#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o5y s VAL 2 N 0.00 3.54 -0.02 1.69 1.01 -1.26 -4.08 120.40 121.29 2o5y s VAL 2 Ca 0.00 1.07 0.00 0.00 0.00 0.00 0.00 61.98 63.05 2o5y s VAL 2 Cb 0.00 -3.68 0.02 0.00 0.00 0.00 0.00 36.38 32.71 2o5y s VAL 2 CO 0.00 0.06 0.00 -1.10 0.00 0.00 0.00 175.10 174.06 2o5y s GLN 3 N 1.48 0.13 -0.21 2.72 -0.21 -1.02 -5.02 119.66 117.54 2o5y s GLN 3 Ca 0.63 0.06 0.01 0.00 0.02 0.00 0.00 55.36 56.09 2o5y s GLN 3 Cb -0.34 -0.27 0.04 0.00 1.00 0.00 0.00 33.01 33.44 2o5y s GLN 3 CO 0.29 -0.08 -0.11 -0.51 -2.12 0.00 0.00 175.29 172.76 2o5y s LEU 4 N 0.64 2.47 -0.27 2.90 1.02 -1.26 -1.42 118.68 122.76 2o5y s LEU 4 Ca -0.06 -0.96 0.01 0.00 0.02 0.00 0.00 54.13 53.14 2o5y s LEU 4 Cb -0.09 -1.31 0.05 0.00 0.02 0.00 0.00 46.19 44.86 2o5y s LEU 4 CO -0.01 -0.14 -0.07 -0.69 0.02 0.00 0.00 176.35 175.45 2o5y s VAL 5 N 1.34 2.55 0.29 -1.59 1.01 -0.50 -3.96 120.40 119.54 2o5y s VAL 5 Ca -0.02 -1.41 -0.05 0.00 0.00 0.00 0.00 61.98 60.50 2o5y s VAL 5 Cb -0.17 -2.43 -0.05 0.00 0.00 0.00 0.00 36.38 33.73 2o5y s VAL 5 CO -0.08 0.02 0.57 -1.10 0.00 0.00 0.00 175.10 174.50 2o5y s GLN 6 N 1.20 3.65 0.95 2.72 -0.21 -1.26 -1.43 119.66 125.28 2o5y s GLN 6 Ca -0.05 0.04 -0.11 0.00 0.02 0.00 0.00 55.36 55.26 2o5y s GLN 6 Cb -0.19 -2.63 0.16 0.00 1.00 0.00 0.00 33.01 31.35 2o5y s GLN 6 CO -0.04 0.20 1.11 -1.54 -2.12 0.00 0.00 175.29 172.90 2o5y s SER 7 N -3.12 2.77 1.35 5.90 1.04 -0.76 -4.95 113.70 115.92 2o5y s SER 7 Ca 0.44 1.91 -0.21 0.00 0.48 0.00 0.00 55.95 58.58 2o5y s SER 7 Cb -0.11 -2.46 0.34 0.00 0.10 0.00 0.00 66.02 63.90 2o5y s SER 7 CO 0.30 -3.15 0.97 -0.83 0.98 0.00 0.00 173.24 171.51 2o5y s GLY 8 N -2.83 1.46 0.44 7.32 0.00 -1.26 -4.65 107.32 107.79 2o5y s GLY 8 Ca 0.66 -0.73 -0.25 0.00 0.00 0.00 0.00 44.72 44.41 2o5y s GLY 8 CO 0.59 0.22 1.23 -1.55 0.00 0.00 0.00 173.10 173.59 2o5y n PRO 9 N -5.40 1.80 -4.66 2.90 -0.04 -1.26 -4.64 135.00 123.71 2o5y n PRO 9 Ca 0.11 0.64 -0.24 0.00 -0.04 0.00 0.00 63.50 63.98 2o5y n PRO 9 Cb 0.59 -2.35 -0.14 0.00 -0.04 0.00 0.00 33.50 31.56 2o5y n PRO 9 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2o5y s GLU 10 N -2.25 1.28 -0.16 0.54 0.41 -0.55 -4.59 118.70 113.38 2o5y s GLU 10 Ca 0.62 -0.74 0.00 0.00 -0.41 0.00 0.00 54.97 54.45 2o5y s GLU 10 Cb -0.50 -1.29 0.03 0.00 -1.78 0.00 0.00 34.13 30.58 2o5y s GLU 10 CO 0.57 0.34 -0.13 -1.17 -0.49 0.00 0.00 175.26 174.38 2o5y s LEU 11 N -0.79 1.76 0.02 1.80 2.96 -1.26 -0.56 118.68 122.62 2o5y s LEU 11 Ca 0.06 -0.55 0.04 0.00 -0.22 0.00 0.00 54.13 53.46 2o5y s LEU 11 Cb -0.07 -1.17 -0.02 0.00 0.50 0.00 0.00 46.19 45.43 2o5y s LEU 11 CO 0.00 -0.08 -0.12 -0.54 -1.32 0.00 0.00 176.35 174.30 2o5y s LYS 12 N 1.49 0.85 0.62 1.98 -0.14 0.12 -4.98 119.74 119.68 2o5y s LYS 12 Ca 0.04 -0.63 -0.17 0.00 -1.36 0.00 0.00 55.97 53.85 2o5y s LYS 12 Cb -0.13 -0.83 -0.02 0.00 -1.68 0.00 0.00 37.83 35.17 2o5y s LYS 12 CO -0.10 0.21 1.13 0.15 -0.76 0.00 0.00 175.35 175.98 2o5y s LYS 13 N -0.90 2.95 0.32 1.68 -0.14 -1.25 -1.32 119.74 121.07 2o5y s LYS 13 Ca 0.01 1.53 -0.29 0.00 -1.36 0.00 0.00 55.97 55.86 2o5y s LYS 13 Cb -0.07 -1.96 -0.11 0.00 -1.68 0.00 0.00 37.83 34.01 2o5y s LYS 13 CO 0.01 -1.16 1.52 -2.14 -0.76 0.00 0.00 175.35 172.83 2o5y s PRO 14 N -3.74 4.15 0.00 -1.68 0.02 -1.26 -2.25 135.00 130.23 2o5y s PRO 14 Ca 0.70 2.53 0.00 0.00 0.02 0.00 0.00 61.00 64.25 2o5y s PRO 14 Cb -0.23 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.27 2o5y s PRO 14 CO 0.36 -0.55 0.00 0.41 -0.33 0.00 0.00 177.00 176.89 2o5y n GLY 15 N 1.52 3.40 3.85 0.52 0.00 0.21 -4.86 105.19 109.83 2o5y n GLY 15 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 2o5y n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2o5y s GLU 16 N -0.80 1.49 0.07 1.61 2.02 -0.96 -3.73 118.70 118.40 2o5y s GLU 16 Ca 0.00 0.16 0.01 0.00 0.02 0.00 0.00 54.97 55.16 2o5y s GLU 16 Cb 0.00 -1.89 -0.04 0.00 0.10 0.00 0.00 34.13 32.30 2o5y s GLU 16 CO 0.00 -1.94 0.20 0.99 0.02 0.00 0.00 175.26 174.53 2o5y s THR 17 N -3.45 5.26 0.06 3.63 2.01 -1.26 -1.42 115.64 120.47 2o5y s THR 17 Ca 0.63 -0.47 0.06 0.00 0.31 0.00 0.00 61.69 62.22 2o5y s THR 17 Cb -0.12 -3.58 -0.03 0.00 0.01 0.00 0.00 72.50 68.78 2o5y s THR 17 CO 0.51 0.11 -0.16 0.54 -0.69 0.00 0.00 174.62 174.94 2o5y s VAL 18 N -1.52 1.25 -0.14 3.82 0.11 -0.13 -5.01 120.40 118.77 2o5y s VAL 18 Ca 0.34 -1.20 -0.01 0.00 -2.93 0.00 0.00 61.98 58.18 2o5y s VAL 18 Cb -0.13 -1.15 0.04 0.00 -1.53 0.00 0.00 36.38 33.62 2o5y s VAL 18 CO 0.27 -0.07 -0.01 -0.75 -3.33 0.00 0.00 175.10 171.22 2o5y s LYS 19 N -1.46 0.93 -0.01 1.54 2.47 -1.26 -1.34 119.74 120.61 2o5y s LYS 19 Ca 0.02 -0.27 0.02 0.00 -1.56 0.00 0.00 55.97 54.17 2o5y s LYS 19 Cb -0.09 -1.68 -0.03 0.00 -1.46 0.00 0.00 37.83 34.57 2o5y s LYS 19 CO 0.02 -0.45 -0.02 0.42 0.16 0.00 0.00 175.35 175.48 2o5y s ILE 20 N 1.82 4.00 0.39 5.43 1.01 0.21 -4.95 121.20 129.11 2o5y s ILE 20 Ca 0.02 -0.60 0.08 0.00 0.00 0.00 0.00 60.65 60.14 2o5y s ILE 20 Cb -0.15 -2.75 -0.07 0.00 0.01 0.00 0.00 42.46 39.50 2o5y s ILE 20 CO -0.07 0.42 -0.00 -0.94 0.00 0.00 0.00 174.94 174.35 2o5y s SER 21 N -1.39 3.90 -0.29 3.58 1.04 -1.26 -0.10 113.70 119.19 2o5y s SER 21 Ca 0.18 -1.29 0.04 0.00 0.48 0.00 0.00 55.95 55.35 2o5y s SER 21 Cb -0.11 -0.40 0.19 0.00 0.10 0.00 0.00 66.02 65.80 2o5y s SER 21 CO 0.08 -0.39 0.55 0.00 0.98 0.00 0.00 173.24 174.46 2o5y s LYS 23 N 2.77 4.15 0.06 0.00 2.47 -0.51 -1.56 119.74 127.11 2o5y s LYS 23 Ca 0.12 0.27 0.00 0.00 -1.56 0.00 0.00 55.97 54.79 2o5y s LYS 23 Cb -0.11 -3.58 -0.04 0.00 -1.46 0.00 0.00 37.83 32.64 2o5y s LYS 23 CO -0.26 -0.15 0.19 0.00 0.16 0.00 0.00 175.35 175.30 2o5y s ALA 24 N 1.65 3.96 0.16 3.13 0.00 -0.67 -1.42 121.76 128.57 2o5y s ALA 24 Ca 0.20 -0.85 -0.12 0.00 0.00 0.00 0.00 51.96 51.19 2o5y s ALA 24 Cb -0.15 -1.79 0.01 0.00 0.00 0.00 0.00 23.12 21.18 2o5y s ALA 24 CO 0.09 0.82 0.36 -1.54 0.00 0.00 0.00 175.76 175.49 2o5y s SER 25 N -2.46 -0.07 -0.24 0.00 1.04 -0.51 -4.83 113.70 106.63 2o5y s SER 25 Ca 0.34 -0.66 0.00 0.00 0.48 0.00 0.00 55.95 56.11 2o5y s SER 25 Cb -0.13 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.46 2o5y s SER 25 CO 0.27 -0.92 0.00 0.61 0.98 0.00 0.00 173.24 174.18 2o5y n GLY 26 N -0.24 0.40 3.57 7.32 0.00 -1.26 -2.42 105.19 112.57 2o5y n GLY 26 Ca -0.10 -0.87 -0.06 0.00 0.00 0.00 0.00 46.02 45.00 2o5y n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2o5y s TYR 27 N -2.11 -0.20 -0.52 1.61 1.13 -1.26 -4.14 117.35 111.86 2o5y s TYR 27 Ca 0.00 0.14 -0.29 0.00 -1.41 0.00 0.00 57.07 55.51 2o5y s TYR 27 Cb 0.00 0.52 -0.11 0.00 -1.10 0.00 0.00 41.96 41.27 2o5y s TYR 27 CO 0.00 -0.30 2.40 -1.33 -2.51 0.00 0.00 175.55 173.81 2o5y n MET 28 N -0.08 0.97 -0.07 -3.49 2.81 -1.26 -4.88 117.12 111.12 2o5y n MET 28 Ca -0.03 0.13 -0.08 0.00 -1.81 0.00 0.00 57.70 55.91 2o5y n MET 28 Cb 0.59 -2.85 -0.01 0.00 -0.71 0.00 0.00 33.22 30.25 2o5y n MET 28 CO 0.00 0.00 0.00 0.35 1.51 0.00 0.00 175.97 177.83 2o5y h PHE 29 N 16.09 0.05 0.00 2.03 3.57 -1.96 -2.70 116.94 134.01 2o5y h PHE 29 Ca -0.23 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.29 2o5y h PHE 29 Cb 1.29 0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.04 2o5y h PHE 29 CO 0.98 -0.00 0.00 0.25 -2.23 0.00 0.00 178.31 177.31 2o5y n THR 30 N -5.11 0.93 1.43 4.41 -2.24 -1.26 -3.06 114.28 109.37 2o5y n THR 30 Ca -0.01 0.27 0.14 0.00 -2.27 0.00 0.00 64.05 62.18 2o5y n THR 30 Cb 0.12 -1.14 0.50 0.00 -2.10 0.00 0.00 70.33 67.71 2o5y n THR 30 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2o5y n ASN 31 N -1.97 1.16 -4.02 3.42 4.13 -1.02 -3.42 115.26 113.55 2o5y n ASN 31 Ca 0.02 -1.17 -0.13 0.00 1.68 0.00 0.00 54.58 54.98 2o5y n ASN 31 Cb 0.19 0.04 -0.12 0.00 -1.54 0.00 0.00 39.78 38.35 2o5y n ASN 31 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 2o5y s TYR 32 N -2.22 0.55 0.70 3.10 1.51 -1.17 -4.92 117.35 114.89 2o5y s TYR 32 Ca 0.33 -0.37 -0.15 0.00 -1.01 0.00 0.00 57.07 55.86 2o5y s TYR 32 Cb 0.20 -0.34 0.02 0.00 -0.11 0.00 0.00 41.96 41.74 2o5y s TYR 32 CO 0.42 -0.07 1.18 0.20 -1.11 0.00 0.00 175.55 176.16 2o5y s GLY 33 N -1.12 2.32 -0.18 0.71 0.00 -0.88 -4.48 107.32 103.68 2o5y s GLY 33 Ca -0.07 0.79 -0.00 0.00 0.00 0.00 0.00 44.72 45.43 2o5y s GLY 33 CO 0.00 1.17 -0.16 -0.29 0.00 0.00 0.00 173.10 173.83 2o5y s MET 34 N -3.92 3.12 0.13 2.90 1.75 -0.85 -0.16 119.30 122.27 2o5y s MET 34 Ca 0.72 -0.77 0.03 0.00 -1.25 0.00 0.00 55.69 54.42 2o5y s MET 34 Cb -0.26 -2.66 -0.04 0.00 2.84 0.00 0.00 34.83 34.71 2o5y s MET 34 CO 0.43 -0.15 0.17 -0.80 -0.65 0.00 0.00 175.02 174.02 2o5y s ASN 35 N 1.20 5.80 -0.06 1.11 0.01 -0.64 -0.72 114.94 121.64 2o5y s ASN 35 Ca 0.02 0.01 0.03 0.00 -0.71 0.00 0.00 52.86 52.21 2o5y s ASN 35 Cb -0.14 -1.61 0.00 0.00 0.41 0.00 0.00 41.25 39.91 2o5y s ASN 35 CO -0.08 0.10 -0.16 0.26 -1.51 0.00 0.00 177.10 175.71 2o5y s TRP 36 N -1.65 1.75 -0.11 2.20 0.52 -0.44 -1.13 118.94 120.09 2o5y s TRP 36 Ca 0.32 -0.62 0.03 0.00 0.02 0.00 0.00 56.10 55.85 2o5y s TRP 36 Cb -0.11 -1.22 0.01 0.00 -1.15 0.00 0.00 33.47 31.00 2o5y s TRP 36 CO 0.25 -0.27 -0.19 0.08 0.02 0.00 0.00 176.95 176.84 2o5y s VAL 37 N 0.38 1.77 0.04 4.03 1.01 0.28 -1.14 120.40 126.78 2o5y s VAL 37 Ca -0.12 -0.82 -0.19 0.00 0.00 0.00 0.00 61.98 60.86 2o5y s VAL 37 Cb -0.15 -1.57 -0.06 0.00 0.00 0.00 0.00 36.38 34.60 2o5y s VAL 37 CO 0.04 0.49 0.54 -0.75 0.00 0.00 0.00 175.10 175.43 2o5y s LYS 38 N 0.73 4.17 -0.25 2.72 2.20 0.46 -0.33 119.74 129.44 2o5y s LYS 38 Ca -0.11 0.67 -0.03 0.00 -0.36 0.00 0.00 55.97 56.14 2o5y s LYS 38 Cb -0.16 -3.25 0.09 0.00 -1.51 0.00 0.00 37.83 32.99 2o5y s LYS 38 CO 0.02 0.60 0.10 -1.14 -0.36 0.00 0.00 175.35 174.57 2o5y s GLN 39 N -0.94 0.37 0.46 4.03 0.74 0.10 -1.06 119.66 123.36 2o5y s GLN 39 Ca 0.28 -0.55 -0.23 0.00 0.05 0.00 0.00 55.36 54.91 2o5y s GLN 39 Cb -0.19 -1.64 -0.07 0.00 1.10 0.00 0.00 33.01 32.21 2o5y s GLN 39 CO 0.17 -0.88 1.17 0.00 -0.55 0.00 0.00 175.29 175.21 2o5y s ALA 40 N 1.96 2.99 -0.26 1.58 0.00 -1.26 0.51 121.76 127.28 2o5y s ALA 40 Ca 0.06 0.96 -0.42 0.00 0.00 0.00 0.00 51.96 52.56 2o5y s ALA 40 Cb -0.16 -3.39 -0.18 0.00 0.00 0.00 0.00 23.12 19.39 2o5y s ALA 40 CO -0.24 -0.67 1.55 -2.30 0.00 0.00 0.00 175.76 174.10 2o5y n PRO 41 N -0.44 0.63 -1.03 0.00 -0.02 -1.26 -1.12 135.00 131.76 2o5y n PRO 41 Ca 0.07 0.23 -0.01 0.00 -2.02 0.00 0.00 63.50 61.77 2o5y n PRO 41 Cb 0.48 -1.82 -0.00 0.00 -0.02 0.00 0.00 33.50 32.13 2o5y n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2o5y n GLY 42 N 3.53 0.14 3.96 -1.23 0.00 -1.26 -4.97 105.19 105.37 2o5y n GLY 42 Ca 0.26 -0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.06 2o5y n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o5y s LYS 43 N -1.96 2.43 0.68 1.61 -0.14 -0.28 -5.12 119.74 116.97 2o5y s LYS 43 Ca 0.00 -1.65 -0.11 0.00 -1.36 0.00 0.00 55.97 52.85 2o5y s LYS 43 Cb 0.00 -2.47 0.00 0.00 -1.68 0.00 0.00 37.83 33.68 2o5y s LYS 43 CO 0.00 -0.56 1.08 0.00 -0.76 0.00 0.00 175.35 175.11 2o5y s ALA 44 N -2.60 2.95 0.49 5.17 0.00 -1.26 -4.76 121.76 121.75 2o5y s ALA 44 Ca 0.51 -0.28 -0.22 0.00 0.00 0.00 0.00 51.96 51.97 2o5y s ALA 44 Cb -0.05 -3.04 -0.07 0.00 0.00 0.00 0.00 23.12 19.96 2o5y s ALA 44 CO 0.31 -1.02 1.15 -0.51 0.00 0.00 0.00 175.76 175.69 2o5y s LEU 45 N -5.31 3.92 -0.05 0.00 1.43 -1.26 -4.56 118.68 112.85 2o5y s LEU 45 Ca 0.57 2.25 0.02 0.00 -1.03 0.00 0.00 54.13 55.94 2o5y s LEU 45 Cb -0.11 -4.36 0.02 0.00 0.03 0.00 0.00 46.19 41.76 2o5y s LEU 45 CO 0.52 -1.01 -0.08 -0.54 0.23 0.00 0.00 176.35 175.48 2o5y s LYS 46 N -2.91 1.12 -0.37 1.70 -0.14 -0.22 -4.99 119.74 113.94 2o5y s LYS 46 Ca 0.67 -0.23 -0.23 0.00 -1.36 0.00 0.00 55.97 54.81 2o5y s LYS 46 Cb -0.27 -1.02 0.01 0.00 -1.68 0.00 0.00 37.83 34.88 2o5y s LYS 46 CO 0.32 -0.02 0.79 -0.46 -0.76 0.00 0.00 175.35 175.22 2o5y s TRP 47 N 0.72 3.11 -0.14 3.18 -0.00 -1.26 -0.40 118.94 124.14 2o5y s TRP 47 Ca -0.12 0.55 -0.24 0.00 -0.00 0.00 0.00 56.10 56.29 2o5y s TRP 47 Cb -0.14 -3.42 -0.25 0.00 -0.00 0.00 0.00 33.47 29.66 2o5y s TRP 47 CO 0.01 -0.75 0.60 0.52 -0.00 0.00 0.00 176.95 177.34 2o5y h MET 48 N 8.50 0.08 0.00 5.86 2.86 -1.51 -3.42 114.93 127.30 2o5y h MET 48 Ca -0.25 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.26 2o5y h MET 48 Cb 1.09 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.80 2o5y h MET 48 CO 0.92 1.06 0.00 0.41 1.06 0.00 0.00 176.91 180.36 2o5y n GLY 49 N 1.59 -1.20 3.16 8.32 0.00 -1.23 0.30 105.19 116.12 2o5y n GLY 49 Ca -0.19 -0.96 -0.08 0.00 0.00 0.00 0.00 46.02 44.79 2o5y n GLY 49 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2o5y s TRP 50 N -3.00 0.33 -0.09 1.61 1.48 -0.59 -1.32 118.94 117.36 2o5y s TRP 50 Ca 0.00 -0.81 0.02 0.00 -1.06 0.00 0.00 56.10 54.24 2o5y s TRP 50 Cb 0.00 -0.21 -0.02 0.00 -1.16 0.00 0.00 33.47 32.08 2o5y s TRP 50 CO 0.00 -0.48 -0.13 -1.50 -4.06 0.00 0.00 176.95 170.79 2o5y s ILE 51 N -3.89 3.13 -0.63 0.66 2.07 0.10 -1.50 121.20 121.14 2o5y s ILE 51 Ca 0.07 -0.67 -0.21 0.00 -1.41 0.00 0.00 60.65 58.43 2o5y s ILE 51 Cb 0.06 -2.27 0.08 0.00 0.13 0.00 0.00 42.46 40.47 2o5y s ILE 51 CO -0.10 0.56 0.85 0.21 -1.91 0.00 0.00 174.94 174.55 2o5y s ASN 52 N -0.25 6.18 0.00 4.50 3.84 0.72 -2.00 114.94 127.93 2o5y s ASN 52 Ca 0.02 -1.17 0.17 0.00 0.21 0.00 0.00 52.86 52.09 2o5y s ASN 52 Cb -0.13 -2.37 0.79 0.00 -0.55 0.00 0.00 41.25 38.99 2o5y s ASN 52 CO 0.03 -1.30 1.53 -0.81 -2.79 0.00 0.00 177.10 173.76 2o5y n PRO 52 N 7.12 0.10 0.02 0.43 -0.04 -1.26 0.14 135.00 141.51 2o5y n PRO 52 Ca -0.06 0.17 -0.12 0.00 -0.04 0.00 0.00 63.50 63.45 2o5y n PRO 52 Cb 0.44 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.26 2o5y n PRO 52 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 2o5y h TYR 53 N 0.00 0.19 0.00 0.54 5.03 -1.89 -3.37 116.97 117.47 2o5y h TYR 53 Ca 0.00 -0.14 0.00 0.00 2.58 0.00 0.00 58.73 61.17 2o5y h TYR 53 Cb 0.24 -0.01 0.00 0.00 1.55 0.00 0.00 36.73 38.51 2o5y h TYR 53 CO 0.00 1.22 -0.76 0.25 -1.32 0.00 0.00 178.16 177.55 2o5y n THR 54 N -3.26 0.00 -0.95 1.81 -2.24 -0.38 -4.99 114.28 104.26 2o5y n THR 54 Ca -0.16 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 2o5y n THR 54 Cb 1.03 0.93 0.00 0.00 -2.10 0.00 0.00 70.33 70.20 2o5y n THR 54 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2o5y n GLY 55 N 1.36 0.81 3.84 3.38 0.00 0.37 -5.00 105.19 109.95 2o5y n GLY 55 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 2o5y n GLY 55 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2o5y s GLU 56 N -0.05 3.94 -0.04 1.61 2.12 -1.12 -4.78 118.70 120.38 2o5y s GLU 56 Ca 0.00 0.43 0.03 0.00 0.36 0.00 0.00 54.97 55.80 2o5y s GLU 56 Cb 0.00 -3.20 -0.03 0.00 0.26 0.00 0.00 34.13 31.16 2o5y s GLU 56 CO 0.00 0.67 -0.13 -1.12 -0.54 0.00 0.00 175.26 174.14 2o5y s SER 57 N -1.15 4.14 -0.05 -1.70 0.01 -1.26 -0.20 113.70 113.49 2o5y s SER 57 Ca 0.25 -0.19 0.05 0.00 1.31 0.00 0.00 55.95 57.37 2o5y s SER 57 Cb -0.17 -0.89 -0.01 0.00 0.21 0.00 0.00 66.02 65.17 2o5y s SER 57 CO 0.14 0.34 -0.20 -0.89 0.41 0.00 0.00 173.24 173.04 2o5y s THR 58 N -0.78 1.64 0.07 1.44 2.01 -0.56 -5.02 115.64 114.44 2o5y s THR 58 Ca 0.12 -0.83 0.10 0.00 0.31 0.00 0.00 61.69 61.39 2o5y s THR 58 Cb -0.11 -1.40 -0.03 0.00 0.01 0.00 0.00 72.50 70.97 2o5y s THR 58 CO 0.02 0.46 -0.25 -0.36 -0.69 0.00 0.00 174.62 173.80 2o5y s PHE 59 N -0.01 2.36 0.58 4.92 0.08 -1.26 -1.54 117.98 123.10 2o5y s PHE 59 Ca -0.04 -0.38 -0.15 0.00 0.12 0.00 0.00 56.93 56.48 2o5y s PHE 59 Cb -0.12 -1.35 -0.05 0.00 -0.57 0.00 0.00 43.02 40.92 2o5y s PHE 59 CO 0.03 0.22 1.03 0.00 -0.10 0.00 0.00 175.22 176.40 2o5y s ALA 60 N -0.92 2.88 0.27 5.36 0.00 0.15 -4.79 121.76 124.71 2o5y s ALA 60 Ca 0.13 0.25 -0.10 0.00 0.00 0.00 0.00 51.96 52.24 2o5y s ALA 60 Cb -0.10 -3.17 0.41 0.00 0.00 0.00 0.00 23.12 20.26 2o5y s ALA 60 CO 0.04 -0.63 1.56 -0.44 0.00 0.00 0.00 175.76 176.30 2o5y h ASP 61 N 0.45 -0.98 -0.40 0.00 3.32 -1.93 0.14 116.42 117.02 2o5y h ASP 61 Ca -0.46 0.29 -0.01 0.00 0.02 0.00 0.00 57.03 56.87 2o5y h ASP 61 Cb 1.20 0.62 -0.02 0.00 0.22 0.00 0.00 39.33 41.36 2o5y h ASP 61 CO 0.59 -0.32 0.21 0.44 -1.72 0.00 0.00 179.24 178.45 2o5y h ASP 62 N -0.00 0.54 -0.66 6.45 5.19 -1.94 -2.93 116.42 123.08 2o5y h ASP 62 Ca 0.45 -0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.81 2o5y h ASP 62 Cb 0.69 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.06 2o5y h ASP 62 CO -1.00 0.47 0.00 0.49 -3.12 0.00 0.00 179.24 176.08 2o5y n PHE 63 N -4.40 1.50 -1.93 4.55 3.01 0.44 -4.83 117.46 115.81 2o5y n PHE 63 Ca 0.03 -0.60 -0.42 0.00 1.01 0.00 0.00 57.45 57.47 2o5y n PHE 63 Cb 0.12 -0.24 -0.03 0.00 -0.01 0.00 0.00 39.48 39.32 2o5y n PHE 63 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 2o5y s LYS 64 N -1.84 4.20 0.00 -1.08 -0.14 -0.95 -4.32 119.74 115.60 2o5y s LYS 64 Ca 0.51 2.32 0.00 0.00 -1.36 0.00 0.00 55.97 57.45 2o5y s LYS 64 Cb 0.33 -3.61 0.00 0.00 -1.68 0.00 0.00 37.83 32.87 2o5y s LYS 64 CO 0.25 -0.73 0.00 0.41 -0.76 0.00 0.00 175.35 174.52 2o5y n GLY 65 N 3.99 1.21 0.67 -3.33 0.00 -1.26 -4.87 105.19 101.60 2o5y n GLY 65 Ca 0.16 -0.54 0.03 0.00 0.00 0.00 0.00 46.02 45.67 2o5y n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o5y n ARG 66 N 0.00 1.86 -5.25 1.61 1.74 -1.26 -4.88 116.66 110.47 2o5y n ARG 66 Ca 0.00 -0.88 -0.31 0.00 -0.77 0.00 0.00 57.85 55.89 2o5y n ARG 66 Cb 0.00 -1.46 -0.16 0.00 -1.02 0.00 0.00 32.46 29.82 2o5y n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2o5y s PHE 67 N -1.62 2.40 0.08 -1.55 0.40 -1.26 -4.26 117.98 112.17 2o5y s PHE 67 Ca 0.16 -0.70 0.04 0.00 -0.60 0.00 0.00 56.93 55.84 2o5y s PHE 67 Cb 0.10 -1.57 -0.03 0.00 0.51 0.00 0.00 43.02 42.03 2o5y s PHE 67 CO 0.07 -0.20 -0.12 0.00 0.70 0.00 0.00 175.22 175.67 2o5y s ALA 68 N -0.19 1.09 -0.07 5.36 0.00 0.63 -4.99 121.76 123.58 2o5y s ALA 68 Ca -0.03 -1.03 0.02 0.00 0.00 0.00 0.00 51.96 50.93 2o5y s ALA 68 Cb -0.13 -0.04 -0.02 0.00 0.00 0.00 0.00 23.12 22.92 2o5y s ALA 68 CO 0.03 0.09 -0.13 -0.06 0.00 0.00 0.00 175.76 175.69 2o5y s PHE 69 N -1.62 2.75 0.20 0.00 0.08 -1.26 -0.93 117.98 117.20 2o5y s PHE 69 Ca -0.01 -0.25 0.05 0.00 0.12 0.00 0.00 56.93 56.85 2o5y s PHE 69 Cb -0.08 -1.69 -0.05 0.00 -0.57 0.00 0.00 43.02 40.63 2o5y s PHE 69 CO 0.02 0.11 -0.08 -0.06 -0.10 0.00 0.00 175.22 175.10 2o5y s PHE 70 N -0.49 1.54 0.13 0.36 0.08 -0.56 -4.95 117.98 114.10 2o5y s PHE 70 Ca 0.06 -0.74 0.05 0.00 0.12 0.00 0.00 56.93 56.43 2o5y s PHE 70 Cb -0.12 -0.81 -0.04 0.00 -0.57 0.00 0.00 43.02 41.49 2o5y s PHE 70 CO 0.02 0.15 -0.13 -0.51 -0.10 0.00 0.00 175.22 174.65 2o5y s LEU 71 N -3.27 2.44 -0.40 -0.37 1.43 -1.26 -0.33 118.68 116.92 2o5y s LEU 71 Ca 0.23 -0.87 0.07 0.00 -1.03 0.00 0.00 54.13 52.53 2o5y s LEU 71 Cb 0.03 -0.48 0.22 0.00 0.03 0.00 0.00 46.19 45.98 2o5y s LEU 71 CO 0.06 -0.20 0.46 1.21 0.23 0.00 0.00 176.35 178.10 2o5y n GLU 72 N 0.32 0.53 -0.13 1.70 2.13 0.41 -4.96 120.64 120.64 2o5y n GLU 72 Ca -0.14 -3.21 -0.08 0.00 0.66 0.00 0.00 57.16 54.40 2o5y n GLU 72 Cb 0.58 -1.37 -0.02 0.00 0.27 0.00 0.00 31.44 30.90 2o5y n GLU 72 CO 0.00 0.00 0.00 1.15 -0.41 0.00 0.00 177.13 177.87 2o5y h THR 73 N 2.91 0.20 -0.76 6.31 2.02 -1.94 0.62 112.91 122.27 2o5y h THR 73 Ca 0.14 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.44 2o5y h THR 73 Cb 0.89 0.20 -0.12 0.00 -1.74 0.00 0.00 68.15 67.37 2o5y h THR 73 CO 0.43 0.00 -0.29 -1.54 0.37 0.00 0.00 175.52 174.49 2o5y n SER 74 N -5.42 -0.48 -0.84 4.18 3.41 -1.26 -0.28 113.62 112.93 2o5y n SER 74 Ca 0.01 1.32 0.09 0.00 -0.26 0.00 0.00 58.87 60.03 2o5y n SER 74 Cb 0.34 -0.31 0.25 0.00 -0.26 0.00 0.00 64.21 64.24 2o5y n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2o5y n ALA 75 N -3.61 2.45 -2.07 7.33 0.00 0.18 -4.95 120.51 119.84 2o5y n ALA 75 Ca 0.08 -0.79 -0.15 0.00 0.00 0.00 0.00 53.44 52.59 2o5y n ALA 75 Cb 0.31 -0.98 -0.03 0.00 0.00 0.00 0.00 19.45 18.75 2o5y n ALA 75 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2o5y n THR 76 N 0.85 -0.45 -4.17 0.00 -2.24 0.88 -4.77 114.28 104.38 2o5y n THR 76 Ca 0.17 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.61 2o5y n THR 76 Cb 0.42 -1.83 -0.08 0.00 -2.10 0.00 0.00 70.33 66.74 2o5y n THR 76 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2o5y s THR 77 N -2.55 4.64 0.11 4.28 2.01 -1.16 -1.68 115.64 121.30 2o5y s THR 77 Ca 0.00 -0.32 0.06 0.00 0.31 0.00 0.00 61.69 61.75 2o5y s THR 77 Cb 0.00 -3.06 -0.04 0.00 0.01 0.00 0.00 72.50 69.41 2o5y s THR 77 CO 0.00 0.45 -0.04 0.00 -0.69 0.00 0.00 174.62 174.34 2o5y s ALA 78 N -1.08 3.13 0.09 7.40 0.00 -0.60 -0.45 121.76 130.26 2o5y s ALA 78 Ca 0.19 -1.22 0.06 0.00 0.00 0.00 0.00 51.96 50.99 2o5y s ALA 78 Cb -0.12 -1.02 -0.03 0.00 0.00 0.00 0.00 23.12 21.95 2o5y s ALA 78 CO 0.09 0.63 -0.17 0.71 0.00 0.00 0.00 175.76 177.03 2o5y s TYR 79 N -1.36 1.46 -0.11 0.00 1.51 0.55 -1.88 117.35 117.52 2o5y s TYR 79 Ca 0.24 -0.46 0.01 0.00 -1.01 0.00 0.00 57.07 55.85 2o5y s TYR 79 Cb -0.11 -0.80 -0.02 0.00 -0.11 0.00 0.00 41.96 40.93 2o5y s TYR 79 CO 0.16 0.13 -0.14 -1.17 -1.11 0.00 0.00 175.55 173.42 2o5y s LEU 80 N -1.95 2.67 -0.10 -1.29 2.96 0.86 -1.49 118.68 120.33 2o5y s LEU 80 Ca 0.03 -0.32 0.02 0.00 -0.22 0.00 0.00 54.13 53.64 2o5y s LEU 80 Cb -0.09 -1.58 0.01 0.00 0.50 0.00 0.00 46.19 45.03 2o5y s LEU 80 CO 0.03 0.20 -0.16 -1.58 -1.32 0.00 0.00 176.35 173.53 2o5y s GLN 81 N 0.13 2.22 0.48 1.98 0.74 -0.10 0.67 119.66 125.77 2o5y s GLN 81 Ca -0.07 -0.57 0.07 0.00 0.05 0.00 0.00 55.36 54.84 2o5y s GLN 81 Cb -0.15 -1.85 0.00 0.00 1.10 0.00 0.00 33.01 32.11 2o5y s GLN 81 CO 0.05 -0.03 0.36 0.42 -0.55 0.00 0.00 175.29 175.54 2o5y s ILE 82 N 0.88 2.13 0.00 -2.34 1.01 -0.45 -0.27 121.20 122.16 2o5y s ILE 82 Ca -0.09 -1.47 0.00 0.00 0.00 0.00 0.00 60.65 59.09 2o5y s ILE 82 Cb -0.15 -2.60 0.00 0.00 0.01 0.00 0.00 42.46 39.72 2o5y s ILE 82 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 174.94 171.74 2o5y n ASN 82 N -1.60 0.00 -4.66 3.58 2.85 -1.11 -0.96 115.26 113.36 2o5y n ASN 82 Ca 0.01 0.00 -0.43 0.00 -0.11 0.00 0.00 54.58 54.04 2o5y n ASN 82 Cb 0.63 0.00 -0.01 0.00 1.24 0.00 0.00 39.78 41.65 2o5y n ASN 82 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2o5y n LEU 82 N -0.63 2.99 -4.59 1.20 4.77 -0.51 -4.42 117.00 115.81 2o5y n LEU 82 Ca 0.00 1.19 -0.27 0.00 -0.03 0.00 0.00 56.01 56.91 2o5y n LEU 82 Cb 0.00 -1.42 -0.11 0.00 -2.33 0.00 0.00 43.42 39.56 2o5y n LEU 82 CO 0.00 -0.79 -0.29 -0.54 -1.33 0.00 0.00 177.39 174.44 2o5y s LYS 83 N -1.79 1.91 0.49 3.23 1.02 -1.26 0.65 119.74 123.98 2o5y s LYS 83 Ca 0.57 -2.08 0.26 0.00 0.02 0.00 0.00 55.97 54.74 2o5y s LYS 83 Cb -0.61 -1.52 1.23 0.00 -0.52 0.00 0.00 37.83 36.41 2o5y s LYS 83 CO 0.61 -0.07 1.96 -0.91 -0.92 0.00 0.00 175.35 176.03 2o5y h ASN 84 N 1.83 0.00 0.50 2.83 -0.26 -1.97 -2.13 115.58 116.38 2o5y h ASN 84 Ca -0.43 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.31 2o5y h ASN 84 Cb 1.24 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.50 2o5y h ASN 84 CO 0.79 0.16 0.00 -0.33 -1.06 0.00 0.00 177.43 176.99 2o5y h GLU 85 N 0.00 0.00 0.00 0.81 3.07 -1.96 -2.40 114.58 114.10 2o5y h GLU 85 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2o5y h GLU 85 Cb 0.53 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.44 2o5y h GLU 85 CO 0.02 0.00 -0.24 -0.44 -1.40 0.00 0.00 179.01 176.95 2o5y h ASP 86 N 0.00 0.00 -2.12 1.42 3.32 -1.78 -3.45 116.42 113.81 2o5y h ASP 86 Ca 0.00 -0.06 -0.59 0.00 0.02 0.00 0.00 57.03 56.40 2o5y h ASP 86 Cb 0.25 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.82 2o5y h ASP 86 CO 0.00 0.03 1.17 0.41 -1.72 0.00 0.00 179.24 179.14 2o5y n THR 87 N -2.35 0.64 0.00 0.35 -1.04 -0.91 -4.84 114.28 106.12 2o5y n THR 87 Ca 0.04 -0.14 0.00 0.00 -2.04 0.00 0.00 64.05 61.92 2o5y n THR 87 Cb 0.45 -2.06 0.00 0.00 -1.82 0.00 0.00 70.33 66.90 2o5y n THR 87 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2o5y n ALA 88 N 7.27 0.00 -2.80 2.41 0.00 -0.82 -4.76 120.51 121.81 2o5y n ALA 88 Ca 0.22 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.31 2o5y n ALA 88 Cb 0.34 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.71 2o5y n ALA 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2o5y s THR 89 N -2.00 5.03 -0.10 0.00 2.01 0.18 -1.01 115.64 119.75 2o5y s THR 89 Ca 0.00 0.04 0.01 0.00 0.31 0.00 0.00 61.69 62.06 2o5y s THR 89 Cb 0.00 -3.23 -0.02 0.00 0.01 0.00 0.00 72.50 69.26 2o5y s THR 89 CO 0.00 0.52 -0.14 -0.31 -0.69 0.00 0.00 174.62 174.00 2o5y s TYR 90 N -0.22 2.75 -0.07 4.92 2.02 0.18 0.01 117.35 126.94 2o5y s TYR 90 Ca 0.09 -0.52 0.05 0.00 -0.37 0.00 0.00 57.07 56.32 2o5y s TYR 90 Cb -0.12 -1.76 -0.00 0.00 -0.40 0.00 0.00 41.96 39.68 2o5y s TYR 90 CO 0.01 -0.10 -0.23 -0.06 -1.57 0.00 0.00 175.55 173.60 2o5y s PHE 91 N -0.00 2.30 0.15 2.71 0.08 0.55 -0.91 117.98 122.85 2o5y s PHE 91 Ca -0.04 -0.77 -0.05 0.00 0.12 0.00 0.00 56.93 56.18 2o5y s PHE 91 Cb -0.14 -1.53 -0.06 0.00 -0.57 0.00 0.00 43.02 40.72 2o5y s PHE 91 CO 0.04 -0.27 0.39 0.00 -0.10 0.00 0.00 175.22 175.28 2o5y s ALA 93 N -1.68 -0.91 0.20 0.00 0.00 -0.28 -0.74 121.76 118.36 2o5y s ALA 93 Ca 0.42 1.33 -0.33 0.00 0.00 0.00 0.00 51.96 53.38 2o5y s ALA 93 Cb -0.12 -0.98 -0.13 0.00 0.00 0.00 0.00 23.12 21.89 2o5y s ALA 93 CO 0.24 -0.43 1.61 -2.13 0.00 0.00 0.00 175.76 175.06 2o5y n ARG 94 N 4.69 2.42 -3.12 0.00 0.63 0.96 -1.62 116.66 120.63 2o5y n ARG 94 Ca -0.18 0.87 -0.45 0.00 -0.92 0.00 0.00 57.85 57.18 2o5y n ARG 94 Cb 0.53 -2.66 -0.04 0.00 0.45 0.00 0.00 32.46 30.74 2o5y n ARG 94 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2o5y s GLY 95 N 0.89 1.89 -0.75 5.14 0.00 0.77 -0.99 107.32 114.28 2o5y s GLY 95 Ca 0.75 -2.42 -0.26 0.00 0.00 0.00 0.00 44.72 42.79 2o5y s GLY 95 CO 0.38 1.59 1.60 -1.08 0.00 0.00 0.00 173.10 175.60 2o5y s THR 96 N 2.39 3.57 -0.26 0.90 -1.32 0.05 -2.06 115.64 118.91 2o5y s THR 96 Ca 0.14 0.09 0.27 0.00 -1.21 0.00 0.00 61.69 60.99 2o5y s THR 96 Cb -0.20 -4.45 0.30 0.00 -1.51 0.00 0.00 72.50 66.63 2o5y s THR 96 CO 0.03 -1.40 1.81 0.71 -2.21 0.00 0.00 174.62 173.56 2o5y h THR 97 N 6.60 0.00 0.00 5.08 1.35 -1.91 -2.18 112.91 121.85 2o5y h THR 97 Ca -0.17 -0.31 -0.04 0.00 -0.55 0.00 0.00 66.41 65.34 2o5y h THR 97 Cb 1.08 1.13 -0.01 0.00 -1.73 0.00 0.00 68.15 68.63 2o5y h THR 97 CO 1.27 0.00 -0.19 -0.29 -0.25 0.00 0.00 175.52 176.06 2o5y h ILE 98 N 0.00 0.46 0.00 6.82 2.10 -1.93 -3.20 117.51 121.75 2o5y h ILE 98 Ca 0.00 -1.04 0.00 0.00 1.08 0.00 0.00 64.86 64.90 2o5y h ILE 98 Cb 0.40 1.75 0.00 0.00 -1.09 0.00 0.00 36.82 37.87 2o5y h ILE 98 CO 0.00 0.18 -0.11 1.33 -1.08 0.00 0.00 178.15 178.48 2o5y n VAL 99 N -3.33 0.53 -3.61 2.19 0.24 -1.10 -5.05 118.33 108.19 2o5y n VAL 99 Ca 0.00 -0.58 -0.21 0.00 -2.04 0.00 0.00 64.34 61.52 2o5y n VAL 99 Cb 0.42 0.59 0.06 0.00 -1.47 0.00 0.00 33.84 33.43 2o5y n VAL 99 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 2o5y n TRP 100 N -0.33 -2.10 -3.81 6.34 7.02 -0.84 -5.00 117.44 118.73 2o5y n TRP 100 Ca 0.02 0.89 -0.12 0.00 -1.02 0.00 0.00 57.50 57.27 2o5y n TRP 100 Cb 0.50 -4.65 -0.09 0.00 -2.42 0.00 0.00 31.31 24.64 2o5y n TRP 100 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2o5y s ALA 100 N -3.51 -0.59 0.18 6.99 0.00 -1.15 -5.02 121.76 118.66 2o5y s ALA 100 Ca 0.08 0.14 -0.30 0.00 0.00 0.00 0.00 51.96 51.88 2o5y s ALA 100 Cb -0.04 0.08 -0.07 0.00 0.00 0.00 0.00 23.12 23.09 2o5y s ALA 100 CO 0.78 -0.24 0.94 -1.64 0.00 0.00 0.00 175.76 175.61 2o5y s MET 100 N -1.33 4.78 -0.03 0.00 -1.94 -1.25 -0.77 119.30 118.76 2o5y s MET 100 Ca -0.14 1.46 0.01 0.00 -1.71 0.00 0.00 55.69 55.31 2o5y s MET 100 Cb -0.06 -3.32 -0.02 0.00 2.01 0.00 0.00 34.83 33.43 2o5y s MET 100 CO 0.03 0.38 -0.02 -0.40 -0.01 0.00 0.00 175.02 175.00 2o5y n ASP 101 N 2.09 3.94 -4.25 3.03 5.75 -0.16 -4.88 116.55 122.06 2o5y n ASP 101 Ca -0.00 -0.01 -0.31 0.00 -0.01 0.00 0.00 54.79 54.46 2o5y n ASP 101 Cb 0.48 0.14 -0.16 0.00 -1.03 0.00 0.00 41.12 40.55 2o5y n ASP 101 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 2o5y s TYR 102 N -2.06 2.38 0.06 2.11 2.02 -1.26 -4.97 117.35 115.62 2o5y s TYR 102 Ca -0.03 -0.73 0.09 0.00 -0.37 0.00 0.00 57.07 56.03 2o5y s TYR 102 Cb 0.01 -1.57 -0.03 0.00 -0.40 0.00 0.00 41.96 39.97 2o5y s TYR 102 CO 0.09 -0.23 -0.26 -1.58 -1.57 0.00 0.00 175.55 172.00 2o5y s TRP 103 N -0.10 2.34 1.05 2.71 0.52 -1.26 -0.03 118.94 124.17 2o5y s TRP 103 Ca -0.05 -0.39 -0.15 0.00 0.02 0.00 0.00 56.10 55.53 2o5y s TRP 103 Cb -0.14 -1.38 0.21 0.00 -1.15 0.00 0.00 33.47 31.01 2o5y s TRP 103 CO 0.04 0.17 1.12 0.20 0.02 0.00 0.00 176.95 178.49 2o5y s GLY 104 N -1.38 1.58 0.13 0.98 0.00 0.08 -4.67 107.32 104.05 2o5y s GLY 104 Ca 0.12 -0.62 0.27 0.00 0.00 0.00 0.00 44.72 44.50 2o5y s GLY 104 CO 0.03 0.08 1.83 0.61 0.00 0.00 0.00 173.10 175.65 2o5y n GLN 105 N -4.28 0.16 0.00 2.90 0.00 -1.25 -4.81 117.38 110.10 2o5y n GLN 105 Ca 0.08 0.14 0.00 0.00 0.00 0.00 0.00 57.00 57.22 2o5y n GLN 105 Cb 0.58 -1.69 0.00 0.00 0.00 0.00 0.00 30.24 29.13 2o5y n GLN 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2o5y n GLY 106 N 1.37 2.30 3.25 2.61 0.00 -1.26 -5.06 105.19 108.40 2o5y n GLY 106 Ca 0.06 -1.47 -0.32 0.00 0.00 0.00 0.00 46.02 44.29 2o5y n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2o5y s THR 107 N -0.49 2.33 -0.27 2.61 2.01 -0.09 -4.91 115.64 116.83 2o5y s THR 107 Ca 0.00 -0.91 -0.10 0.00 0.31 0.00 0.00 61.69 60.98 2o5y s THR 107 Cb 0.00 -1.93 -0.05 0.00 0.01 0.00 0.00 72.50 70.54 2o5y s THR 107 CO 0.00 0.55 0.17 -0.55 -0.69 0.00 0.00 174.62 174.10 2o5y s SER 108 N 0.47 5.90 -0.19 3.53 0.15 -1.26 0.48 113.70 122.78 2o5y s SER 108 Ca -0.14 -0.03 -0.01 0.00 0.70 0.00 0.00 55.95 56.47 2o5y s SER 108 Cb -0.17 -2.09 0.01 0.00 -1.71 0.00 0.00 66.02 62.05 2o5y s SER 108 CO 0.06 -0.04 -0.14 -0.69 1.20 0.00 0.00 173.24 173.63 2o5y s VAL 109 N 1.70 2.61 -0.16 4.45 1.01 -0.18 -1.48 120.40 128.34 2o5y s VAL 109 Ca 0.07 -0.76 -0.06 0.00 0.00 0.00 0.00 61.98 61.23 2o5y s VAL 109 Cb -0.16 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.06 2o5y s VAL 109 CO 0.10 0.50 0.03 -0.89 0.00 0.00 0.00 175.10 174.83 2o5y s THR 110 N 1.25 4.48 -0.26 3.92 2.01 0.28 -1.95 115.64 125.37 2o5y s THR 110 Ca 0.03 -0.15 -0.09 0.00 0.31 0.00 0.00 61.69 61.79 2o5y s THR 110 Cb -0.14 -2.99 -0.04 0.00 0.01 0.00 0.00 72.50 69.34 2o5y s THR 110 CO -0.07 0.49 0.13 -0.69 -0.69 0.00 0.00 174.62 173.78 2o5y s VAL 111 N 0.22 4.83 -0.11 3.82 1.01 -1.26 -0.71 120.40 128.21 2o5y s VAL 111 Ca 0.02 0.01 -0.23 0.00 0.00 0.00 0.00 61.98 61.77 2o5y s VAL 111 Cb -0.13 -3.28 0.05 0.00 0.00 0.00 0.00 36.38 33.03 2o5y s VAL 111 CO 0.01 0.31 0.55 -0.55 0.00 0.00 0.00 175.10 175.42 2o5y s SER 112 N 1.56 -0.53 0.02 3.32 0.15 -0.44 -4.80 113.70 112.99 2o5y s SER 112 Ca 0.06 0.75 0.19 0.00 0.70 0.00 0.00 55.95 57.65 2o5y s SER 112 Cb -0.15 0.74 0.78 0.00 -1.71 0.00 0.00 66.02 65.68 2o5y s SER 112 CO 0.07 -0.41 1.59 -1.54 1.20 0.00 0.00 173.24 174.15 2o5y n SER 113 N 1.74 0.05 -4.95 5.45 3.41 -1.26 -3.89 113.62 114.17 2o5y n SER 113 Ca -0.17 0.51 -0.23 0.00 -0.26 0.00 0.00 58.87 58.71 2o5y n SER 113 Cb 0.56 -0.52 -0.00 0.00 -0.26 0.00 0.00 64.21 63.99 2o5y n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2o5y s ALA 114 N -3.02 3.74 -0.08 7.33 0.00 -1.26 -5.03 121.76 123.44 2o5y s ALA 114 Ca 0.08 -0.99 -0.08 0.00 0.00 0.00 0.00 51.96 50.97 2o5y s ALA 114 Cb 0.12 -2.11 -0.04 0.00 0.00 0.00 0.00 23.12 21.08 2o5y s ALA 114 CO 0.34 -0.18 0.21 -1.12 0.00 0.00 0.00 175.76 175.02 2o5y s SER 115 N -4.12 6.49 0.31 0.00 0.01 -1.26 -4.98 113.70 110.15 2o5y s SER 115 Ca 0.44 0.58 -0.28 0.00 1.31 0.00 0.00 55.95 58.00 2o5y s SER 115 Cb -0.10 -2.11 -0.13 0.00 0.21 0.00 0.00 66.02 63.89 2o5y s SER 115 CO 0.37 0.37 1.20 1.07 0.41 0.00 0.00 173.24 176.66 2o5y n THR 116 N 1.81 1.87 -4.06 1.44 5.66 -1.26 -4.87 114.28 114.87 2o5y n THR 116 Ca -0.17 -0.47 -0.21 0.00 -3.05 0.00 0.00 64.05 60.15 2o5y n THR 116 Cb 0.54 -1.36 -0.17 0.00 -1.55 0.00 0.00 70.33 67.80 2o5y n THR 116 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 2o5y s LYS 117 N -1.60 0.82 0.23 1.09 2.36 0.12 -4.95 119.74 117.80 2o5y s LYS 117 Ca 0.58 -0.07 -0.02 0.00 -2.55 0.00 0.00 55.97 53.91 2o5y s LYS 117 Cb -0.63 -0.91 -0.04 0.00 -1.05 0.00 0.00 37.83 35.20 2o5y s LYS 117 CO 0.60 -0.14 0.43 0.20 1.55 0.00 0.00 175.35 178.00 2o5y s GLY 118 N 1.19 1.80 0.65 5.54 0.00 -1.26 0.09 107.32 115.34 2o5y s GLY 118 Ca -0.07 -0.76 -0.11 0.00 0.00 0.00 0.00 44.72 43.78 2o5y s GLY 118 CO -0.02 -0.70 1.05 2.56 0.00 0.00 0.00 173.10 175.99 2o5y s PRO 119 N -3.39 3.31 0.01 2.90 0.04 -1.26 -4.56 135.00 132.04 2o5y s PRO 119 Ca 0.40 0.79 0.01 0.00 0.04 0.00 0.00 61.00 62.24 2o5y s PRO 119 Cb -0.11 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 32.35 2o5y s PRO 119 CO 0.29 -0.79 0.03 -1.12 0.04 0.00 0.00 177.00 175.46 2o5y s SER 120 N -4.07 5.31 -0.11 6.66 0.01 0.46 -4.91 113.70 117.04 2o5y s SER 120 Ca 0.56 0.03 0.03 0.00 1.31 0.00 0.00 55.95 57.88 2o5y s SER 120 Cb -0.12 -1.42 0.01 0.00 0.21 0.00 0.00 66.02 64.69 2o5y s SER 120 CO 0.54 0.26 -0.21 -0.69 0.41 0.00 0.00 173.24 173.56 2o5y s VAL 121 N -1.16 1.86 -0.05 3.43 1.01 -1.26 -0.36 120.40 123.89 2o5y s VAL 121 Ca 0.22 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.35 2o5y s VAL 121 Cb -0.12 -1.64 -0.00 0.00 0.00 0.00 0.00 36.38 34.62 2o5y s VAL 121 CO 0.13 0.51 -0.17 -0.36 0.00 0.00 0.00 175.10 175.21 2o5y s PHE 122 N 0.64 1.70 0.13 5.22 0.08 -0.74 -4.95 117.98 120.06 2o5y s PHE 122 Ca -0.12 -0.50 -0.31 0.00 0.12 0.00 0.00 56.93 56.11 2o5y s PHE 122 Cb -0.16 -1.15 -0.09 0.00 -0.57 0.00 0.00 43.02 41.05 2o5y s PHE 122 CO 0.03 -0.18 1.50 -1.25 -0.10 0.00 0.00 175.22 175.22 2o5y s PRO 123 N 0.08 4.26 -0.72 0.24 0.04 -1.26 -1.27 135.00 136.37 2o5y s PRO 123 Ca -0.05 2.24 -0.18 0.00 0.04 0.00 0.00 61.00 63.05 2o5y s PRO 123 Cb -0.12 -3.23 0.13 0.00 0.04 0.00 0.00 34.50 31.31 2o5y s PRO 123 CO 0.02 -0.55 0.85 -0.51 0.04 0.00 0.00 177.00 176.85 2o5y s LEU 124 N 1.27 5.42 0.06 -3.56 1.43 0.18 -4.86 118.68 118.63 2o5y s LEU 124 Ca 0.68 -1.75 -0.22 0.00 -1.03 0.00 0.00 54.13 51.81 2o5y s LEU 124 Cb -0.40 -2.32 -0.06 0.00 0.03 0.00 0.00 46.19 43.43 2o5y s LEU 124 CO 0.31 -1.05 0.67 0.00 0.23 0.00 0.00 176.35 176.51 2o5y s ALA 125 N 2.42 3.47 0.54 4.21 0.00 -1.26 -0.24 121.76 130.90 2o5y s ALA 125 Ca 0.19 0.16 -0.20 0.00 0.00 0.00 0.00 51.96 52.11 2o5y s ALA 125 Cb -0.16 -2.83 -0.05 0.00 0.00 0.00 0.00 23.12 20.08 2o5y s ALA 125 CO 0.00 0.22 1.18 -1.25 0.00 0.00 0.00 175.76 175.91 2o5y s PRO 126 N -0.55 3.33 -0.02 0.00 0.04 -1.26 -4.95 135.00 131.60 2o5y s PRO 126 Ca 0.33 1.78 0.12 0.00 0.04 0.00 0.00 61.00 63.27 2o5y s PRO 126 Cb -0.20 -2.11 -0.18 0.00 0.04 0.00 0.00 34.50 32.04 2o5y s PRO 126 CO 0.21 -0.91 0.28 0.43 0.04 0.00 0.00 177.00 177.06 2o5y n SER 127 N -1.14 2.11 -4.65 6.66 7.64 -1.26 -4.61 113.62 118.38 2o5y n SER 127 Ca 0.11 -0.07 -0.43 0.00 1.01 0.00 0.00 58.87 59.50 2o5y n SER 127 Cb 0.49 1.50 -0.02 0.00 -1.01 0.00 0.00 64.21 65.17 2o5y n SER 127 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2o5y s SER 128 N -3.27 6.79 0.13 6.43 0.01 -1.26 -4.98 113.70 117.54 2o5y s SER 128 Ca -0.04 1.71 -0.31 0.00 1.31 0.00 0.00 55.95 58.62 2o5y s SER 128 Cb 0.08 -2.54 -0.10 0.00 0.21 0.00 0.00 66.02 63.67 2o5y s SER 128 CO 0.50 -0.89 1.81 -0.54 0.41 0.00 0.00 173.24 174.52 2o5y s LYS 129 N 3.83 4.14 0.61 12.44 1.02 -1.26 -4.87 119.74 135.64 2o5y s LYS 129 Ca 0.60 2.58 0.26 0.00 0.02 0.00 0.00 55.97 59.44 2o5y s LYS 129 Cb -0.23 -3.53 1.18 0.00 -0.52 0.00 0.00 37.83 34.72 2o5y s LYS 129 CO 0.20 -0.83 1.60 0.66 -0.92 0.00 0.00 175.35 176.07 2o5y h SER 130 N 8.36 0.00 -0.78 2.83 4.64 -1.94 -1.83 113.55 124.83 2o5y h SER 130 Ca -0.45 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 60.90 2o5y h SER 130 Cb 1.21 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.26 2o5y h SER 130 CO 0.95 0.00 0.49 0.74 -0.87 0.00 0.00 176.83 178.14 2o5y h THR 131 N 0.00 1.11 -5.68 2.95 2.02 -1.89 -3.38 112.91 108.05 2o5y h THR 131 Ca 0.30 -0.33 -0.47 0.00 0.77 0.00 0.00 66.41 66.68 2o5y h THR 131 Cb 1.91 0.07 0.08 0.00 -1.74 0.00 0.00 68.15 68.46 2o5y h THR 131 CO -0.00 0.18 0.09 -1.54 0.37 0.00 0.00 175.52 174.62 2o5y n SER 132 N -4.61 1.44 -2.12 4.18 3.41 -0.69 -5.05 113.62 110.19 2o5y n SER 132 Ca 0.09 -2.19 -0.01 0.00 -0.26 0.00 0.00 58.87 56.50 2o5y n SER 132 Cb 0.09 -0.62 0.00 0.00 -0.26 0.00 0.00 64.21 63.42 2o5y n SER 132 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2o5y n GLY 133 N -2.59 1.25 5.21 5.00 0.00 -1.26 -4.53 105.19 108.26 2o5y n GLY 133 Ca 0.16 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 44.15 2o5y n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2o5y n GLY 136 N 4.68 -1.75 3.50 -0.02 0.00 -1.26 -4.84 105.19 105.51 2o5y n GLY 136 Ca 0.01 -1.53 -0.33 0.00 0.00 0.00 0.00 46.02 44.17 2o5y n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2o5y s THR 137 N 0.00 3.37 0.06 2.61 2.01 -1.26 -3.14 115.64 119.29 2o5y s THR 137 Ca 0.00 -0.59 0.01 0.00 0.31 0.00 0.00 61.69 61.42 2o5y s THR 137 Cb 0.00 -2.37 -0.04 0.00 0.01 0.00 0.00 72.50 70.10 2o5y s THR 137 CO 0.00 0.58 0.16 0.00 -0.69 0.00 0.00 174.62 174.67 2o5y s ALA 138 N -0.50 3.84 0.08 7.40 0.00 0.94 -4.84 121.76 128.68 2o5y s ALA 138 Ca 0.07 -0.89 0.06 0.00 0.00 0.00 0.00 51.96 51.19 2o5y s ALA 138 Cb -0.12 -1.69 -0.04 0.00 0.00 0.00 0.00 23.12 21.27 2o5y s ALA 138 CO 0.02 0.79 -0.07 0.00 0.00 0.00 0.00 175.76 176.50 2o5y s ALA 139 N -1.45 3.03 0.22 0.00 0.00 -1.26 -1.13 121.76 121.17 2o5y s ALA 139 Ca 0.32 -1.16 -0.21 0.00 0.00 0.00 0.00 51.96 50.91 2o5y s ALA 139 Cb -0.13 -1.01 0.04 0.00 0.00 0.00 0.00 23.12 22.03 2o5y s ALA 139 CO 0.25 0.65 0.63 -0.48 0.00 0.00 0.00 175.76 176.80 2o5y s LEU 140 N -2.01 -0.30 0.00 0.00 0.05 -0.37 -4.04 118.68 112.01 2o5y s LEU 140 Ca 0.21 -0.36 0.00 0.00 0.05 0.00 0.00 54.13 54.03 2o5y s LEU 140 Cb -0.11 2.54 0.00 0.00 -2.05 0.00 0.00 46.19 46.57 2o5y s LEU 140 CO 0.13 -1.14 0.00 0.61 -0.55 0.00 0.00 176.35 175.40 2o5y n GLY 141 N -0.40 -0.61 3.00 -3.48 0.00 0.67 0.44 105.19 104.80 2o5y n GLY 141 Ca -0.10 -0.54 -0.22 0.00 0.00 0.00 0.00 46.02 45.15 2o5y n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o5y s LEU 143 N 0.52 5.30 -0.60 0.00 2.96 -0.39 -1.22 118.68 125.24 2o5y s LEU 143 Ca -0.10 -1.16 -0.21 0.00 -0.22 0.00 0.00 54.13 52.44 2o5y s LEU 143 Cb -0.13 -2.33 0.08 0.00 0.50 0.00 0.00 46.19 44.31 2o5y s LEU 143 CO 0.02 -0.84 0.82 -0.69 -1.32 0.00 0.00 176.35 174.34 2o5y s VAL 144 N 2.27 4.58 -0.01 1.68 1.01 0.74 -1.79 120.40 128.87 2o5y s VAL 144 Ca 0.10 -0.53 0.05 0.00 0.00 0.00 0.00 61.98 61.60 2o5y s VAL 144 Cb -0.22 -4.55 -0.03 0.00 0.00 0.00 0.00 36.38 31.58 2o5y s VAL 144 CO 0.09 -1.22 -0.14 -0.75 0.00 0.00 0.00 175.10 173.08 2o5y s LYS 145 N 3.38 2.37 -0.87 2.72 2.20 0.52 -0.78 119.74 129.28 2o5y s LYS 145 Ca 0.18 -0.79 -0.04 0.00 -0.36 0.00 0.00 55.97 54.96 2o5y s LYS 145 Cb -0.19 -2.33 -0.05 0.00 -1.51 0.00 0.00 37.83 33.75 2o5y s LYS 145 CO 0.10 0.59 0.77 -0.25 -0.36 0.00 0.00 175.35 176.20 2o5y n ASP 146 N 1.95 -6.28 -4.31 1.43 8.00 -0.43 -0.41 116.55 116.51 2o5y n ASP 146 Ca -0.16 -0.51 -0.17 0.00 0.71 0.00 0.00 54.79 54.66 2o5y n ASP 146 Cb 0.52 -4.66 -0.10 0.00 -0.02 0.00 0.00 41.12 36.86 2o5y n ASP 146 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2o5y s TYR 147 N -3.27 1.52 -0.24 1.24 -0.85 -0.64 -4.32 117.35 110.79 2o5y s TYR 147 Ca 0.32 -0.65 -0.19 0.00 -0.52 0.00 0.00 57.07 56.03 2o5y s TYR 147 Cb -0.04 -0.73 0.06 0.00 0.38 0.00 0.00 41.96 41.63 2o5y s TYR 147 CO 0.65 0.24 0.62 0.12 -1.52 0.00 0.00 175.55 175.65 2o5y s PHE 148 N -3.13 -0.77 0.69 -3.49 5.36 0.11 -1.42 117.98 115.35 2o5y s PHE 148 Ca 0.20 1.74 0.02 0.00 -0.96 0.00 0.00 56.93 57.93 2o5y s PHE 148 Cb 0.01 0.33 0.12 0.00 -0.34 0.00 0.00 43.02 43.14 2o5y s PHE 148 CO 0.04 -0.38 0.95 -1.25 -1.46 0.00 0.00 175.22 173.12 2o5y s PRO 149 N 0.76 1.80 0.53 10.12 0.04 -1.26 0.11 135.00 147.09 2o5y s PRO 149 Ca -0.03 -1.25 -0.22 0.00 0.04 0.00 0.00 61.00 59.53 2o5y s PRO 149 Cb -0.05 -2.40 -0.05 0.00 0.04 0.00 0.00 34.50 32.03 2o5y s PRO 149 CO -0.06 -1.33 1.32 -1.21 0.04 0.00 0.00 177.00 175.77 2o5y s GLU 150 N -5.04 3.25 0.29 4.56 0.41 -1.26 -4.68 118.70 116.23 2o5y s GLU 150 Ca 0.65 2.14 0.06 0.00 -0.41 0.00 0.00 54.97 57.41 2o5y s GLU 150 Cb -0.05 -2.28 -0.02 0.00 -1.78 0.00 0.00 34.13 30.00 2o5y s GLU 150 CO 0.43 -1.07 0.40 -1.25 -0.49 0.00 0.00 175.26 173.28 2o5y s PRO 151 N -2.88 3.20 0.19 0.39 0.04 -1.26 -4.85 135.00 129.83 2o5y s PRO 151 Ca 0.70 -0.94 0.08 0.00 0.04 0.00 0.00 61.00 60.89 2o5y s PRO 151 Cb -0.38 -2.81 -0.04 0.00 0.04 0.00 0.00 34.50 31.31 2o5y s PRO 151 CO 0.45 0.23 -0.03 0.14 0.04 0.00 0.00 177.00 177.83 2o5y s VAL 152 N -2.11 3.49 -0.21 -0.36 -7.23 -1.26 -4.45 120.40 108.27 2o5y s VAL 152 Ca 0.40 -1.58 0.02 0.00 -1.81 0.00 0.00 61.98 59.00 2o5y s VAL 152 Cb -0.09 -2.76 0.03 0.00 0.56 0.00 0.00 36.38 34.12 2o5y s VAL 152 CO 0.30 -0.15 -0.17 -0.89 -0.31 0.00 0.00 175.10 173.88 2o5y s THR 153 N -1.81 2.09 -0.17 5.32 2.01 0.71 -4.98 115.64 118.82 2o5y s THR 153 Ca 0.27 -1.19 -0.06 0.00 0.31 0.00 0.00 61.69 61.02 2o5y s THR 153 Cb -0.09 -2.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.38 2o5y s THR 153 CO 0.18 0.33 0.02 -0.69 -0.69 0.00 0.00 174.62 173.77 2o5y s VAL 154 N 1.23 4.42 0.32 3.82 1.01 -1.26 -0.77 120.40 129.16 2o5y s VAL 154 Ca -0.00 -0.17 0.03 0.00 0.00 0.00 0.00 61.98 61.84 2o5y s VAL 154 Cb -0.16 -2.97 -0.06 0.00 0.00 0.00 0.00 36.38 33.20 2o5y s VAL 154 CO -0.10 0.48 0.08 -0.94 0.00 0.00 0.00 175.10 174.62 2o5y s SER 156 N 0.31 2.18 -0.06 3.32 1.04 -0.03 -4.97 113.70 115.50 2o5y s SER 156 Ca 0.00 -1.42 0.05 0.00 0.48 0.00 0.00 55.95 55.06 2o5y s SER 156 Cb -0.13 0.04 -0.00 0.00 0.10 0.00 0.00 66.02 66.03 2o5y s SER 156 CO 0.01 -0.68 -0.19 0.26 0.98 0.00 0.00 173.24 173.62 2o5y s TRP 157 N -3.38 1.96 -1.32 5.02 0.52 -1.26 -0.65 118.94 119.84 2o5y s TRP 157 Ca 0.35 -0.62 -0.08 0.00 0.02 0.00 0.00 56.10 55.78 2o5y s TRP 157 Cb 0.08 -1.32 0.00 0.00 -1.15 0.00 0.00 33.47 31.08 2o5y s TRP 157 CO 0.15 -0.22 0.54 0.09 0.02 0.00 0.00 176.95 177.53 2o5y n ASN 162 N 3.20 -1.94 -3.86 2.95 3.02 0.60 -1.80 115.26 117.43 2o5y n ASN 162 Ca -0.18 -1.03 -0.26 0.00 -0.03 0.00 0.00 54.58 53.08 2o5y n ASN 162 Cb 0.53 -3.07 0.00 0.00 -0.61 0.00 0.00 39.78 36.63 2o5y n ASN 162 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2o5y n SER 163 N -2.85 -1.43 -0.68 6.41 7.64 -1.26 -1.89 113.62 119.57 2o5y n SER 163 Ca -0.24 -0.98 -0.09 0.00 1.01 0.00 0.00 58.87 58.57 2o5y n SER 163 Cb 0.65 -3.26 -0.04 0.00 -1.01 0.00 0.00 64.21 60.55 2o5y n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2o5y n GLY 164 N -1.86 0.91 1.13 0.23 0.00 -0.75 -4.83 105.19 100.02 2o5y n GLY 164 Ca -0.27 -0.08 0.08 0.00 0.00 0.00 0.00 46.02 45.76 2o5y n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o5y n ALA 165 N 1.16 2.72 -3.76 4.61 0.00 -0.79 -4.68 120.51 119.77 2o5y n ALA 165 Ca -0.09 -1.58 -0.29 0.00 0.00 0.00 0.00 53.44 51.48 2o5y n ALA 165 Cb 0.51 -0.76 -0.16 0.00 0.00 0.00 0.00 19.45 19.04 2o5y n ALA 165 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2o5y s LEU 166 N -1.71 1.74 0.00 0.00 2.96 -0.96 -4.98 118.68 115.73 2o5y s LEU 166 Ca 0.40 -1.16 0.00 0.00 -0.22 0.00 0.00 54.13 53.16 2o5y s LEU 166 Cb 0.26 -0.77 0.00 0.00 0.50 0.00 0.00 46.19 46.18 2o5y s LEU 166 CO 0.19 -0.33 0.00 0.35 -1.32 0.00 0.00 176.35 175.24 2o5y n THR 167 N 4.93 0.00 -1.86 3.68 -2.24 -1.26 -4.07 114.28 113.45 2o5y n THR 167 Ca -0.07 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.29 2o5y n THR 167 Cb 0.45 -0.70 -0.03 0.00 -2.10 0.00 0.00 70.33 67.95 2o5y n THR 167 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2o5y s SER 168 N -3.57 6.52 0.00 3.42 0.15 -1.26 -3.00 113.70 115.96 2o5y s SER 168 Ca 0.00 2.67 0.00 0.00 0.70 0.00 0.00 55.95 59.32 2o5y s SER 168 Cb 0.00 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.72 2o5y s SER 168 CO 0.00 -0.89 0.00 0.61 1.20 0.00 0.00 173.24 174.16 2o5y n GLY 169 N 3.91 0.61 3.64 9.45 0.00 -1.26 -4.84 105.19 116.70 2o5y n GLY 169 Ca 0.15 -0.50 -0.35 0.00 0.00 0.00 0.00 46.02 45.32 2o5y n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5y s VAL 171 N -2.00 4.26 -0.18 1.61 1.01 -1.16 -1.89 120.40 122.05 2o5y s VAL 171 Ca 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 61.98 61.71 2o5y s VAL 171 Cb 0.00 -2.82 0.05 0.00 0.00 0.00 0.00 36.38 33.61 2o5y s VAL 171 CO 0.00 0.57 -0.00 -1.00 0.00 0.00 0.00 175.10 174.66 2o5y s HIS 172 N -0.49 1.33 -0.30 5.22 3.76 0.90 -5.00 115.29 120.71 2o5y s HIS 172 Ca 0.09 -0.94 -0.11 0.00 -0.15 0.00 0.00 55.06 53.95 2o5y s HIS 172 Cb -0.12 -1.14 -0.03 0.00 1.11 0.00 0.00 32.58 32.40 2o5y s HIS 172 CO 0.02 -0.60 0.19 0.99 -0.85 0.00 0.00 174.74 174.49 2o5y s THR 173 N 1.76 5.06 0.47 1.30 2.01 -1.26 -0.54 115.64 124.44 2o5y s THR 173 Ca -0.00 -0.10 -0.21 0.00 0.31 0.00 0.00 61.69 61.69 2o5y s THR 173 Cb -0.16 -3.50 -0.09 0.00 0.01 0.00 0.00 72.50 68.77 2o5y s THR 173 CO -0.07 0.14 1.04 -0.36 -0.69 0.00 0.00 174.62 174.68 2o5y s PHE 174 N 1.70 3.04 0.33 4.92 0.40 0.15 -4.99 117.98 123.53 2o5y s PHE 174 Ca 0.06 1.59 -0.26 0.00 -0.60 0.00 0.00 56.93 57.71 2o5y s PHE 174 Cb -0.17 -3.08 -0.13 0.00 0.51 0.00 0.00 43.02 40.16 2o5y s PHE 174 CO 0.09 -0.80 0.91 -2.30 0.70 0.00 0.00 175.22 173.82 2o5y n PRO 175 N -0.82 1.15 -2.00 0.24 -0.02 -1.26 -4.65 135.00 127.65 2o5y n PRO 175 Ca 0.09 0.41 -0.37 0.00 -2.02 0.00 0.00 63.50 61.61 2o5y n PRO 175 Cb 0.52 -1.78 0.03 0.00 -0.02 0.00 0.00 33.50 32.25 2o5y n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2o5y s ALA 176 N -1.16 2.65 0.04 3.55 0.00 -1.26 -4.79 121.76 120.79 2o5y s ALA 176 Ca 0.61 1.07 0.04 0.00 0.00 0.00 0.00 51.96 53.67 2o5y s ALA 176 Cb -0.67 -3.47 -0.02 0.00 0.00 0.00 0.00 23.12 18.96 2o5y s ALA 176 CO 0.59 -1.15 -0.11 0.08 0.00 0.00 0.00 175.76 175.17 2o5y s VAL 177 N -1.52 0.83 0.27 0.00 1.01 -0.62 -4.96 120.40 115.40 2o5y s VAL 177 Ca 0.75 -1.02 -0.12 0.00 0.00 0.00 0.00 61.98 61.59 2o5y s VAL 177 Cb -0.32 -0.80 -0.08 0.00 0.00 0.00 0.00 36.38 35.17 2o5y s VAL 177 CO 0.36 -0.18 0.62 -0.76 0.00 0.00 0.00 175.10 175.14 2o5y s LEU 178 N -1.34 4.12 0.46 3.92 1.02 -1.26 -1.25 118.68 124.35 2o5y s LEU 178 Ca -0.03 1.06 0.03 0.00 0.02 0.00 0.00 54.13 55.20 2o5y s LEU 178 Cb -0.09 -3.84 -0.02 0.00 0.02 0.00 0.00 46.19 42.27 2o5y s LEU 178 CO 0.01 -0.13 0.08 0.00 0.02 0.00 0.00 176.35 176.34 2o5y s GLN 179 N -2.90 2.07 0.54 1.70 -2.07 -0.92 -4.98 119.66 113.10 2o5y s GLN 179 Ca 0.50 -2.30 0.36 0.00 -1.82 0.00 0.00 55.36 52.11 2o5y s GLN 179 Cb -0.11 -0.96 1.94 0.00 -1.09 0.00 0.00 33.01 32.80 2o5y s GLN 179 CO 0.20 -0.46 2.11 0.77 -1.32 0.00 0.00 175.29 176.58 2o5y h SER 180 N 1.58 0.00 0.33 12.60 0.02 -2.00 -0.97 113.55 125.11 2o5y h SER 180 Ca -0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 2o5y h SER 180 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 2o5y h SER 180 CO 0.62 0.00 0.00 0.77 -1.14 0.00 0.00 176.83 177.08 2o5y h SER 181 N 0.00 0.00 0.00 3.07 4.64 -2.03 -3.45 113.55 115.78 2o5y h SER 181 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2o5y h SER 181 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2o5y h SER 181 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2o5y n GLY 183 N -0.73 0.75 3.50 -0.77 0.00 -0.37 -5.06 105.19 102.51 2o5y n GLY 183 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 2o5y n GLY 183 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2o5y s LEU 184 N 0.00 2.68 0.31 0.99 1.43 -1.25 -4.94 118.68 117.90 2o5y s LEU 184 Ca 0.00 -0.95 -0.08 0.00 -1.03 0.00 0.00 54.13 52.07 2o5y s LEU 184 Cb 0.00 -1.22 -0.06 0.00 0.03 0.00 0.00 46.19 44.94 2o5y s LEU 184 CO 0.00 0.04 0.62 -0.31 0.23 0.00 0.00 176.35 176.93 2o5y s TYR 185 N -2.40 3.45 -0.02 0.29 2.02 -0.50 -2.16 117.35 118.02 2o5y s TYR 185 Ca 0.29 0.84 -0.06 0.00 -0.37 0.00 0.00 57.07 57.78 2o5y s TYR 185 Cb -0.06 -2.26 0.01 0.00 -0.40 0.00 0.00 41.96 39.25 2o5y s TYR 185 CO 0.15 0.12 0.13 -1.12 -1.57 0.00 0.00 175.55 173.26 2o5y s SER 186 N -2.90 -0.04 0.32 2.29 0.01 -0.38 -1.32 113.70 111.69 2o5y s SER 186 Ca 0.47 -0.01 -0.03 0.00 1.31 0.00 0.00 55.95 57.69 2o5y s SER 186 Cb -0.11 0.24 -0.00 0.00 0.21 0.00 0.00 66.02 66.36 2o5y s SER 186 CO 0.27 -0.22 0.43 -1.48 0.41 0.00 0.00 173.24 172.66 2o5y s LEU 187 N -0.74 0.97 0.03 2.44 0.05 0.04 -1.59 118.68 119.88 2o5y s LEU 187 Ca -0.08 -1.41 0.05 0.00 0.05 0.00 0.00 54.13 52.74 2o5y s LEU 187 Cb -0.05 1.37 -0.02 0.00 -2.05 0.00 0.00 46.19 45.44 2o5y s LEU 187 CO 0.01 -1.22 -0.15 -0.44 -0.55 0.00 0.00 176.35 173.99 2o5y s SER 188 N -3.21 1.79 -0.16 1.48 0.01 -1.26 -0.19 113.70 112.17 2o5y s SER 188 Ca 0.31 -0.44 0.00 0.00 1.31 0.00 0.00 55.95 57.13 2o5y s SER 188 Cb 0.00 -0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.10 2o5y s SER 188 CO 0.18 0.07 -0.16 -0.55 0.41 0.00 0.00 173.24 173.19 2o5y s SER 189 N -1.04 3.55 0.21 2.44 0.15 -0.36 -0.68 113.70 117.97 2o5y s SER 189 Ca 0.03 -0.51 0.10 0.00 0.70 0.00 0.00 55.95 56.27 2o5y s SER 189 Cb -0.08 -1.55 -0.04 0.00 -1.71 0.00 0.00 66.02 62.64 2o5y s SER 189 CO 0.01 0.07 -0.15 0.68 1.20 0.00 0.00 173.24 175.05 2o5y s VAL 190 N 0.92 2.85 0.02 4.45 -7.23 0.30 -0.92 120.40 120.80 2o5y s VAL 190 Ca -0.03 -1.92 0.01 0.00 -1.81 0.00 0.00 61.98 58.23 2o5y s VAL 190 Cb -0.15 -2.43 -0.02 0.00 0.56 0.00 0.00 36.38 34.34 2o5y s VAL 190 CO -0.02 -0.19 -0.04 0.54 -0.31 0.00 0.00 175.10 175.08 2o5y s VAL 191 N -1.89 0.26 -0.07 1.32 0.11 0.17 -0.07 120.40 120.23 2o5y s VAL 191 Ca 0.25 -0.82 -0.04 0.00 -2.93 0.00 0.00 61.98 58.44 2o5y s VAL 191 Cb -0.08 -0.35 -0.04 0.00 -1.53 0.00 0.00 36.38 34.38 2o5y s VAL 191 CO 0.14 -0.36 0.09 -0.89 -3.33 0.00 0.00 175.10 170.75 2o5y s THR 192 N -1.18 5.01 -0.02 5.04 2.01 -0.79 -1.23 115.64 124.47 2o5y s THR 192 Ca -0.11 -0.09 -0.18 0.00 0.31 0.00 0.00 61.69 61.62 2o5y s THR 192 Cb -0.08 -3.20 0.03 0.00 0.01 0.00 0.00 72.50 69.25 2o5y s THR 192 CO -0.00 0.53 0.38 0.68 -0.69 0.00 0.00 174.62 175.51 2o5y s VAL 193 N -1.06 0.05 0.21 3.82 -7.23 -0.28 -4.79 120.40 111.12 2o5y s VAL 193 Ca 0.18 -0.39 -0.32 0.00 -1.81 0.00 0.00 61.98 59.63 2o5y s VAL 193 Cb -0.12 -0.70 -0.13 0.00 0.56 0.00 0.00 36.38 36.00 2o5y s VAL 193 CO 0.07 -0.22 1.67 -0.81 -0.31 0.00 0.00 175.10 175.50 2o5y n PRO 194 N 1.17 2.59 0.30 4.82 -0.04 -1.26 -0.04 135.00 142.54 2o5y n PRO 194 Ca -0.21 0.93 0.17 0.00 -0.04 0.00 0.00 63.50 64.36 2o5y n PRO 194 Cb 0.56 -2.75 0.91 0.00 -0.04 0.00 0.00 33.50 32.18 2o5y n PRO 194 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2o5y h SER 195 N 6.30 0.00 -0.08 3.54 4.64 -1.85 -1.80 113.55 124.30 2o5y h SER 195 Ca -0.44 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 60.90 2o5y h SER 195 Cb 1.22 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2o5y h SER 195 CO 0.92 0.04 0.06 0.28 -0.87 0.00 0.00 176.83 177.26 2o5y h SER 196 N 0.00 0.00 0.07 4.97 0.02 -1.80 -3.02 113.55 113.79 2o5y h SER 196 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2o5y h SER 196 Cb 0.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.76 2o5y h SER 196 CO 0.01 0.00 -0.41 -1.54 -1.14 0.00 0.00 176.83 173.75 2o5y n SER 199 N -4.50 1.67 0.27 3.07 3.41 -0.68 -4.15 113.62 112.72 2o5y n SER 199 Ca -0.01 -1.29 0.13 0.00 -0.26 0.00 0.00 58.87 57.43 2o5y n SER 199 Cb 0.17 0.37 0.77 0.00 -0.26 0.00 0.00 64.21 65.26 2o5y n SER 199 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2o5y h LEU 200 N 1.98 0.00 -3.63 1.04 3.38 -1.65 0.55 115.31 116.98 2o5y h LEU 200 Ca 0.00 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.72 2o5y h LEU 200 Cb 0.67 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.27 2o5y h LEU 200 CO 0.00 0.08 0.23 0.61 0.09 0.00 0.00 178.44 179.45 2o5y n GLY 202 N -0.99 4.24 0.71 0.83 0.00 -1.26 -4.46 105.19 104.25 2o5y n GLY 202 Ca -0.02 -1.09 -0.05 0.00 0.00 0.00 0.00 46.02 44.86 2o5y n GLY 202 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2o5y n THR 203 N -0.69 1.16 -3.87 2.61 -1.04 0.12 -5.12 114.28 107.44 2o5y n THR 203 Ca 0.41 0.21 -0.09 0.00 -2.04 0.00 0.00 64.05 62.54 2o5y n THR 203 Cb 1.29 -1.81 -0.07 0.00 -1.82 0.00 0.00 70.33 67.93 2o5y n THR 203 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2o5y s GLN 204 N -2.29 0.98 0.40 -2.82 1.03 -0.77 -5.13 119.66 111.05 2o5y s GLN 204 Ca -0.11 -1.00 -0.00 0.00 0.04 0.00 0.00 55.36 54.28 2o5y s GLN 204 Cb 0.02 0.37 -0.02 0.00 0.03 0.00 0.00 33.01 33.41 2o5y s GLN 204 CO 0.16 -0.34 0.62 0.95 -2.54 0.00 0.00 175.29 174.14 2o5y s THR 205 N -3.89 4.76 -0.16 3.63 -4.23 -1.26 -4.67 115.64 109.82 2o5y s THR 205 Ca 0.09 -0.37 -0.02 0.00 -1.18 0.00 0.00 61.69 60.21 2o5y s THR 205 Cb 0.04 -3.75 0.05 0.00 1.34 0.00 0.00 72.50 70.17 2o5y s THR 205 CO -0.07 -0.54 0.02 -0.31 -0.54 0.00 0.00 174.62 173.17 2o5y s TYR 206 N -2.45 1.04 -0.11 3.99 2.02 -1.26 -5.00 117.35 115.57 2o5y s TYR 206 Ca 0.43 -0.74 0.01 0.00 -0.37 0.00 0.00 57.07 56.40 2o5y s TYR 206 Cb -0.10 -1.02 -0.02 0.00 -0.40 0.00 0.00 41.96 40.43 2o5y s TYR 206 CO 0.38 -0.55 -0.14 0.42 -1.57 0.00 0.00 175.55 174.09 2o5y s ILE 207 N 1.85 2.96 -0.11 2.71 -1.09 -1.26 -1.08 121.20 125.18 2o5y s ILE 207 Ca 0.01 -0.71 -0.04 0.00 -2.23 0.00 0.00 60.65 57.68 2o5y s ILE 207 Cb -0.16 -2.22 -0.04 0.00 -1.58 0.00 0.00 42.46 38.47 2o5y s ILE 207 CO -0.07 0.54 0.05 0.00 -1.23 0.00 0.00 174.94 174.23 2o5y s ASN 209 N -0.73 4.86 -0.26 0.00 -0.87 0.18 -1.15 114.94 116.97 2o5y s ASN 209 Ca 0.12 -1.50 -0.06 0.00 -1.57 0.00 0.00 52.86 49.84 2o5y s ASN 209 Cb -0.12 -1.70 -0.01 0.00 -0.02 0.00 0.00 41.25 39.40 2o5y s ASN 209 CO 0.03 -0.31 0.05 -0.69 -2.57 0.00 0.00 177.10 173.61 2o5y s VAL 210 N 1.17 4.03 -0.16 1.60 1.01 0.97 -0.85 120.40 128.17 2o5y s VAL 210 Ca -0.02 -0.37 -0.04 0.00 0.00 0.00 0.00 61.98 61.54 2o5y s VAL 210 Cb -0.20 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.22 2o5y s VAL 210 CO -0.03 0.29 -0.02 0.21 0.00 0.00 0.00 175.10 175.55 2o5y s ASN 211 N 1.56 4.94 -0.32 3.32 3.04 0.05 -0.24 114.94 127.29 2o5y s ASN 211 Ca 0.05 -0.10 0.02 0.00 0.04 0.00 0.00 52.86 52.88 2o5y s ASN 211 Cb -0.15 -1.82 0.09 0.00 -1.54 0.00 0.00 41.25 37.84 2o5y s ASN 211 CO 0.02 0.17 0.05 -2.28 -3.04 0.00 0.00 177.10 172.01 2o5y s HIS 212 N 0.39 3.11 0.17 0.43 5.65 -0.23 -0.21 115.29 124.59 2o5y s HIS 212 Ca -0.03 -2.55 0.05 0.00 0.25 0.00 0.00 55.06 52.78 2o5y s HIS 212 Cb -0.14 -2.46 -0.00 0.00 -1.18 0.00 0.00 32.58 28.80 2o5y s HIS 212 CO 0.02 -0.91 1.39 0.87 -0.65 0.00 0.00 174.74 175.46 2o5y h LYS 213 N 7.77 0.11 0.00 2.88 1.57 -1.82 -2.32 116.57 124.76 2o5y h LYS 213 Ca -0.08 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.56 2o5y h LYS 213 Cb 1.02 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.37 2o5y h LYS 213 CO 0.50 0.91 -0.01 -1.35 -0.57 0.00 0.00 179.45 178.93 2o5y h PRO 214 N 0.06 0.00 -0.01 3.15 0.11 -1.88 -2.78 132.00 130.65 2o5y h PRO 214 Ca -0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.08 2o5y h PRO 214 Cb 1.51 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.62 2o5y h PRO 214 CO 0.13 0.01 -0.09 -1.13 -0.21 0.00 0.00 178.00 176.71 2o5y n SER 215 N -3.34 1.54 -3.46 -2.05 3.41 -1.18 -4.91 113.62 103.63 2o5y n SER 215 Ca -0.03 -1.27 -0.22 0.00 -0.26 0.00 0.00 58.87 57.09 2o5y n SER 215 Cb 0.11 0.21 0.08 0.00 -0.26 0.00 0.00 64.21 64.35 2o5y n SER 215 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2o5y n ASN 216 N 0.19 -5.70 -4.52 4.04 4.13 -0.90 -4.95 115.26 107.55 2o5y n ASN 216 Ca 0.05 -0.53 -0.36 0.00 1.68 0.00 0.00 54.58 55.42 2o5y n ASN 216 Cb 0.23 -4.87 -0.12 0.00 -1.54 0.00 0.00 39.78 33.48 2o5y n ASN 216 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 2o5y s THR 217 N -3.31 4.65 -0.18 3.41 -4.23 -1.06 -5.02 115.64 109.90 2o5y s THR 217 Ca 0.49 -0.06 -0.03 0.00 -1.18 0.00 0.00 61.69 60.91 2o5y s THR 217 Cb -0.22 -3.17 -0.02 0.00 1.34 0.00 0.00 72.50 70.44 2o5y s THR 217 CO 0.70 0.34 -0.06 -0.54 -0.54 0.00 0.00 174.62 174.52 2o5y s LYS 218 N 1.42 3.48 0.02 3.99 1.02 -1.26 -1.07 119.74 127.34 2o5y s LYS 218 Ca 0.06 -0.60 0.04 0.00 0.02 0.00 0.00 55.97 55.48 2o5y s LYS 218 Cb -0.15 -2.89 -0.01 0.00 -0.52 0.00 0.00 37.83 34.25 2o5y s LYS 218 CO 0.05 0.05 -0.11 0.08 -0.92 0.00 0.00 175.35 174.50 2o5y s VAL 219 N 0.84 0.86 -0.08 3.17 1.01 0.67 -5.00 120.40 121.88 2o5y s VAL 219 Ca -0.02 -0.72 0.04 0.00 0.00 0.00 0.00 61.98 61.29 2o5y s VAL 219 Cb -0.15 -0.77 -0.01 0.00 0.00 0.00 0.00 36.38 35.45 2o5y s VAL 219 CO 0.01 0.06 -0.21 -1.81 0.00 0.00 0.00 175.10 173.14 2o5y s ASP 220 N -0.75 3.35 -0.09 3.32 1.01 -1.26 -0.02 116.67 122.24 2o5y s ASP 220 Ca 0.01 -0.45 0.01 0.00 0.71 0.00 0.00 52.55 52.83 2o5y s ASP 220 Cb -0.06 -1.07 0.02 0.00 1.01 0.00 0.00 42.92 42.82 2o5y s ASP 220 CO 0.00 0.23 -0.11 -0.75 0.21 0.00 0.00 175.17 174.75 2o5y s LYS 221 N -0.06 1.74 -0.29 8.23 2.47 -0.30 -4.96 119.74 126.57 2o5y s LYS 221 Ca -0.06 -0.38 -0.25 0.00 -1.56 0.00 0.00 55.97 53.73 2o5y s LYS 221 Cb -0.14 -1.58 0.00 0.00 -1.46 0.00 0.00 37.83 34.65 2o5y s LYS 221 CO 0.05 -0.11 0.84 0.21 0.16 0.00 0.00 175.35 176.49 2o5y s LYS 222 N 1.16 4.04 -0.21 4.03 2.20 -1.26 -1.23 119.74 128.46 2o5y s LYS 222 Ca -0.05 0.76 -0.14 0.00 -0.36 0.00 0.00 55.97 56.18 2o5y s LYS 222 Cb -0.14 -3.70 -0.04 0.00 -1.51 0.00 0.00 37.83 32.43 2o5y s LYS 222 CO -0.02 -0.66 0.31 0.08 -0.36 0.00 0.00 175.35 174.69 2o5y s VAL 223 N 3.02 5.26 -0.01 4.02 1.01 -0.24 -4.86 120.40 128.60 2o5y s VAL 223 Ca 0.35 0.51 -0.28 0.00 0.00 0.00 0.00 61.98 62.55 2o5y s VAL 223 Cb -0.14 -3.64 0.09 0.00 0.00 0.00 0.00 36.38 32.69 2o5y s VAL 223 CO 0.11 0.29 0.77 -1.83 0.00 0.00 0.00 175.10 174.44 2o5y s GLU 226 N 1.19 0.96 0.00 2.72 -1.05 -1.26 -4.37 118.70 116.89 2o5y s GLU 226 Ca 0.15 -0.06 0.00 0.00 -0.15 0.00 0.00 54.97 54.91 2o5y s GLU 226 Cb -0.14 0.45 0.00 0.00 -0.44 0.00 0.00 34.13 34.00 2o5y s GLU 226 CO 0.06 -0.36 0.00 -2.30 0.95 0.00 0.00 175.26 173.61