#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mcq n SER 2 N 0.00 0.00 -3.73 3.54 7.64 -1.26 -4.91 113.62 114.90 1mcq n SER 2 Ca 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.74 1mcq n SER 2 Cb 0.00 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.11 1mcq n SER 2 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1mcq s ALA 3 N -1.00 -0.92 0.04 -0.43 0.00 -1.26 -3.67 121.76 114.52 1mcq s ALA 3 Ca 0.00 0.55 0.01 0.00 0.00 0.00 0.00 51.96 52.52 1mcq s ALA 3 Cb 0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.04 1mcq s ALA 3 CO 0.00 -0.26 0.10 -0.51 0.00 0.00 0.00 175.76 175.09 1mcq s LEU 4 N -1.09 3.94 -0.21 0.00 1.02 0.87 -4.98 118.68 118.24 1mcq s LEU 4 Ca -0.11 0.11 -0.09 0.00 0.02 0.00 0.00 54.13 54.05 1mcq s LEU 4 Cb -0.04 -2.48 -0.04 0.00 0.02 0.00 0.00 46.19 43.64 1mcq s LEU 4 CO 0.04 0.21 0.11 0.42 0.02 0.00 0.00 176.35 177.15 1mcq s THR 5 N -1.33 5.03 -0.07 5.49 -4.23 0.13 -1.01 115.64 119.64 1mcq s THR 5 Ca 0.28 0.06 0.03 0.00 -1.18 0.00 0.00 61.69 60.87 1mcq s THR 5 Cb -0.12 -3.31 0.01 0.00 1.34 0.00 0.00 72.50 70.42 1mcq s THR 5 CO 0.20 0.41 -0.16 -1.10 -0.54 0.00 0.00 174.62 173.42 1mcq s GLN 6 N 0.73 1.98 0.04 3.99 -0.21 -1.26 -1.06 119.66 123.88 1mcq s GLN 6 Ca 0.06 -0.55 -0.38 0.00 0.02 0.00 0.00 55.36 54.50 1mcq s GLN 6 Cb -0.13 -1.61 -0.19 0.00 1.00 0.00 0.00 33.01 32.08 1mcq s GLN 6 CO 0.02 0.11 1.11 -0.35 -2.12 0.00 0.00 175.29 174.06 1mcq n PRO 7 N 3.58 0.36 0.25 2.91 -0.04 -1.26 -4.51 135.00 136.28 1mcq n PRO 7 Ca -0.21 0.13 0.14 0.00 -0.04 0.00 0.00 63.50 63.52 1mcq n PRO 7 Cb 0.52 -1.63 0.54 0.00 -0.04 0.00 0.00 33.50 32.89 1mcq n PRO 7 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1mcq h PRO 8 N 3.29 0.00 -2.27 0.54 0.13 -1.90 -3.37 132.00 128.42 1mcq h PRO 8 Ca -0.48 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.50 1mcq h PRO 8 Cb 1.40 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 32.24 1mcq h PRO 8 CO 0.68 0.09 -0.45 0.45 -0.23 0.00 0.00 178.00 178.54 1mcq s SER 9 N -5.94 0.13 0.08 1.44 0.15 -1.26 -2.54 113.70 105.76 1mcq s SER 9 Ca 0.02 0.53 -0.12 0.00 0.70 0.00 0.00 55.95 57.08 1mcq s SER 9 Cb 0.09 1.11 -0.06 0.00 -1.71 0.00 0.00 66.02 65.45 1mcq s SER 9 CO 0.59 -0.27 0.43 0.00 1.20 0.00 0.00 173.24 175.20 1mcq s ALA 10 N 2.54 3.69 -0.18 5.45 0.00 -0.02 -4.71 121.76 128.54 1mcq s ALA 10 Ca 0.06 -0.30 -0.17 0.00 0.00 0.00 0.00 51.96 51.54 1mcq s ALA 10 Cb -0.14 -2.34 0.05 0.00 0.00 0.00 0.00 23.12 20.69 1mcq s ALA 10 CO -0.14 0.53 0.49 -1.12 0.00 0.00 0.00 175.76 175.53 1mcq s SER 11 N -1.65 -0.51 -0.26 0.00 0.01 -1.26 -0.28 113.70 109.75 1mcq s SER 11 Ca 0.33 0.97 -0.26 0.00 1.31 0.00 0.00 55.95 58.30 1mcq s SER 11 Cb -0.15 0.99 0.12 0.00 0.21 0.00 0.00 66.02 67.20 1mcq s SER 11 CO 0.18 -0.18 1.03 -0.83 0.41 0.00 0.00 173.24 173.84 1mcq s GLY 12 N 0.21 -0.16 0.09 3.44 0.00 -1.14 -4.89 107.32 104.86 1mcq s GLY 12 Ca -0.00 2.57 -0.31 0.00 0.00 0.00 0.00 44.72 46.98 1mcq s GLY 12 CO 0.01 1.69 1.62 1.48 0.00 0.00 0.00 173.10 177.90 1mcq h SER 13 N 3.89 -0.89 0.00 1.64 4.64 -1.87 -1.86 113.55 119.09 1mcq h SER 13 Ca -0.26 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 1mcq h SER 13 Cb 1.17 0.30 0.00 0.00 -0.31 0.00 0.00 62.40 63.56 1mcq h SER 13 CO 0.15 -0.47 0.00 -0.11 -0.87 0.00 0.00 176.83 175.52 1mcq n LEU 14 N -5.45 0.00 0.00 5.97 7.94 -1.26 -3.59 117.00 120.61 1mcq n LEU 14 Ca -0.10 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.80 1mcq n LEU 14 Cb 0.35 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.30 1mcq n LEU 14 CO 0.29 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.18 1mcq n GLY 15 N 0.00 2.91 3.75 -3.96 0.00 -0.21 -4.88 105.19 102.81 1mcq n GLY 15 Ca 0.00 -0.71 -0.41 0.00 0.00 0.00 0.00 46.02 44.90 1mcq n GLY 15 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1mcq s GLN 16 N 0.00 4.35 -0.01 1.61 0.74 -1.26 -3.88 119.66 121.21 1mcq s GLN 16 Ca 0.00 2.19 -0.23 0.00 0.05 0.00 0.00 55.36 57.37 1mcq s GLN 16 Cb 0.00 -3.12 -0.05 0.00 1.10 0.00 0.00 33.01 30.95 1mcq s GLN 16 CO 0.00 -0.26 0.69 -1.12 -0.55 0.00 0.00 175.29 174.05 1mcq s SER 17 N -0.06 7.06 -0.12 6.67 0.01 -1.26 -2.39 113.70 123.62 1mcq s SER 17 Ca 0.54 1.26 0.03 0.00 1.31 0.00 0.00 55.95 59.09 1mcq s SER 17 Cb -0.39 -2.42 0.00 0.00 0.21 0.00 0.00 66.02 63.43 1mcq s SER 17 CO 0.46 -0.00 -0.23 -0.69 0.41 0.00 0.00 173.24 173.19 1mcq s VAL 18 N 0.20 2.09 0.14 3.43 1.01 -0.44 -4.97 120.40 121.86 1mcq s VAL 18 Ca 0.36 -1.00 0.02 0.00 0.00 0.00 0.00 61.98 61.37 1mcq s VAL 18 Cb -0.19 -1.81 -0.04 0.00 0.00 0.00 0.00 36.38 34.35 1mcq s VAL 18 CO 0.19 0.56 0.27 0.28 0.00 0.00 0.00 175.10 176.40 1mcq s THR 19 N 0.51 5.27 -0.02 3.92 -1.32 -1.26 -1.16 115.64 121.59 1mcq s THR 19 Ca -0.15 -0.69 0.00 0.00 -1.21 0.00 0.00 61.69 59.65 1mcq s THR 19 Cb -0.17 -3.70 0.02 0.00 -1.51 0.00 0.00 72.50 67.14 1mcq s THR 19 CO 0.05 -0.07 0.01 -0.63 -2.21 0.00 0.00 174.62 171.76 1mcq s ILE 20 N -1.72 0.11 0.15 5.08 1.09 -0.18 -4.94 121.20 120.80 1mcq s ILE 20 Ca 0.34 0.10 0.08 0.00 -1.10 0.00 0.00 60.65 60.07 1mcq s ILE 20 Cb -0.11 -0.20 -0.04 0.00 -1.06 0.00 0.00 42.46 41.05 1mcq s ILE 20 CO 0.28 0.12 -0.09 -0.44 -0.10 0.00 0.00 174.94 174.71 1mcq s SER 21 N 0.89 4.33 -0.16 3.58 0.01 -1.26 -0.94 113.70 120.15 1mcq s SER 21 Ca -0.08 -0.50 -0.04 0.00 1.31 0.00 0.00 55.95 56.64 1mcq s SER 21 Cb -0.12 -0.78 0.07 0.00 0.21 0.00 0.00 66.02 65.41 1mcq s SER 21 CO -0.02 0.13 0.19 0.00 0.41 0.00 0.00 173.24 173.95 1mcq s THR 23 N 2.30 3.13 0.00 0.00 2.01 -0.22 -0.75 115.64 122.11 1mcq s THR 23 Ca 0.05 -1.34 0.00 0.00 0.31 0.00 0.00 61.69 60.71 1mcq s THR 23 Cb -0.15 -2.44 0.00 0.00 0.01 0.00 0.00 72.50 69.92 1mcq s THR 23 CO -0.10 0.13 0.00 0.61 -0.69 0.00 0.00 174.62 174.57 1mcq n GLY 24 N 0.82 5.40 3.64 4.40 0.00 -1.12 -0.70 105.19 117.63 1mcq n GLY 24 Ca -0.14 -1.30 -0.05 0.00 0.00 0.00 0.00 46.02 44.53 1mcq n GLY 24 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mcq s THR 25 N 2.21 0.00 0.00 2.61 2.01 -1.25 -5.00 115.64 116.21 1mcq s THR 25 Ca 0.00 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.00 1mcq s THR 25 Cb 0.00 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.51 1mcq s THR 25 CO 0.00 0.00 0.00 -1.54 -0.69 0.00 0.00 174.62 172.39 1mcq n SER 26 N 2.38 0.00 -4.76 3.53 3.41 -1.26 -4.49 113.62 112.44 1mcq n SER 26 Ca -0.13 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.07 1mcq n SER 26 Cb 0.57 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.48 1mcq n SER 26 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1mcq s SER 27 N -4.00 7.19 1.38 4.04 0.15 -1.26 -4.11 113.70 117.08 1mcq s SER 27 Ca 0.00 2.31 0.00 0.00 0.70 0.00 0.00 55.95 58.96 1mcq s SER 27 Cb 0.00 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.68 1mcq s SER 27 CO 0.00 -0.22 0.00 -0.67 1.20 0.00 0.00 173.24 173.55 1mcq n ASP 28 N 1.32 0.00 -4.59 5.45 -0.08 -1.26 -4.89 116.55 112.50 1mcq n ASP 28 Ca -0.00 0.00 -0.42 0.00 -1.51 0.00 0.00 54.79 52.85 1mcq n ASP 28 Cb 0.44 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 43.88 1mcq n ASP 28 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1mcq s VAL 29 N 0.00 3.83 0.00 5.18 1.01 -1.26 -4.56 120.40 124.61 1mcq s VAL 29 Ca 0.00 0.81 0.00 0.00 0.00 0.00 0.00 61.98 62.79 1mcq s VAL 29 Cb 0.00 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 32.13 1mcq s VAL 29 CO 0.00 -0.87 0.00 0.61 0.00 0.00 0.00 175.10 174.84 1mcq n GLY 30 N 5.17 0.02 2.41 4.51 0.00 -1.26 -3.79 105.19 112.26 1mcq n GLY 30 Ca 0.16 0.52 -0.40 0.00 0.00 0.00 0.00 46.02 46.30 1mcq n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mcq n GLY 31 N 0.00 4.61 2.65 -0.02 0.00 -1.26 -4.55 105.19 106.62 1mcq n GLY 31 Ca 0.00 -1.71 -0.21 0.00 0.00 0.00 0.00 46.02 44.09 1mcq n GLY 31 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1mcq s TYR 32 N 1.04 0.05 -0.65 1.61 5.04 -1.26 -5.03 117.35 118.15 1mcq s TYR 32 Ca 0.62 -1.05 0.00 0.00 -2.44 0.00 0.00 57.07 54.21 1mcq s TYR 32 Cb 0.18 -0.59 0.41 0.00 0.35 0.00 0.00 41.96 42.30 1mcq s TYR 32 CO -0.07 -0.91 1.78 0.09 -1.34 0.00 0.00 175.55 175.09 1mcq n ASN 33 N 4.29 6.82 -0.82 4.32 3.02 -1.26 -4.46 115.26 127.17 1mcq n ASN 33 Ca 0.10 -3.79 0.09 0.00 -0.03 0.00 0.00 54.58 50.95 1mcq n ASN 33 Cb 0.42 -0.84 0.12 0.00 -0.61 0.00 0.00 39.78 38.87 1mcq n ASN 33 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1mcq n TYR 34 N -0.69 0.20 -1.68 3.10 4.19 -1.26 -4.43 117.16 116.59 1mcq n TYR 34 Ca 0.54 -0.13 -0.42 0.00 3.31 0.00 0.00 57.90 61.20 1mcq n TYR 34 Cb 0.55 -0.00 -0.03 0.00 0.49 0.00 0.00 39.34 40.35 1mcq n TYR 34 CO 0.00 0.00 0.00 0.54 0.91 0.00 0.00 176.86 178.31 1mcq s VAL 35 N -1.40 2.95 0.13 2.97 0.11 -1.25 -4.09 120.40 119.81 1mcq s VAL 35 Ca 0.26 0.03 0.08 0.00 -2.93 0.00 0.00 61.98 59.42 1mcq s VAL 35 Cb 0.17 -3.02 -0.04 0.00 -1.53 0.00 0.00 36.38 31.96 1mcq s VAL 35 CO 0.24 -0.00 -0.13 -0.94 -3.33 0.00 0.00 175.10 170.94 1mcq s SER 36 N 4.20 4.19 -0.08 3.54 1.04 -0.23 -0.33 113.70 126.03 1mcq s SER 36 Ca 0.87 -0.49 -0.00 0.00 0.48 0.00 0.00 55.95 56.81 1mcq s SER 36 Cb -0.43 -0.71 -0.03 0.00 0.10 0.00 0.00 66.02 64.95 1mcq s SER 36 CO 0.41 0.16 -0.04 0.26 0.98 0.00 0.00 173.24 175.01 1mcq s TRP 37 N -1.30 3.04 -0.10 5.02 0.52 0.26 -0.44 118.94 125.95 1mcq s TRP 37 Ca 0.21 0.10 0.02 0.00 0.02 0.00 0.00 56.10 56.45 1mcq s TRP 37 Cb -0.10 -1.75 -0.01 0.00 -1.15 0.00 0.00 33.47 30.45 1mcq s TRP 37 CO 0.13 0.40 -0.17 0.71 0.02 0.00 0.00 176.95 178.04 1mcq s TYR 38 N -0.84 2.69 0.23 -1.98 1.51 0.29 -0.87 117.35 118.39 1mcq s TYR 38 Ca 0.13 -0.63 0.01 0.00 -1.01 0.00 0.00 57.07 55.56 1mcq s TYR 38 Cb -0.11 -1.75 -0.04 0.00 -0.11 0.00 0.00 41.96 39.95 1mcq s TYR 38 CO 0.02 -0.17 0.40 -1.14 -1.11 0.00 0.00 175.55 173.55 1mcq s GLN 39 N 0.07 3.49 -0.24 -0.62 0.74 -0.51 -0.78 119.66 121.82 1mcq s GLN 39 Ca -0.07 -0.43 -0.09 0.00 0.05 0.00 0.00 55.36 54.82 1mcq s GLN 39 Cb -0.15 -2.83 0.10 0.00 1.10 0.00 0.00 33.01 31.23 1mcq s GLN 39 CO 0.05 0.37 0.53 -1.14 -0.55 0.00 0.00 175.29 174.55 1mcq s GLN 40 N -3.58 0.46 0.12 1.67 0.74 -0.08 -0.40 119.66 118.59 1mcq s GLN 40 Ca 0.38 1.19 0.03 0.00 0.05 0.00 0.00 55.36 57.01 1mcq s GLN 40 Cb -0.10 0.49 -0.04 0.00 1.10 0.00 0.00 33.01 34.46 1mcq s GLN 40 CO 0.30 -0.21 0.15 -1.01 -0.55 0.00 0.00 175.29 173.97 1mcq s HIS 41 N 2.52 3.26 0.00 1.67 3.76 -1.26 -0.86 115.29 124.38 1mcq s HIS 41 Ca -0.05 0.07 0.00 0.00 -0.15 0.00 0.00 55.06 54.93 1mcq s HIS 41 Cb -0.11 -1.60 0.00 0.00 1.11 0.00 0.00 32.58 31.98 1mcq s HIS 41 CO -0.16 0.53 0.00 0.00 -0.85 0.00 0.00 174.74 174.26 1mcq n ALA 42 N -0.02 0.00 -2.87 -1.40 0.00 -1.26 -1.06 120.51 113.90 1mcq n ALA 42 Ca -0.08 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.93 1mcq n ALA 42 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1mcq n ALA 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mcq n GLY 43 N 0.00 4.48 3.34 0.00 0.00 -1.26 -4.89 105.19 106.85 1mcq n GLY 43 Ca 0.00 -2.35 -0.10 0.00 0.00 0.00 0.00 46.02 43.58 1mcq n GLY 43 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1mcq s LYS 44 N -0.63 1.10 0.31 1.61 2.36 -0.23 -5.16 119.74 119.10 1mcq s LYS 44 Ca 0.36 -0.92 -0.27 0.00 -2.55 0.00 0.00 55.97 52.59 1mcq s LYS 44 Cb 0.02 0.43 -0.10 0.00 -1.05 0.00 0.00 37.83 37.13 1mcq s LYS 44 CO 0.02 -0.42 0.97 0.00 1.55 0.00 0.00 175.35 177.47 1mcq s ALA 45 N -3.87 3.25 -0.39 3.13 0.00 -1.26 -4.37 121.76 118.24 1mcq s ALA 45 Ca 0.08 0.61 -0.34 0.00 0.00 0.00 0.00 51.96 52.31 1mcq s ALA 45 Cb 0.02 -3.22 -0.11 0.00 0.00 0.00 0.00 23.12 19.81 1mcq s ALA 45 CO -0.07 0.10 2.24 -0.35 0.00 0.00 0.00 175.76 177.68 1mcq n PRO 46 N 0.77 1.03 -3.82 0.00 -0.04 -1.26 -4.71 135.00 126.97 1mcq n PRO 46 Ca 0.01 0.26 -0.36 0.00 -0.04 0.00 0.00 63.50 63.36 1mcq n PRO 46 Cb 0.49 -2.50 -0.13 0.00 -0.04 0.00 0.00 33.50 31.32 1mcq n PRO 46 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1mcq s LYS 47 N 6.54 2.47 -0.28 0.54 2.36 0.47 -4.91 119.74 126.91 1mcq s LYS 47 Ca 1.10 -1.30 -0.40 0.00 -2.55 0.00 0.00 55.97 52.82 1mcq s LYS 47 Cb -0.82 -3.36 -0.16 0.00 -1.05 0.00 0.00 37.83 32.44 1mcq s LYS 47 CO 0.47 -0.70 1.76 0.28 1.55 0.00 0.00 175.35 178.71 1mcq n VAL 48 N 4.71 0.31 -0.00 4.02 0.31 -1.26 -1.42 118.33 124.99 1mcq n VAL 48 Ca -0.11 -0.06 0.02 0.00 -0.01 0.00 0.00 64.34 64.18 1mcq n VAL 48 Cb 0.44 -1.24 -0.03 0.00 -0.91 0.00 0.00 33.84 32.10 1mcq n VAL 48 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 1mcq n ILE 49 N 4.67 0.01 -3.89 2.52 -6.64 -0.05 -4.86 119.36 111.13 1mcq n ILE 49 Ca 0.27 -0.10 -0.11 0.00 -1.77 0.00 0.00 62.75 61.04 1mcq n ILE 49 Cb 0.13 0.37 -0.10 0.00 -1.44 0.00 0.00 39.64 38.60 1mcq n ILE 49 CO 0.00 0.00 0.00 -0.63 -1.77 0.00 0.00 176.55 174.15 1mcq s ILE 50 N -2.28 0.08 -0.01 7.28 1.01 -1.08 -4.33 121.20 121.87 1mcq s ILE 50 Ca -0.02 -0.67 -0.14 0.00 0.00 0.00 0.00 60.65 59.83 1mcq s ILE 50 Cb 0.03 -0.38 0.02 0.00 0.01 0.00 0.00 42.46 42.13 1mcq s ILE 50 CO 0.17 -0.37 0.29 -0.72 0.00 0.00 0.00 174.94 174.31 1mcq s TYR 51 N -1.27 -0.16 -0.95 3.97 -0.85 0.55 -0.57 117.35 118.07 1mcq s TYR 51 Ca -0.14 0.23 -0.11 0.00 -0.52 0.00 0.00 57.07 56.54 1mcq s TYR 51 Cb -0.07 0.08 0.01 0.00 0.38 0.00 0.00 41.96 42.36 1mcq s TYR 51 CO 0.01 -0.38 0.63 0.39 -1.52 0.00 0.00 175.55 174.69 1mcq n GLU 52 N 1.32 -1.14 0.00 -3.49 1.02 -1.03 -0.61 120.64 116.71 1mcq n GLU 52 Ca -0.22 0.55 0.00 0.00 -0.02 0.00 0.00 57.16 57.48 1mcq n GLU 52 Cb 0.56 -2.42 0.00 0.00 -0.02 0.00 0.00 31.44 29.56 1mcq n GLU 52 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1mcq n VAL 53 N -3.38 0.00 -1.45 2.62 0.31 0.55 -3.68 118.33 113.31 1mcq n VAL 53 Ca -0.25 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1mcq n VAL 53 Cb 0.65 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.58 1mcq n VAL 53 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1mcq n ASN 54 N 1.35 0.00 -4.65 4.52 6.94 -0.91 -3.56 115.26 118.95 1mcq n ASN 54 Ca 0.00 -0.47 -0.43 0.00 -0.02 0.00 0.00 54.58 53.66 1mcq n ASN 54 Cb 0.00 0.00 -0.03 0.00 -2.36 0.00 0.00 39.78 37.39 1mcq n ASN 54 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1mcq s LYS 55 N 0.00 4.00 0.15 -3.83 1.02 0.22 -4.62 119.74 116.68 1mcq s LYS 55 Ca 0.00 1.92 0.01 0.00 0.02 0.00 0.00 55.97 57.92 1mcq s LYS 55 Cb 0.00 -4.00 -0.04 0.00 -0.52 0.00 0.00 37.83 33.28 1mcq s LYS 55 CO 0.00 -1.05 0.31 -0.98 -0.92 0.00 0.00 175.35 172.71 1mcq s ARG 56 N 4.31 3.47 -0.09 1.68 1.04 -1.26 -0.33 118.95 127.76 1mcq s ARG 56 Ca 0.72 -0.50 0.05 0.00 -1.04 0.00 0.00 55.73 54.96 1mcq s ARG 56 Cb -0.29 -2.94 0.31 0.00 -2.04 0.00 0.00 34.95 30.00 1mcq s ARG 56 CO 0.28 0.50 0.98 -2.30 -0.04 0.00 0.00 175.30 174.72 1mcq n PRO 57 N -0.45 2.48 0.00 3.89 -0.02 -1.26 -4.91 135.00 134.73 1mcq n PRO 57 Ca -0.06 -1.20 0.00 0.00 -2.02 0.00 0.00 63.50 60.22 1mcq n PRO 57 Cb 0.53 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 1mcq n PRO 57 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1mcq n SER 58 N 0.24 0.00 0.00 2.55 7.64 -1.26 -4.33 113.62 118.46 1mcq n SER 58 Ca 0.11 0.00 0.03 0.00 1.01 0.00 0.00 58.87 60.01 1mcq n SER 58 Cb 0.61 -0.38 0.17 0.00 -1.01 0.00 0.00 64.21 63.59 1mcq n SER 58 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1mcq n GLY 59 N -0.73 -0.42 3.30 0.23 0.00 -1.26 -4.67 105.19 101.64 1mcq n GLY 59 Ca 0.00 -0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 1mcq n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mcq s VAL 60 N -2.00 2.09 0.65 1.61 1.01 -1.26 -5.13 120.40 117.38 1mcq s VAL 60 Ca 0.08 -1.08 -0.16 0.00 0.00 0.00 0.00 61.98 60.83 1mcq s VAL 60 Cb 0.04 -1.73 -0.00 0.00 0.00 0.00 0.00 36.38 34.68 1mcq s VAL 60 CO 0.07 0.58 1.14 -2.84 0.00 0.00 0.00 175.10 174.04 1mcq s PRO 61 N -0.44 2.75 0.29 2.72 0.02 -1.26 -4.86 135.00 134.21 1mcq s PRO 61 Ca 0.05 1.53 0.16 0.00 0.02 0.00 0.00 61.00 62.76 1mcq s PRO 61 Cb -0.11 -1.93 0.09 0.00 0.02 0.00 0.00 34.50 32.56 1mcq s PRO 61 CO 0.01 -1.32 1.42 0.38 -0.33 0.00 0.00 177.00 177.16 1mcq h ASP 62 N 0.17 0.00 0.00 2.53 3.04 -2.00 -2.17 116.42 118.00 1mcq h ASP 62 Ca -0.48 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.31 1mcq h ASP 62 Cb 1.26 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.55 1mcq h ASP 62 CO 0.54 0.43 0.04 -2.11 -2.04 0.00 0.00 179.24 176.10 1mcq n ARG 63 N -3.18 0.00 -2.78 4.15 1.85 -1.26 -4.15 116.66 111.29 1mcq n ARG 63 Ca 0.02 0.43 -0.43 0.00 -1.00 0.00 0.00 57.85 56.87 1mcq n ARG 63 Cb 0.71 -1.54 -0.04 0.00 -1.05 0.00 0.00 32.46 30.54 1mcq n ARG 63 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1mcq s PHE 64 N -2.86 2.78 0.01 2.89 0.08 -0.82 -1.01 117.98 119.06 1mcq s PHE 64 Ca 0.00 0.15 0.00 0.00 0.12 0.00 0.00 56.93 57.21 1mcq s PHE 64 Cb 0.00 -4.14 -0.04 0.00 -0.57 0.00 0.00 43.02 38.27 1mcq s PHE 64 CO 0.00 -1.35 0.07 -1.12 -0.10 0.00 0.00 175.22 172.72 1mcq s SER 65 N 2.75 5.55 0.02 1.36 0.01 -0.29 -4.94 113.70 118.17 1mcq s SER 65 Ca 0.34 0.10 0.08 0.00 1.31 0.00 0.00 55.95 57.78 1mcq s SER 65 Cb -0.11 -1.56 -0.03 0.00 0.21 0.00 0.00 66.02 64.54 1mcq s SER 65 CO 0.22 0.26 -0.25 -0.83 0.41 0.00 0.00 173.24 173.05 1mcq s GLY 66 N -1.78 1.39 -0.13 3.44 0.00 -1.26 -1.14 107.32 107.84 1mcq s GLY 66 Ca 0.23 -1.20 -0.26 0.00 0.00 0.00 0.00 44.72 43.49 1mcq s GLY 66 CO 0.14 -1.06 0.63 -0.56 0.00 0.00 0.00 173.10 172.25 1mcq s SER 67 N -1.04 -0.62 -0.17 1.64 0.01 -0.87 -4.73 113.70 107.92 1mcq s SER 67 Ca 0.11 0.89 -0.04 0.00 1.31 0.00 0.00 55.95 58.23 1mcq s SER 67 Cb -0.10 0.84 0.08 0.00 0.21 0.00 0.00 66.02 67.05 1mcq s SER 67 CO 0.01 -0.43 0.24 -0.75 0.41 0.00 0.00 173.24 172.72 1mcq s LYS 68 N -0.57 0.18 0.48 12.44 2.36 -1.26 0.12 119.74 133.49 1mcq s LYS 68 Ca -0.07 0.44 0.07 0.00 -2.55 0.00 0.00 55.97 53.86 1mcq s LYS 68 Cb -0.02 -0.70 0.02 0.00 -1.05 0.00 0.00 37.83 36.08 1mcq s LYS 68 CO 0.06 -0.51 0.48 0.45 1.55 0.00 0.00 175.35 177.37 1mcq s SER 69 N 2.37 4.99 0.00 1.43 0.15 0.20 -4.95 113.70 117.89 1mcq s SER 69 Ca 0.05 -0.88 0.00 0.00 0.70 0.00 0.00 55.95 55.82 1mcq s SER 69 Cb -0.14 -0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.02 1mcq s SER 69 CO -0.11 -0.91 0.00 0.61 1.20 0.00 0.00 173.24 174.03 1mcq n GLY 70 N -1.76 0.00 1.96 9.45 0.00 -1.26 -0.13 105.19 113.45 1mcq n GLY 70 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.06 1mcq n GLY 70 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1mcq n ASN 71 N 0.00 5.20 -3.60 1.61 4.13 -1.26 -4.71 115.26 116.63 1mcq n ASN 71 Ca 0.00 -3.08 -0.25 0.00 1.68 0.00 0.00 54.58 52.93 1mcq n ASN 71 Cb 0.00 -0.72 -0.17 0.00 -1.54 0.00 0.00 39.78 37.35 1mcq n ASN 71 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1mcq s THR 72 N -2.86 -0.11 0.86 3.41 2.01 0.82 -2.80 115.64 116.97 1mcq s THR 72 Ca 0.54 -0.14 -0.12 0.00 0.31 0.00 0.00 61.69 62.29 1mcq s THR 72 Cb 0.42 -0.57 0.11 0.00 0.01 0.00 0.00 72.50 72.48 1mcq s THR 72 CO 0.14 -0.26 1.11 0.00 -0.69 0.00 0.00 174.62 174.93 1mcq s ALA 73 N 2.16 1.95 0.15 7.40 0.00 0.07 -0.63 121.76 132.86 1mcq s ALA 73 Ca 0.02 -0.34 -0.20 0.00 0.00 0.00 0.00 51.96 51.45 1mcq s ALA 73 Cb -0.16 -3.08 0.05 0.00 0.00 0.00 0.00 23.12 19.93 1mcq s ALA 73 CO -0.09 -2.05 0.52 -1.12 0.00 0.00 0.00 175.76 173.02 1mcq s SER 74 N -3.91 -0.40 -0.21 0.00 0.01 0.12 -1.58 113.70 107.72 1mcq s SER 74 Ca 0.62 -0.18 -0.05 0.00 1.31 0.00 0.00 55.95 57.66 1mcq s SER 74 Cb -0.15 0.55 0.11 0.00 0.21 0.00 0.00 66.02 66.74 1mcq s SER 74 CO 0.54 -0.94 0.39 -0.22 0.41 0.00 0.00 173.24 173.42 1mcq s LEU 75 N -2.79 -0.61 -0.29 2.44 2.96 -0.12 -2.06 118.68 118.22 1mcq s LEU 75 Ca 0.03 0.62 -0.06 0.00 -0.22 0.00 0.00 54.13 54.49 1mcq s LEU 75 Cb 0.00 1.19 0.01 0.00 0.50 0.00 0.00 46.19 47.89 1mcq s LEU 75 CO -0.11 -0.26 0.07 -0.89 -1.32 0.00 0.00 176.35 173.83 1mcq s THR 76 N 2.57 3.86 -0.64 3.68 2.01 -0.29 -1.00 115.64 125.82 1mcq s THR 76 Ca 0.05 -0.76 -0.27 0.00 0.31 0.00 0.00 61.69 61.02 1mcq s THR 76 Cb -0.14 -3.00 0.04 0.00 0.01 0.00 0.00 72.50 69.41 1mcq s THR 76 CO -0.14 0.07 1.17 -0.69 -0.69 0.00 0.00 174.62 174.34 1mcq s VAL 77 N 1.48 3.99 -2.00 3.82 1.01 -0.30 -1.13 120.40 127.26 1mcq s VAL 77 Ca 0.02 0.53 0.02 0.00 0.00 0.00 0.00 61.98 62.55 1mcq s VAL 77 Cb -0.17 -4.77 0.07 0.00 0.00 0.00 0.00 36.38 31.51 1mcq s VAL 77 CO 0.02 -1.51 0.92 -1.20 0.00 0.00 0.00 175.10 173.33 1mcq n SER 78 N 8.58 0.00 0.00 3.32 7.64 -0.18 -1.33 113.62 131.66 1mcq n SER 78 Ca 0.04 -1.57 0.00 0.00 1.01 0.00 0.00 58.87 58.35 1mcq n SER 78 Cb 0.48 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 1mcq n SER 78 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1mcq n GLY 79 N 0.35 -1.54 3.77 0.23 0.00 -1.26 -4.71 105.19 102.03 1mcq n GLY 79 Ca 0.02 0.92 -0.40 0.00 0.00 0.00 0.00 46.02 46.56 1mcq n GLY 79 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mcq s LEU 80 N 0.00 4.16 0.25 0.99 1.43 -1.00 -4.63 118.68 119.87 1mcq s LEU 80 Ca 0.00 2.87 0.11 0.00 -1.03 0.00 0.00 54.13 56.08 1mcq s LEU 80 Cb 0.00 -3.90 -0.05 0.00 0.03 0.00 0.00 46.19 42.27 1mcq s LEU 80 CO 0.00 -1.07 -0.20 -1.10 0.23 0.00 0.00 176.35 174.21 1mcq s GLN 81 N -2.37 1.60 0.46 1.70 -1.52 -1.26 -1.04 119.66 117.23 1mcq s GLN 81 Ca 0.59 -1.69 0.18 0.00 -1.95 0.00 0.00 55.36 52.50 1mcq s GLN 81 Cb -0.43 -1.72 1.15 0.00 -0.22 0.00 0.00 33.01 31.79 1mcq s GLN 81 CO 0.55 0.33 1.96 0.00 -0.25 0.00 0.00 175.29 177.88 1mcq h ALA 82 N 2.55 2.20 -0.10 6.09 0.00 -1.96 -0.48 119.26 127.55 1mcq h ALA 82 Ca -0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1mcq h ALA 82 Cb 1.24 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1mcq h ALA 82 CO 0.57 -0.36 0.00 0.39 0.00 0.00 0.00 179.25 179.85 1mcq n GLU 83 N -4.45 1.33 0.11 0.00 4.71 -1.26 -2.17 120.64 118.91 1mcq n GLU 83 Ca 0.11 -0.50 0.12 0.00 -0.01 0.00 0.00 57.16 56.88 1mcq n GLU 83 Cb 0.50 -1.27 0.20 0.00 -1.01 0.00 0.00 31.44 29.87 1mcq n GLU 83 CO 0.00 0.00 0.00 -0.44 0.09 0.00 0.00 177.13 176.78 1mcq h ASP 84 N 0.94 0.00 -2.31 1.62 3.32 -1.49 -3.45 116.42 115.05 1mcq h ASP 84 Ca 0.00 -0.08 -0.54 0.00 0.02 0.00 0.00 57.03 56.43 1mcq h ASP 84 Cb 0.21 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.78 1mcq h ASP 84 CO 0.00 0.04 1.26 -0.62 -1.72 0.00 0.00 179.24 178.21 1mcq n GLU 85 N -2.42 2.78 0.00 3.56 1.02 -0.92 -4.88 120.64 119.78 1mcq n GLU 85 Ca 0.03 1.00 0.00 0.00 -0.02 0.00 0.00 57.16 58.17 1mcq n GLU 85 Cb 0.47 -3.03 0.00 0.00 -0.02 0.00 0.00 31.44 28.86 1mcq n GLU 85 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1mcq n ALA 86 N 7.97 0.00 -2.70 0.62 0.00 -1.08 -4.83 120.51 120.48 1mcq n ALA 86 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.26 1mcq n ALA 86 Cb 0.41 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.80 1mcq n ALA 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1mcq s ASP 87 N 0.00 6.75 -0.16 0.00 1.01 -0.04 -0.83 116.67 123.40 1mcq s ASP 87 Ca 0.00 0.89 0.02 0.00 0.71 0.00 0.00 52.55 54.17 1mcq s ASP 87 Cb 0.00 -2.33 0.01 0.00 1.01 0.00 0.00 42.92 41.61 1mcq s ASP 87 CO 0.00 -0.09 -0.20 -0.31 0.21 0.00 0.00 175.17 174.77 1mcq s TYR 88 N 1.00 2.72 0.28 4.23 1.51 -0.11 -0.91 117.35 126.08 1mcq s TYR 88 Ca 0.29 -1.40 0.09 0.00 -1.01 0.00 0.00 57.07 55.03 1mcq s TYR 88 Cb -0.16 -1.86 -0.04 0.00 -0.11 0.00 0.00 41.96 39.79 1mcq s TYR 88 CO 0.12 -0.66 0.09 0.71 -1.11 0.00 0.00 175.55 174.70 1mcq s TYR 89 N 0.98 2.79 0.23 2.71 1.51 0.04 -0.88 117.35 124.74 1mcq s TYR 89 Ca -0.03 -0.24 0.10 0.00 -1.01 0.00 0.00 57.07 55.89 1mcq s TYR 89 Cb -0.15 -1.38 -0.05 0.00 -0.11 0.00 0.00 41.96 40.28 1mcq s TYR 89 CO -0.05 0.51 -0.19 0.00 -1.11 0.00 0.00 175.55 174.71 1mcq s SER 91 N -3.25 0.27 -0.07 0.00 0.01 0.42 -0.94 113.70 110.15 1mcq s SER 91 Ca 0.25 -0.32 -0.06 0.00 1.31 0.00 0.00 55.95 57.14 1mcq s SER 91 Cb -0.04 0.05 0.02 0.00 0.21 0.00 0.00 66.02 66.25 1mcq s SER 91 CO 0.11 -0.16 0.18 -0.55 0.41 0.00 0.00 173.24 173.22 1mcq s SER 92 N -0.91 -0.18 -0.46 2.44 0.15 0.14 -1.07 113.70 113.82 1mcq s SER 92 Ca -0.09 0.36 -0.14 0.00 0.70 0.00 0.00 55.95 56.79 1mcq s SER 92 Cb -0.06 0.35 0.07 0.00 -1.71 0.00 0.00 66.02 64.67 1mcq s SER 92 CO -0.00 -0.08 0.36 -0.47 1.20 0.00 0.00 173.24 174.25 1mcq s TYR 93 N 0.26 3.27 -0.76 3.44 5.04 -1.26 -0.47 117.35 126.86 1mcq s TYR 93 Ca -0.01 -1.07 -0.26 0.00 -2.44 0.00 0.00 57.07 53.29 1mcq s TYR 93 Cb -0.03 -3.09 0.02 0.00 0.35 0.00 0.00 41.96 39.22 1mcq s TYR 93 CO -0.01 -0.80 1.47 -2.00 -1.34 0.00 0.00 175.55 172.87 1mcq s GLU 94 N 1.59 3.08 0.00 4.97 2.12 0.13 -4.87 118.70 125.72 1mcq s GLU 94 Ca 0.04 -0.16 0.00 0.00 0.36 0.00 0.00 54.97 55.20 1mcq s GLU 94 Cb -0.24 -4.43 0.00 0.00 0.26 0.00 0.00 34.13 29.73 1mcq s GLU 94 CO 0.06 -2.35 0.00 0.41 -0.54 0.00 0.00 175.26 172.83 1mcq n GLY 95 N 5.73 0.00 5.21 -1.50 0.00 -1.26 -1.84 105.19 111.52 1mcq n GLY 95 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1mcq n GLY 95 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1mcq n SER 96 N 0.00 0.00 -2.86 1.61 7.64 -1.26 -4.50 113.62 114.25 1mcq n SER 96 Ca 0.00 0.00 0.02 0.00 1.01 0.00 0.00 58.87 59.90 1mcq n SER 96 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1mcq n SER 96 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 1mcq s ASP 97 N -1.17 -0.48 -0.43 6.43 1.47 -1.05 -5.01 116.67 116.44 1mcq s ASP 97 Ca 0.00 -0.21 0.04 0.00 1.18 0.00 0.00 52.55 53.57 1mcq s ASP 97 Cb 0.00 0.69 0.17 0.00 -0.34 0.00 0.00 42.92 43.44 1mcq s ASP 97 CO 0.00 -0.06 0.45 0.20 0.68 0.00 0.00 175.17 176.44 1mcq s ASN 98 N 2.06 0.61 -1.08 2.11 0.02 -0.77 -4.98 114.94 112.91 1mcq s ASN 98 Ca 0.16 -2.26 -0.22 0.00 -1.02 0.00 0.00 52.86 49.52 1mcq s ASN 98 Cb 0.02 0.48 0.05 0.00 0.02 0.00 0.00 41.25 41.81 1mcq s ASN 98 CO -0.15 -0.17 1.55 0.12 0.02 0.00 0.00 177.10 178.48 1mcq s PHE 99 N 0.70 2.54 -0.26 2.20 5.36 -1.26 0.19 117.98 127.44 1mcq s PHE 99 Ca 0.27 -0.93 -0.25 0.00 -0.96 0.00 0.00 56.93 55.06 1mcq s PHE 99 Cb -0.03 -4.67 -0.00 0.00 -0.34 0.00 0.00 43.02 37.98 1mcq s PHE 99 CO -0.10 -1.89 0.86 0.08 -1.46 0.00 0.00 175.22 172.71 1mcq s VAL 100 N 5.18 4.79 0.62 3.12 1.01 0.38 -4.93 120.40 130.56 1mcq s VAL 100 Ca 0.50 1.53 -0.05 0.00 0.00 0.00 0.00 61.98 63.95 1mcq s VAL 100 Cb 0.01 -4.16 0.03 0.00 0.00 0.00 0.00 36.38 32.25 1mcq s VAL 100 CO -0.05 -0.16 0.91 -0.36 0.00 0.00 0.00 175.10 175.45 1mcq s PHE 101 N 2.97 3.11 0.45 5.22 0.40 -1.24 -0.68 117.98 128.20 1mcq s PHE 101 Ca 0.36 0.50 0.08 0.00 -0.60 0.00 0.00 56.93 57.27 1mcq s PHE 101 Cb -0.15 -2.87 0.01 0.00 0.51 0.00 0.00 43.02 40.53 1mcq s PHE 101 CO 0.09 -1.00 0.53 0.20 0.70 0.00 0.00 175.22 175.75 1mcq s GLY 102 N -4.38 2.00 0.22 4.36 0.00 -0.12 -0.09 107.32 109.31 1mcq s GLY 102 Ca 0.56 -1.79 0.10 0.00 0.00 0.00 0.00 44.72 43.60 1mcq s GLY 102 CO 0.44 -1.61 1.46 -0.84 0.00 0.00 0.00 173.10 172.55 1mcq h THR 103 N 0.70 1.44 0.00 0.90 2.02 -1.37 -3.43 112.91 113.17 1mcq h THR 103 Ca -0.39 -2.64 0.00 0.00 0.77 0.00 0.00 66.41 64.15 1mcq h THR 103 Cb 1.28 2.46 0.00 0.00 -1.74 0.00 0.00 68.15 70.15 1mcq h THR 103 CO 0.49 0.73 0.00 0.61 0.37 0.00 0.00 175.52 177.72 1mcq n GLY 104 N 0.84 2.47 3.72 2.16 0.00 -1.26 -4.98 105.19 108.14 1mcq n GLY 104 Ca -0.00 -1.54 -0.27 0.00 0.00 0.00 0.00 46.02 44.21 1mcq n GLY 104 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mcq s THR 105 N -0.89 4.07 -0.32 2.61 2.01 -0.06 -4.50 115.64 118.56 1mcq s THR 105 Ca 0.00 -1.22 0.01 0.00 0.31 0.00 0.00 61.69 60.79 1mcq s THR 105 Cb 0.00 -3.04 0.08 0.00 0.01 0.00 0.00 72.50 69.54 1mcq s THR 105 CO 0.00 -0.07 0.02 -0.75 -0.69 0.00 0.00 174.62 173.13 1mcq s LYS 106 N -2.91 2.04 -0.22 4.92 2.20 -1.05 -0.93 119.74 123.78 1mcq s LYS 106 Ca 0.29 -1.56 -0.25 0.00 -0.36 0.00 0.00 55.97 54.09 1mcq s LYS 106 Cb -0.10 -3.19 -0.01 0.00 -1.51 0.00 0.00 37.83 33.03 1mcq s LYS 106 CO 0.20 -0.78 0.83 0.08 -0.36 0.00 0.00 175.35 175.32 1mcq s VAL 107 N 1.09 4.85 -0.17 4.02 1.01 -0.01 -0.84 120.40 130.35 1mcq s VAL 107 Ca 0.01 1.58 -0.03 0.00 0.00 0.00 0.00 61.98 63.55 1mcq s VAL 107 Cb -0.20 -4.12 -0.02 0.00 0.00 0.00 0.00 36.38 32.04 1mcq s VAL 107 CO -0.05 -0.04 -0.07 -0.89 0.00 0.00 0.00 175.10 174.05 1mcq s THR 108 N 2.63 3.39 -0.11 3.92 2.01 0.62 -2.63 115.64 125.47 1mcq s THR 108 Ca 0.36 -0.52 -0.24 0.00 0.31 0.00 0.00 61.69 61.60 1mcq s THR 108 Cb -0.16 -2.49 -0.03 0.00 0.01 0.00 0.00 72.50 69.83 1mcq s THR 108 CO 0.09 0.48 0.73 -0.69 -0.69 0.00 0.00 174.62 174.53 1mcq s VAL 109 N 0.80 5.00 -0.32 3.82 1.01 -1.26 -2.91 120.40 126.55 1mcq s VAL 109 Ca -0.03 1.47 -0.28 0.00 0.00 0.00 0.00 61.98 63.14 1mcq s VAL 109 Cb -0.15 -4.06 -0.02 0.00 0.00 0.00 0.00 36.38 32.16 1mcq s VAL 109 CO 0.01 0.18 1.79 -0.22 0.00 0.00 0.00 175.10 176.87 1mcq s LEU 110 N 1.28 3.53 0.00 3.92 2.96 -0.70 -4.94 118.68 124.73 1mcq s LEU 110 Ca 0.37 1.34 0.00 0.00 -0.22 0.00 0.00 54.13 55.62 1mcq s LEU 110 Cb -0.17 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 42.99 1mcq s LEU 110 CO 0.16 -1.68 0.00 0.61 -1.32 0.00 0.00 176.35 174.12 1mcq n GLY 111 N 5.38 0.68 3.67 7.98 0.00 -1.26 -4.92 105.19 116.72 1mcq n GLY 111 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 1mcq n GLY 111 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1mcq s GLN 112 N 0.00 0.83 0.79 1.61 -1.52 -1.26 -4.97 119.66 115.14 1mcq s GLN 112 Ca 0.00 1.01 -0.15 0.00 -1.95 0.00 0.00 55.36 54.27 1mcq s GLN 112 Cb 0.00 -1.75 0.00 0.00 -0.22 0.00 0.00 33.01 31.05 1mcq s GLN 112 CO 0.00 -2.59 0.65 -2.30 -0.25 0.00 0.00 175.29 170.81 1mcq n PRO 113 N -4.15 0.15 -2.60 2.91 -0.02 -1.26 -4.97 135.00 125.07 1mcq n PRO 113 Ca 0.07 0.10 -0.40 0.00 -2.02 0.00 0.00 63.50 61.26 1mcq n PRO 113 Cb 0.54 -1.98 -0.05 0.00 -0.02 0.00 0.00 33.50 32.00 1mcq n PRO 113 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1mcq s LYS 114 N -3.26 4.74 -0.15 -0.52 2.20 -1.26 -4.81 119.74 116.67 1mcq s LYS 114 Ca 0.65 1.66 -0.04 0.00 -0.36 0.00 0.00 55.97 57.88 1mcq s LYS 114 Cb -0.30 -3.24 0.07 0.00 -1.51 0.00 0.00 37.83 32.85 1mcq s LYS 114 CO 0.58 0.34 0.16 0.00 -0.36 0.00 0.00 175.35 176.07 1mcq s ALA 115 N -1.10 -0.02 0.28 3.13 0.00 0.54 -4.96 121.76 119.63 1mcq s ALA 115 Ca 0.43 0.18 -0.29 0.00 0.00 0.00 0.00 51.96 52.28 1mcq s ALA 115 Cb -0.29 -1.06 -0.09 0.00 0.00 0.00 0.00 23.12 21.68 1mcq s ALA 115 CO 0.37 -0.97 1.05 -0.80 0.00 0.00 0.00 175.76 175.40 1mcq s ASN 116 N 2.26 7.35 0.87 0.00 0.02 -1.26 -1.12 114.94 123.06 1mcq s ASN 116 Ca 0.04 2.15 -0.11 0.00 -1.02 0.00 0.00 52.86 53.93 1mcq s ASN 116 Cb -0.15 -2.62 0.12 0.00 0.02 0.00 0.00 41.25 38.63 1mcq s ASN 116 CO -0.09 -0.07 1.16 -2.16 0.02 0.00 0.00 177.10 175.96 1mcq s PRO 117 N -1.44 1.28 -0.27 -0.60 0.04 -1.26 -4.74 135.00 128.00 1mcq s PRO 117 Ca 0.44 1.59 0.02 0.00 0.04 0.00 0.00 61.00 63.09 1mcq s PRO 117 Cb -0.29 -1.75 0.06 0.00 0.04 0.00 0.00 34.50 32.55 1mcq s PRO 117 CO 0.37 -2.45 -0.08 0.95 0.04 0.00 0.00 177.00 175.84 1mcq s THR 118 N -2.51 2.41 -0.53 1.26 -4.23 -0.46 -4.97 115.64 106.62 1mcq s THR 118 Ca 0.68 -1.57 -0.18 0.00 -1.18 0.00 0.00 61.69 59.44 1mcq s THR 118 Cb -0.24 -2.41 0.08 0.00 1.34 0.00 0.00 72.50 71.27 1mcq s THR 118 CO 0.55 -0.06 0.60 -0.69 -0.54 0.00 0.00 174.62 174.49 1mcq s VAL 119 N 1.14 4.94 -0.27 2.29 1.01 -1.26 -1.67 120.40 126.59 1mcq s VAL 119 Ca -0.08 -0.83 -0.11 0.00 0.00 0.00 0.00 61.98 60.96 1mcq s VAL 119 Cb -0.20 -4.34 -0.05 0.00 0.00 0.00 0.00 36.38 31.80 1mcq s VAL 119 CO -0.04 -0.88 0.20 0.42 0.00 0.00 0.00 175.10 174.80 1mcq s THR 120 N 2.40 5.31 0.08 3.92 -4.23 -0.26 -4.92 115.64 117.94 1mcq s THR 120 Ca 0.11 0.20 -0.20 0.00 -1.18 0.00 0.00 61.69 60.62 1mcq s THR 120 Cb -0.23 -3.54 -0.07 0.00 1.34 0.00 0.00 72.50 70.01 1mcq s THR 120 CO 0.08 0.27 0.60 -0.22 -0.54 0.00 0.00 174.62 174.81 1mcq s LEU 121 N 1.59 4.53 -0.08 4.79 2.96 -1.26 -0.66 118.68 130.55 1mcq s LEU 121 Ca 0.08 1.30 0.04 0.00 -0.22 0.00 0.00 54.13 55.34 1mcq s LEU 121 Cb -0.15 -2.95 -0.01 0.00 0.50 0.00 0.00 46.19 43.58 1mcq s LEU 121 CO 0.09 0.26 -0.22 -0.36 -1.32 0.00 0.00 176.35 174.80 1mcq s PHE 122 N -1.06 2.55 0.55 5.38 0.40 0.13 -4.98 117.98 120.95 1mcq s PHE 122 Ca 0.30 -0.80 -0.01 0.00 -0.60 0.00 0.00 56.93 55.82 1mcq s PHE 122 Cb -0.20 -1.67 0.03 0.00 0.51 0.00 0.00 43.02 41.68 1mcq s PHE 122 CO 0.20 -0.27 0.80 -1.25 0.70 0.00 0.00 175.22 175.40 1mcq s PRO 123 N 0.05 2.66 -0.08 0.24 0.05 -1.26 -1.42 135.00 135.25 1mcq s PRO 123 Ca -0.09 -0.55 -0.34 0.00 0.05 0.00 0.00 61.00 60.06 1mcq s PRO 123 Cb -0.15 -2.44 -0.12 0.00 0.05 0.00 0.00 34.50 31.84 1mcq s PRO 123 CO 0.06 -0.68 1.86 -2.30 0.05 0.00 0.00 177.00 175.99 1mcq n PRO 124 N -2.39 2.14 -0.99 0.56 -0.02 -1.23 -4.89 135.00 128.19 1mcq n PRO 124 Ca 0.06 0.79 -0.34 0.00 -2.02 0.00 0.00 63.50 61.99 1mcq n PRO 124 Cb 0.59 -2.62 0.11 0.00 -0.02 0.00 0.00 33.50 31.56 1mcq n PRO 124 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1mcq n SER 125 N 6.38 -0.71 0.36 2.55 3.41 -1.26 -4.81 113.62 119.54 1mcq n SER 125 Ca 0.22 0.48 -0.17 0.00 -0.26 0.00 0.00 58.87 59.14 1mcq n SER 125 Cb 0.29 -1.32 -0.09 0.00 -0.26 0.00 0.00 64.21 62.83 1mcq n SER 125 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1mcq h SER 126 N -1.10 -0.74 -0.16 4.04 4.64 -1.99 -0.63 113.55 117.61 1mcq h SER 126 Ca -0.45 0.01 0.02 0.00 -0.47 0.00 0.00 61.79 60.91 1mcq h SER 126 Cb 1.30 0.19 -0.04 0.00 -0.31 0.00 0.00 62.40 63.54 1mcq h SER 126 CO 0.40 -0.50 -0.32 -0.33 -0.87 0.00 0.00 176.83 175.21 1mcq h GLU 127 N -0.93 -0.27 -0.54 4.77 5.08 -1.98 0.14 114.58 120.84 1mcq h GLU 127 Ca -0.09 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.35 1mcq h GLU 127 Cb 0.69 0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.93 1mcq h GLU 127 CO 0.15 -0.18 -0.29 0.39 -1.00 0.00 0.00 179.01 178.08 1mcq n GLU 128 N -4.24 -0.21 0.27 2.33 -0.58 -1.11 0.33 120.64 117.43 1mcq n GLU 128 Ca -0.03 0.83 0.11 0.00 -0.42 0.00 0.00 57.16 57.65 1mcq n GLU 128 Cb 0.21 -1.22 0.73 0.00 -0.57 0.00 0.00 31.44 30.59 1mcq n GLU 128 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1mcq h LEU 129 N 0.00 0.00 -0.85 -4.62 3.38 -0.29 0.35 115.31 113.27 1mcq h LEU 129 Ca 0.12 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.00 1mcq h LEU 129 Cb 0.25 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1mcq h LEU 129 CO -0.52 0.07 -0.10 1.56 0.09 0.00 0.00 178.44 179.55 1mcq h GLN 130 N 0.00 0.75 -0.00 1.13 7.50 0.82 -3.19 115.11 122.12 1mcq h GLN 130 Ca -0.00 -0.24 0.00 0.00 0.50 0.00 0.00 58.65 58.91 1mcq h GLN 130 Cb 0.16 -0.07 0.00 0.00 0.05 0.00 0.00 27.48 27.62 1mcq h GLN 130 CO 0.01 0.82 0.00 0.00 -1.50 0.00 0.00 178.83 178.16 1mcq n ALA 131 N -2.48 2.64 -2.03 3.87 0.00 0.12 -4.83 120.51 117.80 1mcq n ALA 131 Ca 0.01 -0.17 -0.13 0.00 0.00 0.00 0.00 53.44 53.15 1mcq n ALA 131 Cb 0.35 -1.40 -0.02 0.00 0.00 0.00 0.00 19.45 18.39 1mcq n ALA 131 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1mcq n ASN 132 N -0.84 -4.30 -4.80 0.00 5.15 -1.00 -5.01 115.26 104.45 1mcq n ASN 132 Ca 0.19 0.08 -0.24 0.00 -0.60 0.00 0.00 54.58 54.01 1mcq n ASN 132 Cb 0.10 -3.35 -0.05 0.00 -0.53 0.00 0.00 39.78 35.94 1mcq n ASN 132 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1mcq s LYS 133 N -4.26 2.87 -0.14 1.20 -0.14 -1.02 -4.78 119.74 113.47 1mcq s LYS 133 Ca 0.00 -1.00 -0.04 0.00 -1.36 0.00 0.00 55.97 53.57 1mcq s LYS 133 Cb 0.00 -2.57 0.06 0.00 -1.68 0.00 0.00 37.83 33.64 1mcq s LYS 133 CO 0.00 0.44 0.13 0.00 -0.76 0.00 0.00 175.35 175.16 1mcq s ALA 134 N -1.97 0.10 -0.06 5.17 0.00 -0.89 -3.88 121.76 120.24 1mcq s ALA 134 Ca 0.32 0.09 -0.01 0.00 0.00 0.00 0.00 51.96 52.36 1mcq s ALA 134 Cb -0.09 -1.00 0.03 0.00 0.00 0.00 0.00 23.12 22.06 1mcq s ALA 134 CO 0.24 -0.95 -0.00 0.99 0.00 0.00 0.00 175.76 176.04 1mcq s THR 135 N 2.22 0.34 0.04 0.00 2.01 -1.26 0.11 115.64 119.10 1mcq s THR 135 Ca 0.04 0.10 -0.04 0.00 0.31 0.00 0.00 61.69 62.10 1mcq s THR 135 Cb -0.15 -0.48 -0.05 0.00 0.01 0.00 0.00 72.50 71.84 1mcq s THR 135 CO -0.08 0.24 0.25 -0.76 -0.69 0.00 0.00 174.62 173.58 1mcq s LEU 136 N 1.72 4.35 -0.05 4.42 1.02 -0.85 -3.48 118.68 125.81 1mcq s LEU 136 Ca 0.01 0.45 -0.02 0.00 0.02 0.00 0.00 54.13 54.59 1mcq s LEU 136 Cb -0.13 -2.84 0.03 0.00 0.02 0.00 0.00 46.19 43.28 1mcq s LEU 136 CO -0.04 0.20 0.08 0.54 0.02 0.00 0.00 176.35 177.15 1mcq s VAL 137 N -1.41 -0.12 -0.54 -1.59 0.11 -0.50 -0.92 120.40 115.42 1mcq s VAL 137 Ca 0.31 0.36 -0.19 0.00 -2.93 0.00 0.00 61.98 59.53 1mcq s VAL 137 Cb -0.13 -0.17 0.08 0.00 -1.53 0.00 0.00 36.38 34.63 1mcq s VAL 137 CO 0.21 0.15 0.64 0.00 -3.33 0.00 0.00 175.10 172.77 1mcq s LEU 139 N 2.59 4.46 -0.23 0.00 0.20 0.16 -1.57 118.68 124.29 1mcq s LEU 139 Ca 0.13 1.48 0.00 0.00 0.69 0.00 0.00 54.13 56.43 1mcq s LEU 139 Cb -0.21 -3.25 0.06 0.00 -0.43 0.00 0.00 46.19 42.36 1mcq s LEU 139 CO 0.10 0.03 -0.03 -0.63 -0.29 0.00 0.00 176.35 175.52 1mcq s ILE 140 N -0.14 1.34 0.41 6.68 1.01 0.06 -1.10 121.20 129.46 1mcq s ILE 140 Ca 0.39 -1.13 0.03 0.00 0.00 0.00 0.00 60.65 59.94 1mcq s ILE 140 Cb -0.21 -1.67 -0.03 0.00 0.01 0.00 0.00 42.46 40.56 1mcq s ILE 140 CO 0.23 -0.15 0.10 -0.94 0.00 0.00 0.00 174.94 174.19 1mcq s SER 141 N 1.48 2.95 -1.48 3.58 1.04 -0.67 -0.68 113.70 119.92 1mcq s SER 141 Ca -0.04 -1.64 -0.12 0.00 0.48 0.00 0.00 55.95 54.63 1mcq s SER 141 Cb -0.18 0.44 0.06 0.00 0.10 0.00 0.00 66.02 66.43 1mcq s SER 141 CO -0.07 -0.88 1.05 0.47 0.98 0.00 0.00 173.24 174.78 1mcq n ASP 142 N -1.23 -5.26 -4.46 7.02 8.00 -0.31 -1.35 116.55 118.96 1mcq n ASP 142 Ca -0.07 -0.71 -0.33 0.00 0.71 0.00 0.00 54.79 54.39 1mcq n ASP 142 Cb 0.65 -4.24 -0.13 0.00 -0.02 0.00 0.00 41.12 37.38 1mcq n ASP 142 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1mcq s PHE 143 N -3.31 2.89 -0.04 1.24 -0.71 -1.10 -4.61 117.98 112.35 1mcq s PHE 143 Ca 0.64 -0.37 -0.00 0.00 -1.04 0.00 0.00 56.93 56.15 1mcq s PHE 143 Cb -0.31 -1.84 0.03 0.00 -1.21 0.00 0.00 43.02 39.69 1mcq s PHE 143 CO 0.80 -0.02 0.02 -0.47 -1.34 0.00 0.00 175.22 174.20 1mcq s TYR 144 N 0.06 0.27 0.96 3.49 6.14 -0.28 -1.09 117.35 126.90 1mcq s TYR 144 Ca -0.03 0.05 -0.12 0.00 0.64 0.00 0.00 57.07 57.61 1mcq s TYR 144 Cb -0.14 -0.45 0.17 0.00 0.42 0.00 0.00 41.96 41.95 1mcq s TYR 144 CO 0.04 -0.16 1.11 -2.14 0.64 0.00 0.00 175.55 175.04 1mcq s PRO 145 N 1.40 0.72 -0.04 4.97 0.02 -1.26 -0.34 135.00 140.47 1mcq s PRO 145 Ca -0.05 0.40 -0.06 0.00 0.02 0.00 0.00 61.00 61.31 1mcq s PRO 145 Cb -0.13 -1.78 -0.23 0.00 0.02 0.00 0.00 34.50 32.38 1mcq s PRO 145 CO -0.03 -2.51 3.50 0.41 -0.33 0.00 0.00 177.00 178.05 1mcq n GLY 146 N -1.61 3.10 2.90 0.52 0.00 -1.26 -4.80 105.19 104.04 1mcq n GLY 146 Ca 0.06 -1.23 -0.11 0.00 0.00 0.00 0.00 46.02 44.73 1mcq n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mcq s ALA 147 N 0.73 0.00 0.15 4.61 0.00 -1.26 -4.65 121.76 121.34 1mcq s ALA 147 Ca 0.64 -0.10 -0.16 0.00 0.00 0.00 0.00 51.96 52.34 1mcq s ALA 147 Cb 0.31 0.02 0.03 0.00 0.00 0.00 0.00 23.12 23.49 1mcq s ALA 147 CO -0.02 -0.04 0.44 0.14 0.00 0.00 0.00 175.76 176.29 1mcq s VAL 148 N -0.30 0.05 -0.11 0.00 -7.23 -1.26 -4.73 120.40 106.82 1mcq s VAL 148 Ca -0.03 -0.68 0.02 0.00 -1.81 0.00 0.00 61.98 59.48 1mcq s VAL 148 Cb -0.02 -1.34 -0.01 0.00 0.56 0.00 0.00 36.38 35.56 1mcq s VAL 148 CO -0.00 -0.23 -0.17 -0.89 -0.31 0.00 0.00 175.10 173.49 1mcq s THR 149 N -3.84 2.72 0.15 5.32 2.01 0.46 -4.88 115.64 117.58 1mcq s THR 149 Ca 0.06 -0.79 0.08 0.00 0.31 0.00 0.00 61.69 61.35 1mcq s THR 149 Cb 0.01 -2.10 -0.04 0.00 0.01 0.00 0.00 72.50 70.37 1mcq s THR 149 CO -0.08 0.54 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.60 1mcq s VAL 150 N 0.21 3.23 -0.00 3.82 1.01 -1.26 -0.12 120.40 127.30 1mcq s VAL 150 Ca -0.11 -1.53 -0.28 0.00 0.00 0.00 0.00 61.98 60.07 1mcq s VAL 150 Cb -0.16 -2.57 0.09 0.00 0.00 0.00 0.00 36.38 33.74 1mcq s VAL 150 CO 0.06 -0.03 0.76 0.00 0.00 0.00 0.00 175.10 175.89 1mcq s ALA 151 N -1.52 -1.76 -0.06 5.51 0.00 -0.36 -4.97 121.76 118.60 1mcq s ALA 151 Ca 0.23 1.07 0.04 0.00 0.00 0.00 0.00 51.96 53.30 1mcq s ALA 151 Cb -0.10 0.22 0.00 0.00 0.00 0.00 0.00 23.12 23.24 1mcq s ALA 151 CO 0.14 -0.54 -0.17 -1.58 0.00 0.00 0.00 175.76 173.61 1mcq s TRP 152 N -2.34 1.82 -0.08 0.00 0.52 -1.26 -0.28 118.94 117.32 1mcq s TRP 152 Ca -0.02 -0.59 0.02 0.00 0.02 0.00 0.00 56.10 55.52 1mcq s TRP 152 Cb -0.01 -1.24 0.01 0.00 -1.15 0.00 0.00 33.47 31.09 1mcq s TRP 152 CO -0.02 -0.23 -0.14 0.15 0.02 0.00 0.00 176.95 176.73 1mcq s LYS 153 N 0.21 1.93 -0.25 4.98 1.02 -0.51 0.31 119.74 127.43 1mcq s LYS 153 Ca -0.08 -0.48 -0.18 0.00 0.02 0.00 0.00 55.97 55.24 1mcq s LYS 153 Cb -0.14 -1.61 -0.03 0.00 -0.52 0.00 0.00 37.83 35.54 1mcq s LYS 153 CO 0.04 0.01 0.53 0.00 -0.92 0.00 0.00 175.35 175.01 1mcq s ALA 154 N 0.76 3.59 -1.44 5.17 0.00 0.94 -0.51 121.76 130.26 1mcq s ALA 154 Ca -0.12 -0.55 -0.02 0.00 0.00 0.00 0.00 51.96 51.27 1mcq s ALA 154 Cb -0.16 -2.90 0.02 0.00 0.00 0.00 0.00 23.12 20.08 1mcq s ALA 154 CO 0.03 -0.71 0.45 -0.25 0.00 0.00 0.00 175.76 175.27 1mcq n ASP 155 N 5.47 -0.63 0.00 0.00 8.00 -0.66 -1.54 116.55 127.20 1mcq n ASP 155 Ca -0.04 -1.01 0.00 0.00 0.71 0.00 0.00 54.79 54.46 1mcq n ASP 155 Cb 0.50 -3.02 0.00 0.00 -0.02 0.00 0.00 41.12 38.58 1mcq n ASP 155 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1mcq n GLY 156 N -1.94 1.99 3.68 0.44 0.00 -1.26 -4.97 105.19 103.14 1mcq n GLY 156 Ca -0.27 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.21 1mcq n GLY 156 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mcq s SER 157 N 0.11 7.09 -0.19 1.61 0.01 -0.59 -4.81 113.70 116.94 1mcq s SER 157 Ca 0.00 1.34 -0.39 0.00 1.31 0.00 0.00 55.95 58.22 1mcq s SER 157 Cb 0.00 -2.50 -0.15 0.00 0.21 0.00 0.00 66.02 63.58 1mcq s SER 157 CO 0.00 -0.42 1.70 -0.81 0.41 0.00 0.00 173.24 174.12 1mcq n PRO 158 N 5.13 1.32 -3.13 12.44 -0.04 -1.26 -0.04 135.00 149.42 1mcq n PRO 158 Ca 0.07 0.48 -0.44 0.00 -0.04 0.00 0.00 63.50 63.57 1mcq n PRO 158 Cb 0.49 -2.18 -0.06 0.00 -0.04 0.00 0.00 33.50 31.70 1mcq n PRO 158 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1mcq s VAL 159 N 3.10 4.83 0.05 0.52 0.11 0.15 -4.74 120.40 124.42 1mcq s VAL 159 Ca 0.95 -0.43 -0.15 0.00 -2.93 0.00 0.00 61.98 59.42 1mcq s VAL 159 Cb -0.99 -4.33 -0.30 0.00 -1.53 0.00 0.00 36.38 29.24 1mcq s VAL 159 CO 0.60 -0.84 1.09 0.50 -3.33 0.00 0.00 175.10 173.13 1mcq h LYS 160 N 9.03 0.62 -6.30 1.54 3.11 -1.91 -3.42 116.57 119.25 1mcq h LYS 160 Ca -0.27 -0.85 -0.55 0.00 -2.81 0.00 0.00 60.65 56.17 1mcq h LYS 160 Cb 1.09 0.28 -0.05 0.00 -1.00 0.00 0.00 32.23 32.56 1mcq h LYS 160 CO 0.98 1.39 1.19 0.00 -2.81 0.00 0.00 179.45 180.20 1mcq s ALA 161 N -2.95 2.72 0.00 5.00 0.00 -1.26 -4.19 121.76 121.08 1mcq s ALA 161 Ca -0.09 -0.36 0.00 0.00 0.00 0.00 0.00 51.96 51.51 1mcq s ALA 161 Cb 0.05 -4.10 0.00 0.00 0.00 0.00 0.00 23.12 19.07 1mcq s ALA 161 CO 0.94 -2.99 0.00 0.41 0.00 0.00 0.00 175.76 174.12 1mcq n GLY 162 N 5.37 1.31 3.94 0.00 0.00 -1.26 -4.79 105.19 109.75 1mcq n GLY 162 Ca 0.17 -0.35 -0.25 0.00 0.00 0.00 0.00 46.02 45.60 1mcq n GLY 162 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1mcq s VAL 163 N -2.00 4.50 -0.27 1.61 -7.23 -1.26 -3.49 120.40 112.26 1mcq s VAL 163 Ca 0.00 -0.28 -0.00 0.00 -1.81 0.00 0.00 61.98 59.88 1mcq s VAL 163 Cb 0.00 -3.68 0.16 0.00 0.56 0.00 0.00 36.38 33.42 1mcq s VAL 163 CO 0.00 -0.53 0.47 -0.70 -0.31 0.00 0.00 175.10 174.03 1mcq s GLU 164 N -4.57 0.45 0.61 4.82 2.56 -0.47 -4.96 118.70 117.15 1mcq s GLU 164 Ca 0.46 0.60 0.01 0.00 0.00 0.00 0.00 54.97 56.04 1mcq s GLU 164 Cb -0.10 -0.06 0.07 0.00 2.00 0.00 0.00 34.13 36.03 1mcq s GLU 164 CO 0.40 -0.75 0.86 0.99 -0.56 0.00 0.00 175.26 176.19 1mcq s THR 165 N 2.67 2.45 0.20 -1.70 2.01 -1.26 -0.49 115.64 119.52 1mcq s THR 165 Ca 0.14 -0.64 0.08 0.00 0.31 0.00 0.00 61.69 61.59 1mcq s THR 165 Cb -0.14 -2.81 -0.05 0.00 0.01 0.00 0.00 72.50 69.51 1mcq s THR 165 CO -0.21 0.00 -0.16 -0.89 -0.69 0.00 0.00 174.62 172.67 1mcq s THR 166 N -2.91 1.81 0.64 -0.82 2.01 0.09 -4.93 115.64 111.54 1mcq s THR 166 Ca 0.61 -2.13 -0.11 0.00 0.31 0.00 0.00 61.69 60.37 1mcq s THR 166 Cb -0.08 -1.99 -0.03 0.00 0.01 0.00 0.00 72.50 70.41 1mcq s THR 166 CO 0.41 -0.49 1.04 -0.54 -0.69 0.00 0.00 174.62 174.34 1mcq s LYS 167 N -3.36 3.43 0.75 4.92 1.02 -1.26 -4.58 119.74 120.66 1mcq s LYS 167 Ca 0.21 0.67 -0.15 0.00 0.02 0.00 0.00 55.97 56.72 1mcq s LYS 167 Cb -0.03 -2.07 0.01 0.00 -0.52 0.00 0.00 37.83 35.22 1mcq s LYS 167 CO 0.07 -0.67 0.84 -2.30 -0.92 0.00 0.00 175.35 172.37 1mcq n PRO 168 N -2.80 0.35 -4.05 -1.68 -0.02 -1.26 -4.63 135.00 120.90 1mcq n PRO 168 Ca 0.06 0.17 -0.09 0.00 -2.02 0.00 0.00 63.50 61.62 1mcq n PRO 168 Cb 0.55 -2.12 -0.09 0.00 -0.02 0.00 0.00 33.50 31.82 1mcq n PRO 168 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1mcq s SER 169 N -1.68 0.22 0.06 2.55 0.01 -0.82 -4.91 113.70 109.14 1mcq s SER 169 Ca 0.70 -1.02 -0.14 0.00 1.31 0.00 0.00 55.95 56.80 1mcq s SER 169 Cb -0.33 0.34 -0.06 0.00 0.21 0.00 0.00 66.02 66.18 1mcq s SER 169 CO 0.54 -0.77 0.46 -0.54 0.41 0.00 0.00 173.24 173.33 1mcq s LYS 170 N -3.99 3.92 0.59 12.44 -0.14 -1.26 -0.97 119.74 130.33 1mcq s LYS 170 Ca 0.18 0.41 0.08 0.00 -1.36 0.00 0.00 55.97 55.28 1mcq s LYS 170 Cb 0.06 -3.09 0.09 0.00 -1.68 0.00 0.00 37.83 33.20 1mcq s LYS 170 CO -0.01 0.60 0.81 -0.65 -0.76 0.00 0.00 175.35 175.34 1mcq s GLN 171 N -1.52 2.24 0.59 1.68 -0.21 0.19 -4.89 119.66 117.73 1mcq s GLN 171 Ca 0.30 -1.56 0.38 0.00 0.02 0.00 0.00 55.36 54.50 1mcq s GLN 171 Cb -0.16 -2.61 2.05 0.00 1.00 0.00 0.00 33.01 33.29 1mcq s GLN 171 CO 0.17 -0.92 2.15 0.66 -2.12 0.00 0.00 175.29 175.23 1mcq h SER 172 N 0.10 0.00 -0.34 5.90 4.64 -1.99 -2.19 113.55 119.67 1mcq h SER 172 Ca -0.31 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.98 1mcq h SER 172 Cb 1.29 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.36 1mcq h SER 172 CO 0.41 0.00 0.01 -0.46 -0.87 0.00 0.00 176.83 175.92 1mcq n ASN 173 N -2.86 4.04 0.00 4.97 6.94 -1.26 -4.97 115.26 122.13 1mcq n ASN 173 Ca -0.03 -3.09 0.00 0.00 -0.02 0.00 0.00 54.58 51.44 1mcq n ASN 173 Cb 0.10 -0.58 0.00 0.00 -2.36 0.00 0.00 39.78 36.93 1mcq n ASN 173 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1mcq n ASN 174 N -0.42 0.00 -4.91 0.53 3.02 -0.83 -4.95 115.26 107.72 1mcq n ASN 174 Ca 0.25 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.52 1mcq n ASN 174 Cb 0.98 -0.33 0.05 0.00 -0.61 0.00 0.00 39.78 39.87 1mcq n ASN 174 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1mcq s LYS 175 N 0.00 2.60 0.44 3.52 1.02 -1.26 -4.71 119.74 121.35 1mcq s LYS 175 Ca 0.00 0.13 0.08 0.00 0.02 0.00 0.00 55.97 56.20 1mcq s LYS 175 Cb 0.00 -2.11 0.02 0.00 -0.52 0.00 0.00 37.83 35.22 1mcq s LYS 175 CO 0.00 -1.07 0.60 0.71 -0.92 0.00 0.00 175.35 174.67 1mcq s TYR 176 N -3.26 2.62 -0.18 3.18 1.51 -0.25 -0.64 117.35 120.32 1mcq s TYR 176 Ca 0.58 -0.44 -0.07 0.00 -1.01 0.00 0.00 57.07 56.13 1mcq s TYR 176 Cb -0.11 -2.36 0.08 0.00 -0.11 0.00 0.00 41.96 39.46 1mcq s TYR 176 CO 0.48 -0.52 0.38 0.00 -1.11 0.00 0.00 175.55 174.78 1mcq s ALA 177 N -2.39 -1.00 0.05 3.71 0.00 -0.14 -1.16 121.76 120.83 1mcq s ALA 177 Ca 0.56 1.38 0.05 0.00 0.00 0.00 0.00 51.96 53.95 1mcq s ALA 177 Cb -0.09 -1.18 -0.03 0.00 0.00 0.00 0.00 23.12 21.82 1mcq s ALA 177 CO 0.34 -0.64 -0.15 0.00 0.00 0.00 0.00 175.76 175.31 1mcq s ALA 178 N 2.34 1.28 -0.01 0.00 0.00 0.14 -1.94 121.76 123.57 1mcq s ALA 178 Ca -0.03 -0.93 0.07 0.00 0.00 0.00 0.00 51.96 51.07 1mcq s ALA 178 Cb -0.11 -0.18 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 1mcq s ALA 178 CO -0.12 0.23 -0.21 0.45 0.00 0.00 0.00 175.76 176.12 1mcq s SER 179 N -1.38 2.45 -0.02 0.00 0.15 -1.26 -0.76 113.70 112.88 1mcq s SER 179 Ca 0.02 -0.39 0.01 0.00 0.70 0.00 0.00 55.95 56.28 1mcq s SER 179 Cb -0.09 -0.26 0.02 0.00 -1.71 0.00 0.00 66.02 63.98 1mcq s SER 179 CO 0.02 0.25 -0.01 -0.55 1.20 0.00 0.00 173.24 174.15 1mcq s SER 180 N -0.57 0.40 0.49 5.45 0.15 -0.61 -0.73 113.70 118.28 1mcq s SER 180 Ca 0.08 -0.03 0.02 0.00 0.70 0.00 0.00 55.95 56.71 1mcq s SER 180 Cb -0.08 -0.19 -0.01 0.00 -1.71 0.00 0.00 66.02 64.03 1mcq s SER 180 CO -0.00 -0.07 0.04 -0.72 1.20 0.00 0.00 173.24 173.68 1mcq s TYR 181 N 0.82 1.81 -0.06 3.44 -0.85 0.36 -0.28 117.35 122.59 1mcq s TYR 181 Ca -0.08 -1.07 -0.12 0.00 -0.52 0.00 0.00 57.07 55.28 1mcq s TYR 181 Cb -0.11 -1.48 0.02 0.00 0.38 0.00 0.00 41.96 40.77 1mcq s TYR 181 CO -0.01 0.06 0.28 -1.17 -1.52 0.00 0.00 175.55 173.19 1mcq s LEU 182 N -3.82 0.95 -0.02 -3.49 0.20 -0.10 -1.37 118.68 111.04 1mcq s LEU 182 Ca 0.09 0.28 0.07 0.00 0.69 0.00 0.00 54.13 55.26 1mcq s LEU 182 Cb 0.01 1.08 -0.02 0.00 -0.43 0.00 0.00 46.19 46.83 1mcq s LEU 182 CO 0.05 -0.28 -0.22 -0.44 -0.29 0.00 0.00 176.35 175.18 1mcq s SER 183 N -0.65 2.57 0.12 3.68 0.01 -1.23 -2.01 113.70 116.18 1mcq s SER 183 Ca -0.08 -0.40 -0.01 0.00 1.31 0.00 0.00 55.95 56.78 1mcq s SER 183 Cb -0.04 -0.30 -0.04 0.00 0.21 0.00 0.00 66.02 65.85 1mcq s SER 183 CO 0.02 0.27 0.03 -0.76 0.41 0.00 0.00 173.24 173.20 1mcq s LEU 184 N -0.50 2.00 -0.21 2.44 2.01 0.29 -4.88 118.68 119.83 1mcq s LEU 184 Ca 0.08 -1.15 -0.19 0.00 0.01 0.00 0.00 54.13 52.88 1mcq s LEU 184 Cb -0.09 0.23 -0.03 0.00 0.01 0.00 0.00 46.19 46.31 1mcq s LEU 184 CO -0.01 -0.67 0.53 0.42 1.01 0.00 0.00 176.35 177.63 1mcq s THR 185 N -3.96 5.09 0.54 5.49 -4.23 -1.26 -2.08 115.64 115.22 1mcq s THR 185 Ca 0.20 0.96 0.36 0.00 -1.18 0.00 0.00 61.69 62.03 1mcq s THR 185 Cb 0.07 -3.85 0.55 0.00 1.34 0.00 0.00 72.50 70.61 1mcq s THR 185 CO -0.01 0.15 1.81 -0.65 -0.54 0.00 0.00 174.62 175.37 1mcq h PRO 186 N 7.59 0.01 0.43 3.99 0.11 -1.86 1.32 132.00 143.58 1mcq h PRO 186 Ca -0.32 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.77 1mcq h PRO 186 Cb 1.15 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1mcq h PRO 186 CO 0.74 0.00 -0.24 0.93 -0.21 0.00 0.00 178.00 179.23 1mcq h GLU 187 N 0.01 -0.60 0.00 1.05 4.39 -1.93 -1.07 114.58 116.43 1mcq h GLU 187 Ca 0.56 0.04 0.00 0.00 0.34 0.00 0.00 59.36 60.30 1mcq h GLU 187 Cb 2.24 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 31.02 1mcq h GLU 187 CO -0.01 -0.40 0.00 -0.56 -1.16 0.00 0.00 179.01 176.88 1mcq h GLN 188 N -0.62 0.00 0.65 2.33 3.07 0.12 0.31 115.11 120.97 1mcq h GLN 188 Ca -0.05 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.66 1mcq h GLN 188 Cb 0.50 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.06 1mcq h GLN 188 CO 0.07 0.00 -0.31 2.35 0.09 0.00 0.00 178.83 181.02 1mcq h TRP 189 N 0.00 -0.81 -0.18 0.06 -0.00 -0.56 -3.26 115.95 111.21 1mcq h TRP 189 Ca 0.00 -0.02 -0.11 0.00 -0.00 0.00 0.00 58.89 58.76 1mcq h TRP 189 Cb 0.31 0.27 -0.05 0.00 -0.00 0.00 0.00 29.16 29.69 1mcq h TRP 189 CO 0.00 -0.46 0.14 0.36 -0.00 0.00 0.00 178.44 178.47 1mcq n LYS 190 N -5.39 1.26 -0.18 2.65 -0.00 0.97 -3.67 118.16 113.80 1mcq n LYS 190 Ca -0.12 -0.56 0.09 0.00 -0.00 0.00 0.00 58.31 57.72 1mcq n LYS 190 Cb 0.37 -1.22 0.17 0.00 -0.00 0.00 0.00 35.03 34.35 1mcq n LYS 190 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1mcq n SER 191 N 0.67 2.81 -3.73 -5.58 3.41 -0.56 -4.98 113.62 105.66 1mcq n SER 191 Ca 0.11 -3.04 -0.14 0.00 -0.26 0.00 0.00 58.87 55.55 1mcq n SER 191 Cb 0.61 -0.45 -0.09 0.00 -0.26 0.00 0.00 64.21 64.02 1mcq n SER 191 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1mcq s HIS 192 N -2.81 -0.37 -0.02 7.33 3.76 -1.24 -5.07 115.29 116.87 1mcq s HIS 192 Ca 0.34 0.80 -0.25 0.00 -0.15 0.00 0.00 55.06 55.80 1mcq s HIS 192 Cb 0.29 0.15 -0.19 0.00 1.11 0.00 0.00 32.58 33.95 1mcq s HIS 192 CO 0.05 -0.31 1.22 0.00 -0.85 0.00 0.00 174.74 174.84 1mcq h ARG 193 N 4.69 -0.11 -5.17 1.40 3.08 -1.94 -3.40 114.38 112.93 1mcq h ARG 193 Ca -0.28 0.01 -0.52 0.00 0.07 0.00 0.00 59.98 59.25 1mcq h ARG 193 Cb 1.18 0.03 -0.14 0.00 0.08 0.00 0.00 29.97 31.12 1mcq h ARG 193 CO 0.32 0.31 -0.57 -1.54 -1.07 0.00 0.00 179.97 177.42 1mcq s SER 194 N -5.51 2.71 -0.13 7.04 1.04 -1.26 -3.67 113.70 113.92 1mcq s SER 194 Ca -0.15 -1.51 -0.06 0.00 0.48 0.00 0.00 55.95 54.71 1mcq s SER 194 Cb 0.02 0.17 0.06 0.00 0.10 0.00 0.00 66.02 66.37 1mcq s SER 194 CO 0.62 -0.74 0.29 -0.31 0.98 0.00 0.00 173.24 174.08 1mcq s TYR 195 N -3.22 -0.45 -0.17 5.02 2.02 0.68 -1.65 117.35 119.58 1mcq s TYR 195 Ca 0.29 1.00 -0.04 0.00 -0.37 0.00 0.00 57.07 57.95 1mcq s TYR 195 Cb 0.06 0.08 -0.02 0.00 -0.40 0.00 0.00 41.96 41.67 1mcq s TYR 195 CO 0.14 -0.31 -0.03 -1.12 -1.57 0.00 0.00 175.55 172.66 1mcq s SER 196 N 1.78 4.74 -0.20 2.29 0.01 0.33 0.13 113.70 122.77 1mcq s SER 196 Ca -0.05 -0.18 -0.09 0.00 1.31 0.00 0.00 55.95 56.94 1mcq s SER 196 Cb -0.11 -1.78 -0.05 0.00 0.21 0.00 0.00 66.02 64.29 1mcq s SER 196 CO -0.10 0.12 0.12 0.00 0.41 0.00 0.00 173.24 173.79 1mcq s GLN 198 N 0.54 0.42 -0.23 0.00 0.74 0.62 -0.95 119.66 120.79 1mcq s GLN 198 Ca 0.07 -0.33 -0.02 0.00 0.05 0.00 0.00 55.36 55.12 1mcq s GLN 198 Cb -0.12 -1.96 0.01 0.00 1.10 0.00 0.00 33.01 32.05 1mcq s GLN 198 CO 0.00 -0.69 -0.07 0.08 -0.55 0.00 0.00 175.29 174.07 1mcq s VAL 199 N 1.96 2.97 -0.10 1.34 1.01 0.07 -1.23 120.40 126.43 1mcq s VAL 199 Ca 0.01 -0.83 -0.16 0.00 0.00 0.00 0.00 61.98 61.00 1mcq s VAL 199 Cb -0.17 -2.43 -0.05 0.00 0.00 0.00 0.00 36.38 33.74 1mcq s VAL 199 CO -0.11 0.31 0.41 -0.89 0.00 0.00 0.00 175.10 174.83 1mcq s THR 200 N 1.38 5.18 -0.46 3.92 2.01 0.83 -1.00 115.64 127.49 1mcq s THR 200 Ca 0.03 0.82 0.07 0.00 0.31 0.00 0.00 61.69 62.91 1mcq s THR 200 Cb -0.15 -3.74 0.24 0.00 0.01 0.00 0.00 72.50 68.86 1mcq s THR 200 CO -0.05 0.41 0.77 1.57 -0.69 0.00 0.00 174.62 176.63 1mcq n HIS 201 N 3.17 -2.45 -2.49 4.92 -0.00 0.28 -0.41 115.22 118.24 1mcq n HIS 201 Ca -0.10 -2.30 -0.03 0.00 -0.00 0.00 0.00 57.72 55.29 1mcq n HIS 201 Cb 0.52 0.98 0.00 0.00 -0.00 0.00 0.00 29.99 31.50 1mcq n HIS 201 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.34 175.49 1mcq n GLU 202 N 1.60 -1.30 0.00 1.57 0.28 -1.26 -4.18 120.64 117.35 1mcq n GLU 202 Ca 0.13 1.42 0.00 0.00 -0.16 0.00 0.00 57.16 58.55 1mcq n GLU 202 Cb 0.60 -4.39 0.00 0.00 1.43 0.00 0.00 31.44 29.08 1mcq n GLU 202 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1mcq n GLY 203 N -0.89 1.92 3.47 -1.84 0.00 -1.26 -4.94 105.19 101.66 1mcq n GLY 203 Ca 0.05 -0.58 -0.48 0.00 0.00 0.00 0.00 46.02 45.00 1mcq n GLY 203 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1mcq n SER 204 N 4.03 2.22 -4.41 1.61 7.64 -1.26 -4.92 113.62 118.52 1mcq n SER 204 Ca 0.00 0.31 -0.33 0.00 1.01 0.00 0.00 58.87 59.86 1mcq n SER 204 Cb 0.00 -1.31 -0.14 0.00 -1.01 0.00 0.00 64.21 61.75 1mcq n SER 204 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1mcq s THR 205 N 7.87 3.03 -0.03 0.44 2.01 -1.26 -0.55 115.64 127.14 1mcq s THR 205 Ca 1.09 -0.70 0.04 0.00 0.31 0.00 0.00 61.69 62.44 1mcq s THR 205 Cb -0.76 -2.24 -0.01 0.00 0.01 0.00 0.00 72.50 69.51 1mcq s THR 205 CO 0.46 0.55 -0.16 -0.69 -0.69 0.00 0.00 174.62 174.08 1mcq s VAL 206 N -0.07 1.34 -0.08 3.82 1.01 -0.17 -4.99 120.40 121.25 1mcq s VAL 206 Ca -0.02 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.30 1mcq s VAL 206 Cb -0.14 -1.14 0.01 0.00 0.00 0.00 0.00 36.38 35.11 1mcq s VAL 206 CO 0.04 0.39 -0.17 -0.70 0.00 0.00 0.00 175.10 174.65 1mcq s GLU 207 N -0.11 2.28 0.36 2.72 2.12 -1.26 -0.75 118.70 124.06 1mcq s GLU 207 Ca 0.00 -0.61 0.08 0.00 0.36 0.00 0.00 54.97 54.80 1mcq s GLU 207 Cb -0.09 -1.79 -0.04 0.00 0.26 0.00 0.00 34.13 32.46 1mcq s GLU 207 CO 0.01 0.09 0.14 0.15 -0.54 0.00 0.00 175.26 175.12 1mcq s LYS 208 N 0.52 2.31 -0.23 4.30 -0.14 -0.13 -4.98 119.74 121.40 1mcq s LYS 208 Ca -0.16 -1.63 -0.03 0.00 -1.36 0.00 0.00 55.97 52.78 1mcq s LYS 208 Cb -0.17 -2.12 0.12 0.00 -1.68 0.00 0.00 37.83 33.98 1mcq s LYS 208 CO 0.06 0.05 0.31 0.99 -0.76 0.00 0.00 175.35 176.00 1mcq s THR 209 N -2.47 -0.47 0.17 2.17 2.01 -1.26 -1.46 115.64 114.32 1mcq s THR 209 Ca 0.38 -0.12 -0.14 0.00 0.31 0.00 0.00 61.69 62.12 1mcq s THR 209 Cb -0.01 -0.77 -0.07 0.00 0.01 0.00 0.00 72.50 71.66 1mcq s THR 209 CO 0.22 -0.18 0.56 0.68 -0.69 0.00 0.00 174.62 175.22 1mcq s VAL 210 N 2.44 4.85 -0.01 3.82 -7.23 0.12 -4.85 120.40 119.54 1mcq s VAL 210 Ca 0.10 0.81 0.03 0.00 -1.81 0.00 0.00 61.98 61.10 1mcq s VAL 210 Cb -0.15 -3.72 -0.00 0.00 0.56 0.00 0.00 36.38 33.06 1mcq s VAL 210 CO -0.16 0.18 -0.08 0.00 -0.31 0.00 0.00 175.10 174.73 1mcq s ALA 211 N -1.54 0.74 0.09 1.32 0.00 -1.26 -0.23 121.76 120.88 1mcq s ALA 211 Ca 0.40 -0.35 -0.31 0.00 0.00 0.00 0.00 51.96 51.70 1mcq s ALA 211 Cb -0.14 -0.22 -0.07 0.00 0.00 0.00 0.00 23.12 22.68 1mcq s ALA 211 CO 0.19 0.16 1.40 -1.25 0.00 0.00 0.00 175.76 176.26 1mcq s PRO 212 N -0.07 4.31 0.16 0.00 0.04 -1.24 -5.03 135.00 133.16 1mcq s PRO 212 Ca 0.01 2.06 0.07 0.00 0.04 0.00 0.00 61.00 63.19 1mcq s PRO 212 Cb -0.05 -3.32 -0.04 0.00 0.04 0.00 0.00 34.50 31.13 1mcq s PRO 212 CO -0.00 -0.47 -0.15 0.99 0.04 0.00 0.00 177.00 177.40 1mcq s THR 213 N 1.40 1.59 -0.13 1.26 2.01 -1.26 -5.10 115.64 115.42 1mcq s THR 213 Ca 0.65 -1.92 0.00 0.00 0.31 0.00 0.00 61.69 60.73 1mcq s THR 213 Cb -0.36 -1.78 0.02 0.00 0.01 0.00 0.00 72.50 70.39 1mcq s THR 213 CO 0.30 -0.44 -0.12 -1.61 -0.69 0.00 0.00 174.62 172.06 1mcq s GLU 214 N -3.00 1.99 0.58 4.92 8.01 -1.26 -5.01 118.70 124.94 1mcq s GLU 214 Ca 0.15 -0.44 0.29 0.00 0.01 0.00 0.00 54.97 54.97 1mcq s GLU 214 Cb -0.04 -1.86 1.78 0.00 -4.31 0.00 0.00 34.13 29.70 1mcq s GLU 214 CO 0.05 -0.21 2.25 0.00 0.01 0.00 0.00 175.26 177.35