#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o5x s LEU 2 N 0.00 3.33 -0.17 4.31 0.05 -1.26 -5.04 118.68 119.90 2o5x s LEU 2 Ca 0.00 2.21 -0.04 0.00 0.05 0.00 0.00 54.13 56.34 2o5x s LEU 2 Cb 0.00 -4.57 -0.03 0.00 -2.05 0.00 0.00 46.19 39.54 2o5x s LEU 2 CO 0.00 -2.03 -0.02 -0.69 -0.55 0.00 0.00 176.35 173.06 2o5x s VAL 3 N -2.15 4.01 -0.24 1.48 1.01 -1.26 -4.94 120.40 118.32 2o5x s VAL 3 Ca 0.71 -0.31 -0.15 0.00 0.00 0.00 0.00 61.98 62.23 2o5x s VAL 3 Cb -0.25 -2.78 -0.04 0.00 0.00 0.00 0.00 36.38 33.31 2o5x s VAL 3 CO 0.44 0.48 0.38 -0.04 0.00 0.00 0.00 175.10 176.35 2o5x s MET 4 N 0.49 4.09 -0.23 2.72 -1.94 -1.26 -1.33 119.30 121.84 2o5x s MET 4 Ca -0.02 0.11 -0.03 0.00 -1.71 0.00 0.00 55.69 54.04 2o5x s MET 4 Cb -0.14 -3.60 0.01 0.00 2.01 0.00 0.00 34.83 33.11 2o5x s MET 4 CO 0.02 -0.15 -0.05 0.99 -0.01 0.00 0.00 175.02 175.82 2o5x s THR 5 N 1.68 3.13 -0.10 2.05 2.01 0.11 -4.40 115.64 120.12 2o5x s THR 5 Ca 0.17 -0.73 -0.10 0.00 0.31 0.00 0.00 61.69 61.33 2o5x s THR 5 Cb -0.15 -2.49 -0.05 0.00 0.01 0.00 0.00 72.50 69.82 2o5x s THR 5 CO 0.09 0.33 0.23 -1.10 -0.69 0.00 0.00 174.62 173.47 2o5x s GLN 6 N 1.41 3.77 0.01 4.92 -0.21 -1.26 -0.65 119.66 127.65 2o5x s GLN 6 Ca 0.04 0.03 0.02 0.00 0.02 0.00 0.00 55.36 55.46 2o5x s GLN 6 Cb -0.15 -3.26 -0.01 0.00 1.00 0.00 0.00 33.01 30.59 2o5x s GLN 6 CO -0.04 0.62 -0.05 0.95 -2.12 0.00 0.00 175.29 174.65 2o5x s THR 7 N -0.66 0.39 0.85 -0.19 -4.23 -0.77 -4.51 115.64 106.52 2o5x s THR 7 Ca 0.17 -0.45 -0.13 0.00 -1.18 0.00 0.00 61.69 60.09 2o5x s THR 7 Cb -0.13 -0.38 0.11 0.00 1.34 0.00 0.00 72.50 73.44 2o5x s THR 7 CO 0.06 -0.05 1.20 -2.16 -0.54 0.00 0.00 174.62 173.13 2o5x s PRO 8 N -0.55 1.61 0.26 3.99 0.04 -1.26 -1.72 135.00 137.37 2o5x s PRO 8 Ca -0.02 0.02 0.07 0.00 0.04 0.00 0.00 61.00 61.11 2o5x s PRO 8 Cb -0.04 -1.92 0.33 0.00 0.04 0.00 0.00 34.50 32.91 2o5x s PRO 8 CO -0.00 -1.82 1.61 -0.07 0.04 0.00 0.00 177.00 176.75 2o5x h LEU 9 N -1.22 0.19 -7.85 -3.56 4.07 -1.85 -3.42 115.31 101.67 2o5x h LEU 9 Ca -0.46 -0.10 -0.33 0.00 0.08 0.00 0.00 57.88 57.07 2o5x h LEU 9 Cb 1.31 -0.05 -0.30 0.00 1.08 0.00 0.00 40.66 42.70 2o5x h LEU 9 CO 0.60 0.71 -0.75 -0.44 -1.08 0.00 0.00 178.44 177.48 2o5x s SER 10 N -6.88 0.59 -0.30 -0.43 0.01 -1.26 -1.33 113.70 104.09 2o5x s SER 10 Ca -0.03 -0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.14 2o5x s SER 10 Cb 0.12 -0.12 0.09 0.00 0.21 0.00 0.00 66.02 66.33 2o5x s SER 10 CO 0.78 0.03 0.07 -0.22 0.41 0.00 0.00 173.24 174.32 2o5x s LEU 11 N 0.10 2.76 0.16 2.44 2.96 0.53 -4.92 118.68 122.72 2o5x s LEU 11 Ca -0.01 -1.67 -0.30 0.00 -0.22 0.00 0.00 54.13 51.93 2o5x s LEU 11 Cb -0.04 -1.04 -0.07 0.00 0.50 0.00 0.00 46.19 45.53 2o5x s LEU 11 CO -0.00 -0.39 1.00 -2.16 -1.32 0.00 0.00 176.35 173.48 2o5x s PRO 12 N 1.46 4.71 -0.05 0.98 0.04 -1.26 -0.86 135.00 140.01 2o5x s PRO 12 Ca 0.08 1.54 -0.04 0.00 0.04 0.00 0.00 61.00 62.62 2o5x s PRO 12 Cb -0.18 -3.32 0.02 0.00 0.04 0.00 0.00 34.50 31.06 2o5x s PRO 12 CO -0.19 0.25 0.13 0.08 0.04 0.00 0.00 177.00 177.30 2o5x s VAL 13 N -0.37 -0.01 0.49 -0.36 1.01 0.02 -4.92 120.40 116.25 2o5x s VAL 13 Ca 0.46 0.03 -0.18 0.00 0.00 0.00 0.00 61.98 62.29 2o5x s VAL 13 Cb -0.26 -0.19 -0.09 0.00 0.00 0.00 0.00 36.38 35.84 2o5x s VAL 13 CO 0.32 0.01 0.98 -0.44 0.00 0.00 0.00 175.10 175.98 2o5x s SER 14 N 0.27 6.64 0.31 3.32 0.01 -1.26 -0.15 113.70 122.85 2o5x s SER 14 Ca -0.02 1.66 -0.30 0.00 1.31 0.00 0.00 55.95 58.61 2o5x s SER 14 Cb -0.03 -2.53 -0.12 0.00 0.21 0.00 0.00 66.02 63.56 2o5x s SER 14 CO -0.01 -0.57 1.50 0.18 0.41 0.00 0.00 173.24 174.75 2o5x n LEU 15 N -1.23 4.09 0.00 2.44 7.99 -1.25 -1.59 117.00 127.45 2o5x n LEU 15 Ca 0.07 1.17 0.00 0.00 -0.01 0.00 0.00 56.01 57.24 2o5x n LEU 15 Cb 0.54 -1.55 0.00 0.00 -0.11 0.00 0.00 43.42 42.30 2o5x n LEU 15 CO 0.43 -0.06 0.00 0.61 -1.51 0.00 0.00 177.39 176.86 2o5x n GLY 16 N 1.65 2.45 3.95 -0.72 0.00 0.56 -4.85 105.19 108.23 2o5x n GLY 16 Ca 0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.85 2o5x n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2o5x s ASP 17 N -2.18 4.76 -0.08 1.61 1.11 -0.62 -4.02 116.67 117.25 2o5x s ASP 17 Ca 0.00 0.24 -0.12 0.00 0.18 0.00 0.00 52.55 52.84 2o5x s ASP 17 Cb 0.00 -0.87 -0.05 0.00 1.07 0.00 0.00 42.92 43.07 2o5x s ASP 17 CO 0.00 -1.59 0.30 -1.58 1.18 0.00 0.00 175.17 173.47 2o5x s GLN 18 N -5.16 3.89 -0.08 8.23 0.74 -1.26 -0.80 119.66 125.22 2o5x s GLN 18 Ca 0.61 0.16 0.00 0.00 0.05 0.00 0.00 55.36 56.19 2o5x s GLN 18 Cb -0.10 -3.28 -0.03 0.00 1.10 0.00 0.00 33.01 30.71 2o5x s GLN 18 CO 0.44 0.57 -0.07 0.00 -0.55 0.00 0.00 175.29 175.67 2o5x s ALA 19 N -0.57 2.95 -0.10 1.58 0.00 0.04 -4.97 121.76 120.70 2o5x s ALA 19 Ca 0.19 -0.89 0.01 0.00 0.00 0.00 0.00 51.96 51.28 2o5x s ALA 19 Cb -0.14 -1.25 0.02 0.00 0.00 0.00 0.00 23.12 21.74 2o5x s ALA 19 CO 0.08 0.52 -0.12 -1.12 0.00 0.00 0.00 175.76 175.11 2o5x s SER 20 N -0.62 2.18 -0.11 0.00 0.01 -1.26 -1.10 113.70 112.80 2o5x s SER 20 Ca 0.09 -0.36 0.03 0.00 1.31 0.00 0.00 55.95 57.02 2o5x s SER 20 Cb -0.12 -0.95 -0.00 0.00 0.21 0.00 0.00 66.02 65.16 2o5x s SER 20 CO 0.02 -0.02 -0.22 -0.63 0.41 0.00 0.00 173.24 172.80 2o5x s ILE 21 N 1.11 2.25 -0.09 1.44 1.01 0.08 -4.79 121.20 122.21 2o5x s ILE 21 Ca -0.05 -0.95 -0.04 0.00 0.00 0.00 0.00 60.65 59.61 2o5x s ILE 21 Cb -0.14 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.41 2o5x s ILE 21 CO -0.02 0.55 0.08 -0.55 0.00 0.00 0.00 174.94 175.00 2o5x s SER 22 N 0.37 5.87 -0.07 3.58 0.15 -0.70 -0.64 113.70 122.26 2o5x s SER 22 Ca -0.17 0.30 0.01 0.00 0.70 0.00 0.00 55.95 56.79 2o5x s SER 22 Cb -0.17 -1.79 0.02 0.00 -1.71 0.00 0.00 66.02 62.37 2o5x s SER 22 CO 0.08 0.37 -0.07 0.00 1.20 0.00 0.00 173.24 174.82 2o5x s ARG 24 N 1.19 2.10 0.13 0.00 3.52 0.18 -0.78 118.95 125.28 2o5x s ARG 24 Ca -0.06 -0.63 0.04 0.00 -0.13 0.00 0.00 55.73 54.95 2o5x s ARG 24 Cb -0.14 -1.72 -0.04 0.00 -1.56 0.00 0.00 34.95 31.49 2o5x s ARG 24 CO -0.02 0.18 0.10 -1.54 -0.81 0.00 0.00 175.30 173.21 2o5x s SER 25 N 0.27 5.45 0.25 -2.12 1.04 -0.31 0.07 113.70 118.36 2o5x s SER 25 Ca -0.10 -0.11 0.26 0.00 0.48 0.00 0.00 55.95 56.48 2o5x s SER 25 Cb -0.14 -1.42 0.83 0.00 0.10 0.00 0.00 66.02 65.38 2o5x s SER 25 CO 0.04 0.11 1.76 0.77 0.98 0.00 0.00 173.24 176.90 2o5x h SER 26 N 2.79 0.00 -4.87 7.02 4.64 -1.54 -3.46 113.55 118.13 2o5x h SER 26 Ca -0.47 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 60.63 2o5x h SER 26 Cb 1.19 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.07 2o5x h SER 26 CO 0.64 0.00 -0.72 -1.58 -0.87 0.00 0.00 176.83 174.30 2o5x s GLN 27 N -3.18 0.46 0.29 4.77 0.74 -1.26 -4.97 119.66 116.51 2o5x s GLN 27 Ca 0.09 -0.75 -0.30 0.00 0.05 0.00 0.00 55.36 54.45 2o5x s GLN 27 Cb 0.11 -0.10 -0.12 0.00 1.10 0.00 0.00 33.01 34.01 2o5x s GLN 27 CO 0.56 -0.00 1.59 0.45 -0.55 0.00 0.00 175.29 177.34 2o5x n SER 27 N 1.38 3.82 -0.89 6.67 2.88 -1.26 -4.72 113.62 121.49 2o5x n SER 27 Ca -0.22 1.15 0.06 0.00 -1.33 0.00 0.00 58.87 58.52 2o5x n SER 27 Cb 0.55 -1.59 0.19 0.00 -0.75 0.00 0.00 64.21 62.62 2o5x n SER 27 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2o5x n LEU 27 N 2.18 2.56 -4.63 2.46 4.77 0.07 -4.85 117.00 119.55 2o5x n LEU 27 Ca 0.09 -1.28 -0.41 0.00 -0.03 0.00 0.00 56.01 54.37 2o5x n LEU 27 Cb 0.36 -0.36 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 2o5x n LEU 27 CO 0.64 0.52 0.50 -0.69 -1.33 0.00 0.00 177.39 177.03 2o5x s VAL 27 N -1.60 4.92 0.48 4.08 1.01 -1.26 -3.73 120.40 124.29 2o5x s VAL 27 Ca 0.28 1.31 -0.21 0.00 0.00 0.00 0.00 61.98 63.35 2o5x s VAL 27 Cb 0.16 -4.01 -0.08 0.00 0.00 0.00 0.00 36.38 32.45 2o5x s VAL 27 CO 0.16 -0.02 1.06 -2.28 0.00 0.00 0.00 175.10 174.02 2o5x s HIS 27 N 2.65 2.99 0.60 5.22 2.46 0.51 -4.92 115.29 124.80 2o5x s HIS 27 Ca 0.30 1.58 0.29 0.00 0.47 0.00 0.00 55.06 57.70 2o5x s HIS 27 Cb -0.15 -3.13 1.46 0.00 -0.13 0.00 0.00 32.58 30.63 2o5x s HIS 27 CO 0.08 -0.94 1.87 0.66 -2.47 0.00 0.00 174.74 173.94 2o5x h SER 27 N 1.72 0.00 0.00 9.88 4.64 -1.96 0.35 113.55 128.17 2o5x h SER 27 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2o5x h SER 27 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2o5x h SER 27 CO 0.59 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.09 2o5x n ASN 28 N -3.61 0.00 0.00 4.97 0.23 -1.26 -4.91 115.26 110.68 2o5x n ASN 28 Ca 0.08 -1.10 0.00 0.00 -0.53 0.00 0.00 54.58 53.03 2o5x n ASN 28 Cb 0.67 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.37 2o5x n ASN 28 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2o5x n GLY 29 N 0.83 3.20 3.87 4.83 0.00 0.12 -5.06 105.19 112.98 2o5x n GLY 29 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 2o5x n GLY 29 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2o5x s ASN 30 N -1.10 6.60 -0.32 1.61 0.01 -1.26 -4.76 114.94 115.72 2o5x s ASN 30 Ca 0.00 1.12 -0.01 0.00 -0.71 0.00 0.00 52.86 53.26 2o5x s ASN 30 Cb 0.00 -2.31 0.07 0.00 0.41 0.00 0.00 41.25 39.41 2o5x s ASN 30 CO 0.00 -0.30 0.04 -0.89 -1.51 0.00 0.00 177.10 174.44 2o5x s THR 31 N -2.19 2.90 -1.29 1.60 2.01 -1.26 -0.36 115.64 117.04 2o5x s THR 31 Ca 0.51 -1.67 -0.09 0.00 0.31 0.00 0.00 61.69 60.76 2o5x s THR 31 Cb -0.10 -2.79 0.16 0.00 0.01 0.00 0.00 72.50 69.77 2o5x s THR 31 CO 0.26 -0.28 1.95 -1.22 -0.69 0.00 0.00 174.62 174.64 2o5x n TYR 32 N 4.56 2.88 -4.46 4.92 4.01 -1.24 -4.26 117.16 123.56 2o5x n TYR 32 Ca -0.09 -2.79 -0.33 0.00 -0.16 0.00 0.00 57.90 54.53 2o5x n TYR 32 Cb 0.43 -1.95 -0.16 0.00 -0.31 0.00 0.00 39.34 37.35 2o5x n TYR 32 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 2o5x s LEU 33 N -0.33 2.24 0.24 7.72 1.98 -1.26 -1.69 118.68 127.58 2o5x s LEU 33 Ca 0.41 -0.57 0.06 0.00 -2.89 0.00 0.00 54.13 51.14 2o5x s LEU 33 Cb 0.11 -1.50 -0.05 0.00 0.66 0.00 0.00 46.19 45.41 2o5x s LEU 33 CO -0.01 0.06 -0.08 -1.00 -1.89 0.00 0.00 176.35 173.43 2o5x s HIS 34 N 0.97 1.77 0.02 5.38 3.76 0.12 0.28 115.29 127.59 2o5x s HIS 34 Ca -0.03 -0.70 0.04 0.00 -0.15 0.00 0.00 55.06 54.22 2o5x s HIS 34 Cb -0.15 -0.96 -0.02 0.00 1.11 0.00 0.00 32.58 32.57 2o5x s HIS 34 CO -0.04 0.24 -0.14 -1.58 -0.85 0.00 0.00 174.74 172.37 2o5x s TRP 35 N -3.09 1.20 0.08 1.40 0.52 0.13 -1.08 118.94 118.11 2o5x s TRP 35 Ca 0.26 -0.29 0.06 0.00 0.02 0.00 0.00 56.10 56.16 2o5x s TRP 35 Cb 0.03 -0.74 -0.03 0.00 -1.15 0.00 0.00 33.47 31.57 2o5x s TRP 35 CO 0.09 0.01 -0.17 0.71 0.02 0.00 0.00 176.95 177.61 2o5x s TYR 36 N -0.61 1.47 -0.08 -1.98 1.51 -0.13 -1.05 117.35 116.48 2o5x s TYR 36 Ca 0.03 -0.44 0.05 0.00 -1.01 0.00 0.00 57.07 55.70 2o5x s TYR 36 Cb -0.07 -0.81 -0.00 0.00 -0.11 0.00 0.00 41.96 40.97 2o5x s TYR 36 CO 0.00 0.12 -0.24 -1.17 -1.11 0.00 0.00 175.55 173.16 2o5x s LEU 37 N -1.80 2.07 -0.23 -1.29 2.96 0.32 -0.34 118.68 120.36 2o5x s LEU 37 Ca 0.02 -0.53 0.00 0.00 -0.22 0.00 0.00 54.13 53.40 2o5x s LEU 37 Cb -0.10 -1.37 0.03 0.00 0.50 0.00 0.00 46.19 45.25 2o5x s LEU 37 CO 0.03 0.19 -0.11 -1.58 -1.32 0.00 0.00 176.35 173.57 2o5x s GLN 38 N 0.12 2.72 0.44 1.98 0.74 0.67 -0.21 119.66 126.12 2o5x s GLN 38 Ca -0.12 -1.04 -0.11 0.00 0.05 0.00 0.00 55.36 54.14 2o5x s GLN 38 Cb -0.16 -2.86 -0.06 0.00 1.10 0.00 0.00 33.01 31.03 2o5x s GLN 38 CO 0.06 -0.40 0.83 0.15 -0.55 0.00 0.00 175.29 175.38 2o5x s LYS 39 N 1.26 3.79 -0.01 1.67 1.02 -1.26 -0.81 119.74 125.40 2o5x s LYS 39 Ca -0.01 0.56 -0.36 0.00 0.02 0.00 0.00 55.97 56.18 2o5x s LYS 39 Cb -0.17 -2.32 -0.14 0.00 -0.52 0.00 0.00 37.83 34.68 2o5x s LYS 39 CO -0.07 -0.12 1.65 -0.35 -0.92 0.00 0.00 175.35 175.54 2o5x n PRO 40 N -1.48 1.78 -0.07 -1.68 -0.04 -1.26 -1.57 135.00 130.68 2o5x n PRO 40 Ca 0.03 0.65 0.00 0.00 -0.04 0.00 0.00 63.50 64.14 2o5x n PRO 40 Cb 0.54 -2.40 0.00 0.00 -0.04 0.00 0.00 33.50 31.60 2o5x n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2o5x n GLY 41 N 3.66 1.76 3.78 0.55 0.00 -1.26 -5.03 105.19 108.65 2o5x n GLY 41 Ca 0.21 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.00 2o5x n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2o5x s GLN 42 N -0.37 2.40 0.57 1.61 -0.21 -0.61 -5.11 119.66 117.94 2o5x s GLN 42 Ca 0.00 -1.60 -0.20 0.00 0.02 0.00 0.00 55.36 53.58 2o5x s GLN 42 Cb 0.00 -2.20 -0.04 0.00 1.00 0.00 0.00 33.01 31.77 2o5x s GLN 42 CO 0.00 -0.01 1.24 -1.12 -2.12 0.00 0.00 175.29 173.28 2o5x s SER 43 N -3.94 5.31 0.69 5.90 0.01 -1.26 -4.67 113.70 115.74 2o5x s SER 43 Ca 0.41 2.47 -0.17 0.00 1.31 0.00 0.00 55.95 59.98 2o5x s SER 43 Cb -0.01 -2.61 0.01 0.00 0.21 0.00 0.00 66.02 63.62 2o5x s SER 43 CO 0.24 -1.52 1.20 -2.65 0.41 0.00 0.00 173.24 170.93 2o5x n PRO 44 N -1.33 0.81 -4.92 12.44 -0.02 -1.26 -4.53 135.00 136.20 2o5x n PRO 44 Ca 0.12 0.34 -0.26 0.00 -2.02 0.00 0.00 63.50 61.68 2o5x n PRO 44 Cb 0.48 -2.44 -0.16 0.00 -0.02 0.00 0.00 33.50 31.36 2o5x n PRO 44 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2o5x s LYS 45 N -3.48 1.70 0.08 -0.52 -0.14 0.70 -4.94 119.74 113.14 2o5x s LYS 45 Ca 0.79 -0.67 -0.31 0.00 -1.36 0.00 0.00 55.97 54.42 2o5x s LYS 45 Cb -0.36 -1.56 -0.07 0.00 -1.68 0.00 0.00 37.83 34.16 2o5x s LYS 45 CO 0.44 0.35 1.31 0.12 -0.76 0.00 0.00 175.35 176.81 2o5x s PHE 46 N -0.25 3.29 0.05 3.18 5.36 -1.26 -0.52 117.98 127.82 2o5x s PHE 46 Ca 0.03 1.08 -0.02 0.00 -0.96 0.00 0.00 56.93 57.06 2o5x s PHE 46 Cb -0.09 -3.58 -0.01 0.00 -0.34 0.00 0.00 43.02 39.00 2o5x s PHE 46 CO 0.01 -1.95 -0.04 -0.11 -1.46 0.00 0.00 175.22 171.67 2o5x n LEU 47 N 4.08 0.97 -4.01 6.12 7.94 -0.21 -4.76 117.00 127.12 2o5x n LEU 47 Ca 0.11 0.13 -0.22 0.00 -1.11 0.00 0.00 56.01 54.91 2o5x n LEU 47 Cb 0.44 -0.31 -0.16 0.00 0.53 0.00 0.00 43.42 43.92 2o5x n LEU 47 CO 0.57 -0.53 -0.45 -0.63 -1.11 0.00 0.00 177.39 175.24 2o5x s ILE 48 N -2.08 0.93 0.14 1.96 -1.09 -0.95 -1.23 121.20 118.89 2o5x s ILE 48 Ca -0.03 -0.41 0.08 0.00 -2.23 0.00 0.00 60.65 58.06 2o5x s ILE 48 Cb 0.01 -0.84 -0.04 0.00 -1.58 0.00 0.00 42.46 40.00 2o5x s ILE 48 CO 0.04 0.29 -0.08 -0.72 -1.23 0.00 0.00 174.94 173.25 2o5x s TYR 49 N 0.39 2.72 -1.33 3.97 1.13 0.52 -0.69 117.35 124.06 2o5x s TYR 49 Ca -0.07 -0.18 -0.13 0.00 -1.41 0.00 0.00 57.07 55.28 2o5x s TYR 49 Cb -0.12 -1.37 0.01 0.00 -1.10 0.00 0.00 41.96 39.38 2o5x s TYR 49 CO 0.02 0.47 0.48 1.63 -2.51 0.00 0.00 175.55 175.64 2o5x n LYS 50 N 0.32 -1.61 0.00 -3.49 5.02 -0.88 -1.83 118.16 115.68 2o5x n LYS 50 Ca -0.12 0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.44 2o5x n LYS 50 Cb 0.54 -3.76 0.00 0.00 -0.02 0.00 0.00 35.03 31.79 2o5x n LYS 50 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2o5x n VAL 51 N -4.55 0.00 -0.74 -0.18 0.31 0.14 -4.18 118.33 109.13 2o5x n VAL 51 Ca -0.22 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.11 2o5x n VAL 51 Cb 0.64 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.57 2o5x n VAL 51 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2o5x n SER 52 N 3.26 0.50 -4.55 4.52 3.41 -1.23 -3.50 113.62 116.03 2o5x n SER 52 Ca 0.00 -1.23 -0.35 0.00 -0.26 0.00 0.00 58.87 57.02 2o5x n SER 52 Cb 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.84 2o5x n SER 52 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2o5x s ASN 53 N -0.23 5.38 0.17 4.04 0.01 -0.76 -4.59 114.94 118.96 2o5x s ASN 53 Ca 0.00 -0.05 -0.30 0.00 -0.71 0.00 0.00 52.86 51.80 2o5x s ASN 53 Cb 0.00 -1.94 -0.08 0.00 0.41 0.00 0.00 41.25 39.65 2o5x s ASN 53 CO 0.00 0.09 1.11 -0.13 -1.51 0.00 0.00 177.10 176.66 2o5x s ARG 54 N 0.86 4.58 0.78 -0.60 0.52 -1.26 -0.35 118.95 123.47 2o5x s ARG 54 Ca 0.03 1.73 -0.11 0.00 -0.52 0.00 0.00 55.73 56.87 2o5x s ARG 54 Cb -0.14 -3.28 0.06 0.00 0.52 0.00 0.00 34.95 32.11 2o5x s ARG 54 CO 0.02 0.05 1.09 0.12 0.02 0.00 0.00 175.30 176.60 2o5x s PHE 55 N -0.18 2.62 0.14 -0.53 5.36 -0.36 -4.86 117.98 120.16 2o5x s PHE 55 Ca 0.50 1.51 -0.35 0.00 -0.96 0.00 0.00 56.93 57.63 2o5x s PHE 55 Cb -0.30 -3.04 -0.15 0.00 -0.34 0.00 0.00 43.02 39.19 2o5x s PHE 55 CO 0.35 -1.79 1.43 0.45 -1.46 0.00 0.00 175.22 174.20 2o5x n SER 56 N -3.51 2.32 0.00 6.13 2.88 -1.26 -2.33 113.62 117.84 2o5x n SER 56 Ca 0.09 1.11 0.00 0.00 -1.33 0.00 0.00 58.87 58.73 2o5x n SER 56 Cb 0.53 -1.31 0.00 0.00 -0.75 0.00 0.00 64.21 62.68 2o5x n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2o5x n GLY 57 N 2.83 1.62 3.69 0.46 0.00 -1.26 -5.03 105.19 107.50 2o5x n GLY 57 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2o5x n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5x s VAL 58 N -2.65 4.73 0.63 1.61 1.01 -0.99 -5.02 120.40 119.72 2o5x s VAL 58 Ca 0.00 1.98 -0.18 0.00 0.00 0.00 0.00 61.98 63.78 2o5x s VAL 58 Cb 0.00 -4.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.08 2o5x s VAL 58 CO 0.00 0.05 1.07 -2.65 0.00 0.00 0.00 175.10 173.57 2o5x n PRO 59 N 4.69 0.93 0.11 2.72 -0.02 -1.26 -4.89 135.00 137.28 2o5x n PRO 59 Ca 0.08 0.37 0.19 0.00 -2.02 0.00 0.00 63.50 62.12 2o5x n PRO 59 Cb 0.49 -2.30 0.76 0.00 -0.02 0.00 0.00 33.50 32.44 2o5x n PRO 59 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2o5x h ASP 60 N 0.42 0.00 0.37 2.55 3.32 -2.01 -2.35 116.42 118.73 2o5x h ASP 60 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 2o5x h ASP 60 Cb 1.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.91 2o5x h ASP 60 CO 0.51 0.00 0.00 0.08 -1.72 0.00 0.00 179.24 178.11 2o5x h ARG 61 N 0.00 0.00 -5.44 3.56 0.11 -1.90 -3.41 114.38 107.30 2o5x h ARG 61 Ca 0.17 0.00 -0.60 0.00 0.10 0.00 0.00 59.98 59.65 2o5x h ARG 61 Cb 0.90 0.00 -0.11 0.00 1.11 0.00 0.00 29.97 31.87 2o5x h ARG 61 CO -0.00 0.00 -0.26 -0.06 0.10 0.00 0.00 179.97 179.75 2o5x s PHE 62 N -3.48 3.41 -0.01 4.08 0.40 -0.89 -1.22 117.98 120.27 2o5x s PHE 62 Ca 0.01 0.60 -0.05 0.00 -0.60 0.00 0.00 56.93 56.88 2o5x s PHE 62 Cb 0.08 -2.45 0.00 0.00 0.51 0.00 0.00 43.02 41.17 2o5x s PHE 62 CO 0.31 0.09 0.11 -1.54 0.70 0.00 0.00 175.22 174.89 2o5x s SER 63 N 0.82 0.00 0.11 1.36 1.04 -0.47 -4.90 113.70 111.67 2o5x s SER 63 Ca 0.18 -0.09 0.09 0.00 0.48 0.00 0.00 55.95 56.60 2o5x s SER 63 Cb -0.14 0.21 -0.04 0.00 0.10 0.00 0.00 66.02 66.15 2o5x s SER 63 CO 0.06 -0.24 -0.17 -0.83 0.98 0.00 0.00 173.24 173.04 2o5x s GLY 64 N -0.88 1.70 0.35 7.32 0.00 -1.25 -0.57 107.32 113.98 2o5x s GLY 64 Ca -0.10 -1.33 -0.03 0.00 0.00 0.00 0.00 44.72 43.27 2o5x s GLY 64 CO 0.01 -1.30 0.49 -1.35 0.00 0.00 0.00 173.10 170.94 2o5x s SER 65 N -2.10 0.92 0.00 1.64 1.04 -0.23 -4.10 113.70 110.87 2o5x s SER 65 Ca 0.18 -1.49 0.00 0.00 0.48 0.00 0.00 55.95 55.12 2o5x s SER 65 Cb -0.11 0.68 0.00 0.00 0.10 0.00 0.00 66.02 66.69 2o5x s SER 65 CO 0.10 -1.32 0.00 0.61 0.98 0.00 0.00 173.24 173.61 2o5x n GLY 66 N -0.57 1.59 3.58 7.32 0.00 -1.26 -1.58 105.19 114.26 2o5x n GLY 66 Ca 0.01 -2.20 -0.10 0.00 0.00 0.00 0.00 46.02 43.72 2o5x n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2o5x s SER 67 N 0.00 -0.43 1.16 1.61 1.04 -0.58 -4.95 113.70 111.55 2o5x s SER 67 Ca 0.00 -0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.17 2o5x s SER 67 Cb 0.00 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.76 2o5x s SER 67 CO 0.00 -1.10 0.00 0.61 0.98 0.00 0.00 173.24 173.73 2o5x n GLY 68 N -0.40 1.06 0.00 7.32 0.00 -1.26 -2.02 105.19 109.89 2o5x n GLY 68 Ca -0.12 0.35 0.06 0.00 0.00 0.00 0.00 46.02 46.31 2o5x n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2o5x n THR 69 N 0.00 0.00 -4.73 2.61 -2.24 -1.26 -0.76 114.28 107.90 2o5x n THR 69 Ca 0.00 -0.21 -0.32 0.00 -2.27 0.00 0.00 64.05 61.24 2o5x n THR 69 Cb 0.00 0.84 -0.17 0.00 -2.10 0.00 0.00 70.33 68.90 2o5x n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2o5x s ASP 70 N -2.51 3.12 0.06 3.42 1.11 -0.86 -1.16 116.67 119.86 2o5x s ASP 70 Ca 0.03 -0.60 0.03 0.00 0.18 0.00 0.00 52.55 52.19 2o5x s ASP 70 Cb 0.10 -1.44 -0.03 0.00 1.07 0.00 0.00 42.92 42.61 2o5x s ASP 70 CO 0.55 0.09 -0.09 -0.36 1.18 0.00 0.00 175.17 176.54 2o5x s PHE 71 N 0.76 0.84 -0.02 4.23 0.08 0.04 -1.53 117.98 122.38 2o5x s PHE 71 Ca -0.08 -0.55 -0.01 0.00 0.12 0.00 0.00 56.93 56.40 2o5x s PHE 71 Cb -0.16 -0.49 0.02 0.00 -0.57 0.00 0.00 43.02 41.82 2o5x s PHE 71 CO -0.01 -0.05 0.04 0.42 -0.10 0.00 0.00 175.22 175.52 2o5x s ILE 72 N -1.72 -0.03 -0.19 0.64 1.01 -0.61 -0.69 121.20 119.61 2o5x s ILE 72 Ca -0.04 0.10 -0.06 0.00 0.00 0.00 0.00 60.65 60.65 2o5x s ILE 72 Cb -0.08 -0.08 -0.03 0.00 0.01 0.00 0.00 42.46 42.28 2o5x s ILE 72 CO 0.00 0.04 0.01 -0.22 0.00 0.00 0.00 174.94 174.77 2o5x s LEU 73 N 0.52 3.43 -0.08 2.97 2.96 0.19 -1.06 118.68 127.60 2o5x s LEU 73 Ca -0.04 -0.10 0.03 0.00 -0.22 0.00 0.00 54.13 53.80 2o5x s LEU 73 Cb -0.06 -1.86 -0.02 0.00 0.50 0.00 0.00 46.19 44.75 2o5x s LEU 73 CO -0.02 0.12 -0.18 -0.54 -1.32 0.00 0.00 176.35 174.41 2o5x s LYS 74 N 0.68 2.87 -0.30 1.98 1.02 0.26 -0.74 119.74 125.50 2o5x s LYS 74 Ca 0.01 -0.77 0.00 0.00 0.02 0.00 0.00 55.97 55.22 2o5x s LYS 74 Cb -0.14 -2.39 0.06 0.00 -0.52 0.00 0.00 37.83 34.84 2o5x s LYS 74 CO 0.02 0.37 -0.01 0.42 -0.92 0.00 0.00 175.35 175.23 2o5x s ILE 75 N -0.10 2.71 0.63 2.17 1.01 -0.26 -1.36 121.20 126.00 2o5x s ILE 75 Ca -0.03 -1.59 -0.11 0.00 0.00 0.00 0.00 60.65 58.91 2o5x s ILE 75 Cb -0.14 -2.63 -0.03 0.00 0.01 0.00 0.00 42.46 39.68 2o5x s ILE 75 CO 0.04 -0.17 1.03 -0.94 0.00 0.00 0.00 174.94 174.90 2o5x s SER 76 N 1.22 6.07 -1.07 3.58 1.04 -0.36 -0.78 113.70 123.41 2o5x s SER 76 Ca -0.04 1.34 -0.21 0.00 0.48 0.00 0.00 55.95 57.52 2o5x s SER 76 Cb -0.20 -2.35 0.02 0.00 0.10 0.00 0.00 66.02 63.59 2o5x s SER 76 CO -0.03 -0.96 0.68 0.54 0.98 0.00 0.00 173.24 174.45 2o5x n ARG 77 N -2.78 -0.82 -1.75 4.02 1.74 -1.12 -4.77 116.66 111.17 2o5x n ARG 77 Ca 0.06 0.39 -0.41 0.00 -0.77 0.00 0.00 57.85 57.12 2o5x n ARG 77 Cb 0.55 -2.83 -0.00 0.00 -1.02 0.00 0.00 32.46 29.15 2o5x n ARG 77 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2o5x n VAL 78 N -4.07 2.07 -4.43 1.55 0.31 0.02 -4.54 118.33 109.23 2o5x n VAL 78 Ca -0.17 -0.50 -0.24 0.00 -0.01 0.00 0.00 64.34 63.43 2o5x n VAL 78 Cb 0.60 -1.84 -0.09 0.00 -0.91 0.00 0.00 33.84 31.60 2o5x n VAL 78 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2o5x s GLU 79 N -2.06 1.83 0.47 5.55 2.02 -1.26 -0.32 118.70 124.93 2o5x s GLU 79 Ca 0.55 -1.71 0.16 0.00 0.02 0.00 0.00 54.97 53.98 2o5x s GLU 79 Cb -0.50 -1.85 1.14 0.00 0.10 0.00 0.00 34.13 33.01 2o5x s GLU 79 CO 0.63 0.32 2.04 0.00 0.02 0.00 0.00 175.26 178.27 2o5x h ALA 80 N 2.16 2.06 0.00 5.21 0.00 -1.87 -0.86 119.26 125.96 2o5x h ALA 80 Ca -0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2o5x h ALA 80 Cb 1.26 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2o5x h ALA 80 CO 0.61 -0.15 0.00 -0.85 0.00 0.00 0.00 179.25 178.86 2o5x n GLU 81 N -4.47 0.03 0.00 0.00 0.28 -1.22 -2.99 120.64 112.27 2o5x n GLU 81 Ca 0.05 0.09 0.11 0.00 -0.16 0.00 0.00 57.16 57.26 2o5x n GLU 81 Cb 0.30 -1.54 0.53 0.00 1.43 0.00 0.00 31.44 32.15 2o5x n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2o5x n ASP 82 N -1.60 0.00 -4.61 -1.84 8.00 -0.33 -4.88 116.55 111.30 2o5x n ASP 82 Ca 0.06 0.33 -0.46 0.00 0.71 0.00 0.00 54.79 55.43 2o5x n ASP 82 Cb 0.30 -0.44 -0.03 0.00 -0.02 0.00 0.00 41.12 40.94 2o5x n ASP 82 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2o5x n LEU 83 N -1.44 2.06 0.00 0.64 7.94 -1.16 -4.89 117.00 120.16 2o5x n LEU 83 Ca 0.07 1.16 0.00 0.00 -1.11 0.00 0.00 56.01 56.13 2o5x n LEU 83 Cb 0.25 -1.30 0.00 0.00 0.53 0.00 0.00 43.42 42.90 2o5x n LEU 83 CO 0.21 -1.12 0.00 0.61 -1.11 0.00 0.00 177.39 175.97 2o5x n GLY 84 N 1.69 -0.21 3.40 -3.96 0.00 -1.22 -4.63 105.19 100.26 2o5x n GLY 84 Ca 0.12 -1.50 -0.35 0.00 0.00 0.00 0.00 46.02 44.29 2o5x n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5x s VAL 85 N -2.70 3.72 -0.14 1.61 1.01 0.01 -0.84 120.40 123.07 2o5x s VAL 85 Ca 0.00 -0.39 -0.11 0.00 0.00 0.00 0.00 61.98 61.47 2o5x s VAL 85 Cb 0.00 -2.67 -0.05 0.00 0.00 0.00 0.00 36.38 33.66 2o5x s VAL 85 CO 0.00 0.44 0.23 -0.31 0.00 0.00 0.00 175.10 175.46 2o5x s TYR 86 N 1.07 3.52 -0.07 5.22 1.51 -0.12 -0.24 117.35 128.24 2o5x s TYR 86 Ca 0.02 0.57 0.03 0.00 -1.01 0.00 0.00 57.07 56.68 2o5x s TYR 86 Cb -0.14 -2.19 0.01 0.00 -0.11 0.00 0.00 41.96 39.52 2o5x s TYR 86 CO 0.01 0.43 -0.16 -0.06 -1.11 0.00 0.00 175.55 174.66 2o5x s PHE 87 N -0.15 1.77 0.61 2.71 0.08 0.54 -1.37 117.98 122.17 2o5x s PHE 87 Ca 0.15 -0.64 -0.09 0.00 0.12 0.00 0.00 56.93 56.47 2o5x s PHE 87 Cb -0.13 -1.24 -0.01 0.00 -0.57 0.00 0.00 43.02 41.08 2o5x s PHE 87 CO 0.04 -0.28 0.97 0.00 -0.10 0.00 0.00 175.22 175.85 2o5x s PHE 89 N -3.10 -0.94 -0.04 0.00 5.36 -0.24 -0.70 117.98 118.32 2o5x s PHE 89 Ca 0.54 1.80 0.02 0.00 -0.96 0.00 0.00 56.93 58.33 2o5x s PHE 89 Cb -0.11 0.49 -0.03 0.00 -0.34 0.00 0.00 43.02 43.03 2o5x s PHE 89 CO 0.49 -0.50 -0.09 1.14 -1.46 0.00 0.00 175.22 174.81 2o5x s GLN 90 N 2.12 2.63 -0.02 10.12 1.03 -0.07 -0.70 119.66 134.78 2o5x s GLN 90 Ca -0.07 -0.63 0.03 0.00 0.04 0.00 0.00 55.36 54.73 2o5x s GLN 90 Cb -0.09 -2.51 0.04 0.00 0.03 0.00 0.00 33.01 30.47 2o5x s GLN 90 CO -0.16 0.64 0.84 -1.13 -2.54 0.00 0.00 175.29 172.94 2o5x n SER 91 N 2.07 1.04 -0.06 12.60 3.41 -0.68 -1.58 113.62 130.41 2o5x n SER 91 Ca -0.17 -1.78 -0.09 0.00 -0.26 0.00 0.00 58.87 56.57 2o5x n SER 91 Cb 0.53 -0.09 -0.02 0.00 -0.26 0.00 0.00 64.21 64.37 2o5x n SER 91 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2o5x h THR 92 N 2.05 1.01 -3.53 6.66 2.02 -1.88 -3.44 112.91 115.80 2o5x h THR 92 Ca 0.00 -0.10 -0.67 0.00 0.77 0.00 0.00 66.41 66.42 2o5x h THR 92 Cb 0.87 0.70 -0.16 0.00 -1.74 0.00 0.00 68.15 67.83 2o5x h THR 92 CO 0.00 0.05 -0.69 -1.00 0.37 0.00 0.00 175.52 174.25 2o5x s HIS 93 N -6.17 2.91 0.08 3.16 3.76 -1.26 -4.97 115.29 112.80 2o5x s HIS 93 Ca -0.13 -0.04 -0.31 0.00 -0.15 0.00 0.00 55.06 54.43 2o5x s HIS 93 Cb 0.10 -1.58 -0.07 0.00 1.11 0.00 0.00 32.58 32.14 2o5x s HIS 93 CO 0.70 0.41 1.35 0.12 -0.85 0.00 0.00 174.74 176.47 2o5x s PHE 94 N -1.09 3.20 0.13 1.40 5.36 -1.26 -3.33 117.98 122.39 2o5x s PHE 94 Ca 0.19 1.00 0.04 0.00 -0.96 0.00 0.00 56.93 57.20 2o5x s PHE 94 Cb -0.11 -3.62 -0.04 0.00 -0.34 0.00 0.00 43.02 38.91 2o5x s PHE 94 CO 0.11 -2.15 0.14 -0.59 -1.46 0.00 0.00 175.22 171.27 2o5x s PHE 95 N 1.38 3.22 0.42 10.12 -0.12 -1.26 -4.93 117.98 126.81 2o5x s PHE 95 Ca 0.63 0.04 -0.23 0.00 -0.05 0.00 0.00 56.93 57.32 2o5x s PHE 95 Cb -0.34 -1.57 -0.12 0.00 -0.63 0.00 0.00 43.02 40.36 2o5x s PHE 95 CO 0.29 0.52 0.71 -2.30 -0.05 0.00 0.00 175.22 174.40 2o5x n PRO 96 N -0.13 0.82 -3.84 1.99 -0.02 -1.21 -4.95 135.00 127.65 2o5x n PRO 96 Ca -0.08 0.30 -0.12 0.00 -2.02 0.00 0.00 63.50 61.58 2o5x n PRO 96 Cb 0.54 -1.69 -0.10 0.00 -0.02 0.00 0.00 33.50 32.22 2o5x n PRO 96 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2o5x s THR 97 N -1.40 0.06 0.16 3.45 -1.32 -0.62 -4.99 115.64 110.99 2o5x s THR 97 Ca 0.64 -0.48 -0.06 0.00 -1.21 0.00 0.00 61.69 60.57 2o5x s THR 97 Cb -0.59 -0.41 -0.06 0.00 -1.51 0.00 0.00 72.50 69.93 2o5x s THR 97 CO 0.57 -0.27 0.42 -0.36 -2.21 0.00 0.00 174.62 172.78 2o5x s PHE 98 N -0.98 3.47 1.14 9.09 0.08 -1.26 -0.89 117.98 128.63 2o5x s PHE 98 Ca -0.11 0.65 -0.19 0.00 0.12 0.00 0.00 56.93 57.41 2o5x s PHE 98 Cb -0.06 -2.08 0.27 0.00 -0.57 0.00 0.00 43.02 40.58 2o5x s PHE 98 CO 0.02 0.40 1.18 0.20 -0.10 0.00 0.00 175.22 176.92 2o5x s GLY 99 N -2.37 1.65 0.00 4.36 0.00 0.13 -4.76 107.32 106.33 2o5x s GLY 99 Ca 0.42 -1.08 0.28 0.00 0.00 0.00 0.00 44.72 44.34 2o5x s GLY 99 CO 0.23 -0.21 1.95 0.61 0.00 0.00 0.00 173.10 175.68 2o5x n GLY 100 N -1.86 -1.35 0.00 0.20 0.00 -1.26 -4.74 105.19 96.17 2o5x n GLY 100 Ca 0.15 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2o5x n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2o5x n GLY 101 N 1.28 0.67 2.92 -0.02 0.00 -1.26 -5.03 105.19 103.76 2o5x n GLY 101 Ca 0.10 -1.60 -0.26 0.00 0.00 0.00 0.00 46.02 44.26 2o5x n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2o5x s THR 102 N -2.51 1.01 -0.42 2.61 2.01 -0.47 -4.72 115.64 113.14 2o5x s THR 102 Ca 0.00 -0.30 -0.26 0.00 0.31 0.00 0.00 61.69 61.43 2o5x s THR 102 Cb 0.00 -1.02 0.02 0.00 0.01 0.00 0.00 72.50 71.52 2o5x s THR 102 CO 0.00 0.36 0.96 -0.75 -0.69 0.00 0.00 174.62 174.50 2o5x s LYS 103 N 1.51 3.70 -0.25 4.92 2.20 -0.44 -0.95 119.74 130.43 2o5x s LYS 103 Ca 0.01 0.41 -0.24 0.00 -0.36 0.00 0.00 55.97 55.80 2o5x s LYS 103 Cb -0.13 -3.87 -0.01 0.00 -1.51 0.00 0.00 37.83 32.31 2o5x s LYS 103 CO -0.06 -1.13 0.80 -1.17 -0.36 0.00 0.00 175.35 173.43 2o5x s LEU 104 N 3.75 4.08 -0.01 5.43 2.96 -0.02 -0.35 118.68 134.51 2o5x s LEU 104 Ca 0.39 0.94 0.02 0.00 -0.22 0.00 0.00 54.13 55.26 2o5x s LEU 104 Cb -0.10 -3.13 -0.03 0.00 0.50 0.00 0.00 46.19 43.42 2o5x s LEU 104 CO 0.24 -0.52 -0.05 -1.61 -1.32 0.00 0.00 176.35 173.09 2o5x s GLU 105 N 2.82 2.66 -0.19 1.98 2.02 -0.04 -3.42 118.70 124.53 2o5x s GLU 105 Ca 0.33 -0.65 -0.12 0.00 0.02 0.00 0.00 54.97 54.55 2o5x s GLU 105 Cb -0.15 -2.57 -0.05 0.00 0.10 0.00 0.00 34.13 31.46 2o5x s GLU 105 CO 0.08 0.62 0.23 0.42 0.02 0.00 0.00 175.26 176.63 2o5x s ILE 106 N -0.98 5.34 -0.05 -1.63 -1.09 -1.26 -0.80 121.20 120.73 2o5x s ILE 106 Ca 0.17 0.38 -0.17 0.00 -2.23 0.00 0.00 60.65 58.79 2o5x s ILE 106 Cb -0.11 -3.56 -0.05 0.00 -1.58 0.00 0.00 42.46 37.15 2o5x s ILE 106 CO 0.07 0.39 0.47 -0.54 -1.23 0.00 0.00 174.94 174.09 2o5x s LYS 107 N 0.61 4.19 0.33 2.79 1.02 0.79 -4.87 119.74 124.60 2o5x s LYS 107 Ca 0.12 0.48 0.06 0.00 0.02 0.00 0.00 55.97 56.65 2o5x s LYS 107 Cb -0.13 -3.34 -0.02 0.00 -0.52 0.00 0.00 37.83 33.82 2o5x s LYS 107 CO 0.02 0.40 0.31 2.89 -0.92 0.00 0.00 175.35 178.05 2o5x n ARG 108 N 2.79 0.44 -2.11 1.68 1.85 -1.26 -3.78 116.66 116.27 2o5x n ARG 108 Ca -0.10 -3.16 -0.34 0.00 -1.00 0.00 0.00 57.85 53.25 2o5x n ARG 108 Cb 0.52 2.66 0.01 0.00 -1.05 0.00 0.00 32.46 34.60 2o5x n ARG 108 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 2o5x s THR 109 N -3.24 3.50 0.45 8.89 -4.23 -1.26 -4.97 115.64 114.78 2o5x s THR 109 Ca 0.37 0.80 -0.24 0.00 -1.18 0.00 0.00 61.69 61.44 2o5x s THR 109 Cb 0.01 -3.30 -0.09 0.00 1.34 0.00 0.00 72.50 70.47 2o5x s THR 109 CO 0.26 -0.33 1.10 0.55 -0.54 0.00 0.00 174.62 175.66 2o5x n VAL 110 N -1.76 2.73 -3.79 2.29 3.14 -1.26 -4.76 118.33 114.92 2o5x n VAL 110 Ca 0.10 -0.50 -0.15 0.00 -2.96 0.00 0.00 64.34 60.83 2o5x n VAL 110 Cb 0.52 -1.31 -0.16 0.00 -1.06 0.00 0.00 33.84 31.84 2o5x n VAL 110 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2o5x s ALA 111 N -1.29 0.07 0.32 1.55 0.00 0.28 -4.91 121.76 117.79 2o5x s ALA 111 Ca 0.65 0.25 -0.27 0.00 0.00 0.00 0.00 51.96 52.59 2o5x s ALA 111 Cb -0.51 -0.21 -0.09 0.00 0.00 0.00 0.00 23.12 22.30 2o5x s ALA 111 CO 0.55 -0.09 0.99 0.00 0.00 0.00 0.00 175.76 177.21 2o5x s ALA 112 N 0.90 3.24 0.48 0.00 0.00 -1.26 -1.70 121.76 123.41 2o5x s ALA 112 Ca -0.08 0.63 -0.23 0.00 0.00 0.00 0.00 51.96 52.29 2o5x s ALA 112 Cb -0.11 -3.23 -0.07 0.00 0.00 0.00 0.00 23.12 19.71 2o5x s ALA 112 CO -0.02 0.05 1.19 -1.25 0.00 0.00 0.00 175.76 175.73 2o5x s PRO 113 N -1.90 3.64 -0.01 0.00 0.04 -1.26 -4.51 135.00 131.00 2o5x s PRO 113 Ca 0.49 1.84 -0.17 0.00 0.04 0.00 0.00 61.00 63.20 2o5x s PRO 113 Cb -0.23 -2.36 -0.06 0.00 0.04 0.00 0.00 34.50 31.89 2o5x s PRO 113 CO 0.29 -0.67 0.48 -1.12 0.04 0.00 0.00 177.00 176.02 2o5x s SER 114 N -1.32 6.86 -0.06 6.66 0.01 -0.45 -4.83 113.70 120.58 2o5x s SER 114 Ca 0.65 1.03 0.04 0.00 1.31 0.00 0.00 55.95 58.97 2o5x s SER 114 Cb -0.30 -2.30 -0.02 0.00 0.21 0.00 0.00 66.02 63.61 2o5x s SER 114 CO 0.36 0.22 -0.15 -0.69 0.41 0.00 0.00 173.24 173.40 2o5x s VAL 115 N -0.65 2.99 0.02 3.43 1.01 -1.26 0.14 120.40 126.09 2o5x s VAL 115 Ca 0.26 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.51 2o5x s VAL 115 Cb -0.17 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.02 2o5x s VAL 115 CO 0.14 0.58 -0.05 -0.36 0.00 0.00 0.00 175.10 175.42 2o5x s PHE 116 N -0.62 0.45 -0.00 5.22 0.40 -0.09 -4.97 117.98 118.37 2o5x s PHE 116 Ca 0.09 -0.40 0.07 0.00 -0.60 0.00 0.00 56.93 56.09 2o5x s PHE 116 Cb -0.11 -0.29 -0.02 0.00 0.51 0.00 0.00 43.02 43.11 2o5x s PHE 116 CO 0.01 -0.10 -0.23 -1.50 0.70 0.00 0.00 175.22 174.10 2o5x s ILE 117 N -1.09 1.83 -0.12 0.64 2.07 -1.26 -0.53 121.20 122.75 2o5x s ILE 117 Ca -0.09 -1.05 0.02 0.00 -1.41 0.00 0.00 60.65 58.11 2o5x s ILE 117 Cb -0.08 -1.54 0.01 0.00 0.13 0.00 0.00 42.46 40.99 2o5x s ILE 117 CO -0.00 0.46 -0.17 -0.36 -1.91 0.00 0.00 174.94 172.97 2o5x s PHE 118 N -0.60 2.13 0.85 3.50 0.08 0.35 -5.00 117.98 119.30 2o5x s PHE 118 Ca 0.09 -1.04 -0.11 0.00 0.12 0.00 0.00 56.93 55.99 2o5x s PHE 118 Cb -0.09 -1.52 0.10 0.00 -0.57 0.00 0.00 43.02 40.94 2o5x s PHE 118 CO -0.00 -0.52 1.10 -2.14 -0.10 0.00 0.00 175.22 173.55 2o5x s PRO 119 N 0.99 1.65 0.65 0.24 0.02 -1.26 -1.65 135.00 135.64 2o5x s PRO 119 Ca -0.06 1.13 -0.18 0.00 0.02 0.00 0.00 61.00 61.91 2o5x s PRO 119 Cb -0.15 -1.83 -0.02 0.00 0.02 0.00 0.00 34.50 32.53 2o5x s PRO 119 CO -0.02 -2.06 1.16 -2.30 -0.33 0.00 0.00 177.00 173.45 2o5x n PRO 120 N -3.80 0.95 -2.14 5.54 -0.02 -1.20 -4.81 135.00 129.52 2o5x n PRO 120 Ca 0.09 0.38 -0.32 0.00 -2.02 0.00 0.00 63.50 61.63 2o5x n PRO 120 Cb 0.53 -2.40 -0.01 0.00 -0.02 0.00 0.00 33.50 31.61 2o5x n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2o5x s SER 121 N -1.40 6.19 0.34 2.55 1.04 -1.26 -4.96 113.70 116.20 2o5x s SER 121 Ca 0.80 1.63 0.05 0.00 0.48 0.00 0.00 55.95 58.91 2o5x s SER 121 Cb -0.38 -2.51 0.62 0.00 0.10 0.00 0.00 66.02 63.84 2o5x s SER 121 CO 0.43 -0.88 1.87 0.44 0.98 0.00 0.00 173.24 176.07 2o5x h ASP 122 N 0.44 0.44 -0.38 7.02 3.32 -1.99 -1.88 116.42 123.38 2o5x h ASP 122 Ca -0.46 -0.09 0.03 0.00 0.02 0.00 0.00 57.03 56.53 2o5x h ASP 122 Cb 1.20 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.60 2o5x h ASP 122 CO 0.60 0.54 0.18 -0.08 -1.72 0.00 0.00 179.24 178.77 2o5x h GLU 123 N 0.44 0.37 -0.13 3.56 4.81 -1.99 -0.28 114.58 121.35 2o5x h GLU 123 Ca 0.09 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 2o5x h GLU 123 Cb 0.38 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 2o5x h GLU 123 CO 0.02 0.24 0.05 0.37 -0.73 0.00 0.00 179.01 178.96 2o5x h GLN 124 N 0.38 0.19 -0.63 1.92 4.15 -1.80 -3.03 115.11 116.30 2o5x h GLN 124 Ca 0.16 -0.04 0.10 0.00 0.77 0.00 0.00 58.65 59.65 2o5x h GLN 124 Cb 0.08 -0.03 -0.07 0.00 0.21 0.00 0.00 27.48 27.67 2o5x h GLN 124 CO -0.12 0.29 0.24 -0.07 -1.93 0.00 0.00 178.83 177.24 2o5x h LEU 125 N 0.05 0.25 -1.04 -2.39 4.07 -1.08 0.14 115.31 115.31 2o5x h LEU 125 Ca 0.04 0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.08 2o5x h LEU 125 Cb 0.17 0.05 0.00 0.00 1.08 0.00 0.00 40.66 41.96 2o5x h LEU 125 CO -0.00 0.14 0.00 2.29 -1.08 0.00 0.00 178.44 179.79 2o5x n LYS 126 N -4.99 0.18 0.00 1.13 2.85 -0.14 -1.32 118.16 115.87 2o5x n LYS 126 Ca 0.09 0.52 0.13 0.00 -1.05 0.00 0.00 58.31 58.00 2o5x n LYS 126 Cb 0.28 -1.92 0.46 0.00 -0.65 0.00 0.00 35.03 33.20 2o5x n LYS 126 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 2o5x n SER 127 N -2.26 0.47 0.00 -5.58 3.41 0.46 -4.97 113.62 105.14 2o5x n SER 127 Ca 0.01 -0.30 0.00 0.00 -0.26 0.00 0.00 58.87 58.31 2o5x n SER 127 Cb 0.15 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 2o5x n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2o5x n GLY 128 N 1.40 0.56 3.35 5.00 0.00 -0.43 -5.10 105.19 109.98 2o5x n GLY 128 Ca 0.10 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.93 2o5x n GLY 128 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2o5x s THR 129 N -2.00 1.50 -0.06 2.61 2.01 -1.23 -2.46 115.64 116.01 2o5x s THR 129 Ca 0.00 -2.13 -0.00 0.00 0.31 0.00 0.00 61.69 59.86 2o5x s THR 129 Cb 0.00 -2.18 0.03 0.00 0.01 0.00 0.00 72.50 70.35 2o5x s THR 129 CO 0.00 -0.49 -0.02 0.00 -0.69 0.00 0.00 174.62 173.42 2o5x s ALA 130 N -3.12 0.75 -0.14 7.40 0.00 -0.45 -3.25 121.76 122.94 2o5x s ALA 130 Ca 0.25 -0.14 0.01 0.00 0.00 0.00 0.00 51.96 52.08 2o5x s ALA 130 Cb 0.02 -0.63 -0.00 0.00 0.00 0.00 0.00 23.12 22.51 2o5x s ALA 130 CO 0.08 -0.28 -0.17 -1.12 0.00 0.00 0.00 175.76 174.27 2o5x s SER 131 N 1.53 3.55 -0.16 0.00 0.01 -1.26 -0.95 113.70 116.41 2o5x s SER 131 Ca -0.01 -0.48 -0.06 0.00 1.31 0.00 0.00 55.95 56.71 2o5x s SER 131 Cb -0.13 -1.53 -0.04 0.00 0.21 0.00 0.00 66.02 64.53 2o5x s SER 131 CO -0.03 0.10 0.03 -0.69 0.41 0.00 0.00 173.24 173.06 2o5x s VAL 132 N 0.70 4.54 -0.12 3.43 1.01 0.42 -3.25 120.40 127.13 2o5x s VAL 132 Ca -0.08 -0.13 0.01 0.00 0.00 0.00 0.00 61.98 61.79 2o5x s VAL 132 Cb -0.16 -3.01 -0.01 0.00 0.00 0.00 0.00 36.38 33.20 2o5x s VAL 132 CO 0.01 0.50 -0.17 -0.69 0.00 0.00 0.00 175.10 174.75 2o5x s VAL 133 N 0.12 2.65 -0.18 2.92 1.01 -0.66 -0.44 120.40 125.82 2o5x s VAL 133 Ca 0.03 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.18 2o5x s VAL 133 Cb -0.13 -2.08 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 2o5x s VAL 133 CO 0.01 0.54 -0.07 0.00 0.00 0.00 0.00 175.10 175.58 2o5x s LEU 135 N 0.92 2.89 -0.27 0.00 2.96 0.31 -0.64 118.68 124.85 2o5x s LEU 135 Ca -0.01 -0.28 -0.07 0.00 -0.22 0.00 0.00 54.13 53.55 2o5x s LEU 135 Cb -0.15 -1.68 -0.01 0.00 0.50 0.00 0.00 46.19 44.85 2o5x s LEU 135 CO 0.01 0.14 0.08 -0.76 -1.32 0.00 0.00 176.35 174.50 2o5x s LEU 136 N 0.50 3.64 -0.15 -0.68 1.02 0.14 -0.91 118.68 122.25 2o5x s LEU 136 Ca -0.07 -0.42 -0.01 0.00 0.02 0.00 0.00 54.13 53.65 2o5x s LEU 136 Cb -0.15 -1.91 -0.02 0.00 0.02 0.00 0.00 46.19 44.13 2o5x s LEU 136 CO 0.04 -0.11 -0.10 0.21 0.02 0.00 0.00 176.35 176.41 2o5x s ASN 137 N 1.57 4.22 -0.69 2.29 3.04 0.12 -1.30 114.94 124.19 2o5x s ASN 137 Ca 0.05 -0.29 -0.03 0.00 0.04 0.00 0.00 52.86 52.63 2o5x s ASN 137 Cb -0.16 -1.66 -0.03 0.00 -1.54 0.00 0.00 41.25 37.85 2o5x s ASN 137 CO 0.03 0.15 0.62 0.59 -3.04 0.00 0.00 177.10 175.45 2o5x n ASN 138 N 3.66 -5.73 -4.38 -4.21 3.02 -0.47 -1.35 115.26 105.80 2o5x n ASN 138 Ca -0.18 -0.36 -0.19 0.00 -0.03 0.00 0.00 54.58 53.82 2o5x n ASN 138 Cb 0.52 -4.05 -0.10 0.00 -0.61 0.00 0.00 39.78 35.54 2o5x n ASN 138 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 2o5x s PHE 139 N -3.19 1.79 -0.22 3.10 -0.71 -0.18 -4.50 117.98 114.07 2o5x s PHE 139 Ca 0.22 -0.70 -0.20 0.00 -1.04 0.00 0.00 56.93 55.20 2o5x s PHE 139 Cb -0.03 -0.97 0.06 0.00 -1.21 0.00 0.00 43.02 40.87 2o5x s PHE 139 CO 0.55 0.24 0.59 -0.47 -1.34 0.00 0.00 175.22 174.79 2o5x s TYR 140 N -3.08 -0.66 1.06 3.49 6.14 -0.69 -0.03 117.35 123.58 2o5x s TYR 140 Ca 0.27 1.60 -0.17 0.00 0.64 0.00 0.00 57.07 59.40 2o5x s TYR 140 Cb 0.03 0.23 0.24 0.00 0.42 0.00 0.00 41.96 42.88 2o5x s TYR 140 CO 0.09 -0.32 1.24 -1.25 0.64 0.00 0.00 175.55 175.95 2o5x s PRO 141 N 0.36 -0.13 0.38 4.97 0.04 -1.26 -0.55 135.00 138.80 2o5x s PRO 141 Ca -0.00 -0.27 0.08 0.00 0.04 0.00 0.00 61.00 60.84 2o5x s PRO 141 Cb -0.04 -1.74 0.76 0.00 0.04 0.00 0.00 34.50 33.52 2o5x s PRO 141 CO 0.00 -2.95 1.93 -0.09 0.04 0.00 0.00 177.00 175.92 2o5x h ARG 142 N -2.03 0.33 -6.50 4.56 2.43 -1.99 -3.43 114.38 107.75 2o5x h ARG 142 Ca -0.45 -0.07 -0.53 0.00 -0.81 0.00 0.00 59.98 58.13 2o5x h ARG 142 Cb 1.26 -0.05 0.04 0.00 -0.42 0.00 0.00 29.97 30.80 2o5x h ARG 142 CO 0.36 0.41 1.12 0.39 -1.51 0.00 0.00 179.97 180.74 2o5x n GLU 143 N -4.30 2.80 -3.73 0.20 4.71 -1.26 -4.98 120.64 114.07 2o5x n GLU 143 Ca 0.00 1.02 -0.14 0.00 -0.01 0.00 0.00 57.16 58.03 2o5x n GLU 143 Cb 0.24 -2.92 -0.09 0.00 -1.01 0.00 0.00 31.44 27.66 2o5x n GLU 143 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2o5x s ALA 144 N 2.86 -0.94 -0.19 0.62 0.00 -1.26 -4.69 121.76 118.17 2o5x s ALA 144 Ca 0.83 0.67 -0.03 0.00 0.00 0.00 0.00 51.96 53.43 2o5x s ALA 144 Cb -0.48 -0.16 -0.01 0.00 0.00 0.00 0.00 23.12 22.46 2o5x s ALA 144 CO 0.38 -0.25 -0.06 0.21 0.00 0.00 0.00 175.76 176.04 2o5x s LYS 145 N -0.82 3.44 -0.18 0.00 2.20 -0.24 -4.99 119.74 119.15 2o5x s LYS 145 Ca -0.09 -0.62 -0.00 0.00 -0.36 0.00 0.00 55.97 54.90 2o5x s LYS 145 Cb -0.04 -2.90 0.00 0.00 -1.51 0.00 0.00 37.83 33.38 2o5x s LYS 145 CO 0.04 -0.02 -0.14 0.08 -0.36 0.00 0.00 175.35 174.95 2o5x s VAL 146 N 1.00 2.60 -0.01 4.02 1.01 -1.26 -0.66 120.40 127.11 2o5x s VAL 146 Ca -0.00 -0.77 0.08 0.00 0.00 0.00 0.00 61.98 61.28 2o5x s VAL 146 Cb -0.15 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 34.09 2o5x s VAL 146 CO 0.00 0.50 -0.24 -1.10 0.00 0.00 0.00 175.10 174.27 2o5x s GLN 147 N 1.14 2.11 -0.15 2.72 -0.21 -0.01 -4.95 119.66 120.31 2o5x s GLN 147 Ca 0.01 -0.93 -0.07 0.00 0.02 0.00 0.00 55.36 54.38 2o5x s GLN 147 Cb -0.14 -2.09 -0.04 0.00 1.00 0.00 0.00 33.01 31.73 2o5x s GLN 147 CO -0.05 0.56 0.10 -1.58 -2.12 0.00 0.00 175.29 172.20 2o5x s TRP 148 N -0.69 3.42 -0.06 0.91 0.52 -1.26 -0.27 118.94 121.50 2o5x s TRP 148 Ca 0.11 0.33 0.03 0.00 0.02 0.00 0.00 56.10 56.59 2o5x s TRP 148 Cb -0.10 -2.01 0.01 0.00 -1.15 0.00 0.00 33.47 30.21 2o5x s TRP 148 CO 0.00 0.45 -0.14 0.15 0.02 0.00 0.00 176.95 177.43 2o5x s LYS 149 N -0.32 1.84 -0.16 4.98 -0.14 -0.23 -0.95 119.74 124.75 2o5x s LYS 149 Ca 0.10 -0.49 0.01 0.00 -1.36 0.00 0.00 55.97 54.23 2o5x s LYS 149 Cb -0.12 -1.51 0.02 0.00 -1.68 0.00 0.00 37.83 34.54 2o5x s LYS 149 CO 0.01 0.08 -0.19 0.08 -0.76 0.00 0.00 175.35 174.58 2o5x s VAL 150 N 0.50 1.93 -1.76 3.17 1.01 -0.34 -1.53 120.40 123.37 2o5x s VAL 150 Ca -0.13 -0.86 -0.16 0.00 0.00 0.00 0.00 61.98 60.83 2o5x s VAL 150 Cb -0.15 -1.75 0.16 0.00 0.00 0.00 0.00 36.38 34.64 2o5x s VAL 150 CO 0.04 0.52 0.45 0.47 0.00 0.00 0.00 175.10 176.58 2o5x n ASP 151 N 4.55 -1.17 0.00 3.32 8.00 -0.21 -0.73 116.55 130.31 2o5x n ASP 151 Ca -0.20 -1.23 0.00 0.00 0.71 0.00 0.00 54.79 54.08 2o5x n ASP 151 Cb 0.50 -1.76 0.00 0.00 -0.02 0.00 0.00 41.12 39.84 2o5x n ASP 151 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2o5x n ASN 152 N -2.61 -1.78 -4.68 -2.24 4.05 -1.26 -5.01 115.26 101.72 2o5x n ASN 152 Ca -0.02 0.00 -0.40 0.00 0.45 0.00 0.00 54.58 54.61 2o5x n ASN 152 Cb 0.53 -1.11 -0.05 0.00 1.23 0.00 0.00 39.78 40.38 2o5x n ASN 152 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2o5x s ALA 153 N -2.42 3.48 0.26 5.20 0.00 0.09 -5.02 121.76 123.35 2o5x s ALA 153 Ca 0.00 -0.12 -0.30 0.00 0.00 0.00 0.00 51.96 51.53 2o5x s ALA 153 Cb 0.00 -2.94 -0.11 0.00 0.00 0.00 0.00 23.12 20.07 2o5x s ALA 153 CO 0.00 -0.36 1.51 -1.17 0.00 0.00 0.00 175.76 175.73 2o5x s LEU 154 N 1.45 4.37 -0.14 0.00 2.96 -1.26 -1.20 118.68 124.86 2o5x s LEU 154 Ca 0.31 2.77 -0.07 0.00 -0.22 0.00 0.00 54.13 56.93 2o5x s LEU 154 Cb -0.16 -3.63 -0.04 0.00 0.50 0.00 0.00 46.19 42.86 2o5x s LEU 154 CO 0.13 -0.79 0.09 -1.10 -1.32 0.00 0.00 176.35 173.36 2o5x s GLN 155 N -0.30 3.61 0.03 1.98 -1.52 -0.12 -4.93 119.66 118.40 2o5x s GLN 155 Ca 0.62 -0.25 0.08 0.00 -1.95 0.00 0.00 55.36 53.86 2o5x s GLN 155 Cb -0.44 -3.16 -0.03 0.00 -0.22 0.00 0.00 33.01 29.16 2o5x s GLN 155 CO 0.44 0.56 -0.22 0.45 -0.25 0.00 0.00 175.29 176.27 2o5x s SER 156 N -0.43 3.50 0.00 5.90 0.15 -1.26 -4.60 113.70 116.97 2o5x s SER 156 Ca 0.11 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.28 2o5x s SER 156 Cb -0.12 -0.48 0.00 0.00 -1.71 0.00 0.00 66.02 63.72 2o5x s SER 156 CO 0.02 0.27 0.00 0.61 1.20 0.00 0.00 173.24 175.34 2o5x n GLY 157 N 1.77 0.30 0.43 9.45 0.00 -1.26 -4.85 105.19 111.03 2o5x n GLY 157 Ca -0.17 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.94 2o5x n GLY 157 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2o5x n ASN 158 N -0.36 2.77 -4.21 1.61 0.23 -1.26 -5.03 115.26 109.00 2o5x n ASN 158 Ca 0.00 -3.18 -0.12 0.00 -0.53 0.00 0.00 54.58 50.75 2o5x n ASN 158 Cb 0.18 -0.49 -0.10 0.00 -2.08 0.00 0.00 39.78 37.30 2o5x n ASN 158 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 2o5x s SER 159 N -2.61 1.37 -0.02 0.53 1.04 -1.26 -1.74 113.70 111.01 2o5x s SER 159 Ca 0.36 -1.05 -0.07 0.00 0.48 0.00 0.00 55.95 55.68 2o5x s SER 159 Cb 0.31 0.07 0.01 0.00 0.10 0.00 0.00 66.02 66.51 2o5x s SER 159 CO 0.04 -0.45 0.15 0.00 0.98 0.00 0.00 173.24 173.96 2o5x s GLN 160 N -3.83 0.36 0.13 4.02 -2.07 -0.90 -4.96 119.66 112.42 2o5x s GLN 160 Ca 0.16 -0.14 0.08 0.00 -1.82 0.00 0.00 55.36 53.64 2o5x s GLN 160 Cb 0.05 0.16 -0.04 0.00 -1.09 0.00 0.00 33.01 32.08 2o5x s GLN 160 CO -0.01 -0.08 -0.10 -1.21 -1.32 0.00 0.00 175.29 172.57 2o5x s GLU 161 N -0.77 2.09 -0.01 9.60 2.02 -1.26 -1.11 118.70 129.26 2o5x s GLU 161 Ca -0.09 -1.12 -0.00 0.00 0.02 0.00 0.00 54.97 53.78 2o5x s GLU 161 Cb -0.05 -2.25 0.01 0.00 0.10 0.00 0.00 34.13 31.94 2o5x s GLU 161 CO 0.01 0.48 0.01 0.45 0.02 0.00 0.00 175.26 176.23 2o5x s SER 162 N -2.44 0.00 -0.01 -0.19 0.15 -0.27 -4.98 113.70 105.96 2o5x s SER 162 Ca 0.22 0.02 0.05 0.00 0.70 0.00 0.00 55.95 56.95 2o5x s SER 162 Cb -0.10 0.01 -0.01 0.00 -1.71 0.00 0.00 66.02 64.20 2o5x s SER 162 CO 0.14 -0.02 -0.17 0.54 1.20 0.00 0.00 173.24 174.93 2o5x s VAL 163 N 0.16 1.35 0.85 4.45 0.11 -1.26 -0.26 120.40 125.81 2o5x s VAL 163 Ca -0.01 -0.75 -0.12 0.00 -2.93 0.00 0.00 61.98 58.17 2o5x s VAL 163 Cb -0.02 -1.13 0.10 0.00 -1.53 0.00 0.00 36.38 33.81 2o5x s VAL 163 CO -0.00 0.37 1.12 0.42 -3.33 0.00 0.00 175.10 173.68 2o5x s THR 164 N -0.42 2.46 0.86 5.04 -4.23 -0.09 -4.99 115.64 114.26 2o5x s THR 164 Ca 0.07 0.15 -0.11 0.00 -1.18 0.00 0.00 61.69 60.62 2o5x s THR 164 Cb -0.07 -2.92 0.11 0.00 1.34 0.00 0.00 72.50 70.96 2o5x s THR 164 CO -0.01 -0.20 1.10 -1.61 -0.54 0.00 0.00 174.62 173.37 2o5x s GLU 165 N -5.26 1.56 0.29 3.99 0.41 -1.26 -4.63 118.70 113.81 2o5x s GLU 165 Ca 0.62 1.18 -0.29 0.00 -0.41 0.00 0.00 54.97 56.07 2o5x s GLU 165 Cb -0.14 -1.82 -0.13 0.00 -1.78 0.00 0.00 34.13 30.26 2o5x s GLU 165 CO 0.53 -2.14 1.26 1.04 -0.49 0.00 0.00 175.26 175.46 2o5x n GLN 166 N -3.86 1.89 -2.27 1.61 6.02 -1.26 -4.73 117.38 114.78 2o5x n GLN 166 Ca 0.09 0.67 -0.41 0.00 -0.01 0.00 0.00 57.00 57.34 2o5x n GLN 166 Cb 0.53 -2.22 -0.03 0.00 1.02 0.00 0.00 30.24 29.54 2o5x n GLN 166 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2o5x s ASP 167 N -0.18 6.98 0.00 1.08 2.15 -0.01 -4.87 116.67 121.82 2o5x s ASP 167 Ca 0.60 2.43 0.16 0.00 0.43 0.00 0.00 52.55 56.18 2o5x s ASP 167 Cb -0.63 -2.62 0.97 0.00 -0.30 0.00 0.00 42.92 40.33 2o5x s ASP 167 CO 0.58 -0.41 1.52 -1.20 -0.17 0.00 0.00 175.17 175.48 2o5x n SER 168 N 1.74 0.00 -0.02 -0.34 7.64 -1.26 -0.57 113.62 120.80 2o5x n SER 168 Ca 0.02 -1.19 -0.04 0.00 1.01 0.00 0.00 58.87 58.68 2o5x n SER 168 Cb 0.43 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.61 2o5x n SER 168 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2o5x n LYS 169 N -0.80 0.10 -0.04 1.43 5.02 -1.26 -3.38 118.16 119.22 2o5x n LYS 169 Ca 0.12 0.04 0.03 0.00 -2.02 0.00 0.00 58.31 56.48 2o5x n LYS 169 Cb 0.06 -0.80 0.05 0.00 -0.02 0.00 0.00 35.03 34.32 2o5x n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2o5x n ASP 170 N -3.01 1.97 -1.37 4.39 5.68 -1.25 -4.82 116.55 118.16 2o5x n ASP 170 Ca -0.08 -1.62 -0.18 0.00 -0.50 0.00 0.00 54.79 52.40 2o5x n ASP 170 Cb 0.57 -0.06 -0.08 0.00 -1.14 0.00 0.00 41.12 40.41 2o5x n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2o5x n SER 171 N 0.16 -5.26 -5.00 -1.12 7.64 0.26 -4.91 113.62 105.39 2o5x n SER 171 Ca 0.05 0.44 -0.18 0.00 1.01 0.00 0.00 58.87 60.19 2o5x n SER 171 Cb 0.24 -4.33 0.02 0.00 -1.01 0.00 0.00 64.21 59.13 2o5x n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2o5x s THR 172 N -2.63 2.81 0.24 0.44 -4.23 -1.26 -4.47 115.64 106.54 2o5x s THR 172 Ca 0.00 -0.94 0.09 0.00 -1.18 0.00 0.00 61.69 59.66 2o5x s THR 172 Cb 0.00 -2.87 -0.04 0.00 1.34 0.00 0.00 72.50 70.93 2o5x s THR 172 CO 0.00 0.00 0.01 -0.31 -0.54 0.00 0.00 174.62 173.78 2o5x s TYR 173 N -2.47 2.76 0.16 3.99 2.02 0.96 -0.83 117.35 123.94 2o5x s TYR 173 Ca 0.57 -0.19 0.06 0.00 -0.37 0.00 0.00 57.07 57.13 2o5x s TYR 173 Cb -0.09 -1.26 -0.04 0.00 -0.40 0.00 0.00 41.96 40.17 2o5x s TYR 173 CO 0.35 0.58 -0.13 -1.12 -1.57 0.00 0.00 175.55 173.66 2o5x s SER 174 N -3.49 2.14 -0.06 2.29 0.01 -1.26 -1.01 113.70 112.32 2o5x s SER 174 Ca 0.30 -0.96 -0.03 0.00 1.31 0.00 0.00 55.95 56.57 2o5x s SER 174 Cb -0.07 -0.07 0.03 0.00 0.21 0.00 0.00 66.02 66.11 2o5x s SER 174 CO 0.20 -0.22 0.13 -0.22 0.41 0.00 0.00 173.24 173.54 2o5x s LEU 175 N -3.03 1.06 -0.08 2.44 0.20 -0.42 -0.92 118.68 117.92 2o5x s LEU 175 Ca 0.17 0.27 -0.02 0.00 0.69 0.00 0.00 54.13 55.24 2o5x s LEU 175 Cb -0.01 0.37 -0.03 0.00 -0.43 0.00 0.00 46.19 46.09 2o5x s LEU 175 CO 0.03 -0.11 -0.00 -0.94 -0.29 0.00 0.00 176.35 175.05 2o5x s SER 176 N 0.72 5.20 -0.12 3.68 1.04 0.64 -0.69 113.70 124.18 2o5x s SER 176 Ca -0.05 0.13 0.03 0.00 0.48 0.00 0.00 55.95 56.54 2o5x s SER 176 Cb -0.07 -1.45 0.01 0.00 0.10 0.00 0.00 66.02 64.60 2o5x s SER 176 CO -0.03 0.38 -0.22 -0.55 0.98 0.00 0.00 173.24 173.79 2o5x s SER 177 N -0.88 3.04 -0.18 7.02 0.15 0.19 -1.12 113.70 121.91 2o5x s SER 177 Ca 0.13 -0.57 -0.00 0.00 0.70 0.00 0.00 55.95 56.21 2o5x s SER 177 Cb -0.11 -1.40 0.01 0.00 -1.71 0.00 0.00 66.02 62.81 2o5x s SER 177 CO 0.02 0.11 -0.15 -0.89 1.20 0.00 0.00 173.24 173.53 2o5x s THR 178 N 0.64 2.52 -0.24 6.45 2.01 -0.27 -0.16 115.64 126.59 2o5x s THR 178 Ca -0.12 -0.79 -0.14 0.00 0.31 0.00 0.00 61.69 60.95 2o5x s THR 178 Cb -0.16 -2.08 -0.04 0.00 0.01 0.00 0.00 72.50 70.22 2o5x s THR 178 CO 0.02 0.51 0.32 -0.22 -0.69 0.00 0.00 174.62 174.56 2o5x s LEU 179 N 1.17 4.10 -0.18 4.42 2.96 0.41 -2.11 118.68 129.46 2o5x s LEU 179 Ca 0.02 0.31 -0.02 0.00 -0.22 0.00 0.00 54.13 54.23 2o5x s LEU 179 Cb -0.14 -2.36 -0.01 0.00 0.50 0.00 0.00 46.19 44.18 2o5x s LEU 179 CO -0.07 -0.07 -0.10 0.42 -1.32 0.00 0.00 176.35 175.20 2o5x s THR 180 N 1.52 3.01 0.18 3.68 -4.23 -0.71 -0.44 115.64 118.65 2o5x s THR 180 Ca 0.14 -0.64 0.05 0.00 -1.18 0.00 0.00 61.69 60.07 2o5x s THR 180 Cb -0.15 -2.31 -0.05 0.00 1.34 0.00 0.00 72.50 71.33 2o5x s THR 180 CO 0.08 0.48 -0.10 -0.76 -0.54 0.00 0.00 174.62 173.78 2o5x s LEU 181 N 1.02 2.49 0.72 4.79 1.43 -0.13 -4.87 118.68 124.12 2o5x s LEU 181 Ca -0.01 -1.05 -0.11 0.00 -1.03 0.00 0.00 54.13 51.93 2o5x s LEU 181 Cb -0.15 -0.44 0.02 0.00 0.03 0.00 0.00 46.19 45.66 2o5x s LEU 181 CO -0.02 -0.31 1.07 -0.94 0.23 0.00 0.00 176.35 176.38 2o5x s SER 182 N -3.24 5.04 0.18 2.29 1.04 -1.26 -1.35 113.70 116.40 2o5x s SER 182 Ca 0.20 1.72 -0.12 0.00 0.48 0.00 0.00 55.95 58.23 2o5x s SER 182 Cb 0.02 -2.51 0.09 0.00 0.10 0.00 0.00 66.02 63.73 2o5x s SER 182 CO 0.04 -1.67 1.80 0.50 0.98 0.00 0.00 173.24 174.89 2o5x h LYS 183 N -0.81 0.85 -0.43 4.02 3.64 -1.75 0.22 116.57 122.31 2o5x h LYS 183 Ca -0.44 -0.09 0.08 0.00 -1.27 0.00 0.00 60.65 58.93 2o5x h LYS 183 Cb 1.22 -0.17 -0.09 0.00 -0.41 0.00 0.00 32.23 32.77 2o5x h LYS 183 CO 0.55 0.64 -0.36 0.00 -2.27 0.00 0.00 179.45 178.00 2o5x h ALA 184 N 1.17 -0.24 -0.49 5.00 0.00 -1.92 0.19 119.26 122.96 2o5x h ALA 184 Ca 0.22 0.10 -0.12 0.00 0.00 0.00 0.00 54.91 55.11 2o5x h ALA 184 Cb 0.03 0.78 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2o5x h ALA 184 CO -0.04 -0.76 -0.18 -0.44 0.00 0.00 0.00 179.25 177.84 2o5x h ASP 185 N -0.26 0.99 -0.78 0.00 3.32 -1.83 -2.75 116.42 115.11 2o5x h ASP 185 Ca 0.17 -0.36 0.05 0.00 0.02 0.00 0.00 57.03 56.92 2o5x h ASP 185 Cb 0.56 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.78 2o5x h ASP 185 CO -0.57 1.14 0.48 0.22 -1.72 0.00 0.00 179.24 178.79 2o5x h TYR 186 N 0.86 0.89 -0.01 4.55 3.20 -0.68 -2.12 116.97 123.65 2o5x h TYR 186 Ca 0.12 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.02 2o5x h TYR 186 Cb 0.74 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 38.73 2o5x h TYR 186 CO 0.05 0.47 0.00 0.39 -1.64 0.00 0.00 178.16 177.43 2o5x n GLU 187 N -4.66 1.05 0.00 1.82 1.02 0.03 -2.71 120.64 117.19 2o5x n GLU 187 Ca 0.10 -0.07 0.13 0.00 -0.02 0.00 0.00 57.16 57.30 2o5x n GLU 187 Cb 0.14 -1.36 0.49 0.00 -0.02 0.00 0.00 31.44 30.68 2o5x n GLU 187 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2o5x n LYS 188 N -0.78 0.64 -4.13 3.49 5.02 -0.80 -4.94 118.16 116.67 2o5x n LYS 188 Ca 0.17 -0.29 -0.10 0.00 -2.02 0.00 0.00 58.31 56.06 2o5x n LYS 188 Cb 0.10 -1.49 -0.10 0.00 -0.02 0.00 0.00 35.03 33.51 2o5x n LYS 188 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2o5x s HIS 189 N -2.57 0.76 -0.17 2.13 3.76 -1.10 -5.10 115.29 113.01 2o5x s HIS 189 Ca 0.24 -0.84 -0.10 0.00 -0.15 0.00 0.00 55.06 54.21 2o5x s HIS 189 Cb 0.19 -0.46 -0.07 0.00 1.11 0.00 0.00 32.58 33.35 2o5x s HIS 189 CO 0.52 -0.17 -0.25 1.63 -0.85 0.00 0.00 174.74 175.62 2o5x n LYS 190 N 0.36 0.40 -3.44 1.40 4.76 -1.26 -4.77 118.16 115.61 2o5x n LYS 190 Ca -0.15 0.17 -0.38 0.00 -2.87 0.00 0.00 58.31 55.08 2o5x n LYS 190 Cb 0.59 -1.17 -0.08 0.00 -1.84 0.00 0.00 35.03 32.53 2o5x n LYS 190 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2o5x s VAL 191 N -2.43 5.22 -0.15 -0.18 1.01 -1.26 -0.62 120.40 121.99 2o5x s VAL 191 Ca -0.25 0.56 -0.01 0.00 0.00 0.00 0.00 61.98 62.28 2o5x s VAL 191 Cb 0.08 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.78 2o5x s VAL 191 CO 0.33 0.23 -0.11 -0.31 0.00 0.00 0.00 175.10 175.24 2o5x s TYR 192 N 1.55 2.85 -0.00 5.22 1.51 -0.20 -1.04 117.35 127.23 2o5x s TYR 192 Ca 0.15 -0.76 -0.00 0.00 -1.01 0.00 0.00 57.07 55.45 2o5x s TYR 192 Cb -0.15 -1.91 -0.00 0.00 -0.11 0.00 0.00 41.96 39.79 2o5x s TYR 192 CO 0.08 -0.31 0.01 0.00 -1.11 0.00 0.00 175.55 174.21 2o5x s ALA 193 N 0.64 -0.02 -0.12 3.71 0.00 -0.58 -0.92 121.76 124.47 2o5x s ALA 193 Ca -0.06 -0.00 0.02 0.00 0.00 0.00 0.00 51.96 51.91 2o5x s ALA 193 Cb -0.15 -0.01 -0.01 0.00 0.00 0.00 0.00 23.12 22.95 2o5x s ALA 193 CO 0.03 -0.01 -0.18 0.00 0.00 0.00 0.00 175.76 175.60 2o5x s GLU 195 N 0.37 3.65 -0.17 0.00 2.12 0.62 -1.81 118.70 123.47 2o5x s GLU 195 Ca -0.14 -0.50 -0.02 0.00 0.36 0.00 0.00 54.97 54.67 2o5x s GLU 195 Cb -0.17 -3.11 -0.01 0.00 0.26 0.00 0.00 34.13 31.10 2o5x s GLU 195 CO 0.07 0.01 -0.09 0.08 -0.54 0.00 0.00 175.26 174.79 2o5x s VAL 196 N 1.01 3.25 -0.13 3.70 1.01 0.27 -0.83 120.40 128.68 2o5x s VAL 196 Ca 0.02 -0.57 -0.03 0.00 0.00 0.00 0.00 61.98 61.41 2o5x s VAL 196 Cb -0.14 -2.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 2o5x s VAL 196 CO 0.02 0.48 -0.03 -0.89 0.00 0.00 0.00 175.10 174.67 2o5x s THR 197 N 0.86 3.95 -0.08 3.92 2.01 0.17 -1.27 115.64 125.19 2o5x s THR 197 Ca -0.02 -0.35 -0.27 0.00 0.31 0.00 0.00 61.69 61.35 2o5x s THR 197 Cb -0.15 -2.70 0.06 0.00 0.01 0.00 0.00 72.50 69.72 2o5x s THR 197 CO 0.01 0.53 0.62 -2.28 -0.69 0.00 0.00 174.62 172.80 2o5x s HIS 198 N -0.03 -0.60 0.32 4.92 2.46 -1.26 -1.08 115.29 120.02 2o5x s HIS 198 Ca 0.01 1.13 0.06 0.00 0.47 0.00 0.00 55.06 56.73 2o5x s HIS 198 Cb -0.13 0.33 0.89 0.00 -0.13 0.00 0.00 32.58 33.54 2o5x s HIS 198 CO 0.03 -0.52 1.59 0.37 -2.47 0.00 0.00 174.74 173.73 2o5x h GLN 199 N 3.56 0.05 0.00 2.88 5.75 -1.92 -1.19 115.11 124.24 2o5x h GLN 199 Ca -0.28 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.22 2o5x h GLN 199 Cb 1.15 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.69 2o5x h GLN 199 CO 0.33 0.03 0.00 0.41 -2.65 0.00 0.00 178.83 176.95 2o5x n GLY 200 N -1.42 -1.26 3.59 2.39 0.00 -1.26 -4.74 105.19 102.50 2o5x n GLY 200 Ca 0.26 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.92 2o5x n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2o5x s LEU 201 N -3.55 3.65 0.30 0.99 1.43 -0.45 -4.55 118.68 116.50 2o5x s LEU 201 Ca 0.08 0.02 0.14 0.00 -1.03 0.00 0.00 54.13 53.35 2o5x s LEU 201 Cb 0.12 -1.91 0.41 0.00 0.03 0.00 0.00 46.19 44.84 2o5x s LEU 201 CO 0.39 0.18 1.61 0.77 0.23 0.00 0.00 176.35 179.53 2o5x h SER 202 N 6.67 0.00 -5.29 2.29 4.64 -1.85 -3.43 113.55 116.59 2o5x h SER 202 Ca -0.35 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.84 2o5x h SER 202 Cb 1.17 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.13 2o5x h SER 202 CO 0.68 0.53 -0.45 -0.94 -0.87 0.00 0.00 176.83 175.78 2o5x s SER 203 N -6.60 0.17 0.64 4.97 1.04 -1.26 -5.14 113.70 107.52 2o5x s SER 203 Ca 0.00 -0.93 -0.18 0.00 0.48 0.00 0.00 55.95 55.32 2o5x s SER 203 Cb 0.11 0.36 -0.01 0.00 0.10 0.00 0.00 66.02 66.58 2o5x s SER 203 CO 0.73 -0.79 1.23 -2.84 0.98 0.00 0.00 173.24 172.56 2o5x s PRO 204 N -3.96 2.65 -0.19 4.02 0.02 -1.26 -4.93 135.00 131.34 2o5x s PRO 204 Ca 0.16 1.88 -0.05 0.00 0.02 0.00 0.00 61.00 63.01 2o5x s PRO 204 Cb 0.05 -1.88 -0.02 0.00 0.02 0.00 0.00 34.50 32.67 2o5x s PRO 204 CO -0.03 -1.47 -0.00 0.08 -0.33 0.00 0.00 177.00 175.25 2o5x s VAL 205 N -1.63 3.96 -0.16 3.83 1.01 -0.40 -4.90 120.40 122.11 2o5x s VAL 205 Ca 0.78 -0.31 -0.04 0.00 0.00 0.00 0.00 61.98 62.41 2o5x s VAL 205 Cb -0.32 -2.78 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 2o5x s VAL 205 CO 0.38 0.44 -0.02 -0.89 0.00 0.00 0.00 175.10 175.01 2o5x s THR 206 N 0.89 4.01 -0.08 3.92 2.01 -1.26 -0.57 115.64 124.57 2o5x s THR 206 Ca 0.01 -0.31 0.02 0.00 0.31 0.00 0.00 61.69 61.71 2o5x s THR 206 Cb -0.14 -2.77 -0.02 0.00 0.01 0.00 0.00 72.50 69.57 2o5x s THR 206 CO 0.02 0.48 -0.11 -0.54 -0.69 0.00 0.00 174.62 173.78 2o5x s LYS 207 N 0.43 2.81 0.25 4.92 -0.14 -0.75 -4.99 119.74 122.26 2o5x s LYS 207 Ca -0.03 -0.64 -0.10 0.00 -1.36 0.00 0.00 55.97 53.84 2o5x s LYS 207 Cb -0.14 -2.51 -0.01 0.00 -1.68 0.00 0.00 37.83 33.49 2o5x s LYS 207 CO 0.02 0.53 0.43 -1.54 -0.76 0.00 0.00 175.35 174.04 2o5x s SER 208 N -0.48 0.03 0.04 2.83 1.04 -1.26 -1.15 113.70 114.75 2o5x s SER 208 Ca 0.06 -1.04 -0.11 0.00 0.48 0.00 0.00 55.95 55.34 2o5x s SER 208 Cb -0.12 0.57 0.01 0.00 0.10 0.00 0.00 66.02 66.58 2o5x s SER 208 CO 0.02 -1.12 0.24 0.72 0.98 0.00 0.00 173.24 174.08 2o5x s PHE 209 N -3.93 -0.01 -0.16 5.02 -0.12 -0.10 -4.99 117.98 113.68 2o5x s PHE 209 Ca 0.25 -0.18 -0.18 0.00 -0.05 0.00 0.00 56.93 56.78 2o5x s PHE 209 Cb 0.00 0.02 -0.04 0.00 -0.63 0.00 0.00 43.02 42.38 2o5x s PHE 209 CO 0.10 -0.46 0.47 -0.80 -0.05 0.00 0.00 175.22 174.48 2o5x s ASN 210 N -2.07 6.58 0.58 1.98 0.01 -1.26 -1.03 114.94 119.73 2o5x s ASN 210 Ca -0.05 0.69 -0.20 0.00 -0.71 0.00 0.00 52.86 52.59 2o5x s ASN 210 Cb -0.01 -2.27 -0.04 0.00 0.41 0.00 0.00 41.25 39.34 2o5x s ASN 210 CO -0.04 -0.07 1.23 0.00 -1.51 0.00 0.00 177.10 176.72 2o5x s ARG 211 N 1.09 3.04 0.00 -0.60 1.70 0.21 -2.52 118.95 121.87 2o5x s ARG 211 Ca 0.23 1.90 0.00 0.00 -0.47 0.00 0.00 55.73 57.40 2o5x s ARG 211 Cb -0.15 -2.02 0.00 0.00 -0.57 0.00 0.00 34.95 32.21 2o5x s ARG 211 CO 0.09 -1.17 0.00 0.41 -1.08 0.00 0.00 175.30 173.55 2o5x n GLY 212 N 0.57 0.46 0.00 3.88 0.00 -1.26 -5.04 105.19 103.81 2o5x n GLY 212 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2o5x n GLY 212 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50