#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a4e s VAL 16 N 0.00 4.16 0.28 2.53 1.01 -1.26 -4.97 120.40 122.15 1a4e s VAL 16 Ca 0.00 1.43 -0.30 0.00 0.00 0.00 0.00 61.98 63.11 1a4e s VAL 16 Cb 0.00 -3.92 -0.11 0.00 0.00 0.00 0.00 36.38 32.35 1a4e s VAL 16 CO 0.00 -0.09 1.57 0.00 0.00 0.00 0.00 175.10 176.58 1a4e s ARG 17 N 3.17 4.15 0.28 2.72 1.70 -1.26 -4.93 118.95 124.78 1a4e s ARG 17 Ca 0.58 2.52 0.01 0.00 -0.47 0.00 0.00 55.73 58.37 1a4e s ARG 17 Cb -0.24 -3.04 0.55 0.00 -0.57 0.00 0.00 34.95 31.64 1a4e s ARG 17 CO 0.19 -0.59 1.84 0.93 -1.08 0.00 0.00 175.30 176.58 1a4e h GLU 18 N 4.96 0.96 0.00 3.89 5.08 -2.01 -1.60 114.58 125.86 1a4e h GLU 18 Ca -0.47 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 1a4e h GLU 18 Cb 1.22 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.25 1a4e h GLU 18 CO 0.80 0.64 0.00 -0.40 -1.00 0.00 0.00 179.01 179.04 1a4e n ASP 19 N -4.62 0.00 -3.15 1.42 5.75 -1.26 -4.93 116.55 109.76 1a4e n ASP 19 Ca 0.19 0.42 -0.22 0.00 -0.01 0.00 0.00 54.79 55.17 1a4e n ASP 19 Cb 0.35 -0.47 0.01 0.00 -1.03 0.00 0.00 41.12 39.97 1a4e n ASP 19 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1a4e n ARG 20 N -1.47 -3.61 -2.18 0.11 1.74 -0.60 -4.94 116.66 105.70 1a4e n ARG 20 Ca 0.07 0.60 -0.42 0.00 -0.77 0.00 0.00 57.85 57.32 1a4e n ARG 20 Cb 0.27 -5.33 -0.03 0.00 -1.02 0.00 0.00 32.46 26.35 1a4e n ARG 20 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1a4e s VAL 21 N -2.95 3.83 -0.18 1.55 1.01 -1.26 -4.98 120.40 117.42 1a4e s VAL 21 Ca 0.32 1.05 -0.29 0.00 0.00 0.00 0.00 61.98 63.07 1a4e s VAL 21 Cb -0.16 -3.68 -0.00 0.00 0.00 0.00 0.00 36.38 32.54 1a4e s VAL 21 CO 0.40 -0.08 1.00 -0.69 0.00 0.00 0.00 175.10 175.73 1a4e s VAL 22 N 3.55 4.74 0.44 2.92 1.01 -1.26 -5.02 120.40 126.79 1a4e s VAL 22 Ca 0.65 1.99 0.04 0.00 0.00 0.00 0.00 61.98 64.66 1a4e s VAL 22 Cb -0.29 -4.29 -0.05 0.00 0.00 0.00 0.00 36.38 31.75 1a4e s VAL 22 CO 0.24 -0.09 0.02 0.42 0.00 0.00 0.00 175.10 175.69 1a4e s THR 23 N 2.63 1.56 0.33 3.92 -4.23 -1.26 -1.55 115.64 117.03 1a4e s THR 23 Ca 0.45 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.93 1a4e s THR 23 Cb -0.16 -2.63 0.07 0.00 1.34 0.00 0.00 72.50 71.11 1a4e s THR 23 CO 0.11 0.00 0.45 -0.46 -0.54 0.00 0.00 174.62 174.19 1a4e n ASN 24 N -1.08 0.34 -0.11 3.99 0.23 -0.40 -4.84 115.26 113.39 1a4e n ASN 24 Ca -0.10 -1.35 0.16 0.00 -0.53 0.00 0.00 54.58 52.75 1a4e n ASN 24 Cb 0.67 -0.32 0.54 0.00 -2.08 0.00 0.00 39.78 38.60 1a4e n ASN 24 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1a4e h SER 25 N -0.42 0.30 -0.85 0.53 0.02 -1.95 -2.21 113.55 108.96 1a4e h SER 25 Ca -0.15 0.01 -0.36 0.00 -0.84 0.00 0.00 61.79 60.45 1a4e h SER 25 Cb 0.48 -0.05 -0.22 0.00 0.14 0.00 0.00 62.40 62.76 1a4e h SER 25 CO 0.13 0.16 0.45 0.35 -1.14 0.00 0.00 176.83 176.78 1a4e n THR 26 N -4.45 3.06 -1.04 -2.27 -2.24 -1.26 -4.92 114.28 101.15 1a4e n THR 26 Ca 0.12 -1.83 -0.01 0.00 -2.27 0.00 0.00 64.05 60.06 1a4e n THR 26 Cb 0.51 -0.41 -0.01 0.00 -2.10 0.00 0.00 70.33 68.32 1a4e n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1a4e n GLY 27 N -0.68 0.39 3.71 3.38 0.00 -0.83 -5.01 105.19 106.15 1a4e n GLY 27 Ca 0.50 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 46.02 1a4e n GLY 27 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1a4e s ASN 28 N -2.13 7.25 0.27 1.61 0.02 -1.26 -4.78 114.94 115.92 1a4e s ASN 28 Ca 0.00 1.51 -0.29 0.00 -1.02 0.00 0.00 52.86 53.05 1a4e s ASN 28 Cb 0.00 -2.52 -0.10 0.00 0.02 0.00 0.00 41.25 38.65 1a4e s ASN 28 CO 0.00 -0.22 1.31 -2.84 0.02 0.00 0.00 177.10 175.37 1a4e s PRO 29 N 0.97 4.38 -0.22 -0.60 0.02 -1.26 -1.27 135.00 137.01 1a4e s PRO 29 Ca 0.47 2.14 -0.14 0.00 0.02 0.00 0.00 61.00 63.49 1a4e s PRO 29 Cb -0.20 -3.13 -0.04 0.00 0.02 0.00 0.00 34.50 31.15 1a4e s PRO 29 CO 0.25 -0.21 0.33 0.42 -0.33 0.00 0.00 177.00 177.46 1a4e s ILE 30 N -0.54 5.24 0.13 2.83 1.01 -0.60 -4.89 121.20 124.37 1a4e s ILE 30 Ca 0.53 0.56 -0.24 0.00 0.00 0.00 0.00 60.65 61.49 1a4e s ILE 30 Cb -0.38 -3.67 -0.04 0.00 0.01 0.00 0.00 42.46 38.38 1a4e s ILE 30 CO 0.45 0.27 1.65 0.78 0.00 0.00 0.00 174.94 178.09 1a4e h ASN 31 N 7.49 -0.64 -3.47 3.58 -0.26 -1.95 -3.45 115.58 116.88 1a4e h ASN 31 Ca -0.36 0.10 -0.25 0.00 -0.56 0.00 0.00 56.30 55.22 1a4e h ASN 31 Cb 1.16 0.27 -0.32 0.00 -1.06 0.00 0.00 38.32 38.38 1a4e h ASN 31 CO 0.69 -0.28 -0.62 -0.70 -1.06 0.00 0.00 177.43 175.47 1a4e s GLU 32 N -6.10 0.07 0.42 0.81 -6.30 -1.26 -5.09 118.70 101.26 1a4e s GLU 32 Ca -0.15 0.32 0.14 0.00 -2.50 0.00 0.00 54.97 52.78 1a4e s GLU 32 Cb 0.09 -0.17 1.01 0.00 0.00 0.00 0.00 34.13 35.06 1a4e s GLU 32 CO 0.67 -0.16 1.95 -1.00 0.02 0.00 0.00 175.26 176.74 1a4e h PRO 33 N 7.16 0.43 -0.01 4.30 0.13 -2.00 -3.24 132.00 138.77 1a4e h PRO 33 Ca -0.42 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1a4e h PRO 33 Cb 1.14 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1a4e h PRO 33 CO 0.43 0.29 0.00 1.19 -0.23 0.00 0.00 178.00 179.68 1a4e n PHE 34 N -4.48 0.01 -2.01 1.56 3.72 -1.26 -5.05 117.46 109.96 1a4e n PHE 34 Ca 0.12 -0.15 -0.41 0.00 -0.05 0.00 0.00 57.45 56.95 1a4e n PHE 34 Cb 0.42 -0.02 -0.02 0.00 -0.94 0.00 0.00 39.48 38.92 1a4e n PHE 34 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 1a4e s VAL 35 N -0.35 2.63 -0.02 -4.37 -7.23 -1.23 -5.03 120.40 104.81 1a4e s VAL 35 Ca 0.01 0.54 0.04 0.00 -1.81 0.00 0.00 61.98 60.76 1a4e s VAL 35 Cb 0.01 -3.34 -0.01 0.00 0.56 0.00 0.00 36.38 33.60 1a4e s VAL 35 CO 0.01 0.09 -0.14 0.42 -0.31 0.00 0.00 175.10 175.17 1a4e s THR 36 N -0.09 1.12 0.20 5.32 -4.23 -1.26 -4.93 115.64 111.76 1a4e s THR 36 Ca 0.59 -0.58 -0.30 0.00 -1.18 0.00 0.00 61.69 60.22 1a4e s THR 36 Cb -0.42 -0.95 -0.08 0.00 1.34 0.00 0.00 72.50 72.39 1a4e s THR 36 CO 0.44 0.32 1.09 -1.10 -0.54 0.00 0.00 174.62 174.84 1a4e s GLN 37 N -0.14 4.62 0.22 3.99 -0.21 -1.26 -5.03 119.66 121.84 1a4e s GLN 37 Ca 0.02 1.72 -0.12 0.00 0.02 0.00 0.00 55.36 56.99 1a4e s GLN 37 Cb -0.08 -3.27 -0.00 0.00 1.00 0.00 0.00 33.01 30.67 1a4e s GLN 37 CO 0.00 0.12 0.42 -0.98 -2.12 0.00 0.00 175.29 172.73 1a4e s ARG 38 N -0.57 1.40 -0.17 2.91 1.70 -1.26 -1.72 118.95 121.24 1a4e s ARG 38 Ca 0.48 -1.20 -0.26 0.00 -0.47 0.00 0.00 55.73 54.29 1a4e s ARG 38 Cb -0.30 0.44 -0.01 0.00 -0.57 0.00 0.00 34.95 34.52 1a4e s ARG 38 CO 0.36 -0.56 0.87 0.42 -1.08 0.00 0.00 175.30 175.30 1a4e s ILE 39 N -3.99 4.85 0.00 4.99 -1.09 -1.06 -4.82 121.20 120.07 1a4e s ILE 39 Ca 0.20 1.71 0.00 0.00 -2.23 0.00 0.00 60.65 60.33 1a4e s ILE 39 Cb 0.01 -4.17 0.00 0.00 -1.58 0.00 0.00 42.46 36.72 1a4e s ILE 39 CO 0.05 0.00 0.00 0.61 -1.23 0.00 0.00 174.94 174.38 1a4e n GLY 40 N 3.42 0.29 0.10 6.18 0.00 -1.26 -1.12 105.19 112.80 1a4e n GLY 40 Ca 0.06 -0.92 0.01 0.00 0.00 0.00 0.00 46.02 45.17 1a4e n GLY 40 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1a4e h GLU 41 N 0.00 0.00 0.00 1.61 5.08 -2.02 -3.40 114.58 115.85 1a4e h GLU 41 Ca 0.00 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.29 1a4e h GLU 41 Cb 0.00 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.10 1a4e h GLU 41 CO 0.00 0.30 -0.65 0.72 -1.00 0.00 0.00 179.01 178.38 1a4e n HIS 42 N -2.93 0.00 -1.78 4.33 8.25 -1.26 -5.02 115.22 116.82 1a4e n HIS 42 Ca -0.07 -0.56 0.00 0.00 -0.26 0.00 0.00 57.72 56.83 1a4e n HIS 42 Cb 0.80 -0.13 0.00 0.00 1.12 0.00 0.00 29.99 31.78 1a4e n HIS 42 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1a4e n GLY 43 N -0.16 0.10 3.77 -1.41 0.00 -0.28 -5.02 105.19 102.18 1a4e n GLY 43 Ca 0.07 -1.85 -0.35 0.00 0.00 0.00 0.00 46.02 43.89 1a4e n GLY 43 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1a4e s PRO 44 N -2.51 3.16 0.41 1.61 0.02 -1.26 -4.44 135.00 131.98 1a4e s PRO 44 Ca 0.00 1.68 -0.24 0.00 0.02 0.00 0.00 61.00 62.46 1a4e s PRO 44 Cb 0.00 -1.97 -0.08 0.00 0.02 0.00 0.00 34.50 32.47 1a4e s PRO 44 CO 0.00 -1.02 1.12 -1.17 -0.33 0.00 0.00 177.00 175.60 1a4e s LEU 45 N -3.99 4.15 -0.05 -5.54 2.96 -1.26 -2.57 118.68 112.38 1a4e s LEU 45 Ca 0.74 2.22 -0.04 0.00 -0.22 0.00 0.00 54.13 56.84 1a4e s LEU 45 Cb -0.26 -4.11 -0.04 0.00 0.50 0.00 0.00 46.19 42.28 1a4e s LEU 45 CO 0.30 -0.63 0.16 -0.76 -1.32 0.00 0.00 176.35 174.10 1a4e s LEU 46 N -2.61 4.32 0.45 -0.68 1.43 -0.70 -4.95 118.68 115.95 1a4e s LEU 46 Ca 0.58 0.36 0.17 0.00 -1.03 0.00 0.00 54.13 54.21 1a4e s LEU 46 Cb -0.27 -2.39 1.06 0.00 0.03 0.00 0.00 46.19 44.62 1a4e s LEU 46 CO 0.34 0.31 1.99 0.25 0.23 0.00 0.00 176.35 179.47 1a4e h LEU 47 N 4.24 0.00 0.00 1.79 6.46 -1.96 -2.81 115.31 123.03 1a4e h LEU 47 Ca -0.51 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.25 1a4e h LEU 47 Cb 1.20 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.13 1a4e h LEU 47 CO 0.65 0.19 0.00 0.00 -0.62 0.00 0.00 178.44 178.66 1a4e n GLN 48 N -4.15 0.44 -2.84 1.25 10.64 -1.26 -4.31 117.38 117.14 1a4e n GLN 48 Ca -0.02 0.03 -0.43 0.00 -1.83 0.00 0.00 57.00 54.74 1a4e n GLN 48 Cb 0.26 -1.50 -0.02 0.00 -0.86 0.00 0.00 30.24 28.13 1a4e n GLN 48 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1a4e s ASP 49 N -2.13 6.77 0.44 2.61 -1.08 -1.06 -4.77 116.67 117.45 1a4e s ASP 49 Ca 0.22 -2.30 0.24 0.00 -0.52 0.00 0.00 52.55 50.19 1a4e s ASP 49 Cb 0.11 -2.45 0.82 0.00 -1.46 0.00 0.00 42.92 39.95 1a4e s ASP 49 CO 0.20 -1.04 1.78 0.10 0.52 0.00 0.00 175.17 176.73 1a4e h TYR 50 N 8.31 0.00 -0.09 -5.34 -0.00 -1.90 -2.98 116.97 114.97 1a4e h TYR 50 Ca 0.25 0.00 -0.14 0.00 0.00 0.00 0.00 58.73 58.84 1a4e h TYR 50 Cb 0.96 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.68 1a4e h TYR 50 CO 1.19 0.21 -0.56 -0.91 -0.00 0.00 0.00 178.16 178.09 1a4e h ASN 51 N 0.00 0.29 -0.16 0.10 2.35 -1.97 0.09 115.58 116.28 1a4e h ASN 51 Ca -0.00 -0.16 -0.07 0.00 -0.55 0.00 0.00 56.30 55.52 1a4e h ASN 51 Cb 0.82 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 39.10 1a4e h ASN 51 CO 0.03 0.79 -0.17 0.25 -1.65 0.00 0.00 177.43 176.68 1a4e h LEU 52 N 0.20 0.42 -0.85 1.61 5.85 -1.90 -2.57 115.31 118.07 1a4e h LEU 52 Ca 0.00 -0.48 -0.05 0.00 0.84 0.00 0.00 57.88 58.18 1a4e h LEU 52 Cb 1.05 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.93 1a4e h LEU 52 CO 0.09 0.82 0.23 0.40 -0.34 0.00 0.00 178.44 179.64 1a4e h ILE 53 N 0.03 1.25 -0.33 4.05 1.08 -1.47 -0.77 117.51 121.35 1a4e h ILE 53 Ca 0.02 -0.86 0.02 0.00 -0.39 0.00 0.00 64.86 63.65 1a4e h ILE 53 Cb 0.70 0.47 -0.03 0.00 -3.07 0.00 0.00 36.82 34.89 1a4e h ILE 53 CO 0.04 0.34 0.17 -0.78 -0.69 0.00 0.00 178.15 177.23 1a4e h ASP 54 N 1.04 0.26 -0.18 1.72 3.58 -0.97 0.45 116.42 122.32 1a4e h ASP 54 Ca 0.23 0.01 -0.11 0.00 0.42 0.00 0.00 57.03 57.58 1a4e h ASP 54 Cb 0.28 -0.04 -0.00 0.00 1.72 0.00 0.00 39.33 41.29 1a4e h ASP 54 CO -0.01 0.19 -0.30 -1.28 -2.88 0.00 0.00 179.24 174.96 1a4e h SER 55 N 0.36 0.58 -0.27 2.28 0.87 -1.18 -2.38 113.55 113.81 1a4e h SER 55 Ca 0.13 -0.53 -0.12 0.00 -1.23 0.00 0.00 61.79 60.04 1a4e h SER 55 Cb 0.03 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.81 1a4e h SER 55 CO -0.08 1.00 -0.25 -0.07 -0.53 0.00 0.00 176.83 176.90 1a4e h LEU 56 N 0.18 0.77 -0.63 2.23 3.38 -1.03 -1.47 115.31 118.74 1a4e h LEU 56 Ca 0.01 -0.29 -0.14 0.00 0.09 0.00 0.00 57.88 57.56 1a4e h LEU 56 Cb 0.89 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1a4e h LEU 56 CO 0.07 0.99 -0.47 0.00 0.09 0.00 0.00 178.44 179.12 1a4e h ALA 57 N 1.07 0.81 -0.06 1.53 0.00 -0.96 -1.71 119.26 119.94 1a4e h ALA 57 Ca 0.09 -0.47 -0.15 0.00 0.00 0.00 0.00 54.91 54.37 1a4e h ALA 57 Cb 0.76 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1a4e h ALA 57 CO 0.06 0.66 -0.64 1.25 0.00 0.00 0.00 179.25 180.58 1a4e h HIS 58 N 0.42 0.29 -0.68 0.00 -0.00 -1.30 -2.95 115.15 110.94 1a4e h HIS 58 Ca 0.02 -0.12 0.01 0.00 -0.00 0.00 0.00 60.37 60.28 1a4e h HIS 58 Cb 0.98 -0.05 -0.03 0.00 -0.00 0.00 0.00 27.41 28.30 1a4e h HIS 58 CO 0.04 0.80 0.45 0.35 -0.00 0.00 0.00 177.93 179.57 1a4e h PHE 59 N 0.16 0.86 0.00 5.26 3.57 -1.00 -2.04 116.94 123.75 1a4e h PHE 59 Ca -0.01 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1a4e h PHE 59 Cb 1.17 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 39.62 1a4e h PHE 59 CO 0.02 0.55 0.00 -0.91 -2.23 0.00 0.00 178.31 175.74 1a4e h ASN 60 N 0.92 0.00 -0.21 0.41 2.35 -1.14 -2.94 115.58 114.97 1a4e h ASN 60 Ca 0.25 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.96 1a4e h ASN 60 Cb -0.10 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.24 1a4e h ASN 60 CO -0.05 0.00 -0.04 0.54 -1.65 0.00 0.00 177.43 176.23 1a4e n ARG 61 N -2.34 2.23 0.06 0.81 1.74 -0.78 -4.72 116.66 113.66 1a4e n ARG 61 Ca -0.00 -2.89 -0.07 0.00 -0.77 0.00 0.00 57.85 54.12 1a4e n ARG 61 Cb 0.12 -1.75 0.08 0.00 -1.02 0.00 0.00 32.46 29.89 1a4e n ARG 61 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1a4e h GLU 62 N 1.16 0.34 -5.98 5.56 5.08 -1.41 -3.45 114.58 115.88 1a4e h GLU 62 Ca 0.05 -0.24 -0.60 0.00 -1.00 0.00 0.00 59.36 57.57 1a4e h GLU 62 Cb 1.38 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 30.61 1a4e h GLU 62 CO 0.20 0.86 -0.18 -0.80 -1.00 0.00 0.00 179.01 178.09 1a4e s ASN 63 N -6.92 6.81 0.21 1.42 0.01 -1.26 -5.10 114.94 110.10 1a4e s ASN 63 Ca -0.05 0.96 0.08 0.00 -0.71 0.00 0.00 52.86 53.14 1a4e s ASN 63 Cb 0.11 -2.26 -0.04 0.00 0.41 0.00 0.00 41.25 39.47 1a4e s ASN 63 CO 0.82 0.27 0.03 0.27 -1.51 0.00 0.00 177.10 176.98 1a4e s ILE 64 N -0.80 3.78 0.48 0.60 -4.36 -1.26 -5.10 121.20 114.53 1a4e s ILE 64 Ca 0.24 -1.54 -0.24 0.00 -0.26 0.00 0.00 60.65 58.85 1a4e s ILE 64 Cb -0.17 -2.95 -0.07 0.00 1.25 0.00 0.00 42.46 40.52 1a4e s ILE 64 CO 0.13 -0.21 1.37 -0.81 0.24 0.00 0.00 174.94 175.66 1a4e n PRO 65 N -0.48 1.99 -1.84 0.37 -0.04 -1.26 -4.97 135.00 128.76 1a4e n PRO 65 Ca -0.08 0.72 -0.33 0.00 -0.04 0.00 0.00 63.50 63.77 1a4e n PRO 65 Cb 0.57 -2.56 0.03 0.00 -0.04 0.00 0.00 33.50 31.50 1a4e n PRO 65 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 1a4e s GLN 66 N -2.55 3.00 0.41 0.54 -2.07 -1.26 -4.97 119.66 112.77 1a4e s GLN 66 Ca 0.65 1.27 -0.26 0.00 -1.82 0.00 0.00 55.36 55.20 1a4e s GLN 66 Cb -0.45 -1.99 -0.10 0.00 -1.09 0.00 0.00 33.01 29.39 1a4e s GLN 66 CO 0.55 -1.07 1.36 0.54 -1.32 0.00 0.00 175.29 175.34 1a4e n ARG 67 N -2.35 2.18 -3.91 9.60 1.74 -1.26 -4.98 116.66 117.68 1a4e n ARG 67 Ca 0.09 0.77 -0.30 0.00 -0.77 0.00 0.00 57.85 57.64 1a4e n ARG 67 Cb 0.52 -2.49 -0.15 0.00 -1.02 0.00 0.00 32.46 29.32 1a4e n ARG 67 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1a4e s ASN 68 N -0.41 4.24 0.00 0.55 2.47 -1.26 -3.49 114.94 117.04 1a4e s ASN 68 Ca 0.59 -1.67 0.00 0.00 0.42 0.00 0.00 52.86 52.20 1a4e s ASN 68 Cb -0.49 -1.25 0.00 0.00 -1.45 0.00 0.00 41.25 38.06 1a4e s ASN 68 CO 0.60 -0.34 0.00 -0.81 -3.72 0.00 0.00 177.10 172.82 1a4e n PRO 69 N 4.57 3.17 -3.27 0.43 -0.04 -1.26 -5.06 135.00 133.54 1a4e n PRO 69 Ca -0.03 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.27 1a4e n PRO 69 Cb 0.43 0.00 0.07 0.00 -0.04 0.00 0.00 33.50 33.96 1a4e n PRO 69 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1a4e n HIS 70 N 0.00 -2.04 -0.11 0.54 8.25 -0.59 -4.95 115.22 116.31 1a4e n HIS 70 Ca 0.00 0.80 -0.08 0.00 -0.26 0.00 0.00 57.72 58.18 1a4e n HIS 70 Cb 0.00 -4.48 0.07 0.00 1.12 0.00 0.00 29.99 26.70 1a4e n HIS 70 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1a4e h ALA 71 N 0.78 0.85 -2.96 -1.41 0.00 -1.68 -3.44 119.26 111.40 1a4e h ALA 71 Ca -0.48 -0.36 -0.60 0.00 0.00 0.00 0.00 54.91 53.46 1a4e h ALA 71 Cb 1.29 -0.16 -0.11 0.00 0.00 0.00 0.00 17.79 18.81 1a4e h ALA 71 CO 0.43 0.64 -0.27 -1.58 0.00 0.00 0.00 179.25 178.48 1a4e s HIS 72 N -4.68 3.40 0.17 0.00 5.65 -1.26 -4.52 115.29 114.06 1a4e s HIS 72 Ca -0.10 0.58 -0.24 0.00 0.25 0.00 0.00 55.06 55.56 1a4e s HIS 72 Cb 0.13 -2.45 0.07 0.00 -1.18 0.00 0.00 32.58 29.15 1a4e s HIS 72 CO 0.84 0.08 0.99 0.20 -0.65 0.00 0.00 174.74 176.21 1a4e s GLY 73 N 0.85 -0.08 0.16 1.59 0.00 -1.26 -1.90 107.32 106.68 1a4e s GLY 73 Ca 0.17 -0.08 0.07 0.00 0.00 0.00 0.00 44.72 44.89 1a4e s GLY 73 CO 0.06 0.87 -0.16 -0.56 0.00 0.00 0.00 173.10 173.32 1a4e s SER 74 N -3.12 2.39 0.12 1.64 0.01 -0.22 -4.98 113.70 109.53 1a4e s SER 74 Ca 0.16 -0.88 -0.02 0.00 1.31 0.00 0.00 55.95 56.52 1a4e s SER 74 Cb -0.02 -0.12 -0.03 0.00 0.21 0.00 0.00 66.02 66.06 1a4e s SER 74 CO 0.04 -0.11 0.08 -0.83 0.41 0.00 0.00 173.24 172.83 1a4e s GLY 75 N -2.73 0.83 -0.16 3.44 0.00 -1.26 -0.22 107.32 107.21 1a4e s GLY 75 Ca 0.15 -1.33 -0.29 0.00 0.00 0.00 0.00 44.72 43.25 1a4e s GLY 75 CO 0.05 -1.27 0.87 0.00 0.00 0.00 0.00 173.10 172.75 1a4e s ALA 76 N -4.02 -1.87 0.43 3.20 0.00 -0.44 -4.61 121.76 114.45 1a4e s ALA 76 Ca 0.21 1.62 -0.01 0.00 0.00 0.00 0.00 51.96 53.77 1a4e s ALA 76 Cb 0.07 -0.69 -0.02 0.00 0.00 0.00 0.00 23.12 22.47 1a4e s ALA 76 CO -0.00 -0.32 0.67 -0.06 0.00 0.00 0.00 175.76 176.05 1a4e s PHE 77 N -0.67 3.43 0.00 0.00 0.40 0.65 -1.15 117.98 120.64 1a4e s PHE 77 Ca -0.03 0.46 0.00 0.00 -0.60 0.00 0.00 56.93 56.75 1a4e s PHE 77 Cb -0.02 -2.17 0.00 0.00 0.51 0.00 0.00 43.02 41.34 1a4e s PHE 77 CO 0.03 -0.17 0.00 0.41 0.70 0.00 0.00 175.22 176.18 1a4e n GLY 78 N -2.04 1.45 3.38 4.36 0.00 -0.53 -1.71 105.19 110.10 1a4e n GLY 78 Ca -0.01 -0.08 -0.10 0.00 0.00 0.00 0.00 46.02 45.83 1a4e n GLY 78 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1a4e s TYR 79 N 0.14 -0.14 -0.05 1.61 -0.85 -0.01 -1.79 117.35 116.27 1a4e s TYR 79 Ca 0.00 -0.19 0.02 0.00 -0.52 0.00 0.00 57.07 56.38 1a4e s TYR 79 Cb 0.00 0.28 -0.03 0.00 0.38 0.00 0.00 41.96 42.59 1a4e s TYR 79 CO 0.00 -0.77 -0.09 0.12 -1.52 0.00 0.00 175.55 173.29 1a4e s PHE 80 N -3.84 2.87 -0.04 -3.49 5.36 0.26 -1.07 117.98 118.03 1a4e s PHE 80 Ca 0.06 -0.03 0.03 0.00 -0.96 0.00 0.00 56.93 56.03 1a4e s PHE 80 Cb 0.01 -1.67 0.00 0.00 -0.34 0.00 0.00 43.02 41.02 1a4e s PHE 80 CO -0.08 0.30 -0.13 -2.00 -1.46 0.00 0.00 175.22 171.85 1a4e s GLU 81 N -0.89 1.42 -0.02 10.12 2.12 0.06 -1.14 118.70 130.37 1a4e s GLU 81 Ca 0.13 -0.44 -0.30 0.00 0.36 0.00 0.00 54.97 54.72 1a4e s GLU 81 Cb -0.11 -1.25 -0.03 0.00 0.26 0.00 0.00 34.13 32.99 1a4e s GLU 81 CO 0.02 0.14 1.11 0.08 -0.54 0.00 0.00 175.26 176.08 1a4e s VAL 82 N 0.24 4.45 -0.02 3.70 1.01 -0.66 -0.99 120.40 128.14 1a4e s VAL 82 Ca -0.06 1.75 0.09 0.00 0.00 0.00 0.00 61.98 63.76 1a4e s VAL 82 Cb -0.11 -4.13 -0.14 0.00 0.00 0.00 0.00 36.38 32.01 1a4e s VAL 82 CO 0.02 0.07 0.18 0.35 0.00 0.00 0.00 175.10 175.72 1a4e n THR 83 N 4.26 0.03 -4.13 3.92 -2.24 -0.70 -0.36 114.28 115.05 1a4e n THR 83 Ca 0.09 -0.21 -0.14 0.00 -2.27 0.00 0.00 64.05 61.52 1a4e n THR 83 Cb 0.48 0.24 -0.11 0.00 -2.10 0.00 0.00 70.33 68.84 1a4e n THR 83 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1a4e s ASP 84 N -3.07 1.23 -0.28 3.42 1.11 -0.87 -4.87 116.67 113.34 1a4e s ASP 84 Ca -0.03 -0.69 -0.27 0.00 0.18 0.00 0.00 52.55 51.74 1a4e s ASP 84 Cb 0.05 0.02 0.01 0.00 1.07 0.00 0.00 42.92 44.07 1a4e s ASP 84 CO 0.37 -0.22 0.95 -0.62 1.18 0.00 0.00 175.17 176.82 1a4e s ASP 85 N -2.02 6.89 -0.12 0.27 -1.08 -1.26 -4.82 116.67 114.53 1a4e s ASP 85 Ca -0.02 1.04 0.16 0.00 -0.52 0.00 0.00 52.55 53.21 1a4e s ASP 85 Cb -0.06 -2.49 0.38 0.00 -1.46 0.00 0.00 42.92 39.29 1a4e s ASP 85 CO 0.00 -0.69 1.18 2.30 0.52 0.00 0.00 175.17 178.48 1a4e n ILE 86 N 5.53 1.29 0.29 4.11 -5.35 -1.26 -4.81 119.36 119.15 1a4e n ILE 86 Ca 0.09 -2.16 0.18 0.00 -0.27 0.00 0.00 62.75 60.59 1a4e n ILE 86 Cb 0.47 0.22 0.83 0.00 -1.74 0.00 0.00 39.64 39.42 1a4e n ILE 86 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 1a4e h THR 87 N 3.30 0.07 0.00 7.28 1.35 -1.82 -0.22 112.91 122.87 1a4e h THR 87 Ca -0.08 -0.40 -0.07 0.00 -0.55 0.00 0.00 66.41 65.31 1a4e h THR 87 Cb 1.32 1.37 -0.01 0.00 -1.73 0.00 0.00 68.15 69.10 1a4e h THR 87 CO 0.03 0.02 -0.33 -2.24 -0.25 0.00 0.00 175.52 172.75 1a4e h ASP 88 N 0.00 0.00 0.05 5.36 2.03 -1.99 -3.30 116.42 118.57 1a4e h ASP 88 Ca -0.00 0.00 -0.30 0.00 -0.73 0.00 0.00 57.03 56.00 1a4e h ASP 88 Cb 0.37 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 38.84 1a4e h ASP 88 CO 0.00 0.33 -1.65 -0.38 -1.03 0.00 0.00 179.24 176.51 1a4e n ILE 89 N -3.84 1.63 -3.82 4.15 2.08 -0.40 -4.50 119.36 114.65 1a4e n ILE 89 Ca -0.01 -0.30 -0.17 0.00 0.56 0.00 0.00 62.75 62.82 1a4e n ILE 89 Cb 0.41 -1.90 -0.16 0.00 -0.75 0.00 0.00 39.64 37.23 1a4e n ILE 89 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1a4e n GLY 91 N 4.41 0.23 3.77 0.00 0.00 -0.49 -4.24 105.19 108.88 1a4e n GLY 91 Ca -0.22 -0.36 -0.41 0.00 0.00 0.00 0.00 46.02 45.04 1a4e n GLY 91 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1a4e s SER 92 N -1.33 6.45 0.57 1.61 0.01 -1.26 -4.86 113.70 114.88 1a4e s SER 92 Ca 0.27 2.95 0.27 0.00 1.31 0.00 0.00 55.95 60.75 1a4e s SER 92 Cb 0.14 -2.66 1.51 0.00 0.21 0.00 0.00 66.02 65.23 1a4e s SER 92 CO 0.21 -0.80 2.02 0.00 0.41 0.00 0.00 173.24 175.07 1a4e h ALA 93 N 3.45 2.14 0.00 1.44 0.00 -1.93 -1.74 119.26 122.62 1a4e h ALA 93 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1a4e h ALA 93 Cb 1.23 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1a4e h ALA 93 CO 0.67 -0.50 0.00 0.00 0.00 0.00 0.00 179.25 179.42 1a4e n MET 94 N -4.01 0.07 -0.14 0.00 -0.00 -1.26 -2.76 117.12 109.02 1a4e n MET 94 Ca 0.06 0.25 0.06 0.00 -0.00 0.00 0.00 57.70 58.07 1a4e n MET 94 Cb 0.49 -1.62 0.14 0.00 -0.00 0.00 0.00 33.22 32.22 1a4e n MET 94 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 1a4e n PHE 95 N -1.76 0.38 0.05 3.17 3.72 -0.65 -4.78 117.46 117.58 1a4e n PHE 95 Ca 0.04 -0.38 -0.13 0.00 -0.05 0.00 0.00 57.45 56.94 1a4e n PHE 95 Cb 0.24 -0.02 -0.08 0.00 -0.94 0.00 0.00 39.48 38.68 1a4e n PHE 95 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1a4e h SER 96 N 2.23 -0.07 -3.29 4.37 4.64 -1.58 -3.43 113.55 116.42 1a4e h SER 96 Ca 0.00 -0.19 -0.64 0.00 -0.47 0.00 0.00 61.79 60.49 1a4e h SER 96 Cb 0.69 0.02 -0.14 0.00 -0.31 0.00 0.00 62.40 62.66 1a4e h SER 96 CO 0.00 0.15 -0.70 -0.54 -0.87 0.00 0.00 176.83 174.86 1a4e s LYS 97 N -5.34 2.27 0.11 4.77 1.02 -1.26 -4.96 119.74 116.35 1a4e s LYS 97 Ca -0.14 -1.04 -0.30 0.00 0.02 0.00 0.00 55.97 54.51 1a4e s LYS 97 Cb 0.04 -2.35 -0.06 0.00 -0.52 0.00 0.00 37.83 34.94 1a4e s LYS 97 CO 0.65 0.49 1.03 0.42 -0.92 0.00 0.00 175.35 177.02 1a4e s ILE 98 N -1.41 4.33 0.00 2.17 1.01 -1.26 -3.06 121.20 122.98 1a4e s ILE 98 Ca 0.24 1.88 0.00 0.00 0.00 0.00 0.00 60.65 62.77 1a4e s ILE 98 Cb -0.11 -4.20 0.00 0.00 0.01 0.00 0.00 42.46 38.16 1a4e s ILE 98 CO 0.16 0.26 0.00 0.61 0.00 0.00 0.00 174.94 175.97 1a4e n GLY 99 N 2.39 0.71 3.71 6.18 0.00 0.51 -4.99 105.19 113.70 1a4e n GLY 99 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1a4e n GLY 99 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1a4e s LYS 100 N -0.73 4.32 -0.09 1.61 2.20 -1.17 -4.71 119.74 121.16 1a4e s LYS 100 Ca 0.00 2.04 -0.01 0.00 -0.36 0.00 0.00 55.97 57.64 1a4e s LYS 100 Cb 0.00 -3.33 -0.03 0.00 -1.51 0.00 0.00 37.83 32.96 1a4e s LYS 100 CO 0.00 -0.46 -0.04 1.03 -0.36 0.00 0.00 175.35 175.52 1a4e s ARG 101 N 1.40 3.02 -0.11 4.03 0.52 -1.26 -1.65 118.95 124.90 1a4e s ARG 101 Ca 0.64 -0.49 0.01 0.00 -0.52 0.00 0.00 55.73 55.37 1a4e s ARG 101 Cb -0.35 -2.72 0.02 0.00 0.52 0.00 0.00 34.95 32.41 1a4e s ARG 101 CO 0.29 0.59 -0.13 0.99 0.02 0.00 0.00 175.30 177.07 1a4e s THR 102 N -0.59 1.36 0.31 0.02 2.01 -0.29 -4.96 115.64 113.49 1a4e s THR 102 Ca 0.09 -0.54 -0.29 0.00 0.31 0.00 0.00 61.69 61.25 1a4e s THR 102 Cb -0.12 -1.27 -0.12 0.00 0.01 0.00 0.00 72.50 71.01 1a4e s THR 102 CO 0.02 0.42 1.55 1.17 -0.69 0.00 0.00 174.62 177.08 1a4e n LYS 103 N 4.38 2.64 -4.16 4.92 3.00 -1.26 -0.57 118.16 127.10 1a4e n LYS 103 Ca -0.18 0.93 -0.10 0.00 -0.00 0.00 0.00 58.31 58.97 1a4e n LYS 103 Cb 0.51 -2.69 -0.10 0.00 0.00 0.00 0.00 35.03 32.75 1a4e n LYS 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1a4e s LEU 105 N -3.05 1.32 -0.12 0.00 2.96 -0.33 -1.46 118.68 118.00 1a4e s LEU 105 Ca 0.21 -0.27 -0.00 0.00 -0.22 0.00 0.00 54.13 53.84 1a4e s LEU 105 Cb 0.07 -0.78 -0.02 0.00 0.50 0.00 0.00 46.19 45.96 1a4e s LEU 105 CO -0.00 -0.07 -0.11 -0.89 -1.32 0.00 0.00 176.35 173.96 1a4e s THR 106 N 1.31 3.28 -0.19 3.68 2.01 -0.30 -0.52 115.64 124.92 1a4e s THR 106 Ca -0.03 -0.59 -0.01 0.00 0.31 0.00 0.00 61.69 61.37 1a4e s THR 106 Cb -0.14 -2.37 0.01 0.00 0.01 0.00 0.00 72.50 70.01 1a4e s THR 106 CO -0.03 0.54 -0.15 -0.60 -0.69 0.00 0.00 174.62 173.69 1a4e s ARG 107 N 0.07 3.14 0.28 4.92 3.52 -0.22 -1.33 118.95 129.33 1a4e s ARG 107 Ca -0.04 -0.76 -0.01 0.00 -0.13 0.00 0.00 55.73 54.79 1a4e s ARG 107 Cb -0.14 -2.71 -0.04 0.00 -1.56 0.00 0.00 34.95 30.50 1a4e s ARG 107 CO 0.04 -0.16 0.49 -0.06 -0.81 0.00 0.00 175.30 174.80 1a4e s PHE 108 N 1.25 3.49 0.09 5.12 0.08 0.69 -2.02 117.98 126.68 1a4e s PHE 108 Ca 0.03 0.40 -0.27 0.00 0.12 0.00 0.00 56.93 57.22 1a4e s PHE 108 Cb -0.14 -1.92 0.08 0.00 -0.57 0.00 0.00 43.02 40.48 1a4e s PHE 108 CO -0.08 0.23 0.99 -1.54 -0.10 0.00 0.00 175.22 174.73 1a4e s SER 109 N -3.53 -0.20 0.30 1.36 1.04 -1.05 -1.06 113.70 110.56 1a4e s SER 109 Ca 0.40 -0.28 0.02 0.00 0.48 0.00 0.00 55.95 56.57 1a4e s SER 109 Cb -0.10 0.42 0.04 0.00 0.10 0.00 0.00 66.02 66.47 1a4e s SER 109 CO 0.32 -0.75 0.28 0.35 0.98 0.00 0.00 173.24 174.41 1a4e n THR 110 N -0.42 0.00 0.00 2.02 -2.24 -0.80 -0.58 114.28 112.27 1a4e n THR 110 Ca -0.07 -0.57 -0.02 0.00 -2.27 0.00 0.00 64.05 61.12 1a4e n THR 110 Cb 0.61 -0.99 -0.01 0.00 -2.10 0.00 0.00 70.33 67.85 1a4e n THR 110 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1a4e n VAL 111 N -1.57 0.98 0.08 2.28 0.31 -1.23 -3.95 118.33 115.23 1a4e n VAL 111 Ca 0.05 0.28 -0.09 0.00 -0.01 0.00 0.00 64.34 64.57 1a4e n VAL 111 Cb 0.19 -1.66 -0.08 0.00 -0.91 0.00 0.00 33.84 31.38 1a4e n VAL 111 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1a4e h GLY 112 N -0.24 0.12 -2.15 2.92 0.00 -1.92 -1.57 103.07 100.23 1a4e h GLY 112 Ca 0.00 -0.27 -0.49 0.00 0.00 0.00 0.00 47.33 46.57 1a4e h GLY 112 CO 0.00 0.24 0.43 -0.32 0.00 0.00 0.00 176.54 176.88 1a4e s GLY 113 N -4.63 2.62 1.10 4.60 0.00 -1.26 -4.72 107.32 105.03 1a4e s GLY 113 Ca -0.01 0.78 -0.16 0.00 0.00 0.00 0.00 44.72 45.33 1a4e s GLY 113 CO 0.83 1.14 1.11 0.99 0.00 0.00 0.00 173.10 177.17 1a4e s ASP 114 N -1.78 1.82 0.43 1.64 1.01 -1.26 -3.97 116.67 114.56 1a4e s ASP 114 Ca 0.70 0.86 0.22 0.00 0.71 0.00 0.00 52.55 55.04 1a4e s ASP 114 Cb -0.22 -1.29 1.20 0.00 1.01 0.00 0.00 42.92 43.61 1a4e s ASP 114 CO 0.26 -3.59 1.80 0.50 0.21 0.00 0.00 175.17 174.34 1a4e h LYS 115 N -2.22 0.30 -0.50 8.23 1.63 -1.95 -2.04 116.57 120.02 1a4e h LYS 115 Ca -0.50 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.29 1a4e h LYS 115 Cb 1.31 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.87 1a4e h LYS 115 CO 0.46 0.20 0.00 0.41 -3.45 0.00 0.00 179.45 177.07 1a4e n GLY 116 N -1.54 3.24 3.89 5.01 0.00 -1.26 -4.62 105.19 109.91 1a4e n GLY 116 Ca 0.24 -0.94 -0.30 0.00 0.00 0.00 0.00 46.02 45.02 1a4e n GLY 116 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1a4e s SER 117 N -1.10 5.26 0.58 1.61 1.04 -0.77 -5.03 113.70 115.29 1a4e s SER 117 Ca 0.51 1.05 -0.17 0.00 0.48 0.00 0.00 55.95 57.82 1a4e s SER 117 Cb 0.38 -1.79 -0.04 0.00 0.10 0.00 0.00 66.02 64.67 1a4e s SER 117 CO 0.15 -1.45 1.10 0.00 0.98 0.00 0.00 173.24 174.02 1a4e s ALA 118 N -3.40 2.65 0.14 5.32 0.00 -1.26 -4.91 121.76 120.31 1a4e s ALA 118 Ca 0.59 0.64 -0.06 0.00 0.00 0.00 0.00 51.96 53.12 1a4e s ALA 118 Cb -0.11 -3.31 -0.04 0.00 0.00 0.00 0.00 23.12 19.66 1a4e s ALA 118 CO 0.51 -0.89 1.38 -0.44 0.00 0.00 0.00 175.76 176.32 1a4e h ASP 119 N 0.73 0.69 -2.36 0.00 3.32 -1.21 -3.38 116.42 114.22 1a4e h ASP 119 Ca -0.48 -0.45 -0.81 0.00 0.02 0.00 0.00 57.03 55.31 1a4e h ASP 119 Cb 1.24 -0.20 -0.27 0.00 0.22 0.00 0.00 39.33 40.32 1a4e h ASP 119 CO 0.56 1.22 1.03 0.35 -1.72 0.00 0.00 179.24 180.68 1a4e n THR 120 N -3.88 5.92 -4.08 0.35 -2.24 -1.26 -4.92 114.28 104.16 1a4e n THR 120 Ca -0.06 -5.92 -0.24 0.00 -2.27 0.00 0.00 64.05 55.57 1a4e n THR 120 Cb 0.72 -1.69 -0.07 0.00 -2.10 0.00 0.00 70.33 67.20 1a4e n THR 120 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1a4e s VAL 121 N -3.86 2.53 -0.22 2.28 -7.23 -1.26 -4.31 120.40 108.33 1a4e s VAL 121 Ca 0.38 -1.68 -0.26 0.00 -1.81 0.00 0.00 61.98 58.61 1a4e s VAL 121 Cb 0.16 -2.98 -0.00 0.00 0.56 0.00 0.00 36.38 34.11 1a4e s VAL 121 CO -0.07 -0.06 0.88 -0.60 -0.31 0.00 0.00 175.10 174.94 1a4e s ARG 122 N -3.90 4.24 -0.11 4.82 3.52 -1.26 -4.61 118.95 121.64 1a4e s ARG 122 Ca 0.41 1.06 -0.33 0.00 -0.13 0.00 0.00 55.73 56.74 1a4e s ARG 122 Cb 0.01 -3.62 0.12 0.00 -1.56 0.00 0.00 34.95 29.91 1a4e s ARG 122 CO 0.23 -0.48 1.08 0.34 -0.81 0.00 0.00 175.30 175.66 1a4e s ASP 123 N 1.25 -0.22 0.71 -2.12 -1.08 -1.06 -5.00 116.67 109.15 1a4e s ASP 123 Ca 0.38 -0.00 -0.15 0.00 -0.52 0.00 0.00 52.55 52.25 1a4e s ASP 123 Cb -0.16 0.24 0.03 0.00 -1.46 0.00 0.00 42.92 41.57 1a4e s ASP 123 CO 0.09 -0.39 1.19 -2.84 0.52 0.00 0.00 175.17 173.74 1a4e s PRO 124 N -2.70 2.31 -0.09 4.34 0.02 -1.26 -4.69 135.00 132.93 1a4e s PRO 124 Ca 0.08 1.69 0.00 0.00 0.02 0.00 0.00 61.00 62.79 1a4e s PRO 124 Cb -0.01 -1.86 -0.02 0.00 0.02 0.00 0.00 34.50 32.63 1a4e s PRO 124 CO -0.06 -1.69 -0.09 1.03 -0.33 0.00 0.00 177.00 175.85 1a4e s ARG 125 N -3.91 3.02 0.47 5.54 1.81 -1.26 -3.55 118.95 121.07 1a4e s ARG 125 Ca 0.73 -0.61 -0.19 0.00 -1.72 0.00 0.00 55.73 53.94 1a4e s ARG 125 Cb -0.28 -2.61 -0.09 0.00 -0.45 0.00 0.00 34.95 31.52 1a4e s ARG 125 CO 0.44 0.47 0.98 0.20 -0.68 0.00 0.00 175.30 176.70 1a4e s GLY 126 N -0.30 2.28 -0.42 -3.53 0.00 0.25 -0.71 107.32 104.90 1a4e s GLY 126 Ca 0.03 0.35 0.04 0.00 0.00 0.00 0.00 44.72 45.14 1a4e s GLY 126 CO 0.03 0.63 0.43 -0.12 0.00 0.00 0.00 173.10 174.06 1a4e s PHE 127 N -2.33 0.03 -0.21 1.90 2.19 0.44 -2.54 117.98 117.46 1a4e s PHE 127 Ca 0.62 -1.42 -0.05 0.00 0.33 0.00 0.00 56.93 56.41 1a4e s PHE 127 Cb -0.10 -0.48 -0.02 0.00 -1.31 0.00 0.00 43.02 41.10 1a4e s PHE 127 CO 0.21 -0.97 0.01 0.00 1.83 0.00 0.00 175.22 176.30 1a4e s ALA 128 N 0.74 3.02 -0.02 11.12 0.00 -0.86 -2.18 121.76 133.59 1a4e s ALA 128 Ca 0.26 -1.04 0.07 0.00 0.00 0.00 0.00 51.96 51.25 1a4e s ALA 128 Cb -0.05 -1.82 -0.02 0.00 0.00 0.00 0.00 23.12 21.23 1a4e s ALA 128 CO -0.10 -0.25 -0.23 0.99 0.00 0.00 0.00 175.76 176.17 1a4e s THR 129 N 1.18 2.29 -0.27 0.00 2.01 -0.83 -1.06 115.64 118.95 1a4e s THR 129 Ca 0.03 -1.03 -0.03 0.00 0.31 0.00 0.00 61.69 60.96 1a4e s THR 129 Cb -0.14 -1.82 0.02 0.00 0.01 0.00 0.00 72.50 70.57 1a4e s THR 129 CO 0.01 0.57 -0.00 -0.75 -0.69 0.00 0.00 174.62 173.76 1a4e s LYS 130 N -0.67 2.85 -0.24 4.92 2.20 0.32 -0.79 119.74 128.33 1a4e s LYS 130 Ca 0.10 -0.99 -0.11 0.00 -0.36 0.00 0.00 55.97 54.62 1a4e s LYS 130 Cb -0.10 -3.14 -0.05 0.00 -1.51 0.00 0.00 37.83 33.03 1a4e s LYS 130 CO -0.00 -0.45 0.19 -0.06 -0.36 0.00 0.00 175.35 174.67 1a4e s PHE 131 N 1.37 3.32 -1.08 4.03 0.08 0.25 -1.19 117.98 124.76 1a4e s PHE 131 Ca 0.00 0.27 -0.15 0.00 0.12 0.00 0.00 56.93 57.17 1a4e s PHE 131 Cb -0.17 -2.31 0.18 0.00 -0.57 0.00 0.00 43.02 40.14 1a4e s PHE 131 CO -0.02 0.04 1.24 0.71 -0.10 0.00 0.00 175.22 177.10 1a4e s TYR 132 N 1.14 3.50 0.55 0.36 2.02 -0.73 -1.18 117.35 123.00 1a4e s TYR 132 Ca 0.09 -1.96 -0.01 0.00 -0.37 0.00 0.00 57.07 54.83 1a4e s TYR 132 Cb -0.14 -4.20 0.03 0.00 -0.40 0.00 0.00 41.96 37.24 1a4e s TYR 132 CO 0.05 -1.34 0.79 0.95 -1.57 0.00 0.00 175.55 174.44 1a4e s THR 133 N 1.46 3.04 -0.00 -0.71 -4.23 -1.03 -4.56 115.64 109.61 1a4e s THR 133 Ca 0.36 -0.52 0.30 0.00 -1.18 0.00 0.00 61.69 60.66 1a4e s THR 133 Cb -0.05 -3.16 0.32 0.00 1.34 0.00 0.00 72.50 70.95 1a4e s THR 133 CO -0.05 -0.12 1.91 -0.33 -0.54 0.00 0.00 174.62 175.49 1a4e h GLU 134 N 0.05 0.00 -0.56 3.99 5.08 -1.95 -2.48 114.58 118.70 1a4e h GLU 134 Ca -0.44 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 57.60 1a4e h GLU 134 Cb 1.28 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 30.34 1a4e h GLU 134 CO 0.55 0.00 0.06 0.39 -1.00 0.00 0.00 179.01 179.01 1a4e n GLU 135 N -2.62 2.15 0.00 2.33 1.02 -1.26 -4.57 120.64 117.69 1a4e n GLU 135 Ca -0.01 -3.27 0.00 0.00 -0.02 0.00 0.00 57.16 53.87 1a4e n GLU 135 Cb 0.15 -1.97 0.00 0.00 -0.02 0.00 0.00 31.44 29.60 1a4e n GLU 135 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1a4e n GLY 136 N -1.07 -0.16 3.83 0.62 0.00 -0.93 -4.62 105.19 102.85 1a4e n GLY 136 Ca 0.42 -1.90 -0.32 0.00 0.00 0.00 0.00 46.02 44.22 1a4e n GLY 136 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1a4e s ASN 137 N -0.87 6.04 -0.06 1.61 0.01 -1.26 -2.46 114.94 117.96 1a4e s ASN 137 Ca 0.00 1.61 0.01 0.00 -0.71 0.00 0.00 52.86 53.77 1a4e s ASN 137 Cb 0.00 -2.50 0.02 0.00 0.41 0.00 0.00 41.25 39.18 1a4e s ASN 137 CO 0.00 -0.99 -0.06 -0.22 -1.51 0.00 0.00 177.10 174.32 1a4e s LEU 138 N -4.76 1.34 -0.21 0.60 0.20 -0.33 -3.82 118.68 111.71 1a4e s LEU 138 Ca 0.59 -0.18 -0.02 0.00 0.69 0.00 0.00 54.13 55.20 1a4e s LEU 138 Cb -0.13 -0.57 -0.00 0.00 -0.43 0.00 0.00 46.19 45.06 1a4e s LEU 138 CO 0.43 -0.05 -0.09 -1.81 -0.29 0.00 0.00 176.35 174.54 1a4e s ASP 139 N 1.00 3.96 -0.87 3.68 1.01 -0.39 -0.58 116.67 124.48 1a4e s ASP 139 Ca -0.09 -0.47 -0.15 0.00 0.71 0.00 0.00 52.55 52.55 1a4e s ASP 139 Cb -0.14 -1.66 0.20 0.00 1.01 0.00 0.00 42.92 42.33 1a4e s ASP 139 CO -0.00 -0.01 0.87 0.26 0.21 0.00 0.00 175.17 176.49 1a4e s TRP 140 N 1.42 3.65 -1.04 4.23 0.52 0.03 -4.60 118.94 123.16 1a4e s TRP 140 Ca 0.06 -1.91 -0.17 0.00 0.02 0.00 0.00 56.10 54.10 1a4e s TRP 140 Cb -0.14 -3.92 0.14 0.00 -1.15 0.00 0.00 33.47 28.40 1a4e s TRP 140 CO -0.06 -1.10 1.26 0.08 0.02 0.00 0.00 176.95 177.15 1a4e s VAL 141 N 0.63 4.78 0.30 4.03 1.01 -1.26 -1.96 120.40 127.92 1a4e s VAL 141 Ca 0.22 -1.90 0.08 0.00 0.00 0.00 0.00 61.98 60.38 1a4e s VAL 141 Cb -0.09 -4.85 -0.04 0.00 0.00 0.00 0.00 36.38 31.41 1a4e s VAL 141 CO -0.09 -1.58 0.15 -0.31 0.00 0.00 0.00 175.10 173.27 1a4e s TYR 142 N 2.46 2.84 0.50 5.22 2.02 -0.93 -4.98 117.35 124.49 1a4e s TYR 142 Ca 0.37 -0.27 0.05 0.00 -0.37 0.00 0.00 57.07 56.86 1a4e s TYR 142 Cb -0.04 -1.51 0.01 0.00 -0.40 0.00 0.00 41.96 40.02 1a4e s TYR 142 CO -0.06 0.41 0.30 -0.80 -1.57 0.00 0.00 175.55 173.84 1a4e s ASN 143 N -3.84 4.55 -0.13 2.29 0.01 -1.18 -0.42 114.94 116.23 1a4e s ASN 143 Ca 0.36 -1.24 0.08 0.00 -0.71 0.00 0.00 52.86 51.35 1a4e s ASN 143 Cb -0.05 0.19 0.45 0.00 0.41 0.00 0.00 41.25 42.24 1a4e s ASN 143 CO 0.23 -0.93 1.19 -0.46 -1.51 0.00 0.00 177.10 175.63 1a4e n ASN 144 N -1.57 3.57 -4.13 -1.22 2.04 0.11 -1.18 115.26 112.88 1a4e n ASN 144 Ca -0.04 -2.50 -0.19 0.00 -0.44 0.00 0.00 54.58 51.41 1a4e n ASN 144 Cb 0.65 -0.59 -0.13 0.00 -2.53 0.00 0.00 39.78 37.17 1a4e n ASN 144 CO 0.00 0.00 0.00 0.28 -0.44 0.00 0.00 177.26 177.10 1a4e s THR 145 N -1.95 1.05 0.32 5.53 -1.32 -1.26 -4.66 115.64 113.35 1a4e s THR 145 Ca 0.30 -0.98 0.04 0.00 -1.21 0.00 0.00 61.69 59.83 1a4e s THR 145 Cb 0.23 -0.96 0.14 0.00 -1.51 0.00 0.00 72.50 70.40 1a4e s THR 145 CO 0.09 -0.02 1.84 -0.65 -2.21 0.00 0.00 174.62 173.67 1a4e h PRO 146 N 4.93 0.53 0.00 7.08 0.11 -1.91 -3.42 132.00 139.33 1a4e h PRO 146 Ca -0.38 -0.13 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1a4e h PRO 146 Cb 1.18 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1a4e h PRO 146 CO 0.44 0.59 0.00 1.33 -0.21 0.00 0.00 178.00 180.15 1a4e n VAL 147 N -4.25 0.00 -3.94 3.15 0.24 -1.26 -3.92 118.33 108.34 1a4e n VAL 147 Ca 0.01 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.22 1a4e n VAL 147 Cb 0.27 -0.07 -0.05 0.00 -1.47 0.00 0.00 33.84 32.53 1a4e n VAL 147 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1a4e s PHE 148 N 0.02 0.23 0.35 6.34 5.36 -1.22 -4.95 117.98 124.12 1a4e s PHE 148 Ca 0.00 -0.60 0.25 0.00 -0.96 0.00 0.00 56.93 55.61 1a4e s PHE 148 Cb 0.00 0.27 1.24 0.00 -0.34 0.00 0.00 43.02 44.19 1a4e s PHE 148 CO 0.00 -1.00 1.99 0.74 -1.46 0.00 0.00 175.22 175.49 1a4e h PHE 149 N 2.23 0.00 -3.55 10.12 -1.00 -1.93 -3.41 116.94 119.41 1a4e h PHE 149 Ca -0.26 0.00 -0.37 0.00 2.81 0.00 0.00 57.97 60.16 1a4e h PHE 149 Cb 1.25 0.00 -0.17 0.00 3.61 0.00 0.00 35.95 40.64 1a4e h PHE 149 CO 0.40 0.17 -0.74 0.96 -1.61 0.00 0.00 178.31 177.49 1a4e s ILE 150 N -4.09 1.19 0.00 -0.55 -4.36 -1.26 -3.55 121.20 108.58 1a4e s ILE 150 Ca -0.02 -1.79 0.00 0.00 -0.26 0.00 0.00 60.65 58.57 1a4e s ILE 150 Cb 0.13 -1.57 0.00 0.00 1.25 0.00 0.00 42.46 42.27 1a4e s ILE 150 CO 0.61 -0.55 0.77 -2.11 0.24 0.00 0.00 174.94 173.91 1a4e n ARG 151 N 0.33 1.62 -4.07 0.37 1.85 -1.26 -4.68 116.66 110.82 1a4e n ARG 151 Ca -0.14 -1.07 -0.33 0.00 -1.00 0.00 0.00 57.85 55.31 1a4e n ARG 151 Cb 0.58 -0.88 -0.15 0.00 -1.05 0.00 0.00 32.46 30.96 1a4e n ARG 151 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1a4e s ASP 152 N -0.60 3.50 0.41 2.89 1.01 -1.26 -4.53 116.67 118.09 1a4e s ASP 152 Ca 0.00 -0.69 0.12 0.00 0.71 0.00 0.00 52.55 52.70 1a4e s ASP 152 Cb 0.00 -1.54 0.87 0.00 1.01 0.00 0.00 42.92 43.26 1a4e s ASP 152 CO 0.00 -0.03 1.93 1.55 0.21 0.00 0.00 175.17 178.84 1a4e h PRO 153 N 7.96 0.09 0.00 8.23 0.13 -1.92 -2.30 132.00 144.18 1a4e h PRO 153 Ca -0.42 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1a4e h PRO 153 Cb 1.13 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1a4e h PRO 153 CO 0.62 0.29 0.00 0.66 -0.23 0.00 0.00 178.00 179.33 1a4e h SER 154 N 0.08 0.00 1.38 1.44 4.64 -1.96 -2.54 113.55 116.59 1a4e h SER 154 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1a4e h SER 154 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 1a4e h SER 154 CO 0.03 0.00 -0.04 1.17 -0.87 0.00 0.00 176.83 177.12 1a4e n LYS 155 N -2.90 0.23 -0.10 4.77 3.00 -0.87 -4.32 118.16 117.97 1a4e n LYS 155 Ca -0.01 0.18 -0.11 0.00 -0.00 0.00 0.00 58.31 58.37 1a4e n LYS 155 Cb 0.18 -1.76 -0.03 0.00 0.00 0.00 0.00 35.03 33.42 1a4e n LYS 155 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.40 177.75 1a4e h PHE 156 N 0.00 0.58 -0.77 5.64 3.57 -1.60 -0.86 116.94 123.50 1a4e h PHE 156 Ca 0.00 -0.11 0.10 0.00 3.53 0.00 0.00 57.97 61.49 1a4e h PHE 156 Cb 0.71 -0.15 -0.07 0.00 2.79 0.00 0.00 35.95 39.22 1a4e h PHE 156 CO 0.00 0.68 0.40 -1.35 -2.23 0.00 0.00 178.31 175.82 1a4e h PRO 157 N 0.31 0.65 -0.28 6.41 0.11 -1.82 -1.70 132.00 135.68 1a4e h PRO 157 Ca 0.08 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.14 1a4e h PRO 157 Cb 0.46 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.41 1a4e h PRO 157 CO 0.02 0.43 0.12 0.45 -0.21 0.00 0.00 178.00 178.80 1a4e h HIS 158 N 0.67 0.43 0.17 0.65 3.86 -1.77 -2.20 115.15 116.96 1a4e h HIS 158 Ca 0.38 -0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.55 1a4e h HIS 158 Cb 0.40 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 28.74 1a4e h HIS 158 CO -0.09 0.42 -0.08 0.35 0.86 0.00 0.00 177.93 179.39 1a4e h PHE 159 N 0.31 -0.21 -0.40 2.45 3.57 -0.91 -2.71 116.94 119.05 1a4e h PHE 159 Ca 0.10 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.56 1a4e h PHE 159 Cb 0.17 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.96 1a4e h PHE 159 CO -0.01 -0.03 0.11 0.82 -2.23 0.00 0.00 178.31 176.97 1a4e h ILE 160 N -0.36 1.18 -0.98 1.41 1.08 -1.32 -2.02 117.51 116.49 1a4e h ILE 160 Ca -0.02 -0.61 0.01 0.00 -0.39 0.00 0.00 64.86 63.84 1a4e h ILE 160 Cb 0.28 0.76 -0.05 0.00 -3.07 0.00 0.00 36.82 34.75 1a4e h ILE 160 CO 0.04 0.22 0.63 0.45 -0.69 0.00 0.00 178.15 178.81 1a4e h HIS 161 N 0.57 1.25 0.00 1.37 3.86 -1.30 -1.57 115.15 119.33 1a4e h HIS 161 Ca 0.13 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.36 1a4e h HIS 161 Cb 0.20 -0.42 0.00 0.00 1.06 0.00 0.00 27.41 28.25 1a4e h HIS 161 CO 0.01 0.80 0.00 1.79 0.86 0.00 0.00 177.93 181.39 1a4e h THR 162 N 1.34 0.00 0.00 2.45 1.35 -1.05 -2.72 112.91 114.27 1a4e h THR 162 Ca 0.36 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 1a4e h THR 162 Cb -0.13 1.54 0.00 0.00 -1.73 0.00 0.00 68.15 67.83 1a4e h THR 162 CO -0.07 0.00 -0.18 1.56 -0.25 0.00 0.00 175.52 176.57 1a4e h GLN 163 N 0.00 0.00 0.00 4.72 1.08 -0.81 -3.29 115.11 116.81 1a4e h GLN 163 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1a4e h GLN 163 Cb 0.66 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.09 1a4e h GLN 163 CO 0.00 0.00 0.00 1.63 -0.95 0.00 0.00 178.83 179.51 1a4e n LYS 164 N -2.81 0.00 -4.29 1.46 5.02 -0.84 -4.81 118.16 111.89 1a4e n LYS 164 Ca 0.04 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.04 1a4e n LYS 164 Cb 0.51 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.41 1a4e n LYS 164 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1a4e s ARG 165 N 3.18 1.88 0.27 1.97 0.52 -1.26 -4.32 118.95 121.20 1a4e s ARG 165 Ca 0.00 -1.16 -0.30 0.00 -0.52 0.00 0.00 55.73 53.74 1a4e s ARG 165 Cb 0.00 -2.15 -0.12 0.00 0.52 0.00 0.00 34.95 33.19 1a4e s ARG 165 CO 0.00 0.48 1.54 -1.71 0.02 0.00 0.00 175.30 175.63 1a4e n ASN 166 N 0.69 3.51 0.04 0.23 2.85 0.01 -4.87 115.26 117.72 1a4e n ASN 166 Ca -0.15 1.14 0.10 0.00 -0.11 0.00 0.00 54.58 55.57 1a4e n ASN 166 Cb 0.53 -1.54 0.55 0.00 1.24 0.00 0.00 39.78 40.55 1a4e n ASN 166 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1a4e h PRO 167 N 4.67 0.27 0.00 1.20 0.13 -1.96 -1.51 132.00 134.80 1a4e h PRO 167 Ca -0.46 -0.02 -0.08 0.00 -0.87 0.00 0.00 66.00 64.57 1a4e h PRO 167 Cb 1.24 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 1a4e h PRO 167 CO 0.79 0.18 -0.88 0.94 -0.23 0.00 0.00 178.00 178.79 1a4e n GLN 168 N -4.48 0.50 0.22 0.86 7.27 -1.26 -4.62 117.38 115.87 1a4e n GLN 168 Ca 0.05 0.47 0.13 0.00 0.07 0.00 0.00 57.00 57.72 1a4e n GLN 168 Cb 0.26 -1.65 0.32 0.00 2.41 0.00 0.00 30.24 31.58 1a4e n GLN 168 CO 0.00 0.00 0.00 1.79 0.07 0.00 0.00 177.06 178.92 1a4e h THR 169 N -1.00 0.00 -0.46 1.69 1.35 -1.97 -3.47 112.91 109.05 1a4e h THR 169 Ca -0.12 -0.81 -0.20 0.00 -0.55 0.00 0.00 66.41 64.73 1a4e h THR 169 Cb 0.83 1.80 -0.08 0.00 -1.73 0.00 0.00 68.15 68.97 1a4e h THR 169 CO -0.07 0.00 -0.18 -3.20 -0.25 0.00 0.00 175.52 171.82 1a4e n ASN 170 N -2.98 -5.50 -4.93 5.36 4.05 -0.57 -4.97 115.26 105.72 1a4e n ASN 170 Ca 0.03 0.24 -0.26 0.00 0.45 0.00 0.00 54.58 55.04 1a4e n ASN 170 Cb 0.46 -3.86 -0.03 0.00 1.23 0.00 0.00 39.78 37.59 1a4e n ASN 170 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1a4e s LEU 171 N -2.20 4.17 -0.10 1.20 1.43 -1.26 -4.67 118.68 117.25 1a4e s LEU 171 Ca 0.00 0.40 -0.30 0.00 -1.03 0.00 0.00 54.13 53.21 1a4e s LEU 171 Cb 0.00 -3.20 -0.01 0.00 0.03 0.00 0.00 46.19 43.01 1a4e s LEU 171 CO 0.00 -0.12 1.04 -0.13 0.23 0.00 0.00 176.35 177.37 1a4e s ARG 172 N -3.65 4.41 -0.22 1.70 0.52 -1.26 -0.81 118.95 119.64 1a4e s ARG 172 Ca 0.39 1.43 -0.04 0.00 -0.52 0.00 0.00 55.73 56.99 1a4e s ARG 172 Cb -0.10 -3.55 -0.01 0.00 0.52 0.00 0.00 34.95 31.81 1a4e s ARG 172 CO 0.31 -0.34 -0.04 0.34 0.02 0.00 0.00 175.30 175.59 1a4e s ASP 173 N 1.16 4.36 0.43 0.23 2.15 -1.26 -4.95 116.67 118.79 1a4e s ASP 173 Ca 0.49 -0.37 0.18 0.00 0.43 0.00 0.00 52.55 53.29 1a4e s ASP 173 Cb -0.19 -1.75 1.00 0.00 -0.30 0.00 0.00 42.92 41.68 1a4e s ASP 173 CO 0.18 -0.01 1.92 0.00 -0.17 0.00 0.00 175.17 177.10 1a4e h ALA 174 N 8.04 1.37 -0.40 3.66 0.00 -1.91 -2.82 119.26 127.20 1a4e h ALA 174 Ca -0.41 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.23 1a4e h ALA 174 Cb 1.16 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1a4e h ALA 174 CO 0.60 0.32 0.07 -0.44 0.00 0.00 0.00 179.25 179.80 1a4e h ASP 175 N 0.00 0.62 -0.20 0.00 3.32 -1.94 -2.00 116.42 116.22 1a4e h ASP 175 Ca -0.00 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 1a4e h ASP 175 Cb 0.52 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 1a4e h ASP 175 CO 0.03 0.72 0.08 0.24 -1.72 0.00 0.00 179.24 178.59 1a4e h MET 176 N 0.50 0.30 0.29 3.56 2.86 -1.85 -0.04 114.93 120.57 1a4e h MET 176 Ca 0.12 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1a4e h MET 176 Cb 0.36 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 31.93 1a4e h MET 176 CO 0.01 0.38 -0.52 0.35 1.06 0.00 0.00 176.91 178.19 1a4e h PHE 177 N 0.17 -1.47 0.00 -0.22 3.04 -1.48 -2.05 116.94 114.93 1a4e h PHE 177 Ca 0.07 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 62.02 1a4e h PHE 177 Cb 0.19 0.60 -0.00 0.00 2.56 0.00 0.00 35.95 39.30 1a4e h PHE 177 CO -0.01 -0.63 -0.09 -1.49 -2.02 0.00 0.00 178.31 174.07 1a4e h TRP 178 N -0.87 0.00 -0.36 0.41 4.06 -1.41 -3.09 115.95 114.68 1a4e h TRP 178 Ca -0.03 0.00 -0.09 0.00 2.06 0.00 0.00 58.89 60.83 1a4e h TRP 178 Cb 0.81 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.96 1a4e h TRP 178 CO -0.36 0.09 -0.13 0.22 -3.56 0.00 0.00 178.44 174.70 1a4e h ASP 179 N 0.00 0.74 -0.06 -3.49 3.58 -0.74 -1.87 116.42 114.57 1a4e h ASP 179 Ca -0.00 -0.39 -0.01 0.00 0.42 0.00 0.00 57.03 57.06 1a4e h ASP 179 Cb 0.94 -0.20 -0.00 0.00 1.72 0.00 0.00 39.33 41.78 1a4e h ASP 179 CO 0.01 0.96 0.01 0.15 -2.88 0.00 0.00 179.24 177.49 1a4e h PHE 180 N 0.52 0.10 0.00 0.28 3.57 -1.40 -2.86 116.94 117.15 1a4e h PHE 180 Ca 0.09 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 1a4e h PHE 180 Cb 0.66 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.36 1a4e h PHE 180 CO 0.05 0.29 -0.27 -0.07 -2.23 0.00 0.00 178.31 176.09 1a4e h LEU 181 N -0.12 0.00 -0.77 0.59 3.38 -1.51 -2.87 115.31 114.01 1a4e h LEU 181 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1a4e h LEU 181 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1a4e h LEU 181 CO 0.00 0.27 -0.27 0.35 0.09 0.00 0.00 178.44 178.88 1a4e n THR 182 N -3.78 0.00 -1.95 0.22 -2.24 -0.71 -3.94 114.28 101.89 1a4e n THR 182 Ca -0.01 -0.20 -0.42 0.00 -2.27 0.00 0.00 64.05 61.15 1a4e n THR 182 Cb 0.37 0.70 -0.03 0.00 -2.10 0.00 0.00 70.33 69.27 1a4e n THR 182 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1a4e s THR 183 N -2.40 2.65 0.19 4.28 2.01 -1.08 -4.86 115.64 116.42 1a4e s THR 183 Ca 0.25 0.47 -0.17 0.00 0.31 0.00 0.00 61.69 62.55 1a4e s THR 183 Cb 0.19 -3.30 0.15 0.00 0.01 0.00 0.00 72.50 69.56 1a4e s THR 183 CO 0.50 0.04 1.63 -0.65 -0.69 0.00 0.00 174.62 175.45 1a4e h PRO 184 N 6.75 -0.06 0.00 4.92 0.11 -1.90 0.17 132.00 141.99 1a4e h PRO 184 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1a4e h PRO 184 Cb 1.20 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1a4e h PRO 184 CO 0.91 -0.04 0.00 -0.85 -0.21 0.00 0.00 178.00 177.81 1a4e n GLU 185 N -5.39 0.12 0.00 1.05 0.00 -1.26 -2.33 120.64 112.83 1a4e n GLU 185 Ca 0.04 0.18 0.08 0.00 0.00 0.00 0.00 57.16 57.47 1a4e n GLU 185 Cb 0.30 -1.50 -0.00 0.00 0.00 0.00 0.00 31.44 30.24 1a4e n GLU 185 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1a4e n ASN 186 N -1.39 1.68 0.00 -1.84 3.02 0.01 -2.89 115.26 113.85 1a4e n ASN 186 Ca 0.06 -1.34 0.06 0.00 -0.03 0.00 0.00 54.58 53.33 1a4e n ASN 186 Cb 0.15 0.48 0.28 0.00 -0.61 0.00 0.00 39.78 40.09 1a4e n ASN 186 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1a4e n GLN 187 N -0.13 0.10 0.00 3.52 6.02 -0.98 -1.84 117.38 124.06 1a4e n GLN 187 Ca 0.07 0.22 0.04 0.00 -0.01 0.00 0.00 57.00 57.32 1a4e n GLN 187 Cb 0.36 -1.50 0.20 0.00 1.02 0.00 0.00 30.24 30.32 1a4e n GLN 187 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.06 177.60 1a4e n VAL 188 N -1.38 0.93 0.40 5.09 3.14 -1.26 -1.71 118.33 123.54 1a4e n VAL 188 Ca 0.05 0.23 0.13 0.00 -2.96 0.00 0.00 64.34 61.79 1a4e n VAL 188 Cb 0.11 -1.10 0.50 0.00 -1.06 0.00 0.00 33.84 32.30 1a4e n VAL 188 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1a4e h ALA 189 N 2.37 1.00 -0.96 1.55 0.00 -1.41 -3.38 119.26 118.43 1a4e h ALA 189 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 54.91 55.10 1a4e h ALA 189 Cb 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.79 1a4e h ALA 189 CO 0.00 0.00 0.61 0.97 0.00 0.00 0.00 179.25 180.83 1a4e h ILE 190 N 0.00 0.71 -0.76 0.00 -0.00 -1.60 -0.50 117.51 115.36 1a4e h ILE 190 Ca 0.00 -0.21 -0.04 0.00 -0.00 0.00 0.00 64.86 64.61 1a4e h ILE 190 Cb 0.52 0.04 -0.03 0.00 -0.00 0.00 0.00 36.82 37.35 1a4e h ILE 190 CO 0.00 0.11 0.33 -0.74 -0.00 0.00 0.00 178.15 177.85 1a4e h HIS 191 N 0.61 1.13 -0.05 2.19 2.76 -1.84 -1.93 115.15 118.01 1a4e h HIS 191 Ca 0.52 -0.07 -0.16 0.00 -2.20 0.00 0.00 60.37 58.46 1a4e h HIS 191 Cb 1.01 -0.34 -0.01 0.00 1.55 0.00 0.00 27.41 29.62 1a4e h HIS 191 CO -0.00 0.85 -0.68 0.37 -1.30 0.00 0.00 177.93 177.16 1a4e h GLN 192 N 1.08 0.25 -0.59 5.26 5.75 -1.40 -2.98 115.11 122.48 1a4e h GLN 192 Ca 0.26 -0.19 -0.07 0.00 -0.15 0.00 0.00 58.65 58.50 1a4e h GLN 192 Cb 0.18 0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.74 1a4e h GLN 192 CO -0.03 0.83 0.11 0.28 -2.65 0.00 0.00 178.83 177.38 1a4e h VAL 193 N 0.17 1.25 -0.14 2.39 2.07 -0.90 -1.07 116.25 120.02 1a4e h VAL 193 Ca -0.02 -0.94 0.02 0.00 0.82 0.00 0.00 66.70 66.58 1a4e h VAL 193 Cb 1.22 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.65 1a4e h VAL 193 CO 0.11 0.35 0.02 0.24 0.02 0.00 0.00 177.57 178.30 1a4e h MET 194 N 0.90 0.07 -0.58 1.57 2.86 -1.24 -1.46 114.93 117.04 1a4e h MET 194 Ca 0.19 -0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.74 1a4e h MET 194 Cb 0.38 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 1a4e h MET 194 CO 0.01 0.05 0.04 0.82 1.06 0.00 0.00 176.91 178.88 1a4e h ILE 195 N 0.07 1.26 -0.24 -1.22 2.04 -1.38 -2.65 117.51 115.39 1a4e h ILE 195 Ca 0.06 -1.06 -0.00 0.00 1.00 0.00 0.00 64.86 64.86 1a4e h ILE 195 Cb 0.06 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1a4e h ILE 195 CO -0.09 0.39 0.14 0.25 0.00 0.00 0.00 178.15 178.83 1a4e h LEU 196 N 0.91 0.30 -0.59 1.44 5.85 -0.86 -2.69 115.31 119.68 1a4e h LEU 196 Ca 0.17 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1a4e h LEU 196 Cb 0.48 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.43 1a4e h LEU 196 CO 0.02 0.28 0.00 0.49 -0.34 0.00 0.00 178.44 178.89 1a4e n PHE 197 N -4.87 0.10 -2.03 1.25 3.72 -0.58 -3.74 117.46 111.31 1a4e n PHE 197 Ca -0.03 -0.05 -0.28 0.00 -0.05 0.00 0.00 57.45 57.04 1a4e n PHE 197 Cb 0.06 0.00 0.10 0.00 -0.94 0.00 0.00 39.48 38.71 1a4e n PHE 197 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1a4e s SER 198 N -1.60 4.30 0.20 4.37 1.04 -1.00 -4.43 113.70 116.57 1a4e s SER 198 Ca 0.31 0.52 0.20 0.00 0.48 0.00 0.00 55.95 57.46 1a4e s SER 198 Cb 0.16 -0.96 0.88 0.00 0.10 0.00 0.00 66.02 66.20 1a4e s SER 198 CO 0.25 -1.99 1.61 0.47 0.98 0.00 0.00 173.24 174.56 1a4e n ASP 199 N -3.27 0.48 0.30 7.02 8.00 -1.26 -1.20 116.55 126.62 1a4e n ASP 199 Ca 0.10 0.64 0.19 0.00 0.71 0.00 0.00 54.79 56.43 1a4e n ASP 199 Cb 0.60 -0.73 0.90 0.00 -0.02 0.00 0.00 41.12 41.87 1a4e n ASP 199 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1a4e h ARG 200 N 0.00 0.00 0.00 -1.24 2.47 -1.89 -1.93 114.38 111.79 1a4e h ARG 200 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1a4e h ARG 200 Cb 0.25 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.57 1a4e h ARG 200 CO 0.00 0.01 0.00 0.78 0.56 0.00 0.00 179.97 181.32 1a4e h GLY 201 N 1.15 0.00 -6.58 0.04 0.00 -1.22 -3.34 103.07 93.11 1a4e h GLY 201 Ca -0.00 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.73 1a4e h GLY 201 CO 0.00 0.00 -0.77 -1.30 0.00 0.00 0.00 176.54 174.47 1a4e n THR 202 N -2.76 0.55 -1.89 4.70 -2.24 -0.73 -2.55 114.28 109.35 1a4e n THR 202 Ca 0.01 -4.36 -0.35 0.00 -2.27 0.00 0.00 64.05 57.09 1a4e n THR 202 Cb 0.29 -1.97 0.04 0.00 -2.10 0.00 0.00 70.33 66.59 1a4e n THR 202 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1a4e s PRO 203 N -1.10 2.86 0.41 -0.78 0.04 -1.26 -1.59 135.00 133.58 1a4e s PRO 203 Ca 0.31 1.66 0.10 0.00 0.04 0.00 0.00 61.00 63.12 1a4e s PRO 203 Cb 0.04 -1.93 0.87 0.00 0.04 0.00 0.00 34.50 33.52 1a4e s PRO 203 CO -0.15 -1.26 1.98 0.00 0.04 0.00 0.00 177.00 177.61 1a4e h ALA 204 N 0.52 1.62 -2.02 8.56 0.00 -1.44 -3.42 119.26 123.09 1a4e h ALA 204 Ca -0.49 -0.14 0.27 0.00 0.00 0.00 0.00 54.91 54.55 1a4e h ALA 204 Cb 1.28 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.90 1a4e h ALA 204 CO 0.54 0.28 0.74 0.54 0.00 0.00 0.00 179.25 181.36 1a4e s ASN 205 N -6.88 -0.04 0.46 0.00 2.20 -1.26 -4.87 114.94 104.55 1a4e s ASN 205 Ca -0.06 -0.32 0.24 0.00 -0.94 0.00 0.00 52.86 51.78 1a4e s ASN 205 Cb 0.16 0.29 1.04 0.00 -2.00 0.00 0.00 41.25 40.74 1a4e s ASN 205 CO 0.72 -0.55 1.88 1.88 -2.94 0.00 0.00 177.10 178.09 1a4e h TYR 206 N 2.00 0.00 0.00 1.54 0.05 -1.90 -2.89 116.97 115.77 1a4e h TYR 206 Ca -0.27 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.51 1a4e h TYR 206 Cb 1.21 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.95 1a4e h TYR 206 CO 0.87 0.21 0.00 0.00 -1.05 0.00 0.00 178.16 178.20 1a4e h ARG 207 N 0.00 0.00 -1.48 4.88 3.08 -1.96 -3.30 114.38 115.60 1a4e h ARG 207 Ca -0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.44 1a4e h ARG 207 Cb 0.65 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 30.29 1a4e h ARG 207 CO 0.03 0.00 -0.55 -1.13 -1.07 0.00 0.00 179.97 177.24 1a4e n SER 208 N -2.97 5.03 -3.94 7.04 3.41 -1.09 -4.48 113.62 116.62 1a4e n SER 208 Ca 0.02 -3.74 -0.09 0.00 -0.26 0.00 0.00 58.87 54.81 1a4e n SER 208 Cb 0.39 -0.51 -0.09 0.00 -0.26 0.00 0.00 64.21 63.75 1a4e n SER 208 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a4e s MET 209 N -3.60 0.69 0.60 4.33 0.23 -1.25 -2.67 119.30 117.63 1a4e s MET 209 Ca 0.49 -0.93 0.01 0.00 -1.03 0.00 0.00 55.69 54.23 1a4e s MET 209 Cb 0.41 0.27 0.06 0.00 -1.53 0.00 0.00 34.83 34.03 1a4e s MET 209 CO -0.18 -0.18 0.84 -1.01 -2.03 0.00 0.00 175.02 172.45 1a4e s HIS 210 N -3.35 2.50 0.00 3.16 3.76 -1.26 -4.24 115.29 115.86 1a4e s HIS 210 Ca 0.01 -0.09 0.04 0.00 -0.15 0.00 0.00 55.06 54.88 1a4e s HIS 210 Cb 0.03 -2.81 -0.01 0.00 1.11 0.00 0.00 32.58 30.90 1a4e s HIS 210 CO -0.08 -1.11 -0.14 0.20 -0.85 0.00 0.00 174.74 172.77 1a4e s GLY 211 N -4.51 0.69 -0.06 -2.22 0.00 0.31 -4.17 107.32 97.36 1a4e s GLY 211 Ca 0.60 -0.65 -0.08 0.00 0.00 0.00 0.00 44.72 44.59 1a4e s GLY 211 CO 0.40 -0.57 0.20 -0.19 0.00 0.00 0.00 173.10 172.93 1a4e s TYR 212 N -0.47 -0.16 0.27 1.90 1.51 -0.32 -0.25 117.35 119.82 1a4e s TYR 212 Ca 0.04 0.38 0.00 0.00 -1.01 0.00 0.00 57.07 56.48 1a4e s TYR 212 Cb -0.06 0.05 0.55 0.00 -0.11 0.00 0.00 41.96 42.40 1a4e s TYR 212 CO 0.00 -0.16 1.78 1.03 -1.11 0.00 0.00 175.55 177.09 1a4e h SER 213 N 5.37 0.64 0.00 2.29 0.87 -1.55 -3.11 113.55 118.05 1a4e h SER 213 Ca -0.27 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.37 1a4e h SER 213 Cb 1.19 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.12 1a4e h SER 213 CO 0.39 0.28 0.00 0.61 -0.53 0.00 0.00 176.83 177.58 1a4e n GLY 214 N -1.33 2.14 3.87 5.77 0.00 -1.25 -4.81 105.19 109.57 1a4e n GLY 214 Ca 0.18 -0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 1a4e n GLY 214 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1a4e s HIS 215 N 0.00 3.35 -0.01 1.61 3.76 -1.26 -4.79 115.29 117.95 1a4e s HIS 215 Ca 0.00 1.16 -0.21 0.00 -0.15 0.00 0.00 55.06 55.86 1a4e s HIS 215 Cb 0.00 -2.95 -0.05 0.00 1.11 0.00 0.00 32.58 30.69 1a4e s HIS 215 CO 0.00 -1.10 0.62 0.99 -0.85 0.00 0.00 174.74 174.41 1a4e s THR 216 N -3.26 4.91 0.40 1.30 2.01 -1.26 -4.71 115.64 115.03 1a4e s THR 216 Ca 0.57 1.30 0.08 0.00 0.31 0.00 0.00 61.69 63.95 1a4e s THR 216 Cb -0.12 -3.96 -0.05 0.00 0.01 0.00 0.00 72.50 68.38 1a4e s THR 216 CO 0.53 0.39 0.17 -0.31 -0.69 0.00 0.00 174.62 174.71 1a4e s TYR 217 N -0.04 2.62 -0.28 4.92 1.51 -0.10 -3.41 117.35 122.57 1a4e s TYR 217 Ca 0.32 -0.54 0.01 0.00 -1.01 0.00 0.00 57.07 55.85 1a4e s TYR 217 Cb -0.18 -1.88 0.05 0.00 -0.11 0.00 0.00 41.96 39.84 1a4e s TYR 217 CO 0.18 0.22 -0.06 0.15 -1.11 0.00 0.00 175.55 174.93 1a4e s LYS 218 N -3.89 2.35 -0.09 -0.62 1.02 0.12 -0.72 119.74 117.91 1a4e s LYS 218 Ca 0.40 -1.30 -0.02 0.00 0.02 0.00 0.00 55.97 55.08 1a4e s LYS 218 Cb 0.02 -3.04 -0.03 0.00 -0.52 0.00 0.00 37.83 34.26 1a4e s LYS 218 CO 0.23 -0.59 -0.00 -1.58 -0.92 0.00 0.00 175.35 172.48 1a4e s TRP 219 N 1.18 3.15 0.05 3.18 0.52 -0.66 -1.38 118.94 124.98 1a4e s TRP 219 Ca -0.07 0.15 0.03 0.00 0.02 0.00 0.00 56.10 56.23 1a4e s TRP 219 Cb -0.20 -1.81 -0.03 0.00 -1.15 0.00 0.00 33.47 30.29 1a4e s TRP 219 CO -0.03 0.42 -0.10 -1.54 0.02 0.00 0.00 176.95 175.71 1a4e s SER 220 N -0.75 1.20 0.89 2.95 1.04 -0.55 -1.27 113.70 117.21 1a4e s SER 220 Ca 0.12 -0.55 -0.12 0.00 0.48 0.00 0.00 55.95 55.87 1a4e s SER 220 Cb -0.12 -0.01 0.17 0.00 0.10 0.00 0.00 66.02 66.16 1a4e s SER 220 CO 0.02 -0.13 1.23 0.54 0.98 0.00 0.00 173.24 175.88 1a4e s ASN 221 N -1.56 3.57 0.33 7.02 2.20 -0.65 -1.40 114.94 124.45 1a4e s ASN 221 Ca -0.06 0.20 0.26 0.00 -0.94 0.00 0.00 52.86 52.32 1a4e s ASN 221 Cb -0.10 -0.38 1.08 0.00 -2.00 0.00 0.00 41.25 39.86 1a4e s ASN 221 CO 0.01 -2.43 1.78 0.11 -2.94 0.00 0.00 177.10 173.63 1a4e h LYS 222 N -1.31 0.00 0.00 3.55 1.57 -1.89 -2.57 116.57 115.92 1a4e h LYS 222 Ca -0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1a4e h LYS 222 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.56 1a4e h LYS 222 CO 0.42 0.00 -0.16 0.09 -0.57 0.00 0.00 179.45 179.23 1a4e n ASN 223 N -2.43 0.53 0.00 0.86 4.13 -1.26 -4.93 115.26 112.16 1a4e n ASN 223 Ca 0.02 0.39 0.00 0.00 1.68 0.00 0.00 54.58 56.66 1a4e n ASN 223 Cb 0.24 -0.43 0.00 0.00 -1.54 0.00 0.00 39.78 38.05 1a4e n ASN 223 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1a4e n GLY 224 N 1.39 0.52 3.74 7.41 0.00 -0.97 -5.08 105.19 112.20 1a4e n GLY 224 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1a4e n GLY 224 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1a4e s ASP 225 N -2.45 7.55 0.22 1.61 1.01 -1.26 -4.87 116.67 118.47 1a4e s ASP 225 Ca 0.00 1.90 0.06 0.00 0.71 0.00 0.00 52.55 55.22 1a4e s ASP 225 Cb 0.00 -2.60 -0.05 0.00 1.01 0.00 0.00 42.92 41.28 1a4e s ASP 225 CO 0.00 0.03 -0.09 -1.66 0.21 0.00 0.00 175.17 173.66 1a4e s TRP 226 N -0.61 1.66 -0.01 4.23 1.48 -1.26 -1.63 118.94 122.80 1a4e s TRP 226 Ca 0.44 -0.70 -0.05 0.00 -1.06 0.00 0.00 56.10 54.73 1a4e s TRP 226 Cb -0.25 -0.86 0.00 0.00 -1.16 0.00 0.00 33.47 31.20 1a4e s TRP 226 CO 0.31 0.22 0.11 -1.01 -4.06 0.00 0.00 176.95 172.53 1a4e s HIS 227 N -3.13 0.01 0.01 1.66 3.76 -0.40 -4.79 115.29 112.42 1a4e s HIS 227 Ca 0.24 -0.04 -0.30 0.00 -0.15 0.00 0.00 55.06 54.81 1a4e s HIS 227 Cb 0.02 -0.04 -0.05 0.00 1.11 0.00 0.00 32.58 33.63 1a4e s HIS 227 CO 0.07 -0.21 1.22 0.71 -0.85 0.00 0.00 174.74 175.69 1a4e s TYR 228 N -0.94 3.28 0.02 1.40 2.02 0.01 -1.65 117.35 121.49 1a4e s TYR 228 Ca -0.10 1.22 0.06 0.00 -0.37 0.00 0.00 57.07 57.88 1a4e s TYR 228 Cb -0.06 -3.44 -0.02 0.00 -0.40 0.00 0.00 41.96 38.04 1a4e s TYR 228 CO 0.01 -1.41 -0.19 0.08 -1.57 0.00 0.00 175.55 172.47 1a4e s VAL 229 N 1.65 1.53 -0.06 0.71 1.01 0.10 -1.20 120.40 124.14 1a4e s VAL 229 Ca 0.58 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 61.54 1a4e s VAL 229 Cb -0.28 -1.32 0.02 0.00 0.00 0.00 0.00 36.38 34.81 1a4e s VAL 229 CO 0.26 0.25 -0.07 -1.10 0.00 0.00 0.00 175.10 174.45 1a4e s GLN 230 N -0.91 1.14 0.03 2.72 -0.21 -0.83 -0.92 119.66 120.68 1a4e s GLN 230 Ca 0.07 -0.20 -0.07 0.00 0.02 0.00 0.00 55.36 55.17 1a4e s GLN 230 Cb -0.08 -1.08 -0.05 0.00 1.00 0.00 0.00 33.01 32.80 1a4e s GLN 230 CO 0.01 -0.07 0.31 0.08 -2.12 0.00 0.00 175.29 173.49 1a4e s VAL 231 N 0.95 5.24 -0.19 1.09 1.01 -1.26 -1.29 120.40 125.95 1a4e s VAL 231 Ca -0.10 0.22 -0.02 0.00 0.00 0.00 0.00 61.98 62.07 1a4e s VAL 231 Cb -0.15 -3.59 0.06 0.00 0.00 0.00 0.00 36.38 32.70 1a4e s VAL 231 CO 0.00 0.32 0.01 -1.00 0.00 0.00 0.00 175.10 174.44 1a4e s HIS 232 N -1.35 1.27 -0.71 5.22 3.76 0.26 -1.47 115.29 122.26 1a4e s HIS 232 Ca 0.30 -0.98 -0.12 0.00 -0.15 0.00 0.00 55.06 54.11 1a4e s HIS 232 Cb -0.13 -1.12 0.19 0.00 1.11 0.00 0.00 32.58 32.62 1a4e s HIS 232 CO 0.17 -0.62 0.63 0.42 -0.85 0.00 0.00 174.74 174.49 1a4e s ILE 233 N 1.78 5.12 0.00 0.60 1.01 0.65 -0.46 121.20 129.90 1a4e s ILE 233 Ca -0.01 -2.31 -0.24 0.00 0.00 0.00 0.00 60.65 58.09 1a4e s ILE 233 Cb -0.17 -4.22 -0.05 0.00 0.01 0.00 0.00 42.46 38.03 1a4e s ILE 233 CO -0.07 -0.95 0.72 -0.54 0.00 0.00 0.00 174.94 174.09 1a4e s LYS 234 N 0.49 4.44 0.14 2.79 -0.14 0.07 -0.53 119.74 127.01 1a4e s LYS 234 Ca 0.14 0.95 -0.30 0.00 -1.36 0.00 0.00 55.97 55.40 1a4e s LYS 234 Cb -0.17 -3.39 -0.07 0.00 -1.68 0.00 0.00 37.83 32.53 1a4e s LYS 234 CO -0.05 0.23 1.13 -0.08 -0.76 0.00 0.00 175.35 175.82 1a4e s THR 235 N 0.20 3.92 -0.85 2.17 -1.32 -1.26 -0.20 115.64 118.30 1a4e s THR 235 Ca 0.37 1.55 0.27 0.00 -1.21 0.00 0.00 61.69 62.67 1a4e s THR 235 Cb -0.19 -3.99 0.23 0.00 -1.51 0.00 0.00 72.50 67.03 1a4e s THR 235 CO 0.20 0.22 1.77 0.47 -2.21 0.00 0.00 174.62 175.07 1a4e n ASP 236 N 2.87 0.46 0.04 8.08 8.00 -0.84 -2.92 116.55 132.24 1a4e n ASP 236 Ca 0.05 0.44 0.12 0.00 0.71 0.00 0.00 54.79 56.11 1a4e n ASP 236 Cb 0.46 -0.51 0.23 0.00 -0.02 0.00 0.00 41.12 41.28 1a4e n ASP 236 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a4e n GLN 237 N -1.89 0.19 0.00 -1.24 3.00 -1.26 -5.03 117.38 111.15 1a4e n GLN 237 Ca 0.06 0.06 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 1a4e n GLN 237 Cb 0.39 -1.62 0.00 0.00 0.00 0.00 0.00 30.24 29.01 1a4e n GLN 237 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1a4e n GLY 238 N 1.39 -1.30 3.69 1.08 0.00 -1.15 -4.90 105.19 104.00 1a4e n GLY 238 Ca 0.04 -1.45 -0.42 0.00 0.00 0.00 0.00 46.02 44.19 1a4e n GLY 238 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a4e s ILE 239 N -3.35 3.10 -0.05 -0.61 -1.09 -1.26 -4.52 121.20 113.41 1a4e s ILE 239 Ca 0.00 0.52 0.00 0.00 -2.23 0.00 0.00 60.65 58.95 1a4e s ILE 239 Cb 0.00 -3.34 0.02 0.00 -1.58 0.00 0.00 42.46 37.57 1a4e s ILE 239 CO 0.00 -0.00 -0.02 -0.75 -1.23 0.00 0.00 174.94 172.93 1a4e s LYS 240 N 2.70 0.67 0.41 2.79 2.20 -1.09 -5.05 119.74 122.36 1a4e s LYS 240 Ca 0.73 -0.01 0.07 0.00 -0.36 0.00 0.00 55.97 56.41 1a4e s LYS 240 Cb -0.39 -0.81 -0.07 0.00 -1.51 0.00 0.00 37.83 35.05 1a4e s LYS 240 CO 0.32 -0.16 0.05 -0.80 -0.36 0.00 0.00 175.35 174.40 1a4e s ASN 241 N 1.24 4.01 0.18 1.43 0.01 -1.26 -1.34 114.94 119.20 1a4e s ASN 241 Ca -0.06 -1.28 0.11 0.00 -0.71 0.00 0.00 52.86 50.91 1a4e s ASN 241 Cb -0.14 -0.42 -0.04 0.00 0.41 0.00 0.00 41.25 41.06 1a4e s ASN 241 CO -0.02 -0.45 -0.21 -0.76 -1.51 0.00 0.00 177.10 174.15 1a4e s LEU 242 N -3.75 2.57 0.73 0.60 1.43 -0.62 -4.49 118.68 115.14 1a4e s LEU 242 Ca 0.36 -0.76 -0.09 0.00 -1.03 0.00 0.00 54.13 52.61 1a4e s LEU 242 Cb 0.08 -1.32 0.06 0.00 0.03 0.00 0.00 46.19 45.04 1a4e s LEU 242 CO 0.19 0.13 1.07 0.42 0.23 0.00 0.00 176.35 178.39 1a4e s THR 243 N -1.56 2.46 0.31 5.49 -4.23 -1.26 -4.70 115.64 112.15 1a4e s THR 243 Ca 0.21 -0.07 0.13 0.00 -1.18 0.00 0.00 61.69 60.78 1a4e s THR 243 Cb -0.09 -3.10 0.05 0.00 1.34 0.00 0.00 72.50 70.70 1a4e s THR 243 CO 0.11 -0.12 1.73 -0.29 -0.54 0.00 0.00 174.62 175.51 1a4e h ILE 244 N -0.71 1.28 -0.49 2.99 6.09 -1.97 -1.71 117.51 122.98 1a4e h ILE 244 Ca -0.45 -1.65 -0.10 0.00 -1.37 0.00 0.00 64.86 61.29 1a4e h ILE 244 Cb 1.31 1.90 -0.02 0.00 0.47 0.00 0.00 36.82 40.48 1a4e h ILE 244 CO 0.63 0.46 -0.08 -0.33 -3.07 0.00 0.00 178.15 175.76 1a4e h GLU 245 N 0.00 0.93 -0.19 2.19 3.07 -1.99 -1.33 114.58 117.25 1a4e h GLU 245 Ca -0.00 -0.34 -0.02 0.00 -0.50 0.00 0.00 59.36 58.50 1a4e h GLU 245 Cb 0.86 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.70 1a4e h GLU 245 CO 0.06 0.99 0.05 0.93 -1.40 0.00 0.00 179.01 179.64 1a4e h GLU 246 N 0.78 0.31 -0.88 2.33 5.08 -1.91 -2.24 114.58 118.05 1a4e h GLU 246 Ca 0.13 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 1a4e h GLU 246 Cb 0.63 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.79 1a4e h GLU 246 CO 0.04 0.43 0.53 0.00 -1.00 0.00 0.00 179.01 179.01 1a4e h ALA 247 N 0.86 1.27 -0.17 3.43 0.00 -1.25 -1.98 119.26 121.42 1a4e h ALA 247 Ca 0.06 -0.10 -0.16 0.00 0.00 0.00 0.00 54.91 54.72 1a4e h ALA 247 Cb 0.26 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1a4e h ALA 247 CO 0.00 0.62 -0.55 1.15 0.00 0.00 0.00 179.25 180.48 1a4e h THR 248 N 1.22 1.33 -0.02 0.00 2.02 -1.19 -1.26 112.91 115.00 1a4e h THR 248 Ca 0.32 -1.80 -0.00 0.00 0.77 0.00 0.00 66.41 65.69 1a4e h THR 248 Cb -0.05 1.79 -0.00 0.00 -1.74 0.00 0.00 68.15 68.15 1a4e h THR 248 CO -0.06 0.56 0.01 0.11 0.37 0.00 0.00 175.52 176.50 1a4e h LYS 249 N 0.40 0.04 -0.02 6.66 1.57 -1.04 -2.99 116.57 121.19 1a4e h LYS 249 Ca 0.01 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 1a4e h LYS 249 Cb 1.08 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.38 1a4e h LYS 249 CO 0.10 0.24 -0.22 0.82 -0.57 0.00 0.00 179.45 179.81 1a4e h ILE 250 N -0.17 1.17 -0.85 1.86 2.04 -1.35 -1.78 117.51 118.43 1a4e h ILE 250 Ca 0.01 -0.80 0.03 0.00 1.00 0.00 0.00 64.86 65.10 1a4e h ILE 250 Cb 0.21 1.41 -0.05 0.00 -0.74 0.00 0.00 36.82 37.65 1a4e h ILE 250 CO -0.00 0.23 0.55 0.00 0.00 0.00 0.00 178.15 178.93 1a4e h ALA 251 N 1.75 1.13 0.25 1.87 0.00 -1.07 0.20 119.26 123.39 1a4e h ALA 251 Ca 0.00 -0.03 -0.34 0.00 0.00 0.00 0.00 54.91 54.54 1a4e h ALA 251 Cb 0.41 -0.29 0.04 0.00 0.00 0.00 0.00 17.79 17.95 1a4e h ALA 251 CO 0.03 0.39 -1.50 0.78 0.00 0.00 0.00 179.25 178.95 1a4e h GLY 252 N 1.07 0.61 0.55 0.00 0.00 -1.50 -3.24 103.07 100.55 1a4e h GLY 252 Ca 0.34 -1.55 -0.03 0.00 0.00 0.00 0.00 47.33 46.09 1a4e h GLY 252 CO -0.12 1.36 -0.26 0.23 0.00 0.00 0.00 176.54 177.75 1a4e h SER 253 N 0.14 -0.63 -3.20 0.19 0.87 -1.16 -3.42 113.55 106.34 1a4e h SER 253 Ca -0.26 0.02 -0.59 0.00 -1.23 0.00 0.00 61.79 59.73 1a4e h SER 253 Cb 2.17 0.16 -0.40 0.00 -0.44 0.00 0.00 62.40 63.89 1a4e h SER 253 CO 0.27 -0.36 -0.76 0.21 -0.53 0.00 0.00 176.83 175.66 1a4e s ASN 254 N -3.77 3.79 0.62 6.23 2.47 0.68 -4.99 114.94 119.96 1a4e s ASN 254 Ca -0.11 -2.02 0.32 0.00 0.42 0.00 0.00 52.86 51.48 1a4e s ASN 254 Cb 0.01 -0.86 1.81 0.00 -1.45 0.00 0.00 41.25 40.76 1a4e s ASN 254 CO 0.32 -0.36 2.11 -0.65 -3.72 0.00 0.00 177.10 174.81 1a4e h PRO 255 N 7.53 0.00 -0.83 0.43 0.11 -1.64 -2.74 132.00 134.86 1a4e h PRO 255 Ca -0.07 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.44 1a4e h PRO 255 Cb 0.98 0.00 -0.38 0.00 0.11 0.00 0.00 31.00 31.71 1a4e h PRO 255 CO 0.45 0.00 -0.26 -0.25 -0.21 0.00 0.00 178.00 177.73 1a4e n ASP 256 N -3.43 5.85 -0.09 -2.05 8.00 -1.26 -0.70 116.55 122.87 1a4e n ASP 256 Ca 0.00 -3.76 -0.08 0.00 0.71 0.00 0.00 54.79 51.66 1a4e n ASP 256 Cb 0.30 -0.55 -0.01 0.00 -0.02 0.00 0.00 41.12 40.84 1a4e n ASP 256 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1a4e h TYR 257 N 2.12 0.32 0.00 1.24 3.20 -1.83 -0.77 116.97 121.25 1a4e h TYR 257 Ca 0.45 0.01 -0.16 0.00 3.14 0.00 0.00 58.73 62.17 1a4e h TYR 257 Cb 1.30 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.45 1a4e h TYR 257 CO 1.04 0.18 -0.75 0.00 -1.64 0.00 0.00 178.16 176.99 1a4e h GLN 259 N 0.00 0.68 -0.49 0.00 5.75 -1.88 -2.01 115.11 117.15 1a4e h GLN 259 Ca -0.01 -0.23 -0.04 0.00 -0.15 0.00 0.00 58.65 58.23 1a4e h GLN 259 Cb 1.37 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.85 1a4e h GLN 259 CO 0.10 0.79 0.15 0.37 -2.65 0.00 0.00 178.83 177.59 1a4e h GLN 260 N 0.49 0.76 -0.22 1.69 4.15 -1.12 -1.71 115.11 119.15 1a4e h GLN 260 Ca 0.10 -0.16 -0.00 0.00 0.77 0.00 0.00 58.65 59.36 1a4e h GLN 260 Cb 0.50 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 1a4e h GLN 260 CO 0.02 0.71 0.13 0.22 -1.93 0.00 0.00 178.83 177.99 1a4e h ASP 261 N 0.66 0.27 -0.48 -0.69 3.58 -1.23 -0.84 116.42 117.69 1a4e h ASP 261 Ca 0.16 -0.05 -0.09 0.00 0.42 0.00 0.00 57.03 57.46 1a4e h ASP 261 Cb 0.27 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 41.24 1a4e h ASP 261 CO -0.01 0.24 -0.06 0.25 -2.88 0.00 0.00 179.24 176.78 1a4e h LEU 262 N 0.27 0.89 0.18 2.28 5.85 -1.31 -1.27 115.31 122.20 1a4e h LEU 262 Ca 0.08 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.45 1a4e h LEU 262 Cb 0.02 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.81 1a4e h LEU 262 CO -0.01 1.02 -0.08 0.15 -0.34 0.00 0.00 178.44 179.17 1a4e h PHE 263 N 0.75 -0.22 -0.26 1.25 3.57 -1.21 -2.56 116.94 118.25 1a4e h PHE 263 Ca 0.13 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.56 1a4e h PHE 263 Cb 0.60 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.40 1a4e h PHE 263 CO 0.04 -0.02 -0.11 0.93 -2.23 0.00 0.00 178.31 176.93 1a4e h GLU 264 N -0.39 0.43 -0.19 1.11 5.08 -1.17 -1.18 114.58 118.27 1a4e h GLU 264 Ca -0.02 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.20 1a4e h GLU 264 Cb 0.30 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1a4e h GLU 264 CO 0.04 0.55 0.05 0.00 -1.00 0.00 0.00 179.01 178.65 1a4e h ALA 265 N 1.48 0.25 -0.41 3.43 0.00 -1.16 -0.86 119.26 121.99 1a4e h ALA 265 Ca 0.08 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 1a4e h ALA 265 Cb 0.45 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1a4e h ALA 265 CO 0.02 -0.11 -0.21 0.82 0.00 0.00 0.00 179.25 179.78 1a4e h ILE 266 N 0.13 1.27 -0.45 0.00 2.04 -1.35 -1.37 117.51 117.78 1a4e h ILE 266 Ca 0.06 -1.33 -0.05 0.00 1.00 0.00 0.00 64.86 64.54 1a4e h ILE 266 Cb 0.26 1.18 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 1a4e h ILE 266 CO 0.00 0.45 0.08 -0.61 0.00 0.00 0.00 178.15 178.07 1a4e h GLN 267 N 0.72 0.68 -0.12 2.37 4.15 -1.07 -2.13 115.11 119.72 1a4e h GLN 267 Ca 0.10 -0.14 0.00 0.00 0.77 0.00 0.00 58.65 59.38 1a4e h GLN 267 Cb 0.73 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.32 1a4e h GLN 267 CO 0.06 0.64 0.00 0.09 -1.93 0.00 0.00 178.83 177.69 1a4e n ASN 268 N -4.29 1.07 0.00 -0.69 3.02 -0.34 -4.92 115.26 109.11 1a4e n ASN 268 Ca 0.03 -1.66 0.00 0.00 -0.03 0.00 0.00 54.58 52.92 1a4e n ASN 268 Cb 0.22 -0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.32 1a4e n ASN 268 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1a4e n GLY 269 N 0.98 0.91 3.24 7.41 0.00 -0.80 -4.96 105.19 111.97 1a4e n GLY 269 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 1a4e n GLY 269 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1a4e n ASN 270 N 0.00 5.21 -4.67 1.61 4.05 -0.53 -4.99 115.26 115.94 1a4e n ASN 270 Ca 0.00 -3.04 -0.42 0.00 0.45 0.00 0.00 54.58 51.57 1a4e n ASN 270 Cb 0.00 -1.53 -0.03 0.00 1.23 0.00 0.00 39.78 39.46 1a4e n ASN 270 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 177.26 173.90 1a4e s TYR 271 N 0.97 2.34 0.26 1.20 2.02 -1.26 -4.26 117.35 118.61 1a4e s TYR 271 Ca 0.41 0.48 -0.29 0.00 -0.37 0.00 0.00 57.07 57.29 1a4e s TYR 271 Cb 0.02 -3.79 -0.10 0.00 -0.40 0.00 0.00 41.96 37.69 1a4e s TYR 271 CO 0.00 -3.16 1.27 -1.25 -1.57 0.00 0.00 175.55 170.84 1a4e s PRO 272 N 3.56 4.42 0.13 -1.71 0.04 -1.25 -4.90 135.00 135.30 1a4e s PRO 272 Ca 0.68 2.07 0.04 0.00 0.04 0.00 0.00 61.00 63.83 1a4e s PRO 272 Cb -0.31 -3.15 -0.04 0.00 0.04 0.00 0.00 34.50 31.05 1a4e s PRO 272 CO 0.26 -0.14 -0.11 -1.54 0.04 0.00 0.00 177.00 175.51 1a4e s SER 273 N -0.20 1.70 -0.01 6.66 1.04 -1.26 -1.68 113.70 119.95 1a4e s SER 273 Ca 0.51 -0.93 0.01 0.00 0.48 0.00 0.00 55.95 56.03 1a4e s SER 273 Cb -0.37 -0.01 -0.00 0.00 0.10 0.00 0.00 66.02 65.74 1a4e s SER 273 CO 0.44 -0.29 -0.05 0.26 0.98 0.00 0.00 173.24 174.58 1a4e s TRP 274 N -2.94 0.44 -0.21 5.02 0.51 0.24 -1.98 118.94 120.03 1a4e s TRP 274 Ca 0.12 -0.08 -0.14 0.00 -2.12 0.00 0.00 56.10 53.88 1a4e s TRP 274 Cb 0.00 -0.30 -0.04 0.00 -0.81 0.00 0.00 33.47 32.32 1a4e s TRP 274 CO 0.01 -0.02 0.32 0.99 -0.51 0.00 0.00 176.95 177.74 1a4e s THR 275 N -0.04 5.26 -0.09 2.01 2.01 0.72 -0.86 115.64 124.64 1a4e s THR 275 Ca 0.01 0.54 -0.22 0.00 0.31 0.00 0.00 61.69 62.34 1a4e s THR 275 Cb -0.03 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.79 1a4e s THR 275 CO -0.00 0.29 0.63 -0.69 -0.69 0.00 0.00 174.62 174.16 1a4e s VAL 276 N 1.13 5.09 0.11 3.82 1.01 -0.31 -0.75 120.40 130.50 1a4e s VAL 276 Ca 0.16 1.27 0.04 0.00 0.00 0.00 0.00 61.98 63.45 1a4e s VAL 276 Cb -0.14 -3.96 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 1a4e s VAL 276 CO 0.06 0.26 -0.10 -0.31 0.00 0.00 0.00 175.10 175.01 1a4e s TYR 277 N 0.85 1.14 0.04 5.22 1.51 0.40 -0.80 117.35 125.71 1a4e s TYR 277 Ca 0.33 -0.68 0.02 0.00 -1.01 0.00 0.00 57.07 55.73 1a4e s TYR 277 Cb -0.17 -0.61 -0.02 0.00 -0.11 0.00 0.00 41.96 41.05 1a4e s TYR 277 CO 0.15 0.03 -0.07 0.96 -1.11 0.00 0.00 175.55 175.51 1a4e s ILE 278 N -2.68 0.49 -0.11 2.71 -4.36 -0.15 -0.58 121.20 116.53 1a4e s ILE 278 Ca 0.09 -1.07 -0.02 0.00 -0.26 0.00 0.00 60.65 59.39 1a4e s ILE 278 Cb -0.01 -0.58 -0.03 0.00 1.25 0.00 0.00 42.46 43.09 1a4e s ILE 278 CO 0.00 -0.40 -0.03 -1.10 0.24 0.00 0.00 174.94 173.65 1a4e s GLN 279 N -1.59 3.18 0.25 0.37 -0.21 -0.41 -0.85 119.66 120.40 1a4e s GLN 279 Ca -0.10 -0.49 0.12 0.00 0.02 0.00 0.00 55.36 54.90 1a4e s GLN 279 Cb -0.10 -2.78 -0.05 0.00 1.00 0.00 0.00 33.01 31.08 1a4e s GLN 279 CO 0.00 0.52 -0.20 0.95 -2.12 0.00 0.00 175.29 174.44 1a4e s THR 280 N -0.39 2.50 -0.05 -0.19 -4.23 -1.26 -1.96 115.64 110.05 1a4e s THR 280 Ca 0.07 -2.27 -0.27 0.00 -1.18 0.00 0.00 61.69 58.04 1a4e s THR 280 Cb -0.12 -2.28 0.06 0.00 1.34 0.00 0.00 72.50 71.50 1a4e s THR 280 CO 0.02 -0.31 0.59 -0.32 -0.54 0.00 0.00 174.62 174.07 1a4e s MET 281 N -3.26 0.96 0.40 3.99 0.00 -0.34 -4.96 119.30 116.09 1a4e s MET 281 Ca 0.27 0.18 0.02 0.00 0.00 0.00 0.00 55.69 56.15 1a4e s MET 281 Cb -0.06 0.45 -0.01 0.00 0.00 0.00 0.00 34.83 35.21 1a4e s MET 281 CO 0.14 -0.29 0.60 0.99 0.00 0.00 0.00 175.02 176.46 1a4e s THR 282 N -1.18 4.28 0.37 10.11 2.01 -1.26 -0.81 115.64 129.16 1a4e s THR 282 Ca -0.11 -0.59 0.04 0.00 0.31 0.00 0.00 61.69 61.33 1a4e s THR 282 Cb -0.01 -3.56 0.25 0.00 0.01 0.00 0.00 72.50 69.19 1a4e s THR 282 CO 0.08 -0.35 2.01 -0.08 -0.69 0.00 0.00 174.62 175.59 1a4e h GLU 283 N 0.58 0.69 -0.49 4.92 4.81 -1.99 -1.52 114.58 121.59 1a4e h GLU 283 Ca -0.47 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 58.63 1a4e h GLU 283 Cb 1.25 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.46 1a4e h GLU 283 CO 0.57 0.49 0.00 -0.09 -0.73 0.00 0.00 179.01 179.26 1a4e h ARG 284 N 0.71 0.86 -0.11 1.92 2.43 -2.00 -2.90 114.38 115.29 1a4e h ARG 284 Ca 0.19 -0.27 -0.08 0.00 -0.81 0.00 0.00 59.98 59.00 1a4e h ARG 284 Cb -0.02 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 1a4e h ARG 284 CO -0.04 0.90 -0.30 -0.44 -1.51 0.00 0.00 179.97 178.58 1a4e h ASP 285 N 0.72 0.21 -0.03 -3.80 3.32 -1.83 -2.71 116.42 112.31 1a4e h ASP 285 Ca 0.14 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1a4e h ASP 285 Cb 0.51 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 1a4e h ASP 285 CO 0.02 0.51 -0.04 0.00 -1.72 0.00 0.00 179.24 178.02 1a4e h ALA 286 N 1.51 1.71 -0.00 3.45 0.00 -1.11 -2.24 119.26 122.58 1a4e h ALA 286 Ca 0.03 -0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 1a4e h ALA 286 Cb 0.63 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1a4e h ALA 286 CO 0.05 0.22 -0.66 0.87 0.00 0.00 0.00 179.25 179.72 1a4e h LYS 287 N 0.18 0.01 -0.67 0.00 1.57 -1.29 -3.17 116.57 113.20 1a4e h LYS 287 Ca 0.04 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1a4e h LYS 287 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1a4e h LYS 287 CO 0.01 0.67 0.00 1.63 -0.57 0.00 0.00 179.45 181.19 1a4e n LYS 288 N -3.76 2.71 -3.76 3.15 5.02 -0.85 -4.90 118.16 115.77 1a4e n LYS 288 Ca -0.01 -1.57 -0.37 0.00 -2.02 0.00 0.00 58.31 54.34 1a4e n LYS 288 Cb 0.65 -1.73 -0.06 0.00 -0.02 0.00 0.00 35.03 33.87 1a4e n LYS 288 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1a4e s LEU 289 N -1.31 4.40 0.48 -0.35 2.96 -1.19 -5.01 118.68 118.67 1a4e s LEU 289 Ca 0.28 0.60 0.19 0.00 -0.22 0.00 0.00 54.13 54.98 1a4e s LEU 289 Cb 0.19 -2.35 1.21 0.00 0.50 0.00 0.00 46.19 45.74 1a4e s LEU 289 CO 0.11 0.35 2.05 -0.65 -1.32 0.00 0.00 176.35 176.88 1a4e h PRO 290 N 4.65 0.00 -5.32 0.98 0.11 -1.90 -3.45 132.00 127.07 1a4e h PRO 290 Ca -0.53 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 64.94 1a4e h PRO 290 Cb 1.22 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.20 1a4e h PRO 290 CO 0.61 0.14 -0.55 -0.59 -0.21 0.00 0.00 178.00 177.40 1a4e s PHE 291 N -4.55 2.06 0.11 0.65 -0.12 -1.26 -5.13 117.98 109.74 1a4e s PHE 291 Ca -0.04 -0.90 -0.24 0.00 -0.05 0.00 0.00 56.93 55.70 1a4e s PHE 291 Cb 0.15 -1.59 -0.07 0.00 -0.63 0.00 0.00 43.02 40.88 1a4e s PHE 291 CO 0.65 0.23 0.73 0.45 -0.05 0.00 0.00 175.22 177.23 1a4e s SER 292 N -3.78 7.27 0.26 1.98 0.15 -1.26 -4.96 113.70 113.36 1a4e s SER 292 Ca 0.18 1.50 0.23 0.00 0.70 0.00 0.00 55.95 58.57 1a4e s SER 292 Cb 0.05 -2.46 0.98 0.00 -1.71 0.00 0.00 66.02 62.88 1a4e s SER 292 CO 0.09 0.17 1.70 1.33 1.20 0.00 0.00 173.24 177.74 1a4e n VAL 293 N 1.98 0.84 1.26 4.45 0.24 -1.26 -2.38 118.33 123.45 1a4e n VAL 293 Ca -0.06 0.24 0.10 0.00 -2.04 0.00 0.00 64.34 62.59 1a4e n VAL 293 Cb 0.50 -1.17 0.38 0.00 -1.47 0.00 0.00 33.84 32.07 1a4e n VAL 293 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1a4e n PHE 294 N -2.23 0.20 -3.54 6.34 3.72 -1.26 -4.38 117.46 116.31 1a4e n PHE 294 Ca 0.02 -0.10 -0.40 0.00 -0.05 0.00 0.00 57.45 56.92 1a4e n PHE 294 Cb 0.22 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.66 1a4e n PHE 294 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1a4e s ASP 295 N -1.56 6.06 0.50 4.37 -1.08 -1.00 -4.35 116.67 119.61 1a4e s ASP 295 Ca 0.32 -0.33 0.22 0.00 -0.52 0.00 0.00 52.55 52.24 1a4e s ASP 295 Cb 0.17 -2.14 1.33 0.00 -1.46 0.00 0.00 42.92 40.82 1a4e s ASP 295 CO 0.26 -0.20 2.07 0.25 0.52 0.00 0.00 175.17 178.07 1a4e h LEU 296 N 8.48 0.00 -0.28 -1.34 6.46 -1.86 -2.64 115.31 124.12 1a4e h LEU 296 Ca -0.32 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.44 1a4e h LEU 296 Cb 1.16 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.09 1a4e h LEU 296 CO 0.62 0.12 0.00 0.35 -0.62 0.00 0.00 178.44 178.91 1a4e n THR 297 N -3.97 0.01 -4.59 1.05 -2.24 -1.26 -3.43 114.28 99.84 1a4e n THR 297 Ca -0.02 -0.08 -0.32 0.00 -2.27 0.00 0.00 64.05 61.37 1a4e n THR 297 Cb 0.21 -0.20 -0.12 0.00 -2.10 0.00 0.00 70.33 68.13 1a4e n THR 297 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1a4e s LYS 298 N -1.99 2.34 0.06 -0.78 -0.14 -1.00 -4.88 119.74 113.36 1a4e s LYS 298 Ca 0.43 -0.83 0.05 0.00 -1.36 0.00 0.00 55.97 54.26 1a4e s LYS 298 Cb 0.21 -2.35 -0.04 0.00 -1.68 0.00 0.00 37.83 33.96 1a4e s LYS 298 CO 0.34 0.58 -0.08 0.14 -0.76 0.00 0.00 175.35 175.57 1a4e s VAL 299 N -0.94 3.54 -0.15 3.17 -7.23 -1.26 -4.91 120.40 112.62 1a4e s VAL 299 Ca 0.15 -1.05 -0.26 0.00 -1.81 0.00 0.00 61.98 59.01 1a4e s VAL 299 Cb -0.11 -2.62 -0.02 0.00 0.56 0.00 0.00 36.38 34.20 1a4e s VAL 299 CO 0.06 0.22 0.87 0.26 -0.31 0.00 0.00 175.10 176.19 1a4e s TRP 300 N -1.14 3.45 0.11 2.82 0.51 -1.26 -5.02 118.94 118.42 1a4e s TRP 300 Ca 0.20 1.34 -0.31 0.00 -2.12 0.00 0.00 56.10 55.21 1a4e s TRP 300 Cb -0.11 -3.04 -0.10 0.00 -0.81 0.00 0.00 33.47 29.40 1a4e s TRP 300 CO 0.12 -0.22 1.86 -1.25 -0.51 0.00 0.00 176.95 176.96 1a4e s PRO 301 N 2.04 4.13 0.31 4.98 0.04 -1.26 -4.92 135.00 140.33 1a4e s PRO 301 Ca 0.41 2.62 0.26 0.00 0.04 0.00 0.00 61.00 64.32 1a4e s PRO 301 Cb -0.17 -3.69 1.03 0.00 0.04 0.00 0.00 34.50 31.72 1a4e s PRO 301 CO 0.14 -0.87 1.77 1.96 0.04 0.00 0.00 177.00 180.04 1a4e h GLN 302 N 8.94 0.00 0.25 4.56 4.20 -1.96 -1.45 115.11 129.66 1a4e h GLN 302 Ca -0.47 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.23 1a4e h GLN 302 Cb 1.22 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.00 1a4e h GLN 302 CO 0.95 0.00 -0.12 0.78 -0.67 0.00 0.00 178.83 179.77 1a4e h GLY 303 N 2.42 -0.35 1.21 3.46 0.00 -1.99 -2.90 103.07 104.92 1a4e h GLY 303 Ca 0.00 0.13 -0.17 0.00 0.00 0.00 0.00 47.33 47.29 1a4e h GLY 303 CO 0.00 -0.13 -0.50 1.46 0.00 0.00 0.00 176.54 177.37 1a4e h GLN 304 N -0.69 0.84 -3.26 4.80 4.20 -1.96 -3.39 115.11 115.65 1a4e h GLN 304 Ca -0.03 -0.50 -0.63 0.00 0.06 0.00 0.00 58.65 57.54 1a4e h GLN 304 Cb 0.48 0.05 -0.41 0.00 0.30 0.00 0.00 27.48 27.90 1a4e h GLN 304 CO 0.06 1.14 -0.66 -0.06 -0.67 0.00 0.00 178.83 178.63 1a4e s PHE 305 N -4.18 2.79 0.66 2.96 0.08 -0.55 -5.11 117.98 114.63 1a4e s PHE 305 Ca -0.10 -2.93 -0.14 0.00 0.12 0.00 0.00 56.93 53.87 1a4e s PHE 305 Cb 0.11 -2.52 0.00 0.00 -0.57 0.00 0.00 43.02 40.04 1a4e s PHE 305 CO 0.88 -0.75 1.10 -1.25 -0.10 0.00 0.00 175.22 175.09 1a4e s PRO 306 N -0.08 2.82 0.16 0.24 0.04 -1.10 -4.13 135.00 132.95 1a4e s PRO 306 Ca 0.17 1.31 -0.30 0.00 0.04 0.00 0.00 61.00 62.22 1a4e s PRO 306 Cb -0.26 -1.96 -0.07 0.00 0.04 0.00 0.00 34.50 32.25 1a4e s PRO 306 CO 0.00 -1.22 1.13 -0.51 0.04 0.00 0.00 177.00 176.44 1a4e s LEU 307 N -4.97 4.46 -0.17 -3.56 1.43 -1.26 -4.56 118.68 110.05 1a4e s LEU 307 Ca 0.65 2.10 0.01 0.00 -1.03 0.00 0.00 54.13 55.86 1a4e s LEU 307 Cb -0.19 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.44 1a4e s LEU 307 CO 0.43 -0.28 -0.19 -0.60 0.23 0.00 0.00 176.35 175.94 1a4e s ARG 308 N -0.13 3.04 0.36 1.70 3.52 -0.03 -4.91 118.95 122.50 1a4e s ARG 308 Ca 0.51 -0.81 -0.27 0.00 -0.13 0.00 0.00 55.73 55.03 1a4e s ARG 308 Cb -0.30 -2.58 -0.09 0.00 -1.56 0.00 0.00 34.95 30.42 1a4e s ARG 308 CO 0.34 -0.16 1.21 0.50 -0.81 0.00 0.00 175.30 176.39 1a4e s ARG 309 N 1.18 4.23 0.00 5.12 3.52 -1.26 -0.98 118.95 130.76 1a4e s ARG 309 Ca 0.02 1.98 0.00 0.00 -0.13 0.00 0.00 55.73 57.60 1a4e s ARG 309 Cb -0.14 -2.89 0.00 0.00 -1.56 0.00 0.00 34.95 30.36 1a4e s ARG 309 CO -0.09 -0.21 0.00 0.28 -0.81 0.00 0.00 175.30 174.47 1a4e n VAL 310 N 0.48 0.00 -2.40 7.11 0.31 0.02 -4.63 118.33 119.23 1a4e n VAL 310 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 1a4e n VAL 310 Cb 0.44 -1.40 0.00 0.00 -0.91 0.00 0.00 33.84 31.97 1a4e n VAL 310 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1a4e n GLY 311 N 2.97 1.25 2.94 2.92 0.00 -1.18 -1.73 105.19 112.36 1a4e n GLY 311 Ca 0.00 -0.48 -0.11 0.00 0.00 0.00 0.00 46.02 45.43 1a4e n GLY 311 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a4e s LYS 312 N 1.41 0.20 -0.22 1.61 1.02 -0.16 -1.16 119.74 122.45 1a4e s LYS 312 Ca 0.00 -0.37 -0.03 0.00 0.02 0.00 0.00 55.97 55.59 1a4e s LYS 312 Cb 0.00 0.03 -0.00 0.00 -0.52 0.00 0.00 37.83 37.34 1a4e s LYS 312 CO 0.00 -0.02 -0.06 0.42 -0.92 0.00 0.00 175.35 174.77 1a4e s ILE 313 N -0.85 3.20 -0.18 2.17 1.01 -0.04 -0.76 121.20 125.76 1a4e s ILE 313 Ca -0.09 -0.58 -0.00 0.00 0.00 0.00 0.00 60.65 59.98 1a4e s ILE 313 Cb -0.06 -2.46 0.00 0.00 0.01 0.00 0.00 42.46 39.96 1a4e s ILE 313 CO -0.01 0.42 -0.15 -0.69 0.00 0.00 0.00 174.94 174.52 1a4e s VAL 314 N 1.45 2.58 -0.39 2.92 1.01 -0.23 -0.59 120.40 127.14 1a4e s VAL 314 Ca 0.05 -0.78 -0.16 0.00 0.00 0.00 0.00 61.98 61.09 1a4e s VAL 314 Cb -0.14 -2.11 0.01 0.00 0.00 0.00 0.00 36.38 34.14 1a4e s VAL 314 CO -0.04 0.51 0.38 -0.76 0.00 0.00 0.00 175.10 175.18 1a4e s LEU 315 N 1.12 4.76 -0.02 3.92 1.43 -0.68 -0.83 118.68 128.39 1a4e s LEU 315 Ca 0.01 -0.56 0.02 0.00 -1.03 0.00 0.00 54.13 52.57 1a4e s LEU 315 Cb -0.14 -2.32 0.04 0.00 0.03 0.00 0.00 46.19 43.79 1a4e s LEU 315 CO -0.05 -0.47 0.86 -0.46 0.23 0.00 0.00 176.35 176.46 1a4e n ASN 316 N 5.44 1.24 -3.68 2.29 0.23 -0.83 -3.78 115.26 116.16 1a4e n ASN 316 Ca -0.09 -1.83 -0.13 0.00 -0.53 0.00 0.00 54.58 52.01 1a4e n ASN 316 Cb 0.48 -0.07 -0.13 0.00 -2.08 0.00 0.00 39.78 37.98 1a4e n ASN 316 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 1a4e s GLU 317 N -0.84 0.19 0.44 -3.83 2.12 -0.69 -4.99 118.70 111.09 1a4e s GLU 317 Ca 0.04 0.72 -0.21 0.00 0.36 0.00 0.00 54.97 55.87 1a4e s GLU 317 Cb 0.04 -0.03 -0.09 0.00 0.26 0.00 0.00 34.13 34.30 1a4e s GLU 317 CO 0.00 -0.24 1.01 -0.80 -0.54 0.00 0.00 175.26 174.68 1a4e s ASN 318 N 2.08 6.67 0.56 -1.70 0.01 -1.26 -0.25 114.94 121.04 1a4e s ASN 318 Ca -0.02 1.86 -0.20 0.00 -0.71 0.00 0.00 52.86 53.79 1a4e s ASN 318 Cb -0.11 -2.56 -0.05 0.00 0.41 0.00 0.00 41.25 38.94 1a4e s ASN 318 CO -0.09 -0.55 1.19 -2.16 -1.51 0.00 0.00 177.10 173.98 1a4e s PRO 319 N -3.01 3.19 0.03 -0.60 0.04 -1.26 -4.81 135.00 128.58 1a4e s PRO 319 Ca 0.63 1.79 -0.17 0.00 0.04 0.00 0.00 61.00 63.29 1a4e s PRO 319 Cb -0.15 -2.04 -0.25 0.00 0.04 0.00 0.00 34.50 32.11 1a4e s PRO 319 CO 0.19 -1.02 1.12 -0.07 0.04 0.00 0.00 177.00 177.26 1a4e h LEU 320 N 1.17 0.72 -7.61 -3.56 3.38 -2.01 -3.44 115.31 103.97 1a4e h LEU 320 Ca -0.50 -0.77 -0.52 0.00 0.09 0.00 0.00 57.88 56.18 1a4e h LEU 320 Cb 1.28 -0.22 -0.38 0.00 0.09 0.00 0.00 40.66 41.43 1a4e h LEU 320 CO 0.56 1.40 -0.79 0.21 0.09 0.00 0.00 178.44 179.91 1a4e s ASN 321 N -7.05 2.34 0.19 -0.43 2.47 -1.26 -5.04 114.94 106.17 1a4e s ASN 321 Ca -0.11 -0.42 -0.12 0.00 0.42 0.00 0.00 52.86 52.63 1a4e s ASN 321 Cb 0.05 -0.78 0.12 0.00 -1.45 0.00 0.00 41.25 39.19 1a4e s ASN 321 CO 0.87 -0.17 1.86 0.15 -3.72 0.00 0.00 177.10 176.09 1a4e h PHE 322 N 8.19 0.85 0.19 0.43 3.57 -1.97 -2.15 116.94 126.04 1a4e h PHE 322 Ca -0.25 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.25 1a4e h PHE 322 Cb 1.12 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 39.58 1a4e h PHE 322 CO 0.45 0.54 -0.09 0.35 -2.23 0.00 0.00 178.31 177.34 1a4e h PHE 323 N 0.90 -0.23 -0.58 0.41 3.57 -1.96 0.35 116.94 119.40 1a4e h PHE 323 Ca 0.24 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.67 1a4e h PHE 323 Cb -0.08 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.71 1a4e h PHE 323 CO -0.02 0.06 0.08 0.00 -2.23 0.00 0.00 178.31 176.20 1a4e h ALA 324 N 0.22 1.05 0.00 2.41 0.00 -1.96 -0.60 119.26 120.38 1a4e h ALA 324 Ca -0.03 -0.25 -0.28 0.00 0.00 0.00 0.00 54.91 54.35 1a4e h ALA 324 Cb 0.40 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 1a4e h ALA 324 CO 0.04 0.61 -2.18 1.04 0.00 0.00 0.00 179.25 178.76 1a4e n GLN 325 N -4.23 1.03 -0.10 0.00 6.02 -0.81 -4.26 117.38 115.03 1a4e n GLN 325 Ca 0.04 -0.03 -0.19 0.00 -0.01 0.00 0.00 57.00 56.80 1a4e n GLN 325 Cb 0.28 -1.46 -0.07 0.00 1.02 0.00 0.00 30.24 30.01 1a4e n GLN 325 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1a4e n VAL 326 N -2.60 1.06 0.02 5.09 0.31 -0.03 -4.10 118.33 118.09 1a4e n VAL 326 Ca -0.26 -0.29 -0.06 0.00 -0.01 0.00 0.00 64.34 63.72 1a4e n VAL 326 Cb 1.00 -1.65 0.14 0.00 -0.91 0.00 0.00 33.84 32.43 1a4e n VAL 326 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1a4e h GLU 327 N -0.56 0.46 -0.09 5.55 4.57 -0.97 -2.57 114.58 120.96 1a4e h GLU 327 Ca -0.48 -0.23 0.00 0.00 -1.18 0.00 0.00 59.36 57.47 1a4e h GLU 327 Cb 1.47 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.06 1a4e h GLU 327 CO -0.25 0.80 0.00 1.04 -1.18 0.00 0.00 179.01 179.41 1a4e n GLN 328 N -4.02 1.54 -2.30 1.92 6.02 -0.25 -4.89 117.38 115.40 1a4e n GLN 328 Ca -0.02 -0.80 -0.40 0.00 -0.01 0.00 0.00 57.00 55.77 1a4e n GLN 328 Cb 0.51 -1.40 -0.03 0.00 1.02 0.00 0.00 30.24 30.34 1a4e n GLN 328 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1a4e s ALA 329 N -1.89 3.45 -0.12 -1.58 0.00 -0.97 -4.83 121.76 115.82 1a4e s ALA 329 Ca 0.34 1.08 0.01 0.00 0.00 0.00 0.00 51.96 53.39 1a4e s ALA 329 Cb 0.18 -3.40 0.02 0.00 0.00 0.00 0.00 23.12 19.91 1a4e s ALA 329 CO 0.28 -0.40 -0.13 0.00 0.00 0.00 0.00 175.76 175.51 1a4e s ALA 330 N -1.15 1.62 -0.04 0.00 0.00 -1.26 -5.04 121.76 115.88 1a4e s ALA 330 Ca 0.47 -0.71 0.07 0.00 0.00 0.00 0.00 51.96 51.78 1a4e s ALA 330 Cb -0.36 -0.88 -0.02 0.00 0.00 0.00 0.00 23.12 21.86 1a4e s ALA 330 CO 0.47 -0.21 -0.24 -0.06 0.00 0.00 0.00 175.76 175.72 1a4e s PHE 331 N 1.24 2.43 -0.13 0.00 0.08 -1.26 -4.94 117.98 115.40 1a4e s PHE 331 Ca -0.02 -0.55 -0.08 0.00 0.12 0.00 0.00 56.93 56.40 1a4e s PHE 331 Cb -0.14 -1.57 0.05 0.00 -0.57 0.00 0.00 43.02 40.79 1a4e s PHE 331 CO -0.05 -0.11 0.32 0.00 -0.10 0.00 0.00 175.22 175.28 1a4e s ALA 332 N -0.39 -0.77 0.51 5.36 0.00 -1.26 -4.81 121.76 120.41 1a4e s ALA 332 Ca 0.03 1.16 0.24 0.00 0.00 0.00 0.00 51.96 53.39 1a4e s ALA 332 Cb -0.12 -0.71 1.34 0.00 0.00 0.00 0.00 23.12 23.63 1a4e s ALA 332 CO 0.01 -0.21 1.98 -1.35 0.00 0.00 0.00 175.76 176.19 1a4e h PRO 333 N 6.87 0.07 0.00 0.00 0.11 -1.81 -1.60 132.00 135.64 1a4e h PRO 333 Ca -0.36 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1a4e h PRO 333 Cb 1.17 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1a4e h PRO 333 CO 0.34 0.05 0.00 -1.13 -0.21 0.00 0.00 178.00 177.04 1a4e n SER 334 N -4.39 0.00 -4.41 -2.05 3.41 -1.26 -4.31 113.62 100.60 1a4e n SER 334 Ca 0.11 0.46 -0.44 0.00 -0.26 0.00 0.00 58.87 58.74 1a4e n SER 334 Cb 0.61 -0.48 -0.04 0.00 -0.26 0.00 0.00 64.21 64.04 1a4e n SER 334 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1a4e s THR 335 N -2.96 4.65 0.05 6.66 2.01 -0.60 -4.98 115.64 120.46 1a4e s THR 335 Ca 0.09 -0.90 0.00 0.00 0.31 0.00 0.00 61.69 61.19 1a4e s THR 335 Cb 0.11 -4.60 -0.03 0.00 0.01 0.00 0.00 72.50 67.99 1a4e s THR 335 CO 0.30 -1.30 -0.04 0.28 -0.69 0.00 0.00 174.62 173.17 1a4e s THR 336 N 3.10 0.30 0.40 -0.82 -1.32 -1.25 -1.26 115.64 114.78 1a4e s THR 336 Ca 0.19 -1.41 0.03 0.00 -1.21 0.00 0.00 61.69 59.29 1a4e s THR 336 Cb -0.18 -0.97 -0.00 0.00 -1.51 0.00 0.00 72.50 69.83 1a4e s THR 336 CO 0.05 -0.72 0.58 0.68 -2.21 0.00 0.00 174.62 173.00 1a4e s VAL 337 N -2.64 3.99 0.21 5.08 -7.23 -1.26 -4.88 120.40 113.67 1a4e s VAL 337 Ca -0.03 -0.74 -0.28 0.00 -1.81 0.00 0.00 61.98 59.12 1a4e s VAL 337 Cb -0.01 -3.43 -0.17 0.00 0.56 0.00 0.00 36.38 33.33 1a4e s VAL 337 CO -0.05 -0.24 0.53 -2.65 -0.31 0.00 0.00 175.10 172.38 1a4e n PRO 338 N -1.88 0.05 -0.87 4.82 -0.02 -1.26 -2.46 135.00 133.38 1a4e n PRO 338 Ca 0.01 0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 1a4e n PRO 338 Cb 0.58 -1.03 0.00 0.00 -0.02 0.00 0.00 33.50 33.03 1a4e n PRO 338 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1a4e n TYR 339 N -0.02 0.00 -4.05 6.00 4.01 -1.26 -4.15 117.16 117.70 1a4e n TYR 339 Ca 0.18 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.61 1a4e n TYR 339 Cb 0.26 -0.56 -0.16 0.00 -0.31 0.00 0.00 39.34 38.56 1a4e n TYR 339 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 1a4e s GLN 340 N -0.43 2.47 0.14 -0.72 -0.21 -1.03 -1.47 119.66 118.41 1a4e s GLN 340 Ca 0.00 -0.67 0.01 0.00 0.02 0.00 0.00 55.36 54.72 1a4e s GLN 340 Cb 0.00 -2.27 -0.04 0.00 1.00 0.00 0.00 33.01 31.69 1a4e s GLN 340 CO 0.00 -0.25 -0.01 -1.21 -2.12 0.00 0.00 175.29 171.70 1a4e s GLU 341 N 1.42 0.97 0.30 2.91 0.41 -0.48 -4.50 118.70 119.73 1a4e s GLU 341 Ca 0.04 -1.45 -0.21 0.00 -0.41 0.00 0.00 54.97 52.95 1a4e s GLU 341 Cb -0.13 -0.13 -0.09 0.00 -1.78 0.00 0.00 34.13 32.00 1a4e s GLU 341 CO -0.11 -0.12 0.82 0.00 -0.49 0.00 0.00 175.26 175.36 1a4e s ALA 342 N -3.74 3.29 0.91 5.21 0.00 -1.26 -0.70 121.76 125.47 1a4e s ALA 342 Ca 0.20 0.28 -0.13 0.00 0.00 0.00 0.00 51.96 52.31 1a4e s ALA 342 Cb 0.06 -2.96 0.18 0.00 0.00 0.00 0.00 23.12 20.40 1a4e s ALA 342 CO 0.00 0.26 1.26 -1.54 0.00 0.00 0.00 175.76 175.74 1a4e s SER 343 N -1.82 3.39 -0.00 0.00 1.04 -1.22 -4.63 113.70 110.46 1a4e s SER 343 Ca 0.50 0.15 0.00 0.00 0.48 0.00 0.00 55.95 57.08 1a4e s SER 343 Cb -0.15 -0.27 0.01 0.00 0.10 0.00 0.00 66.02 65.71 1a4e s SER 343 CO 0.20 -2.54 0.61 0.00 0.98 0.00 0.00 173.24 172.49 1a4e n ALA 344 N -3.57 2.52 -1.63 5.32 0.00 -1.26 -4.61 120.51 117.28 1a4e n ALA 344 Ca 0.15 -0.03 -0.45 0.00 0.00 0.00 0.00 53.44 53.11 1a4e n ALA 344 Cb 0.60 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.01 1a4e n ALA 344 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1a4e n ASP 345 N -0.08 3.48 0.10 0.00 -0.08 -1.26 -4.87 116.55 113.84 1a4e n ASP 345 Ca 0.00 0.66 0.05 0.00 -1.51 0.00 0.00 54.79 54.00 1a4e n ASP 345 Cb 0.22 -1.46 0.50 0.00 2.34 0.00 0.00 41.12 42.71 1a4e n ASP 345 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1a4e h PRO 346 N 11.74 0.34 -0.08 -0.67 0.11 -1.84 -0.16 132.00 141.43 1a4e h PRO 346 Ca -0.45 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.62 1a4e h PRO 346 Cb 1.26 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 1a4e h PRO 346 CO 0.96 0.23 -0.05 0.28 -0.21 0.00 0.00 178.00 179.21 1a4e h VAL 347 N 0.34 1.34 -0.43 3.15 2.07 -1.89 -2.35 116.25 118.48 1a4e h VAL 347 Ca 0.09 -1.12 -0.05 0.00 0.82 0.00 0.00 66.70 66.45 1a4e h VAL 347 Cb -0.02 1.91 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 1a4e h VAL 347 CO -0.02 0.31 0.08 0.25 0.02 0.00 0.00 177.57 178.21 1a4e h LEU 348 N -0.22 0.60 -0.41 2.57 5.85 -1.65 -1.81 115.31 120.24 1a4e h LEU 348 Ca 0.02 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.63 1a4e h LEU 348 Cb 0.52 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 1a4e h LEU 348 CO 0.01 0.62 0.26 1.56 -0.34 0.00 0.00 178.44 180.56 1a4e h GLN 349 N 0.63 0.55 -0.13 1.25 1.08 -1.01 -1.91 115.11 115.57 1a4e h GLN 349 Ca 0.14 -0.04 -0.11 0.00 -1.45 0.00 0.00 58.65 57.19 1a4e h GLN 349 Cb 0.28 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.58 1a4e h GLN 349 CO 0.00 0.40 -0.39 0.00 -0.95 0.00 0.00 178.83 177.88 1a4e h ALA 350 N 1.13 1.10 0.00 3.87 0.00 -1.22 -2.82 119.26 121.31 1a4e h ALA 350 Ca 0.15 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1a4e h ALA 350 Cb -0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1a4e h ALA 350 CO -0.03 0.59 -0.07 0.00 0.00 0.00 0.00 179.25 179.73 1a4e h ARG 351 N 0.24 0.00 0.00 0.00 3.08 -0.69 -1.01 114.38 115.99 1a4e h ARG 351 Ca 0.02 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 1a4e h ARG 351 Cb 0.80 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.85 1a4e h ARG 351 CO 0.06 0.07 -0.07 -0.07 -1.07 0.00 0.00 179.97 178.90 1a4e h LEU 352 N 0.00 0.00 0.00 3.04 4.07 -1.10 -3.23 115.31 118.09 1a4e h LEU 352 Ca -0.00 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.86 1a4e h LEU 352 Cb 0.34 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.07 1a4e h LEU 352 CO 0.01 0.07 -0.91 0.33 -1.08 0.00 0.00 178.44 176.86 1a4e n PHE 353 N -3.35 0.79 -0.32 1.13 7.35 -0.45 -4.58 117.46 118.03 1a4e n PHE 353 Ca -0.01 0.34 0.11 0.00 -0.76 0.00 0.00 57.45 57.13 1a4e n PHE 353 Cb 0.24 -0.85 0.29 0.00 0.35 0.00 0.00 39.48 39.51 1a4e n PHE 353 CO 0.00 0.00 0.00 0.77 -0.76 0.00 0.00 176.76 176.77 1a4e h SER 354 N -1.00 0.56 -0.02 -2.13 0.02 -1.39 -3.07 113.55 106.51 1a4e h SER 354 Ca -0.14 0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1a4e h SER 354 Cb 0.86 0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.43 1a4e h SER 354 CO -0.09 0.16 -0.08 1.88 -1.14 0.00 0.00 176.83 177.57 1a4e h TYR 355 N 0.59 0.13 -0.20 3.45 -1.99 -1.86 -0.82 116.97 116.27 1a4e h TYR 355 Ca 0.54 -0.05 -0.03 0.00 2.00 0.00 0.00 58.73 61.18 1a4e h TYR 355 Cb 0.89 -0.02 -0.01 0.00 2.00 0.00 0.00 36.73 39.58 1a4e h TYR 355 CO -0.07 0.71 -0.02 0.00 -0.00 0.00 0.00 178.16 178.77 1a4e h ALA 356 N 0.40 1.60 -0.32 3.88 0.00 -1.86 -0.36 119.26 122.60 1a4e h ALA 356 Ca -0.00 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 1a4e h ALA 356 Cb 0.71 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1a4e h ALA 356 CO 0.02 0.30 -0.03 0.22 0.00 0.00 0.00 179.25 179.75 1a4e h ASP 357 N 0.28 0.59 -0.68 0.00 3.58 -1.50 -2.13 116.42 116.56 1a4e h ASP 357 Ca 0.07 -0.33 -0.02 0.00 0.42 0.00 0.00 57.03 57.16 1a4e h ASP 357 Cb 0.23 -0.16 -0.03 0.00 1.72 0.00 0.00 39.33 41.09 1a4e h ASP 357 CO 0.01 0.78 0.34 0.00 -2.88 0.00 0.00 179.24 177.48 1a4e h ALA 358 N 0.83 1.28 -0.67 -0.78 0.00 -0.42 -2.87 119.26 116.63 1a4e h ALA 358 Ca 0.09 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1a4e h ALA 358 Cb 0.50 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1a4e h ALA 358 CO 0.02 0.56 0.11 0.45 0.00 0.00 0.00 179.25 180.39 1a4e h HIS 359 N 0.99 1.17 -0.51 0.00 3.86 -0.87 -0.66 115.15 119.12 1a4e h HIS 359 Ca 0.24 -0.16 -0.01 0.00 -1.16 0.00 0.00 60.37 59.28 1a4e h HIS 359 Cb 0.10 -0.32 -0.03 0.00 1.06 0.00 0.00 27.41 28.22 1a4e h HIS 359 CO 0.01 0.98 0.26 0.00 0.86 0.00 0.00 177.93 180.04 1a4e h ARG 360 N 1.03 0.70 0.01 2.45 3.08 -1.17 -0.56 114.38 119.93 1a4e h ARG 360 Ca 0.20 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.18 1a4e h ARG 360 Cb 0.44 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.34 1a4e h ARG 360 CO 0.01 0.53 -0.01 -0.92 -1.07 0.00 0.00 179.97 178.52 1a4e h TYR 361 N 0.71 -0.02 -0.01 3.04 3.20 -1.37 -2.46 116.97 120.07 1a4e h TYR 361 Ca 0.18 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.05 1a4e h TYR 361 Cb 0.05 0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.32 1a4e h TYR 361 CO 0.00 0.72 0.00 -0.09 -1.64 0.00 0.00 178.16 177.16 1a4e h ARG 362 N -0.96 0.01 0.00 1.82 2.43 -1.08 -3.36 114.38 113.24 1a4e h ARG 362 Ca -0.00 -0.00 -0.32 0.00 -0.81 0.00 0.00 59.98 58.84 1a4e h ARG 362 Cb 0.75 -0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.24 1a4e h ARG 362 CO 0.00 0.14 -2.22 1.28 -1.51 0.00 0.00 179.97 177.66 1a4e n LEU 363 N -5.02 2.20 0.00 3.80 4.77 -0.27 -4.54 117.00 117.94 1a4e n LEU 363 Ca -0.07 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 1a4e n LEU 363 Cb 0.09 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 1a4e n LEU 363 CO 0.33 0.75 0.00 0.61 -1.33 0.00 0.00 177.39 177.75 1a4e n GLY 364 N 2.33 3.71 0.39 -0.72 0.00 -0.88 -4.78 105.19 105.23 1a4e n GLY 364 Ca -0.36 -1.77 0.20 0.00 0.00 0.00 0.00 46.02 44.09 1a4e n GLY 364 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1a4e h PRO 365 N 0.00 0.07 -0.85 1.61 0.13 -1.85 -2.07 132.00 129.04 1a4e h PRO 365 Ca 0.00 -0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.55 1a4e h PRO 365 Cb 0.00 -0.02 -0.32 0.00 0.13 0.00 0.00 31.00 30.79 1a4e h PRO 365 CO 0.00 0.04 0.17 0.09 -0.23 0.00 0.00 178.00 178.07 1a4e n ASN 366 N -4.39 6.03 0.27 1.44 3.02 -1.26 -4.73 115.26 115.64 1a4e n ASN 366 Ca 0.11 -3.77 0.16 0.00 -0.03 0.00 0.00 54.58 51.05 1a4e n ASN 366 Cb 0.61 -0.71 0.89 0.00 -0.61 0.00 0.00 39.78 39.96 1a4e n ASN 366 CO 0.00 0.00 0.00 2.19 -2.62 0.00 0.00 177.26 176.83 1a4e h PHE 367 N 1.92 0.00 0.00 3.10 -0.00 -1.67 -1.79 116.94 118.50 1a4e h PHE 367 Ca 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.46 1a4e h PHE 367 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.20 1a4e h PHE 367 CO 1.20 0.00 0.00 -2.39 -0.00 0.00 0.00 178.31 177.12 1a4e n HIS 368 N -3.82 0.00 1.25 6.09 1.44 -1.26 -2.31 115.22 116.61 1a4e n HIS 368 Ca -0.02 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.82 1a4e n HIS 368 Cb 0.16 -0.48 0.39 0.00 0.12 0.00 0.00 29.99 30.18 1a4e n HIS 368 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1a4e n GLN 369 N -1.48 0.85 -2.30 -1.40 6.02 -0.67 -3.38 117.38 115.02 1a4e n GLN 369 Ca 0.06 -0.50 -0.42 0.00 -0.01 0.00 0.00 57.00 56.13 1a4e n GLN 369 Cb 0.24 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.98 1a4e n GLN 369 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1a4e s ILE 370 N -2.49 3.72 0.27 5.09 1.01 -0.98 -4.87 121.20 122.96 1a4e s ILE 370 Ca 0.25 1.22 -0.04 0.00 0.00 0.00 0.00 60.65 62.07 1a4e s ILE 370 Cb 0.19 -3.78 0.36 0.00 0.01 0.00 0.00 42.46 39.24 1a4e s ILE 370 CO 0.51 0.08 1.60 -0.65 0.00 0.00 0.00 174.94 176.48 1a4e h PRO 371 N 6.96 0.05 0.00 2.79 0.11 -1.89 -0.05 132.00 139.97 1a4e h PRO 371 Ca -0.41 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.68 1a4e h PRO 371 Cb 1.21 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1a4e h PRO 371 CO 0.85 0.03 -0.10 -0.39 -0.21 0.00 0.00 178.00 178.17 1a4e h VAL 372 N 0.05 0.30 -0.00 3.15 -1.51 -1.91 -2.50 116.25 113.82 1a4e h VAL 372 Ca 0.49 -0.70 0.00 0.00 -1.23 0.00 0.00 66.70 65.26 1a4e h VAL 372 Cb 0.91 1.54 0.00 0.00 -2.13 0.00 0.00 31.29 31.60 1a4e h VAL 372 CO -0.82 0.10 -0.56 0.59 -1.23 0.00 0.00 177.57 175.64 1a4e n ASN 373 N -3.30 0.77 -4.72 4.19 3.02 -0.10 -4.91 115.26 110.20 1a4e n ASN 373 Ca -0.00 -0.57 -0.42 0.00 -0.03 0.00 0.00 54.58 53.56 1a4e n ASN 373 Cb 0.32 0.40 -0.03 0.00 -0.61 0.00 0.00 39.78 39.86 1a4e n ASN 373 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1a4e n PRO 375 N 3.31 2.20 0.23 0.00 -0.04 -1.26 -4.83 135.00 134.60 1a4e n PRO 375 Ca 0.06 -2.62 0.06 0.00 -0.04 0.00 0.00 63.50 60.97 1a4e n PRO 375 Cb 0.46 -3.47 0.52 0.00 -0.04 0.00 0.00 33.50 30.98 1a4e n PRO 375 CO 0.00 0.00 0.00 0.10 -0.04 0.00 0.00 175.50 175.56 1a4e h TYR 376 N 8.32 0.00 -0.01 0.54 -0.00 -1.93 -2.28 116.97 121.61 1a4e h TYR 376 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.09 1a4e h TYR 376 Cb 0.84 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.57 1a4e h TYR 376 CO 1.31 0.20 -0.04 0.00 -0.00 0.00 0.00 178.16 179.62 1a4e n ALA 377 N -2.46 2.68 -2.84 0.10 0.00 -1.26 -4.39 120.51 112.35 1a4e n ALA 377 Ca -0.02 -0.35 -0.08 0.00 0.00 0.00 0.00 53.44 52.99 1a4e n ALA 377 Cb 0.27 -1.28 0.01 0.00 0.00 0.00 0.00 19.45 18.44 1a4e n ALA 377 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1a4e n SER 378 N -0.40 -2.86 -4.57 0.00 2.88 -0.87 -4.36 113.62 103.43 1a4e n SER 378 Ca 0.19 -2.97 -0.54 0.00 -1.33 0.00 0.00 58.87 54.22 1a4e n SER 378 Cb 0.28 1.46 -0.06 0.00 -0.75 0.00 0.00 64.21 65.13 1a4e n SER 378 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1a4e n LYS 379 N 2.48 0.85 -1.89 -1.46 5.02 -1.13 -4.65 118.16 117.38 1a4e n LYS 379 Ca 0.17 0.31 -0.42 0.00 -2.02 0.00 0.00 58.31 56.34 1a4e n LYS 379 Cb 0.57 -1.91 -0.03 0.00 -0.02 0.00 0.00 35.03 33.64 1a4e n LYS 379 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1a4e s PHE 380 N 0.39 2.18 -0.14 2.13 5.36 -1.26 -4.98 117.98 121.65 1a4e s PHE 380 Ca 0.86 0.17 -0.05 0.00 -0.96 0.00 0.00 56.93 56.96 1a4e s PHE 380 Cb -1.04 -4.01 0.07 0.00 -0.34 0.00 0.00 43.02 37.70 1a4e s PHE 380 CO 0.50 -4.15 0.28 0.12 -1.46 0.00 0.00 175.22 170.50 1a4e s PHE 381 N 3.11 -0.46 -0.28 10.12 5.36 -1.26 -5.11 117.98 129.46 1a4e s PHE 381 Ca 0.76 0.98 -0.05 0.00 -0.96 0.00 0.00 56.93 57.66 1a4e s PHE 381 Cb -0.39 -0.02 0.15 0.00 -0.34 0.00 0.00 43.02 42.42 1a4e s PHE 381 CO 0.33 -0.39 0.57 1.21 -1.46 0.00 0.00 175.22 175.49 1a4e s ASN 382 N 2.44 -1.02 0.63 6.13 3.84 -1.26 -5.05 114.94 120.64 1a4e s ASN 382 Ca 0.02 1.04 0.39 0.00 0.21 0.00 0.00 52.86 54.52 1a4e s ASN 382 Cb -0.12 2.02 2.12 0.00 -0.55 0.00 0.00 41.25 44.71 1a4e s ASN 382 CO -0.09 -0.25 2.29 1.55 -2.79 0.00 0.00 177.10 177.80 1a4e h PRO 383 N 8.04 0.00 -0.01 0.43 0.13 -1.90 -2.72 132.00 135.97 1a4e h PRO 383 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 1a4e h PRO 383 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1a4e h PRO 383 CO 0.20 0.01 -0.66 0.00 -0.23 0.00 0.00 178.00 177.32 1a4e n ALA 384 N -2.15 3.97 -3.22 -0.56 0.00 -1.26 -4.12 120.51 113.17 1a4e n ALA 384 Ca -0.03 -0.57 -0.46 0.00 0.00 0.00 0.00 53.44 52.38 1a4e n ALA 384 Cb 0.11 -0.85 -0.03 0.00 0.00 0.00 0.00 19.45 18.68 1a4e n ALA 384 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1a4e s ILE 385 N -2.73 5.23 0.25 0.00 1.01 -1.03 -5.01 121.20 118.94 1a4e s ILE 385 Ca 0.14 -1.83 0.02 0.00 0.00 0.00 0.00 60.65 58.98 1a4e s ILE 385 Cb 0.17 -4.49 -0.05 0.00 0.01 0.00 0.00 42.46 38.10 1a4e s ILE 385 CO 0.69 -1.09 0.06 -0.13 0.00 0.00 0.00 174.94 174.47 1a4e s ARG 386 N 1.36 1.40 3.46 2.79 1.81 -1.26 -4.84 118.95 123.67 1a4e s ARG 386 Ca 0.16 -1.74 0.00 0.00 -1.72 0.00 0.00 55.73 52.42 1a4e s ARG 386 Cb -0.16 -0.43 0.00 0.00 -0.45 0.00 0.00 34.95 33.90 1a4e s ARG 386 CO -0.03 -0.22 0.00 -0.25 -0.68 0.00 0.00 175.30 174.12 1a4e n ASP 387 N -0.47 0.00 0.00 0.23 8.00 -1.26 -5.06 116.55 117.99 1a4e n ASP 387 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.48 1a4e n ASP 387 Cb 0.65 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.75 1a4e n ASP 387 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a4e n GLY 388 N 0.00 -0.17 3.61 0.44 0.00 -1.26 -4.72 105.19 103.08 1a4e n GLY 388 Ca 0.00 -1.58 -0.47 0.00 0.00 0.00 0.00 46.02 43.97 1a4e n GLY 388 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1a4e n PRO 389 N 0.23 1.43 -3.60 1.61 -0.02 -1.26 -3.31 135.00 130.07 1a4e n PRO 389 Ca 0.00 0.51 -0.21 0.00 -2.02 0.00 0.00 63.50 61.78 1a4e n PRO 389 Cb 0.00 -2.02 0.05 0.00 -0.02 0.00 0.00 33.50 31.51 1a4e n PRO 389 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1a4e n MET 390 N 1.60 -4.60 -2.82 -0.52 2.81 -1.26 -4.34 117.12 108.00 1a4e n MET 390 Ca 0.13 0.67 -0.43 0.00 -1.81 0.00 0.00 57.70 56.26 1a4e n MET 390 Cb 0.28 -5.27 -0.04 0.00 -0.71 0.00 0.00 33.22 27.48 1a4e n MET 390 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 1a4e s ASN 391 N -4.18 6.26 0.00 7.83 3.84 -1.21 -4.81 114.94 122.67 1a4e s ASN 391 Ca 0.09 -0.59 0.16 0.00 0.21 0.00 0.00 52.86 52.73 1a4e s ASN 391 Cb -0.02 -2.44 0.09 0.00 -0.55 0.00 0.00 41.25 38.32 1a4e s ASN 391 CO 0.79 -1.37 0.95 1.33 -2.79 0.00 0.00 177.10 176.01 1a4e n VAL 392 N 6.12 0.00 -0.67 -5.21 0.24 -1.26 -4.59 118.33 112.96 1a4e n VAL 392 Ca -0.00 -0.45 0.09 0.00 -2.04 0.00 0.00 64.34 61.94 1a4e n VAL 392 Cb 0.47 1.28 0.36 0.00 -1.47 0.00 0.00 33.84 34.48 1a4e n VAL 392 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1a4e n ASN 393 N 0.57 4.82 0.00 -1.34 6.94 -1.26 -4.93 115.26 120.06 1a4e n ASN 393 Ca 0.08 -2.53 0.00 0.00 -0.02 0.00 0.00 54.58 52.11 1a4e n ASN 393 Cb 0.37 -0.58 0.00 0.00 -2.36 0.00 0.00 39.78 37.21 1a4e n ASN 393 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1a4e n GLY 394 N 0.96 2.82 3.15 4.83 0.00 -1.26 -4.57 105.19 111.12 1a4e n GLY 394 Ca 0.26 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.05 1a4e n GLY 394 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1a4e n ASN 395 N 0.00 -5.73 -1.58 1.61 5.15 -1.26 -2.12 115.26 111.33 1a4e n ASN 395 Ca 0.00 -0.34 -0.16 0.00 -0.60 0.00 0.00 54.58 53.48 1a4e n ASN 395 Cb 0.00 -4.63 -0.06 0.00 -0.53 0.00 0.00 39.78 34.56 1a4e n ASN 395 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1a4e n PHE 396 N -4.47 -0.35 -0.18 1.20 3.72 -1.26 -4.79 117.46 111.33 1a4e n PHE 396 Ca -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 1a4e n PHE 396 Cb 0.60 -2.97 0.00 0.00 -0.94 0.00 0.00 39.48 36.17 1a4e n PHE 396 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1a4e n GLY 397 N -0.37 3.45 0.30 1.37 0.00 -0.90 -2.17 105.19 106.87 1a4e n GLY 397 Ca -0.17 -0.09 0.08 0.00 0.00 0.00 0.00 46.02 45.84 1a4e n GLY 397 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1a4e n SER 398 N 4.31 0.89 -4.58 1.61 3.41 -1.26 -4.94 113.62 113.06 1a4e n SER 398 Ca 0.00 -1.68 -0.50 0.00 -0.26 0.00 0.00 58.87 56.43 1a4e n SER 398 Cb 0.00 -0.07 -0.05 0.00 -0.26 0.00 0.00 64.21 63.83 1a4e n SER 398 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1a4e n GLU 399 N -0.15 1.12 -1.56 4.33 -0.58 -0.92 -4.91 120.64 117.97 1a4e n GLU 399 Ca 0.13 0.40 -0.44 0.00 -0.42 0.00 0.00 57.16 56.83 1a4e n GLU 399 Cb 0.19 -1.95 -0.01 0.00 -0.57 0.00 0.00 31.44 29.10 1a4e n GLU 399 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 1a4e n PRO 400 N 2.05 1.15 -0.12 3.49 -0.02 -1.26 -4.88 135.00 135.41 1a4e n PRO 400 Ca 0.17 0.41 0.02 0.00 -2.02 0.00 0.00 63.50 62.07 1a4e n PRO 400 Cb 0.22 -1.77 0.07 0.00 -0.02 0.00 0.00 33.50 32.00 1a4e n PRO 400 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1a4e n THR 401 N -0.06 0.35 -3.79 3.45 -2.24 -1.26 -4.74 114.28 106.00 1a4e n THR 401 Ca 0.10 -0.24 -0.05 0.00 -2.27 0.00 0.00 64.05 61.60 1a4e n THR 401 Cb 0.34 -0.12 -0.01 0.00 -2.10 0.00 0.00 70.33 68.43 1a4e n THR 401 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1a4e n TYR 402 N 0.02 -0.64 -3.01 4.78 4.11 -1.26 -4.11 117.16 117.05 1a4e n TYR 402 Ca 0.05 -0.72 -0.44 0.00 -0.00 0.00 0.00 57.90 56.79 1a4e n TYR 402 Cb 0.26 0.15 -0.02 0.00 -0.00 0.00 0.00 39.34 39.73 1a4e n TYR 402 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1a4e s LEU 403 N 0.00 5.39 0.22 -3.48 1.43 -1.26 -4.87 118.68 116.11 1a4e s LEU 403 Ca 0.09 -2.33 -0.30 0.00 -1.03 0.00 0.00 54.13 50.56 1a4e s LEU 403 Cb -0.00 -2.36 -0.09 0.00 0.03 0.00 0.00 46.19 43.76 1a4e s LEU 403 CO 0.07 -0.91 1.38 0.00 0.23 0.00 0.00 176.35 177.11 1a4e s ALA 404 N 1.98 3.58 0.23 4.21 0.00 -1.26 -4.94 121.76 125.56 1a4e s ALA 404 Ca 0.31 1.22 0.31 0.00 0.00 0.00 0.00 51.96 53.81 1a4e s ALA 404 Cb -0.06 -3.52 1.38 0.00 0.00 0.00 0.00 23.12 20.92 1a4e s ALA 404 CO -0.08 -0.64 2.00 -0.91 0.00 0.00 0.00 175.76 176.13 1a4e h ASN 405 N 5.26 0.00 -0.10 0.00 2.35 -2.03 -2.58 115.58 118.47 1a4e h ASN 405 Ca -0.45 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.30 1a4e h ASN 405 Cb 1.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.59 1a4e h ASN 405 CO 0.78 0.08 0.00 -0.90 -1.65 0.00 0.00 177.43 175.74 1a4e n ASP 406 N -3.27 1.27 -4.61 5.81 5.75 -1.26 -4.86 116.55 115.37 1a4e n ASP 406 Ca -0.00 -1.59 -0.24 0.00 -0.01 0.00 0.00 54.79 52.94 1a4e n ASP 406 Cb 0.30 -0.06 -0.09 0.00 -1.03 0.00 0.00 41.12 40.24 1a4e n ASP 406 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1a4e s LYS 407 N -1.87 2.06 -0.13 0.11 -0.14 -0.97 -5.14 119.74 113.65 1a4e s LYS 407 Ca 0.33 -1.71 -0.05 0.00 -1.36 0.00 0.00 55.97 53.17 1a4e s LYS 407 Cb 0.17 -1.93 -0.04 0.00 -1.68 0.00 0.00 37.83 34.35 1a4e s LYS 407 CO 0.27 0.18 0.06 0.45 -0.76 0.00 0.00 175.35 175.55 1a4e s SER 408 N -3.69 5.68 -0.04 2.83 0.15 -1.26 -4.87 113.70 112.51 1a4e s SER 408 Ca 0.34 0.21 0.00 0.00 0.70 0.00 0.00 55.95 57.20 1a4e s SER 408 Cb -0.01 -1.81 0.02 0.00 -1.71 0.00 0.00 66.02 62.51 1a4e s SER 408 CO 0.19 0.32 -0.02 -0.31 1.20 0.00 0.00 173.24 174.61 1a4e s TYR 409 N -0.48 0.56 -0.21 3.44 2.02 -1.26 -5.12 117.35 116.30 1a4e s TYR 409 Ca 0.10 -0.12 -0.08 0.00 -0.37 0.00 0.00 57.07 56.60 1a4e s TYR 409 Cb -0.12 -0.58 -0.04 0.00 -0.40 0.00 0.00 41.96 40.82 1a4e s TYR 409 CO 0.02 -0.18 0.09 0.99 -1.57 0.00 0.00 175.55 174.90 1a4e s THR 410 N 1.09 4.93 -0.33 -0.71 2.01 -1.26 -5.05 115.64 116.32 1a4e s THR 410 Ca -0.09 0.02 -0.01 0.00 0.31 0.00 0.00 61.69 61.92 1a4e s THR 410 Cb -0.14 -3.26 0.07 0.00 0.01 0.00 0.00 72.50 69.19 1a4e s THR 410 CO -0.01 0.41 0.04 -0.31 -0.69 0.00 0.00 174.62 174.06 1a4e s TYR 411 N 0.72 3.38 0.51 4.92 2.02 -1.26 -5.11 117.35 122.53 1a4e s TYR 411 Ca 0.05 -2.13 -0.06 0.00 -0.37 0.00 0.00 57.07 54.57 1a4e s TYR 411 Cb -0.13 -2.43 -0.03 0.00 -0.40 0.00 0.00 41.96 38.98 1a4e s TYR 411 CO 0.02 -0.86 0.82 0.96 -1.57 0.00 0.00 175.55 174.92 1a4e s ILE 412 N 1.19 4.70 -1.39 2.71 -4.36 -1.26 -4.41 121.20 118.38 1a4e s ILE 412 Ca -0.01 0.21 -0.07 0.00 -0.26 0.00 0.00 60.65 60.52 1a4e s ILE 412 Cb -0.20 -3.80 0.03 0.00 1.25 0.00 0.00 42.46 39.74 1a4e s ILE 412 CO -0.03 -0.81 0.92 0.00 0.24 0.00 0.00 174.94 175.26 1a4e n GLN 413 N -2.34 -5.85 0.27 0.37 6.02 -1.26 -4.91 117.38 109.68 1a4e n GLN 413 Ca 0.02 0.67 0.12 0.00 -0.01 0.00 0.00 57.00 57.80 1a4e n GLN 413 Cb 0.55 -5.49 0.77 0.00 1.02 0.00 0.00 30.24 27.09 1a4e n GLN 413 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 1a4e h GLN 414 N -2.10 0.00 0.00 -1.09 4.20 -2.05 -1.36 115.11 112.72 1a4e h GLN 414 Ca -0.59 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.12 1a4e h GLN 414 Cb 1.36 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.14 1a4e h GLN 414 CO 0.60 0.06 -0.44 -0.25 -0.67 0.00 0.00 178.83 178.12 1a4e n ASP 415 N -3.96 0.66 -4.67 1.46 8.00 -1.26 -4.85 116.55 111.92 1a4e n ASP 415 Ca -0.03 0.20 -0.42 0.00 0.71 0.00 0.00 54.79 55.25 1a4e n ASP 415 Cb 0.15 -0.07 -0.03 0.00 -0.02 0.00 0.00 41.12 41.15 1a4e n ASP 415 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1a4e s ARG 416 N -3.12 4.22 0.51 -1.24 3.52 -0.51 -5.01 118.95 117.31 1a4e s ARG 416 Ca 0.08 2.09 -0.20 0.00 -0.13 0.00 0.00 55.73 57.57 1a4e s ARG 416 Cb 0.14 -3.75 -0.07 0.00 -1.56 0.00 0.00 34.95 29.70 1a4e s ARG 416 CO 0.68 -0.72 1.08 -1.25 -0.81 0.00 0.00 175.30 174.28 1a4e s PRO 417 N 3.17 3.63 -0.01 5.12 0.04 -1.26 -5.03 135.00 140.67 1a4e s PRO 417 Ca 0.68 1.48 -0.00 0.00 0.04 0.00 0.00 61.00 63.20 1a4e s PRO 417 Cb -0.33 -2.07 -0.00 0.00 0.04 0.00 0.00 34.50 32.14 1a4e s PRO 417 CO 0.28 -0.60 -0.01 0.82 0.04 0.00 0.00 177.00 177.53 1a4e h ILE 418 N 1.43 0.00 0.00 0.56 2.04 -1.99 -3.47 117.51 116.09 1a4e h ILE 418 Ca -0.50 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.33 1a4e h ILE 418 Cb 1.24 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 1a4e h ILE 418 CO 0.58 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.73 1a4e n GLN 419 N -2.32 0.12 0.15 2.37 6.02 -1.26 -4.87 117.38 117.59 1a4e n GLN 419 Ca -0.00 -0.05 0.12 0.00 -0.01 0.00 0.00 57.00 57.06 1a4e n GLN 419 Cb 0.01 -0.44 0.54 0.00 1.02 0.00 0.00 30.24 31.37 1a4e n GLN 419 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1a4e n GLN 420 N -0.03 0.19 -0.00 -1.09 0.00 -1.26 -1.86 117.38 113.33 1a4e n GLN 420 Ca 0.00 0.50 0.14 0.00 0.00 0.00 0.00 57.00 57.64 1a4e n GLN 420 Cb 0.16 -1.92 0.61 0.00 0.00 0.00 0.00 30.24 29.09 1a4e n GLN 420 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.06 174.67 1a4e n HIS 421 N -2.29 0.01 0.00 2.61 1.44 -1.26 -4.89 115.22 110.84 1a4e n HIS 421 Ca 0.01 -0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.72 1a4e n HIS 421 Cb 0.17 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.28 1a4e n HIS 421 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1a4e n GLN 422 N -0.06 0.87 -2.05 -1.40 6.02 -0.78 -5.00 117.38 114.98 1a4e n GLN 422 Ca 0.20 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.83 1a4e n GLN 422 Cb 0.30 0.00 0.03 0.00 1.02 0.00 0.00 30.24 31.59 1a4e n GLN 422 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1a4e s GLU 423 N 4.29 3.09 -0.20 -1.09 8.01 -1.26 -5.02 118.70 126.52 1a4e s GLU 423 Ca 0.00 1.82 -0.05 0.00 0.01 0.00 0.00 54.97 56.75 1a4e s GLU 423 Cb 0.00 -1.99 -0.03 0.00 -4.31 0.00 0.00 34.13 27.80 1a4e s GLU 423 CO 0.00 -1.11 0.01 0.08 0.01 0.00 0.00 175.26 174.25 1a4e s VAL 424 N -1.59 4.07 -0.02 2.63 1.01 -1.26 -4.98 120.40 120.27 1a4e s VAL 424 Ca 0.76 -0.27 -0.03 0.00 0.00 0.00 0.00 61.98 62.43 1a4e s VAL 424 Cb -0.30 -2.84 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 1a4e s VAL 424 CO 0.33 0.43 0.17 0.26 0.00 0.00 0.00 175.10 176.29 1a4e s TRP 425 N 0.96 3.54 -0.08 5.22 0.52 -1.26 -5.10 118.94 122.74 1a4e s TRP 425 Ca 0.02 0.36 -0.05 0.00 0.02 0.00 0.00 56.10 56.45 1a4e s TRP 425 Cb -0.14 -1.83 0.03 0.00 -1.15 0.00 0.00 33.47 30.38 1a4e s TRP 425 CO 0.02 0.65 0.19 1.21 0.02 0.00 0.00 176.95 179.04 1a4e s ASN 426 N -1.86 -0.19 0.00 2.95 3.84 -1.26 -5.14 114.94 113.29 1a4e s ASN 426 Ca 0.26 0.40 0.00 0.00 0.21 0.00 0.00 52.86 53.73 1a4e s ASN 426 Cb -0.13 0.32 0.00 0.00 -0.55 0.00 0.00 41.25 40.89 1a4e s ASN 426 CO 0.17 -0.13 0.00 0.61 -2.79 0.00 0.00 177.10 174.97 1a4e n GLY 427 N 3.83 3.67 3.75 1.21 0.00 -1.26 -5.13 105.19 111.26 1a4e n GLY 427 Ca -0.22 -1.35 -0.30 0.00 0.00 0.00 0.00 46.02 44.16 1a4e n GLY 427 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1a4e s PRO 428 N -2.48 -0.14 -0.51 1.61 0.04 -1.26 -4.99 135.00 127.27 1a4e s PRO 428 Ca 0.00 -0.14 -0.28 0.00 0.04 0.00 0.00 61.00 60.62 1a4e s PRO 428 Cb 0.00 -1.73 0.01 0.00 0.04 0.00 0.00 34.50 32.82 1a4e s PRO 428 CO 0.00 -2.98 1.42 0.00 0.04 0.00 0.00 177.00 175.48 1a4e s ALA 429 N -3.38 2.89 -0.19 8.56 0.00 -1.26 -5.01 121.76 123.37 1a4e s ALA 429 Ca 0.71 -0.48 -0.06 0.00 0.00 0.00 0.00 51.96 52.13 1a4e s ALA 429 Cb -0.08 -4.04 -0.03 0.00 0.00 0.00 0.00 23.12 18.96 1a4e s ALA 429 CO 0.54 -2.75 0.02 0.42 0.00 0.00 0.00 175.76 174.00 1a4e s ILE 430 N 5.88 4.30 -0.45 0.00 1.01 -1.26 -5.06 121.20 125.62 1a4e s ILE 430 Ca 0.56 -0.20 -0.28 0.00 0.00 0.00 0.00 60.65 60.73 1a4e s ILE 430 Cb -0.12 -2.94 -0.01 0.00 0.01 0.00 0.00 42.46 39.41 1a4e s ILE 430 CO 0.28 0.45 1.65 -2.84 0.00 0.00 0.00 174.94 174.47 1a4e s PRO 431 N 0.65 3.24 -0.06 2.79 0.02 -1.26 -5.00 135.00 135.39 1a4e s PRO 431 Ca 0.01 0.97 0.04 0.00 0.02 0.00 0.00 61.00 62.04 1a4e s PRO 431 Cb -0.14 -4.18 -0.00 0.00 0.02 0.00 0.00 34.50 30.20 1a4e s PRO 431 CO 0.02 -1.98 -0.19 -0.47 -0.33 0.00 0.00 177.00 174.05 1a4e s TYR 432 N 6.83 1.91 -0.29 6.54 5.04 -1.26 -5.09 117.35 131.02 1a4e s TYR 432 Ca 0.68 -0.61 0.01 0.00 -2.44 0.00 0.00 57.07 54.71 1a4e s TYR 432 Cb -0.16 -1.29 0.06 0.00 0.35 0.00 0.00 41.96 40.92 1a4e s TYR 432 CO 0.29 -0.22 -0.04 -1.58 -1.34 0.00 0.00 175.55 172.66 1a4e s HIS 433 N 0.13 3.32 -1.51 4.97 5.65 -1.26 -5.02 115.29 121.56 1a4e s HIS 433 Ca -0.07 -2.18 -0.12 0.00 0.25 0.00 0.00 55.06 52.95 1a4e s HIS 433 Cb -0.13 -2.14 -0.04 0.00 -1.18 0.00 0.00 32.58 29.08 1a4e s HIS 433 CO 0.04 -0.86 2.63 1.87 -0.65 0.00 0.00 174.74 177.77 1a4e n TRP 434 N 4.51 2.76 -1.41 3.88 -0.00 -1.26 -4.96 117.44 120.95 1a4e n TRP 434 Ca -0.12 -2.96 -0.34 0.00 -0.00 0.00 0.00 57.50 54.08 1a4e n TRP 434 Cb 0.43 -2.46 0.09 0.00 -0.00 0.00 0.00 31.31 29.37 1a4e n TRP 434 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1a4e s ALA 435 N 2.68 2.11 -0.16 5.87 0.00 -1.26 -4.81 121.76 126.19 1a4e s ALA 435 Ca 0.60 0.84 -0.39 0.00 0.00 0.00 0.00 51.96 53.01 1a4e s ALA 435 Cb 0.16 -3.46 -0.16 0.00 0.00 0.00 0.00 23.12 19.67 1a4e s ALA 435 CO -0.06 -1.88 1.64 2.41 0.00 0.00 0.00 175.76 177.87 1a4e n THR 436 N -2.78 0.24 -1.75 0.00 -1.04 -1.14 -4.88 114.28 102.92 1a4e n THR 436 Ca 0.13 -0.04 -0.42 0.00 -2.04 0.00 0.00 64.05 61.68 1a4e n THR 436 Cb 0.50 -1.16 -0.01 0.00 -1.82 0.00 0.00 70.33 67.84 1a4e n THR 436 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1a4e n SER 437 N 4.66 3.75 -4.71 8.00 7.64 -1.26 -4.88 113.62 126.82 1a4e n SER 437 Ca 0.24 1.17 -0.42 0.00 1.01 0.00 0.00 58.87 60.87 1a4e n SER 437 Cb 0.16 -1.59 -0.00 0.00 -1.01 0.00 0.00 64.21 61.76 1a4e n SER 437 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1a4e n PRO 438 N 1.60 2.17 0.00 1.43 -0.04 -1.26 -4.74 135.00 134.16 1a4e n PRO 438 Ca 0.06 0.76 0.00 0.00 -0.04 0.00 0.00 63.50 64.29 1a4e n PRO 438 Cb 0.37 -2.37 0.00 0.00 -0.04 0.00 0.00 33.50 31.46 1a4e n PRO 438 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1a4e n GLY 439 N 0.74 0.04 0.10 0.55 0.00 -1.26 -4.68 105.19 100.68 1a4e n GLY 439 Ca 0.04 -1.80 0.04 0.00 0.00 0.00 0.00 46.02 44.30 1a4e n GLY 439 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1a4e n ASP 440 N 0.01 0.77 -0.25 1.61 2.03 -1.26 -4.70 116.55 114.75 1a4e n ASP 440 Ca 0.00 -0.88 0.13 0.00 0.52 0.00 0.00 54.79 54.56 1a4e n ASP 440 Cb 0.00 0.73 0.41 0.00 -0.72 0.00 0.00 41.12 41.54 1a4e n ASP 440 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 1a4e h VAL 441 N 0.50 0.82 -0.06 5.18 3.04 -1.89 -0.95 116.25 122.89 1a4e h VAL 441 Ca 0.00 -0.22 0.00 0.00 -1.01 0.00 0.00 66.70 65.47 1a4e h VAL 441 Cb 0.25 0.13 0.00 0.00 -2.01 0.00 0.00 31.29 29.67 1a4e h VAL 441 CO 0.00 0.11 0.00 0.47 -1.01 0.00 0.00 177.57 177.14 1a4e n ASP 442 N -4.55 1.30 -0.00 3.17 8.00 -1.26 -3.84 116.55 119.37 1a4e n ASP 442 Ca 0.17 -1.50 0.04 0.00 0.71 0.00 0.00 54.79 54.21 1a4e n ASP 442 Cb 0.49 -0.03 -0.05 0.00 -0.02 0.00 0.00 41.12 41.51 1a4e n ASP 442 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1a4e n PHE 443 N 0.03 0.00 -0.08 1.24 3.01 -0.44 -4.69 117.46 116.52 1a4e n PHE 443 Ca 0.18 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.58 1a4e n PHE 443 Cb 0.30 -0.11 -0.00 0.00 -0.01 0.00 0.00 39.48 39.66 1a4e n PHE 443 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1a4e h VAL 444 N 0.00 0.71 0.00 -4.37 2.07 -1.44 -2.09 116.25 111.13 1a4e h VAL 444 Ca 0.00 -0.01 -0.10 0.00 0.82 0.00 0.00 66.70 67.41 1a4e h VAL 444 Cb 0.29 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1a4e h VAL 444 CO 0.00 0.00 -0.47 1.56 0.02 0.00 0.00 177.57 178.68 1a4e h GLN 445 N 0.03 0.00 -0.19 1.57 4.20 -1.86 -0.83 115.11 118.02 1a4e h GLN 445 Ca 0.15 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.73 1a4e h GLN 445 Cb 0.22 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1a4e h GLN 445 CO -0.30 0.47 -0.42 0.00 -0.67 0.00 0.00 178.83 177.91 1a4e h ALA 446 N 1.53 0.92 -0.26 3.87 0.00 -1.81 -1.35 119.26 122.16 1a4e h ALA 446 Ca -0.00 -0.44 -0.19 0.00 0.00 0.00 0.00 54.91 54.28 1a4e h ALA 446 Cb 1.01 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1a4e h ALA 446 CO 0.06 0.64 -0.58 -0.09 0.00 0.00 0.00 179.25 179.28 1a4e h ARG 447 N 0.38 0.82 0.00 0.00 2.43 -0.94 -1.88 114.38 115.18 1a4e h ARG 447 Ca 0.03 -0.54 -0.08 0.00 -0.81 0.00 0.00 59.98 58.58 1a4e h ARG 447 Cb 0.90 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.51 1a4e h ARG 447 CO 0.08 1.17 -0.38 -0.91 -1.51 0.00 0.00 179.97 178.42 1a4e h ASN 448 N 0.62 0.00 -0.07 -3.80 2.35 -1.11 -2.48 115.58 111.09 1a4e h ASN 448 Ca 0.00 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.64 1a4e h ASN 448 Cb 1.18 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.54 1a4e h ASN 448 CO 0.12 0.38 -0.31 0.25 -1.65 0.00 0.00 177.43 176.22 1a4e h LEU 449 N 0.00 0.56 -0.80 1.61 7.12 -1.03 -2.01 115.31 120.76 1a4e h LEU 449 Ca -0.00 -0.22 -0.07 0.00 0.13 0.00 0.00 57.88 57.72 1a4e h LEU 449 Cb 0.97 -0.15 -0.03 0.00 -0.53 0.00 0.00 40.66 40.92 1a4e h LEU 449 CO 0.05 0.84 0.14 0.22 -0.13 0.00 0.00 178.44 179.56 1a4e h TYR 450 N 0.47 1.09 -0.65 1.25 3.20 -1.01 -2.33 116.97 118.99 1a4e h TYR 450 Ca 0.06 -0.13 0.01 0.00 3.14 0.00 0.00 58.73 61.81 1a4e h TYR 450 Cb 0.77 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 38.70 1a4e h TYR 450 CO 0.03 0.90 0.42 0.00 -1.64 0.00 0.00 178.16 177.87 1a4e h ARG 451 N 0.98 0.83 -0.33 1.82 3.08 -1.05 -2.64 114.38 117.08 1a4e h ARG 451 Ca 0.20 -0.05 -0.07 0.00 0.07 0.00 0.00 59.98 60.13 1a4e h ARG 451 Cb 0.38 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 1a4e h ARG 451 CO 0.01 0.55 -0.11 0.28 -1.07 0.00 0.00 179.97 179.63 1a4e h VAL 452 N 0.85 1.23 0.00 2.04 2.07 -1.13 -2.12 116.25 119.20 1a4e h VAL 452 Ca 0.24 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.74 1a4e h VAL 452 Cb -0.07 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1a4e h VAL 452 CO -0.06 0.34 0.00 -0.07 0.02 0.00 0.00 177.57 177.79 1a4e h LEU 453 N 0.51 0.00 -1.05 2.57 3.38 -1.08 -2.65 115.31 116.99 1a4e h LEU 453 Ca 0.10 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 1a4e h LEU 453 Cb 0.49 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1a4e h LEU 453 CO 0.03 0.00 -0.31 1.23 0.09 0.00 0.00 178.44 179.48 1a4e h GLY 454 N 2.17 0.00 1.86 0.83 0.00 -1.09 -3.12 103.07 103.71 1a4e h GLY 454 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.18 1a4e h GLY 454 CO 0.00 0.00 -0.67 0.50 0.00 0.00 0.00 176.54 176.37 1a4e h LYS 455 N 0.00 0.14 -5.63 4.80 1.57 -1.53 -3.42 116.57 112.50 1a4e h LYS 455 Ca -0.00 -0.11 -0.61 0.00 -1.87 0.00 0.00 60.65 58.06 1a4e h LYS 455 Cb 0.81 0.02 -0.11 0.00 0.08 0.00 0.00 32.23 33.04 1a4e h LYS 455 CO 0.04 0.76 0.28 -0.65 -0.57 0.00 0.00 179.45 179.31 1a4e s GLN 456 N -3.58 4.06 0.07 3.15 -0.21 -1.18 -5.02 119.66 116.95 1a4e s GLN 456 Ca -0.03 0.60 -0.31 0.00 0.02 0.00 0.00 55.36 55.65 1a4e s GLN 456 Cb 0.12 -3.68 -0.08 0.00 1.00 0.00 0.00 33.01 30.36 1a4e s GLN 456 CO 0.79 -0.52 1.68 -1.25 -2.12 0.00 0.00 175.29 173.87 1a4e s PRO 457 N 2.70 4.19 0.00 2.91 0.04 -1.26 -2.95 135.00 140.62 1a4e s PRO 457 Ca 0.29 2.36 0.00 0.00 0.04 0.00 0.00 61.00 63.69 1a4e s PRO 457 Cb -0.15 -3.63 0.00 0.00 0.04 0.00 0.00 34.50 30.76 1a4e s PRO 457 CO 0.10 -0.76 0.00 0.41 0.04 0.00 0.00 177.00 176.79 1a4e n GLY 458 N 4.04 2.07 0.18 0.56 0.00 -1.26 -4.94 105.19 105.84 1a4e n GLY 458 Ca 0.16 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.19 1a4e n GLY 458 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1a4e h GLN 459 N 2.63 0.04 -0.04 1.61 1.08 -1.74 -1.79 115.11 116.90 1a4e h GLN 459 Ca 0.00 -0.02 -0.16 0.00 -1.45 0.00 0.00 58.65 57.02 1a4e h GLN 459 Cb 0.00 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 1a4e h GLN 459 CO 0.00 0.45 -0.70 1.96 -0.95 0.00 0.00 178.83 179.59 1a4e h GLN 460 N 0.04 0.20 -0.27 1.46 4.20 -1.81 -1.45 115.11 117.48 1a4e h GLN 460 Ca 0.00 -0.17 -0.10 0.00 0.06 0.00 0.00 58.65 58.44 1a4e h GLN 460 Cb 0.75 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.56 1a4e h GLN 460 CO 0.06 0.82 -0.23 -0.22 -0.67 0.00 0.00 178.83 178.59 1a4e h LYS 461 N 0.14 0.64 -0.56 1.46 3.64 -1.91 -2.40 116.57 117.59 1a4e h LYS 461 Ca -0.02 -0.32 -0.07 0.00 -1.27 0.00 0.00 60.65 58.97 1a4e h LYS 461 Cb 1.25 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.05 1a4e h LYS 461 CO 0.11 0.92 0.07 -0.91 -2.27 0.00 0.00 179.45 177.37 1a4e h ASN 462 N 0.37 0.85 -0.21 4.20 4.21 -1.30 -1.44 115.58 122.26 1a4e h ASN 462 Ca 0.05 -0.19 -0.00 0.00 1.21 0.00 0.00 56.30 57.37 1a4e h ASN 462 Cb 0.78 -0.23 -0.01 0.00 -1.12 0.00 0.00 38.32 37.75 1a4e h ASN 462 CO 0.06 0.87 0.13 0.25 -1.29 0.00 0.00 177.43 177.45 1a4e h LEU 463 N 0.85 0.25 -1.23 1.61 5.85 -1.19 -0.29 115.31 121.16 1a4e h LEU 463 Ca 0.17 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.77 1a4e h LEU 463 Cb 0.40 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1a4e h LEU 463 CO 0.01 0.22 -0.33 0.00 -0.34 0.00 0.00 178.44 178.00 1a4e h ALA 464 N 1.04 1.36 -0.02 1.25 0.00 -1.27 -2.00 119.26 119.62 1a4e h ALA 464 Ca 0.07 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1a4e h ALA 464 Cb 0.02 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1a4e h ALA 464 CO -0.01 0.46 -0.04 -0.92 0.00 0.00 0.00 179.25 178.74 1a4e h TYR 465 N 0.09 0.08 -0.79 0.00 3.20 -0.95 -0.73 116.97 117.87 1a4e h TYR 465 Ca 0.01 -0.03 0.06 0.00 3.14 0.00 0.00 58.73 61.91 1a4e h TYR 465 Cb 0.63 -0.01 -0.05 0.00 1.54 0.00 0.00 36.73 38.83 1a4e h TYR 465 CO 0.00 0.60 0.52 -0.91 -1.64 0.00 0.00 178.16 176.73 1a4e h ASN 466 N -0.46 0.77 0.07 -2.11 2.35 -0.90 -0.84 115.58 114.46 1a4e h ASN 466 Ca 0.00 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.56 1a4e h ASN 466 Cb 0.59 -0.16 0.02 0.00 0.05 0.00 0.00 38.32 38.81 1a4e h ASN 466 CO 0.01 0.50 -0.78 0.40 -1.65 0.00 0.00 177.43 175.91 1a4e h ILE 467 N 0.88 1.43 -0.92 2.81 2.04 -1.38 -3.28 117.51 119.09 1a4e h ILE 467 Ca 0.34 -2.29 0.02 0.00 1.00 0.00 0.00 64.86 63.92 1a4e h ILE 467 Cb 0.20 2.81 -0.05 0.00 -0.74 0.00 0.00 36.82 39.04 1a4e h ILE 467 CO -0.11 0.67 0.60 1.23 0.00 0.00 0.00 178.15 180.53 1a4e h GLY 468 N -0.13 1.31 2.00 5.37 0.00 -0.45 -0.22 103.07 110.95 1a4e h GLY 468 Ca -0.12 -0.47 -0.04 0.00 0.00 0.00 0.00 47.33 46.71 1a4e h GLY 468 CO 0.15 0.44 -0.17 0.16 0.00 0.00 0.00 176.54 177.12 1a4e h ILE 469 N 1.21 0.37 0.08 2.60 3.07 -1.32 -2.13 117.51 121.39 1a4e h ILE 469 Ca 0.35 -1.13 -0.17 0.00 1.55 0.00 0.00 64.86 65.46 1a4e h ILE 469 Cb -0.09 1.86 0.00 0.00 -0.27 0.00 0.00 36.82 38.32 1a4e h ILE 469 CO -0.09 0.17 -0.83 -0.74 -1.05 0.00 0.00 178.15 175.61 1a4e h HIS 470 N 0.00 0.31 0.00 0.16 2.76 -1.51 -3.34 115.15 113.53 1a4e h HIS 470 Ca -0.00 -0.23 -0.03 0.00 -2.20 0.00 0.00 60.37 57.91 1a4e h HIS 470 Cb 0.84 -0.01 -0.00 0.00 1.55 0.00 0.00 27.41 29.78 1a4e h HIS 470 CO 0.00 1.32 -0.16 0.28 -1.30 0.00 0.00 177.93 178.07 1a4e h VAL 471 N -0.59 0.70 -0.89 5.26 2.07 -1.08 -3.01 116.25 118.71 1a4e h VAL 471 Ca -0.18 -0.67 0.20 0.00 0.82 0.00 0.00 66.70 66.87 1a4e h VAL 471 Cb 1.47 1.41 -0.06 0.00 -1.52 0.00 0.00 31.29 32.59 1a4e h VAL 471 CO 0.04 0.16 0.59 -0.08 0.02 0.00 0.00 177.57 178.30 1a4e h GLU 472 N 0.00 0.37 0.00 1.57 4.22 -1.50 -0.65 114.58 118.59 1a4e h GLU 472 Ca -0.00 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.42 1a4e h GLU 472 Cb 0.40 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1a4e h GLU 472 CO 0.02 0.25 0.00 0.41 -2.18 0.00 0.00 179.01 177.51 1a4e n GLY 473 N -1.53 -1.49 3.88 1.92 0.00 -1.13 -4.87 105.19 101.97 1a4e n GLY 473 Ca 0.19 -0.04 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1a4e n GLY 473 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4e s ALA 474 N -3.07 3.14 0.53 4.61 0.00 -0.25 -4.76 121.76 121.96 1a4e s ALA 474 Ca 0.11 -0.18 -0.17 0.00 0.00 0.00 0.00 51.96 51.72 1a4e s ALA 474 Cb 0.14 -2.99 -0.07 0.00 0.00 0.00 0.00 23.12 20.20 1a4e s ALA 474 CO 0.51 -0.66 1.01 0.00 0.00 0.00 0.00 175.76 176.62 1a4e h PRO 476 N 0.91 0.69 -0.38 0.00 0.11 -1.97 -1.73 132.00 129.64 1a4e h PRO 476 Ca -0.47 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 1a4e h PRO 476 Cb 1.20 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 1a4e h PRO 476 CO 0.60 0.46 0.18 1.96 -0.21 0.00 0.00 178.00 180.98 1a4e h GLN 477 N 0.71 0.56 -0.17 1.05 4.20 -2.00 -1.58 115.11 117.89 1a4e h GLN 477 Ca 0.54 -0.09 -0.15 0.00 0.06 0.00 0.00 58.65 59.01 1a4e h GLN 477 Cb 0.80 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.48 1a4e h GLN 477 CO -0.38 0.50 -0.53 0.82 -0.67 0.00 0.00 178.83 178.58 1a4e h ILE 478 N 0.48 1.33 -0.86 2.54 2.04 -1.84 -2.88 117.51 118.32 1a4e h ILE 478 Ca 0.13 -1.78 0.03 0.00 1.00 0.00 0.00 64.86 64.24 1a4e h ILE 478 Cb 0.14 1.77 -0.05 0.00 -0.74 0.00 0.00 36.82 37.94 1a4e h ILE 478 CO -0.02 0.55 0.56 1.56 0.00 0.00 0.00 178.15 180.80 1a4e h GLN 479 N 0.38 1.05 -0.52 2.37 4.20 -1.03 -2.11 115.11 119.46 1a4e h GLN 479 Ca 0.01 -0.06 -0.09 0.00 0.06 0.00 0.00 58.65 58.57 1a4e h GLN 479 Cb 1.05 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 28.57 1a4e h GLN 479 CO 0.10 0.70 -0.02 0.37 -0.67 0.00 0.00 178.83 179.30 1a4e h GLN 480 N 1.09 0.89 -0.10 1.46 5.75 -1.18 -2.17 115.11 120.85 1a4e h GLN 480 Ca 0.34 -0.27 -0.06 0.00 -0.15 0.00 0.00 58.65 58.52 1a4e h GLN 480 Cb -0.01 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.44 1a4e h GLN 480 CO -0.11 0.90 -0.20 0.00 -2.65 0.00 0.00 178.83 176.77 1a4e h ARG 481 N 0.82 0.17 -0.34 1.69 3.08 -1.24 -1.55 114.38 116.99 1a4e h ARG 481 Ca 0.15 -0.04 -0.13 0.00 0.07 0.00 0.00 59.98 60.03 1a4e h ARG 481 Cb 0.52 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 1a4e h ARG 481 CO 0.03 0.37 -0.29 0.28 -1.07 0.00 0.00 179.97 179.29 1a4e h VAL 482 N 0.15 1.29 -0.45 2.04 2.07 -1.01 -2.09 116.25 118.25 1a4e h VAL 482 Ca 0.03 -1.45 -0.04 0.00 0.82 0.00 0.00 66.70 66.06 1a4e h VAL 482 Cb 0.45 1.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.65 1a4e h VAL 482 CO 0.03 0.48 0.13 1.88 0.02 0.00 0.00 177.57 180.11 1a4e h TYR 483 N 0.59 0.72 -0.45 1.57 0.05 -0.91 -2.11 116.97 116.43 1a4e h TYR 483 Ca 0.06 -0.08 -0.07 0.00 0.05 0.00 0.00 58.73 58.70 1a4e h TYR 483 Cb 0.86 -0.21 -0.02 0.00 1.01 0.00 0.00 36.73 38.37 1a4e h TYR 483 CO 0.07 0.66 0.01 -0.44 -1.05 0.00 0.00 178.16 177.40 1a4e h ASP 484 N 0.58 0.70 -0.30 3.88 3.32 -1.30 0.34 116.42 123.64 1a4e h ASP 484 Ca 0.14 -0.16 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 1a4e h ASP 484 Cb 0.28 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1a4e h ASP 484 CO -0.00 0.77 -0.01 -0.03 -1.72 0.00 0.00 179.24 178.24 1a4e h MET 485 N 0.69 0.53 0.00 3.56 4.05 -1.21 -2.80 114.93 119.75 1a4e h MET 485 Ca 0.14 -0.18 -0.05 0.00 -0.28 0.00 0.00 59.70 59.34 1a4e h MET 485 Cb 0.42 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.16 1a4e h MET 485 CO 0.02 0.69 -0.23 0.74 0.23 0.00 0.00 176.91 178.35 1a4e h PHE 486 N 0.32 0.00 -0.18 1.39 0.04 -1.24 -2.99 116.94 114.28 1a4e h PHE 486 Ca 0.08 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.80 1a4e h PHE 486 Cb 0.45 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.59 1a4e h PHE 486 CO 0.04 0.23 -0.13 0.00 -0.60 0.00 0.00 178.31 177.85 1a4e h ALA 487 N 1.77 1.46 0.00 2.45 0.00 -0.75 -1.42 119.26 122.77 1a4e h ALA 487 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1a4e h ALA 487 Cb 0.88 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1a4e h ALA 487 CO 0.03 0.38 0.00 -0.09 0.00 0.00 0.00 179.25 179.57 1a4e h ARG 488 N 0.27 0.00 0.00 0.00 2.43 -1.34 -2.99 114.38 112.75 1a4e h ARG 488 Ca 0.05 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.09 1a4e h ARG 488 Cb 0.39 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 1a4e h ARG 488 CO 0.02 0.00 -0.79 0.28 -1.51 0.00 0.00 179.97 177.98 1a4e h VAL 489 N 0.00 1.01 -1.76 0.20 2.07 -1.38 -3.49 116.25 112.91 1a4e h VAL 489 Ca 0.00 -2.05 0.07 0.00 0.82 0.00 0.00 66.70 65.54 1a4e h VAL 489 Cb 0.48 2.20 -0.23 0.00 -1.52 0.00 0.00 31.29 32.22 1a4e h VAL 489 CO 0.00 0.34 0.14 -0.62 0.02 0.00 0.00 177.57 177.46 1a4e s ASP 490 N -6.51 -0.79 0.37 0.57 2.15 -0.72 -4.80 116.67 106.93 1a4e s ASP 490 Ca -0.23 1.23 0.16 0.00 0.43 0.00 0.00 52.55 54.13 1a4e s ASP 490 Cb 0.03 1.46 0.72 0.00 -0.30 0.00 0.00 42.92 44.83 1a4e s ASP 490 CO 0.55 -0.19 1.79 0.50 -0.17 0.00 0.00 175.17 177.65 1a4e h LYS 491 N 6.84 0.00 -0.39 4.34 3.64 -1.77 -2.70 116.57 126.52 1a4e h LYS 491 Ca -0.27 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.00 1a4e h LYS 491 Cb 1.19 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.00 1a4e h LYS 491 CO 0.16 0.39 -0.19 0.78 -2.27 0.00 0.00 179.45 178.32 1a4e h GLY 492 N 1.52 0.82 0.87 5.01 0.00 -1.93 -2.28 103.07 107.09 1a4e h GLY 492 Ca -0.00 -0.68 -0.00 0.00 0.00 0.00 0.00 47.33 46.65 1a4e h GLY 492 CO 0.05 0.62 0.03 -2.00 0.00 0.00 0.00 176.54 175.24 1a4e h LEU 493 N 0.67 0.08 -0.90 3.11 6.46 -1.83 -1.87 115.31 121.02 1a4e h LEU 493 Ca 0.10 -0.14 0.09 0.00 -0.12 0.00 0.00 57.88 57.81 1a4e h LEU 493 Cb 0.69 -0.02 -0.07 0.00 -0.73 0.00 0.00 40.66 40.53 1a4e h LEU 493 CO 0.05 0.20 0.55 -1.28 -0.62 0.00 0.00 178.44 177.34 1a4e h SER 494 N -0.05 0.83 -0.39 1.25 0.87 -1.35 -1.09 113.55 113.61 1a4e h SER 494 Ca 0.02 0.04 -0.15 0.00 -1.23 0.00 0.00 61.79 60.47 1a4e h SER 494 Cb 0.14 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 1a4e h SER 494 CO -0.00 0.48 -0.33 -0.33 -0.53 0.00 0.00 176.83 176.13 1a4e h GLU 495 N 0.94 0.93 -0.45 2.24 4.39 -1.30 -2.28 114.58 119.05 1a4e h GLU 495 Ca 0.42 -0.45 -0.07 0.00 0.34 0.00 0.00 59.36 59.60 1a4e h GLU 495 Cb 0.32 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 1a4e h GLU 495 CO -0.22 1.11 -0.02 0.00 -1.16 0.00 0.00 179.01 178.72 1a4e h ALA 496 N 0.84 1.12 -0.30 3.43 0.00 -0.73 -1.01 119.26 122.62 1a4e h ALA 496 Ca 0.08 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 1a4e h ALA 496 Cb 0.91 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1a4e h ALA 496 CO 0.08 0.56 -0.15 0.82 0.00 0.00 0.00 179.25 180.56 1a4e h ILE 497 N 0.70 1.29 -0.34 0.00 2.04 -1.18 -2.80 117.51 117.22 1a4e h ILE 497 Ca 0.14 -1.26 -0.03 0.00 1.00 0.00 0.00 64.86 64.71 1a4e h ILE 497 Cb 0.46 1.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 1a4e h ILE 497 CO 0.02 0.40 0.08 0.50 0.00 0.00 0.00 178.15 179.15 1a4e h LYS 498 N 0.38 0.50 -0.46 2.37 3.64 -1.16 -0.32 116.57 121.51 1a4e h LYS 498 Ca 0.07 -0.08 -0.12 0.00 -1.27 0.00 0.00 60.65 59.24 1a4e h LYS 498 Cb 0.68 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 1a4e h LYS 498 CO 0.05 0.46 -0.20 0.87 -2.27 0.00 0.00 179.45 178.36 1a4e h LYS 499 N 0.49 0.94 -0.17 1.90 1.57 -1.08 -2.33 116.57 117.89 1a4e h LYS 499 Ca 0.12 -0.40 -0.17 0.00 -1.87 0.00 0.00 60.65 58.33 1a4e h LYS 499 Cb 0.20 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.47 1a4e h LYS 499 CO -0.00 1.06 -0.59 0.28 -0.57 0.00 0.00 179.45 179.63 1a4e h VAL 500 N 0.78 1.33 0.00 0.50 2.07 -1.19 -3.12 116.25 116.61 1a4e h VAL 500 Ca 0.10 -1.86 -0.08 0.00 0.82 0.00 0.00 66.70 65.68 1a4e h VAL 500 Cb 0.77 1.84 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 1a4e h VAL 500 CO 0.06 0.58 -0.40 0.00 0.02 0.00 0.00 177.57 177.83 1a4e h ALA 501 N 0.93 1.23 -0.01 1.67 0.00 -1.02 -3.42 119.26 118.64 1a4e h ALA 501 Ca -0.00 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1a4e h ALA 501 Cb 1.15 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1a4e h ALA 501 CO 0.11 0.50 0.00 0.39 0.00 0.00 0.00 179.25 180.25