 -1.53 -2.45 119.26 116.80 1qfl h ALA 189 Ca 0.09 -0.35 -0.14 0.00 0.00 0.00 0.00 54.91 54.52 1qfl h ALA 189 Cb 0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1qfl h ALA 189 CO -0.02 0.63 -0.28 0.37 0.00 0.00 0.00 179.25 179.95 1qfl h GLN 190 N 0.73 0.92 -0.42 0.00 4.15 -1.12 -0.12 115.11 119.25 1qfl h GLN 190 Ca 0.11 -0.42 -0.06 0.00 0.77 0.00 0.00 58.65 59.05 1qfl h GLN 190 Cb 0.67 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.33 1qfl h GLN 190 CO 0.05 1.08 0.00 0.87 -1.93 0.00 0.00 178.83 178.90 1qfl h LYS 191 N 0.78 0.67 -0.37 1.69 1.57 -0.87 -2.80 116.57 117.24 1qfl h LYS 191 Ca 0.09 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1qfl h LYS 191 Cb 0.85 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.08 1qfl h LYS 191 CO 0.08 0.69 0.00 -0.25 -0.57 0.00 0.00 179.45 179.40 1qfl n ASP 192 N -4.24 1.77 -0.12 0.86 8.00 -0.94 -4.90 116.55 116.98 1qfl n ASP 192 Ca 0.02 -2.05 -0.02 0.00 0.71 0.00 0.00 54.79 53.45 1qfl n ASP 192 Cb 0.28 -0.25 -0.01 0.00 -0.02 0.00 0.00 41.12 41.12 1qfl n ASP 192 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qfl n GLY 193 N 0.87 0.49 0.12 0.44 0.00 -1.06 -4.91 105.19 101.14 1qfl n GLY 193 Ca 0.10 -0.21 0.09 0.00 0.00 0.00 0.00 46.02 46.00 1qfl n GLY 193 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qfl n ARG 194 N -2.12 0.11 0.00 1.61 1.74 -0.07 -1.86 116.66 116.08 1qfl n ARG 194 Ca -0.02 0.57 0.08 0.00 -0.77 0.00 0.00 57.85 57.71 1qfl n ARG 194 Cb 0.16 -1.84 -0.03 0.00 -1.02 0.00 0.00 32.46 29.73 1qfl n ARG 194 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1qfl n PHE 195 N -2.08 0.00 -0.30 -1.55 3.72 -1.26 -4.64 117.46 111.35 1qfl n PHE 195 Ca -0.00 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.38 1qfl n PHE 195 Cb 0.06 0.00 0.16 0.00 -0.94 0.00 0.00 39.48 38.76 1qfl n PHE 195 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1qfl h LYS 196 N 1.19 1.18 -0.29 -1.08 3.64 -1.72 -1.45 116.57 118.03 1qfl h LYS 196 Ca 0.00 -0.09 -0.06 0.00 -1.27 0.00 0.00 60.65 59.23 1qfl h LYS 196 Cb 0.48 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 1qfl h LYS 196 CO 0.00 0.81 -0.05 -0.44 -2.27 0.00 0.00 179.45 177.50 1qfl h ASP 197 N 1.20 0.55 -0.50 4.20 3.32 -1.82 -3.24 116.42 120.13 1qfl h ASP 197 Ca 0.32 -0.35 -0.07 0.00 0.02 0.00 0.00 57.03 56.95 1qfl h ASP 197 Cb -0.09 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 1qfl h ASP 197 CO -0.06 0.77 0.05 1.05 -1.72 0.00 0.00 179.24 179.33 1qfl h GLU 198 N 0.32 0.85 -6.98 3.56 4.11 -1.83 -3.44 114.58 111.18 1qfl h GLU 198 Ca 0.08 -0.25 -0.51 0.00 0.07 0.00 0.00 59.36 58.75 1qfl h GLU 198 Cb 0.52 -0.09 0.07 0.00 0.50 0.00 0.00 28.75 29.75 1qfl h GLU 198 CO 0.03 0.87 0.51 0.42 0.07 0.00 0.00 179.01 180.90 1qfl s ILE 199 N -5.11 2.99 -0.19 -1.06 1.01 -0.57 -1.65 121.20 116.62 1qfl s ILE 199 Ca -0.13 0.78 0.00 0.00 0.00 0.00 0.00 60.65 61.31 1qfl s ILE 199 Cb 0.12 -3.41 0.04 0.00 0.01 0.00 0.00 42.46 39.22 1qfl s ILE 199 CO 0.81 0.02 -0.08 0.54 0.00 0.00 0.00 174.94 176.24 1qfl s VAL 200 N -1.46 1.44 0.40 2.92 0.11 -0.72 -4.86 120.40 118.23 1qfl s VAL 200 Ca 0.62 -0.88 -0.24 0.00 -2.93 0.00 0.00 61.98 58.55 1qfl s VAL 200 Cb -0.31 -1.56 -0.12 0.00 -1.53 0.00 0.00 36.38 32.86 1qfl s VAL 200 CO 0.38 0.14 0.81 -2.65 -3.33 0.00 0.00 175.10 170.45 1qfl n PRO 201 N 4.75 0.97 -4.97 1.54 -0.02 -1.26 -4.34 135.00 131.68 1qfl n PRO 201 Ca -0.14 0.35 -0.32 0.00 -2.02 0.00 0.00 63.50 61.38 1qfl n PRO 201 Cb 0.47 -1.76 -0.17 0.00 -0.02 0.00 0.00 33.50 32.02 1qfl n PRO 201 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1qfl s PHE 202 N -1.32 2.54 -0.53 6.00 5.36 0.23 -4.91 117.98 125.35 1qfl s PHE 202 Ca 0.63 -1.13 -0.25 0.00 -0.96 0.00 0.00 56.93 55.22 1qfl s PHE 202 Cb -0.61 -1.71 0.04 0.00 -0.34 0.00 0.00 43.02 40.40 1qfl s PHE 202 CO 0.57 -0.49 0.96 0.42 -1.46 0.00 0.00 175.22 175.22 1qfl s ILE 203 N 0.55 4.38 -0.76 3.12 -1.09 -1.26 0.06 121.20 126.20 1qfl s ILE 203 Ca -0.14 0.45 -0.26 0.00 -2.23 0.00 0.00 60.65 58.47 1qfl s ILE 203 Cb -0.17 -4.53 0.02 0.00 -1.58 0.00 0.00 42.46 36.20 1qfl s ILE 203 CO 0.04 -1.06 1.48 -0.69 -1.23 0.00 0.00 174.94 173.48 1qfl s VAL 204 N 3.98 3.65 -0.16 2.92 1.01 0.23 -4.91 120.40 127.12 1qfl s VAL 204 Ca 0.33 0.15 -0.29 0.00 0.00 0.00 0.00 61.98 62.18 1qfl s VAL 204 Cb -0.11 -4.66 -0.06 0.00 0.00 0.00 0.00 36.38 31.54 1qfl s VAL 204 CO 0.22 -1.60 2.16 -0.54 0.00 0.00 0.00 175.10 175.34 1qfl s LYS 205 N 6.00 3.37 0.07 2.72 -0.14 -1.26 -2.12 119.74 128.38 1qfl s LYS 205 Ca 0.46 2.17 0.01 0.00 -1.36 0.00 0.00 55.97 57.25 1qfl s LYS 205 Cb -0.08 -4.32 0.01 0.00 -1.68 0.00 0.00 37.83 31.76 1qfl s LYS 205 CO 0.12 -1.84 0.08 0.41 -0.76 0.00 0.00 175.35 173.37 1qfl n GLY 206 N 5.47 2.35 1.09 -3.33 0.00 -1.21 -4.98 105.19 104.59 1qfl n GLY 206 Ca 0.27 -2.16 0.00 0.00 0.00 0.00 0.00 46.02 44.13 1qfl n GLY 206 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1qfl n ARG 207 N -0.97 0.00 -1.45 1.61 0.00 -1.26 -4.68 116.66 109.90 1qfl n ARG 207 Ca 0.01 0.00 -0.35 0.00 -0.00 0.00 0.00 57.85 57.52 1qfl n ARG 207 Cb 0.08 -0.46 0.07 0.00 -0.00 0.00 0.00 32.46 32.15 1qfl n ARG 207 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1qfl n LYS 208 N -3.05 2.77 0.00 2.89 5.02 -1.26 -4.91 118.16 119.62 1qfl n LYS 208 Ca 0.00 -3.39 0.00 0.00 -2.02 0.00 0.00 58.31 52.90 1qfl n LYS 208 Cb 0.38 -2.29 0.00 0.00 -0.02 0.00 0.00 35.03 33.10 1qfl n LYS 208 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1qfl n GLY 209 N -0.86 3.81 3.79 0.72 0.00 -1.26 -5.10 105.19 106.29 1qfl n GLY 209 Ca 0.61 -1.40 -0.38 0.00 0.00 0.00 0.00 46.02 44.85 1qfl n GLY 209 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1qfl s ASP 210 N 0.00 6.69 -0.11 1.61 1.11 -1.26 -3.32 116.67 121.39 1qfl s ASP 210 Ca 0.00 0.81 0.03 0.00 0.18 0.00 0.00 52.55 53.58 1qfl s ASP 210 Cb 0.00 -2.23 0.01 0.00 1.07 0.00 0.00 42.92 41.76 1qfl s ASP 210 CO 0.00 0.22 -0.21 -0.63 1.18 0.00 0.00 175.17 175.72 1qfl s ILE 211 N -0.42 1.91 -0.23 0.77 1.01 -0.90 -4.92 121.20 118.42 1qfl s ILE 211 Ca 0.22 -0.92 -0.21 0.00 0.00 0.00 0.00 60.65 59.75 1qfl s ILE 211 Cb -0.15 -1.67 -0.02 0.00 0.01 0.00 0.00 42.46 40.62 1qfl s ILE 211 CO 0.10 0.52 0.64 -0.89 0.00 0.00 0.00 174.94 175.32 1qfl s THR 212 N 0.55 4.99 -0.21 2.92 2.01 -1.26 0.76 115.64 125.40 1qfl s THR 212 Ca -0.14 1.19 -0.06 0.00 0.31 0.00 0.00 61.69 62.99 1qfl s THR 212 Cb -0.17 -3.95 -0.03 0.00 0.01 0.00 0.00 72.50 68.36 1qfl s THR 212 CO 0.05 0.06 0.02 -0.69 -0.69 0.00 0.00 174.62 173.37 1qfl s VAL 213 N 2.24 4.13 0.00 3.82 1.01 0.11 -4.91 120.40 126.79 1qfl s VAL 213 Ca 0.28 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.01 1qfl s VAL 213 Cb -0.16 -2.88 0.00 0.00 0.00 0.00 0.00 36.38 33.35 1qfl s VAL 213 CO 0.09 0.42 0.46 -0.90 0.00 0.00 0.00 175.10 175.17 1qfl n ASP 214 N 4.26 0.00 -4.09 3.32 5.68 -1.26 0.74 116.55 125.20 1qfl n ASP 214 Ca -0.17 -1.03 -0.20 0.00 -0.50 0.00 0.00 54.79 52.89 1qfl n ASP 214 Cb 0.52 -0.01 -0.14 0.00 -1.14 0.00 0.00 41.12 40.35 1qfl n ASP 214 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1qfl s ALA 215 N 0.00 1.01 -0.29 2.12 0.00 -1.26 -4.86 121.76 118.48 1qfl s ALA 215 Ca 0.00 -0.61 -0.28 0.00 0.00 0.00 0.00 51.96 51.07 1qfl s ALA 215 Cb 0.00 -0.22 -0.03 0.00 0.00 0.00 0.00 23.12 22.88 1qfl s ALA 215 CO 0.00 0.22 1.92 -0.51 0.00 0.00 0.00 175.76 177.39 1qfl s ASP 216 N -0.58 5.78 0.39 0.00 1.01 -1.26 -4.63 116.67 117.38 1qfl s ASP 216 Ca 0.03 1.49 0.21 0.00 0.71 0.00 0.00 52.55 54.99 1qfl s ASP 216 Cb -0.06 -2.52 0.35 0.00 1.01 0.00 0.00 42.92 41.70 1qfl s ASP 216 CO 0.00 -1.77 1.59 1.05 0.21 0.00 0.00 175.17 176.26 1qfl h GLU 217 N 13.44 0.00 0.00 8.23 4.11 -1.86 -3.31 114.58 135.18 1qfl h GLU 217 Ca -0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.07 1qfl h GLU 217 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1qfl h GLU 217 CO 1.01 0.19 0.00 -0.92 0.07 0.00 0.00 179.01 179.36 1qfl h TYR 218 N 0.00 0.00 -3.90 2.06 3.20 -1.81 -3.45 116.97 113.07 1qfl h TYR 218 Ca -0.00 0.00 -0.52 0.00 3.14 0.00 0.00 58.73 61.34 1qfl h TYR 218 Cb 1.09 0.00 0.07 0.00 1.54 0.00 0.00 36.73 39.43 1qfl h TYR 218 CO 0.00 0.00 0.64 0.42 -1.64 0.00 0.00 178.16 177.58 1qfl s ILE 219 N -3.54 2.65 -0.21 1.81 1.01 -0.93 -4.78 121.20 117.21 1qfl s ILE 219 Ca 0.03 0.64 -0.05 0.00 0.00 0.00 0.00 60.65 61.27 1qfl s ILE 219 Cb 0.09 -3.40 -0.02 0.00 0.01 0.00 0.00 42.46 39.14 1qfl s ILE 219 CO 0.54 0.14 -0.01 0.00 0.00 0.00 0.00 174.94 175.61 1qfl s ARG 220 N -1.92 3.53 0.19 2.79 1.70 -1.26 -5.06 118.95 118.92 1qfl s ARG 220 Ca 0.51 -0.56 -0.30 0.00 -0.47 0.00 0.00 55.73 54.91 1qfl s ARG 220 Cb -0.40 -3.08 -0.08 0.00 -0.57 0.00 0.00 34.95 30.82 1qfl s ARG 220 CO 0.53 -0.10 1.16 -1.01 -1.08 0.00 0.00 175.30 174.80 1qfl s HIS 221 N 1.27 3.49 -1.26 5.89 3.76 -1.26 -3.62 115.29 123.55 1qfl s HIS 221 Ca 0.04 1.50 -0.02 0.00 -0.15 0.00 0.00 55.06 56.42 1qfl s HIS 221 Cb -0.15 -3.37 0.00 0.00 1.11 0.00 0.00 32.58 30.18 1qfl s HIS 221 CO 0.00 -0.97 0.27 0.41 -0.85 0.00 0.00 174.74 173.61 1qfl n GLY 222 N 2.09 -0.26 3.69 -2.22 0.00 -1.26 -4.95 105.19 102.29 1qfl n GLY 222 Ca 0.03 -0.14 -0.44 0.00 0.00 0.00 0.00 46.02 45.47 1qfl n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qfl n ALA 223 N -2.56 1.80 -2.64 4.61 0.00 -1.24 -4.98 120.51 115.50 1qfl n ALA 223 Ca -0.13 0.42 -0.29 0.00 0.00 0.00 0.00 53.44 53.44 1qfl n ALA 223 Cb 0.61 -2.39 -0.08 0.00 0.00 0.00 0.00 19.45 17.59 1qfl n ALA 223 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1qfl s THR 224 N 0.63 3.70 0.23 0.00 -4.23 -1.26 -4.96 115.64 109.74 1qfl s THR 224 Ca 0.74 -1.26 0.02 0.00 -1.18 0.00 0.00 61.69 60.01 1qfl s THR 224 Cb -0.61 -2.79 -0.02 0.00 1.34 0.00 0.00 72.50 70.42 1qfl s THR 224 CO 0.41 0.02 1.58 0.25 -0.54 0.00 0.00 174.62 176.34 1qfl h LEU 225 N 3.18 0.41 -0.58 4.79 5.85 -1.97 -2.79 115.31 124.21 1qfl h LEU 225 Ca -0.48 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.06 1qfl h LEU 225 Cb 1.18 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 42.06 1qfl h LEU 225 CO 0.57 0.86 0.36 0.44 -0.34 0.00 0.00 178.44 180.32 1qfl h ASP 226 N 0.30 0.58 -0.25 1.25 3.32 -1.98 -0.00 116.42 119.63 1qfl h ASP 226 Ca 0.01 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.95 1qfl h ASP 226 Cb 1.00 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.42 1qfl h ASP 226 CO 0.09 0.41 -0.23 0.77 -1.72 0.00 0.00 179.24 178.55 1qfl h SER 227 N 0.70 0.73 -0.41 6.45 4.64 -1.97 -2.94 113.55 120.75 1qfl h SER 227 Ca 0.23 -0.26 -0.01 0.00 -0.47 0.00 0.00 61.79 61.28 1qfl h SER 227 Cb 0.02 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 61.89 1qfl h SER 227 CO -0.10 0.94 0.22 -0.03 -0.87 0.00 0.00 176.83 176.99 1qfl h MET 228 N 0.63 0.58 0.00 4.77 -1.53 -1.10 -3.02 114.93 115.26 1qfl h MET 228 Ca 0.09 -0.07 0.00 0.00 -3.44 0.00 0.00 59.70 56.27 1qfl h MET 228 Cb 0.72 -0.11 0.00 0.00 -0.55 0.00 0.00 31.60 31.66 1qfl h MET 228 CO 0.06 0.48 0.00 0.00 0.14 0.00 0.00 176.91 177.59 1qfl n ALA 229 N -2.27 2.06 1.07 0.39 0.00 -0.08 -3.20 120.51 118.48 1qfl n ALA 229 Ca 0.00 -0.07 0.11 0.00 0.00 0.00 0.00 53.44 53.49 1qfl n ALA 229 Cb 0.09 -1.38 0.12 0.00 0.00 0.00 0.00 19.45 18.28 1qfl n ALA 229 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1qfl n LYS 230 N -1.58 0.61 -2.51 0.00 5.02 -1.12 -4.95 118.16 113.63 1qfl n LYS 230 Ca 0.05 -0.45 -0.35 0.00 -2.02 0.00 0.00 58.31 55.55 1qfl n LYS 230 Cb 0.28 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.77 1qfl n LYS 230 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1qfl s LEU 231 N -2.70 3.91 0.16 -0.35 1.43 -1.20 -5.04 118.68 114.89 1qfl s LEU 231 Ca 0.16 1.99 -0.08 0.00 -1.03 0.00 0.00 54.13 55.17 1qfl s LEU 231 Cb 0.18 -4.46 -0.06 0.00 0.03 0.00 0.00 46.19 41.87 1qfl s LEU 231 CO 0.65 -0.75 0.45 -0.13 0.23 0.00 0.00 176.35 176.80 1qfl s ARG 232 N -3.04 3.73 0.23 1.70 0.52 -1.26 -5.01 118.95 115.81 1qfl s ARG 232 Ca 0.65 0.12 -0.32 0.00 -0.52 0.00 0.00 55.73 55.67 1qfl s ARG 232 Cb -0.19 -2.81 -0.12 0.00 0.52 0.00 0.00 34.95 32.35 1qfl s ARG 232 CO 0.23 0.43 1.63 -2.30 0.02 0.00 0.00 175.30 175.31 1qfl n PRO 233 N 0.22 2.59 0.12 3.54 -0.02 -1.26 -4.54 135.00 135.64 1qfl n PRO 233 Ca -0.03 0.93 0.10 0.00 -2.02 0.00 0.00 63.50 62.49 1qfl n PRO 233 Cb 0.52 -2.73 0.02 0.00 -0.02 0.00 0.00 33.50 31.29 1qfl n PRO 233 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1qfl h ALA 234 N 5.78 0.60 0.00 3.55 0.00 -1.68 -3.43 119.26 124.08 1qfl h ALA 234 Ca -0.45 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 1qfl h ALA 234 Cb 1.22 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 1qfl h ALA 234 CO 0.88 0.10 -1.04 1.19 0.00 0.00 0.00 179.25 180.38 1qfl n PHE 235 N -2.78 0.00 -3.71 0.00 3.72 -1.26 -4.96 117.46 108.47 1qfl n PHE 235 Ca -0.00 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.02 1qfl n PHE 235 Cb 0.58 -0.03 -0.12 0.00 -0.94 0.00 0.00 39.48 38.97 1qfl n PHE 235 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1qfl s ASP 236 N -4.15 5.34 0.37 4.37 -1.08 -1.26 -4.95 116.67 115.31 1qfl s ASP 236 Ca -0.01 -0.44 0.14 0.00 -0.52 0.00 0.00 52.55 51.72 1qfl s ASP 236 Cb 0.00 -1.96 0.98 0.00 -1.46 0.00 0.00 42.92 40.49 1qfl s ASP 236 CO 0.02 -0.14 1.79 0.11 0.52 0.00 0.00 175.17 177.46 1qfl h LYS 237 N 8.29 0.50 -0.64 4.34 6.56 -1.93 0.45 116.57 134.13 1qfl h LYS 237 Ca -0.34 -0.03 -0.44 0.00 -1.06 0.00 0.00 60.65 58.78 1qfl h LYS 237 Cb 1.15 -0.11 -0.29 0.00 -0.57 0.00 0.00 32.23 32.41 1qfl h LYS 237 CO 0.60 0.33 -0.26 -0.85 -2.06 0.00 0.00 179.45 177.21 1qfl n GLU 238 N -4.66 2.81 -0.99 3.15 0.28 -1.26 -4.68 120.64 115.28 1qfl n GLU 238 Ca 0.24 -3.67 -0.11 0.00 -0.16 0.00 0.00 57.16 53.46 1qfl n GLU 238 Cb 0.75 -2.11 0.07 0.00 1.43 0.00 0.00 31.44 31.58 1qfl n GLU 238 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1qfl n GLY 239 N -0.89 -0.60 0.00 -1.84 0.00 0.16 -5.06 105.19 96.95 1qfl n GLY 239 Ca 0.43 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.66 1qfl n GLY 239 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1qfl n THR 240 N -2.48 0.00 -3.20 2.61 5.66 -1.26 -4.69 114.28 110.91 1qfl n THR 240 Ca 0.07 -0.24 -0.39 0.00 -3.05 0.00 0.00 64.05 60.44 1qfl n THR 240 Cb 0.24 0.74 -0.06 0.00 -1.55 0.00 0.00 70.33 69.71 1qfl n THR 240 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1qfl s VAL 241 N -1.38 4.98 0.42 1.08 1.01 -1.26 -4.81 120.40 120.44 1qfl s VAL 241 Ca 0.00 1.23 0.04 0.00 0.00 0.00 0.00 61.98 63.25 1qfl s VAL 241 Cb 0.00 -3.93 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 1qfl s VAL 241 CO 0.00 0.38 0.15 0.42 0.00 0.00 0.00 175.10 176.05 1qfl s THR 242 N 0.08 0.48 0.38 3.92 -4.23 -1.26 -1.77 115.64 113.24 1qfl s THR 242 Ca 0.31 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.95 1qfl s THR 242 Cb -0.18 -2.28 0.11 0.00 1.34 0.00 0.00 72.50 71.49 1qfl s THR 242 CO 0.16 0.00 1.85 0.00 -0.54 0.00 0.00 174.62 176.10 1qfl h ALA 243 N 1.73 1.44 0.00 3.99 0.00 -1.91 -2.20 119.26 122.31 1qfl h ALA 243 Ca -0.33 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.18 1qfl h ALA 243 Cb 1.28 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1qfl h ALA 243 CO 0.53 0.43 -0.40 0.78 0.00 0.00 0.00 179.25 180.58 1qfl h GLY 244 N 1.02 0.00 -1.33 0.00 0.00 -1.95 -3.26 103.07 97.55 1qfl h GLY 244 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1qfl h GLY 244 CO 0.04 0.00 0.00 1.16 0.00 0.00 0.00 176.54 177.74 1qfl n ASN 245 N -3.26 3.59 -4.46 0.19 0.23 -1.06 -4.85 115.26 105.64 1qfl n ASN 245 Ca 0.02 -2.97 -0.24 0.00 -0.53 0.00 0.00 54.58 50.86 1qfl n ASN 245 Cb 0.65 -0.51 -0.10 0.00 -2.08 0.00 0.00 39.78 37.74 1qfl n ASN 245 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1qfl s ALA 246 N -2.73 2.69 1.00 -2.53 0.00 -0.85 -0.55 121.76 118.79 1qfl s ALA 246 Ca 0.39 -1.84 -0.14 0.00 0.00 0.00 0.00 51.96 50.37 1qfl s ALA 246 Cb 0.32 -0.26 0.19 0.00 0.00 0.00 0.00 23.12 23.37 1qfl s ALA 246 CO 0.08 0.29 1.15 -1.54 0.00 0.00 0.00 175.76 175.74 1qfl s SER 247 N -3.38 2.70 0.58 0.00 1.04 0.65 -4.71 113.70 110.57 1qfl s SER 247 Ca 0.28 0.82 0.07 0.00 0.48 0.00 0.00 55.95 57.61 1qfl s SER 247 Cb -0.05 -1.27 0.07 0.00 0.10 0.00 0.00 66.02 64.87 1qfl s SER 247 CO 0.14 -3.04 0.58 -0.83 0.98 0.00 0.00 173.24 171.07 1qfl s GLY 248 N -4.02 2.12 -0.32 7.32 0.00 -1.26 -5.00 107.32 106.17 1qfl s GLY 248 Ca 0.67 -1.56 -0.14 0.00 0.00 0.00 0.00 44.72 43.69 1qfl s GLY 248 CO 0.55 -1.87 0.29 1.08 0.00 0.00 0.00 173.10 173.15 1qfl s LEU 249 N -4.47 4.33 0.21 0.66 1.43 -1.26 -3.72 118.68 115.86 1qfl s LEU 249 Ca 0.44 -0.18 -0.08 0.00 -1.03 0.00 0.00 54.13 53.29 1qfl s LEU 249 Cb -0.03 -2.24 -0.02 0.00 0.03 0.00 0.00 46.19 43.92 1qfl s LEU 249 CO 0.28 -0.23 0.31 0.20 0.23 0.00 0.00 176.35 177.15 1qfl s ASN 250 N 1.72 0.02 0.24 2.29 -0.87 -1.26 -2.21 114.94 114.88 1qfl s ASN 250 Ca 0.09 -1.09 0.10 0.00 -1.57 0.00 0.00 52.86 50.40 1qfl s ASN 250 Cb -0.17 0.48 -0.05 0.00 -0.02 0.00 0.00 41.25 41.50 1qfl s ASN 250 CO 0.11 -0.99 -0.12 -1.81 -2.57 0.00 0.00 177.10 171.72 1qfl s ASP 251 N -3.06 4.00 0.00 -1.22 1.01 -0.98 -3.51 116.67 112.91 1qfl s ASP 251 Ca 0.28 -0.78 0.00 0.00 0.71 0.00 0.00 52.55 52.75 1qfl s ASP 251 Cb 0.03 -0.55 0.00 0.00 1.01 0.00 0.00 42.92 43.41 1qfl s ASP 251 CO 0.09 0.06 0.00 0.61 0.21 0.00 0.00 175.17 176.13 1qfl n GLY 252 N -0.40 2.49 3.07 0.21 0.00 -1.00 -1.57 105.19 107.99 1qfl n GLY 252 Ca -0.08 -0.85 -0.12 0.00 0.00 0.00 0.00 46.02 44.97 1qfl n GLY 252 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qfl s ALA 253 N -2.00 -0.33 -0.06 4.61 0.00 -1.26 -1.72 121.76 120.99 1qfl s ALA 253 Ca 0.00 0.10 -0.16 0.00 0.00 0.00 0.00 51.96 51.90 1qfl s ALA 253 Cb 0.00 -0.05 0.03 0.00 0.00 0.00 0.00 23.12 23.11 1qfl s ALA 253 CO 0.00 -0.15 0.38 0.00 0.00 0.00 0.00 175.76 175.99 1qfl s ALA 254 N -0.74 -0.95 0.20 0.00 0.00 -0.24 -0.20 121.76 119.83 1qfl s ALA 254 Ca -0.08 0.70 -0.17 0.00 0.00 0.00 0.00 51.96 52.41 1qfl s ALA 254 Cb -0.05 -0.18 0.02 0.00 0.00 0.00 0.00 23.12 22.91 1qfl s ALA 254 CO 0.01 -0.25 0.51 0.00 0.00 0.00 0.00 175.76 176.03 1qfl s ALA 255 N -0.78 -0.83 0.03 0.00 0.00 0.21 -0.87 121.76 119.51 1qfl s ALA 255 Ca -0.09 -0.32 0.05 0.00 0.00 0.00 0.00 51.96 51.60 1qfl s ALA 255 Cb -0.04 0.87 -0.02 0.00 0.00 0.00 0.00 23.12 23.93 1qfl s ALA 255 CO 0.04 -0.81 -0.14 0.00 0.00 0.00 0.00 175.76 174.85 1qfl s ALA 256 N -3.89 1.15 -0.27 0.00 0.00 0.11 -1.69 121.76 117.16 1qfl s ALA 256 Ca 0.11 -0.79 -0.10 0.00 0.00 0.00 0.00 51.96 51.17 1qfl s ALA 256 Cb -0.01 -0.19 -0.05 0.00 0.00 0.00 0.00 23.12 22.87 1qfl s ALA 256 CO -0.01 0.22 0.17 -1.17 0.00 0.00 0.00 175.76 174.97 1qfl s LEU 257 N -1.04 3.90 0.04 0.00 0.20 0.13 -1.28 118.68 120.63 1qfl s LEU 257 Ca 0.02 -0.06 0.03 0.00 0.69 0.00 0.00 54.13 54.81 1qfl s LEU 257 Cb -0.07 -2.08 -0.04 0.00 -0.43 0.00 0.00 46.19 43.57 1qfl s LEU 257 CO 0.01 -0.05 0.00 -0.76 -0.29 0.00 0.00 176.35 175.26 1qfl s LEU 258 N 1.73 3.50 0.04 -0.68 2.01 0.39 -0.04 118.68 125.63 1qfl s LEU 258 Ca 0.07 -0.07 -0.27 0.00 0.01 0.00 0.00 54.13 53.86 1qfl s LEU 258 Cb -0.16 -2.10 0.09 0.00 0.01 0.00 0.00 46.19 44.04 1qfl s LEU 258 CO 0.09 0.24 0.84 0.00 1.01 0.00 0.00 176.35 178.53 1qfl s MET 259 N -1.86 0.95 0.90 1.70 0.23 -0.84 -2.31 119.30 118.08 1qfl s MET 259 Ca 0.22 -0.37 -0.11 0.00 -1.03 0.00 0.00 55.69 54.40 1qfl s MET 259 Cb -0.12 0.42 0.12 0.00 -1.53 0.00 0.00 34.83 33.73 1qfl s MET 259 CO 0.14 -0.42 1.07 -1.13 -2.03 0.00 0.00 175.02 172.65 1qfl n SER 260 N -0.29 0.17 -0.24 -1.18 3.41 -1.26 -1.25 113.62 112.98 1qfl n SER 260 Ca -0.10 0.44 -0.07 0.00 -0.26 0.00 0.00 58.87 58.88 1qfl n SER 260 Cb 0.62 -1.45 0.04 0.00 -0.26 0.00 0.00 64.21 63.16 1qfl n SER 260 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1qfl h GLU 261 N -1.70 1.03 -0.38 4.33 4.81 -0.66 -2.09 114.58 119.92 1qfl h GLU 261 Ca -0.44 -0.21 0.01 0.00 -0.13 0.00 0.00 59.36 58.59 1qfl h GLU 261 Cb 1.28 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.48 1qfl h GLU 261 CO 0.41 0.88 0.25 0.00 -0.73 0.00 0.00 179.01 179.82 1qfl h ALA 262 N 1.10 0.49 -0.43 2.92 0.00 -1.90 -0.91 119.26 120.53 1qfl h ALA 262 Ca 0.22 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.13 1qfl h ALA 262 Cb 0.26 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1qfl h ALA 262 CO -0.01 -0.06 0.25 1.49 0.00 0.00 0.00 179.25 180.91 1qfl h GLU 263 N 0.51 0.49 -0.63 0.00 4.57 -1.83 0.28 114.58 117.97 1qfl h GLU 263 Ca 0.14 -0.03 0.07 0.00 -1.18 0.00 0.00 59.36 58.36 1qfl h GLU 263 Cb -0.05 -0.11 -0.06 0.00 -0.16 0.00 0.00 28.75 28.37 1qfl h GLU 263 CO -0.04 0.32 0.32 0.00 -1.18 0.00 0.00 179.01 178.44 1qfl h ALA 264 N 1.20 0.84 -0.72 2.92 0.00 -1.11 -0.65 119.26 121.73 1qfl h ALA 264 Ca 0.17 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 1qfl h ALA 264 Cb 0.02 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1qfl h ALA 264 CO -0.09 -0.03 0.25 1.03 0.00 0.00 0.00 179.25 180.41 1qfl h SER 265 N 0.59 1.04 0.02 0.00 0.87 -0.01 -1.86 113.55 114.19 1qfl h SER 265 Ca 0.29 -0.20 -0.00 0.00 -1.23 0.00 0.00 61.79 60.65 1qfl h SER 265 Cb 0.24 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 61.92 1qfl h SER 265 CO -0.21 0.95 -0.02 0.03 -0.53 0.00 0.00 176.83 177.06 1qfl h ARG 266 N 1.06 0.00 -0.22 2.24 3.08 0.93 -2.17 114.38 119.30 1qfl h ARG 266 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1qfl h ARG 266 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.32 1qfl h ARG 266 CO -0.01 0.02 0.00 0.54 -1.07 0.00 0.00 179.97 179.45 1qfl n ARG 267 N -4.52 2.17 -2.30 0.04 1.74 -0.50 -4.96 116.66 108.33 1qfl n ARG 267 Ca -0.03 -1.75 -0.14 0.00 -0.77 0.00 0.00 57.85 55.16 1qfl n ARG 267 Cb 0.11 -1.47 -0.00 0.00 -1.02 0.00 0.00 32.46 30.08 1qfl n ARG 267 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1qfl n GLY 268 N 1.34 -0.21 3.88 -0.13 0.00 -0.80 -5.01 105.19 104.26 1qfl n GLY 268 Ca 0.17 -0.28 -0.33 0.00 0.00 0.00 0.00 46.02 45.57 1qfl n GLY 268 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qfl s ILE 269 N -2.72 5.13 -0.50 -0.61 1.01 -0.77 -5.05 121.20 117.69 1qfl s ILE 269 Ca 0.01 0.28 -0.10 0.00 0.00 0.00 0.00 60.65 60.84 1qfl s ILE 269 Cb -0.01 -3.63 0.12 0.00 0.01 0.00 0.00 42.46 38.96 1qfl s ILE 269 CO 0.02 0.19 0.39 -1.58 0.00 0.00 0.00 174.94 173.96 1qfl s GLN 270 N -2.19 2.59 0.61 2.79 -0.44 -1.26 -4.58 119.66 117.18 1qfl s GLN 270 Ca 0.36 -1.79 -0.19 0.00 -2.50 0.00 0.00 55.36 51.24 1qfl s GLN 270 Cb -0.13 -4.00 -0.03 0.00 -1.64 0.00 0.00 33.01 27.21 1qfl s GLN 270 CO 0.20 -1.22 1.23 -2.30 0.50 0.00 0.00 175.29 173.70 1qfl n PRO 271 N 4.92 1.19 0.24 1.67 -0.02 -1.26 -4.91 135.00 136.83 1qfl n PRO 271 Ca -0.08 0.46 0.13 0.00 -2.02 0.00 0.00 63.50 61.99 1qfl n PRO 271 Cb 0.41 -2.45 0.39 0.00 -0.02 0.00 0.00 33.50 31.83 1qfl n PRO 271 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1qfl h LEU 272 N 0.73 0.00 0.00 2.45 -0.00 -0.99 -3.43 115.31 114.07 1qfl h LEU 272 Ca -0.50 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.38 1qfl h LEU 272 Cb 1.34 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.00 1qfl h LEU 272 CO 0.53 0.06 0.00 0.61 -0.00 0.00 0.00 178.44 179.64 1qfl n GLY 273 N 0.59 1.82 3.74 0.83 0.00 -1.25 -4.64 105.19 106.28 1qfl n GLY 273 Ca 0.02 -1.05 -0.33 0.00 0.00 0.00 0.00 46.02 44.65 1qfl n GLY 273 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1qfl s ARG 274 N -2.00 2.99 -0.59 1.61 3.52 0.94 -1.31 118.95 124.11 1qfl s ARG 274 Ca 0.00 -0.49 -0.25 0.00 -0.13 0.00 0.00 55.73 54.87 1qfl s ARG 274 Cb 0.00 -2.81 0.04 0.00 -1.56 0.00 0.00 34.95 30.62 1qfl s ARG 274 CO 0.00 0.66 1.00 0.42 -0.81 0.00 0.00 175.30 176.57 1qfl s ILE 275 N -1.10 4.29 0.10 4.11 1.01 0.09 -1.51 121.20 128.19 1qfl s ILE 275 Ca 0.20 0.25 0.03 0.00 0.00 0.00 0.00 60.65 61.13 1qfl s ILE 275 Cb -0.12 -4.61 -0.24 0.00 0.01 0.00 0.00 42.46 37.50 1qfl s ILE 275 CO 0.10 -1.25 1.21 1.62 0.00 0.00 0.00 174.94 176.62 1qfl h VAL 276 N 6.03 1.61 -2.59 2.92 3.04 -1.17 -3.43 116.25 122.66 1qfl h VAL 276 Ca -0.27 -3.27 0.13 0.00 -1.01 0.00 0.00 66.70 62.28 1qfl h VAL 276 Cb 1.07 2.87 -0.03 0.00 -2.01 0.00 0.00 31.29 33.19 1qfl h VAL 276 CO 1.13 0.94 0.52 -0.94 -1.01 0.00 0.00 177.57 178.20 1qfl s SER 277 N -6.86 -0.02 0.06 3.17 1.04 -1.20 -4.72 113.70 105.18 1qfl s SER 277 Ca -0.01 -0.72 -0.26 0.00 0.48 0.00 0.00 55.95 55.43 1qfl s SER 277 Cb 0.09 0.56 0.09 0.00 0.10 0.00 0.00 66.02 66.86 1qfl s SER 277 CO 0.84 -1.11 0.78 -1.66 0.98 0.00 0.00 173.24 173.08 1qfl s TRP 278 N -2.35 -0.41 0.12 5.02 1.48 -1.26 -1.24 118.94 120.30 1qfl s TRP 278 Ca 0.19 0.24 -0.24 0.00 -1.06 0.00 0.00 56.10 55.23 1qfl s TRP 278 Cb -0.03 0.55 0.08 0.00 -1.16 0.00 0.00 33.47 32.91 1qfl s TRP 278 CO 0.06 -0.67 0.66 0.00 -4.06 0.00 0.00 176.95 172.94 1qfl s ALA 279 N -3.36 -1.65 -0.12 2.67 0.00 0.11 -4.71 121.76 114.69 1qfl s ALA 279 Ca 0.04 0.62 -0.07 0.00 0.00 0.00 0.00 51.96 52.55 1qfl s ALA 279 Cb -0.01 0.76 0.04 0.00 0.00 0.00 0.00 23.12 23.92 1qfl s ALA 279 CO -0.10 -0.74 0.29 -0.08 0.00 0.00 0.00 175.76 175.13 1qfl s THR 280 N -3.54 -0.03 -0.02 0.00 -1.32 -1.26 -0.06 115.64 109.41 1qfl s THR 280 Ca 0.01 0.10 -0.09 0.00 -1.21 0.00 0.00 61.69 60.50 1qfl s THR 280 Cb -0.01 -0.44 0.01 0.00 -1.51 0.00 0.00 72.50 70.55 1qfl s THR 280 CO -0.12 0.04 0.20 -0.69 -2.21 0.00 0.00 174.62 171.84 1qfl s VAL 281 N 1.02 0.06 0.20 5.08 1.01 -0.83 -4.97 120.40 121.97 1qfl s VAL 281 Ca -0.07 -0.46 -0.00 0.00 0.00 0.00 0.00 61.98 61.44 1qfl s VAL 281 Cb -0.08 -0.44 -0.04 0.00 0.00 0.00 0.00 36.38 35.82 1qfl s VAL 281 CO -0.07 -0.26 0.38 -0.83 0.00 0.00 0.00 175.10 174.33 1qfl s GLY 282 N -0.98 1.76 0.35 4.51 0.00 -1.26 0.75 107.32 112.45 1qfl s GLY 282 Ca -0.11 -0.86 0.02 0.00 0.00 0.00 0.00 44.72 43.77 1qfl s GLY 282 CO 0.02 -0.82 0.42 -1.34 0.00 0.00 0.00 173.10 171.37 1qfl s VAL 283 N -1.87 0.00 0.18 1.40 -7.23 -0.65 -4.91 120.40 107.32 1qfl s VAL 283 Ca 0.38 -1.74 -0.32 0.00 -1.81 0.00 0.00 61.98 58.49 1qfl s VAL 283 Cb -0.11 -2.62 -0.12 0.00 0.56 0.00 0.00 36.38 34.09 1qfl s VAL 283 CO 0.29 0.00 1.75 -0.67 -0.31 0.00 0.00 175.10 176.16 1qfl n ASP 284 N -1.58 3.97 -0.07 4.85 -0.08 -1.26 -4.32 116.55 118.06 1qfl n ASP 284 Ca 0.04 1.04 0.08 0.00 -1.51 0.00 0.00 54.79 54.44 1qfl n ASP 284 Cb 0.62 -1.56 0.44 0.00 2.34 0.00 0.00 41.12 42.96 1qfl n ASP 284 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1qfl h PRO 285 N 7.24 0.51 -1.01 -0.67 0.11 -1.86 -1.81 132.00 134.52 1qfl h PRO 285 Ca -0.44 -0.03 0.06 0.00 0.11 0.00 0.00 66.00 65.70 1qfl h PRO 285 Cb 1.21 -0.12 -0.07 0.00 0.11 0.00 0.00 31.00 32.14 1qfl h PRO 285 CO 0.95 0.34 0.65 0.87 -0.21 0.00 0.00 178.00 180.60 1qfl h LYS 286 N 0.53 1.17 -1.46 1.05 1.57 -1.92 -2.93 116.57 114.58 1qfl h LYS 286 Ca 0.24 -0.07 -0.61 0.00 -1.87 0.00 0.00 60.65 58.34 1qfl h LYS 286 Cb 0.27 -0.26 -0.40 0.00 0.08 0.00 0.00 32.23 31.92 1qfl h LYS 286 CO -0.07 0.77 -0.45 1.33 -0.57 0.00 0.00 179.45 180.47 1qfl n VAL 287 N -4.49 2.60 0.01 0.50 0.24 -0.72 -4.39 118.33 112.08 1qfl n VAL 287 Ca 0.15 -4.68 0.23 0.00 -2.04 0.00 0.00 64.34 57.99 1qfl n VAL 287 Cb 0.16 -1.24 0.72 0.00 -1.47 0.00 0.00 33.84 32.01 1qfl n VAL 287 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1qfl h MET 288 N 2.56 0.00 -0.10 7.34 -0.00 -1.27 -0.75 114.93 122.72 1qfl h MET 288 Ca 0.36 0.00 0.03 0.00 -0.00 0.00 0.00 59.70 60.09 1qfl h MET 288 Cb 0.88 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.48 1qfl h MET 288 CO 0.94 0.00 0.12 0.78 -0.00 0.00 0.00 176.91 178.75 1qfl h GLY 289 N 0.00 0.00 2.00 -3.00 0.00 -1.88 0.86 103.07 101.05 1qfl h GLY 289 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.60 1qfl h GLY 289 CO -0.00 0.00 0.00 -0.91 0.00 0.00 0.00 176.54 175.63 1qfl h THR 290 N 0.00 0.00 -0.10 4.70 1.35 -1.47 -3.39 112.91 114.01 1qfl h THR 290 Ca 0.05 -0.41 0.01 0.00 -0.55 0.00 0.00 66.41 65.51 1qfl h THR 290 Cb 0.28 1.29 -0.01 0.00 -1.73 0.00 0.00 68.15 67.98 1qfl h THR 290 CO -0.00 0.00 -0.06 0.61 -0.25 0.00 0.00 175.52 175.82 1qfl n GLY 291 N 0.63 -0.65 0.43 5.82 0.00 0.29 -0.25 105.19 111.46 1qfl n GLY 291 Ca 0.04 0.19 0.23 0.00 0.00 0.00 0.00 46.02 46.48 1qfl n GLY 291 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1qfl h PRO 292 N 0.00 0.00 0.91 1.61 0.11 -1.75 -3.14 132.00 129.73 1qfl h PRO 292 Ca 0.02 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.08 1qfl h PRO 292 Cb 0.04 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.16 1qfl h PRO 292 CO -0.09 0.00 -0.44 0.82 -0.21 0.00 0.00 178.00 178.08 1qfl h ILE 293 N 0.00 0.00 -0.50 4.15 2.04 -0.95 -0.81 117.51 121.44 1qfl h ILE 293 Ca 0.28 -0.10 -0.08 0.00 1.00 0.00 0.00 64.86 65.96 1qfl h ILE 293 Cb 1.59 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 1qfl h ILE 293 CO -0.00 0.00 -0.00 1.55 0.00 0.00 0.00 178.15 179.70 1qfl h PRO 294 N -1.32 0.84 -0.14 2.37 0.13 -1.74 -2.73 132.00 129.41 1qfl h PRO 294 Ca -0.12 -0.23 -0.08 0.00 -0.87 0.00 0.00 66.00 64.69 1qfl h PRO 294 Cb 0.94 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 31.97 1qfl h PRO 294 CO 0.21 0.84 -0.21 0.00 -0.23 0.00 0.00 178.00 178.61 1qfl h ALA 295 N 1.21 0.22 -0.02 -0.56 0.00 -1.58 -2.41 119.26 116.11 1qfl h ALA 295 Ca 0.15 -0.37 0.03 0.00 0.00 0.00 0.00 54.91 54.72 1qfl h ALA 295 Cb 0.47 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1qfl h ALA 295 CO 0.02 0.16 -0.15 0.77 0.00 0.00 0.00 179.25 180.06 1qfl h SER 296 N 0.00 -0.43 -0.15 0.00 0.02 -1.14 -0.10 113.55 111.75 1qfl h SER 296 Ca 0.01 0.07 0.05 0.00 -0.84 0.00 0.00 61.79 61.08 1qfl h SER 296 Cb 0.78 0.19 -0.06 0.00 0.14 0.00 0.00 62.40 63.44 1qfl h SER 296 CO 0.05 -0.20 -0.29 0.03 -1.14 0.00 0.00 176.83 175.28 1qfl h ARG 297 N -0.23 -0.34 -0.21 3.45 3.08 -1.55 0.20 114.38 118.78 1qfl h ARG 297 Ca 0.06 0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.19 1qfl h ARG 297 Cb 0.31 0.08 -0.07 0.00 0.08 0.00 0.00 29.97 30.37 1qfl h ARG 297 CO -0.16 -0.23 -0.26 -0.22 -1.07 0.00 0.00 179.97 178.04 1qfl h LYS 298 N -0.35 -0.27 -0.47 0.04 3.11 -1.18 0.33 116.57 117.77 1qfl h LYS 298 Ca 0.10 0.02 0.09 0.00 -2.81 0.00 0.00 60.65 58.05 1qfl h LYS 298 Cb 0.51 0.06 -0.07 0.00 -1.00 0.00 0.00 32.23 31.73 1qfl h LYS 298 CO -0.35 -0.18 0.03 0.00 -2.81 0.00 0.00 179.45 176.14 1qfl h ALA 299 N 0.70 0.47 -0.47 5.00 0.00 -0.02 0.60 119.26 125.54 1qfl h ALA 299 Ca 0.12 0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.18 1qfl h ALA 299 Cb 0.48 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 1qfl h ALA 299 CO -0.37 -0.37 0.29 -0.07 0.00 0.00 0.00 179.25 178.73 1qfl h LEU 300 N 0.14 0.48 -0.63 0.00 3.38 0.49 -0.63 115.31 118.54 1qfl h LEU 300 Ca 0.24 -0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.23 1qfl h LEU 300 Cb 0.34 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 1qfl h LEU 300 CO -0.37 0.34 0.39 -0.08 0.09 0.00 0.00 178.44 178.81 1qfl h GLU 301 N 0.58 0.75 0.00 1.13 4.81 0.67 -0.85 114.58 121.68 1qfl h GLU 301 Ca 0.19 -0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 59.27 1qfl h GLU 301 Cb -0.01 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 1qfl h GLU 301 CO -0.07 0.50 -0.48 0.00 -0.73 0.00 0.00 179.01 178.23 1qfl h ARG 302 N 0.78 0.00 0.00 1.92 3.08 -0.59 -2.90 114.38 116.66 1qfl h ARG 302 Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.30 1qfl h ARG 302 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1qfl h ARG 302 CO -0.09 0.48 -0.20 0.00 -1.07 0.00 0.00 179.97 179.08 1qfl h ALA 303 N 1.52 0.88 -0.25 0.04 0.00 -0.49 -3.47 119.26 117.49 1qfl h ALA 303 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1qfl h ALA 303 Cb 0.90 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 1qfl h ALA 303 CO 0.06 0.00 -0.05 0.41 0.00 0.00 0.00 179.25 179.68 1qfl n GLY 304 N 1.26 0.31 3.67 0.00 0.00 -0.44 -5.02 105.19 104.97 1qfl n GLY 304 Ca 0.04 -0.83 -0.23 0.00 0.00 0.00 0.00 46.02 45.00 1qfl n GLY 304 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1qfl s TRP 305 N -2.09 2.78 0.29 1.61 0.51 -0.53 -5.03 118.94 116.47 1qfl s TRP 305 Ca 0.00 -0.19 0.06 0.00 -2.12 0.00 0.00 56.10 53.85 1qfl s TRP 305 Cb 0.00 -1.25 -0.03 0.00 -0.81 0.00 0.00 33.47 31.38 1qfl s TRP 305 CO 0.00 0.59 0.33 0.15 -0.51 0.00 0.00 176.95 177.51 1qfl s LYS 306 N -3.56 3.06 0.22 4.98 1.02 -1.26 -4.37 119.74 119.82 1qfl s LYS 306 Ca 0.31 -1.03 -0.09 0.00 0.02 0.00 0.00 55.97 55.19 1qfl s LYS 306 Cb -0.07 -2.69 0.24 0.00 -0.52 0.00 0.00 37.83 34.79 1qfl s LYS 306 CO 0.20 0.25 1.84 0.82 -0.92 0.00 0.00 175.35 177.54 1qfl h ILE 307 N 1.21 1.04 0.00 2.17 2.04 -1.97 -1.57 117.51 120.43 1qfl h ILE 307 Ca -0.48 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.10 1qfl h ILE 307 Cb 1.24 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.46 1qfl h ILE 307 CO 0.58 0.15 0.00 0.61 0.00 0.00 0.00 178.15 179.49 1qfl n GLY 308 N -1.30 -0.98 0.13 5.37 0.00 -1.26 -2.46 105.19 104.69 1qfl n GLY 308 Ca 0.09 0.08 -0.01 0.00 0.00 0.00 0.00 46.02 46.18 1qfl n GLY 308 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1qfl h ASP 309 N 0.00 0.00 -2.57 1.61 3.32 -1.67 -3.45 116.42 113.67 1qfl h ASP 309 Ca 0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 1qfl h ASP 309 Cb 0.18 0.00 0.05 0.00 0.22 0.00 0.00 39.33 39.78 1qfl h ASP 309 CO 0.00 0.64 1.09 -0.76 -1.72 0.00 0.00 179.24 178.48 1qfl s LEU 310 N -7.17 4.39 -0.12 1.55 1.43 -1.03 -4.73 118.68 113.01 1qfl s LEU 310 Ca 0.00 2.81 0.11 0.00 -1.03 0.00 0.00 54.13 56.02 1qfl s LEU 310 Cb 0.11 -3.58 -0.24 0.00 0.03 0.00 0.00 46.19 42.52 1qfl s LEU 310 CO 0.76 -1.00 0.37 0.47 0.23 0.00 0.00 176.35 177.18 1qfl n ASP 311 N 5.12 0.85 -3.95 2.29 8.00 -0.03 -4.95 116.55 123.88 1qfl n ASP 311 Ca 0.17 0.22 -0.10 0.00 0.71 0.00 0.00 54.79 55.79 1qfl n ASP 311 Cb 0.37 0.14 -0.11 0.00 -0.02 0.00 0.00 41.12 41.49 1qfl n ASP 311 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1qfl s LEU 312 N -6.06 2.10 -0.02 0.64 2.96 -0.73 -4.85 118.68 112.72 1qfl s LEU 312 Ca -0.11 -0.38 -0.03 0.00 -0.22 0.00 0.00 54.13 53.40 1qfl s LEU 312 Cb 0.07 0.17 0.01 0.00 0.50 0.00 0.00 46.19 46.94 1qfl s LEU 312 CO 0.80 -0.26 0.07 -0.69 -1.32 0.00 0.00 176.35 174.95 1qfl s VAL 313 N -1.22 0.01 -0.29 1.68 1.01 0.31 -2.06 120.40 119.83 1qfl s VAL 313 Ca -0.13 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 61.76 1qfl s VAL 313 Cb -0.08 -0.14 0.08 0.00 0.00 0.00 0.00 36.38 36.24 1qfl s VAL 313 CO -0.01 -0.05 0.02 -1.61 0.00 0.00 0.00 175.10 173.45 1qfl s GLU 314 N -0.14 1.37 -0.29 2.72 0.41 0.07 -1.27 118.70 121.57 1qfl s GLU 314 Ca -0.02 -1.36 0.01 0.00 -0.41 0.00 0.00 54.97 53.19 1qfl s GLU 314 Cb -0.02 -2.68 0.06 0.00 -1.78 0.00 0.00 34.13 29.71 1qfl s GLU 314 CO 0.00 -0.82 -0.03 0.00 -0.49 0.00 0.00 175.26 173.92 1qfl s ALA 315 N 1.25 2.75 -0.21 5.21 0.00 -1.26 -1.21 121.76 128.29 1qfl s ALA 315 Ca 0.04 -1.89 -0.41 0.00 0.00 0.00 0.00 51.96 49.70 1qfl s ALA 315 Cb -0.19 -1.83 -0.19 0.00 0.00 0.00 0.00 23.12 20.91 1qfl s ALA 315 CO -0.12 -1.32 1.25 -1.71 0.00 0.00 0.00 175.76 173.87 1qfl n ASN 316 N 4.51 0.50 -3.92 0.00 5.15 -0.61 -4.88 115.26 116.00 1qfl n ASN 316 Ca -0.11 1.13 -0.43 0.00 -0.60 0.00 0.00 54.58 54.57 1qfl n ASN 316 Cb 0.43 -0.87 0.00 0.00 -0.53 0.00 0.00 39.78 38.81 1qfl n ASN 316 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1qfl n GLU 317 N 2.48 3.59 0.10 1.20 1.02 -1.26 -4.73 120.64 123.03 1qfl n GLU 317 Ca 0.24 -3.54 -0.13 0.00 -0.02 0.00 0.00 57.16 53.71 1qfl n GLU 317 Cb 0.02 -2.94 -0.08 0.00 -0.02 0.00 0.00 31.44 28.41 1qfl n GLU 317 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1qfl h ALA 318 N 5.87 -0.22 -2.85 0.62 0.00 -1.96 -3.25 119.26 117.47 1qfl h ALA 318 Ca 0.39 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 55.01 1qfl h ALA 318 Cb 0.65 0.09 -0.21 0.00 0.00 0.00 0.00 17.79 18.32 1qfl h ALA 318 CO 1.60 -0.51 -0.57 -0.06 0.00 0.00 0.00 179.25 179.70 1qfl s PHE 319 N -5.23 0.12 0.16 0.00 0.40 -1.26 -0.25 117.98 111.92 1qfl s PHE 319 Ca -0.15 -0.28 -0.15 0.00 -0.60 0.00 0.00 56.93 55.75 1qfl s PHE 319 Cb 0.03 -0.10 0.07 0.00 0.51 0.00 0.00 43.02 43.53 1qfl s PHE 319 CO 0.62 -0.25 1.78 0.00 0.70 0.00 0.00 175.22 178.08 1qfl h ALA 320 N 4.44 0.51 -0.39 5.36 0.00 -1.14 -2.08 119.26 125.95 1qfl h ALA 320 Ca -0.31 0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.69 1qfl h ALA 320 Cb 1.20 -0.07 -0.09 0.00 0.00 0.00 0.00 17.79 18.83 1qfl h ALA 320 CO 0.41 -0.14 -0.25 0.00 0.00 0.00 0.00 179.25 179.26 1qfl h ALA 321 N 1.21 -0.02 -0.45 0.00 0.00 -1.91 -1.25 119.26 116.83 1qfl h ALA 321 Ca 0.17 0.12 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 1qfl h ALA 321 Cb 0.07 0.57 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1qfl h ALA 321 CO -0.12 -0.63 -0.03 -0.56 0.00 0.00 0.00 179.25 177.91 1qfl h GLN 322 N -0.19 0.82 -0.07 0.00 -0.00 -1.77 -2.44 115.11 111.46 1qfl h GLN 322 Ca 0.19 -0.28 0.02 0.00 -0.00 0.00 0.00 58.65 58.58 1qfl h GLN 322 Cb 0.48 -0.07 -0.02 0.00 -0.00 0.00 0.00 27.48 27.87 1qfl h GLN 322 CO -0.50 0.89 -0.06 0.00 -0.00 0.00 0.00 178.83 179.16 1qfl h ALA 323 N 0.90 0.00 -0.63 0.06 0.00 -0.96 0.36 119.26 118.99 1qfl h ALA 323 Ca 0.12 0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.11 1qfl h ALA 323 Cb 0.54 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.40 1qfl h ALA 323 CO 0.03 -0.53 0.36 0.00 0.00 0.00 0.00 179.25 179.11 1qfl h ALA 325 N 1.31 1.22 0.67 0.00 0.00 -0.91 0.22 119.26 121.78 1qfl h ALA 325 Ca 0.27 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1qfl h ALA 325 Cb 0.13 -0.38 0.01 0.00 0.00 0.00 0.00 17.79 17.55 1qfl h ALA 325 CO -0.16 0.66 -0.32 0.28 0.00 0.00 0.00 179.25 179.72 1qfl h VAL 326 N 1.29 0.32 -0.91 0.00 2.07 -0.31 -2.02 116.25 116.70 1qfl h VAL 326 Ca 0.33 -0.08 -0.02 0.00 0.82 0.00 0.00 66.70 67.76 1qfl h VAL 326 Cb -0.05 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 30.03 1qfl h VAL 326 CO -0.06 0.01 0.50 0.78 0.02 0.00 0.00 177.57 178.82 1qfl h ASN 327 N -0.95 1.13 0.07 0.57 2.35 -1.12 -0.98 115.58 116.65 1qfl h ASN 327 Ca -0.09 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.56 1qfl h ASN 327 Cb 0.70 -0.29 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 1qfl h ASN 327 CO 0.15 0.90 -0.06 0.50 -1.65 0.00 0.00 177.43 177.26 1qfl h LYS 328 N 1.27 -0.14 0.03 0.81 3.64 -0.51 -0.11 116.57 121.55 1qfl h LYS 328 Ca 0.32 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.71 1qfl h LYS 328 Cb 0.02 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1qfl h LYS 328 CO -0.05 -0.10 -0.01 0.22 -2.27 0.00 0.00 179.45 177.24 1qfl h ASP 329 N -0.15 -0.03 -0.62 4.20 3.58 -1.22 -3.26 116.42 118.92 1qfl h ASP 329 Ca 0.00 -0.33 -0.07 0.00 0.42 0.00 0.00 57.03 57.05 1qfl h ASP 329 Cb 0.14 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.18 1qfl h ASP 329 CO -0.02 0.31 0.10 -0.07 -2.88 0.00 0.00 179.24 176.69 1qfl h LEU 330 N -0.38 0.98 0.00 2.28 3.38 -1.21 -3.47 115.31 116.89 1qfl h LEU 330 Ca -0.00 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1qfl h LEU 330 Cb 0.36 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1qfl h LEU 330 CO 0.01 0.99 0.00 0.61 0.09 0.00 0.00 178.44 180.14 1qfl n GLY 331 N -0.56 1.12 3.65 0.83 0.00 -0.06 -5.03 105.19 105.15 1qfl n GLY 331 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 1qfl n GLY 331 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1qfl n TRP 332 N -2.00 1.27 -1.65 1.61 2.14 -1.26 -4.83 117.44 112.71 1qfl n TRP 332 Ca 0.00 0.45 -0.43 0.00 2.07 0.00 0.00 57.50 59.59 1qfl n TRP 332 Cb 0.00 -2.21 -0.03 0.00 -0.81 0.00 0.00 31.31 28.26 1qfl n TRP 332 CO 0.00 0.00 0.00 -3.47 2.07 0.00 0.00 177.69 176.29 1qfl n ASP 333 N -0.79 3.98 -0.31 -0.67 2.03 -1.26 -4.88 116.55 114.65 1qfl n ASP 333 Ca 0.13 0.83 0.10 0.00 0.52 0.00 0.00 54.79 56.37 1qfl n ASP 333 Cb 0.46 -1.51 0.27 0.00 -0.72 0.00 0.00 41.12 39.62 1qfl n ASP 333 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1qfl h PRO 334 N 10.97 0.59 -0.03 -0.67 0.13 -1.95 -2.52 132.00 138.52 1qfl h PRO 334 Ca -0.49 -0.04 0.01 0.00 -0.87 0.00 0.00 66.00 64.62 1qfl h PRO 334 Cb 1.24 -0.13 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 1qfl h PRO 334 CO 0.94 0.39 0.21 0.66 -0.23 0.00 0.00 178.00 179.97 1qfl h SER 335 N 0.61 0.00 -0.47 1.44 4.64 -2.01 -1.55 113.55 116.21 1qfl h SER 335 Ca 0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 1qfl h SER 335 Cb 0.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1qfl h SER 335 CO -0.41 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 177.85 1qfl n ILE 336 N -3.07 2.13 -4.00 0.95 -5.35 -0.95 -4.70 119.36 104.37 1qfl n ILE 336 Ca -0.02 -1.45 -0.34 0.00 -0.27 0.00 0.00 62.75 60.68 1qfl n ILE 336 Cb 0.27 -0.06 -0.15 0.00 -1.74 0.00 0.00 39.64 37.97 1qfl n ILE 336 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1qfl s VAL 337 N -2.31 2.59 -1.25 7.28 1.01 -0.59 -0.53 120.40 126.60 1qfl s VAL 337 Ca 0.46 -1.33 -0.02 0.00 0.00 0.00 0.00 61.98 61.09 1qfl s VAL 337 Cb 0.33 -2.42 0.00 0.00 0.00 0.00 0.00 36.38 34.30 1qfl s VAL 337 CO 0.16 0.07 1.03 0.59 0.00 0.00 0.00 175.10 176.94 1qfl n ASN 338 N 4.57 -3.10 -0.30 3.32 4.13 -0.40 -4.88 115.26 118.60 1qfl n ASN 338 Ca -0.15 -0.62 0.17 0.00 1.68 0.00 0.00 54.58 55.66 1qfl n ASN 338 Cb 0.45 -5.01 0.43 0.00 -1.54 0.00 0.00 39.78 34.10 1qfl n ASN 338 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 1qfl h VAL 339 N -2.10 0.68 -0.73 2.41 2.07 -1.83 -0.54 116.25 116.22 1qfl h VAL 339 Ca -0.59 -0.20 -0.20 0.00 0.82 0.00 0.00 66.70 66.54 1qfl h VAL 339 Cb 1.35 0.06 -0.12 0.00 -1.52 0.00 0.00 31.29 31.06 1qfl h VAL 339 CO 0.52 0.10 0.25 0.59 0.02 0.00 0.00 177.57 179.06 1qfl n ASN 340 N -4.62 4.89 0.00 0.57 3.02 -1.26 -4.85 115.26 113.01 1qfl n ASN 340 Ca 0.21 -3.21 0.00 0.00 -0.03 0.00 0.00 54.58 51.55 1qfl n ASN 340 Cb 0.65 -0.74 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 1qfl n ASN 340 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1qfl n GLY 341 N -0.11 1.17 0.00 7.41 0.00 -0.21 -3.48 105.19 109.97 1qfl n GLY 341 Ca 0.40 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.51 1qfl n GLY 341 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qfl n GLY 342 N 1.48 4.56 0.30 -0.02 0.00 -1.26 -4.78 105.19 105.47 1qfl n GLY 342 Ca 0.00 -1.83 0.10 0.00 0.00 0.00 0.00 46.02 44.29 1qfl n GLY 342 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qfl h ALA 343 N 1.00 2.03 -0.25 4.61 0.00 -1.77 0.58 119.26 125.46 1qfl h ALA 343 Ca 0.00 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1qfl h ALA 343 Cb 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1qfl h ALA 343 CO 0.00 -0.08 0.04 0.82 0.00 0.00 0.00 179.25 180.04 1qfl h ILE 344 N 0.17 0.88 0.13 0.00 2.04 -1.83 0.21 117.51 119.10 1qfl h ILE 344 Ca 0.11 -0.05 -0.24 0.00 1.00 0.00 0.00 64.86 65.68 1qfl h ILE 344 Cb 0.23 0.73 0.01 0.00 -0.74 0.00 0.00 36.82 37.05 1qfl h ILE 344 CO -0.02 0.02 -1.18 0.00 0.00 0.00 0.00 178.15 176.98 1qfl h ALA 345 N 1.19 0.06 -0.24 1.87 0.00 -1.35 -3.39 119.26 117.41 1qfl h ALA 345 Ca 0.12 -0.93 -0.17 0.00 0.00 0.00 0.00 54.91 53.93 1qfl h ALA 345 Cb 0.12 0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1qfl h ALA 345 CO -0.16 0.65 -0.53 0.82 0.00 0.00 0.00 179.25 180.03 1qfl h ILE 346 N -0.33 1.30 0.00 0.00 2.04 0.07 -2.47 117.51 118.12 1qfl h ILE 346 Ca -0.24 -1.74 0.00 0.00 1.00 0.00 0.00 64.86 63.88 1qfl h ILE 346 Cb 1.72 1.68 0.00 0.00 -0.74 0.00 0.00 36.82 39.48 1qfl h ILE 346 CO 0.10 0.55 0.00 0.61 0.00 0.00 0.00 178.15 179.41 1qfl n GLY 347 N 0.26 2.89 2.30 5.37 0.00 0.72 -4.58 105.19 112.15 1qfl n GLY 347 Ca -0.03 -2.01 -0.21 0.00 0.00 0.00 0.00 46.02 43.76 1qfl n GLY 347 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1qfl n HIS 348 N -1.24 -0.93 -2.36 1.61 -0.00 -1.24 -4.33 115.22 106.73 1qfl n HIS 348 Ca 0.00 -3.22 -0.36 0.00 0.46 0.00 0.00 57.72 54.60 1qfl n HIS 348 Cb 0.00 0.02 -0.03 0.00 -0.12 0.00 0.00 29.99 29.85 1qfl n HIS 348 CO 0.00 0.00 0.00 -1.25 0.46 0.00 0.00 176.34 175.55 1qfl s PRO 349 N -0.80 3.24 0.00 1.57 0.04 -1.26 -4.33 135.00 133.46 1qfl s PRO 349 Ca 0.34 -1.12 -0.00 0.00 0.04 0.00 0.00 61.00 60.26 1qfl s PRO 349 Cb 0.18 -5.31 -0.00 0.00 0.04 0.00 0.00 34.50 29.41 1qfl s PRO 349 CO -0.14 -2.81 0.03 -0.89 0.04 0.00 0.00 177.00 173.23 1qfl n ILE 350 N 7.18 -0.00 0.32 0.56 5.41 -1.26 0.45 119.36 132.02 1qfl n ILE 350 Ca 0.40 0.04 0.15 0.00 1.00 0.00 0.00 62.75 64.34 1qfl n ILE 350 Cb 0.48 -0.05 0.65 0.00 -0.71 0.00 0.00 39.64 40.01 1qfl n ILE 350 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1qfl h GLY 351 N 0.00 0.00 0.00 7.39 0.00 -1.80 -3.03 103.07 105.64 1qfl h GLY 351 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 1qfl h GLY 351 CO -0.00 0.00 -1.88 0.00 0.00 0.00 0.00 176.54 174.66 1qfl n ALA 352 N -1.91 2.53 -0.32 3.60 0.00 0.17 -2.38 120.51 122.21 1qfl n ALA 352 Ca 0.01 -0.53 0.15 0.00 0.00 0.00 0.00 53.44 53.07 1qfl n ALA 352 Cb 0.21 -0.56 0.34 0.00 0.00 0.00 0.00 19.45 19.44 1qfl n ALA 352 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1qfl h SER 353 N 0.00 0.46 -0.46 0.00 0.02 -0.49 -0.68 113.55 112.40 1qfl h SER 353 Ca -0.06 0.15 -0.02 0.00 -0.84 0.00 0.00 61.79 61.02 1qfl h SER 353 Cb 1.00 0.10 -0.02 0.00 0.14 0.00 0.00 62.40 63.61 1qfl h SER 353 CO 0.00 0.03 0.23 1.23 -1.14 0.00 0.00 176.83 177.19 1qfl h GLY 354 N 0.46 0.75 1.57 -3.77 0.00 -1.84 -0.08 103.07 100.16 1qfl h GLY 354 Ca 0.59 -0.34 -0.06 0.00 0.00 0.00 0.00 47.33 47.52 1qfl h GLY 354 CO -0.51 0.33 -0.66 0.00 0.00 0.00 0.00 176.54 175.69 1qfl h ALA 355 N 1.56 0.72 0.14 3.60 0.00 -1.44 -3.00 119.26 120.84 1qfl h ALA 355 Ca 0.17 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1qfl h ALA 355 Cb 0.08 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1qfl h ALA 355 CO -0.02 0.37 -0.07 -0.09 0.00 0.00 0.00 179.25 179.44 1qfl h ARG 356 N 0.00 -0.18 0.00 0.00 1.12 0.17 -2.26 114.38 113.22 1qfl h ARG 356 Ca -0.03 0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.85 1qfl h ARG 356 Cb 1.23 0.04 0.00 0.00 -0.01 0.00 0.00 29.97 31.23 1qfl h ARG 356 CO 0.03 0.22 0.00 0.44 -3.11 0.00 0.00 179.97 177.55 1qfl n ILE 357 N -4.97 1.07 0.09 1.20 -5.35 -0.17 -1.68 119.36 109.54 1qfl n ILE 357 Ca -0.09 0.43 -0.23 0.00 -0.27 0.00 0.00 62.75 62.59 1qfl n ILE 357 Cb 0.25 -1.36 -0.15 0.00 -1.74 0.00 0.00 39.64 36.64 1qfl n ILE 357 CO 0.00 0.00 0.00 0.25 -1.76 0.00 0.00 176.55 175.04 1qfl h LEU 358 N 0.00 0.65 0.35 7.28 6.46 -1.35 -2.71 115.31 125.99 1qfl h LEU 358 Ca 0.00 -0.92 -0.00 0.00 -0.12 0.00 0.00 57.88 56.83 1qfl h LEU 358 Cb 0.19 -0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 39.87 1qfl h LEU 358 CO 0.00 1.65 -0.50 0.78 -0.62 0.00 0.00 178.44 179.75 1qfl h ASN 359 N -0.04 -1.43 -0.24 1.25 2.35 -0.73 0.53 115.58 117.27 1qfl h ASN 359 Ca -0.26 0.13 0.06 0.00 -0.55 0.00 0.00 56.30 55.68 1qfl h ASN 359 Cb 1.98 0.49 -0.06 0.00 0.05 0.00 0.00 38.32 40.78 1qfl h ASN 359 CO 0.20 -0.61 -0.14 0.74 -1.65 0.00 0.00 177.43 175.97 1qfl h THR 360 N -0.89 0.58 -0.63 2.81 2.02 -1.56 0.14 112.91 115.40 1qfl h THR 360 Ca -0.04 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.27 1qfl h THR 360 Cb 0.81 0.58 -0.10 0.00 -1.74 0.00 0.00 68.15 67.70 1qfl h THR 360 CO -0.14 0.00 0.06 0.25 0.37 0.00 0.00 175.52 176.06 1qfl h LEU 361 N -0.12 -0.15 -0.31 2.58 6.46 -1.10 -0.33 115.31 122.34 1qfl h LEU 361 Ca 0.13 0.14 -0.06 0.00 -0.12 0.00 0.00 57.88 57.97 1qfl h LEU 361 Cb 0.32 0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 40.46 1qfl h LEU 361 CO -0.32 -0.07 -0.04 -0.07 -0.62 0.00 0.00 178.44 177.32 1qfl h LEU 362 N 0.18 0.56 0.00 2.25 3.38 0.13 -1.62 115.31 120.19 1qfl h LEU 362 Ca 0.33 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1qfl h LEU 362 Cb 0.53 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1qfl h LEU 362 CO -0.49 0.77 -0.00 -0.26 0.09 0.00 0.00 178.44 178.55 1qfl h PHE 363 N 0.35 0.00 0.18 1.13 -1.00 -0.46 -2.70 116.94 114.43 1qfl h PHE 363 Ca 0.08 0.00 -0.24 0.00 2.81 0.00 0.00 57.97 60.62 1qfl h PHE 363 Cb 0.50 0.00 0.03 0.00 3.61 0.00 0.00 35.95 40.09 1qfl h PHE 363 CO 0.04 0.00 -1.07 1.49 -1.61 0.00 0.00 178.31 177.16 1qfl h GLU 364 N 0.00 0.38 -0.93 1.51 4.57 -1.04 -2.07 114.58 117.01 1qfl h GLU 364 Ca 0.00 -0.66 0.06 0.00 -1.18 0.00 0.00 59.36 57.58 1qfl h GLU 364 Cb 0.97 0.24 -0.06 0.00 -0.16 0.00 0.00 28.75 29.74 1qfl h GLU 364 CO 0.00 1.31 0.60 0.52 -1.18 0.00 0.00 179.01 180.27 1qfl h MET 365 N -0.19 1.05 -0.05 1.92 2.86 -1.31 0.12 114.93 119.33 1qfl h MET 365 Ca -0.19 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.32 1qfl h MET 365 Cb 1.83 -0.24 0.00 0.00 0.06 0.00 0.00 31.60 33.26 1qfl h MET 365 CO 0.19 0.70 -0.25 -0.22 1.06 0.00 0.00 176.91 178.39 1qfl h LYS 366 N 1.08 0.26 -0.74 1.72 3.64 -1.51 -0.93 116.57 120.09 1qfl h LYS 366 Ca 0.39 -0.21 -0.01 0.00 -1.27 0.00 0.00 60.65 59.55 1qfl h LYS 366 Cb 0.15 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.98 1qfl h LYS 366 CO -0.14 0.86 0.42 0.07 -2.27 0.00 0.00 179.45 178.39 1qfl h ARG 367 N -0.28 1.00 -0.43 1.90 0.11 -0.64 -2.73 114.38 113.32 1qfl h ARG 367 Ca -0.02 -0.10 0.00 0.00 0.10 0.00 0.00 59.98 59.97 1qfl h ARG 367 Cb 0.91 -0.21 0.00 0.00 1.11 0.00 0.00 29.97 31.78 1qfl h ARG 367 CO 0.05 0.72 0.00 2.89 0.10 0.00 0.00 179.97 183.73 1qfl n ARG 368 N -4.37 2.46 -3.17 0.08 1.85 0.35 -4.97 116.66 108.88 1qfl n ARG 368 Ca 0.08 -2.26 -0.23 0.00 -1.00 0.00 0.00 57.85 54.44 1qfl n ARG 368 Cb 0.08 -1.47 0.04 0.00 -1.05 0.00 0.00 32.46 30.06 1qfl n ARG 368 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1qfl n GLY 369 N 1.35 -0.53 3.81 2.89 0.00 -0.46 -4.98 105.19 107.28 1qfl n GLY 369 Ca 0.19 0.16 -0.34 0.00 0.00 0.00 0.00 46.02 46.03 1qfl n GLY 369 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qfl s ALA 370 N -3.20 3.06 -0.22 4.61 0.00 -0.59 -5.01 121.76 120.41 1qfl s ALA 370 Ca 0.37 0.42 -0.17 0.00 0.00 0.00 0.00 51.96 52.58 1qfl s ALA 370 Cb -0.17 -3.16 -0.14 0.00 0.00 0.00 0.00 23.12 19.66 1qfl s ALA 370 CO 0.46 0.13 -0.07 0.54 0.00 0.00 0.00 175.76 176.82 1qfl n ARG 371 N -0.48 0.56 -4.27 0.00 3.00 -1.26 -4.67 116.66 109.53 1qfl n ARG 371 Ca 0.06 0.44 -0.35 0.00 -0.01 0.00 0.00 57.85 57.99 1qfl n ARG 371 Cb 0.53 -1.63 -0.10 0.00 0.00 0.00 0.00 32.46 31.27 1qfl n ARG 371 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1qfl s LYS 372 N -2.44 3.37 0.09 5.56 1.02 -1.26 -0.23 119.74 125.85 1qfl s LYS 372 Ca -0.31 -0.40 -0.01 0.00 0.02 0.00 0.00 55.97 55.28 1qfl s LYS 372 Cb 0.08 -2.93 -0.04 0.00 -0.52 0.00 0.00 37.83 34.42 1qfl s LYS 372 CO 0.50 0.52 0.01 0.20 -0.92 0.00 0.00 175.35 175.65 1qfl s GLY 373 N -0.36 0.73 -0.11 -3.33 0.00 0.18 -0.85 107.32 103.58 1qfl s GLY 373 Ca 0.07 -1.34 -0.08 0.00 0.00 0.00 0.00 44.72 43.38 1qfl s GLY 373 CO 0.02 -1.35 0.28 -2.27 0.00 0.00 0.00 173.10 169.78 1qfl s LEU 374 N -2.99 0.59 0.00 0.66 0.20 -0.88 -1.18 118.68 115.08 1qfl s LEU 374 Ca 0.15 0.58 0.05 0.00 0.69 0.00 0.00 54.13 55.60 1qfl s LEU 374 Cb 0.08 0.90 -0.03 0.00 -0.43 0.00 0.00 46.19 46.71 1qfl s LEU 374 CO -0.04 -0.14 -0.13 0.00 -0.29 0.00 0.00 176.35 175.75 1qfl s ALA 375 N 0.79 2.76 -0.09 5.97 0.00 -0.72 -0.75 121.76 129.71 1qfl s ALA 375 Ca -0.05 -1.07 -0.21 0.00 0.00 0.00 0.00 51.96 50.62 1qfl s ALA 375 Cb -0.06 -0.93 0.05 0.00 0.00 0.00 0.00 23.12 22.17 1qfl s ALA 375 CO -0.05 0.58 0.51 -0.08 0.00 0.00 0.00 175.76 176.72 1qfl s THR 376 N -0.90 0.02 0.05 0.00 -1.32 -0.35 -1.86 115.64 111.29 1qfl s THR 376 Ca 0.15 -0.15 0.01 0.00 -1.21 0.00 0.00 61.69 60.49 1qfl s THR 376 Cb -0.11 -0.79 -0.03 0.00 -1.51 0.00 0.00 72.50 70.07 1qfl s THR 376 CO 0.05 -0.08 -0.06 -0.76 -2.21 0.00 0.00 174.62 171.56 1qfl s LEU 377 N -0.69 2.34 0.23 9.08 1.02 -0.82 -1.58 118.68 128.27 1qfl s LEU 377 Ca -0.08 -0.70 -0.07 0.00 0.02 0.00 0.00 54.13 53.30 1qfl s LEU 377 Cb -0.03 -0.03 -0.06 0.00 0.02 0.00 0.00 46.19 46.09 1qfl s LEU 377 CO 0.05 -0.34 0.51 0.00 0.02 0.00 0.00 176.35 176.59 1qfl s ILE 379 N -1.88 0.96 0.63 0.00 1.01 0.19 -4.51 121.20 117.61 1qfl s ILE 379 Ca 0.45 -0.49 -0.18 0.00 0.00 0.00 0.00 60.65 60.42 1qfl s ILE 379 Cb -0.11 -0.82 -0.02 0.00 0.01 0.00 0.00 42.46 41.52 1qfl s ILE 379 CO 0.25 0.28 1.30 -0.83 0.00 0.00 0.00 174.94 175.94 1qfl s GLY 380 N -0.10 2.86 0.00 6.18 0.00 -1.26 -1.94 107.32 113.05 1qfl s GLY 380 Ca 0.01 1.22 0.00 0.00 0.00 0.00 0.00 44.72 45.95 1qfl s GLY 380 CO 0.00 1.65 0.00 0.61 0.00 0.00 0.00 173.10 175.36 1qfl n GLY 381 N 0.86 0.73 1.23 0.20 0.00 -1.26 -4.50 105.19 102.45 1qfl n GLY 381 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1qfl n GLY 381 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qfl n GLY 382 N -2.00 -0.41 3.38 -0.02 0.00 -1.14 -4.11 105.19 100.89 1qfl n GLY 382 Ca 0.00 -0.21 -0.13 0.00 0.00 0.00 0.00 46.02 45.68 1qfl n GLY 382 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1qfl s MET 383 N -1.13 1.06 0.04 1.61 1.00 -0.82 -1.63 119.30 119.42 1qfl s MET 383 Ca 0.00 -0.35 0.02 0.00 0.00 0.00 0.00 55.69 55.36 1qfl s MET 383 Cb 0.00 0.48 -0.02 0.00 0.00 0.00 0.00 34.83 35.29 1qfl s MET 383 CO 0.00 -0.40 -0.07 0.20 0.00 0.00 0.00 175.02 174.75 1qfl s GLY 384 N -2.20 0.45 0.01 -0.03 0.00 0.23 0.57 107.32 106.34 1qfl s GLY 384 Ca -0.03 -0.70 0.04 0.00 0.00 0.00 0.00 44.72 44.03 1qfl s GLY 384 CO -0.05 -0.74 -0.13 0.54 0.00 0.00 0.00 173.10 172.71 1qfl s VAL 385 N -1.29 1.06 -0.02 1.40 0.11 -0.85 -1.96 120.40 118.86 1qfl s VAL 385 Ca -0.10 -0.71 -0.08 0.00 -2.93 0.00 0.00 61.98 58.16 1qfl s VAL 385 Cb -0.09 -0.91 0.01 0.00 -1.53 0.00 0.00 36.38 33.85 1qfl s VAL 385 CO 0.00 0.19 0.17 0.00 -3.33 0.00 0.00 175.10 172.14 1qfl s ALA 386 N -0.50 -0.42 -0.02 1.54 0.00 0.92 -1.94 121.76 121.34 1qfl s ALA 386 Ca 0.04 0.08 -0.01 0.00 0.00 0.00 0.00 51.96 52.06 1qfl s ALA 386 Cb -0.06 0.01 0.02 0.00 0.00 0.00 0.00 23.12 23.09 1qfl s ALA 386 CO 0.00 -0.19 0.05 1.41 0.00 0.00 0.00 175.76 177.03 1qfl s MET 387 N -1.06 0.03 -0.18 0.00 1.75 -0.77 0.04 119.30 119.09 1qfl s MET 387 Ca -0.11 0.14 -0.06 0.00 -1.25 0.00 0.00 55.69 54.41 1qfl s MET 387 Cb -0.06 -0.09 -0.03 0.00 2.84 0.00 0.00 34.83 37.49 1qfl s MET 387 CO 0.02 -0.08 0.03 0.00 -0.65 0.00 0.00 175.02 174.34 1qfl s ILE 389 N 0.57 1.93 -0.05 0.00 -1.09 -0.33 -0.60 121.20 121.64 1qfl s ILE 389 Ca 0.01 -1.02 0.05 0.00 -2.23 0.00 0.00 60.65 57.46 1qfl s ILE 389 Cb -0.13 -1.62 -0.01 0.00 -1.58 0.00 0.00 42.46 39.12 1qfl s ILE 389 CO 0.02 0.54 -0.19 -0.70 -1.23 0.00 0.00 174.94 173.38 1qfl s GLU 390 N -0.34 1.96 0.85 2.79 2.12 -0.57 -0.65 118.70 124.86 1qfl s GLU 390 Ca 0.03 -0.68 -0.12 0.00 0.36 0.00 0.00 54.97 54.56 1qfl s GLU 390 Cb -0.11 -1.69 0.10 0.00 0.26 0.00 0.00 34.13 32.68 1qfl s GLU 390 CO 0.01 0.28 1.12 -1.54 -0.54 0.00 0.00 175.26 174.59 1qfl s SER 391 N -0.01 4.08 0.00 -1.70 1.04 0.69 -0.04 113.70 117.75 1qfl s SER 391 Ca -0.04 1.09 0.00 0.00 0.48 0.00 0.00 55.95 57.48 1qfl s SER 391 Cb -0.12 -1.73 0.00 0.00 0.10 0.00 0.00 66.02 64.27 1qfl s SER 391 CO 0.03 -2.20 0.24 0.18 0.98 0.00 0.00 173.24 172.46