#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c5d s SER 28 N 0.00 7.39 0.53 1.62 0.15 -1.26 -4.94 113.70 117.18 2c5d s SER 28 Ca 0.00 1.68 0.25 0.00 0.70 0.00 0.00 55.95 58.58 2c5d s SER 28 Cb 0.00 -2.57 1.46 0.00 -1.71 0.00 0.00 66.02 63.20 2c5d s SER 28 CO 0.00 -0.20 2.11 1.55 1.20 0.00 0.00 173.24 177.90 2c5d h PRO 29 N 6.48 0.00 -7.23 5.44 0.13 -1.97 -3.45 132.00 131.40 2c5d h PRO 29 Ca -0.42 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.19 2c5d h PRO 29 Cb 1.22 0.00 0.18 0.00 0.13 0.00 0.00 31.00 32.53 2c5d h PRO 29 CO 0.74 0.09 0.31 -0.06 -0.23 0.00 0.00 178.00 178.85 2c5d s PHE 30 N -4.44 1.80 0.00 1.56 0.40 -1.26 -1.36 117.98 114.67 2c5d s PHE 30 Ca -0.04 1.70 0.00 0.00 -0.60 0.00 0.00 56.93 58.00 2c5d s PHE 30 Cb 0.14 -3.42 0.00 0.00 0.51 0.00 0.00 43.02 40.25 2c5d s PHE 30 CO 0.60 -2.77 0.00 0.28 0.70 0.00 0.00 175.22 174.03 2c5d n VAL 31 N -3.56 0.00 -4.19 -0.44 0.31 -0.81 -4.80 118.33 104.84 2c5d n VAL 31 Ca 0.13 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.26 2c5d n VAL 31 Cb 0.51 0.00 -0.16 0.00 -0.91 0.00 0.00 33.84 33.28 2c5d n VAL 31 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2c5d s GLY 32 N -0.18 0.45 0.27 2.92 0.00 -0.72 -4.95 107.32 105.10 2c5d s GLY 32 Ca 0.00 -0.07 0.08 0.00 0.00 0.00 0.00 44.72 44.74 2c5d s GLY 32 CO 0.00 0.38 0.10 -1.31 0.00 0.00 0.00 173.10 172.26 2c5d s ASN 33 N 0.83 4.97 0.73 1.64 0.01 -1.26 -1.24 114.94 120.61 2c5d s ASN 33 Ca -0.11 -0.49 -0.16 0.00 -0.71 0.00 0.00 52.86 51.39 2c5d s ASN 33 Cb -0.14 -1.06 0.02 0.00 0.41 0.00 0.00 41.25 40.48 2c5d s ASN 33 CO 0.00 -0.05 1.09 -2.65 -1.51 0.00 0.00 177.10 173.99 2c5d n PRO 34 N -1.04 0.54 0.00 -0.60 -0.02 -1.24 -4.68 135.00 127.95 2c5d n PRO 34 Ca -0.07 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 2c5d n PRO 34 Cb 0.59 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 2c5d n PRO 34 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c5d n GLY 35 N 0.92 1.76 2.98 -1.23 0.00 -1.26 -4.46 105.19 103.90 2c5d n GLY 35 Ca 0.14 -1.56 -0.12 0.00 0.00 0.00 0.00 46.02 44.47 2c5d n GLY 35 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2c5d s ASN 36 N -1.00 -0.07 -0.10 1.61 0.01 -1.26 -3.19 114.94 110.93 2c5d s ASN 36 Ca 0.00 0.13 -0.02 0.00 -0.71 0.00 0.00 52.86 52.27 2c5d s ASN 36 Cb 0.00 0.19 0.03 0.00 0.41 0.00 0.00 41.25 41.88 2c5d s ASN 36 CO 0.00 -0.06 0.00 0.27 -1.51 0.00 0.00 177.10 175.80 2c5d s ILE 37 N -0.10 0.47 -0.05 0.60 -4.36 -1.04 -5.00 121.20 111.72 2c5d s ILE 37 Ca -0.02 -0.08 0.04 0.00 -0.26 0.00 0.00 60.65 60.34 2c5d s ILE 37 Cb -0.01 -0.70 -0.00 0.00 1.25 0.00 0.00 42.46 42.99 2c5d s ILE 37 CO 0.00 0.16 -0.18 0.42 0.24 0.00 0.00 174.94 175.58 2c5d s THR 38 N 1.92 1.55 0.05 8.37 -4.23 -1.26 -2.47 115.64 119.57 2c5d s THR 38 Ca 0.04 -0.77 -0.15 0.00 -1.18 0.00 0.00 61.69 59.62 2c5d s THR 38 Cb -0.13 -1.33 0.05 0.00 1.34 0.00 0.00 72.50 72.43 2c5d s THR 38 CO -0.06 0.44 0.69 0.61 -0.54 0.00 0.00 174.62 175.76 2c5d n GLY 39 N 3.19 0.65 3.82 3.99 0.00 -1.02 -4.92 105.19 110.89 2c5d n GLY 39 Ca -0.18 -1.01 -0.30 0.00 0.00 0.00 0.00 46.02 44.53 2c5d n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c5d s ALA 40 N -1.61 2.31 0.61 4.61 0.00 -1.22 -0.26 121.76 126.20 2c5d s ALA 40 Ca 0.16 -0.30 -0.19 0.00 0.00 0.00 0.00 51.96 51.63 2c5d s ALA 40 Cb -0.01 -3.07 -0.03 0.00 0.00 0.00 0.00 23.12 20.00 2c5d s ALA 40 CO 0.02 -1.71 1.14 0.54 0.00 0.00 0.00 175.76 175.75 2c5d n ARG 41 N -3.40 1.09 0.00 0.00 1.74 -1.26 -2.48 116.66 112.35 2c5d n ARG 41 Ca 0.07 0.42 0.00 0.00 -0.77 0.00 0.00 57.85 57.57 2c5d n ARG 41 Cb 0.57 -2.36 0.00 0.00 -1.02 0.00 0.00 32.46 29.65 2c5d n ARG 41 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2c5d n GLY 42 N 1.08 2.34 3.57 -0.13 0.00 0.11 -4.87 105.19 107.29 2c5d n GLY 42 Ca 0.14 -0.54 -0.48 0.00 0.00 0.00 0.00 46.02 45.15 2c5d n GLY 42 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2c5d n LEU 43 N 0.00 1.40 -4.67 0.99 0.00 -1.03 -2.96 117.00 110.73 2c5d n LEU 43 Ca 0.00 1.15 -0.35 0.00 0.00 0.00 0.00 56.01 56.81 2c5d n LEU 43 Cb 0.00 -1.22 -0.10 0.00 0.00 0.00 0.00 43.42 42.11 2c5d n LEU 43 CO 0.00 -1.45 -0.31 0.42 0.00 0.00 0.00 177.39 176.05 2c5d s THR 44 N -0.51 4.33 0.32 1.96 -4.23 -0.99 -0.93 115.64 115.60 2c5d s THR 44 Ca 0.68 -0.23 -0.13 0.00 -1.18 0.00 0.00 61.69 60.83 2c5d s THR 44 Cb -0.82 -2.84 0.02 0.00 1.34 0.00 0.00 72.50 70.20 2c5d s THR 44 CO 0.55 0.59 0.61 -0.83 -0.54 0.00 0.00 174.62 175.00 2c5d s GLY 45 N -0.68 0.61 0.01 3.99 0.00 -0.13 -5.00 107.32 106.11 2c5d s GLY 45 Ca 0.11 -0.90 0.00 0.00 0.00 0.00 0.00 44.72 43.93 2c5d s GLY 45 CO 0.02 -0.53 -0.01 -0.51 0.00 0.00 0.00 173.10 172.07 2c5d s THR 46 N -3.25 0.07 0.09 0.90 -4.23 -1.26 -0.97 115.64 106.99 2c5d s THR 46 Ca 0.20 -0.27 0.04 0.00 -1.18 0.00 0.00 61.69 60.48 2c5d s THR 46 Cb -0.03 -0.11 -0.04 0.00 1.34 0.00 0.00 72.50 73.66 2c5d s THR 46 CO 0.12 -0.13 0.06 -0.76 -0.54 0.00 0.00 174.62 173.37 2c5d s LEU 47 N -0.42 3.69 -0.26 4.79 1.43 -0.49 -4.94 118.68 122.47 2c5d s LEU 47 Ca -0.04 -0.08 -0.18 0.00 -1.03 0.00 0.00 54.13 52.81 2c5d s LEU 47 Cb -0.03 -2.38 0.07 0.00 0.03 0.00 0.00 46.19 43.88 2c5d s LEU 47 CO -0.00 0.17 0.66 0.00 0.23 0.00 0.00 176.35 177.40 2c5d s ARG 48 N -2.42 0.71 0.12 1.70 1.70 -1.26 -0.83 118.95 118.66 2c5d s ARG 48 Ca 0.28 1.10 0.10 0.00 -0.47 0.00 0.00 55.73 56.75 2c5d s ARG 48 Cb -0.12 0.20 -0.04 0.00 -0.57 0.00 0.00 34.95 34.42 2c5d s ARG 48 CO 0.21 -0.13 -0.25 0.00 -1.08 0.00 0.00 175.30 174.04 2c5d s GLN 50 N -2.00 0.18 0.40 0.00 -2.07 -0.37 -1.26 119.66 114.54 2c5d s GLN 50 Ca 0.12 -0.18 0.06 0.00 -1.82 0.00 0.00 55.36 53.54 2c5d s GLN 50 Cb -0.10 -1.85 0.00 0.00 -1.09 0.00 0.00 33.01 29.98 2c5d s GLN 50 CO 0.05 -0.69 0.56 -0.48 -1.32 0.00 0.00 175.29 173.41 2c5d s LEU 51 N 2.08 3.76 -0.10 2.60 2.34 -0.75 -1.76 118.68 126.85 2c5d s LEU 51 Ca 0.02 -0.21 -0.01 0.00 0.06 0.00 0.00 54.13 54.00 2c5d s LEU 51 Cb -0.16 -2.77 0.03 0.00 -0.56 0.00 0.00 46.19 42.72 2c5d s LEU 51 CO -0.11 -0.65 -0.06 -1.58 -1.06 0.00 0.00 176.35 172.90 2c5d s GLN 52 N -4.33 1.29 0.43 1.48 0.74 -0.47 -1.56 119.66 117.23 2c5d s GLN 52 Ca 0.50 -0.16 0.04 0.00 0.05 0.00 0.00 55.36 55.79 2c5d s GLN 52 Cb -0.10 -1.42 -0.05 0.00 1.10 0.00 0.00 33.01 32.55 2c5d s GLN 52 CO 0.33 -0.26 0.03 0.14 -0.55 0.00 0.00 175.29 174.98 2c5d s VAL 53 N 1.73 1.37 -0.37 1.34 -7.23 -0.51 -4.80 120.40 111.93 2c5d s VAL 53 Ca 0.04 -2.00 -0.14 0.00 -1.81 0.00 0.00 61.98 58.07 2c5d s VAL 53 Cb -0.13 -2.60 -0.00 0.00 0.56 0.00 0.00 36.38 34.21 2c5d s VAL 53 CO -0.07 0.00 0.27 -1.58 -0.31 0.00 0.00 175.10 173.41 2c5d s GLN 54 N -3.80 3.29 0.56 4.82 0.74 -1.26 -0.08 119.66 123.92 2c5d s GLN 54 Ca 0.24 -0.79 0.00 0.00 0.05 0.00 0.00 55.36 54.87 2c5d s GLN 54 Cb 0.06 -3.88 0.00 0.00 1.10 0.00 0.00 33.01 30.29 2c5d s GLN 54 CO 0.12 -0.57 0.00 0.41 -0.55 0.00 0.00 175.29 174.70 2c5d n GLY 55 N 5.12 -4.17 0.24 2.59 0.00 0.29 -4.84 105.19 104.43 2c5d n GLY 55 Ca -0.12 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.07 2c5d n GLY 55 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2c5d n GLU 56 N -2.21 0.00 -1.61 1.61 4.07 -0.72 -4.77 120.64 117.01 2c5d n GLU 56 Ca 0.00 0.00 -0.39 0.00 -0.06 0.00 0.00 57.16 56.71 2c5d n GLU 56 Cb 0.36 0.00 0.03 0.00 -0.06 0.00 0.00 31.44 31.78 2c5d n GLU 56 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 2c5d n PRO 57 N 0.60 1.14 -2.11 5.31 -0.04 -1.26 -5.01 135.00 133.63 2c5d n PRO 57 Ca 0.00 0.42 -0.29 0.00 -0.04 0.00 0.00 63.50 63.59 2c5d n PRO 57 Cb 0.00 -2.12 0.02 0.00 -0.04 0.00 0.00 33.50 31.37 2c5d n PRO 57 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2c5d s PRO 58 N -2.39 3.23 0.01 0.54 0.04 -1.26 -5.03 135.00 130.14 2c5d s PRO 58 Ca 0.69 0.42 -0.26 0.00 0.04 0.00 0.00 61.00 61.89 2c5d s PRO 58 Cb -0.48 -2.15 -0.04 0.00 0.04 0.00 0.00 34.50 31.87 2c5d s PRO 58 CO 0.52 -0.67 0.82 -2.00 0.04 0.00 0.00 177.00 175.71 2c5d s GLU 59 N -5.12 4.52 -0.21 4.56 2.12 -1.26 -5.03 118.70 118.28 2c5d s GLU 59 Ca 0.54 1.14 -0.12 0.00 0.36 0.00 0.00 54.97 56.90 2c5d s GLU 59 Cb -0.11 -3.41 -0.05 0.00 0.26 0.00 0.00 34.13 30.82 2c5d s GLU 59 CO 0.50 0.13 0.20 0.54 -0.54 0.00 0.00 175.26 176.09 2c5d s VAL 60 N 0.47 5.35 0.33 3.70 0.11 -1.26 -4.54 120.40 124.55 2c5d s VAL 60 Ca 0.43 0.31 0.07 0.00 -2.93 0.00 0.00 61.98 59.85 2c5d s VAL 60 Cb -0.20 -3.54 -0.02 0.00 -1.53 0.00 0.00 36.38 31.09 2c5d s VAL 60 CO 0.24 0.37 0.39 -1.00 -3.33 0.00 0.00 175.10 171.77 2c5d s HIS 61 N 0.78 3.05 -0.08 1.54 0.09 -0.15 -4.93 115.29 115.58 2c5d s HIS 61 Ca 0.11 -0.24 0.03 0.00 -0.00 0.00 0.00 55.06 54.96 2c5d s HIS 61 Cb -0.13 -1.89 -0.02 0.00 -0.00 0.00 0.00 32.58 30.55 2c5d s HIS 61 CO 0.03 0.09 -0.18 -1.58 -0.00 0.00 0.00 174.74 173.10 2c5d s TRP 62 N -2.21 2.64 -0.15 1.40 0.52 -1.26 -0.83 118.94 119.05 2c5d s TRP 62 Ca 0.43 -0.54 -0.02 0.00 0.02 0.00 0.00 56.10 55.99 2c5d s TRP 62 Cb -0.08 -1.69 -0.02 0.00 -1.15 0.00 0.00 33.47 30.53 2c5d s TRP 62 CO 0.29 -0.10 -0.08 -0.51 0.02 0.00 0.00 176.95 176.57 2c5d s LEU 63 N -0.15 2.99 -0.19 2.99 1.43 0.35 -1.08 118.68 125.02 2c5d s LEU 63 Ca -0.02 -0.23 0.01 0.00 -1.03 0.00 0.00 54.13 52.85 2c5d s LEU 63 Cb -0.14 -1.70 0.04 0.00 0.03 0.00 0.00 46.19 44.42 2c5d s LEU 63 CO 0.04 0.16 -0.12 -0.60 0.23 0.00 0.00 176.35 176.05 2c5d s ARG 64 N 0.43 2.19 -1.24 1.70 3.52 0.33 0.12 118.95 126.00 2c5d s ARG 64 Ca -0.07 -0.79 -0.03 0.00 -0.13 0.00 0.00 55.73 54.71 2c5d s ARG 64 Cb -0.15 -2.37 0.00 0.00 -1.56 0.00 0.00 34.95 30.87 2c5d s ARG 64 CO 0.04 -0.37 0.46 -0.25 -0.81 0.00 0.00 175.30 174.37 2c5d n ASP 65 N 4.69 -5.15 0.00 -2.12 8.00 0.58 -2.08 116.55 120.46 2c5d n ASP 65 Ca -0.16 -0.22 0.00 0.00 0.71 0.00 0.00 54.79 55.13 2c5d n ASP 65 Cb 0.47 -4.01 0.00 0.00 -0.02 0.00 0.00 41.12 37.56 2c5d n ASP 65 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2c5d n GLY 66 N -1.35 2.94 3.95 0.44 0.00 -1.26 -5.01 105.19 104.90 2c5d n GLY 66 Ca -0.10 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.72 2c5d n GLY 66 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c5d s GLN 67 N -0.00 3.33 -0.04 1.61 -0.21 -0.89 -5.03 119.66 118.44 2c5d s GLN 67 Ca 0.00 -0.83 -0.29 0.00 0.02 0.00 0.00 55.36 54.26 2c5d s GLN 67 Cb 0.00 -2.83 -0.03 0.00 1.00 0.00 0.00 33.01 31.15 2c5d s GLN 67 CO 0.00 0.38 0.94 0.42 -2.12 0.00 0.00 175.29 174.91 2c5d s ILE 68 N -2.03 4.88 -0.73 1.08 -1.09 -1.26 -0.51 121.20 121.53 2c5d s ILE 68 Ca 0.35 1.96 -0.24 0.00 -2.23 0.00 0.00 60.65 60.50 2c5d s ILE 68 Cb -0.09 -4.27 0.06 0.00 -1.58 0.00 0.00 42.46 36.58 2c5d s ILE 68 CO 0.29 0.14 1.11 -0.76 -1.23 0.00 0.00 174.94 174.48 2c5d s LEU 69 N 1.22 4.01 0.08 2.97 1.43 -0.24 -4.91 118.68 123.23 2c5d s LEU 69 Ca 0.49 -0.96 -0.16 0.00 -1.03 0.00 0.00 54.13 52.48 2c5d s LEU 69 Cb -0.20 -2.47 -0.13 0.00 0.03 0.00 0.00 46.19 43.42 2c5d s LEU 69 CO 0.24 -1.53 1.33 -0.33 0.23 0.00 0.00 176.35 176.28 2c5d h GLU 70 N 9.66 0.64 -3.68 1.70 4.39 -1.94 -3.41 114.58 121.94 2c5d h GLU 70 Ca -0.21 -0.43 -0.66 0.00 0.34 0.00 0.00 59.36 58.40 2c5d h GLU 70 Cb 1.06 0.06 -0.39 0.00 -0.10 0.00 0.00 28.75 29.37 2c5d h GLU 70 CO 1.22 1.05 -0.58 -0.51 -1.16 0.00 0.00 179.01 179.03 2c5d s LEU 71 N -8.75 4.63 -0.05 1.33 1.43 -1.26 -5.07 118.68 110.95 2c5d s LEU 71 Ca -0.12 -2.80 -0.12 0.00 -1.03 0.00 0.00 54.13 50.05 2c5d s LEU 71 Cb 0.07 -1.70 0.02 0.00 0.03 0.00 0.00 46.19 44.62 2c5d s LEU 71 CO 0.84 -0.30 0.28 0.00 0.23 0.00 0.00 176.35 177.40 2c5d s ALA 72 N 0.01 -0.70 -0.06 4.21 0.00 -1.26 -5.12 121.76 118.83 2c5d s ALA 72 Ca 0.16 0.44 -0.30 0.00 0.00 0.00 0.00 51.96 52.25 2c5d s ALA 72 Cb -0.23 -0.11 -0.04 0.00 0.00 0.00 0.00 23.12 22.73 2c5d s ALA 72 CO -0.02 -0.21 1.40 -0.51 0.00 0.00 0.00 175.76 176.41 2c5d s ASP 73 N -0.83 6.86 0.06 0.00 1.11 -1.26 -4.99 116.67 117.62 2c5d s ASP 73 Ca -0.09 2.00 -0.03 0.00 0.18 0.00 0.00 52.55 54.61 2c5d s ASP 73 Cb -0.05 -2.55 -0.03 0.00 1.07 0.00 0.00 42.92 41.37 2c5d s ASP 73 CO 0.03 -0.76 0.03 -0.94 1.18 0.00 0.00 175.17 174.71 2c5d s SER 74 N 2.15 0.37 -0.20 0.27 1.04 -1.26 -1.09 113.70 114.98 2c5d s SER 74 Ca 0.63 -0.86 -0.04 0.00 0.48 0.00 0.00 55.95 56.15 2c5d s SER 74 Cb -0.29 0.23 0.09 0.00 0.10 0.00 0.00 66.02 66.15 2c5d s SER 74 CO 0.24 -0.62 0.19 -0.89 0.98 0.00 0.00 173.24 173.14 2c5d s THR 75 N -3.73 -0.26 -0.11 2.02 2.01 -0.55 -4.98 115.64 110.03 2c5d s THR 75 Ca 0.05 -0.16 -0.12 0.00 0.31 0.00 0.00 61.69 61.76 2c5d s THR 75 Cb 0.06 -0.68 -0.05 0.00 0.01 0.00 0.00 72.50 71.85 2c5d s THR 75 CO -0.10 -0.25 0.28 -1.10 -0.69 0.00 0.00 174.62 172.76 2c5d s GLN 76 N 2.28 3.97 -0.25 4.92 -0.21 -1.26 -2.38 119.66 126.72 2c5d s GLN 76 Ca 0.06 0.12 -0.01 0.00 0.02 0.00 0.00 55.36 55.54 2c5d s GLN 76 Cb -0.16 -3.31 0.03 0.00 1.00 0.00 0.00 33.01 30.57 2c5d s GLN 76 CO -0.13 0.49 -0.06 0.99 -2.12 0.00 0.00 175.29 174.46 2c5d s THR 77 N -0.31 2.80 -0.16 -0.19 2.01 0.06 -4.97 115.64 114.89 2c5d s THR 77 Ca 0.18 -1.11 -0.05 0.00 0.31 0.00 0.00 61.69 61.02 2c5d s THR 77 Cb -0.14 -2.45 -0.03 0.00 0.01 0.00 0.00 72.50 69.89 2c5d s THR 77 CO 0.06 0.16 0.01 -1.10 -0.69 0.00 0.00 174.62 173.06 2c5d s GLN 78 N 1.30 3.73 -0.15 4.92 -0.21 -1.26 -1.91 119.66 126.08 2c5d s GLN 78 Ca -0.01 -0.43 -0.01 0.00 0.02 0.00 0.00 55.36 54.93 2c5d s GLN 78 Cb -0.17 -3.02 0.04 0.00 1.00 0.00 0.00 33.01 30.85 2c5d s GLN 78 CO -0.04 0.31 -0.04 0.08 -2.12 0.00 0.00 175.29 173.47 2c5d s VAL 79 N 0.22 0.96 0.06 1.09 1.01 -0.37 -4.97 120.40 118.40 2c5d s VAL 79 Ca 0.01 -0.47 -0.31 0.00 0.00 0.00 0.00 61.98 61.21 2c5d s VAL 79 Cb -0.13 -1.13 -0.06 0.00 0.00 0.00 0.00 36.38 35.06 2c5d s VAL 79 CO 0.02 0.16 1.20 -2.16 0.00 0.00 0.00 175.10 174.32 2c5d s PRO 80 N 1.70 4.43 0.03 2.72 0.04 -1.26 -1.26 135.00 141.41 2c5d s PRO 80 Ca 0.02 1.76 0.21 0.00 0.04 0.00 0.00 61.00 63.03 2c5d s PRO 80 Cb -0.14 -3.35 -0.20 0.00 0.04 0.00 0.00 34.50 30.84 2c5d s PRO 80 CO -0.08 -0.26 0.64 1.28 0.04 0.00 0.00 177.00 178.63 2c5d n LEU 81 N 3.97 0.39 0.00 -3.56 4.77 0.51 -4.97 117.00 118.11 2c5d n LEU 81 Ca 0.09 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 2c5d n LEU 81 Cb 0.46 0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 2c5d n LEU 81 CO 0.55 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 2c5d n GLY 82 N 1.33 0.89 0.01 -0.72 0.00 -1.21 -4.93 105.19 100.56 2c5d n GLY 82 Ca -0.08 -1.89 0.10 0.00 0.00 0.00 0.00 46.02 44.15 2c5d n GLY 82 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2c5d n GLU 83 N -0.08 0.60 -4.16 1.61 4.71 -1.26 -4.98 120.64 117.08 2c5d n GLU 83 Ca 0.00 -0.16 -0.25 0.00 -0.01 0.00 0.00 57.16 56.74 2c5d n GLU 83 Cb 0.00 -1.48 -0.06 0.00 -1.01 0.00 0.00 31.44 28.89 2c5d n GLU 83 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2c5d n ASP 84 N -2.12 2.44 -0.81 1.62 8.00 -1.26 -5.03 116.55 119.39 2c5d n ASP 84 Ca -0.03 -2.85 0.05 0.00 0.71 0.00 0.00 54.79 52.68 2c5d n ASP 84 Cb 0.51 0.51 0.18 0.00 -0.02 0.00 0.00 41.12 42.29 2c5d n ASP 84 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2c5d n GLU 85 N -0.95 2.12 -0.11 -1.24 1.02 -1.26 -3.78 120.64 116.44 2c5d n GLU 85 Ca -0.13 -1.41 0.03 0.00 -0.02 0.00 0.00 57.16 55.63 2c5d n GLU 85 Cb 0.53 -1.43 0.09 0.00 -0.02 0.00 0.00 31.44 30.62 2c5d n GLU 85 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2c5d n GLN 86 N 0.54 2.91 -0.55 3.49 3.00 -1.26 -1.75 117.38 123.76 2c5d n GLN 86 Ca 0.13 -1.84 0.00 0.00 -0.01 0.00 0.00 57.00 55.28 2c5d n GLN 86 Cb 0.41 -1.17 0.00 0.00 0.00 0.00 0.00 30.24 29.48 2c5d n GLN 86 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 2c5d n ASP 87 N 0.07 0.41 -4.76 1.08 10.43 -1.25 -4.02 116.55 118.51 2c5d n ASP 87 Ca 0.07 -0.46 -0.41 0.00 2.57 0.00 0.00 54.79 56.57 2c5d n ASP 87 Cb 0.36 0.00 -0.03 0.00 1.84 0.00 0.00 41.12 43.29 2c5d n ASP 87 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 2c5d s ASP 88 N -0.78 6.97 0.18 -2.24 1.11 -1.26 0.10 116.67 120.75 2c5d s ASP 88 Ca 0.00 2.47 0.10 0.00 0.18 0.00 0.00 52.55 55.30 2c5d s ASP 88 Cb 0.00 -2.63 -0.04 0.00 1.07 0.00 0.00 42.92 41.32 2c5d s ASP 88 CO 0.00 -0.40 -0.21 0.26 1.18 0.00 0.00 175.17 176.00 2c5d s TRP 89 N -0.78 2.06 -0.24 4.23 0.52 0.88 -0.36 118.94 125.25 2c5d s TRP 89 Ca 0.50 -0.41 0.01 0.00 0.02 0.00 0.00 56.10 56.21 2c5d s TRP 89 Cb -0.36 -1.02 0.04 0.00 -1.15 0.00 0.00 33.47 30.98 2c5d s TRP 89 CO 0.45 0.42 -0.12 0.42 0.02 0.00 0.00 176.95 178.14 2c5d s ILE 90 N -1.86 2.36 -0.03 2.03 1.01 -0.39 -1.42 121.20 122.90 2c5d s ILE 90 Ca 0.18 -1.28 0.00 0.00 0.00 0.00 0.00 60.65 59.56 2c5d s ILE 90 Cb -0.07 -2.23 -0.03 0.00 0.01 0.00 0.00 42.46 40.13 2c5d s ILE 90 CO 0.08 0.18 -0.01 -0.69 0.00 0.00 0.00 174.94 174.51 2c5d s VAL 91 N 1.22 4.15 -0.05 2.92 1.01 -0.60 -1.23 120.40 127.81 2c5d s VAL 91 Ca -0.03 -0.49 -0.02 0.00 0.00 0.00 0.00 61.98 61.45 2c5d s VAL 91 Cb -0.17 -2.80 0.03 0.00 0.00 0.00 0.00 36.38 33.44 2c5d s VAL 91 CO -0.07 0.47 0.08 -0.69 0.00 0.00 0.00 175.10 174.89 2c5d s VAL 92 N -1.00 -0.14 -0.08 2.92 1.01 -0.80 -1.80 120.40 120.51 2c5d s VAL 92 Ca 0.17 0.40 0.04 0.00 0.00 0.00 0.00 61.98 62.59 2c5d s VAL 92 Cb -0.11 -0.18 -0.01 0.00 0.00 0.00 0.00 36.38 36.07 2c5d s VAL 92 CO 0.07 0.17 -0.20 -0.55 0.00 0.00 0.00 175.10 174.58 2c5d s SER 93 N 2.13 3.44 -0.11 3.32 0.15 -0.39 -0.76 113.70 121.47 2c5d s SER 93 Ca 0.04 -0.42 0.01 0.00 0.70 0.00 0.00 55.95 56.27 2c5d s SER 93 Cb -0.12 -1.09 0.02 0.00 -1.71 0.00 0.00 66.02 63.12 2c5d s SER 93 CO -0.04 0.23 -0.12 0.00 1.20 0.00 0.00 173.24 174.52 2c5d s GLN 94 N -0.08 1.90 0.07 5.44 -2.07 -1.00 -1.92 119.66 122.01 2c5d s GLN 94 Ca -0.05 -0.42 -0.22 0.00 -1.82 0.00 0.00 55.36 52.85 2c5d s GLN 94 Cb -0.14 -1.76 -0.07 0.00 -1.09 0.00 0.00 33.01 29.96 2c5d s GLN 94 CO 0.04 -0.17 0.65 -1.17 -1.32 0.00 0.00 175.29 173.33 2c5d s LEU 95 N 1.32 4.51 -0.08 2.60 2.96 -0.01 -1.49 118.68 128.49 2c5d s LEU 95 Ca -0.01 1.36 0.03 0.00 -0.22 0.00 0.00 54.13 55.30 2c5d s LEU 95 Cb -0.14 -3.05 0.00 0.00 0.50 0.00 0.00 46.19 43.51 2c5d s LEU 95 CO -0.05 0.18 -0.19 -0.60 -1.32 0.00 0.00 176.35 174.37 2c5d s ARG 96 N -0.76 2.44 -0.23 1.98 3.52 -0.25 -1.40 118.95 124.26 2c5d s ARG 96 Ca 0.32 -0.69 -0.06 0.00 -0.13 0.00 0.00 55.73 55.17 2c5d s ARG 96 Cb -0.20 -1.91 -0.03 0.00 -1.56 0.00 0.00 34.95 31.25 2c5d s ARG 96 CO 0.21 0.14 0.04 0.42 -0.81 0.00 0.00 175.30 175.29 2c5d s ILE 97 N 0.42 4.15 0.00 4.11 1.01 -0.15 -4.24 121.20 126.50 2c5d s ILE 97 Ca -0.16 -0.23 0.00 0.00 0.00 0.00 0.00 60.65 60.26 2c5d s ILE 97 Cb -0.17 -2.91 0.00 0.00 0.01 0.00 0.00 42.46 39.39 2c5d s ILE 97 CO 0.06 0.38 0.00 0.35 0.00 0.00 0.00 174.94 175.73 2c5d n THR 98 N 4.62 0.00 -2.60 2.92 -2.24 -1.26 -0.96 114.28 114.76 2c5d n THR 98 Ca -0.17 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.20 2c5d n THR 98 Cb 0.51 -0.26 -0.03 0.00 -2.10 0.00 0.00 70.33 68.46 2c5d n THR 98 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2c5d s SER 99 N -1.26 6.26 -0.12 3.42 0.15 -1.26 -2.33 113.70 118.56 2c5d s SER 99 Ca 0.00 -0.82 -0.31 0.00 0.70 0.00 0.00 55.95 55.52 2c5d s SER 99 Cb 0.00 -2.54 -0.08 0.00 -1.71 0.00 0.00 66.02 61.69 2c5d s SER 99 CO 0.00 -1.68 2.08 -0.11 1.20 0.00 0.00 173.24 174.72 2c5d n LEU 100 N 8.97 3.50 0.00 3.45 7.94 -0.11 -4.61 117.00 136.15 2c5d n LEU 100 Ca 0.11 0.60 0.00 0.00 -1.11 0.00 0.00 56.01 55.60 2c5d n LEU 100 Cb 0.49 -1.49 0.00 0.00 0.53 0.00 0.00 43.42 42.95 2c5d n LEU 100 CO 0.68 -0.27 0.00 0.00 -1.11 0.00 0.00 177.39 176.69 2c5d n GLN 101 N 7.92 3.63 -0.03 1.96 10.64 -1.26 0.10 117.38 140.33 2c5d n GLN 101 Ca 0.26 0.00 -0.15 0.00 -1.83 0.00 0.00 57.00 55.28 2c5d n GLN 101 Cb 0.39 0.00 -0.12 0.00 -0.86 0.00 0.00 30.24 29.64 2c5d n GLN 101 CO 0.00 0.00 0.00 1.25 -1.83 0.00 0.00 177.06 176.48 2c5d h LEU 102 N 0.00 0.14 -1.24 2.61 5.85 -2.01 -3.35 115.31 117.31 2c5d h LEU 102 Ca 0.00 -0.86 0.13 0.00 0.84 0.00 0.00 57.88 57.98 2c5d h LEU 102 Cb 0.00 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 40.92 2c5d h LEU 102 CO 0.00 0.99 0.58 0.77 -0.34 0.00 0.00 178.44 180.43 2c5d h SER 103 N -0.69 0.72 0.00 1.25 4.64 -2.00 -1.58 113.55 115.89 2c5d h SER 103 Ca -0.03 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2c5d h SER 103 Cb 1.03 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 2c5d h SER 103 CO 0.04 0.39 0.00 0.47 -0.87 0.00 0.00 176.83 176.86 2c5d n ASP 104 N -4.56 0.00 -4.72 4.97 10.43 -1.26 -4.67 116.55 116.75 2c5d n ASP 104 Ca 0.17 0.05 -0.42 0.00 2.57 0.00 0.00 54.79 57.16 2c5d n ASP 104 Cb 0.41 -0.05 -0.04 0.00 1.84 0.00 0.00 41.12 43.28 2c5d n ASP 104 CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 2c5d s THR 105 N -2.05 4.55 -4.59 -3.53 -1.32 -0.60 -4.80 115.64 103.31 2c5d s THR 105 Ca 0.00 1.95 0.00 0.00 -1.21 0.00 0.00 61.69 62.43 2c5d s THR 105 Cb 0.00 -4.25 0.00 0.00 -1.51 0.00 0.00 72.50 66.74 2c5d s THR 105 CO 0.00 0.22 0.00 0.61 -2.21 0.00 0.00 174.62 173.24 2c5d n GLY 106 N 2.64 -1.22 3.66 6.08 0.00 -0.39 -4.99 105.19 110.97 2c5d n GLY 106 Ca 0.05 -1.17 -0.36 0.00 0.00 0.00 0.00 46.02 44.53 2c5d n GLY 106 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c5d s GLN 107 N -1.83 4.06 0.08 1.61 -0.21 -1.26 -0.42 119.66 121.69 2c5d s GLN 107 Ca 0.00 -0.28 0.08 0.00 0.02 0.00 0.00 55.36 55.18 2c5d s GLN 107 Cb 0.00 -3.50 -0.04 0.00 1.00 0.00 0.00 33.01 30.47 2c5d s GLN 107 CO 0.00 0.09 -0.16 0.71 -2.12 0.00 0.00 175.29 173.81 2c5d s TYR 108 N 0.96 2.61 0.05 0.91 1.51 0.52 -0.31 117.35 123.60 2c5d s TYR 108 Ca 0.07 -0.22 -0.24 0.00 -1.01 0.00 0.00 57.07 55.66 2c5d s TYR 108 Cb -0.13 -1.42 0.06 0.00 -0.11 0.00 0.00 41.96 40.36 2c5d s TYR 108 CO 0.04 0.35 0.57 1.14 -1.11 0.00 0.00 175.55 176.54 2c5d s GLN 109 N -1.87 1.09 0.26 -0.62 -2.07 0.12 -0.13 119.66 116.43 2c5d s GLN 109 Ca 0.17 -0.16 -0.13 0.00 -1.82 0.00 0.00 55.36 53.42 2c5d s GLN 109 Cb -0.11 0.50 -0.08 0.00 -1.09 0.00 0.00 33.01 32.24 2c5d s GLN 109 CO 0.09 -0.40 0.64 0.00 -1.32 0.00 0.00 175.29 174.30 2c5d s LEU 111 N -2.68 0.97 0.02 0.00 2.96 -0.01 -0.90 118.68 119.04 2c5d s LEU 111 Ca 0.48 -0.01 0.04 0.00 -0.22 0.00 0.00 54.13 54.42 2c5d s LEU 111 Cb -0.12 -0.22 -0.02 0.00 0.50 0.00 0.00 46.19 46.33 2c5d s LEU 111 CO 0.19 -0.13 -0.12 0.68 -1.32 0.00 0.00 176.35 175.65 2c5d s VAL 112 N 1.26 0.93 -0.33 1.68 -7.23 0.04 -0.98 120.40 115.77 2c5d s VAL 112 Ca -0.06 -0.79 -0.12 0.00 -1.81 0.00 0.00 61.98 59.19 2c5d s VAL 112 Cb -0.13 -0.84 -0.02 0.00 0.56 0.00 0.00 36.38 35.95 2c5d s VAL 112 CO -0.02 0.05 0.23 -0.36 -0.31 0.00 0.00 175.10 174.68 2c5d s PHE 113 N -0.67 3.23 -0.76 2.82 0.08 -1.26 -0.69 117.98 120.72 2c5d s PHE 113 Ca 0.01 -0.15 -0.02 0.00 0.12 0.00 0.00 56.93 56.89 2c5d s PHE 113 Cb -0.07 -2.45 0.19 0.00 -0.57 0.00 0.00 43.02 40.12 2c5d s PHE 113 CO 0.01 -0.32 0.61 -0.51 -0.10 0.00 0.00 175.22 174.90 2c5d s LEU 114 N 1.73 5.39 0.00 -0.37 1.43 -1.13 -4.90 118.68 120.83 2c5d s LEU 114 Ca 0.06 -3.31 0.00 0.00 -1.03 0.00 0.00 54.13 49.85 2c5d s LEU 114 Cb -0.17 -1.87 0.00 0.00 0.03 0.00 0.00 46.19 44.18 2c5d s LEU 114 CO 0.10 -0.27 0.00 0.61 0.23 0.00 0.00 176.35 177.03 2c5d n GLY 115 N 2.87 -0.36 0.00 -3.19 0.00 -1.26 -3.26 105.19 99.99 2c5d n GLY 115 Ca 0.15 -1.37 0.13 0.00 0.00 0.00 0.00 46.02 44.93 2c5d n GLY 115 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2c5d n HIS 116 N 0.00 0.00 -2.01 1.61 8.25 -1.26 -4.80 115.22 117.01 2c5d n HIS 116 Ca 0.00 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.18 2c5d n HIS 116 Cb 0.00 -0.26 0.10 0.00 1.12 0.00 0.00 29.99 30.95 2c5d n HIS 116 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2c5d s GLN 117 N -2.51 1.78 0.01 -0.41 0.74 -1.20 -5.11 119.66 112.95 2c5d s GLN 117 Ca 0.27 -0.12 -0.01 0.00 0.05 0.00 0.00 55.36 55.55 2c5d s GLN 117 Cb 0.18 -2.00 -0.01 0.00 1.10 0.00 0.00 33.01 32.28 2c5d s GLN 117 CO 0.40 -1.64 -0.00 0.99 -0.55 0.00 0.00 175.29 174.48 2c5d s THR 118 N -3.53 0.06 -0.02 -0.34 2.01 -1.26 -2.82 115.64 109.73 2c5d s THR 118 Ca 0.64 -0.48 0.01 0.00 0.31 0.00 0.00 61.69 62.17 2c5d s THR 118 Cb -0.09 -0.16 0.01 0.00 0.01 0.00 0.00 72.50 72.27 2c5d s THR 118 CO 0.48 -0.26 -0.04 -0.36 -0.69 0.00 0.00 174.62 173.75 2c5d s PHE 119 N -0.77 0.49 0.07 4.92 0.40 0.13 -4.93 117.98 118.28 2c5d s PHE 119 Ca -0.08 -0.09 0.09 0.00 -0.60 0.00 0.00 56.93 56.24 2c5d s PHE 119 Cb -0.05 -0.41 -0.03 0.00 0.51 0.00 0.00 43.02 43.04 2c5d s PHE 119 CO -0.00 -0.08 -0.23 0.08 0.70 0.00 0.00 175.22 175.68 2c5d s VAL 120 N 0.39 1.91 0.65 -0.44 1.01 -1.26 -0.78 120.40 121.88 2c5d s VAL 120 Ca -0.04 -1.39 -0.06 0.00 0.00 0.00 0.00 61.98 60.48 2c5d s VAL 120 Cb -0.08 -1.67 0.04 0.00 0.00 0.00 0.00 36.38 34.67 2c5d s VAL 120 CO -0.00 0.20 0.96 -0.94 0.00 0.00 0.00 175.10 175.31 2c5d s SER 121 N -1.44 5.19 1.02 3.32 1.04 -0.08 -4.97 113.70 117.79 2c5d s SER 121 Ca 0.10 0.57 -0.11 0.00 0.48 0.00 0.00 55.95 56.98 2c5d s SER 121 Cb -0.10 -1.38 0.20 0.00 0.10 0.00 0.00 66.02 64.85 2c5d s SER 121 CO 0.03 -1.34 1.09 -1.58 0.98 0.00 0.00 173.24 172.42 2c5d s GLN 122 N -5.12 0.21 0.37 4.02 2.00 -1.26 -4.61 119.66 115.27 2c5d s GLN 122 Ca 0.57 1.20 0.03 0.00 -2.00 0.00 0.00 55.36 55.17 2c5d s GLN 122 Cb -0.11 -1.66 -0.01 0.00 0.80 0.00 0.00 33.01 32.03 2c5d s GLN 122 CO 0.45 -3.07 0.54 -1.25 -0.50 0.00 0.00 175.29 171.46 2c5d s PRO 123 N -4.59 3.17 0.07 1.67 0.04 -1.26 -4.32 135.00 129.78 2c5d s PRO 123 Ca 0.67 -0.72 0.02 0.00 0.04 0.00 0.00 61.00 61.02 2c5d s PRO 123 Cb -0.23 -2.71 -0.03 0.00 0.04 0.00 0.00 34.50 31.56 2c5d s PRO 123 CO 0.61 -0.01 -0.08 0.20 0.04 0.00 0.00 177.00 177.76 2c5d s GLY 124 N -4.15 0.64 -0.03 0.56 0.00 0.82 -4.72 107.32 100.43 2c5d s GLY 124 Ca 0.44 -0.99 0.05 0.00 0.00 0.00 0.00 44.72 44.23 2c5d s GLY 124 CO 0.34 -1.05 -0.18 -0.19 0.00 0.00 0.00 173.10 172.02 2c5d s TYR 125 N -2.09 1.69 -0.18 1.90 1.51 -1.19 0.20 117.35 119.18 2c5d s TYR 125 Ca -0.02 -0.42 0.01 0.00 -1.01 0.00 0.00 57.07 55.63 2c5d s TYR 125 Cb -0.05 -1.12 0.03 0.00 -0.11 0.00 0.00 41.96 40.70 2c5d s TYR 125 CO -0.01 -0.11 -0.17 0.14 -1.11 0.00 0.00 175.55 174.29 2c5d s VAL 126 N -0.15 1.92 0.01 0.71 -7.23 0.44 -2.50 120.40 113.60 2c5d s VAL 126 Ca 0.00 -0.96 0.07 0.00 -1.81 0.00 0.00 61.98 59.29 2c5d s VAL 126 Cb -0.10 -1.81 -0.02 0.00 0.56 0.00 0.00 36.38 35.01 2c5d s VAL 126 CO 0.01 0.41 -0.23 -0.83 -0.31 0.00 0.00 175.10 174.16 2c5d s GLY 127 N 1.32 1.16 0.14 2.32 0.00 -1.03 -1.26 107.32 109.96 2c5d s GLY 127 Ca 0.03 -1.05 -0.30 0.00 0.00 0.00 0.00 44.72 43.40 2c5d s GLY 127 CO -0.11 -0.92 1.00 -2.27 0.00 0.00 0.00 173.10 170.80 2c5d s LEU 128 N -0.85 4.51 -0.30 0.66 2.96 -1.26 -2.42 118.68 121.98 2c5d s LEU 128 Ca 0.09 1.88 -0.06 0.00 -0.22 0.00 0.00 54.13 55.82 2c5d s LEU 128 Cb -0.09 -3.59 0.19 0.00 0.50 0.00 0.00 46.19 43.20 2c5d s LEU 128 CO 0.00 -0.09 0.88 -0.70 -1.32 0.00 0.00 176.35 175.13 2c5d s GLU 129 N -0.19 0.31 0.00 1.98 2.12 0.65 -4.73 118.70 118.84 2c5d s GLU 129 Ca 0.47 0.37 0.00 0.00 0.36 0.00 0.00 54.97 56.17 2c5d s GLU 129 Cb -0.25 0.18 0.00 0.00 0.26 0.00 0.00 34.13 34.32 2c5d s GLU 129 CO 0.31 -0.51 0.00 0.41 -0.54 0.00 0.00 175.26 174.94 2c5d n GLY 130 N 5.30 2.92 3.50 -1.50 0.00 -0.86 -3.44 105.19 111.11 2c5d n GLY 130 Ca 0.04 -1.11 -0.28 0.00 0.00 0.00 0.00 46.02 44.66 2c5d n GLY 130 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c5d s LEU 131 N 0.00 0.93 0.53 0.99 1.43 -1.26 -3.84 118.68 117.45 2c5d s LEU 131 Ca 0.00 1.54 -0.22 0.00 -1.03 0.00 0.00 54.13 54.42 2c5d s LEU 131 Cb 0.00 -3.47 -0.05 0.00 0.03 0.00 0.00 46.19 42.70 2c5d s LEU 131 CO 0.00 -4.15 1.32 -2.84 0.23 0.00 0.00 176.35 170.91 2c5d s PRO 132 N -4.48 3.25 -0.17 1.29 0.02 -1.26 -4.86 135.00 128.79 2c5d s PRO 132 Ca 0.68 2.14 -0.01 0.00 0.02 0.00 0.00 61.00 63.84 2c5d s PRO 132 Cb -0.25 -2.28 -0.00 0.00 0.02 0.00 0.00 34.50 31.99 2c5d s PRO 132 CO 0.64 -1.07 -0.13 -0.47 -0.33 0.00 0.00 177.00 175.64 2c5d s TYR 133 N -1.35 2.83 0.40 6.54 5.04 0.02 -4.81 117.35 126.02 2c5d s TYR 133 Ca 0.70 -1.03 -0.23 0.00 -2.44 0.00 0.00 57.07 54.07 2c5d s TYR 133 Cb -0.38 -1.94 -0.10 0.00 0.35 0.00 0.00 41.96 39.89 2c5d s TYR 133 CO 0.45 -0.49 0.97 -0.06 -1.34 0.00 0.00 175.55 175.08 2c5d s PHE 134 N 0.96 3.39 -0.03 4.97 0.40 -1.26 -0.65 117.98 125.76 2c5d s PHE 134 Ca -0.02 1.67 0.03 0.00 -0.60 0.00 0.00 56.93 58.01 2c5d s PHE 134 Cb -0.15 -2.94 -0.05 0.00 0.51 0.00 0.00 43.02 40.40 2c5d s PHE 134 CO -0.02 -0.17 0.03 1.28 0.70 0.00 0.00 175.22 177.05 2c5d n LEU 135 N -0.22 0.00 -3.71 -0.37 4.77 -0.95 -4.88 117.00 111.64 2c5d n LEU 135 Ca 0.05 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.92 2c5d n LEU 135 Cb 0.52 0.06 -0.11 0.00 -2.33 0.00 0.00 43.42 41.56 2c5d n LEU 135 CO 0.41 0.06 0.04 -0.70 -1.33 0.00 0.00 177.39 175.87 2c5d s GLU 136 N -2.13 0.40 0.12 3.23 2.12 -1.21 -4.93 118.70 116.30 2c5d s GLU 136 Ca -0.02 0.68 0.08 0.00 0.36 0.00 0.00 54.97 56.08 2c5d s GLU 136 Cb 0.01 0.05 -0.04 0.00 0.26 0.00 0.00 34.13 34.42 2c5d s GLU 136 CO 0.14 -0.12 -0.19 -1.21 -0.54 0.00 0.00 175.26 173.34 2c5d s GLU 137 N 0.99 1.14 -0.02 4.30 2.02 -1.26 -1.60 118.70 124.26 2c5d s GLU 137 Ca -0.06 -1.24 -0.37 0.00 0.02 0.00 0.00 54.97 53.31 2c5d s GLU 137 Cb -0.07 -1.27 -0.16 0.00 0.10 0.00 0.00 34.13 32.74 2c5d s GLU 137 CO -0.08 0.28 1.53 -0.35 0.02 0.00 0.00 175.26 176.66 2c5d n PRO 138 N 0.76 1.37 -3.42 0.39 -0.04 -1.03 -4.78 135.00 128.26 2c5d n PRO 138 Ca -0.17 0.50 -0.23 0.00 -0.04 0.00 0.00 63.50 63.55 2c5d n PRO 138 Cb 0.55 -2.19 -0.01 0.00 -0.04 0.00 0.00 33.50 31.81 2c5d n PRO 138 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2c5d s GLU 139 N 1.72 3.46 0.28 0.54 2.02 -1.26 -4.41 118.70 121.05 2c5d s GLU 139 Ca 0.88 -0.38 -0.29 0.00 0.02 0.00 0.00 54.97 55.20 2c5d s GLU 139 Cb -0.93 -2.68 -0.09 0.00 0.10 0.00 0.00 34.13 30.53 2c5d s GLU 139 CO 0.51 0.16 1.06 -0.51 0.02 0.00 0.00 175.26 176.50 2c5d s ASP 140 N -4.04 7.32 0.10 -0.19 -0.00 -1.26 -4.61 116.67 113.98 2c5d s ASP 140 Ca 0.40 2.19 -0.05 0.00 -0.00 0.00 0.00 52.55 55.08 2c5d s ASP 140 Cb -0.10 -2.62 -0.02 0.00 -0.00 0.00 0.00 42.92 40.18 2c5d s ASP 140 CO 0.35 -0.10 0.13 -0.13 -0.00 0.00 0.00 175.17 175.42 2c5d s ARG 141 N -1.46 0.86 -0.31 8.23 0.52 -1.06 -4.99 118.95 120.74 2c5d s ARG 141 Ca 0.45 -1.16 -0.02 0.00 -0.52 0.00 0.00 55.73 54.48 2c5d s ARG 141 Cb -0.30 0.30 0.11 0.00 0.52 0.00 0.00 34.95 35.57 2c5d s ARG 141 CO 0.38 -0.26 0.13 -0.08 0.02 0.00 0.00 175.30 175.50 2c5d s THR 142 N -3.93 0.39 0.17 0.02 -1.32 -1.26 0.67 115.64 110.39 2c5d s THR 142 Ca 0.11 -1.18 0.06 0.00 -1.21 0.00 0.00 61.69 59.47 2c5d s THR 142 Cb 0.06 -1.31 -0.04 0.00 -1.51 0.00 0.00 72.50 69.70 2c5d s THR 142 CO -0.06 -0.74 0.07 0.68 -2.21 0.00 0.00 174.62 172.36 2c5d s VAL 143 N 1.74 4.09 0.45 5.08 -7.23 -0.19 -4.93 120.40 119.40 2c5d s VAL 143 Ca 0.11 -1.28 -0.23 0.00 -1.81 0.00 0.00 61.98 58.76 2c5d s VAL 143 Cb -0.17 -3.08 -0.08 0.00 0.56 0.00 0.00 36.38 33.61 2c5d s VAL 143 CO -0.27 -0.13 1.14 0.00 -0.31 0.00 0.00 175.10 175.53 2c5d s ALA 144 N -1.77 3.00 0.80 1.32 0.00 -1.26 -2.76 121.76 121.09 2c5d s ALA 144 Ca 0.29 0.88 -0.15 0.00 0.00 0.00 0.00 51.96 52.98 2c5d s ALA 144 Cb -0.09 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.66 2c5d s ALA 144 CO 0.21 -0.55 0.51 0.00 0.00 0.00 0.00 175.76 175.93 2c5d n ALA 145 N -0.39 -1.81 -3.60 0.00 0.00 -1.26 -2.99 120.51 110.46 2c5d n ALA 145 Ca 0.07 -0.37 -0.23 0.00 0.00 0.00 0.00 53.44 52.91 2c5d n ALA 145 Cb 0.48 -1.85 -0.04 0.00 0.00 0.00 0.00 19.45 18.04 2c5d n ALA 145 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2c5d n ASN 146 N -0.73 -1.44 -4.50 0.00 4.13 -1.09 -4.89 115.26 106.74 2c5d n ASN 146 Ca 0.09 -0.45 -0.31 0.00 1.68 0.00 0.00 54.58 55.59 2c5d n ASN 146 Cb 0.51 -1.32 -0.12 0.00 -1.54 0.00 0.00 39.78 37.32 2c5d n ASN 146 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2c5d s THR 147 N -2.66 3.08 0.47 3.41 2.01 -1.16 -4.82 115.64 115.96 2c5d s THR 147 Ca 0.45 -1.05 -0.15 0.00 0.31 0.00 0.00 61.69 61.25 2c5d s THR 147 Cb -0.27 -2.31 -0.08 0.00 0.01 0.00 0.00 72.50 69.85 2c5d s THR 147 CO 0.56 0.35 0.92 -2.16 -0.69 0.00 0.00 174.62 173.60 2c5d s PRO 148 N -1.44 3.94 0.21 4.92 0.04 -0.44 -3.95 135.00 138.27 2c5d s PRO 148 Ca 0.16 0.84 -0.23 0.00 0.04 0.00 0.00 61.00 61.81 2c5d s PRO 148 Cb -0.11 -2.21 0.05 0.00 0.04 0.00 0.00 34.50 32.27 2c5d s PRO 148 CO 0.06 -0.17 0.87 -0.59 0.04 0.00 0.00 177.00 177.21 2c5d s PHE 149 N -2.50 -0.14 0.06 0.56 -0.12 -0.39 -5.01 117.98 110.44 2c5d s PHE 149 Ca 0.57 -0.23 0.04 0.00 -0.05 0.00 0.00 56.93 57.26 2c5d s PHE 149 Cb -0.10 0.67 -0.03 0.00 -0.63 0.00 0.00 43.02 42.94 2c5d s PHE 149 CO 0.29 -1.00 -0.12 -0.80 -0.05 0.00 0.00 175.22 173.53 2c5d s ASN 150 N -2.95 1.44 0.31 1.98 0.01 -1.26 -0.31 114.94 114.16 2c5d s ASN 150 Ca 0.12 -0.55 0.11 0.00 -0.71 0.00 0.00 52.86 51.82 2c5d s ASN 150 Cb -0.03 -0.04 -0.05 0.00 0.41 0.00 0.00 41.25 41.53 2c5d s ASN 150 CO 0.04 -0.08 -0.12 -0.76 -1.51 0.00 0.00 177.10 174.67 2c5d s LEU 151 N -1.54 2.74 0.17 0.60 1.43 -0.06 -4.97 118.68 117.05 2c5d s LEU 151 Ca -0.03 -1.04 0.06 0.00 -1.03 0.00 0.00 54.13 52.09 2c5d s LEU 151 Cb -0.09 -1.16 -0.05 0.00 0.03 0.00 0.00 46.19 44.92 2c5d s LEU 151 CO 0.02 -0.07 -0.12 -0.44 0.23 0.00 0.00 176.35 175.96 2c5d s SER 152 N -3.58 2.15 -0.41 2.29 0.01 -1.26 -1.57 113.70 111.33 2c5d s SER 152 Ca 0.31 -1.01 0.05 0.00 1.31 0.00 0.00 55.95 56.61 2c5d s SER 152 Cb -0.02 -0.07 0.18 0.00 0.21 0.00 0.00 66.02 66.32 2c5d s SER 152 CO 0.16 -0.26 0.73 0.00 0.41 0.00 0.00 173.24 174.29 2c5d s GLN 154 N 1.71 3.53 -0.29 0.00 -0.21 -0.63 -3.31 119.66 120.46 2c5d s GLN 154 Ca 0.18 -0.29 -0.14 0.00 0.02 0.00 0.00 55.36 55.12 2c5d s GLN 154 Cb -0.02 -2.75 0.14 0.00 1.00 0.00 0.00 33.01 31.37 2c5d s GLN 154 CO -0.08 0.29 0.86 0.00 -2.12 0.00 0.00 175.29 174.24 2c5d s ALA 155 N -2.04 -2.29 0.35 6.09 0.00 -1.26 -2.25 121.76 120.37 2c5d s ALA 155 Ca 0.40 2.23 0.07 0.00 0.00 0.00 0.00 51.96 54.66 2c5d s ALA 155 Cb -0.10 -1.78 -0.01 0.00 0.00 0.00 0.00 23.12 21.23 2c5d s ALA 155 CO 0.31 -0.66 0.49 1.14 0.00 0.00 0.00 175.76 177.03 2c5d s GLN 156 N 2.07 3.04 0.00 0.00 -2.07 0.18 -4.84 119.66 118.04 2c5d s GLN 156 Ca -0.07 -1.08 0.00 0.00 -1.82 0.00 0.00 55.36 52.40 2c5d s GLN 156 Cb -0.06 -2.79 0.00 0.00 -1.09 0.00 0.00 33.01 29.06 2c5d s GLN 156 CO -0.17 -0.01 0.00 0.41 -1.32 0.00 0.00 175.29 174.19 2c5d n GLY 157 N -1.68 2.13 3.91 2.60 0.00 -1.26 -0.80 105.19 110.09 2c5d n GLY 157 Ca 0.02 -1.83 -0.28 0.00 0.00 0.00 0.00 46.02 43.93 2c5d n GLY 157 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2c5d s PRO 158 N 4.32 3.02 0.68 1.61 0.04 -1.26 -4.76 135.00 138.65 2c5d s PRO 158 Ca 0.00 0.14 -0.11 0.00 0.04 0.00 0.00 61.00 61.07 2c5d s PRO 158 Cb 0.00 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.31 2c5d s PRO 158 CO 0.00 -0.69 1.06 -1.25 0.04 0.00 0.00 177.00 176.17 2c5d s PRO 159 N -5.03 3.04 0.38 0.56 0.04 -1.25 -2.03 135.00 130.71 2c5d s PRO 159 Ca 0.54 0.71 0.08 0.00 0.04 0.00 0.00 61.00 62.37 2c5d s PRO 159 Cb -0.11 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 2c5d s PRO 159 CO 0.47 -0.96 0.27 -1.21 0.04 0.00 0.00 177.00 175.60 2c5d s GLU 160 N -5.19 2.49 0.52 4.56 2.02 -1.26 -4.67 118.70 117.18 2c5d s GLU 160 Ca 0.57 -1.53 -0.10 0.00 0.02 0.00 0.00 54.97 53.93 2c5d s GLU 160 Cb -0.12 -2.29 -0.05 0.00 0.10 0.00 0.00 34.13 31.77 2c5d s GLU 160 CO 0.54 -0.05 0.90 -1.25 0.02 0.00 0.00 175.26 175.42 2c5d s PRO 161 N -4.00 3.65 -0.18 0.39 0.04 -1.26 -4.92 135.00 128.72 2c5d s PRO 161 Ca 0.43 0.54 -0.01 0.00 0.04 0.00 0.00 61.00 62.00 2c5d s PRO 161 Cb -0.02 -2.24 -0.00 0.00 0.04 0.00 0.00 34.50 32.28 2c5d s PRO 161 CO 0.25 -0.32 -0.12 0.14 0.04 0.00 0.00 177.00 176.99 2c5d s VAL 162 N -2.83 2.86 -0.08 -0.36 -7.23 -1.26 -4.62 120.40 106.88 2c5d s VAL 162 Ca 0.52 -0.68 -0.16 0.00 -1.81 0.00 0.00 61.98 59.85 2c5d s VAL 162 Cb -0.11 -2.25 -0.05 0.00 0.56 0.00 0.00 36.38 34.54 2c5d s VAL 162 CO 0.44 0.49 0.41 -1.81 -0.31 0.00 0.00 175.10 174.32 2c5d s ASP 163 N 1.10 6.68 0.52 4.85 1.01 -0.25 -4.87 116.67 125.72 2c5d s ASP 163 Ca 0.00 0.81 0.03 0.00 0.71 0.00 0.00 52.55 54.10 2c5d s ASP 163 Cb -0.14 -2.25 0.03 0.00 1.01 0.00 0.00 42.92 41.56 2c5d s ASP 163 CO -0.03 0.15 0.73 -0.76 0.21 0.00 0.00 175.17 175.46 2c5d s LEU 164 N -0.06 3.36 -0.30 1.23 1.43 -1.26 -0.29 118.68 122.79 2c5d s LEU 164 Ca 0.23 -0.12 -0.10 0.00 -1.03 0.00 0.00 54.13 53.11 2c5d s LEU 164 Cb -0.15 -2.80 0.18 0.00 0.03 0.00 0.00 46.19 43.44 2c5d s LEU 164 CO 0.10 -1.06 0.90 -0.22 0.23 0.00 0.00 176.35 176.30 2c5d s LEU 165 N -4.67 -0.76 0.76 1.79 2.96 -1.03 -0.40 118.68 117.33 2c5d s LEU 165 Ca 0.57 0.60 -0.12 0.00 -0.22 0.00 0.00 54.13 54.96 2c5d s LEU 165 Cb -0.10 1.69 0.05 0.00 0.50 0.00 0.00 46.19 48.32 2c5d s LEU 165 CO 0.37 -0.14 1.13 0.26 -1.32 0.00 0.00 176.35 176.65 2c5d s TRP 166 N 2.83 3.13 -0.05 5.38 0.52 -1.26 -1.23 118.94 128.26 2c5d s TRP 166 Ca 0.05 0.92 -0.04 0.00 0.02 0.00 0.00 56.10 57.05 2c5d s TRP 166 Cb -0.11 -3.26 0.02 0.00 -1.15 0.00 0.00 33.47 28.97 2c5d s TRP 166 CO -0.15 -1.48 0.14 -0.51 0.02 0.00 0.00 176.95 174.97 2c5d s LEU 167 N -5.48 1.33 -0.14 2.99 1.02 -1.13 -2.51 118.68 114.75 2c5d s LEU 167 Ca 0.60 0.28 0.02 0.00 0.02 0.00 0.00 54.13 55.05 2c5d s LEU 167 Cb -0.11 0.44 0.01 0.00 0.02 0.00 0.00 46.19 46.55 2c5d s LEU 167 CO 0.51 -0.07 -0.21 -1.58 0.02 0.00 0.00 176.35 175.02 2c5d s GLN 168 N 0.30 2.93 -1.45 1.70 0.74 0.22 -1.48 119.66 122.62 2c5d s GLN 168 Ca -0.02 -0.82 -0.03 0.00 0.05 0.00 0.00 55.36 54.54 2c5d s GLN 168 Cb -0.03 -2.40 0.02 0.00 1.10 0.00 0.00 33.01 31.70 2c5d s GLN 168 CO -0.01 -0.05 0.46 -0.25 -0.55 0.00 0.00 175.29 174.89 2c5d n ASP 169 N 4.18 -0.75 -1.75 6.67 8.00 0.16 0.27 116.55 133.32 2c5d n ASP 169 Ca -0.20 -1.01 -0.15 0.00 0.71 0.00 0.00 54.79 54.14 2c5d n ASP 169 Cb 0.51 -2.98 -0.01 0.00 -0.02 0.00 0.00 41.12 38.63 2c5d n ASP 169 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2c5d n ALA 170 N -4.41 -0.46 -3.73 2.24 0.00 -1.26 -5.01 120.51 107.88 2c5d n ALA 170 Ca -0.25 0.13 -0.26 0.00 0.00 0.00 0.00 53.44 53.05 2c5d n ALA 170 Cb 0.66 -1.80 -0.17 0.00 0.00 0.00 0.00 19.45 18.14 2c5d n ALA 170 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2c5d s VAL 171 N -2.77 1.11 0.55 0.00 1.01 0.14 -5.08 120.40 115.36 2c5d s VAL 171 Ca 0.01 -0.39 -0.21 0.00 0.00 0.00 0.00 61.98 61.39 2c5d s VAL 171 Cb -0.01 -1.07 -0.06 0.00 0.00 0.00 0.00 36.38 35.24 2c5d s VAL 171 CO 0.01 0.37 1.06 -2.65 0.00 0.00 0.00 175.10 173.89 2c5d n PRO 172 N 4.45 1.19 -0.43 2.72 -0.02 -1.26 0.72 135.00 142.37 2c5d n PRO 172 Ca -0.17 0.44 0.08 0.00 -2.02 0.00 0.00 63.50 61.83 2c5d n PRO 172 Cb 0.51 -2.23 0.25 0.00 -0.02 0.00 0.00 33.50 32.01 2c5d n PRO 172 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2c5d n LEU 173 N -0.50 3.75 -3.53 2.45 4.32 -1.04 -4.76 117.00 117.70 2c5d n LEU 173 Ca 0.12 -3.07 -0.08 0.00 -0.02 0.00 0.00 56.01 52.96 2c5d n LEU 173 Cb 0.45 -0.54 -0.02 0.00 -1.62 0.00 0.00 43.42 41.68 2c5d n LEU 173 CO 0.52 0.71 0.75 0.00 -1.22 0.00 0.00 177.39 178.15 2c5d s ALA 174 N -2.86 -1.88 0.12 -1.18 0.00 -1.26 -4.82 121.76 109.87 2c5d s ALA 174 Ca 0.41 1.17 -0.26 0.00 0.00 0.00 0.00 51.96 53.29 2c5d s ALA 174 Cb 0.34 0.21 -0.07 0.00 0.00 0.00 0.00 23.12 23.60 2c5d s ALA 174 CO 0.08 -0.63 1.64 1.15 0.00 0.00 0.00 175.76 178.00 2c5d h THR 175 N 2.06 0.46 -3.63 0.00 2.02 -1.94 -3.47 112.91 108.42 2c5d h THR 175 Ca -0.20 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 66.93 2c5d h THR 175 Cb 1.22 0.46 -0.10 0.00 -1.74 0.00 0.00 68.15 67.99 2c5d h THR 175 CO 0.30 0.00 -0.13 0.00 0.37 0.00 0.00 175.52 176.06 2c5d s ALA 176 N -6.08 -0.32 0.53 6.16 0.00 -1.26 -5.11 121.76 115.67 2c5d s ALA 176 Ca -0.15 -0.76 -0.19 0.00 0.00 0.00 0.00 51.96 50.85 2c5d s ALA 176 Cb 0.08 0.99 -0.10 0.00 0.00 0.00 0.00 23.12 24.10 2c5d s ALA 176 CO 0.66 -0.81 0.58 -2.30 0.00 0.00 0.00 175.76 173.89 2c5d n PRO 177 N -0.34 0.60 0.00 0.00 -0.02 -1.26 -1.83 135.00 132.15 2c5d n PRO 177 Ca -0.04 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 2c5d n PRO 177 Cb 0.62 -1.70 0.00 0.00 -0.02 0.00 0.00 33.50 32.40 2c5d n PRO 177 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c5d n GLY 178 N 1.72 2.97 3.83 -1.23 0.00 0.46 -4.90 105.19 108.05 2c5d n GLY 178 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 2c5d n GLY 178 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2c5d s HIS 179 N -1.25 3.64 0.00 1.61 3.76 -0.76 -4.89 115.29 117.40 2c5d s HIS 179 Ca 0.00 0.79 0.00 0.00 -0.15 0.00 0.00 55.06 55.70 2c5d s HIS 179 Cb 0.00 -2.20 0.00 0.00 1.11 0.00 0.00 32.58 31.49 2c5d s HIS 179 CO 0.00 0.59 0.00 0.41 -0.85 0.00 0.00 174.74 174.89 2c5d n GLY 180 N 2.18 -1.80 3.74 -2.22 0.00 -1.26 -4.72 105.19 101.11 2c5d n GLY 180 Ca -0.15 -1.89 -0.32 0.00 0.00 0.00 0.00 46.02 43.66 2c5d n GLY 180 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2c5d s PRO 181 N 0.00 2.09 -0.16 1.61 0.04 -1.26 -5.06 135.00 132.27 2c5d s PRO 181 Ca 0.00 1.40 -0.28 0.00 0.04 0.00 0.00 61.00 62.16 2c5d s PRO 181 Cb 0.00 -1.86 0.07 0.00 0.04 0.00 0.00 34.50 32.75 2c5d s PRO 181 CO 0.00 -1.80 0.69 -0.65 0.04 0.00 0.00 177.00 175.28 2c5d s GLN 182 N -4.50 0.94 0.00 4.56 -0.21 -1.26 -4.52 119.66 114.67 2c5d s GLN 182 Ca 0.66 0.61 0.00 0.00 0.02 0.00 0.00 55.36 56.65 2c5d s GLN 182 Cb -0.21 0.45 0.00 0.00 1.00 0.00 0.00 33.01 34.25 2c5d s GLN 182 CO 0.51 -0.21 0.00 0.54 -2.12 0.00 0.00 175.29 174.01 2c5d n ARG 183 N 1.79 0.00 -3.27 2.91 1.74 -1.21 -4.67 116.66 113.95 2c5d n ARG 183 Ca -0.17 0.00 0.03 0.00 -0.77 0.00 0.00 57.85 56.95 2c5d n ARG 183 Cb 0.56 -2.68 -0.02 0.00 -1.02 0.00 0.00 32.46 29.30 2c5d n ARG 183 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2c5d s SER 184 N -0.78 -0.96 -0.18 0.55 0.15 -1.26 -2.61 113.70 108.60 2c5d s SER 184 Ca 0.00 0.82 -0.03 0.00 0.70 0.00 0.00 55.95 57.44 2c5d s SER 184 Cb 0.00 1.89 -0.01 0.00 -1.71 0.00 0.00 66.02 66.19 2c5d s SER 184 CO 0.00 -0.18 -0.07 -0.22 1.20 0.00 0.00 173.24 173.97 2c5d s LEU 185 N 2.82 2.91 -0.22 3.45 0.20 -0.61 -4.89 118.68 122.35 2c5d s LEU 185 Ca 0.07 -0.32 -0.14 0.00 0.69 0.00 0.00 54.13 54.43 2c5d s LEU 185 Cb -0.12 -1.71 -0.04 0.00 -0.43 0.00 0.00 46.19 43.89 2c5d s LEU 185 CO -0.17 0.08 0.34 -2.28 -0.29 0.00 0.00 176.35 174.02 2c5d s HIS 186 N 0.89 3.35 -0.25 5.38 5.65 -1.26 -0.88 115.29 128.16 2c5d s HIS 186 Ca -0.02 0.51 -0.07 0.00 0.25 0.00 0.00 55.06 55.73 2c5d s HIS 186 Cb -0.15 -2.47 -0.02 0.00 -1.18 0.00 0.00 32.58 28.77 2c5d s HIS 186 CO 0.01 -0.01 0.05 0.08 -0.65 0.00 0.00 174.74 174.22 2c5d s VAL 187 N 1.30 4.08 0.09 0.89 1.01 0.58 -5.00 120.40 123.36 2c5d s VAL 187 Ca 0.16 -0.32 -0.21 0.00 0.00 0.00 0.00 61.98 61.61 2c5d s VAL 187 Cb -0.14 -2.93 -0.11 0.00 0.00 0.00 0.00 36.38 33.19 2c5d s VAL 187 CO 0.07 0.31 1.69 -0.65 0.00 0.00 0.00 175.10 176.53 2c5d h PRO 188 N 8.22 0.17 -1.57 2.72 0.11 -1.88 -1.04 132.00 138.73 2c5d h PRO 188 Ca -0.38 -0.02 0.26 0.00 0.11 0.00 0.00 66.00 65.97 2c5d h PRO 188 Cb 1.16 -0.03 -0.16 0.00 0.11 0.00 0.00 31.00 32.08 2c5d h PRO 188 CO 0.59 0.19 0.78 0.20 -0.21 0.00 0.00 178.00 179.54 2c5d s GLY 189 N -2.46 -0.34 -0.04 -0.55 0.00 -1.25 -1.32 107.32 101.36 2c5d s GLY 189 Ca -0.13 1.25 -0.02 0.00 0.00 0.00 0.00 44.72 45.82 2c5d s GLY 189 CO 0.68 0.38 0.07 1.08 0.00 0.00 0.00 173.10 175.32 2c5d s LEU 190 N -2.45 0.36 -0.02 0.66 1.43 -1.26 -4.88 118.68 112.52 2c5d s LEU 190 Ca 0.10 0.11 0.11 0.00 -1.03 0.00 0.00 54.13 53.42 2c5d s LEU 190 Cb 0.01 -0.04 0.33 0.00 0.03 0.00 0.00 46.19 46.51 2c5d s LEU 190 CO -0.04 -0.22 1.25 -0.46 0.23 0.00 0.00 176.35 177.11 2c5d n ASN 191 N 4.99 2.15 -3.59 2.29 0.23 -1.26 -2.67 115.26 117.40 2c5d n ASN 191 Ca -0.10 -2.07 -0.09 0.00 -0.53 0.00 0.00 54.58 51.80 2c5d n ASN 191 Cb 0.50 -0.29 -0.05 0.00 -2.08 0.00 0.00 39.78 37.86 2c5d n ASN 191 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 2c5d s LYS 192 N -1.56 0.49 0.13 -3.83 2.20 -1.26 -5.00 119.74 110.91 2c5d s LYS 192 Ca 0.25 0.09 -0.34 0.00 -0.36 0.00 0.00 55.97 55.61 2c5d s LYS 192 Cb 0.14 0.23 -0.14 0.00 -1.51 0.00 0.00 37.83 36.56 2c5d s LYS 192 CO 0.15 -0.16 1.62 2.41 -0.36 0.00 0.00 175.35 179.01 2c5d n THR 193 N 0.60 0.07 -4.40 3.43 -1.04 -1.26 -4.75 114.28 106.94 2c5d n THR 193 Ca -0.08 -0.01 -0.22 0.00 -2.04 0.00 0.00 64.05 61.70 2c5d n THR 193 Cb 0.58 -1.59 -0.08 0.00 -1.82 0.00 0.00 70.33 67.42 2c5d n THR 193 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 2c5d s SER 194 N 1.31 2.13 0.02 8.00 0.01 -0.79 -4.97 113.70 119.41 2c5d s SER 194 Ca 0.80 -1.67 0.01 0.00 1.31 0.00 0.00 55.95 56.41 2c5d s SER 194 Cb -0.67 0.49 -0.02 0.00 0.21 0.00 0.00 66.02 66.03 2c5d s SER 194 CO 0.39 -0.96 -0.05 -0.94 0.41 0.00 0.00 173.24 172.10 2c5d s SER 195 N -3.48 0.50 0.02 2.44 1.04 -1.26 -0.14 113.70 112.82 2c5d s SER 195 Ca 0.32 -0.39 0.05 0.00 0.48 0.00 0.00 55.95 56.41 2c5d s SER 195 Cb 0.03 0.04 -0.02 0.00 0.10 0.00 0.00 66.02 66.17 2c5d s SER 195 CO 0.19 -0.17 -0.15 -0.36 0.98 0.00 0.00 173.24 173.73 2c5d s PHE 196 N -1.02 1.32 0.33 5.02 0.40 -0.25 0.35 117.98 124.14 2c5d s PHE 196 Ca -0.09 -0.30 0.00 0.00 -0.60 0.00 0.00 56.93 55.94 2c5d s PHE 196 Cb -0.07 -0.82 0.00 0.00 0.51 0.00 0.00 43.02 42.64 2c5d s PHE 196 CO -0.00 0.01 0.02 0.43 0.70 0.00 0.00 175.22 176.38 2c5d n SER 197 N 2.30 2.86 -3.15 1.36 7.64 -0.55 -1.06 113.62 123.02 2c5d n SER 197 Ca -0.16 -2.44 0.04 0.00 1.01 0.00 0.00 58.87 57.32 2c5d n SER 197 Cb 0.55 0.21 -0.00 0.00 -1.01 0.00 0.00 64.21 63.96 2c5d n SER 197 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2c5d s GLU 199 N 2.85 3.08 -0.08 0.00 2.02 -0.36 -1.69 118.70 124.51 2c5d s GLU 199 Ca 0.13 0.76 -0.03 0.00 0.02 0.00 0.00 54.97 55.85 2c5d s GLU 199 Cb -0.10 -2.02 0.05 0.00 0.10 0.00 0.00 34.13 32.16 2c5d s GLU 199 CO -0.25 -0.95 0.15 0.00 0.02 0.00 0.00 175.26 174.23 2c5d s ALA 200 N -3.16 -0.11 0.21 5.21 0.00 -0.92 -2.46 121.76 120.54 2c5d s ALA 200 Ca 0.57 0.50 0.11 0.00 0.00 0.00 0.00 51.96 53.14 2c5d s ALA 200 Cb -0.12 -0.81 -0.04 0.00 0.00 0.00 0.00 23.12 22.14 2c5d s ALA 200 CO 0.54 -0.58 -0.17 -1.01 0.00 0.00 0.00 175.76 174.54 2c5d s HIS 201 N 2.28 2.42 0.11 0.00 3.76 0.60 -1.53 115.29 122.94 2c5d s HIS 201 Ca 0.03 -0.30 -0.26 0.00 -0.15 0.00 0.00 55.06 54.38 2c5d s HIS 201 Cb -0.12 -1.15 0.07 0.00 1.11 0.00 0.00 32.58 32.49 2c5d s HIS 201 CO -0.06 0.56 0.85 0.54 -0.85 0.00 0.00 174.74 175.78 2c5d s ASN 202 N -2.97 -0.31 0.51 1.40 2.20 -0.78 -1.08 114.94 113.90 2c5d s ASN 202 Ca 0.25 -0.22 0.31 0.00 -0.94 0.00 0.00 52.86 52.26 2c5d s ASN 202 Cb -0.07 0.49 1.06 0.00 -2.00 0.00 0.00 41.25 40.73 2c5d s ASN 202 CO 0.13 -0.86 1.20 0.00 -2.94 0.00 0.00 177.10 174.64 2c5d n ALA 203 N -0.37 1.16 0.09 3.54 0.00 -1.26 -0.34 120.51 123.33 2c5d n ALA 203 Ca -0.08 0.40 -0.23 0.00 0.00 0.00 0.00 53.44 53.52 2c5d n ALA 203 Cb 0.62 -0.69 -0.15 0.00 0.00 0.00 0.00 19.45 19.22 2c5d n ALA 203 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2c5d h LYS 204 N 0.00 0.42 0.00 0.00 1.79 -1.93 -3.51 116.57 113.35 2c5d h LYS 204 Ca 0.57 -0.72 0.00 0.00 -2.18 0.00 0.00 60.65 58.32 2c5d h LYS 204 Cb 2.82 0.27 0.00 0.00 -1.58 0.00 0.00 32.23 33.74 2c5d h LYS 204 CO -0.01 1.35 0.00 0.41 -1.08 0.00 0.00 179.45 180.12 2c5d n GLY 205 N 1.73 -0.54 3.19 3.86 0.00 0.54 -4.92 105.19 109.05 2c5d n GLY 205 Ca -0.18 -0.80 -0.22 0.00 0.00 0.00 0.00 46.02 44.82 2c5d n GLY 205 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c5d s VAL 206 N -3.60 1.34 -0.13 1.61 0.11 -1.26 -1.86 120.40 116.61 2c5d s VAL 206 Ca 0.00 -1.12 -0.01 0.00 -2.93 0.00 0.00 61.98 57.92 2c5d s VAL 206 Cb 0.00 -1.19 0.03 0.00 -1.53 0.00 0.00 36.38 33.69 2c5d s VAL 206 CO 0.00 0.05 -0.05 0.28 -3.33 0.00 0.00 175.10 172.06 2c5d s THR 207 N -0.88 0.91 0.18 5.04 -1.32 -0.58 -4.95 115.64 114.04 2c5d s THR 207 Ca 0.04 -0.36 -0.18 0.00 -1.21 0.00 0.00 61.69 59.98 2c5d s THR 207 Cb -0.08 -1.04 -0.08 0.00 -1.51 0.00 0.00 72.50 69.79 2c5d s THR 207 CO 0.02 0.23 0.65 0.42 -2.21 0.00 0.00 174.62 173.73 2c5d s THR 208 N 1.74 4.67 0.80 5.08 -4.23 -1.26 -2.16 115.64 120.27 2c5d s THR 208 Ca 0.03 1.16 -0.13 0.00 -1.18 0.00 0.00 61.69 61.57 2c5d s THR 208 Cb -0.14 -3.84 0.18 0.00 1.34 0.00 0.00 72.50 70.04 2c5d s THR 208 CO -0.08 0.28 1.09 -1.54 -0.54 0.00 0.00 174.62 173.83 2c5d n SER 209 N 0.92 0.15 -4.80 3.99 3.41 -0.68 -4.98 113.62 111.63 2c5d n SER 209 Ca -0.04 -1.44 -0.31 0.00 -0.26 0.00 0.00 58.87 56.82 2c5d n SER 209 Cb 0.51 -0.82 0.08 0.00 -0.26 0.00 0.00 64.21 63.71 2c5d n SER 209 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2c5d s ARG 210 N -5.36 2.42 -0.37 4.33 1.70 -1.26 -4.68 118.95 115.73 2c5d s ARG 210 Ca 0.62 0.85 -0.17 0.00 -0.47 0.00 0.00 55.73 56.56 2c5d s ARG 210 Cb -0.02 -1.94 -0.00 0.00 -0.57 0.00 0.00 34.95 32.42 2c5d s ARG 210 CO 0.43 -1.44 0.44 0.99 -1.08 0.00 0.00 175.30 174.64 2c5d s THR 211 N -3.06 5.09 0.16 4.99 2.01 -1.26 -4.54 115.64 119.03 2c5d s THR 211 Ca 0.60 0.05 -0.23 0.00 0.31 0.00 0.00 61.69 62.41 2c5d s THR 211 Cb -0.15 -3.93 -0.08 0.00 0.01 0.00 0.00 72.50 68.36 2c5d s THR 211 CO 0.55 -0.22 0.73 0.00 -0.69 0.00 0.00 174.62 174.99 2c5d s ALA 212 N 2.19 3.47 -0.22 7.40 0.00 -0.22 -4.91 121.76 129.47 2c5d s ALA 212 Ca 0.14 0.27 -0.02 0.00 0.00 0.00 0.00 51.96 52.35 2c5d s ALA 212 Cb -0.16 -2.88 0.01 0.00 0.00 0.00 0.00 23.12 20.09 2c5d s ALA 212 CO 0.13 0.32 -0.08 0.99 0.00 0.00 0.00 175.76 177.11 2c5d s THR 213 N -1.22 2.94 -0.31 0.00 2.01 -1.26 -1.09 115.64 116.71 2c5d s THR 213 Ca 0.36 -0.73 -0.14 0.00 0.31 0.00 0.00 61.69 61.49 2c5d s THR 213 Cb -0.21 -2.36 -0.03 0.00 0.01 0.00 0.00 72.50 69.91 2c5d s THR 213 CO 0.24 0.39 0.31 -0.63 -0.69 0.00 0.00 174.62 174.25 2c5d s ILE 214 N 1.40 5.21 -0.23 1.82 -1.09 0.80 -2.57 121.20 126.54 2c5d s ILE 214 Ca 0.04 0.18 -0.15 0.00 -2.23 0.00 0.00 60.65 58.49 2c5d s ILE 214 Cb -0.15 -3.71 -0.04 0.00 -1.58 0.00 0.00 42.46 36.98 2c5d s ILE 214 CO -0.06 0.06 0.39 -0.89 -1.23 0.00 0.00 174.94 173.20 2c5d s THR 215 N 1.94 5.19 0.11 2.92 2.01 0.21 -1.89 115.64 126.13 2c5d s THR 215 Ca 0.11 0.65 -0.07 0.00 0.31 0.00 0.00 61.69 62.69 2c5d s THR 215 Cb -0.16 -3.71 -0.06 0.00 0.01 0.00 0.00 72.50 68.58 2c5d s THR 215 CO 0.11 0.22 0.37 -0.69 -0.69 0.00 0.00 174.62 173.94 2c5d s VAL 216 N 1.60 5.15 -0.09 3.82 1.01 -1.26 -1.03 120.40 129.61 2c5d s VAL 216 Ca 0.17 0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.30 2c5d s VAL 216 Cb -0.15 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 2c5d s VAL 216 CO 0.08 0.15 -0.11 0.18 0.00 0.00 0.00 175.10 175.40 2c5d n LEU 217 N 0.46 0.74 0.00 3.92 4.77 -1.11 -4.78 117.00 120.99 2c5d n LEU 217 Ca -0.05 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 2c5d n LEU 217 Cb 0.52 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 2c5d n LEU 217 CO 0.46 0.21 0.00 0.09 -1.33 0.00 0.00 177.39 176.81