#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 7.37 0.54 1.62 0.15 -1.26 -4.94 113.70 117.18 2c5d s SER 28 Ca 0.00 1.65 0.27 0.00 0.70 0.00 0.00 55.95 58.57 2c5d s SER 28 Cb 0.00 -2.56 1.56 0.00 -1.71 0.00 0.00 66.02 63.31 2c5d s SER 28 CO 0.00 -0.21 2.14 1.55 1.20 0.00 0.00 173.24 177.92 2c5d h PRO 29 N 6.56 0.00 -7.21 5.44 0.13 -1.97 -3.45 132.00 131.50 2c5d h PRO 29 Ca -0.41 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 0.17 0.00 0.13 0.00 0.00 31.00 32.52 2c5d h PRO 29 CO 0.74 0.07 0.34 -0.06 -0.23 0.00 0.00 178.00 178.87 2c5d s PHE 30 N -4.45 1.94 0.00 1.56 0.40 -1.26 -1.28 117.98 114.90 2c5d s PHE 30 Ca -0.04 1.66 0.00 0.00 -0.60 0.00 0.00 56.93 57.95 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 0.58 -2.65 0.00 0.28 0.70 0.00 0.00 175.22 174.13 2c5d n VAL 31 N -3.23 0.00 -4.23 -0.44 0.31 -0.81 -4.81 118.33 105.13 2c5d n VAL 31 Ca 0.13 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.25 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 -0.28 0.49 0.26 2.92 0.00 -0.72 -4.95 107.32 105.04 2c5d s GLY 32 Ca 0.00 -0.10 0.08 0.00 0.00 0.00 0.00 44.72 44.71 2c5d s GLY 32 CO 0.00 0.37 0.10 -1.31 0.00 0.00 0.00 173.10 172.26 2c5d s ASN 33 N 0.84 5.03 0.71 1.64 0.01 -1.26 -1.14 114.94 120.77 2c5d s ASN 33 Ca -0.12 -0.45 -0.16 0.00 -0.71 0.00 0.00 52.86 51.42 2c5d s ASN 33 Cb -0.15 -1.12 0.01 0.00 0.41 0.00 0.00 41.25 40.41 2c5d s ASN 33 CO 0.01 -0.02 1.09 -2.65 -1.51 0.00 0.00 177.10 174.01 2c5d n PRO 34 N -1.04 0.62 0.00 -0.60 -0.02 -1.24 -4.69 135.00 128.02 2c5d n PRO 34 Ca -0.07 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 2c5d n PRO 34 Cb 0.58 -2.33 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 0.97 1.73 2.99 -1.23 0.00 -1.26 -4.45 105.19 103.94 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 -0.09 -0.10 1.61 0.01 -1.26 -3.28 114.94 110.83 2c5d s ASN 36 Ca 0.00 0.17 -0.01 0.00 -0.71 0.00 0.00 52.86 52.30 2c5d s ASN 36 Cb 0.00 0.21 0.03 0.00 0.41 0.00 0.00 41.25 41.90 2c5d s ASN 36 CO 0.00 -0.06 -0.00 0.27 -1.51 0.00 0.00 177.10 175.79 2c5d s ILE 37 N -0.06 0.49 -0.04 0.60 -4.36 -1.06 -5.00 121.20 111.77 2c5d s ILE 37 Ca -0.01 -0.04 0.04 0.00 -0.26 0.00 0.00 60.65 60.38 2c5d s ILE 37 Cb -0.01 -0.68 -0.00 0.00 1.25 0.00 0.00 42.46 43.01 2c5d s ILE 37 CO 0.00 0.20 -0.17 0.42 0.24 0.00 0.00 174.94 175.63 2c5d s THR 38 N 1.92 1.46 0.04 8.37 -4.23 -1.26 -2.37 115.64 119.57 2c5d s THR 38 Ca 0.04 -0.73 -0.14 0.00 -1.18 0.00 0.00 61.69 59.68 2c5d s THR 38 Cb -0.13 -1.25 0.05 0.00 1.34 0.00 0.00 72.50 72.51 2c5d s THR 38 CO -0.06 0.42 0.67 0.61 -0.54 0.00 0.00 174.62 175.72 2c5d n GLY 39 N 3.15 0.62 3.81 3.99 0.00 -1.00 -4.92 105.19 110.84 2c5d n GLY 39 Ca -0.18 -1.00 -0.30 0.00 0.00 0.00 0.00 46.02 44.54 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 -1.59 2.32 0.61 4.61 0.00 -1.21 -0.09 121.76 126.41 2c5d s ALA 40 Ca 0.15 -0.24 -0.19 0.00 0.00 0.00 0.00 51.96 51.69 2c5d s ALA 40 Cb -0.01 -3.09 -0.04 0.00 0.00 0.00 0.00 23.12 19.98 2c5d s ALA 40 CO 0.01 -1.67 1.11 0.54 0.00 0.00 0.00 175.76 175.75 2c5d n ARG 41 N -3.39 1.05 0.00 0.00 1.74 -1.26 -2.40 116.66 112.40 2c5d n ARG 41 Ca 0.07 0.41 0.00 0.00 -0.77 0.00 0.00 57.85 57.56 2c5d n ARG 41 Cb 0.56 -2.32 0.00 0.00 -1.02 0.00 0.00 32.46 29.69 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 1.12 2.34 3.56 -0.13 0.00 0.10 -4.87 105.19 107.31 2c5d n GLY 42 Ca 0.14 -0.53 -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 1.19 -4.70 0.99 0.00 -1.01 -2.89 117.00 110.58 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 -1.19 -0.09 0.00 0.00 0.00 0.00 43.42 42.14 2c5d n LEU 43 CO 0.00 -1.56 -0.29 0.42 0.00 0.00 0.00 177.39 175.96 2c5d s THR 44 N -0.50 4.46 0.32 1.96 -4.23 -1.00 -1.08 115.64 115.58 2c5d s THR 44 Ca 0.69 -0.19 -0.13 0.00 -1.18 0.00 0.00 61.69 60.88 2c5d s THR 44 Cb -0.84 -2.89 0.02 0.00 1.34 0.00 0.00 72.50 70.13 2c5d s THR 44 CO 0.55 0.60 0.64 -0.83 -0.54 0.00 0.00 174.62 175.04 2c5d s GLY 45 N -0.86 0.56 0.00 3.99 0.00 -0.12 -5.00 107.32 105.90 2c5d s GLY 45 Ca 0.13 -0.86 0.00 0.00 0.00 0.00 0.00 44.72 43.99 2c5d s GLY 45 CO 0.02 -0.49 -0.02 -0.51 0.00 0.00 0.00 173.10 172.11 2c5d s THR 46 N -3.18 0.09 0.09 0.90 -4.23 -1.26 -1.01 115.64 107.04 2c5d s THR 46 Ca 0.19 -0.24 0.04 0.00 -1.18 0.00 0.00 61.69 60.50 2c5d s THR 46 Cb -0.03 -0.12 -0.04 0.00 1.34 0.00 0.00 72.50 73.65 2c5d s THR 46 CO 0.12 -0.10 0.04 -0.76 -0.54 0.00 0.00 174.62 173.39 2c5d s LEU 47 N -0.36 3.64 -0.26 4.79 1.43 -0.52 -4.94 118.68 122.46 2c5d s LEU 47 Ca -0.03 -0.10 -0.18 0.00 -1.03 0.00 0.00 54.13 52.79 2c5d s LEU 47 Cb -0.03 -2.34 0.07 0.00 0.03 0.00 0.00 46.19 43.93 2c5d s LEU 47 CO -0.00 0.17 0.66 0.00 0.23 0.00 0.00 176.35 177.41 2c5d s ARG 48 N -2.39 0.72 0.12 1.70 1.70 -1.26 -0.84 118.95 118.69 2c5d s ARG 48 Ca 0.28 1.08 0.10 0.00 -0.47 0.00 0.00 55.73 56.72 2c5d s ARG 48 Cb -0.12 0.22 -0.04 0.00 -0.57 0.00 0.00 34.95 34.45 2c5d s ARG 48 CO 0.20 -0.13 -0.25 0.00 -1.08 0.00 0.00 175.30 174.04 2c5d s GLN 50 N -2.01 0.19 0.41 0.00 -2.07 -0.29 -1.22 119.66 114.68 2c5d s GLN 50 Ca 0.12 -0.19 0.06 0.00 -1.82 0.00 0.00 55.36 53.52 2c5d s GLN 50 Cb -0.10 -1.84 0.01 0.00 -1.09 0.00 0.00 33.01 29.98 2c5d s GLN 50 CO 0.05 -0.69 0.58 -0.48 -1.32 0.00 0.00 175.29 173.43 2c5d s LEU 51 N 2.08 3.71 -0.10 2.60 2.34 -0.75 -1.76 118.68 126.79 2c5d s LEU 51 Ca 0.02 -0.21 -0.01 0.00 0.06 0.00 0.00 54.13 53.99 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 -0.70 -0.05 -1.58 -1.06 0.00 0.00 176.35 172.85 2c5d s GLN 52 N -4.37 1.26 0.42 1.48 0.74 -0.40 -1.52 119.66 117.26 2c5d s GLN 52 Ca 0.51 -0.15 0.04 0.00 0.05 0.00 0.00 55.36 55.82 2c5d s GLN 52 Cb -0.10 -1.41 -0.05 0.00 1.10 0.00 0.00 33.01 32.55 2c5d s GLN 52 CO 0.34 -0.28 0.03 0.14 -0.55 0.00 0.00 175.29 174.97 2c5d s VAL 53 N 1.78 1.41 -0.37 1.34 -7.23 -0.54 -4.80 120.40 111.99 2c5d s VAL 53 Ca 0.05 -2.00 -0.14 0.00 -1.81 0.00 0.00 61.98 58.08 2c5d s VAL 53 Cb -0.12 -2.65 -0.00 0.00 0.56 0.00 0.00 36.38 34.17 2c5d s VAL 53 CO -0.07 0.00 0.29 -1.58 -0.31 0.00 0.00 175.10 173.43 2c5d s GLN 54 N -3.80 3.29 0.58 4.82 0.74 -1.26 -0.06 119.66 123.97 2c5d s GLN 54 Ca 0.26 -0.76 0.00 0.00 0.05 0.00 0.00 55.36 54.91 2c5d s GLN 54 Cb 0.07 -3.88 0.00 0.00 1.10 0.00 0.00 33.01 30.29 2c5d s GLN 54 CO 0.13 -0.59 0.00 0.41 -0.55 0.00 0.00 175.29 174.69 2c5d n GLY 55 N 5.11 -4.12 0.24 2.59 0.00 0.35 -4.84 105.19 104.52 2c5d n GLY 55 Ca -0.11 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.42 0.00 -1.63 1.61 4.07 -0.66 -4.77 120.64 116.85 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 0.43 0.00 0.03 0.00 -0.06 0.00 0.00 31.44 31.84 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 0.59 1.21 -2.07 5.31 -0.04 -1.26 -5.01 135.00 133.72 2c5d n PRO 57 Ca 0.00 0.45 -0.29 0.00 -0.04 0.00 0.00 63.50 63.61 2c5d n PRO 57 Cb 0.00 -2.17 0.03 0.00 -0.04 0.00 0.00 33.50 31.31 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 -2.45 3.19 0.01 0.54 0.04 -1.26 -5.03 135.00 130.03 2c5d s PRO 58 Ca 0.70 0.43 -0.26 0.00 0.04 0.00 0.00 61.00 61.91 2c5d s PRO 58 Cb -0.47 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 31.89 2c5d s PRO 58 CO 0.52 -0.72 0.80 -2.00 0.04 0.00 0.00 177.00 175.65 2c5d s GLU 59 N -5.15 4.51 -0.22 4.56 2.12 -1.26 -5.03 118.70 118.23 2c5d s GLU 59 Ca 0.55 1.11 -0.11 0.00 0.36 0.00 0.00 54.97 56.88 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 0.14 0.19 0.54 -0.54 0.00 0.00 175.26 176.10 2c5d s VAL 60 N 0.42 5.35 0.33 3.70 0.11 -1.26 -4.54 120.40 124.50 2c5d s VAL 60 Ca 0.42 0.28 0.07 0.00 -2.93 0.00 0.00 61.98 59.82 2c5d s VAL 60 Cb -0.20 -3.53 -0.02 0.00 -1.53 0.00 0.00 36.38 31.10 2c5d s VAL 60 CO 0.23 0.36 0.41 -1.00 -3.33 0.00 0.00 175.10 171.77 2c5d s HIS 61 N 0.87 3.08 -0.08 1.54 0.09 0.00 -4.93 115.29 115.87 2c5d s HIS 61 Ca 0.10 -0.23 0.03 0.00 -0.00 0.00 0.00 55.06 54.96 2c5d s HIS 61 Cb -0.13 -1.91 -0.02 0.00 -0.00 0.00 0.00 32.58 30.53 2c5d s HIS 61 CO 0.03 0.08 -0.18 -1.58 -0.00 0.00 0.00 174.74 173.09 2c5d s TRP 62 N -2.19 2.65 -0.15 1.40 0.52 -1.26 -0.89 118.94 119.02 2c5d s TRP 62 Ca 0.43 -0.53 -0.02 0.00 0.02 0.00 0.00 56.10 56.00 2c5d s TRP 62 Cb -0.09 -1.70 -0.02 0.00 -1.15 0.00 0.00 33.47 30.52 2c5d s TRP 62 CO 0.30 -0.09 -0.08 -0.51 0.02 0.00 0.00 176.95 176.59 2c5d s LEU 63 N -0.15 3.00 -0.20 2.99 1.43 0.36 -0.98 118.68 125.13 2c5d s LEU 63 Ca -0.02 -0.23 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 2c5d s LEU 63 Cb -0.14 -1.71 0.04 0.00 0.03 0.00 0.00 46.19 44.42 2c5d s LEU 63 CO 0.04 0.15 -0.11 -0.60 0.23 0.00 0.00 176.35 176.05 2c5d s ARG 64 N 0.45 2.15 -1.19 1.70 3.52 0.24 0.30 118.95 126.12 2c5d s ARG 64 Ca -0.06 -0.85 -0.03 0.00 -0.13 0.00 0.00 55.73 54.66 2c5d s ARG 64 Cb -0.15 -2.43 0.00 0.00 -1.56 0.00 0.00 34.95 30.81 2c5d s ARG 64 CO 0.04 -0.40 0.43 -0.25 -0.81 0.00 0.00 175.30 174.31 2c5d n ASP 65 N 4.67 -5.01 0.00 -2.12 8.00 0.40 -2.12 116.55 120.38 2c5d n ASP 65 Ca -0.15 -0.20 0.00 0.00 0.71 0.00 0.00 54.79 55.14 2c5d n ASP 65 Cb 0.47 -3.88 0.00 0.00 -0.02 0.00 0.00 41.12 37.69 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 -1.32 2.93 3.95 0.44 0.00 -1.26 -5.01 105.19 104.91 2c5d n GLY 66 Ca -0.09 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 -0.01 3.32 -0.03 1.61 -0.21 -0.90 -5.03 119.66 118.41 2c5d s GLN 67 Ca 0.00 -0.84 -0.29 0.00 0.02 0.00 0.00 55.36 54.25 2c5d s GLN 67 Cb 0.00 -2.83 -0.03 0.00 1.00 0.00 0.00 33.01 31.16 2c5d s GLN 67 CO 0.00 0.39 0.95 0.42 -2.12 0.00 0.00 175.29 174.92 2c5d s ILE 68 N -2.03 4.88 -0.71 1.08 -1.09 -1.26 -0.59 121.20 121.48 2c5d s ILE 68 Ca 0.35 1.97 -0.23 0.00 -2.23 0.00 0.00 60.65 60.51 2c5d s ILE 68 Cb -0.09 -4.28 0.06 0.00 -1.58 0.00 0.00 42.46 36.57 2c5d s ILE 68 CO 0.29 0.15 1.07 -0.76 -1.23 0.00 0.00 174.94 174.46 2c5d s LEU 69 N 1.15 4.08 0.07 2.97 1.43 -0.15 -4.91 118.68 123.32 2c5d s LEU 69 Ca 0.49 -0.94 -0.17 0.00 -1.03 0.00 0.00 54.13 52.49 2c5d s LEU 69 Cb -0.20 -2.46 -0.14 0.00 0.03 0.00 0.00 46.19 43.42 2c5d s LEU 69 CO 0.25 -1.52 1.32 -0.33 0.23 0.00 0.00 176.35 176.29 2c5d h GLU 70 N 9.65 0.59 -3.60 1.70 4.39 -1.94 -3.41 114.58 121.95 2c5d h GLU 70 Ca -0.24 -0.39 -0.66 0.00 0.34 0.00 0.00 59.36 58.41 2c5d h GLU 70 Cb 1.06 0.05 -0.39 0.00 -0.10 0.00 0.00 28.75 29.37 2c5d h GLU 70 CO 1.21 1.01 -0.56 -0.51 -1.16 0.00 0.00 179.01 179.00 2c5d s LEU 71 N -8.78 4.65 -0.05 1.33 1.43 -1.26 -5.07 118.68 110.94 2c5d s LEU 71 Ca -0.13 -2.86 -0.12 0.00 -1.03 0.00 0.00 54.13 50.00 2c5d s LEU 71 Cb 0.07 -1.71 0.02 0.00 0.03 0.00 0.00 46.19 44.60 2c5d s LEU 71 CO 0.82 -0.29 0.27 0.00 0.23 0.00 0.00 176.35 177.38 2c5d s ALA 72 N -0.07 -0.68 -0.04 4.21 0.00 -1.26 -5.12 121.76 118.80 2c5d s ALA 72 Ca 0.16 0.43 -0.30 0.00 0.00 0.00 0.00 51.96 52.25 2c5d s ALA 72 Cb -0.24 -0.13 -0.05 0.00 0.00 0.00 0.00 23.12 22.71 2c5d s ALA 72 CO -0.02 -0.21 1.39 -0.51 0.00 0.00 0.00 175.76 176.42 2c5d s ASP 73 N -0.78 6.86 0.06 0.00 1.11 -1.26 -4.99 116.67 117.67 2c5d s ASP 73 Ca -0.09 2.03 -0.03 0.00 0.18 0.00 0.00 52.55 54.64 2c5d s ASP 73 Cb -0.04 -2.55 -0.03 0.00 1.07 0.00 0.00 42.92 41.36 2c5d s ASP 73 CO 0.02 -0.74 0.04 -0.94 1.18 0.00 0.00 175.17 174.73 2c5d s SER 74 N 2.05 0.37 -0.20 0.27 1.04 -1.26 -1.06 113.70 114.91 2c5d s SER 74 Ca 0.63 -0.89 -0.04 0.00 0.48 0.00 0.00 55.95 56.12 2c5d s SER 74 Cb -0.29 0.24 0.09 0.00 0.10 0.00 0.00 66.02 66.16 2c5d s SER 74 CO 0.25 -0.64 0.20 -0.89 0.98 0.00 0.00 173.24 173.14 2c5d s THR 75 N -3.90 -0.29 -0.12 2.02 2.01 -0.62 -4.98 115.64 109.76 2c5d s THR 75 Ca 0.06 -0.13 -0.12 0.00 0.31 0.00 0.00 61.69 61.81 2c5d s THR 75 Cb 0.07 -0.67 -0.05 0.00 0.01 0.00 0.00 72.50 71.86 2c5d s THR 75 CO -0.10 -0.23 0.27 -1.10 -0.69 0.00 0.00 174.62 172.78 2c5d s GLN 76 N 2.30 4.00 -0.24 4.92 -0.21 -1.26 -2.29 119.66 126.88 2c5d s GLN 76 Ca 0.06 0.09 -0.01 0.00 0.02 0.00 0.00 55.36 55.52 2c5d s GLN 76 Cb -0.16 -3.33 0.02 0.00 1.00 0.00 0.00 33.01 30.55 2c5d s GLN 76 CO -0.12 0.46 -0.07 0.99 -2.12 0.00 0.00 175.29 174.42 2c5d s THR 77 N -0.19 2.81 -0.16 -0.19 2.01 0.09 -4.97 115.64 115.04 2c5d s THR 77 Ca 0.17 -1.01 -0.04 0.00 0.31 0.00 0.00 61.69 61.11 2c5d s THR 77 Cb -0.13 -2.41 -0.03 0.00 0.01 0.00 0.00 72.50 69.93 2c5d s THR 77 CO 0.05 0.23 -0.01 -1.10 -0.69 0.00 0.00 174.62 173.10 2c5d s GLN 78 N 1.32 3.72 -0.15 4.92 -0.21 -1.26 -1.88 119.66 126.13 2c5d s GLN 78 Ca 0.00 -0.48 -0.01 0.00 0.02 0.00 0.00 55.36 54.90 2c5d s GLN 78 Cb -0.16 -2.98 0.04 0.00 1.00 0.00 0.00 33.01 30.91 2c5d s GLN 78 CO -0.05 0.27 -0.05 0.08 -2.12 0.00 0.00 175.29 173.41 2c5d s VAL 79 N 0.31 1.02 0.06 1.09 1.01 -0.32 -4.97 120.40 118.60 2c5d s VAL 79 Ca -0.02 -0.50 -0.31 0.00 0.00 0.00 0.00 61.98 61.16 2c5d s VAL 79 Cb -0.14 -1.17 -0.05 0.00 0.00 0.00 0.00 36.38 35.02 2c5d s VAL 79 CO 0.02 0.18 1.19 -2.16 0.00 0.00 0.00 175.10 174.33 2c5d s PRO 80 N 1.68 4.44 0.02 2.72 0.04 -1.26 -1.26 135.00 141.38 2c5d s PRO 80 Ca 0.02 1.75 0.21 0.00 0.04 0.00 0.00 61.00 63.02 2c5d s PRO 80 Cb -0.14 -3.35 -0.21 0.00 0.04 0.00 0.00 34.50 30.84 2c5d s PRO 80 CO -0.08 -0.24 0.62 1.28 0.04 0.00 0.00 177.00 178.62 2c5d n LEU 81 N 3.91 0.36 0.00 -3.56 4.77 0.54 -4.97 117.00 118.05 2c5d n LEU 81 Ca 0.09 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 2c5d n LEU 81 Cb 0.47 0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 2c5d n LEU 81 CO 0.55 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 2c5d n GLY 82 N 1.33 0.90 0.01 -0.72 0.00 -1.21 -4.93 105.19 100.58 2c5d n GLY 82 Ca -0.08 -1.90 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 -0.12 0.60 -4.30 1.61 4.71 -1.26 -4.98 120.64 116.90 2c5d n GLU 83 Ca 0.00 -0.17 -0.27 0.00 -0.01 0.00 0.00 57.16 56.71 2c5d n GLU 83 Cb 0.00 -1.48 -0.06 0.00 -1.01 0.00 0.00 31.44 28.88 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 -2.13 2.54 -0.78 1.62 8.00 -1.26 -5.03 116.55 119.51 2c5d n ASP 84 Ca -0.03 -2.97 0.05 0.00 0.71 0.00 0.00 54.79 52.56 2c5d n ASP 84 Cb 0.51 0.53 0.17 0.00 -0.02 0.00 0.00 41.12 42.31 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 -1.02 2.07 -0.11 -1.24 1.02 -1.26 -3.79 120.64 116.31 2c5d n GLU 85 Ca -0.14 -1.37 0.03 0.00 -0.02 0.00 0.00 57.16 55.66 2c5d n GLU 85 Cb 0.56 -1.40 0.09 0.00 -0.02 0.00 0.00 31.44 30.67 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 0.53 2.91 -0.46 3.49 3.00 -1.26 -1.65 117.38 123.93 2c5d n GLN 86 Ca 0.13 -1.85 0.00 0.00 -0.01 0.00 0.00 57.00 55.26 2c5d n GLN 86 Cb 0.39 -1.17 0.00 0.00 0.00 0.00 0.00 30.24 29.46 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 0.08 0.38 -4.76 1.08 10.43 -1.25 -4.03 116.55 118.48 2c5d n ASP 87 Ca 0.07 -0.39 -0.41 0.00 2.57 0.00 0.00 54.79 56.64 2c5d n ASP 87 Cb 0.37 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 -0.77 7.02 0.18 -2.24 1.11 -1.26 0.13 116.67 120.84 2c5d s ASP 88 Ca 0.00 2.47 0.09 0.00 0.18 0.00 0.00 52.55 55.29 2c5d s ASP 88 Cb 0.00 -2.64 -0.04 0.00 1.07 0.00 0.00 42.92 41.31 2c5d s ASP 88 CO 0.00 -0.34 -0.19 0.26 1.18 0.00 0.00 175.17 176.07 2c5d s TRP 89 N -1.07 1.92 -0.22 4.23 0.52 0.92 -0.34 118.94 124.90 2c5d s TRP 89 Ca 0.47 -0.45 0.02 0.00 0.02 0.00 0.00 56.10 56.16 2c5d s TRP 89 Cb -0.36 -0.95 0.04 0.00 -1.15 0.00 0.00 33.47 31.06 2c5d s TRP 89 CO 0.46 0.38 -0.15 0.42 0.02 0.00 0.00 176.95 178.09 2c5d s ILE 90 N -2.05 2.16 -0.03 2.03 1.01 -0.38 -1.47 121.20 122.46 2c5d s ILE 90 Ca 0.18 -1.27 0.01 0.00 0.00 0.00 0.00 60.65 59.57 2c5d s ILE 90 Cb -0.06 -2.09 -0.03 0.00 0.01 0.00 0.00 42.46 40.29 2c5d s ILE 90 CO 0.08 0.25 -0.03 -0.69 0.00 0.00 0.00 174.94 174.55 2c5d s VAL 91 N 1.20 3.95 -0.05 2.92 1.01 -0.58 -1.17 120.40 127.68 2c5d s VAL 91 Ca -0.02 -0.57 -0.02 0.00 0.00 0.00 0.00 61.98 61.37 2c5d s VAL 91 Cb -0.16 -2.70 0.03 0.00 0.00 0.00 0.00 36.38 33.54 2c5d s VAL 91 CO -0.09 0.46 0.08 -0.69 0.00 0.00 0.00 175.10 174.86 2c5d s VAL 92 N -0.98 -0.13 -0.07 2.92 1.01 -0.79 -1.81 120.40 120.56 2c5d s VAL 92 Ca 0.16 0.38 0.05 0.00 0.00 0.00 0.00 61.98 62.57 2c5d s VAL 92 Cb -0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 36.38 36.09 2c5d s VAL 92 CO 0.06 0.16 -0.22 -0.55 0.00 0.00 0.00 175.10 174.55 2c5d s SER 93 N 1.98 3.28 -0.12 3.32 0.15 -0.35 -0.73 113.70 121.23 2c5d s SER 93 Ca 0.02 -0.47 0.00 0.00 0.70 0.00 0.00 55.95 56.21 2c5d s SER 93 Cb -0.12 -1.01 0.02 0.00 -1.71 0.00 0.00 66.02 63.20 2c5d s SER 93 CO -0.04 0.23 -0.11 0.00 1.20 0.00 0.00 173.24 174.53 2c5d s GLN 94 N -0.09 1.83 0.12 5.44 -2.07 -0.97 -1.81 119.66 122.10 2c5d s GLN 94 Ca -0.05 -0.38 -0.24 0.00 -1.82 0.00 0.00 55.36 52.87 2c5d s GLN 94 Cb -0.14 -1.74 -0.07 0.00 -1.09 0.00 0.00 33.01 29.96 2c5d s GLN 94 CO 0.04 -0.21 0.72 -1.17 -1.32 0.00 0.00 175.29 173.35 2c5d s LEU 95 N 1.47 4.55 -0.08 2.60 2.96 -0.02 -1.58 118.68 128.57 2c5d s LEU 95 Ca 0.02 1.51 0.03 0.00 -0.22 0.00 0.00 54.13 55.47 2c5d s LEU 95 Cb -0.13 -3.18 0.01 0.00 0.50 0.00 0.00 46.19 43.39 2c5d s LEU 95 CO -0.07 0.20 -0.18 -0.60 -1.32 0.00 0.00 176.35 174.38 2c5d s ARG 96 N -0.96 2.34 -0.23 1.98 3.52 -0.22 -1.43 118.95 123.94 2c5d s ARG 96 Ca 0.34 -0.64 -0.07 0.00 -0.13 0.00 0.00 55.73 55.24 2c5d s ARG 96 Cb -0.22 -1.83 -0.03 0.00 -1.56 0.00 0.00 34.95 31.32 2c5d s ARG 96 CO 0.24 0.10 0.05 0.42 -0.81 0.00 0.00 175.30 175.29 2c5d s ILE 97 N 0.51 4.20 0.00 4.11 1.01 -0.18 -4.23 121.20 126.62 2c5d s ILE 97 Ca -0.17 -0.22 0.00 0.00 0.00 0.00 0.00 60.65 60.27 2c5d s ILE 97 Cb -0.17 -2.94 0.00 0.00 0.01 0.00 0.00 42.46 39.36 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 4.64 0.00 -2.61 2.92 -2.24 -1.26 -0.94 114.28 114.79 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 0.52 -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 6.28 -0.14 3.42 0.15 -1.26 -2.37 113.70 118.54 2c5d s SER 99 Ca 0.00 -0.89 -0.31 0.00 0.70 0.00 0.00 55.95 55.45 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 -1.66 2.08 -0.11 1.20 0.00 0.00 173.24 174.75 2c5d n LEU 100 N 8.89 3.41 0.00 3.45 7.94 -0.24 -4.60 117.00 135.85 2c5d n LEU 100 Ca 0.12 0.59 0.00 0.00 -1.11 0.00 0.00 56.01 55.61 2c5d n LEU 100 Cb 0.49 -1.47 0.00 0.00 0.53 0.00 0.00 43.42 42.97 2c5d n LEU 100 CO 0.68 -0.31 0.00 0.00 -1.11 0.00 0.00 177.39 176.65 2c5d n GLN 101 N 7.88 3.62 -0.02 1.96 10.64 -1.26 0.01 117.38 140.20 2c5d n GLN 101 Ca 0.27 0.00 -0.16 0.00 -1.83 0.00 0.00 57.00 55.28 2c5d n GLN 101 Cb 0.37 0.00 -0.12 0.00 -0.86 0.00 0.00 30.24 29.63 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 0.20 -1.42 2.61 5.85 -2.01 -3.35 115.31 117.20 2c5d h LEU 102 Ca 0.00 -0.85 0.10 0.00 0.84 0.00 0.00 57.88 57.97 2c5d h LEU 102 Cb 0.00 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 40.92 2c5d h LEU 102 CO 0.00 1.04 0.49 0.77 -0.34 0.00 0.00 178.44 180.40 2c5d h SER 103 N -0.60 0.58 0.00 1.25 4.64 -2.00 -1.58 113.55 115.83 2c5d h SER 103 Ca -0.04 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2c5d h SER 103 Cb 1.10 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 2c5d h SER 103 CO 0.05 0.34 0.00 0.47 -0.87 0.00 0.00 176.83 176.83 2c5d n ASP 104 N -4.50 0.00 -4.71 4.97 10.43 -1.26 -4.68 116.55 116.81 2c5d n ASP 104 Ca 0.13 0.01 -0.42 0.00 2.57 0.00 0.00 54.79 57.08 2c5d n ASP 104 Cb 0.35 -0.03 -0.03 0.00 1.84 0.00 0.00 41.12 43.25 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 4.65 -4.21 -3.53 -1.32 -0.60 -4.80 115.64 103.79 2c5d s THR 105 Ca 0.01 1.96 0.00 0.00 -1.21 0.00 0.00 61.69 62.45 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 0.01 0.18 0.00 0.61 -2.21 0.00 0.00 174.62 173.21 2c5d n GLY 106 N 2.81 -1.25 3.64 6.08 0.00 -0.51 -4.99 105.19 110.97 2c5d n GLY 106 Ca 0.06 -1.14 -0.36 0.00 0.00 0.00 0.00 46.02 44.57 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 -1.68 4.03 0.07 1.61 -0.21 -1.26 -0.39 119.66 121.82 2c5d s GLN 107 Ca 0.00 -0.30 0.07 0.00 0.02 0.00 0.00 55.36 55.15 2c5d s GLN 107 Cb 0.00 -3.48 -0.04 0.00 1.00 0.00 0.00 33.01 30.50 2c5d s GLN 107 CO 0.00 0.07 -0.15 0.71 -2.12 0.00 0.00 175.29 173.80 2c5d s TYR 108 N 1.01 2.64 0.04 0.91 1.51 0.52 -0.45 117.35 123.52 2c5d s TYR 108 Ca 0.07 -0.21 -0.23 0.00 -1.01 0.00 0.00 57.07 55.69 2c5d s TYR 108 Cb -0.13 -1.45 0.05 0.00 -0.11 0.00 0.00 41.96 40.32 2c5d s TYR 108 CO 0.04 0.34 0.54 1.14 -1.11 0.00 0.00 175.55 176.50 2c5d s GLN 109 N -1.79 1.03 0.25 -0.62 -2.07 0.15 -0.15 119.66 116.47 2c5d s GLN 109 Ca 0.17 -0.17 -0.13 0.00 -1.82 0.00 0.00 55.36 53.41 2c5d s GLN 109 Cb -0.11 0.47 -0.08 0.00 -1.09 0.00 0.00 33.01 32.21 2c5d s GLN 109 CO 0.09 -0.37 0.64 0.00 -1.32 0.00 0.00 175.29 174.33 2c5d s LEU 111 N -2.66 1.03 0.02 0.00 2.96 -0.07 -0.94 118.68 119.01 2c5d s LEU 111 Ca 0.48 -0.02 0.04 0.00 -0.22 0.00 0.00 54.13 54.40 2c5d s LEU 111 Cb -0.12 -0.23 -0.01 0.00 0.50 0.00 0.00 46.19 46.32 2c5d s LEU 111 CO 0.19 -0.12 -0.11 0.68 -1.32 0.00 0.00 176.35 175.67 2c5d s VAL 112 N 1.20 0.86 -0.34 1.68 -7.23 0.00 -0.82 120.40 115.76 2c5d s VAL 112 Ca -0.07 -0.70 -0.13 0.00 -1.81 0.00 0.00 61.98 59.27 2c5d s VAL 112 Cb -0.13 -0.77 -0.02 0.00 0.56 0.00 0.00 36.38 36.02 2c5d s VAL 112 CO -0.02 0.07 0.25 -0.36 -0.31 0.00 0.00 175.10 174.73 2c5d s PHE 113 N -0.58 3.23 -0.76 2.82 0.08 -1.26 -0.68 117.98 120.83 2c5d s PHE 113 Ca 0.01 -0.17 -0.02 0.00 0.12 0.00 0.00 56.93 56.87 2c5d s PHE 113 Cb -0.06 -2.48 0.19 0.00 -0.57 0.00 0.00 43.02 40.10 2c5d s PHE 113 CO 0.00 -0.35 0.61 -0.51 -0.10 0.00 0.00 175.22 174.87 2c5d s LEU 114 N 1.75 5.39 0.00 -0.37 1.43 -1.13 -4.90 118.68 120.85 2c5d s LEU 114 Ca 0.07 -3.31 0.00 0.00 -1.03 0.00 0.00 54.13 49.86 2c5d s LEU 114 Cb -0.17 -1.88 0.00 0.00 0.03 0.00 0.00 46.19 44.17 2c5d s LEU 114 CO 0.11 -0.27 0.00 0.61 0.23 0.00 0.00 176.35 177.02 2c5d n GLY 115 N 2.88 -0.32 0.00 -3.19 0.00 -1.26 -3.28 105.19 100.02 2c5d n GLY 115 Ca 0.15 -1.36 0.13 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.03 1.61 8.25 -1.26 -4.80 115.22 116.99 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 -0.24 0.09 0.00 1.12 0.00 0.00 29.99 30.97 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 -2.47 1.90 0.01 -0.41 0.74 -1.21 -5.11 119.66 113.11 2c5d s GLN 117 Ca 0.28 -0.11 0.00 0.00 0.05 0.00 0.00 55.36 55.59 2c5d s GLN 117 Cb 0.18 -2.03 -0.01 0.00 1.10 0.00 0.00 33.01 32.25 2c5d s GLN 117 CO 0.40 -1.55 -0.02 0.99 -0.55 0.00 0.00 175.29 174.55 2c5d s THR 118 N -3.48 0.09 -0.02 -0.34 2.01 -1.26 -2.82 115.64 109.82 2c5d s THR 118 Ca 0.63 -0.47 0.01 0.00 0.31 0.00 0.00 61.69 62.16 2c5d s THR 118 Cb -0.10 -0.17 0.01 0.00 0.01 0.00 0.00 72.50 72.25 2c5d s THR 118 CO 0.48 -0.24 -0.04 -0.36 -0.69 0.00 0.00 174.62 173.77 2c5d s PHE 119 N -0.73 0.48 0.07 4.92 0.40 0.15 -4.94 117.98 118.32 2c5d s PHE 119 Ca -0.08 -0.09 0.08 0.00 -0.60 0.00 0.00 56.93 56.25 2c5d s PHE 119 Cb -0.05 -0.39 -0.03 0.00 0.51 0.00 0.00 43.02 43.06 2c5d s PHE 119 CO -0.00 -0.07 -0.22 0.08 0.70 0.00 0.00 175.22 175.70 2c5d s VAL 120 N 0.32 1.83 0.65 -0.44 1.01 -1.26 -0.82 120.40 121.70 2c5d s VAL 120 Ca -0.03 -1.39 -0.06 0.00 0.00 0.00 0.00 61.98 60.50 2c5d s VAL 120 Cb -0.07 -1.61 0.04 0.00 0.00 0.00 0.00 36.38 34.74 2c5d s VAL 120 CO -0.00 0.15 0.95 -0.94 0.00 0.00 0.00 175.10 175.26 2c5d s SER 121 N -1.48 5.18 1.00 3.32 1.04 -0.12 -4.97 113.70 117.67 2c5d s SER 121 Ca 0.09 0.55 -0.11 0.00 0.48 0.00 0.00 55.95 56.96 2c5d s SER 121 Cb -0.09 -1.36 0.19 0.00 0.10 0.00 0.00 66.02 64.85 2c5d s SER 121 CO 0.03 -1.34 1.10 -1.58 0.98 0.00 0.00 173.24 172.42 2c5d s GLN 122 N -5.11 0.39 0.37 4.02 2.00 -1.26 -4.61 119.66 115.46 2c5d s GLN 122 Ca 0.57 1.21 0.03 0.00 -2.00 0.00 0.00 55.36 55.17 2c5d s GLN 122 Cb -0.11 -1.68 -0.01 0.00 0.80 0.00 0.00 33.01 32.01 2c5d s GLN 122 CO 0.45 -2.95 0.55 -1.25 -0.50 0.00 0.00 175.29 171.58 2c5d s PRO 123 N -4.62 3.18 0.06 1.67 0.04 -1.26 -4.30 135.00 129.76 2c5d s PRO 123 Ca 0.67 -0.69 0.02 0.00 0.04 0.00 0.00 61.00 61.04 2c5d s PRO 123 Cb -0.23 -2.70 -0.03 0.00 0.04 0.00 0.00 34.50 31.58 2c5d s PRO 123 CO 0.60 -0.02 -0.08 0.20 0.04 0.00 0.00 177.00 177.74 2c5d s GLY 124 N -4.15 0.62 -0.02 0.56 0.00 0.79 -4.72 107.32 100.39 2c5d s GLY 124 Ca 0.45 -0.96 0.05 0.00 0.00 0.00 0.00 44.72 44.26 2c5d s GLY 124 CO 0.34 -1.03 -0.19 -0.19 0.00 0.00 0.00 173.10 172.04 2c5d s TYR 125 N -2.04 1.71 -0.17 1.90 1.51 -1.21 0.20 117.35 119.24 2c5d s TYR 125 Ca -0.03 -0.37 0.01 0.00 -1.01 0.00 0.00 57.07 55.67 2c5d s TYR 125 Cb -0.05 -1.11 0.03 0.00 -0.11 0.00 0.00 41.96 40.71 2c5d s TYR 125 CO -0.01 -0.07 -0.15 0.14 -1.11 0.00 0.00 175.55 174.36 2c5d s VAL 126 N -0.32 1.75 0.02 0.71 -7.23 0.47 -2.55 120.40 113.26 2c5d s VAL 126 Ca 0.04 -0.84 0.07 0.00 -1.81 0.00 0.00 61.98 59.44 2c5d s VAL 126 Cb -0.08 -1.67 -0.02 0.00 0.56 0.00 0.00 36.38 35.16 2c5d s VAL 126 CO 0.00 0.40 -0.21 -0.83 -0.31 0.00 0.00 175.10 174.14 2c5d s GLY 127 N 1.40 1.12 0.11 2.32 0.00 -1.00 -1.42 107.32 109.84 2c5d s GLY 127 Ca 0.03 -1.03 -0.30 0.00 0.00 0.00 0.00 44.72 43.42 2c5d s GLY 127 CO -0.11 -0.92 1.02 -2.27 0.00 0.00 0.00 173.10 170.82 2c5d s LEU 128 N -0.94 4.47 -0.30 0.66 2.96 -1.26 -2.37 118.68 121.90 2c5d s LEU 128 Ca 0.08 1.86 -0.04 0.00 -0.22 0.00 0.00 54.13 55.81 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 0.01 -0.17 0.81 -0.70 -1.32 0.00 0.00 176.35 174.99 2c5d s GLU 129 N 0.16 0.37 0.00 1.98 2.12 0.87 -4.72 118.70 119.48 2c5d s GLU 129 Ca 0.49 0.46 0.00 0.00 0.36 0.00 0.00 54.97 56.29 2c5d s GLU 129 Cb -0.25 0.23 0.00 0.00 0.26 0.00 0.00 34.13 34.38 2c5d s GLU 129 CO 0.31 -0.58 0.00 0.41 -0.54 0.00 0.00 175.26 174.85 2c5d n GLY 130 N 5.34 2.81 3.50 -1.50 0.00 -0.80 -3.35 105.19 111.18 2c5d n GLY 130 Ca 0.03 -1.11 -0.28 0.00 0.00 0.00 0.00 46.02 44.65 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 0.86 0.55 0.99 1.43 -1.26 -3.83 118.68 117.42 2c5d s LEU 131 Ca 0.00 1.50 -0.21 0.00 -1.03 0.00 0.00 54.13 54.38 2c5d s LEU 131 Cb 0.00 -3.42 -0.05 0.00 0.03 0.00 0.00 46.19 42.76 2c5d s LEU 131 CO 0.00 -4.17 1.32 -2.84 0.23 0.00 0.00 176.35 170.89 2c5d s PRO 132 N -4.49 3.15 -0.16 1.29 0.02 -1.26 -4.86 135.00 128.69 2c5d s PRO 132 Ca 0.68 2.13 -0.00 0.00 0.02 0.00 0.00 61.00 63.84 2c5d s PRO 132 Cb -0.25 -2.22 -0.00 0.00 0.02 0.00 0.00 34.50 32.06 2c5d s PRO 132 CO 0.64 -1.15 -0.14 -0.47 -0.33 0.00 0.00 177.00 175.55 2c5d s TYR 133 N -1.36 2.80 0.40 6.54 5.04 0.06 -4.81 117.35 126.02 2c5d s TYR 133 Ca 0.72 -1.02 -0.23 0.00 -2.44 0.00 0.00 57.07 54.11 2c5d s TYR 133 Cb -0.38 -1.91 -0.10 0.00 0.35 0.00 0.00 41.96 39.92 2c5d s TYR 133 CO 0.44 -0.47 0.96 -0.06 -1.34 0.00 0.00 175.55 175.09 2c5d s PHE 134 N 0.85 3.41 -0.02 4.97 0.40 -1.26 -0.53 117.98 125.80 2c5d s PHE 134 Ca -0.04 1.66 0.03 0.00 -0.60 0.00 0.00 56.93 57.98 2c5d s PHE 134 Cb -0.15 -2.90 -0.04 0.00 0.51 0.00 0.00 43.02 40.44 2c5d s PHE 134 CO -0.00 -0.08 0.02 1.28 0.70 0.00 0.00 175.22 177.14 2c5d n LEU 135 N -0.25 0.00 -3.72 -0.37 4.77 -1.01 -4.87 117.00 111.54 2c5d n LEU 135 Ca 0.05 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.92 2c5d n LEU 135 Cb 0.52 0.05 -0.11 0.00 -2.33 0.00 0.00 43.42 41.56 2c5d n LEU 135 CO 0.40 0.05 0.02 -0.70 -1.33 0.00 0.00 177.39 175.83 2c5d s GLU 136 N -2.10 0.38 0.11 3.23 2.12 -1.22 -4.94 118.70 116.28 2c5d s GLU 136 Ca -0.01 0.62 0.07 0.00 0.36 0.00 0.00 54.97 56.00 2c5d s GLU 136 Cb 0.01 0.07 -0.04 0.00 0.26 0.00 0.00 34.13 34.43 2c5d s GLU 136 CO 0.12 -0.11 -0.17 -1.21 -0.54 0.00 0.00 175.26 173.34 2c5d s GLU 137 N 0.83 1.06 -0.03 4.30 2.02 -1.26 -1.76 118.70 123.86 2c5d s GLU 137 Ca -0.05 -1.17 -0.37 0.00 0.02 0.00 0.00 54.97 53.39 2c5d s GLU 137 Cb -0.06 -1.14 -0.16 0.00 0.10 0.00 0.00 34.13 32.87 2c5d s GLU 137 CO -0.06 0.25 1.51 -0.35 0.02 0.00 0.00 175.26 176.62 2c5d n PRO 138 N 0.87 1.28 -3.44 0.39 -0.04 -1.01 -4.78 135.00 128.26 2c5d n PRO 138 Ca -0.18 0.46 -0.24 0.00 -0.04 0.00 0.00 63.50 63.50 2c5d n PRO 138 Cb 0.55 -2.14 -0.01 0.00 -0.04 0.00 0.00 33.50 31.86 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 1.61 3.49 0.29 0.54 2.02 -1.26 -4.43 118.70 120.96 2c5d s GLU 139 Ca 0.89 -0.34 -0.29 0.00 0.02 0.00 0.00 54.97 55.24 2c5d s GLU 139 Cb -0.96 -2.69 -0.09 0.00 0.10 0.00 0.00 34.13 30.49 2c5d s GLU 139 CO 0.52 0.19 1.08 -0.51 0.02 0.00 0.00 175.26 176.57 2c5d s ASP 140 N -3.91 7.26 0.12 -0.19 -0.00 -1.26 -4.63 116.67 114.06 2c5d s ASP 140 Ca 0.40 2.23 -0.05 0.00 -0.00 0.00 0.00 52.55 55.13 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 -0.14 0.14 -0.13 -0.00 0.00 0.00 175.17 175.38 2c5d s ARG 141 N -1.50 0.91 -0.32 8.23 0.52 -1.10 -4.99 118.95 120.71 2c5d s ARG 141 Ca 0.45 -1.21 -0.02 0.00 -0.52 0.00 0.00 55.73 54.43 2c5d s ARG 141 Cb -0.31 0.30 0.11 0.00 0.52 0.00 0.00 34.95 35.57 2c5d s ARG 141 CO 0.39 -0.28 0.14 -0.08 0.02 0.00 0.00 175.30 175.49 2c5d s THR 142 N -3.96 0.36 0.18 0.02 -1.32 -1.26 0.44 115.64 110.10 2c5d s THR 142 Ca 0.14 -1.22 0.06 0.00 -1.21 0.00 0.00 61.69 59.46 2c5d s THR 142 Cb 0.06 -1.29 -0.04 0.00 -1.51 0.00 0.00 72.50 69.72 2c5d s THR 142 CO -0.04 -0.76 0.09 0.68 -2.21 0.00 0.00 174.62 172.37 2c5d s VAL 143 N 1.68 4.16 0.45 5.08 -7.23 -0.19 -4.93 120.40 119.42 2c5d s VAL 143 Ca 0.11 -1.27 -0.23 0.00 -1.81 0.00 0.00 61.98 58.78 2c5d s VAL 143 Cb -0.18 -3.13 -0.08 0.00 0.56 0.00 0.00 36.38 33.55 2c5d s VAL 143 CO -0.25 -0.14 1.13 0.00 -0.31 0.00 0.00 175.10 175.53 2c5d s ALA 144 N -1.80 2.99 0.78 1.32 0.00 -1.26 -2.79 121.76 121.00 2c5d s ALA 144 Ca 0.30 0.86 -0.15 0.00 0.00 0.00 0.00 51.96 52.96 2c5d s ALA 144 Cb -0.09 -3.35 -0.01 0.00 0.00 0.00 0.00 23.12 19.66 2c5d s ALA 144 CO 0.22 -0.53 0.55 0.00 0.00 0.00 0.00 175.76 176.00 2c5d n ALA 145 N -0.41 -1.64 -3.37 0.00 0.00 -1.26 -2.98 120.51 110.84 2c5d n ALA 145 Ca 0.07 -0.33 -0.19 0.00 0.00 0.00 0.00 53.44 52.99 2c5d n ALA 145 Cb 0.49 -1.87 -0.03 0.00 0.00 0.00 0.00 19.45 18.03 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 -0.72 -1.52 -4.52 0.00 4.13 -1.12 -4.89 115.26 106.62 2c5d n ASN 146 Ca 0.10 -0.26 -0.32 0.00 1.68 0.00 0.00 54.58 55.78 2c5d n ASN 146 Cb 0.51 -1.38 -0.12 0.00 -1.54 0.00 0.00 39.78 37.25 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 -2.56 3.22 0.47 3.41 2.01 -1.16 -4.82 115.64 116.21 2c5d s THR 147 Ca 0.36 -0.95 -0.17 0.00 0.31 0.00 0.00 61.69 61.25 2c5d s THR 147 Cb -0.21 -2.37 -0.09 0.00 0.01 0.00 0.00 72.50 69.84 2c5d s THR 147 CO 0.44 0.39 0.94 -2.16 -0.69 0.00 0.00 174.62 173.54 2c5d s PRO 148 N -1.37 4.00 0.21 4.92 0.04 -0.61 -4.00 135.00 138.20 2c5d s PRO 148 Ca 0.16 0.92 -0.23 0.00 0.04 0.00 0.00 61.00 61.88 2c5d s PRO 148 Cb -0.11 -2.20 0.05 0.00 0.04 0.00 0.00 34.50 32.28 2c5d s PRO 148 CO 0.06 -0.16 0.86 -0.59 0.04 0.00 0.00 177.00 177.21 2c5d s PHE 149 N -2.45 -0.15 0.06 0.56 -0.12 -0.58 -5.01 117.98 110.30 2c5d s PHE 149 Ca 0.58 -0.23 0.04 0.00 -0.05 0.00 0.00 56.93 57.28 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 0.26 -1.01 -0.13 -0.80 -0.05 0.00 0.00 175.22 173.49 2c5d s ASN 150 N -2.94 1.48 0.30 1.98 0.01 -1.26 -0.43 114.94 114.08 2c5d s ASN 150 Ca 0.12 -0.59 0.11 0.00 -0.71 0.00 0.00 52.86 51.79 2c5d s ASN 150 Cb -0.03 -0.03 -0.05 0.00 0.41 0.00 0.00 41.25 41.54 2c5d s ASN 150 CO 0.04 -0.10 -0.15 -0.76 -1.51 0.00 0.00 177.10 174.62 2c5d s LEU 151 N -1.67 2.67 0.16 0.60 1.43 -0.28 -4.97 118.68 116.61 2c5d s LEU 151 Ca -0.04 -1.07 0.06 0.00 -1.03 0.00 0.00 54.13 52.04 2c5d s LEU 151 Cb -0.10 -1.09 -0.04 0.00 0.03 0.00 0.00 46.19 44.98 2c5d s LEU 151 CO 0.02 -0.05 -0.12 -0.44 0.23 0.00 0.00 176.35 175.99 2c5d s SER 152 N -3.56 2.04 -0.40 2.29 0.01 -1.26 -1.60 113.70 111.22 2c5d s SER 152 Ca 0.31 -0.98 0.04 0.00 1.31 0.00 0.00 55.95 56.63 2c5d s SER 152 Cb -0.02 -0.05 0.18 0.00 0.21 0.00 0.00 66.02 66.34 2c5d s SER 152 CO 0.16 -0.26 0.74 0.00 0.41 0.00 0.00 173.24 174.29 2c5d s GLN 154 N 1.73 3.51 -0.29 0.00 -0.21 -0.72 -3.28 119.66 120.40 2c5d s GLN 154 Ca 0.18 -0.34 -0.15 0.00 0.02 0.00 0.00 55.36 55.06 2c5d s GLN 154 Cb -0.02 -2.75 0.13 0.00 1.00 0.00 0.00 33.01 31.37 2c5d s GLN 154 CO -0.08 0.28 0.86 0.00 -2.12 0.00 0.00 175.29 174.23 2c5d s ALA 155 N -2.08 -2.24 0.37 6.09 0.00 -1.26 -2.41 121.76 120.23 2c5d s ALA 155 Ca 0.39 2.25 0.07 0.00 0.00 0.00 0.00 51.96 54.67 2c5d s ALA 155 Cb -0.10 -1.72 -0.01 0.00 0.00 0.00 0.00 23.12 21.29 2c5d s ALA 155 CO 0.32 -0.56 0.47 1.14 0.00 0.00 0.00 175.76 177.12 2c5d s GLN 156 N 1.86 2.90 0.00 0.00 -2.07 0.32 -4.84 119.66 117.83 2c5d s GLN 156 Ca -0.08 -1.19 0.00 0.00 -1.82 0.00 0.00 55.36 52.27 2c5d s GLN 156 Cb -0.06 -2.70 0.00 0.00 -1.09 0.00 0.00 33.01 29.16 2c5d s GLN 156 CO -0.17 -0.07 0.00 0.41 -1.32 0.00 0.00 175.29 174.14 2c5d n GLY 157 N -1.66 2.26 3.91 2.60 0.00 -1.26 -0.76 105.19 110.28 2c5d n GLY 157 Ca 0.03 -1.84 -0.27 0.00 0.00 0.00 0.00 46.02 43.94 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 4.19 3.05 0.69 1.61 0.04 -1.26 -4.76 135.00 138.56 2c5d s PRO 158 Ca 0.00 0.12 -0.11 0.00 0.04 0.00 0.00 61.00 61.04 2c5d s PRO 158 Cb 0.00 -2.25 0.01 0.00 0.04 0.00 0.00 34.50 32.29 2c5d s PRO 158 CO 0.00 -0.65 1.07 -1.25 0.04 0.00 0.00 177.00 176.21 2c5d s PRO 159 N -5.00 2.96 0.37 0.56 0.04 -1.25 -1.91 135.00 130.77 2c5d s PRO 159 Ca 0.53 0.68 0.08 0.00 0.04 0.00 0.00 61.00 62.33 2c5d s PRO 159 Cb -0.11 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.39 2c5d s PRO 159 CO 0.46 -1.01 0.25 -1.21 0.04 0.00 0.00 177.00 175.53 2c5d s GLU 160 N -5.21 2.48 0.53 4.56 2.02 -1.26 -4.67 118.70 117.15 2c5d s GLU 160 Ca 0.58 -1.53 -0.10 0.00 0.02 0.00 0.00 54.97 53.94 2c5d s GLU 160 Cb -0.12 -2.28 -0.05 0.00 0.10 0.00 0.00 34.13 31.78 2c5d s GLU 160 CO 0.54 -0.02 0.90 -1.25 0.02 0.00 0.00 175.26 175.45 2c5d s PRO 161 N -3.97 3.65 -0.17 0.39 0.04 -1.26 -4.92 135.00 128.76 2c5d s PRO 161 Ca 0.42 0.55 -0.01 0.00 0.04 0.00 0.00 61.00 62.00 2c5d s PRO 161 Cb -0.03 -2.23 -0.00 0.00 0.04 0.00 0.00 34.50 32.28 2c5d s PRO 161 CO 0.25 -0.33 -0.13 0.14 0.04 0.00 0.00 177.00 176.97 2c5d s VAL 162 N -2.84 2.76 -0.09 -0.36 -7.23 -1.26 -4.62 120.40 106.76 2c5d s VAL 162 Ca 0.52 -0.73 -0.15 0.00 -1.81 0.00 0.00 61.98 59.81 2c5d s VAL 162 Cb -0.11 -2.19 -0.05 0.00 0.56 0.00 0.00 36.38 34.60 2c5d s VAL 162 CO 0.45 0.50 0.39 -1.81 -0.31 0.00 0.00 175.10 174.31 2c5d s ASP 163 N 1.03 6.64 0.52 4.85 1.01 -0.25 -4.87 116.67 125.60 2c5d s ASP 163 Ca -0.01 0.76 0.03 0.00 0.71 0.00 0.00 52.55 54.04 2c5d s ASP 163 Cb -0.15 -2.24 0.03 0.00 1.01 0.00 0.00 42.92 41.58 2c5d s ASP 163 CO -0.03 0.15 0.73 -0.76 0.21 0.00 0.00 175.17 175.47 2c5d s LEU 164 N -0.04 3.36 -0.30 1.23 1.43 -1.26 -0.42 118.68 122.68 2c5d s LEU 164 Ca 0.22 -0.18 -0.10 0.00 -1.03 0.00 0.00 54.13 53.04 2c5d s LEU 164 Cb -0.15 -2.72 0.18 0.00 0.03 0.00 0.00 46.19 43.53 2c5d s LEU 164 CO 0.09 -1.08 0.93 -0.22 0.23 0.00 0.00 176.35 176.30 2c5d s LEU 165 N -4.66 -0.71 0.80 1.79 2.96 -1.05 -0.37 118.68 117.44 2c5d s LEU 165 Ca 0.57 0.50 -0.12 0.00 -0.22 0.00 0.00 54.13 54.87 2c5d s LEU 165 Cb -0.10 1.62 0.07 0.00 0.50 0.00 0.00 46.19 48.29 2c5d s LEU 165 CO 0.37 -0.13 1.16 0.26 -1.32 0.00 0.00 176.35 176.69 2c5d s TRP 166 N 2.88 2.97 -0.07 5.38 0.52 -1.26 -1.36 118.94 127.99 2c5d s TRP 166 Ca 0.04 0.83 -0.05 0.00 0.02 0.00 0.00 56.10 56.94 2c5d s TRP 166 Cb -0.11 -3.40 0.02 0.00 -1.15 0.00 0.00 33.47 28.83 2c5d s TRP 166 CO -0.14 -1.73 0.17 -0.51 0.02 0.00 0.00 176.95 174.75 2c5d s LEU 167 N -5.60 1.22 -0.14 2.99 1.02 -1.15 -2.64 118.68 114.39 2c5d s LEU 167 Ca 0.61 0.35 0.02 0.00 0.02 0.00 0.00 54.13 55.13 2c5d s LEU 167 Cb -0.12 0.56 0.01 0.00 0.02 0.00 0.00 46.19 46.67 2c5d s LEU 167 CO 0.50 -0.08 -0.20 -1.58 0.02 0.00 0.00 176.35 175.02 2c5d s GLN 168 N 0.29 2.82 -1.45 1.70 0.74 0.20 -1.53 119.66 122.44 2c5d s GLN 168 Ca -0.02 -0.78 -0.03 0.00 0.05 0.00 0.00 55.36 54.59 2c5d s GLN 168 Cb -0.03 -2.34 0.02 0.00 1.10 0.00 0.00 33.01 31.77 2c5d s GLN 168 CO -0.01 -0.07 0.47 -0.25 -0.55 0.00 0.00 175.29 174.88 2c5d n ASP 169 N 4.23 -0.76 -1.86 6.67 8.00 0.15 0.07 116.55 133.06 2c5d n ASP 169 Ca -0.20 -1.01 -0.16 0.00 0.71 0.00 0.00 54.79 54.14 2c5d n ASP 169 Cb 0.51 -3.01 -0.00 0.00 -0.02 0.00 0.00 41.12 38.60 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 -0.50 -3.71 2.24 0.00 -1.26 -5.01 120.51 107.86 2c5d n ALA 170 Ca -0.26 0.14 -0.26 0.00 0.00 0.00 0.00 53.44 53.07 2c5d n ALA 170 Cb 0.66 -1.99 -0.17 0.00 0.00 0.00 0.00 19.45 17.95 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 -2.81 1.04 0.55 0.00 1.01 0.11 -5.08 120.40 115.22 2c5d s VAL 171 Ca 0.04 -0.36 -0.20 0.00 0.00 0.00 0.00 61.98 61.46 2c5d s VAL 171 Cb -0.02 -1.02 -0.06 0.00 0.00 0.00 0.00 36.38 35.28 2c5d s VAL 171 CO 0.05 0.35 1.06 -2.65 0.00 0.00 0.00 175.10 173.92 2c5d n PRO 172 N 4.43 1.17 -0.40 2.72 -0.02 -1.26 0.61 135.00 142.25 2c5d n PRO 172 Ca -0.18 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 0.23 0.00 -0.02 0.00 0.00 33.50 31.99 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 -0.53 3.61 -3.52 2.45 4.32 -1.08 -4.76 117.00 117.49 2c5d n LEU 173 Ca 0.12 -3.08 -0.08 0.00 -0.02 0.00 0.00 56.01 52.95 2c5d n LEU 173 Cb 0.45 -0.53 -0.02 0.00 -1.62 0.00 0.00 43.42 41.70 2c5d n LEU 173 CO 0.52 0.71 0.74 0.00 -1.22 0.00 0.00 177.39 178.14 2c5d s ALA 174 N -2.87 -1.87 0.11 -1.18 0.00 -1.26 -4.82 121.76 109.87 2c5d s ALA 174 Ca 0.40 1.16 -0.27 0.00 0.00 0.00 0.00 51.96 53.25 2c5d s ALA 174 Cb 0.33 0.22 -0.08 0.00 0.00 0.00 0.00 23.12 23.60 2c5d s ALA 174 CO 0.07 -0.63 1.63 1.15 0.00 0.00 0.00 175.76 177.98 2c5d h THR 175 N 2.06 0.41 -3.68 0.00 2.02 -1.94 -3.47 112.91 108.31 2c5d h THR 175 Ca -0.20 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 66.92 2c5d h THR 175 Cb 1.22 0.41 -0.10 0.00 -1.74 0.00 0.00 68.15 67.94 2c5d h THR 175 CO 0.30 0.00 -0.15 0.00 0.37 0.00 0.00 175.52 176.04 2c5d s ALA 176 N -6.05 -0.23 0.50 6.16 0.00 -1.26 -5.11 121.76 115.76 2c5d s ALA 176 Ca -0.16 -0.84 -0.21 0.00 0.00 0.00 0.00 51.96 50.75 2c5d s ALA 176 Cb 0.08 1.03 -0.10 0.00 0.00 0.00 0.00 23.12 24.14 2c5d s ALA 176 CO 0.65 -0.81 0.65 -2.30 0.00 0.00 0.00 175.76 173.95 2c5d n PRO 177 N -0.35 0.71 0.00 0.00 -0.02 -1.26 -1.87 135.00 132.21 2c5d n PRO 177 Ca -0.03 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 2c5d n PRO 177 Cb 0.62 -1.74 0.00 0.00 -0.02 0.00 0.00 33.50 32.37 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 1.64 2.99 3.83 -1.23 0.00 0.51 -4.90 105.19 108.03 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 -1.36 3.65 0.00 1.61 3.76 -0.78 -4.88 115.29 117.28 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 -2.19 0.00 0.00 1.11 0.00 0.00 32.58 31.50 2c5d s HIS 179 CO 0.00 0.61 0.00 0.41 -0.85 0.00 0.00 174.74 174.91 2c5d n GLY 180 N 2.12 -1.79 3.74 -2.22 0.00 -1.26 -4.73 105.19 101.05 2c5d n GLY 180 Ca -0.15 -1.90 -0.32 0.00 0.00 0.00 0.00 46.02 43.64 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 2.07 -0.14 1.61 0.04 -1.26 -5.06 135.00 132.25 2c5d s PRO 181 Ca 0.00 1.42 -0.27 0.00 0.04 0.00 0.00 61.00 62.19 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 -1.82 0.67 -0.65 0.04 0.00 0.00 177.00 175.23 2c5d s GLN 182 N -4.47 0.92 0.00 4.56 -0.21 -1.26 -4.52 119.66 114.68 2c5d s GLN 182 Ca 0.66 0.56 0.00 0.00 0.02 0.00 0.00 55.36 56.60 2c5d s GLN 182 Cb -0.21 0.44 0.00 0.00 1.00 0.00 0.00 33.01 34.24 2c5d s GLN 182 CO 0.51 -0.22 0.00 0.54 -2.12 0.00 0.00 175.29 174.01 2c5d n ARG 183 N 1.76 0.00 -3.29 2.91 1.74 -1.21 -4.66 116.66 113.91 2c5d n ARG 183 Ca -0.17 0.00 0.03 0.00 -0.77 0.00 0.00 57.85 56.94 2c5d n ARG 183 Cb 0.56 -2.86 -0.02 0.00 -1.02 0.00 0.00 32.46 29.12 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 -0.86 -0.95 -0.17 0.55 0.15 -1.26 -2.64 113.70 108.52 2c5d s SER 184 Ca 0.00 0.83 -0.02 0.00 0.70 0.00 0.00 55.95 57.46 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 -0.09 -0.22 1.20 0.00 0.00 173.24 173.95 2c5d s LEU 185 N 2.81 2.81 -0.20 3.45 0.20 -0.63 -4.89 118.68 122.23 2c5d s LEU 185 Ca 0.06 -0.35 -0.15 0.00 0.69 0.00 0.00 54.13 54.38 2c5d s LEU 185 Cb -0.11 -1.67 -0.04 0.00 -0.43 0.00 0.00 46.19 43.93 2c5d s LEU 185 CO -0.17 0.08 0.37 -2.28 -0.29 0.00 0.00 176.35 174.05 2c5d s HIS 186 N 0.87 3.37 -0.27 5.38 5.65 -1.26 -1.13 115.29 127.90 2c5d s HIS 186 Ca -0.02 0.57 -0.07 0.00 0.25 0.00 0.00 55.06 55.79 2c5d s HIS 186 Cb -0.15 -2.49 -0.01 0.00 -1.18 0.00 0.00 32.58 28.76 2c5d s HIS 186 CO 0.01 0.01 0.07 0.08 -0.65 0.00 0.00 174.74 174.25 2c5d s VAL 187 N 1.23 4.06 0.13 0.89 1.01 0.43 -4.99 120.40 123.15 2c5d s VAL 187 Ca 0.18 -0.46 -0.19 0.00 0.00 0.00 0.00 61.98 61.51 2c5d s VAL 187 Cb -0.14 -2.99 -0.05 0.00 0.00 0.00 0.00 36.38 33.20 2c5d s VAL 187 CO 0.07 0.22 1.77 -0.65 0.00 0.00 0.00 175.10 176.51 2c5d h PRO 188 N 8.23 0.34 -1.53 2.72 0.11 -1.88 -1.54 132.00 138.45 2c5d h PRO 188 Ca -0.35 -0.03 0.27 0.00 0.11 0.00 0.00 66.00 66.00 2c5d h PRO 188 Cb 1.15 -0.07 -0.16 0.00 0.11 0.00 0.00 31.00 32.02 2c5d h PRO 188 CO 0.60 0.25 0.79 0.20 -0.21 0.00 0.00 178.00 179.63 2c5d s GLY 189 N -2.47 -0.34 -0.05 -0.55 0.00 -1.26 -1.57 107.32 101.09 2c5d s GLY 189 Ca -0.13 1.23 -0.02 0.00 0.00 0.00 0.00 44.72 45.80 2c5d s GLY 189 CO 0.70 0.37 0.08 1.08 0.00 0.00 0.00 173.10 175.34 2c5d s LEU 190 N -2.48 0.25 -0.02 0.66 1.43 -1.26 -4.88 118.68 112.38 2c5d s LEU 190 Ca 0.11 0.15 0.11 0.00 -1.03 0.00 0.00 54.13 53.46 2c5d s LEU 190 Cb 0.01 -0.01 0.34 0.00 0.03 0.00 0.00 46.19 46.56 2c5d s LEU 190 CO -0.04 -0.23 1.25 -0.46 0.23 0.00 0.00 176.35 177.10 2c5d n ASN 191 N 5.09 2.21 -3.59 2.29 0.23 -1.26 -2.79 115.26 117.44 2c5d n ASN 191 Ca -0.08 -2.08 -0.08 0.00 -0.53 0.00 0.00 54.58 51.81 2c5d n ASN 191 Cb 0.50 -0.30 -0.05 0.00 -2.08 0.00 0.00 39.78 37.85 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 -1.57 0.49 0.14 -3.83 2.20 -1.26 -5.01 119.74 110.90 2c5d s LYS 192 Ca 0.25 0.08 -0.34 0.00 -0.36 0.00 0.00 55.97 55.60 2c5d s LYS 192 Cb 0.14 0.23 -0.14 0.00 -1.51 0.00 0.00 37.83 36.55 2c5d s LYS 192 CO 0.15 -0.16 1.61 2.41 -0.36 0.00 0.00 175.35 179.00 2c5d n THR 193 N 0.59 0.06 -4.41 3.43 -1.04 -1.26 -4.74 114.28 106.90 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 -1.57 -0.08 0.00 -1.82 0.00 0.00 70.33 67.44 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 1.21 2.23 0.02 8.00 0.01 -0.82 -4.97 113.70 119.37 2c5d s SER 194 Ca 0.80 -1.68 0.01 0.00 1.31 0.00 0.00 55.95 56.39 2c5d s SER 194 Cb -0.68 0.50 -0.01 0.00 0.21 0.00 0.00 66.02 66.04 2c5d s SER 194 CO 0.39 -0.96 -0.04 -0.94 0.41 0.00 0.00 173.24 172.10 2c5d s SER 195 N -3.50 0.37 0.02 2.44 1.04 -1.26 -0.24 113.70 112.58 2c5d s SER 195 Ca 0.31 -0.33 0.05 0.00 0.48 0.00 0.00 55.95 56.46 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 -0.16 -0.16 -0.36 0.98 0.00 0.00 173.24 173.73 2c5d s PHE 196 N -0.90 1.44 0.31 5.02 0.40 -0.19 0.34 117.98 124.40 2c5d s PHE 196 Ca -0.08 -0.33 0.00 0.00 -0.60 0.00 0.00 56.93 55.92 2c5d s PHE 196 Cb -0.06 -0.88 0.00 0.00 0.51 0.00 0.00 43.02 42.59 2c5d s PHE 196 CO -0.00 0.03 0.01 0.43 0.70 0.00 0.00 175.22 176.39 2c5d n SER 197 N 2.13 2.84 -3.15 1.36 7.64 -0.58 -0.94 113.62 122.91 2c5d n SER 197 Ca -0.17 -2.35 0.04 0.00 1.01 0.00 0.00 58.87 57.40 2c5d n SER 197 Cb 0.54 0.21 -0.00 0.00 -1.01 0.00 0.00 64.21 63.95 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 2.84 2.95 -0.10 0.00 2.02 -0.47 -1.76 118.70 124.18 2c5d s GLU 199 Ca 0.12 0.72 -0.04 0.00 0.02 0.00 0.00 54.97 55.80 2c5d s GLU 199 Cb -0.10 -2.01 0.05 0.00 0.10 0.00 0.00 34.13 32.17 2c5d s GLU 199 CO -0.25 -1.03 0.18 0.00 0.02 0.00 0.00 175.26 174.18 2c5d s ALA 200 N -3.18 -0.21 0.22 5.21 0.00 -0.93 -2.53 121.76 120.35 2c5d s ALA 200 Ca 0.58 0.57 0.11 0.00 0.00 0.00 0.00 51.96 53.22 2c5d s ALA 200 Cb -0.13 -0.89 -0.05 0.00 0.00 0.00 0.00 23.12 22.06 2c5d s ALA 200 CO 0.54 -0.64 -0.17 -1.01 0.00 0.00 0.00 175.76 174.48 2c5d s HIS 201 N 2.31 2.43 0.09 0.00 3.76 0.44 -1.50 115.29 122.82 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 -1.14 0.08 0.00 1.11 0.00 0.00 32.58 32.50 2c5d s HIS 201 CO -0.07 0.58 0.88 0.54 -0.85 0.00 0.00 174.74 175.82 2c5d s ASN 202 N -3.05 -0.31 0.49 1.40 2.20 -0.78 -1.09 114.94 113.79 2c5d s ASN 202 Ca 0.26 -0.20 0.32 0.00 -0.94 0.00 0.00 52.86 52.30 2c5d s ASN 202 Cb -0.07 0.47 1.10 0.00 -2.00 0.00 0.00 41.25 40.75 2c5d s ASN 202 CO 0.14 -0.81 1.20 0.00 -2.94 0.00 0.00 177.10 174.68 2c5d n ALA 203 N -0.36 1.21 0.12 3.54 0.00 -1.26 -0.13 120.51 123.63 2c5d n ALA 203 Ca -0.08 0.42 -0.24 0.00 0.00 0.00 0.00 53.44 53.53 2c5d n ALA 203 Cb 0.62 -0.72 -0.16 0.00 0.00 0.00 0.00 19.45 19.18 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 0.49 0.00 0.00 1.79 -1.93 -3.51 116.57 113.41 2c5d h LYS 204 Ca 0.60 -0.83 0.00 0.00 -2.18 0.00 0.00 60.65 58.24 2c5d h LYS 204 Cb 2.82 0.31 0.00 0.00 -1.58 0.00 0.00 32.23 33.78 2c5d h LYS 204 CO -0.01 1.40 0.00 0.41 -1.08 0.00 0.00 179.45 180.17 2c5d n GLY 205 N 1.73 -0.52 3.19 3.86 0.00 0.81 -4.92 105.19 109.35 2c5d n GLY 205 Ca -0.18 -0.86 -0.22 0.00 0.00 0.00 0.00 46.02 44.77 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 -3.57 1.33 -0.13 1.61 0.11 -1.26 -1.88 120.40 116.61 2c5d s VAL 206 Ca 0.00 -1.15 -0.01 0.00 -2.93 0.00 0.00 61.98 57.90 2c5d s VAL 206 Cb 0.00 -1.20 0.03 0.00 -1.53 0.00 0.00 36.38 33.69 2c5d s VAL 206 CO 0.00 0.03 -0.05 0.28 -3.33 0.00 0.00 175.10 172.04 2c5d s THR 207 N -0.91 0.92 0.18 5.04 -1.32 -0.57 -4.96 115.64 114.02 2c5d s THR 207 Ca 0.03 -0.39 -0.20 0.00 -1.21 0.00 0.00 61.69 59.93 2c5d s THR 207 Cb -0.09 -1.06 -0.08 0.00 -1.51 0.00 0.00 72.50 69.76 2c5d s THR 207 CO 0.02 0.21 0.69 0.42 -2.21 0.00 0.00 174.62 173.74 2c5d s THR 208 N 1.73 4.59 0.86 5.08 -4.23 -1.26 -2.18 115.64 120.23 2c5d s THR 208 Ca 0.03 1.29 -0.14 0.00 -1.18 0.00 0.00 61.69 61.69 2c5d s THR 208 Cb -0.14 -3.90 0.20 0.00 1.34 0.00 0.00 72.50 70.00 2c5d s THR 208 CO -0.08 0.33 1.17 -1.54 -0.54 0.00 0.00 174.62 173.96 2c5d n SER 209 N 1.05 0.17 -4.79 3.99 3.41 -0.72 -4.98 113.62 111.75 2c5d n SER 209 Ca -0.05 -1.47 -0.30 0.00 -0.26 0.00 0.00 58.87 56.79 2c5d n SER 209 Cb 0.51 -0.88 0.09 0.00 -0.26 0.00 0.00 64.21 63.66 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 -5.54 2.17 -0.36 4.33 1.70 -1.26 -4.66 118.95 115.32 2c5d s ARG 210 Ca 0.67 0.80 -0.16 0.00 -0.47 0.00 0.00 55.73 56.57 2c5d s ARG 210 Cb -0.02 -1.91 -0.00 0.00 -0.57 0.00 0.00 34.95 32.45 2c5d s ARG 210 CO 0.47 -1.60 0.41 0.99 -1.08 0.00 0.00 175.30 174.48 2c5d s THR 211 N -3.06 5.12 0.16 4.99 2.01 -1.26 -4.52 115.64 119.07 2c5d s THR 211 Ca 0.61 -0.01 -0.23 0.00 0.31 0.00 0.00 61.69 62.36 2c5d s THR 211 Cb -0.15 -3.91 -0.08 0.00 0.01 0.00 0.00 72.50 68.37 2c5d s THR 211 CO 0.55 -0.21 0.73 0.00 -0.69 0.00 0.00 174.62 175.01 2c5d s ALA 212 N 2.12 3.46 -0.23 7.40 0.00 -0.12 -4.91 121.76 129.48 2c5d s ALA 212 Ca 0.13 0.27 -0.02 0.00 0.00 0.00 0.00 51.96 52.34 2c5d s ALA 212 Cb -0.16 -2.88 0.02 0.00 0.00 0.00 0.00 23.12 20.09 2c5d s ALA 212 CO 0.12 0.32 -0.07 0.99 0.00 0.00 0.00 175.76 177.12 2c5d s THR 213 N -1.22 2.90 -0.30 0.00 2.01 -1.26 -1.03 115.64 116.75 2c5d s THR 213 Ca 0.36 -0.87 -0.15 0.00 0.31 0.00 0.00 61.69 61.34 2c5d s THR 213 Cb -0.21 -2.40 -0.03 0.00 0.01 0.00 0.00 72.50 69.87 2c5d s THR 213 CO 0.24 0.30 0.38 -0.63 -0.69 0.00 0.00 174.62 174.23 2c5d s ILE 214 N 1.36 5.16 -0.22 1.82 -1.09 0.66 -2.69 121.20 126.21 2c5d s ILE 214 Ca 0.02 0.40 -0.15 0.00 -2.23 0.00 0.00 60.65 58.69 2c5d s ILE 214 Cb -0.15 -3.76 -0.04 0.00 -1.58 0.00 0.00 42.46 36.93 2c5d s ILE 214 CO -0.05 0.05 0.37 -0.89 -1.23 0.00 0.00 174.94 173.19 2c5d s THR 215 N 2.09 5.21 0.12 2.92 2.01 0.17 -1.95 115.64 126.20 2c5d s THR 215 Ca 0.14 0.63 -0.05 0.00 0.31 0.00 0.00 61.69 62.72 2c5d s THR 215 Cb -0.16 -3.70 -0.05 0.00 0.01 0.00 0.00 72.50 68.60 2c5d s THR 215 CO 0.11 0.25 0.36 -0.69 -0.69 0.00 0.00 174.62 173.96 2c5d s VAL 216 N 1.40 5.18 -0.08 3.82 1.01 -1.26 -1.02 120.40 129.45 2c5d s VAL 216 Ca 0.17 0.09 -0.03 0.00 0.00 0.00 0.00 61.98 62.21 2c5d s VAL 216 Cb -0.15 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 2c5d s VAL 216 CO 0.08 0.11 -0.10 0.18 0.00 0.00 0.00 175.10 175.37 2c5d n LEU 217 N 0.31 0.80 0.00 3.92 4.77 -1.12 -4.79 117.00 120.90 2c5d n LEU 217 Ca -0.04 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 2c5d n LEU 217 Cb 0.52 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 2c5d n LEU 217 CO 0.47 0.21 0.00 0.09 -1.33 0.00 0.00 177.39 176.83