#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mmy n SER 8 N 0.00 0.00 0.00 4.37 2.88 -1.26 -5.24 113.62 114.36 3mmy n SER 8 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 3mmy n SER 8 Cb 0.00 0.06 0.00 0.00 -0.75 0.00 0.00 64.21 63.52 3mmy n SER 8 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3mmy n GLY 9 N 0.15 2.98 0.24 0.46 0.00 -0.85 -4.94 105.19 103.23 3mmy n GLY 9 Ca 0.00 -1.66 0.13 0.00 0.00 0.00 0.00 46.02 44.49 3mmy n GLY 9 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3mmy h PHE 10 N 0.00 0.00 -0.64 1.61 0.04 -1.75 -3.39 116.94 112.81 3mmy h PHE 10 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3mmy h PHE 10 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 3mmy h PHE 10 CO 0.00 0.11 0.00 0.41 -0.60 0.00 0.00 178.31 178.23 3mmy n GLY 11 N 0.38 0.11 2.94 -1.45 0.00 -1.26 -4.86 105.19 101.04 3mmy n GLY 11 Ca 0.01 -0.99 -0.17 0.00 0.00 0.00 0.00 46.02 44.87 3mmy n GLY 11 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mmy s THR 12 N 0.00 0.46 0.34 2.61 2.01 -1.26 -5.05 115.64 114.75 3mmy s THR 12 Ca 0.00 -0.20 -0.26 0.00 0.31 0.00 0.00 61.69 61.55 3mmy s THR 12 Cb 0.00 -0.43 -0.10 0.00 0.01 0.00 0.00 72.50 71.98 3mmy s THR 12 CO 0.00 0.16 0.96 -0.44 -0.69 0.00 0.00 174.62 174.61 3mmy s SER 13 N 0.20 7.26 0.31 3.53 0.01 -1.26 -5.09 113.70 118.67 3mmy s SER 13 Ca -0.02 1.86 0.10 0.00 1.31 0.00 0.00 55.95 59.20 3mmy s SER 13 Cb -0.06 -2.58 -0.05 0.00 0.21 0.00 0.00 66.02 63.54 3mmy s SER 13 CO -0.00 -0.13 -0.07 -0.83 0.41 0.00 0.00 173.24 172.62 3mmy s GLY 14 N -1.63 1.99 0.14 3.44 0.00 -1.26 -5.11 107.32 104.89 3mmy s GLY 14 Ca 0.51 -1.93 0.08 0.00 0.00 0.00 0.00 44.72 43.39 3mmy s GLY 14 CO 0.24 -1.92 -0.08 -0.51 0.00 0.00 0.00 173.10 170.82 3mmy s THR 15 N -2.51 3.38 0.43 0.90 -4.23 -1.26 -5.10 115.64 107.25 3mmy s THR 15 Ca 0.32 -1.40 -0.25 0.00 -1.18 0.00 0.00 61.69 59.18 3mmy s THR 15 Cb -0.02 -2.63 -0.10 0.00 1.34 0.00 0.00 72.50 71.10 3mmy s THR 15 CO 0.18 0.01 1.20 -0.24 -0.54 0.00 0.00 174.62 175.23 3mmy n SER 16 N 0.38 2.18 0.15 3.99 2.88 -1.26 -4.87 113.62 117.07 3mmy n SER 16 Ca -0.12 1.08 0.11 0.00 -1.33 0.00 0.00 58.87 58.61 3mmy n SER 16 Cb 0.54 -1.46 0.55 0.00 -0.75 0.00 0.00 64.21 63.08 3mmy n SER 16 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 3mmy n MET 17 N -0.01 0.16 -0.00 -1.46 2.81 -1.26 -5.33 117.12 112.04 3mmy n MET 17 Ca 0.08 0.56 0.01 0.00 -1.81 0.00 0.00 57.70 56.54 3mmy n MET 17 Cb 0.40 -1.93 0.01 0.00 -0.71 0.00 0.00 33.22 30.99 3mmy n MET 17 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 3mmy n PHE 18 N -2.25 0.01 0.00 2.03 3.01 -1.26 -5.37 117.46 113.64 3mmy n PHE 18 Ca -0.00 -0.06 0.00 0.00 1.01 0.00 0.00 57.45 58.40 3mmy n PHE 18 Cb 0.11 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.57 3mmy n PHE 18 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 3mmy n THR 23 N 0.07 0.00 -4.50 4.37 -2.24 -1.26 -5.23 114.28 105.50 3mmy n THR 23 Ca 0.01 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.48 3mmy n THR 23 Cb 0.08 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.20 3mmy n THR 23 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3mmy s ASP 24 N 0.00 4.24 -0.24 3.42 2.15 -1.26 -5.06 116.67 119.92 3mmy s ASP 24 Ca 0.00 -0.30 0.13 0.00 0.43 0.00 0.00 52.55 52.80 3mmy s ASP 24 Cb 0.00 -0.84 0.54 0.00 -0.30 0.00 0.00 42.92 42.31 3mmy s ASP 24 CO 0.00 0.25 1.48 -3.20 -0.17 0.00 0.00 175.17 173.54 3mmy n ASN 25 N 1.40 3.36 0.09 -0.34 5.15 -1.26 -4.61 115.26 119.05 3mmy n ASN 25 Ca -0.15 -3.36 -0.07 0.00 -0.60 0.00 0.00 54.58 50.39 3mmy n ASN 25 Cb 0.52 -0.61 -0.02 0.00 -0.53 0.00 0.00 39.78 39.15 3mmy n ASN 25 CO 0.00 0.00 0.00 1.12 1.40 0.00 0.00 177.26 179.78 3mmy h HIS 26 N 1.47 0.16 -2.04 1.20 2.07 -1.97 -2.99 115.15 113.06 3mmy h HIS 26 Ca 0.13 -0.10 -0.56 0.00 -2.85 0.00 0.00 60.37 56.99 3mmy h HIS 26 Cb 1.65 -0.02 -0.39 0.00 2.57 0.00 0.00 27.41 31.22 3mmy h HIS 26 CO 0.80 0.94 -1.06 -1.71 -3.07 0.00 0.00 177.93 173.83 3mmy n ASN 27 N -3.58 0.38 0.26 3.10 5.15 -1.26 -4.67 115.26 114.64 3mmy n ASN 27 Ca -0.02 -2.72 0.16 0.00 -0.60 0.00 0.00 54.58 51.40 3mmy n ASN 27 Cb 0.83 -0.64 0.60 0.00 -0.53 0.00 0.00 39.78 40.04 3mmy n ASN 27 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 3mmy h PRO 28 N 4.12 0.00 -0.00 1.20 0.13 -1.87 -1.68 132.00 133.91 3mmy h PRO 28 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 3mmy h PRO 28 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 3mmy h PRO 28 CO 0.48 0.00 -0.15 -1.33 -0.23 0.00 0.00 178.00 176.78 3mmy n MET 29 N -3.04 0.21 -3.85 0.86 2.81 -1.26 -4.92 117.12 107.91 3mmy n MET 29 Ca 0.01 -0.06 -0.26 0.00 -1.81 0.00 0.00 57.70 55.59 3mmy n MET 29 Cb 0.33 -1.50 0.02 0.00 -0.71 0.00 0.00 33.22 31.36 3mmy n MET 29 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3mmy n LYS 30 N -1.35 -4.66 -1.64 0.03 5.02 -0.63 -4.97 118.16 109.96 3mmy n LYS 30 Ca 0.09 0.55 -0.30 0.00 -2.02 0.00 0.00 58.31 56.63 3mmy n LYS 30 Cb 0.31 -5.14 0.08 0.00 -0.02 0.00 0.00 35.03 30.26 3mmy n LYS 30 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3mmy s ASP 31 N -3.98 4.81 0.32 4.39 1.01 -1.26 -4.65 116.67 117.32 3mmy s ASP 31 Ca 0.25 1.28 -0.29 0.00 0.71 0.00 0.00 52.55 54.50 3mmy s ASP 31 Cb -0.13 -2.04 -0.11 0.00 1.01 0.00 0.00 42.92 41.65 3mmy s ASP 31 CO 0.84 -1.76 1.57 -0.63 0.21 0.00 0.00 175.17 175.39 3mmy s ILE 32 N -3.20 2.04 -0.22 0.77 -1.09 -0.66 -4.80 121.20 114.05 3mmy s ILE 32 Ca 0.60 0.04 -0.08 0.00 -2.23 0.00 0.00 60.65 58.97 3mmy s ILE 32 Cb -0.13 -3.02 -0.04 0.00 -1.58 0.00 0.00 42.46 37.68 3mmy s ILE 32 CO 0.54 0.01 0.10 -1.61 -1.23 0.00 0.00 174.94 172.74 3mmy s GLU 33 N -1.02 3.94 0.15 2.79 2.02 -1.26 -0.65 118.70 124.67 3mmy s GLU 33 Ca 0.60 -0.35 -0.31 0.00 0.02 0.00 0.00 54.97 54.93 3mmy s GLU 33 Cb -0.48 -3.35 -0.09 0.00 0.10 0.00 0.00 34.13 30.32 3mmy s GLU 33 CO 0.53 0.10 1.50 0.08 0.02 0.00 0.00 175.26 177.49 3mmy s VAL 34 N 0.87 2.88 0.46 2.63 1.01 -0.35 -4.89 120.40 123.01 3mmy s VAL 34 Ca 0.05 0.63 -0.22 0.00 0.00 0.00 0.00 61.98 62.44 3mmy s VAL 34 Cb -0.13 -3.41 -0.08 0.00 0.00 0.00 0.00 36.38 32.76 3mmy s VAL 34 CO 0.03 0.05 1.11 0.42 0.00 0.00 0.00 175.10 176.71 3mmy s THR 35 N 1.10 3.38 -0.98 3.92 -4.23 -1.26 -4.07 115.64 113.50 3mmy s THR 35 Ca 0.68 0.99 -0.10 0.00 -1.18 0.00 0.00 61.69 62.08 3mmy s THR 35 Cb -0.41 -3.48 -0.02 0.00 1.34 0.00 0.00 72.50 69.93 3mmy s THR 35 CO 0.31 -0.06 0.78 -1.20 -0.54 0.00 0.00 174.62 173.91 3mmy n SER 36 N -0.56 -6.20 -4.83 3.99 7.64 -1.26 -4.80 113.62 107.60 3mmy n SER 36 Ca 0.08 -0.71 -0.31 0.00 1.01 0.00 0.00 58.87 58.94 3mmy n SER 36 Cb 0.50 -4.06 0.04 0.00 -1.01 0.00 0.00 64.21 59.68 3mmy n SER 36 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3mmy s SER 37 N -3.27 5.49 0.79 6.43 1.04 -1.26 -5.00 113.70 117.91 3mmy s SER 37 Ca 0.30 1.54 -0.14 0.00 0.48 0.00 0.00 55.95 58.12 3mmy s SER 37 Cb -0.08 -2.44 0.05 0.00 0.10 0.00 0.00 66.02 63.64 3mmy s SER 37 CO 0.81 -1.36 1.01 -2.65 0.98 0.00 0.00 173.24 172.02 3mmy n PRO 38 N -3.07 0.26 0.00 4.02 -0.02 -1.26 -4.92 135.00 130.00 3mmy n PRO 38 Ca 0.07 0.15 0.13 0.00 -2.02 0.00 0.00 63.50 61.84 3mmy n PRO 38 Cb 0.54 -2.27 0.47 0.00 -0.02 0.00 0.00 33.50 32.22 3mmy n PRO 38 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3mmy n ASP 39 N -2.37 0.91 -3.91 2.55 8.00 -1.26 -4.57 116.55 115.91 3mmy n ASP 39 Ca 0.13 -0.88 -0.14 0.00 0.71 0.00 0.00 54.79 54.60 3mmy n ASP 39 Cb 0.50 0.06 -0.09 0.00 -0.02 0.00 0.00 41.12 41.57 3mmy n ASP 39 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3mmy s ASP 40 N -2.42 0.64 0.30 -2.24 -1.08 -1.26 -4.94 116.67 105.67 3mmy s ASP 40 Ca 0.28 -1.49 -0.27 0.00 -0.52 0.00 0.00 52.55 50.54 3mmy s ASP 40 Cb 0.20 0.45 -0.14 0.00 -1.46 0.00 0.00 42.92 41.97 3mmy s ASP 40 CO 0.48 -0.93 0.92 -1.20 0.52 0.00 0.00 175.17 174.96 3mmy n SER 41 N -0.70 0.86 -4.64 -0.34 7.64 -1.26 -4.46 113.62 110.72 3mmy n SER 41 Ca 0.04 1.14 -0.38 0.00 1.01 0.00 0.00 58.87 60.67 3mmy n SER 41 Cb 0.65 -1.25 -0.08 0.00 -1.01 0.00 0.00 64.21 62.52 3mmy n SER 41 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3mmy s ILE 42 N -1.11 5.20 -0.05 0.44 1.01 -1.26 -0.97 121.20 124.46 3mmy s ILE 42 Ca 0.60 0.61 0.06 0.00 0.00 0.00 0.00 60.65 61.92 3mmy s ILE 42 Cb -0.70 -3.70 -0.24 0.00 0.01 0.00 0.00 42.46 37.83 3mmy s ILE 42 CO 0.59 0.21 0.63 1.23 0.00 0.00 0.00 174.94 177.61 3mmy h GLY 43 N 8.09 0.10 -4.28 6.18 0.00 -1.55 -3.43 103.07 108.19 3mmy h GLY 43 Ca -0.34 -0.25 -0.09 0.00 0.00 0.00 0.00 47.33 46.65 3mmy h GLY 43 CO 0.68 0.22 -0.03 0.00 0.00 0.00 0.00 176.54 177.41 3mmy s LEU 45 N -1.19 2.06 -0.18 0.00 1.43 -1.26 -1.99 118.68 117.55 3mmy s LEU 45 Ca -0.12 -0.20 -0.09 0.00 -1.03 0.00 0.00 54.13 52.69 3mmy s LEU 45 Cb -0.02 -0.30 0.07 0.00 0.03 0.00 0.00 46.19 45.97 3mmy s LEU 45 CO 0.07 0.02 0.42 -0.55 0.23 0.00 0.00 176.35 176.54 3mmy s SER 46 N -0.43 -0.47 0.17 2.29 0.15 -0.39 -4.76 113.70 110.27 3mmy s SER 46 Ca 0.00 0.93 -0.10 0.00 0.70 0.00 0.00 55.95 57.49 3mmy s SER 46 Cb -0.04 0.91 -0.07 0.00 -1.71 0.00 0.00 66.02 65.12 3mmy s SER 46 CO -0.00 -0.20 0.50 -0.36 1.20 0.00 0.00 173.24 174.37 3mmy s PHE 47 N 1.68 3.49 0.71 3.44 0.40 -1.26 -0.85 117.98 125.59 3mmy s PHE 47 Ca -0.08 0.84 -0.16 0.00 -0.60 0.00 0.00 56.93 56.93 3mmy s PHE 47 Cb -0.09 -2.22 -0.01 0.00 0.51 0.00 0.00 43.02 41.21 3mmy s PHE 47 CO -0.13 0.37 0.91 -1.13 0.70 0.00 0.00 175.22 175.94 3mmy n SER 48 N 0.25 0.28 -4.82 1.36 3.41 0.02 -4.86 113.62 109.26 3mmy n SER 48 Ca -0.02 0.67 -0.30 0.00 -0.26 0.00 0.00 58.87 58.95 3mmy n SER 48 Cb 0.52 -1.38 0.07 0.00 -0.26 0.00 0.00 64.21 63.16 3mmy n SER 48 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 3mmy s PRO 49 N -3.20 2.51 0.27 4.33 0.04 -1.26 -4.10 135.00 133.59 3mmy s PRO 49 Ca 0.73 0.73 0.18 0.00 0.04 0.00 0.00 61.00 62.68 3mmy s PRO 49 Cb -0.35 -1.96 0.99 0.00 0.04 0.00 0.00 34.50 33.22 3mmy s PRO 49 CO 0.51 -1.35 1.56 -0.35 0.04 0.00 0.00 177.00 177.41 3mmy n PRO 50 N -3.26 0.12 0.24 0.56 -0.04 -1.26 -1.82 135.00 129.54 3mmy n PRO 50 Ca 0.07 0.62 0.13 0.00 -0.04 0.00 0.00 63.50 64.28 3mmy n PRO 50 Cb 0.55 -1.89 0.53 0.00 -0.04 0.00 0.00 33.50 32.65 3mmy n PRO 50 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 3mmy h THR 51 N 0.00 0.32 -3.35 0.52 1.35 -1.90 -3.42 112.91 106.43 3mmy h THR 51 Ca 0.00 -0.89 -0.58 0.00 -0.55 0.00 0.00 66.41 64.39 3mmy h THR 51 Cb 0.00 1.68 -0.08 0.00 -1.73 0.00 0.00 68.15 68.03 3mmy h THR 51 CO 0.00 0.13 -0.07 -0.76 -0.25 0.00 0.00 175.52 174.57 3mmy s LEU 52 N -6.53 4.26 0.31 3.87 1.43 -0.76 -4.94 118.68 116.33 3mmy s LEU 52 Ca 0.01 0.87 -0.29 0.00 -1.03 0.00 0.00 54.13 53.69 3mmy s LEU 52 Cb 0.09 -2.78 -0.10 0.00 0.03 0.00 0.00 46.19 43.44 3mmy s LEU 52 CO 0.60 -0.06 1.26 -2.84 0.23 0.00 0.00 176.35 175.54 3mmy s PRO 53 N 0.85 4.43 0.59 1.29 0.02 -1.26 -4.75 135.00 136.15 3mmy s PRO 53 Ca 0.28 2.11 0.00 0.00 0.02 0.00 0.00 61.00 63.41 3mmy s PRO 53 Cb -0.16 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.26 3mmy s PRO 53 CO 0.12 -0.09 0.00 0.41 -0.33 0.00 0.00 177.00 177.10 3mmy n GLY 54 N 0.95 -2.08 3.05 0.52 0.00 -1.26 -4.92 105.19 101.44 3mmy n GLY 54 Ca -0.00 -1.43 -0.28 0.00 0.00 0.00 0.00 46.02 44.32 3mmy n GLY 54 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3mmy s ASN 55 N -3.36 2.30 -0.09 1.61 0.01 -1.26 -4.99 114.94 109.17 3mmy s ASN 55 Ca 0.00 -0.39 0.03 0.00 -0.71 0.00 0.00 52.86 51.78 3mmy s ASN 55 Cb 0.00 -1.03 0.01 0.00 0.41 0.00 0.00 41.25 40.64 3mmy s ASN 55 CO 0.00 0.02 -0.18 -0.36 -1.51 0.00 0.00 177.10 175.07 3mmy s PHE 56 N 0.93 2.02 -0.10 2.20 0.40 -1.26 0.22 117.98 122.39 3mmy s PHE 56 Ca -0.08 -0.83 -0.03 0.00 -0.60 0.00 0.00 56.93 55.39 3mmy s PHE 56 Cb -0.15 -1.40 -0.03 0.00 0.51 0.00 0.00 43.02 41.94 3mmy s PHE 56 CO -0.00 -0.37 0.03 -1.17 0.70 0.00 0.00 175.22 174.40 3mmy s LEU 57 N 0.58 3.71 -0.05 -0.37 2.96 -0.18 -0.80 118.68 124.53 3mmy s LEU 57 Ca -0.15 0.17 0.04 0.00 -0.22 0.00 0.00 54.13 53.98 3mmy s LEU 57 Cb -0.17 -1.87 -0.02 0.00 0.50 0.00 0.00 46.19 44.63 3mmy s LEU 57 CO 0.05 0.36 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.64 3mmy s ILE 58 N -0.74 2.83 -0.01 6.68 -1.09 -0.03 -1.29 121.20 127.56 3mmy s ILE 58 Ca 0.12 -0.81 0.01 0.00 -2.23 0.00 0.00 60.65 57.74 3mmy s ILE 58 Cb -0.12 -2.09 0.00 0.00 -1.58 0.00 0.00 42.46 38.68 3mmy s ILE 58 CO 0.02 0.59 -0.05 0.00 -1.23 0.00 0.00 174.94 174.27 3mmy s ALA 59 N -0.67 0.49 0.07 9.38 0.00 -0.69 -1.26 121.76 129.07 3mmy s ALA 59 Ca 0.10 -0.17 0.04 0.00 0.00 0.00 0.00 51.96 51.93 3mmy s ALA 59 Cb -0.11 -0.19 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 3mmy s ALA 59 CO 0.00 0.08 0.01 0.20 0.00 0.00 0.00 175.76 176.05 3mmy s GLY 60 N 0.17 1.92 0.26 0.00 0.00 -0.84 -1.36 107.32 107.46 3mmy s GLY 60 Ca -0.02 -1.06 0.01 0.00 0.00 0.00 0.00 44.72 43.66 3mmy s GLY 60 CO -0.00 -1.01 0.14 -1.35 0.00 0.00 0.00 173.10 170.87 3mmy s SER 61 N -2.12 0.97 0.00 1.64 1.04 -0.71 -1.69 113.70 112.83 3mmy s SER 61 Ca 0.24 -1.46 0.03 0.00 0.48 0.00 0.00 55.95 55.25 3mmy s SER 61 Cb -0.12 0.32 0.16 0.00 0.10 0.00 0.00 66.02 66.49 3mmy s SER 61 CO 0.17 -0.83 0.91 0.79 0.98 0.00 0.00 173.24 175.26 3mmy n TRP 62 N -0.44 0.00 -0.42 5.02 7.02 -0.14 -1.92 117.44 126.55 3mmy n TRP 62 Ca 0.01 0.00 0.09 0.00 -1.02 0.00 0.00 57.50 56.59 3mmy n TRP 62 Cb 0.66 0.00 0.28 0.00 -2.42 0.00 0.00 31.31 29.83 3mmy n TRP 62 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3mmy n ALA 63 N -0.55 2.55 -0.91 6.99 0.00 -1.26 -4.67 120.51 122.66 3mmy n ALA 63 Ca 0.02 -1.40 0.00 0.00 0.00 0.00 0.00 53.44 52.06 3mmy n ALA 63 Cb 0.01 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 18.66 3mmy n ALA 63 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3mmy n ASN 64 N 1.08 -0.69 -4.91 0.00 3.02 -0.81 -4.97 115.26 107.98 3mmy n ASN 64 Ca 0.21 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.46 3mmy n ASN 64 Cb 0.66 -0.12 -0.04 0.00 -0.61 0.00 0.00 39.78 39.67 3mmy n ASN 64 CO 0.00 0.00 0.00 1.51 -2.62 0.00 0.00 177.26 176.15 3mmy s ASP 65 N -2.75 6.42 -0.12 6.41 -4.77 -1.26 -0.48 116.67 120.13 3mmy s ASP 65 Ca 0.00 0.43 0.03 0.00 -3.30 0.00 0.00 52.55 49.72 3mmy s ASP 65 Cb 0.00 -2.03 0.00 0.00 -1.09 0.00 0.00 42.92 39.81 3mmy s ASP 65 CO 0.00 0.06 -0.23 -0.69 0.70 0.00 0.00 175.17 175.01 3mmy s VAL 66 N -1.68 2.07 0.17 2.11 1.01 -0.02 -1.74 120.40 122.32 3mmy s VAL 66 Ca 0.38 -1.00 0.11 0.00 0.00 0.00 0.00 61.98 61.47 3mmy s VAL 66 Cb -0.12 -1.80 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 3mmy s VAL 66 CO 0.27 0.56 -0.25 -0.13 0.00 0.00 0.00 175.10 175.55 3mmy s ARG 67 N 0.52 1.44 -0.03 2.72 0.52 -0.47 -0.77 118.95 122.89 3mmy s ARG 67 Ca -0.14 -1.44 0.06 0.00 -0.52 0.00 0.00 55.73 53.68 3mmy s ARG 67 Cb -0.17 -1.81 -0.01 0.00 0.52 0.00 0.00 34.95 33.48 3mmy s ARG 67 CO 0.05 0.40 -0.20 0.00 0.02 0.00 0.00 175.30 175.57 3mmy s TRP 69 N -0.24 1.27 0.01 0.00 0.51 -0.41 -0.71 118.94 119.37 3mmy s TRP 69 Ca 0.02 -0.30 -0.26 0.00 -2.12 0.00 0.00 56.10 53.44 3mmy s TRP 69 Cb -0.10 -0.78 -0.05 0.00 -0.81 0.00 0.00 33.47 31.73 3mmy s TRP 69 CO 0.01 0.01 0.80 -2.00 -0.51 0.00 0.00 176.95 175.26 3mmy s GLU 70 N -0.77 4.50 -0.25 4.98 2.12 0.46 -1.01 118.70 128.74 3mmy s GLU 70 Ca 0.04 1.10 -0.06 0.00 0.36 0.00 0.00 54.97 56.40 3mmy s GLU 70 Cb -0.07 -3.41 -0.02 0.00 0.26 0.00 0.00 34.13 30.90 3mmy s GLU 70 CO 0.00 0.15 0.04 0.08 -0.54 0.00 0.00 175.26 175.00 3mmy s VAL 71 N 0.39 4.04 0.31 3.70 1.01 0.13 -0.82 120.40 129.16 3mmy s VAL 71 Ca 0.41 -0.32 -0.03 0.00 0.00 0.00 0.00 61.98 62.04 3mmy s VAL 71 Cb -0.20 -2.91 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 3mmy s VAL 71 CO 0.23 0.32 0.55 -1.10 0.00 0.00 0.00 175.10 175.10 3mmy s GLN 72 N 1.57 3.57 0.43 2.72 -0.21 0.21 -3.97 119.66 123.98 3mmy s GLN 72 Ca 0.06 -0.12 0.19 0.00 0.02 0.00 0.00 55.36 55.50 3mmy s GLN 72 Cb -0.15 -2.66 1.12 0.00 1.00 0.00 0.00 33.01 32.32 3mmy s GLN 72 CO 0.02 0.19 1.87 -0.44 -2.12 0.00 0.00 175.29 174.81 3mmy h ASP 73 N 1.34 0.36 0.88 5.90 3.32 -1.96 0.26 116.42 126.52 3mmy h ASP 73 Ca -0.48 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.60 3mmy h ASP 73 Cb 1.20 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.72 3mmy h ASP 73 CO 0.65 0.15 0.00 0.77 -1.72 0.00 0.00 179.24 179.09 3mmy h SER 74 N 0.36 0.00 0.00 6.45 4.64 -1.94 -2.26 113.55 120.80 3mmy h SER 74 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 3mmy h SER 74 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3mmy h SER 74 CO -0.15 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.42 3mmy n GLY 75 N 0.02 0.38 3.74 -0.77 0.00 0.08 -4.34 105.19 104.30 3mmy n GLY 75 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 3mmy n GLY 75 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3mmy s GLN 76 N -0.91 4.32 -0.09 1.61 0.74 -1.26 -4.82 119.66 119.25 3mmy s GLN 76 Ca 0.00 2.18 0.04 0.00 0.05 0.00 0.00 55.36 57.63 3mmy s GLN 76 Cb 0.00 -3.15 0.00 0.00 1.10 0.00 0.00 33.01 30.96 3mmy s GLN 76 CO 0.00 -0.34 -0.22 0.95 -0.55 0.00 0.00 175.29 175.13 3mmy s THR 77 N 0.09 1.88 -0.25 -0.34 -4.23 -1.26 -0.62 115.64 110.92 3mmy s THR 77 Ca 0.58 -0.92 0.02 0.00 -1.18 0.00 0.00 61.69 60.19 3mmy s THR 77 Cb -0.39 -1.64 0.05 0.00 1.34 0.00 0.00 72.50 71.87 3mmy s THR 77 CO 0.40 0.52 -0.11 -0.63 -0.54 0.00 0.00 174.62 174.27 3mmy s ILE 78 N 0.36 2.25 0.32 2.99 1.09 0.00 -4.55 121.20 123.67 3mmy s ILE 78 Ca -0.17 -1.51 -0.29 0.00 -1.10 0.00 0.00 60.65 57.58 3mmy s ILE 78 Cb -0.17 -2.28 -0.12 0.00 -1.06 0.00 0.00 42.46 38.83 3mmy s ILE 78 CO 0.08 0.04 1.39 -2.65 -0.10 0.00 0.00 174.94 173.70 3mmy n PRO 79 N 4.48 2.30 -0.01 2.79 -0.02 -1.26 -0.40 135.00 142.88 3mmy n PRO 79 Ca -0.15 0.81 -0.01 0.00 -2.02 0.00 0.00 63.50 62.13 3mmy n PRO 79 Cb 0.43 -2.46 -0.01 0.00 -0.02 0.00 0.00 33.50 31.44 3mmy n PRO 79 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3mmy n LYS 80 N 1.02 0.03 -3.65 -0.52 4.76 0.11 -4.84 118.16 115.08 3mmy n LYS 80 Ca 0.06 0.01 -0.02 0.00 -2.87 0.00 0.00 58.31 55.49 3mmy n LYS 80 Cb 0.36 -0.95 -0.02 0.00 -1.84 0.00 0.00 35.03 32.57 3mmy n LYS 80 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3mmy s ALA 81 N -2.03 -2.21 0.07 7.82 0.00 -1.23 -5.02 121.76 119.16 3mmy s ALA 81 Ca -0.02 1.93 -0.06 0.00 0.00 0.00 0.00 51.96 53.82 3mmy s ALA 81 Cb 0.01 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.66 3mmy s ALA 81 CO 0.03 -0.53 0.10 1.14 0.00 0.00 0.00 175.76 176.50 3mmy s GLN 82 N -1.99 0.73 0.14 0.00 -2.07 -1.26 -1.20 119.66 114.01 3mmy s GLN 82 Ca 0.12 -1.02 0.02 0.00 -1.82 0.00 0.00 55.36 52.66 3mmy s GLN 82 Cb -0.01 0.28 -0.04 0.00 -1.09 0.00 0.00 33.01 32.15 3mmy s GLN 82 CO -0.02 -0.20 -0.03 -0.65 -1.32 0.00 0.00 175.29 173.07 3mmy s GLN 83 N -3.72 1.00 -0.03 9.60 -1.52 0.05 -4.99 119.66 120.04 3mmy s GLN 83 Ca 0.04 -1.45 0.05 0.00 -1.95 0.00 0.00 55.36 52.06 3mmy s GLN 83 Cb 0.05 -0.25 -0.01 0.00 -0.22 0.00 0.00 33.01 32.58 3mmy s GLN 83 CO -0.10 -0.08 -0.20 -1.64 -0.25 0.00 0.00 175.29 173.02 3mmy s MET 84 N -3.88 1.84 0.57 2.91 -1.94 -1.26 -0.84 119.30 116.71 3mmy s MET 84 Ca 0.19 -0.71 0.09 0.00 -1.71 0.00 0.00 55.69 53.56 3mmy s MET 84 Cb 0.06 -1.66 0.09 0.00 2.01 0.00 0.00 34.83 35.32 3mmy s MET 84 CO 0.00 0.35 0.76 0.72 -0.01 0.00 0.00 175.02 176.84 3mmy n HIS 85 N 2.87 -2.15 0.13 -0.03 8.25 0.36 -5.00 115.22 119.65 3mmy n HIS 85 Ca -0.17 -2.11 0.09 0.00 -0.26 0.00 0.00 57.72 55.27 3mmy n HIS 85 Cb 0.53 -0.54 0.17 0.00 1.12 0.00 0.00 29.99 31.27 3mmy n HIS 85 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3mmy n THR 86 N -2.21 0.59 -3.94 1.59 -2.24 -1.26 -4.80 114.28 102.01 3mmy n THR 86 Ca 0.15 -0.79 -0.10 0.00 -2.27 0.00 0.00 64.05 61.04 3mmy n THR 86 Cb 0.59 0.85 -0.06 0.00 -2.10 0.00 0.00 70.33 69.61 3mmy n THR 86 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3mmy s GLY 87 N -1.17 0.43 0.13 3.38 0.00 -1.26 -4.84 107.32 103.99 3mmy s GLY 87 Ca 0.29 -0.80 -0.34 0.00 0.00 0.00 0.00 44.72 43.87 3mmy s GLY 87 CO 0.23 -0.72 0.98 -1.05 0.00 0.00 0.00 173.10 172.55 3mmy n PRO 88 N -0.27 0.58 -3.05 2.90 -0.02 -1.26 -4.36 135.00 129.52 3mmy n PRO 88 Ca -0.06 0.21 -0.41 0.00 -2.02 0.00 0.00 63.50 61.21 3mmy n PRO 88 Cb 0.63 -1.59 -0.06 0.00 -0.02 0.00 0.00 33.50 32.46 3mmy n PRO 88 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3mmy s VAL 89 N -0.34 4.93 -0.11 -1.45 1.01 -0.89 -0.57 120.40 122.98 3mmy s VAL 89 Ca 0.76 1.20 0.20 0.00 0.00 0.00 0.00 61.98 64.14 3mmy s VAL 89 Cb -0.98 -4.00 -0.26 0.00 0.00 0.00 0.00 36.38 31.14 3mmy s VAL 89 CO 0.55 -0.04 0.44 0.18 0.00 0.00 0.00 175.10 176.23 3mmy n LEU 90 N 5.84 0.17 -3.58 3.92 4.77 0.19 -4.14 117.00 124.17 3mmy n LEU 90 Ca 0.01 0.07 -0.15 0.00 -0.03 0.00 0.00 56.01 55.91 3mmy n LEU 90 Cb 0.49 0.15 -0.06 0.00 -2.33 0.00 0.00 43.42 41.67 3mmy n LEU 90 CO 0.45 0.15 0.30 -0.62 -1.33 0.00 0.00 177.39 176.34 3mmy s ASP 91 N -5.02 -0.48 0.03 -1.43 2.15 -1.17 -4.56 116.67 106.18 3mmy s ASP 91 Ca -0.07 0.37 -0.02 0.00 0.43 0.00 0.00 52.55 53.25 3mmy s ASP 91 Cb 0.11 0.48 -0.02 0.00 -0.30 0.00 0.00 42.92 43.19 3mmy s ASP 91 CO 0.87 -0.63 0.02 0.68 -0.17 0.00 0.00 175.17 175.93 3mmy s VAL 92 N -1.79 0.13 0.35 1.11 -7.23 -1.26 -0.97 120.40 110.74 3mmy s VAL 92 Ca -0.09 -1.11 -0.11 0.00 -1.81 0.00 0.00 61.98 58.86 3mmy s VAL 92 Cb -0.01 -0.69 0.03 0.00 0.56 0.00 0.00 36.38 36.27 3mmy s VAL 92 CO 0.04 -0.61 0.63 0.00 -0.31 0.00 0.00 175.10 174.85 3mmy s TRP 94 N -2.91 2.65 0.63 0.00 0.52 -1.26 -0.04 118.94 118.53 3mmy s TRP 94 Ca 0.21 -0.21 -0.14 0.00 0.02 0.00 0.00 56.10 55.98 3mmy s TRP 94 Cb -0.03 -1.29 -0.02 0.00 -1.15 0.00 0.00 33.47 30.98 3mmy s TRP 94 CO 0.14 0.52 1.06 -1.54 0.02 0.00 0.00 176.95 177.15 3mmy s SER 95 N -2.88 5.61 0.48 2.95 1.04 -0.48 -4.62 113.70 115.80 3mmy s SER 95 Ca 0.25 1.76 0.13 0.00 0.48 0.00 0.00 55.95 58.58 3mmy s SER 95 Cb -0.09 -2.52 1.13 0.00 0.10 0.00 0.00 66.02 64.64 3mmy s SER 95 CO 0.16 -1.29 2.12 -2.24 0.98 0.00 0.00 173.24 172.97 3mmy h ASP 96 N 0.04 0.16 0.14 7.02 2.03 -1.94 -1.62 116.42 122.25 3mmy h ASP 96 Ca -0.46 -0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.84 3mmy h ASP 96 Cb 1.22 -0.04 0.00 0.00 -0.83 0.00 0.00 39.33 39.68 3mmy h ASP 96 CO 0.57 0.12 -0.08 -0.90 -1.03 0.00 0.00 179.24 177.92 3mmy n ASP 97 N -4.52 0.89 0.00 4.15 5.75 -1.26 -4.56 116.55 117.01 3mmy n ASP 97 Ca -0.01 -1.05 0.00 0.00 -0.01 0.00 0.00 54.79 53.72 3mmy n ASP 97 Cb 0.08 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.18 3mmy n ASP 97 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3mmy n GLY 98 N 1.21 0.58 0.11 6.12 0.00 -0.61 -4.60 105.19 107.99 3mmy n GLY 98 Ca 0.17 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.19 3mmy n GLY 98 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3mmy h SER 99 N 0.00 0.00 -4.25 1.61 4.64 -1.92 -3.47 113.55 110.16 3mmy h SER 99 Ca 0.00 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.69 3mmy h SER 99 Cb 0.06 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 61.89 3mmy h SER 99 CO 0.00 0.63 -0.86 -0.54 -0.87 0.00 0.00 176.83 175.19 3mmy s LYS 100 N -2.89 1.53 -0.12 4.77 -0.14 -1.26 -2.34 119.74 119.29 3mmy s LYS 100 Ca 0.01 -1.06 0.01 0.00 -1.36 0.00 0.00 55.97 53.56 3mmy s LYS 100 Cb 0.08 -1.72 -0.02 0.00 -1.68 0.00 0.00 37.83 34.50 3mmy s LYS 100 CO 0.78 0.44 -0.14 0.08 -0.76 0.00 0.00 175.35 175.75 3mmy s VAL 101 N -0.85 2.97 -0.05 3.17 1.01 -0.08 -1.38 120.40 125.18 3mmy s VAL 101 Ca 0.10 -0.70 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 3mmy s VAL 101 Cb -0.09 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 34.03 3mmy s VAL 101 CO 0.02 0.54 0.02 -0.36 0.00 0.00 0.00 175.10 175.32 3mmy s PHE 102 N 0.19 3.17 0.00 5.22 0.40 0.94 0.05 117.98 127.95 3mmy s PHE 102 Ca -0.08 0.17 0.01 0.00 -0.60 0.00 0.00 56.93 56.43 3mmy s PHE 102 Cb -0.15 -1.75 -0.01 0.00 0.51 0.00 0.00 43.02 41.62 3mmy s PHE 102 CO 0.05 0.49 -0.05 0.95 0.70 0.00 0.00 175.22 177.36 3mmy s THR 103 N -0.99 0.35 -0.04 0.64 -4.23 -0.44 -1.38 115.64 109.54 3mmy s THR 103 Ca 0.16 -0.30 0.04 0.00 -1.18 0.00 0.00 61.69 60.41 3mmy s THR 103 Cb -0.11 -0.32 0.00 0.00 1.34 0.00 0.00 72.50 73.41 3mmy s THR 103 CO 0.06 0.02 -0.15 0.00 -0.54 0.00 0.00 174.62 174.02 3mmy s ALA 104 N -0.27 1.36 0.08 3.99 0.00 -0.14 -0.88 121.76 125.89 3mmy s ALA 104 Ca -0.00 -0.58 0.02 0.00 0.00 0.00 0.00 51.96 51.40 3mmy s ALA 104 Cb -0.03 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.58 3mmy s ALA 104 CO -0.00 0.23 -0.07 0.45 0.00 0.00 0.00 175.76 176.36 3mmy s SER 105 N 0.16 1.04 0.35 0.00 0.15 -0.85 -0.64 113.70 113.92 3mmy s SER 105 Ca -0.05 -0.83 0.24 0.00 0.70 0.00 0.00 55.95 56.01 3mmy s SER 105 Cb -0.12 0.07 1.27 0.00 -1.71 0.00 0.00 66.02 65.54 3mmy s SER 105 CO 0.02 -0.36 1.74 0.00 1.20 0.00 0.00 173.24 175.84 3mmy n ASP 107 N -2.35 0.00 -0.01 0.00 5.68 -1.26 -4.34 116.55 114.28 3mmy n ASP 107 Ca -0.01 -1.36 -0.00 0.00 -0.50 0.00 0.00 54.79 52.91 3mmy n ASP 107 Cb 0.06 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.04 3mmy n ASP 107 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3mmy n LYS 108 N -0.62 -0.16 -4.52 0.11 5.02 -0.88 -5.00 118.16 112.11 3mmy n LYS 108 Ca 0.04 0.08 -0.24 0.00 -2.02 0.00 0.00 58.31 56.17 3mmy n LYS 108 Cb 0.02 -3.24 -0.11 0.00 -0.02 0.00 0.00 35.03 31.68 3mmy n LYS 108 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3mmy s THR 109 N -1.93 1.56 0.01 -0.18 -4.23 -1.25 -0.51 115.64 109.11 3mmy s THR 109 Ca 0.00 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.53 3mmy s THR 109 Cb 0.00 -2.88 -0.01 0.00 1.34 0.00 0.00 72.50 70.95 3mmy s THR 109 CO 0.00 -0.00 -0.07 0.00 -0.54 0.00 0.00 174.62 174.01 3mmy s ALA 110 N -3.03 0.55 0.21 3.99 0.00 -0.99 -2.01 121.76 120.48 3mmy s ALA 110 Ca 0.36 -0.45 0.10 0.00 0.00 0.00 0.00 51.96 51.96 3mmy s ALA 110 Cb 0.09 -0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 3mmy s ALA 110 CO 0.17 0.08 -0.10 0.15 0.00 0.00 0.00 175.76 176.06 3mmy s LYS 111 N -0.67 2.02 -0.22 0.00 1.02 -0.06 -0.87 119.74 120.97 3mmy s LYS 111 Ca -0.02 -1.39 -0.05 0.00 0.02 0.00 0.00 55.97 54.54 3mmy s LYS 111 Cb -0.05 -2.09 -0.02 0.00 -0.52 0.00 0.00 37.83 35.16 3mmy s LYS 111 CO 0.00 0.40 -0.01 1.41 -0.92 0.00 0.00 175.35 176.23 3mmy s MET 112 N -3.10 3.47 -0.30 1.68 -2.45 0.34 -1.33 119.30 117.62 3mmy s MET 112 Ca 0.27 -0.58 -0.05 0.00 -1.25 0.00 0.00 55.69 54.08 3mmy s MET 112 Cb -0.08 -3.09 0.03 0.00 1.25 0.00 0.00 34.83 32.94 3mmy s MET 112 CO 0.16 -0.16 0.04 -0.46 1.05 0.00 0.00 175.02 175.64 3mmy s TRP 113 N 1.44 3.17 -0.48 4.11 -0.00 0.11 -1.57 118.94 125.73 3mmy s TRP 113 Ca 0.05 -1.37 -0.25 0.00 -0.00 0.00 0.00 56.10 54.53 3mmy s TRP 113 Cb -0.14 -2.19 0.03 0.00 -0.00 0.00 0.00 33.47 31.17 3mmy s TRP 113 CO -0.01 -0.69 0.91 0.34 -0.00 0.00 0.00 176.95 177.50 3mmy s ASP 114 N 1.39 6.45 0.18 5.86 2.15 0.80 -0.91 116.67 132.60 3mmy s ASP 114 Ca -0.00 -0.01 -0.11 0.00 0.43 0.00 0.00 52.55 52.86 3mmy s ASP 114 Cb -0.18 -2.44 0.08 0.00 -0.30 0.00 0.00 42.92 40.08 3mmy s ASP 114 CO 0.00 -1.07 1.72 -0.07 -0.17 0.00 0.00 175.17 175.59 3mmy h LEU 115 N 10.58 0.88 -0.70 -1.34 3.38 -1.75 0.11 115.31 126.47 3mmy h LEU 115 Ca -0.25 -0.19 -0.10 0.00 0.09 0.00 0.00 57.88 57.44 3mmy h LEU 115 Cb 1.08 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 3mmy h LEU 115 CO 1.03 0.84 -0.06 0.77 0.09 0.00 0.00 178.44 181.11 3mmy h SER 116 N 0.88 0.93 0.09 -0.43 4.64 -1.93 -2.39 113.55 115.34 3mmy h SER 116 Ca 0.20 -0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 3mmy h SER 116 Cb 0.26 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 3mmy h SER 116 CO -0.01 1.02 -0.25 -1.54 -0.87 0.00 0.00 176.83 175.18 3mmy n SER 117 N -4.17 1.60 -3.40 4.97 3.41 -1.20 -4.97 113.62 109.86 3mmy n SER 117 Ca 0.02 -1.29 -0.24 0.00 -0.26 0.00 0.00 58.87 57.10 3mmy n SER 117 Cb 0.36 0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.51 3mmy n SER 117 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3mmy n ASN 118 N -0.12 -4.12 -4.59 4.04 5.15 0.33 -4.98 115.26 110.98 3mmy n ASN 118 Ca 0.13 -0.43 -0.34 0.00 -0.60 0.00 0.00 54.58 53.33 3mmy n ASN 118 Cb 0.41 -3.38 -0.11 0.00 -0.53 0.00 0.00 39.78 36.17 3mmy n ASN 118 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 3mmy s GLN 119 N -6.06 3.26 -0.05 1.20 -1.52 -1.01 -4.95 119.66 110.54 3mmy s GLN 119 Ca 0.42 -0.47 0.06 0.00 -1.95 0.00 0.00 55.36 53.42 3mmy s GLN 119 Cb -0.22 -2.82 -0.01 0.00 -0.22 0.00 0.00 33.01 29.73 3mmy s GLN 119 CO 0.52 0.49 -0.25 0.00 -0.25 0.00 0.00 175.29 175.81 3mmy s ALA 120 N -0.31 2.11 0.07 6.09 0.00 -1.26 -0.14 121.76 128.32 3mmy s ALA 120 Ca 0.06 -1.03 0.05 0.00 0.00 0.00 0.00 51.96 51.04 3mmy s ALA 120 Cb -0.12 -0.63 -0.03 0.00 0.00 0.00 0.00 23.12 22.33 3mmy s ALA 120 CO 0.02 0.43 -0.15 0.96 0.00 0.00 0.00 175.76 177.02 3mmy s ILE 121 N -0.23 1.19 0.25 0.00 -4.36 -0.60 -4.97 121.20 112.47 3mmy s ILE 121 Ca -0.01 -1.27 -0.30 0.00 -0.26 0.00 0.00 60.65 58.81 3mmy s ILE 121 Cb -0.13 -1.12 -0.09 0.00 1.25 0.00 0.00 42.46 42.37 3mmy s ILE 121 CO 0.03 -0.16 1.33 -1.58 0.24 0.00 0.00 174.94 174.80 3mmy s GLN 122 N -1.64 4.36 0.00 0.37 0.74 -1.26 -0.50 119.66 121.73 3mmy s GLN 122 Ca -0.00 2.14 0.00 0.00 0.05 0.00 0.00 55.36 57.55 3mmy s GLN 122 Cb -0.10 -3.14 0.00 0.00 1.10 0.00 0.00 33.01 30.87 3mmy s GLN 122 CO 0.02 -0.26 0.00 0.44 -0.55 0.00 0.00 175.29 174.95 3mmy n ILE 123 N 2.04 0.00 -3.77 -2.34 -5.35 -0.04 -4.85 119.36 105.05 3mmy n ILE 123 Ca 0.04 -0.38 -0.13 0.00 -0.27 0.00 0.00 62.75 62.01 3mmy n ILE 123 Cb 0.42 1.00 -0.09 0.00 -1.74 0.00 0.00 39.64 39.23 3mmy n ILE 123 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3mmy s ALA 124 N -0.75 -0.75 -0.01 -1.28 0.00 -1.13 -4.71 121.76 113.13 3mmy s ALA 124 Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 51.96 52.31 3mmy s ALA 124 Cb 0.00 0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.15 3mmy s ALA 124 CO 0.00 -0.25 0.01 -1.14 0.00 0.00 0.00 175.76 174.39 3mmy s GLN 125 N -1.18 0.02 0.34 0.00 2.00 -1.26 -2.34 119.66 117.25 3mmy s GLN 125 Ca -0.12 0.08 0.04 0.00 -2.00 0.00 0.00 55.36 53.35 3mmy s GLN 125 Cb -0.05 -0.16 -0.06 0.00 0.80 0.00 0.00 33.01 33.54 3mmy s GLN 125 CO 0.04 -0.08 0.07 -1.01 -0.50 0.00 0.00 175.29 173.81 3mmy s HIS 126 N 0.54 1.93 -2.50 1.67 3.76 0.33 -5.01 115.29 116.01 3mmy s HIS 126 Ca -0.05 -1.01 0.23 0.00 -0.15 0.00 0.00 55.06 54.08 3mmy s HIS 126 Cb -0.07 -1.27 0.61 0.00 1.11 0.00 0.00 32.58 32.97 3mmy s HIS 126 CO -0.01 -0.04 1.49 -0.25 -0.85 0.00 0.00 174.74 175.08 3mmy n ASP 127 N -0.80 2.37 -3.29 1.40 8.00 -1.26 -4.82 116.55 118.15 3mmy n ASP 127 Ca -0.03 -1.80 -0.10 0.00 0.71 0.00 0.00 54.79 53.56 3mmy n ASP 127 Cb 0.66 -0.11 -0.01 0.00 -0.02 0.00 0.00 41.12 41.64 3mmy n ASP 127 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3mmy s ALA 128 N -1.78 -0.38 0.32 2.24 0.00 -1.26 -4.90 121.76 115.99 3mmy s ALA 128 Ca 0.34 -0.89 -0.28 0.00 0.00 0.00 0.00 51.96 51.14 3mmy s ALA 128 Cb 0.20 0.87 -0.13 0.00 0.00 0.00 0.00 23.12 24.06 3mmy s ALA 128 CO 0.30 -0.93 1.12 -2.30 0.00 0.00 0.00 175.76 173.95 3mmy n PRO 129 N -0.51 1.67 -3.14 0.00 -0.02 -1.26 -4.32 135.00 127.41 3mmy n PRO 129 Ca -0.05 0.58 -0.41 0.00 -2.02 0.00 0.00 63.50 61.60 3mmy n PRO 129 Cb 0.60 -2.05 -0.07 0.00 -0.02 0.00 0.00 33.50 31.96 3mmy n PRO 129 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3mmy s VAL 130 N -1.09 4.93 -0.07 -1.45 1.01 -0.65 -1.87 120.40 121.21 3mmy s VAL 130 Ca 0.57 0.61 0.14 0.00 0.00 0.00 0.00 61.98 63.31 3mmy s VAL 130 Cb -0.64 -4.03 -0.21 0.00 0.00 0.00 0.00 36.38 31.51 3mmy s VAL 130 CO 0.61 -0.24 0.67 1.17 0.00 0.00 0.00 175.10 177.31 3mmy n LYS 131 N 5.93 0.63 -4.06 2.72 3.00 0.21 -3.55 118.16 123.04 3mmy n LYS 131 Ca -0.02 0.26 -0.11 0.00 -0.00 0.00 0.00 58.31 58.44 3mmy n LYS 131 Cb 0.49 -1.78 -0.11 0.00 0.00 0.00 0.00 35.03 33.62 3mmy n LYS 131 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 3mmy s THR 132 N -2.68 0.44 -0.14 3.15 -4.23 -0.95 -4.29 115.64 106.94 3mmy s THR 132 Ca -0.04 -1.22 -0.09 0.00 -1.18 0.00 0.00 61.69 59.15 3mmy s THR 132 Cb 0.08 -0.75 0.05 0.00 1.34 0.00 0.00 72.50 73.21 3mmy s THR 132 CO 0.82 -0.53 0.34 -0.51 -0.54 0.00 0.00 174.62 174.21 3mmy s ILE 133 N -1.91 -0.02 0.02 2.99 2.07 -1.26 -2.01 121.20 121.08 3mmy s ILE 133 Ca -0.07 0.08 -0.05 0.00 -1.41 0.00 0.00 60.65 59.20 3mmy s ILE 133 Cb -0.06 -0.51 -0.01 0.00 0.13 0.00 0.00 42.46 42.01 3mmy s ILE 133 CO -0.01 0.03 0.09 -1.00 -1.91 0.00 0.00 174.94 172.13 3mmy s HIS 134 N 0.97 0.14 -0.21 3.50 3.76 -0.22 -4.59 115.29 118.64 3mmy s HIS 134 Ca -0.06 -0.34 -0.09 0.00 -0.15 0.00 0.00 55.06 54.41 3mmy s HIS 134 Cb -0.07 -0.11 -0.05 0.00 1.11 0.00 0.00 32.58 33.46 3mmy s HIS 134 CO -0.07 -0.29 0.12 -0.46 -0.85 0.00 0.00 174.74 173.19 3mmy s TRP 135 N -1.80 3.33 -0.25 1.40 -0.11 -1.26 -0.02 118.94 120.22 3mmy s TRP 135 Ca -0.12 0.21 -0.05 0.00 1.22 0.00 0.00 56.10 57.35 3mmy s TRP 135 Cb -0.06 -2.18 -0.00 0.00 -1.50 0.00 0.00 33.47 29.72 3mmy s TRP 135 CO -0.01 0.15 0.02 0.42 -4.62 0.00 0.00 176.95 172.92 3mmy s ILE 136 N 0.66 3.74 -0.45 5.86 1.01 0.49 -4.97 121.20 127.53 3mmy s ILE 136 Ca 0.07 -0.53 -0.07 0.00 0.00 0.00 0.00 60.65 60.12 3mmy s ILE 136 Cb -0.12 -2.81 0.12 0.00 0.01 0.00 0.00 42.46 39.66 3mmy s ILE 136 CO 0.01 0.27 0.29 -0.75 0.00 0.00 0.00 174.94 174.76 3mmy s LYS 137 N 1.50 2.29 0.33 2.79 2.20 -1.26 -1.54 119.74 126.04 3mmy s LYS 137 Ca 0.04 -1.79 0.07 0.00 -0.36 0.00 0.00 55.97 53.93 3mmy s LYS 137 Cb -0.16 -3.79 -0.01 0.00 -1.51 0.00 0.00 37.83 32.36 3mmy s LYS 137 CO 0.00 -1.15 0.43 0.00 -0.36 0.00 0.00 175.35 174.27 3mmy s ALA 138 N 1.26 4.14 0.42 3.13 0.00 0.21 -4.92 121.76 126.00 3mmy s ALA 138 Ca 0.07 -1.48 0.09 0.00 0.00 0.00 0.00 51.96 50.64 3mmy s ALA 138 Cb -0.25 -1.59 0.90 0.00 0.00 0.00 0.00 23.12 22.18 3mmy s ALA 138 CO -0.02 -0.00 2.03 -1.35 0.00 0.00 0.00 175.76 176.42 3mmy h PRO 139 N 0.98 0.38 0.00 0.00 0.11 -1.98 -3.23 132.00 128.25 3mmy h PRO 139 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3mmy h PRO 139 Cb 1.25 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3mmy h PRO 139 CO 0.54 0.31 -0.80 0.27 -0.21 0.00 0.00 178.00 178.12 3mmy n ASN 140 N -4.43 0.80 -3.74 -2.05 6.94 -1.26 -5.02 115.26 106.50 3mmy n ASN 140 Ca 0.01 -0.72 -0.10 0.00 -0.02 0.00 0.00 54.58 53.75 3mmy n ASN 140 Cb 0.12 1.09 -0.05 0.00 -2.36 0.00 0.00 39.78 38.59 3mmy n ASN 140 CO 0.00 0.00 0.00 -0.72 -1.03 0.00 0.00 177.26 175.51 3mmy s TYR 141 N -2.42 -0.06 -0.02 -2.53 1.13 -1.22 -5.15 117.35 107.08 3mmy s TYR 141 Ca 0.04 -0.28 0.01 0.00 -1.41 0.00 0.00 57.07 55.43 3mmy s TYR 141 Cb 0.10 0.24 0.01 0.00 -1.10 0.00 0.00 41.96 41.22 3mmy s TYR 141 CO 0.58 -0.78 -0.03 -1.12 -2.51 0.00 0.00 175.55 171.69 3mmy s SER 142 N -2.86 0.60 0.28 -0.18 0.01 -1.26 -0.62 113.70 109.67 3mmy s SER 142 Ca 0.08 -0.08 -0.15 0.00 1.31 0.00 0.00 55.95 57.10 3mmy s SER 142 Cb 0.01 -0.20 0.01 0.00 0.21 0.00 0.00 66.02 66.05 3mmy s SER 142 CO -0.07 -0.01 0.60 0.00 0.41 0.00 0.00 173.24 174.17 3mmy s VAL 144 N -3.72 5.12 -0.19 0.00 1.01 -0.14 -0.38 120.40 122.09 3mmy s VAL 144 Ca 0.18 0.08 -0.05 0.00 0.00 0.00 0.00 61.98 62.18 3mmy s VAL 144 Cb -0.03 -3.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.05 3mmy s VAL 144 CO 0.09 0.52 -0.00 -0.32 0.00 0.00 0.00 175.10 175.39 3mmy s MET 145 N -0.18 3.65 -0.00 2.72 0.00 0.97 -0.77 119.30 125.69 3mmy s MET 145 Ca 0.09 -0.51 0.06 0.00 0.00 0.00 0.00 55.69 55.33 3mmy s MET 145 Cb -0.12 -3.06 -0.03 0.00 0.00 0.00 0.00 34.83 31.62 3mmy s MET 145 CO 0.01 0.07 -0.18 0.95 0.00 0.00 0.00 175.02 175.87 3mmy s THR 146 N 0.84 2.75 -0.03 10.11 -4.23 0.16 -1.05 115.64 124.19 3mmy s THR 146 Ca 0.01 -1.00 0.06 0.00 -1.18 0.00 0.00 61.69 59.57 3mmy s THR 146 Cb -0.14 -2.09 -0.01 0.00 1.34 0.00 0.00 72.50 71.60 3mmy s THR 146 CO 0.02 0.48 -0.20 -0.83 -0.54 0.00 0.00 174.62 173.55 3mmy s GLY 147 N -1.01 0.99 0.13 3.99 0.00 -0.85 -0.77 107.32 109.80 3mmy s GLY 147 Ca 0.13 -0.83 0.03 0.00 0.00 0.00 0.00 44.72 44.05 3mmy s GLY 147 CO 0.02 -0.60 -0.08 -0.45 0.00 0.00 0.00 173.10 171.99 3mmy s SER 148 N -0.29 1.54 0.00 1.64 0.15 -0.87 -0.62 113.70 115.25 3mmy s SER 148 Ca 0.03 -1.02 0.17 0.00 0.70 0.00 0.00 55.95 55.83 3mmy s SER 148 Cb -0.09 0.03 0.91 0.00 -1.71 0.00 0.00 66.02 65.16 3mmy s SER 148 CO 0.01 -0.39 1.45 0.79 1.20 0.00 0.00 173.24 176.30 3mmy n TRP 149 N -0.15 0.00 1.50 3.44 8.01 -0.78 -1.79 117.44 127.66 3mmy n TRP 149 Ca -0.11 0.00 0.03 0.00 -1.31 0.00 0.00 57.50 56.11 3mmy n TRP 149 Cb 0.61 -0.16 0.10 0.00 -2.01 0.00 0.00 31.31 29.84 3mmy n TRP 149 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.69 176.28 3mmy n ASP 150 N -1.16 0.85 -1.16 -0.99 5.68 -1.26 -4.70 116.55 113.81 3mmy n ASP 150 Ca 0.10 -1.97 -0.11 0.00 -0.50 0.00 0.00 54.79 52.31 3mmy n ASP 150 Cb 0.10 -0.10 -0.01 0.00 -1.14 0.00 0.00 41.12 39.96 3mmy n ASP 150 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3mmy n LYS 151 N -0.05 -0.84 -4.31 0.11 5.02 -0.93 -4.99 118.16 112.17 3mmy n LYS 151 Ca 0.06 0.58 -0.20 0.00 -2.02 0.00 0.00 58.31 56.73 3mmy n LYS 151 Cb 0.14 -4.66 -0.11 0.00 -0.02 0.00 0.00 35.03 30.38 3mmy n LYS 151 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3mmy s THR 152 N -2.51 1.66 -0.16 -0.18 -4.23 -1.25 -0.11 115.64 108.84 3mmy s THR 152 Ca 0.00 -1.92 0.02 0.00 -1.18 0.00 0.00 61.69 58.60 3mmy s THR 152 Cb 0.00 -1.80 0.02 0.00 1.34 0.00 0.00 72.50 72.06 3mmy s THR 152 CO 0.00 -0.41 -0.21 -0.22 -0.54 0.00 0.00 174.62 173.25 3mmy s LEU 153 N -2.74 2.11 0.19 4.79 2.96 0.23 -2.06 118.68 124.16 3mmy s LEU 153 Ca 0.15 -0.63 0.10 0.00 -0.22 0.00 0.00 54.13 53.54 3mmy s LEU 153 Cb -0.04 -1.46 -0.04 0.00 0.50 0.00 0.00 46.19 45.15 3mmy s LEU 153 CO 0.05 0.03 -0.21 -0.54 -1.32 0.00 0.00 176.35 174.37 3mmy s LYS 154 N 1.11 1.43 -0.06 1.98 1.02 0.05 -0.39 119.74 124.88 3mmy s LYS 154 Ca 0.00 -1.51 0.02 0.00 0.02 0.00 0.00 55.97 54.51 3mmy s LYS 154 Cb -0.14 -1.60 0.01 0.00 -0.52 0.00 0.00 37.83 35.58 3mmy s LYS 154 CO -0.09 0.33 -0.13 -0.06 -0.92 0.00 0.00 175.35 174.49 3mmy s PHE 155 N -1.96 1.48 -0.03 3.18 0.08 -0.70 -0.66 117.98 119.38 3mmy s PHE 155 Ca 0.20 -0.53 0.03 0.00 0.12 0.00 0.00 56.93 56.75 3mmy s PHE 155 Cb -0.06 -1.07 -0.00 0.00 -0.57 0.00 0.00 43.02 41.31 3mmy s PHE 155 CO 0.09 -0.26 -0.11 -1.58 -0.10 0.00 0.00 175.22 173.25 3mmy s TRP 156 N 0.58 1.14 -2.17 0.36 0.52 0.05 0.58 118.94 120.00 3mmy s TRP 156 Ca -0.13 -0.28 0.29 0.00 0.02 0.00 0.00 56.10 56.00 3mmy s TRP 156 Cb -0.15 -0.78 1.24 0.00 -1.15 0.00 0.00 33.47 32.63 3mmy s TRP 156 CO 0.04 -0.09 1.85 -0.40 0.02 0.00 0.00 176.95 178.36 3mmy n ASP 157 N 3.14 0.95 0.00 2.95 5.75 -1.26 -0.97 116.55 127.11 3mmy n ASP 157 Ca -0.17 -1.17 0.00 0.00 -0.01 0.00 0.00 54.79 53.44 3mmy n ASP 157 Cb 0.54 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.64 3mmy n ASP 157 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 3mmy n THR 158 N -0.36 0.00 -0.08 2.12 -2.24 -1.26 -4.81 114.28 107.65 3mmy n THR 158 Ca 0.19 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.81 3mmy n THR 158 Cb 0.29 -0.06 -0.06 0.00 -2.10 0.00 0.00 70.33 68.39 3mmy n THR 158 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3mmy n ARG 159 N -2.00 0.35 -4.03 -0.78 1.74 -1.26 -4.93 116.66 105.74 3mmy n ARG 159 Ca 0.00 0.13 -0.28 0.00 -0.77 0.00 0.00 57.85 56.93 3mmy n ARG 159 Cb 0.00 -1.13 -0.05 0.00 -1.02 0.00 0.00 32.46 30.25 3mmy n ARG 159 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3mmy s SER 160 N -6.16 5.74 0.00 0.55 1.04 -1.26 -5.01 113.70 108.60 3mmy s SER 160 Ca -0.22 -0.00 0.29 0.00 0.48 0.00 0.00 55.95 56.50 3mmy s SER 160 Cb 0.08 -1.58 1.28 0.00 0.10 0.00 0.00 66.02 65.89 3mmy s SER 160 CO 0.30 0.11 1.91 -1.54 0.98 0.00 0.00 173.24 175.01 3mmy n SER 161 N -0.04 0.16 -4.67 7.02 3.41 -1.26 -4.71 113.62 113.53 3mmy n SER 161 Ca -0.08 -0.06 -0.40 0.00 -0.26 0.00 0.00 58.87 58.07 3mmy n SER 161 Cb 0.53 -0.25 -0.05 0.00 -0.26 0.00 0.00 64.21 64.18 3mmy n SER 161 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 3mmy s ASN 162 N -2.72 6.75 0.35 4.04 0.01 -1.26 -4.90 114.94 117.21 3mmy s ASN 162 Ca 0.23 0.91 -0.29 0.00 -0.71 0.00 0.00 52.86 53.00 3mmy s ASN 162 Cb 0.20 -2.37 -0.11 0.00 0.41 0.00 0.00 41.25 39.38 3mmy s ASN 162 CO 0.51 -0.28 1.53 -2.16 -1.51 0.00 0.00 177.10 175.19 3mmy s PRO 163 N 1.84 4.10 0.27 -0.60 0.04 -1.26 -4.81 135.00 134.59 3mmy s PRO 163 Ca 0.31 2.59 0.25 0.00 0.04 0.00 0.00 61.00 64.18 3mmy s PRO 163 Cb -0.16 -2.98 0.96 0.00 0.04 0.00 0.00 34.50 32.36 3mmy s PRO 163 CO 0.11 -0.58 1.74 0.00 0.04 0.00 0.00 177.00 178.31 3mmy h MET 164 N 3.57 0.00 -1.61 4.56 -0.00 -0.23 -3.45 114.93 117.77 3mmy h MET 164 Ca -0.50 0.00 0.06 0.00 -0.00 0.00 0.00 59.70 59.27 3mmy h MET 164 Cb 1.23 0.00 -0.23 0.00 -0.00 0.00 0.00 31.60 32.61 3mmy h MET 164 CO 0.69 0.00 0.50 1.41 -0.00 0.00 0.00 176.91 179.51 3mmy s MET 165 N -3.29 0.64 -0.12 -0.10 -2.45 -1.22 -4.99 119.30 107.77 3mmy s MET 165 Ca 0.05 0.18 -0.01 0.00 -1.25 0.00 0.00 55.69 54.67 3mmy s MET 165 Cb 0.10 0.30 0.04 0.00 1.25 0.00 0.00 34.83 36.52 3mmy s MET 165 CO 0.45 -0.19 -0.02 0.08 1.05 0.00 0.00 175.02 176.38 3mmy s VAL 166 N -1.04 0.70 -0.08 10.11 1.01 -1.26 -1.72 120.40 128.12 3mmy s VAL 166 Ca -0.02 -0.24 -0.00 0.00 0.00 0.00 0.00 61.98 61.71 3mmy s VAL 166 Cb -0.01 -0.89 -0.03 0.00 0.00 0.00 0.00 36.38 35.46 3mmy s VAL 166 CO 0.02 0.18 -0.04 -0.76 0.00 0.00 0.00 175.10 174.50 3mmy s LEU 167 N 1.82 3.30 0.02 3.92 1.43 0.48 -4.97 118.68 124.69 3mmy s LEU 167 Ca 0.03 0.02 -0.24 0.00 -1.03 0.00 0.00 54.13 52.91 3mmy s LEU 167 Cb -0.14 -1.74 -0.05 0.00 0.03 0.00 0.00 46.19 44.29 3mmy s LEU 167 CO -0.07 0.35 0.72 -1.10 0.23 0.00 0.00 176.35 176.48 3mmy s GLN 168 N -0.71 4.45 0.08 1.70 -1.52 -1.26 -0.60 119.66 121.79 3mmy s GLN 168 Ca 0.11 0.97 -0.00 0.00 -1.95 0.00 0.00 55.36 54.49 3mmy s GLN 168 Cb -0.11 -3.37 -0.04 0.00 -0.22 0.00 0.00 33.01 29.27 3mmy s GLN 168 CO 0.02 0.28 0.24 -0.51 -0.25 0.00 0.00 175.29 175.07 3mmy s LEU 169 N -0.02 4.34 0.63 2.90 1.43 0.84 -4.91 118.68 123.90 3mmy s LEU 169 Ca 0.37 0.31 0.40 0.00 -1.03 0.00 0.00 54.13 54.18 3mmy s LEU 169 Cb -0.20 -3.00 2.10 0.00 0.03 0.00 0.00 46.19 45.12 3mmy s LEU 169 CO 0.21 0.14 2.26 1.55 0.23 0.00 0.00 176.35 180.75 3mmy h PRO 170 N 2.96 0.00 0.00 1.29 0.13 -1.97 -3.46 132.00 130.95 3mmy h PRO 170 Ca -0.45 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.71 3mmy h PRO 170 Cb 1.16 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 3mmy h PRO 170 CO 0.75 0.01 0.27 0.39 -0.23 0.00 0.00 178.00 179.19 3mmy n GLU 171 N -3.17 0.63 -1.83 0.86 -0.58 -1.26 -5.04 120.64 110.26 3mmy n GLU 171 Ca -0.02 -1.29 -0.42 0.00 -0.42 0.00 0.00 57.16 55.01 3mmy n GLU 171 Cb 0.13 1.66 -0.02 0.00 -0.57 0.00 0.00 31.44 32.64 3mmy n GLU 171 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3mmy s ARG 172 N -2.05 4.16 -0.08 3.49 0.52 -1.26 -4.47 118.95 119.26 3mmy s ARG 172 Ca 0.13 2.51 -0.30 0.00 -0.52 0.00 0.00 55.73 57.55 3mmy s ARG 172 Cb -0.03 -3.07 -0.05 0.00 0.52 0.00 0.00 34.95 32.32 3mmy s ARG 172 CO 0.06 -0.62 1.62 0.00 0.02 0.00 0.00 175.30 176.38 3mmy n TYR 174 N 7.19 0.00 -3.67 0.00 4.02 -0.12 -4.48 117.16 120.09 3mmy n TYR 174 Ca 0.17 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 58.00 3mmy n TYR 174 Cb 0.43 -0.88 -0.02 0.00 -0.02 0.00 0.00 39.34 38.85 3mmy n TYR 174 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3mmy s ALA 176 N -3.45 -1.69 0.05 0.00 0.00 -1.26 -0.96 121.76 114.45 3mmy s ALA 176 Ca 0.09 0.73 -0.10 0.00 0.00 0.00 0.00 51.96 52.67 3mmy s ALA 176 Cb -0.02 0.65 0.01 0.00 0.00 0.00 0.00 23.12 23.76 3mmy s ALA 176 CO -0.02 -0.71 0.22 0.34 0.00 0.00 0.00 175.76 175.60 3mmy s ASP 177 N -2.55 0.00 -0.05 0.00 2.15 -0.52 -4.81 116.67 110.90 3mmy s ASP 177 Ca 0.02 -0.37 -0.01 0.00 0.43 0.00 0.00 52.55 52.62 3mmy s ASP 177 Cb -0.01 0.32 0.03 0.00 -0.30 0.00 0.00 42.92 42.95 3mmy s ASP 177 CO -0.10 -0.60 0.01 -0.69 -0.17 0.00 0.00 175.17 173.61 3mmy s VAL 178 N -2.78 0.27 -0.25 1.11 1.01 -1.26 -1.14 120.40 117.36 3mmy s VAL 178 Ca -0.03 0.13 -0.01 0.00 0.00 0.00 0.00 61.98 62.07 3mmy s VAL 178 Cb -0.00 -0.41 0.07 0.00 0.00 0.00 0.00 36.38 36.04 3mmy s VAL 178 CO -0.05 0.22 0.03 -0.63 0.00 0.00 0.00 175.10 174.66 3mmy s ILE 179 N 1.65 1.00 0.19 2.22 1.01 -0.31 -5.01 121.20 121.95 3mmy s ILE 179 Ca -0.00 -1.08 -0.31 0.00 0.00 0.00 0.00 60.65 59.26 3mmy s ILE 179 Cb -0.13 -1.51 -0.16 0.00 0.01 0.00 0.00 42.46 40.67 3mmy s ILE 179 CO -0.03 -0.33 0.97 0.00 0.00 0.00 0.00 174.94 175.55 3mmy n TYR 180 N 4.85 0.83 -0.04 3.97 9.36 -1.26 -0.42 117.16 134.45 3mmy n TYR 180 Ca -0.07 0.78 -0.05 0.00 3.32 0.00 0.00 57.90 61.89 3mmy n TYR 180 Cb 0.44 -2.18 0.14 0.00 -0.63 0.00 0.00 39.34 37.11 3mmy n TYR 180 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 3mmy n PRO 181 N 1.30 2.26 -4.98 2.98 -0.04 -1.26 -4.76 135.00 130.50 3mmy n PRO 181 Ca 0.15 -1.54 -0.32 0.00 -0.04 0.00 0.00 63.50 61.75 3mmy n PRO 181 Cb 0.25 -1.73 -0.14 0.00 -0.04 0.00 0.00 33.50 31.84 3mmy n PRO 181 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 3mmy s MET 182 N -1.76 2.26 0.06 0.54 0.00 0.44 -0.80 119.30 120.05 3mmy s MET 182 Ca 0.28 -0.85 0.05 0.00 0.00 0.00 0.00 55.69 55.18 3mmy s MET 182 Cb 0.22 -2.22 -0.03 0.00 0.00 0.00 0.00 34.83 32.81 3mmy s MET 182 CO 0.07 0.58 -0.15 0.00 0.00 0.00 0.00 175.02 175.52 3mmy s ALA 183 N -0.74 1.24 -0.04 4.11 0.00 -0.64 -1.17 121.76 124.53 3mmy s ALA 183 Ca 0.12 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 51.14 3mmy s ALA 183 Cb -0.10 -0.15 0.01 0.00 0.00 0.00 0.00 23.12 22.88 3mmy s ALA 183 CO 0.01 0.21 -0.10 0.08 0.00 0.00 0.00 175.76 175.96 3mmy s VAL 184 N -1.09 0.93 -0.04 0.00 1.01 -0.29 -0.25 120.40 120.67 3mmy s VAL 184 Ca 0.00 -0.41 0.03 0.00 0.00 0.00 0.00 61.98 61.60 3mmy s VAL 184 Cb -0.09 -0.84 0.00 0.00 0.00 0.00 0.00 36.38 35.45 3mmy s VAL 184 CO 0.02 0.29 -0.12 -0.69 0.00 0.00 0.00 175.10 174.60 3mmy s VAL 185 N 0.39 1.08 -0.00 2.92 1.01 0.17 -1.43 120.40 124.54 3mmy s VAL 185 Ca -0.07 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.44 3mmy s VAL 185 Cb -0.12 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.27 3mmy s VAL 185 CO 0.02 0.33 -0.12 0.00 0.00 0.00 0.00 175.10 175.32 3mmy s ALA 186 N 0.27 2.78 0.37 5.51 0.00 -0.13 -1.02 121.76 129.53 3mmy s ALA 186 Ca -0.06 -1.06 0.04 0.00 0.00 0.00 0.00 51.96 50.88 3mmy s ALA 186 Cb -0.11 -0.96 -0.03 0.00 0.00 0.00 0.00 23.12 22.01 3mmy s ALA 186 CO 0.02 0.58 0.12 0.95 0.00 0.00 0.00 175.76 177.43 3mmy s THR 187 N -0.89 0.65 0.93 0.00 -4.23 -0.22 -0.95 115.64 110.93 3mmy s THR 187 Ca 0.15 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.55 3mmy s THR 187 Cb -0.11 -2.47 0.12 0.00 1.34 0.00 0.00 72.50 71.38 3mmy s THR 187 CO 0.05 0.00 0.97 0.00 -0.54 0.00 0.00 174.62 175.10 3mmy n ALA 188 N -0.79 -1.24 -2.49 3.99 0.00 -0.02 -3.00 120.51 116.95 3mmy n ALA 188 Ca -0.04 -0.57 -0.21 0.00 0.00 0.00 0.00 53.44 52.62 3mmy n ALA 188 Cb 0.65 -2.10 -0.00 0.00 0.00 0.00 0.00 19.45 18.00 3mmy n ALA 188 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3mmy n GLU 189 N -3.64 -2.13 -2.79 0.00 1.02 -1.26 -2.95 120.64 108.89 3mmy n GLU 189 Ca 0.11 1.00 -0.22 0.00 -0.02 0.00 0.00 57.16 58.02 3mmy n GLU 189 Cb 0.52 -5.69 0.02 0.00 -0.02 0.00 0.00 31.44 26.27 3mmy n GLU 189 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3mmy n ARG 190 N -3.16 -3.69 -2.48 3.49 1.74 -1.21 -4.98 116.66 106.38 3mmy n ARG 190 Ca -0.23 0.95 -0.38 0.00 -0.77 0.00 0.00 57.85 57.42 3mmy n ARG 190 Cb 0.68 -5.74 -0.04 0.00 -1.02 0.00 0.00 32.46 26.34 3mmy n ARG 190 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3mmy s GLY 191 N -2.46 2.84 -0.22 -0.13 0.00 -1.15 -4.41 107.32 101.79 3mmy s GLY 191 Ca 0.19 0.80 -0.05 0.00 0.00 0.00 0.00 44.72 45.66 3mmy s GLY 191 CO 0.23 1.28 0.40 -2.27 0.00 0.00 0.00 173.10 172.75 3mmy s LEU 192 N -2.35 -0.66 -0.04 0.66 2.96 -1.26 -1.05 118.68 116.95 3mmy s LEU 192 Ca 0.55 0.64 0.02 0.00 -0.22 0.00 0.00 54.13 55.12 3mmy s LEU 192 Cb -0.26 1.27 0.01 0.00 0.50 0.00 0.00 46.19 47.71 3mmy s LEU 192 CO 0.33 -0.26 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.40 3mmy s ILE 193 N 2.59 0.64 -0.14 6.68 1.09 -0.19 -1.23 121.20 130.64 3mmy s ILE 193 Ca 0.06 -0.22 -0.07 0.00 -1.10 0.00 0.00 60.65 59.32 3mmy s ILE 193 Cb -0.14 -0.62 -0.04 0.00 -1.06 0.00 0.00 42.46 40.60 3mmy s ILE 193 CO -0.14 0.23 0.10 -0.69 -0.10 0.00 0.00 174.94 174.34 3mmy s VAL 194 N 0.61 5.17 0.04 2.92 1.01 0.14 -0.66 120.40 129.63 3mmy s VAL 194 Ca -0.09 0.09 0.07 0.00 0.00 0.00 0.00 61.98 62.05 3mmy s VAL 194 Cb -0.12 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.96 3mmy s VAL 194 CO 0.01 0.56 -0.18 -0.31 0.00 0.00 0.00 175.10 175.17 3mmy s TYR 195 N -0.54 2.55 0.12 5.22 1.51 0.65 -0.03 117.35 126.83 3mmy s TYR 195 Ca 0.12 -0.26 0.01 0.00 -1.01 0.00 0.00 57.07 55.92 3mmy s TYR 195 Cb -0.12 -1.47 -0.04 0.00 -0.11 0.00 0.00 41.96 40.23 3mmy s TYR 195 CO 0.02 0.24 0.27 1.14 -1.11 0.00 0.00 175.55 176.11 3mmy s GLN 196 N -1.38 3.45 0.00 -0.62 1.03 0.01 -1.62 119.66 120.54 3mmy s GLN 196 Ca 0.14 -0.50 0.00 0.00 0.04 0.00 0.00 55.36 55.04 3mmy s GLN 196 Cb -0.10 -2.98 0.00 0.00 0.03 0.00 0.00 33.01 29.96 3mmy s GLN 196 CO 0.05 0.54 0.33 1.28 -2.54 0.00 0.00 175.29 174.95 3mmy n LEU 197 N -0.23 0.66 -4.75 2.60 4.77 0.02 -1.30 117.00 118.77 3mmy n LEU 197 Ca -0.06 -0.71 -0.41 0.00 -0.03 0.00 0.00 56.01 54.80 3mmy n LEU 197 Cb 0.53 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.60 3mmy n LEU 197 CO 0.50 0.17 1.09 -1.61 -1.33 0.00 0.00 177.39 176.21 3mmy s GLU 198 N -0.10 4.27 0.00 3.23 2.02 -1.26 -3.85 118.70 123.01 3mmy s GLU 198 Ca 0.00 2.32 0.00 0.00 0.02 0.00 0.00 54.97 57.31 3mmy s GLU 198 Cb 0.00 -3.09 0.00 0.00 0.10 0.00 0.00 34.13 31.14 3mmy s GLU 198 CO 0.00 -0.40 0.00 0.09 0.02 0.00 0.00 175.26 174.97 3mmy n ASN 199 N 1.98 0.00 -3.62 -0.19 4.13 -1.26 -4.60 115.26 111.70 3mmy n ASN 199 Ca 0.05 0.00 -0.16 0.00 1.68 0.00 0.00 54.58 56.16 3mmy n ASN 199 Cb 0.40 0.00 -0.07 0.00 -1.54 0.00 0.00 39.78 38.57 3mmy n ASN 199 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3mmy s GLN 200 N 0.00 0.91 0.22 3.52 -2.07 -1.25 -4.94 119.66 116.05 3mmy s GLN 200 Ca 0.00 0.02 -0.32 0.00 -1.82 0.00 0.00 55.36 53.24 3mmy s GLN 200 Cb 0.00 0.42 -0.13 0.00 -1.09 0.00 0.00 33.01 32.21 3mmy s GLN 200 CO 0.00 -0.28 1.51 -2.30 -1.32 0.00 0.00 175.29 172.90 3mmy n PRO 201 N 0.97 2.20 -3.76 9.60 -0.02 -1.26 -4.52 135.00 138.21 3mmy n PRO 201 Ca -0.20 0.79 -0.12 0.00 -2.02 0.00 0.00 63.50 61.95 3mmy n PRO 201 Cb 0.57 -2.51 -0.08 0.00 -0.02 0.00 0.00 33.50 31.46 3mmy n PRO 201 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3mmy s SER 202 N 0.59 -0.13 0.26 2.55 1.04 -0.42 -5.00 113.70 112.59 3mmy s SER 202 Ca 0.72 -0.14 -0.30 0.00 0.48 0.00 0.00 55.95 56.71 3mmy s SER 202 Cb -0.63 0.34 -0.10 0.00 0.10 0.00 0.00 66.02 65.73 3mmy s SER 202 CO 0.44 -0.57 1.41 -0.70 0.98 0.00 0.00 173.24 174.80 3mmy s GLU 203 N -2.27 4.28 -0.14 4.02 2.12 -1.26 -0.81 118.70 124.64 3mmy s GLU 203 Ca -0.07 2.28 -0.03 0.00 0.36 0.00 0.00 54.97 57.51 3mmy s GLU 203 Cb -0.02 -3.11 -0.08 0.00 0.26 0.00 0.00 34.13 31.19 3mmy s GLU 203 CO -0.02 -0.38 -0.15 0.34 -0.54 0.00 0.00 175.26 174.51 3mmy n PHE 204 N 2.12 0.00 -3.66 5.30 7.35 0.96 -4.75 117.46 124.77 3mmy n PHE 204 Ca 0.06 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 56.64 3mmy n PHE 204 Cb 0.41 -0.52 -0.08 0.00 0.35 0.00 0.00 39.48 39.64 3mmy n PHE 204 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 3mmy s ARG 205 N -2.27 0.64 -0.19 -4.13 3.52 -0.78 -5.00 118.95 110.74 3mmy s ARG 205 Ca -0.19 0.98 -0.15 0.00 -0.13 0.00 0.00 55.73 56.24 3mmy s ARG 205 Cb 0.06 0.19 -0.04 0.00 -1.56 0.00 0.00 34.95 33.60 3mmy s ARG 205 CO 0.28 -0.13 0.36 1.03 -0.81 0.00 0.00 175.30 176.04 3mmy s ARG 206 N 1.05 4.19 -0.12 5.12 0.52 -1.26 -0.69 118.95 127.76 3mmy s ARG 206 Ca -0.06 0.15 0.00 0.00 -0.52 0.00 0.00 55.73 55.30 3mmy s ARG 206 Cb -0.05 -3.51 -0.02 0.00 0.52 0.00 0.00 34.95 31.89 3mmy s ARG 206 CO -0.10 0.03 -0.13 0.42 0.02 0.00 0.00 175.30 175.54 3mmy s ILE 207 N 1.11 3.10 0.00 1.52 1.01 -0.37 -5.03 121.20 122.54 3mmy s ILE 207 Ca 0.18 -0.65 -0.30 0.00 0.00 0.00 0.00 60.65 59.87 3mmy s ILE 207 Cb -0.14 -2.29 -0.07 0.00 0.01 0.00 0.00 42.46 39.97 3mmy s ILE 207 CO 0.07 0.53 1.60 -0.70 0.00 0.00 0.00 174.94 176.44 3mmy s GLU 208 N 0.20 4.21 0.22 2.79 2.56 -1.26 -4.24 118.70 123.18 3mmy s GLU 208 Ca -0.08 2.20 -0.32 0.00 0.00 0.00 0.00 54.97 56.77 3mmy s GLU 208 Cb -0.15 -3.75 -0.12 0.00 2.00 0.00 0.00 34.13 32.11 3mmy s GLU 208 CO 0.05 -0.75 1.69 0.45 -0.56 0.00 0.00 175.26 176.15 3mmy n SER 209 N 6.17 3.94 0.00 -1.70 2.88 -1.26 -4.87 113.62 118.78 3mmy n SER 209 Ca 0.16 1.08 0.08 0.00 -1.33 0.00 0.00 58.87 58.86 3mmy n SER 209 Cb 0.42 -1.57 0.38 0.00 -0.75 0.00 0.00 64.21 62.69 3mmy n SER 209 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3mmy n PRO 210 N 3.56 0.16 -4.71 -1.46 -0.04 -1.26 -4.75 135.00 126.51 3mmy n PRO 210 Ca 0.14 0.16 -0.30 0.00 -0.04 0.00 0.00 63.50 63.46 3mmy n PRO 210 Cb 0.35 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.18 3mmy n PRO 210 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3mmy s LEU 211 N -2.69 2.47 0.00 1.53 1.43 -1.26 -4.99 118.68 115.17 3mmy s LEU 211 Ca 0.13 -0.49 0.26 0.00 -1.03 0.00 0.00 54.13 52.99 3mmy s LEU 211 Cb 0.11 -1.44 0.62 0.00 0.03 0.00 0.00 46.19 45.51 3mmy s LEU 211 CO 0.25 0.25 1.48 1.17 0.23 0.00 0.00 176.35 179.74 3mmy n LYS 212 N 1.56 0.60 -4.50 1.70 4.81 -1.26 -4.94 118.16 116.13 3mmy n LYS 212 Ca -0.16 -0.37 -0.24 0.00 -0.87 0.00 0.00 58.31 56.67 3mmy n LYS 212 Cb 0.52 -1.49 -0.11 0.00 0.02 0.00 0.00 35.03 33.97 3mmy n LYS 212 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 3mmy s HIS 213 N -2.65 2.15 0.11 5.64 3.76 -1.26 -5.09 115.29 117.94 3mmy s HIS 213 Ca 0.20 -0.77 -0.36 0.00 -0.15 0.00 0.00 55.06 53.98 3mmy s HIS 213 Cb 0.19 -1.38 -0.16 0.00 1.11 0.00 0.00 32.58 32.34 3mmy s HIS 213 CO 0.58 0.25 1.31 0.94 -0.85 0.00 0.00 174.74 176.98 3mmy n GLN 214 N -0.74 1.19 -2.65 1.40 7.27 -1.26 -4.72 117.38 117.87 3mmy n GLN 214 Ca -0.04 0.43 -0.38 0.00 0.07 0.00 0.00 57.00 57.08 3mmy n GLN 214 Cb 0.66 -2.05 -0.05 0.00 2.41 0.00 0.00 30.24 31.21 3mmy n GLN 214 CO 0.00 0.00 0.00 -1.01 0.07 0.00 0.00 177.06 176.12 3mmy s HIS 215 N 0.35 3.61 0.00 3.69 3.76 -1.26 -1.77 115.29 123.67 3mmy s HIS 215 Ca 0.82 1.76 0.00 0.00 -0.15 0.00 0.00 55.06 57.48 3mmy s HIS 215 Cb -0.92 -3.06 0.00 0.00 1.11 0.00 0.00 32.58 29.71 3mmy s HIS 215 CO 0.48 -0.12 0.00 -2.13 -0.85 0.00 0.00 174.74 172.11 3mmy n ARG 216 N 0.71 0.00 -3.81 1.40 0.63 0.15 -4.88 116.66 110.87 3mmy n ARG 216 Ca 0.01 0.00 -0.11 0.00 -0.92 0.00 0.00 57.85 56.83 3mmy n ARG 216 Cb 0.48 -0.65 -0.08 0.00 0.45 0.00 0.00 32.46 32.66 3mmy n ARG 216 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3mmy s VAL 218 N -2.55 0.02 -0.06 0.00 0.11 -1.26 -0.44 120.40 116.21 3mmy s VAL 218 Ca -0.05 -0.13 -0.04 0.00 -2.93 0.00 0.00 61.98 58.83 3mmy s VAL 218 Cb -0.01 -0.59 0.03 0.00 -1.53 0.00 0.00 36.38 34.28 3mmy s VAL 218 CO -0.04 -0.07 0.15 0.00 -3.33 0.00 0.00 175.10 171.82 3mmy s ALA 219 N -0.26 -0.33 0.25 1.54 0.00 -0.52 -4.58 121.76 117.87 3mmy s ALA 219 Ca -0.04 0.58 -0.25 0.00 0.00 0.00 0.00 51.96 52.25 3mmy s ALA 219 Cb -0.03 -0.37 -0.09 0.00 0.00 0.00 0.00 23.12 22.63 3mmy s ALA 219 CO 0.02 -0.12 0.85 0.42 0.00 0.00 0.00 175.76 176.93 3mmy s ILE 220 N 0.69 4.32 0.23 0.00 1.01 -1.26 -0.43 121.20 125.76 3mmy s ILE 220 Ca -0.05 1.69 0.09 0.00 0.00 0.00 0.00 60.65 62.39 3mmy s ILE 220 Cb -0.07 -4.04 -0.05 0.00 0.01 0.00 0.00 42.46 38.31 3mmy s ILE 220 CO -0.03 0.29 -0.17 0.72 0.00 0.00 0.00 174.94 175.75 3mmy s PHE 221 N -1.43 1.92 0.25 3.97 -0.12 -0.63 -4.85 117.98 117.09 3mmy s PHE 221 Ca 0.44 -0.48 0.10 0.00 -0.05 0.00 0.00 56.93 56.93 3mmy s PHE 221 Cb -0.20 -0.87 -0.04 0.00 -0.63 0.00 0.00 43.02 41.28 3mmy s PHE 221 CO 0.25 0.48 -0.05 0.15 -0.05 0.00 0.00 175.22 176.00 3mmy s LYS 222 N -3.55 2.16 0.56 1.99 1.02 -1.26 -1.04 119.74 119.61 3mmy s LYS 222 Ca 0.25 -1.44 -0.05 0.00 0.02 0.00 0.00 55.97 54.74 3mmy s LYS 222 Cb -0.02 -2.10 0.12 0.00 -0.52 0.00 0.00 37.83 35.30 3mmy s LYS 222 CO 0.10 0.37 0.76 -0.40 -0.92 0.00 0.00 175.35 175.26 3mmy n ASP 223 N -0.67 0.48 0.05 2.83 5.68 0.54 -4.83 116.55 120.63 3mmy n ASP 223 Ca -0.07 -1.53 0.15 0.00 -0.50 0.00 0.00 54.79 52.84 3mmy n ASP 223 Cb 0.58 -0.54 0.64 0.00 -1.14 0.00 0.00 41.12 40.66 3mmy n ASP 223 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 3mmy h LYS 224 N 0.00 0.08 -0.26 0.11 3.64 -2.01 -0.81 116.57 117.32 3mmy h LYS 224 Ca -0.25 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.13 3mmy h LYS 224 Cb 0.79 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 3mmy h LYS 224 CO 0.22 0.05 0.00 1.04 -2.27 0.00 0.00 179.45 178.49 3mmy n GLN 225 N -4.44 1.71 -1.30 1.90 3.00 -1.26 -4.92 117.38 112.08 3mmy n GLN 225 Ca 0.06 -1.10 -0.09 0.00 -0.01 0.00 0.00 57.00 55.87 3mmy n GLN 225 Cb 0.42 -1.30 -0.03 0.00 0.00 0.00 0.00 30.24 29.33 3mmy n GLN 225 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 3mmy n ASN 226 N 0.36 -3.97 -4.85 1.08 5.15 -0.31 -5.03 115.26 107.70 3mmy n ASN 226 Ca 0.13 0.20 -0.37 0.00 -0.60 0.00 0.00 54.58 53.94 3mmy n ASN 226 Cb 0.28 -2.28 -0.07 0.00 -0.53 0.00 0.00 39.78 37.19 3mmy n ASN 226 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3mmy s LYS 227 N -2.82 3.49 0.21 1.20 1.02 -1.26 -4.82 119.74 116.77 3mmy s LYS 227 Ca 0.00 -0.16 -0.32 0.00 0.02 0.00 0.00 55.97 55.51 3mmy s LYS 227 Cb 0.00 -3.18 -0.13 0.00 -0.52 0.00 0.00 37.83 33.99 3mmy s LYS 227 CO 0.00 0.72 1.49 -0.35 -0.92 0.00 0.00 175.35 176.28 3mmy n PRO 228 N 2.17 2.13 0.00 -1.68 -0.04 -1.26 -0.34 135.00 135.99 3mmy n PRO 228 Ca -0.19 0.76 0.00 0.00 -0.04 0.00 0.00 63.50 64.03 3mmy n PRO 228 Cb 0.55 -2.47 0.00 0.00 -0.04 0.00 0.00 33.50 31.53 3mmy n PRO 228 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 3mmy n THR 229 N 2.51 0.00 -4.00 0.52 5.66 -0.21 -4.82 114.28 113.94 3mmy n THR 229 Ca 0.13 0.00 0.02 0.00 -3.05 0.00 0.00 64.05 61.16 3mmy n THR 229 Cb 0.31 0.96 0.01 0.00 -1.55 0.00 0.00 70.33 70.05 3mmy n THR 229 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3mmy n GLY 230 N 0.00 0.26 3.30 1.09 0.00 -1.16 -1.04 105.19 107.64 3mmy n GLY 230 Ca 0.00 -0.93 -0.10 0.00 0.00 0.00 0.00 46.02 44.99 3mmy n GLY 230 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3mmy s PHE 231 N -2.14 -0.15 0.01 1.61 -0.12 -0.01 -1.60 117.98 115.59 3mmy s PHE 231 Ca 0.18 -0.16 0.00 0.00 -0.05 0.00 0.00 56.93 56.90 3mmy s PHE 231 Cb -0.00 0.21 -0.04 0.00 -0.63 0.00 0.00 43.02 42.56 3mmy s PHE 231 CO -0.01 -0.67 0.07 0.00 -0.05 0.00 0.00 175.22 174.56 3mmy s ALA 232 N -3.71 3.54 -0.03 1.99 0.00 0.43 -1.11 121.76 122.87 3mmy s ALA 232 Ca 0.03 -0.90 -0.00 0.00 0.00 0.00 0.00 51.96 51.08 3mmy s ALA 232 Cb 0.02 -1.53 0.03 0.00 0.00 0.00 0.00 23.12 21.64 3mmy s ALA 232 CO -0.11 0.69 0.04 -1.17 0.00 0.00 0.00 175.76 175.21 3mmy s LEU 233 N -1.81 0.91 0.05 0.00 2.96 -0.24 -1.44 118.68 119.12 3mmy s LEU 233 Ca 0.23 0.06 0.05 0.00 -0.22 0.00 0.00 54.13 54.25 3mmy s LEU 233 Cb -0.12 -0.06 -0.04 0.00 0.50 0.00 0.00 46.19 46.47 3mmy s LEU 233 CO 0.15 -0.15 -0.06 -0.83 -1.32 0.00 0.00 176.35 174.14 3mmy s GLY 234 N 1.25 1.81 0.46 7.98 0.00 0.42 -0.66 107.32 118.58 3mmy s GLY 234 Ca -0.07 -1.10 0.02 0.00 0.00 0.00 0.00 44.72 43.57 3mmy s GLY 234 CO -0.03 -1.02 0.16 -1.14 0.00 0.00 0.00 173.10 171.07 3mmy n SER 235 N 1.10 2.93 0.00 1.64 3.41 -0.98 -0.67 113.62 121.05 3mmy n SER 235 Ca -0.14 -2.83 0.11 0.00 -0.26 0.00 0.00 58.87 55.75 3mmy n SER 235 Cb 0.52 0.16 0.52 0.00 -0.26 0.00 0.00 64.21 65.15 3mmy n SER 235 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3mmy n ILE 236 N -1.35 0.38 -1.55 -1.33 -5.35 -0.73 -1.74 119.36 107.69 3mmy n ILE 236 Ca -0.11 0.09 -0.31 0.00 -0.27 0.00 0.00 62.75 62.16 3mmy n ILE 236 Cb 0.56 -0.73 0.07 0.00 -1.74 0.00 0.00 39.64 37.79 3mmy n ILE 236 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 3mmy n GLU 237 N -1.34 2.95 -3.95 6.28 0.00 -1.26 -3.10 120.64 120.22 3mmy n GLU 237 Ca 0.09 -3.56 -0.26 0.00 0.00 0.00 0.00 57.16 53.43 3mmy n GLU 237 Cb 0.19 -2.27 -0.02 0.00 0.00 0.00 0.00 31.44 29.35 3mmy n GLU 237 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3mmy n GLY 238 N -0.86 -0.25 3.31 8.31 0.00 -0.02 -4.87 105.19 110.80 3mmy n GLY 238 Ca 0.56 0.15 -0.13 0.00 0.00 0.00 0.00 46.02 46.59 3mmy n GLY 238 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3mmy s ARG 239 N -6.53 0.55 -0.01 1.61 3.52 -1.26 -1.53 118.95 115.30 3mmy s ARG 239 Ca 0.08 0.43 0.06 0.00 -0.13 0.00 0.00 55.73 56.16 3mmy s ARG 239 Cb -0.04 0.26 -0.02 0.00 -1.56 0.00 0.00 34.95 33.60 3mmy s ARG 239 CO 0.88 -0.10 -0.19 0.08 -0.81 0.00 0.00 175.30 175.17 3mmy s VAL 240 N -0.14 1.52 -0.14 7.11 1.01 -0.29 -2.31 120.40 127.16 3mmy s VAL 240 Ca -0.03 -0.84 -0.03 0.00 0.00 0.00 0.00 61.98 61.08 3mmy s VAL 240 Cb -0.03 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 35.06 3mmy s VAL 240 CO 0.02 0.41 -0.03 0.00 0.00 0.00 0.00 175.10 175.50 3mmy s ALA 241 N -0.47 3.04 -0.23 5.51 0.00 0.16 -1.03 121.76 128.74 3mmy s ALA 241 Ca 0.07 -0.82 -0.12 0.00 0.00 0.00 0.00 51.96 51.09 3mmy s ALA 241 Cb -0.07 -1.53 -0.05 0.00 0.00 0.00 0.00 23.12 21.47 3mmy s ALA 241 CO -0.01 0.28 0.24 0.42 0.00 0.00 0.00 175.76 176.69 3mmy s ILE 242 N 0.16 5.30 -0.14 0.00 -1.09 0.45 -1.07 121.20 124.81 3mmy s ILE 242 Ca -0.01 0.35 -0.02 0.00 -2.23 0.00 0.00 60.65 58.73 3mmy s ILE 242 Cb -0.14 -3.58 0.05 0.00 -1.58 0.00 0.00 42.46 37.21 3mmy s ILE 242 CO 0.03 0.30 0.02 -2.28 -1.23 0.00 0.00 174.94 171.78 3mmy s HIS 243 N 1.23 0.81 0.21 3.97 2.46 -0.27 -1.98 115.29 121.72 3mmy s HIS 243 Ca 0.11 -0.51 -0.16 0.00 0.47 0.00 0.00 55.06 54.97 3mmy s HIS 243 Cb -0.14 -0.90 -0.08 0.00 -0.13 0.00 0.00 32.58 31.33 3mmy s HIS 243 CO 0.06 -0.48 0.65 0.71 -2.47 0.00 0.00 174.74 173.21 3mmy s TYR 244 N 1.93 3.57 0.02 3.88 1.51 -1.26 -0.83 117.35 126.17 3mmy s TYR 244 Ca 0.02 1.20 -0.20 0.00 -1.01 0.00 0.00 57.07 57.08 3mmy s TYR 244 Cb -0.15 -2.49 -0.18 0.00 -0.11 0.00 0.00 41.96 39.03 3mmy s TYR 244 CO -0.07 0.32 1.23 0.82 -1.11 0.00 0.00 175.55 176.74 3mmy h ILE 245 N 2.57 1.40 -2.04 2.71 1.08 -1.46 -3.40 117.51 118.38 3mmy h ILE 245 Ca -0.48 -1.67 -0.54 0.00 -0.39 0.00 0.00 64.86 61.78 3mmy h ILE 245 Cb 1.19 2.21 -0.40 0.00 -3.07 0.00 0.00 36.82 36.75 3mmy h ILE 245 CO 0.66 0.49 -1.06 0.59 -0.69 0.00 0.00 178.15 178.14 3mmy n ASN 246 N -4.40 1.10 -4.87 1.72 3.02 -1.26 -5.11 115.26 105.46 3mmy n ASN 246 Ca -0.08 -2.96 -0.31 0.00 -0.03 0.00 0.00 54.58 51.20 3mmy n ASN 246 Cb 0.50 -0.63 -0.01 0.00 -0.61 0.00 0.00 39.78 39.03 3mmy n ASN 246 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3mmy s PRO 247 N -1.96 3.73 0.53 3.52 0.04 -1.26 -4.95 135.00 134.64 3mmy s PRO 247 Ca 0.38 0.72 0.31 0.00 0.04 0.00 0.00 61.00 62.46 3mmy s PRO 247 Cb 0.24 -2.17 1.31 0.00 0.04 0.00 0.00 34.50 33.93 3mmy s PRO 247 CO -0.09 -0.37 1.97 -1.35 0.04 0.00 0.00 177.00 177.20 3mmy h PRO 248 N 0.32 0.00 -1.91 0.56 0.11 -2.00 -3.37 132.00 125.70 3mmy h PRO 248 Ca -0.46 0.00 -0.46 0.00 0.11 0.00 0.00 66.00 65.20 3mmy h PRO 248 Cb 1.19 0.00 -0.31 0.00 0.11 0.00 0.00 31.00 31.99 3mmy h PRO 248 CO 0.62 0.07 -0.84 -1.71 -0.21 0.00 0.00 178.00 175.94 3mmy n ASN 249 N -3.23 -1.36 -0.30 -2.05 2.85 -1.26 -5.03 115.26 104.88 3mmy n ASN 249 Ca 0.00 -2.56 0.03 0.00 -0.11 0.00 0.00 54.58 51.95 3mmy n ASN 249 Cb 0.32 0.15 0.18 0.00 1.24 0.00 0.00 39.78 41.66 3mmy n ASN 249 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3mmy h PRO 250 N 5.35 0.78 0.00 1.20 0.11 -1.97 0.26 132.00 137.73 3mmy h PRO 250 Ca 0.19 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.23 3mmy h PRO 250 Cb 0.97 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 31.90 3mmy h PRO 250 CO 0.27 0.52 -0.11 0.00 -0.21 0.00 0.00 178.00 178.47 3mmy h ALA 251 N 1.47 1.58 0.00 -0.75 0.00 -1.96 -1.01 119.26 118.59 3mmy h ALA 251 Ca 0.41 -0.10 -0.26 0.00 0.00 0.00 0.00 54.91 54.96 3mmy h ALA 251 Cb 0.39 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 3mmy h ALA 251 CO -0.25 0.13 -2.05 0.36 0.00 0.00 0.00 179.25 177.44 3mmy n LYS 252 N -4.06 1.34 0.08 0.00 2.85 -0.73 -4.63 118.16 113.00 3mmy n LYS 252 Ca -0.02 -0.02 -0.11 0.00 -1.05 0.00 0.00 58.31 57.10 3mmy n LYS 252 Cb 0.19 -1.40 -0.05 0.00 -0.65 0.00 0.00 35.03 33.11 3mmy n LYS 252 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 3mmy h ASP 253 N 0.00 0.36 -3.34 -5.58 3.32 -0.37 -3.42 116.42 107.38 3mmy h ASP 253 Ca -0.39 -0.31 -0.56 0.00 0.02 0.00 0.00 57.03 55.79 3mmy h ASP 253 Cb 1.86 -0.11 -0.06 0.00 0.22 0.00 0.00 39.33 41.24 3mmy h ASP 253 CO 0.02 1.14 0.02 0.20 -1.72 0.00 0.00 179.24 178.90 3mmy s ASN 254 N -7.01 6.96 0.23 6.45 0.01 -0.40 -4.80 114.94 116.39 3mmy s ASN 254 Ca -0.04 1.15 -0.14 0.00 -0.71 0.00 0.00 52.86 53.12 3mmy s ASN 254 Cb 0.09 -2.38 0.00 0.00 0.41 0.00 0.00 41.25 39.38 3mmy s ASN 254 CO 0.85 0.01 0.50 0.72 -1.51 0.00 0.00 177.10 177.67 3mmy s PHE 255 N 0.23 0.20 0.24 2.20 -0.12 -0.84 -4.80 117.98 115.09 3mmy s PHE 255 Ca 0.33 -0.57 0.10 0.00 -0.05 0.00 0.00 56.93 56.75 3mmy s PHE 255 Cb -0.18 0.27 -0.05 0.00 -0.63 0.00 0.00 43.02 42.43 3mmy s PHE 255 CO 0.17 -0.98 -0.18 0.95 -0.05 0.00 0.00 175.22 175.13 3mmy s THR 256 N -3.97 2.19 0.00 -4.49 -4.23 -1.26 -0.42 115.64 103.46 3mmy s THR 256 Ca 0.18 -2.29 -0.04 0.00 -1.18 0.00 0.00 61.69 58.36 3mmy s THR 256 Cb -0.01 -2.17 -0.00 0.00 1.34 0.00 0.00 72.50 71.65 3mmy s THR 256 CO 0.05 -0.44 0.07 0.72 -0.54 0.00 0.00 174.62 174.49 3mmy s PHE 257 N -2.56 0.09 0.27 3.99 -0.71 -0.20 -4.99 117.98 113.87 3mmy s PHE 257 Ca 0.26 -0.19 -0.11 0.00 -1.04 0.00 0.00 56.93 55.85 3mmy s PHE 257 Cb -0.04 -0.08 -0.08 0.00 -1.21 0.00 0.00 43.02 41.62 3mmy s PHE 257 CO 0.11 -0.21 0.61 0.15 -1.34 0.00 0.00 175.22 174.55 3mmy s LYS 258 N -1.14 3.85 0.21 1.99 1.02 -1.26 -1.13 119.74 123.28 3mmy s LYS 258 Ca -0.12 0.38 -0.23 0.00 0.02 0.00 0.00 55.97 56.01 3mmy s LYS 258 Cb -0.07 -2.57 0.04 0.00 -0.52 0.00 0.00 37.83 34.71 3mmy s LYS 258 CO 0.00 0.25 0.86 0.00 -0.92 0.00 0.00 175.35 175.54 3mmy n HIS 260 N -0.47 -1.96 -4.27 0.00 8.25 -1.26 -4.27 115.22 111.24 3mmy n HIS 260 Ca -0.05 0.85 -0.17 0.00 -0.26 0.00 0.00 57.72 58.09 3mmy n HIS 260 Cb 0.60 -4.32 -0.10 0.00 1.12 0.00 0.00 29.99 27.28 3mmy n HIS 260 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3mmy s ARG 261 N -6.08 1.11 0.86 -0.41 0.52 -1.26 -1.50 118.95 112.18 3mmy s ARG 261 Ca 0.09 -1.40 -0.12 0.00 -0.52 0.00 0.00 55.73 53.78 3mmy s ARG 261 Cb -0.04 -0.87 0.11 0.00 0.52 0.00 0.00 34.95 34.66 3mmy s ARG 261 CO 0.82 0.15 1.11 -1.54 0.02 0.00 0.00 175.30 175.85 3mmy s SER 262 N -2.90 3.93 -0.03 0.23 1.04 -0.51 -4.95 113.70 110.50 3mmy s SER 262 Ca 0.15 1.21 -0.30 0.00 0.48 0.00 0.00 55.95 57.49 3mmy s SER 262 Cb -0.01 -1.88 -0.07 0.00 0.10 0.00 0.00 66.02 64.16 3mmy s SER 262 CO 0.03 -2.32 1.87 0.21 0.98 0.00 0.00 173.24 174.02 3mmy s ASN 263 N -3.86 6.42 0.00 7.02 3.84 -1.26 -4.69 114.94 122.41 3mmy s ASN 263 Ca 0.62 2.40 0.23 0.00 0.21 0.00 0.00 52.86 56.33 3mmy s ASN 263 Cb -0.15 -2.53 0.05 0.00 -0.55 0.00 0.00 41.25 38.07 3mmy s ASN 263 CO 0.54 -1.11 1.11 0.61 -2.79 0.00 0.00 177.10 175.47 3mmy n GLY 264 N 4.54 -0.40 0.17 1.21 0.00 -1.26 -4.42 105.19 105.03 3mmy n GLY 264 Ca 0.20 -0.59 -0.05 0.00 0.00 0.00 0.00 46.02 45.58 3mmy n GLY 264 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3mmy h THR 265 N 1.48 0.00 0.00 2.61 2.02 -1.98 -3.41 112.91 113.63 3mmy h THR 265 Ca 0.00 -0.51 -0.02 0.00 0.77 0.00 0.00 66.41 66.65 3mmy h THR 265 Cb 0.64 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.05 3mmy h THR 265 CO 0.00 0.00 -0.12 0.78 0.37 0.00 0.00 175.52 176.55 3mmy h ASN 266 N -0.87 0.00 -3.65 4.18 -0.26 -2.01 -3.49 115.58 109.49 3mmy h ASN 266 Ca -0.04 -0.58 -0.49 0.00 -0.56 0.00 0.00 56.30 54.64 3mmy h ASN 266 Cb 0.27 0.00 0.21 0.00 -1.06 0.00 0.00 38.32 37.74 3mmy h ASN 266 CO 0.06 0.86 -0.03 0.35 -1.06 0.00 0.00 177.43 177.61 3mmy n THR 267 N -4.65 0.00 -0.01 2.81 -2.24 -1.26 -5.00 114.28 103.92 3mmy n THR 267 Ca -0.08 -0.21 -0.21 0.00 -2.27 0.00 0.00 64.05 61.27 3mmy n THR 267 Cb 0.33 -0.94 -0.13 0.00 -2.10 0.00 0.00 70.33 67.48 3mmy n THR 267 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 3mmy h SER 268 N -2.20 0.31 -3.80 3.42 0.87 -1.94 -3.49 113.55 106.72 3mmy h SER 268 Ca -0.51 -0.82 -0.45 0.00 -1.23 0.00 0.00 61.79 58.78 3mmy h SER 268 Cb 1.30 -0.10 0.17 0.00 -0.44 0.00 0.00 62.40 63.33 3mmy h SER 268 CO 0.43 1.58 0.17 0.00 -0.53 0.00 0.00 176.83 178.49 3mmy s ALA 269 N -2.45 0.78 0.74 6.23 0.00 -1.26 -5.01 121.76 120.78 3mmy s ALA 269 Ca -0.21 -0.28 -0.16 0.00 0.00 0.00 0.00 51.96 51.31 3mmy s ALA 269 Cb 0.04 -3.15 0.01 0.00 0.00 0.00 0.00 23.12 20.03 3mmy s ALA 269 CO 0.74 -2.96 0.95 -2.30 0.00 0.00 0.00 175.76 172.19 3mmy n PRO 270 N -4.28 0.44 -2.78 0.00 -0.02 -1.26 -4.97 135.00 122.14 3mmy n PRO 270 Ca 0.05 0.21 -0.42 0.00 -2.02 0.00 0.00 63.50 61.32 3mmy n PRO 270 Cb 0.56 -2.21 -0.03 0.00 -0.02 0.00 0.00 33.50 31.80 3mmy n PRO 270 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 3mmy s GLN 271 N -3.39 4.43 0.06 -0.52 0.74 -1.26 -5.01 119.66 114.70 3mmy s GLN 271 Ca 0.72 1.26 -0.30 0.00 0.05 0.00 0.00 55.36 57.09 3mmy s GLN 271 Cb -0.34 -3.52 -0.05 0.00 1.10 0.00 0.00 33.01 30.21 3mmy s GLN 271 CO 0.51 -0.22 0.96 -0.51 -0.55 0.00 0.00 175.29 175.48 3mmy s ASP 272 N 1.06 7.43 -0.15 6.67 1.01 -1.26 -4.89 116.67 126.52 3mmy s ASP 272 Ca 0.46 1.71 -0.03 0.00 0.71 0.00 0.00 52.55 55.40 3mmy s ASP 272 Cb -0.18 -2.57 -0.02 0.00 1.01 0.00 0.00 42.92 41.15 3mmy s ASP 272 CO 0.19 -0.15 -0.05 -0.63 0.21 0.00 0.00 175.17 174.74 3mmy s ILE 273 N 0.44 3.74 0.24 0.77 1.01 -1.26 -1.43 121.20 124.71 3mmy s ILE 273 Ca 0.49 -0.41 0.11 0.00 0.00 0.00 0.00 60.65 60.84 3mmy s ILE 273 Cb -0.22 -2.63 -0.05 0.00 0.01 0.00 0.00 42.46 39.57 3mmy s ILE 273 CO 0.29 0.50 -0.21 -0.31 0.00 0.00 0.00 174.94 175.21 3mmy s TYR 274 N 0.39 2.23 0.42 3.97 1.51 -0.57 -4.87 117.35 120.44 3mmy s TYR 274 Ca -0.05 -0.36 -0.25 0.00 -1.01 0.00 0.00 57.07 55.40 3mmy s TYR 274 Cb -0.14 -1.02 -0.08 0.00 -0.11 0.00 0.00 41.96 40.61 3mmy s TYR 274 CO 0.03 0.61 1.21 0.00 -1.11 0.00 0.00 175.55 176.29 3mmy s ALA 275 N -2.27 3.11 -0.28 3.71 0.00 -1.18 -0.84 121.76 124.01 3mmy s ALA 275 Ca 0.26 1.04 -0.21 0.00 0.00 0.00 0.00 51.96 53.05 3mmy s ALA 275 Cb -0.06 -3.41 -0.01 0.00 0.00 0.00 0.00 23.12 19.64 3mmy s ALA 275 CO 0.12 -0.67 0.66 0.08 0.00 0.00 0.00 175.76 175.96 3mmy s VAL 276 N -1.41 4.93 -0.14 0.00 1.01 -0.71 -0.85 120.40 123.24 3mmy s VAL 276 Ca 0.59 1.07 0.17 0.00 0.00 0.00 0.00 61.98 63.81 3mmy s VAL 276 Cb -0.32 -4.00 -0.24 0.00 0.00 0.00 0.00 36.38 31.82 3mmy s VAL 276 CO 0.40 -0.08 0.31 0.59 0.00 0.00 0.00 175.10 176.33 3mmy n ASN 277 N 5.85 0.28 -3.71 3.32 3.02 0.12 -4.54 115.26 119.61 3mmy n ASN 277 Ca 0.00 0.13 -0.13 0.00 -0.03 0.00 0.00 54.58 54.56 3mmy n ASN 277 Cb 0.49 0.76 -0.07 0.00 -0.61 0.00 0.00 39.78 40.35 3mmy n ASN 277 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3mmy s GLY 278 N -5.26 -0.21 -0.11 7.41 0.00 -1.08 -4.77 107.32 103.31 3mmy s GLY 278 Ca -0.08 0.23 -0.08 0.00 0.00 0.00 0.00 44.72 44.80 3mmy s GLY 278 CO 0.83 -0.01 0.27 -1.50 0.00 0.00 0.00 173.10 172.69 3mmy s ILE 279 N -2.28 -0.02 -0.12 0.90 2.07 -1.26 -1.50 121.20 119.00 3mmy s ILE 279 Ca -0.07 0.07 -0.10 0.00 -1.41 0.00 0.00 60.65 59.13 3mmy s ILE 279 Cb -0.01 -0.39 0.03 0.00 0.13 0.00 0.00 42.46 42.21 3mmy s ILE 279 CO -0.01 0.03 0.31 0.00 -1.91 0.00 0.00 174.94 173.36 3mmy s ALA 280 N 0.67 -0.78 0.00 1.50 0.00 -0.25 -4.68 121.76 118.23 3mmy s ALA 280 Ca -0.04 0.92 -0.14 0.00 0.00 0.00 0.00 51.96 52.70 3mmy s ALA 280 Cb -0.06 -0.54 -0.06 0.00 0.00 0.00 0.00 23.12 22.47 3mmy s ALA 280 CO -0.04 -0.16 0.39 -0.06 0.00 0.00 0.00 175.76 175.89 3mmy s PHE 281 N 0.29 3.70 0.02 0.00 0.40 -1.26 -0.34 117.98 120.79 3mmy s PHE 281 Ca -0.01 0.94 -0.30 0.00 -0.60 0.00 0.00 56.93 56.96 3mmy s PHE 281 Cb -0.03 -2.25 -0.06 0.00 0.51 0.00 0.00 43.02 41.20 3mmy s PHE 281 CO -0.01 0.64 1.33 -1.58 0.70 0.00 0.00 175.22 176.30 3mmy s HIS 282 N -1.12 3.08 -0.47 0.36 5.65 0.51 -4.88 115.29 118.42 3mmy s HIS 282 Ca 0.24 1.00 0.23 0.00 0.25 0.00 0.00 55.06 56.78 3mmy s HIS 282 Cb -0.16 -3.58 0.98 0.00 -1.18 0.00 0.00 32.58 28.64 3mmy s HIS 282 CO 0.13 -2.03 1.69 -0.35 -0.65 0.00 0.00 174.74 173.53 3mmy n PRO 283 N 4.85 0.18 -0.12 2.88 -0.04 -1.26 -1.78 135.00 139.71 3mmy n PRO 283 Ca 0.12 0.44 -0.26 0.00 -0.04 0.00 0.00 63.50 63.76 3mmy n PRO 283 Cb 0.44 -1.87 -0.09 0.00 -0.04 0.00 0.00 33.50 31.95 3mmy n PRO 283 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3mmy n VAL 284 N -2.21 1.36 0.12 0.52 0.31 -1.26 -4.79 118.33 112.38 3mmy n VAL 284 Ca 0.02 -0.35 0.09 0.00 -0.01 0.00 0.00 64.34 64.09 3mmy n VAL 284 Cb 0.20 -1.82 0.03 0.00 -0.91 0.00 0.00 33.84 31.34 3mmy n VAL 284 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 3mmy h HIS 285 N -0.85 0.00 0.00 3.52 3.86 -1.88 -3.47 115.15 116.33 3mmy h HIS 285 Ca -0.63 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.58 3mmy h HIS 285 Cb 1.56 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.03 3mmy h HIS 285 CO -0.08 0.11 0.00 0.41 0.86 0.00 0.00 177.93 179.24 3mmy n GLY 286 N 1.20 0.62 3.85 2.45 0.00 -0.73 -4.97 105.19 107.60 3mmy n GLY 286 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 3mmy n GLY 286 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3mmy s THR 287 N -2.63 1.96 0.04 2.61 -4.23 -1.26 -4.77 115.64 107.36 3mmy s THR 287 Ca 0.00 0.00 0.02 0.00 -1.18 0.00 0.00 61.69 60.53 3mmy s THR 287 Cb 0.00 -2.88 -0.02 0.00 1.34 0.00 0.00 72.50 70.94 3mmy s THR 287 CO 0.00 0.00 -0.06 -1.48 -0.54 0.00 0.00 174.62 172.54 3mmy s LEU 288 N -5.94 2.28 -0.05 4.79 2.34 -0.26 -0.36 118.68 121.48 3mmy s LEU 288 Ca 0.67 -0.58 0.00 0.00 0.06 0.00 0.00 54.13 54.28 3mmy s LEU 288 Cb -0.10 -0.08 -0.03 0.00 -0.56 0.00 0.00 46.19 45.42 3mmy s LEU 288 CO 0.52 -0.26 -0.03 0.00 -1.06 0.00 0.00 176.35 175.53 3mmy s ALA 289 N -1.64 3.17 0.11 1.48 0.00 0.53 -0.42 121.76 124.99 3mmy s ALA 289 Ca -0.09 -0.90 0.10 0.00 0.00 0.00 0.00 51.96 51.07 3mmy s ALA 289 Cb -0.08 -1.33 -0.04 0.00 0.00 0.00 0.00 23.12 21.67 3mmy s ALA 289 CO -0.01 0.60 -0.25 0.95 0.00 0.00 0.00 175.76 177.06 3mmy s THR 290 N -0.93 2.06 0.04 0.00 -4.23 -0.22 -1.09 115.64 111.28 3mmy s THR 290 Ca 0.15 -1.63 0.05 0.00 -1.18 0.00 0.00 61.69 59.08 3mmy s THR 290 Cb -0.11 -1.83 -0.02 0.00 1.34 0.00 0.00 72.50 71.88 3mmy s THR 290 CO 0.05 0.08 -0.15 0.68 -0.54 0.00 0.00 174.62 174.75 3mmy s VAL 291 N -1.05 1.15 0.18 2.29 -7.23 -0.56 -1.59 120.40 113.60 3mmy s VAL 291 Ca 0.11 -1.05 0.01 0.00 -1.81 0.00 0.00 61.98 59.24 3mmy s VAL 291 Cb -0.10 -1.05 -0.05 0.00 0.56 0.00 0.00 36.38 35.75 3mmy s VAL 291 CO 0.05 -0.01 0.04 -0.83 -0.31 0.00 0.00 175.10 174.04 3mmy s GLY 292 N -1.21 1.30 0.22 2.32 0.00 -0.99 -0.70 107.32 108.26 3mmy s GLY 292 Ca 0.02 -1.63 0.20 0.00 0.00 0.00 0.00 44.72 43.31 3mmy s GLY 292 CO 0.01 -1.51 1.62 -1.26 0.00 0.00 0.00 173.10 171.97 3mmy n SER 293 N -0.26 0.52 0.00 1.64 2.88 -0.03 -1.56 113.62 116.81 3mmy n SER 293 Ca -0.05 0.66 0.11 0.00 -1.33 0.00 0.00 58.87 58.26 3mmy n SER 293 Cb 0.64 -0.76 0.61 0.00 -0.75 0.00 0.00 64.21 63.96 3mmy n SER 293 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 3mmy n ASP 294 N -2.10 0.00 -1.38 -3.46 5.75 -1.26 -4.31 116.55 109.79 3mmy n ASP 294 Ca 0.01 -0.30 -0.10 0.00 -0.01 0.00 0.00 54.79 54.39 3mmy n ASP 294 Cb 0.16 -0.18 0.01 0.00 -1.03 0.00 0.00 41.12 40.08 3mmy n ASP 294 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3mmy n GLY 295 N 0.56 0.04 3.17 6.12 0.00 -0.60 -4.64 105.19 109.83 3mmy n GLY 295 Ca 0.13 -0.40 -0.19 0.00 0.00 0.00 0.00 46.02 45.56 3mmy n GLY 295 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mmy s ARG 296 N -4.82 0.85 0.01 1.61 0.52 -1.26 0.14 118.95 116.00 3mmy s ARG 296 Ca 0.08 -0.92 -0.01 0.00 -0.52 0.00 0.00 55.73 54.36 3mmy s ARG 296 Cb -0.03 -0.87 -0.04 0.00 0.52 0.00 0.00 34.95 34.53 3mmy s ARG 296 CO 0.10 0.20 0.13 -0.59 0.02 0.00 0.00 175.30 175.15 3mmy s PHE 297 N -1.18 3.39 0.11 -0.53 -0.71 -1.26 -2.34 117.98 115.46 3mmy s PHE 297 Ca -0.01 0.25 0.06 0.00 -1.04 0.00 0.00 56.93 56.20 3mmy s PHE 297 Cb -0.10 -1.76 -0.04 0.00 -1.21 0.00 0.00 43.02 39.92 3mmy s PHE 297 CO 0.02 0.59 -0.16 -1.12 -1.34 0.00 0.00 175.22 173.21 3mmy s SER 298 N -1.93 2.08 -0.02 1.98 0.01 -0.62 -0.64 113.70 114.56 3mmy s SER 298 Ca 0.26 -0.74 0.08 0.00 1.31 0.00 0.00 55.95 56.86 3mmy s SER 298 Cb -0.12 -0.08 -0.02 0.00 0.21 0.00 0.00 66.02 66.00 3mmy s SER 298 CO 0.17 -0.08 -0.25 -0.36 0.41 0.00 0.00 173.24 173.14 3mmy s PHE 299 N -1.71 2.37 0.02 2.43 0.08 0.02 -1.05 117.98 120.14 3mmy s PHE 299 Ca 0.06 -0.41 -0.01 0.00 0.12 0.00 0.00 56.93 56.69 3mmy s PHE 299 Cb -0.07 -1.50 -0.02 0.00 -0.57 0.00 0.00 43.02 40.85 3mmy s PHE 299 CO 0.03 -0.00 -0.02 -1.58 -0.10 0.00 0.00 175.22 173.55 3mmy s TRP 300 N -0.64 0.28 -0.32 0.36 0.52 0.44 0.40 118.94 119.98 3mmy s TRP 300 Ca 0.10 -0.57 -0.01 0.00 0.02 0.00 0.00 56.10 55.64 3mmy s TRP 300 Cb -0.10 -0.20 0.06 0.00 -1.15 0.00 0.00 33.47 32.08 3mmy s TRP 300 CO -0.01 -0.22 0.03 0.34 0.02 0.00 0.00 176.95 177.11 3mmy s ASP 301 N -1.64 4.92 0.00 2.95 -1.08 0.11 -1.10 116.67 120.84 3mmy s ASP 301 Ca -0.13 -1.46 0.29 0.00 -0.52 0.00 0.00 52.55 50.73 3mmy s ASP 301 Cb -0.08 -1.72 1.29 0.00 -1.46 0.00 0.00 42.92 40.96 3mmy s ASP 301 CO -0.02 -0.31 1.91 2.29 0.52 0.00 0.00 175.17 179.56 3mmy n LYS 302 N 4.58 0.43 -0.07 4.34 -0.00 -1.26 -1.03 118.16 125.15 3mmy n LYS 302 Ca -0.10 -0.09 -0.20 0.00 -0.00 0.00 0.00 58.31 57.92 3mmy n LYS 302 Cb 0.43 -1.50 -0.12 0.00 -0.00 0.00 0.00 35.03 33.84 3mmy n LYS 302 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 3mmy h ASP 303 N 0.22 0.08 1.58 -5.58 3.32 -1.94 -3.34 116.42 110.76 3mmy h ASP 303 Ca 0.00 -0.70 0.00 0.00 0.02 0.00 0.00 57.03 56.35 3mmy h ASP 303 Cb 0.36 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.88 3mmy h ASP 303 CO 0.00 1.41 0.00 0.00 -1.72 0.00 0.00 179.24 178.93 3mmy h ALA 304 N -0.28 1.00 -5.10 3.45 0.00 -2.01 -3.47 119.26 112.86 3mmy h ALA 304 Ca -0.26 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.38 3mmy h ALA 304 Cb 1.34 0.00 0.15 0.00 0.00 0.00 0.00 17.79 19.28 3mmy h ALA 304 CO -0.10 0.00 -0.67 0.54 0.00 0.00 0.00 179.25 179.01 3mmy n ARG 305 N -2.44 -4.72 -4.27 0.00 1.74 -0.20 -5.04 116.66 101.73 3mmy n ARG 305 Ca 0.05 0.73 -0.18 0.00 -0.77 0.00 0.00 57.85 57.68 3mmy n ARG 305 Cb 0.45 -5.32 -0.11 0.00 -1.02 0.00 0.00 32.46 26.46 3mmy n ARG 305 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3mmy s THR 306 N -3.31 1.43 -0.22 0.55 -4.23 -0.44 -5.00 115.64 104.42 3mmy s THR 306 Ca 0.10 -1.82 -0.16 0.00 -1.18 0.00 0.00 61.69 58.62 3mmy s THR 306 Cb -0.01 -1.65 -0.04 0.00 1.34 0.00 0.00 72.50 72.14 3mmy s THR 306 CO 0.62 -0.45 0.40 -0.75 -0.54 0.00 0.00 174.62 173.91 3mmy s LYS 307 N -2.87 4.14 -0.02 3.99 2.20 -1.26 -0.71 119.74 125.20 3mmy s LYS 307 Ca 0.12 0.19 0.00 0.00 -0.36 0.00 0.00 55.97 55.92 3mmy s LYS 307 Cb -0.04 -3.56 -0.26 0.00 -1.51 0.00 0.00 37.83 32.46 3mmy s LYS 307 CO 0.04 -0.09 0.75 -0.07 -0.36 0.00 0.00 175.35 175.61 3mmy h LEU 308 N 7.85 0.29 -7.00 5.43 3.38 -0.39 -3.48 115.31 121.38 3mmy h LEU 308 Ca -0.35 -0.46 0.05 0.00 0.09 0.00 0.00 57.88 57.21 3mmy h LEU 308 Cb 1.16 -0.09 -0.24 0.00 0.09 0.00 0.00 40.66 41.58 3mmy h LEU 308 CO 0.71 1.40 0.44 -0.75 0.09 0.00 0.00 178.44 180.33 3mmy s LYS 309 N -2.61 0.61 -0.03 1.13 2.20 -1.13 -4.96 119.74 114.96 3mmy s LYS 309 Ca -0.10 0.42 0.05 0.00 -0.36 0.00 0.00 55.97 55.98 3mmy s LYS 309 Cb 0.07 0.29 -0.01 0.00 -1.51 0.00 0.00 37.83 36.68 3mmy s LYS 309 CO 0.83 -0.14 -0.19 0.99 -0.36 0.00 0.00 175.35 176.48 3mmy s THR 310 N -0.41 1.55 0.89 3.43 2.01 -1.26 -0.80 115.64 121.06 3mmy s THR 310 Ca -0.00 -0.81 -0.12 0.00 0.31 0.00 0.00 61.69 61.06 3mmy s THR 310 Cb -0.03 -1.31 0.13 0.00 0.01 0.00 0.00 72.50 71.30 3mmy s THR 310 CO -0.01 0.44 1.12 -0.94 -0.69 0.00 0.00 174.62 174.54 3mmy s SER 311 N -0.23 3.65 0.86 3.53 1.04 0.19 -5.01 113.70 117.73 3mmy s SER 311 Ca 0.02 1.11 -0.11 0.00 0.48 0.00 0.00 55.95 57.45 3mmy s SER 311 Cb -0.10 -1.74 0.11 0.00 0.10 0.00 0.00 66.02 64.39 3mmy s SER 311 CO 0.01 -2.48 1.14 -1.61 0.98 0.00 0.00 173.24 171.28 3mmy s GLU 312 N -5.19 1.42 -0.09 4.02 0.41 -1.26 -4.78 118.70 113.23 3mmy s GLU 312 Ca 0.63 1.48 -0.25 0.00 -0.41 0.00 0.00 54.97 56.41 3mmy s GLU 312 Cb -0.15 -1.78 -0.03 0.00 -1.78 0.00 0.00 34.13 30.39 3mmy s GLU 312 CO 0.54 -2.32 0.80 -1.14 -0.49 0.00 0.00 175.26 172.65 3mmy s GLN 313 N -4.65 4.40 0.73 1.61 0.74 -1.26 -4.62 119.66 116.62 3mmy s GLN 313 Ca 0.66 1.02 -0.12 0.00 0.05 0.00 0.00 55.36 56.97 3mmy s GLN 313 Cb -0.22 -3.50 0.03 0.00 1.10 0.00 0.00 33.01 30.42 3mmy s GLN 313 CO 0.56 -0.10 1.11 -0.51 -0.55 0.00 0.00 175.29 175.80 3mmy s LEU 314 N 1.35 2.80 0.00 3.68 1.02 0.12 -4.82 118.68 122.83 3mmy s LEU 314 Ca 0.40 1.07 0.22 0.00 0.02 0.00 0.00 54.13 55.84 3mmy s LEU 314 Cb -0.18 -3.79 1.08 0.00 0.02 0.00 0.00 46.19 43.32 3mmy s LEU 314 CO 0.18 -1.50 1.72 -0.90 0.02 0.00 0.00 176.35 175.87 3mmy n ASP 315 N -3.10 0.69 -3.92 2.29 5.68 -1.13 -4.74 116.55 112.32 3mmy n ASP 315 Ca 0.07 -1.47 -0.09 0.00 -0.50 0.00 0.00 54.79 52.80 3mmy n ASP 315 Cb 0.58 -0.03 -0.06 0.00 -1.14 0.00 0.00 41.12 40.47 3mmy n ASP 315 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3mmy s GLN 316 N -1.93 1.36 0.71 0.11 -2.07 -1.26 -5.10 119.66 111.49 3mmy s GLN 316 Ca 0.33 -1.13 -0.16 0.00 -1.82 0.00 0.00 55.36 52.58 3mmy s GLN 316 Cb 0.16 0.45 -0.02 0.00 -1.09 0.00 0.00 33.01 32.51 3mmy s GLN 316 CO 0.26 -0.55 0.78 -2.30 -1.32 0.00 0.00 175.29 172.16 3mmy n PRO 317 N -0.31 0.43 -3.48 9.60 -0.02 -1.26 -4.14 135.00 135.83 3mmy n PRO 317 Ca -0.06 0.20 -0.38 0.00 -2.02 0.00 0.00 63.50 61.24 3mmy n PRO 317 Cb 0.62 -2.05 -0.09 0.00 -0.02 0.00 0.00 33.50 31.97 3mmy n PRO 317 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3mmy s ILE 318 N -1.84 5.25 -0.63 4.25 1.01 -0.92 -1.51 121.20 126.79 3mmy s ILE 318 Ca 0.70 0.50 0.20 0.00 0.00 0.00 0.00 60.65 62.06 3mmy s ILE 318 Cb -0.35 -3.65 -0.25 0.00 0.01 0.00 0.00 42.46 38.22 3mmy s ILE 318 CO 0.53 0.26 0.72 -1.54 0.00 0.00 0.00 174.94 174.91 3mmy n SER 319 N 4.60 0.72 -3.55 3.58 3.41 -0.36 -4.02 113.62 118.00 3mmy n SER 319 Ca -0.11 -0.64 -0.09 0.00 -0.26 0.00 0.00 58.87 57.77 3mmy n SER 319 Cb 0.51 1.32 -0.03 0.00 -0.26 0.00 0.00 64.21 65.75 3mmy n SER 319 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3mmy s ALA 320 N -3.07 -1.90 0.20 7.33 0.00 -1.26 -4.67 121.76 118.38 3mmy s ALA 320 Ca 0.02 1.36 -0.18 0.00 0.00 0.00 0.00 51.96 53.16 3mmy s ALA 320 Cb 0.14 -0.18 0.03 0.00 0.00 0.00 0.00 23.12 23.11 3mmy s ALA 320 CO 0.83 -0.50 0.53 0.00 0.00 0.00 0.00 175.76 176.63 3mmy s PHE 323 N -3.21 2.64 1.17 0.00 0.40 -1.26 -0.82 117.98 116.91 3mmy s PHE 323 Ca 0.12 -0.21 -0.18 0.00 -0.60 0.00 0.00 56.93 56.06 3mmy s PHE 323 Cb -0.01 -1.40 0.27 0.00 0.51 0.00 0.00 43.02 42.39 3mmy s PHE 323 CO 0.01 0.40 1.09 0.54 0.70 0.00 0.00 175.22 177.95 3mmy s ASN 324 N -2.12 1.14 0.43 1.36 4.22 -0.62 -4.45 114.94 114.91 3mmy s ASN 324 Ca 0.19 0.81 0.10 0.00 -2.14 0.00 0.00 52.86 51.83 3mmy s ASN 324 Cb -0.11 -1.19 0.96 0.00 1.28 0.00 0.00 41.25 42.19 3mmy s ASN 324 CO 0.12 -4.00 2.04 1.12 -2.04 0.00 0.00 177.10 174.33 3mmy h HIS 325 N -2.50 0.44 -0.18 1.54 2.07 -1.89 -1.52 115.15 113.11 3mmy h HIS 325 Ca -0.48 0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.05 3mmy h HIS 325 Cb 1.31 -0.15 0.00 0.00 2.57 0.00 0.00 27.41 31.14 3mmy h HIS 325 CO -1.53 0.25 0.00 0.27 -3.07 0.00 0.00 177.93 173.85 3mmy n ASN 326 N -4.48 2.79 -0.02 3.10 0.23 -1.26 -4.82 115.26 110.81 3mmy n ASN 326 Ca 0.05 -1.82 -0.00 0.00 -0.53 0.00 0.00 54.58 52.27 3mmy n ASN 326 Cb 0.17 -0.11 -0.00 0.00 -2.08 0.00 0.00 39.78 37.76 3mmy n ASN 326 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3mmy n GLY 327 N 1.05 0.32 0.24 4.83 0.00 -0.57 -4.61 105.19 106.44 3mmy n GLY 327 Ca 0.13 -0.02 0.16 0.00 0.00 0.00 0.00 46.02 46.29 3mmy n GLY 327 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3mmy h ASN 328 N 0.00 0.00 -3.40 1.61 2.35 -1.94 -3.35 115.58 110.85 3mmy h ASN 328 Ca -0.00 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 55.17 3mmy h ASN 328 Cb 0.39 0.00 -0.33 0.00 0.05 0.00 0.00 38.32 38.43 3mmy h ASN 328 CO 0.01 0.00 -0.84 -0.63 -1.65 0.00 0.00 177.43 174.32 3mmy s ILE 329 N -3.56 1.47 -0.18 2.81 1.01 -1.26 -3.98 121.20 117.51 3mmy s ILE 329 Ca 0.02 -0.68 -0.05 0.00 0.00 0.00 0.00 60.65 59.95 3mmy s ILE 329 Cb 0.09 -1.31 -0.03 0.00 0.01 0.00 0.00 42.46 41.22 3mmy s ILE 329 CO 0.51 0.43 -0.01 0.12 0.00 0.00 0.00 174.94 175.99 3mmy s PHE 330 N 0.54 3.06 -0.07 3.97 2.19 0.18 -1.58 117.98 126.26 3mmy s PHE 330 Ca -0.16 -0.32 0.02 0.00 0.33 0.00 0.00 56.93 56.79 3mmy s PHE 330 Cb -0.17 -2.03 -0.03 0.00 -1.31 0.00 0.00 43.02 39.49 3mmy s PHE 330 CO 0.06 -0.11 -0.11 0.00 1.83 0.00 0.00 175.22 176.89 3mmy s ALA 331 N 0.66 2.79 -0.02 11.12 0.00 0.00 -0.92 121.76 135.39 3mmy s ALA 331 Ca -0.01 -0.93 -0.03 0.00 0.00 0.00 0.00 51.96 51.00 3mmy s ALA 331 Cb -0.14 -1.13 0.00 0.00 0.00 0.00 0.00 23.12 21.86 3mmy s ALA 331 CO 0.02 0.50 0.08 1.52 0.00 0.00 0.00 175.76 177.88 3mmy s TYR 332 N -0.56 -0.03 -0.18 0.00 1.13 -0.39 -1.31 117.35 116.01 3mmy s TYR 332 Ca 0.08 0.09 -0.06 0.00 -1.41 0.00 0.00 57.07 55.77 3mmy s TYR 332 Cb -0.12 -0.01 -0.04 0.00 -1.10 0.00 0.00 41.96 40.70 3mmy s TYR 332 CO 0.02 -0.09 0.04 0.00 -2.51 0.00 0.00 175.55 173.00 3mmy s ALA 333 N -0.32 3.31 -0.45 9.51 0.00 -0.54 -0.36 121.76 132.90 3mmy s ALA 333 Ca -0.04 -0.76 -0.17 0.00 0.00 0.00 0.00 51.96 50.99 3mmy s ALA 333 Cb -0.03 -1.83 0.04 0.00 0.00 0.00 0.00 23.12 21.30 3mmy s ALA 333 CO 0.00 0.19 0.48 0.45 0.00 0.00 0.00 175.76 176.88 3mmy s SER 334 N 0.36 6.19 -0.17 0.00 0.15 0.66 -1.23 113.70 119.66 3mmy s SER 334 Ca 0.01 -0.86 -0.21 0.00 0.70 0.00 0.00 55.95 55.59 3mmy s SER 334 Cb -0.13 -2.23 0.05 0.00 -1.71 0.00 0.00 66.02 62.00 3mmy s SER 334 CO 0.01 -0.68 0.56 -0.44 1.20 0.00 0.00 173.24 173.89 3mmy s SER 335 N 2.19 -0.57 0.32 5.45 0.01 -0.57 -2.15 113.70 118.39 3mmy s SER 335 Ca 0.11 0.98 -0.29 0.00 1.31 0.00 0.00 55.95 58.07 3mmy s SER 335 Cb -0.19 0.99 -0.11 0.00 0.21 0.00 0.00 66.02 66.92 3mmy s SER 335 CO 0.12 -0.28 1.53 -0.47 0.41 0.00 0.00 173.24 174.55 3mmy s TYR 336 N -0.08 2.72 -0.82 2.43 5.04 -1.26 -4.04 117.35 121.34 3mmy s TYR 336 Ca -0.03 0.97 0.08 0.00 -2.44 0.00 0.00 57.07 55.65 3mmy s TYR 336 Cb -0.04 -4.02 0.15 0.00 0.35 0.00 0.00 41.96 38.41 3mmy s TYR 336 CO 0.02 -3.23 1.00 -0.40 -1.34 0.00 0.00 175.55 171.60 3mmy n ASP 337 N 1.47 2.24 -0.26 4.32 5.68 -1.26 -4.80 116.55 123.93 3mmy n ASP 337 Ca 0.05 -1.71 -0.03 0.00 -0.50 0.00 0.00 54.79 52.60 3mmy n ASP 337 Cb 0.38 -0.09 -0.01 0.00 -1.14 0.00 0.00 41.12 40.26 3mmy n ASP 337 CO 0.00 0.00 0.00 1.87 -1.33 0.00 0.00 177.20 177.74 3mmy n TRP 338 N 0.33 0.00 0.27 2.11 -0.00 -1.26 -4.90 117.44 113.99 3mmy n TRP 338 Ca 0.07 0.00 0.17 0.00 -0.00 0.00 0.00 57.50 57.74 3mmy n TRP 338 Cb 0.30 -1.11 0.86 0.00 -0.00 0.00 0.00 31.31 31.37 3mmy n TRP 338 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 177.69 178.35 3mmy h SER 339 N 0.00 0.00 0.00 5.87 4.64 -1.99 -0.82 113.55 121.24 3mmy h SER 339 Ca -0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 3mmy h SER 339 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 3mmy h SER 339 CO 0.10 0.00 -0.05 0.29 -0.87 0.00 0.00 176.83 176.30 3mmy n LYS 340 N -2.68 1.59 -0.02 4.77 5.02 -1.26 -5.11 118.16 120.47 3mmy n LYS 340 Ca -0.02 -1.95 0.00 0.00 -2.02 0.00 0.00 58.31 54.32 3mmy n LYS 340 Cb 0.09 -1.18 -0.00 0.00 -0.02 0.00 0.00 35.03 33.92 3mmy n LYS 340 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3mmy n GLY 341 N -0.91 -2.05 0.24 0.72 0.00 -0.32 -4.44 105.19 98.43 3mmy n GLY 341 Ca 0.08 -1.41 0.09 0.00 0.00 0.00 0.00 46.02 44.79 3mmy n GLY 341 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 3mmy h HIS 342 N -0.01 0.00 0.00 1.61 2.07 -1.98 -3.12 115.15 113.71 3mmy h HIS 342 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3mmy h HIS 342 Cb 0.01 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.99 3mmy h HIS 342 CO 0.00 0.18 0.00 0.93 -3.07 0.00 0.00 177.93 175.97 3mmy h GLU 343 N 0.00 0.00 -0.28 5.12 5.08 -2.00 -2.38 114.58 120.11 3mmy h GLU 343 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3mmy h GLU 343 Cb 0.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 3mmy h GLU 343 CO 0.02 0.00 0.00 1.19 -1.00 0.00 0.00 179.01 179.22 3mmy n PHE 344 N -2.42 0.37 -2.59 4.33 3.01 -1.18 -4.93 117.46 114.05 3mmy n PHE 344 Ca 0.01 -0.35 -0.43 0.00 1.01 0.00 0.00 57.45 57.70 3mmy n PHE 344 Cb 0.22 -0.02 -0.02 0.00 -0.01 0.00 0.00 39.48 39.65 3mmy n PHE 344 CO 0.00 0.00 0.00 -0.47 1.01 0.00 0.00 176.76 177.30 3mmy s TYR 345 N -1.02 3.29 -0.47 1.38 6.04 -0.90 -5.00 117.35 120.67 3mmy s TYR 345 Ca 0.23 1.39 -0.00 0.00 0.04 0.00 0.00 57.07 58.73 3mmy s TYR 345 Cb 0.13 -3.31 0.13 0.00 -1.04 0.00 0.00 41.96 37.86 3mmy s TYR 345 CO 0.17 -0.75 0.25 1.21 -1.54 0.00 0.00 175.55 174.89 3mmy s ASN 346 N 1.34 4.98 0.00 4.32 3.84 -1.26 -4.97 114.94 123.19 3mmy s ASN 346 Ca 0.49 -2.46 0.07 0.00 0.21 0.00 0.00 52.86 51.17 3mmy s ASN 346 Cb -0.19 -1.76 0.31 0.00 -0.55 0.00 0.00 41.25 39.06 3mmy s ASN 346 CO 0.14 -0.41 1.17 -0.81 -2.79 0.00 0.00 177.10 174.41 3mmy n PRO 347 N 3.95 0.03 -0.00 0.43 -0.04 -1.26 -1.78 135.00 136.33 3mmy n PRO 347 Ca 0.03 0.33 0.10 0.00 -0.04 0.00 0.00 63.50 63.92 3mmy n PRO 347 Cb 0.39 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.22 3mmy n PRO 347 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3mmy n GLN 348 N -1.43 0.55 -2.18 0.54 6.02 -1.26 -4.93 117.38 114.69 3mmy n GLN 348 Ca 0.02 -0.09 -0.41 0.00 -0.01 0.00 0.00 57.00 56.51 3mmy n GLN 348 Cb 0.07 -1.45 -0.03 0.00 1.02 0.00 0.00 30.24 29.85 3mmy n GLN 348 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 3mmy s LYS 349 N -3.12 4.36 0.46 -1.09 2.20 -0.74 -4.98 119.74 116.84 3mmy s LYS 349 Ca 0.01 2.09 -0.21 0.00 -0.36 0.00 0.00 55.97 57.50 3mmy s LYS 349 Cb 0.14 -3.19 -0.09 0.00 -1.51 0.00 0.00 37.83 33.19 3mmy s LYS 349 CO 0.83 -0.29 1.05 0.21 -0.36 0.00 0.00 175.35 176.78 3mmy s LYS 350 N -0.04 3.88 -0.03 4.03 2.20 -1.26 -5.02 119.74 123.51 3mmy s LYS 350 Ca 0.58 1.41 -0.04 0.00 -0.36 0.00 0.00 55.97 57.56 3mmy s LYS 350 Cb -0.37 -2.21 -0.04 0.00 -1.51 0.00 0.00 37.83 33.70 3mmy s LYS 350 CO 0.38 -0.37 0.18 -0.80 -0.36 0.00 0.00 175.35 174.38 3mmy s ASN 351 N -1.86 6.38 0.05 1.43 0.01 -1.26 -4.90 114.94 114.79 3mmy s ASN 351 Ca 0.65 0.38 0.03 0.00 -0.71 0.00 0.00 52.86 53.21 3mmy s ASN 351 Cb -0.18 -2.02 -0.02 0.00 0.41 0.00 0.00 41.25 39.44 3mmy s ASN 351 CO 0.22 0.28 -0.11 -0.31 -1.51 0.00 0.00 177.10 175.68 3mmy s TYR 352 N -1.28 0.91 -0.16 2.20 1.51 -0.91 -4.77 117.35 114.85 3mmy s TYR 352 Ca 0.25 -0.45 -0.01 0.00 -1.01 0.00 0.00 57.07 55.86 3mmy s TYR 352 Cb -0.13 -0.53 -0.01 0.00 -0.11 0.00 0.00 41.96 41.19 3mmy s TYR 352 CO 0.16 -0.02 -0.13 0.42 -1.11 0.00 0.00 175.55 174.88 3mmy s ILE 353 N -1.22 2.89 0.03 2.71 1.01 -1.26 -0.25 121.20 125.11 3mmy s ILE 353 Ca -0.05 -0.69 0.05 0.00 0.00 0.00 0.00 60.65 59.95 3mmy s ILE 353 Cb -0.09 -2.23 -0.03 0.00 0.01 0.00 0.00 42.46 40.11 3mmy s ILE 353 CO 0.01 0.50 -0.11 -0.36 0.00 0.00 0.00 174.94 174.98 3mmy s PHE 354 N 0.77 2.75 0.02 3.97 2.99 0.51 -1.21 117.98 127.78 3mmy s PHE 354 Ca -0.05 -0.13 0.08 0.00 0.00 0.00 0.00 56.93 56.82 3mmy s PHE 354 Cb -0.15 -1.53 -0.02 0.00 0.00 0.00 0.00 43.02 41.31 3mmy s PHE 354 CO 0.01 0.33 -0.23 -0.51 -0.00 0.00 0.00 175.22 174.82 3mmy s LEU 355 N -1.52 2.11 -0.01 -0.37 1.43 0.18 -1.26 118.68 119.24 3mmy s LEU 355 Ca 0.17 -0.49 -0.01 0.00 -1.03 0.00 0.00 54.13 52.77 3mmy s LEU 355 Cb -0.11 -1.15 0.01 0.00 0.03 0.00 0.00 46.19 44.97 3mmy s LEU 355 CO 0.08 0.24 0.03 -0.60 0.23 0.00 0.00 176.35 176.32 3mmy s ARG 356 N -0.90 0.02 -0.93 1.70 3.52 -0.09 -1.65 118.95 120.60 3mmy s ARG 356 Ca 0.09 0.07 -0.24 0.00 -0.13 0.00 0.00 55.73 55.53 3mmy s ARG 356 Cb -0.09 -0.04 0.05 0.00 -1.56 0.00 0.00 34.95 33.31 3mmy s ARG 356 CO 0.01 -0.04 1.37 -0.80 -0.81 0.00 0.00 175.30 175.03 3mmy s ASN 357 N 0.24 6.41 0.00 -2.12 0.01 -1.26 -0.64 114.94 117.58 3mmy s ASN 357 Ca -0.02 -1.23 0.13 0.00 -0.71 0.00 0.00 52.86 51.03 3mmy s ASN 357 Cb -0.03 -2.55 0.37 0.00 0.41 0.00 0.00 41.25 39.45 3mmy s ASN 357 CO -0.01 -1.56 1.30 0.00 -1.51 0.00 0.00 177.10 175.33 3mmy n ALA 358 N 8.81 2.21 -0.26 0.60 0.00 -1.26 -4.73 120.51 125.89 3mmy n ALA 358 Ca 0.24 -1.17 -0.00 0.00 0.00 0.00 0.00 53.44 52.51 3mmy n ALA 358 Cb 0.50 -0.52 0.12 0.00 0.00 0.00 0.00 19.45 19.55 3mmy n ALA 358 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3mmy h ALA 359 N 2.42 1.01 0.00 0.00 0.00 -1.80 -1.56 119.26 119.33 3mmy h ALA 359 Ca 0.00 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 3mmy h ALA 359 Cb 0.78 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3mmy h ALA 359 CO 0.00 0.10 -0.44 0.93 0.00 0.00 0.00 179.25 179.83 3mmy h GLU 360 N 0.76 0.00 0.00 0.00 4.39 -1.93 -2.45 114.58 115.34 3mmy h GLU 360 Ca 0.34 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 60.02 3mmy h GLU 360 Cb 0.23 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.88 3mmy h GLU 360 CO -0.20 0.44 -0.07 0.93 -1.16 0.00 0.00 179.01 178.95 3mmy h GLU 361 N 0.00 0.00 -0.39 2.33 5.08 -1.68 -2.86 114.58 117.06 3mmy h GLU 361 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3mmy h GLU 361 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 3mmy h GLU 361 CO 0.06 0.07 0.00 1.28 -1.00 0.00 0.00 179.01 179.42 3mmy n LEU 362 N -3.24 3.25 -4.51 1.33 4.77 -0.66 -4.78 117.00 113.16 3mmy n LEU 362 Ca -0.00 -1.63 -0.41 0.00 -0.03 0.00 0.00 56.01 53.94 3mmy n LEU 362 Cb 0.30 -0.25 -0.10 0.00 -2.33 0.00 0.00 43.42 41.04 3mmy n LEU 362 CO 0.28 0.74 -0.06 -0.75 -1.33 0.00 0.00 177.39 176.27 3mmy s LYS 363 N -1.23 3.35 0.31 3.23 2.20 -1.04 -4.61 119.74 121.94 3mmy s LYS 363 Ca 0.34 -0.70 -0.29 0.00 -0.36 0.00 0.00 55.97 54.95 3mmy s LYS 363 Cb 0.19 -3.86 -0.10 0.00 -1.51 0.00 0.00 37.83 32.55 3mmy s LYS 363 CO 0.26 -0.57 1.30 -2.14 -0.36 0.00 0.00 175.35 173.85 3mmy s PRO 364 N 1.80 4.37 0.00 4.03 0.02 -1.26 -4.98 135.00 138.98 3mmy s PRO 364 Ca 0.07 2.18 0.27 0.00 0.02 0.00 0.00 61.00 63.54 3mmy s PRO 364 Cb -0.18 -3.10 1.59 0.00 0.02 0.00 0.00 34.50 32.84 3mmy s PRO 364 CO 0.11 -0.19 1.94 -2.13 -0.33 0.00 0.00 177.00 176.40