#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h0g n THR 11 N 0.00 0.00 -0.35 6.31 -1.04 -1.26 -5.15 114.28 112.79 3h0g n THR 11 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3h0g n THR 11 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 3h0g n THR 11 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 3h0g n LEU 12 N -1.86 -1.80 -4.67 -4.42 -0.00 -1.26 -5.01 117.00 97.98 3h0g n LEU 12 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 56.01 55.78 3h0g n LEU 12 Cb 0.00 -0.50 -0.07 0.00 -0.00 0.00 0.00 43.42 42.85 3h0g n LEU 12 CO 0.00 0.00 -0.30 0.28 -0.00 0.00 0.00 177.39 177.37 3h0g s THR 13 N -0.20 3.41 0.21 1.96 -1.32 -1.26 -4.94 115.64 113.51 3h0g s THR 13 Ca 0.00 -1.85 -0.06 0.00 -1.21 0.00 0.00 61.69 58.57 3h0g s THR 13 Cb 0.00 -2.90 0.09 0.00 -1.51 0.00 0.00 72.50 68.18 3h0g s THR 13 CO 0.00 -0.34 1.69 1.56 -2.21 0.00 0.00 174.62 175.32 3h0g h GLN 14 N 1.81 0.98 0.00 7.08 4.20 -2.01 -2.84 115.11 124.33 3h0g h GLN 14 Ca -0.44 -0.29 0.00 0.00 0.06 0.00 0.00 58.65 57.98 3h0g h GLN 14 Cb 1.25 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.93 3h0g h GLN 14 CO 0.61 0.96 0.03 0.93 -0.67 0.00 0.00 178.83 180.69 3h0g h GLU 15 N 0.90 0.00 0.26 1.46 5.08 -2.02 -0.19 114.58 120.07 3h0g h GLU 15 Ca 0.17 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.19 3h0g h GLU 15 Cb 0.51 0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.80 3h0g h GLU 15 CO 0.03 0.00 -1.48 -0.44 -1.00 0.00 0.00 179.01 176.11 3h0g h ASP 16 N 0.00 0.85 -0.97 1.42 3.32 -1.93 -3.31 116.42 115.80 3h0g h ASP 16 Ca 0.00 -0.92 0.15 0.00 0.02 0.00 0.00 57.03 56.28 3h0g h ASP 16 Cb 0.06 -0.28 -0.08 0.00 0.22 0.00 0.00 39.33 39.24 3h0g h ASP 16 CO 0.00 1.72 0.61 0.00 -1.72 0.00 0.00 179.24 179.85 3h0g h TRP 18 N 0.83 1.02 0.00 0.00 4.06 -1.68 -1.62 115.95 118.56 3h0g h TRP 18 Ca 0.50 -0.19 0.00 0.00 2.06 0.00 0.00 58.89 61.26 3h0g h TRP 18 Cb 0.68 -0.26 0.00 0.00 -1.00 0.00 0.00 29.16 28.58 3h0g h TRP 18 CO -0.00 0.96 0.00 -2.37 -3.56 0.00 0.00 178.44 173.46 3h0g n THR 19 N -4.16 1.10 -0.09 1.49 5.66 0.87 -0.61 114.28 118.54 3h0g n THR 19 Ca 0.02 0.30 -0.15 0.00 -3.05 0.00 0.00 64.05 61.17 3h0g n THR 19 Cb 0.37 -1.12 -0.08 0.00 -1.55 0.00 0.00 70.33 67.95 3h0g n THR 19 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 175.07 172.60 3h0g h VAL 20 N 0.00 0.69 0.00 1.08 2.07 -0.86 -3.39 116.25 115.85 3h0g h VAL 20 Ca 0.00 -1.79 0.00 0.00 0.82 0.00 0.00 66.70 65.73 3h0g h VAL 20 Cb 0.23 1.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 3h0g h VAL 20 CO 0.00 0.23 0.00 2.30 0.02 0.00 0.00 177.57 180.12 3h0g n ILE 21 N -4.53 0.42 0.07 4.57 -6.64 -0.69 -0.82 119.36 111.74 3h0g n ILE 21 Ca -0.21 0.11 -0.09 0.00 -1.77 0.00 0.00 62.75 60.79 3h0g n ILE 21 Cb 0.50 -0.74 0.03 0.00 -1.44 0.00 0.00 39.64 37.99 3h0g n ILE 21 CO 0.00 0.00 0.00 0.77 -1.77 0.00 0.00 176.55 175.55 3h0g h SER 22 N 0.00 0.40 -0.55 7.28 4.64 -1.05 -3.20 113.55 121.07 3h0g h SER 22 Ca 0.00 -0.27 -0.00 0.00 -0.47 0.00 0.00 61.79 61.04 3h0g h SER 22 Cb 0.29 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.23 3h0g h SER 22 CO 0.00 1.02 0.33 -1.28 -0.87 0.00 0.00 176.83 176.03 3h0g h SER 23 N 0.22 0.66 -0.99 4.97 0.87 -1.16 -2.15 113.55 115.98 3h0g h SER 23 Ca -0.03 -0.06 0.19 0.00 -1.23 0.00 0.00 61.79 60.65 3h0g h SER 23 Cb 1.33 -0.17 -0.10 0.00 -0.44 0.00 0.00 62.40 63.03 3h0g h SER 23 CO 0.12 0.53 0.61 0.15 -0.53 0.00 0.00 176.83 177.72 3h0g h PHE 24 N 0.74 0.98 -0.01 2.24 3.04 -1.54 0.16 116.94 122.55 3h0g h PHE 24 Ca 0.20 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.18 3h0g h PHE 24 Cb -0.01 -0.30 0.00 0.00 2.56 0.00 0.00 35.95 38.20 3h0g h PHE 24 CO -0.02 0.24 -0.14 1.19 -2.02 0.00 0.00 178.31 177.56 3h0g n PHE 25 N -4.70 0.00 0.08 0.41 3.01 -0.90 -1.22 117.46 114.15 3h0g n PHE 25 Ca 0.22 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.47 3h0g n PHE 25 Cb 0.58 -0.10 -0.12 0.00 -0.01 0.00 0.00 39.48 39.83 3h0g n PHE 25 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 3h0g h GLU 26 N 1.31 0.62 0.00 -1.08 4.22 -0.34 -3.28 114.58 116.02 3h0g h GLU 26 Ca 0.00 -0.80 -0.05 0.00 0.08 0.00 0.00 59.36 58.59 3h0g h GLU 26 Cb 0.44 0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 3h0g h GLU 26 CO 0.00 1.36 -1.03 -1.91 -2.18 0.00 0.00 179.01 175.25 3h0g n GLU 27 N -3.79 0.45 0.02 1.92 2.13 -1.14 -4.66 120.64 115.57 3h0g n GLU 27 Ca -0.13 0.18 0.03 0.00 0.66 0.00 0.00 57.16 57.90 3h0g n GLU 27 Cb 0.97 -1.29 0.40 0.00 0.27 0.00 0.00 31.44 31.78 3h0g n GLU 27 CO 0.00 0.00 0.00 1.15 -0.41 0.00 0.00 177.13 177.87 3h0g h THR 28 N -0.84 1.13 -2.36 6.31 2.02 -1.41 -3.48 112.91 114.27 3h0g h THR 28 Ca -0.08 -0.38 0.29 0.00 0.77 0.00 0.00 66.41 67.01 3h0g h THR 28 Cb 0.93 0.68 -0.07 0.00 -1.74 0.00 0.00 68.15 67.95 3h0g h THR 28 CO -0.05 0.15 -0.38 -1.54 0.37 0.00 0.00 175.52 174.07 3h0g n SER 29 N -4.41 -6.28 -4.91 4.18 3.41 -1.22 -4.12 113.62 100.27 3h0g n SER 29 Ca 0.02 0.42 -0.27 0.00 -0.26 0.00 0.00 58.87 58.78 3h0g n SER 29 Cb 0.12 -3.34 -0.01 0.00 -0.26 0.00 0.00 64.21 60.72 3h0g n SER 29 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3h0g s LEU 30 N -5.50 3.75 0.00 1.04 1.43 -1.26 -3.96 118.68 114.19 3h0g s LEU 30 Ca 0.00 0.84 0.00 0.00 -1.03 0.00 0.00 54.13 53.94 3h0g s LEU 30 Cb 0.00 -3.76 0.00 0.00 0.03 0.00 0.00 46.19 42.46 3h0g s LEU 30 CO 0.00 -0.48 0.00 0.00 0.23 0.00 0.00 176.35 176.10 3h0g n ALA 31 N -1.97 0.00 -0.26 4.21 0.00 -1.26 -4.79 120.51 116.44 3h0g n ALA 31 Ca -0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 3h0g n ALA 31 Cb 0.55 -1.11 0.12 0.00 0.00 0.00 0.00 19.45 19.01 3h0g n ALA 31 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3h0g n ARG 32 N -1.17 -0.07 -3.12 0.00 0.00 -1.25 -2.93 116.66 108.12 3h0g n ARG 32 Ca 0.00 1.14 -0.45 0.00 -0.00 0.00 0.00 57.85 58.55 3h0g n ARG 32 Cb 0.14 -1.72 -0.04 0.00 0.00 0.00 0.00 32.46 30.83 3h0g n ARG 32 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.63 178.77 3h0g s GLN 33 N -5.89 3.07 0.00 -0.14 0.00 -1.26 -3.38 119.66 112.07 3h0g s GLN 33 Ca -0.11 -1.37 0.00 0.00 -0.00 0.00 0.00 55.36 53.88 3h0g s GLN 33 Cb 0.20 -4.29 0.00 0.00 0.00 0.00 0.00 33.01 28.92 3h0g s GLN 33 CO 0.57 -1.54 0.00 0.94 0.00 0.00 0.00 175.29 175.26 3h0g n GLN 34 N 6.26 0.00 0.00 9.60 -0.06 -1.15 -4.69 117.38 127.34 3h0g n GLN 34 Ca -0.08 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.92 3h0g n GLN 34 Cb 0.43 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.61 3h0g n GLN 34 CO 0.00 0.00 0.00 -0.11 -0.20 0.00 0.00 177.06 176.75 3h0g n LEU 35 N -1.43 0.00 0.00 1.69 -0.00 -1.26 -4.17 117.00 111.83 3h0g n LEU 35 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 3h0g n LEU 35 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 3h0g n LEU 35 CO 0.00 0.00 0.00 0.33 -0.00 0.00 0.00 177.39 177.72 3h0g n PHE 36 N -2.00 0.00 1.05 1.96 -0.00 -1.22 -4.61 117.46 112.65 3h0g n PHE 36 Ca 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 57.45 57.54 3h0g n PHE 36 Cb 0.00 0.00 0.52 0.00 -0.00 0.00 0.00 39.48 40.00 3h0g n PHE 36 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 3h0g n SER 37 N -0.82 0.00 -0.01 -2.13 2.88 -1.26 -2.04 113.62 110.24 3h0g n SER 37 Ca 0.00 -0.37 0.00 0.00 -1.33 0.00 0.00 58.87 57.18 3h0g n SER 37 Cb 0.00 -0.10 -0.03 0.00 -0.75 0.00 0.00 64.21 63.33 3h0g n SER 37 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 3h0g n PHE 38 N -1.10 0.00 0.23 0.66 7.35 -1.26 -2.86 117.46 120.47 3h0g n PHE 38 Ca 0.12 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.83 3h0g n PHE 38 Cb 0.09 -0.13 0.12 0.00 0.35 0.00 0.00 39.48 39.91 3h0g n PHE 38 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 3h0g n ASP 39 N -1.86 0.00 -3.50 -2.13 8.00 -0.87 -3.48 116.55 112.72 3h0g n ASP 39 Ca -0.03 0.15 -0.27 0.00 0.71 0.00 0.00 54.79 55.35 3h0g n ASP 39 Cb 0.34 -0.23 -0.10 0.00 -0.02 0.00 0.00 41.12 41.12 3h0g n ASP 39 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3h0g n GLU 40 N -1.23 1.11 0.00 -1.24 1.02 -1.14 -4.57 120.64 114.59 3h0g n GLU 40 Ca 0.02 -3.78 0.00 0.00 -0.02 0.00 0.00 57.16 53.38 3h0g n GLU 40 Cb 0.03 -1.84 0.00 0.00 -0.02 0.00 0.00 31.44 29.61 3h0g n GLU 40 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3h0g n PHE 41 N 2.00 0.00 -2.00 -0.32 7.35 -1.23 -4.72 117.46 118.55 3h0g n PHE 41 Ca 0.25 0.00 -0.01 0.00 -0.76 0.00 0.00 57.45 56.93 3h0g n PHE 41 Cb 0.44 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.27 3h0g n PHE 41 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 3h0g n VAL 42 N -1.36 -4.53 -0.06 -2.13 0.31 -1.26 -2.40 118.33 106.90 3h0g n VAL 42 Ca 0.00 0.09 -0.07 0.00 -0.01 0.00 0.00 64.34 64.34 3h0g n VAL 42 Cb 0.00 -4.86 -0.01 0.00 -0.91 0.00 0.00 33.84 28.06 3h0g n VAL 42 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 3h0g h GLN 43 N 0.38 0.03 0.00 5.55 7.50 -1.89 -3.44 115.11 123.24 3h0g h GLN 43 Ca 0.00 -0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 3h0g h GLN 43 Cb 0.71 -0.01 0.00 0.00 0.05 0.00 0.00 27.48 28.24 3h0g h GLN 43 CO 0.09 0.02 0.00 -1.71 -1.50 0.00 0.00 178.83 175.72 3h0g n ASN 44 N -5.20 0.00 0.10 1.46 5.15 -1.01 -4.59 115.26 111.17 3h0g n ASN 44 Ca -0.01 0.00 0.12 0.00 -0.60 0.00 0.00 54.58 54.09 3h0g n ASN 44 Cb 0.15 0.00 0.24 0.00 -0.53 0.00 0.00 39.78 39.63 3h0g n ASN 44 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3h0g h THR 45 N 0.00 0.00 -0.08 -0.44 1.03 -1.85 -3.36 112.91 108.21 3h0g h THR 45 Ca 0.00 -0.60 -0.12 0.00 -0.01 0.00 0.00 66.41 65.68 3h0g h THR 45 Cb 0.00 1.37 -0.01 0.00 -1.07 0.00 0.00 68.15 68.44 3h0g h THR 45 CO 0.00 0.00 -0.50 -0.03 -0.01 0.00 0.00 175.52 174.98 3h0g h MET 46 N 0.00 0.21 0.00 0.00 1.85 -1.80 -2.93 114.93 112.26 3h0g h MET 46 Ca 0.00 -0.12 0.00 0.00 -0.61 0.00 0.00 59.70 58.97 3h0g h MET 46 Cb 0.80 0.01 0.00 0.00 0.43 0.00 0.00 31.60 32.84 3h0g h MET 46 CO 0.00 0.67 0.00 1.96 -0.40 0.00 0.00 176.91 179.14 3h0g h GLN 47 N 0.17 0.00 0.00 0.39 4.20 -1.81 -2.09 115.11 115.96 3h0g h GLN 47 Ca 0.01 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.55 3h0g h GLN 47 Cb 0.95 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.70 3h0g h GLN 47 CO 0.08 0.00 -1.73 0.39 -0.67 0.00 0.00 178.83 176.89 3h0g n GLU 48 N -2.61 0.64 0.16 1.46 1.02 -1.11 -4.07 120.64 116.13 3h0g n GLU 48 Ca -0.00 0.08 0.03 0.00 -0.02 0.00 0.00 57.16 57.25 3h0g n GLU 48 Cb 0.16 -1.69 0.20 0.00 -0.02 0.00 0.00 31.44 30.10 3h0g n GLU 48 CO 0.00 0.00 0.00 -0.84 1.18 0.00 0.00 177.13 177.47 3h0g h ILE 49 N 0.00 1.00 0.00 -3.67 3.07 -1.33 -2.49 117.51 114.09 3h0g h ILE 49 Ca -0.21 -1.92 0.00 0.00 1.55 0.00 0.00 64.86 64.28 3h0g h ILE 49 Cb 1.58 2.16 0.00 0.00 -0.27 0.00 0.00 36.82 40.29 3h0g h ILE 49 CO 0.03 0.48 0.00 1.33 -1.05 0.00 0.00 178.15 178.94 3h0g n VAL 50 N -3.46 0.65 0.96 0.16 0.24 -1.06 -3.07 118.33 112.76 3h0g n VAL 50 Ca 0.00 -0.13 0.12 0.00 -2.04 0.00 0.00 64.34 62.29 3h0g n VAL 50 Cb 0.61 -0.75 0.16 0.00 -1.47 0.00 0.00 33.84 32.39 3h0g n VAL 50 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 3h0g n ASP 51 N -2.25 0.62 0.23 -1.34 8.00 -0.95 -3.33 116.55 117.53 3h0g n ASP 51 Ca 0.05 -0.40 0.11 0.00 0.71 0.00 0.00 54.79 55.26 3h0g n ASP 51 Cb 0.37 0.44 0.41 0.00 -0.02 0.00 0.00 41.12 42.32 3h0g n ASP 51 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 3h0g h ASP 52 N 0.00 0.00 -0.90 -2.24 5.19 -1.46 -3.32 116.42 113.70 3h0g h ASP 52 Ca 0.00 0.00 -0.35 0.00 -0.62 0.00 0.00 57.03 56.06 3h0g h ASP 52 Cb 0.52 0.00 -0.37 0.00 0.18 0.00 0.00 39.33 39.66 3h0g h ASP 52 CO 0.00 0.16 -1.11 -0.90 -3.12 0.00 0.00 179.24 174.27 3h0g n ASP 53 N -3.24 1.09 -3.09 6.45 5.68 -1.25 -4.96 116.55 117.23 3h0g n ASP 53 Ca 0.01 -2.69 -0.38 0.00 -0.50 0.00 0.00 54.79 51.24 3h0g n ASP 53 Cb 0.45 -0.37 0.01 0.00 -1.14 0.00 0.00 41.12 40.08 3h0g n ASP 53 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3h0g n SER 54 N -0.11 7.35 -4.14 -1.12 3.41 -1.21 -4.95 113.62 112.85 3h0g n SER 54 Ca 0.08 -3.61 -0.14 0.00 -0.26 0.00 0.00 58.87 54.94 3h0g n SER 54 Cb 0.82 -1.16 -0.11 0.00 -0.26 0.00 0.00 64.21 63.51 3h0g n SER 54 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3h0g s THR 55 N -3.95 0.81 0.00 6.66 -1.32 -1.26 -4.13 115.64 112.45 3h0g s THR 55 Ca 0.50 -1.51 0.00 0.00 -1.21 0.00 0.00 61.69 59.47 3h0g s THR 55 Cb 0.34 -1.19 0.00 0.00 -1.51 0.00 0.00 72.50 70.14 3h0g s THR 55 CO -0.27 -0.53 0.00 -0.11 -2.21 0.00 0.00 174.62 171.50 3h0g n LEU 56 N 0.77 0.00 -2.97 9.08 0.00 -1.26 -5.01 117.00 117.60 3h0g n LEU 56 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.83 3h0g n LEU 56 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.99 3h0g n LEU 56 CO 0.25 0.00 0.82 1.07 0.00 0.00 0.00 177.39 179.53 3h0g n THR 57 N 0.00 0.00 0.00 1.96 5.66 -1.26 -4.92 114.28 115.72 3h0g n THR 57 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 3h0g n THR 57 Cb 0.00 -1.33 0.00 0.00 -1.55 0.00 0.00 70.33 67.45 3h0g n THR 57 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 175.07 171.64 3h0g n ILE 77 N 4.42 0.00 -4.37 1.09 5.41 -1.01 -5.19 119.36 119.70 3h0g n ILE 77 Ca 0.00 0.00 -0.29 0.00 1.00 0.00 0.00 62.75 63.46 3h0g n ILE 77 Cb 0.00 0.00 -0.13 0.00 -0.71 0.00 0.00 39.64 38.80 3h0g n ILE 77 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 3h0g s ASN 78 N 0.00 3.43 -0.19 4.38 0.01 -0.89 -4.20 114.94 117.47 3h0g s ASN 78 Ca 0.00 -0.72 -0.08 0.00 -0.71 0.00 0.00 52.86 51.35 3h0g s ASN 78 Cb 0.00 -0.28 -0.04 0.00 0.41 0.00 0.00 41.25 41.34 3h0g s ASN 78 CO 0.00 0.18 0.09 -0.36 -1.51 0.00 0.00 177.10 175.50 3h0g s PHE 79 N -1.09 3.31 0.00 2.20 0.40 -1.26 -1.17 117.98 120.37 3h0g s PHE 79 Ca 0.15 0.16 0.00 0.00 -0.60 0.00 0.00 56.93 56.64 3h0g s PHE 79 Cb -0.10 -2.11 0.00 0.00 0.51 0.00 0.00 43.02 41.32 3h0g s PHE 79 CO 0.07 0.20 0.00 0.41 0.70 0.00 0.00 175.22 176.60 3h0g n GLY 80 N 3.54 1.83 3.81 4.36 0.00 0.26 -4.85 105.19 114.13 3h0g n GLY 80 Ca -0.16 -2.00 -0.30 0.00 0.00 0.00 0.00 46.02 43.55 3h0g n GLY 80 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h0g s GLN 81 N 3.05 2.19 -0.15 1.61 -0.21 -1.26 -4.69 119.66 120.20 3h0g s GLN 81 Ca 0.00 0.67 0.02 0.00 0.02 0.00 0.00 55.36 56.07 3h0g s GLN 81 Cb 0.00 -1.93 0.01 0.00 1.00 0.00 0.00 33.01 32.10 3h0g s GLN 81 CO 0.00 -1.56 -0.20 -1.50 -2.12 0.00 0.00 175.29 169.91 3h0g s ILE 82 N -3.15 1.98 0.24 1.08 2.07 -1.26 -2.96 121.20 119.21 3h0g s ILE 82 Ca 0.60 -0.92 -0.31 0.00 -1.41 0.00 0.00 60.65 58.62 3h0g s ILE 82 Cb -0.14 -1.77 -0.11 0.00 0.13 0.00 0.00 42.46 40.57 3h0g s ILE 82 CO 0.54 0.53 1.60 -0.31 -1.91 0.00 0.00 174.94 175.39 3h0g s TYR 83 N 0.99 2.88 -0.17 3.50 1.51 -0.30 -4.94 117.35 120.83 3h0g s TYR 83 Ca -0.03 0.68 -0.25 0.00 -1.01 0.00 0.00 57.07 56.46 3h0g s TYR 83 Cb -0.15 -4.03 -0.02 0.00 -0.11 0.00 0.00 41.96 37.66 3h0g s TYR 83 CO -0.05 -3.61 0.80 -0.51 -1.11 0.00 0.00 175.55 171.08 3h0g s LEU 84 N 0.21 4.18 -0.04 -1.29 1.43 -1.26 -4.08 118.68 117.83 3h0g s LEU 84 Ca 0.67 1.14 0.03 0.00 -1.03 0.00 0.00 54.13 54.94 3h0g s LEU 84 Cb -0.47 -3.19 0.00 0.00 0.03 0.00 0.00 46.19 42.57 3h0g s LEU 84 CO 0.40 -0.37 -0.14 -0.94 0.23 0.00 0.00 176.35 175.54 3h0g s SER 85 N 1.15 1.77 0.58 2.29 1.04 -1.26 -5.11 113.70 114.15 3h0g s SER 85 Ca 0.37 -0.29 -0.18 0.00 0.48 0.00 0.00 55.95 56.34 3h0g s SER 85 Cb -0.17 -0.53 -0.04 0.00 0.10 0.00 0.00 66.02 65.39 3h0g s SER 85 CO 0.12 0.10 1.10 -0.13 0.98 0.00 0.00 173.24 175.42 3h0g s ARG 86 N 0.18 3.22 -0.06 4.02 0.52 -1.26 -4.56 118.95 121.01 3h0g s ARG 86 Ca -0.05 1.45 -0.29 0.00 -0.52 0.00 0.00 55.73 56.32 3h0g s ARG 86 Cb -0.11 -2.00 -0.07 0.00 0.52 0.00 0.00 34.95 33.29 3h0g s ARG 86 CO 0.02 -0.93 2.04 -2.14 0.02 0.00 0.00 175.30 174.31 3h0g s PRO 87 N -3.66 3.78 0.24 3.54 0.02 -1.26 -4.69 135.00 132.96 3h0g s PRO 87 Ca 0.69 2.38 0.01 0.00 0.02 0.00 0.00 61.00 64.10 3h0g s PRO 87 Cb -0.21 -4.23 -0.00 0.00 0.02 0.00 0.00 34.50 30.07 3h0g s PRO 87 CO 0.32 -1.37 0.04 -2.37 -0.33 0.00 0.00 177.00 173.29 3h0g n THR 88 N 6.35 0.00 -3.81 0.99 5.66 -1.23 -2.00 114.28 120.24 3h0g n THR 88 Ca 0.23 -1.25 -0.13 0.00 -3.05 0.00 0.00 64.05 59.86 3h0g n THR 88 Cb 0.43 0.35 -0.12 0.00 -1.55 0.00 0.00 70.33 69.44 3h0g n THR 88 CO 0.00 0.00 0.00 -0.32 -3.05 0.00 0.00 175.07 171.70 3h0g s MET 89 N -2.88 0.20 -0.05 1.09 1.75 -1.06 -4.59 119.30 113.76 3h0g s MET 89 Ca 0.06 0.25 0.03 0.00 -1.25 0.00 0.00 55.69 54.77 3h0g s MET 89 Cb 0.00 0.08 0.01 0.00 2.84 0.00 0.00 34.83 37.76 3h0g s MET 89 CO 0.04 -0.03 -0.14 -0.08 -0.65 0.00 0.00 175.02 174.16 3h0g s THR 90 N 0.15 1.21 0.10 10.11 -1.32 -1.26 -3.11 115.64 121.52 3h0g s THR 90 Ca -0.00 -0.56 -0.10 0.00 -1.21 0.00 0.00 61.69 59.81 3h0g s THR 90 Cb -0.02 -1.08 0.01 0.00 -1.51 0.00 0.00 72.50 69.90 3h0g s THR 90 CO -0.00 0.36 0.24 -1.83 -2.21 0.00 0.00 174.62 171.19 3h0g s GLU 91 N 0.37 0.90 0.62 7.08 -1.05 -1.25 -5.04 118.70 120.33 3h0g s GLU 91 Ca -0.09 -0.90 -0.17 0.00 -0.15 0.00 0.00 54.97 53.65 3h0g s GLU 91 Cb -0.13 0.37 -0.02 0.00 -0.44 0.00 0.00 34.13 33.91 3h0g s GLU 91 CO 0.03 -0.31 1.15 0.00 0.95 0.00 0.00 175.26 177.09 3h0g s ALA 92 N -3.85 2.51 -0.75 -0.84 0.00 -1.26 -2.75 121.76 114.82 3h0g s ALA 92 Ca 0.05 0.80 0.00 0.00 0.00 0.00 0.00 51.96 52.81 3h0g s ALA 92 Cb 0.04 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.77 3h0g s ALA 92 CO -0.11 -1.17 0.00 -0.25 0.00 0.00 0.00 175.76 174.23 3h0g n ASP 93 N -1.90 -2.82 0.00 0.00 9.92 -1.26 -4.78 116.55 115.72 3h0g n ASP 93 Ca 0.12 0.27 0.00 0.00 -0.53 0.00 0.00 54.79 54.65 3h0g n ASP 93 Cb 0.51 -2.51 0.00 0.00 -0.64 0.00 0.00 41.12 38.48 3h0g n ASP 93 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3h0g n GLY 94 N -0.59 4.99 0.00 0.44 0.00 -1.11 -5.19 105.19 103.73 3h0g n GLY 94 Ca -0.10 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.11 3h0g n GLY 94 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h0g n SER 95 N 0.00 0.00 -4.33 1.61 3.41 -1.25 -4.94 113.62 108.13 3h0g n SER 95 Ca 0.00 -1.00 -0.46 0.00 -0.26 0.00 0.00 58.87 57.15 3h0g n SER 95 Cb 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 63.94 3h0g n SER 95 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3h0g s THR 96 N -2.71 5.76 -0.12 6.66 2.01 -1.26 -3.90 115.64 122.07 3h0g s THR 96 Ca 0.00 -2.98 0.01 0.00 0.31 0.00 0.00 61.69 59.02 3h0g s THR 96 Cb 0.00 -4.51 -0.01 0.00 0.01 0.00 0.00 72.50 67.99 3h0g s THR 96 CO 0.00 -1.11 -0.15 0.42 -0.69 0.00 0.00 174.62 173.09 3h0g s THR 97 N -0.59 2.83 1.06 -0.82 -4.23 -1.18 -4.96 115.64 107.75 3h0g s THR 97 Ca 0.24 -0.74 -0.13 0.00 -1.18 0.00 0.00 61.69 59.88 3h0g s THR 97 Cb -0.10 -2.17 0.16 0.00 1.34 0.00 0.00 72.50 71.73 3h0g s THR 97 CO -0.08 0.53 0.70 1.07 -0.54 0.00 0.00 174.62 176.29 3h0g n THR 98 N 3.52 0.00 -2.79 3.99 5.66 -1.26 -2.55 114.28 120.85 3h0g n THR 98 Ca -0.18 -0.26 -0.33 0.00 -3.05 0.00 0.00 64.05 60.23 3h0g n THR 98 Cb 0.53 -0.83 -0.07 0.00 -1.55 0.00 0.00 70.33 68.41 3h0g n THR 98 CO 0.00 0.00 0.00 -0.32 -3.05 0.00 0.00 175.07 171.70 3h0g s MET 99 N -4.09 4.20 -0.46 1.09 1.75 -0.85 -4.69 119.30 116.26 3h0g s MET 99 Ca 0.63 1.15 0.03 0.00 -1.25 0.00 0.00 55.69 56.25 3h0g s MET 99 Cb -0.21 -2.20 0.15 0.00 2.84 0.00 0.00 34.83 35.42 3h0g s MET 99 CO 0.64 -0.05 0.32 -0.06 -0.65 0.00 0.00 175.02 175.21 3h0g s PHE 100 N -2.14 1.73 0.68 4.11 0.40 -1.26 -4.98 117.98 116.53 3h0g s PHE 100 Ca 0.62 -2.42 -0.11 0.00 -0.60 0.00 0.00 56.93 54.41 3h0g s PHE 100 Cb -0.10 -1.52 0.00 0.00 0.51 0.00 0.00 43.02 41.91 3h0g s PHE 100 CO 0.14 -0.76 1.06 -1.25 0.70 0.00 0.00 175.22 175.11 3h0g s PRO 101 N 0.04 2.96 -0.02 0.24 0.05 -1.26 -2.02 135.00 134.99 3h0g s PRO 101 Ca 0.25 0.99 0.12 0.00 0.05 0.00 0.00 61.00 62.41 3h0g s PRO 101 Cb -0.10 -1.99 0.38 0.00 0.05 0.00 0.00 34.50 32.83 3h0g s PRO 101 CO -0.10 -1.08 1.29 1.04 0.05 0.00 0.00 177.00 178.20 3h0g n GLN 102 N -3.00 2.14 0.20 4.56 3.00 -1.26 -4.81 117.38 118.21 3h0g n GLN 102 Ca 0.08 -1.53 0.10 0.00 -0.01 0.00 0.00 57.00 55.64 3h0g n GLN 102 Cb 0.53 -1.41 0.55 0.00 0.00 0.00 0.00 30.24 29.91 3h0g n GLN 102 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 3h0g h GLU 103 N 2.39 0.00 0.00 -1.09 5.08 -1.64 -3.34 114.58 115.98 3h0g h GLU 103 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3h0g h GLU 103 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 3h0g h GLU 103 CO 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.05 3h0g n ALA 104 N -1.71 0.00 -0.57 3.43 0.00 -1.17 -4.68 120.51 115.81 3h0g n ALA 104 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 3h0g n ALA 104 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.68 3h0g n ALA 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3h0g n ARG 105 N 0.00 0.00 0.19 0.00 1.74 -1.25 -3.59 116.66 113.75 3h0g n ARG 105 Ca 0.00 0.00 0.15 0.00 -0.77 0.00 0.00 57.85 57.23 3h0g n ARG 105 Cb 0.00 0.00 0.77 0.00 -1.02 0.00 0.00 32.46 32.21 3h0g n ARG 105 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3h0g h LEU 106 N 0.00 0.00 -1.18 0.55 -0.00 -1.80 1.39 115.31 114.27 3h0g h LEU 106 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 3h0g h LEU 106 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 3h0g h LEU 106 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 178.44 178.98 3h0g n ARG 107 N -4.09 0.55 -2.00 1.13 1.74 -1.24 -4.79 116.66 107.96 3h0g n ARG 107 Ca 0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 3h0g n ARG 107 Cb 0.28 -1.26 0.00 0.00 -1.02 0.00 0.00 32.46 30.46 3h0g n ARG 107 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3h0g n ASN 108 N 0.32 -0.73 -4.74 0.55 5.03 0.48 -4.87 115.26 111.30 3h0g n ASN 108 Ca 0.00 0.37 -0.41 0.00 0.87 0.00 0.00 54.58 55.41 3h0g n ASN 108 Cb 0.16 -0.78 -0.05 0.00 -1.02 0.00 0.00 39.78 38.09 3h0g n ASN 108 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 3h0g s LEU 109 N -3.86 4.56 0.19 3.41 0.20 -1.15 -3.48 118.68 118.55 3h0g s LEU 109 Ca 0.00 1.83 -0.29 0.00 0.69 0.00 0.00 54.13 56.35 3h0g s LEU 109 Cb 0.00 -3.57 -0.08 0.00 -0.43 0.00 0.00 46.19 42.12 3h0g s LEU 109 CO 0.00 0.03 0.93 -0.89 -0.29 0.00 0.00 176.35 176.13 3h0g s THR 110 N -0.49 4.24 -1.11 3.68 2.01 -1.26 -3.32 115.64 119.39 3h0g s THR 110 Ca 0.44 2.04 -0.07 0.00 0.31 0.00 0.00 61.69 64.41 3h0g s THR 110 Cb -0.24 -4.31 0.29 0.00 0.01 0.00 0.00 72.50 68.25 3h0g s THR 110 CO 0.30 0.45 1.36 0.00 -0.69 0.00 0.00 174.62 176.03 3h0g n TYR 111 N 1.91 3.59 -4.68 4.92 9.36 -1.20 -4.91 117.16 126.16 3h0g n TYR 111 Ca -0.01 -3.15 -0.32 0.00 3.32 0.00 0.00 57.90 57.74 3h0g n TYR 111 Cb 0.48 -1.50 -0.08 0.00 -0.63 0.00 0.00 39.34 37.61 3h0g n TYR 111 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 3h0g s SER 112 N -0.27 4.12 0.12 2.98 1.04 -1.26 -0.73 113.70 119.70 3h0g s SER 112 Ca 0.32 -1.57 0.03 0.00 0.48 0.00 0.00 55.95 55.21 3h0g s SER 112 Cb -0.01 0.33 -0.04 0.00 0.10 0.00 0.00 66.02 66.40 3h0g s SER 112 CO 0.02 -0.79 -0.08 -0.94 0.98 0.00 0.00 173.24 172.43 3h0g s SER 113 N -3.87 1.43 0.26 7.02 1.04 -0.57 -3.57 113.70 115.44 3h0g s SER 113 Ca 0.13 -1.00 -0.22 0.00 0.48 0.00 0.00 55.95 55.34 3h0g s SER 113 Cb 0.03 0.05 -0.09 0.00 0.10 0.00 0.00 66.02 66.11 3h0g s SER 113 CO 0.07 -0.40 0.80 -2.84 0.98 0.00 0.00 173.24 171.85 3h0g s PRO 114 N -3.77 4.38 0.04 4.02 0.02 -1.26 -1.23 135.00 137.20 3h0g s PRO 114 Ca 0.14 1.04 -0.13 0.00 0.02 0.00 0.00 61.00 62.07 3h0g s PRO 114 Cb 0.04 -2.86 -0.06 0.00 0.02 0.00 0.00 34.50 31.64 3h0g s PRO 114 CO -0.02 0.36 0.42 -0.51 -0.33 0.00 0.00 177.00 176.92 3h0g s LEU 115 N -1.98 4.42 -0.23 -5.54 1.02 -1.05 -4.48 118.68 110.84 3h0g s LEU 115 Ca 0.45 0.92 -0.02 0.00 0.02 0.00 0.00 54.13 55.50 3h0g s LEU 115 Cb -0.18 -2.78 0.07 0.00 0.02 0.00 0.00 46.19 43.33 3h0g s LEU 115 CO 0.22 0.26 0.06 -0.31 0.02 0.00 0.00 176.35 176.60 3h0g s TYR 116 N -1.22 1.13 -0.18 0.29 2.02 -1.26 -1.19 117.35 116.95 3h0g s TYR 116 Ca 0.28 -1.08 -0.04 0.00 -0.37 0.00 0.00 57.07 55.86 3h0g s TYR 116 Cb -0.16 -1.18 -0.02 0.00 -0.40 0.00 0.00 41.96 40.20 3h0g s TYR 116 CO 0.15 -0.70 -0.04 0.08 -1.57 0.00 0.00 175.55 173.48 3h0g s VAL 117 N 1.82 3.73 -0.12 0.71 1.01 -1.03 -1.14 120.40 125.39 3h0g s VAL 117 Ca 0.03 -0.40 -0.29 0.00 0.00 0.00 0.00 61.98 61.31 3h0g s VAL 117 Cb -0.17 -2.66 -0.05 0.00 0.00 0.00 0.00 36.38 33.50 3h0g s VAL 117 CO -0.15 0.46 1.79 -1.81 0.00 0.00 0.00 175.10 175.39 3h0g s ASP 118 N 0.74 6.35 0.02 3.32 1.01 -1.16 -3.44 116.67 123.51 3h0g s ASP 118 Ca -0.02 2.07 -0.01 0.00 0.71 0.00 0.00 52.55 55.30 3h0g s ASP 118 Cb -0.14 -2.53 -0.04 0.00 1.01 0.00 0.00 42.92 41.22 3h0g s ASP 118 CO 0.02 -1.21 0.16 -0.04 0.21 0.00 0.00 175.17 174.31 3h0g s MET 119 N 4.67 3.32 -0.17 8.23 -1.94 -1.26 -0.58 119.30 131.56 3h0g s MET 119 Ca 0.80 -0.42 0.01 0.00 -1.71 0.00 0.00 55.69 54.37 3h0g s MET 119 Cb -0.32 -3.00 0.01 0.00 2.01 0.00 0.00 34.83 33.53 3h0g s MET 119 CO 0.33 0.64 -0.19 1.03 -0.01 0.00 0.00 175.02 176.82 3h0g s ARG 120 N -2.09 3.05 0.00 2.03 0.52 -0.32 -3.46 118.95 118.68 3h0g s ARG 120 Ca 0.29 -0.81 0.00 0.00 -0.52 0.00 0.00 55.73 54.68 3h0g s ARG 120 Cb -0.13 -2.58 0.00 0.00 0.52 0.00 0.00 34.95 32.77 3h0g s ARG 120 CO 0.21 -0.15 0.00 0.36 0.02 0.00 0.00 175.30 175.74 3h0g n LYS 121 N 4.47 0.00 -3.72 3.54 2.85 -1.26 -2.10 118.16 121.94 3h0g n LYS 121 Ca -0.20 0.00 -0.13 0.00 -1.05 0.00 0.00 58.31 56.93 3h0g n LYS 121 Cb 0.51 0.00 -0.13 0.00 -0.65 0.00 0.00 35.03 34.75 3h0g n LYS 121 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 3h0g s GLU 143 N 0.24 0.20 -0.32 -1.58 2.02 -1.26 -4.52 118.70 113.47 3h0g s GLU 143 Ca 0.00 0.55 0.09 0.00 0.02 0.00 0.00 54.97 55.63 3h0g s GLU 143 Cb 0.00 -0.12 0.46 0.00 0.10 0.00 0.00 34.13 34.57 3h0g s GLU 143 CO 0.00 -0.18 1.15 -0.25 0.02 0.00 0.00 175.26 176.00 3h0g n ASP 144 N 4.34 4.29 0.00 -0.19 9.92 -1.26 -5.01 116.55 128.64 3h0g n ASP 144 Ca -0.24 -3.48 0.00 0.00 -0.53 0.00 0.00 54.79 50.55 3h0g n ASP 144 Cb 0.53 -0.40 0.00 0.00 -0.64 0.00 0.00 41.12 40.61 3h0g n ASP 144 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3h0g n GLU 145 N -0.61 0.00 -2.45 -1.24 1.02 -1.26 -4.74 120.64 111.36 3h0g n GLU 145 Ca 0.37 0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 57.16 3h0g n GLU 145 Cb 0.87 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 32.26 3h0g n GLU 145 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3h0g s GLU 146 N 0.00 3.67 0.00 3.49 2.02 -1.26 -5.06 118.70 121.56 3h0g s GLU 146 Ca 0.00 1.39 0.00 0.00 0.02 0.00 0.00 54.97 56.38 3h0g s GLU 146 Cb 0.00 -2.07 0.00 0.00 0.10 0.00 0.00 34.13 32.16 3h0g s GLU 146 CO 0.00 -0.54 0.00 -2.30 0.02 0.00 0.00 175.26 172.44 3h0g n PRO 147 N -1.13 0.00 0.00 0.39 -0.02 -1.26 -4.95 135.00 128.03 3h0g n PRO 147 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 3h0g n PRO 147 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 3h0g n PRO 147 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3h0g n SER 148 N 0.00 0.00 -4.11 2.55 3.41 -1.22 -4.79 113.62 109.45 3h0g n SER 148 Ca 0.00 0.00 -0.46 0.00 -0.26 0.00 0.00 58.87 58.15 3h0g n SER 148 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 3h0g n SER 148 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 3h0g n LYS 149 N 0.00 -0.27 -3.84 4.33 2.85 -1.26 -4.87 118.16 115.10 3h0g n LYS 149 Ca 0.00 0.04 -0.33 0.00 -1.05 0.00 0.00 58.31 56.97 3h0g n LYS 149 Cb 0.00 -2.48 -0.05 0.00 -0.65 0.00 0.00 35.03 31.85 3h0g n LYS 149 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 3h0g s VAL 150 N -3.64 5.35 0.08 0.58 1.01 -1.22 -4.90 120.40 117.66 3h0g s VAL 150 Ca 0.44 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 62.04 3h0g s VAL 150 Cb -0.25 -3.58 -0.05 0.00 0.00 0.00 0.00 36.38 32.50 3h0g s VAL 150 CO 0.96 0.26 1.04 0.12 0.00 0.00 0.00 175.10 177.49 3h0g s PHE 151 N -1.40 3.65 -0.54 5.22 5.36 -1.26 -2.46 117.98 126.56 3h0g s PHE 151 Ca 0.31 1.64 0.04 0.00 -0.96 0.00 0.00 56.93 57.95 3h0g s PHE 151 Cb -0.13 -3.19 0.16 0.00 -0.34 0.00 0.00 43.02 39.53 3h0g s PHE 151 CO 0.20 -0.30 0.38 0.42 -1.46 0.00 0.00 175.22 174.47 3h0g s ILE 152 N 0.44 1.65 0.35 3.12 1.01 -0.33 -4.95 121.20 122.49 3h0g s ILE 152 Ca 0.51 -3.29 0.00 0.00 0.00 0.00 0.00 60.65 57.87 3h0g s ILE 152 Cb -0.25 -2.11 0.00 0.00 0.01 0.00 0.00 42.46 40.11 3h0g s ILE 152 CO 0.30 -1.06 0.00 0.61 0.00 0.00 0.00 174.94 174.80 3h0g n GLY 153 N 2.66 -1.93 3.20 6.18 0.00 -1.26 -4.42 105.19 109.63 3h0g n GLY 153 Ca 0.20 -1.14 -0.26 0.00 0.00 0.00 0.00 46.02 44.83 3h0g n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h0g s LYS 154 N -2.29 1.48 -0.21 1.61 1.02 -1.26 -2.54 119.74 117.56 3h0g s LYS 154 Ca 0.00 -0.74 -0.02 0.00 0.02 0.00 0.00 55.97 55.23 3h0g s LYS 154 Cb 0.00 -1.47 0.00 0.00 -0.52 0.00 0.00 37.83 35.84 3h0g s LYS 154 CO 0.00 0.40 -0.10 0.42 -0.92 0.00 0.00 175.35 175.15 3h0g s ILE 155 N -0.54 2.91 -0.11 2.17 1.01 -0.36 -3.90 121.20 122.37 3h0g s ILE 155 Ca 0.07 -0.65 -0.29 0.00 0.00 0.00 0.00 60.65 59.78 3h0g s ILE 155 Cb -0.08 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 40.06 3h0g s ILE 155 CO -0.00 0.46 1.54 -2.84 0.00 0.00 0.00 174.94 174.10 3h0g s PRO 156 N 1.41 4.14 0.36 2.79 0.02 -1.26 -1.51 135.00 140.95 3h0g s PRO 156 Ca 0.05 1.97 -0.14 0.00 0.02 0.00 0.00 61.00 62.90 3h0g s PRO 156 Cb -0.14 -3.93 -0.08 0.00 0.02 0.00 0.00 34.50 30.37 3h0g s PRO 156 CO -0.07 -0.87 0.77 0.42 -0.33 0.00 0.00 177.00 176.92 3h0g s ILE 157 N 4.05 4.68 -0.26 2.83 1.01 0.09 -4.91 121.20 128.68 3h0g s ILE 157 Ca 0.68 0.92 -0.12 0.00 0.00 0.00 0.00 60.65 62.13 3h0g s ILE 157 Cb -0.29 -3.64 -0.05 0.00 0.01 0.00 0.00 42.46 38.49 3h0g s ILE 157 CO 0.25 -0.30 0.25 -0.32 0.00 0.00 0.00 174.94 174.83 3h0g s MET 158 N -3.25 4.01 0.29 2.79 -2.45 -1.26 -4.64 119.30 114.80 3h0g s MET 158 Ca 0.54 -0.17 -0.28 0.00 -1.25 0.00 0.00 55.69 54.53 3h0g s MET 158 Cb -0.10 -3.63 -0.14 0.00 1.25 0.00 0.00 34.83 32.21 3h0g s MET 158 CO 0.21 -0.15 1.03 1.28 1.05 0.00 0.00 175.02 178.44 3h0g n LEU 159 N 4.94 1.95 -3.07 4.11 4.77 -1.09 -3.66 117.00 124.96 3h0g n LEU 159 Ca -0.12 1.18 -0.07 0.00 -0.03 0.00 0.00 56.01 56.97 3h0g n LEU 159 Cb 0.52 -1.31 0.01 0.00 -2.33 0.00 0.00 43.42 40.31 3h0g n LEU 159 CO 0.35 -1.32 0.15 0.54 -1.33 0.00 0.00 177.39 175.78 3h0g n ARG 160 N 0.70 -1.77 -3.20 3.23 1.74 -1.26 -3.81 116.66 112.30 3h0g n ARG 160 Ca 0.09 1.66 -0.12 0.00 -0.77 0.00 0.00 57.85 58.71 3h0g n ARG 160 Cb 0.32 -5.22 -0.04 0.00 -1.02 0.00 0.00 32.46 26.51 3h0g n ARG 160 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3h0g n SER 161 N -1.21 0.99 -0.15 0.55 3.41 -1.24 -4.82 113.62 111.16 3h0g n SER 161 Ca 0.01 -2.09 -0.05 0.00 -0.26 0.00 0.00 58.87 56.49 3h0g n SER 161 Cb 0.51 0.54 0.14 0.00 -0.26 0.00 0.00 64.21 65.14 3h0g n SER 161 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3h0g h THR 162 N 1.35 1.24 -1.85 6.66 1.35 -1.92 -3.17 112.91 116.58 3h0g h THR 162 Ca -0.16 -0.96 -0.63 0.00 -0.55 0.00 0.00 66.41 64.11 3h0g h THR 162 Cb 0.61 0.76 -0.39 0.00 -1.73 0.00 0.00 68.15 67.40 3h0g h THR 162 CO 0.25 0.35 -0.30 0.49 -0.25 0.00 0.00 175.52 176.06 3h0g n PHE 163 N -4.23 3.47 -3.93 4.73 3.72 -1.26 -4.99 117.46 114.97 3h0g n PHE 163 Ca 0.03 -3.19 -0.27 0.00 -0.05 0.00 0.00 57.45 53.98 3h0g n PHE 163 Cb 0.28 -0.44 -0.01 0.00 -0.94 0.00 0.00 39.48 38.37 3h0g n PHE 163 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3h0g n ILE 165 N -1.74 0.02 0.00 0.00 5.41 -1.26 -4.48 119.36 117.30 3h0g n ILE 165 Ca -0.02 -0.08 0.00 0.00 1.00 0.00 0.00 62.75 63.65 3h0g n ILE 165 Cb 0.64 -0.18 0.00 0.00 -0.71 0.00 0.00 39.64 39.39 3h0g n ILE 165 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 3h0g n LEU 166 N -0.61 0.00 0.00 1.39 4.77 -1.26 -5.00 117.00 116.29 3h0g n LEU 166 Ca 0.20 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 3h0g n LEU 166 Cb 0.17 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 3h0g n LEU 166 CO 0.16 -0.46 0.00 -3.20 -1.33 0.00 0.00 177.39 172.56 3h0g n ASN 167 N -2.37 0.00 -3.67 -1.43 5.15 -1.26 -2.32 115.26 109.35 3h0g n ASN 167 Ca 0.00 0.00 -0.41 0.00 -0.60 0.00 0.00 54.58 53.57 3h0g n ASN 167 Cb 0.00 0.00 -0.00 0.00 -0.53 0.00 0.00 39.78 39.25 3h0g n ASN 167 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3h0g n GLY 168 N 0.00 4.85 3.20 8.20 0.00 -1.26 -4.91 105.19 115.27 3h0g n GLY 168 Ca 0.00 -1.99 -0.32 0.00 0.00 0.00 0.00 46.02 43.71 3h0g n GLY 168 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h0g s VAL 169 N 0.24 2.16 0.57 1.61 1.01 -0.98 -5.12 120.40 119.88 3h0g s VAL 169 Ca 0.48 -0.96 -0.19 0.00 0.00 0.00 0.00 61.98 61.31 3h0g s VAL 169 Cb 0.14 -1.85 -0.05 0.00 0.00 0.00 0.00 36.38 34.62 3h0g s VAL 169 CO -0.04 0.55 1.13 -0.94 0.00 0.00 0.00 175.10 175.80 3h0g s SER 170 N 0.63 5.58 0.18 3.32 1.04 -1.26 -4.82 113.70 118.38 3h0g s SER 170 Ca -0.11 2.16 -0.21 0.00 0.48 0.00 0.00 55.95 58.27 3h0g s SER 170 Cb -0.16 -2.58 0.11 0.00 0.10 0.00 0.00 66.02 63.49 3h0g s SER 170 CO 0.02 -1.31 1.60 0.44 0.98 0.00 0.00 173.24 174.97 3h0g h ASP 171 N 0.98 -1.05 0.00 7.02 5.19 -2.00 0.14 116.42 126.70 3h0g h ASP 171 Ca -0.49 0.21 0.00 0.00 -0.62 0.00 0.00 57.03 56.12 3h0g h ASP 171 Cb 1.26 0.53 0.00 0.00 0.18 0.00 0.00 39.33 41.30 3h0g h ASP 171 CO 0.56 -0.30 0.23 0.77 -3.12 0.00 0.00 179.24 177.38 3h0g h SER 172 N -0.18 0.00 -0.00 6.45 4.64 -2.04 0.13 113.55 122.55 3h0g h SER 172 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 3h0g h SER 172 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 3h0g h SER 172 CO -0.62 0.00 -0.65 -0.62 -0.87 0.00 0.00 176.83 174.07 3h0g n GLU 173 N -2.64 1.46 0.02 4.77 1.02 0.43 -4.33 120.64 121.37 3h0g n GLU 173 Ca -0.02 -0.31 -0.15 0.00 -0.02 0.00 0.00 57.16 56.66 3h0g n GLU 173 Cb 0.27 -1.31 -0.04 0.00 -0.02 0.00 0.00 31.44 30.33 3h0g n GLU 173 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3h0g h LEU 174 N 0.70 0.77 0.29 -4.62 3.38 -0.22 -3.30 115.31 112.31 3h0g h LEU 174 Ca 0.00 -0.53 -0.01 0.00 0.09 0.00 0.00 57.88 57.43 3h0g h LEU 174 Cb 0.47 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 3h0g h LEU 174 CO 0.00 1.32 -0.20 1.88 0.09 0.00 0.00 178.44 181.52 3h0g h TYR 175 N 0.41 -0.54 -1.46 1.13 0.99 -1.75 -2.21 116.97 113.55 3h0g h TYR 175 Ca -0.06 -0.00 0.48 0.00 2.00 0.00 0.00 58.73 61.14 3h0g h TYR 175 Cb 1.44 0.20 -0.12 0.00 1.00 0.00 0.00 36.73 39.25 3h0g h TYR 175 CO 0.07 -0.31 0.96 -0.44 -0.00 0.00 0.00 178.16 178.44 3h0g h ASP 176 N -0.49 0.18 -0.25 3.88 3.45 -1.77 2.02 116.42 123.44 3h0g h ASP 176 Ca -0.02 0.12 0.00 0.00 0.43 0.00 0.00 57.03 57.56 3h0g h ASP 176 Cb 0.42 0.12 0.00 0.00 -0.56 0.00 0.00 39.33 39.31 3h0g h ASP 176 CO 0.01 -0.18 0.00 0.18 -1.57 0.00 0.00 179.24 177.67 3h0g n LEU 177 N -4.58 1.89 -2.83 1.55 4.77 -0.88 -4.93 117.00 112.00 3h0g n LEU 177 Ca 0.40 -0.84 -0.15 0.00 -0.03 0.00 0.00 56.01 55.39 3h0g n LEU 177 Cb 1.59 -0.16 0.06 0.00 -2.33 0.00 0.00 43.42 42.58 3h0g n LEU 177 CO 0.24 0.42 0.12 0.59 -1.33 0.00 0.00 177.39 177.43 3h0g n ASN 178 N 0.49 -3.24 -3.59 -1.43 3.02 0.68 -4.28 115.26 106.91 3h0g n ASN 178 Ca 0.15 -0.44 -0.18 0.00 -0.03 0.00 0.00 54.58 54.08 3h0g n ASN 178 Cb 0.34 -3.96 -0.02 0.00 -0.61 0.00 0.00 39.78 35.53 3h0g n ASN 178 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3h0g n GLU 179 N -3.56 1.19 -3.72 3.52 1.02 -0.89 -4.51 120.64 113.70 3h0g n GLU 179 Ca -0.14 -2.10 -0.28 0.00 -0.02 0.00 0.00 57.16 54.63 3h0g n GLU 179 Cb 0.60 0.44 -0.16 0.00 -0.02 0.00 0.00 31.44 32.30 3h0g n GLU 179 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3h0g n PRO 181 N 5.06 0.00 -0.07 0.00 -0.02 -1.26 0.12 135.00 138.83 3h0g n PRO 181 Ca -0.08 0.02 -0.03 0.00 -2.02 0.00 0.00 63.50 61.38 3h0g n PRO 181 Cb 0.47 -1.83 -0.16 0.00 -0.02 0.00 0.00 33.50 31.95 3h0g n PRO 181 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3h0g n TYR 182 N -0.87 0.04 -1.55 6.00 4.02 -1.26 -4.93 117.16 118.61 3h0g n TYR 182 Ca 0.00 0.01 -0.46 0.00 -0.01 0.00 0.00 57.90 57.45 3h0g n TYR 182 Cb 0.33 -0.85 -0.02 0.00 -0.02 0.00 0.00 39.34 38.78 3h0g n TYR 182 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 3h0g n ASP 183 N -2.61 0.72 -0.15 7.72 9.92 0.32 -4.87 116.55 127.60 3h0g n ASP 183 Ca -0.23 1.17 0.09 0.00 -0.53 0.00 0.00 54.79 55.29 3h0g n ASP 183 Cb 0.97 -1.21 0.14 0.00 -0.64 0.00 0.00 41.12 40.39 3h0g n ASP 183 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3h0g n GLN 184 N 0.82 1.28 0.00 -1.24 6.02 -1.26 -5.02 117.38 117.99 3h0g n GLN 184 Ca 0.12 -2.63 0.00 0.00 -0.01 0.00 0.00 57.00 54.48 3h0g n GLN 184 Cb 0.30 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.07 3h0g n GLN 184 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3h0g n GLY 185 N -1.36 0.67 0.00 1.08 0.00 -1.26 -4.90 105.19 99.41 3h0g n GLY 185 Ca 0.16 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.31 3h0g n GLY 185 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h0g n GLY 186 N 0.00 1.89 3.49 -0.02 0.00 -1.25 -5.05 105.19 104.25 3h0g n GLY 186 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 3h0g n GLY 186 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3h0g s TYR 187 N -2.20 2.22 0.07 1.61 -0.85 -1.26 -4.52 117.35 112.42 3h0g s TYR 187 Ca 0.00 -0.55 0.07 0.00 -0.52 0.00 0.00 57.07 56.07 3h0g s TYR 187 Cb 0.00 -1.23 -0.04 0.00 0.38 0.00 0.00 41.96 41.08 3h0g s TYR 187 CO 0.00 0.49 -0.12 -0.06 -1.52 0.00 0.00 175.55 174.34 3h0g s PHE 188 N -2.74 2.70 -0.74 -3.49 0.40 0.13 -2.66 117.98 111.57 3h0g s PHE 188 Ca 0.31 -0.17 0.03 0.00 -0.60 0.00 0.00 56.93 56.49 3h0g s PHE 188 Cb 0.02 -1.46 0.33 0.00 0.51 0.00 0.00 43.02 42.42 3h0g s PHE 188 CO 0.14 0.37 1.27 0.44 0.70 0.00 0.00 175.22 178.14 3h0g n ILE 189 N 1.10 4.18 -2.65 0.64 -5.35 -1.26 0.13 119.36 116.16 3h0g n ILE 189 Ca -0.15 -5.73 -0.42 0.00 -0.27 0.00 0.00 62.75 56.18 3h0g n ILE 189 Cb 0.52 -1.46 -0.03 0.00 -1.74 0.00 0.00 39.64 36.93 3h0g n ILE 189 CO 0.00 0.00 0.00 0.27 -1.76 0.00 0.00 176.55 175.06 3h0g s ILE 190 N -4.41 4.52 -0.71 7.28 -4.36 -1.19 -3.23 121.20 119.10 3h0g s ILE 190 Ca 0.45 1.92 0.00 0.00 -0.26 0.00 0.00 60.65 62.76 3h0g s ILE 190 Cb 0.25 -4.23 0.00 0.00 1.25 0.00 0.00 42.46 39.73 3h0g s ILE 190 CO -0.13 0.21 0.00 0.59 0.24 0.00 0.00 174.94 175.85 3h0g n ASN 191 N 3.42 -5.56 0.00 4.36 3.02 -1.26 -2.97 115.26 116.27 3h0g n ASN 191 Ca 0.05 0.17 0.00 0.00 -0.03 0.00 0.00 54.58 54.77 3h0g n ASN 191 Cb 0.49 -3.65 0.00 0.00 -0.61 0.00 0.00 39.78 36.01 3h0g n ASN 191 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h0g n GLY 192 N 0.17 0.41 3.22 7.41 0.00 -1.21 -4.56 105.19 110.63 3h0g n GLY 192 Ca -0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.70 3h0g n GLY 192 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h0g s SER 193 N -2.12 2.35 0.29 1.61 1.04 -1.16 -4.55 113.70 111.17 3h0g s SER 193 Ca 0.00 -0.44 -0.29 0.00 0.48 0.00 0.00 55.95 55.70 3h0g s SER 193 Cb 0.00 -0.22 -0.13 0.00 0.10 0.00 0.00 66.02 65.76 3h0g s SER 193 CO 0.00 0.19 1.20 -0.62 0.98 0.00 0.00 173.24 174.99 3h0g n GLU 194 N 2.19 1.74 -4.11 4.02 -0.58 -1.26 -3.19 120.64 119.45 3h0g n GLU 194 Ca -0.16 0.61 -0.14 0.00 -0.42 0.00 0.00 57.16 57.06 3h0g n GLU 194 Cb 0.53 -2.13 -0.11 0.00 -0.57 0.00 0.00 31.44 29.17 3h0g n GLU 194 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 3h0g s LYS 195 N -1.34 0.67 -0.09 3.49 -0.14 0.35 -3.67 119.74 119.00 3h0g s LYS 195 Ca 0.61 -0.94 -0.01 0.00 -1.36 0.00 0.00 55.97 54.27 3h0g s LYS 195 Cb -0.66 -0.39 0.03 0.00 -1.68 0.00 0.00 37.83 35.13 3h0g s LYS 195 CO 0.58 0.06 -0.04 0.08 -0.76 0.00 0.00 175.35 175.28 3h0g s VAL 196 N -1.88 0.67 0.65 3.17 1.01 -0.46 0.22 120.40 123.79 3h0g s VAL 196 Ca -0.03 -0.08 -0.16 0.00 0.00 0.00 0.00 61.98 61.71 3h0g s VAL 196 Cb -0.06 -0.76 -0.00 0.00 0.00 0.00 0.00 36.38 35.55 3h0g s VAL 196 CO -0.00 0.31 1.14 -0.63 0.00 0.00 0.00 175.10 175.92 3h0g s ILE 197 N 1.76 2.96 -0.01 2.22 1.01 -1.26 -3.55 121.20 124.34 3h0g s ILE 197 Ca 0.03 0.49 0.05 0.00 0.00 0.00 0.00 60.65 61.22 3h0g s ILE 197 Cb -0.13 -3.05 -0.01 0.00 0.01 0.00 0.00 42.46 39.28 3h0g s ILE 197 CO -0.06 -0.24 -0.16 -0.63 0.00 0.00 0.00 174.94 173.86 3h0g s ILE 198 N -2.10 1.25 0.00 2.92 1.01 -1.26 -4.83 121.20 118.19 3h0g s ILE 198 Ca 0.70 -0.70 0.00 0.00 0.00 0.00 0.00 60.65 60.66 3h0g s ILE 198 Cb -0.24 -1.04 0.00 0.00 0.01 0.00 0.00 42.46 41.19 3h0g s ILE 198 CO 0.39 0.34 0.00 0.00 0.00 0.00 0.00 174.94 175.67 3h0g n ALA 199 N 2.65 0.00 -3.59 9.38 0.00 -0.41 -4.70 120.51 123.83 3h0g n ALA 199 Ca -0.15 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.23 3h0g n ALA 199 Cb 0.55 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.96 3h0g n ALA 199 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3h0g s GLN 200 N -0.99 0.40 -0.37 0.00 -1.52 -1.23 -3.38 119.66 112.56 3h0g s GLN 200 Ca 0.00 0.01 0.00 0.00 -1.95 0.00 0.00 55.36 53.42 3h0g s GLN 200 Cb 0.00 0.19 0.12 0.00 -0.22 0.00 0.00 33.01 33.10 3h0g s GLN 200 CO 0.00 -0.14 0.18 -1.21 -0.25 0.00 0.00 175.29 173.86 3h0g s GLU 201 N -1.57 0.90 0.00 2.91 2.02 -1.26 -1.71 118.70 119.99 3h0g s GLU 201 Ca 0.04 -1.48 0.00 0.00 0.02 0.00 0.00 54.97 53.55 3h0g s GLU 201 Cb -0.01 -1.98 0.00 0.00 0.10 0.00 0.00 34.13 32.25 3h0g s GLU 201 CO -0.03 -1.10 0.00 -2.13 0.02 0.00 0.00 175.26 172.02 3h0g n ARG 202 N 4.18 0.00 0.00 1.61 3.00 -1.26 -4.00 116.66 120.19 3h0g n ARG 202 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.90 3h0g n ARG 202 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.84 3h0g n ARG 202 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 3h0g n SER 203 N 0.00 0.00 0.00 6.15 3.41 -1.26 -4.93 113.62 116.99 3h0g n SER 203 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3h0g n SER 203 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3h0g n SER 203 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h0g n ALA 204 N -3.00 2.51 0.00 7.33 0.00 -1.26 -3.44 120.51 122.65 3h0g n ALA 204 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3h0g n ALA 204 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3h0g n ALA 204 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h0g n ALA 205 N -2.38 0.00 -1.87 0.00 0.00 -1.26 -4.90 120.51 110.11 3h0g n ALA 205 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 3h0g n ALA 205 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 3h0g n ALA 205 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3h0g n ASN 206 N -0.94 -2.50 -4.68 0.00 3.02 -1.25 -4.89 115.26 104.02 3h0g n ASN 206 Ca 0.00 0.25 -0.34 0.00 -0.03 0.00 0.00 54.58 54.46 3h0g n ASN 206 Cb 0.00 -2.34 -0.09 0.00 -0.61 0.00 0.00 39.78 36.74 3h0g n ASN 206 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 3h0g s ILE 207 N -2.05 4.23 -0.94 2.41 -5.25 -1.26 -4.59 121.20 113.75 3h0g s ILE 207 Ca 0.00 -0.41 -0.03 0.00 -0.99 0.00 0.00 60.65 59.22 3h0g s ILE 207 Cb 0.00 -2.82 0.00 0.00 2.95 0.00 0.00 42.46 42.59 3h0g s ILE 207 CO 0.00 0.50 0.46 0.52 -1.79 0.00 0.00 174.94 174.63 3h0g n VAL 208 N 1.81 -1.39 -3.58 8.37 0.31 -1.26 -4.01 118.33 118.57 3h0g n VAL 208 Ca -0.17 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 63.95 3h0g n VAL 208 Cb 0.53 -2.67 -0.15 0.00 -0.91 0.00 0.00 33.84 30.64 3h0g n VAL 208 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 3h0g s GLN 209 N -5.38 0.09 0.00 5.55 0.74 -1.26 -5.08 119.66 114.32 3h0g s GLN 209 Ca 0.23 0.13 0.00 0.00 0.05 0.00 0.00 55.36 55.77 3h0g s GLN 209 Cb -0.10 -1.33 0.00 0.00 1.10 0.00 0.00 33.01 32.68 3h0g s GLN 209 CO 0.28 -0.60 0.34 0.28 -0.55 0.00 0.00 175.29 175.04 3h0g n VAL 210 N 5.30 0.00 -2.66 1.34 0.31 -1.26 -3.62 118.33 117.74 3h0g n VAL 210 Ca -0.06 0.84 -0.05 0.00 -0.01 0.00 0.00 64.34 65.06 3h0g n VAL 210 Cb 0.49 -1.65 -0.04 0.00 -0.91 0.00 0.00 33.84 31.73 3h0g n VAL 210 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 3h0g n PHE 211 N -0.46 -4.07 -1.51 3.52 -0.00 -1.26 -3.92 117.46 109.77 3h0g n PHE 211 Ca 0.00 2.31 0.00 0.00 -0.00 0.00 0.00 57.45 59.76 3h0g n PHE 211 Cb 0.00 -3.68 0.00 0.00 -0.00 0.00 0.00 39.48 35.80 3h0g n PHE 211 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.76 177.12 3h0g n LYS 212 N 1.69 3.73 0.00 -4.13 2.85 -1.26 -3.59 118.16 117.45 3h0g n LYS 212 Ca -0.35 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 56.91 3h0g n LYS 212 Cb 0.55 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.93 3h0g n LYS 212 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 3h0g n LYS 213 N 0.00 -1.92 0.00 -1.58 5.02 -1.26 -4.82 118.16 113.60 3h0g n LYS 213 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3h0g n LYS 213 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 3h0g n LYS 213 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h0g n ALA 214 N -0.01 0.00 -2.84 7.82 0.00 -1.26 -4.57 120.51 119.65 3h0g n ALA 214 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 3h0g n ALA 214 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 3h0g n ALA 214 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h0g n ALA 215 N -1.24 1.87 0.00 0.00 0.00 -1.26 -5.09 120.51 114.79 3h0g n ALA 215 Ca 0.00 -2.57 0.00 0.00 0.00 0.00 0.00 53.44 50.87 3h0g n ALA 215 Cb 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.46 3h0g n ALA 215 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3h0g n PRO 216 N 0.01 0.00 -3.89 0.00 -0.02 -1.26 -4.73 135.00 125.11 3h0g n PRO 216 Ca 0.11 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.47 3h0g n PRO 216 Cb 0.76 0.00 -0.13 0.00 -0.02 0.00 0.00 33.50 34.11 3h0g n PRO 216 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3h0g s SER 217 N -4.77 0.03 -0.12 2.55 1.04 -1.26 -5.17 113.70 106.00 3h0g s SER 217 Ca 0.00 -0.07 -0.11 0.00 0.48 0.00 0.00 55.95 56.25 3h0g s SER 217 Cb 0.00 0.04 -0.04 0.00 0.10 0.00 0.00 66.02 66.13 3h0g s SER 217 CO 0.00 -0.06 -0.22 -0.81 0.98 0.00 0.00 173.24 173.13 3h0g n PRO 218 N 2.79 0.37 -0.36 4.02 -0.04 -1.26 -5.06 135.00 135.46 3h0g n PRO 218 Ca -0.14 0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 3h0g n PRO 218 Cb 0.59 -1.25 0.00 0.00 -0.04 0.00 0.00 33.50 32.80 3h0g n PRO 218 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 3h0g n ILE 219 N -3.94 0.00 -2.71 0.52 5.41 -1.26 -4.76 119.36 112.63 3h0g n ILE 219 Ca -0.09 0.00 -0.01 0.00 1.00 0.00 0.00 62.75 63.65 3h0g n ILE 219 Cb 0.32 -1.22 0.02 0.00 -0.71 0.00 0.00 39.64 38.06 3h0g n ILE 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3h0g s ALA 220 N -2.43 -4.54 0.00 -1.39 0.00 -1.26 -4.73 121.76 107.41 3h0g s ALA 220 Ca 0.00 0.94 0.00 0.00 0.00 0.00 0.00 51.96 52.90 3h0g s ALA 220 Cb 0.00 -3.01 0.00 0.00 0.00 0.00 0.00 23.12 20.11 3h0g s ALA 220 CO 0.00 -2.52 0.00 0.66 0.00 0.00 0.00 175.76 173.90 3h0g n TYR 221 N 3.07 0.00 -4.12 0.00 4.01 -1.26 -3.97 117.16 114.89 3h0g n TYR 221 Ca 0.09 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.59 3h0g n TYR 221 Cb 0.64 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.61 3h0g n TYR 221 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3h0g s VAL 222 N 0.00 3.02 -0.40 -0.72 1.01 -1.24 -3.81 120.40 118.27 3h0g s VAL 222 Ca 0.00 -1.71 0.08 0.00 0.00 0.00 0.00 61.98 60.34 3h0g s VAL 222 Cb 0.00 -2.97 0.24 0.00 0.00 0.00 0.00 36.38 33.66 3h0g s VAL 222 CO 0.00 -0.19 0.52 0.00 0.00 0.00 0.00 175.10 175.43 3h0g n ALA 223 N -1.13 2.31 -1.77 5.51 0.00 -1.16 -4.43 120.51 119.84 3h0g n ALA 223 Ca -0.03 -3.29 -0.36 0.00 0.00 0.00 0.00 53.44 49.76 3h0g n ALA 223 Cb 0.61 -0.83 -0.01 0.00 0.00 0.00 0.00 19.45 19.23 3h0g n ALA 223 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3h0g s GLU 224 N -0.98 3.63 0.00 0.00 2.12 -1.24 -3.63 118.70 118.61 3h0g s GLU 224 Ca 0.35 1.74 0.00 0.00 0.36 0.00 0.00 54.97 57.41 3h0g s GLU 224 Cb 0.16 -2.29 0.00 0.00 0.26 0.00 0.00 34.13 32.26 3h0g s GLU 224 CO -0.12 -0.65 0.00 -0.89 -0.54 0.00 0.00 175.26 173.06 3h0g n ILE 225 N -0.72 0.00 -2.50 -3.70 5.41 -1.26 -4.14 119.36 112.44 3h0g n ILE 225 Ca 0.09 0.00 -0.09 0.00 1.00 0.00 0.00 62.75 63.74 3h0g n ILE 225 Cb 0.49 -0.36 -0.02 0.00 -0.71 0.00 0.00 39.64 39.04 3h0g n ILE 225 CO 0.00 0.00 0.00 -2.11 0.00 0.00 0.00 176.55 174.44 3h0g n ARG 226 N -2.08 -2.01 -3.33 0.38 0.00 -1.26 -3.81 116.66 104.54 3h0g n ARG 226 Ca 0.00 0.03 -0.27 0.00 -0.00 0.00 0.00 57.85 57.61 3h0g n ARG 226 Cb 0.21 -3.42 -0.03 0.00 -0.00 0.00 0.00 32.46 29.22 3h0g n ARG 226 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 3h0g s SER 227 N -1.83 6.40 0.00 2.89 1.04 -1.26 -4.53 113.70 116.40 3h0g s SER 227 Ca 0.18 0.64 0.00 0.00 0.48 0.00 0.00 55.95 57.25 3h0g s SER 227 Cb -0.10 -2.11 0.00 0.00 0.10 0.00 0.00 66.02 63.90 3h0g s SER 227 CO 0.22 -0.23 0.00 0.00 0.98 0.00 0.00 173.24 174.21 3h0g n ALA 228 N -1.18 0.00 -1.55 5.32 0.00 -1.26 -4.61 120.51 117.23 3h0g n ALA 228 Ca -0.02 0.00 -0.52 0.00 0.00 0.00 0.00 53.44 52.90 3h0g n ALA 228 Cb 0.54 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.94 3h0g n ALA 228 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 3h0g n LEU 229 N 0.00 0.95 0.00 0.00 -0.00 -1.26 -4.51 117.00 112.18 3h0g n LEU 229 Ca 0.00 1.14 0.00 0.00 -0.00 0.00 0.00 56.01 57.15 3h0g n LEU 229 Cb 0.00 -1.12 0.00 0.00 -0.00 0.00 0.00 43.42 42.30 3h0g n LEU 229 CO 0.00 -1.53 0.00 1.21 -0.00 0.00 0.00 177.39 177.07 3h0g n GLU 230 N 1.82 0.00 0.16 1.47 2.13 0.43 -2.65 120.64 124.00 3h0g n GLU 230 Ca 0.17 0.00 0.13 0.00 0.66 0.00 0.00 57.16 58.13 3h0g n GLU 230 Cb 0.19 -0.05 0.52 0.00 0.27 0.00 0.00 31.44 32.38 3h0g n GLU 230 CO 0.00 0.00 0.00 0.07 -0.41 0.00 0.00 177.13 176.79 3h0g h ARG 231 N 0.57 0.00 0.00 5.31 0.11 -1.87 -3.43 114.38 115.07 3h0g h ARG 231 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3h0g h ARG 231 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 3h0g h ARG 231 CO 0.00 0.00 0.00 0.41 0.10 0.00 0.00 179.97 180.48 3h0g n GLY 232 N 0.14 0.00 0.00 0.08 0.00 -1.26 -5.05 105.19 99.10 3h0g n GLY 232 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3h0g n GLY 232 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h0g n SER 233 N 0.00 0.00 -2.57 1.61 3.41 -1.26 -4.96 113.62 109.85 3h0g n SER 233 Ca 0.00 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.38 3h0g n SER 233 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 3h0g n SER 233 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 3h0g n ARG 234 N 0.00 0.00 -0.02 4.33 0.63 -1.26 -4.31 116.66 116.03 3h0g n ARG 234 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 3h0g n ARG 234 Cb 0.00 -0.62 0.00 0.00 0.45 0.00 0.00 32.46 32.29 3h0g n ARG 234 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 3h0g n LEU 235 N 1.82 0.00 -4.66 6.15 0.00 -1.08 -0.43 117.00 118.80 3h0g n LEU 235 Ca 0.02 -0.04 -0.41 0.00 0.00 0.00 0.00 56.01 55.58 3h0g n LEU 235 Cb 0.32 0.00 -0.04 0.00 0.00 0.00 0.00 43.42 43.69 3h0g n LEU 235 CO 0.33 0.47 0.59 -0.63 0.00 0.00 0.00 177.39 178.15 3h0g s ILE 236 N 0.00 4.88 0.00 1.96 -1.09 -1.26 -4.77 121.20 120.92 3h0g s ILE 236 Ca 0.00 1.54 0.00 0.00 -2.23 0.00 0.00 60.65 59.96 3h0g s ILE 236 Cb 0.00 -4.10 0.00 0.00 -1.58 0.00 0.00 42.46 36.78 3h0g s ILE 236 CO 0.00 -0.00 0.00 -1.54 -1.23 0.00 0.00 174.94 172.17 3h0g n SER 237 N 5.54 0.00 0.00 3.58 3.41 -1.26 -4.99 113.62 119.90 3h0g n SER 237 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 3h0g n SER 237 Cb 0.48 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 3h0g n SER 237 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3h0g n SER 238 N 0.00 0.00 0.00 4.04 3.41 -1.26 -4.51 113.62 115.30 3h0g n SER 238 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3h0g n SER 238 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3h0g n SER 238 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3h0g n MET 239 N 0.00 0.00 -1.39 4.33 2.81 -1.26 -4.45 117.12 117.15 3h0g n MET 239 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 3h0g n MET 239 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.51 3h0g n MET 239 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 3h0g n GLN 240 N 0.00 -3.89 -3.70 0.03 6.02 -1.24 -4.07 117.38 110.53 3h0g n GLN 240 Ca 0.00 2.94 -0.14 0.00 -0.01 0.00 0.00 57.00 59.79 3h0g n GLN 240 Cb 0.00 -3.43 -0.08 0.00 1.02 0.00 0.00 30.24 27.75 3h0g n GLN 240 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 3h0g s ILE 241 N -3.94 0.03 0.00 5.09 -4.36 -1.25 -3.51 121.20 113.24 3h0g s ILE 241 Ca 0.00 -0.21 0.00 0.00 -0.26 0.00 0.00 60.65 60.18 3h0g s ILE 241 Cb 0.00 -0.70 0.00 0.00 1.25 0.00 0.00 42.46 43.01 3h0g s ILE 241 CO 0.00 -0.12 0.00 0.29 0.24 0.00 0.00 174.94 175.35 3h0g n LYS 242 N 1.75 3.18 0.01 0.37 5.02 -1.21 -2.97 118.16 124.30 3h0g n LYS 242 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.11 3h0g n LYS 242 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.57 3h0g n LYS 242 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 3h0g n LEU 243 N 0.00 -0.10 -1.50 -0.35 0.00 -1.25 -4.23 117.00 109.57 3h0g n LEU 243 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 56.01 56.05 3h0g n LEU 243 Cb 0.00 0.33 0.00 0.00 0.00 0.00 0.00 43.42 43.75 3h0g n LEU 243 CO 0.00 -0.22 -0.39 1.15 0.00 0.00 0.00 177.39 177.94 3h0g n MET 244 N -2.28 -3.43 -0.55 1.96 -0.00 -1.25 -3.60 117.12 107.96 3h0g n MET 244 Ca 0.00 2.64 -0.02 0.00 -0.00 0.00 0.00 57.70 60.32 3h0g n MET 244 Cb 0.00 -3.33 -0.02 0.00 -0.00 0.00 0.00 33.22 29.87 3h0g n MET 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3h0g n ALA 245 N -2.15 1.22 -2.11 3.17 0.00 -1.26 -4.02 120.51 115.37 3h0g n ALA 245 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.23 3h0g n ALA 245 Cb 0.30 -0.16 0.00 0.00 0.00 0.00 0.00 19.45 19.59 3h0g n ALA 245 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3h0g n ARG 246 N 0.00 3.36 -3.56 0.00 0.63 -1.26 -4.88 116.66 110.95 3h0g n ARG 246 Ca -0.08 0.00 -0.37 0.00 -0.92 0.00 0.00 57.85 56.48 3h0g n ARG 246 Cb 0.39 0.00 0.03 0.00 0.45 0.00 0.00 32.46 33.34 3h0g n ARG 246 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 3h0g n ASN 247 N 0.00 -5.39 0.00 6.15 3.02 -1.26 -4.48 115.26 113.30 3h0g n ASN 247 Ca 0.00 -0.31 0.00 0.00 -0.03 0.00 0.00 54.58 54.24 3h0g n ASN 247 Cb 0.00 -1.67 0.00 0.00 -0.61 0.00 0.00 39.78 37.50 3h0g n ASN 247 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 3h0g n THR 248 N -0.64 0.19 0.15 3.41 5.66 -1.26 0.12 114.28 121.90 3h0g n THR 248 Ca -0.13 0.07 0.08 0.00 -3.05 0.00 0.00 64.05 61.02 3h0g n THR 248 Cb 0.69 -1.07 -0.12 0.00 -1.55 0.00 0.00 70.33 68.28 3h0g n THR 248 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 3h0g n GLU 249 N -0.91 0.74 -3.30 1.09 1.02 -1.26 -4.90 120.64 113.12 3h0g n GLU 249 Ca 0.00 -0.12 -0.07 0.00 -0.02 0.00 0.00 57.16 56.95 3h0g n GLU 249 Cb 0.02 -1.37 -0.06 0.00 -0.02 0.00 0.00 31.44 30.01 3h0g n GLU 249 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3h0g s ASN 250 N -3.64 0.06 0.25 1.62 2.47 0.32 -4.97 114.94 111.05 3h0g s ASN 250 Ca -0.04 -0.04 0.00 0.00 0.42 0.00 0.00 52.86 53.20 3h0g s ASN 250 Cb 0.11 1.26 0.00 0.00 -1.45 0.00 0.00 41.25 41.17 3h0g s ASN 250 CO 0.69 -0.33 0.00 -1.54 -3.72 0.00 0.00 177.10 172.20 3h0g n SER 251 N 5.37 -0.28 -0.78 -4.21 3.41 -1.25 -4.52 113.62 111.35 3h0g n SER 251 Ca -0.01 0.42 0.00 0.00 -0.26 0.00 0.00 58.87 59.03 3h0g n SER 251 Cb 0.50 0.46 -0.00 0.00 -0.26 0.00 0.00 64.21 64.91 3h0g n SER 251 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h0g n GLY 252 N 1.39 0.71 2.15 5.00 0.00 -1.26 -5.00 105.19 108.17 3h0g n GLY 252 Ca 0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 46.02 45.81 3h0g n GLY 252 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3h0g n GLN 253 N 0.12 -1.86 -4.81 1.61 3.00 -1.26 -4.80 117.38 109.37 3h0g n GLN 253 Ca -0.01 1.72 -0.32 0.00 -0.01 0.00 0.00 57.00 58.39 3h0g n GLN 253 Cb 0.78 -3.37 -0.13 0.00 0.00 0.00 0.00 30.24 27.51 3h0g n GLN 253 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 3h0g s THR 254 N -0.91 2.83 0.03 5.09 -4.23 -1.24 -4.73 115.64 112.48 3h0g s THR 254 Ca 0.00 -1.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.53 3h0g s THR 254 Cb -0.00 -2.14 -0.04 0.00 1.34 0.00 0.00 72.50 71.66 3h0g s THR 254 CO 0.42 0.46 0.06 0.27 -0.54 0.00 0.00 174.62 175.28 3h0g s ILE 255 N -0.82 4.50 0.00 2.99 -4.36 -1.24 -4.12 121.20 118.15 3h0g s ILE 255 Ca 0.13 -0.59 0.00 0.00 -0.26 0.00 0.00 60.65 59.93 3h0g s ILE 255 Cb -0.10 -3.08 0.00 0.00 1.25 0.00 0.00 42.46 40.52 3h0g s ILE 255 CO 0.03 0.28 0.00 0.54 0.24 0.00 0.00 174.94 176.03 3h0g n ARG 256 N 0.99 1.24 -3.87 0.37 1.74 -1.26 -4.00 116.66 111.86 3h0g n ARG 256 Ca -0.12 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 56.88 3h0g n ARG 256 Cb 0.52 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.96 3h0g n ARG 256 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3h0g s ALA 257 N -2.00 -0.82 0.01 7.54 0.00 -1.07 -3.34 121.76 122.08 3h0g s ALA 257 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 51.96 51.35 3h0g s ALA 257 Cb 0.00 0.82 0.00 0.00 0.00 0.00 0.00 23.12 23.94 3h0g s ALA 257 CO 0.00 -0.99 0.00 2.41 0.00 0.00 0.00 175.76 177.18 3h0g n THR 258 N -0.49 0.10 -3.05 0.00 -1.04 -1.23 -1.05 114.28 107.51 3h0g n THR 258 Ca -0.05 0.03 -0.06 0.00 -2.04 0.00 0.00 64.05 61.93 3h0g n THR 258 Cb 0.60 -1.33 0.01 0.00 -1.82 0.00 0.00 70.33 67.78 3h0g n THR 258 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3h0g n LEU 259 N -2.97 -6.73 -4.35 -4.42 4.77 -1.26 -4.37 117.00 97.68 3h0g n LEU 259 Ca 0.00 0.08 -0.34 0.00 -0.03 0.00 0.00 56.01 55.72 3h0g n LEU 259 Cb 0.37 -3.17 0.09 0.00 -2.33 0.00 0.00 43.42 38.39 3h0g n LEU 259 CO 0.00 -1.42 -0.28 -2.65 -1.33 0.00 0.00 177.39 171.71 3h0g n PRO 260 N -1.25 -0.12 -0.59 3.23 -0.02 -1.26 -3.71 135.00 131.27 3h0g n PRO 260 Ca 0.02 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.59 3h0g n PRO 260 Cb 0.51 -1.69 0.35 0.00 -0.02 0.00 0.00 33.50 32.65 3h0g n PRO 260 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 3h0g n TYR 261 N -3.14 1.42 -3.71 6.00 0.18 -1.26 -4.74 117.16 111.91 3h0g n TYR 261 Ca 0.06 -0.62 -0.12 0.00 1.88 0.00 0.00 57.90 59.10 3h0g n TYR 261 Cb 0.53 -0.23 -0.10 0.00 -0.38 0.00 0.00 39.34 39.16 3h0g n TYR 261 CO 0.00 0.00 0.00 0.96 -2.08 0.00 0.00 176.86 175.74 3h0g s ILE 262 N -1.84 -0.01 0.08 -3.48 -0.00 -1.24 -4.95 121.20 109.76 3h0g s ILE 262 Ca 0.50 0.02 0.00 0.00 -0.00 0.00 0.00 60.65 61.17 3h0g s ILE 262 Cb 0.32 -0.64 0.00 0.00 -0.00 0.00 0.00 42.46 42.14 3h0g s ILE 262 CO 0.24 0.01 0.00 -1.14 -0.00 0.00 0.00 174.94 174.05 3h0g n ARG 263 N 3.26 0.00 0.00 0.37 3.00 -1.26 -4.89 116.66 117.14 3h0g n ARG 263 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.69 3h0g n ARG 263 Cb 0.57 -0.06 0.00 0.00 0.00 0.00 0.00 32.46 32.96 3h0g n ARG 263 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 3h0g n SER 264 N -2.84 0.00 -4.65 6.15 7.64 -1.26 -5.09 113.62 113.57 3h0g n SER 264 Ca 0.00 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.53 3h0g n SER 264 Cb 0.04 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.15 3h0g n SER 264 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3h0g s ASP 265 N -0.05 5.12 -0.26 6.43 1.01 -1.26 -4.46 116.67 123.19 3h0g s ASP 265 Ca 0.00 0.10 -0.03 0.00 0.71 0.00 0.00 52.55 53.32 3h0g s ASP 265 Cb 0.00 -1.46 0.09 0.00 1.01 0.00 0.00 42.92 42.56 3h0g s ASP 265 CO 0.00 0.36 0.11 -0.63 0.21 0.00 0.00 175.17 175.21 3h0g s ILE 266 N -0.76 0.17 0.92 0.77 1.01 -0.22 -4.91 121.20 118.19 3h0g s ILE 266 Ca 0.12 -0.77 -0.15 0.00 0.00 0.00 0.00 60.65 59.85 3h0g s ILE 266 Cb -0.11 -1.05 -0.07 0.00 0.01 0.00 0.00 42.46 41.24 3h0g s ILE 266 CO 0.02 -0.59 -0.16 -2.65 0.00 0.00 0.00 174.94 171.56 3h0g n PRO 267 N 5.16 -0.08 0.04 2.79 -0.02 -1.26 -2.61 135.00 139.02 3h0g n PRO 267 Ca -0.06 -0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.30 3h0g n PRO 267 Cb 0.44 -1.41 -0.09 0.00 -0.02 0.00 0.00 33.50 32.41 3h0g n PRO 267 CO 0.00 0.00 0.00 -0.84 1.98 0.00 0.00 175.50 176.64 3h0g h ILE 268 N -1.09 1.11 -1.12 4.25 3.07 -1.84 -3.10 117.51 118.79 3h0g h ILE 268 Ca -0.44 -0.99 0.31 0.00 1.55 0.00 0.00 64.86 65.29 3h0g h ILE 268 Cb 1.31 1.72 -0.09 0.00 -0.27 0.00 0.00 36.82 39.49 3h0g h ILE 268 CO 0.30 0.23 0.74 0.58 -1.05 0.00 0.00 178.15 178.96 3h0g h VAL 269 N -0.62 0.44 -0.62 0.16 2.07 -1.90 0.30 116.25 116.07 3h0g h VAL 269 Ca -0.01 -0.09 0.17 0.00 0.82 0.00 0.00 66.70 67.59 3h0g h VAL 269 Cb 0.49 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 3h0g h VAL 269 CO 0.02 0.05 0.44 0.40 0.02 0.00 0.00 177.57 178.50 3h0g h ILE 270 N 0.25 0.70 0.06 4.57 2.04 -1.88 -1.84 117.51 121.41 3h0g h ILE 270 Ca 0.62 -0.01 -0.33 0.00 1.00 0.00 0.00 64.86 66.14 3h0g h ILE 270 Cb 1.86 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 38.57 3h0g h ILE 270 CO -0.24 0.01 -1.84 0.52 0.00 0.00 0.00 178.15 176.60 3h0g n VAL 271 N -4.37 1.70 -0.29 1.67 0.31 0.10 -3.33 118.33 114.13 3h0g n VAL 271 Ca 0.12 -0.73 -0.04 0.00 -0.01 0.00 0.00 64.34 63.68 3h0g n VAL 271 Cb 0.67 -1.39 0.07 0.00 -0.91 0.00 0.00 33.84 32.28 3h0g n VAL 271 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 3h0g h PHE 272 N 0.04 1.00 0.00 3.52 -1.00 -1.47 0.08 116.94 119.11 3h0g h PHE 272 Ca -0.35 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.45 3h0g h PHE 272 Cb 2.03 -0.34 0.00 0.00 3.61 0.00 0.00 35.95 41.25 3h0g h PHE 272 CO 0.04 0.63 0.00 0.54 -1.61 0.00 0.00 178.31 177.91 3h0g n ARG 273 N -4.53 0.40 -0.12 1.51 1.74 -0.72 -1.68 116.66 113.24 3h0g n ARG 273 Ca 0.08 0.03 0.04 0.00 -0.77 0.00 0.00 57.85 57.23 3h0g n ARG 273 Cb 0.02 -1.50 0.11 0.00 -1.02 0.00 0.00 32.46 30.07 3h0g n ARG 273 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3h0g n ALA 274 N -1.05 2.14 0.00 7.54 0.00 0.00 -4.49 120.51 124.65 3h0g n ALA 274 Ca 0.10 -1.09 -0.04 0.00 0.00 0.00 0.00 53.44 52.41 3h0g n ALA 274 Cb 0.06 -0.31 -0.01 0.00 0.00 0.00 0.00 19.45 19.18 3h0g n ALA 274 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3h0g n LEU 275 N 0.24 1.07 0.00 0.00 4.77 -0.68 -5.02 117.00 117.38 3h0g n LEU 275 Ca 0.08 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 3h0g n LEU 275 Cb 0.37 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 3h0g n LEU 275 CO 0.06 -0.41 0.00 0.61 -1.33 0.00 0.00 177.39 176.31 3h0g n GLY 276 N 2.89 0.00 2.76 -0.72 0.00 -1.17 -4.90 105.19 104.05 3h0g n GLY 276 Ca -0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 3h0g n GLY 276 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h0g s VAL 277 N 0.00 1.86 -0.18 1.61 1.01 -1.01 -4.93 120.40 118.76 3h0g s VAL 277 Ca 0.00 -3.12 -0.20 0.00 0.00 0.00 0.00 61.98 58.66 3h0g s VAL 277 Cb 0.00 -2.27 -0.22 0.00 0.00 0.00 0.00 36.38 33.89 3h0g s VAL 277 CO 0.00 -0.94 0.34 0.58 0.00 0.00 0.00 175.10 175.08 3h0g h VAL 278 N 5.03 0.99 -2.62 2.92 2.07 -1.86 -3.12 116.25 119.67 3h0g h VAL 278 Ca 0.04 -2.24 -0.60 0.00 0.82 0.00 0.00 66.70 64.72 3h0g h VAL 278 Cb 0.88 2.44 0.09 0.00 -1.52 0.00 0.00 31.29 33.18 3h0g h VAL 278 CO 0.56 0.46 0.45 -0.81 0.02 0.00 0.00 177.57 178.25 3h0g n PRO 279 N -4.28 1.77 0.00 1.57 -0.04 -1.26 -4.86 135.00 127.91 3h0g n PRO 279 Ca -0.29 0.63 0.00 0.00 -0.04 0.00 0.00 63.50 63.80 3h0g n PRO 279 Cb 0.73 -2.19 0.00 0.00 -0.04 0.00 0.00 33.50 32.00 3h0g n PRO 279 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3h0g n ASP 280 N 1.72 -0.57 0.00 3.54 10.43 -1.26 -3.88 116.55 126.53 3h0g n ASP 280 Ca 0.11 -0.05 0.00 0.00 2.57 0.00 0.00 54.79 57.41 3h0g n ASP 280 Cb 0.31 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.27 3h0g n ASP 280 CO 0.00 0.00 0.00 -1.14 -1.07 0.00 0.00 177.20 174.99 3h0g n ARG 281 N -0.62 0.00 -0.20 -1.24 0.63 -1.26 -3.75 116.66 110.23 3h0g n ARG 281 Ca 0.00 0.00 0.15 0.00 -0.92 0.00 0.00 57.85 57.08 3h0g n ARG 281 Cb 0.00 0.00 0.48 0.00 0.45 0.00 0.00 32.46 33.39 3h0g n ARG 281 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 3h0g h ASP 282 N 0.00 0.44 -0.69 6.15 5.19 -1.98 -0.50 116.42 125.04 3h0g h ASP 282 Ca 0.00 0.03 -0.04 0.00 -0.62 0.00 0.00 57.03 56.40 3h0g h ASP 282 Cb 0.00 -0.06 -0.03 0.00 0.18 0.00 0.00 39.33 39.42 3h0g h ASP 282 CO 0.00 0.22 0.26 0.40 -3.12 0.00 0.00 179.24 177.00 3h0g h ILE 283 N 0.47 1.25 0.00 0.35 2.04 -1.67 -2.32 117.51 117.62 3h0g h ILE 283 Ca 0.40 -0.79 -0.05 0.00 1.00 0.00 0.00 64.86 65.43 3h0g h ILE 283 Cb 0.87 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 3h0g h ILE 283 CO -0.14 0.31 -0.22 -0.07 0.00 0.00 0.00 178.15 178.03 3h0g h LEU 284 N 0.98 0.00 -1.70 1.44 -0.00 -1.43 -2.76 115.31 111.85 3h0g h LEU 284 Ca 0.23 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 58.09 3h0g h LEU 284 Cb 0.23 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.88 3h0g h LEU 284 CO -0.02 0.22 -0.02 -0.33 -0.00 0.00 0.00 178.44 178.29 3h0g h GLU 285 N 0.00 0.16 0.00 1.13 5.08 -0.90 -0.50 114.58 119.54 3h0g h GLU 285 Ca -0.00 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.21 3h0g h GLU 285 Cb 0.60 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 3h0g h GLU 285 CO 0.03 0.20 -0.62 0.45 -1.00 0.00 0.00 179.01 178.06 3h0g h HIS 286 N 0.16 0.00 0.00 4.33 3.86 -1.52 -3.39 115.15 118.59 3h0g h HIS 286 Ca 0.04 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.25 3h0g h HIS 286 Cb 0.15 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.62 3h0g h HIS 286 CO 0.00 0.62 0.00 -0.89 0.86 0.00 0.00 177.93 178.52 3h0g n ILE 287 N -3.46 0.00 -3.46 2.45 5.41 -0.64 -4.03 119.36 115.63 3h0g n ILE 287 Ca 0.00 0.21 -0.19 0.00 1.00 0.00 0.00 62.75 63.77 3h0g n ILE 287 Cb 0.70 -0.78 0.03 0.00 -0.71 0.00 0.00 39.64 38.88 3h0g n ILE 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3h0g s TYR 289 N -2.08 -0.20 0.33 0.00 1.51 -1.26 -4.22 117.35 111.43 3h0g s TYR 289 Ca 0.36 -0.15 -0.27 0.00 -1.01 0.00 0.00 57.07 56.00 3h0g s TYR 289 Cb -0.03 -0.52 -0.09 0.00 -0.11 0.00 0.00 41.96 41.21 3h0g s TYR 289 CO 0.23 -0.75 1.02 0.34 -1.11 0.00 0.00 175.55 175.28 3h0g s ASP 290 N 2.28 7.15 0.09 2.29 3.68 -1.26 -3.19 116.67 127.71 3h0g s ASP 290 Ca 0.08 2.02 -0.26 0.00 2.13 0.00 0.00 52.55 56.52 3h0g s ASP 290 Cb -0.15 -2.60 -0.06 0.00 -1.45 0.00 0.00 42.92 38.66 3h0g s ASP 290 CO -0.24 -0.21 0.80 -2.84 0.13 0.00 0.00 175.17 172.81 3h0g s PRO 291 N -1.98 4.55 0.00 4.34 0.02 -1.26 -5.08 135.00 135.59 3h0g s PRO 291 Ca 0.51 1.16 0.00 0.00 0.02 0.00 0.00 61.00 62.68 3h0g s PRO 291 Cb -0.24 -3.34 0.00 0.00 0.02 0.00 0.00 34.50 30.94 3h0g s PRO 291 CO 0.30 0.35 0.00 -1.71 -0.33 0.00 0.00 177.00 175.61 3h0g n ASN 292 N 2.48 -1.04 0.00 2.53 5.15 -1.19 -5.09 115.26 118.10 3h0g n ASN 292 Ca -0.02 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.96 3h0g n ASN 292 Cb 0.50 -0.52 0.00 0.00 -0.53 0.00 0.00 39.78 39.23 3h0g n ASN 292 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 3h0g n ASP 293 N 0.00 -0.59 -0.25 1.20 9.92 -1.26 -5.03 116.55 120.54 3h0g n ASP 293 Ca 0.00 0.00 0.17 0.00 -0.53 0.00 0.00 54.79 54.43 3h0g n ASP 293 Cb 0.00 -0.12 0.46 0.00 -0.64 0.00 0.00 41.12 40.83 3h0g n ASP 293 CO 0.00 0.00 0.00 -0.26 0.13 0.00 0.00 177.20 177.07 3h0g h PHE 294 N 0.00 0.65 -0.50 1.24 0.04 -1.98 -2.70 116.94 113.69 3h0g h PHE 294 Ca 0.00 0.02 0.05 0.00 2.80 0.00 0.00 57.97 60.84 3h0g h PHE 294 Cb 0.06 -0.20 -0.07 0.00 2.20 0.00 0.00 35.95 37.94 3h0g h PHE 294 CO 0.00 0.19 -0.39 1.96 -0.60 0.00 0.00 178.31 179.47 3h0g h GLN 295 N 0.51 -0.11 -0.64 1.51 4.20 -1.99 3.57 115.11 122.16 3h0g h GLN 295 Ca 0.47 0.01 0.08 0.00 0.06 0.00 0.00 58.65 59.26 3h0g h GLN 295 Cb 1.01 0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.78 3h0g h GLN 295 CO -0.20 -0.07 0.42 0.52 -0.67 0.00 0.00 178.83 178.83 3h0g h MET 296 N -0.12 0.53 0.10 1.46 2.86 -1.86 -2.97 114.93 114.93 3h0g h MET 296 Ca 0.08 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.69 3h0g h MET 296 Cb 0.33 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.87 3h0g h MET 296 CO -0.53 0.35 -0.05 -0.07 1.06 0.00 0.00 176.91 177.67 3h0g h LEU 297 N 0.54 -0.12 -0.26 1.22 3.38 -0.41 -3.36 115.31 116.30 3h0g h LEU 297 Ca 0.29 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 58.02 3h0g h LEU 297 Cb 0.41 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 3h0g h LEU 297 CO -0.09 0.48 -0.13 -0.62 0.09 0.00 0.00 178.44 178.17 3h0g n GLU 298 N -4.84 -0.09 0.24 1.13 1.02 1.15 0.38 120.64 119.62 3h0g n GLU 298 Ca -0.05 0.40 0.00 0.00 -0.02 0.00 0.00 57.16 57.49 3h0g n GLU 298 Cb 0.19 -0.59 0.00 0.00 -0.02 0.00 0.00 31.44 31.01 3h0g n GLU 298 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 3h0g n MET 299 N -4.36 0.02 -0.07 3.49 2.81 -1.22 0.16 117.12 117.94 3h0g n MET 299 Ca 0.02 0.69 -0.14 0.00 -1.81 0.00 0.00 57.70 56.46 3h0g n MET 299 Cb 0.09 -2.36 -0.05 0.00 -0.71 0.00 0.00 33.22 30.18 3h0g n MET 299 CO 0.00 0.00 0.00 0.52 1.51 0.00 0.00 175.97 178.00 3h0g h MET 300 N 0.00 0.66 -0.21 0.03 2.86 0.66 -3.32 114.93 115.61 3h0g h MET 300 Ca 0.00 -0.40 0.02 0.00 -2.06 0.00 0.00 59.70 57.26 3h0g h MET 300 Cb 1.70 0.04 -0.03 0.00 0.06 0.00 0.00 31.60 33.38 3h0g h MET 300 CO 0.00 1.01 -0.12 1.63 1.06 0.00 0.00 176.91 180.49 3h0g n LYS 301 N -4.24 -0.09 0.23 1.72 5.02 0.42 0.38 118.16 121.60 3h0g n LYS 301 Ca -0.05 0.52 0.07 0.00 -2.02 0.00 0.00 58.31 56.83 3h0g n LYS 301 Cb 0.52 -0.77 0.61 0.00 -0.02 0.00 0.00 35.03 35.37 3h0g n LYS 301 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 3h0g h PRO 302 N 0.00 0.05 0.01 1.97 0.13 -1.76 -1.91 132.00 130.49 3h0g h PRO 302 Ca 0.03 -0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.16 3h0g h PRO 302 Cb 0.09 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.20 3h0g h PRO 302 CO -0.20 0.05 -0.00 0.00 -0.23 0.00 0.00 178.00 177.62 3h0g h ILE 304 N -0.42 1.06 -1.67 0.00 2.04 -0.23 -2.43 117.51 115.86 3h0g h ILE 304 Ca -0.00 -0.15 0.50 0.00 1.00 0.00 0.00 64.86 66.21 3h0g h ILE 304 Cb 0.41 1.01 -0.09 0.00 -0.74 0.00 0.00 36.82 37.41 3h0g h ILE 304 CO 0.00 0.05 1.17 -0.33 0.00 0.00 0.00 178.15 179.04 3h0g h GLU 305 N 0.07 0.02 0.00 2.37 5.08 -1.41 2.95 114.58 123.66 3h0g h GLU 305 Ca 0.03 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3h0g h GLU 305 Cb 0.04 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3h0g h GLU 305 CO -0.01 0.01 0.00 0.93 -1.00 0.00 0.00 179.01 178.95 3h0g h GLU 306 N 0.02 0.00 -0.33 2.33 5.08 -1.47 -2.11 114.58 118.10 3h0g h GLU 306 Ca 0.85 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.21 3h0g h GLU 306 Cb 3.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 32.46 3h0g h GLU 306 CO -0.14 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 177.87 3h0g n ALA 307 N -1.93 2.68 1.06 3.43 0.00 0.98 -4.58 120.51 122.15 3h0g n ALA 307 Ca 0.01 -1.76 0.00 0.00 0.00 0.00 0.00 53.44 51.68 3h0g n ALA 307 Cb 0.22 -0.63 0.00 0.00 0.00 0.00 0.00 19.45 19.05 3h0g n ALA 307 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3h0g n PHE 308 N 0.06 0.00 0.00 0.00 7.35 -0.79 -2.36 117.46 121.72 3h0g n PHE 308 Ca 0.18 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.87 3h0g n PHE 308 Cb 0.70 -0.01 0.00 0.00 0.35 0.00 0.00 39.48 40.52 3h0g n PHE 308 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 3h0g n VAL 309 N -0.35 0.00 0.00 -2.13 0.31 -1.26 -5.00 118.33 109.91 3h0g n VAL 309 Ca 0.00 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 3h0g n VAL 309 Cb 0.03 0.38 0.00 0.00 -0.91 0.00 0.00 33.84 33.35 3h0g n VAL 309 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3h0g n ILE 310 N -0.14 0.00 -0.22 2.52 5.41 -1.00 -4.79 119.36 121.14 3h0g n ILE 310 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 3h0g n ILE 310 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 3h0g n ILE 310 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 176.55 178.22 3h0g n GLN 311 N -0.05 -0.73 0.00 0.38 7.27 -1.26 -4.00 117.38 118.98 3h0g n GLN 311 Ca 0.00 -0.40 0.00 0.00 0.07 0.00 0.00 57.00 56.67 3h0g n GLN 311 Cb 0.00 -0.89 0.00 0.00 2.41 0.00 0.00 30.24 31.76 3h0g n GLN 311 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 3h0g n ASP 312 N -0.01 0.00 0.00 1.69 10.43 -1.26 -4.98 116.55 122.42 3h0g n ASP 312 Ca 0.00 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.36 3h0g n ASP 312 Cb 0.06 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.02 3h0g n ASP 312 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3h0g n LYS 313 N 0.00 2.29 0.03 -1.24 5.02 -1.26 -4.61 118.16 118.38 3h0g n LYS 313 Ca 0.00 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.28 3h0g n LYS 313 Cb 0.00 -0.94 -0.01 0.00 -0.02 0.00 0.00 35.03 34.07 3h0g n LYS 313 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 3h0g h ASP 314 N 0.00 -0.06 -0.48 4.39 3.32 -1.93 -3.13 116.42 118.54 3h0g h ASP 314 Ca 0.00 0.00 0.10 0.00 0.02 0.00 0.00 57.03 57.15 3h0g h ASP 314 Cb 0.49 0.02 -0.09 0.00 0.22 0.00 0.00 39.33 39.96 3h0g h ASP 314 CO 0.00 -0.03 -0.15 0.40 -1.72 0.00 0.00 179.24 177.74 3h0g h ILE 315 N -0.10 0.47 -0.58 0.35 2.04 -1.89 -1.83 117.51 115.98 3h0g h ILE 315 Ca -0.01 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.90 3h0g h ILE 315 Cb 0.06 0.47 -0.07 0.00 -0.74 0.00 0.00 36.82 36.54 3h0g h ILE 315 CO 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 178.15 177.82 3h0g n ALA 316 N -2.87 -0.37 0.28 1.87 0.00 -1.25 0.19 120.51 118.36 3h0g n ALA 316 Ca 0.04 0.49 0.14 0.00 0.00 0.00 0.00 53.44 54.11 3h0g n ALA 316 Cb 0.27 0.08 0.84 0.00 0.00 0.00 0.00 19.45 20.65 3h0g n ALA 316 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3h0g h LEU 317 N 0.00 0.00 0.85 0.00 4.07 -1.40 -3.01 115.31 115.82 3h0g h LEU 317 Ca 0.09 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 58.01 3h0g h LEU 317 Cb 0.24 0.00 0.01 0.00 1.08 0.00 0.00 40.66 41.99 3h0g h LEU 317 CO -0.54 0.05 -0.41 0.44 -1.08 0.00 0.00 178.44 176.90 3h0g h ASP 318 N 0.00 -0.97 0.00 -0.43 3.32 0.29 -3.24 116.42 115.39 3h0g h ASP 318 Ca -0.00 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.07 3h0g h ASP 318 Cb 0.14 0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.93 3h0g h ASP 318 CO 0.01 -0.62 0.65 0.00 -1.72 0.00 0.00 179.24 177.56 3h0g n TYR 319 N -5.48 0.04 -2.23 4.55 9.36 -0.15 -3.07 117.16 120.18 3h0g n TYR 319 Ca -0.14 -0.24 0.01 0.00 3.32 0.00 0.00 57.90 60.85 3h0g n TYR 319 Cb 0.45 -0.53 -0.00 0.00 -0.63 0.00 0.00 39.34 38.63 3h0g n TYR 319 CO 0.00 0.00 0.00 -0.89 0.22 0.00 0.00 176.86 176.19 3h0g n ILE 320 N 3.54 0.00 -3.39 2.97 5.41 -1.22 -5.04 119.36 121.62 3h0g n ILE 320 Ca 0.03 -0.46 -0.45 0.00 1.00 0.00 0.00 62.75 62.87 3h0g n ILE 320 Cb 0.04 0.68 -0.05 0.00 -0.71 0.00 0.00 39.64 39.60 3h0g n ILE 320 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 3h0g s GLY 321 N -1.36 2.32 0.00 7.39 0.00 -1.17 -4.86 107.32 109.63 3h0g s GLY 321 Ca 0.16 -2.87 0.00 0.00 0.00 0.00 0.00 44.72 42.00 3h0g s GLY 321 CO -0.08 1.20 0.00 0.58 0.00 0.00 0.00 173.10 174.80 3h0g n LYS 322 N 4.60 0.00 0.00 2.90 2.85 -1.26 -5.01 118.16 122.24 3h0g n LYS 322 Ca -0.01 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.25 3h0g n LYS 322 Cb 0.42 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.80 3h0g n LYS 322 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 3h0g n ARG 323 N 0.00 0.00 0.00 -1.58 1.74 -1.26 -4.14 116.66 111.42 3h0g n ARG 323 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3h0g n ARG 323 Cb 0.00 -0.23 0.00 0.00 -1.02 0.00 0.00 32.46 31.21 3h0g n ARG 323 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h0g n GLY 324 N 0.57 3.31 1.47 -0.13 0.00 -1.26 -4.57 105.19 104.57 3h0g n GLY 324 Ca 0.00 -0.49 -0.04 0.00 0.00 0.00 0.00 46.02 45.49 3h0g n GLY 324 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3h0g n SER 325 N 0.00 3.53 0.00 1.61 7.64 -1.26 -4.80 113.62 120.34 3h0g n SER 325 Ca 0.00 -2.70 0.00 0.00 1.01 0.00 0.00 58.87 57.18 3h0g n SER 325 Cb 0.00 -0.64 0.00 0.00 -1.01 0.00 0.00 64.21 62.56 3h0g n SER 325 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 3h0g n THR 326 N -0.02 0.00 -0.91 0.44 -1.04 -1.26 -5.14 114.28 106.35 3h0g n THR 326 Ca 0.24 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.25 3h0g n THR 326 Cb 0.96 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.47 3h0g n THR 326 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 3h0g n THR 327 N 0.00 0.00 0.00 12.58 -2.24 -1.26 -5.15 114.28 118.21 3h0g n THR 327 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3h0g n THR 327 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 3h0g n THR 327 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h0g n GLY 328 N 0.00 -2.55 0.00 3.38 0.00 -1.26 -4.82 105.19 99.93 3h0g n GLY 328 Ca 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.93 3h0g n GLY 328 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3h0g n VAL 329 N -0.24 0.00 0.00 1.61 0.24 -1.26 -5.03 118.33 113.64 3h0g n VAL 329 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 3h0g n VAL 329 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 3h0g n VAL 329 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3h0g n THR 330 N 0.00 0.00 0.00 3.34 -2.24 -1.26 -4.69 114.28 109.43 3h0g n THR 330 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3h0g n THR 330 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 3h0g n THR 330 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3h0g n ARG 331 N 0.00 0.00 -0.07 -0.78 5.12 -1.26 0.52 116.66 120.19 3h0g n ARG 331 Ca 0.00 0.33 -0.13 0.00 -1.93 0.00 0.00 57.85 56.12 3h0g n ARG 331 Cb 0.00 -1.29 -0.09 0.00 -1.16 0.00 0.00 32.46 29.92 3h0g n ARG 331 CO 0.00 0.00 0.00 1.49 -1.93 0.00 0.00 177.63 177.19 3h0g h GLU 332 N 0.00 -0.42 -0.39 5.56 4.81 -1.99 0.21 114.58 122.35 3h0g h GLU 332 Ca 0.00 0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.33 3h0g h GLU 332 Cb 0.00 0.09 -0.06 0.00 0.63 0.00 0.00 28.75 29.41 3h0g h GLU 332 CO 0.00 -0.28 -0.00 0.87 -0.73 0.00 0.00 179.01 178.87 3h0g h LYS 333 N -0.43 0.10 -0.57 1.92 1.57 -1.84 -1.82 116.57 115.49 3h0g h LYS 333 Ca 0.05 -0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.92 3h0g h LYS 333 Cb 0.57 -0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.78 3h0g h LYS 333 CO -0.47 0.06 0.17 0.00 -0.57 0.00 0.00 179.45 178.65 3h0g h ARG 334 N 0.10 0.32 -0.59 3.15 3.08 0.95 -1.56 114.38 119.83 3h0g h ARG 334 Ca 0.19 -0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.28 3h0g h ARG 334 Cb 0.27 -0.07 -0.05 0.00 0.08 0.00 0.00 29.97 30.19 3h0g h ARG 334 CO -0.32 0.21 0.29 -0.07 -1.07 0.00 0.00 179.97 179.01 3h0g h LEU 335 N 0.33 0.40 -0.51 3.04 3.38 0.20 -1.58 115.31 120.57 3h0g h LEU 335 Ca 0.29 0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.33 3h0g h LEU 335 Cb 0.38 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 3h0g h LEU 335 CO -0.33 0.26 0.29 0.03 0.09 0.00 0.00 178.44 178.79 3h0g h ARG 336 N 0.55 0.56 -0.92 1.13 3.08 -0.74 -2.17 114.38 115.86 3h0g h ARG 336 Ca 0.27 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.28 3h0g h ARG 336 Cb 0.22 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.10 3h0g h ARG 336 CO -0.20 0.37 0.53 -0.92 -1.07 0.00 0.00 179.97 178.68 3h0g h TYR 337 N 0.58 1.22 -0.35 3.04 3.20 -0.79 -1.97 116.97 121.90 3h0g h TYR 337 Ca 0.21 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.08 3h0g h TYR 337 Cb 0.06 -0.40 -0.02 0.00 1.54 0.00 0.00 36.73 37.91 3h0g h TYR 337 CO -0.08 0.83 0.22 0.00 -1.64 0.00 0.00 178.16 177.49 3h0g h ALA 338 N 1.32 0.45 -0.82 1.82 0.00 -0.72 -1.35 119.26 119.94 3h0g h ALA 338 Ca 0.33 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 3h0g h ALA 338 Cb -0.02 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 3h0g h ALA 338 CO -0.06 -0.11 0.42 0.45 0.00 0.00 0.00 179.25 179.96 3h0g h HIS 339 N 0.46 1.16 -0.35 0.00 3.86 -1.09 -1.63 115.15 117.56 3h0g h HIS 339 Ca 0.13 -0.04 0.02 0.00 -1.16 0.00 0.00 60.37 59.32 3h0g h HIS 339 Cb -0.04 -0.36 -0.02 0.00 1.06 0.00 0.00 27.41 28.05 3h0g h HIS 339 CO -0.06 0.82 0.20 -0.44 0.86 0.00 0.00 177.93 179.31 3h0g h ASP 340 N 1.16 0.31 -0.38 2.45 3.32 -0.94 -2.55 116.42 119.79 3h0g h ASP 340 Ca 0.29 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.37 3h0g h ASP 340 Cb 0.08 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 3h0g h ASP 340 CO -0.04 0.23 0.19 0.40 -1.72 0.00 0.00 179.24 178.29 3h0g h ILE 341 N 0.40 0.97 0.00 0.35 2.04 -0.92 -0.27 117.51 120.08 3h0g h ILE 341 Ca 0.14 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.87 3h0g h ILE 341 Cb 0.01 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 3h0g h ILE 341 CO -0.07 0.07 0.00 0.18 0.00 0.00 0.00 178.15 178.33 3h0g n LEU 342 N -4.93 0.30 -3.00 1.44 4.77 -0.64 -0.31 117.00 114.62 3h0g n LEU 342 Ca 0.01 0.62 -0.25 0.00 -0.03 0.00 0.00 56.01 56.36 3h0g n LEU 342 Cb 0.10 -0.63 -0.04 0.00 -2.33 0.00 0.00 43.42 40.52 3h0g n LEU 342 CO 0.30 -0.63 0.06 0.00 -1.33 0.00 0.00 177.39 175.79 3h0g n GLN 343 N -1.88 2.72 0.00 3.23 6.02 -0.12 -4.58 117.38 122.78 3h0g n GLN 343 Ca 0.00 -4.52 0.00 0.00 -0.01 0.00 0.00 57.00 52.47 3h0g n GLN 343 Cb 0.07 -2.12 0.00 0.00 1.02 0.00 0.00 30.24 29.21 3h0g n GLN 343 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3h0g n LYS 344 N -0.13 0.00 -0.09 -1.09 5.02 -1.13 -4.92 118.16 115.82 3h0g n LYS 344 Ca 0.30 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.44 3h0g n LYS 344 Cb 0.45 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.41 3h0g n LYS 344 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3h0g n GLU 345 N 0.00 0.52 -1.77 1.97 -0.58 0.58 -4.05 120.64 117.30 3h0g n GLU 345 Ca 0.00 0.43 -0.32 0.00 -0.42 0.00 0.00 57.16 56.85 3h0g n GLU 345 Cb 0.00 -1.62 -0.04 0.00 -0.57 0.00 0.00 31.44 29.21 3h0g n GLU 345 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3h0g s LEU 346 N -7.95 3.26 -1.05 -4.62 2.01 0.20 -3.34 118.68 107.19 3h0g s LEU 346 Ca -0.25 0.47 -0.12 0.00 0.01 0.00 0.00 54.13 54.24 3h0g s LEU 346 Cb 0.06 -2.52 -0.03 0.00 0.01 0.00 0.00 46.19 43.70 3h0g s LEU 346 CO 0.40 -2.87 0.83 -0.11 1.01 0.00 0.00 176.35 175.62 3h0g n LEU 347 N 15.14 -4.37 -0.28 1.79 7.94 -1.26 -4.78 117.00 131.18 3h0g n LEU 347 Ca 0.34 -0.79 0.30 0.00 -1.11 0.00 0.00 56.01 54.74 3h0g n LEU 347 Cb 0.51 -2.80 0.67 0.00 0.53 0.00 0.00 43.42 42.34 3h0g n LEU 347 CO 0.67 0.15 1.28 1.55 -1.11 0.00 0.00 177.39 179.93 3h0g h PRO 348 N -1.26 0.12 0.00 1.96 0.13 -1.69 -3.40 132.00 127.85 3h0g h PRO 348 Ca -0.57 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.55 3h0g h PRO 348 Cb 1.30 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.41 3h0g h PRO 348 CO 0.44 0.08 0.00 -2.39 -0.23 0.00 0.00 178.00 175.90 3h0g n HIS 349 N -4.33 -0.82 0.00 1.56 1.44 -1.26 -4.47 115.22 107.34 3h0g n HIS 349 Ca 0.23 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.94 3h0g n HIS 349 Cb 1.05 0.00 0.00 0.00 0.12 0.00 0.00 29.99 31.16 3h0g n HIS 349 CO 0.00 0.00 0.00 -0.89 -2.81 0.00 0.00 176.34 172.64 3h0g n ILE 350 N -0.51 0.00 -3.69 0.61 5.41 -1.26 -4.68 119.36 115.23 3h0g n ILE 350 Ca 0.00 0.00 -0.14 0.00 1.00 0.00 0.00 62.75 63.61 3h0g n ILE 350 Cb 0.00 0.00 -0.09 0.00 -0.71 0.00 0.00 39.64 38.84 3h0g n ILE 350 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 3h0g s THR 351 N 0.00 0.00 -0.24 1.39 -1.32 -1.26 -5.03 115.64 109.18 3h0g s THR 351 Ca 0.00 -0.02 0.15 0.00 -1.21 0.00 0.00 61.69 60.61 3h0g s THR 351 Cb 0.00 -0.73 0.38 0.00 -1.51 0.00 0.00 72.50 70.64 3h0g s THR 351 CO 0.00 -0.01 1.27 0.35 -2.21 0.00 0.00 174.62 174.02 3h0g n THR 352 N 2.67 1.88 0.00 5.08 -2.24 -1.26 -4.88 114.28 115.53 3h0g n THR 352 Ca -0.14 -1.82 0.00 0.00 -2.27 0.00 0.00 64.05 59.82 3h0g n THR 352 Cb 0.56 -0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 3h0g n THR 352 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 3h0g n MET 353 N -0.68 0.40 0.08 -0.78 2.81 -1.26 -4.90 117.12 112.79 3h0g n MET 353 Ca 0.16 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.05 3h0g n MET 353 Cb 0.69 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.20 3h0g n MET 353 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 3h0g n GLU 354 N 0.00 0.00 -2.11 0.03 1.02 -1.26 -4.92 120.64 113.40 3h0g n GLU 354 Ca 0.00 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.73 3h0g n GLU 354 Cb 0.00 -0.22 -0.00 0.00 -0.02 0.00 0.00 31.44 31.20 3h0g n GLU 354 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3h0g n GLY 355 N 2.32 4.89 2.64 0.62 0.00 -1.26 -4.46 105.19 109.93 3h0g n GLY 355 Ca 0.00 -2.02 -0.10 0.00 0.00 0.00 0.00 46.02 43.90 3h0g n GLY 355 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3h0g n PHE 356 N 3.17 -2.17 0.93 1.61 3.01 -1.26 -4.93 117.46 117.82 3h0g n PHE 356 Ca 0.51 -2.38 0.10 0.00 1.01 0.00 0.00 57.45 56.69 3h0g n PHE 356 Cb 0.31 1.23 -0.09 0.00 -0.01 0.00 0.00 39.48 40.93 3h0g n PHE 356 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 3h0g n GLU 357 N 0.16 0.67 0.11 -1.08 -0.58 -1.26 -4.15 120.64 114.52 3h0g n GLU 357 Ca 0.07 -0.23 0.12 0.00 -0.42 0.00 0.00 57.16 56.71 3h0g n GLU 357 Cb 0.73 -1.43 0.19 0.00 -0.57 0.00 0.00 31.44 30.36 3h0g n GLU 357 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3h0g h THR 358 N 0.55 0.00 0.08 2.62 1.03 -1.91 -3.30 112.91 111.98 3h0g h THR 358 Ca 0.00 -0.69 -0.22 0.00 -0.01 0.00 0.00 66.41 65.49 3h0g h THR 358 Cb 0.53 1.44 0.02 0.00 -1.07 0.00 0.00 68.15 69.07 3h0g h THR 358 CO 0.00 0.00 -0.92 0.03 -0.01 0.00 0.00 175.52 174.62 3h0g h ARG 359 N 0.00 0.48 0.00 0.00 3.08 -1.96 -3.20 114.38 112.78 3h0g h ARG 359 Ca 0.00 -0.63 0.00 0.00 0.07 0.00 0.00 59.98 59.42 3h0g h ARG 359 Cb 0.85 0.20 0.00 0.00 0.08 0.00 0.00 29.97 31.10 3h0g h ARG 359 CO 0.00 1.26 0.00 1.63 -1.07 0.00 0.00 179.97 181.79 3h0g n LYS 360 N -4.02 0.74 0.05 0.04 5.02 -1.25 -3.27 118.16 115.49 3h0g n LYS 360 Ca -0.13 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.13 3h0g n LYS 360 Cb 0.84 -1.41 -0.08 0.00 -0.02 0.00 0.00 35.03 34.36 3h0g n LYS 360 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h0g h ALA 361 N 3.30 0.59 0.06 7.82 0.00 -1.63 -3.34 119.26 126.07 3h0g h ALA 361 Ca 0.00 -0.91 -0.18 0.00 0.00 0.00 0.00 54.91 53.82 3h0g h ALA 361 Cb 0.00 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3h0g h ALA 361 CO 0.00 1.10 -0.92 0.74 0.00 0.00 0.00 179.25 180.17 3h0g h PHE 362 N 0.00 0.24 -0.66 0.00 -1.00 -1.72 -3.34 116.94 110.46 3h0g h PHE 362 Ca -0.11 -0.18 0.11 0.00 2.81 0.00 0.00 57.97 60.61 3h0g h PHE 362 Cb 1.69 -0.01 -0.12 0.00 3.61 0.00 0.00 35.95 41.12 3h0g h PHE 362 CO 0.00 1.36 -0.33 0.74 -1.61 0.00 0.00 178.31 178.47 3h0g h PHE 363 N -0.65 -0.90 -0.77 -0.55 -1.00 -1.71 1.31 116.94 112.67 3h0g h PHE 363 Ca -0.21 0.08 0.16 0.00 2.81 0.00 0.00 57.97 60.81 3h0g h PHE 363 Cb 1.44 0.49 -0.10 0.00 3.61 0.00 0.00 35.95 41.39 3h0g h PHE 363 CO 0.17 -0.38 0.28 -0.07 -1.61 0.00 0.00 178.31 176.70 3h0g h LEU 364 N -0.13 0.21 -1.32 1.54 3.38 -1.75 0.98 115.31 118.21 3h0g h LEU 364 Ca 0.26 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.35 3h0g h LEU 364 Cb 0.56 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 3h0g h LEU 364 CO -0.73 0.05 0.34 1.23 0.09 0.00 0.00 178.44 179.42 3h0g h GLY 365 N 0.39 0.85 0.45 0.83 0.00 0.13 -0.70 103.07 105.02 3h0g h GLY 365 Ca 0.44 -0.35 -0.00 0.00 0.00 0.00 0.00 47.33 47.41 3h0g h GLY 365 CO -0.45 0.34 -0.03 -1.82 0.00 0.00 0.00 176.54 174.58 3h0g h TYR 366 N 0.81 -0.07 0.00 5.60 3.20 0.39 -0.89 116.97 126.00 3h0g h TYR 366 Ca 0.21 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.08 3h0g h TYR 366 Cb -0.01 0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.29 3h0g h TYR 366 CO 0.00 0.44 0.00 -1.33 -1.64 0.00 0.00 178.16 175.64 3h0g n MET 367 N -4.87 0.00 0.05 1.82 2.81 0.30 -1.42 117.12 115.81 3h0g n MET 367 Ca -0.09 0.93 0.07 0.00 -1.81 0.00 0.00 57.70 56.80 3h0g n MET 367 Cb 0.27 -1.49 0.31 0.00 -0.71 0.00 0.00 33.22 31.60 3h0g n MET 367 CO 0.00 0.00 0.00 0.44 1.51 0.00 0.00 175.97 177.92 3h0g n ILE 368 N -2.85 1.23 -0.15 2.02 -5.35 -0.28 -0.19 119.36 113.78 3h0g n ILE 368 Ca 0.00 0.39 -0.10 0.00 -0.27 0.00 0.00 62.75 62.76 3h0g n ILE 368 Cb 0.00 -1.28 -0.01 0.00 -1.74 0.00 0.00 39.64 36.61 3h0g n ILE 368 CO 0.00 0.00 0.00 -0.74 -1.76 0.00 0.00 176.55 174.05 3h0g h HIS 369 N 0.00 0.85 0.51 4.28 2.76 0.04 -2.88 115.15 120.71 3h0g h HIS 369 Ca 0.00 -0.15 -0.03 0.00 -2.20 0.00 0.00 60.37 57.99 3h0g h HIS 369 Cb 0.17 -0.22 0.01 0.00 1.55 0.00 0.00 27.41 28.92 3h0g h HIS 369 CO 0.00 0.84 -0.25 0.00 -1.30 0.00 0.00 177.93 177.22 3h0g h ARG 370 N 0.61 -0.66 -0.51 5.26 2.47 -0.21 -3.11 114.38 118.23 3h0g h ARG 370 Ca 0.12 0.05 0.05 0.00 -1.26 0.00 0.00 59.98 58.93 3h0g h ARG 370 Cb 0.51 0.15 -0.07 0.00 -1.65 0.00 0.00 29.97 28.91 3h0g h ARG 370 CO 0.02 -0.41 -0.35 0.52 0.56 0.00 0.00 179.97 180.31 3h0g h MET 371 N -0.75 -0.05 -1.42 0.04 2.86 -1.53 0.17 114.93 114.24 3h0g h MET 371 Ca -0.07 0.00 0.42 0.00 -2.06 0.00 0.00 59.70 57.99 3h0g h MET 371 Cb 0.56 0.01 -0.07 0.00 0.06 0.00 0.00 31.60 32.15 3h0g h MET 371 CO 0.12 -0.04 1.00 -0.07 1.06 0.00 0.00 176.91 178.97 3h0g h LEU 372 N -0.06 0.09 -0.95 1.22 3.38 -1.45 0.76 115.31 118.29 3h0g h LEU 372 Ca 0.08 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3h0g h LEU 372 Cb 0.27 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.04 3h0g h LEU 372 CO -0.51 -0.02 0.00 -0.07 0.09 0.00 0.00 178.44 177.93 3h0g h LEU 373 N 0.06 0.00 0.00 1.67 3.38 -0.58 -2.82 115.31 117.02 3h0g h LEU 373 Ca 0.72 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 58.32 3h0g h LEU 373 Cb 2.66 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 43.36 3h0g h LEU 373 CO -0.11 0.00 -2.26 0.00 0.09 0.00 0.00 178.44 176.16 3h0g h ALA 375 N -0.50 0.65 0.00 0.00 0.00 -1.61 0.39 119.26 118.19 3h0g h ALA 375 Ca -0.54 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.33 3h0g h ALA 375 Cb 1.60 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.19 3h0g h ALA 375 CO -0.24 0.10 0.00 -0.11 0.00 0.00 0.00 179.25 179.00 3h0g n LEU 376 N -4.72 0.18 -2.47 0.00 0.00 -1.06 -4.87 117.00 104.05 3h0g n LEU 376 Ca 0.03 0.56 -0.09 0.00 0.00 0.00 0.00 56.01 56.51 3h0g n LEU 376 Cb 0.02 -0.55 0.04 0.00 0.00 0.00 0.00 43.42 42.94 3h0g n LEU 376 CO 0.35 -0.44 0.02 1.21 0.00 0.00 0.00 177.39 178.54 3h0g n GLU 377 N -1.71 -1.70 -0.00 1.96 2.13 0.14 -4.97 120.64 116.49 3h0g n GLU 377 Ca 0.02 0.49 0.05 0.00 0.66 0.00 0.00 57.16 58.38 3h0g n GLU 377 Cb 0.13 -4.04 -0.07 0.00 0.27 0.00 0.00 31.44 27.73 3h0g n GLU 377 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3h0g n ARG 378 N -2.53 2.86 0.00 5.31 1.74 0.53 -4.97 116.66 119.59 3h0g n ARG 378 Ca -0.06 -0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 3h0g n ARG 378 Cb 0.57 -1.05 0.00 0.00 -1.02 0.00 0.00 32.46 30.96 3h0g n ARG 378 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3h0g n ARG 379 N -1.38 0.00 -3.95 5.56 1.74 -0.71 -4.99 116.66 112.93 3h0g n ARG 379 Ca 0.01 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.96 3h0g n ARG 379 Cb 0.19 0.00 -0.14 0.00 -1.02 0.00 0.00 32.46 31.49 3h0g n ARG 379 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 3h0g s GLU 380 N 3.08 0.13 -0.10 5.56 2.02 -1.26 -4.88 118.70 123.25 3h0g s GLU 380 Ca 0.00 -0.05 -0.36 0.00 0.02 0.00 0.00 54.97 54.58 3h0g s GLU 380 Cb 0.00 -0.14 -0.14 0.00 0.10 0.00 0.00 34.13 33.96 3h0g s GLU 380 CO 0.00 0.02 1.75 -2.30 0.02 0.00 0.00 175.26 174.75 3h0g n PRO 381 N 3.10 1.74 -1.07 0.39 -0.02 -1.26 -4.89 135.00 132.99 3h0g n PRO 381 Ca -0.13 0.63 -0.37 0.00 -2.02 0.00 0.00 63.50 61.62 3h0g n PRO 381 Cb 0.59 -2.40 0.04 0.00 -0.02 0.00 0.00 33.50 31.71 3h0g n PRO 381 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3h0g n ASP 382 N 5.43 -4.83 -4.45 2.55 4.64 -1.26 -4.85 116.55 113.78 3h0g n ASP 382 Ca 0.23 0.35 -0.36 0.00 -1.38 0.00 0.00 54.79 53.62 3h0g n ASP 382 Cb 0.23 -0.84 -0.12 0.00 -1.04 0.00 0.00 41.12 39.34 3h0g n ASP 382 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 3h0g s ASP 383 N -1.10 5.14 0.00 1.67 2.15 -1.26 -4.40 116.67 118.88 3h0g s ASP 383 Ca 0.47 -0.20 0.30 0.00 0.43 0.00 0.00 52.55 53.56 3h0g s ASP 383 Cb -0.28 -1.92 1.56 0.00 -0.30 0.00 0.00 42.92 41.97 3h0g s ASP 383 CO 0.76 -0.02 2.05 -1.14 -0.17 0.00 0.00 175.17 176.65 3h0g n ARG 384 N 4.85 0.71 0.16 4.34 0.63 -1.26 -3.88 116.66 122.21 3h0g n ARG 384 Ca -0.16 -0.09 -0.14 0.00 -0.92 0.00 0.00 57.85 56.54 3h0g n ARG 384 Cb 0.51 -1.50 -0.07 0.00 0.45 0.00 0.00 32.46 31.86 3h0g n ARG 384 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 3h0g h ASP 385 N 0.22 -0.85 -1.09 6.15 5.19 -2.02 -3.38 116.42 120.64 3h0g h ASP 385 Ca 0.00 0.09 -0.70 0.00 -0.62 0.00 0.00 57.03 55.80 3h0g h ASP 385 Cb 0.22 0.31 0.09 0.00 0.18 0.00 0.00 39.33 40.13 3h0g h ASP 385 CO 0.00 -0.41 -0.33 1.41 -3.12 0.00 0.00 179.24 176.79 3h0g n HIS 386 N -5.41 -0.08 0.00 4.55 8.25 -1.25 -4.66 115.22 116.62 3h0g n HIS 386 Ca -0.08 0.97 0.00 0.00 -0.26 0.00 0.00 57.72 58.35 3h0g n HIS 386 Cb 0.32 -2.01 0.00 0.00 1.12 0.00 0.00 29.99 29.42 3h0g n HIS 386 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3h0g n PHE 387 N 0.43 0.00 -0.40 4.41 7.35 -1.26 -4.21 117.46 123.79 3h0g n PHE 387 Ca 0.18 0.00 0.37 0.00 -0.76 0.00 0.00 57.45 57.24 3h0g n PHE 387 Cb 0.21 0.00 0.73 0.00 0.35 0.00 0.00 39.48 40.77 3h0g n PHE 387 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 3h0g h GLY 388 N 0.00 0.25 0.01 7.13 0.00 -1.87 -0.30 103.07 108.29 3h0g h GLY 388 Ca 0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 47.33 47.23 3h0g h GLY 388 CO 0.00 -0.05 -2.05 0.28 0.00 0.00 0.00 176.54 174.72 3h0g n LYS 389 N -4.23 0.66 -3.04 4.80 5.02 -1.26 -4.01 118.16 116.10 3h0g n LYS 389 Ca 0.30 -0.16 -0.33 0.00 -2.02 0.00 0.00 58.31 56.09 3h0g n LYS 389 Cb 1.35 -1.52 -0.06 0.00 -0.02 0.00 0.00 35.03 34.77 3h0g n LYS 389 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3h0g s LYS 390 N -3.34 4.10 0.13 1.97 1.02 -0.12 -4.63 119.74 118.87 3h0g s LYS 390 Ca -0.08 0.82 0.07 0.00 0.02 0.00 0.00 55.97 56.80 3h0g s LYS 390 Cb 0.13 -2.41 -0.04 0.00 -0.52 0.00 0.00 37.83 34.99 3h0g s LYS 390 CO 0.89 0.13 -0.08 1.03 -0.92 0.00 0.00 175.35 176.41 3h0g s ARG 391 N -2.93 2.18 -0.26 1.68 0.52 -1.22 -4.58 118.95 114.34 3h0g s ARG 391 Ca 0.55 -1.08 -0.12 0.00 -0.52 0.00 0.00 55.73 54.56 3h0g s ARG 391 Cb -0.11 -2.29 -0.05 0.00 0.52 0.00 0.00 34.95 33.02 3h0g s ARG 391 CO 0.17 0.48 0.24 -0.51 0.02 0.00 0.00 175.30 175.70 3h0g s LEU 392 N -2.48 4.07 -0.87 2.53 1.43 -0.52 -4.41 118.68 118.42 3h0g s LEU 392 Ca 0.23 0.15 -0.19 0.00 -1.03 0.00 0.00 54.13 53.29 3h0g s LEU 392 Cb -0.10 -2.22 0.12 0.00 0.03 0.00 0.00 46.19 44.02 3h0g s LEU 392 CO 0.15 -0.04 1.07 -1.81 0.23 0.00 0.00 176.35 175.95 3h0g s ASP 393 N 1.43 6.54 0.17 2.29 1.11 -0.69 -4.19 116.67 123.34 3h0g s ASP 393 Ca 0.10 -1.88 0.00 0.00 0.18 0.00 0.00 52.55 50.95 3h0g s ASP 393 Cb -0.15 -2.39 0.00 0.00 1.07 0.00 0.00 42.92 41.45 3h0g s ASP 393 CO 0.08 -1.11 0.00 0.18 1.18 0.00 0.00 175.17 175.51 3h0g n LEU 394 N 6.63 0.00 0.00 1.23 4.77 -1.26 -3.53 117.00 124.84 3h0g n LEU 394 Ca 0.18 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.24 3h0g n LEU 394 Cb 0.48 0.00 0.41 0.00 -2.33 0.00 0.00 43.42 41.98 3h0g n LEU 394 CO 0.52 -0.53 0.71 0.00 -1.33 0.00 0.00 177.39 176.76 3h0g n ALA 395 N -3.00 1.91 -1.13 -1.18 0.00 -1.26 -3.38 120.51 112.48 3h0g n ALA 395 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.36 3h0g n ALA 395 Cb 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.20 3h0g n ALA 395 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h0g n GLY 396 N 0.02 1.58 0.12 0.00 0.00 -1.14 -3.41 105.19 102.36 3h0g n GLY 396 Ca 0.08 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.12 3h0g n GLY 396 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3h0g n PRO 397 N -0.05 0.03 0.02 1.61 -0.02 -1.26 0.14 135.00 135.48 3h0g n PRO 397 Ca 0.00 0.41 -0.21 0.00 -2.02 0.00 0.00 63.50 61.68 3h0g n PRO 397 Cb 0.00 -2.12 -0.14 0.00 -0.02 0.00 0.00 33.50 31.22 3h0g n PRO 397 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3h0g h LEU 398 N 0.00 0.41 -0.32 2.45 3.38 -1.74 -3.27 115.31 116.23 3h0g h LEU 398 Ca 0.00 -0.88 0.00 0.00 0.09 0.00 0.00 57.88 57.09 3h0g h LEU 398 Cb 1.04 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.65 3h0g h LEU 398 CO 0.00 1.54 0.00 0.18 0.09 0.00 0.00 178.44 180.25 3h0g n LEU 399 N -4.00 0.56 0.02 1.67 4.77 0.12 -3.53 117.00 116.62 3h0g n LEU 399 Ca -0.21 0.60 -0.06 0.00 -0.03 0.00 0.00 56.01 56.31 3h0g n LEU 399 Cb 0.87 -0.48 -0.04 0.00 -2.33 0.00 0.00 43.42 41.44 3h0g n LEU 399 CO 0.44 -0.35 0.19 0.00 -1.33 0.00 0.00 177.39 176.34 3h0g h ALA 400 N 2.45 -0.17 -0.75 -1.18 0.00 -1.59 -1.71 119.26 116.31 3h0g h ALA 400 Ca 0.00 -0.15 0.22 0.00 0.00 0.00 0.00 54.91 54.98 3h0g h ALA 400 Cb 0.48 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 3h0g h ALA 400 CO 0.00 -0.18 0.57 0.66 0.00 0.00 0.00 179.25 180.30 3h0g h SER 401 N -1.00 0.00 0.00 0.00 4.64 -1.61 -1.68 113.55 113.90 3h0g h SER 401 Ca -0.02 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.28 3h0g h SER 401 Cb 0.35 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.44 3h0g h SER 401 CO 0.03 0.00 -0.11 -0.07 -0.87 0.00 0.00 176.83 175.80 3h0g h LEU 402 N 0.00 0.00 -1.17 5.97 3.38 -1.62 -2.79 115.31 119.07 3h0g h LEU 402 Ca 0.36 -0.76 0.25 0.00 0.09 0.00 0.00 57.88 57.82 3h0g h LEU 402 Cb 1.49 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 42.13 3h0g h LEU 402 CO -0.00 0.94 0.63 0.15 0.09 0.00 0.00 178.44 180.25 3h0g h PHE 403 N -1.00 0.85 0.00 1.13 3.57 -0.45 0.54 116.94 121.59 3h0g h PHE 403 Ca -0.03 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.41 3h0g h PHE 403 Cb 0.83 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.31 3h0g h PHE 403 CO 0.20 0.07 -0.46 0.07 -2.23 0.00 0.00 178.31 175.96 3h0g h ARG 404 N 0.50 0.00 -0.95 1.11 0.11 -1.46 -3.20 114.38 110.50 3h0g h ARG 404 Ca 0.62 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.70 3h0g h ARG 404 Cb 1.35 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.43 3h0g h ARG 404 CO -0.39 0.43 0.01 -1.33 0.10 0.00 0.00 179.97 178.78 3h0g n MET 405 N -3.20 1.45 0.00 0.08 2.81 0.19 -3.55 117.12 114.90 3h0g n MET 405 Ca 0.02 -0.38 0.00 0.00 -1.81 0.00 0.00 57.70 55.53 3h0g n MET 405 Cb 0.71 -1.55 0.00 0.00 -0.71 0.00 0.00 33.22 31.66 3h0g n MET 405 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3h0g n LEU 406 N 0.10 0.00 -0.02 4.03 4.77 -1.16 -4.86 117.00 119.85 3h0g n LEU 406 Ca 0.04 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.86 3h0g n LEU 406 Cb 0.39 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.36 3h0g n LEU 406 CO 0.04 0.00 0.36 0.15 -1.33 0.00 0.00 177.39 176.61 3h0g h PHE 407 N 0.00 0.25 -1.25 -1.77 3.57 -1.60 -3.25 116.94 112.88 3h0g h PHE 407 Ca 0.00 -0.14 0.36 0.00 3.53 0.00 0.00 57.97 61.72 3h0g h PHE 407 Cb 0.01 -0.02 -0.06 0.00 2.79 0.00 0.00 35.95 38.67 3h0g h PHE 407 CO 0.00 0.98 0.89 0.00 -2.23 0.00 0.00 178.31 177.95 3h0g h ARG 408 N -0.55 0.04 -0.00 1.11 3.08 -1.88 1.03 114.38 117.20 3h0g h ARG 408 Ca -0.04 -0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.87 3h0g h ARG 408 Cb 1.06 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.08 3h0g h ARG 408 CO 0.05 0.02 -0.67 0.87 -1.07 0.00 0.00 179.97 179.17 3h0g h LYS 409 N 0.04 0.01 -0.24 0.04 1.57 -1.88 -3.20 116.57 112.90 3h0g h LYS 409 Ca 0.61 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.37 3h0g h LYS 409 Cb 2.35 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.65 3h0g h LYS 409 CO -0.04 0.68 0.10 0.52 -0.57 0.00 0.00 179.45 180.13 3h0g h MET 410 N 0.00 0.36 0.00 3.15 2.86 0.10 -0.09 114.93 121.32 3h0g h MET 410 Ca -0.01 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.57 3h0g h MET 410 Cb 1.19 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.79 3h0g h MET 410 CO 0.09 0.40 -0.01 1.79 1.06 0.00 0.00 176.91 180.23 3h0g h THR 411 N 0.24 0.06 0.02 2.22 1.35 -1.55 -1.05 112.91 114.21 3h0g h THR 411 Ca 0.08 -0.21 -0.14 0.00 -0.55 0.00 0.00 66.41 65.59 3h0g h THR 411 Cb 0.17 1.20 -0.01 0.00 -1.73 0.00 0.00 68.15 67.77 3h0g h THR 411 CO -0.01 0.01 -0.75 0.03 -0.25 0.00 0.00 175.52 174.55 3h0g h ARG 412 N 0.00 0.04 -0.83 4.72 3.08 -1.40 -2.40 114.38 117.59 3h0g h ARG 412 Ca -0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.99 3h0g h ARG 412 Cb 0.19 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.23 3h0g h ARG 412 CO 0.00 1.03 0.54 -0.44 -1.07 0.00 0.00 179.97 180.03 3h0g h ASP 413 N -0.89 0.96 -0.18 7.04 3.32 -0.79 -1.99 116.42 123.89 3h0g h ASP 413 Ca -0.19 -0.04 -0.21 0.00 0.02 0.00 0.00 57.03 56.61 3h0g h ASP 413 Cb 1.25 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 40.56 3h0g h ASP 413 CO -0.08 0.71 -0.69 0.58 -1.72 0.00 0.00 179.24 178.04 3h0g h VAL 414 N 1.13 1.28 -0.93 -1.35 2.07 -1.35 -3.04 116.25 114.06 3h0g h VAL 414 Ca 0.30 -1.88 0.10 0.00 0.82 0.00 0.00 66.70 66.04 3h0g h VAL 414 Cb -0.11 1.85 -0.07 0.00 -1.52 0.00 0.00 31.29 31.44 3h0g h VAL 414 CO -0.06 0.60 0.60 0.22 0.02 0.00 0.00 177.57 178.95 3h0g h TYR 415 N 0.58 1.02 -0.18 1.57 3.20 -1.06 -0.37 116.97 121.73 3h0g h TYR 415 Ca -0.03 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.76 3h0g h TYR 415 Cb 1.31 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 39.24 3h0g h TYR 415 CO 0.08 0.46 -0.38 0.87 -1.64 0.00 0.00 178.16 177.55 3h0g h LYS 416 N 0.94 0.39 -0.59 1.82 1.57 -1.33 -2.93 116.57 116.42 3h0g h LYS 416 Ca 0.43 -0.18 -0.05 0.00 -1.87 0.00 0.00 60.65 58.98 3h0g h LYS 416 Cb 0.40 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.68 3h0g h LYS 416 CO -0.19 0.71 0.18 -0.92 -0.57 0.00 0.00 179.45 178.66 3h0g h TYR 417 N 0.33 0.92 -0.76 -1.35 3.20 -0.96 -2.64 116.97 115.71 3h0g h TYR 417 Ca 0.03 -0.08 -0.02 0.00 3.14 0.00 0.00 58.73 61.81 3h0g h TYR 417 Cb 0.82 -0.27 -0.04 0.00 1.54 0.00 0.00 36.73 38.78 3h0g h TYR 417 CO 0.02 0.74 0.40 0.52 -1.64 0.00 0.00 178.16 178.20 3h0g h MET 418 N 0.87 1.07 -0.72 1.82 2.86 -1.23 -0.91 114.93 118.69 3h0g h MET 418 Ca 0.20 -0.14 0.01 0.00 -2.06 0.00 0.00 59.70 57.71 3h0g h MET 418 Cb 0.26 -0.20 -0.04 0.00 0.06 0.00 0.00 31.60 31.68 3h0g h MET 418 CO -0.01 0.80 0.47 1.96 1.06 0.00 0.00 176.91 181.20 3h0g h GLN 419 N 1.05 0.93 0.00 1.72 4.20 -1.43 0.19 115.11 121.77 3h0g h GLN 419 Ca 0.26 -0.06 -0.10 0.00 0.06 0.00 0.00 58.65 58.82 3h0g h GLN 419 Cb 0.06 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.62 3h0g h GLN 419 CO -0.04 0.61 -0.48 0.87 -0.67 0.00 0.00 178.83 179.12 3h0g h LYS 420 N 0.95 0.00 0.06 1.46 1.57 -1.23 -2.81 116.57 116.56 3h0g h LYS 420 Ca 0.27 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.05 3h0g h LYS 420 Cb -0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.23 3h0g h LYS 420 CO -0.07 0.48 -0.03 0.00 -0.57 0.00 0.00 179.45 179.26 3h0g h VAL 422 N -0.82 0.41 -3.58 0.00 2.07 -0.69 5.22 116.25 118.85 3h0g h VAL 422 Ca -0.01 0.00 -0.64 0.00 0.82 0.00 0.00 66.70 66.87 3h0g h VAL 422 Cb 0.64 0.85 -0.21 0.00 -1.52 0.00 0.00 31.29 31.05 3h0g h VAL 422 CO 0.01 0.00 -0.61 -0.70 0.02 0.00 0.00 177.57 176.29 3h0g s GLU 423 N -4.57 3.73 0.00 1.57 2.12 -1.06 -4.57 118.70 115.92 3h0g s GLU 423 Ca -0.05 -0.44 0.00 0.00 0.36 0.00 0.00 54.97 54.84 3h0g s GLU 423 Cb 0.15 -3.31 0.00 0.00 0.26 0.00 0.00 34.13 31.23 3h0g s GLU 423 CO 0.52 -0.08 0.00 0.25 -0.54 0.00 0.00 175.26 175.41 3h0g n THR 424 N 4.61 0.00 0.00 -1.70 -2.24 -1.26 -4.71 114.28 108.98 3h0g n THR 424 Ca -0.16 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 3h0g n THR 424 Cb 0.52 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 3h0g n THR 424 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3h0g n ASN 425 N 1.23 0.00 0.00 3.42 3.02 -0.88 -5.06 115.26 116.99 3h0g n ASN 425 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 3h0g n ASN 425 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 3h0g n ASN 425 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3h0g n ARG 426 N 0.00 0.00 0.00 3.52 1.74 1.70 -4.83 116.66 118.78 3h0g n ARG 426 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3h0g n ARG 426 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 3h0g n ARG 426 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3h0g n GLU 427 N 0.00 0.00 0.00 5.56 1.02 -1.26 -4.32 120.64 121.64 3h0g n GLU 427 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3h0g n GLU 427 Cb 0.00 -0.96 0.00 0.00 -0.02 0.00 0.00 31.44 30.46 3h0g n GLU 427 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3h0g n PHE 428 N 0.00 0.00 -0.00 -0.32 3.01 -1.26 -5.08 117.46 113.81 3h0g n PHE 428 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 3h0g n PHE 428 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 3h0g n PHE 428 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 3h0g n ASN 429 N 0.00 3.98 0.00 4.37 3.02 -1.26 -4.97 115.26 120.40 3h0g n ASN 429 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 3h0g n ASN 429 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 3h0g n ASN 429 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3h0g n LEU 430 N 0.00 0.00 -1.06 3.41 4.77 -1.26 -4.71 117.00 118.14 3h0g n LEU 430 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3h0g n LEU 430 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3h0g n LEU 430 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.39 176.41 3h0g n THR 431 N -0.64 0.00 0.15 -5.08 -2.24 -1.26 -3.44 114.28 101.77 3h0g n THR 431 Ca 0.00 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.80 3h0g n THR 431 Cb 0.00 -0.52 0.19 0.00 -2.10 0.00 0.00 70.33 67.90 3h0g n THR 431 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3h0g h LEU 432 N 2.10 0.00 0.00 3.22 3.38 -2.04 -3.44 115.31 118.53 3h0g h LEU 432 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3h0g h LEU 432 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3h0g h LEU 432 CO 0.00 0.54 0.00 0.00 0.09 0.00 0.00 178.44 179.07 3h0g n ALA 433 N -2.34 0.00 -3.52 1.53 0.00 -1.22 -4.96 120.51 110.00 3h0g n ALA 433 Ca -0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.23 3h0g n ALA 433 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 3h0g n ALA 433 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3h0g n VAL 434 N 0.00 -2.12 -1.50 0.00 0.31 -1.26 -4.67 118.33 109.10 3h0g n VAL 434 Ca 0.00 -0.09 -0.52 0.00 -0.01 0.00 0.00 64.34 63.72 3h0g n VAL 434 Cb 0.00 -1.87 -0.05 0.00 -0.91 0.00 0.00 33.84 31.01 3h0g n VAL 434 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 3h0g n LYS 435 N -2.35 0.39 0.01 5.55 4.81 -1.26 -4.90 118.16 120.41 3h0g n LYS 435 Ca -0.20 0.14 -0.18 0.00 -0.87 0.00 0.00 58.31 57.21 3h0g n LYS 435 Cb 0.46 -1.48 -0.13 0.00 0.02 0.00 0.00 35.03 33.90 3h0g n LYS 435 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 3h0g h SER 436 N 2.49 0.36 -0.63 3.14 0.87 -1.92 -3.39 113.55 114.45 3h0g h SER 436 Ca -0.41 -0.89 -0.73 0.00 -1.23 0.00 0.00 61.79 58.53 3h0g h SER 436 Cb 1.40 -0.11 -0.08 0.00 -0.44 0.00 0.00 62.40 63.17 3h0g h SER 436 CO 0.64 1.21 2.73 -3.20 -0.53 0.00 0.00 176.83 177.68 3h0g n ASN 437 N -4.30 5.31 0.00 6.23 2.85 -1.26 -4.12 115.26 119.97 3h0g n ASN 437 Ca -0.12 -2.94 0.00 0.00 -0.11 0.00 0.00 54.58 51.41 3h0g n ASN 437 Cb 0.67 -1.55 0.00 0.00 1.24 0.00 0.00 39.78 40.14 3h0g n ASN 437 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 3h0g n ILE 438 N 3.92 0.00 0.00 -1.44 -0.00 -1.26 -4.79 119.36 115.78 3h0g n ILE 438 Ca 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 63.26 3h0g n ILE 438 Cb 0.35 -0.72 0.00 0.00 -0.00 0.00 0.00 39.64 39.26 3h0g n ILE 438 CO 0.00 0.00 0.00 2.30 -0.00 0.00 0.00 176.55 178.85 3h0g n ILE 439 N -2.12 0.00 0.31 7.28 -5.35 -1.26 -4.29 119.36 113.93 3h0g n ILE 439 Ca 0.00 0.00 -0.16 0.00 -0.27 0.00 0.00 62.75 62.32 3h0g n ILE 439 Cb 0.46 0.00 -0.08 0.00 -1.74 0.00 0.00 39.64 38.28 3h0g n ILE 439 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3h0g h THR 440 N 0.00 0.00 0.00 7.28 1.03 -1.77 0.18 112.91 119.63 3h0g h THR 440 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 66.41 66.36 3h0g h THR 440 Cb 0.00 0.00 -0.01 0.00 -1.07 0.00 0.00 68.15 67.07 3h0g h THR 440 CO 0.00 0.00 -0.20 0.78 -0.01 0.00 0.00 175.52 176.09 3h0g h ASN 441 N -0.94 0.00 0.00 0.00 4.21 -1.86 -3.21 115.58 113.78 3h0g h ASN 441 Ca -0.07 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.44 3h0g h ASN 441 Cb 0.77 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.97 3h0g h ASN 441 CO 0.03 0.20 0.00 0.61 -1.29 0.00 0.00 177.43 176.98 3h0g n GLY 442 N 0.09 -1.00 0.00 2.83 0.00 -0.66 -3.27 105.19 103.19 3h0g n GLY 442 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 3h0g n GLY 442 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h0g n LEU 443 N -0.54 1.49 -0.11 0.99 4.77 0.54 -4.55 117.00 119.59 3h0g n LEU 443 Ca 0.02 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.91 3h0g n LEU 443 Cb 0.01 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.07 3h0g n LEU 443 CO 0.02 0.25 0.61 0.03 -1.33 0.00 0.00 177.39 176.96 3h0g h ARG 444 N 0.00 -0.30 -0.73 3.23 3.08 -1.55 0.20 114.38 118.30 3h0g h ARG 444 Ca 0.00 0.02 -0.10 0.00 0.07 0.00 0.00 59.98 59.97 3h0g h ARG 444 Cb 0.90 0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.95 3h0g h ARG 444 CO 0.00 -0.20 0.13 0.66 -1.07 0.00 0.00 179.97 179.49 3h0g n TYR 445 N -5.42 1.97 -0.01 3.04 4.02 -1.22 -1.61 117.16 117.93 3h0g n TYR 445 Ca -0.00 -0.86 0.00 0.00 -0.01 0.00 0.00 57.90 57.03 3h0g n TYR 445 Cb 0.35 -0.54 -0.02 0.00 -0.02 0.00 0.00 39.34 39.11 3h0g n TYR 445 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 3h0g n SER 446 N 0.19 4.50 -0.06 7.72 3.41 -0.54 -4.40 113.62 124.44 3h0g n SER 446 Ca 0.30 0.00 -0.19 0.00 -0.26 0.00 0.00 58.87 58.72 3h0g n SER 446 Cb 1.16 0.84 -0.13 0.00 -0.26 0.00 0.00 64.21 65.82 3h0g n SER 446 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3h0g n LEU 447 N -1.81 2.55 0.26 1.04 0.00 0.61 -4.25 117.00 115.39 3h0g n LEU 447 Ca -0.02 0.06 0.08 0.00 0.00 0.00 0.00 56.01 56.13 3h0g n LEU 447 Cb 0.30 -0.87 0.64 0.00 0.00 0.00 0.00 43.42 43.48 3h0g n LEU 447 CO 0.04 0.85 1.05 0.00 0.00 0.00 0.00 177.39 179.33 3h0g h ALA 448 N 0.14 1.93 -0.15 1.96 0.00 -1.45 -3.43 119.26 118.25 3h0g h ALA 448 Ca -0.49 -0.02 -0.69 0.00 0.00 0.00 0.00 54.91 53.71 3h0g h ALA 448 Cb 1.99 -0.00 -0.13 0.00 0.00 0.00 0.00 17.79 19.64 3h0g h ALA 448 CO 0.01 0.03 -0.50 -0.08 0.00 0.00 0.00 179.25 178.71 3h0g s THR 449 N -4.98 1.03 -1.60 0.00 -1.32 -1.26 -4.98 115.64 102.52 3h0g s THR 449 Ca -0.05 -2.00 0.06 0.00 -1.21 0.00 0.00 61.69 58.50 3h0g s THR 449 Cb 0.17 -2.03 0.22 0.00 -1.51 0.00 0.00 72.50 69.35 3h0g s THR 449 CO 0.67 0.00 1.08 0.61 -2.21 0.00 0.00 174.62 174.77 3h0g n GLY 450 N -1.31 0.69 3.96 6.08 0.00 -1.26 -4.74 105.19 108.60 3h0g n GLY 450 Ca -0.21 -0.26 -0.22 0.00 0.00 0.00 0.00 46.02 45.32 3h0g n GLY 450 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3h0g s ASN 451 N -0.76 5.16 -0.42 1.61 0.01 -1.26 -1.15 114.94 118.13 3h0g s ASN 451 Ca 0.16 0.07 0.11 0.00 -0.71 0.00 0.00 52.86 52.49 3h0g s ASN 451 Cb 0.10 -0.89 0.36 0.00 0.41 0.00 0.00 41.25 41.22 3h0g s ASN 451 CO 0.09 -1.25 0.82 0.79 -1.51 0.00 0.00 177.10 176.04 3h0g n TRP 452 N -2.47 1.38 0.00 2.20 7.02 -1.26 -4.63 117.44 119.68 3h0g n TRP 452 Ca 0.08 -3.73 0.00 0.00 -1.02 0.00 0.00 57.50 52.84 3h0g n TRP 452 Cb 0.60 -0.42 0.00 0.00 -2.42 0.00 0.00 31.31 29.07 3h0g n TRP 452 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3h0g n GLY 453 N 0.08 0.01 3.95 6.99 0.00 -1.26 -5.02 105.19 109.94 3h0g n GLY 453 Ca 0.25 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.05 3h0g n GLY 453 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3h0g s ASP 454 N -0.02 6.04 -0.20 1.61 2.15 -1.26 -1.99 116.67 123.01 3h0g s ASP 454 Ca 0.00 0.28 0.02 0.00 0.43 0.00 0.00 52.55 53.27 3h0g s ASP 454 Cb 0.00 -1.69 0.29 0.00 -0.30 0.00 0.00 42.92 41.22 3h0g s ASP 454 CO 0.00 -0.49 1.41 0.00 -0.17 0.00 0.00 175.17 175.92 3h0g n GLN 455 N -1.89 1.55 0.00 4.34 10.64 -1.26 -4.71 117.38 126.05 3h0g n GLN 455 Ca -0.02 -1.31 0.00 0.00 -1.83 0.00 0.00 57.00 53.84 3h0g n GLN 455 Cb 0.57 -1.52 0.00 0.00 -0.86 0.00 0.00 30.24 28.44 3h0g n GLN 455 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 3h0g n LYS 456 N -0.20 -0.14 0.16 2.61 4.76 -0.84 -4.85 118.16 119.65 3h0g n LYS 456 Ca 0.26 0.00 0.01 0.00 -2.87 0.00 0.00 58.31 55.71 3h0g n LYS 456 Cb 1.00 0.00 0.24 0.00 -1.84 0.00 0.00 35.03 34.43 3h0g n LYS 456 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3h0g h ARG 457 N 0.00 0.00 -4.84 1.97 2.47 -1.99 -3.43 114.38 108.56 3h0g h ARG 457 Ca 0.00 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 58.59 3h0g h ARG 457 Cb 0.00 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.28 3h0g h ARG 457 CO 0.00 0.53 1.35 0.45 0.56 0.00 0.00 179.97 182.85 3h0g n SER 458 N -3.75 -1.75 0.00 7.04 2.88 -1.26 -4.73 113.62 112.05 3h0g n SER 458 Ca -0.01 -1.05 0.00 0.00 -1.33 0.00 0.00 58.87 56.48 3h0g n SER 458 Cb 0.57 -0.56 0.00 0.00 -0.75 0.00 0.00 64.21 63.47 3h0g n SER 458 CO 0.00 0.00 0.00 0.80 -1.23 0.00 0.00 175.04 174.61 3h0g n MET 459 N 4.72 0.00 -2.03 -1.46 1.56 -1.26 -4.53 117.12 114.12 3h0g n MET 459 Ca 0.25 0.00 -0.27 0.00 -0.27 0.00 0.00 57.70 57.41 3h0g n MET 459 Cb 0.35 -0.06 -0.07 0.00 2.15 0.00 0.00 33.22 35.59 3h0g n MET 459 CO 0.00 0.00 0.00 0.08 -0.73 0.00 0.00 175.97 175.32 3h0g s VAL 460 N 0.00 3.50 -0.62 1.12 1.01 -1.26 -4.76 120.40 119.39 3h0g s VAL 460 Ca 0.00 -0.84 0.05 0.00 0.00 0.00 0.00 61.98 61.19 3h0g s VAL 460 Cb 0.00 -4.51 0.32 0.00 0.00 0.00 0.00 36.38 32.19 3h0g s VAL 460 CO 0.00 -0.91 0.95 -3.20 0.00 0.00 0.00 175.10 171.94 3h0g n ASN 461 N 14.86 4.49 -1.46 3.32 2.85 -1.26 -5.05 115.26 133.02 3h0g n ASN 461 Ca 0.44 -3.64 0.00 0.00 -0.11 0.00 0.00 54.58 51.28 3h0g n ASN 461 Cb 0.47 -0.62 0.00 0.00 1.24 0.00 0.00 39.78 40.87 3h0g n ASN 461 CO 0.00 0.00 0.00 -2.11 -2.11 0.00 0.00 177.26 173.04 3h0g n ARG 462 N -0.00 0.00 -2.15 1.20 1.85 -1.26 -4.27 116.66 112.03 3h0g n ARG 462 Ca 0.31 0.00 -0.41 0.00 -1.00 0.00 0.00 57.85 56.76 3h0g n ARG 462 Cb 0.39 -0.47 -0.02 0.00 -1.05 0.00 0.00 32.46 31.31 3h0g n ARG 462 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3h0g s VAL 463 N 0.00 2.81 1.15 8.89 1.01 -1.25 -4.58 120.40 128.43 3h0g s VAL 463 Ca 0.00 0.80 -0.15 0.00 0.00 0.00 0.00 61.98 62.63 3h0g s VAL 463 Cb 0.00 -3.51 0.23 0.00 0.00 0.00 0.00 36.38 33.10 3h0g s VAL 463 CO 0.00 0.18 0.69 0.61 0.00 0.00 0.00 175.10 176.58 3h0g n GLY 464 N 1.02 -2.13 2.79 4.51 0.00 -0.30 -4.96 105.19 106.12 3h0g n GLY 464 Ca 0.01 -1.04 -0.00 0.00 0.00 0.00 0.00 46.02 44.99 3h0g n GLY 464 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3h0g n VAL 465 N -4.77 -8.67 0.00 1.61 0.31 -1.26 -4.83 118.33 100.72 3h0g n VAL 465 Ca 0.03 -0.18 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 3h0g n VAL 465 Cb 0.56 -6.37 0.00 0.00 -0.91 0.00 0.00 33.84 27.12 3h0g n VAL 465 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3h0g n SER 466 N -1.61 0.00 -2.32 4.52 3.41 -1.23 -4.67 113.62 111.72 3h0g n SER 466 Ca 0.00 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.36 3h0g n SER 466 Cb 0.50 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.43 3h0g n SER 466 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h0g n GLN 467 N 0.00 0.00 -0.87 4.33 6.02 -1.24 -3.76 117.38 121.86 3h0g n GLN 467 Ca 0.00 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.70 3h0g n GLN 467 Cb 0.00 -0.53 0.18 0.00 1.02 0.00 0.00 30.24 30.92 3h0g n GLN 467 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3h0g s VAL 468 N -0.59 2.29 0.09 5.09 -7.23 -1.26 -1.35 120.40 117.44 3h0g s VAL 468 Ca 0.33 0.09 -0.21 0.00 -1.81 0.00 0.00 61.98 60.39 3h0g s VAL 468 Cb -0.46 -2.33 -0.10 0.00 0.56 0.00 0.00 36.38 34.04 3h0g s VAL 468 CO 0.30 -0.12 1.65 0.25 -0.31 0.00 0.00 175.10 176.87 3h0g h LEU 469 N -2.00 0.20 -1.57 1.32 6.46 -1.90 -3.44 115.31 114.38 3h0g h LEU 469 Ca -0.52 -0.13 0.00 0.00 -0.12 0.00 0.00 57.88 57.10 3h0g h LEU 469 Cb 1.30 -0.05 0.00 0.00 -0.73 0.00 0.00 40.66 41.18 3h0g h LEU 469 CO 0.50 0.28 0.00 -3.20 -0.62 0.00 0.00 178.44 175.40 3h0g n ASN 470 N -4.89 -1.34 -2.47 1.25 5.15 -1.26 -4.87 115.26 106.83 3h0g n ASN 470 Ca -0.05 0.00 -0.26 0.00 -0.60 0.00 0.00 54.58 53.67 3h0g n ASN 470 Cb 0.10 -0.34 -0.06 0.00 -0.53 0.00 0.00 39.78 38.95 3h0g n ASN 470 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3h0g n ARG 471 N -0.78 2.38 0.19 1.20 1.74 -1.26 -3.97 116.66 116.16 3h0g n ARG 471 Ca 0.00 -2.29 -0.09 0.00 -0.77 0.00 0.00 57.85 54.70 3h0g n ARG 471 Cb 0.34 -2.13 -0.04 0.00 -1.02 0.00 0.00 32.46 29.60 3h0g n ARG 471 CO 0.00 0.00 0.00 1.88 -1.52 0.00 0.00 177.63 177.99 3h0g h TYR 472 N 2.99 -0.52 -4.27 -1.55 -1.99 -1.94 -3.45 116.97 106.23 3h0g h TYR 472 Ca 0.39 -0.01 -0.60 0.00 2.00 0.00 0.00 58.73 60.51 3h0g h TYR 472 Cb 0.75 0.17 -0.27 0.00 2.00 0.00 0.00 36.73 39.38 3h0g h TYR 472 CO 1.47 -0.32 -0.85 0.99 -0.00 0.00 0.00 178.16 179.45 3h0g s THR 473 N -3.37 1.68 0.18 -2.88 2.01 -1.26 -4.67 115.64 107.33 3h0g s THR 473 Ca -0.08 -1.10 -0.24 0.00 0.31 0.00 0.00 61.69 60.58 3h0g s THR 473 Cb 0.01 -1.44 0.07 0.00 0.01 0.00 0.00 72.50 71.15 3h0g s THR 473 CO 0.25 0.31 1.57 0.15 -0.69 0.00 0.00 174.62 176.20 3h0g h PHE 474 N 5.14 -1.22 -0.93 4.92 3.57 -1.78 0.74 116.94 127.38 3h0g h PHE 474 Ca -0.42 0.08 0.21 0.00 3.53 0.00 0.00 57.97 61.38 3h0g h PHE 474 Cb 1.15 0.62 -0.18 0.00 2.79 0.00 0.00 35.95 40.34 3h0g h PHE 474 CO 0.46 -0.41 -0.15 0.00 -2.23 0.00 0.00 178.31 175.98 3h0g n ALA 475 N -3.19 0.31 0.28 2.41 0.00 -1.26 -0.29 120.51 118.77 3h0g n ALA 475 Ca 0.03 1.02 -0.16 0.00 0.00 0.00 0.00 53.44 54.33 3h0g n ALA 475 Cb 0.35 -0.65 -0.08 0.00 0.00 0.00 0.00 19.45 19.07 3h0g n ALA 475 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3h0g h SER 476 N 0.00 -0.77 -0.77 0.00 0.87 0.16 -2.70 113.55 110.33 3h0g h SER 476 Ca 0.49 0.05 0.13 0.00 -1.23 0.00 0.00 61.79 61.23 3h0g h SER 476 Cb 0.84 0.23 -0.13 0.00 -0.44 0.00 0.00 62.40 62.90 3h0g h SER 476 CO -0.94 -0.48 -0.26 0.41 -0.53 0.00 0.00 176.83 175.03 3h0g n THR 477 N -5.44 -0.38 0.06 2.23 -1.04 0.60 0.54 114.28 110.85 3h0g n THR 477 Ca -0.11 1.79 -0.13 0.00 -2.04 0.00 0.00 64.05 63.56 3h0g n THR 477 Cb 0.34 -2.41 -0.08 0.00 -1.82 0.00 0.00 70.33 66.36 3h0g n THR 477 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3h0g h LEU 478 N 0.00 -0.10 -1.00 -4.42 3.38 -1.37 -2.11 115.31 109.69 3h0g h LEU 478 Ca 0.30 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3h0g h LEU 478 Cb 0.50 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3h0g h LEU 478 CO -0.78 0.12 0.00 -0.24 0.09 0.00 0.00 178.44 177.63 3h0g n SER 479 N -5.05 0.39 -0.05 -0.43 2.88 0.19 -1.28 113.62 110.27 3h0g n SER 479 Ca -0.08 0.68 -0.15 0.00 -1.33 0.00 0.00 58.87 57.99 3h0g n SER 479 Cb 0.15 -0.73 -0.13 0.00 -0.75 0.00 0.00 64.21 62.75 3h0g n SER 479 CO 0.00 0.00 0.00 -0.74 -1.23 0.00 0.00 175.04 173.07 3h0g h HIS 480 N 0.00 0.09 0.00 0.66 6.17 -0.42 -3.34 115.15 118.31 3h0g h HIS 480 Ca 0.00 -0.07 0.00 0.00 0.71 0.00 0.00 60.37 61.01 3h0g h HIS 480 Cb 0.01 -0.00 0.00 0.00 2.52 0.00 0.00 27.41 29.93 3h0g h HIS 480 CO 0.00 1.02 0.00 1.28 0.71 0.00 0.00 177.93 180.94 3h0g n LEU 481 N -4.54 0.30 -2.72 0.26 4.77 -0.41 -2.66 117.00 112.01 3h0g n LEU 481 Ca -0.10 -0.15 -0.04 0.00 -0.03 0.00 0.00 56.01 55.68 3h0g n LEU 481 Cb 0.52 -0.10 0.09 0.00 -2.33 0.00 0.00 43.42 41.60 3h0g n LEU 481 CO 0.36 0.06 0.32 0.54 -1.33 0.00 0.00 177.39 177.35 3h0g n ARG 482 N 0.52 1.38 -4.33 3.23 1.74 -1.24 -4.88 116.66 113.08 3h0g n ARG 482 Ca 0.00 -2.27 -0.25 0.00 -0.77 0.00 0.00 57.85 54.56 3h0g n ARG 482 Cb 0.06 -0.47 -0.09 0.00 -1.02 0.00 0.00 32.46 30.94 3h0g n ARG 482 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3h0g s ARG 483 N -1.38 2.00 -0.17 5.56 0.52 -1.09 -3.15 118.95 121.24 3h0g s ARG 483 Ca 0.20 -1.40 -0.08 0.00 -0.52 0.00 0.00 55.73 53.92 3h0g s ARG 483 Cb 0.41 -2.07 0.07 0.00 0.52 0.00 0.00 34.95 33.88 3h0g s ARG 483 CO -0.07 0.40 0.40 -0.08 0.02 0.00 0.00 175.30 175.97 3h0g s THR 484 N -1.96 -0.22 0.00 0.02 -1.32 -1.24 -1.29 115.64 109.63 3h0g s THR 484 Ca 0.27 0.13 0.00 0.00 -1.21 0.00 0.00 61.69 60.87 3h0g s THR 484 Cb -0.08 -0.61 0.00 0.00 -1.51 0.00 0.00 72.50 70.30 3h0g s THR 484 CO 0.16 0.05 0.00 0.59 -2.21 0.00 0.00 174.62 173.21 3h0g n ASN 485 N 4.63 0.00 0.00 8.08 5.03 -1.22 -3.88 115.26 127.91 3h0g n ASN 485 Ca -0.18 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.27 3h0g n ASN 485 Cb 0.53 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.29 3h0g n ASN 485 CO 0.00 0.00 0.00 1.07 -1.83 0.00 0.00 177.26 176.50 3h0g n THR 486 N 0.00 0.00 -1.50 3.41 5.66 -1.26 -4.28 114.28 116.31 3h0g n THR 486 Ca 0.00 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.59 3h0g n THR 486 Cb 0.00 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 68.67 3h0g n THR 486 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 3h0g n PRO 487 N 0.00 0.34 0.00 1.09 -0.02 -1.26 -3.81 135.00 131.35 3h0g n PRO 487 Ca 0.00 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 3h0g n PRO 487 Cb 0.00 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 3h0g n PRO 487 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3h0g n ILE 488 N 7.59 0.00 0.00 4.25 5.41 -1.26 -4.55 119.36 130.79 3h0g n ILE 488 Ca 0.56 0.00 0.00 0.00 1.00 0.00 0.00 62.75 64.31 3h0g n ILE 488 Cb 0.18 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.11 3h0g n ILE 488 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3h0g n GLY 489 N 1.87 0.29 3.34 7.39 0.00 -1.25 -4.86 105.19 111.96 3h0g n GLY 489 Ca 0.00 -1.55 -0.41 0.00 0.00 0.00 0.00 46.02 44.06 3h0g n GLY 489 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3h0g n ARG 490 N 0.00 2.86 -1.03 1.61 1.85 -1.26 -4.02 116.66 116.67 3h0g n ARG 490 Ca 0.00 -2.95 -0.02 0.00 -1.00 0.00 0.00 57.85 53.88 3h0g n ARG 490 Cb 0.00 -3.44 -0.01 0.00 -1.05 0.00 0.00 32.46 27.96 3h0g n ARG 490 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 3h0g n ASP 491 N 8.38 -0.42 0.00 2.89 5.75 -1.26 -5.11 116.55 126.77 3h0g n ASP 491 Ca 0.49 -0.95 0.00 0.00 -0.01 0.00 0.00 54.79 54.33 3h0g n ASP 491 Cb 0.44 0.15 0.00 0.00 -1.03 0.00 0.00 41.12 40.68 3h0g n ASP 491 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3h0g n GLY 492 N -0.16 1.36 2.69 6.12 0.00 -1.26 -4.88 105.19 109.06 3h0g n GLY 492 Ca -0.09 0.25 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 3h0g n GLY 492 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3h0g n LYS 493 N 0.00 3.23 -3.95 1.61 2.85 -1.26 -5.13 118.16 115.51 3h0g n LYS 493 Ca 0.00 -4.74 -0.35 0.00 -1.05 0.00 0.00 58.31 52.17 3h0g n LYS 493 Cb 0.00 -2.29 -0.14 0.00 -0.65 0.00 0.00 35.03 31.95 3h0g n LYS 493 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 177.40 176.18 3h0g s LEU 494 N -3.06 2.96 0.18 -5.58 2.96 -1.26 -5.04 118.68 109.83 3h0g s LEU 494 Ca 0.43 -0.64 0.00 0.00 -0.22 0.00 0.00 54.13 53.70 3h0g s LEU 494 Cb 0.20 -1.68 0.00 0.00 0.50 0.00 0.00 46.19 45.20 3h0g s LEU 494 CO -0.06 -0.07 0.00 0.00 -1.32 0.00 0.00 176.35 174.90 3h0g n ALA 495 N 4.73 -2.76 -2.38 5.97 0.00 -1.26 -4.95 120.51 119.85 3h0g n ALA 495 Ca -0.18 0.25 -0.01 0.00 0.00 0.00 0.00 53.44 53.50 3h0g n ALA 495 Cb 0.49 -0.88 -0.01 0.00 0.00 0.00 0.00 19.45 19.06 3h0g n ALA 495 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3h0g n LYS 496 N -2.57 -3.30 0.02 0.00 5.02 -1.26 -4.71 118.16 111.35 3h0g n LYS 496 Ca -0.01 2.44 -0.17 0.00 -2.02 0.00 0.00 58.31 58.55 3h0g n LYS 496 Cb 0.58 -3.24 -0.14 0.00 -0.02 0.00 0.00 35.03 32.20 3h0g n LYS 496 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 3h0g h PRO 497 N 4.28 0.20 0.00 1.97 0.13 -1.91 -3.49 132.00 133.19 3h0g h PRO 497 Ca -0.10 -0.35 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3h0g h PRO 497 Cb 0.22 0.13 0.00 0.00 0.13 0.00 0.00 31.00 31.48 3h0g h PRO 497 CO 0.00 1.01 0.00 0.54 -0.23 0.00 0.00 178.00 179.33 3h0g n ARG 498 N -3.37 0.00 -0.78 0.86 1.74 -1.26 -4.40 116.66 109.45 3h0g n ARG 498 Ca -0.24 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 56.59 3h0g n ARG 498 Cb 1.05 0.00 -0.00 0.00 -1.02 0.00 0.00 32.46 32.49 3h0g n ARG 498 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3h0g n GLN 499 N 0.00 0.00 -2.80 5.56 6.02 -1.26 -4.62 117.38 120.29 3h0g n GLN 499 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.57 3h0g n GLN 499 Cb 0.00 -0.60 -0.03 0.00 1.02 0.00 0.00 30.24 30.63 3h0g n GLN 499 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 3h0g s LEU 500 N 2.62 4.28 -0.13 1.08 1.98 -1.26 -4.94 118.68 122.30 3h0g s LEU 500 Ca 0.35 1.44 -0.06 0.00 -2.89 0.00 0.00 54.13 52.97 3h0g s LEU 500 Cb -0.38 -3.41 -0.04 0.00 0.66 0.00 0.00 46.19 43.01 3h0g s LEU 500 CO 0.38 -0.33 0.09 -2.28 -1.89 0.00 0.00 176.35 172.32 3h0g s HIS 501 N 1.55 3.41 0.34 5.38 5.65 -1.26 -4.98 115.29 125.37 3h0g s HIS 501 Ca 0.45 0.34 0.14 0.00 0.25 0.00 0.00 55.06 56.24 3h0g s HIS 501 Cb -0.19 -1.95 1.07 0.00 -1.18 0.00 0.00 32.58 30.33 3h0g s HIS 501 CO 0.20 0.51 1.64 -0.91 -0.65 0.00 0.00 174.74 175.53 3h0g h ASN 502 N 5.54 0.37 -1.57 9.88 4.21 -2.00 0.42 115.58 132.43 3h0g h ASN 502 Ca -0.49 0.21 0.46 0.00 1.21 0.00 0.00 56.30 57.69 3h0g h ASN 502 Cb 1.20 0.19 -0.07 0.00 -1.12 0.00 0.00 38.32 38.52 3h0g h ASN 502 CO 0.62 -0.20 1.12 0.74 -1.29 0.00 0.00 177.43 178.41 3h0g h THR 503 N 0.24 0.20 -0.07 2.81 2.02 -1.98 -1.98 112.91 114.14 3h0g h THR 503 Ca 0.73 -0.01 -0.11 0.00 0.77 0.00 0.00 66.41 67.79 3h0g h THR 503 Cb 1.69 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 68.27 3h0g h THR 503 CO -0.66 0.00 -0.46 0.45 0.37 0.00 0.00 175.52 175.23 3h0g h HIS 504 N 0.01 0.19 -1.45 3.16 3.86 -0.55 -3.45 115.15 116.92 3h0g h HIS 504 Ca 0.76 -0.06 -0.72 0.00 -1.16 0.00 0.00 60.37 59.20 3h0g h HIS 504 Cb 2.99 -0.04 0.05 0.00 1.06 0.00 0.00 27.41 31.47 3h0g h HIS 504 CO -0.00 0.59 0.32 1.87 0.86 0.00 0.00 177.93 181.57 3h0g n TRP 505 N -3.99 1.22 0.00 2.45 -0.00 -0.75 -0.57 117.44 115.80 3h0g n TRP 505 Ca -0.02 0.78 0.00 0.00 -0.00 0.00 0.00 57.50 58.26 3h0g n TRP 505 Cb 0.50 -2.25 0.00 0.00 -0.00 0.00 0.00 31.31 29.56 3h0g n TRP 505 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3h0g n GLY 506 N 2.17 2.02 0.06 5.87 0.00 -1.26 -4.59 105.19 109.47 3h0g n GLY 506 Ca 0.19 -0.67 0.11 0.00 0.00 0.00 0.00 46.02 45.65 3h0g n GLY 506 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 3h0g n MET 507 N 0.00 1.08 -1.66 1.61 0.00 -0.93 -4.69 117.12 112.54 3h0g n MET 507 Ca 0.00 -0.13 -0.63 0.00 0.00 0.00 0.00 57.70 56.95 3h0g n MET 507 Cb 0.00 -1.35 -0.09 0.00 0.00 0.00 0.00 33.22 31.79 3h0g n MET 507 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 3h0g n VAL 508 N -0.70 0.04 -2.76 3.17 0.31 0.26 -2.74 118.33 115.92 3h0g n VAL 508 Ca 0.16 -0.01 -0.13 0.00 -0.01 0.00 0.00 64.34 64.35 3h0g n VAL 508 Cb 0.11 -0.49 0.02 0.00 -0.91 0.00 0.00 33.84 32.57 3h0g n VAL 508 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h0g n PRO 510 N -2.70 0.00 -3.60 0.00 -0.05 -1.26 -4.82 135.00 122.56 3h0g n PRO 510 Ca -0.06 0.00 -0.29 0.00 -0.05 0.00 0.00 63.50 63.11 3h0g n PRO 510 Cb 0.56 -0.06 -0.12 0.00 -0.05 0.00 0.00 33.50 33.84 3h0g n PRO 510 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 3h0g s ALA 511 N -3.23 1.84 -0.42 0.55 0.00 -1.26 -5.01 121.76 114.22 3h0g s ALA 511 Ca 0.00 -2.48 0.08 0.00 0.00 0.00 0.00 51.96 49.56 3h0g s ALA 511 Cb 0.00 -1.78 0.33 0.00 0.00 0.00 0.00 23.12 21.66 3h0g s ALA 511 CO 0.00 -2.06 0.95 -1.91 0.00 0.00 0.00 175.76 172.73 3h0g n GLU 512 N 3.41 0.98 -4.19 0.00 2.13 -1.26 -3.89 120.64 117.83 3h0g n GLU 512 Ca 0.14 -2.51 -0.29 0.00 0.66 0.00 0.00 57.16 55.16 3h0g n GLU 512 Cb 0.38 -1.31 -0.03 0.00 0.27 0.00 0.00 31.44 30.75 3h0g n GLU 512 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 3h0g s THR 513 N -0.78 1.43 0.56 6.31 -4.23 -1.26 -4.63 115.64 113.03 3h0g s THR 513 Ca 0.30 -1.66 -0.18 0.00 -1.18 0.00 0.00 61.69 58.97 3h0g s THR 513 Cb 0.31 -2.09 -0.05 0.00 1.34 0.00 0.00 72.50 72.01 3h0g s THR 513 CO -0.07 0.00 1.07 -2.84 -0.54 0.00 0.00 174.62 172.24 3h0g s PRO 514 N -4.16 3.41 -0.42 3.99 0.02 -1.26 -4.69 135.00 131.88 3h0g s PRO 514 Ca 0.23 1.35 -0.28 0.00 0.02 0.00 0.00 61.00 62.32 3h0g s PRO 514 Cb -0.01 -2.04 -0.01 0.00 0.02 0.00 0.00 34.50 32.46 3h0g s PRO 514 CO 0.14 -0.76 1.74 -1.21 -0.33 0.00 0.00 177.00 176.59 3h0g s GLU 515 N -3.68 3.18 0.22 5.54 2.02 -1.26 -4.30 118.70 120.42 3h0g s GLU 515 Ca 0.67 1.10 0.00 0.00 0.02 0.00 0.00 54.97 56.76 3h0g s GLU 515 Cb -0.18 -4.22 0.00 0.00 0.10 0.00 0.00 34.13 29.83 3h0g s GLU 515 CO 0.31 -2.04 0.00 0.41 0.02 0.00 0.00 175.26 173.95 3h0g n GLY 516 N 5.43 -1.87 6.65 -1.39 0.00 -1.26 -4.83 105.19 107.92 3h0g n GLY 516 Ca 0.21 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.92 3h0g n GLY 516 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3h0g n GLN 517 N -3.09 0.00 -1.47 1.61 -0.06 -1.26 -3.45 117.38 109.66 3h0g n GLN 517 Ca -0.00 0.00 -0.32 0.00 -2.00 0.00 0.00 57.00 54.68 3h0g n GLN 517 Cb 0.38 0.00 -0.06 0.00 -4.06 0.00 0.00 30.24 26.50 3h0g n GLN 517 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 3h0g n ALA 518 N 7.49 6.92 -1.87 1.69 0.00 -1.26 -4.95 120.51 128.53 3h0g n ALA 518 Ca 0.00 -3.26 -0.41 0.00 0.00 0.00 0.00 53.44 49.78 3h0g n ALA 518 Cb 0.00 -2.77 -0.04 0.00 0.00 0.00 0.00 19.45 16.64 3h0g n ALA 518 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h0g n GLY 520 N 1.52 0.50 0.11 0.00 0.00 -1.26 -4.55 105.19 101.52 3h0g n GLY 520 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.88 3h0g n GLY 520 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h0g n LEU 521 N -0.66 1.78 -4.89 0.99 4.77 -1.23 -4.00 117.00 113.75 3h0g n LEU 521 Ca -0.05 0.16 -0.32 0.00 -0.03 0.00 0.00 56.01 55.76 3h0g n LEU 521 Cb 0.45 -0.45 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 3h0g n LEU 521 CO 0.08 0.69 0.04 -0.69 -1.33 0.00 0.00 177.39 176.17 3h0g s VAL 522 N -2.55 5.15 0.11 4.08 1.01 -1.25 -4.15 120.40 122.81 3h0g s VAL 522 Ca -0.18 0.13 -0.09 0.00 0.00 0.00 0.00 61.98 61.83 3h0g s VAL 522 Cb 0.07 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.83 3h0g s VAL 522 CO 0.76 0.10 0.24 -0.54 0.00 0.00 0.00 175.10 175.65 3h0g s LYS 523 N -2.48 0.94 0.11 2.72 1.02 -1.25 -4.72 119.74 116.07 3h0g s LYS 523 Ca 0.39 -0.99 0.10 0.00 0.02 0.00 0.00 55.97 55.50 3h0g s LYS 523 Cb -0.12 0.36 -0.04 0.00 -0.52 0.00 0.00 37.83 37.51 3h0g s LYS 523 CO 0.23 -0.32 -0.26 -0.80 -0.92 0.00 0.00 175.35 173.27 3h0g s ASN 524 N -2.88 3.23 -0.06 2.83 -0.87 -1.26 -3.66 114.94 112.26 3h0g s ASN 524 Ca 0.08 -0.70 -0.30 0.00 -1.57 0.00 0.00 52.86 50.37 3h0g s ASN 524 Cb 0.04 -0.23 -0.04 0.00 -0.02 0.00 0.00 41.25 41.00 3h0g s ASN 524 CO -0.08 0.19 1.33 -0.76 -2.57 0.00 0.00 177.10 175.21 3h0g s LEU 525 N -1.83 4.27 0.00 0.60 1.43 -1.19 -1.56 118.68 120.40 3h0g s LEU 525 Ca 0.13 1.93 -0.02 0.00 -1.03 0.00 0.00 54.13 55.14 3h0g s LEU 525 Cb -0.10 -3.55 0.04 0.00 0.03 0.00 0.00 46.19 42.61 3h0g s LEU 525 CO 0.05 -0.71 0.09 -1.54 0.23 0.00 0.00 176.35 174.46 3h0g n SER 526 N 5.82 -1.90 0.10 2.29 3.41 -1.11 -4.45 113.62 117.80 3h0g n SER 526 Ca 0.13 -0.09 -0.02 0.00 -0.26 0.00 0.00 58.87 58.64 3h0g n SER 526 Cb 0.45 -0.46 -0.04 0.00 -0.26 0.00 0.00 64.21 63.90 3h0g n SER 526 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3h0g h LEU 527 N 0.00 0.00 -0.13 1.04 3.38 -1.55 -3.32 115.31 114.72 3h0g h LEU 527 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3h0g h LEU 527 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3h0g h LEU 527 CO 0.02 0.72 -0.80 0.23 0.09 0.00 0.00 178.44 178.70 3h0g n MET 528 N -3.27 1.02 -1.58 1.13 2.81 -1.26 -4.99 117.12 110.98 3h0g n MET 528 Ca 0.01 -0.13 -0.49 0.00 -1.81 0.00 0.00 57.70 55.28 3h0g n MET 528 Cb 0.83 -1.37 -0.04 0.00 -0.71 0.00 0.00 33.22 31.93 3h0g n MET 528 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3h0g n SER 529 N -1.24 1.35 -3.92 7.83 3.41 -1.25 -4.48 113.62 115.32 3h0g n SER 529 Ca 0.04 1.14 -0.26 0.00 -0.26 0.00 0.00 58.87 59.53 3h0g n SER 529 Cb 0.30 -1.21 -0.17 0.00 -0.26 0.00 0.00 64.21 62.88 3h0g n SER 529 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 3h0g s TYR 530 N -0.10 1.38 -0.10 7.33 6.14 -1.26 -4.96 117.35 125.77 3h0g s TYR 530 Ca 0.75 -0.63 -0.10 0.00 0.64 0.00 0.00 57.07 57.72 3h0g s TYR 530 Cb -0.87 -1.14 -0.05 0.00 0.42 0.00 0.00 41.96 40.32 3h0g s TYR 530 CO 0.52 -0.44 0.23 0.08 0.64 0.00 0.00 175.55 176.57 3h0g s VAL 531 N 1.51 5.35 -0.41 3.14 1.01 -1.26 -0.62 120.40 129.12 3h0g s VAL 531 Ca 0.01 0.41 -0.28 0.00 0.00 0.00 0.00 61.98 62.13 3h0g s VAL 531 Cb -0.13 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 3h0g s VAL 531 CO -0.06 0.56 1.94 -0.55 0.00 0.00 0.00 175.10 176.99 3h0g s SER 532 N -0.68 5.49 0.25 3.32 0.15 -0.75 -4.89 113.70 116.61 3h0g s SER 532 Ca 0.17 1.09 -0.04 0.00 0.70 0.00 0.00 55.95 57.87 3h0g s SER 532 Cb -0.13 -2.52 0.37 0.00 -1.71 0.00 0.00 66.02 62.03 3h0g s SER 532 CO 0.06 -2.06 1.87 0.58 1.20 0.00 0.00 173.24 174.88 3h0g h VAL 533 N 6.98 1.07 0.00 4.45 2.07 -1.94 -1.57 116.25 127.31 3h0g h VAL 533 Ca -0.31 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 66.84 3h0g h VAL 533 Cb 1.19 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.85 3h0g h VAL 533 CO 1.09 0.20 0.00 0.61 0.02 0.00 0.00 177.57 179.49 3h0g n GLY 534 N -1.35 2.71 3.01 2.17 0.00 -1.26 -4.52 105.19 105.96 3h0g n GLY 534 Ca 0.14 -1.78 -0.09 0.00 0.00 0.00 0.00 46.02 44.29 3h0g n GLY 534 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h0g s SER 535 N 0.00 0.24 0.21 1.61 1.04 -1.22 -4.92 113.70 110.67 3h0g s SER 535 Ca 0.00 -0.53 -0.31 0.00 0.48 0.00 0.00 55.95 55.59 3h0g s SER 535 Cb 0.00 0.13 -0.15 0.00 0.10 0.00 0.00 66.02 66.10 3h0g s SER 535 CO 0.00 -0.35 1.22 -2.65 0.98 0.00 0.00 173.24 172.44 3h0g n PRO 536 N 1.39 1.49 -0.03 4.02 -0.02 -1.26 -4.81 135.00 135.78 3h0g n PRO 536 Ca -0.23 0.53 0.13 0.00 -2.02 0.00 0.00 63.50 61.91 3h0g n PRO 536 Cb 0.56 -2.06 0.54 0.00 -0.02 0.00 0.00 33.50 32.52 3h0g n PRO 536 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3h0g n SER 537 N 1.92 1.13 0.00 2.55 2.88 -1.26 -4.43 113.62 116.41 3h0g n SER 537 Ca 0.13 -1.48 0.00 0.00 -1.33 0.00 0.00 58.87 56.19 3h0g n SER 537 Cb 0.28 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 63.70 3h0g n SER 537 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3h0g n ALA 538 N -0.08 0.00 0.00 -1.46 0.00 -1.26 -4.26 120.51 113.44 3h0g n ALA 538 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.62 3h0g n ALA 538 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.72 3h0g n ALA 538 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3h0g n PRO 539 N -0.54 0.00 0.07 0.00 -0.02 -1.26 -0.28 135.00 132.96 3h0g n PRO 539 Ca 0.00 0.00 -0.23 0.00 -2.02 0.00 0.00 63.50 61.25 3h0g n PRO 539 Cb 0.00 -1.49 -0.15 0.00 -0.02 0.00 0.00 33.50 31.84 3h0g n PRO 539 CO 0.00 0.00 0.00 -0.84 1.98 0.00 0.00 175.50 176.64 3h0g h ILE 540 N 0.00 0.96 0.00 4.25 3.07 -1.80 -3.25 117.51 120.75 3h0g h ILE 540 Ca 0.00 -2.50 -0.01 0.00 1.55 0.00 0.00 64.86 63.89 3h0g h ILE 540 Cb 0.00 2.77 -0.00 0.00 -0.27 0.00 0.00 36.82 39.32 3h0g h ILE 540 CO 0.00 0.84 -0.07 0.16 -1.05 0.00 0.00 178.15 178.03 3h0g h ILE 541 N 0.05 0.15 -0.89 0.16 3.07 -0.83 -2.85 117.51 116.37 3h0g h ILE 541 Ca -0.34 -0.80 0.05 0.00 1.55 0.00 0.00 64.86 65.32 3h0g h ILE 541 Cb 2.06 1.70 -0.06 0.00 -0.27 0.00 0.00 36.82 40.25 3h0g h ILE 541 CO 0.17 0.07 0.58 -0.33 -1.05 0.00 0.00 178.15 177.58 3h0g h GLU 542 N 0.00 1.02 -0.42 0.16 5.08 -1.62 0.22 114.58 119.02 3h0g h GLU 542 Ca -0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3h0g h GLU 542 Cb 0.69 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.71 3h0g h GLU 542 CO 0.01 0.68 0.00 1.19 -1.00 0.00 0.00 179.01 179.88 3h0g n PHE 543 N -4.47 0.50 0.06 4.33 3.01 -1.08 -3.47 117.46 116.34 3h0g n PHE 543 Ca 0.13 -0.22 0.00 0.00 1.01 0.00 0.00 57.45 58.37 3h0g n PHE 543 Cb 0.16 -0.06 0.00 0.00 -0.01 0.00 0.00 39.48 39.57 3h0g n PHE 543 CO 0.00 0.00 0.00 -0.11 1.01 0.00 0.00 176.76 177.66 3h0g n LEU 544 N 0.34 0.85 -0.35 4.37 7.94 0.57 -4.31 117.00 126.41 3h0g n LEU 544 Ca 0.10 0.18 0.03 0.00 -1.11 0.00 0.00 56.01 55.21 3h0g n LEU 544 Cb 0.34 -0.20 0.18 0.00 0.53 0.00 0.00 43.42 44.26 3h0g n LEU 544 CO 0.08 -0.72 1.23 -0.33 -1.11 0.00 0.00 177.39 176.54 3h0g h GLU 545 N 0.00 1.03 0.00 1.96 5.08 -1.19 -2.07 114.58 119.39 3h0g h GLU 545 Ca 0.00 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.22 3h0g h GLU 545 Cb 0.06 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 3h0g h GLU 545 CO 0.00 0.68 -0.37 1.49 -1.00 0.00 0.00 179.01 179.81 3h0g h GLU 546 N 1.06 0.00 -1.56 2.33 4.57 -1.70 -3.42 114.58 115.85 3h0g h GLU 546 Ca 0.43 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.54 3h0g h GLU 546 Cb 0.24 0.00 -0.27 0.00 -0.16 0.00 0.00 28.75 28.57 3h0g h GLU 546 CO -0.20 0.37 -0.41 -0.46 -1.18 0.00 0.00 179.01 177.13 3h0g s TRP 547 N -3.44 -1.13 0.00 0.92 -0.11 -0.78 -4.87 118.94 109.52 3h0g s TRP 547 Ca 0.01 1.09 0.00 0.00 1.22 0.00 0.00 56.10 58.42 3h0g s TRP 547 Cb 0.10 0.19 0.00 0.00 -1.50 0.00 0.00 33.47 32.26 3h0g s TRP 547 CO 0.69 -0.81 0.00 0.41 -4.62 0.00 0.00 176.95 172.62 3h0g n GLY 548 N 5.39 2.76 0.08 5.86 0.00 -1.23 -4.13 105.19 113.92 3h0g n GLY 548 Ca -0.02 0.02 -0.14 0.00 0.00 0.00 0.00 46.02 45.87 3h0g n GLY 548 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3h0g h LEU 549 N 0.00 0.11 -2.34 0.99 -0.00 -1.90 -3.48 115.31 108.70 3h0g h LEU 549 Ca 0.00 -0.78 0.01 0.00 -0.00 0.00 0.00 57.88 57.11 3h0g h LEU 549 Cb 0.00 -0.04 -0.09 0.00 -0.00 0.00 0.00 40.66 40.54 3h0g h LEU 549 CO 0.00 0.88 -1.06 1.21 -0.00 0.00 0.00 178.44 179.47 3h0g n GLU 550 N -4.61 -3.06 -4.53 1.13 0.00 -1.26 -4.52 120.64 103.80 3h0g n GLU 550 Ca -0.10 2.47 -0.34 0.00 0.00 0.00 0.00 57.16 59.20 3h0g n GLU 550 Cb 0.44 -3.77 -0.11 0.00 0.00 0.00 0.00 31.44 28.01 3h0g n GLU 550 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 3h0g s THR 551 N -0.50 3.94 0.00 6.31 -4.23 -1.26 -4.75 115.64 115.15 3h0g s THR 551 Ca -0.18 -0.39 0.00 0.00 -1.18 0.00 0.00 61.69 59.94 3h0g s THR 551 Cb 0.01 -2.63 0.00 0.00 1.34 0.00 0.00 72.50 71.22 3h0g s THR 551 CO 0.54 0.60 0.00 0.00 -0.54 0.00 0.00 174.62 175.22 3h0g n LEU 552 N 2.19 0.00 0.00 4.79 -0.00 -1.26 -2.59 117.00 120.12 3h0g n LEU 552 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.83 3h0g n LEU 552 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.95 3h0g n LEU 552 CO 0.27 0.00 0.00 -0.62 -0.00 0.00 0.00 177.39 177.04 3h0g n GLU 553 N 0.00 0.00 0.00 1.47 1.02 -1.26 -4.49 120.64 117.38 3h0g n GLU 553 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3h0g n GLU 553 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 3h0g n GLU 553 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3h0g n ASP 554 N -2.64 0.00 -1.92 1.62 3.85 -1.26 -4.95 116.55 111.24 3h0g n ASP 554 Ca 0.00 0.00 -0.01 0.00 -0.71 0.00 0.00 54.79 54.07 3h0g n ASP 554 Cb 0.00 0.00 0.01 0.00 -1.35 0.00 0.00 41.12 39.78 3h0g n ASP 554 CO 0.00 0.00 0.00 -1.22 -1.01 0.00 0.00 177.20 174.97 3h0g n TYR 555 N 0.00 -0.74 0.05 2.11 4.02 -1.26 -5.00 117.16 116.34 3h0g n TYR 555 Ca 0.00 0.28 0.00 0.00 -0.01 0.00 0.00 57.90 58.17 3h0g n TYR 555 Cb 0.00 -2.42 0.00 0.00 -0.02 0.00 0.00 39.34 36.90 3h0g n TYR 555 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 3h0g n ASN 556 N -1.44 -0.03 -4.66 7.72 6.94 -1.17 -4.44 115.26 118.17 3h0g n ASN 556 Ca -0.01 0.16 -0.57 0.00 -0.02 0.00 0.00 54.58 54.15 3h0g n ASN 556 Cb 0.51 0.12 -0.07 0.00 -2.36 0.00 0.00 39.78 37.98 3h0g n ASN 556 CO 0.00 0.00 0.00 -2.65 -1.03 0.00 0.00 177.26 173.58 3h0g n PRO 557 N -2.87 0.99 0.00 -0.53 -0.02 -1.26 -4.12 135.00 127.18 3h0g n PRO 557 Ca 0.00 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 3h0g n PRO 557 Cb 0.03 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 3h0g n PRO 557 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3h0g n SER 558 N 4.12 0.00 -4.66 2.55 2.88 -1.26 -4.74 113.62 112.50 3h0g n SER 558 Ca 0.24 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.37 3h0g n SER 558 Cb 0.13 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.60 3h0g n SER 558 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3h0g n ALA 559 N 9.71 0.77 -2.89 -1.46 0.00 -1.26 -4.01 120.51 121.37 3h0g n ALA 559 Ca 0.00 0.26 -0.01 0.00 0.00 0.00 0.00 53.44 53.69 3h0g n ALA 559 Cb 0.00 -2.18 -0.01 0.00 0.00 0.00 0.00 19.45 17.26 3h0g n ALA 559 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3h0g n SER 560 N 0.37 -6.64 -4.64 0.00 7.64 -1.26 -4.22 113.62 104.86 3h0g n SER 560 Ca 0.08 1.06 -0.30 0.00 1.01 0.00 0.00 58.87 60.73 3h0g n SER 560 Cb 0.39 -3.84 0.18 0.00 -1.01 0.00 0.00 64.21 59.93 3h0g n SER 560 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 3h0g s PRO 561 N -1.19 0.54 -0.17 1.43 0.02 -1.26 -3.06 135.00 131.31 3h0g s PRO 561 Ca -0.03 0.96 -0.04 0.00 0.02 0.00 0.00 61.00 61.91 3h0g s PRO 561 Cb 0.00 -1.71 0.08 0.00 0.02 0.00 0.00 34.50 32.89 3h0g s PRO 561 CO 0.48 -2.77 0.23 1.21 -0.33 0.00 0.00 177.00 175.81 3h0g s ASN 562 N -3.01 0.97 -0.28 2.53 3.84 -1.26 -4.85 114.94 112.88 3h0g s ASN 562 Ca 0.66 0.10 -0.00 0.00 0.21 0.00 0.00 52.86 53.82 3h0g s ASN 562 Cb -0.21 0.48 0.00 0.00 -0.55 0.00 0.00 41.25 40.97 3h0g s ASN 562 CO 0.59 -0.29 0.00 0.00 -2.79 0.00 0.00 177.10 174.62 3h0g n ALA 563 N 5.33 -3.45 -1.72 1.71 0.00 -1.26 -5.16 120.51 115.96 3h0g n ALA 563 Ca -0.05 0.49 -0.30 0.00 0.00 0.00 0.00 53.44 53.57 3h0g n ALA 563 Cb 0.50 -0.97 0.07 0.00 0.00 0.00 0.00 19.45 19.05 3h0g n ALA 563 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3h0g s THR 564 N -1.45 3.22 0.01 0.00 -1.32 -1.25 -4.90 115.64 109.94 3h0g s THR 564 Ca -0.01 0.40 0.00 0.00 -1.21 0.00 0.00 61.69 60.87 3h0g s THR 564 Cb 0.00 -3.27 0.00 0.00 -1.51 0.00 0.00 72.50 67.72 3h0g s THR 564 CO 0.71 -0.52 0.01 2.29 -2.21 0.00 0.00 174.62 174.90 3h0g n LYS 565 N -3.23 1.23 -3.24 7.08 0.00 -1.23 -4.23 118.16 114.53 3h0g n LYS 565 Ca 0.07 -0.05 -0.02 0.00 -0.00 0.00 0.00 58.31 58.31 3h0g n LYS 565 Cb 0.57 0.00 -0.04 0.00 -0.00 0.00 0.00 35.03 35.56 3h0g n LYS 565 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 3h0g s VAL 566 N 0.47 -0.82 0.32 0.58 1.01 -1.25 -3.19 120.40 117.54 3h0g s VAL 566 Ca 0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 61.98 61.95 3h0g s VAL 566 Cb -0.00 -0.91 -0.04 0.00 0.00 0.00 0.00 36.38 35.43 3h0g s VAL 566 CO 0.00 -0.06 0.53 -0.36 0.00 0.00 0.00 175.10 175.21 3h0g s PHE 567 N 2.71 3.49 -0.25 5.22 0.40 -1.20 -3.74 117.98 124.62 3h0g s PHE 567 Ca 0.17 0.37 -0.02 0.00 -0.60 0.00 0.00 56.93 56.85 3h0g s PHE 567 Cb -0.15 -1.90 0.13 0.00 0.51 0.00 0.00 43.02 41.61 3h0g s PHE 567 CO -0.19 0.17 0.34 0.08 0.70 0.00 0.00 175.22 176.32 3h0g s VAL 568 N -2.23 -0.52 -1.34 -0.44 1.01 -1.12 -2.77 120.40 112.99 3h0g s VAL 568 Ca 0.40 -0.18 -0.04 0.00 0.00 0.00 0.00 61.98 62.16 3h0g s VAL 568 Cb -0.10 -0.84 0.00 0.00 0.00 0.00 0.00 36.38 35.45 3h0g s VAL 568 CO 0.34 -0.22 0.53 0.59 0.00 0.00 0.00 175.10 176.35 3h0g n ASN 569 N 5.35 -5.51 0.00 3.32 3.02 -0.85 -2.03 115.26 118.56 3h0g n ASN 569 Ca -0.03 -0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.27 3h0g n ASN 569 Cb 0.49 -4.34 0.00 0.00 -0.61 0.00 0.00 39.78 35.32 3h0g n ASN 569 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h0g n GLY 570 N -1.43 1.41 3.49 7.41 0.00 -1.26 -4.87 105.19 109.94 3h0g n GLY 570 Ca -0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 3h0g n GLY 570 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h0g s VAL 571 N -3.07 4.49 -0.86 1.61 1.01 -0.86 -4.93 120.40 117.78 3h0g s VAL 571 Ca 0.00 -1.41 -0.20 0.00 0.00 0.00 0.00 61.98 60.37 3h0g s VAL 571 Cb 0.00 -4.88 -0.13 0.00 0.00 0.00 0.00 36.38 31.37 3h0g s VAL 571 CO 0.00 -1.65 1.97 1.87 0.00 0.00 0.00 175.10 177.29 3h0g n TRP 572 N 7.23 2.06 -3.49 5.22 -0.00 -1.26 -2.78 117.44 124.42 3h0g n TRP 572 Ca 0.28 -1.96 -0.43 0.00 -0.00 0.00 0.00 57.50 55.39 3h0g n TRP 572 Cb 0.49 -1.81 -0.06 0.00 -0.00 0.00 0.00 31.31 29.93 3h0g n TRP 572 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 177.69 176.52 3h0g s LEU 573 N 1.25 6.02 0.00 5.87 1.98 -1.25 -4.96 118.68 127.60 3h0g s LEU 573 Ca 0.55 -2.43 0.00 0.00 -2.89 0.00 0.00 54.13 49.36 3h0g s LEU 573 Cb 0.14 -2.06 0.00 0.00 0.66 0.00 0.00 46.19 44.93 3h0g s LEU 573 CO 0.09 -0.58 0.00 0.61 -1.89 0.00 0.00 176.35 174.57 3h0g n GLY 574 N 4.23 4.18 0.82 7.98 0.00 -1.26 -4.92 105.19 116.23 3h0g n GLY 574 Ca 0.03 -1.28 -0.06 0.00 0.00 0.00 0.00 46.02 44.71 3h0g n GLY 574 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3h0g n VAL 575 N -1.76 0.38 -1.27 1.61 3.14 -1.07 -3.76 118.33 115.60 3h0g n VAL 575 Ca 0.00 -0.05 0.00 0.00 -2.96 0.00 0.00 64.34 61.33 3h0g n VAL 575 Cb 0.00 -1.59 0.00 0.00 -1.06 0.00 0.00 33.84 31.19 3h0g n VAL 575 CO 0.00 0.00 0.00 1.57 -6.46 0.00 0.00 176.83 171.94 3h0g n HIS 576 N -3.29 -0.97 0.00 1.45 -0.00 -1.26 -3.58 115.22 107.57 3h0g n HIS 576 Ca -0.11 0.51 0.00 0.00 -0.00 0.00 0.00 57.72 58.12 3h0g n HIS 576 Cb 0.55 -1.15 0.00 0.00 -0.00 0.00 0.00 29.99 29.39 3h0g n HIS 576 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 3h0g n ARG 577 N -0.57 0.00 -1.49 1.57 1.74 -1.26 -3.86 116.66 112.78 3h0g n ARG 577 Ca 0.00 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.66 3h0g n ARG 577 Cb 0.00 0.00 -0.11 0.00 -1.02 0.00 0.00 32.46 31.33 3h0g n ARG 577 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3h0g n ASP 578 N 0.00 1.06 0.13 0.55 8.00 -1.26 -4.72 116.55 120.31 3h0g n ASP 578 Ca 0.00 0.04 -0.01 0.00 0.71 0.00 0.00 54.79 55.53 3h0g n ASP 578 Cb 0.00 -1.14 0.23 0.00 -0.02 0.00 0.00 41.12 40.19 3h0g n ASP 578 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 3h0g h PRO 579 N 14.00 0.11 0.00 -0.24 0.11 -1.99 -3.29 132.00 140.70 3h0g h PRO 579 Ca -0.13 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.93 3h0g h PRO 579 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 3h0g h PRO 579 CO 1.27 0.57 0.00 0.00 -0.21 0.00 0.00 178.00 179.63 3h0g n ALA 580 N -2.46 0.00 -0.22 -0.75 0.00 -1.26 -0.25 120.51 115.57 3h0g n ALA 580 Ca -0.02 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.53 3h0g n ALA 580 Cb 0.52 0.04 0.39 0.00 0.00 0.00 0.00 19.45 20.40 3h0g n ALA 580 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3h0g h HIS 581 N 0.00 0.73 -0.88 0.00 3.86 -1.97 -2.36 115.15 114.53 3h0g h HIS 581 Ca 0.00 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.23 3h0g h HIS 581 Cb 0.00 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.19 3h0g h HIS 581 CO 0.00 0.32 0.54 1.25 0.86 0.00 0.00 177.93 180.90 3h0g h LEU 582 N 0.66 1.04 0.13 2.43 5.85 -0.73 -3.10 115.31 121.60 3h0g h LEU 582 Ca 0.39 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 59.04 3h0g h LEU 582 Cb 0.58 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.35 3h0g h LEU 582 CO -0.15 0.79 -0.06 0.74 -0.34 0.00 0.00 178.44 179.41 3h0g h THR 583 N 1.20 0.00 -1.12 1.05 2.02 -0.58 -2.98 112.91 112.51 3h0g h THR 583 Ca 0.32 -0.50 0.43 0.00 0.77 0.00 0.00 66.41 67.43 3h0g h THR 583 Cb -0.07 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 66.17 3h0g h THR 583 CO -0.06 0.00 0.65 -0.33 0.37 0.00 0.00 175.52 176.15 3h0g h GLU 584 N -0.68 0.03 0.00 6.66 4.39 -1.65 0.77 114.58 124.11 3h0g h GLU 584 Ca -0.02 -0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.54 3h0g h GLU 584 Cb 0.14 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 3h0g h GLU 584 CO 0.03 0.02 -0.69 0.00 -1.16 0.00 0.00 179.01 177.21 3h0g h THR 585 N 0.03 1.27 0.11 1.13 1.03 -1.63 -2.45 112.91 112.40 3h0g h THR 585 Ca 0.85 -2.55 -0.01 0.00 -0.01 0.00 0.00 66.41 64.69 3h0g h THR 585 Cb 2.38 2.47 0.00 0.00 -1.07 0.00 0.00 68.15 71.93 3h0g h THR 585 CO -0.65 0.67 -0.05 -0.07 -0.01 0.00 0.00 175.52 175.41 3h0g h LEU 586 N 0.00 -0.13 -2.17 0.00 4.07 0.65 -3.19 115.31 114.54 3h0g h LEU 586 Ca -0.01 -0.40 0.06 0.00 0.08 0.00 0.00 57.88 57.62 3h0g h LEU 586 Cb 1.41 0.03 -0.01 0.00 1.08 0.00 0.00 40.66 43.18 3h0g h LEU 586 CO 0.09 0.37 0.22 0.03 -1.08 0.00 0.00 178.44 178.07 3h0g h ARG 587 N -0.66 0.00 -0.00 1.13 3.08 -1.11 0.89 114.38 117.70 3h0g h ARG 587 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 3h0g h ARG 587 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 3h0g h ARG 587 CO 0.02 0.00 -0.14 -1.13 -1.07 0.00 0.00 179.97 177.66 3h0g n SER 588 N -3.90 0.28 0.12 7.04 3.41 -0.93 -2.81 113.62 116.82 3h0g n SER 588 Ca 0.03 -0.13 0.02 0.00 -0.26 0.00 0.00 58.87 58.52 3h0g n SER 588 Cb 0.36 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 3h0g n SER 588 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3h0g h LEU 589 N 0.22 0.00 0.00 1.04 3.38 0.82 -3.15 115.31 117.62 3h0g h LEU 589 Ca 0.00 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.79 3h0g h LEU 589 Cb 0.42 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 3h0g h LEU 589 CO 0.00 0.52 -0.96 0.03 0.09 0.00 0.00 178.44 178.12 3h0g h ARG 590 N 0.00 0.00 0.00 1.13 3.08 -1.42 -1.85 114.38 115.32 3h0g h ARG 590 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3h0g h ARG 590 Cb 1.43 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.48 3h0g h ARG 590 CO 0.06 0.72 0.00 0.00 -1.07 0.00 0.00 179.97 179.68 3h0g h ARG 591 N 0.00 0.00 -0.00 0.04 3.08 -1.58 -2.99 114.38 112.93 3h0g h ARG 591 Ca -0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.00 3h0g h ARG 591 Cb 1.66 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.71 3h0g h ARG 591 CO 0.10 0.00 -0.63 0.54 -1.07 0.00 0.00 179.97 178.90 3h0g n ARG 592 N -2.66 2.12 -0.99 0.04 1.74 -1.19 -0.81 116.66 114.91 3h0g n ARG 592 Ca 0.04 -0.12 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 3h0g n ARG 592 Cb 0.42 -1.20 0.00 0.00 -1.02 0.00 0.00 32.46 30.67 3h0g n ARG 592 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3h0g n LEU 593 N -1.17 0.41 -0.06 0.55 4.77 -0.89 -4.84 117.00 115.78 3h0g n LEU 593 Ca 0.03 0.00 0.25 0.00 -0.03 0.00 0.00 56.01 56.26 3h0g n LEU 593 Cb 0.24 -1.29 0.70 0.00 -2.33 0.00 0.00 43.42 40.74 3h0g n LEU 593 CO 0.28 -0.40 1.23 0.44 -1.33 0.00 0.00 177.39 177.60 3h0g h ASP 594 N 0.00 0.00 -3.65 -1.43 3.32 -1.67 -3.40 116.42 109.60 3h0g h ASP 594 Ca 0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 3h0g h ASP 594 Cb 0.39 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 39.76 3h0g h ASP 594 CO 0.00 0.00 -0.79 0.27 -1.72 0.00 0.00 179.24 177.00 3h0g s ILE 595 N -4.70 1.78 0.24 0.35 -4.36 -1.11 -5.07 121.20 108.33 3h0g s ILE 595 Ca -0.04 -1.86 -0.29 0.00 -0.26 0.00 0.00 60.65 58.19 3h0g s ILE 595 Cb 0.17 -1.80 -0.15 0.00 1.25 0.00 0.00 42.46 41.94 3h0g s ILE 595 CO 0.61 -0.29 0.91 -1.54 0.24 0.00 0.00 174.94 174.87 3h0g n SER 596 N 0.40 0.63 -0.05 4.36 3.41 -1.26 -4.70 113.62 116.41 3h0g n SER 596 Ca -0.14 1.16 0.16 0.00 -0.26 0.00 0.00 58.87 59.79 3h0g n SER 596 Cb 0.57 -1.18 0.88 0.00 -0.26 0.00 0.00 64.21 64.22 3h0g n SER 596 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h0g n ALA 597 N 0.41 2.66 1.25 7.33 0.00 -1.26 -3.52 120.51 127.39 3h0g n ALA 597 Ca 0.13 -0.22 0.05 0.00 0.00 0.00 0.00 53.44 53.40 3h0g n ALA 597 Cb 0.28 -1.48 0.15 0.00 0.00 0.00 0.00 19.45 18.40 3h0g n ALA 597 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3h0g n GLU 598 N -0.93 1.56 -3.37 0.00 1.02 -1.26 -4.70 120.64 112.96 3h0g n GLU 598 Ca 0.22 -0.87 -0.38 0.00 -0.02 0.00 0.00 57.16 56.11 3h0g n GLU 598 Cb 0.15 -1.21 -0.07 0.00 -0.02 0.00 0.00 31.44 30.29 3h0g n GLU 598 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3h0g s VAL 599 N -1.69 5.20 0.57 2.62 1.01 -1.23 -4.72 120.40 122.16 3h0g s VAL 599 Ca 0.18 0.80 -0.01 0.00 0.00 0.00 0.00 61.98 62.95 3h0g s VAL 599 Cb 0.10 -3.76 0.03 0.00 0.00 0.00 0.00 36.38 32.75 3h0g s VAL 599 CO 0.13 0.29 0.82 -0.94 0.00 0.00 0.00 175.10 175.40 3h0g s SER 600 N 0.81 5.25 -0.03 3.32 1.04 -1.17 -4.97 113.70 117.95 3h0g s SER 600 Ca 0.22 0.14 -0.07 0.00 0.48 0.00 0.00 55.95 56.72 3h0g s SER 600 Cb -0.15 -1.02 0.01 0.00 0.10 0.00 0.00 66.02 64.96 3h0g s SER 600 CO 0.08 -1.19 0.15 0.27 0.98 0.00 0.00 173.24 173.53 3h0g s ILE 601 N -2.85 0.05 0.01 -1.02 -5.25 -1.26 -4.01 121.20 106.86 3h0g s ILE 601 Ca 0.57 -0.38 0.00 0.00 -0.99 0.00 0.00 60.65 59.85 3h0g s ILE 601 Cb -0.10 -0.35 -0.01 0.00 2.95 0.00 0.00 42.46 44.94 3h0g s ILE 601 CO 0.40 -0.21 -0.03 -0.69 -1.79 0.00 0.00 174.94 172.62 3h0g s VAL 602 N -0.73 0.16 -0.44 8.37 1.01 -0.59 -4.64 120.40 123.53 3h0g s VAL 602 Ca -0.08 -0.55 0.07 0.00 0.00 0.00 0.00 61.98 61.42 3h0g s VAL 602 Cb -0.05 -0.23 0.24 0.00 0.00 0.00 0.00 36.38 36.35 3h0g s VAL 602 CO 0.01 -0.25 0.54 0.54 0.00 0.00 0.00 175.10 175.94 3h0g n ARG 603 N 2.23 1.01 -2.23 2.72 1.74 -1.26 -3.62 116.66 117.24 3h0g n ARG 603 Ca -0.19 -3.51 -0.33 0.00 -0.77 0.00 0.00 57.85 53.06 3h0g n ARG 603 Cb 0.57 -1.47 -0.04 0.00 -1.02 0.00 0.00 32.46 30.50 3h0g n ARG 603 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3h0g s ASP 604 N -1.30 5.62 0.00 0.55 1.01 -1.18 -4.77 116.67 116.59 3h0g s ASP 604 Ca 0.35 -1.86 0.00 0.00 0.71 0.00 0.00 52.55 51.75 3h0g s ASP 604 Cb 0.15 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.49 3h0g s ASP 604 CO -0.10 -2.46 0.20 2.30 0.21 0.00 0.00 175.17 175.33 3h0g n ILE 605 N 7.36 0.00 0.00 0.77 -6.64 -1.26 0.47 119.36 120.06 3h0g n ILE 605 Ca 0.46 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 61.44 3h0g n ILE 605 Cb 0.46 -0.27 0.00 0.00 -1.44 0.00 0.00 39.64 38.40 3h0g n ILE 605 CO 0.00 0.00 0.00 0.54 -1.77 0.00 0.00 176.55 175.32 3h0g n ARG 606 N -0.14 1.23 -0.04 6.28 1.74 -1.26 -4.67 116.66 119.80 3h0g n ARG 606 Ca 0.00 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.09 3h0g n ARG 606 Cb 0.03 -0.90 0.01 0.00 -1.02 0.00 0.00 32.46 30.58 3h0g n ARG 606 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3h0g n GLU 607 N -1.32 1.56 0.00 5.56 1.02 -0.42 -5.11 120.64 121.92 3h0g n GLU 607 Ca 0.00 -1.22 0.00 0.00 -0.02 0.00 0.00 57.16 55.92 3h0g n GLU 607 Cb 0.00 -0.84 0.00 0.00 -0.02 0.00 0.00 31.44 30.58 3h0g n GLU 607 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3h0g n LYS 608 N -0.38 0.00 -1.34 3.49 4.01 0.18 -5.00 118.16 119.11 3h0g n LYS 608 Ca 0.02 0.00 0.15 0.00 -0.51 0.00 0.00 58.31 57.97 3h0g n LYS 608 Cb 0.41 0.00 -0.08 0.00 -0.51 0.00 0.00 35.03 34.85 3h0g n LYS 608 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 3h0g n GLU 609 N 13.28 -3.14 -3.14 1.97 1.02 -1.26 -3.13 120.64 126.24 3h0g n GLU 609 Ca 0.00 2.57 -0.14 0.00 -0.02 0.00 0.00 57.16 59.57 3h0g n GLU 609 Cb 0.00 -3.62 -0.05 0.00 -0.02 0.00 0.00 31.44 27.75 3h0g n GLU 609 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3h0g s LEU 610 N -6.92 -0.24 0.33 -4.62 0.20 -1.19 -3.23 118.68 103.01 3h0g s LEU 610 Ca 0.00 -2.03 -0.28 0.00 0.69 0.00 0.00 54.13 52.50 3h0g s LEU 610 Cb 0.00 0.86 -0.10 0.00 -0.43 0.00 0.00 46.19 46.52 3h0g s LEU 610 CO 0.00 -0.15 1.22 -0.13 -0.29 0.00 0.00 176.35 177.00 3h0g s ARG 611 N 0.84 4.38 -0.35 1.98 0.52 -1.24 -3.23 118.95 121.84 3h0g s ARG 611 Ca 0.27 2.02 -0.01 0.00 -0.52 0.00 0.00 55.73 57.49 3h0g s ARG 611 Cb -0.03 -3.03 0.13 0.00 0.52 0.00 0.00 34.95 32.54 3h0g s ARG 611 CO -0.09 -0.10 0.19 -0.51 0.02 0.00 0.00 175.30 174.81 3h0g s LEU 612 N -1.83 1.20 0.61 2.53 1.43 -1.11 -1.54 118.68 119.96 3h0g s LEU 612 Ca 0.49 -2.03 -0.06 0.00 -1.03 0.00 0.00 54.13 51.50 3h0g s LEU 612 Cb -0.36 -0.50 0.02 0.00 0.03 0.00 0.00 46.19 45.38 3h0g s LEU 612 CO 0.47 -0.34 0.92 -0.36 0.23 0.00 0.00 176.35 177.27 3h0g s PHE 613 N 1.22 3.19 0.00 0.29 0.40 -1.26 -2.00 117.98 119.82 3h0g s PHE 613 Ca 0.16 0.61 0.00 0.00 -0.60 0.00 0.00 56.93 57.10 3h0g s PHE 613 Cb -0.21 -2.83 0.00 0.00 0.51 0.00 0.00 43.02 40.49 3h0g s PHE 613 CO -0.08 -0.93 0.00 -2.37 0.70 0.00 0.00 175.22 172.53 3h0g n THR 614 N -2.65 0.00 -2.40 0.64 5.66 -1.26 -3.02 114.28 111.25 3h0g n THR 614 Ca 0.05 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.67 3h0g n THR 614 Cb 0.58 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.33 3h0g n THR 614 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 3h0g s ASP 615 N 0.00 6.77 0.33 1.09 2.15 -1.26 -3.43 116.67 122.32 3h0g s ASP 615 Ca 0.00 2.25 -0.29 0.00 0.43 0.00 0.00 52.55 54.94 3h0g s ASP 615 Cb 0.00 -2.61 -0.11 0.00 -0.30 0.00 0.00 42.92 39.90 3h0g s ASP 615 CO 0.00 -0.49 1.48 0.00 -0.17 0.00 0.00 175.17 175.99 3h0g s ALA 616 N -1.41 3.62 0.00 3.66 0.00 -1.26 -3.85 121.76 122.52 3h0g s ALA 616 Ca 0.54 1.49 0.00 0.00 0.00 0.00 0.00 51.96 53.99 3h0g s ALA 616 Cb -0.29 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.24 3h0g s ALA 616 CO 0.37 -0.92 0.00 0.41 0.00 0.00 0.00 175.76 175.61 3h0g n GLY 617 N 1.28 1.18 3.72 0.00 0.00 -0.59 -4.93 105.19 105.85 3h0g n GLY 617 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 3h0g n GLY 617 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h0g s ARG 618 N 0.00 1.88 -0.04 1.61 1.81 -1.25 -1.44 118.95 121.52 3h0g s ARG 618 Ca 0.00 1.55 0.03 0.00 -1.72 0.00 0.00 55.73 55.59 3h0g s ARG 618 Cb 0.00 -1.82 -0.03 0.00 -0.45 0.00 0.00 34.95 32.65 3h0g s ARG 618 CO 0.00 -1.99 -0.10 0.96 -0.68 0.00 0.00 175.30 173.49 3h0g s ILE 619 N -2.39 3.44 0.00 1.52 -4.36 -1.26 -1.80 121.20 116.35 3h0g s ILE 619 Ca 0.69 -0.67 0.00 0.00 -0.26 0.00 0.00 60.65 60.40 3h0g s ILE 619 Cb -0.24 -2.42 0.00 0.00 1.25 0.00 0.00 42.46 41.05 3h0g s ILE 619 CO 0.51 0.53 0.00 0.00 0.24 0.00 0.00 174.94 176.21 3h0g n ARG 621 N -0.02 0.00 -1.54 0.00 0.63 -1.17 -4.30 116.66 110.26 3h0g n ARG 621 Ca 0.00 0.00 -0.56 0.00 -0.92 0.00 0.00 57.85 56.37 3h0g n ARG 621 Cb 0.00 0.00 -0.08 0.00 0.45 0.00 0.00 32.46 32.83 3h0g n ARG 621 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 3h0g n PRO 622 N 0.00 0.89 -4.14 -0.14 -0.02 -1.26 -3.61 135.00 126.72 3h0g n PRO 622 Ca 0.00 0.29 -0.26 0.00 -2.02 0.00 0.00 63.50 61.51 3h0g n PRO 622 Cb 0.00 -2.11 -0.06 0.00 -0.02 0.00 0.00 33.50 31.32 3h0g n PRO 622 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3h0g s LEU 623 N 5.33 2.91 0.32 2.45 1.43 -0.88 -4.59 118.68 125.65 3h0g s LEU 623 Ca 1.07 -1.19 0.02 0.00 -1.03 0.00 0.00 54.13 53.00 3h0g s LEU 623 Cb -1.08 -1.30 -0.03 0.00 0.03 0.00 0.00 46.19 43.81 3h0g s LEU 623 CO 0.60 -0.72 0.49 -0.36 0.23 0.00 0.00 176.35 176.59 3h0g s PHE 624 N -2.68 3.44 0.13 0.29 0.08 -0.99 -2.55 117.98 115.71 3h0g s PHE 624 Ca 0.35 0.18 0.00 0.00 0.12 0.00 0.00 56.93 57.57 3h0g s PHE 624 Cb 0.02 -1.82 -0.00 0.00 -0.57 0.00 0.00 43.02 40.64 3h0g s PHE 624 CO 0.20 0.18 0.00 0.44 -0.10 0.00 0.00 175.22 175.94 3h0g n ILE 625 N -1.67 0.00 0.00 0.64 -5.35 -1.13 -1.66 119.36 110.19 3h0g n ILE 625 Ca -0.05 -0.61 0.00 0.00 -0.27 0.00 0.00 62.75 61.82 3h0g n ILE 625 Cb 0.57 0.13 0.00 0.00 -1.74 0.00 0.00 39.64 38.59 3h0g n ILE 625 CO 0.00 0.00 0.00 0.52 -1.76 0.00 0.00 176.55 175.31 3h0g n VAL 626 N -0.32 0.00 -2.90 7.28 0.31 -0.21 -3.76 118.33 118.73 3h0g n VAL 626 Ca -0.05 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.27 3h0g n VAL 626 Cb 0.16 -0.24 -0.01 0.00 -0.91 0.00 0.00 33.84 32.85 3h0g n VAL 626 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3h0g n ASP 627 N -1.93 -6.47 -4.18 4.52 2.03 -1.26 -4.59 116.55 104.67 3h0g n ASP 627 Ca 0.00 1.03 -0.34 0.00 0.52 0.00 0.00 54.79 56.00 3h0g n ASP 627 Cb 0.19 -3.68 -0.14 0.00 -0.72 0.00 0.00 41.12 36.76 3h0g n ASP 627 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 3h0g s ASN 628 N -1.12 4.58 -0.14 1.67 2.47 -1.26 -4.88 114.94 116.25 3h0g s ASN 628 Ca -0.04 -1.09 -0.14 0.00 0.42 0.00 0.00 52.86 52.01 3h0g s ASN 628 Cb 0.00 -1.68 -0.11 0.00 -1.45 0.00 0.00 41.25 38.01 3h0g s ASN 628 CO 0.44 -0.19 0.18 -1.13 -3.72 0.00 0.00 177.10 172.68 3h0g h ASN 629 N 7.99 0.00 -4.45 -4.21 -1.24 -1.94 -3.49 115.58 108.24 3h0g h ASN 629 Ca -0.27 -0.35 -0.47 0.00 0.71 0.00 0.00 56.30 55.93 3h0g h ASN 629 Cb 1.08 0.00 0.09 0.00 0.73 0.00 0.00 38.32 40.23 3h0g h ASN 629 CO 0.55 0.91 0.38 -2.84 -1.29 0.00 0.00 177.43 175.13 3h0g s PRO 630 N -2.07 2.10 0.00 6.67 0.02 -1.26 -5.17 135.00 135.29 3h0g s PRO 630 Ca -0.15 0.08 0.00 0.00 0.02 0.00 0.00 61.00 60.96 3h0g s PRO 630 Cb 0.01 -2.00 0.00 0.00 0.02 0.00 0.00 34.50 32.53 3h0g s PRO 630 CO 0.35 -1.47 0.00 -1.71 -0.33 0.00 0.00 177.00 173.84 3h0g n ASN 631 N -3.21 0.00 -4.84 2.53 5.15 -1.25 -5.08 115.26 108.56 3h0g n ASN 631 Ca 0.08 0.00 -0.30 0.00 -0.60 0.00 0.00 54.58 53.76 3h0g n ASN 631 Cb 0.60 0.00 0.06 0.00 -0.53 0.00 0.00 39.78 39.92 3h0g n ASN 631 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 3h0g s SER 632 N 2.00 5.11 -1.02 1.20 1.04 -1.26 -4.34 113.70 116.44 3h0g s SER 632 Ca 0.00 1.33 -0.17 0.00 0.48 0.00 0.00 55.95 57.59 3h0g s SER 632 Cb 0.00 -2.14 0.02 0.00 0.10 0.00 0.00 66.02 64.00 3h0g s SER 632 CO 0.00 -1.58 0.66 -0.62 0.98 0.00 0.00 173.24 172.69 3h0g n GLU 633 N -3.18 -0.95 0.00 4.02 -0.58 -1.26 -4.22 120.64 114.47 3h0g n GLU 633 Ca 0.07 0.47 0.00 0.00 -0.42 0.00 0.00 57.16 57.28 3h0g n GLU 633 Cb 0.56 -2.75 0.00 0.00 -0.57 0.00 0.00 31.44 28.67 3h0g n GLU 633 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3h0g n ARG 634 N -3.78 0.00 -0.02 3.49 1.74 -1.26 -3.09 116.66 113.74 3h0g n ARG 634 Ca -0.19 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 56.86 3h0g n ARG 634 Cb 0.62 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 32.05 3h0g n ARG 634 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3h0g n ARG 635 N 0.00 0.15 0.00 5.56 1.74 -1.26 -3.94 116.66 118.92 3h0g n ARG 635 Ca 0.00 0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 3h0g n ARG 635 Cb 0.00 -0.67 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 3h0g n ARG 635 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h0g n GLY 636 N 2.24 1.54 1.34 -0.13 0.00 -1.18 -4.56 105.19 104.44 3h0g n GLY 636 Ca -0.04 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.17 3h0g n GLY 636 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3h0g n GLU 637 N 0.00 0.00 -2.43 1.61 2.13 -1.26 -4.47 120.64 116.22 3h0g n GLU 637 Ca 0.00 0.00 -0.41 0.00 0.66 0.00 0.00 57.16 57.41 3h0g n GLU 637 Cb 0.00 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 31.67 3h0g n GLU 637 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3h0g s LEU 638 N -4.01 4.51 0.00 4.31 1.43 -1.26 -4.56 118.68 119.10 3h0g s LEU 638 Ca 0.00 2.28 0.25 0.00 -1.03 0.00 0.00 54.13 55.63 3h0g s LEU 638 Cb 0.00 -3.62 0.52 0.00 0.03 0.00 0.00 46.19 43.12 3h0g s LEU 638 CO 0.00 -0.23 1.42 0.00 0.23 0.00 0.00 176.35 177.77 3h0g s ILE 640 N -2.46 3.21 0.12 0.00 -1.09 -1.26 -4.94 121.20 114.79 3h0g s ILE 640 Ca 0.23 -1.44 0.10 0.00 -2.23 0.00 0.00 60.65 57.31 3h0g s ILE 640 Cb 0.19 -2.53 -0.04 0.00 -1.58 0.00 0.00 42.46 38.50 3h0g s ILE 640 CO 0.52 0.03 -0.23 -0.13 -1.23 0.00 0.00 174.94 173.91 3h0g s ARG 641 N -2.41 1.59 0.40 2.79 1.81 -1.26 -4.99 118.95 116.87 3h0g s ARG 641 Ca 0.22 -1.27 0.23 0.00 -1.72 0.00 0.00 55.73 53.20 3h0g s ARG 641 Cb -0.10 -2.00 1.30 0.00 -0.45 0.00 0.00 34.95 33.70 3h0g s ARG 641 CO 0.14 0.47 1.63 -0.22 -0.68 0.00 0.00 175.30 176.63 3h0g h LYS 642 N 3.83 0.15 -0.54 3.54 3.64 -2.00 1.07 116.57 126.25 3h0g h LYS 642 Ca -0.50 -0.01 0.07 0.00 -1.27 0.00 0.00 60.65 58.93 3h0g h LYS 642 Cb 1.17 -0.03 -0.10 0.00 -0.41 0.00 0.00 32.23 32.86 3h0g h LYS 642 CO 0.42 0.10 -0.52 0.93 -2.27 0.00 0.00 179.45 178.11 3h0g h GLU 643 N 0.15 -0.28 -0.69 1.90 5.08 -2.00 -1.09 114.58 117.65 3h0g h GLU 643 Ca 0.79 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 59.27 3h0g h GLU 643 Cb 2.21 0.06 -0.12 0.00 0.50 0.00 0.00 28.75 31.41 3h0g h GLU 643 CO -0.53 -0.19 -0.43 0.45 -1.00 0.00 0.00 179.01 177.31 3h0g h HIS 644 N -0.29 -1.26 0.37 4.33 3.86 0.80 -2.02 115.15 120.93 3h0g h HIS 644 Ca 0.12 0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.41 3h0g h HIS 644 Cb 0.57 0.65 -0.01 0.00 1.06 0.00 0.00 27.41 29.67 3h0g h HIS 644 CO -0.75 -0.41 -0.30 0.82 0.86 0.00 0.00 177.93 178.15 3h0g h ILE 645 N -0.16 0.38 -1.02 2.45 2.04 -1.09 -0.38 117.51 119.72 3h0g h ILE 645 Ca 0.21 0.00 0.25 0.00 1.00 0.00 0.00 64.86 66.32 3h0g h ILE 645 Cb 0.55 0.38 -0.10 0.00 -0.74 0.00 0.00 36.82 36.91 3h0g h ILE 645 CO -0.76 0.00 0.64 1.56 0.00 0.00 0.00 178.15 179.59 3h0g h GLN 646 N -0.67 0.48 -0.65 2.37 4.20 -0.91 0.48 115.11 120.40 3h0g h GLN 646 Ca -0.03 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.62 3h0g h GLN 646 Cb 0.59 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 28.23 3h0g h GLN 646 CO -0.02 0.32 0.29 1.96 -0.67 0.00 0.00 178.83 180.72 3h0g h GLN 647 N 0.49 0.95 -0.40 1.46 4.20 -0.40 -2.65 115.11 118.76 3h0g h GLN 647 Ca 0.60 -0.15 0.08 0.00 0.06 0.00 0.00 58.65 59.24 3h0g h GLN 647 Cb 1.33 -0.16 -0.07 0.00 0.30 0.00 0.00 27.48 28.87 3h0g h GLN 647 CO -0.34 0.77 -0.07 -0.07 -0.67 0.00 0.00 178.83 178.44 3h0g h LEU 648 N 0.90 -0.32 -2.72 1.46 3.38 0.10 -0.33 115.31 117.79 3h0g h LEU 648 Ca 0.22 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.31 3h0g h LEU 648 Cb 0.15 0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 3h0g h LEU 648 CO -0.02 -0.11 0.04 0.40 0.09 0.00 0.00 178.44 178.83 3h0g h ILE 649 N 0.03 0.19 0.00 1.22 2.04 -1.08 -0.37 117.51 119.53 3h0g h ILE 649 Ca 0.20 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.06 3h0g h ILE 649 Cb 0.30 0.96 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 3h0g h ILE 649 CO -0.39 0.00 0.00 -0.62 0.00 0.00 0.00 178.15 177.14 3h0g n GLU 650 N -3.34 0.09 -0.01 2.37 1.02 -0.13 -2.42 120.64 118.21 3h0g n GLU 650 Ca -0.03 0.48 0.07 0.00 -0.02 0.00 0.00 57.16 57.67 3h0g n GLU 650 Cb 0.11 -1.73 -0.12 0.00 -0.02 0.00 0.00 31.44 29.68 3h0g n GLU 650 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3h0g n ASP 651 N -1.90 1.36 -0.15 1.62 9.92 -0.15 -4.25 116.55 122.99 3h0g n ASP 651 Ca 0.01 0.00 -0.01 0.00 -0.53 0.00 0.00 54.79 54.25 3h0g n ASP 651 Cb 0.09 1.70 0.22 0.00 -0.64 0.00 0.00 41.12 42.49 3h0g n ASP 651 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 3h0g h LYS 652 N 0.00 0.86 0.00 -1.24 1.57 -1.52 -1.20 116.57 115.05 3h0g h LYS 652 Ca -0.01 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 3h0g h LYS 652 Cb 0.77 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.92 3h0g h LYS 652 CO 0.00 0.70 0.00 -0.25 -0.57 0.00 0.00 179.45 179.33 3h0g n ASP 653 N -4.33 0.32 -2.80 0.86 9.92 -1.23 -4.77 116.55 114.52 3h0g n ASP 653 Ca 0.05 0.58 0.00 0.00 -0.53 0.00 0.00 54.79 54.89 3h0g n ASP 653 Cb 0.16 -0.64 0.00 0.00 -0.64 0.00 0.00 41.12 39.99 3h0g n ASP 653 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 3h0g n ARG 654 N -1.85 -0.83 0.00 -1.24 5.12 -0.45 -4.90 116.66 112.51 3h0g n ARG 654 Ca 0.03 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.95 3h0g n ARG 654 Cb 0.21 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.51 3h0g n ARG 654 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 3h0g n TYR 655 N -2.25 0.00 0.00 -1.55 0.53 -1.26 -5.09 117.16 107.54 3h0g n TYR 655 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 3h0g n TYR 655 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.31 3h0g n TYR 655 CO 0.00 0.00 0.00 -3.47 -1.02 0.00 0.00 176.86 172.37 3h0g n ASP 656 N 0.00 0.00 0.00 7.72 -0.08 -1.26 -5.08 116.55 117.85 3h0g n ASP 656 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 3h0g n ASP 656 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 3h0g n ASP 656 CO 0.00 0.00 0.00 2.30 0.12 0.00 0.00 177.20 179.62 3h0g n ILE 657 N 0.00 0.00 -2.14 5.18 -6.64 -1.26 -5.12 119.36 109.38 3h0g n ILE 657 Ca 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.98 3h0g n ILE 657 Cb 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 39.64 38.20 3h0g n ILE 657 CO 0.00 0.00 0.00 0.47 -1.77 0.00 0.00 176.55 175.25 3h0g n ASP 658 N 0.00 0.00 -3.99 7.28 8.00 -1.26 -5.02 116.55 121.56 3h0g n ASP 658 Ca 0.00 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.19 3h0g n ASP 658 Cb 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 41.12 40.95 3h0g n ASP 658 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 3h0g s PRO 659 N 1.29 1.59 0.00 -0.24 0.04 -1.26 0.40 135.00 136.82 3h0g s PRO 659 Ca 0.00 -2.05 0.00 0.00 0.04 0.00 0.00 61.00 58.99 3h0g s PRO 659 Cb 0.00 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.35 3h0g s PRO 659 CO 0.00 -0.99 0.00 0.39 0.04 0.00 0.00 177.00 176.44 3h0g n GLU 660 N 3.96 0.00 0.00 4.56 -0.58 -1.26 -5.17 120.64 122.15 3h0g n GLU 660 Ca 0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.78 3h0g n GLU 660 Cb 0.39 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.26 3h0g n GLU 660 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 3h0g n GLN 661 N 4.26 0.00 -1.48 3.49 1.13 1.33 -4.96 117.38 121.15 3h0g n GLN 661 Ca 0.00 0.00 -0.21 0.00 -1.94 0.00 0.00 57.00 54.85 3h0g n GLN 661 Cb 0.00 0.00 -0.22 0.00 0.11 0.00 0.00 30.24 30.13 3h0g n GLN 661 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 3h0g n ARG 662 N 0.00 0.01 -1.10 -1.09 1.74 -1.26 -4.62 116.66 110.34 3h0g n ARG 662 Ca 0.00 -0.02 -0.13 0.00 -0.77 0.00 0.00 57.85 56.93 3h0g n ARG 662 Cb 0.00 -1.06 -0.06 0.00 -1.02 0.00 0.00 32.46 30.31 3h0g n ARG 662 CO 0.00 0.00 0.00 1.97 -1.52 0.00 0.00 177.63 178.08 3h0g n PHE 663 N 5.77 0.30 -3.62 -1.55 -0.00 -1.26 -4.74 117.46 112.35 3h0g n PHE 663 Ca 0.64 -0.15 -0.37 0.00 -0.00 0.00 0.00 57.45 57.58 3h0g n PHE 663 Cb 0.16 -1.24 -0.06 0.00 -0.00 0.00 0.00 39.48 38.34 3h0g n PHE 663 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 3h0g s GLY 664 N 4.74 3.05 0.00 4.97 0.00 -1.26 -4.71 107.32 114.11 3h0g s GLY 664 Ca 0.41 -3.80 0.00 0.00 0.00 0.00 0.00 44.72 41.33 3h0g s GLY 664 CO 0.13 1.20 0.00 1.87 0.00 0.00 0.00 173.10 176.30 3h0g n TRP 665 N 2.43 0.00 0.09 1.90 -0.00 -1.26 -4.65 117.44 115.95 3h0g n TRP 665 Ca 0.21 0.00 0.06 0.00 -0.00 0.00 0.00 57.50 57.76 3h0g n TRP 665 Cb 0.37 0.00 0.30 0.00 -0.00 0.00 0.00 31.31 31.98 3h0g n TRP 665 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 177.69 175.32 3h0g n THR 666 N 0.00 1.41 0.00 5.87 5.66 -1.26 -1.56 114.28 124.40 3h0g n THR 666 Ca 0.00 0.63 0.00 0.00 -3.05 0.00 0.00 64.05 61.63 3h0g n THR 666 Cb 0.00 -1.63 0.00 0.00 -1.55 0.00 0.00 70.33 67.15 3h0g n THR 666 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3h0g n ALA 667 N -1.62 1.77 0.11 1.79 0.00 -1.26 -4.61 120.51 116.69 3h0g n ALA 667 Ca -0.01 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.44 3h0g n ALA 667 Cb 0.05 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.56 3h0g n ALA 667 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3h0g n LEU 668 N -1.31 0.00 -0.09 0.00 4.77 -0.60 0.85 117.00 120.62 3h0g n LEU 668 Ca 0.00 0.17 -0.10 0.00 -0.03 0.00 0.00 56.01 56.04 3h0g n LEU 668 Cb 0.00 -0.17 -0.11 0.00 -2.33 0.00 0.00 43.42 40.81 3h0g n LEU 668 CO 0.00 -0.15 -1.07 0.52 -1.33 0.00 0.00 177.39 175.36 3h0g n VAL 669 N -1.17 1.10 0.14 4.08 0.31 -1.24 -2.88 118.33 118.68 3h0g n VAL 669 Ca 0.01 -0.58 0.03 0.00 -0.01 0.00 0.00 64.34 63.79 3h0g n VAL 669 Cb 0.01 -0.82 0.15 0.00 -0.91 0.00 0.00 33.84 32.27 3h0g n VAL 669 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 3h0g n SER 670 N -2.77 0.08 -0.43 4.52 2.88 0.25 -1.73 113.62 116.42 3h0g n SER 670 Ca -0.29 0.53 0.09 0.00 -1.33 0.00 0.00 58.87 57.87 3h0g n SER 670 Cb 0.96 -0.55 0.19 0.00 -0.75 0.00 0.00 64.21 64.06 3h0g n SER 670 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 3h0g n SER 671 N -1.61 2.83 -4.07 -3.46 7.64 -0.64 -4.37 113.62 109.95 3h0g n SER 671 Ca 0.01 -3.15 -0.32 0.00 1.01 0.00 0.00 58.87 56.42 3h0g n SER 671 Cb 0.05 -0.48 -0.01 0.00 -1.01 0.00 0.00 64.21 62.75 3h0g n SER 671 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h0g n GLY 672 N -1.10 -0.40 0.13 0.23 0.00 0.01 -4.88 105.19 99.18 3h0g n GLY 672 Ca 0.19 0.15 -0.26 0.00 0.00 0.00 0.00 46.02 46.10 3h0g n GLY 672 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h0g n LEU 673 N -4.46 1.95 -4.27 0.99 4.77 -1.20 -4.94 117.00 109.84 3h0g n LEU 673 Ca -0.04 0.34 -0.33 0.00 -0.03 0.00 0.00 56.01 55.96 3h0g n LEU 673 Cb 0.55 -0.81 -0.16 0.00 -2.33 0.00 0.00 43.42 40.67 3h0g n LEU 673 CO 0.81 0.41 -0.49 0.27 -1.33 0.00 0.00 177.39 177.06 3h0g s ILE 674 N -2.57 2.58 -0.16 -0.08 -5.25 -1.14 -2.85 121.20 111.73 3h0g s ILE 674 Ca -0.37 -0.82 -0.07 0.00 -0.99 0.00 0.00 60.65 58.41 3h0g s ILE 674 Cb 0.13 -2.06 -0.04 0.00 2.95 0.00 0.00 42.46 43.44 3h0g s ILE 674 CO 0.48 0.53 0.07 -1.61 -1.79 0.00 0.00 174.94 172.62 3h0g s GLU 675 N 0.59 3.75 0.00 0.37 2.02 -1.06 -4.61 118.70 119.77 3h0g s GLU 675 Ca -0.10 -0.31 -0.30 0.00 0.02 0.00 0.00 54.97 54.28 3h0g s GLU 675 Cb -0.16 -3.15 -0.04 0.00 0.10 0.00 0.00 34.13 30.88 3h0g s GLU 675 CO 0.03 0.42 1.13 0.71 0.02 0.00 0.00 175.26 177.58 3h0g s TYR 676 N -0.05 3.43 -0.14 1.61 1.51 -1.26 -2.07 117.35 120.38 3h0g s TYR 676 Ca 0.07 1.39 -0.04 0.00 -1.01 0.00 0.00 57.07 57.48 3h0g s TYR 676 Cb -0.12 -3.33 -0.03 0.00 -0.11 0.00 0.00 41.96 38.36 3h0g s TYR 676 CO 0.01 -0.91 0.02 -0.51 -1.11 0.00 0.00 175.55 173.05 3h0g s LEU 677 N 1.43 3.60 0.90 -1.29 1.43 -1.24 -4.87 118.68 118.65 3h0g s LEU 677 Ca 0.56 0.06 -0.12 0.00 -1.03 0.00 0.00 54.13 53.59 3h0g s LEU 677 Cb -0.25 -1.87 0.13 0.00 0.03 0.00 0.00 46.19 44.23 3h0g s LEU 677 CO 0.26 0.25 1.15 -0.62 0.23 0.00 0.00 176.35 177.63 3h0g s ASP 678 N -0.13 3.62 0.26 2.29 2.15 -1.26 -3.03 116.67 120.57 3h0g s ASP 678 Ca 0.05 0.90 0.05 0.00 0.43 0.00 0.00 52.55 53.99 3h0g s ASP 678 Cb -0.12 -1.44 0.33 0.00 -0.30 0.00 0.00 42.92 41.38 3h0g s ASP 678 CO 0.02 -2.48 1.61 0.00 -0.17 0.00 0.00 175.17 174.15 3h0g h ALA 679 N -1.45 0.95 0.00 3.66 0.00 -1.85 -3.16 119.26 117.42 3h0g h ALA 679 Ca -0.49 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 53.92 3h0g h ALA 679 Cb 1.33 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3h0g h ALA 679 CO 0.61 0.68 -0.73 1.49 0.00 0.00 0.00 179.25 181.30 3h0g h GLU 680 N 0.19 0.00 0.00 0.00 4.81 -1.92 -3.25 114.58 114.40 3h0g h GLU 680 Ca 0.00 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 3h0g h GLU 680 Cb 0.99 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.37 3h0g h GLU 680 CO 0.08 0.00 -0.29 1.49 -0.73 0.00 0.00 179.01 179.56 3h0g h GLU 681 N 0.00 0.00 -0.13 1.92 4.81 -1.81 -3.26 114.58 116.11 3h0g h GLU 681 Ca 0.00 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.27 3h0g h GLU 681 Cb 0.94 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.27 3h0g h GLU 681 CO 0.00 0.29 -0.13 0.93 -0.73 0.00 0.00 179.01 179.37 3h0g h GLU 682 N 0.00 -0.16 -0.90 1.92 4.39 -1.58 -2.84 114.58 115.42 3h0g h GLU 682 Ca -0.00 0.01 0.27 0.00 0.34 0.00 0.00 59.36 59.98 3h0g h GLU 682 Cb 0.85 0.04 -0.17 0.00 -0.10 0.00 0.00 28.75 29.37 3h0g h GLU 682 CO 0.04 -0.10 0.09 0.39 -1.16 0.00 0.00 179.01 178.27 3h0g n GLU 683 N -5.28 -0.07 -0.09 2.33 1.02 -1.23 0.84 120.64 118.16 3h0g n GLU 683 Ca -0.03 1.33 0.09 0.00 -0.02 0.00 0.00 57.16 58.53 3h0g n GLU 683 Cb 0.20 -2.15 0.34 0.00 -0.02 0.00 0.00 31.44 29.80 3h0g n GLU 683 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 3h0g n THR 684 N -5.27 0.24 -4.35 2.62 5.66 -1.07 -4.90 114.28 107.22 3h0g n THR 684 Ca 0.23 -0.35 -0.26 0.00 -3.05 0.00 0.00 64.05 60.63 3h0g n THR 684 Cb 0.77 0.30 -0.09 0.00 -1.55 0.00 0.00 70.33 69.76 3h0g n THR 684 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 3h0g s VAL 685 N -1.76 2.28 -0.39 1.08 1.01 0.25 -5.05 120.40 117.82 3h0g s VAL 685 Ca 0.30 -1.87 0.02 0.00 0.00 0.00 0.00 61.98 60.43 3h0g s VAL 685 Cb 0.16 -2.94 0.16 0.00 0.00 0.00 0.00 36.38 33.75 3h0g s VAL 685 CO 0.24 -0.05 0.30 -0.32 0.00 0.00 0.00 175.10 175.26 3h0g s MET 686 N -3.79 0.74 0.69 2.72 1.75 -1.26 -4.99 119.30 115.16 3h0g s MET 686 Ca 0.37 -1.69 -0.11 0.00 -1.25 0.00 0.00 55.69 53.02 3h0g s MET 686 Cb 0.05 -1.29 0.00 0.00 2.84 0.00 0.00 34.83 36.43 3h0g s MET 686 CO 0.20 -1.30 1.06 0.42 -0.65 0.00 0.00 175.02 174.75 3h0g s ILE 687 N 0.58 4.04 0.34 10.11 1.01 -1.26 -2.04 121.20 133.98 3h0g s ILE 687 Ca 0.26 0.66 0.08 0.00 0.00 0.00 0.00 60.65 61.65 3h0g s ILE 687 Cb -0.09 -3.52 -0.03 0.00 0.01 0.00 0.00 42.46 38.83 3h0g s ILE 687 CO -0.10 -0.86 0.22 0.00 0.00 0.00 0.00 174.94 174.20 3h0g s ALA 688 N -3.15 3.67 -0.12 9.38 0.00 0.28 -4.90 121.76 126.92 3h0g s ALA 688 Ca 0.57 -1.75 -0.10 0.00 0.00 0.00 0.00 51.96 50.69 3h0g s ALA 688 Cb -0.13 -0.94 -0.03 0.00 0.00 0.00 0.00 23.12 22.02 3h0g s ALA 688 CO 0.54 0.01 -0.19 -1.33 0.00 0.00 0.00 175.76 174.80 3h0g n MET 689 N -1.27 0.38 -4.39 0.00 2.81 -1.26 -1.50 117.12 111.89 3h0g n MET 689 Ca -0.02 0.38 -0.20 0.00 -1.81 0.00 0.00 57.70 56.05 3h0g n MET 689 Cb 0.61 -1.43 -0.14 0.00 -0.71 0.00 0.00 33.22 31.55 3h0g n MET 689 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3h0g s SER 690 N -5.37 1.55 0.35 7.83 1.04 -1.26 -4.35 113.70 113.49 3h0g s SER 690 Ca -0.15 -0.39 0.15 0.00 0.48 0.00 0.00 55.95 56.03 3h0g s SER 690 Cb 0.02 -0.12 1.04 0.00 0.10 0.00 0.00 66.02 67.07 3h0g s SER 690 CO 0.23 0.06 1.70 1.55 0.98 0.00 0.00 173.24 177.76 3h0g h PRO 691 N 5.19 0.40 -0.91 4.02 0.13 -1.94 0.21 132.00 139.10 3h0g h PRO 691 Ca -0.36 -0.02 0.18 0.00 -0.87 0.00 0.00 66.00 64.92 3h0g h PRO 691 Cb 1.18 -0.09 -0.10 0.00 0.13 0.00 0.00 31.00 32.11 3h0g h PRO 691 CO 0.45 0.26 0.49 0.93 -0.23 0.00 0.00 178.00 179.91 3h0g h GLU 692 N 0.41 0.61 -0.74 0.86 5.08 -1.95 0.75 114.58 119.60 3h0g h GLU 692 Ca 0.69 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.95 3h0g h GLU 692 Cb 1.55 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 30.63 3h0g h GLU 692 CO -0.49 0.40 0.24 -0.44 -1.00 0.00 0.00 179.01 177.72 3h0g h ASP 693 N 0.63 1.07 -0.59 1.42 3.32 -1.00 -1.76 116.42 119.51 3h0g h ASP 693 Ca 0.52 -0.20 -0.09 0.00 0.02 0.00 0.00 57.03 57.27 3h0g h ASP 693 Cb 0.82 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.07 3h0g h ASP 693 CO -0.40 0.99 -0.00 -0.07 -1.72 0.00 0.00 179.24 178.04 3h0g h LEU 694 N 1.09 1.02 -0.64 1.55 3.38 -0.87 -2.22 115.31 118.62 3h0g h LEU 694 Ca 0.24 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 3h0g h LEU 694 Cb 0.30 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 3h0g h LEU 694 CO -0.01 1.08 0.18 -0.33 0.09 0.00 0.00 178.44 179.45 3h0g h GLU 695 N 0.94 1.01 -0.71 1.13 5.08 -0.82 -1.86 114.58 119.34 3h0g h GLU 695 Ca 0.17 -0.23 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 3h0g h GLU 695 Cb 0.56 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.63 3h0g h GLU 695 CO 0.03 0.89 0.23 0.00 -1.00 0.00 0.00 179.01 179.17 3h0g h ALA 696 N 1.07 0.94 -0.43 3.43 0.00 -1.19 -2.05 119.26 121.02 3h0g h ALA 696 Ca 0.20 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 3h0g h ALA 696 Cb 0.32 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3h0g h ALA 696 CO -0.00 0.61 -0.06 0.66 0.00 0.00 0.00 179.25 180.45 3h0g h SER 697 N 1.05 0.71 -0.18 0.00 4.64 -1.18 -2.03 113.55 116.56 3h0g h SER 697 Ca 0.23 -0.19 -0.11 0.00 -0.47 0.00 0.00 61.79 61.26 3h0g h SER 697 Cb 0.29 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 3h0g h SER 697 CO -0.01 0.82 -0.23 -0.09 -0.87 0.00 0.00 176.83 176.45 3h0g h ARG 698 N 0.67 0.64 -0.13 4.77 2.43 -1.02 -2.53 114.38 119.21 3h0g h ARG 698 Ca 0.12 -0.25 -0.15 0.00 -0.81 0.00 0.00 59.98 58.90 3h0g h ARG 698 Cb 0.51 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.02 3h0g h ARG 698 CO 0.03 0.82 -0.55 1.96 -1.51 0.00 0.00 179.97 180.72 3h0g h GLN 699 N 0.56 0.40 -0.47 0.20 4.20 -1.09 -3.14 115.11 115.77 3h0g h GLN 699 Ca 0.08 -0.25 -0.11 0.00 0.06 0.00 0.00 58.65 58.43 3h0g h GLN 699 Cb 0.70 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.49 3h0g h GLN 699 CO 0.05 0.84 -0.16 0.52 -0.67 0.00 0.00 178.83 179.42 3h0g h MET 700 N 0.31 0.91 0.00 1.46 2.86 -1.18 -2.07 114.93 117.21 3h0g h MET 700 Ca 0.01 -0.35 0.00 0.00 -2.06 0.00 0.00 59.70 57.30 3h0g h MET 700 Cb 1.06 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.67 3h0g h MET 700 CO 0.09 1.00 0.04 1.04 1.06 0.00 0.00 176.91 180.14 3h0g n GLN 701 N -4.13 0.00 0.00 1.72 6.02 -0.97 0.77 117.38 120.79 3h0g n GLN 701 Ca 0.01 0.04 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 3h0g n GLN 701 Cb 0.41 -1.54 0.00 0.00 1.02 0.00 0.00 30.24 30.14 3h0g n GLN 701 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3h0g n ALA 702 N -0.82 0.38 -1.48 -1.58 0.00 -1.06 -5.11 120.51 110.85 3h0g n ALA 702 Ca 0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 53.44 53.32 3h0g n ALA 702 Cb 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.49 3h0g n ALA 702 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h0g n GLY 703 N 0.00 -3.08 2.94 0.00 0.00 0.23 -5.10 105.19 100.18 3h0g n GLY 703 Ca 0.00 -0.30 -0.13 0.00 0.00 0.00 0.00 46.02 45.58 3h0g n GLY 703 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h0g s TYR 704 N -0.04 -0.18 0.63 1.61 1.51 -1.14 -4.89 117.35 114.86 3h0g s TYR 704 Ca -0.02 0.50 -0.15 0.00 -1.01 0.00 0.00 57.07 56.39 3h0g s TYR 704 Cb 0.00 -0.06 -0.13 0.00 -0.11 0.00 0.00 41.96 41.66 3h0g s TYR 704 CO 0.04 -0.17 -0.38 0.39 -1.11 0.00 0.00 175.55 174.32 3h0g n GLU 705 N 4.13 0.00 -0.12 -0.62 1.02 -1.26 -4.74 120.64 119.04 3h0g n GLU 705 Ca -0.25 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.66 3h0g n GLU 705 Cb 0.52 -0.86 -0.11 0.00 -0.02 0.00 0.00 31.44 30.97 3h0g n GLU 705 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86 3h0g n VAL 706 N -1.70 1.53 -2.60 2.62 3.14 -1.26 -5.02 118.33 115.05 3h0g n VAL 706 Ca 0.03 -0.49 -0.01 0.00 -2.96 0.00 0.00 64.34 60.91 3h0g n VAL 706 Cb 0.44 -1.63 0.00 0.00 -1.06 0.00 0.00 33.84 31.59 3h0g n VAL 706 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 3h0g n LYS 707 N -3.67 -1.09 -0.09 1.45 4.76 -1.26 -4.97 118.16 113.30 3h0g n LYS 707 Ca -0.47 1.30 0.08 0.00 -2.87 0.00 0.00 58.31 56.35 3h0g n LYS 707 Cb 0.95 -4.57 0.12 0.00 -1.84 0.00 0.00 35.03 29.69 3h0g n LYS 707 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3h0g n GLU 708 N -1.34 1.73 -0.89 1.97 1.02 -1.26 -4.40 120.64 117.48 3h0g n GLU 708 Ca 0.02 -1.72 -0.05 0.00 -0.02 0.00 0.00 57.16 55.39 3h0g n GLU 708 Cb 0.47 -1.32 0.26 0.00 -0.02 0.00 0.00 31.44 30.83 3h0g n GLU 708 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3h0g n GLU 709 N 0.89 3.01 0.00 3.49 1.02 -1.26 -4.29 120.64 123.50 3h0g n GLU 709 Ca 0.12 -3.06 0.00 0.00 -0.02 0.00 0.00 57.16 54.20 3h0g n GLU 709 Cb 0.43 -2.06 0.00 0.00 -0.02 0.00 0.00 31.44 29.79 3h0g n GLU 709 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3h0g n LEU 710 N -0.54 0.00 -4.77 -4.62 4.77 -1.26 -5.07 117.00 105.51 3h0g n LEU 710 Ca 0.38 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.98 3h0g n LEU 710 Cb 1.25 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 42.33 3h0g n LEU 710 CO 0.35 0.00 0.86 -1.81 -1.33 0.00 0.00 177.39 175.46 3h0g s ASP 711 N -1.29 6.17 0.12 -1.43 1.01 -1.26 -5.05 116.67 114.94 3h0g s ASP 711 Ca 0.00 2.40 0.11 0.00 0.71 0.00 0.00 52.55 55.77 3h0g s ASP 711 Cb 0.00 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.28 3h0g s ASP 711 CO 0.00 -0.92 -0.26 -2.16 0.21 0.00 0.00 175.17 172.03 3h0g s PRO 712 N -2.58 1.47 0.00 8.23 0.04 -1.26 -5.00 135.00 135.90 3h0g s PRO 712 Ca 0.62 -1.31 0.00 0.00 0.04 0.00 0.00 61.00 60.35 3h0g s PRO 712 Cb -0.31 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.31 3h0g s PRO 712 CO 0.38 0.46 0.00 0.00 0.04 0.00 0.00 177.00 177.88 3h0g n ALA 713 N 1.01 0.00 -3.65 8.56 0.00 -1.26 -4.87 120.51 120.29 3h0g n ALA 713 Ca -0.18 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.34 3h0g n ALA 713 Cb 0.53 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.99 3h0g n ALA 713 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3h0g n GLN 714 N 0.00 0.38 -2.16 0.00 6.02 -1.26 -4.87 117.38 115.49 3h0g n GLN 714 Ca 0.00 -0.93 -0.30 0.00 -0.01 0.00 0.00 57.00 55.76 3h0g n GLN 714 Cb 0.00 1.30 -0.05 0.00 1.02 0.00 0.00 30.24 32.51 3h0g n GLN 714 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3h0g s ARG 715 N -2.03 2.78 -0.90 -1.09 3.00 -1.26 -4.88 118.95 114.56 3h0g s ARG 715 Ca 0.18 -0.85 -0.20 0.00 0.00 0.00 0.00 55.73 54.86 3h0g s ARG 715 Cb -0.02 -5.20 -0.24 0.00 0.00 0.00 0.00 34.95 29.49 3h0g s ARG 715 CO 0.03 -3.36 2.39 0.28 0.00 0.00 0.00 175.30 174.64 3h0g n VAL 716 N 7.61 -0.01 -0.76 3.52 0.31 -1.26 -4.90 118.33 122.83 3h0g n VAL 716 Ca 0.42 -0.39 -0.28 0.00 -0.01 0.00 0.00 64.34 64.08 3h0g n VAL 716 Cb 0.47 -0.82 0.23 0.00 -0.91 0.00 0.00 33.84 32.81 3h0g n VAL 716 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3h0g s LYS 717 N 8.07 -0.55 -0.88 5.55 3.01 -1.26 -4.96 119.74 128.72 3h0g s LYS 717 Ca 1.23 0.69 -0.22 0.00 -1.01 0.00 0.00 55.97 56.66 3h0g s LYS 717 Cb -0.77 -1.61 0.08 0.00 -1.01 0.00 0.00 37.83 34.52 3h0g s LYS 717 CO 0.43 -3.44 1.21 -2.14 0.51 0.00 0.00 175.35 171.92 3h0g s PRO 718 N -4.64 3.46 0.08 -1.68 0.02 -1.26 -5.03 135.00 125.96 3h0g s PRO 718 Ca 0.67 -1.23 0.02 0.00 0.02 0.00 0.00 61.00 60.49 3h0g s PRO 718 Cb -0.23 -4.84 -0.04 0.00 0.02 0.00 0.00 34.50 29.41 3h0g s PRO 718 CO 0.62 -1.95 0.12 0.00 -0.33 0.00 0.00 177.00 175.46 3h0g s ALA 719 N 3.97 3.69 0.00 -1.55 0.00 -1.26 -4.39 121.76 122.22 3h0g s ALA 719 Ca 0.35 -0.99 0.00 0.00 0.00 0.00 0.00 51.96 51.32 3h0g s ALA 719 Cb -0.06 -1.54 0.00 0.00 0.00 0.00 0.00 23.12 21.52 3h0g s ALA 719 CO -0.03 0.74 0.00 -2.30 0.00 0.00 0.00 175.76 174.17 3h0g n PRO 720 N 0.32 0.00 -3.15 0.00 -0.02 -1.26 -5.02 135.00 125.87 3h0g n PRO 720 Ca -0.08 0.15 0.04 0.00 -2.02 0.00 0.00 63.50 61.59 3h0g n PRO 720 Cb 0.52 -0.56 -0.01 0.00 -0.02 0.00 0.00 33.50 33.43 3h0g n PRO 720 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3h0g s ASN 721 N -1.97 -1.24 -0.42 2.55 2.47 -1.26 -5.01 114.94 110.06 3h0g s ASN 721 Ca 0.00 0.66 -0.27 0.00 0.42 0.00 0.00 52.86 53.68 3h0g s ASN 721 Cb 0.00 1.99 -0.05 0.00 -1.45 0.00 0.00 41.25 41.74 3h0g s ASN 721 CO 0.00 -0.23 2.23 -2.84 -3.72 0.00 0.00 177.10 172.54 3h0g s PRO 722 N 2.87 2.55 5.72 0.43 0.02 -1.26 -4.74 135.00 140.59 3h0g s PRO 722 Ca 0.16 1.47 0.00 0.00 0.02 0.00 0.00 61.00 62.65 3h0g s PRO 722 Cb -0.13 -4.47 0.00 0.00 0.02 0.00 0.00 34.50 29.92 3h0g s PRO 722 CO -0.20 -2.78 0.00 0.72 -0.33 0.00 0.00 177.00 174.41 3h0g n HIS 723 N 13.90 0.00 -2.85 6.54 8.25 -1.26 -4.92 115.22 134.88 3h0g n HIS 723 Ca 0.32 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.77 3h0g n HIS 723 Cb 0.51 0.01 -0.01 0.00 1.12 0.00 0.00 29.99 31.63 3h0g n HIS 723 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3h0g n VAL 724 N 0.00 -9.04 0.04 1.59 0.31 -1.26 -4.93 118.33 105.05 3h0g n VAL 724 Ca 0.00 1.52 -0.20 0.00 -0.01 0.00 0.00 64.34 65.66 3h0g n VAL 724 Cb 0.00 -5.67 -0.12 0.00 -0.91 0.00 0.00 33.84 27.13 3h0g n VAL 724 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 3h0g h HIS 725 N 3.41 0.73 -4.00 3.52 3.86 -1.97 -3.46 115.15 117.23 3h0g h HIS 725 Ca -0.06 -0.45 -0.17 0.00 -1.16 0.00 0.00 60.37 58.54 3h0g h HIS 725 Cb 0.40 -0.06 -0.20 0.00 1.06 0.00 0.00 27.41 28.60 3h0g h HIS 725 CO 0.01 1.29 -0.70 0.00 0.86 0.00 0.00 177.93 179.39 3h0g s ALA 726 N -2.95 0.17 0.63 2.45 0.00 -1.26 -4.90 121.76 115.90 3h0g s ALA 726 Ca -0.12 -0.65 0.04 0.00 0.00 0.00 0.00 51.96 51.23 3h0g s ALA 726 Cb 0.03 0.16 0.10 0.00 0.00 0.00 0.00 23.12 23.41 3h0g s ALA 726 CO 0.86 -0.18 0.87 -1.58 0.00 0.00 0.00 175.76 175.73 3h0g s TRP 727 N -1.69 1.65 0.03 0.00 0.52 -1.26 -5.08 118.94 113.10 3h0g s TRP 727 Ca -0.14 -0.46 -0.02 0.00 0.02 0.00 0.00 56.10 55.50 3h0g s TRP 727 Cb -0.08 -2.61 -0.01 0.00 -1.15 0.00 0.00 33.47 29.61 3h0g s TRP 727 CO -0.02 -1.35 -0.05 -2.37 0.02 0.00 0.00 176.95 173.17 3h0g n THR 728 N -2.50 0.94 -4.37 2.01 5.66 -0.86 -4.85 114.28 110.31 3h0g n THR 728 Ca 0.14 0.23 -0.19 0.00 -3.05 0.00 0.00 64.05 61.18 3h0g n THR 728 Cb 0.61 -1.66 -0.10 0.00 -1.55 0.00 0.00 70.33 67.63 3h0g n THR 728 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 175.07 171.02 3h0g s HIS 729 N -2.12 1.79 -0.03 1.09 3.76 -1.23 -1.04 115.29 117.51 3h0g s HIS 729 Ca -0.05 -0.57 0.02 0.00 -0.15 0.00 0.00 55.06 54.32 3h0g s HIS 729 Cb 0.01 -0.85 0.01 0.00 1.11 0.00 0.00 32.58 32.85 3h0g s HIS 729 CO 0.07 0.38 -0.09 0.00 -0.85 0.00 0.00 174.74 174.25 3h0g n GLU 731 N 3.47 2.39 -0.09 0.00 4.07 -0.56 -2.33 120.64 127.58 3h0g n GLU 731 Ca -0.20 0.85 -0.06 0.00 -0.06 0.00 0.00 57.16 57.69 3h0g n GLU 731 Cb 0.53 -2.59 0.00 0.00 -0.06 0.00 0.00 31.44 29.32 3h0g n GLU 731 CO 0.00 0.00 0.00 -0.84 -0.06 0.00 0.00 177.13 176.23 3h0g h ILE 732 N 3.30 0.74 -1.47 6.31 3.07 -1.89 -3.45 117.51 124.13 3h0g h ILE 732 Ca -0.46 -0.02 0.09 0.00 1.55 0.00 0.00 64.86 66.03 3h0g h ILE 732 Cb 1.25 0.67 -0.28 0.00 -0.27 0.00 0.00 36.82 38.19 3h0g h ILE 732 CO 0.81 0.01 0.56 -2.28 -1.05 0.00 0.00 178.15 176.20 3h0g s HIS 733 N -6.19 -0.37 -1.99 0.16 5.65 -1.26 -4.88 115.29 106.41 3h0g s HIS 733 Ca -0.13 0.89 0.25 0.00 0.25 0.00 0.00 55.06 56.31 3h0g s HIS 733 Cb 0.12 0.40 1.50 0.00 -1.18 0.00 0.00 32.58 33.42 3h0g s HIS 733 CO 0.70 -0.18 1.86 -2.30 -0.65 0.00 0.00 174.74 174.17 3h0g n PRO 734 N 1.99 0.78 -0.13 2.88 -0.02 -1.26 -2.93 135.00 136.31 3h0g n PRO 734 Ca -0.12 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.48 3h0g n PRO 734 Cb 0.56 -1.50 0.26 0.00 -0.02 0.00 0.00 33.50 32.80 3h0g n PRO 734 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h0g n ALA 735 N -1.01 2.46 1.16 3.55 0.00 -1.26 -3.05 120.51 122.37 3h0g n ALA 735 Ca 0.19 -0.80 0.13 0.00 0.00 0.00 0.00 53.44 52.96 3h0g n ALA 735 Cb 0.09 -0.94 0.27 0.00 0.00 0.00 0.00 19.45 18.87 3h0g n ALA 735 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3h0g n MET 736 N 1.08 2.07 -0.57 0.00 2.81 -1.15 -4.16 117.12 117.20 3h0g n MET 736 Ca 0.18 -1.56 -0.05 0.00 -1.81 0.00 0.00 57.70 54.46 3h0g n MET 736 Cb 0.51 -1.47 0.02 0.00 -0.71 0.00 0.00 33.22 31.57 3h0g n MET 736 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 3h0g n ILE 737 N 0.88 2.12 -4.24 2.02 5.41 -1.17 -3.42 119.36 120.96 3h0g n ILE 737 Ca 0.16 -0.80 -0.19 0.00 1.00 0.00 0.00 62.75 62.92 3h0g n ILE 737 Cb 0.50 -1.36 -0.11 0.00 -0.71 0.00 0.00 39.64 37.95 3h0g n ILE 737 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3h0g s LEU 738 N -0.61 2.39 1.15 1.39 1.02 -1.24 -4.58 118.68 118.21 3h0g s LEU 738 Ca 0.10 -0.79 -0.17 0.00 0.02 0.00 0.00 54.13 53.29 3h0g s LEU 738 Cb 0.08 -0.58 0.17 0.00 0.02 0.00 0.00 46.19 45.87 3h0g s LEU 738 CO 0.00 -0.12 0.30 0.61 0.02 0.00 0.00 176.35 177.16 3h0g n GLY 739 N 0.61 -2.40 0.08 -3.19 0.00 -1.26 -3.01 105.19 96.02 3h0g n GLY 739 Ca -0.16 -0.92 -0.11 0.00 0.00 0.00 0.00 46.02 44.83 3h0g n GLY 739 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3h0g h ILE 740 N -2.29 1.47 0.00 -0.61 -0.00 -1.89 -3.10 117.51 111.09 3h0g h ILE 740 Ca -0.57 -3.15 0.00 0.00 -0.00 0.00 0.00 64.86 61.14 3h0g h ILE 740 Cb 1.36 2.82 0.00 0.00 -0.00 0.00 0.00 36.82 40.99 3h0g h ILE 740 CO 0.42 0.88 -1.45 -0.11 -0.00 0.00 0.00 178.15 177.89 3h0g n LEU 741 N -3.39 0.43 0.00 2.19 0.00 -1.26 -3.86 117.00 111.11 3h0g n LEU 741 Ca -0.07 0.06 0.12 0.00 0.00 0.00 0.00 56.01 56.12 3h0g n LEU 741 Cb 0.99 -0.04 0.27 0.00 0.00 0.00 0.00 43.42 44.65 3h0g n LEU 741 CO 0.49 -0.03 0.49 0.00 0.00 0.00 0.00 177.39 178.34 3h0g n ALA 742 N -2.10 3.40 1.40 1.96 0.00 -1.25 -3.83 120.51 120.10 3h0g n ALA 742 Ca -0.01 -0.32 0.02 0.00 0.00 0.00 0.00 53.44 53.13 3h0g n ALA 742 Cb 0.52 -1.15 0.07 0.00 0.00 0.00 0.00 19.45 18.88 3h0g n ALA 742 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3h0g n SER 743 N -1.55 0.95 -0.58 0.00 7.64 -1.17 -3.07 113.62 115.84 3h0g n SER 743 Ca 0.05 -2.03 0.05 0.00 1.01 0.00 0.00 58.87 57.96 3h0g n SER 743 Cb 0.34 -0.17 0.14 0.00 -1.01 0.00 0.00 64.21 63.52 3h0g n SER 743 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 3h0g n ILE 744 N -0.05 1.03 -3.73 0.44 -5.35 -1.25 -4.78 119.36 105.67 3h0g n ILE 744 Ca 0.05 -1.02 -0.37 0.00 -0.27 0.00 0.00 62.75 61.13 3h0g n ILE 744 Cb 0.17 0.48 -0.12 0.00 -1.74 0.00 0.00 39.64 38.43 3h0g n ILE 744 CO 0.00 0.00 0.00 0.27 -1.76 0.00 0.00 176.55 175.06 3h0g s ILE 745 N -1.04 4.20 0.26 7.28 -4.36 -1.17 -4.94 121.20 121.43 3h0g s ILE 745 Ca 0.21 -0.51 -0.29 0.00 -0.26 0.00 0.00 60.65 59.81 3h0g s ILE 745 Cb 0.11 -3.11 -0.14 0.00 1.25 0.00 0.00 42.46 40.57 3h0g s ILE 745 CO 0.14 0.14 1.03 -2.65 0.24 0.00 0.00 174.94 173.84 3h0g n PRO 746 N 4.91 1.30 -4.06 0.37 -0.02 -1.26 -2.74 135.00 133.50 3h0g n PRO 746 Ca -0.15 0.46 -0.33 0.00 -2.02 0.00 0.00 63.50 61.46 3h0g n PRO 746 Cb 0.49 -1.85 -0.00 0.00 -0.02 0.00 0.00 33.50 32.12 3h0g n PRO 746 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3h0g n PHE 747 N 0.50 -1.99 -0.21 6.00 3.01 -1.16 -4.89 117.46 118.73 3h0g n PHE 747 Ca 0.11 0.83 -0.05 0.00 1.01 0.00 0.00 57.45 59.35 3h0g n PHE 747 Cb 0.30 -3.37 -0.05 0.00 -0.01 0.00 0.00 39.48 36.35 3h0g n PHE 747 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 3h0g n PRO 748 N -4.49 -0.22 -2.06 -1.08 -0.02 -1.11 -2.75 135.00 123.28 3h0g n PRO 748 Ca 0.06 1.25 -0.27 0.00 -2.02 0.00 0.00 63.50 62.52 3h0g n PRO 748 Cb 0.50 -1.85 -0.05 0.00 -0.02 0.00 0.00 33.50 32.08 3h0g n PRO 748 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3h0g s ASP 749 N -4.24 5.12 0.00 2.55 2.15 -1.26 -2.60 116.67 118.39 3h0g s ASP 749 Ca -0.06 -1.00 0.00 0.00 0.43 0.00 0.00 52.55 51.92 3h0g s ASP 749 Cb 0.05 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 40.11 3h0g s ASP 749 CO 0.31 -2.84 0.00 1.57 -0.17 0.00 0.00 175.17 174.03 3h0g n HIS 750 N 14.07 0.00 -2.54 -5.34 -0.00 -1.11 -4.96 115.22 115.34 3h0g n HIS 750 Ca 0.42 0.00 -0.24 0.00 0.46 0.00 0.00 57.72 58.35 3h0g n HIS 750 Cb 0.47 0.00 0.13 0.00 -0.12 0.00 0.00 29.99 30.47 3h0g n HIS 750 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89 3h0g n ASN 751 N 0.00 1.22 -0.03 0.26 3.02 -1.07 -4.38 115.26 114.28 3h0g n ASN 751 Ca 0.00 -2.08 0.16 0.00 -0.03 0.00 0.00 54.58 52.63 3h0g n ASN 751 Cb 0.00 -0.70 0.89 0.00 -0.61 0.00 0.00 39.78 39.36 3h0g n ASN 751 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 3h0g n GLN 752 N -2.99 0.93 0.00 3.52 7.27 -1.22 -4.94 117.38 119.94 3h0g n GLN 752 Ca 0.17 -0.05 0.00 0.00 0.07 0.00 0.00 57.00 57.18 3h0g n GLN 752 Cb 0.60 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.75 3h0g n GLN 752 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 3h0g n SER 753 N -0.99 0.00 -0.35 1.69 2.88 -1.26 -4.66 113.62 110.93 3h0g n SER 753 Ca 0.22 0.00 0.23 0.00 -1.33 0.00 0.00 58.87 57.99 3h0g n SER 753 Cb 0.15 0.00 0.48 0.00 -0.75 0.00 0.00 64.21 64.08 3h0g n SER 753 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3h0g h PRO 754 N 0.00 0.36 -0.15 -1.46 0.11 -1.99 1.34 132.00 130.21 3h0g h PRO 754 Ca 0.00 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 66.00 3h0g h PRO 754 Cb 0.00 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.02 3h0g h PRO 754 CO 0.00 0.24 -0.29 0.00 -0.21 0.00 0.00 178.00 177.74 3h0g h ARG 755 N 0.37 0.30 -0.27 1.05 2.47 -1.89 -3.02 114.38 113.40 3h0g h ARG 755 Ca 0.70 -0.11 -0.00 0.00 -1.26 0.00 0.00 59.98 59.31 3h0g h ARG 755 Cb 1.63 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 29.92 3h0g h ARG 755 CO -0.51 0.57 0.16 -0.91 0.56 0.00 0.00 179.97 179.84 3h0g h ASN 756 N 0.26 0.32 -1.04 7.04 2.35 0.14 -2.08 115.58 122.57 3h0g h ASN 756 Ca 0.04 -0.04 0.27 0.00 -0.55 0.00 0.00 56.30 56.02 3h0g h ASN 756 Cb 0.66 -0.08 -0.08 0.00 0.05 0.00 0.00 38.32 38.86 3h0g h ASN 756 CO 0.05 0.27 0.69 0.00 -1.65 0.00 0.00 177.43 176.78 3h0g h THR 757 N 0.34 0.52 -1.36 2.81 1.03 -1.27 -3.39 112.91 111.59 3h0g h THR 757 Ca 0.10 -0.11 0.00 0.00 -0.01 0.00 0.00 66.41 66.39 3h0g h THR 757 Cb 0.01 0.18 0.00 0.00 -1.07 0.00 0.00 68.15 67.26 3h0g h THR 757 CO -0.02 0.06 0.00 -1.22 -0.01 0.00 0.00 175.52 174.33 3h0g n TYR 758 N -4.53 -2.07 0.00 0.00 4.01 -0.78 -3.92 117.16 109.86 3h0g n TYR 758 Ca 0.24 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.98 3h0g n TYR 758 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.95 3h0g n TYR 758 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 3h0g n GLN 759 N -0.65 0.00 0.15 -0.72 0.00 -1.26 -4.17 117.38 110.73 3h0g n GLN 759 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.00 56.87 3h0g n GLN 759 Cb 0.00 -0.12 -0.08 0.00 0.00 0.00 0.00 30.24 30.04 3h0g n GLN 759 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.06 177.83 3h0g h SER 760 N 0.00 -0.34 -0.35 1.69 0.02 -1.76 4.20 113.55 117.01 3h0g h SER 760 Ca 0.00 -0.17 -0.09 0.00 -0.84 0.00 0.00 61.79 60.68 3h0g h SER 760 Cb 0.00 0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 3h0g h SER 760 CO 0.00 0.02 -0.10 0.00 -1.14 0.00 0.00 176.83 175.60 3h0g h ALA 761 N -0.15 1.00 0.08 3.77 0.00 -1.72 -2.89 119.26 119.33 3h0g h ALA 761 Ca -0.04 -0.31 -0.25 0.00 0.00 0.00 0.00 54.91 54.31 3h0g h ALA 761 Cb 0.49 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3h0g h ALA 761 CO 0.07 0.60 -1.11 0.52 0.00 0.00 0.00 179.25 179.33 3h0g h MET 762 N 0.71 0.30 -0.72 0.00 2.86 -1.85 -3.30 114.93 112.92 3h0g h MET 762 Ca 0.12 -0.42 0.16 0.00 -2.06 0.00 0.00 59.70 57.50 3h0g h MET 762 Cb 0.58 0.14 -0.12 0.00 0.06 0.00 0.00 31.60 32.27 3h0g h MET 762 CO 0.04 1.15 0.10 0.78 1.06 0.00 0.00 176.91 180.04 3h0g h GLY 763 N 1.54 0.91 1.07 8.32 0.00 0.84 0.87 103.07 116.62 3h0g h GLY 763 Ca -0.11 0.03 0.09 0.00 0.00 0.00 0.00 47.33 47.34 3h0g h GLY 763 CO 0.18 -0.23 0.38 0.50 0.00 0.00 0.00 176.54 177.37 3h0g h LYS 764 N 0.19 0.00 -0.72 4.80 1.57 -1.61 0.99 116.57 121.79 3h0g h LYS 764 Ca 0.40 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.18 3h0g h LYS 764 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.00 3h0g h LYS 764 CO -0.56 0.00 0.00 1.04 -0.57 0.00 0.00 179.45 179.36 3h0g n GLN 765 N -3.59 3.33 0.00 3.15 6.02 0.30 -4.11 117.38 122.48 3h0g n GLN 765 Ca 0.05 -1.94 0.00 0.00 -0.01 0.00 0.00 57.00 55.10 3h0g n GLN 765 Cb 0.52 -1.93 0.00 0.00 1.02 0.00 0.00 30.24 29.85 3h0g n GLN 765 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3h0g n ALA 766 N 0.43 0.00 -3.05 -1.58 0.00 0.34 -1.64 120.51 115.01 3h0g n ALA 766 Ca 0.17 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.49 3h0g n ALA 766 Cb 0.81 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 20.13 3h0g n ALA 766 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 3h0g s MET 767 N -2.11 0.14 0.00 0.00 1.75 -1.01 -4.36 119.30 113.71 3h0g s MET 767 Ca 0.00 0.19 0.00 0.00 -1.25 0.00 0.00 55.69 54.63 3h0g s MET 767 Cb 0.00 0.06 0.00 0.00 2.84 0.00 0.00 34.83 37.73 3h0g s MET 767 CO 0.00 -0.03 0.00 0.41 -0.65 0.00 0.00 175.02 174.75 3h0g n GLY 768 N 3.09 -0.67 3.68 2.11 0.00 -1.26 -4.51 105.19 107.63 3h0g n GLY 768 Ca -0.13 -0.92 -0.39 0.00 0.00 0.00 0.00 46.02 44.58 3h0g n GLY 768 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h0g s VAL 769 N -3.00 5.08 -0.10 1.61 1.01 -1.25 -4.03 120.40 119.72 3h0g s VAL 769 Ca 0.00 1.12 0.21 0.00 0.00 0.00 0.00 61.98 63.31 3h0g s VAL 769 Cb 0.00 -3.91 -0.26 0.00 0.00 0.00 0.00 36.38 32.21 3h0g s VAL 769 CO 0.00 0.19 0.52 0.00 0.00 0.00 0.00 175.10 175.81 3h0g n TYR 770 N 4.50 0.23 -3.64 5.22 0.18 -1.26 -4.31 117.16 118.08 3h0g n TYR 770 Ca -0.03 0.07 -0.06 0.00 1.88 0.00 0.00 57.90 59.76 3h0g n TYR 770 Cb 0.50 -0.70 -0.07 0.00 -0.38 0.00 0.00 39.34 38.69 3h0g n TYR 770 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3h0g s LEU 771 N -4.91 -0.77 0.59 -3.48 1.43 -1.26 -4.43 118.68 105.84 3h0g s LEU 771 Ca -0.07 1.25 0.27 0.00 -1.03 0.00 0.00 54.13 54.55 3h0g s LEU 771 Cb 0.12 2.16 1.47 0.00 0.03 0.00 0.00 46.19 49.96 3h0g s LEU 771 CO 0.87 -0.20 1.81 0.00 0.23 0.00 0.00 176.35 179.06 3h0g h THR 772 N 4.89 0.00 -1.04 5.49 1.03 -1.94 -2.58 112.91 118.77 3h0g h THR 772 Ca -0.29 0.00 -0.59 0.00 -0.01 0.00 0.00 66.41 65.52 3h0g h THR 772 Cb 1.21 0.60 -0.40 0.00 -1.07 0.00 0.00 68.15 68.49 3h0g h THR 772 CO 0.16 0.00 -0.45 -0.46 -0.01 0.00 0.00 175.52 174.76 3h0g n ASN 773 N -2.72 5.42 0.16 0.00 0.23 -1.26 -4.66 115.26 112.43 3h0g n ASN 773 Ca -0.02 -3.75 0.02 0.00 -0.53 0.00 0.00 54.58 50.30 3h0g n ASN 773 Cb 0.35 -0.50 0.26 0.00 -2.08 0.00 0.00 39.78 37.81 3h0g n ASN 773 CO 0.00 0.00 0.00 0.10 -0.93 0.00 0.00 177.26 176.43 3h0g h TYR 774 N 2.30 0.00 0.00 -2.53 -0.00 -1.80 -2.85 116.97 112.08 3h0g h TYR 774 Ca 0.40 0.00 -0.03 0.00 0.00 0.00 0.00 58.73 59.10 3h0g h TYR 774 Cb 1.21 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.93 3h0g h TYR 774 CO 0.94 0.49 -0.12 1.96 -0.00 0.00 0.00 178.16 181.44 3h0g h GLN 775 N 0.00 0.00 0.05 0.10 4.20 -1.87 -3.00 115.11 114.60 3h0g h GLN 775 Ca -0.00 0.00 -0.38 0.00 0.06 0.00 0.00 58.65 58.33 3h0g h GLN 775 Cb 0.97 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.70 3h0g h GLN 775 CO 0.06 0.12 -2.24 1.55 -0.67 0.00 0.00 178.83 177.65 3h0g n VAL 776 N -4.23 1.62 -1.84 -0.54 3.14 -1.15 -4.82 118.33 110.51 3h0g n VAL 776 Ca -0.03 -0.63 -0.43 0.00 -2.96 0.00 0.00 64.34 60.30 3h0g n VAL 776 Cb 0.20 -1.50 -0.03 0.00 -1.06 0.00 0.00 33.84 31.45 3h0g n VAL 776 CO 0.00 0.00 0.00 -0.60 -6.46 0.00 0.00 176.83 169.77 3h0g s ARG 777 N -2.54 3.52 -0.06 1.45 3.52 -1.09 -4.97 118.95 118.79 3h0g s ARG 777 Ca -0.27 1.89 -0.30 0.00 -0.13 0.00 0.00 55.73 56.92 3h0g s ARG 777 Cb 0.08 -4.21 -0.03 0.00 -1.56 0.00 0.00 34.95 29.23 3h0g s ARG 777 CO 0.69 -1.64 1.23 1.41 -0.81 0.00 0.00 175.30 176.17 3h0g s MET 778 N 5.43 4.33 -0.25 5.12 -2.45 -1.26 -4.89 119.30 125.33 3h0g s MET 778 Ca 0.86 1.70 -0.17 0.00 -1.25 0.00 0.00 55.69 56.83 3h0g s MET 778 Cb -0.30 -3.58 0.07 0.00 1.25 0.00 0.00 34.83 32.27 3h0g s MET 778 CO 0.34 -0.49 0.64 0.34 1.05 0.00 0.00 175.02 176.90 3h0g s ASP 779 N 1.57 -0.81 0.35 1.11 3.68 -1.26 -4.94 116.67 116.37 3h0g s ASP 779 Ca 0.56 1.37 -0.26 0.00 2.13 0.00 0.00 52.55 56.35 3h0g s ASP 779 Cb -0.25 1.28 -0.09 0.00 -1.45 0.00 0.00 42.92 42.41 3h0g s ASP 779 CO 0.22 -0.23 1.08 0.28 0.13 0.00 0.00 175.17 176.65 3h0g s THR 780 N 1.25 3.56 -0.10 1.71 -1.32 -1.26 -4.31 115.64 115.16 3h0g s THR 780 Ca -0.07 1.36 -0.01 0.00 -1.21 0.00 0.00 61.69 61.75 3h0g s THR 780 Cb -0.05 -3.78 0.00 0.00 -1.51 0.00 0.00 72.50 67.16 3h0g s THR 780 CO -0.13 0.17 0.03 0.23 -2.21 0.00 0.00 174.62 172.70 3h0g n MET 781 N 0.48 -1.76 -4.44 7.08 2.81 -1.17 -4.91 117.12 115.21 3h0g n MET 781 Ca 0.02 1.67 -0.20 0.00 -1.81 0.00 0.00 57.70 57.38 3h0g n MET 781 Cb 0.47 -2.57 -0.14 0.00 -0.71 0.00 0.00 33.22 30.27 3h0g n MET 781 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3h0g s ALA 782 N -0.97 1.07 -0.17 3.04 0.00 -0.33 -4.99 121.76 119.41 3h0g s ALA 782 Ca -0.03 -0.66 -0.01 0.00 0.00 0.00 0.00 51.96 51.26 3h0g s ALA 782 Cb 0.00 -0.22 0.05 0.00 0.00 0.00 0.00 23.12 22.95 3h0g s ALA 782 CO 0.29 0.23 -0.02 -0.80 0.00 0.00 0.00 175.76 175.47 3h0g s ASN 783 N -0.70 2.78 0.45 0.00 0.01 -1.26 -1.56 114.94 114.66 3h0g s ASN 783 Ca 0.03 -0.68 0.05 0.00 -0.71 0.00 0.00 52.86 51.55 3h0g s ASN 783 Cb -0.06 -0.77 -0.05 0.00 0.41 0.00 0.00 41.25 40.78 3h0g s ASN 783 CO 0.00 -0.23 0.08 0.27 -1.51 0.00 0.00 177.10 175.72 3h0g s ILE 784 N 1.73 1.84 -0.14 0.60 -4.36 -1.20 -3.99 121.20 115.68 3h0g s ILE 784 Ca 0.00 -1.88 -0.03 0.00 -0.26 0.00 0.00 60.65 58.48 3h0g s ILE 784 Cb -0.16 -2.72 -0.03 0.00 1.25 0.00 0.00 42.46 40.81 3h0g s ILE 784 CO -0.07 0.00 -0.04 -0.76 0.24 0.00 0.00 174.94 174.31 3h0g s LEU 785 N -3.85 3.26 0.17 0.37 2.01 -1.26 -2.75 118.68 116.63 3h0g s LEU 785 Ca 0.29 -0.09 -0.15 0.00 0.01 0.00 0.00 54.13 54.19 3h0g s LEU 785 Cb 0.05 -1.77 0.10 0.00 0.01 0.00 0.00 46.19 44.58 3h0g s LEU 785 CO 0.16 0.21 1.75 1.88 1.01 0.00 0.00 176.35 181.36 3h0g h TYR 786 N 6.38 0.27 -2.61 0.29 0.99 -1.63 -3.40 116.97 117.27 3h0g h TYR 786 Ca -0.35 0.02 -0.56 0.00 2.00 0.00 0.00 58.73 59.84 3h0g h TYR 786 Cb 1.19 -0.06 -0.39 0.00 1.00 0.00 0.00 36.73 38.47 3h0g h TYR 786 CO 0.54 0.11 -0.82 0.71 -0.00 0.00 0.00 178.16 178.69 3h0g s TYR 787 N -6.15 0.56 0.53 4.88 1.51 -1.26 -5.10 117.35 112.31 3h0g s TYR 787 Ca -0.13 -1.38 -0.13 0.00 -1.01 0.00 0.00 57.07 54.42 3h0g s TYR 787 Cb 0.13 -0.88 -0.06 0.00 -0.11 0.00 0.00 41.96 41.04 3h0g s TYR 787 CO 0.72 -0.84 0.95 -2.14 -1.11 0.00 0.00 175.55 173.14 3h0g s PRO 788 N 1.38 3.80 0.01 -1.71 0.02 -1.26 -4.90 135.00 132.33 3h0g s PRO 788 Ca 0.15 0.77 -0.07 0.00 0.02 0.00 0.00 61.00 61.88 3h0g s PRO 788 Cb -0.21 -2.18 -0.00 0.00 0.02 0.00 0.00 34.50 32.14 3h0g s PRO 788 CO -0.10 -0.32 0.13 -0.65 -0.33 0.00 0.00 177.00 175.73 3h0g s GLN 789 N -4.40 0.48 0.14 5.54 -0.21 -1.18 -5.00 119.66 115.03 3h0g s GLN 789 Ca 0.56 -0.42 -0.31 0.00 0.02 0.00 0.00 55.36 55.20 3h0g s GLN 789 Cb -0.10 0.20 -0.09 0.00 1.00 0.00 0.00 33.01 34.01 3h0g s GLN 789 CO 0.39 -0.11 1.56 0.15 -2.12 0.00 0.00 175.29 175.16 3h0g s LYS 790 N -1.42 4.22 0.00 2.91 1.02 -1.26 -4.40 119.74 120.82 3h0g s LYS 790 Ca -0.15 2.32 0.00 0.00 0.02 0.00 0.00 55.97 58.16 3h0g s LYS 790 Cb -0.08 -3.25 0.00 0.00 -0.52 0.00 0.00 37.83 33.98 3h0g s LYS 790 CO 0.01 -0.61 0.00 -2.30 -0.92 0.00 0.00 175.35 171.53 3h0g n PRO 791 N 4.30 0.00 0.00 -1.68 -0.02 -1.26 -4.79 135.00 131.55 3h0g n PRO 791 Ca 0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 3h0g n PRO 791 Cb 0.39 -0.85 0.00 0.00 -0.02 0.00 0.00 33.50 33.02 3h0g n PRO 791 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3h0g n LEU 792 N -0.02 0.00 -4.34 2.45 4.77 -1.26 -4.02 117.00 114.58 3h0g n LEU 792 Ca 0.00 0.00 -0.46 0.00 -0.03 0.00 0.00 56.01 55.52 3h0g n LEU 792 Cb 0.00 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 3h0g n LEU 792 CO 0.00 0.00 0.30 0.00 -1.33 0.00 0.00 177.39 176.36 3h0g s ALA 793 N -1.00 3.59 0.20 -1.18 0.00 -1.26 -3.55 121.76 118.55 3h0g s ALA 793 Ca 0.00 -2.50 0.08 0.00 0.00 0.00 0.00 51.96 49.55 3h0g s ALA 793 Cb 0.00 -3.42 -0.05 0.00 0.00 0.00 0.00 23.12 19.66 3h0g s ALA 793 CO 0.00 -2.20 -0.16 -0.08 0.00 0.00 0.00 175.76 173.31 3h0g s THR 794 N 1.92 1.85 0.32 0.00 -1.32 -1.04 -4.71 115.64 112.67 3h0g s THR 794 Ca 0.09 -2.13 -0.15 0.00 -1.21 0.00 0.00 61.69 58.28 3h0g s THR 794 Cb -0.25 -2.00 -0.09 0.00 -1.51 0.00 0.00 72.50 68.65 3h0g s THR 794 CO 0.03 -0.47 0.74 0.28 -2.21 0.00 0.00 174.62 172.98 3h0g s THR 795 N -2.59 4.67 0.00 5.08 -1.32 -1.26 0.61 115.64 120.83 3h0g s THR 795 Ca 0.21 0.96 0.00 0.00 -1.21 0.00 0.00 61.69 61.65 3h0g s THR 795 Cb -0.03 -3.62 0.00 0.00 -1.51 0.00 0.00 72.50 67.34 3h0g s THR 795 CO 0.08 -0.17 1.19 -1.14 -2.21 0.00 0.00 174.62 172.37 3h0g n ARG 796 N -0.33 0.64 -1.21 7.08 0.63 -1.26 -3.20 116.66 119.02 3h0g n ARG 796 Ca 0.03 0.00 0.04 0.00 -0.92 0.00 0.00 57.85 57.00 3h0g n ARG 796 Cb 0.53 -1.18 0.04 0.00 0.45 0.00 0.00 32.46 32.30 3h0g n ARG 796 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 3h0g n SER 797 N 1.53 0.97 -0.03 6.15 3.41 -1.26 -4.78 113.62 119.61 3h0g n SER 797 Ca 0.00 -2.25 -0.02 0.00 -0.26 0.00 0.00 58.87 56.34 3h0g n SER 797 Cb 0.32 -0.32 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 3h0g n SER 797 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3h0g n MET 798 N 0.19 2.14 -0.52 4.33 2.81 -1.19 -4.17 117.12 120.70 3h0g n MET 798 Ca 0.07 -0.02 0.44 0.00 -1.81 0.00 0.00 57.70 56.38 3h0g n MET 798 Cb 1.02 -1.20 0.79 0.00 -0.71 0.00 0.00 33.22 33.12 3h0g n MET 798 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 3h0g h GLU 799 N 0.00 0.00 0.09 0.03 4.81 -1.86 0.55 114.58 118.20 3h0g h GLU 799 Ca -0.16 0.00 -0.35 0.00 -0.13 0.00 0.00 59.36 58.73 3h0g h GLU 799 Cb 1.20 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.55 3h0g h GLU 799 CO 0.01 0.00 -1.94 0.66 -0.73 0.00 0.00 179.01 177.01 3h0g n TYR 800 N -4.03 1.16 1.38 0.92 0.53 -1.26 -3.79 117.16 112.06 3h0g n TYR 800 Ca 0.35 0.28 0.00 0.00 -1.02 0.00 0.00 57.90 57.52 3h0g n TYR 800 Cb 1.65 -1.17 0.00 0.00 -1.03 0.00 0.00 39.34 38.79 3h0g n TYR 800 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 3h0g n LEU 801 N -3.35 0.28 -3.24 7.72 4.77 0.18 -4.82 117.00 118.54 3h0g n LEU 801 Ca -0.28 -0.14 -0.17 0.00 -0.03 0.00 0.00 56.01 55.39 3h0g n LEU 801 Cb 1.05 -0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.97 3h0g n LEU 801 CO 0.43 0.07 -0.06 0.29 -1.33 0.00 0.00 177.39 176.79 3h0g n LYS 802 N -0.30 -2.30 0.11 3.23 4.76 -0.35 -4.79 118.16 118.52 3h0g n LYS 802 Ca 0.00 0.13 -0.24 0.00 -2.87 0.00 0.00 58.31 55.33 3h0g n LYS 802 Cb 0.07 -4.68 -0.15 0.00 -1.84 0.00 0.00 35.03 28.43 3h0g n LYS 802 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 3h0g h PHE 803 N -0.39 0.86 0.00 2.13 3.57 -1.84 -3.15 116.94 118.12 3h0g h PHE 803 Ca -0.25 -0.63 0.00 0.00 3.53 0.00 0.00 57.97 60.62 3h0g h PHE 803 Cb 1.17 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.87 3h0g h PHE 803 CO 0.80 1.56 0.00 0.00 -2.23 0.00 0.00 178.31 178.44 3h0g h ARG 804 N 0.05 0.00 0.00 1.11 3.08 -1.87 -2.39 114.38 114.36 3h0g h ARG 804 Ca -0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.79 3h0g h ARG 804 Cb 2.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.12 3h0g h ARG 804 CO 0.23 0.00 -1.16 0.39 -1.07 0.00 0.00 179.97 178.36 3h0g n GLU 805 N -2.39 0.53 -3.02 0.04 4.71 -1.19 -4.48 120.64 114.85 3h0g n GLU 805 Ca -0.01 0.04 -0.15 0.00 -0.01 0.00 0.00 57.16 57.02 3h0g n GLU 805 Cb 0.05 -1.72 0.01 0.00 -1.01 0.00 0.00 31.44 28.77 3h0g n GLU 805 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 3h0g n LEU 806 N -2.42 -0.53 -4.74 -4.62 4.77 -0.93 -5.09 117.00 103.44 3h0g n LEU 806 Ca -0.00 -4.43 -0.37 0.00 -0.03 0.00 0.00 56.01 51.18 3h0g n LEU 806 Cb 0.52 0.78 0.06 0.00 -2.33 0.00 0.00 43.42 42.46 3h0g n LEU 806 CO 0.41 2.17 0.93 -2.84 -1.33 0.00 0.00 177.39 176.73 3h0g s PRO 807 N -1.17 2.70 0.01 3.23 0.02 -1.05 -4.59 135.00 134.14 3h0g s PRO 807 Ca 0.33 2.13 0.22 0.00 0.02 0.00 0.00 61.00 63.70 3h0g s PRO 807 Cb 0.29 -1.96 -0.27 0.00 0.02 0.00 0.00 34.50 32.59 3h0g s PRO 807 CO -0.09 -1.50 0.57 0.00 -0.33 0.00 0.00 177.00 175.65 3h0g n ALA 808 N -1.67 2.65 -1.97 -1.55 0.00 -1.26 -3.86 120.51 112.85 3h0g n ALA 808 Ca 0.14 -0.51 -0.27 0.00 0.00 0.00 0.00 53.44 52.80 3h0g n ALA 808 Cb 0.47 -0.79 0.17 0.00 0.00 0.00 0.00 19.45 19.30 3h0g n ALA 808 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3h0g s GLY 809 N -4.56 1.79 -0.30 0.00 0.00 -1.26 -4.43 107.32 98.57 3h0g s GLY 809 Ca -0.07 -1.58 -0.13 0.00 0.00 0.00 0.00 44.72 42.94 3h0g s GLY 809 CO 0.88 -0.84 0.87 1.62 0.00 0.00 0.00 173.10 175.63 3h0g s GLN 810 N -5.60 0.40 -0.07 2.90 0.74 -1.19 -3.12 119.66 113.71 3h0g s GLN 810 Ca 0.73 0.97 -0.30 0.00 0.05 0.00 0.00 55.36 56.81 3h0g s GLN 810 Cb -0.03 0.55 -0.02 0.00 1.10 0.00 0.00 33.01 34.61 3h0g s GLN 810 CO 0.50 -0.13 1.03 -0.80 -0.55 0.00 0.00 175.29 175.33 3h0g s ASN 811 N 2.51 7.25 -0.14 6.67 0.02 -1.26 -2.29 114.94 127.70 3h0g s ASN 811 Ca -0.04 1.60 -0.00 0.00 -1.02 0.00 0.00 52.86 53.40 3h0g s ASN 811 Cb -0.08 -2.56 0.03 0.00 0.02 0.00 0.00 41.25 38.67 3h0g s ASN 811 CO -0.18 -0.42 -0.07 0.00 0.02 0.00 0.00 177.10 176.45 3h0g s ALA 812 N 1.80 1.43 -0.82 0.60 0.00 1.00 -4.89 121.76 120.88 3h0g s ALA 812 Ca 0.50 -0.70 -0.22 0.00 0.00 0.00 0.00 51.96 51.54 3h0g s ALA 812 Cb -0.20 -1.02 -0.19 0.00 0.00 0.00 0.00 23.12 21.72 3h0g s ALA 812 CO 0.21 -0.59 2.37 -0.89 0.00 0.00 0.00 175.76 176.86 3h0g n ILE 813 N 4.90 -0.01 -3.39 0.00 2.08 -1.26 -2.09 119.36 119.59 3h0g n ILE 813 Ca -0.12 -0.51 -0.32 0.00 0.56 0.00 0.00 62.75 62.35 3h0g n ILE 813 Cb 0.49 -1.52 -0.05 0.00 -0.75 0.00 0.00 39.64 37.80 3h0g n ILE 813 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 3h0g s VAL 814 N 10.61 4.91 -0.12 1.39 1.01 -1.25 0.10 120.40 137.06 3h0g s VAL 814 Ca 1.05 0.55 -0.04 0.00 0.00 0.00 0.00 61.98 63.55 3h0g s VAL 814 Cb -0.37 -3.63 0.05 0.00 0.00 0.00 0.00 36.38 32.43 3h0g s VAL 814 CO 0.24 -0.03 0.11 0.00 0.00 0.00 0.00 175.10 175.42 3h0g s ALA 815 N -1.77 0.18 -0.75 5.51 0.00 -0.81 -0.89 121.76 123.24 3h0g s ALA 815 Ca 0.46 0.07 -0.26 0.00 0.00 0.00 0.00 51.96 52.24 3h0g s ALA 815 Cb -0.12 -0.89 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 3h0g s ALA 815 CO 0.21 -0.85 1.69 0.42 0.00 0.00 0.00 175.76 177.23 3h0g s ILE 816 N 2.20 3.52 0.07 0.00 1.01 -0.95 -3.18 121.20 123.87 3h0g s ILE 816 Ca 0.04 0.03 0.05 0.00 0.00 0.00 0.00 60.65 60.77 3h0g s ILE 816 Cb -0.14 -4.31 -0.03 0.00 0.01 0.00 0.00 42.46 37.99 3h0g s ILE 816 CO -0.07 -1.26 -0.14 -0.22 0.00 0.00 0.00 174.94 173.26 3h0g s LEU 817 N 8.02 2.27 -0.67 2.97 0.20 -0.75 -4.26 118.68 126.46 3h0g s LEU 817 Ca 0.58 -0.59 -0.18 0.00 0.69 0.00 0.00 54.13 54.62 3h0g s LEU 817 Cb -0.09 -0.49 0.13 0.00 -0.43 0.00 0.00 46.19 45.31 3h0g s LEU 817 CO 0.12 -0.08 0.77 0.00 -0.29 0.00 0.00 176.35 176.86 3h0g s TYR 819 N 2.25 -0.49 0.00 0.00 5.04 -1.26 -4.99 117.35 117.90 3h0g s TYR 819 Ca 0.15 0.31 0.00 0.00 -2.44 0.00 0.00 57.07 55.09 3h0g s TYR 819 Cb -0.20 -0.27 0.00 0.00 0.35 0.00 0.00 41.96 41.85 3h0g s TYR 819 CO 0.02 -0.72 0.00 0.45 -1.34 0.00 0.00 175.55 173.96 3h0g n SER 820 N 5.33 0.00 0.00 4.32 2.88 -1.26 -4.56 113.62 120.33 3h0g n SER 820 Ca -0.04 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.50 3h0g n SER 820 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 3h0g n SER 820 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3h0g n GLY 821 N 0.00 0.00 0.11 0.46 0.00 -1.26 -5.01 105.19 99.50 3h0g n GLY 821 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 3h0g n GLY 821 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3h0g h TYR 822 N 0.00 0.00 -1.97 1.61 0.05 -1.94 -3.36 116.97 111.36 3h0g h TYR 822 Ca 0.00 0.00 -0.79 0.00 0.05 0.00 0.00 58.73 57.99 3h0g h TYR 822 Cb 0.00 0.00 -0.22 0.00 1.01 0.00 0.00 36.73 37.52 3h0g h TYR 822 CO 0.00 0.00 1.48 0.27 -1.05 0.00 0.00 178.16 178.86 3h0g n ASN 823 N -2.56 7.21 -4.79 3.88 6.94 -1.26 -4.38 115.26 120.30 3h0g n ASN 823 Ca 0.01 -3.44 -0.23 0.00 -0.02 0.00 0.00 54.58 50.91 3h0g n ASN 823 Cb 0.51 -1.27 -0.05 0.00 -2.36 0.00 0.00 39.78 36.61 3h0g n ASN 823 CO 0.00 0.00 0.00 -1.58 -1.03 0.00 0.00 177.26 174.65 3h0g s GLN 824 N -2.76 2.40 -0.01 -3.83 0.74 -1.23 -4.16 119.66 110.80 3h0g s GLN 824 Ca 0.42 -1.63 -0.01 0.00 0.05 0.00 0.00 55.36 54.19 3h0g s GLN 824 Cb 0.16 -2.19 0.00 0.00 1.10 0.00 0.00 33.01 32.08 3h0g s GLN 824 CO -0.07 -0.06 0.02 -1.91 -0.55 0.00 0.00 175.29 172.72 3h0g n GLU 825 N -1.32 -0.08 -3.65 1.67 2.13 -1.26 -1.08 120.64 117.05 3h0g n GLU 825 Ca -0.00 0.08 -0.24 0.00 0.66 0.00 0.00 57.16 57.66 3h0g n GLU 825 Cb 0.62 -0.11 0.02 0.00 0.27 0.00 0.00 31.44 32.24 3h0g n GLU 825 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3h0g n ASP 826 N 1.25 -5.51 -3.50 4.31 9.92 -1.26 -5.00 116.55 116.76 3h0g n ASP 826 Ca -0.00 -0.84 -0.14 0.00 -0.53 0.00 0.00 54.79 53.27 3h0g n ASP 826 Cb 0.05 -2.89 -0.04 0.00 -0.64 0.00 0.00 41.12 37.59 3h0g n ASP 826 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 3h0g s SER 827 N -3.19 -0.56 0.08 -2.24 0.15 -0.24 -4.27 113.70 103.43 3h0g s SER 827 Ca 0.20 0.40 0.05 0.00 0.70 0.00 0.00 55.95 57.30 3h0g s SER 827 Cb -0.08 0.50 -0.03 0.00 -1.71 0.00 0.00 66.02 64.70 3h0g s SER 827 CO 0.87 -0.67 -0.13 0.27 1.20 0.00 0.00 173.24 174.78 3h0g s ILE 828 N -2.08 1.08 -0.13 6.45 -4.36 0.13 -3.55 121.20 118.74 3h0g s ILE 828 Ca -0.05 -1.43 0.01 0.00 -0.26 0.00 0.00 60.65 58.92 3h0g s ILE 828 Cb -0.00 -1.18 -0.01 0.00 1.25 0.00 0.00 42.46 42.52 3h0g s ILE 828 CO 0.01 -0.34 -0.16 0.27 0.24 0.00 0.00 174.94 174.96 3h0g s ILE 829 N -1.67 2.73 0.14 8.37 -4.36 -1.18 -0.08 121.20 125.14 3h0g s ILE 829 Ca 0.01 -0.77 0.07 0.00 -0.26 0.00 0.00 60.65 59.70 3h0g s ILE 829 Cb -0.08 -2.13 -0.04 0.00 1.25 0.00 0.00 42.46 41.46 3h0g s ILE 829 CO 0.02 0.53 -0.03 -0.32 0.24 0.00 0.00 174.94 175.37 3h0g s MET 830 N 0.54 2.33 -0.25 0.37 1.75 -0.95 -1.37 119.30 121.72 3h0g s MET 830 Ca -0.10 -1.04 -0.29 0.00 -1.25 0.00 0.00 55.69 53.01 3h0g s MET 830 Cb -0.16 -2.37 0.00 0.00 2.84 0.00 0.00 34.83 35.15 3h0g s MET 830 CO 0.04 0.49 1.14 1.21 -0.65 0.00 0.00 175.02 177.24 3h0g s ASN 831 N -2.60 6.96 0.27 1.11 3.04 0.48 -3.17 114.94 121.03 3h0g s ASN 831 Ca 0.25 1.35 -0.03 0.00 0.04 0.00 0.00 52.86 54.47 3h0g s ASN 831 Cb -0.10 -2.54 0.35 0.00 -1.54 0.00 0.00 41.25 37.42 3h0g s ASN 831 CO 0.17 -0.80 1.85 -0.61 -3.04 0.00 0.00 177.10 174.67 3h0g h GLN 832 N 8.04 1.00 -1.01 0.43 5.75 -1.16 -2.31 115.11 125.85 3h0g h GLN 832 Ca -0.22 -0.15 0.21 0.00 -0.15 0.00 0.00 58.65 58.34 3h0g h GLN 832 Cb 1.08 -0.18 -0.11 0.00 1.07 0.00 0.00 27.48 29.34 3h0g h GLN 832 CO 1.00 0.80 0.61 0.00 -2.65 0.00 0.00 178.83 178.58 3h0g h ALA 833 N 1.34 1.72 0.12 3.38 0.00 -1.89 -0.74 119.26 123.18 3h0g h ALA 833 Ca 0.23 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 3h0g h ALA 833 Cb 0.16 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3h0g h ALA 833 CO -0.02 -0.13 -0.06 0.77 0.00 0.00 0.00 179.25 179.81 3h0g h SER 834 N 0.70 -0.13 0.00 0.00 0.02 -1.81 -3.01 113.55 109.32 3h0g h SER 834 Ca 0.60 -0.42 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 3h0g h SER 834 Cb 1.02 0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.59 3h0g h SER 834 CO -0.42 0.47 0.10 0.16 -1.14 0.00 0.00 176.83 176.01 3h0g h ILE 835 N -0.87 0.00 0.00 3.27 3.07 -1.10 0.68 117.51 122.57 3h0g h ILE 835 Ca -0.02 0.00 -0.03 0.00 1.55 0.00 0.00 64.86 66.36 3h0g h ILE 835 Cb 0.55 0.73 -0.00 0.00 -0.27 0.00 0.00 36.82 37.83 3h0g h ILE 835 CO 0.03 0.00 -0.16 0.44 -1.05 0.00 0.00 178.15 177.40 3h0g h ASP 836 N 0.00 0.00 0.00 2.16 3.32 -1.02 -3.22 116.42 117.66 3h0g h ASP 836 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3h0g h ASP 836 Cb 0.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.75 3h0g h ASP 836 CO 0.00 0.16 -0.77 0.54 -1.72 0.00 0.00 179.24 177.45 3h0g n ARG 837 N -3.15 1.84 0.00 3.56 1.74 0.23 -4.95 116.66 115.92 3h0g n ARG 837 Ca 0.03 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.10 3h0g n ARG 837 Cb 0.57 -1.24 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 3h0g n ARG 837 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h0g n GLY 838 N 1.37 0.13 3.68 -0.13 0.00 -0.52 -5.09 105.19 104.64 3h0g n GLY 838 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 3h0g n GLY 838 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h0g n LEU 839 N 0.00 3.29 -3.61 0.99 4.77 -1.00 -2.69 117.00 118.75 3h0g n LEU 839 Ca 0.00 1.20 -0.19 0.00 -0.03 0.00 0.00 56.01 56.99 3h0g n LEU 839 Cb 0.00 -1.46 -0.04 0.00 -2.33 0.00 0.00 43.42 39.59 3h0g n LEU 839 CO 0.00 -0.61 -0.24 0.49 -1.33 0.00 0.00 177.39 175.71 3h0g n PHE 840 N 0.41 -0.73 -3.26 -1.77 3.01 -1.26 -4.72 117.46 109.15 3h0g n PHE 840 Ca 0.06 0.28 -0.38 0.00 1.01 0.00 0.00 57.45 58.42 3h0g n PHE 840 Cb 0.35 -1.58 -0.06 0.00 -0.01 0.00 0.00 39.48 38.18 3h0g n PHE 840 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 3h0g s ARG 841 N -5.67 4.30 0.23 -1.08 0.52 -1.10 -4.24 118.95 111.92 3h0g s ARG 841 Ca 0.05 0.60 0.05 0.00 -0.52 0.00 0.00 55.73 55.91 3h0g s ARG 841 Cb -0.03 -3.38 -0.05 0.00 0.52 0.00 0.00 34.95 32.00 3h0g s ARG 841 CO 0.57 0.28 -0.05 -1.54 0.02 0.00 0.00 175.30 174.58 3h0g s SER 842 N 0.18 2.21 0.17 0.23 1.04 -0.34 -1.48 113.70 115.71 3h0g s SER 842 Ca 0.29 -1.17 0.07 0.00 0.48 0.00 0.00 55.95 55.62 3h0g s SER 842 Cb -0.17 -0.07 -0.04 0.00 0.10 0.00 0.00 66.02 65.85 3h0g s SER 842 CO 0.14 -0.40 0.01 -0.63 0.98 0.00 0.00 173.24 173.33 3h0g s ILE 843 N -3.23 3.76 -0.47 -1.02 1.01 -1.11 0.13 121.20 120.27 3h0g s ILE 843 Ca 0.27 -1.41 0.04 0.00 0.00 0.00 0.00 60.65 59.54 3h0g s ILE 843 Cb 0.04 -2.90 0.16 0.00 0.01 0.00 0.00 42.46 39.78 3h0g s ILE 843 CO 0.09 -0.11 0.35 0.12 0.00 0.00 0.00 174.94 175.38 3h0g s PHE 844 N -1.74 1.67 0.20 3.97 2.19 -1.15 -3.23 117.98 119.89 3h0g s PHE 844 Ca 0.28 -2.48 -0.30 0.00 0.33 0.00 0.00 56.93 54.76 3h0g s PHE 844 Cb -0.09 -1.40 -0.08 0.00 -1.31 0.00 0.00 43.02 40.13 3h0g s PHE 844 CO 0.19 -0.76 1.14 0.71 1.83 0.00 0.00 175.22 178.32 3h0g s TYR 845 N -0.12 3.52 0.07 10.12 1.51 -0.60 -3.66 117.35 128.19 3h0g s TYR 845 Ca 0.28 1.55 0.06 0.00 -1.01 0.00 0.00 57.07 57.94 3h0g s TYR 845 Cb -0.04 -3.34 -0.03 0.00 -0.11 0.00 0.00 41.96 38.45 3h0g s TYR 845 CO -0.15 -0.83 -0.15 0.50 -1.11 0.00 0.00 175.55 173.81 3h0g s ARG 846 N -0.51 0.91 -0.03 -0.62 3.52 -0.79 -1.18 118.95 120.25 3h0g s ARG 846 Ca 0.50 -0.93 0.02 0.00 -0.13 0.00 0.00 55.73 55.19 3h0g s ARG 846 Cb -0.31 -0.96 0.01 0.00 -1.56 0.00 0.00 34.95 32.13 3h0g s ARG 846 CO 0.37 0.22 -0.06 0.95 -0.81 0.00 0.00 175.30 175.97 3h0g s THR 847 N -1.12 0.59 -0.28 4.11 -4.23 -1.26 -1.41 115.64 112.03 3h0g s THR 847 Ca 0.00 -0.22 -0.06 0.00 -1.18 0.00 0.00 61.69 60.23 3h0g s THR 847 Cb -0.09 -0.56 0.00 0.00 1.34 0.00 0.00 72.50 73.19 3h0g s THR 847 CO 0.02 0.21 0.06 -0.31 -0.54 0.00 0.00 174.62 174.06 3h0g s TYR 848 N 0.43 3.12 0.14 3.99 1.51 0.12 -4.70 117.35 121.96 3h0g s TYR 848 Ca -0.06 -0.90 -0.17 0.00 -1.01 0.00 0.00 57.07 54.93 3h0g s TYR 848 Cb -0.10 -2.23 -0.07 0.00 -0.11 0.00 0.00 41.96 39.45 3h0g s TYR 848 CO 0.00 -0.54 0.59 -0.08 -1.11 0.00 0.00 175.55 174.41 3h0g s THR 849 N 1.51 4.77 -0.30 -0.71 -1.32 -1.26 -2.15 115.64 116.18 3h0g s THR 849 Ca 0.03 1.03 -0.12 0.00 -1.21 0.00 0.00 61.69 61.43 3h0g s THR 849 Cb -0.17 -3.81 0.14 0.00 -1.51 0.00 0.00 72.50 67.15 3h0g s THR 849 CO 0.02 0.34 0.73 -0.62 -2.21 0.00 0.00 174.62 172.88 3h0g s ASP 850 N -1.51 -1.00 0.00 8.08 -1.08 -0.88 -5.03 116.67 115.24 3h0g s ASP 850 Ca 0.36 1.39 0.00 0.00 -0.52 0.00 0.00 52.55 53.78 3h0g s ASP 850 Cb -0.17 2.10 0.00 0.00 -1.46 0.00 0.00 42.92 43.39 3h0g s ASP 850 CO 0.19 -0.19 0.00 0.00 0.52 0.00 0.00 175.17 175.69 3h0g n GLN 851 N 5.25 3.39 -2.82 4.34 6.02 -1.26 -1.54 117.38 130.77 3h0g n GLN 851 Ca -0.12 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.80 3h0g n GLN 851 Cb 0.50 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.77 3h0g n GLN 851 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 3h0g n GLU 852 N 0.00 0.58 -1.59 -1.09 2.13 -1.23 -4.79 120.64 114.64 3h0g n GLU 852 Ca 0.00 -2.08 -0.39 0.00 0.66 0.00 0.00 57.16 55.35 3h0g n GLU 852 Cb 0.00 -1.48 0.04 0.00 0.27 0.00 0.00 31.44 30.27 3h0g n GLU 852 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 3h0g n LYS 853 N 2.57 1.02 -3.41 5.31 4.81 -1.26 -4.82 118.16 122.38 3h0g n LYS 853 Ca 0.17 0.38 -0.13 0.00 -0.87 0.00 0.00 58.31 57.86 3h0g n LYS 853 Cb 0.57 -2.06 -0.10 0.00 0.02 0.00 0.00 35.03 33.46 3h0g n LYS 853 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 3h0g s LYS 854 N -2.39 0.28 0.00 1.64 2.20 -1.26 -4.77 119.74 115.44 3h0g s LYS 854 Ca 0.70 0.35 0.00 0.00 -0.36 0.00 0.00 55.97 56.66 3h0g s LYS 854 Cb -0.47 -0.80 0.00 0.00 -1.51 0.00 0.00 37.83 35.05 3h0g s LYS 854 CO 0.52 -0.68 0.00 0.44 -0.36 0.00 0.00 175.35 175.27 3h0g n ILE 855 N 5.34 0.00 -4.35 5.43 -5.35 -1.26 -4.97 119.36 114.20 3h0g n ILE 855 Ca -0.04 0.00 0.03 0.00 -0.27 0.00 0.00 62.75 62.47 3h0g n ILE 855 Cb 0.50 -0.19 -0.01 0.00 -1.74 0.00 0.00 39.64 38.19 3h0g n ILE 855 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3h0g n GLY 856 N 2.98 -1.14 7.00 3.28 0.00 -1.26 -4.64 105.19 111.40 3h0g n GLY 856 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.98 3h0g n GLY 856 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3h0g n MET 857 N -2.26 0.00 -3.56 1.61 2.81 -1.26 -4.95 117.12 109.52 3h0g n MET 857 Ca 0.00 0.00 -0.28 0.00 -1.81 0.00 0.00 57.70 55.61 3h0g n MET 857 Cb 0.11 0.00 -0.11 0.00 -0.71 0.00 0.00 33.22 32.51 3h0g n MET 857 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 3h0g s THR 858 N 0.00 1.05 -0.36 2.03 2.01 -1.26 -5.08 115.64 114.02 3h0g s THR 858 Ca 0.00 -2.94 -0.14 0.00 0.31 0.00 0.00 61.69 58.92 3h0g s THR 858 Cb 0.00 -1.72 -0.00 0.00 0.01 0.00 0.00 72.50 70.79 3h0g s THR 858 CO 0.00 -1.12 0.28 -0.69 -0.69 0.00 0.00 174.62 172.40 3h0g s VAL 859 N -0.18 5.26 0.61 3.82 1.01 -1.26 -5.08 120.40 124.58 3h0g s VAL 859 Ca 0.28 -0.32 -0.08 0.00 0.00 0.00 0.00 61.98 61.86 3h0g s VAL 859 Cb -0.04 -3.80 -0.00 0.00 0.00 0.00 0.00 36.38 32.54 3h0g s VAL 859 CO -0.15 -0.12 0.95 -0.04 0.00 0.00 0.00 175.10 175.74 3h0g s MET 860 N 1.76 3.08 -0.47 2.72 -1.94 -1.26 -4.57 119.30 118.63 3h0g s MET 860 Ca 0.07 0.24 0.03 0.00 -1.71 0.00 0.00 55.69 54.32 3h0g s MET 860 Cb -0.18 -2.20 0.21 0.00 2.01 0.00 0.00 34.83 34.67 3h0g s MET 860 CO 0.11 -0.69 0.86 -1.91 -0.01 0.00 0.00 175.02 173.38 3h0g n GLU 861 N -2.66 0.46 -2.43 2.03 2.13 -1.26 -4.44 120.64 114.48 3h0g n GLU 861 Ca 0.05 -1.65 -0.27 0.00 0.66 0.00 0.00 57.16 55.95 3h0g n GLU 861 Cb 0.57 -1.05 0.02 0.00 0.27 0.00 0.00 31.44 31.24 3h0g n GLU 861 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 3h0g s GLU 862 N 0.82 3.15 -0.01 5.31 2.12 -1.26 -4.76 118.70 124.08 3h0g s GLU 862 Ca 0.29 0.11 0.00 0.00 0.36 0.00 0.00 54.97 55.73 3h0g s GLU 862 Cb 0.07 -2.29 0.01 0.00 0.26 0.00 0.00 34.13 32.19 3h0g s GLU 862 CO -0.09 -0.55 1.56 1.19 -0.54 0.00 0.00 175.26 176.83 3h0g n PHE 863 N -2.50 0.08 -1.86 5.30 3.01 -1.26 -3.63 117.46 116.60 3h0g n PHE 863 Ca 0.03 -0.82 -0.37 0.00 1.01 0.00 0.00 57.45 57.31 3h0g n PHE 863 Cb 0.57 -0.41 0.04 0.00 -0.01 0.00 0.00 39.48 39.67 3h0g n PHE 863 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 3h0g s GLU 864 N -0.09 2.94 -0.26 -1.08 2.02 -1.25 -4.01 118.70 116.98 3h0g s GLU 864 Ca 0.01 2.04 -0.29 0.00 0.02 0.00 0.00 54.97 56.76 3h0g s GLU 864 Cb 0.01 -2.05 -0.01 0.00 0.10 0.00 0.00 34.13 32.18 3h0g s GLU 864 CO 0.00 -1.29 1.49 -0.98 0.02 0.00 0.00 175.26 174.50 3h0g s ARG 865 N -3.16 3.83 0.13 1.61 1.70 -1.26 -4.23 118.95 117.58 3h0g s ARG 865 Ca 0.76 1.48 -0.34 0.00 -0.47 0.00 0.00 55.73 57.16 3h0g s ARG 865 Cb -0.36 -3.98 -0.17 0.00 -0.57 0.00 0.00 34.95 29.88 3h0g s ARG 865 CO 0.40 -1.24 1.09 -2.30 -1.08 0.00 0.00 175.30 172.18 3h0g n PRO 866 N 7.54 0.81 -3.83 3.89 -0.02 -1.26 -4.95 135.00 137.18 3h0g n PRO 866 Ca 0.17 0.29 -0.36 0.00 -2.02 0.00 0.00 63.50 61.58 3h0g n PRO 866 Cb 0.46 -1.75 -0.13 0.00 -0.02 0.00 0.00 33.50 32.06 3h0g n PRO 866 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3h0g s VAL 867 N -0.17 3.52 0.00 -1.45 0.11 -1.26 -4.98 120.40 116.18 3h0g s VAL 867 Ca 0.77 -0.98 -0.01 0.00 -2.93 0.00 0.00 61.98 58.84 3h0g s VAL 867 Cb -0.95 -2.88 -0.02 0.00 -1.53 0.00 0.00 36.38 30.99 3h0g s VAL 867 CO 0.53 0.02 0.72 0.54 -3.33 0.00 0.00 175.10 173.57 3h0g n ARG 868 N 4.77 0.21 0.00 1.54 1.74 -1.26 -2.35 116.66 121.31 3h0g n ARG 868 Ca -0.14 -0.09 0.00 0.00 -0.77 0.00 0.00 57.85 56.85 3h0g n ARG 868 Cb 0.46 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.37 3h0g n ARG 868 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3h0g n SER 869 N 2.68 0.04 -0.53 0.55 3.41 -1.26 -4.89 113.62 113.62 3h0g n SER 869 Ca 0.04 -0.30 -0.01 0.00 -0.26 0.00 0.00 58.87 58.34 3h0g n SER 869 Cb 0.10 0.45 -0.01 0.00 -0.26 0.00 0.00 64.21 64.48 3h0g n SER 869 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3h0g n THR 870 N -0.45 0.00 0.00 6.66 -2.24 -0.99 -4.86 114.28 112.40 3h0g n THR 870 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3h0g n THR 870 Cb 0.01 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 3h0g n THR 870 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3h0g n THR 871 N 0.00 0.00 -0.62 4.28 -2.24 -1.21 -2.97 114.28 111.52 3h0g n THR 871 Ca -0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 3h0g n THR 871 Cb 0.31 -0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 3h0g n THR 871 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h0g n LEU 872 N 0.00 -0.83 -3.83 3.22 -0.00 -1.25 -4.33 117.00 109.99 3h0g n LEU 872 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 56.01 55.89 3h0g n LEU 872 Cb 0.00 -0.41 -0.09 0.00 -0.00 0.00 0.00 43.42 42.92 3h0g n LEU 872 CO 0.00 0.00 -0.08 -0.60 -0.00 0.00 0.00 177.39 176.71 3h0g s ARG 873 N -0.34 0.61 -0.30 1.47 3.52 -1.26 -4.25 118.95 118.40 3h0g s ARG 873 Ca 0.00 -0.40 -0.16 0.00 -0.13 0.00 0.00 55.73 55.04 3h0g s ARG 873 Cb 0.00 0.26 0.17 0.00 -1.56 0.00 0.00 34.95 33.82 3h0g s ARG 873 CO 0.00 -0.16 1.07 1.41 -0.81 0.00 0.00 175.30 176.80 3h0g s MET 874 N -1.73 0.22 0.00 5.12 1.75 -1.26 -4.83 119.30 118.58 3h0g s MET 874 Ca -0.12 0.55 0.00 0.00 -1.25 0.00 0.00 55.69 54.87 3h0g s MET 874 Cb -0.05 0.33 0.00 0.00 2.84 0.00 0.00 34.83 37.95 3h0g s MET 874 CO 0.01 -0.08 0.00 1.63 -0.65 0.00 0.00 175.02 175.92 3h0g n LYS 875 N 4.89 3.76 -3.96 4.11 5.02 -1.26 -4.82 118.16 125.91 3h0g n LYS 875 Ca -0.08 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 55.95 3h0g n LYS 875 Cb 0.53 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.47 3h0g n LYS 875 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 3h0g n HIS 876 N -0.01 -1.01 0.00 2.13 1.44 -1.26 -4.89 115.22 111.62 3h0g n HIS 876 Ca 0.00 0.47 0.00 0.00 -2.01 0.00 0.00 57.72 56.18 3h0g n HIS 876 Cb 0.00 -2.24 0.00 0.00 0.12 0.00 0.00 29.99 27.87 3h0g n HIS 876 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3h0g n GLY 877 N -2.26 -1.98 3.82 -1.39 0.00 -1.26 -4.74 105.19 97.38 3h0g n GLY 877 Ca -0.26 -0.19 -0.32 0.00 0.00 0.00 0.00 46.02 45.25 3h0g n GLY 877 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3h0g s THR 878 N 0.00 4.89 -2.30 2.61 -1.32 -1.26 -3.78 115.64 114.49 3h0g s THR 878 Ca 0.00 -0.45 0.27 0.00 -1.21 0.00 0.00 61.69 60.30 3h0g s THR 878 Cb 0.00 -3.30 0.63 0.00 -1.51 0.00 0.00 72.50 68.33 3h0g s THR 878 CO 0.00 0.26 1.85 -1.22 -2.21 0.00 0.00 174.62 173.30 3h0g n TYR 879 N 0.84 0.03 0.00 9.09 0.53 -1.26 -3.85 117.16 122.54 3h0g n TYR 879 Ca -0.10 -0.01 0.00 0.00 -1.02 0.00 0.00 57.90 56.76 3h0g n TYR 879 Cb 0.52 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.83 3h0g n TYR 879 CO 0.00 0.00 0.00 -0.25 -1.02 0.00 0.00 176.86 175.59 3h0g n ASP 880 N -0.20 0.00 -0.98 7.72 10.43 -1.26 -1.01 116.55 131.25 3h0g n ASP 880 Ca 0.20 0.43 0.12 0.00 2.57 0.00 0.00 54.79 58.10 3h0g n ASP 880 Cb 0.26 -0.43 0.13 0.00 1.84 0.00 0.00 41.12 42.93 3h0g n ASP 880 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3h0g n LYS 881 N -1.42 2.28 -3.43 -1.24 5.02 -1.25 -4.94 118.16 113.18 3h0g n LYS 881 Ca 0.00 -1.99 -0.35 0.00 -2.02 0.00 0.00 58.31 53.95 3h0g n LYS 881 Cb 0.03 -1.46 -0.06 0.00 -0.02 0.00 0.00 35.03 33.53 3h0g n LYS 881 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3h0g s LEU 882 N -1.78 4.33 0.00 -0.35 1.43 -0.18 -4.53 118.68 117.60 3h0g s LEU 882 Ca 0.30 0.98 -0.06 0.00 -1.03 0.00 0.00 54.13 54.32 3h0g s LEU 882 Cb 0.20 -3.21 0.08 0.00 0.03 0.00 0.00 46.19 43.29 3h0g s LEU 882 CO 0.29 0.11 0.47 1.21 0.23 0.00 0.00 176.35 178.66 3h0g n GLU 883 N 0.76 -0.45 0.31 1.70 2.13 -0.66 -4.84 120.64 119.58 3h0g n GLU 883 Ca -0.06 -0.73 0.19 0.00 0.66 0.00 0.00 57.16 57.22 3h0g n GLU 883 Cb 0.52 -0.48 0.97 0.00 0.27 0.00 0.00 31.44 32.72 3h0g n GLU 883 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 3h0g h ASP 884 N -0.61 0.00 0.88 4.31 3.32 -1.99 -1.72 116.42 120.61 3h0g h ASP 884 Ca -0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.90 3h0g h ASP 884 Cb 0.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.97 3h0g h ASP 884 CO 0.11 0.03 0.00 -0.67 -1.72 0.00 0.00 179.24 176.98 3h0g n ASP 885 N -3.28 0.00 0.00 6.45 2.03 -1.26 -4.68 116.55 115.81 3h0g n ASP 885 Ca -0.02 0.35 0.00 0.00 0.52 0.00 0.00 54.79 55.64 3h0g n ASP 885 Cb 0.16 -0.45 0.00 0.00 -0.72 0.00 0.00 41.12 40.11 3h0g n ASP 885 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3h0g n GLY 886 N 1.39 0.46 3.31 0.27 0.00 -0.65 -4.66 105.19 105.31 3h0g n GLY 886 Ca 0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.88 3h0g n GLY 886 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h0g s LEU 887 N 0.00 2.39 0.52 0.99 1.43 -1.26 -3.11 118.68 119.63 3h0g s LEU 887 Ca 0.00 -0.80 -0.16 0.00 -1.03 0.00 0.00 54.13 52.15 3h0g s LEU 887 Cb 0.00 -0.82 -0.07 0.00 0.03 0.00 0.00 46.19 45.32 3h0g s LEU 887 CO 0.00 -0.01 0.97 0.27 0.23 0.00 0.00 176.35 177.81 3h0g s ILE 888 N -1.75 4.57 -0.21 -0.59 -4.36 -1.05 -1.66 121.20 116.15 3h0g s ILE 888 Ca 0.12 1.14 -0.05 0.00 -0.26 0.00 0.00 60.65 61.61 3h0g s ILE 888 Cb -0.07 -3.73 -0.02 0.00 1.25 0.00 0.00 42.46 39.89 3h0g s ILE 888 CO 0.06 -0.72 -0.01 0.00 0.24 0.00 0.00 174.94 174.51 3h0g s ALA 889 N -2.65 2.94 0.48 2.27 0.00 -1.26 -4.93 121.76 118.60 3h0g s ALA 889 Ca 0.58 -1.06 -0.24 0.00 0.00 0.00 0.00 51.96 51.23 3h0g s ALA 889 Cb -0.10 -1.75 -0.07 0.00 0.00 0.00 0.00 23.12 21.20 3h0g s ALA 889 CO 0.33 -0.27 1.39 -2.14 0.00 0.00 0.00 175.76 175.07 3h0g s PRO 890 N 1.20 3.55 -0.79 0.00 0.02 -1.26 -1.80 135.00 135.92 3h0g s PRO 890 Ca 0.03 2.32 0.02 0.00 0.02 0.00 0.00 61.00 63.39 3h0g s PRO 890 Cb -0.15 -2.54 0.20 0.00 0.02 0.00 0.00 34.50 32.04 3h0g s PRO 890 CO 0.00 -0.89 0.67 0.41 -0.33 0.00 0.00 177.00 176.87 3h0g n GLY 891 N 0.63 4.20 3.66 0.52 0.00 -1.26 -5.08 105.19 107.86 3h0g n GLY 891 Ca 0.07 -2.62 -0.43 0.00 0.00 0.00 0.00 46.02 43.04 3h0g n GLY 891 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3h0g s THR 892 N -1.62 3.94 -0.80 2.61 -1.32 -0.75 -4.52 115.64 113.18 3h0g s THR 892 Ca 0.28 1.14 -0.26 0.00 -1.21 0.00 0.00 61.69 61.63 3h0g s THR 892 Cb -0.03 -3.73 -0.17 0.00 -1.51 0.00 0.00 72.50 67.06 3h0g s THR 892 CO -0.13 -0.10 2.52 -1.14 -2.21 0.00 0.00 174.62 173.56 3h0g n ARG 893 N 6.86 0.41 -3.84 7.08 3.00 -1.26 -4.22 116.66 124.69 3h0g n ARG 893 Ca 0.16 -0.08 -0.37 0.00 -0.00 0.00 0.00 57.85 57.56 3h0g n ARG 893 Cb 0.44 -2.32 -0.06 0.00 0.00 0.00 0.00 32.46 30.51 3h0g n ARG 893 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 3h0g s VAL 894 N 9.68 5.48 0.00 5.15 1.01 -1.17 -4.98 120.40 135.56 3h0g s VAL 894 Ca 1.19 0.22 0.00 0.00 0.00 0.00 0.00 61.98 63.39 3h0g s VAL 894 Cb -0.73 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 32.22 3h0g s VAL 894 CO 0.38 0.58 0.00 -1.20 0.00 0.00 0.00 175.10 174.86 3h0g n SER 895 N 2.33 0.37 0.00 3.32 7.64 -1.26 -1.93 113.62 124.09 3h0g n SER 895 Ca -0.19 -0.40 0.00 0.00 1.01 0.00 0.00 58.87 59.29 3h0g n SER 895 Cb 0.54 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.74 3h0g n SER 895 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h0g n GLY 896 N 0.92 0.52 0.79 0.23 0.00 -1.26 -2.73 105.19 103.67 3h0g n GLY 896 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.49 3h0g n GLY 896 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h0g n GLU 897 N 0.00 1.48 -1.15 1.61 1.02 -1.26 -4.24 120.64 118.11 3h0g n GLU 897 Ca 0.00 -0.45 -0.36 0.00 -0.02 0.00 0.00 57.16 56.33 3h0g n GLU 897 Cb 0.00 -1.52 0.05 0.00 -0.02 0.00 0.00 31.44 29.95 3h0g n GLU 897 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3h0g n ASP 898 N 0.12 -2.96 -4.61 1.62 8.00 -1.10 -4.12 116.55 113.50 3h0g n ASP 898 Ca 0.05 0.48 -0.23 0.00 0.71 0.00 0.00 54.79 55.80 3h0g n ASP 898 Cb 0.44 -1.03 -0.08 0.00 -0.02 0.00 0.00 41.12 40.44 3h0g n ASP 898 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 3h0g s ILE 899 N -2.00 3.21 0.00 0.53 -5.25 -1.26 -2.16 121.20 114.27 3h0g s ILE 899 Ca 0.57 -2.02 0.00 0.00 -0.99 0.00 0.00 60.65 58.21 3h0g s ILE 899 Cb -0.33 -2.73 0.00 0.00 2.95 0.00 0.00 42.46 42.36 3h0g s ILE 899 CO 0.67 -0.37 0.00 2.30 -1.79 0.00 0.00 174.94 175.74 3h0g n ILE 900 N -0.84 0.00 -4.38 8.37 -0.00 -1.26 -4.76 119.36 116.50 3h0g n ILE 900 Ca -0.06 0.00 -0.19 0.00 -0.00 0.00 0.00 62.75 62.50 3h0g n ILE 900 Cb 0.59 -0.03 -0.10 0.00 -0.00 0.00 0.00 39.64 40.10 3h0g n ILE 900 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.55 176.82 3h0g s ILE 901 N -0.89 0.69 -0.07 7.28 -0.00 -1.26 -2.53 121.20 124.43 3h0g s ILE 901 Ca 0.00 -2.00 -0.05 0.00 -0.00 0.00 0.00 60.65 58.60 3h0g s ILE 901 Cb 0.00 -2.63 0.02 0.00 -0.00 0.00 0.00 42.46 39.86 3h0g s ILE 901 CO 0.00 0.00 0.17 -0.83 -0.00 0.00 0.00 174.94 174.28 3h0g s GLY 902 N -3.40 -0.10 0.44 6.27 0.00 -1.18 -4.57 107.32 104.77 3h0g s GLY 902 Ca 0.35 0.55 0.06 0.00 0.00 0.00 0.00 44.72 45.68 3h0g s GLY 902 CO 0.15 0.60 0.05 0.54 0.00 0.00 0.00 173.10 174.44 3h0g s LYS 903 N 0.43 2.07 -0.27 2.90 1.02 -1.26 -3.81 119.74 120.81 3h0g s LYS 903 Ca -0.03 -2.12 -0.21 0.00 0.02 0.00 0.00 55.97 53.63 3h0g s LYS 903 Cb -0.04 -1.69 0.07 0.00 -0.52 0.00 0.00 37.83 35.65 3h0g s LYS 903 CO -0.02 -0.15 0.70 -0.08 -0.92 0.00 0.00 175.35 174.89 3h0g s THR 904 N -2.73 -0.00 -0.16 2.17 -1.32 -1.24 -4.39 115.64 107.97 3h0g s THR 904 Ca 0.30 0.00 -0.04 0.00 -1.21 0.00 0.00 61.69 60.74 3h0g s THR 904 Cb 0.07 -1.00 0.06 0.00 -1.51 0.00 0.00 72.50 70.12 3h0g s THR 904 CO 0.16 0.00 0.07 0.00 -2.21 0.00 0.00 174.62 172.64 3h0g s ALA 905 N 0.98 0.57 1.01 11.08 0.00 -1.26 -4.18 121.76 129.97 3h0g s ALA 905 Ca -0.05 -0.36 -0.13 0.00 0.00 0.00 0.00 51.96 51.42 3h0g s ALA 905 Cb -0.05 -1.03 0.14 0.00 0.00 0.00 0.00 23.12 22.18 3h0g s ALA 905 CO -0.09 -1.09 0.70 -2.30 0.00 0.00 0.00 175.76 172.98 3h0g n PRO 906 N 5.21 -1.00 0.00 0.00 -0.02 -1.26 -3.02 135.00 134.92 3h0g n PRO 906 Ca -0.07 -0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.16 3h0g n PRO 906 Cb 0.49 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 3h0g n PRO 906 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3h0g n ILE 907 N -4.23 0.00 -2.61 4.25 5.41 -1.26 -4.93 119.36 116.00 3h0g n ILE 907 Ca 0.07 0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.40 3h0g n ILE 907 Cb 0.55 -0.25 -0.03 0.00 -0.71 0.00 0.00 39.64 39.20 3h0g n ILE 907 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 176.55 174.97 3h0g s GLN 919 N -0.94 3.38 -0.63 0.38 0.74 -1.26 -5.09 119.66 116.25 3h0g s GLN 919 Ca 0.00 0.01 -0.17 0.00 0.05 0.00 0.00 55.36 55.25 3h0g s GLN 919 Cb 0.00 -4.08 0.13 0.00 1.10 0.00 0.00 33.01 30.16 3h0g s GLN 919 CO 0.00 -1.81 0.68 -0.51 -0.55 0.00 0.00 175.29 173.10 3h0g s LEU 920 N 5.06 5.78 0.07 3.68 1.43 -1.26 -5.15 118.68 128.29 3h0g s LEU 920 Ca 0.39 -1.75 0.05 0.00 -1.03 0.00 0.00 54.13 51.79 3h0g s LEU 920 Cb -0.08 -2.27 -0.03 0.00 0.03 0.00 0.00 46.19 43.84 3h0g s LEU 920 CO 0.21 -0.97 -0.14 -1.00 0.23 0.00 0.00 176.35 174.69 3h0g s HIS 921 N 2.04 1.19 -0.10 0.29 3.76 -1.26 -4.69 115.29 116.51 3h0g s HIS 921 Ca 0.11 -0.45 -0.05 0.00 -0.15 0.00 0.00 55.06 54.53 3h0g s HIS 921 Cb -0.23 -0.67 0.05 0.00 1.11 0.00 0.00 32.58 32.84 3h0g s HIS 921 CO 0.02 0.05 0.23 0.00 -0.85 0.00 0.00 174.74 174.19 3h0g s ALA 922 N -1.22 -0.50 -0.12 -1.40 0.00 -1.26 -5.05 121.76 112.22 3h0g s ALA 922 Ca -0.02 0.92 0.00 0.00 0.00 0.00 0.00 51.96 52.86 3h0g s ALA 922 Cb -0.10 -0.70 0.02 0.00 0.00 0.00 0.00 23.12 22.35 3h0g s ALA 922 CO 0.02 -0.30 -0.10 0.15 0.00 0.00 0.00 175.76 175.53 3h0g s LYS 923 N 1.54 1.71 0.06 0.00 1.02 -1.16 -4.07 119.74 118.85 3h0g s LYS 923 Ca -0.06 -0.34 0.00 0.00 0.02 0.00 0.00 55.97 55.59 3h0g s LYS 923 Cb -0.11 -1.68 0.01 0.00 -0.52 0.00 0.00 37.83 35.53 3h0g s LYS 923 CO -0.08 -0.23 0.08 0.54 -0.92 0.00 0.00 175.35 174.75 3h0g n ARG 924 N 4.78 0.58 -3.42 1.68 1.74 -1.17 -3.84 116.66 117.01 3h0g n ARG 924 Ca -0.15 -0.23 -0.19 0.00 -0.77 0.00 0.00 57.85 56.51 3h0g n ARG 924 Cb 0.50 -0.05 -0.10 0.00 -1.02 0.00 0.00 32.46 31.79 3h0g n ARG 924 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3h0g s ASP 925 N -1.34 1.95 -0.34 0.55 2.15 -1.26 -4.11 116.67 114.28 3h0g s ASP 925 Ca 0.05 -1.03 0.08 0.00 0.43 0.00 0.00 52.55 52.09 3h0g s ASP 925 Cb -0.00 0.34 0.59 0.00 -0.30 0.00 0.00 42.92 43.55 3h0g s ASP 925 CO 0.04 -0.37 1.65 0.52 -0.17 0.00 0.00 175.17 176.83 3h0g n VAL 926 N 5.09 2.79 -2.63 1.11 0.31 -1.26 -4.87 118.33 118.88 3h0g n VAL 926 Ca -0.00 -2.30 -0.33 0.00 -0.01 0.00 0.00 64.34 61.70 3h0g n VAL 926 Cb 0.45 -0.37 -0.05 0.00 -0.91 0.00 0.00 33.84 32.96 3h0g n VAL 926 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3h0g s SER 927 N -1.94 6.79 -0.22 4.52 1.04 -1.26 -4.76 113.70 117.88 3h0g s SER 927 Ca 0.50 1.64 -0.10 0.00 0.48 0.00 0.00 55.95 58.47 3h0g s SER 927 Cb 0.43 -2.53 -0.05 0.00 0.10 0.00 0.00 66.02 63.98 3h0g s SER 927 CO 0.05 -0.47 0.13 0.42 0.98 0.00 0.00 173.24 174.35 3h0g s THR 928 N -2.38 5.25 0.00 2.02 -4.23 -1.26 -4.94 115.64 110.10 3h0g s THR 928 Ca 0.61 0.14 0.00 0.00 -1.18 0.00 0.00 61.69 61.25 3h0g s THR 928 Cb -0.10 -3.41 0.00 0.00 1.34 0.00 0.00 72.50 70.33 3h0g s THR 928 CO 0.21 0.40 0.00 -2.65 -0.54 0.00 0.00 174.62 172.04 3h0g n PRO 929 N 3.89 2.52 -3.66 3.99 -0.02 -1.26 -4.09 135.00 136.37 3h0g n PRO 929 Ca -0.16 0.00 -0.19 0.00 -2.02 0.00 0.00 63.50 61.13 3h0g n PRO 929 Cb 0.52 0.00 -0.17 0.00 -0.02 0.00 0.00 33.50 33.83 3h0g n PRO 929 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3h0g s LEU 930 N 0.00 0.07 -0.09 2.45 0.20 -0.92 -4.78 118.68 115.61 3h0g s LEU 930 Ca 0.00 0.13 -0.38 0.00 0.69 0.00 0.00 54.13 54.57 3h0g s LEU 930 Cb 0.00 -0.00 -0.15 0.00 -0.43 0.00 0.00 46.19 45.61 3h0g s LEU 930 CO 0.00 -0.25 1.62 -2.11 -0.29 0.00 0.00 176.35 175.31 3h0g n ARG 931 N 5.31 1.38 -0.33 1.98 1.85 -1.26 -4.03 116.66 121.55 3h0g n ARG 931 Ca -0.04 0.50 0.14 0.00 -1.00 0.00 0.00 57.85 57.45 3h0g n ARG 931 Cb 0.50 -2.20 0.35 0.00 -1.05 0.00 0.00 32.46 30.06 3h0g n ARG 931 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 3h0g h SER 932 N 6.52 0.73 0.00 2.89 4.64 -1.93 -0.81 113.55 125.58 3h0g h SER 932 Ca -0.47 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 3h0g h SER 932 Cb 1.31 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3h0g h SER 932 CO 0.89 0.28 0.28 0.00 -0.87 0.00 0.00 176.83 177.41 3h0g h THR 933 N 0.72 0.00 -2.04 2.95 1.03 -1.90 -3.42 112.91 110.25 3h0g h THR 933 Ca 0.55 0.00 -0.50 0.00 -0.01 0.00 0.00 66.41 66.45 3h0g h THR 933 Cb 0.92 0.34 -0.04 0.00 -1.07 0.00 0.00 68.15 68.30 3h0g h THR 933 CO -0.33 0.00 -0.49 -1.61 -0.01 0.00 0.00 175.52 173.08 3h0g s GLU 934 N -3.42 2.83 0.00 0.00 0.41 -0.31 -4.95 118.70 113.26 3h0g s GLU 934 Ca -0.02 -1.16 0.00 0.00 -0.41 0.00 0.00 54.97 53.38 3h0g s GLU 934 Cb 0.04 -2.52 0.00 0.00 -1.78 0.00 0.00 34.13 29.87 3h0g s GLU 934 CO 0.14 0.27 0.00 -1.13 -0.49 0.00 0.00 175.26 174.05 3h0g n SER 935 N -1.26 0.00 0.00 -0.19 3.41 -1.26 -4.27 113.62 110.05 3h0g n SER 935 Ca -0.05 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 3h0g n SER 935 Cb 0.59 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 3h0g n SER 935 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h0g n GLY 936 N 0.00 -1.22 0.31 5.00 0.00 -0.81 -4.63 105.19 103.85 3h0g n GLY 936 Ca 0.00 -1.61 -0.02 0.00 0.00 0.00 0.00 46.02 44.39 3h0g n GLY 936 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3h0g n ILE 937 N -1.38 0.00 -4.05 -0.61 -5.35 -1.11 -3.04 119.36 103.82 3h0g n ILE 937 Ca 0.00 -0.07 -0.32 0.00 -0.27 0.00 0.00 62.75 62.08 3h0g n ILE 937 Cb 0.00 -1.79 -0.15 0.00 -1.74 0.00 0.00 39.64 35.96 3h0g n ILE 937 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 3h0g s VAL 938 N -1.23 2.27 0.00 7.28 1.01 -1.26 -1.80 120.40 126.68 3h0g s VAL 938 Ca 0.06 -1.55 -0.00 0.00 0.00 0.00 0.00 61.98 60.49 3h0g s VAL 938 Cb -0.00 -2.31 -0.00 0.00 0.00 0.00 0.00 36.38 34.07 3h0g s VAL 938 CO 0.04 0.00 1.00 -0.78 0.00 0.00 0.00 175.10 175.37 3h0g h ASP 939 N 7.81 -0.00 -4.76 3.32 3.58 -0.47 -3.39 116.42 122.51 3h0g h ASP 939 Ca -0.21 0.00 0.07 0.00 0.42 0.00 0.00 57.03 57.31 3h0g h ASP 939 Cb 1.05 0.00 -0.14 0.00 1.72 0.00 0.00 39.33 41.96 3h0g h ASP 939 CO 0.48 -0.00 0.41 0.00 -2.88 0.00 0.00 179.24 177.25 3h0g s GLN 940 N -3.00 0.97 0.07 0.28 -2.07 -1.00 -4.83 119.66 110.07 3h0g s GLN 940 Ca -0.00 -0.36 0.09 0.00 -1.82 0.00 0.00 55.36 53.27 3h0g s GLN 940 Cb 0.00 0.44 -0.03 0.00 -1.09 0.00 0.00 33.01 32.33 3h0g s GLN 940 CO 0.00 -0.42 -0.23 0.14 -1.32 0.00 0.00 175.29 173.45 3h0g s VAL 941 N -3.32 1.89 -0.18 3.63 -7.23 -1.26 -1.76 120.40 112.17 3h0g s VAL 941 Ca 0.04 -1.41 -0.01 0.00 -1.81 0.00 0.00 61.98 58.78 3h0g s VAL 941 Cb -0.01 -1.66 0.05 0.00 0.56 0.00 0.00 36.38 35.32 3h0g s VAL 941 CO -0.10 0.17 -0.02 -0.32 -0.31 0.00 0.00 175.10 174.53 3h0g s MET 942 N -1.49 1.10 -0.35 4.82 1.75 0.13 -4.99 119.30 120.27 3h0g s MET 942 Ca 0.09 -0.50 -0.09 0.00 -1.25 0.00 0.00 55.69 53.94 3h0g s MET 942 Cb -0.10 -2.05 0.03 0.00 2.84 0.00 0.00 34.83 35.55 3h0g s MET 942 CO 0.03 -0.52 0.15 0.08 -0.65 0.00 0.00 175.02 174.11 3h0g s VAL 943 N 1.71 4.24 0.00 10.11 1.01 -1.26 -1.51 120.40 134.70 3h0g s VAL 943 Ca -0.01 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.06 3h0g s VAL 943 Cb -0.16 -3.35 0.00 0.00 0.00 0.00 0.00 36.38 32.87 3h0g s VAL 943 CO -0.07 -0.16 0.00 1.07 0.00 0.00 0.00 175.10 175.93 3h0g n THR 944 N 4.92 0.00 -4.92 3.92 5.66 0.03 -4.98 114.28 118.92 3h0g n THR 944 Ca -0.12 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.58 3h0g n THR 944 Cb 0.46 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 69.09 3h0g n THR 944 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 3h0g s THR 945 N -0.24 2.06 0.48 1.09 -1.32 -1.26 -1.77 115.64 114.67 3h0g s THR 945 Ca 0.00 -1.33 0.05 0.00 -1.21 0.00 0.00 61.69 59.21 3h0g s THR 945 Cb 0.00 -1.76 -0.01 0.00 -1.51 0.00 0.00 72.50 69.22 3h0g s THR 945 CO 0.00 0.37 0.23 0.54 -2.21 0.00 0.00 174.62 173.55 3h0g s ASN 946 N -1.15 4.45 -0.42 8.08 4.22 -1.10 -4.92 114.94 124.10 3h0g s ASN 946 Ca 0.11 -1.24 0.06 0.00 -2.14 0.00 0.00 52.86 49.65 3h0g s ASN 946 Cb -0.10 0.01 0.17 0.00 1.28 0.00 0.00 41.25 42.62 3h0g s ASN 946 CO 0.02 -0.80 0.52 -1.58 -2.04 0.00 0.00 177.10 173.22 3h0g s GLN 947 N -4.03 0.81 5.02 3.55 2.00 -1.26 -1.59 119.66 124.15 3h0g s GLN 947 Ca 0.32 -0.84 0.00 0.00 -2.00 0.00 0.00 55.36 52.84 3h0g s GLN 947 Cb 0.01 -0.40 0.00 0.00 0.80 0.00 0.00 33.01 33.42 3h0g s GLN 947 CO 0.18 -1.24 0.00 0.39 -0.50 0.00 0.00 175.29 174.12 3h0g n GLU 948 N 3.91 0.00 0.00 1.67 -0.58 -1.26 -5.09 120.64 119.29 3h0g n GLU 948 Ca 0.14 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.88 3h0g n GLU 948 Cb 0.51 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.38 3h0g n GLU 948 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3h0g n GLY 949 N 0.00 -0.02 0.00 0.62 0.00 -0.62 -5.05 105.19 100.12 3h0g n GLY 949 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3h0g n GLY 949 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h0g n LEU 950 N 0.00 0.00 -4.98 0.99 7.99 -1.23 -4.95 117.00 114.83 3h0g n LEU 950 Ca 0.00 0.00 -0.21 0.00 -0.01 0.00 0.00 56.01 55.79 3h0g n LEU 950 Cb 0.00 0.00 0.01 0.00 -0.11 0.00 0.00 43.42 43.32 3h0g n LEU 950 CO 0.00 0.00 0.18 -0.54 -1.51 0.00 0.00 177.39 175.52 3h0g s LYS 951 N 1.84 3.02 -0.30 3.23 1.02 -1.26 -2.71 119.74 124.58 3h0g s LYS 951 Ca 0.00 -0.80 -0.01 0.00 0.02 0.00 0.00 55.97 55.18 3h0g s LYS 951 Cb 0.00 -2.68 0.19 0.00 -0.52 0.00 0.00 37.83 34.82 3h0g s LYS 951 CO 0.00 -0.17 0.63 0.12 -0.92 0.00 0.00 175.35 175.01 3h0g s PHE 952 N -2.40 -1.55 0.06 3.18 5.36 -0.73 -3.57 117.98 118.32 3h0g s PHE 952 Ca 0.48 1.59 0.07 0.00 -0.96 0.00 0.00 56.93 58.11 3h0g s PHE 952 Cb -0.10 0.52 -0.03 0.00 -0.34 0.00 0.00 43.02 43.07 3h0g s PHE 952 CO 0.35 -0.86 -0.16 0.08 -1.46 0.00 0.00 175.22 173.17 3h0g s VAL 953 N 2.86 2.97 -0.06 3.12 1.01 -0.59 -0.79 120.40 128.92 3h0g s VAL 953 Ca 0.19 -1.19 0.01 0.00 0.00 0.00 0.00 61.98 60.98 3h0g s VAL 953 Cb -0.14 -2.29 0.02 0.00 0.00 0.00 0.00 36.38 33.97 3h0g s VAL 953 CO -0.21 0.28 -0.06 -0.54 0.00 0.00 0.00 175.10 174.57 3h0g s LYS 954 N -1.63 1.12 -0.10 2.72 1.02 -0.57 -2.08 119.74 120.22 3h0g s LYS 954 Ca 0.16 -0.18 0.02 0.00 0.02 0.00 0.00 55.97 55.99 3h0g s LYS 954 Cb -0.11 -1.10 -0.01 0.00 -0.52 0.00 0.00 37.83 36.09 3h0g s LYS 954 CO 0.07 -0.10 -0.16 0.08 -0.92 0.00 0.00 175.35 174.32 3h0g s VAL 955 N 1.07 2.84 -0.09 3.17 1.01 -0.91 -0.69 120.40 126.78 3h0g s VAL 955 Ca -0.08 -0.76 0.03 0.00 0.00 0.00 0.00 61.98 61.17 3h0g s VAL 955 Cb -0.14 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.10 3h0g s VAL 955 CO -0.01 0.55 -0.18 -0.60 0.00 0.00 0.00 175.10 174.86 3h0g s ARG 956 N 0.08 2.39 -0.02 2.72 3.52 -0.72 0.12 118.95 127.03 3h0g s ARG 956 Ca -0.07 -0.64 0.08 0.00 -0.13 0.00 0.00 55.73 54.97 3h0g s ARG 956 Cb -0.15 -1.90 -0.02 0.00 -1.56 0.00 0.00 34.95 31.32 3h0g s ARG 956 CO 0.05 0.06 -0.25 0.00 -0.81 0.00 0.00 175.30 174.34 3h0g s MET 957 N 0.64 2.14 0.20 5.12 0.23 -0.50 0.27 119.30 127.39 3h0g s MET 957 Ca -0.14 -0.91 -0.01 0.00 -1.03 0.00 0.00 55.69 53.60 3h0g s MET 957 Cb -0.16 -2.03 -0.04 0.00 -1.53 0.00 0.00 34.83 31.07 3h0g s MET 957 CO 0.04 0.53 0.39 -0.98 -2.03 0.00 0.00 175.02 172.97 3h0g s ARG 958 N -0.54 3.53 -0.36 3.16 1.70 -0.74 -1.88 118.95 123.82 3h0g s ARG 958 Ca 0.08 -0.31 0.04 0.00 -0.47 0.00 0.00 55.73 55.07 3h0g s ARG 958 Cb -0.10 -2.83 0.16 0.00 -0.57 0.00 0.00 34.95 31.61 3h0g s ARG 958 CO -0.00 0.40 0.45 0.45 -1.08 0.00 0.00 175.30 175.51 3h0g s SER 959 N -3.11 0.31 0.45 -2.89 0.15 -1.24 -2.74 113.70 104.62 3h0g s SER 959 Ca 0.39 -1.08 -0.22 0.00 0.70 0.00 0.00 55.95 55.74 3h0g s SER 959 Cb -0.11 1.04 -0.12 0.00 -1.71 0.00 0.00 66.02 65.12 3h0g s SER 959 CO 0.29 -0.26 0.58 1.07 1.20 0.00 0.00 173.24 176.11 3h0g n THR 960 N 4.57 1.88 -3.89 6.45 5.66 -1.26 -2.96 114.28 124.73 3h0g n THR 960 Ca 0.08 -0.50 -0.25 0.00 -3.05 0.00 0.00 64.05 60.33 3h0g n THR 960 Cb 0.49 -0.61 -0.17 0.00 -1.55 0.00 0.00 70.33 68.49 3h0g n THR 960 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 3h0g s ARG 961 N -1.69 1.17 0.39 1.09 1.81 0.34 -4.86 118.95 117.19 3h0g s ARG 961 Ca 0.64 -0.12 0.02 0.00 -1.72 0.00 0.00 55.73 54.55 3h0g s ARG 961 Cb -0.57 -1.32 -0.02 0.00 -0.45 0.00 0.00 34.95 32.59 3h0g s ARG 961 CO 0.57 -0.26 0.58 0.96 -0.68 0.00 0.00 175.30 176.48 3h0g s ILE 962 N 1.73 4.43 0.25 1.52 -4.36 -1.26 -1.20 121.20 122.31 3h0g s ILE 962 Ca 0.04 -0.59 -0.30 0.00 -0.26 0.00 0.00 60.65 59.54 3h0g s ILE 962 Cb -0.13 -3.61 -0.09 0.00 1.25 0.00 0.00 42.46 39.88 3h0g s ILE 962 CO -0.06 -0.38 1.14 -2.84 0.24 0.00 0.00 174.94 173.04 3h0g s PRO 963 N -4.39 4.57 0.03 0.37 0.02 -1.26 -4.97 135.00 129.39 3h0g s PRO 963 Ca 0.44 1.85 -0.02 0.00 0.02 0.00 0.00 61.00 63.29 3h0g s PRO 963 Cb -0.10 -3.20 -0.02 0.00 0.02 0.00 0.00 34.50 31.20 3h0g s PRO 963 CO 0.36 0.09 0.02 -1.14 -0.33 0.00 0.00 177.00 175.99 3h0g s GLN 964 N -1.08 0.50 0.03 5.54 0.74 -1.26 -5.08 119.66 119.05 3h0g s GLN 964 Ca 0.47 -0.83 -0.36 0.00 0.05 0.00 0.00 55.36 54.69 3h0g s GLN 964 Cb -0.33 0.18 -0.15 0.00 1.10 0.00 0.00 33.01 33.82 3h0g s GLN 964 CO 0.41 -0.10 1.57 -0.89 -0.55 0.00 0.00 175.29 175.72 3h0g n ILE 965 N 0.87 0.14 0.00 -2.34 5.41 -1.26 -1.99 119.36 120.19 3h0g n ILE 965 Ca -0.19 -0.02 0.00 0.00 1.00 0.00 0.00 62.75 63.53 3h0g n ILE 965 Cb 0.58 -1.30 0.00 0.00 -0.71 0.00 0.00 39.64 38.21 3h0g n ILE 965 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3h0g n GLY 966 N 3.37 0.68 3.81 7.39 0.00 -0.84 -4.97 105.19 114.63 3h0g n GLY 966 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 3h0g n GLY 966 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3h0g s ASP 967 N -1.94 6.65 0.12 1.61 1.01 -0.84 -4.49 116.67 118.79 3h0g s ASP 967 Ca 0.00 1.80 -0.23 0.00 0.71 0.00 0.00 52.55 54.84 3h0g s ASP 967 Cb 0.00 -2.55 -0.07 0.00 1.01 0.00 0.00 42.92 41.31 3h0g s ASP 967 CO 0.00 -0.56 0.68 -0.54 0.21 0.00 0.00 175.17 174.96 3h0g s LYS 968 N -3.21 4.40 0.01 8.23 1.02 -1.26 -2.07 119.74 126.86 3h0g s LYS 968 Ca 0.64 0.96 -0.02 0.00 0.02 0.00 0.00 55.97 57.58 3h0g s LYS 968 Cb -0.12 -3.26 -0.01 0.00 -0.52 0.00 0.00 37.83 33.92 3h0g s LYS 968 CO 0.16 0.58 0.03 -0.06 -0.92 0.00 0.00 175.35 175.15 3h0g s PHE 969 N -1.06 0.15 -0.06 3.18 0.40 0.26 -2.94 117.98 117.91 3h0g s PHE 969 Ca 0.33 -0.32 -0.18 0.00 -0.60 0.00 0.00 56.93 56.16 3h0g s PHE 969 Cb -0.21 -0.12 0.04 0.00 0.51 0.00 0.00 43.02 43.23 3h0g s PHE 969 CO 0.23 -0.19 0.40 0.00 0.70 0.00 0.00 175.22 176.36 3h0g s ALA 970 N -1.22 -1.02 1.00 5.36 0.00 -1.14 0.10 121.76 124.84 3h0g s ALA 970 Ca -0.13 0.72 0.00 0.00 0.00 0.00 0.00 51.96 52.55 3h0g s ALA 970 Cb -0.08 -0.14 0.00 0.00 0.00 0.00 0.00 23.12 22.90 3h0g s ALA 970 CO -0.00 -0.26 0.00 -1.13 0.00 0.00 0.00 175.76 174.36 3h0g n SER 971 N 1.62 0.00 -2.21 0.00 3.41 -1.26 -1.00 113.62 114.18 3h0g n SER 971 Ca -0.19 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.11 3h0g n SER 971 Cb 0.56 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.59 3h0g n SER 971 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3h0g n ARG 972 N 0.00 2.89 -0.02 4.33 1.74 -1.26 -4.19 116.66 120.15 3h0g n ARG 972 Ca 0.00 -3.50 0.00 0.00 -0.77 0.00 0.00 57.85 53.58 3h0g n ARG 972 Cb 0.00 -2.27 0.00 0.00 -1.02 0.00 0.00 32.46 29.17 3h0g n ARG 972 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3h0g n HIS 973 N -0.88 0.00 -2.25 -1.55 8.25 -1.26 -4.64 115.22 112.89 3h0g n HIS 973 Ca 0.57 -0.04 -0.02 0.00 -0.26 0.00 0.00 57.72 57.97 3h0g n HIS 973 Cb 0.79 -0.01 0.01 0.00 1.12 0.00 0.00 29.99 31.90 3h0g n HIS 973 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3h0g n GLY 974 N -0.04 0.43 2.75 -1.41 0.00 -1.26 -4.78 105.19 100.88 3h0g n GLY 974 Ca 0.00 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.20 3h0g n GLY 974 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3h0g n GLN 975 N -1.30 4.22 -1.39 1.61 1.13 -1.26 -4.98 117.38 115.40 3h0g n GLN 975 Ca -0.03 -4.32 -0.60 0.00 -1.94 0.00 0.00 57.00 50.11 3h0g n GLN 975 Cb 0.52 -2.37 -0.11 0.00 0.11 0.00 0.00 30.24 28.40 3h0g n GLN 975 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 3h0g n LYS 976 N -0.26 0.00 -4.34 -1.09 5.02 -1.26 -4.20 118.16 112.03 3h0g n LYS 976 Ca 0.47 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.56 3h0g n LYS 976 Cb 0.29 -1.42 -0.10 0.00 -0.02 0.00 0.00 35.03 33.78 3h0g n LYS 976 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3h0g s GLY 977 N 4.42 1.40 0.07 0.72 0.00 0.28 -4.73 107.32 109.48 3h0g s GLY 977 Ca 1.07 -1.58 0.06 0.00 0.00 0.00 0.00 44.72 44.27 3h0g s GLY 977 CO 0.69 -1.66 -0.16 -1.08 0.00 0.00 0.00 173.10 170.90 3h0g s THR 978 N -2.60 1.24 0.19 0.90 -1.32 -1.26 -0.58 115.64 112.21 3h0g s THR 978 Ca 0.19 -1.29 -0.30 0.00 -1.21 0.00 0.00 61.69 59.09 3h0g s THR 978 Cb -0.03 -1.16 -0.08 0.00 -1.51 0.00 0.00 72.50 69.72 3h0g s THR 978 CO 0.07 -0.14 1.21 -0.63 -2.21 0.00 0.00 174.62 172.92 3h0g s ILE 979 N -1.16 3.50 -0.05 5.08 1.01 -0.88 0.23 121.20 128.93 3h0g s ILE 979 Ca 0.00 1.27 0.10 0.00 0.00 0.00 0.00 60.65 62.02 3h0g s ILE 979 Cb -0.10 -3.81 -0.14 0.00 0.01 0.00 0.00 42.46 38.42 3h0g s ILE 979 CO 0.02 0.21 0.15 0.61 0.00 0.00 0.00 174.94 175.93 3h0g n GLY 980 N 2.13 -0.48 3.52 6.18 0.00 0.88 -1.99 105.19 115.43 3h0g n GLY 980 Ca 0.04 -0.21 -0.10 0.00 0.00 0.00 0.00 46.02 45.75 3h0g n GLY 980 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h0g s MET 981 N -2.52 0.81 -0.41 1.61 -1.94 -1.26 -4.96 119.30 110.64 3h0g s MET 981 Ca -0.04 -0.17 0.02 0.00 -1.71 0.00 0.00 55.69 53.79 3h0g s MET 981 Cb 0.05 0.38 0.12 0.00 2.01 0.00 0.00 34.83 37.39 3h0g s MET 981 CO 0.42 -0.33 0.19 -0.08 -0.01 0.00 0.00 175.02 175.22 3h0g s THR 982 N -2.55 1.46 0.18 2.05 -1.32 -1.26 -2.25 115.64 111.95 3h0g s THR 982 Ca 0.02 -2.34 -0.30 0.00 -1.21 0.00 0.00 61.69 57.86 3h0g s THR 982 Cb -0.01 -2.04 -0.08 0.00 -1.51 0.00 0.00 72.50 68.87 3h0g s THR 982 CO -0.05 -0.81 1.04 -0.31 -2.21 0.00 0.00 174.62 172.27 3h0g s TYR 983 N 0.63 3.71 1.05 9.09 1.51 -1.19 -4.65 117.35 127.49 3h0g s TYR 983 Ca 0.15 1.71 -0.16 0.00 -1.01 0.00 0.00 57.07 57.75 3h0g s TYR 983 Cb -0.23 -3.18 0.22 0.00 -0.11 0.00 0.00 41.96 38.67 3h0g s TYR 983 CO -0.06 -0.24 1.19 1.03 -1.11 0.00 0.00 175.55 176.36 3h0g s ARG 984 N -0.48 -0.03 0.27 -0.62 0.52 -1.26 -0.66 118.95 116.69 3h0g s ARG 984 Ca 0.47 -0.08 -0.01 0.00 -0.52 0.00 0.00 55.73 55.59 3h0g s ARG 984 Cb -0.28 -1.74 0.38 0.00 0.52 0.00 0.00 34.95 33.84 3h0g s ARG 984 CO 0.34 -2.91 1.80 1.25 0.02 0.00 0.00 175.30 175.79 3h0g h HIS 985 N -2.01 0.83 0.06 -0.53 -0.00 -1.95 -3.14 115.15 108.41 3h0g h HIS 985 Ca -0.46 -0.09 -0.00 0.00 -0.00 0.00 0.00 60.37 59.81 3h0g h HIS 985 Cb 1.28 -0.24 0.00 0.00 -0.00 0.00 0.00 27.41 28.46 3h0g h HIS 985 CO -1.19 0.73 -0.03 0.93 -0.00 0.00 0.00 177.93 178.38 3h0g h GLU 986 N 0.76 -0.08 -0.28 5.26 3.07 -1.95 -3.24 114.58 118.13 3h0g h GLU 986 Ca 0.16 0.01 0.06 0.00 -0.50 0.00 0.00 59.36 59.09 3h0g h GLU 986 Cb 0.36 0.02 -0.06 0.00 -0.84 0.00 0.00 28.75 28.23 3h0g h GLU 986 CO 0.01 0.14 -0.12 -0.44 -1.40 0.00 0.00 179.01 177.20 3h0g h ASP 987 N -0.28 -0.41 -3.55 1.42 3.32 -1.80 -3.41 116.42 111.71 3h0g h ASP 987 Ca -0.01 0.10 -0.57 0.00 0.02 0.00 0.00 57.03 56.58 3h0g h ASP 987 Cb 0.25 0.23 0.15 0.00 0.22 0.00 0.00 39.33 40.18 3h0g h ASP 987 CO 0.01 -0.15 0.25 0.23 -1.72 0.00 0.00 179.24 177.87 3h0g n MET 988 N -5.29 1.23 -1.01 3.56 2.81 -1.22 -3.28 117.12 113.91 3h0g n MET 988 Ca -0.00 0.46 -0.26 0.00 -1.81 0.00 0.00 57.70 56.09 3h0g n MET 988 Cb 0.21 -2.24 -0.10 0.00 -0.71 0.00 0.00 33.22 30.38 3h0g n MET 988 CO 0.00 0.00 0.00 -2.30 1.51 0.00 0.00 175.97 175.18 3h0g n PRO 989 N -0.68 0.04 -2.07 0.03 -0.02 -1.26 -4.39 135.00 126.65 3h0g n PRO 989 Ca 0.12 -1.15 -0.43 0.00 -2.02 0.00 0.00 63.50 60.02 3h0g n PRO 989 Cb 0.44 -2.88 -0.03 0.00 -0.02 0.00 0.00 33.50 31.01 3h0g n PRO 989 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 3h0g s PHE 990 N 10.56 1.94 -0.25 6.00 -0.12 -1.20 -4.62 117.98 130.29 3h0g s PHE 990 Ca 0.65 0.61 -0.26 0.00 -0.05 0.00 0.00 56.93 57.88 3h0g s PHE 990 Cb 0.05 -4.14 0.07 0.00 -0.63 0.00 0.00 43.02 38.37 3h0g s PHE 990 CO 0.23 -2.82 0.74 0.45 -0.05 0.00 0.00 175.22 173.77 3h0g s SER 991 N 5.48 -0.72 0.00 1.98 0.15 -0.92 -4.12 113.70 115.55 3h0g s SER 991 Ca 0.76 1.34 0.00 0.00 0.70 0.00 0.00 55.95 58.75 3h0g s SER 991 Cb -0.22 1.34 0.00 0.00 -1.71 0.00 0.00 66.02 65.44 3h0g s SER 991 CO 0.33 -0.27 0.31 0.00 1.20 0.00 0.00 173.24 174.81 3h0g n ALA 992 N 2.49 1.30 0.20 5.45 0.00 -1.26 -2.35 120.51 126.34 3h0g n ALA 992 Ca -0.14 -0.31 0.06 0.00 0.00 0.00 0.00 53.44 53.05 3h0g n ALA 992 Cb 0.55 0.00 0.38 0.00 0.00 0.00 0.00 19.45 20.38 3h0g n ALA 992 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 3h0g h GLN 993 N 0.00 0.00 -4.84 0.00 5.75 -1.93 -3.46 115.11 110.63 3h0g h GLN 993 Ca 0.00 0.00 -0.67 0.00 -0.15 0.00 0.00 58.65 57.83 3h0g h GLN 993 Cb 0.30 0.00 -0.37 0.00 1.07 0.00 0.00 27.48 28.48 3h0g h GLN 993 CO 0.00 0.35 -0.80 0.20 -2.65 0.00 0.00 178.83 175.93 3h0g s GLY 994 N -4.33 1.62 0.33 2.39 0.00 -1.26 -5.18 107.32 100.88 3h0g s GLY 994 Ca -0.01 -1.71 -0.01 0.00 0.00 0.00 0.00 44.72 42.99 3h0g s GLY 994 CO 0.68 0.62 0.45 0.29 0.00 0.00 0.00 173.10 175.14 3h0g n ILE 995 N 4.46 0.00 -3.83 0.90 -0.00 -0.99 -4.51 119.36 115.38 3h0g n ILE 995 Ca -0.14 -0.62 -0.15 0.00 -0.00 0.00 0.00 62.75 61.84 3h0g n ILE 995 Cb 0.43 -1.29 -0.16 0.00 -0.00 0.00 0.00 39.64 38.62 3h0g n ILE 995 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 3h0g s VAL 996 N -1.37 0.01 0.32 7.28 0.11 -1.26 -2.16 120.40 123.32 3h0g s VAL 996 Ca 0.29 0.14 -0.29 0.00 -2.93 0.00 0.00 61.98 59.19 3h0g s VAL 996 Cb -0.01 -0.11 -0.12 0.00 -1.53 0.00 0.00 36.38 34.60 3h0g s VAL 996 CO 0.19 0.08 1.36 -2.65 -3.33 0.00 0.00 175.10 170.76 3h0g n PRO 997 N 3.94 2.20 0.10 1.54 -0.02 -1.26 -4.92 135.00 136.58 3h0g n PRO 997 Ca -0.25 0.78 -0.22 0.00 -2.02 0.00 0.00 63.50 61.79 3h0g n PRO 997 Cb 0.52 -2.40 -0.14 0.00 -0.02 0.00 0.00 33.50 31.45 3h0g n PRO 997 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3h0g h ASP 998 N 3.17 0.74 -5.08 2.55 3.32 0.38 -3.41 116.42 118.10 3h0g h ASP 998 Ca -0.46 -0.89 -0.13 0.00 0.02 0.00 0.00 57.03 55.57 3h0g h ASP 998 Cb 1.27 -0.24 -0.18 0.00 0.22 0.00 0.00 39.33 40.41 3h0g h ASP 998 CO 0.67 1.57 -0.55 0.27 -1.72 0.00 0.00 179.24 179.48 3h0g s ILE 999 N -2.71 0.13 -0.10 0.35 -4.36 -1.23 -0.39 121.20 112.90 3h0g s ILE 999 Ca -0.11 -1.11 -0.02 0.00 -0.26 0.00 0.00 60.65 59.16 3h0g s ILE 999 Cb 0.04 -0.85 0.04 0.00 1.25 0.00 0.00 42.46 42.93 3h0g s ILE 999 CO 0.91 -0.61 0.02 0.27 0.24 0.00 0.00 174.94 175.76 3h0g s ILE 1000N -2.52 0.35 0.45 8.37 -4.36 -0.47 -1.92 121.20 121.09 3h0g s ILE 1000Ca -0.06 -0.01 -0.01 0.00 -0.26 0.00 0.00 60.65 60.31 3h0g s ILE 1000Cb -0.02 -0.61 -0.01 0.00 1.25 0.00 0.00 42.46 43.07 3h0g s ILE 1000CO -0.04 0.13 0.68 0.27 0.24 0.00 0.00 174.94 176.22 3h0g s ILE 1001N 1.97 4.22 -0.07 8.37 -5.25 -1.19 -3.10 121.20 126.16 3h0g s ILE 1001Ca 0.04 -0.38 -0.12 0.00 -0.99 0.00 0.00 60.65 59.20 3h0g s ILE 1001Cb -0.13 -3.57 -0.05 0.00 2.95 0.00 0.00 42.46 41.65 3h0g s ILE 1001CO -0.06 -0.43 0.30 0.21 -1.79 0.00 0.00 174.94 173.17 3h0g s ASN 1002N -4.19 6.61 0.41 4.36 2.47 -1.26 -1.80 114.94 121.54 3h0g s ASN 1002Ca 0.47 0.72 0.21 0.00 0.42 0.00 0.00 52.86 54.69 3h0g s ASN 1002Cb -0.10 -2.18 1.17 0.00 -1.45 0.00 0.00 41.25 38.69 3h0g s ASN 1002CO 0.39 0.31 1.61 -0.65 -3.72 0.00 0.00 177.10 175.04 3h0g h PRO 1003N 5.18 0.00 -0.00 0.43 0.11 -1.86 -1.88 132.00 133.97 3h0g h PRO 1003Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3h0g h PRO 1003Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3h0g h PRO 1003CO 0.63 0.00 -0.04 0.72 -0.21 0.00 0.00 178.00 179.10 3h0g n HIS 1004N -2.35 0.00 -0.80 0.65 8.25 -1.26 -3.07 115.22 116.64 3h0g n HIS 1004Ca -0.01 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.25 3h0g n HIS 1004Cb 0.22 -0.16 0.08 0.00 1.12 0.00 0.00 29.99 31.25 3h0g n HIS 1004CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3h0g n ALA 1005N -1.01 5.12 -0.73 -1.41 0.00 -0.71 -4.52 120.51 117.25 3h0g n ALA 1005Ca 0.17 -2.12 0.00 0.00 0.00 0.00 0.00 53.44 51.50 3h0g n ALA 1005Cb 0.22 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.25 3h0g n ALA 1005CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3h0g n ILE 1006N -0.28 0.00 -0.29 0.00 2.08 -1.17 -4.81 119.36 114.89 3h0g n ILE 1006Ca 0.40 0.00 0.29 0.00 0.56 0.00 0.00 62.75 64.00 3h0g n ILE 1006Cb 0.88 -0.53 0.66 0.00 -0.75 0.00 0.00 39.64 39.90 3h0g n ILE 1006CO 0.00 0.00 0.00 -0.65 0.56 0.00 0.00 176.55 176.46 3h0g h PRO 1007N 0.00 0.14 0.08 0.38 0.11 -1.79 -1.36 132.00 129.56 3h0g h PRO 1007Ca 0.00 -0.01 -0.34 0.00 0.11 0.00 0.00 66.00 65.76 3h0g h PRO 1007Cb 0.00 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.05 3h0g h PRO 1007CO 0.00 0.09 -1.91 -1.13 -0.21 0.00 0.00 178.00 174.85 3h0g n SER 1008N -4.36 1.63 -0.70 -2.05 3.41 -1.26 -3.69 113.62 106.60 3h0g n SER 1008Ca 0.24 0.28 0.04 0.00 -0.26 0.00 0.00 58.87 59.17 3h0g n SER 1008Cb 1.05 -0.53 0.14 0.00 -0.26 0.00 0.00 64.21 64.61 3h0g n SER 1008CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3h0g n ARG 1009N -3.30 1.95 -0.15 4.33 1.74 -0.75 -5.00 116.66 115.49 3h0g n ARG 1009Ca -0.27 -1.13 0.00 0.00 -0.77 0.00 0.00 57.85 55.68 3h0g n ARG 1009Cb 1.05 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 31.09 3h0g n ARG 1009CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 3h0g n MET 1010N 0.34 0.00 -3.05 5.56 2.81 -0.59 -4.77 117.12 117.42 3h0g n MET 1010Ca 0.10 0.00 -0.16 0.00 -1.81 0.00 0.00 57.70 55.83 3h0g n MET 1010Cb 0.36 0.00 -0.00 0.00 -0.71 0.00 0.00 33.22 32.87 3h0g n MET 1010CO 0.00 0.00 0.00 -2.37 1.51 0.00 0.00 175.97 175.11 3h0g n THR 1011N 0.52 -0.21 0.40 2.03 5.66 -1.26 -3.43 114.28 117.99 3h0g n THR 1011Ca 0.00 -3.54 0.04 0.00 -3.05 0.00 0.00 64.05 57.50 3h0g n THR 1011Cb 0.00 -0.01 0.21 0.00 -1.55 0.00 0.00 70.33 68.99 3h0g n THR 1011CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 3h0g n VAL 1012N 0.60 0.80 -0.01 1.08 0.31 -1.26 -1.81 118.33 118.04 3h0g n VAL 1012Ca 0.19 0.20 -0.17 0.00 -0.01 0.00 0.00 64.34 64.55 3h0g n VAL 1012Cb 0.64 -1.06 -0.10 0.00 -0.91 0.00 0.00 33.84 32.41 3h0g n VAL 1012CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h0g h ALA 1013N 2.40 0.12 -0.73 3.52 0.00 -1.91 -2.27 119.26 120.40 3h0g h ALA 1013Ca 0.00 -0.55 0.16 0.00 0.00 0.00 0.00 54.91 54.52 3h0g h ALA 1013Cb 0.08 0.02 -0.12 0.00 0.00 0.00 0.00 17.79 17.77 3h0g h ALA 1013CO 0.00 0.38 0.10 1.25 0.00 0.00 0.00 179.25 180.98 3h0g h HIS 1014N 0.01 0.12 0.32 0.00 6.17 -1.72 -0.02 115.15 120.03 3h0g h HIS 1014Ca -0.06 0.05 -0.01 0.00 0.71 0.00 0.00 60.37 61.05 3h0g h HIS 1014Cb 1.28 0.06 -0.00 0.00 2.52 0.00 0.00 27.41 31.26 3h0g h HIS 1014CO 0.13 -0.16 -0.21 -0.07 0.71 0.00 0.00 177.93 178.33 3h0g h LEU 1015N 0.18 -0.54 -0.87 0.26 3.38 -1.66 -3.07 115.31 113.00 3h0g h LEU 1015Ca 0.41 0.03 0.20 0.00 0.09 0.00 0.00 57.88 58.61 3h0g h LEU 1015Cb 0.72 0.16 -0.16 0.00 0.09 0.00 0.00 40.66 41.47 3h0g h LEU 1015CO -0.57 -0.32 -0.08 0.58 0.09 0.00 0.00 178.44 178.14 3h0g h VAL 1016N -0.50 0.16 -0.86 1.22 2.07 -0.65 0.30 116.25 117.99 3h0g h VAL 1016Ca -0.04 -0.01 0.14 0.00 0.82 0.00 0.00 66.70 67.61 3h0g h VAL 1016Cb 0.41 0.13 -0.09 0.00 -1.52 0.00 0.00 31.29 30.21 3h0g h VAL 1016CO 0.04 0.01 0.46 -0.08 0.02 0.00 0.00 177.57 178.01 3h0g h GLU 1017N 0.04 0.64 -0.12 1.57 4.81 -0.96 -0.51 114.58 120.04 3h0g h GLU 1017Ca 0.47 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.52 3h0g h GLU 1017Cb 0.82 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 3h0g h GLU 1017CO -0.83 0.43 -0.54 0.00 -0.73 0.00 0.00 179.01 177.34 3h0g h GLN 1019N 0.27 0.05 0.12 0.00 4.15 -0.81 -2.85 115.11 116.05 3h0g h GLN 1019Ca 0.01 -0.02 -0.28 0.00 0.77 0.00 0.00 58.65 59.12 3h0g h GLN 1019Cb 1.03 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.72 3h0g h GLN 1019CO 0.09 0.54 -1.42 1.25 -1.93 0.00 0.00 178.83 177.35 3h0g h LEU 1020N 0.04 0.41 -0.19 -2.39 6.46 -0.69 -3.15 115.31 115.80 3h0g h LEU 1020Ca -0.00 -0.87 0.05 0.00 -0.12 0.00 0.00 57.88 56.94 3h0g h LEU 1020Cb 0.90 -0.13 -0.07 0.00 -0.73 0.00 0.00 40.66 40.62 3h0g h LEU 1020CO 0.07 1.63 -0.42 0.77 -0.62 0.00 0.00 178.44 179.87 3h0g h SER 1021N -0.27 -1.32 -0.97 1.25 4.64 0.04 0.56 113.55 117.48 3h0g h SER 1021Ca -0.30 0.18 0.14 0.00 -0.47 0.00 0.00 61.79 61.34 3h0g h SER 1021Cb 1.79 0.55 -0.15 0.00 -0.31 0.00 0.00 62.40 64.28 3h0g h SER 1021CO 0.07 -0.41 -0.41 1.17 -0.87 0.00 0.00 176.83 176.39 3h0g n LYS 1022N -5.43 -0.26 0.01 4.77 4.81 -1.07 -0.15 118.16 120.83 3h0g n LYS 1022Ca -0.03 1.49 0.01 0.00 -0.87 0.00 0.00 58.31 58.91 3h0g n LYS 1022Cb 0.36 -2.20 0.06 0.00 0.02 0.00 0.00 35.03 33.27 3h0g n LYS 1022CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 3h0g n VAL 1023N -5.39 1.84 -0.22 3.15 0.31 0.16 0.30 118.33 118.47 3h0g n VAL 1023Ca 0.09 0.48 -0.10 0.00 -0.01 0.00 0.00 64.34 64.79 3h0g n VAL 1023Cb 0.37 -1.45 0.05 0.00 -0.91 0.00 0.00 33.84 31.90 3h0g n VAL 1023CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3h0g n SER 1024N -1.54 4.49 0.00 4.52 3.41 0.79 -4.46 113.62 120.82 3h0g n SER 1024Ca 0.00 -2.72 0.00 0.00 -0.26 0.00 0.00 58.87 55.89 3h0g n SER 1024Cb 0.02 -0.81 0.00 0.00 -0.26 0.00 0.00 64.21 63.16 3h0g n SER 1024CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h0g n ALA 1025N 0.20 0.00 -0.85 7.33 0.00 0.86 -3.94 120.51 124.12 3h0g n ALA 1025Ca 0.22 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.40 3h0g n ALA 1025Cb 0.78 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.20 3h0g n ALA 1025CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3h0g n LEU 1026N 0.00 5.17 0.12 0.00 0.00 -1.26 -2.77 117.00 118.26 3h0g n LEU 1026Ca 0.00 -3.03 0.00 0.00 0.00 0.00 0.00 56.01 52.98 3h0g n LEU 1026Cb 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 43.42 42.28 3h0g n LEU 1026CO 0.00 0.63 0.00 -1.54 0.00 0.00 0.00 177.39 176.48 3h0g n SER 1027N 4.56 -2.23 0.00 1.96 3.41 -1.26 -4.99 113.62 115.07 3h0g n SER 1027Ca 0.48 0.49 0.00 0.00 -0.26 0.00 0.00 58.87 59.57 3h0g n SER 1027Cb 0.17 2.30 0.00 0.00 -0.26 0.00 0.00 64.21 66.42 3h0g n SER 1027CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h0g n GLY 1028N -1.49 2.15 3.53 5.00 0.00 -1.12 -4.94 105.19 108.32 3h0g n GLY 1028Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 3h0g n GLY 1028CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3h0g n PHE 1029N -2.00 1.35 -1.44 1.61 3.01 -1.26 -4.78 117.46 113.94 3h0g n PHE 1029Ca 0.00 0.16 -0.46 0.00 1.01 0.00 0.00 57.45 58.16 3h0g n PHE 1029Cb 0.00 -2.59 -0.11 0.00 -0.01 0.00 0.00 39.48 36.77 3h0g n PHE 1029CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 3h0g n GLU 1030N 8.77 0.35 -2.40 -1.08 2.13 -1.26 -4.61 120.64 122.55 3h0g n GLU 1030Ca 0.42 0.05 -0.43 0.00 0.66 0.00 0.00 57.16 57.86 3h0g n GLU 1030Cb 0.40 -1.97 -0.02 0.00 0.27 0.00 0.00 31.44 30.11 3h0g n GLU 1030CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 3h0g s GLY 1031N 8.56 1.14 0.47 8.31 0.00 -1.23 -4.94 107.32 119.63 3h0g s GLY 1031Ca 1.22 -0.21 -0.24 0.00 0.00 0.00 0.00 44.72 45.50 3h0g s GLY 1031CO 0.49 2.70 1.34 0.51 0.00 0.00 0.00 173.10 178.14 3h0g s ASP 1032N 3.62 5.84 -0.16 1.64 -4.77 -1.25 -2.49 116.67 119.10 3h0g s ASP 1032Ca 0.59 2.72 0.15 0.00 -3.30 0.00 0.00 52.55 52.71 3h0g s ASP 1032Cb -0.13 -2.64 0.34 0.00 -1.09 0.00 0.00 42.92 39.41 3h0g s ASP 1032CO 0.32 -1.18 1.18 0.00 0.70 0.00 0.00 175.17 176.19 3h0g n ALA 1033N -0.41 2.85 -1.70 2.11 0.00 0.20 -4.78 120.51 118.79 3h0g n ALA 1033Ca 0.07 -2.89 -0.55 0.00 0.00 0.00 0.00 53.44 50.06 3h0g n ALA 1033Cb 0.44 -0.37 -0.07 0.00 0.00 0.00 0.00 19.45 19.45 3h0g n ALA 1033CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3h0g n THR 1034N -1.27 0.35 -0.19 0.00 -1.04 -1.26 -2.96 114.28 107.91 3h0g n THR 1034Ca 0.17 -0.06 0.03 0.00 -2.04 0.00 0.00 64.05 62.15 3h0g n THR 1034Cb 0.67 -1.34 0.08 0.00 -1.82 0.00 0.00 70.33 67.91 3h0g n THR 1034CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 3h0g n PRO 1035N 5.50 -0.05 -3.75 -2.82 -0.02 -1.26 -3.55 135.00 129.05 3h0g n PRO 1035Ca 0.25 0.81 -0.30 0.00 -2.02 0.00 0.00 63.50 62.24 3h0g n PRO 1035Cb 0.17 -1.21 -0.15 0.00 -0.02 0.00 0.00 33.50 32.29 3h0g n PRO 1035CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3h0g s PHE 1036N -5.63 1.86 0.26 6.00 0.40 -1.26 -4.26 117.98 115.35 3h0g s PHE 1036Ca -0.08 -1.85 0.00 0.00 -0.60 0.00 0.00 56.93 54.41 3h0g s PHE 1036Cb 0.14 -1.81 -0.03 0.00 0.51 0.00 0.00 43.02 41.84 3h0g s PHE 1036CO 0.40 -0.88 0.24 -0.08 0.70 0.00 0.00 175.22 175.61 3h0g s THR 1037N 1.52 0.00 -0.81 0.64 -1.32 -1.23 -5.02 115.64 109.42 3h0g s THR 1037Ca 0.10 -1.91 0.23 0.00 -1.21 0.00 0.00 61.69 58.91 3h0g s THR 1037Cb -0.18 -2.49 0.22 0.00 -1.51 0.00 0.00 72.50 68.55 3h0g s THR 1037CO -0.23 0.00 1.73 -0.90 -2.21 0.00 0.00 174.62 173.01 3h0g n ASP 1038N -0.80 0.36 -4.66 8.08 3.85 -1.26 -4.82 116.55 117.29 3h0g n ASP 1038Ca 0.03 0.56 -0.42 0.00 -0.71 0.00 0.00 54.79 54.25 3h0g n ASP 1038Cb 0.64 -0.65 -0.03 0.00 -1.35 0.00 0.00 41.12 39.73 3h0g n ASP 1038CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 3h0g s VAL 1039N -3.10 3.15 0.31 2.12 1.01 -1.26 -4.98 120.40 117.65 3h0g s VAL 1039Ca 0.09 0.19 0.07 0.00 0.00 0.00 0.00 61.98 62.33 3h0g s VAL 1039Cb 0.13 -3.12 -0.06 0.00 0.00 0.00 0.00 36.38 33.32 3h0g s VAL 1039CO 0.45 -0.02 -0.04 0.28 0.00 0.00 0.00 175.10 175.77 3h0g s THR 1040N 4.35 1.74 0.11 3.92 -1.32 -1.26 -5.01 115.64 118.17 3h0g s THR 1040Ca 0.85 -2.11 -0.29 0.00 -1.21 0.00 0.00 61.69 58.93 3h0g s THR 1040Cb -0.40 -2.60 -0.10 0.00 -1.51 0.00 0.00 72.50 67.89 3h0g s THR 1040CO 0.39 -0.21 1.62 0.58 -2.21 0.00 0.00 174.62 174.79 3h0g h VAL 1041N 2.15 0.35 -0.01 5.08 2.07 -1.93 0.63 116.25 124.58 3h0g h VAL 1041Ca -0.41 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.11 3h0g h VAL 1041Cb 1.24 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 31.36 3h0g h VAL 1041CO 0.70 0.00 0.29 -0.33 0.02 0.00 0.00 177.57 178.25 3h0g h GLU 1042N -0.56 0.00 0.09 1.57 4.39 -1.96 -0.44 114.58 117.66 3h0g h GLU 1042Ca 0.02 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.55 3h0g h GLU 1042Cb 0.57 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.22 3h0g h GLU 1042CO -0.14 0.00 -0.78 0.00 -1.16 0.00 0.00 179.01 176.93 3h0g h ALA 1043N 1.43 0.02 -0.26 3.43 0.00 -1.32 -3.29 119.26 119.28 3h0g h ALA 1043Ca 0.01 -0.78 -0.16 0.00 0.00 0.00 0.00 54.91 53.97 3h0g h ALA 1043Cb 0.58 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 3h0g h ALA 1043CO -0.00 0.41 -0.50 0.28 0.00 0.00 0.00 179.25 179.44 3h0g h VAL 1044N -0.57 1.30 -0.11 0.00 2.07 -0.12 -3.02 116.25 115.79 3h0g h VAL 1044Ca -0.16 -1.70 0.04 0.00 0.82 0.00 0.00 66.70 65.69 3h0g h VAL 1044Cb 1.48 1.63 -0.06 0.00 -1.52 0.00 0.00 31.29 32.81 3h0g h VAL 1044CO 0.06 0.54 -0.48 0.77 0.02 0.00 0.00 177.57 178.48 3h0g h SER 1045N 0.56 -1.52 -0.96 0.57 4.64 -1.28 0.13 113.55 115.69 3h0g h SER 1045Ca 0.02 0.19 0.22 0.00 -0.47 0.00 0.00 61.79 61.75 3h0g h SER 1045Cb 1.06 0.60 -0.12 0.00 -0.31 0.00 0.00 62.40 63.63 3h0g h SER 1045CO 0.10 -0.47 0.53 0.11 -0.87 0.00 0.00 176.83 176.24 3h0g h LYS 1046N -0.56 0.55 0.00 4.77 1.57 -1.61 2.15 116.57 123.45 3h0g h LYS 1046Ca 0.05 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3h0g h LYS 1046Cb 0.67 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.85 3h0g h LYS 1046CO -0.41 0.36 0.00 1.28 -0.57 0.00 0.00 179.45 180.12 3h0g n LEU 1047N -4.91 0.49 -0.01 2.94 4.77 0.30 -3.03 117.00 117.55 3h0g n LEU 1047Ca 0.24 0.67 -0.00 0.00 -0.03 0.00 0.00 56.01 56.90 3h0g n LEU 1047Cb 0.67 -0.67 -0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3h0g n LEU 1047CO 0.17 -0.69 -0.00 -0.07 -1.33 0.00 0.00 177.39 175.46 3h0g h LEU 1048N 0.00 0.00 -2.23 2.23 3.38 0.50 -3.30 115.31 115.90 3h0g h LEU 1048Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3h0g h LEU 1048Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3h0g h LEU 1048CO 0.00 0.13 0.21 -0.09 0.09 0.00 0.00 178.44 178.78 3h0g h ARG 1049N -0.26 0.00 0.00 1.13 2.43 -1.62 0.57 114.38 116.63 3h0g h ARG 1049Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3h0g h ARG 1049Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 3h0g h ARG 1049CO 0.00 0.00 0.44 1.03 -1.51 0.00 0.00 179.97 179.93 3h0g h SER 1050N 0.00 0.00 -0.00 -3.80 0.87 -1.62 0.54 113.55 109.54 3h0g h SER 1050Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 3h0g h SER 1050Cb 0.41 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.37 3h0g h SER 1050CO 0.00 0.00 0.00 1.41 -0.53 0.00 0.00 176.83 177.71 3h0g n HIS 1051N -2.23 0.00 0.00 2.24 8.25 0.20 -5.00 115.22 118.69 3h0g n HIS 1051Ca -0.01 -0.02 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 3h0g n HIS 1051Cb 0.46 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.57 3h0g n HIS 1051CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3h0g n GLY 1052N 0.03 0.88 0.36 -1.41 0.00 0.19 -5.08 105.19 100.16 3h0g n GLY 1052Ca 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.01 3h0g n GLY 1052CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3h0g n PHE 1053N -0.74 -3.21 -3.18 1.61 3.01 -1.25 -4.96 117.46 108.74 3h0g n PHE 1053Ca 0.00 -0.17 -0.40 0.00 1.01 0.00 0.00 57.45 57.89 3h0g n PHE 1053Cb 0.00 -0.06 -0.06 0.00 -0.01 0.00 0.00 39.48 39.34 3h0g n PHE 1053CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 3h0g s GLN 1054N -2.51 4.19 -0.01 -1.08 1.11 -1.26 -3.82 119.66 116.28 3h0g s GLN 1054Ca 0.06 0.51 -0.01 0.00 0.01 0.00 0.00 55.36 55.93 3h0g s GLN 1054Cb -0.00 -3.58 -0.03 0.00 -1.01 0.00 0.00 33.01 28.38 3h0g s GLN 1054CO 0.04 -0.22 0.90 -1.13 0.01 0.00 0.00 175.29 174.88 3h0g n SER 1055N 5.02 0.66 0.00 5.90 3.41 -1.26 -1.26 113.62 126.09 3h0g n SER 1055Ca -0.03 -1.64 0.00 0.00 -0.26 0.00 0.00 58.87 56.94 3h0g n SER 1055Cb 0.50 -0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 3h0g n SER 1055CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 3h0g n ARG 1056N 3.04 0.00 0.00 4.33 0.00 -1.26 -4.74 116.66 118.03 3h0g n ARG 1056Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.90 3h0g n ARG 1056Cb 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 32.57 3h0g n ARG 1056CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3h0g n GLY 1057N 0.00 3.11 2.62 2.89 0.00 -0.39 -5.04 105.19 108.38 3h0g n GLY 1057Ca 0.00 -0.86 -0.02 0.00 0.00 0.00 0.00 46.02 45.14 3h0g n GLY 1057CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3h0g n PHE 1058N 0.00 -1.21 -3.62 1.61 0.99 -1.26 -4.42 117.46 109.54 3h0g n PHE 1058Ca 0.00 0.65 -0.04 0.00 -0.00 0.00 0.00 57.45 58.06 3h0g n PHE 1058Cb 0.00 -1.31 -0.03 0.00 -1.00 0.00 0.00 39.48 37.14 3h0g n PHE 1058CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 176.76 174.76 3h0g s GLU 1059N -1.90 0.20 0.51 -1.08 2.12 -0.40 -4.48 118.70 113.67 3h0g s GLU 1059Ca 0.01 -0.04 -0.14 0.00 0.36 0.00 0.00 54.97 55.17 3h0g s GLU 1059Cb 0.00 0.09 -0.07 0.00 0.26 0.00 0.00 34.13 34.42 3h0g s GLU 1059CO 0.03 -0.08 0.94 0.14 -0.54 0.00 0.00 175.26 175.75 3h0g s VAL 1060N -1.87 4.64 -0.02 3.70 -7.23 -1.26 -1.75 120.40 116.61 3h0g s VAL 1060Ca 0.09 0.98 -0.01 0.00 -1.81 0.00 0.00 61.98 61.23 3h0g s VAL 1060Cb -0.01 -3.76 0.02 0.00 0.56 0.00 0.00 36.38 33.19 3h0g s VAL 1060CO -0.04 -0.75 0.04 -0.04 -0.31 0.00 0.00 175.10 173.99 3h0g s MET 1061N -4.27 0.01 -0.20 4.82 -1.94 -1.26 -4.47 119.30 111.99 3h0g s MET 1061Ca 0.56 0.14 -0.06 0.00 -1.71 0.00 0.00 55.69 54.62 3h0g s MET 1061Cb -0.10 -0.12 -0.03 0.00 2.01 0.00 0.00 34.83 36.59 3h0g s MET 1061CO 0.36 -0.09 0.03 0.71 -0.01 0.00 0.00 175.02 176.02 3h0g s TYR 1062N 0.59 3.11 0.57 -0.03 4.12 -1.26 -0.22 117.35 124.24 3h0g s TYR 1062Ca -0.05 -0.25 -0.20 0.00 0.02 0.00 0.00 57.07 56.59 3h0g s TYR 1062Cb -0.07 -2.10 -0.05 0.00 -1.52 0.00 0.00 41.96 38.22 3h0g s TYR 1062CO -0.02 -0.11 1.11 1.58 0.02 0.00 0.00 175.55 178.13 3h0g n HIS 1063N 4.06 1.36 0.05 2.71 -0.00 -0.46 -3.21 115.22 119.73 3h0g n HIS 1063Ca -0.17 0.45 -0.08 0.00 0.46 0.00 0.00 57.72 58.38 3h0g n HIS 1063Cb 0.52 -2.22 -0.12 0.00 -0.12 0.00 0.00 29.99 28.05 3h0g n HIS 1063CO 0.00 0.00 0.00 0.78 0.46 0.00 0.00 176.34 177.58 3h0g h GLY 1064N 0.84 0.01 0.05 1.57 0.00 -1.75 -2.90 103.07 100.89 3h0g h GLY 1064Ca -0.49 -0.03 -0.00 0.00 0.00 0.00 0.00 47.33 46.81 3h0g h GLY 1064CO 0.53 0.02 -0.02 0.45 0.00 0.00 0.00 176.54 177.53 3h0g h HIS 1065N 0.00 -0.06 0.13 5.60 3.86 -1.83 -3.42 115.15 119.44 3h0g h HIS 1065Ca -0.05 -0.00 -0.32 0.00 -1.16 0.00 0.00 60.37 58.84 3h0g h HIS 1065Cb 1.81 0.02 -0.00 0.00 1.06 0.00 0.00 27.41 30.29 3h0g h HIS 1065CO 0.00 -0.04 -1.63 0.00 0.86 0.00 0.00 177.93 177.13 3h0g h THR 1066N -0.46 0.91 0.00 2.45 1.03 -1.98 -3.48 112.91 111.38 3h0g h THR 1066Ca -0.01 -2.41 0.00 0.00 -0.01 0.00 0.00 66.41 63.98 3h0g h THR 1066Cb 0.05 2.66 0.00 0.00 -1.07 0.00 0.00 68.15 69.79 3h0g h THR 1066CO 0.01 0.77 0.00 0.61 -0.01 0.00 0.00 175.52 176.90 3h0g n GLY 1067N 1.82 0.46 3.69 2.99 0.00 -1.09 -5.02 105.19 108.04 3h0g n GLY 1067Ca -0.27 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.31 3h0g n GLY 1067CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3h0g n ARG 1068N -1.40 2.29 -1.68 1.61 3.00 -1.26 -4.58 116.66 114.64 3h0g n ARG 1068Ca 0.00 0.82 -0.39 0.00 -0.00 0.00 0.00 57.85 58.28 3h0g n ARG 1068Cb 0.00 -2.54 0.04 0.00 0.00 0.00 0.00 32.46 29.96 3h0g n ARG 1068CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 3h0g n LYS 1069N 2.38 1.45 -2.69 -0.14 5.02 -1.26 -1.36 118.16 121.57 3h0g n LYS 1069Ca 0.12 0.53 -0.42 0.00 -2.02 0.00 0.00 58.31 56.52 3h0g n LYS 1069Cb 0.33 -2.35 -0.03 0.00 -0.02 0.00 0.00 35.03 32.96 3h0g n LYS 1069CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3h0g s LEU 1070N -2.32 4.41 0.22 -0.35 1.43 0.70 -4.85 118.68 117.92 3h0g s LEU 1070Ca 0.70 1.74 -0.19 0.00 -1.03 0.00 0.00 54.13 55.35 3h0g s LEU 1070Cb -0.45 -3.58 0.20 0.00 0.03 0.00 0.00 46.19 42.39 3h0g s LEU 1070CO 0.51 -0.22 1.56 0.58 0.23 0.00 0.00 176.35 179.01 3h0g h VAL 1071N 4.54 0.04 -3.67 -1.59 2.07 -1.93 -3.42 116.25 112.30 3h0g h VAL 1071Ca -0.42 0.00 -0.49 0.00 0.82 0.00 0.00 66.70 66.61 3h0g h VAL 1071Cb 1.22 0.04 0.04 0.00 -1.52 0.00 0.00 31.29 31.07 3h0g h VAL 1071CO 0.75 0.00 0.15 0.00 0.02 0.00 0.00 177.57 178.49 3h0g s ALA 1072N -5.95 3.36 -0.12 1.67 0.00 -1.26 -5.07 121.76 114.40 3h0g s ALA 1072Ca -0.14 -0.46 -0.12 0.00 0.00 0.00 0.00 51.96 51.24 3h0g s ALA 1072Cb 0.19 -2.65 -0.05 0.00 0.00 0.00 0.00 23.12 20.61 3h0g s ALA 1072CO 0.71 -0.41 0.27 -0.65 0.00 0.00 0.00 175.76 175.68 3h0g s GLN 1073N -4.80 3.97 0.04 0.00 -1.52 -1.26 -4.67 119.66 111.40 3h0g s GLN 1073Ca 0.48 0.09 -0.15 0.00 -1.95 0.00 0.00 55.36 53.83 3h0g s GLN 1073Cb -0.10 -3.32 -0.06 0.00 -0.22 0.00 0.00 33.01 29.31 3h0g s GLN 1073CO 0.46 0.48 0.45 0.08 -0.25 0.00 0.00 175.29 176.51 3h0g s VAL 1074N -0.27 4.97 -0.94 1.09 1.01 -0.72 -4.82 120.40 120.71 3h0g s VAL 1074Ca 0.17 0.85 -0.20 0.00 0.00 0.00 0.00 61.98 62.80 3h0g s VAL 1074Cb -0.13 -3.74 0.11 0.00 0.00 0.00 0.00 36.38 32.62 3h0g s VAL 1074CO 0.06 0.50 1.20 0.12 0.00 0.00 0.00 175.10 176.98 3h0g s PHE 1075N -1.17 2.96 -0.17 5.22 5.36 -1.26 -1.28 117.98 127.64 3h0g s PHE 1075Ca 0.27 -1.23 -0.07 0.00 -0.96 0.00 0.00 56.93 54.94 3h0g s PHE 1075Cb -0.17 -4.39 -0.04 0.00 -0.34 0.00 0.00 43.02 38.09 3h0g s PHE 1075CO 0.16 -1.61 0.07 -1.17 -1.46 0.00 0.00 175.22 171.21 3h0g s LEU 1076N 3.30 3.87 0.00 6.12 0.20 -1.26 -2.24 118.68 128.67 3h0g s LEU 1076Ca 0.36 0.12 0.00 0.00 0.69 0.00 0.00 54.13 55.30 3h0g s LEU 1076Cb -0.04 -1.97 0.00 0.00 -0.43 0.00 0.00 46.19 43.75 3h0g s LEU 1076CO -0.09 0.20 0.00 0.61 -0.29 0.00 0.00 176.35 176.78 3h0g n GLY 1077N 3.35 0.81 1.81 7.98 0.00 -0.07 -4.76 105.19 114.30 3h0g n GLY 1077Ca -0.17 0.56 -0.22 0.00 0.00 0.00 0.00 46.02 46.19 3h0g n GLY 1077CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3h0g n PRO 1078N 0.00 0.00 -3.70 1.61 -0.02 -1.26 -3.91 135.00 127.72 3h0g n PRO 1078Ca 0.00 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.46 3h0g n PRO 1078Cb 0.00 -0.57 -0.01 0.00 -0.02 0.00 0.00 33.50 32.90 3h0g n PRO 1078CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 3h0g s THR 1079N -1.14 0.00 -0.16 3.45 -1.32 -0.89 -4.27 115.64 111.31 3h0g s THR 1079Ca 0.30 -0.48 -0.05 0.00 -1.21 0.00 0.00 61.69 60.24 3h0g s THR 1079Cb -0.23 -1.91 -0.04 0.00 -1.51 0.00 0.00 72.50 68.81 3h0g s THR 1079CO 0.40 0.00 0.02 -0.72 -2.21 0.00 0.00 174.62 172.12 3h0g s TYR 1080N -3.01 3.17 0.05 9.09 -0.00 -1.26 0.33 117.35 125.72 3h0g s TYR 1080Ca 0.12 -0.03 0.02 0.00 -0.00 0.00 0.00 57.07 57.18 3h0g s TYR 1080Cb 0.00 -2.00 -0.04 0.00 -0.00 0.00 0.00 41.96 39.93 3h0g s TYR 1080CO -0.00 0.14 0.06 0.71 -0.00 0.00 0.00 175.55 176.46 3h0g s TYR 1081N 0.19 3.19 -0.20 -3.49 1.51 -0.97 -4.45 117.35 113.13 3h0g s TYR 1081Ca 0.02 0.10 -0.16 0.00 -1.01 0.00 0.00 57.07 56.02 3h0g s TYR 1081Cb -0.13 -1.65 -0.04 0.00 -0.11 0.00 0.00 41.96 40.03 3h0g s TYR 1081CO 0.01 0.52 0.42 -0.65 -1.11 0.00 0.00 175.55 174.75 3h0g s GLN 1082N -2.10 4.18 -0.69 -0.62 -0.21 -0.17 -3.18 119.66 116.88 3h0g s GLN 1082Ca 0.26 0.25 -0.26 0.00 0.02 0.00 0.00 55.36 55.63 3h0g s GLN 1082Cb -0.12 -3.54 -0.03 0.00 1.00 0.00 0.00 33.01 30.32 3h0g s GLN 1082CO 0.18 -0.05 1.89 0.50 -2.12 0.00 0.00 175.29 175.69 3h0g s ARG 1083N 1.34 2.60 0.83 2.91 3.00 -1.26 -2.87 118.95 125.50 3h0g s ARG 1083Ca 0.20 0.39 -0.10 0.00 -1.00 0.00 0.00 55.73 55.22 3h0g s ARG 1083Cb -0.15 -4.56 0.09 0.00 0.00 0.00 0.00 34.95 30.33 3h0g s ARG 1083CO 0.08 -2.91 1.11 -0.51 0.00 0.00 0.00 175.30 173.08 3h0g s LEU 1084N 9.39 2.94 0.00 -0.88 1.43 -1.15 -2.41 118.68 128.00 3h0g s LEU 1084Ca 0.68 1.96 0.00 0.00 -1.03 0.00 0.00 54.13 55.74 3h0g s LEU 1084Cb -0.11 -4.53 0.00 0.00 0.03 0.00 0.00 46.19 41.58 3h0g s LEU 1084CO 0.15 -2.46 0.00 0.29 0.23 0.00 0.00 176.35 174.56 3h0g n LYS 1085N -3.81 0.55 -2.99 1.70 5.02 -0.65 -4.75 118.16 113.23 3h0g n LYS 1085Ca 0.10 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.39 3h0g n LYS 1085Cb 0.53 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.53 3h0g n LYS 1085CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 3h0g n HIS 1086N -1.45 -1.51 -2.19 2.13 1.44 -1.26 -4.80 115.22 107.58 3h0g n HIS 1086Ca 0.00 0.73 -0.20 0.00 -2.01 0.00 0.00 57.72 56.23 3h0g n HIS 1086Cb 0.00 -2.09 0.12 0.00 0.12 0.00 0.00 29.99 28.14 3h0g n HIS 1086CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3h0g n LEU 1087N 1.37 0.00 -0.07 2.39 4.77 -1.26 -4.48 117.00 119.72 3h0g n LEU 1087Ca -0.04 -1.45 -0.10 0.00 -0.03 0.00 0.00 56.01 54.39 3h0g n LEU 1087Cb 0.30 -0.64 -0.08 0.00 -2.33 0.00 0.00 43.42 40.68 3h0g n LEU 1087CO 0.16 -1.04 0.04 0.58 -1.33 0.00 0.00 177.39 175.80 3h0g h VAL 1088N -1.01 0.91 0.00 4.08 2.07 -1.94 -3.32 116.25 117.05 3h0g h VAL 1088Ca -0.29 -1.76 0.00 0.00 0.82 0.00 0.00 66.70 65.46 3h0g h VAL 1088Cb 0.95 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 32.52 3h0g h VAL 1088CO 0.26 0.31 0.04 0.47 0.02 0.00 0.00 177.57 178.67 3h0g n ASP 1089N -4.63 0.00 -0.01 0.57 8.00 -1.26 0.23 116.55 119.45 3h0g n ASP 1089Ca -0.10 0.05 0.07 0.00 0.71 0.00 0.00 54.79 55.52 3h0g n ASP 1089Cb 0.34 -0.05 -0.11 0.00 -0.02 0.00 0.00 41.12 41.29 3h0g n ASP 1089CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3h0g n ASP 1090N -0.86 1.84 -0.19 -2.24 8.00 -1.25 -4.62 116.55 117.23 3h0g n ASP 1090Ca 0.00 0.00 0.10 0.00 0.71 0.00 0.00 54.79 55.60 3h0g n ASP 1090Cb 0.04 1.63 -0.07 0.00 -0.02 0.00 0.00 41.12 42.70 3h0g n ASP 1090CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3h0g n LYS 1091N -1.98 0.45 -2.50 -1.24 5.02 0.63 -4.96 118.16 113.58 3h0g n LYS 1091Ca -0.03 -0.37 -0.37 0.00 -2.02 0.00 0.00 58.31 55.52 3h0g n LYS 1091Cb 0.36 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.84 3h0g n LYS 1091CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3h0g s ILE 1092N -2.80 3.63 -0.11 -0.18 -4.36 -1.05 -5.05 121.20 111.28 3h0g s ILE 1092Ca 0.12 1.25 -0.10 0.00 -0.26 0.00 0.00 60.65 61.66 3h0g s ILE 1092Cb 0.17 -3.64 0.03 0.00 1.25 0.00 0.00 42.46 40.27 3h0g s ILE 1092CO 0.76 0.00 0.29 -2.28 0.24 0.00 0.00 174.94 173.95 3h0g s HIS 1093N -1.64 -0.33 -0.15 1.37 2.46 -1.26 -5.07 115.29 110.67 3h0g s HIS 1093Ca 0.59 0.80 -0.07 0.00 0.47 0.00 0.00 55.06 56.85 3h0g s HIS 1093Cb -0.23 0.11 0.06 0.00 -0.13 0.00 0.00 32.58 32.39 3h0g s HIS 1093CO 0.29 -0.17 0.34 0.00 -2.47 0.00 0.00 174.74 172.73 3h0g s ALA 1094N 0.30 -0.85 0.37 1.58 0.00 -1.26 -5.15 121.76 116.76 3h0g s ALA 1094Ca -0.01 1.30 0.08 0.00 0.00 0.00 0.00 51.96 53.33 3h0g s ALA 1094Cb -0.03 -0.86 -0.06 0.00 0.00 0.00 0.00 23.12 22.17 3h0g s ALA 1094CO -0.01 -0.30 0.08 0.50 0.00 0.00 0.00 175.76 176.03 3h0g s ARG 1095N 1.51 2.14 0.00 0.00 6.06 -1.26 -4.69 118.95 122.71 3h0g s ARG 1095Ca -0.08 -1.81 0.00 0.00 -2.50 0.00 0.00 55.73 51.34 3h0g s ARG 1095Cb -0.10 -1.93 0.00 0.00 0.06 0.00 0.00 34.95 32.98 3h0g s ARG 1095CO -0.11 0.02 0.00 0.00 -2.50 0.00 0.00 175.30 172.71 3h0g n ALA 1096N -1.07 0.00 -3.07 6.12 0.00 -1.26 -4.99 120.51 116.25 3h0g n ALA 1096Ca -0.03 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.28 3h0g n ALA 1096Cb 0.64 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.13 3h0g n ALA 1096CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3h0g n ARG 1097N 0.00 -4.47 -2.25 0.00 1.74 -1.26 -5.03 116.66 105.39 3h0g n ARG 1097Ca 0.00 0.49 -0.26 0.00 -0.77 0.00 0.00 57.85 57.30 3h0g n ARG 1097Cb 0.00 -4.47 0.12 0.00 -1.02 0.00 0.00 32.46 27.09 3h0g n ARG 1097CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3h0g s GLY 1098N -3.33 1.74 1.04 -0.13 0.00 -1.26 -5.05 107.32 100.33 3h0g s GLY 1098Ca 0.26 -1.27 -0.19 0.00 0.00 0.00 0.00 44.72 43.51 3h0g s GLY 1098CO 0.42 -0.71 -0.41 -1.05 0.00 0.00 0.00 173.10 171.35 3h0g n PRO 1099N -3.13 -0.69 -3.82 2.90 -0.02 -1.26 -4.89 135.00 124.08 3h0g n PRO 1099Ca 0.12 -0.18 -0.11 0.00 -2.02 0.00 0.00 63.50 61.31 3h0g n PRO 1099Cb 0.60 -1.46 -0.08 0.00 -0.02 0.00 0.00 33.50 32.54 3h0g n PRO 1099CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3h0g s VAL 1100N -2.18 0.11 1.09 -1.45 -7.23 -1.26 -3.40 120.40 106.07 3h0g s VAL 1100Ca 0.49 -0.87 -0.15 0.00 -1.81 0.00 0.00 61.98 59.64 3h0g s VAL 1100Cb -0.09 -0.95 0.14 0.00 0.56 0.00 0.00 36.38 36.04 3h0g s VAL 1100CO 0.69 -0.48 0.42 0.00 -0.31 0.00 0.00 175.10 175.43 3h0g n GLN 1101N 0.60 -1.49 -0.07 4.82 1.13 0.10 -4.85 117.38 117.63 3h0g n GLN 1101Ca -0.18 -0.41 -0.20 0.00 -1.94 0.00 0.00 57.00 54.27 3h0g n GLN 1101Cb 0.59 -1.90 -0.13 0.00 0.11 0.00 0.00 30.24 28.91 3h0g n GLN 1101CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 3h0g n ILE 1102N -4.40 1.63 -0.03 5.09 2.08 -1.26 -3.16 119.36 119.31 3h0g n ILE 1102Ca 0.03 -0.61 -0.16 0.00 0.56 0.00 0.00 62.75 62.58 3h0g n ILE 1102Cb 0.58 -1.57 -0.10 0.00 -0.75 0.00 0.00 39.64 37.80 3h0g n ILE 1102CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 3h0g h LEU 1103N 0.03 0.44 0.00 1.39 3.38 -1.98 -3.34 115.31 115.23 3h0g h LEU 1103Ca -0.51 -0.67 -0.13 0.00 0.09 0.00 0.00 57.88 56.66 3h0g h LEU 1103Cb 1.96 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 42.56 3h0g h LEU 1103CO -0.01 1.04 -2.05 1.07 0.09 0.00 0.00 178.44 178.58 3h0g n THR 1104N -4.37 0.56 -1.58 0.22 5.66 -1.26 -4.99 114.28 108.52 3h0g n THR 1104Ca -0.09 -0.63 -0.13 0.00 -3.05 0.00 0.00 64.05 60.15 3h0g n THR 1104Cb 0.54 -0.21 -0.04 0.00 -1.55 0.00 0.00 70.33 69.07 3h0g n THR 1104CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 3h0g n ARG 1105N -2.48 -0.93 -3.32 1.09 5.12 -1.19 -4.46 116.66 110.49 3h0g n ARG 1105Ca -0.14 0.88 -0.21 0.00 -1.93 0.00 0.00 57.85 56.45 3h0g n ARG 1105Cb 0.78 -4.97 0.03 0.00 -1.16 0.00 0.00 32.46 27.14 3h0g n ARG 1105CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 3h0g s GLN 1106N -3.45 2.39 0.35 5.56 -0.21 -1.26 -4.74 119.66 118.29 3h0g s GLN 1106Ca 0.00 -1.68 -0.28 0.00 0.02 0.00 0.00 55.36 53.42 3h0g s GLN 1106Cb 0.00 -2.49 -0.10 0.00 1.00 0.00 0.00 33.01 31.43 3h0g s GLN 1106CO 0.00 -0.64 1.26 -2.14 -2.12 0.00 0.00 175.29 171.64 3h0g s PRO 1107N -4.46 4.28 1.28 2.91 0.02 -1.26 0.01 135.00 137.78 3h0g s PRO 1107Ca 0.52 2.09 -0.21 0.00 0.02 0.00 0.00 61.00 63.42 3h0g s PRO 1107Cb -0.05 -2.97 0.33 0.00 0.02 0.00 0.00 34.50 31.83 3h0g s PRO 1107CO 0.32 -0.21 0.75 1.55 -0.33 0.00 0.00 177.00 179.08 3h0g n VAL 1108N 0.61 0.00 -2.95 3.83 3.14 -1.20 -4.43 118.33 117.33 3h0g n VAL 1108Ca 0.01 0.00 -0.19 0.00 -2.96 0.00 0.00 64.34 61.20 3h0g n VAL 1108Cb 0.43 -0.85 0.04 0.00 -1.06 0.00 0.00 33.84 32.40 3h0g n VAL 1108CO 0.00 0.00 0.00 -0.70 -6.46 0.00 0.00 176.83 169.67 3h0g s GLU 1109N -4.76 2.52 0.90 1.45 2.12 -1.20 0.10 118.70 119.83 3h0g s GLU 1109Ca 0.58 -1.34 -0.16 0.00 0.36 0.00 0.00 54.97 54.42 3h0g s GLU 1109Cb -0.10 -2.66 -0.14 0.00 0.26 0.00 0.00 34.13 31.49 3h0g s GLU 1109CO 0.48 -0.62 -0.72 0.41 -0.54 0.00 0.00 175.26 174.27 3h0g n GLY 1110N -2.12 -4.22 7.00 -1.50 0.00 -1.26 -4.47 105.19 98.62 3h0g n GLY 1110Ca 0.11 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.42 3h0g n GLY 1110CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h0g n ARG 1111N 2.25 0.00 0.00 1.61 1.74 -1.26 -4.92 116.66 116.08 3h0g n ARG 1111Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 3h0g n ARG 1111Cb 0.51 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.95 3h0g n ARG 1111CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3h0g n SER 1112N -0.46 0.00 0.00 0.55 3.41 -1.26 -4.13 113.62 111.72 3h0g n SER 1112Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3h0g n SER 1112Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3h0g n SER 1112CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 3h0g n ARG 1113N 0.00 0.00 -1.53 4.33 1.85 -1.26 -4.96 116.66 115.09 3h0g n ARG 1113Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 57.85 56.82 3h0g n ARG 1113Cb 0.00 0.00 0.02 0.00 -1.05 0.00 0.00 32.46 31.43 3h0g n ARG 1113CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 3h0g n ASP 1114N 0.00 -0.72 -4.03 2.89 2.03 -1.26 -4.63 116.55 110.84 3h0g n ASP 1114Ca 0.00 -1.45 -0.26 0.00 0.52 0.00 0.00 54.79 53.60 3h0g n ASP 1114Cb 0.00 0.29 -0.06 0.00 -0.72 0.00 0.00 41.12 40.63 3h0g n ASP 1114CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3h0g n GLY 1115N -0.48 3.44 0.00 0.27 0.00 -1.26 -4.57 105.19 102.59 3h0g n GLY 1115Ca -0.13 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.67 3h0g n GLY 1115CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h0g n GLY 1116N -0.57 2.69 0.00 -0.02 0.00 0.11 -3.22 105.19 104.18 3h0g n GLY 1116Ca -0.11 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.40 3h0g n GLY 1116CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3h0g n LEU 1117N 0.00 0.00 0.00 0.99 -0.00 -1.26 -4.45 117.00 112.28 3h0g n LEU 1117Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 3h0g n LEU 1117Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 3h0g n LEU 1117CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 177.39 176.25 3h0g n ARG 1118N 0.00 0.00 -3.72 1.96 3.00 -1.26 -4.89 116.66 111.75 3h0g n ARG 1118Ca 0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 57.85 57.50 3h0g n ARG 1118Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 32.46 32.37 3h0g n ARG 1118CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.63 177.75 3h0g s PHE 1119N 0.00 3.65 1.03 -0.14 5.36 -1.26 -5.09 117.98 121.54 3h0g s PHE 1119Ca 0.00 -2.99 -0.12 0.00 -0.96 0.00 0.00 56.93 52.85 3h0g s PHE 1119Cb 0.00 -3.12 0.18 0.00 -0.34 0.00 0.00 43.02 39.74 3h0g s PHE 1119CO 0.00 -0.74 0.88 0.41 -1.46 0.00 0.00 175.22 174.31 3h0g n GLY 1120N 2.66 -1.39 0.31 13.12 0.00 -1.26 -4.69 105.19 113.94 3h0g n GLY 1120Ca 0.16 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 45.17 3h0g n GLY 1120CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3h0g h GLU 1121N -2.15 -0.48 -0.91 1.61 5.08 -2.00 -1.58 114.58 114.16 3h0g h GLU 1121Ca -0.51 0.03 0.09 0.00 -1.00 0.00 0.00 59.36 57.98 3h0g h GLU 1121Cb 1.30 0.11 -0.11 0.00 0.50 0.00 0.00 28.75 30.55 3h0g h GLU 1121CO 0.42 -0.32 -0.52 -0.12 -1.00 0.00 0.00 179.01 177.48 3h0g n MET 1122N -5.40 -0.38 -0.11 2.33 1.56 -1.26 -1.44 117.12 112.42 3h0g n MET 1122Ca -0.06 1.38 -0.06 0.00 -0.27 0.00 0.00 57.70 58.70 3h0g n MET 1122Cb 0.31 -2.04 0.01 0.00 2.15 0.00 0.00 33.22 33.65 3h0g n MET 1122CO 0.00 0.00 0.00 0.93 -0.73 0.00 0.00 175.97 176.17 3h0g h GLU 1123N 0.00 -0.08 -0.47 2.12 4.39 -1.63 -2.01 114.58 116.90 3h0g h GLU 1123Ca 0.16 0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.84 3h0g h GLU 1123Cb 0.39 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.04 3h0g h GLU 1123CO -0.86 -0.05 0.17 -0.09 -1.16 0.00 0.00 179.01 177.01 3h0g h ARG 1124N -0.08 0.68 0.00 2.33 1.12 -0.41 -1.28 114.38 116.74 3h0g h ARG 1124Ca 0.19 -0.10 0.00 0.00 -1.11 0.00 0.00 59.98 58.95 3h0g h ARG 1124Cb 0.37 -0.12 0.00 0.00 -0.01 0.00 0.00 29.97 30.21 3h0g h ARG 1124CO -0.43 0.58 0.00 -0.25 -3.11 0.00 0.00 179.97 176.76 3h0g n ASP 1125N -4.34 0.30 -0.07 -3.80 8.00 -0.76 -1.94 116.55 113.95 3h0g n ASP 1125Ca 0.03 0.64 -0.10 0.00 0.71 0.00 0.00 54.79 56.08 3h0g n ASP 1125Cb 0.17 -0.68 -0.15 0.00 -0.02 0.00 0.00 41.12 40.44 3h0g n ASP 1125CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h0g h GLN 1127N 0.00 0.39 -0.99 0.00 1.08 -1.44 -2.87 115.11 111.27 3h0g h GLN 1127Ca -0.44 -0.02 0.07 0.00 -1.45 0.00 0.00 58.65 56.81 3h0g h GLN 1127Cb 2.14 -0.09 -0.07 0.00 -0.05 0.00 0.00 27.48 29.42 3h0g h GLN 1127CO 0.05 0.26 0.64 0.82 -0.95 0.00 0.00 178.83 179.64 3h0g h ILE 1128N 0.40 1.07 0.00 2.54 2.04 -1.61 0.23 117.51 122.18 3h0g h ILE 1128Ca 0.11 -0.39 0.03 0.00 1.00 0.00 0.00 64.86 65.61 3h0g h ILE 1128Cb -0.04 -0.17 -0.05 0.00 -0.74 0.00 0.00 36.82 35.82 3h0g h ILE 1128CO -0.03 0.21 -0.32 0.77 0.00 0.00 0.00 178.15 178.78 3h0g h SER 1129N 1.14 -0.95 0.75 1.72 4.64 -1.46 -3.03 113.55 116.36 3h0g h SER 1129Ca 0.43 0.12 -0.03 0.00 -0.47 0.00 0.00 61.79 61.84 3h0g h SER 1129Cb 0.20 0.38 -0.01 0.00 -0.31 0.00 0.00 62.40 62.67 3h0g h SER 1129CO -0.18 -0.38 -0.48 0.45 -0.87 0.00 0.00 176.83 175.37 3h0g h HIS 1130N -0.47 -1.29 0.00 4.77 3.86 -0.67 -3.48 115.15 117.86 3h0g h HIS 1130Ca 0.06 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.26 3h0g h HIS 1130Cb 0.56 0.47 0.00 0.00 1.06 0.00 0.00 27.41 29.49 3h0g h HIS 1130CO -0.34 -0.71 0.00 0.41 0.86 0.00 0.00 177.93 178.14 3h0g n GLY 1131N -1.61 0.93 3.28 2.45 0.00 0.53 -5.10 105.19 105.67 3h0g n GLY 1131Ca -0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 3h0g n GLY 1131CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h0g h SER 1133N 6.64 0.02 0.15 0.00 4.64 -1.98 -1.57 113.55 121.44 3h0g h SER 1133Ca 0.16 0.15 -0.24 0.00 -0.47 0.00 0.00 61.79 61.39 3h0g h SER 1133Cb 0.88 0.21 0.02 0.00 -0.31 0.00 0.00 62.40 63.19 3h0g h SER 1133CO 0.94 -0.05 -1.15 0.28 -0.87 0.00 0.00 176.83 175.98 3h0g h SER 1134N 0.27 0.50 -0.27 4.97 0.02 -1.98 -1.12 113.55 115.93 3h0g h SER 1134Ca 0.44 -0.91 0.05 0.00 -0.84 0.00 0.00 61.79 60.53 3h0g h SER 1134Cb 0.78 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 63.11 3h0g h SER 1134CO -0.54 1.53 -0.05 0.58 -1.14 0.00 0.00 176.83 177.21 3h0g h VAL 1135N -0.26 0.75 0.29 2.27 2.07 -1.96 0.25 116.25 119.65 3h0g h VAL 1135Ca -0.22 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.29 3h0g h VAL 1135Cb 1.77 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 32.23 3h0g h VAL 1135CO 0.14 0.00 -0.51 0.25 0.02 0.00 0.00 177.57 177.47 3h0g h LEU 1136N 0.02 -1.47 -1.57 2.57 5.85 -1.27 0.11 115.31 119.55 3h0g h LEU 1136Ca 0.13 0.14 0.11 0.00 0.84 0.00 0.00 57.88 59.10 3h0g h LEU 1136Cb 0.19 0.52 -0.04 0.00 0.37 0.00 0.00 40.66 41.70 3h0g h LEU 1136CO -0.27 -0.60 0.45 -0.09 -0.34 0.00 0.00 178.44 177.60 3h0g h ARG 1137N -0.85 0.45 -0.29 1.25 2.43 -0.99 -1.91 114.38 114.47 3h0g h ARG 1137Ca -0.03 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 58.97 3h0g h ARG 1137Cb 0.80 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.24 3h0g h ARG 1137CO -0.18 0.30 -0.38 1.49 -1.51 0.00 0.00 179.97 179.69 3h0g h GLU 1138N 0.46 0.77 -0.90 0.20 4.81 0.47 -2.10 114.58 118.29 3h0g h GLU 1138Ca 0.32 -0.44 -0.13 0.00 -0.13 0.00 0.00 59.36 58.98 3h0g h GLU 1138Cb 0.62 0.03 -0.08 0.00 0.63 0.00 0.00 28.75 29.95 3h0g h GLU 1138CO -0.10 1.07 0.17 0.54 -0.73 0.00 0.00 179.01 179.96 3h0g n ARG 1139N -4.17 2.24 0.00 1.92 5.12 -0.07 -1.18 116.66 120.53 3h0g n ARG 1139Ca -0.04 -1.52 0.00 0.00 -1.93 0.00 0.00 57.85 54.36 3h0g n ARG 1139Cb 0.53 -1.72 0.00 0.00 -1.16 0.00 0.00 32.46 30.10 3h0g n ARG 1139CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3h0g n LEU 1140N -0.02 0.00 -0.38 0.55 4.77 -1.15 -4.86 117.00 115.91 3h0g n LEU 1140Ca 0.22 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.27 3h0g n LEU 1140Cb 0.91 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 42.14 3h0g n LEU 1140CO 0.23 0.00 0.60 0.49 -1.33 0.00 0.00 177.39 177.39 3h0g n PHE 1141N -1.31 0.34 0.12 -1.77 3.72 -0.79 -4.27 117.46 113.50 3h0g n PHE 1141Ca 0.00 -0.76 0.00 0.00 -0.05 0.00 0.00 57.45 56.64 3h0g n PHE 1141Cb 0.00 -0.15 0.00 0.00 -0.94 0.00 0.00 39.48 38.39 3h0g n PHE 1141CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3h0g n ASP 1142N -0.62 -0.32 -0.47 4.37 -0.08 -1.18 -4.25 116.55 113.99 3h0g n ASP 1142Ca 0.13 0.43 0.00 0.00 -1.51 0.00 0.00 54.79 53.84 3h0g n ASP 1142Cb 0.58 0.50 0.00 0.00 2.34 0.00 0.00 41.12 44.54 3h0g n ASP 1142CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3h0g n SER 1144N -0.04 0.00 -3.42 0.00 3.41 -1.26 -4.93 113.62 107.37 3h0g n SER 1144Ca 0.00 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.26 3h0g n SER 1144Cb 0.23 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.18 3h0g n SER 1144CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3h0g n ASP 1145N -1.05 6.05 -3.59 4.04 10.43 -1.26 -4.85 116.55 126.32 3h0g n ASP 1145Ca 0.00 -3.65 -0.41 0.00 2.57 0.00 0.00 54.79 53.31 3h0g n ASP 1145Cb 0.00 -0.94 -0.04 0.00 1.84 0.00 0.00 41.12 41.98 3h0g n ASP 1145CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3h0g n ALA 1146N 0.08 4.12 -2.69 2.24 0.00 -1.24 -3.74 120.51 119.28 3h0g n ALA 1146Ca 0.38 -3.32 -0.29 0.00 0.00 0.00 0.00 53.44 50.21 3h0g n ALA 1146Cb 0.32 -3.54 -0.08 0.00 0.00 0.00 0.00 19.45 16.15 3h0g n ALA 1146CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3h0g s TYR 1147N 4.32 2.97 0.08 0.00 5.04 -1.21 -5.00 117.35 123.55 3h0g s TYR 1147Ca 0.53 -0.04 0.04 0.00 -2.44 0.00 0.00 57.07 55.16 3h0g s TYR 1147Cb 0.14 -1.51 -0.03 0.00 0.35 0.00 0.00 41.96 40.91 3h0g s TYR 1147CO 0.05 0.49 -0.11 -0.98 -1.34 0.00 0.00 175.55 173.65 3h0g s ARG 1148N -2.44 0.77 -0.18 4.97 1.70 -1.26 -2.03 118.95 120.49 3h0g s ARG 1148Ca 0.26 -1.00 -0.19 0.00 -0.47 0.00 0.00 55.73 54.33 3h0g s ARG 1148Cb -0.11 -0.60 0.05 0.00 -0.57 0.00 0.00 34.95 33.72 3h0g s ARG 1148CO 0.19 0.11 0.53 0.54 -1.08 0.00 0.00 175.30 175.58 3h0g s VAL 1149N -1.78 0.00 0.62 4.99 0.11 -0.77 -4.95 120.40 118.62 3h0g s VAL 1149Ca -0.01 -0.03 -0.14 0.00 -2.93 0.00 0.00 61.98 58.87 3h0g s VAL 1149Cb -0.07 -0.75 -0.02 0.00 -1.53 0.00 0.00 36.38 34.01 3h0g s VAL 1149CO 0.01 -0.02 1.05 -0.63 -3.33 0.00 0.00 175.10 172.19 3h0g s ILE 1150N 0.09 3.94 -0.01 7.04 1.09 -1.26 -2.45 121.20 129.64 3h0g s ILE 1150Ca -0.02 0.82 0.01 0.00 -1.10 0.00 0.00 60.65 60.36 3h0g s ILE 1150Cb -0.04 -3.42 0.00 0.00 -1.06 0.00 0.00 42.46 37.95 3h0g s ILE 1150CO 0.02 -0.64 -0.03 -0.69 -0.10 0.00 0.00 174.94 173.49 3h0g s VAL 1151N -2.67 0.31 0.40 2.92 1.01 -0.41 -3.87 120.40 118.08 3h0g s VAL 1151Ca 0.61 -0.13 -0.25 0.00 0.00 0.00 0.00 61.98 62.21 3h0g s VAL 1151Cb -0.15 -0.28 -0.08 0.00 0.00 0.00 0.00 36.38 35.86 3h0g s VAL 1151CO 0.43 0.10 1.16 0.00 0.00 0.00 0.00 175.10 176.79 3h0g h ASP 1153N 2.63 0.00 0.00 0.00 3.32 -1.82 -3.25 116.42 117.30 3h0g h ASP 1153Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 3h0g h ASP 1153Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 3h0g h ASP 1153CO 0.62 0.75 -0.06 0.40 -1.72 0.00 0.00 179.24 179.24 3h0g h ILE 1154N 0.00 0.00 -3.27 0.35 2.04 -1.85 -3.37 117.51 111.41 3h0g h ILE 1154Ca -0.01 -0.38 -0.75 0.00 1.00 0.00 0.00 64.86 64.72 3h0g h ILE 1154Cb 1.52 0.00 -0.27 0.00 -0.74 0.00 0.00 36.82 37.33 3h0g h ILE 1154CO 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 178.15 177.99 3h0g s GLY 1156N 2.95 -0.90 0.14 0.00 0.00 -1.23 -4.35 107.32 103.93 3h0g s GLY 1156Ca 0.06 -1.06 -0.07 0.00 0.00 0.00 0.00 44.72 43.65 3h0g s GLY 1156CO -0.00 4.23 0.22 1.08 0.00 0.00 0.00 173.10 178.62 3h0g s LEU 1157N 15.43 1.23 0.33 0.66 1.43 -1.26 -2.67 118.68 133.83 3h0g s LEU 1157Ca 0.88 -0.89 -0.29 0.00 -1.03 0.00 0.00 54.13 52.80 3h0g s LEU 1157Cb -0.10 0.98 -0.12 0.00 0.03 0.00 0.00 46.19 46.98 3h0g s LEU 1157CO 0.11 -0.82 1.35 2.30 0.23 0.00 0.00 176.35 179.52 3h0g n ILE 1158N -0.15 1.79 -3.24 -0.59 -5.35 -1.26 -2.39 119.36 108.16 3h0g n ILE 1158Ca -0.09 -0.45 -0.00 0.00 -0.27 0.00 0.00 62.75 61.94 3h0g n ILE 1158Cb 0.63 -1.64 0.00 0.00 -1.74 0.00 0.00 39.64 36.89 3h0g n ILE 1158CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3h0g n ALA 1159N 0.69 0.02 -2.99 -1.28 0.00 -1.25 -4.89 120.51 110.82 3h0g n ALA 1159Ca 0.05 -0.04 -0.43 0.00 0.00 0.00 0.00 53.44 53.03 3h0g n ALA 1159Cb 0.36 0.01 0.01 0.00 0.00 0.00 0.00 19.45 19.83 3h0g n ALA 1159CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3h0g n ILE 1160N -0.79 5.37 -3.01 0.00 5.41 -1.20 -5.03 119.36 120.11 3h0g n ILE 1160Ca 0.00 -5.94 -0.31 0.00 1.00 0.00 0.00 62.75 57.50 3h0g n ILE 1160Cb 0.01 -2.06 -0.04 0.00 -0.71 0.00 0.00 39.64 36.84 3h0g n ILE 1160CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3h0g s ALA 1161N -2.83 3.36 0.00 -1.39 0.00 -1.26 -4.00 121.76 115.65 3h0g s ALA 1161Ca 0.31 -0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.15 3h0g s ALA 1161Cb 0.05 -2.70 0.00 0.00 0.00 0.00 0.00 23.12 20.47 3h0g s ALA 1161CO 0.10 0.16 0.00 -1.13 0.00 0.00 0.00 175.76 174.89 3h0g n SER 1162N -0.86 0.37 -2.90 0.00 3.41 -1.11 -5.00 113.62 107.52 3h0g n SER 1162Ca 0.03 -0.08 -0.15 0.00 -0.26 0.00 0.00 58.87 58.41 3h0g n SER 1162Cb 0.54 0.23 -0.03 0.00 -0.26 0.00 0.00 64.21 64.69 3h0g n SER 1162CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h0g n TYR 1163N -0.27 -1.31 0.07 7.33 0.18 -1.26 -4.42 117.16 117.49 3h0g n TYR 1163Ca 0.00 0.24 0.00 0.00 1.88 0.00 0.00 57.90 60.02 3h0g n TYR 1163Cb 0.00 -1.10 0.00 0.00 -0.38 0.00 0.00 39.34 37.86 3h0g n TYR 1163CO 0.00 0.00 0.00 1.63 -2.08 0.00 0.00 176.86 176.41 3h0g n LYS 1164N -2.59 0.00 -0.71 -3.48 5.02 -1.26 -4.85 118.16 110.29 3h0g n LYS 1164Ca 0.04 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.26 3h0g n LYS 1164Cb 0.38 -0.01 0.18 0.00 -0.02 0.00 0.00 35.03 35.57 3h0g n LYS 1164CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3h0g n LYS 1165N -3.00 2.56 -1.74 1.97 5.02 -1.26 -4.88 118.16 116.83 3h0g n LYS 1165Ca 0.00 -2.00 -0.05 0.00 -2.02 0.00 0.00 58.31 54.24 3h0g n LYS 1165Cb 0.00 -1.87 -0.01 0.00 -0.02 0.00 0.00 35.03 33.13 3h0g n LYS 1165CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3h0g n ASP 1166N -0.15 -1.59 -4.62 4.39 9.92 -1.26 -4.88 116.55 118.36 3h0g n ASP 1166Ca 0.30 0.24 -0.39 0.00 -0.53 0.00 0.00 54.79 54.40 3h0g n ASP 1166Cb 1.10 -1.63 -0.08 0.00 -0.64 0.00 0.00 41.12 39.87 3h0g n ASP 1166CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 3h0g s SER 1167N -1.67 6.39 0.00 -2.24 1.04 -1.26 -4.93 113.70 111.03 3h0g s SER 1167Ca 0.00 0.46 -0.00 0.00 0.48 0.00 0.00 55.95 56.89 3h0g s SER 1167Cb 0.00 -2.25 -0.00 0.00 0.10 0.00 0.00 66.02 63.87 3h0g s SER 1167CO 0.00 -0.22 -0.00 -1.22 0.98 0.00 0.00 173.24 172.78 3h0g n TYR 1168N 5.30 0.00 -1.39 5.02 4.01 -1.26 -2.76 117.16 126.09 3h0g n TYR 1168Ca -0.06 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.74 3h0g n TYR 1168Cb 0.50 -0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.50 3h0g n TYR 1168CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 3h0g n GLU 1169N -2.51 -3.48 -3.43 -0.72 1.02 -1.25 -3.25 120.64 107.02 3h0g n GLU 1169Ca -0.00 2.76 -0.16 0.00 -0.02 0.00 0.00 57.16 59.74 3h0g n GLU 1169Cb 0.00 -3.62 -0.11 0.00 -0.02 0.00 0.00 31.44 27.69 3h0g n GLU 1169CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3h0g n ARG 1171N 5.33 2.95 0.00 0.00 5.12 -1.26 -1.79 116.66 127.00 3h0g n ARG 1171Ca -0.04 -2.54 0.00 0.00 -1.93 0.00 0.00 57.85 53.34 3h0g n ARG 1171Cb 0.49 -3.22 0.00 0.00 -1.16 0.00 0.00 32.46 28.57 3h0g n ARG 1171CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 3h0g n SER 1172N 5.77 0.00 -0.01 0.55 3.41 -1.26 -4.89 113.62 117.19 3h0g n SER 1172Ca 0.56 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 59.31 3h0g n SER 1172Cb 0.37 0.00 0.72 0.00 -0.26 0.00 0.00 64.21 65.04 3h0g n SER 1172CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h0g n GLN 1174N -1.29 -6.89 -3.98 0.00 1.13 -0.74 -5.00 117.38 100.62 3h0g n GLN 1174Ca 0.13 0.76 -0.32 0.00 -1.94 0.00 0.00 57.00 55.64 3h0g n GLN 1174Cb 0.26 -5.58 -0.05 0.00 0.11 0.00 0.00 30.24 24.97 3h0g n GLN 1174CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 3h0g s ASN 1175N -3.60 6.06 0.00 1.08 0.01 -1.21 -4.90 114.94 112.38 3h0g s ASN 1175Ca 0.36 0.22 0.00 0.00 -0.71 0.00 0.00 52.86 52.73 3h0g s ASN 1175Cb -0.16 -1.81 0.00 0.00 0.41 0.00 0.00 41.25 39.69 3h0g s ASN 1175CO 0.67 0.22 0.00 0.54 -1.51 0.00 0.00 177.10 177.02 3h0g n ARG 1176N 0.71 0.48 -0.03 -0.60 1.74 -1.26 -0.64 116.66 117.06 3h0g n ARG 1176Ca -0.09 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 56.95 3h0g n ARG 1176Cb 0.52 -0.04 -0.03 0.00 -1.02 0.00 0.00 32.46 31.89 3h0g n ARG 1176CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3h0g n THR 1177N 0.00 0.36 -2.90 0.55 -2.24 -1.26 -4.68 114.28 104.12 3h0g n THR 1177Ca 0.00 -0.16 -0.43 0.00 -2.27 0.00 0.00 64.05 61.19 3h0g n THR 1177Cb 0.00 -0.76 -0.05 0.00 -2.10 0.00 0.00 70.33 67.42 3h0g n THR 1177CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3h0g s ARG 1178N -2.13 3.30 0.13 -0.78 0.52 -1.26 -5.01 118.95 113.72 3h0g s ARG 1178Ca -0.07 -0.37 -0.10 0.00 -0.52 0.00 0.00 55.73 54.67 3h0g s ARG 1178Cb 0.02 -4.05 -0.00 0.00 0.52 0.00 0.00 34.95 31.43 3h0g s ARG 1178CO 0.16 -1.42 0.26 -0.06 0.02 0.00 0.00 175.30 174.27 3h0g s PHE 1179N 3.67 0.24 0.02 -0.53 0.08 -1.26 -4.04 117.98 116.15 3h0g s PHE 1179Ca 0.28 -0.63 -0.12 0.00 0.12 0.00 0.00 56.93 56.58 3h0g s PHE 1179Cb -0.14 -0.02 0.01 0.00 -0.57 0.00 0.00 43.02 42.30 3h0g s PHE 1179CO 0.18 -0.65 0.24 -1.54 -0.10 0.00 0.00 175.22 173.35 3h0g s SER 1180N -2.91 -0.06 0.10 1.36 1.04 -1.09 -4.95 113.70 107.18 3h0g s SER 1180Ca 0.11 -0.18 0.02 0.00 0.48 0.00 0.00 55.95 56.38 3h0g s SER 1180Cb 0.04 0.30 -0.04 0.00 0.10 0.00 0.00 66.02 66.42 3h0g s SER 1180CO -0.05 -0.51 0.17 -1.58 0.98 0.00 0.00 173.24 172.24 3h0g s GLN 1181N -2.05 3.16 -0.00 4.02 0.74 -1.26 -1.29 119.66 122.97 3h0g s GLN 1181Ca -0.09 -0.64 0.01 0.00 0.05 0.00 0.00 55.36 54.69 3h0g s GLN 1181Cb -0.03 -2.85 -0.00 0.00 1.10 0.00 0.00 33.01 31.23 3h0g s GLN 1181CO -0.01 0.55 -0.02 0.08 -0.55 0.00 0.00 175.29 175.35 3h0g s VAL 1182N -1.56 0.17 -0.24 1.34 1.01 -1.02 -4.92 120.40 115.17 3h0g s VAL 1182Ca 0.32 -0.09 -0.15 0.00 0.00 0.00 0.00 61.98 62.06 3h0g s VAL 1182Cb -0.12 -0.15 -0.04 0.00 0.00 0.00 0.00 36.38 36.07 3h0g s VAL 1182CO 0.25 0.05 0.39 -0.31 0.00 0.00 0.00 175.10 175.48 3h0g s TYR 1183N -0.03 3.30 0.02 5.22 1.51 -1.26 -1.84 117.35 124.26 3h0g s TYR 1183Ca 0.01 0.51 0.00 0.00 -1.01 0.00 0.00 57.07 56.57 3h0g s TYR 1183Cb -0.01 -2.56 -0.02 0.00 -0.11 0.00 0.00 41.96 39.27 3h0g s TYR 1183CO -0.00 -0.14 -0.03 -0.51 -1.11 0.00 0.00 175.55 173.77 3h0g s LEU 1184N 1.76 2.20 0.13 -1.29 1.43 -0.86 -5.01 118.68 117.05 3h0g s LEU 1184Ca 0.17 -0.43 -0.30 0.00 -1.03 0.00 0.00 54.13 52.54 3h0g s LEU 1184Cb -0.15 0.08 -0.07 0.00 0.03 0.00 0.00 46.19 46.08 3h0g s LEU 1184CO 0.09 -0.25 1.19 -2.84 0.23 0.00 0.00 176.35 174.77 3h0g s PRO 1185N -1.24 4.47 0.63 1.29 0.02 -1.26 -3.31 135.00 135.61 3h0g s PRO 1185Ca -0.14 1.82 0.17 0.00 0.02 0.00 0.00 61.00 62.88 3h0g s PRO 1185Cb -0.09 -3.29 0.71 0.00 0.02 0.00 0.00 34.50 31.86 3h0g s PRO 1185CO -0.01 -0.15 1.33 -0.92 -0.33 0.00 0.00 177.00 176.92 3h0g h TYR 1186N 5.89 0.00 0.27 6.54 3.20 -1.84 3.31 116.97 134.35 3h0g h TYR 1186Ca -0.43 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.43 3h0g h TYR 1186Cb 1.21 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.48 3h0g h TYR 1186CO 0.64 0.00 -0.15 0.00 -1.64 0.00 0.00 178.16 177.01 3h0g h ALA 1187N 0.52 -1.06 -0.50 1.82 0.00 -1.87 -1.64 119.26 116.54 3h0g h ALA 1187Ca 0.22 -0.08 0.08 0.00 0.00 0.00 0.00 54.91 55.12 3h0g h ALA 1187Cb 2.12 0.21 -0.10 0.00 0.00 0.00 0.00 17.79 20.02 3h0g h ALA 1187CO -0.00 -1.04 -0.45 0.00 0.00 0.00 0.00 179.25 177.76 3h0g h ALA 1188N -1.74 -0.43 -0.88 0.00 0.00 0.55 -2.60 119.26 114.16 3h0g h ALA 1188Ca -0.04 0.08 0.10 0.00 0.00 0.00 0.00 54.91 55.05 3h0g h ALA 1188Cb 0.30 0.97 -0.12 0.00 0.00 0.00 0.00 17.79 18.94 3h0g h ALA 1188CO 0.05 -0.88 -0.47 1.17 0.00 0.00 0.00 179.25 179.13 3h0g n LYS 1189N -5.40 -0.33 -0.06 0.00 4.81 0.12 -0.70 118.16 116.59 3h0g n LYS 1189Ca 0.00 1.34 -0.10 0.00 -0.87 0.00 0.00 58.31 58.69 3h0g n LYS 1189Cb 0.35 -1.98 -0.03 0.00 0.02 0.00 0.00 35.03 33.38 3h0g n LYS 1189CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 3h0g h LEU 1190N 0.00 -1.12 -0.23 3.14 3.38 -0.90 -1.54 115.31 118.04 3h0g h LEU 1190Ca 0.19 0.17 0.06 0.00 0.09 0.00 0.00 57.88 58.40 3h0g h LEU 1190Cb 0.41 0.49 -0.07 0.00 0.09 0.00 0.00 40.66 41.59 3h0g h LEU 1190CO -0.85 -0.36 -0.24 0.25 0.09 0.00 0.00 178.44 177.34 3h0g h LEU 1191N -0.35 -0.76 -0.88 1.67 6.46 -0.79 0.81 115.31 121.46 3h0g h LEU 1191Ca 0.13 0.14 0.09 0.00 -0.12 0.00 0.00 57.88 58.11 3h0g h LEU 1191Cb 0.56 0.36 -0.07 0.00 -0.73 0.00 0.00 40.66 40.77 3h0g h LEU 1191CO -0.45 -0.28 0.53 -0.26 -0.62 0.00 0.00 178.44 177.36 3h0g h PHE 1192N -0.25 0.97 0.10 1.25 -1.00 -0.97 0.16 116.94 117.21 3h0g h PHE 1192Ca 0.13 0.03 -0.00 0.00 2.81 0.00 0.00 57.97 60.94 3h0g h PHE 1192Cb 0.45 -0.31 0.00 0.00 3.61 0.00 0.00 35.95 39.71 3h0g h PHE 1192CO -0.39 0.43 -0.05 1.96 -1.61 0.00 0.00 178.31 178.65 3h0g h GLN 1193N 0.90 -0.13 -0.08 1.51 4.20 -0.19 -2.00 115.11 119.32 3h0g h GLN 1193Ca 0.41 0.01 0.02 0.00 0.06 0.00 0.00 58.65 59.16 3h0g h GLN 1193Cb 0.33 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.13 3h0g h GLN 1193CO -0.23 0.08 0.22 0.93 -0.67 0.00 0.00 178.83 179.16 3h0g h GLU 1194N -0.33 0.00 0.16 1.46 5.08 0.14 0.17 114.58 121.26 3h0g h GLU 1194Ca -0.01 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.05 3h0g h GLU 1194Cb 0.27 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.54 3h0g h GLU 1194CO 0.02 0.00 -1.30 -0.07 -1.00 0.00 0.00 179.01 176.66 3h0g h LEU 1195N 0.00 0.67 -1.34 1.33 3.38 -0.04 -3.18 115.31 116.12 3h0g h LEU 1195Ca 0.04 -0.68 0.18 0.00 0.09 0.00 0.00 57.88 57.51 3h0g h LEU 1195Cb 0.48 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 40.95 3h0g h LEU 1195CO -0.00 1.51 0.59 0.24 0.09 0.00 0.00 178.44 180.87 3h0g h MET 1196N 0.15 0.56 0.00 1.13 2.86 0.02 0.60 114.93 120.25 3h0g h MET 1196Ca -0.18 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.42 3h0g h MET 1196Cb 2.00 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 33.53 3h0g h MET 1196CO 0.23 0.37 0.00 0.66 1.06 0.00 0.00 176.91 179.23 3h0g h SER 1197N 0.57 0.00 -0.54 1.22 4.64 -1.49 -1.42 113.55 116.53 3h0g h SER 1197Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 3h0g h SER 1197Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 3h0g h SER 1197CO -0.22 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 175.97 3h0g n MET 1198N -3.06 4.56 -1.97 4.77 2.00 0.21 -4.94 117.12 118.69 3h0g n MET 1198Ca 0.00 -3.11 -0.18 0.00 0.00 0.00 0.00 57.70 54.41 3h0g n MET 1198Cb 0.27 -2.19 -0.04 0.00 0.00 0.00 0.00 33.22 31.26 3h0g n MET 1198CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 3h0g n ASN 1199N 0.50 -5.22 -4.25 7.83 5.03 -0.53 -4.98 115.26 113.64 3h0g n ASN 1199Ca 0.27 0.19 -0.31 0.00 0.87 0.00 0.00 54.58 55.60 3h0g n ASN 1199Cb 1.14 -4.30 -0.17 0.00 -1.02 0.00 0.00 39.78 35.44 3h0g n ASN 1199CO 0.00 0.00 0.00 0.27 -1.83 0.00 0.00 177.26 175.70 3h0g s ILE 1200N -2.80 2.00 -0.40 2.41 -4.36 -1.12 -5.03 121.20 111.90 3h0g s ILE 1200Ca 0.00 -1.03 -0.04 0.00 -0.26 0.00 0.00 60.65 59.32 3h0g s ILE 1200Cb 0.00 -1.69 0.10 0.00 1.25 0.00 0.00 42.46 42.11 3h0g s ILE 1200CO 0.00 0.55 0.20 0.00 0.24 0.00 0.00 174.94 175.93 3h0g s ALA 1201N -0.07 3.15 -0.87 2.27 0.00 -1.26 -3.73 121.76 121.25 3h0g s ALA 1201Ca -0.06 -2.39 -0.25 0.00 0.00 0.00 0.00 51.96 49.26 3h0g s ALA 1201Cb -0.14 -2.43 -0.00 0.00 0.00 0.00 0.00 23.12 20.55 3h0g s ALA 1201CO 0.04 -1.73 1.69 -2.14 0.00 0.00 0.00 175.76 173.63 3h0g s PRO 1202N 1.21 2.97 -0.08 0.00 0.02 -1.26 -4.95 135.00 132.90 3h0g s PRO 1202Ca 0.06 -0.39 -0.30 0.00 0.02 0.00 0.00 61.00 60.39 3h0g s PRO 1202Cb -0.23 -4.93 -0.04 0.00 0.02 0.00 0.00 34.50 29.33 3h0g s PRO 1202CO -0.03 -2.75 1.43 1.03 -0.33 0.00 0.00 177.00 176.36 3h0g s ARG 1203N 6.23 4.23 -1.25 5.54 3.00 -1.26 -4.76 118.95 130.68 3h0g s ARG 1203Ca 0.58 1.92 -0.05 0.00 0.00 0.00 0.00 55.73 58.18 3h0g s ARG 1203Cb -0.06 -3.80 0.12 0.00 0.00 0.00 0.00 34.95 31.21 3h0g s ARG 1203CO 0.02 -0.72 2.41 1.28 0.00 0.00 0.00 175.30 178.29 3h0g n LEU 1204N 6.47 7.92 -4.54 2.53 4.77 -1.09 -4.79 117.00 128.28 3h0g n LEU 1204Ca 0.15 -4.83 -0.24 0.00 -0.03 0.00 0.00 56.01 51.05 3h0g n LEU 1204Cb 0.44 -1.35 -0.10 0.00 -2.33 0.00 0.00 43.42 40.08 3h0g n LEU 1204CO 0.59 2.04 1.72 0.49 -1.33 0.00 0.00 177.39 180.90 3h0g n PHE 1205N 1.63 0.96 -0.00 -1.77 3.01 -1.26 -4.78 117.46 115.24 3h0g n PHE 1205Ca 0.61 0.07 0.00 0.00 1.01 0.00 0.00 57.45 59.14 3h0g n PHE 1205Cb 0.27 -2.21 0.00 0.00 -0.01 0.00 0.00 39.48 37.53 3h0g n PHE 1205CO 0.00 0.00 0.00 -2.37 1.01 0.00 0.00 176.76 175.40 3h0g n THR 1206N 7.83 0.00 0.00 4.37 5.66 -1.26 -4.89 114.28 125.99 3h0g n THR 1206Ca 0.50 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.50 3h0g n THR 1206Cb 0.36 -0.68 0.00 0.00 -1.55 0.00 0.00 70.33 68.47 3h0g n THR 1206CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 3h0g n LYS 1207N -0.02 1.40 -0.02 1.09 4.81 -1.26 -4.07 118.16 120.10 3h0g n LYS 1207Ca 0.00 0.00 0.13 0.00 -0.87 0.00 0.00 58.31 57.57 3h0g n LYS 1207Cb 0.00 0.00 0.20 0.00 0.02 0.00 0.00 35.03 35.25 3h0g n LYS 1207CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 3h0g n ASN 1208N -0.30 0.00 0.00 3.14 5.15 -1.26 -0.22 115.26 121.76 3h0g n ASN 1208Ca 0.00 0.49 0.00 0.00 -0.60 0.00 0.00 54.58 54.47 3h0g n ASN 1208Cb 0.00 -0.12 0.00 0.00 -0.53 0.00 0.00 39.78 39.13 3h0g n ASN 1208CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 3h0g n HIS 1209N -2.44 0.00 0.00 1.20 8.25 -1.26 -5.14 115.22 115.82 3h0g n HIS 1209Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 3h0g n HIS 1209Cb 0.98 -0.17 0.00 0.00 1.12 0.00 0.00 29.99 31.92 3h0g n HIS 1209CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34