#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hrs s SER 2 N 0.00 6.39 -1.13 6.43 0.15 -1.26 -4.89 113.70 119.39 1hrs s SER 2 Ca 0.00 2.40 -0.22 0.00 0.70 0.00 0.00 55.95 58.83 1hrs s SER 2 Cb 0.00 -2.53 -0.02 0.00 -1.71 0.00 0.00 66.02 61.76 1hrs s SER 2 CO 0.00 -1.13 1.82 -1.10 1.20 0.00 0.00 173.24 174.03 1hrs s GLN 3 N 4.57 3.02 0.07 5.44 1.11 -1.26 -2.77 119.66 129.84 1hrs s GLN 3 Ca 0.85 -1.18 0.00 0.00 0.01 0.00 0.00 55.36 55.04 1hrs s GLN 3 Cb -0.38 -5.29 0.00 0.00 -1.01 0.00 0.00 33.01 26.33 1hrs s GLN 3 CO 0.37 -3.19 0.00 1.51 0.01 0.00 0.00 175.29 173.98 1hrs n ILE 4 N 7.35 0.00 -1.64 1.08 3.06 -1.26 -5.13 119.36 122.83 1hrs n ILE 4 Ca 0.43 0.00 -0.46 0.00 -2.50 0.00 0.00 62.75 60.22 1hrs n ILE 4 Cb 0.47 0.00 -0.03 0.00 0.54 0.00 0.00 39.64 40.62 1hrs n ILE 4 CO 0.00 0.00 0.00 -1.14 -2.50 0.00 0.00 176.55 172.91 1hrs n ARG 5 N -2.57 1.70 -3.64 9.51 0.63 -1.11 -4.91 116.66 116.26 1hrs n ARG 5 Ca 0.00 0.61 -0.04 0.00 -0.92 0.00 0.00 57.85 57.49 1hrs n ARG 5 Cb 0.00 -2.20 -0.07 0.00 0.45 0.00 0.00 32.46 30.65 1hrs n ARG 5 CO 0.00 0.00 0.00 -1.14 -2.51 0.00 0.00 177.63 173.98 1hrs s GLN 6 N -0.44 0.44 -0.94 -0.14 0.74 -1.26 -4.92 119.66 113.14 1hrs s GLN 6 Ca 0.70 0.71 0.00 0.00 0.05 0.00 0.00 55.36 56.82 1hrs s GLN 6 Cb -0.72 0.11 0.00 0.00 1.10 0.00 0.00 33.01 33.50 1hrs s GLN 6 CO 0.51 -0.08 0.00 0.09 -0.55 0.00 0.00 175.29 175.25 1hrs n ASN 7 N 3.50 -3.64 -4.41 6.67 4.13 -1.26 -4.93 115.26 115.33 1hrs n ASN 7 Ca -0.18 0.22 -0.44 0.00 1.68 0.00 0.00 54.58 55.87 1hrs n ASN 7 Cb 0.57 -3.00 -0.09 0.00 -1.54 0.00 0.00 39.78 35.73 1hrs n ASN 7 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 1hrs s TYR 8 N -1.63 3.25 0.60 3.10 5.04 -1.26 -4.87 117.35 121.57 1hrs s TYR 8 Ca 0.00 -0.83 -0.16 0.00 -2.44 0.00 0.00 57.07 53.63 1hrs s TYR 8 Cb 0.00 -2.92 -0.03 0.00 0.35 0.00 0.00 41.96 39.35 1hrs s TYR 8 CO 0.00 -0.72 1.08 0.45 -1.34 0.00 0.00 175.55 175.03 1hrs s SER 9 N 2.21 5.60 0.19 4.32 0.15 -1.26 -4.94 113.70 119.97 1hrs s SER 9 Ca 0.04 1.94 -0.08 0.00 0.70 0.00 0.00 55.95 58.56 1hrs s SER 9 Cb -0.22 -2.55 0.10 0.00 -1.71 0.00 0.00 66.02 61.64 1hrs s SER 9 CO 0.08 -1.29 1.63 0.74 1.20 0.00 0.00 173.24 175.60 1hrs h THR 10 N 0.53 1.27 -0.29 6.45 2.02 -1.99 -1.02 112.91 119.86 1hrs h THR 10 Ca -0.48 -1.22 -0.11 0.00 0.77 0.00 0.00 66.41 65.37 1hrs h THR 10 Cb 1.24 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 68.57 1hrs h THR 10 CO 0.56 0.43 -0.29 -0.33 0.37 0.00 0.00 175.52 176.26 1hrs h GLU 11 N 0.88 0.60 -0.64 6.66 5.08 -1.99 -0.89 114.58 124.28 1hrs h GLU 11 Ca 0.14 -0.25 0.05 0.00 -1.00 0.00 0.00 59.36 58.30 1hrs h GLU 11 Cb 0.63 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.81 1hrs h GLU 11 CO 0.04 0.82 0.36 0.28 -1.00 0.00 0.00 179.01 179.52 1hrs h VAL 12 N 0.51 1.00 -0.11 3.13 2.07 -1.67 0.00 116.25 121.19 1hrs h VAL 12 Ca 0.07 -0.24 -0.14 0.00 0.82 0.00 0.00 66.70 67.21 1hrs h VAL 12 Cb 0.76 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1hrs h VAL 12 CO 0.06 0.13 -0.53 1.05 0.02 0.00 0.00 177.57 178.30 1hrs h GLU 13 N 0.69 0.30 -0.75 1.57 4.11 -0.92 -1.29 114.58 118.29 1hrs h GLU 13 Ca 0.28 -0.18 -0.03 0.00 0.07 0.00 0.00 59.36 59.50 1hrs h GLU 13 Cb 0.13 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 1hrs h GLU 13 CO -0.15 0.76 0.35 0.00 0.07 0.00 0.00 179.01 180.04 1hrs h ALA 14 N 1.21 1.22 -0.11 1.06 0.00 -0.58 0.21 119.26 122.27 1hrs h ALA 14 Ca 0.01 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1hrs h ALA 14 Cb 1.01 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1hrs h ALA 14 CO 0.09 0.60 0.01 0.00 0.00 0.00 0.00 179.25 179.94 1hrs h ALA 15 N 1.33 0.15 -0.71 0.00 0.00 -0.96 -2.02 119.26 117.06 1hrs h ALA 15 Ca 0.26 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 55.04 1hrs h ALA 15 Cb 0.11 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1hrs h ALA 15 CO -0.03 -0.18 0.47 0.28 0.00 0.00 0.00 179.25 179.78 1hrs h VAL 16 N -0.06 1.08 0.00 0.00 2.07 0.04 0.26 116.25 119.64 1hrs h VAL 16 Ca 0.03 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.24 1hrs h VAL 16 Cb 0.32 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 30.27 1hrs h VAL 16 CO 0.00 0.15 -0.15 0.78 0.02 0.00 0.00 177.57 178.38 1hrs h ASN 17 N 0.83 0.00 0.99 0.57 2.35 -0.53 -0.47 115.58 119.32 1hrs h ASN 17 Ca 0.29 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.83 1hrs h ASN 17 Cb 0.11 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.45 1hrs h ASN 17 CO -0.09 0.15 -1.04 -0.09 -1.65 0.00 0.00 177.43 174.71 1hrs h ARG 18 N 0.00 0.00 -0.58 0.81 2.43 -0.25 -2.87 114.38 113.92 1hrs h ARG 18 Ca -0.00 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.09 1hrs h ARG 18 Cb 0.88 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.41 1hrs h ARG 18 CO 0.02 0.88 0.05 1.25 -1.51 0.00 0.00 179.97 180.66 1hrs h LEU 19 N 0.00 0.92 -0.45 3.80 7.12 -0.48 0.62 115.31 126.84 1hrs h LEU 19 Ca -0.04 -0.23 -0.04 0.00 0.13 0.00 0.00 57.88 57.70 1hrs h LEU 19 Cb 1.76 -0.24 -0.02 0.00 -0.53 0.00 0.00 40.66 41.62 1hrs h LEU 19 CO 0.12 0.95 0.12 0.58 -0.13 0.00 0.00 178.44 180.08 1hrs h VAL 20 N 0.89 1.23 0.00 1.05 2.07 -1.09 0.12 116.25 120.52 1hrs h VAL 20 Ca 0.17 -0.80 -0.06 0.00 0.82 0.00 0.00 66.70 66.84 1hrs h VAL 20 Cb 0.46 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 1hrs h VAL 20 CO 0.02 0.28 -0.28 -1.13 0.02 0.00 0.00 177.57 176.48 1hrs h ASN 21 N 0.60 0.00 -0.07 0.57 -0.73 -1.01 -1.09 115.58 113.86 1hrs h ASN 21 Ca 0.14 0.00 -0.06 0.00 1.87 0.00 0.00 56.30 58.25 1hrs h ASN 21 Cb 0.31 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.90 1hrs h ASN 21 CO -0.00 0.28 -0.20 -0.07 -0.37 0.00 0.00 177.43 177.08 1hrs h LEU 22 N 0.00 0.29 -0.09 0.34 4.07 0.17 -1.21 115.31 118.87 1hrs h LEU 22 Ca -0.00 -0.61 -0.00 0.00 0.08 0.00 0.00 57.88 57.35 1hrs h LEU 22 Cb 0.99 -0.08 -0.00 0.00 1.08 0.00 0.00 40.66 42.65 1hrs h LEU 22 CO 0.04 0.84 0.05 1.88 -1.08 0.00 0.00 178.44 180.17 1hrs h TYR 23 N -0.26 0.13 -0.89 1.13 0.05 -0.68 0.80 116.97 117.25 1hrs h TYR 23 Ca -0.01 -0.00 0.09 0.00 0.05 0.00 0.00 58.73 58.87 1hrs h TYR 23 Cb 0.82 -0.04 -0.07 0.00 1.01 0.00 0.00 36.73 38.44 1hrs h TYR 23 CO 0.12 0.15 0.53 -0.07 -1.05 0.00 0.00 178.16 177.85 1hrs h LEU 24 N 0.06 0.79 -0.14 3.88 4.07 -1.21 0.16 115.31 122.93 1hrs h LEU 24 Ca 0.03 0.04 -0.08 0.00 0.08 0.00 0.00 57.88 57.95 1hrs h LEU 24 Cb 0.06 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.68 1hrs h LEU 24 CO -0.01 0.45 -0.38 -0.09 -1.08 0.00 0.00 178.44 177.34 1hrs h ARG 25 N 0.90 0.00 0.08 1.13 1.12 -0.57 -1.26 114.38 115.78 1hrs h ARG 25 Ca 0.42 0.00 -0.26 0.00 -1.11 0.00 0.00 59.98 59.03 1hrs h ARG 25 Cb 0.36 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 30.33 1hrs h ARG 25 CO -0.24 0.38 -1.12 0.00 -3.11 0.00 0.00 179.97 175.88 1hrs h ALA 26 N 1.62 0.18 -0.98 2.80 0.00 -0.14 -2.17 119.26 120.57 1hrs h ALA 26 Ca -0.00 -0.78 0.09 0.00 0.00 0.00 0.00 54.91 54.21 1hrs h ALA 26 Cb 1.24 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.98 1hrs h ALA 26 CO 0.05 0.83 0.63 1.03 0.00 0.00 0.00 179.25 181.79 1hrs h SER 27 N 0.19 0.95 -0.41 0.00 0.87 -0.52 -1.80 113.55 112.83 1hrs h SER 27 Ca -0.13 0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.43 1hrs h SER 27 Cb 1.80 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 63.57 1hrs h SER 27 CO 0.20 0.57 0.16 0.22 -0.53 0.00 0.00 176.83 177.45 1hrs h TYR 28 N 1.06 0.63 -0.73 2.24 5.03 -0.87 -2.57 116.97 121.76 1hrs h TYR 28 Ca 0.45 -0.05 -0.02 0.00 2.58 0.00 0.00 58.73 61.69 1hrs h TYR 28 Cb 0.33 -0.19 -0.03 0.00 1.55 0.00 0.00 36.73 38.39 1hrs h TYR 28 CO -0.00 0.56 0.38 1.15 -1.32 0.00 0.00 178.16 178.92 1hrs h THR 29 N 0.52 1.23 -0.77 1.81 2.02 -0.93 -2.57 112.91 114.23 1hrs h THR 29 Ca 0.14 -0.62 0.00 0.00 0.77 0.00 0.00 66.41 66.70 1hrs h THR 29 Cb 0.20 0.29 -0.04 0.00 -1.74 0.00 0.00 68.15 66.86 1hrs h THR 29 CO -0.01 0.27 0.49 1.88 0.37 0.00 0.00 175.52 178.52 1hrs h TYR 30 N 1.02 0.98 0.00 3.16 0.05 -0.94 0.20 116.97 121.44 1hrs h TYR 30 Ca 0.26 0.02 -0.07 0.00 0.05 0.00 0.00 58.73 58.98 1hrs h TYR 30 Cb 0.08 -0.33 -0.01 0.00 1.01 0.00 0.00 36.73 37.48 1hrs h TYR 30 CO 0.00 0.63 -0.35 1.25 -1.05 0.00 0.00 178.16 178.64 1hrs h LEU 31 N 1.05 0.00 -0.35 3.88 6.46 -1.51 0.13 115.31 124.97 1hrs h LEU 31 Ca 0.28 0.00 -0.19 0.00 -0.12 0.00 0.00 57.88 57.85 1hrs h LEU 31 Cb -0.09 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 39.84 1hrs h LEU 31 CO -0.06 0.35 -0.62 -1.28 -0.62 0.00 0.00 178.44 176.22 1hrs h SER 32 N 0.00 0.80 -0.17 1.25 0.87 -0.40 -2.47 113.55 113.42 1hrs h SER 32 Ca -0.00 -0.46 -0.11 0.00 -1.23 0.00 0.00 61.79 59.99 1hrs h SER 32 Cb 1.03 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.76 1hrs h SER 32 CO 0.05 1.23 -0.32 -0.07 -0.53 0.00 0.00 176.83 177.19 1hrs h LEU 33 N 0.52 0.58 0.62 2.23 3.38 -0.55 -3.14 115.31 118.95 1hrs h LEU 33 Ca -0.01 -0.54 -0.02 0.00 0.09 0.00 0.00 57.88 57.39 1hrs h LEU 33 Cb 1.21 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1hrs h LEU 33 CO 0.13 1.01 -0.40 1.23 0.09 0.00 0.00 178.44 180.49 1hrs h GLY 34 N 0.16 -1.07 2.00 0.83 0.00 -0.88 -2.27 103.07 101.84 1hrs h GLY 34 Ca 0.01 0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.79 1hrs h GLY 34 CO 0.07 -0.37 0.00 0.74 0.00 0.00 0.00 176.54 176.98 1hrs h PHE 35 N -0.97 0.00 -0.17 5.60 0.04 -1.55 -0.19 116.94 119.70 1hrs h PHE 35 Ca -0.08 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.58 1hrs h PHE 35 Cb 0.80 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.93 1hrs h PHE 35 CO -0.11 0.00 -0.37 -0.92 -0.60 0.00 0.00 178.31 176.31 1hrs h TYR 36 N 0.00 0.42 0.00 -0.55 3.20 -1.36 -2.65 116.97 116.02 1hrs h TYR 36 Ca 0.00 -0.11 0.00 0.00 3.14 0.00 0.00 58.73 61.76 1hrs h TYR 36 Cb 0.23 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.41 1hrs h TYR 36 CO 0.00 0.68 -0.54 1.19 -1.64 0.00 0.00 178.16 177.86 1hrs n PHE 37 N -4.05 0.34 1.18 -3.82 3.72 -0.12 -2.74 117.46 111.97 1hrs n PHE 37 Ca -0.01 0.10 0.13 0.00 -0.05 0.00 0.00 57.45 57.61 1hrs n PHE 37 Cb 0.47 -0.52 0.64 0.00 -0.94 0.00 0.00 39.48 39.13 1hrs n PHE 37 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1hrs n ASP 38 N -1.87 0.00 -4.77 4.37 -0.08 -0.97 -1.68 116.55 111.54 1hrs n ASP 38 Ca 0.04 0.02 -0.39 0.00 -1.51 0.00 0.00 54.79 52.95 1hrs n ASP 38 Cb 0.40 -0.32 0.00 0.00 2.34 0.00 0.00 41.12 43.54 1hrs n ASP 38 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 1hrs s ARG 39 N -2.65 3.83 0.00 -0.67 0.52 -1.11 -4.69 118.95 114.18 1hrs s ARG 39 Ca 0.23 2.16 0.18 0.00 -0.52 0.00 0.00 55.73 57.78 1hrs s ARG 39 Cb 0.17 -2.66 0.91 0.00 0.52 0.00 0.00 34.95 33.90 1hrs s ARG 39 CO 0.41 -0.61 1.56 -0.40 0.02 0.00 0.00 175.30 176.28 1hrs n ASP 40 N -0.09 0.00 -0.67 0.23 5.75 -1.26 0.25 116.55 120.75 1hrs n ASP 40 Ca 0.05 0.09 0.08 0.00 -0.01 0.00 0.00 54.79 54.99 1hrs n ASP 40 Cb 0.44 -0.31 0.10 0.00 -1.03 0.00 0.00 41.12 40.31 1hrs n ASP 40 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 1hrs n ASP 41 N -1.31 2.50 -0.06 -1.12 5.75 -1.26 -4.45 116.55 116.59 1hrs n ASP 41 Ca 0.08 -1.72 -0.12 0.00 -0.01 0.00 0.00 54.79 53.03 1hrs n ASP 41 Cb 0.16 -0.07 -0.05 0.00 -1.03 0.00 0.00 41.12 40.13 1hrs n ASP 41 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 1hrs n VAL 42 N 0.88 0.70 -2.37 2.12 0.31 -0.49 -5.05 118.33 114.44 1hrs n VAL 42 Ca 0.10 -0.21 -0.17 0.00 -0.01 0.00 0.00 64.34 64.05 1hrs n VAL 42 Cb 0.41 -1.38 -0.01 0.00 -0.91 0.00 0.00 33.84 31.94 1hrs n VAL 42 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1hrs n ALA 43 N -3.30 -0.67 -3.22 3.52 0.00 0.14 -4.93 120.51 112.06 1hrs n ALA 43 Ca -0.24 0.14 -0.37 0.00 0.00 0.00 0.00 53.44 52.98 1hrs n ALA 43 Cb 0.70 -1.87 -0.03 0.00 0.00 0.00 0.00 19.45 18.25 1hrs n ALA 43 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1hrs n LEU 44 N -2.87 5.29 -0.34 0.00 7.94 -0.68 -4.90 117.00 121.45 1hrs n LEU 44 Ca -0.20 -5.28 0.21 0.00 -1.11 0.00 0.00 56.01 49.63 1hrs n LEU 44 Cb 0.65 -1.06 0.46 0.00 0.53 0.00 0.00 43.42 44.00 1hrs n LEU 44 CO 0.23 1.79 1.20 -0.08 -1.11 0.00 0.00 177.39 179.43 1hrs h GLU 45 N 5.10 0.45 -0.66 1.96 4.57 -1.92 0.57 114.58 124.65 1hrs h GLU 45 Ca 0.20 -0.03 0.07 0.00 -1.18 0.00 0.00 59.36 58.42 1hrs h GLU 45 Cb 0.66 -0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 29.10 1hrs h GLU 45 CO 1.11 0.30 0.44 0.78 -1.18 0.00 0.00 179.01 180.46 1hrs h GLY 46 N 0.47 0.80 0.24 1.92 0.00 -1.90 -1.66 103.07 102.94 1hrs h GLY 46 Ca 0.62 -0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.69 1hrs h GLY 46 CO -0.37 0.17 -0.03 -2.08 0.00 0.00 0.00 176.54 174.23 1hrs h VAL 47 N 0.61 1.62 -0.79 4.60 2.07 -1.23 -2.22 116.25 120.91 1hrs h VAL 47 Ca 0.29 -1.86 0.18 0.00 0.82 0.00 0.00 66.70 66.14 1hrs h VAL 47 Cb 0.35 2.87 -0.14 0.00 -1.52 0.00 0.00 31.29 32.84 1hrs h VAL 47 CO -0.09 0.48 -0.05 0.00 0.02 0.00 0.00 177.57 177.93 1hrs h HIS 49 N 0.06 1.09 0.47 0.00 2.76 -1.26 0.27 115.15 118.54 1hrs h HIS 49 Ca 0.42 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.57 1hrs h HIS 49 Cb 0.74 -0.35 -0.01 0.00 1.55 0.00 0.00 27.41 29.33 1hrs h HIS 49 CO -0.49 0.74 -0.32 0.35 -1.30 0.00 0.00 177.93 176.91 1hrs h PHE 50 N 1.13 -0.84 -0.42 5.26 3.57 0.09 -2.33 116.94 123.40 1hrs h PHE 50 Ca 0.29 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.69 1hrs h PHE 50 Cb -0.01 0.31 -0.02 0.00 2.79 0.00 0.00 35.95 39.02 1hrs h PHE 50 CO 0.01 -0.48 -0.14 0.74 -2.23 0.00 0.00 178.31 176.21 1hrs h PHE 51 N -0.76 0.84 -0.54 0.41 0.04 -0.65 -2.58 116.94 113.70 1hrs h PHE 51 Ca -0.05 -0.16 -0.07 0.00 2.80 0.00 0.00 57.97 60.49 1hrs h PHE 51 Cb 0.64 -0.21 -0.02 0.00 2.20 0.00 0.00 35.95 38.55 1hrs h PHE 51 CO -0.12 0.85 0.06 0.00 -0.60 0.00 0.00 178.31 178.50 1hrs h ARG 52 N 0.68 0.87 -0.20 1.51 3.08 -0.35 -0.68 114.38 119.29 1hrs h ARG 52 Ca 0.11 -0.22 -0.12 0.00 0.07 0.00 0.00 59.98 59.82 1hrs h ARG 52 Cb 0.62 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 1hrs h ARG 52 CO 0.04 0.83 -0.40 0.93 -1.07 0.00 0.00 179.97 180.30 1hrs h GLU 53 N 0.82 0.46 -0.73 0.04 4.39 -1.35 -2.96 114.58 115.25 1hrs h GLU 53 Ca 0.17 -0.23 -0.04 0.00 0.34 0.00 0.00 59.36 59.60 1hrs h GLU 53 Cb 0.40 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.02 1hrs h GLU 53 CO 0.01 0.79 0.31 -0.07 -1.16 0.00 0.00 179.01 178.89 1hrs h LEU 54 N 0.38 0.99 -0.84 1.33 -0.00 -0.93 -1.67 115.31 114.57 1hrs h LEU 54 Ca 0.03 -0.16 0.06 0.00 -0.00 0.00 0.00 57.88 57.82 1hrs h LEU 54 Cb 0.87 -0.26 -0.06 0.00 -0.00 0.00 0.00 40.66 41.21 1hrs h LEU 54 CO 0.07 0.88 0.51 0.00 -0.00 0.00 0.00 178.44 179.90 1hrs h ALA 55 N 1.15 1.15 -0.01 1.53 0.00 -1.05 -0.62 119.26 121.42 1hrs h ALA 55 Ca 0.25 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 1hrs h ALA 55 Cb 0.18 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1hrs h ALA 55 CO -0.02 0.24 0.00 1.49 0.00 0.00 0.00 179.25 180.96 1hrs h GLU 56 N 0.93 0.02 -0.85 0.00 4.81 -1.26 -0.86 114.58 117.36 1hrs h GLU 56 Ca 0.37 -0.00 0.16 0.00 -0.13 0.00 0.00 59.36 59.75 1hrs h GLU 56 Cb 0.19 -0.00 -0.10 0.00 0.63 0.00 0.00 28.75 29.47 1hrs h GLU 56 CO -0.18 0.20 0.42 0.93 -0.73 0.00 0.00 179.01 179.65 1hrs h GLU 57 N -0.17 0.56 -0.18 1.92 5.08 -1.02 0.23 114.58 121.00 1hrs h GLU 57 Ca 0.00 -0.03 -0.15 0.00 -1.00 0.00 0.00 59.36 58.18 1hrs h GLU 57 Cb 0.19 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1hrs h GLU 57 CO -0.00 0.37 -0.47 0.87 -1.00 0.00 0.00 179.01 178.78 1hrs h LYS 58 N 0.57 0.63 -0.67 2.33 1.79 -0.71 -1.21 116.57 119.31 1hrs h LYS 58 Ca 0.47 -0.44 0.07 0.00 -2.18 0.00 0.00 60.65 58.57 1hrs h LYS 58 Cb 0.71 0.07 -0.04 0.00 -1.58 0.00 0.00 32.23 31.39 1hrs h LYS 58 CO -0.39 1.06 0.44 -0.09 -1.08 0.00 0.00 179.45 179.39 1hrs h ARG 59 N 0.30 0.64 0.15 3.15 1.12 -0.30 -1.36 114.38 118.08 1hrs h ARG 59 Ca -0.01 -0.04 -0.01 0.00 -1.11 0.00 0.00 59.98 58.82 1hrs h ARG 59 Cb 1.09 -0.14 0.00 0.00 -0.01 0.00 0.00 29.97 30.90 1hrs h ARG 59 CO 0.10 0.42 -0.07 1.49 -3.11 0.00 0.00 179.97 178.80 1hrs h GLU 60 N 0.66 -0.19 -0.87 0.20 4.57 -0.09 -0.90 114.58 117.96 1hrs h GLU 60 Ca 0.29 0.01 0.17 0.00 -1.18 0.00 0.00 59.36 58.65 1hrs h GLU 60 Cb 0.29 0.04 -0.10 0.00 -0.16 0.00 0.00 28.75 28.82 1hrs h GLU 60 CO -0.09 -0.09 0.43 0.78 -1.18 0.00 0.00 179.01 178.86 1hrs h GLY 61 N -0.25 1.43 0.63 1.92 0.00 -0.49 0.49 103.07 106.81 1hrs h GLY 61 Ca -0.02 -0.23 -0.03 0.00 0.00 0.00 0.00 47.33 47.05 1hrs h GLY 61 CO 0.03 -0.10 -0.30 0.00 0.00 0.00 0.00 176.54 176.17 1hrs h ALA 62 N 1.60 -1.21 -0.91 3.60 0.00 -0.99 -1.90 119.26 119.45 1hrs h ALA 62 Ca 0.49 -0.18 0.25 0.00 0.00 0.00 0.00 54.91 55.46 1hrs h ALA 62 Cb 0.77 0.33 -0.14 0.00 0.00 0.00 0.00 17.79 18.75 1hrs h ALA 62 CO -0.41 -1.15 0.37 0.93 0.00 0.00 0.00 179.25 179.00 1hrs h GLU 63 N -0.86 0.31 -0.65 0.00 5.08 -0.87 -0.97 114.58 116.63 1hrs h GLU 63 Ca -0.09 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.20 1hrs h GLU 63 Cb 0.65 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 1hrs h GLU 63 CO 0.14 0.20 0.16 0.00 -1.00 0.00 0.00 179.01 178.52 1hrs h ARG 64 N 0.32 1.01 -0.42 2.33 3.08 -0.74 -0.67 114.38 119.29 1hrs h ARG 64 Ca 0.59 -0.22 -0.06 0.00 0.07 0.00 0.00 59.98 60.36 1hrs h ARG 64 Cb 1.20 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 31.09 1hrs h ARG 64 CO -0.59 0.89 0.04 -0.07 -1.07 0.00 0.00 179.97 179.17 1hrs h LEU 65 N 0.97 0.69 -0.41 3.04 3.38 -0.39 -1.34 115.31 121.24 1hrs h LEU 65 Ca 0.21 -0.28 0.07 0.00 0.09 0.00 0.00 57.88 57.97 1hrs h LEU 65 Cb 0.33 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.83 1hrs h LEU 65 CO -0.00 0.80 0.05 -0.07 0.09 0.00 0.00 178.44 179.31 1hrs h LEU 66 N 0.57 -0.07 0.14 1.67 3.38 -0.73 0.86 115.31 121.13 1hrs h LEU 66 Ca 0.13 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1hrs h LEU 66 Cb 0.42 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1hrs h LEU 66 CO 0.01 0.00 -0.07 0.50 0.09 0.00 0.00 178.44 178.98 1hrs h LYS 67 N 0.17 -0.18 -0.82 1.13 3.64 -1.03 -0.78 116.57 118.69 1hrs h LYS 67 Ca 0.20 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.58 1hrs h LYS 67 Cb 0.27 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.09 1hrs h LYS 67 CO -0.30 -0.08 0.46 1.98 -2.27 0.00 0.00 179.45 179.24 1hrs h MET 68 N -0.24 1.13 -0.43 1.90 4.05 -0.92 -2.46 114.93 117.96 1hrs h MET 68 Ca -0.02 -0.12 -0.00 0.00 -0.28 0.00 0.00 59.70 59.28 1hrs h MET 68 Cb 0.19 -0.23 -0.02 0.00 -0.80 0.00 0.00 31.60 30.74 1hrs h MET 68 CO 0.03 0.82 0.25 0.37 0.23 0.00 0.00 176.91 178.61 1hrs h GLN 69 N 1.14 0.59 0.00 0.39 4.15 -0.64 -0.23 115.11 120.51 1hrs h GLN 69 Ca 0.29 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.65 1hrs h GLN 69 Cb 0.01 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.58 1hrs h GLN 69 CO -0.05 0.45 0.00 -0.91 -1.93 0.00 0.00 178.83 176.39 1hrs h ASN 70 N 0.56 0.00 0.91 -0.69 -0.26 -0.87 0.60 115.58 115.84 1hrs h ASN 70 Ca 0.15 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.89 1hrs h ASN 70 Cb 0.02 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.28 1hrs h ASN 70 CO -0.03 0.00 -0.47 1.67 -1.06 0.00 0.00 177.43 177.54 1hrs n GLN 71 N -2.88 0.23 0.00 0.81 7.27 -0.16 -3.35 117.38 119.30 1hrs n GLN 71 Ca -0.01 0.09 0.07 0.00 0.07 0.00 0.00 57.00 57.22 1hrs n GLN 71 Cb 0.16 -1.66 -0.02 0.00 2.41 0.00 0.00 30.24 31.13 1hrs n GLN 71 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1hrs n ARG 72 N -2.00 1.89 -0.65 3.69 5.12 -0.81 -4.95 116.66 118.94 1hrs n ARG 72 Ca 0.04 -0.61 0.00 0.00 -1.93 0.00 0.00 57.85 55.35 1hrs n ARG 72 Cb 0.42 -1.22 0.00 0.00 -1.16 0.00 0.00 32.46 30.50 1hrs n ARG 72 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1hrs n GLY 73 N 1.14 0.95 3.93 -0.13 0.00 -1.16 -4.01 105.19 105.91 1hrs n GLY 73 Ca 0.05 -0.46 -0.25 0.00 0.00 0.00 0.00 46.02 45.37 1hrs n GLY 73 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hrs s GLY 74 N -2.46 1.54 -0.46 -0.02 0.00 0.18 -4.87 107.32 101.22 1hrs s GLY 74 Ca 0.00 -0.86 -0.03 0.00 0.00 0.00 0.00 44.72 43.83 1hrs s GLY 74 CO 0.00 -0.67 0.26 -1.60 0.00 0.00 0.00 173.10 171.09 1hrs s ARG 75 N -4.67 2.15 -0.68 2.90 3.52 -1.26 -4.43 118.95 116.47 1hrs s ARG 75 Ca 0.49 -1.99 -0.26 0.00 -0.13 0.00 0.00 55.73 53.83 1hrs s ARG 75 Cb -0.10 -3.63 -0.13 0.00 -1.56 0.00 0.00 34.95 29.53 1hrs s ARG 75 CO 0.41 -1.10 2.48 0.00 -0.81 0.00 0.00 175.30 176.27 1hrs n ALA 76 N 4.33 0.62 -2.76 6.12 0.00 -1.26 -4.95 120.51 122.62 1hrs n ALA 76 Ca -0.00 -0.83 -0.35 0.00 0.00 0.00 0.00 53.44 52.26 1hrs n ALA 76 Cb 0.40 -2.94 -0.08 0.00 0.00 0.00 0.00 19.45 16.83 1hrs n ALA 76 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1hrs s LEU 77 N 11.11 4.10 0.18 0.00 1.43 -1.26 -5.08 118.68 129.16 1hrs s LEU 77 Ca 1.09 0.20 -0.08 0.00 -1.03 0.00 0.00 54.13 54.31 1hrs s LEU 77 Cb -0.48 -2.05 -0.06 0.00 0.03 0.00 0.00 46.19 43.62 1hrs s LEU 77 CO 0.31 0.19 0.47 -0.36 0.23 0.00 0.00 176.35 177.19 1hrs s PHE 78 N 0.31 3.47 0.27 0.29 0.08 -1.26 -4.90 117.98 116.23 1hrs s PHE 78 Ca 0.07 0.75 0.03 0.00 0.12 0.00 0.00 56.93 57.89 1hrs s PHE 78 Cb -0.11 -2.15 -0.06 0.00 -0.57 0.00 0.00 43.02 40.13 1hrs s PHE 78 CO -0.01 0.37 0.05 -1.14 -0.10 0.00 0.00 175.22 174.38 1hrs s GLN 79 N -2.63 1.45 0.29 0.44 0.74 -1.26 -5.14 119.66 113.55 1hrs s GLN 79 Ca 0.43 -1.77 -0.08 0.00 0.05 0.00 0.00 55.36 53.99 1hrs s GLN 79 Cb -0.12 -0.57 -0.06 0.00 1.10 0.00 0.00 33.01 33.36 1hrs s GLN 79 CO 0.22 -0.19 0.59 0.16 -0.55 0.00 0.00 175.29 175.52 1hrs s ASP 80 N -3.36 6.52 -0.46 6.67 -4.77 -1.26 -5.00 116.67 115.01 1hrs s ASP 80 Ca 0.34 0.86 -0.20 0.00 -3.30 0.00 0.00 52.55 50.25 1hrs s ASP 80 Cb 0.07 -2.20 0.03 0.00 -1.09 0.00 0.00 42.92 39.73 1hrs s ASP 80 CO 0.12 -0.19 0.63 -0.76 0.70 0.00 0.00 175.17 175.68 1hrs s LEU 81 N -3.34 4.65 0.18 2.11 1.43 -1.26 -5.01 118.68 117.45 1hrs s LEU 81 Ca 0.46 -0.55 -0.33 0.00 -1.03 0.00 0.00 54.13 52.68 1hrs s LEU 81 Cb -0.11 -2.61 -0.13 0.00 0.03 0.00 0.00 46.19 43.37 1hrs s LEU 81 CO 0.27 -0.82 1.62 0.00 0.23 0.00 0.00 176.35 177.65 1hrs n GLN 82 N 6.24 2.37 -1.66 1.70 1.13 -1.26 -4.95 117.38 120.95 1hrs n GLN 82 Ca -0.03 0.86 -0.35 0.00 -1.94 0.00 0.00 57.00 55.53 1hrs n GLN 82 Cb 0.47 -2.65 0.07 0.00 0.11 0.00 0.00 30.24 28.24 1hrs n GLN 82 CO 0.00 0.00 0.00 -1.59 -1.44 0.00 0.00 177.06 174.03 1hrs s LYS 83 N 0.95 2.49 0.44 -1.09 -2.85 -1.26 -4.90 119.74 113.51 1hrs s LYS 83 Ca 0.77 1.75 -0.25 0.00 -1.00 0.00 0.00 55.97 57.25 1hrs s LYS 83 Cb -0.62 -1.88 -0.09 0.00 -2.06 0.00 0.00 37.83 33.19 1hrs s LYS 83 CO 0.36 -1.57 1.23 -2.30 0.10 0.00 0.00 175.35 173.18 1hrs n PRO 84 N -2.30 1.80 -2.54 1.78 -0.02 -1.26 -4.88 135.00 127.58 1hrs n PRO 84 Ca 0.13 0.64 -0.42 0.00 -2.02 0.00 0.00 63.50 61.84 1hrs n PRO 84 Cb 0.50 -2.35 0.01 0.00 -0.02 0.00 0.00 33.50 31.64 1hrs n PRO 84 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1hrs n SER 85 N 0.11 6.52 0.00 2.55 7.64 -1.26 -4.73 113.62 124.45 1hrs n SER 85 Ca 0.07 -3.32 0.00 0.00 1.01 0.00 0.00 58.87 56.63 1hrs n SER 85 Cb 0.40 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.27 1hrs n SER 85 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1hrs n GLN 86 N 1.89 0.00 -0.07 1.43 6.02 -1.26 -5.11 117.38 120.28 1hrs n GLN 86 Ca 0.41 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 57.25 1hrs n GLN 86 Cb 0.31 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.52 1hrs n GLN 86 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1hrs n ASP 87 N 0.00 1.09 -4.77 1.08 8.00 -1.26 -4.97 116.55 115.72 1hrs n ASP 87 Ca 0.00 0.19 -0.39 0.00 0.71 0.00 0.00 54.79 55.30 1hrs n ASP 87 Cb 0.00 -0.45 -0.06 0.00 -0.02 0.00 0.00 41.12 40.60 1hrs n ASP 87 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1hrs s GLU 88 N -2.29 4.26 0.00 -1.24 2.02 -1.26 -4.97 118.70 115.22 1hrs s GLU 88 Ca -0.20 0.66 0.13 0.00 0.02 0.00 0.00 54.97 55.58 1hrs s GLU 88 Cb 0.08 -3.33 0.07 0.00 0.10 0.00 0.00 34.13 31.04 1hrs s GLU 88 CO 0.26 0.41 0.84 0.91 0.02 0.00 0.00 175.26 177.70 1hrs n TRP 89 N 2.63 0.00 -4.04 1.61 8.01 -1.26 -5.08 117.44 119.31 1hrs n TRP 89 Ca -0.08 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.11 1hrs n TRP 89 Cb 0.51 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.81 1hrs n TRP 89 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1hrs n GLY 90 N 0.81 -0.04 3.56 6.99 0.00 -1.26 -3.41 105.19 111.83 1hrs n GLY 90 Ca 0.07 -1.03 -0.29 0.00 0.00 0.00 0.00 46.02 44.77 1hrs n GLY 90 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hrs s THR 91 N 0.00 2.06 0.17 2.61 2.01 -1.26 -4.82 115.64 116.41 1hrs s THR 91 Ca 0.00 0.02 -0.11 0.00 0.31 0.00 0.00 61.69 61.91 1hrs s THR 91 Cb 0.00 -2.08 0.07 0.00 0.01 0.00 0.00 72.50 70.50 1hrs s THR 91 CO 0.00 -0.03 1.69 0.74 -0.69 0.00 0.00 174.62 176.33 1hrs h THR 92 N -2.34 1.25 -0.01 -0.82 2.02 -1.99 0.10 112.91 111.12 1hrs h THR 92 Ca -0.55 -0.89 0.02 0.00 0.77 0.00 0.00 66.41 65.76 1hrs h THR 92 Cb 1.31 0.69 -0.05 0.00 -1.74 0.00 0.00 68.15 68.36 1hrs h THR 92 CO 0.47 0.33 -0.48 0.25 0.37 0.00 0.00 175.52 176.47 1hrs h LEU 93 N 0.86 -1.48 -1.20 2.58 5.85 -1.94 0.63 115.31 120.61 1hrs h LEU 93 Ca 0.19 0.17 0.01 0.00 0.84 0.00 0.00 57.88 59.09 1hrs h LEU 93 Cb 0.34 0.56 -0.04 0.00 0.37 0.00 0.00 40.66 41.89 1hrs h LEU 93 CO 0.00 -0.46 0.54 0.44 -0.34 0.00 0.00 178.44 178.62 1hrs h ASP 94 N -0.59 0.93 0.06 1.25 3.32 -1.77 -0.12 116.42 119.50 1hrs h ASP 94 Ca 0.01 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 1hrs h ASP 94 Cb 0.64 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.96 1hrs h ASP 94 CO -0.33 0.67 -0.03 0.00 -1.72 0.00 0.00 179.24 177.84 1hrs h ALA 95 N 1.49 -0.08 -0.64 3.45 0.00 0.11 -1.72 119.26 121.88 1hrs h ALA 95 Ca 0.30 -0.08 0.15 0.00 0.00 0.00 0.00 54.91 55.28 1hrs h ALA 95 Cb -0.11 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1hrs h ALA 95 CO -0.07 -0.48 0.44 1.98 0.00 0.00 0.00 179.25 181.13 1hrs h MET 96 N -0.21 0.22 0.01 0.00 -1.53 0.51 -1.85 114.93 112.08 1hrs h MET 96 Ca -0.01 -0.01 -0.19 0.00 -3.44 0.00 0.00 59.70 56.05 1hrs h MET 96 Cb 0.18 -0.05 -0.02 0.00 -0.55 0.00 0.00 31.60 31.17 1hrs h MET 96 CO 0.01 0.14 -0.87 0.87 0.14 0.00 0.00 176.91 177.21 1hrs h LYS 97 N 0.22 0.12 -0.24 0.39 1.57 -0.19 -2.27 116.57 116.17 1hrs h LYS 97 Ca 0.31 -0.14 -0.10 0.00 -1.87 0.00 0.00 60.65 58.85 1hrs h LYS 97 Cb 0.91 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.24 1hrs h LYS 97 CO -0.06 0.91 -0.29 0.00 -0.57 0.00 0.00 179.45 179.44 1hrs h ALA 98 N 1.04 1.05 -0.01 3.86 0.00 -0.63 -3.30 119.26 121.26 1hrs h ALA 98 Ca -0.03 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 1hrs h ALA 98 Cb 1.50 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 1hrs h ALA 98 CO 0.13 0.58 -0.02 0.00 0.00 0.00 0.00 179.25 179.94 1hrs h ALA 99 N 1.27 0.02 0.00 0.00 0.00 -1.01 -2.46 119.26 117.08 1hrs h ALA 99 Ca 0.06 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1hrs h ALA 99 Cb 0.72 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1hrs h ALA 99 CO 0.06 -0.20 -0.03 0.97 0.00 0.00 0.00 179.25 180.05 1hrs h ILE 100 N -0.47 0.63 -0.02 0.00 2.10 -1.52 0.07 117.51 118.30 1hrs h ILE 100 Ca 0.00 -0.12 -0.03 0.00 1.08 0.00 0.00 64.86 65.79 1hrs h ILE 100 Cb 0.55 1.07 0.00 0.00 -1.09 0.00 0.00 36.82 37.35 1hrs h ILE 100 CO 0.00 0.03 -0.11 0.58 -1.08 0.00 0.00 178.15 177.57 1hrs h VAL 101 N 0.00 1.52 -0.20 2.19 2.07 -1.62 -0.21 116.25 119.99 1hrs h VAL 101 Ca -0.00 -1.68 0.06 0.00 0.82 0.00 0.00 66.70 65.90 1hrs h VAL 101 Cb 0.07 2.58 -0.01 0.00 -1.52 0.00 0.00 31.29 32.41 1hrs h VAL 101 CO 0.00 0.45 0.16 0.25 0.02 0.00 0.00 177.57 178.45 1hrs h LEU 102 N -0.53 0.00 0.02 2.57 5.85 -0.51 0.15 115.31 122.86 1hrs h LEU 102 Ca -0.01 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 1hrs h LEU 102 Cb 0.80 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.83 1hrs h LEU 102 CO 0.02 0.00 -0.18 -0.33 -0.34 0.00 0.00 178.44 177.62 1hrs h GLU 103 N 0.00 0.09 -0.75 1.25 4.39 -1.38 -1.24 114.58 116.94 1hrs h GLU 103 Ca 0.09 -0.12 0.15 0.00 0.34 0.00 0.00 59.36 59.83 1hrs h GLU 103 Cb 0.41 0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 29.05 1hrs h GLU 103 CO -0.00 0.96 0.50 0.87 -1.16 0.00 0.00 179.01 180.19 1hrs h LYS 104 N -0.73 0.38 -0.05 2.33 1.57 0.91 -1.29 116.57 119.68 1hrs h LYS 104 Ca -0.03 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1hrs h LYS 104 Cb 1.04 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.26 1hrs h LYS 104 CO 0.03 0.25 0.02 0.77 -0.57 0.00 0.00 179.45 179.95 1hrs h SER 105 N 0.39 0.07 -0.46 0.86 0.02 -0.70 0.73 113.55 114.46 1hrs h SER 105 Ca 0.37 -0.19 -0.14 0.00 -0.84 0.00 0.00 61.79 60.98 1hrs h SER 105 Cb 0.88 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.39 1hrs h SER 105 CO -0.11 0.25 -0.26 -0.07 -1.14 0.00 0.00 176.83 175.50 1hrs h LEU 106 N -0.11 1.02 -1.21 5.07 4.07 -0.91 -2.12 115.31 121.12 1hrs h LEU 106 Ca 0.02 -0.41 0.02 0.00 0.08 0.00 0.00 57.88 57.59 1hrs h LEU 106 Cb 0.20 -0.28 -0.04 0.00 1.08 0.00 0.00 40.66 41.61 1hrs h LEU 106 CO -0.00 1.21 0.54 -1.13 -1.08 0.00 0.00 178.44 177.98 1hrs h ASN 107 N 0.84 0.90 -0.51 -0.43 -0.00 -0.99 0.66 115.58 116.06 1hrs h ASN 107 Ca 0.10 -0.02 -0.04 0.00 -0.00 0.00 0.00 56.30 56.34 1hrs h ASN 107 Cb 0.84 -0.22 -0.03 0.00 -0.00 0.00 0.00 38.32 38.92 1hrs h ASN 107 CO 0.07 0.63 0.17 -0.61 -0.00 0.00 0.00 177.43 177.70 1hrs h GLN 108 N 1.05 0.84 -0.12 6.67 5.75 -0.63 0.38 115.11 129.05 1hrs h GLN 108 Ca 0.32 -0.16 -0.01 0.00 -0.15 0.00 0.00 58.65 58.65 1hrs h GLN 108 Cb -0.03 -0.13 -0.00 0.00 1.07 0.00 0.00 27.48 28.38 1hrs h GLN 108 CO -0.08 0.73 0.02 0.00 -2.65 0.00 0.00 178.83 176.85 1hrs h ALA 109 N 1.37 0.16 -0.53 3.38 0.00 -0.22 0.43 119.26 123.85 1hrs h ALA 109 Ca 0.18 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 55.02 1hrs h ALA 109 Cb 0.25 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.93 1hrs h ALA 109 CO -0.01 -0.19 0.17 -0.07 0.00 0.00 0.00 179.25 179.15 1hrs h LEU 110 N -0.02 0.14 -0.62 0.00 4.07 -0.92 0.16 115.31 118.11 1hrs h LEU 110 Ca 0.04 0.07 0.05 0.00 0.08 0.00 0.00 57.88 58.12 1hrs h LEU 110 Cb 0.28 0.07 -0.05 0.00 1.08 0.00 0.00 40.66 42.04 1hrs h LEU 110 CO 0.00 0.10 0.34 -0.07 -1.08 0.00 0.00 178.44 177.74 1hrs h LEU 111 N 0.34 0.51 -0.15 1.67 4.07 -0.30 0.72 115.31 122.17 1hrs h LEU 111 Ca 0.26 0.03 -0.23 0.00 0.08 0.00 0.00 57.88 58.01 1hrs h LEU 111 Cb 0.31 -0.07 0.01 0.00 1.08 0.00 0.00 40.66 41.98 1hrs h LEU 111 CO -0.28 0.34 -0.95 0.44 -1.08 0.00 0.00 178.44 176.91 1hrs h ASP 112 N 0.65 0.62 -0.44 -0.43 3.32 0.55 -2.87 116.42 117.81 1hrs h ASP 112 Ca 0.28 -0.49 -0.14 0.00 0.02 0.00 0.00 57.03 56.70 1hrs h ASP 112 Cb 0.16 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1hrs h ASP 112 CO -0.17 1.29 -0.25 0.25 -1.72 0.00 0.00 179.24 178.64 1hrs h LEU 113 N 0.27 1.00 -1.23 1.55 5.85 -0.29 -2.15 115.31 120.31 1hrs h LEU 113 Ca -0.09 -0.39 0.09 0.00 0.84 0.00 0.00 57.88 58.33 1hrs h LEU 113 Cb 1.59 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 42.28 1hrs h LEU 113 CO 0.17 1.19 0.56 -0.74 -0.34 0.00 0.00 178.44 179.28 1hrs h HIS 114 N 0.83 0.93 -0.01 1.25 2.76 -0.90 0.42 115.15 120.42 1hrs h HIS 114 Ca 0.10 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.28 1hrs h HIS 114 Cb 0.83 -0.30 0.00 0.00 1.55 0.00 0.00 27.41 29.49 1hrs h HIS 114 CO 0.05 0.44 -0.04 0.00 -1.30 0.00 0.00 177.93 177.09 1hrs h ALA 115 N 1.56 0.02 -0.50 5.26 0.00 -1.21 -3.12 119.26 121.27 1hrs h ALA 115 Ca 0.39 -0.32 0.03 0.00 0.00 0.00 0.00 54.91 55.01 1hrs h ALA 115 Cb 0.37 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1hrs h ALA 115 CO -0.16 -0.14 0.33 1.25 0.00 0.00 0.00 179.25 180.53 1hrs h LEU 116 N -0.55 0.50 0.00 0.00 6.46 -1.34 0.95 115.31 121.32 1hrs h LEU 116 Ca -0.00 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.75 1hrs h LEU 116 Cb 0.65 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 40.47 1hrs h LEU 116 CO 0.01 0.35 0.00 0.61 -0.62 0.00 0.00 178.44 178.79 1hrs n GLY 117 N -1.48 -0.36 0.40 3.75 0.00 0.13 -2.56 105.19 105.07 1hrs n GLY 117 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1hrs n GLY 117 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1hrs n SER 118 N -0.94 1.42 0.15 1.61 3.41 0.07 -0.70 113.62 118.65 1hrs n SER 118 Ca 0.08 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.80 1hrs n SER 118 Cb 0.03 0.00 0.55 0.00 -0.26 0.00 0.00 64.21 64.53 1hrs n SER 118 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1hrs n ALA 119 N -2.18 1.35 -3.12 7.33 0.00 0.10 -1.23 120.51 122.76 1hrs n ALA 119 Ca 0.00 0.15 -0.24 0.00 0.00 0.00 0.00 53.44 53.34 1hrs n ALA 119 Cb 0.24 -1.36 -0.05 0.00 0.00 0.00 0.00 19.45 18.28 1hrs n ALA 119 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1hrs n GLN 120 N -2.27 2.25 0.00 0.00 7.27 -1.06 -5.05 117.38 118.52 1hrs n GLN 120 Ca 0.00 -4.27 0.00 0.00 0.07 0.00 0.00 57.00 52.80 1hrs n GLN 120 Cb 0.13 -1.99 0.00 0.00 2.41 0.00 0.00 30.24 30.79 1hrs n GLN 120 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1hrs n ALA 121 N 0.28 0.00 -3.53 1.69 0.00 -0.36 -4.65 120.51 113.94 1hrs n ALA 121 Ca 0.28 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.44 1hrs n ALA 121 Cb 0.48 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.81 1hrs n ALA 121 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1hrs s ASP 122 N 0.00 2.72 0.02 0.00 -1.08 0.13 -4.92 116.67 113.54 1hrs s ASP 122 Ca 0.00 -2.74 -0.06 0.00 -0.52 0.00 0.00 52.55 49.24 1hrs s ASP 122 Cb 0.00 -0.65 -0.02 0.00 -1.46 0.00 0.00 42.92 40.79 1hrs s ASP 122 CO 0.00 -0.23 1.10 -0.65 0.52 0.00 0.00 175.17 175.91 1hrs h PRO 123 N 6.33 -0.05 0.00 4.34 0.11 -1.92 -2.94 132.00 137.86 1hrs h PRO 123 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 1hrs h PRO 123 Cb 0.92 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.04 1hrs h PRO 123 CO 0.39 -0.04 0.00 -2.39 -0.21 0.00 0.00 178.00 175.75 1hrs n HIS 124 N -3.23 0.00 -0.11 0.65 1.44 -1.26 -3.08 115.22 109.64 1hrs n HIS 124 Ca -0.00 0.00 -0.21 0.00 -2.01 0.00 0.00 57.72 55.50 1hrs n HIS 124 Cb 0.06 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.07 1hrs n HIS 124 CO 0.00 0.00 0.00 -0.11 -2.81 0.00 0.00 176.34 173.42 1hrs n LEU 125 N -0.61 1.87 -0.27 2.39 7.94 -1.13 -2.15 117.00 125.03 1hrs n LEU 125 Ca 0.04 0.43 0.00 0.00 -1.11 0.00 0.00 56.01 55.38 1hrs n LEU 125 Cb 0.02 -0.92 0.00 0.00 0.53 0.00 0.00 43.42 43.05 1hrs n LEU 125 CO 0.03 0.21 0.07 0.00 -1.11 0.00 0.00 177.39 176.59 1hrs n ASP 127 N -0.00 1.75 -0.23 0.00 8.00 -1.22 -4.81 116.55 120.04 1hrs n ASP 127 Ca 0.00 0.00 -0.05 0.00 0.71 0.00 0.00 54.79 55.45 1hrs n ASP 127 Cb 0.03 0.02 0.06 0.00 -0.02 0.00 0.00 41.12 41.21 1hrs n ASP 127 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1hrs h PHE 128 N 0.00 0.80 -0.25 1.24 3.57 -0.81 -2.50 116.94 119.00 1hrs h PHE 128 Ca 0.00 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.53 1hrs h PHE 128 Cb 0.43 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.88 1hrs h PHE 128 CO 0.00 0.48 0.14 -0.07 -2.23 0.00 0.00 178.31 176.64 1hrs h LEU 129 N 0.86 0.23 0.03 0.59 -0.00 -1.40 -3.28 115.31 112.35 1hrs h LEU 129 Ca 0.25 0.00 -0.12 0.00 -0.00 0.00 0.00 57.88 58.02 1hrs h LEU 129 Cb -0.04 -0.05 0.01 0.00 -0.00 0.00 0.00 40.66 40.58 1hrs h LEU 129 CO -0.08 0.17 -0.49 -0.33 -0.00 0.00 0.00 178.44 177.71 1hrs h GLU 130 N 0.30 0.27 -0.91 1.13 3.07 -1.71 -1.38 114.58 115.36 1hrs h GLU 130 Ca 0.10 -0.34 0.24 0.00 -0.50 0.00 0.00 59.36 58.86 1hrs h GLU 130 Cb -0.00 0.11 -0.13 0.00 -0.84 0.00 0.00 28.75 27.88 1hrs h GLU 130 CO -0.05 1.07 0.37 0.77 -1.40 0.00 0.00 179.01 179.78 1hrs h SER 131 N -0.37 0.26 0.00 1.42 0.02 -1.55 -2.52 113.55 110.81 1hrs h SER 131 Ca -0.07 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1hrs h SER 131 Cb 1.27 0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.99 1hrs h SER 131 CO 0.10 -0.07 -0.81 1.41 -1.14 0.00 0.00 176.83 176.31 1hrs n HIS 132 N -5.10 0.07 0.00 3.45 8.25 -1.23 -4.77 115.22 115.88 1hrs n HIS 132 Ca 0.24 0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.73 1hrs n HIS 132 Cb 0.72 -0.45 0.00 0.00 1.12 0.00 0.00 29.99 31.38 1hrs n HIS 132 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1hrs n PHE 133 N -4.17 0.00 -0.32 4.41 3.72 -0.97 -3.05 117.46 117.08 1hrs n PHE 133 Ca -0.11 0.00 0.19 0.00 -0.05 0.00 0.00 57.45 57.48 1hrs n PHE 133 Cb 0.42 0.00 0.38 0.00 -0.94 0.00 0.00 39.48 39.34 1hrs n PHE 133 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1hrs h LEU 134 N 0.00 -0.09 0.38 4.37 4.07 -1.19 -2.42 115.31 120.43 1hrs h LEU 134 Ca 0.00 0.25 -0.02 0.00 0.08 0.00 0.00 57.88 58.19 1hrs h LEU 134 Cb 0.00 0.35 0.00 0.00 1.08 0.00 0.00 40.66 42.10 1hrs h LEU 134 CO 0.00 -0.31 -0.18 0.44 -1.08 0.00 0.00 178.44 177.30 1hrs h ASP 135 N 0.08 -0.44 -1.20 -0.43 5.19 -1.62 -2.79 116.42 115.21 1hrs h ASP 135 Ca 0.66 0.02 0.34 0.00 -0.62 0.00 0.00 57.03 57.43 1hrs h ASP 135 Cb 1.49 0.11 -0.07 0.00 0.18 0.00 0.00 39.33 41.04 1hrs h ASP 135 CO -0.80 -0.18 0.83 -0.08 -3.12 0.00 0.00 179.24 175.89 1hrs h GLU 136 N -0.78 0.12 -0.70 3.56 4.81 -1.41 0.72 114.58 120.91 1hrs h GLU 136 Ca -0.05 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.11 1hrs h GLU 136 Cb 0.40 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.72 1hrs h GLU 136 CO 0.09 0.08 0.20 1.49 -0.73 0.00 0.00 179.01 180.14 1hrs h GLU 137 N 0.13 1.08 -0.19 1.92 4.57 -1.39 0.15 114.58 120.85 1hrs h GLU 137 Ca 0.62 -0.23 -0.09 0.00 -1.18 0.00 0.00 59.36 58.47 1hrs h GLU 137 Cb 2.15 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 30.58 1hrs h GLU 137 CO -0.14 0.93 -0.24 0.28 -1.18 0.00 0.00 179.01 178.66 1hrs h VAL 138 N 1.04 1.34 -0.20 0.32 2.07 -0.57 -1.31 116.25 118.93 1hrs h VAL 138 Ca 0.22 -1.43 0.01 0.00 0.82 0.00 0.00 66.70 66.32 1hrs h VAL 138 Cb 0.31 1.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 1hrs h VAL 138 CO -0.01 0.44 0.12 0.50 0.02 0.00 0.00 177.57 178.64 1hrs h LYS 139 N 0.17 0.24 -0.63 1.57 3.64 -1.38 -0.48 116.57 119.69 1hrs h LYS 139 Ca 0.02 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 1hrs h LYS 139 Cb 0.81 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.54 1hrs h LYS 139 CO 0.06 0.16 0.31 1.25 -2.27 0.00 0.00 179.45 178.96 1hrs h LEU 140 N 0.24 0.81 -0.92 5.20 5.85 -0.73 -1.68 115.31 124.09 1hrs h LEU 140 Ca 0.08 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 1hrs h LEU 140 Cb -0.01 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 40.81 1hrs h LEU 140 CO -0.03 0.70 -0.09 0.40 -0.34 0.00 0.00 178.44 179.08 1hrs h ILE 141 N 0.86 0.20 0.00 4.05 2.04 -0.84 -1.56 117.51 122.26 1hrs h ILE 141 Ca 0.22 -0.90 -0.07 0.00 1.00 0.00 0.00 64.86 65.10 1hrs h ILE 141 Cb 0.10 1.76 0.01 0.00 -0.74 0.00 0.00 36.82 37.94 1hrs h ILE 141 CO -0.03 0.09 -0.28 0.50 0.00 0.00 0.00 178.15 178.43 1hrs h LYS 142 N 0.00 0.19 0.00 2.37 3.64 -0.38 -2.82 116.57 119.57 1hrs h LYS 142 Ca -0.00 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 1hrs h LYS 142 Cb 0.75 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.63 1hrs h LYS 142 CO 0.01 0.94 0.00 0.87 -2.27 0.00 0.00 179.45 179.00 1hrs h LYS 143 N -0.48 0.00 0.17 1.90 1.57 -1.15 0.18 116.57 118.76 1hrs h LYS 143 Ca -0.04 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.50 1hrs h LYS 143 Cb 1.04 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.37 1hrs h LYS 143 CO 0.06 0.00 -1.09 1.98 -0.57 0.00 0.00 179.45 179.83 1hrs h MET 144 N 0.00 0.36 -0.36 3.15 4.05 -1.33 -2.90 114.93 117.90 1hrs h MET 144 Ca 0.00 -0.62 0.00 0.00 -0.28 0.00 0.00 59.70 58.80 1hrs h MET 144 Cb 0.30 0.23 -0.02 0.00 -0.80 0.00 0.00 31.60 31.31 1hrs h MET 144 CO 0.00 1.30 0.24 0.78 0.23 0.00 0.00 176.91 179.46 1hrs h GLY 145 N -0.16 0.51 0.91 1.39 0.00 -0.51 -1.86 103.07 103.35 1hrs h GLY 145 Ca -0.20 -0.19 0.07 0.00 0.00 0.00 0.00 47.33 47.02 1hrs h GLY 145 CO 0.18 0.19 0.53 -0.55 0.00 0.00 0.00 176.54 176.89 1hrs h ASP 146 N 0.49 0.76 -0.91 0.19 3.32 -0.92 -1.64 116.42 117.71 1hrs h ASP 146 Ca 0.13 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 1hrs h ASP 146 Cb -0.06 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.30 1hrs h ASP 146 CO -0.03 0.48 0.50 0.45 -1.72 0.00 0.00 179.24 178.92 1hrs h HIS 147 N 0.85 1.24 -0.51 4.55 3.86 -1.13 -2.46 115.15 121.55 1hrs h HIS 147 Ca 0.36 -0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.51 1hrs h HIS 147 Cb 0.29 -0.40 -0.02 0.00 1.06 0.00 0.00 27.41 28.34 1hrs h HIS 147 CO -0.00 0.85 0.20 -0.07 0.86 0.00 0.00 177.93 179.77 1hrs h LEU 148 N 1.27 0.72 0.19 2.43 3.38 -0.96 0.34 115.31 122.68 1hrs h LEU 148 Ca 0.32 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1hrs h LEU 148 Cb 0.02 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1hrs h LEU 148 CO -0.05 0.70 -0.18 0.74 0.09 0.00 0.00 178.44 179.74 1hrs h THR 149 N 0.69 0.60 0.43 0.22 2.02 -1.28 0.35 112.91 115.95 1hrs h THR 149 Ca 0.17 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.34 1hrs h THR 149 Cb 0.21 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 1hrs h THR 149 CO -0.01 0.00 -0.30 0.78 0.37 0.00 0.00 175.52 176.35 1hrs h ASN 150 N -0.40 -0.78 0.34 4.18 2.35 -1.16 0.28 115.58 120.39 1hrs h ASN 150 Ca -0.00 0.05 -0.09 0.00 -0.55 0.00 0.00 56.30 55.71 1hrs h ASN 150 Cb 0.37 0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.97 1hrs h ASN 150 CO -0.04 -0.46 -0.40 -0.29 -1.65 0.00 0.00 177.43 174.58 1hrs h ILE 151 N -0.72 1.30 -0.41 2.81 6.09 -0.04 -1.30 117.51 125.23 1hrs h ILE 151 Ca -0.04 -1.44 -0.05 0.00 -1.37 0.00 0.00 64.86 61.96 1hrs h ILE 151 Cb 0.61 1.72 -0.02 0.00 0.47 0.00 0.00 36.82 39.61 1hrs h ILE 151 CO 0.02 0.42 0.06 1.56 -3.07 0.00 0.00 178.15 177.14 1hrs h GLN 152 N 0.08 0.69 -0.22 2.19 4.20 0.17 0.24 115.11 122.45 1hrs h GLN 152 Ca 0.01 -0.19 -0.08 0.00 0.06 0.00 0.00 58.65 58.45 1hrs h GLN 152 Cb 0.75 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.44 1hrs h GLN 152 CO 0.06 0.73 -0.22 -0.09 -0.67 0.00 0.00 178.83 178.64 1hrs h ARG 153 N 0.54 0.40 0.00 1.46 2.43 0.12 -3.18 114.38 116.15 1hrs h ARG 153 Ca 0.12 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1hrs h ARG 153 Cb 0.38 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1hrs h ARG 153 CO 0.01 0.60 0.00 1.28 -1.51 0.00 0.00 179.97 180.35 1hrs n LEU 154 N -4.16 1.97 0.00 3.80 4.77 -0.54 -4.41 117.00 118.43 1hrs n LEU 154 Ca -0.00 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 1hrs n LEU 154 Cb 0.37 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1hrs n LEU 154 CO 0.41 -0.16 0.00 0.52 -1.33 0.00 0.00 177.39 176.83 1hrs n VAL 155 N -0.98 0.00 0.01 4.08 0.31 0.80 -1.73 118.33 120.83 1hrs n VAL 155 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 64.34 64.41 1hrs n VAL 155 Cb 0.00 -0.51 -0.12 0.00 -0.91 0.00 0.00 33.84 32.30 1hrs n VAL 155 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1hrs n GLY 156 N -0.21 -0.72 0.00 2.92 0.00 -1.20 -4.14 105.19 101.84 1hrs n GLY 156 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1hrs n GLY 156 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1hrs n SER 157 N -2.04 0.00 -4.55 1.61 2.88 -0.70 -4.83 113.62 106.00 1hrs n SER 157 Ca -0.03 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.08 1hrs n SER 157 Cb 0.41 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.82 1hrs n SER 157 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 1hrs s GLN 158 N 0.00 3.44 0.27 -1.46 -1.52 -1.26 -4.97 119.66 114.16 1hrs s GLN 158 Ca 0.00 -0.08 -0.02 0.00 -1.95 0.00 0.00 55.36 53.32 1hrs s GLN 158 Cb 0.00 -3.92 0.44 0.00 -0.22 0.00 0.00 33.01 29.31 1hrs s GLN 158 CO 0.00 -1.07 1.88 0.00 -0.25 0.00 0.00 175.29 175.85 1hrs h ALA 159 N 8.90 1.43 -0.52 6.09 0.00 -1.87 -3.17 119.26 130.11 1hrs h ALA 159 Ca -0.25 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1hrs h ALA 159 Cb 1.09 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 1hrs h ALA 159 CO 0.95 0.42 0.23 0.78 0.00 0.00 0.00 179.25 181.62 1hrs h GLY 160 N 1.15 0.79 1.33 0.00 0.00 -1.93 -2.02 103.07 102.39 1hrs h GLY 160 Ca 0.43 -0.38 -0.19 0.00 0.00 0.00 0.00 47.33 47.20 1hrs h GLY 160 CO -0.18 0.36 -0.65 -2.00 0.00 0.00 0.00 176.54 174.07 1hrs h LEU 161 N 0.74 0.78 0.70 3.11 5.85 -1.97 -2.76 115.31 121.76 1hrs h LEU 161 Ca 0.18 -0.47 -0.03 0.00 0.84 0.00 0.00 57.88 58.41 1hrs h LEU 161 Cb 0.11 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 1hrs h LEU 161 CO -0.02 1.23 -0.48 1.23 -0.34 0.00 0.00 178.44 180.07 1hrs h GLY 162 N 0.86 -1.26 -0.90 3.75 0.00 -1.37 -1.33 103.07 102.81 1hrs h GLY 162 Ca -0.02 0.54 0.16 0.00 0.00 0.00 0.00 47.33 48.01 1hrs h GLY 162 CO 0.13 -0.42 -0.32 0.83 0.00 0.00 0.00 176.54 176.76 1hrs h GLU 163 N -1.12 -0.02 0.15 4.80 5.08 -1.46 -1.44 114.58 120.59 1hrs h GLU 163 Ca -0.09 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1hrs h GLU 163 Cb 0.91 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.17 1hrs h GLU 163 CO 0.06 -0.01 -0.10 -0.92 -1.00 0.00 0.00 179.01 177.04 1hrs h TYR 164 N -0.02 -0.25 -0.95 4.33 3.20 -1.20 -2.16 116.97 119.93 1hrs h TYR 164 Ca 0.38 -0.00 0.29 0.00 3.14 0.00 0.00 58.73 62.54 1hrs h TYR 164 Cb 0.63 0.09 -0.15 0.00 1.54 0.00 0.00 36.73 38.85 1hrs h TYR 164 CO -0.79 -0.14 0.40 -0.07 -1.64 0.00 0.00 178.16 175.91 1hrs h LEU 165 N -0.23 0.23 0.30 2.82 3.38 -1.13 -0.46 115.31 120.21 1hrs h LEU 165 Ca -0.02 0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1hrs h LEU 165 Cb 0.19 0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1hrs h LEU 165 CO 0.02 -0.17 -0.14 0.15 0.09 0.00 0.00 178.44 178.39 1hrs h PHE 166 N 0.24 -0.37 0.00 1.13 3.57 -1.21 0.12 116.94 120.42 1hrs h PHE 166 Ca 0.66 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 62.13 1hrs h PHE 166 Cb 1.44 0.12 -0.00 0.00 2.79 0.00 0.00 35.95 40.30 1hrs h PHE 166 CO -0.14 -0.08 -0.07 1.49 -2.23 0.00 0.00 178.31 177.28 1hrs h GLU 167 N -0.63 0.00 0.05 1.11 4.22 -0.55 0.10 114.58 118.88 1hrs h GLU 167 Ca -0.04 0.00 -0.28 0.00 0.08 0.00 0.00 59.36 59.12 1hrs h GLU 167 Cb 0.45 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.67 1hrs h GLU 167 CO 0.07 0.07 -1.49 0.00 -2.18 0.00 0.00 179.01 175.47 1hrs h ARG 168 N 0.00 0.11 0.00 1.92 2.47 -0.33 -3.28 114.38 115.27 1hrs h ARG 168 Ca -0.00 -0.19 -0.16 0.00 -1.26 0.00 0.00 59.98 58.37 1hrs h ARG 168 Cb 0.39 0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 28.75 1hrs h ARG 168 CO 0.01 0.89 -1.66 1.28 0.56 0.00 0.00 179.97 181.05 1hrs n LEU 169 N -3.30 0.00 0.06 3.04 4.77 0.34 -4.25 117.00 117.66 1hrs n LEU 169 Ca -0.14 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.81 1hrs n LEU 169 Cb 1.02 0.21 -0.02 0.00 -2.33 0.00 0.00 43.42 42.31 1hrs n LEU 169 CO 0.47 0.21 0.10 0.74 -1.33 0.00 0.00 177.39 177.59 1hrs h THR 170 N 0.00 0.00 -0.38 -5.08 2.02 -0.91 -1.99 112.91 106.58 1hrs h THR 170 Ca -0.23 -0.71 -0.72 0.00 0.77 0.00 0.00 66.41 65.51 1hrs h THR 170 Cb 1.46 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.80 1hrs h THR 170 CO 0.01 0.00 2.84 -0.11 0.37 0.00 0.00 175.52 178.63 1hrs n LEU 171 N -4.61 6.83 0.00 2.58 -0.00 -1.24 -2.14 117.00 118.42 1hrs n LEU 171 Ca -0.03 -4.28 0.00 0.00 -0.00 0.00 0.00 56.01 51.70 1hrs n LEU 171 Cb 0.09 -1.61 0.00 0.00 -0.00 0.00 0.00 43.42 41.91 1hrs n LEU 171 CO 0.07 1.20 0.00 1.17 -0.00 0.00 0.00 177.39 179.83 1hrs n LYS 172 N 5.45 0.00 0.02 1.96 3.00 -1.25 -4.81 118.16 122.52 1hrs n LYS 172 Ca 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.80 1hrs n LYS 172 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.41 1hrs n LYS 172 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1hrs n HIS 173 N 0.00 -0.28 1.70 5.64 8.25 -0.75 -4.88 115.22 124.91 1hrs n HIS 173 Ca 0.00 0.05 0.15 0.00 -0.26 0.00 0.00 57.72 57.66 1hrs n HIS 173 Cb 0.00 0.25 0.70 0.00 1.12 0.00 0.00 29.99 32.06 1hrs n HIS 173 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51