#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mcg s ALA 3 N 0.00 3.79 -0.26 -0.43 0.00 -1.26 -4.40 121.76 119.20 3mcg s ALA 3 Ca 0.00 -1.20 0.03 0.00 0.00 0.00 0.00 51.96 50.79 3mcg s ALA 3 Cb 0.00 -1.58 0.06 0.00 0.00 0.00 0.00 23.12 21.60 3mcg s ALA 3 CO 0.00 0.40 -0.09 -1.17 0.00 0.00 0.00 175.76 174.90 3mcg s LEU 4 N -3.51 3.44 0.21 0.00 2.96 -1.24 -4.88 118.68 115.66 3mcg s LEU 4 Ca 0.33 -1.43 -0.31 0.00 -0.22 0.00 0.00 54.13 52.50 3mcg s LEU 4 Cb -0.10 -1.51 -0.10 0.00 0.50 0.00 0.00 46.19 44.98 3mcg s LEU 4 CO 0.27 -0.21 1.52 -0.89 -1.32 0.00 0.00 176.35 175.72 3mcg s THR 5 N 1.12 2.58 -0.22 3.68 2.01 -0.42 -3.56 115.64 120.83 3mcg s THR 5 Ca -0.07 0.45 -0.29 0.00 0.31 0.00 0.00 61.69 62.08 3mcg s THR 5 Cb -0.20 -3.29 0.15 0.00 0.01 0.00 0.00 72.50 69.18 3mcg s THR 5 CO -0.05 0.05 1.15 -1.58 -0.69 0.00 0.00 174.62 173.50 3mcg s GLN 6 N 0.42 0.37 0.92 4.92 0.74 -1.25 0.06 119.66 125.85 3mcg s GLN 6 Ca 0.65 0.13 -0.12 0.00 0.05 0.00 0.00 55.36 56.07 3mcg s GLN 6 Cb -0.43 0.17 0.14 0.00 1.10 0.00 0.00 33.01 33.99 3mcg s GLN 6 CO 0.37 -0.11 1.10 -2.14 -0.55 0.00 0.00 175.29 173.96 3mcg s PRO 7 N -0.91 1.05 0.02 1.67 0.02 -1.26 -4.79 135.00 130.80 3mcg s PRO 7 Ca 0.03 0.67 0.22 0.00 0.02 0.00 0.00 61.00 61.94 3mcg s PRO 7 Cb -0.01 -1.80 -0.12 0.00 0.02 0.00 0.00 34.50 32.59 3mcg s PRO 7 CO -0.03 -2.35 0.85 -0.35 -0.33 0.00 0.00 177.00 174.79 3mcg n PRO 8 N -3.93 0.33 -3.65 5.54 -0.04 -1.26 -2.97 135.00 129.02 3mcg n PRO 8 Ca 0.06 -0.05 -0.06 0.00 -0.04 0.00 0.00 63.50 63.41 3mcg n PRO 8 Cb 0.56 -1.56 -0.07 0.00 -0.04 0.00 0.00 33.50 32.39 3mcg n PRO 8 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3mcg s SER 9 N -3.92 -0.85 0.12 3.54 1.04 -1.22 -2.93 113.70 109.48 3mcg s SER 9 Ca 0.01 1.37 0.03 0.00 0.48 0.00 0.00 55.95 57.84 3mcg s SER 9 Cb 0.14 1.50 -0.04 0.00 0.10 0.00 0.00 66.02 67.72 3mcg s SER 9 CO 0.85 -0.23 0.19 0.00 0.98 0.00 0.00 173.24 175.03 3mcg s ALA 10 N 2.00 3.79 0.17 5.32 0.00 -1.25 -4.97 121.76 126.82 3mcg s ALA 10 Ca -0.08 -1.04 -0.03 0.00 0.00 0.00 0.00 51.96 50.80 3mcg s ALA 10 Cb -0.08 -1.61 -0.03 0.00 0.00 0.00 0.00 23.12 21.40 3mcg s ALA 10 CO -0.18 0.63 0.15 -1.12 0.00 0.00 0.00 175.76 175.24 3mcg s SER 11 N -2.89 0.18 0.00 0.00 0.01 -1.26 0.38 113.70 110.12 3mcg s SER 11 Ca 0.33 -1.18 0.00 0.00 1.31 0.00 0.00 55.95 56.41 3mcg s SER 11 Cb -0.11 0.37 0.00 0.00 0.21 0.00 0.00 66.02 66.48 3mcg s SER 11 CO 0.26 -0.82 0.00 0.61 0.41 0.00 0.00 173.24 173.70 3mcg n GLY 12 N -0.19 -0.31 0.00 3.44 0.00 0.22 -4.80 105.19 103.55 3mcg n GLY 12 Ca -0.03 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.62 3mcg n GLY 12 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3mcg n SER 13 N 1.09 0.00 0.00 1.61 3.41 -1.26 -1.25 113.62 117.23 3mcg n SER 13 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3mcg n SER 13 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3mcg n SER 13 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3mcg n LEU 14 N 0.00 0.00 -0.03 1.04 -0.00 -1.26 -4.20 117.00 112.55 3mcg n LEU 14 Ca 0.00 -0.11 -0.20 0.00 -0.00 0.00 0.00 56.01 55.71 3mcg n LEU 14 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.28 3mcg n LEU 14 CO 0.00 0.12 -0.93 0.61 -0.00 0.00 0.00 177.39 177.19 3mcg n GLY 15 N 0.00 -0.54 0.00 1.47 0.00 -1.25 -4.62 105.19 100.25 3mcg n GLY 15 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.77 3mcg n GLY 15 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3mcg n GLN 16 N -3.39 0.00 -3.86 1.61 7.27 -1.26 -4.85 117.38 112.90 3mcg n GLN 16 Ca -0.35 0.00 -0.12 0.00 0.07 0.00 0.00 57.00 56.61 3mcg n GLN 16 Cb 1.04 0.00 -0.13 0.00 2.41 0.00 0.00 30.24 33.56 3mcg n GLN 16 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 3mcg s SER 17 N -0.35 -0.04 0.03 1.69 0.01 -1.26 0.02 113.70 113.81 3mcg s SER 17 Ca 0.00 0.07 0.07 0.00 1.31 0.00 0.00 55.95 57.40 3mcg s SER 17 Cb 0.00 0.12 -0.03 0.00 0.21 0.00 0.00 66.02 66.32 3mcg s SER 17 CO 0.00 -0.05 -0.19 -0.69 0.41 0.00 0.00 173.24 172.71 3mcg s VAL 18 N -0.12 2.68 -0.14 3.43 1.01 0.62 -4.91 120.40 122.98 3mcg s VAL 18 Ca -0.02 -1.19 -0.01 0.00 0.00 0.00 0.00 61.98 60.77 3mcg s VAL 18 Cb -0.01 -2.10 0.03 0.00 0.00 0.00 0.00 36.38 34.30 3mcg s VAL 18 CO 0.00 0.36 -0.06 0.42 0.00 0.00 0.00 175.10 175.83 3mcg s THR 19 N -0.88 0.99 -0.12 3.92 -4.23 -1.26 -0.41 115.64 113.64 3mcg s THR 19 Ca 0.14 -0.42 -0.12 0.00 -1.18 0.00 0.00 61.69 60.11 3mcg s THR 19 Cb -0.10 -1.11 -0.05 0.00 1.34 0.00 0.00 72.50 72.58 3mcg s THR 19 CO 0.04 0.23 0.26 0.27 -0.54 0.00 0.00 174.62 174.89 3mcg s ILE 20 N 1.70 5.31 -0.38 2.99 -4.36 0.87 -4.91 121.20 122.42 3mcg s ILE 20 Ca 0.03 0.49 -0.06 0.00 -0.26 0.00 0.00 60.65 60.85 3mcg s ILE 20 Cb -0.14 -3.57 0.08 0.00 1.25 0.00 0.00 42.46 40.07 3mcg s ILE 20 CO -0.08 0.49 0.18 -0.44 0.24 0.00 0.00 174.94 175.32 3mcg s SER 21 N -0.21 5.36 -0.65 4.36 0.01 -1.26 0.37 113.70 121.68 3mcg s SER 21 Ca 0.17 -1.55 -0.16 0.00 1.31 0.00 0.00 55.95 55.72 3mcg s SER 21 Cb -0.13 -1.88 0.16 0.00 0.21 0.00 0.00 66.02 64.38 3mcg s SER 21 CO 0.05 -0.46 0.63 0.00 0.41 0.00 0.00 173.24 173.88 3mcg s THR 23 N 1.30 3.92 0.06 0.00 -1.32 0.11 -0.69 115.64 119.02 3mcg s THR 23 Ca 0.10 -0.37 -0.01 0.00 -1.21 0.00 0.00 61.69 60.19 3mcg s THR 23 Cb -0.22 -2.66 0.01 0.00 -1.51 0.00 0.00 72.50 68.11 3mcg s THR 23 CO -0.01 0.56 0.11 0.61 -2.21 0.00 0.00 174.62 173.68 3mcg n GLY 24 N 2.74 2.33 3.74 6.08 0.00 -0.24 -1.30 105.19 118.55 3mcg n GLY 24 Ca -0.18 -1.21 -0.37 0.00 0.00 0.00 0.00 46.02 44.26 3mcg n GLY 24 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3mcg s THR 25 N -2.70 2.26 0.61 2.61 -4.23 -1.26 -4.69 115.64 108.24 3mcg s THR 25 Ca 0.04 0.16 0.34 0.00 -1.18 0.00 0.00 61.69 61.04 3mcg s THR 25 Cb -0.01 -3.07 0.38 0.00 1.34 0.00 0.00 72.50 71.15 3mcg s THR 25 CO 0.03 -0.03 2.26 0.28 -0.54 0.00 0.00 174.62 176.62 3mcg h SER 26 N 0.72 0.00 0.25 3.99 0.02 -1.91 0.11 113.55 116.74 3mcg h SER 26 Ca -0.51 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.44 3mcg h SER 26 Cb 1.32 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.85 3mcg h SER 26 CO 0.54 0.00 -0.25 -1.28 -1.14 0.00 0.00 176.83 174.70 3mcg h SER 27 N 0.00 -0.69 0.52 3.07 0.87 -1.93 2.37 113.55 117.76 3mcg h SER 27 Ca 0.01 0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.60 3mcg h SER 27 Cb 0.08 0.23 0.01 0.00 -0.44 0.00 0.00 62.40 62.27 3mcg h SER 27 CO -0.00 -0.33 -0.25 -0.78 -0.53 0.00 0.00 176.83 174.94 3mcg h ASP 28 N -0.50 -0.60 0.00 6.23 1.82 -1.24 -3.28 116.42 118.85 3mcg h ASP 28 Ca -0.03 -0.06 -0.02 0.00 -0.39 0.00 0.00 57.03 56.53 3mcg h ASP 28 Cb 0.43 0.15 -0.04 0.00 0.68 0.00 0.00 39.33 40.56 3mcg h ASP 28 CO -0.03 -0.25 -0.34 0.55 -1.61 0.00 0.00 179.24 177.55 3mcg n VAL 29 N -5.30 1.48 0.00 2.25 3.14 0.18 -4.01 118.33 116.07 3mcg n VAL 29 Ca -0.11 -2.06 0.00 0.00 -2.96 0.00 0.00 64.34 59.21 3mcg n VAL 29 Cb 0.32 0.01 0.00 0.00 -1.06 0.00 0.00 33.84 33.12 3mcg n VAL 29 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3mcg n GLY 30 N -0.90 -0.15 0.04 7.55 0.00 -0.25 -3.46 105.19 108.01 3mcg n GLY 30 Ca 0.13 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.24 3mcg n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mcg n GLY 31 N 2.68 -0.76 3.81 -0.02 0.00 0.78 -4.90 105.19 106.79 3mcg n GLY 31 Ca 0.00 -0.55 -0.22 0.00 0.00 0.00 0.00 46.02 45.25 3mcg n GLY 31 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3mcg s TYR 32 N -2.79 2.96 0.00 1.61 2.02 -1.11 -5.05 117.35 114.99 3mcg s TYR 32 Ca 0.08 -0.22 0.00 0.00 -0.37 0.00 0.00 57.07 56.56 3mcg s TYR 32 Cb 0.15 -1.55 0.00 0.00 -0.40 0.00 0.00 41.96 40.16 3mcg s TYR 32 CO 0.77 0.39 0.00 -1.71 -1.57 0.00 0.00 175.55 173.43 3mcg n ASN 33 N -1.22 0.00 -2.91 2.29 5.15 -1.26 -4.10 115.26 113.21 3mcg n ASN 33 Ca -0.05 0.00 -0.12 0.00 -0.60 0.00 0.00 54.58 53.81 3mcg n ASN 33 Cb 0.59 0.00 0.06 0.00 -0.53 0.00 0.00 39.78 39.90 3mcg n ASN 33 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 3mcg n TYR 34 N 0.00 -1.89 -3.84 1.20 4.02 0.35 -4.07 117.16 112.93 3mcg n TYR 34 Ca 0.00 0.71 -0.36 0.00 -0.01 0.00 0.00 57.90 58.24 3mcg n TYR 34 Cb 0.00 -4.02 -0.13 0.00 -0.02 0.00 0.00 39.34 35.16 3mcg n TYR 34 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 3mcg s VAL 35 N -3.30 3.48 0.21 -0.72 1.01 0.16 -2.58 120.40 118.66 3mcg s VAL 35 Ca 0.24 -0.93 0.11 0.00 0.00 0.00 0.00 61.98 61.40 3mcg s VAL 35 Cb -0.03 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.47 3mcg s VAL 35 CO 0.59 0.07 -0.19 -0.94 0.00 0.00 0.00 175.10 174.62 3mcg s SER 36 N 1.40 3.70 0.07 3.32 1.04 0.29 -1.21 113.70 122.30 3mcg s SER 36 Ca 0.00 -0.82 0.06 0.00 0.48 0.00 0.00 55.95 55.67 3mcg s SER 36 Cb -0.18 -0.40 -0.03 0.00 0.10 0.00 0.00 66.02 65.52 3mcg s SER 36 CO -0.00 0.10 -0.15 0.26 0.98 0.00 0.00 173.24 174.42 3mcg s TRP 37 N -1.84 1.33 -0.00 5.02 0.52 0.48 -0.66 118.94 123.79 3mcg s TRP 37 Ca 0.24 -0.43 0.05 0.00 0.02 0.00 0.00 56.10 55.97 3mcg s TRP 37 Cb -0.08 -0.75 -0.01 0.00 -1.15 0.00 0.00 33.47 31.48 3mcg s TRP 37 CO 0.12 0.08 -0.15 0.71 0.02 0.00 0.00 176.95 177.73 3mcg s TYR 38 N -1.16 1.38 -0.52 -1.98 1.51 -0.20 0.97 117.35 117.35 3mcg s TYR 38 Ca 0.00 -0.27 -0.20 0.00 -1.01 0.00 0.00 57.07 55.59 3mcg s TYR 38 Cb -0.10 -0.88 0.06 0.00 -0.11 0.00 0.00 41.96 40.94 3mcg s TYR 38 CO 0.02 -0.01 0.67 -1.14 -1.11 0.00 0.00 175.55 173.98 3mcg s GLN 39 N -0.48 3.14 -0.00 -0.62 2.00 0.11 -3.11 119.66 120.69 3mcg s GLN 39 Ca 0.06 -0.86 0.07 0.00 -2.00 0.00 0.00 55.36 52.63 3mcg s GLN 39 Cb -0.06 -4.11 -0.03 0.00 0.80 0.00 0.00 33.01 29.61 3mcg s GLN 39 CO -0.00 -1.29 -0.21 1.14 -0.50 0.00 0.00 175.29 174.43 3mcg s GLN 40 N 2.80 2.14 -0.31 1.67 0.00 -0.53 -1.26 119.66 124.17 3mcg s GLN 40 Ca 0.17 -0.92 0.01 0.00 -0.00 0.00 0.00 55.36 54.62 3mcg s GLN 40 Cb -0.19 -2.14 0.09 0.00 0.00 0.00 0.00 33.01 30.77 3mcg s GLN 40 CO 0.12 0.56 0.05 -1.01 0.00 0.00 0.00 175.29 175.02 3mcg s HIS 41 N -0.74 2.63 0.00 9.60 0.09 -1.26 -2.73 115.29 122.87 3mcg s HIS 41 Ca 0.12 -2.23 0.00 0.00 -0.00 0.00 0.00 55.06 52.95 3mcg s HIS 41 Cb -0.10 -2.16 0.00 0.00 -0.00 0.00 0.00 32.58 30.31 3mcg s HIS 41 CO 0.01 -0.89 0.00 0.00 -0.00 0.00 0.00 174.74 173.87 3mcg n ALA 42 N 4.59 0.00 0.00 -1.40 0.00 -1.26 -4.04 120.51 118.40 3mcg n ALA 42 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 3mcg n ALA 42 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 3mcg n ALA 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mcg n GLY 43 N 0.00 0.06 0.00 0.00 0.00 -1.26 -5.09 105.19 98.90 3mcg n GLY 43 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.85 3mcg n GLY 43 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3mcg n LYS 44 N 0.00 0.00 -0.33 1.61 4.81 -1.26 -5.14 118.16 117.85 3mcg n LYS 44 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 3mcg n LYS 44 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 3mcg n LYS 44 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3mcg n ALA 45 N 0.00 -1.36 -1.64 3.14 0.00 -1.26 -5.04 120.51 114.34 3mcg n ALA 45 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 3mcg n ALA 45 Cb 0.00 -0.12 0.01 0.00 0.00 0.00 0.00 19.45 19.34 3mcg n ALA 45 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3mcg n PRO 46 N 1.64 1.56 -3.86 0.00 -0.02 -1.26 -4.95 135.00 128.11 3mcg n PRO 46 Ca 0.00 0.56 -0.36 0.00 -2.02 0.00 0.00 63.50 61.68 3mcg n PRO 46 Cb 0.00 -2.14 -0.14 0.00 -0.02 0.00 0.00 33.50 31.21 3mcg n PRO 46 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3mcg s LYS 47 N -2.02 3.22 -0.08 -0.52 2.20 -0.39 -4.84 119.74 117.30 3mcg s LYS 47 Ca 0.62 -0.74 -0.37 0.00 -0.36 0.00 0.00 55.97 55.12 3mcg s LYS 47 Cb -0.56 -3.13 -0.14 0.00 -1.51 0.00 0.00 37.83 32.49 3mcg s LYS 47 CO 0.58 -0.30 1.68 1.33 -0.36 0.00 0.00 175.35 178.27 3mcg n VAL 48 N 4.80 0.28 -1.91 4.02 0.24 -1.25 0.08 118.33 124.59 3mcg n VAL 48 Ca -0.17 -0.05 0.00 0.00 -2.04 0.00 0.00 64.34 62.08 3mcg n VAL 48 Cb 0.49 -1.39 0.00 0.00 -1.47 0.00 0.00 33.84 31.47 3mcg n VAL 48 CO 0.00 0.00 0.00 2.30 -2.14 0.00 0.00 176.83 176.99 3mcg n ILE 49 N 4.17 0.00 0.00 1.34 -5.35 0.27 -4.86 119.36 114.94 3mcg n ILE 49 Ca 0.22 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.70 3mcg n ILE 49 Cb 0.22 0.53 0.00 0.00 -1.74 0.00 0.00 39.64 38.64 3mcg n ILE 49 CO 0.00 0.00 0.00 2.30 -1.76 0.00 0.00 176.55 177.09 3mcg n ILE 50 N 0.00 0.00 -4.78 7.28 -5.35 -1.25 -4.80 119.36 110.45 3mcg n ILE 50 Ca 0.00 0.00 -0.27 0.00 -0.27 0.00 0.00 62.75 62.21 3mcg n ILE 50 Cb 0.67 0.00 -0.14 0.00 -1.74 0.00 0.00 39.64 38.43 3mcg n ILE 50 CO 0.00 0.00 0.00 -0.72 -1.76 0.00 0.00 176.55 174.07 3mcg s TYR 51 N 0.00 1.97 0.00 4.28 -0.00 0.85 -0.39 117.35 124.06 3mcg s TYR 51 Ca 0.00 -0.38 0.00 0.00 -0.00 0.00 0.00 57.07 56.69 3mcg s TYR 51 Cb 0.00 -1.19 0.00 0.00 -0.00 0.00 0.00 41.96 40.77 3mcg s TYR 51 CO 0.00 0.08 0.00 -1.91 -0.00 0.00 0.00 175.55 173.72 3mcg n GLU 52 N 1.93 0.00 0.00 -3.49 2.13 -0.35 -1.01 120.64 119.85 3mcg n GLU 52 Ca -0.17 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.65 3mcg n GLU 52 Cb 0.53 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.24 3mcg n GLU 52 CO 0.00 0.00 0.00 1.55 -0.41 0.00 0.00 177.13 178.27 3mcg n VAL 53 N 0.00 0.00 -1.62 6.31 3.14 -1.20 0.40 118.33 125.37 3mcg n VAL 53 Ca 0.00 0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.37 3mcg n VAL 53 Cb 0.00 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 32.77 3mcg n VAL 53 CO 0.00 0.00 0.00 -0.46 -6.46 0.00 0.00 176.83 169.91 3mcg n ASN 54 N -0.64 -0.21 -4.75 6.55 0.23 -1.19 -2.84 115.26 112.41 3mcg n ASN 54 Ca 0.00 -0.73 -0.36 0.00 -0.53 0.00 0.00 54.58 52.96 3mcg n ASN 54 Cb 0.00 0.06 -0.07 0.00 -2.08 0.00 0.00 39.78 37.69 3mcg n ASN 54 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 3mcg s LYS 55 N 0.00 4.13 -0.10 -3.83 1.02 -0.18 -4.83 119.74 115.96 3mcg s LYS 55 Ca 0.00 -0.06 -0.04 0.00 0.02 0.00 0.00 55.97 55.89 3mcg s LYS 55 Cb 0.00 -3.39 0.05 0.00 -0.52 0.00 0.00 37.83 33.97 3mcg s LYS 55 CO 0.00 0.33 0.21 -0.98 -0.92 0.00 0.00 175.35 174.00 3mcg s ARG 56 N 0.22 0.14 0.61 1.68 1.70 -1.26 -0.11 118.95 121.93 3mcg s ARG 56 Ca 0.13 0.55 -0.12 0.00 -0.47 0.00 0.00 55.73 55.81 3mcg s ARG 56 Cb -0.12 -0.14 -0.04 0.00 -0.57 0.00 0.00 34.95 34.08 3mcg s ARG 56 CO 0.01 -0.21 1.03 -1.25 -1.08 0.00 0.00 175.30 173.80 3mcg s PRO 57 N 1.64 3.58 -0.49 3.89 0.04 -1.26 -4.72 135.00 137.68 3mcg s PRO 57 Ca -0.05 0.81 -0.45 0.00 0.04 0.00 0.00 61.00 61.35 3mcg s PRO 57 Cb -0.11 -2.08 -0.19 0.00 0.04 0.00 0.00 34.50 32.16 3mcg s PRO 57 CO -0.08 -0.58 1.94 0.43 0.04 0.00 0.00 177.00 178.75 3mcg n SER 58 N -2.59 1.00 0.00 6.66 7.64 -1.26 -1.22 113.62 123.85 3mcg n SER 58 Ca 0.06 0.86 0.00 0.00 1.01 0.00 0.00 58.87 60.80 3mcg n SER 58 Cb 0.54 -0.91 0.00 0.00 -1.01 0.00 0.00 64.21 62.83 3mcg n SER 58 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mcg n GLY 59 N 6.15 3.08 3.66 0.23 0.00 -1.26 -5.07 105.19 111.99 3mcg n GLY 59 Ca 0.45 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3mcg n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mcg s VAL 60 N 0.00 4.77 0.03 1.61 1.01 -0.36 -4.87 120.40 122.60 3mcg s VAL 60 Ca 0.00 1.85 -0.24 0.00 0.00 0.00 0.00 61.98 63.59 3mcg s VAL 60 Cb 0.00 -4.23 -0.16 0.00 0.00 0.00 0.00 36.38 31.99 3mcg s VAL 60 CO 0.00 -0.09 1.45 1.55 0.00 0.00 0.00 175.10 178.01 3mcg h PRO 61 N 7.44 0.09 0.00 2.72 0.13 -1.94 -3.47 132.00 136.98 3mcg h PRO 61 Ca -0.23 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3mcg h PRO 61 Cb 1.09 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.21 3mcg h PRO 61 CO 0.91 0.38 0.00 -3.47 -0.23 0.00 0.00 178.00 175.59 3mcg n ASP 62 N -4.88 0.00 -2.73 1.44 4.64 -1.26 -5.00 116.55 108.77 3mcg n ASP 62 Ca -0.07 0.00 -0.19 0.00 -1.38 0.00 0.00 54.79 53.15 3mcg n ASP 62 Cb 0.19 0.00 -0.07 0.00 -1.04 0.00 0.00 41.12 40.20 3mcg n ASP 62 CO 0.00 0.00 0.00 -2.11 -0.82 0.00 0.00 177.20 174.27 3mcg n ARG 63 N 0.00 2.06 -2.51 -0.67 -4.01 -1.26 -3.94 116.66 106.33 3mcg n ARG 63 Ca 0.00 -1.24 -0.21 0.00 -1.04 0.00 0.00 57.85 55.36 3mcg n ARG 63 Cb 0.00 -2.24 0.01 0.00 -3.04 0.00 0.00 32.46 27.19 3mcg n ARG 63 CO 0.00 0.00 0.00 0.34 -3.04 0.00 0.00 177.63 174.93 3mcg n PHE 64 N 3.38 2.63 -2.16 2.89 7.35 -1.22 0.68 117.46 131.01 3mcg n PHE 64 Ca 0.44 -2.91 -0.06 0.00 -0.76 0.00 0.00 57.45 54.16 3mcg n PHE 64 Cb 0.38 -0.19 0.03 0.00 0.35 0.00 0.00 39.48 40.05 3mcg n PHE 64 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 3mcg n SER 65 N -0.38 0.29 -3.58 -2.13 3.41 0.11 -4.78 113.62 106.55 3mcg n SER 65 Ca 0.30 -1.26 -0.17 0.00 -0.26 0.00 0.00 58.87 57.48 3mcg n SER 65 Cb 0.74 -0.18 -0.07 0.00 -0.26 0.00 0.00 64.21 64.44 3mcg n SER 65 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3mcg s GLY 66 N -3.17 -0.49 0.16 5.00 0.00 -1.25 -0.18 107.32 107.39 3mcg s GLY 66 Ca 0.17 1.16 -0.16 0.00 0.00 0.00 0.00 44.72 45.89 3mcg s GLY 66 CO 0.11 0.83 0.44 -0.45 0.00 0.00 0.00 173.10 174.03 3mcg s SER 67 N -1.12 -0.21 -0.30 1.64 0.15 0.91 -3.74 113.70 111.04 3mcg s SER 67 Ca -0.11 -0.47 -0.01 0.00 0.70 0.00 0.00 55.95 56.07 3mcg s SER 67 Cb -0.01 0.51 0.09 0.00 -1.71 0.00 0.00 66.02 64.91 3mcg s SER 67 CO 0.08 -0.95 0.09 -1.59 1.20 0.00 0.00 173.24 172.08 3mcg s LYS 68 N -3.86 0.72 -0.16 5.44 0.00 -1.26 -0.27 119.74 120.35 3mcg s LYS 68 Ca 0.08 -0.99 -0.28 0.00 0.00 0.00 0.00 55.97 54.78 3mcg s LYS 68 Cb 0.01 -1.99 -0.01 0.00 0.00 0.00 0.00 37.83 35.84 3mcg s LYS 68 CO -0.06 -0.94 0.94 -1.12 0.00 0.00 0.00 175.35 174.16 3mcg s SER 69 N 1.65 7.08 0.00 0.03 0.01 0.39 -4.61 113.70 118.25 3mcg s SER 69 Ca 0.08 1.34 0.00 0.00 1.31 0.00 0.00 55.95 58.68 3mcg s SER 69 Cb -0.17 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.55 3mcg s SER 69 CO -0.23 -0.48 0.00 0.61 0.41 0.00 0.00 173.24 173.55 3mcg n GLY 70 N 3.31 -0.37 0.00 3.44 0.00 -1.26 -0.28 105.19 110.03 3mcg n GLY 70 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3mcg n GLY 70 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3mcg n ASN 71 N 0.00 0.00 -4.32 1.61 0.23 -1.23 -4.07 115.26 107.48 3mcg n ASN 71 Ca 0.00 -0.48 -0.46 0.00 -0.53 0.00 0.00 54.58 53.11 3mcg n ASN 71 Cb 0.00 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 37.66 3mcg n ASN 71 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 3mcg s THR 72 N 0.00 5.28 -0.43 5.53 -4.23 0.61 -1.08 115.64 121.32 3mcg s THR 72 Ca 0.00 -1.72 -0.07 0.00 -1.18 0.00 0.00 61.69 58.72 3mcg s THR 72 Cb 0.00 -4.39 0.10 0.00 1.34 0.00 0.00 72.50 69.55 3mcg s THR 72 CO 0.00 -0.94 0.27 0.00 -0.54 0.00 0.00 174.62 173.42 3mcg s ALA 73 N 1.32 3.28 -0.13 3.99 0.00 0.13 -0.46 121.76 129.89 3mcg s ALA 73 Ca 0.08 -2.39 -0.07 0.00 0.00 0.00 0.00 51.96 49.58 3mcg s ALA 73 Cb -0.24 -2.64 -0.04 0.00 0.00 0.00 0.00 23.12 20.20 3mcg s ALA 73 CO -0.00 -1.78 0.10 -1.12 0.00 0.00 0.00 175.76 172.96 3mcg s SER 74 N 2.25 6.06 -0.15 0.00 0.01 0.63 0.13 113.70 122.64 3mcg s SER 74 Ca 0.05 0.33 -0.05 0.00 1.31 0.00 0.00 55.95 57.59 3mcg s SER 74 Cb -0.24 -1.95 -0.03 0.00 0.21 0.00 0.00 66.02 64.01 3mcg s SER 74 CO -0.01 0.34 0.01 -0.22 0.41 0.00 0.00 173.24 173.78 3mcg s LEU 75 N -0.64 3.55 -0.08 2.44 0.20 0.16 -0.06 118.68 124.24 3mcg s LEU 75 Ca 0.12 0.03 0.03 0.00 0.69 0.00 0.00 54.13 55.00 3mcg s LEU 75 Cb -0.12 -1.86 -0.01 0.00 -0.43 0.00 0.00 46.19 43.77 3mcg s LEU 75 CO 0.02 0.23 -0.19 0.28 -0.29 0.00 0.00 176.35 176.40 3mcg s THR 76 N 0.01 2.55 -0.25 3.68 -1.32 0.75 -0.09 115.64 120.97 3mcg s THR 76 Ca 0.03 -0.87 -0.07 0.00 -1.21 0.00 0.00 61.69 59.57 3mcg s THR 76 Cb -0.13 -2.00 -0.02 0.00 -1.51 0.00 0.00 72.50 68.85 3mcg s THR 76 CO 0.02 0.56 0.05 0.54 -2.21 0.00 0.00 174.62 173.57 3mcg s VAL 77 N -0.05 4.07 -0.26 5.08 0.11 0.45 0.05 120.40 129.84 3mcg s VAL 77 Ca -0.05 -0.31 -0.15 0.00 -2.93 0.00 0.00 61.98 58.55 3mcg s VAL 77 Cb -0.14 -2.92 -0.04 0.00 -1.53 0.00 0.00 36.38 31.75 3mcg s VAL 77 CO 0.04 0.32 0.35 -0.55 -3.33 0.00 0.00 175.10 171.94 3mcg s SER 78 N 1.57 6.25 0.00 3.54 0.15 0.21 -0.27 113.70 125.16 3mcg s SER 78 Ca 0.06 0.29 0.00 0.00 0.70 0.00 0.00 55.95 57.00 3mcg s SER 78 Cb -0.15 -2.20 0.00 0.00 -1.71 0.00 0.00 66.02 61.96 3mcg s SER 78 CO 0.02 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 174.92 3mcg n GLY 79 N 4.60 2.04 0.00 9.45 0.00 0.10 -4.76 105.19 116.62 3mcg n GLY 79 Ca -0.09 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.28 3mcg n GLY 79 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mcg n LEU 80 N 0.00 -0.67 -4.15 0.99 4.77 -1.25 -3.96 117.00 112.73 3mcg n LEU 80 Ca 0.00 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.77 3mcg n LEU 80 Cb 0.00 0.67 -0.14 0.00 -2.33 0.00 0.00 43.42 41.62 3mcg n LEU 80 CO 0.00 0.00 -0.47 0.00 -1.33 0.00 0.00 177.39 175.59 3mcg s GLN 81 N -5.66 1.05 -0.12 3.23 0.00 -1.26 -4.80 119.66 112.10 3mcg s GLN 81 Ca 0.00 -0.71 -0.27 0.00 -0.00 0.00 0.00 55.36 54.38 3mcg s GLN 81 Cb 0.00 -1.06 -0.31 0.00 0.00 0.00 0.00 33.01 31.64 3mcg s GLN 81 CO 0.00 0.27 1.59 0.00 0.00 0.00 0.00 175.29 177.15 3mcg n ALA 82 N 2.11 1.24 -1.83 2.60 0.00 -1.26 -4.81 120.51 118.56 3mcg n ALA 82 Ca -0.17 -2.52 -0.05 0.00 0.00 0.00 0.00 53.44 50.71 3mcg n ALA 82 Cb 0.55 -3.61 0.03 0.00 0.00 0.00 0.00 19.45 16.42 3mcg n ALA 82 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3mcg n GLU 83 N 7.53 0.13 -2.35 0.00 0.00 -1.26 -5.06 120.64 119.63 3mcg n GLU 83 Ca 0.43 -0.53 -0.32 0.00 0.00 0.00 0.00 57.16 56.74 3mcg n GLU 83 Cb 0.37 -0.21 -0.03 0.00 0.00 0.00 0.00 31.44 31.57 3mcg n GLU 83 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 3mcg s ASP 84 N -1.97 6.57 -0.18 4.31 -1.08 -1.26 -5.07 116.67 117.99 3mcg s ASP 84 Ca 0.15 1.57 0.00 0.00 -0.52 0.00 0.00 52.55 53.75 3mcg s ASP 84 Cb -0.01 -2.51 0.01 0.00 -1.46 0.00 0.00 42.92 38.96 3mcg s ASP 84 CO 0.11 -0.62 -0.17 -1.83 0.52 0.00 0.00 175.17 173.18 3mcg s GLU 85 N -4.15 3.10 0.00 4.34 1.03 -1.26 -5.00 118.70 116.76 3mcg s GLU 85 Ca 0.59 -0.78 0.00 0.00 0.03 0.00 0.00 54.97 54.81 3mcg s GLU 85 Cb -0.10 -2.64 0.00 0.00 -0.80 0.00 0.00 34.13 30.58 3mcg s GLU 85 CO 0.33 -0.15 0.00 0.00 -1.33 0.00 0.00 175.26 174.11 3mcg n ALA 86 N 4.50 0.00 -1.86 -0.84 0.00 -1.26 -4.47 120.51 116.57 3mcg n ALA 86 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.82 3mcg n ALA 86 Cb 0.51 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.93 3mcg n ALA 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3mcg s ASP 87 N 2.00 6.36 0.01 0.00 1.11 -1.11 -2.11 116.67 122.94 3mcg s ASP 87 Ca 0.00 2.20 0.06 0.00 0.18 0.00 0.00 52.55 54.99 3mcg s ASP 87 Cb 0.00 -2.53 -0.03 0.00 1.07 0.00 0.00 42.92 41.43 3mcg s ASP 87 CO 0.00 -1.19 -0.15 -0.31 1.18 0.00 0.00 175.17 174.70 3mcg s TYR 88 N 5.04 2.65 -0.04 4.23 1.51 -0.00 -1.46 117.35 129.28 3mcg s TYR 88 Ca 0.82 -0.19 -0.03 0.00 -1.01 0.00 0.00 57.07 56.65 3mcg s TYR 88 Cb -0.35 -1.53 0.01 0.00 -0.11 0.00 0.00 41.96 39.99 3mcg s TYR 88 CO 0.34 0.26 0.10 0.71 -1.11 0.00 0.00 175.55 175.85 3mcg s TYR 89 N -0.90 -0.11 -0.08 2.71 1.51 -1.18 -3.51 117.35 115.79 3mcg s TYR 89 Ca 0.14 0.27 0.03 0.00 -1.01 0.00 0.00 57.07 56.51 3mcg s TYR 89 Cb -0.11 0.02 -0.02 0.00 -0.11 0.00 0.00 41.96 41.75 3mcg s TYR 89 CO 0.05 -0.06 -0.17 0.00 -1.11 0.00 0.00 175.55 174.25 3mcg s SER 91 N -0.14 2.68 0.20 0.00 1.04 0.17 -0.14 113.70 117.50 3mcg s SER 91 Ca -0.02 -0.45 0.08 0.00 0.48 0.00 0.00 55.95 56.04 3mcg s SER 91 Cb -0.14 -0.88 -0.05 0.00 0.10 0.00 0.00 66.02 65.05 3mcg s SER 91 CO 0.04 0.18 -0.15 -0.55 0.98 0.00 0.00 173.24 173.73 3mcg s SER 92 N 0.08 2.63 0.59 7.02 0.15 0.88 -0.55 113.70 124.49 3mcg s SER 92 Ca -0.08 -0.99 0.31 0.00 0.70 0.00 0.00 55.95 55.89 3mcg s SER 92 Cb -0.14 -0.15 1.83 0.00 -1.71 0.00 0.00 66.02 65.86 3mcg s SER 92 CO 0.04 -0.14 2.25 0.22 1.20 0.00 0.00 173.24 176.81 3mcg h TYR 93 N 2.67 0.00 -1.77 3.44 3.20 -1.64 -0.63 116.97 122.25 3mcg h TYR 93 Ca -0.39 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.48 3mcg h TYR 93 Cb 1.22 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.49 3mcg h TYR 93 CO 0.72 0.01 0.00 -1.91 -1.64 0.00 0.00 178.16 175.34 3mcg n GLU 94 N -3.76 -0.94 0.00 1.82 2.13 -1.26 -3.97 120.64 114.66 3mcg n GLU 94 Ca -0.03 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.79 3mcg n GLU 94 Cb 0.10 -3.03 0.00 0.00 0.27 0.00 0.00 31.44 28.78 3mcg n GLU 94 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3mcg n GLY 95 N -0.04 1.17 3.54 8.31 0.00 -1.26 -4.71 105.19 112.20 3mcg n GLY 95 Ca 0.00 0.35 -0.30 0.00 0.00 0.00 0.00 46.02 46.07 3mcg n GLY 95 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3mcg n SER 96 N 4.45 1.61 -0.76 1.61 7.64 -1.26 -4.21 113.62 122.69 3mcg n SER 96 Ca 0.00 -0.68 0.00 0.00 1.01 0.00 0.00 58.87 59.20 3mcg n SER 96 Cb 0.00 -1.43 0.00 0.00 -1.01 0.00 0.00 64.21 61.77 3mcg n SER 96 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3mcg n ASP 97 N 15.16 0.00 -3.22 6.43 5.75 -1.26 -4.65 116.55 134.76 3mcg n ASP 97 Ca 0.46 0.00 -0.25 0.00 -0.01 0.00 0.00 54.79 54.99 3mcg n ASP 97 Cb 0.41 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.44 3mcg n ASP 97 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 3mcg n ASN 98 N 0.37 2.48 -4.63 -1.12 5.15 -1.25 -5.12 115.26 111.14 3mcg n ASN 98 Ca 0.00 -3.22 -0.40 0.00 -0.60 0.00 0.00 54.58 50.35 3mcg n ASN 98 Cb 0.00 -0.63 0.02 0.00 -0.53 0.00 0.00 39.78 38.64 3mcg n ASN 98 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 3mcg n PHE 99 N 0.67 1.25 -4.00 1.20 3.72 -1.26 -4.76 117.46 114.29 3mcg n PHE 99 Ca 0.27 0.51 -0.10 0.00 -0.05 0.00 0.00 57.45 58.08 3mcg n PHE 99 Cb 0.48 -2.23 -0.11 0.00 -0.94 0.00 0.00 39.48 36.68 3mcg n PHE 99 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3mcg s VAL 100 N -1.33 0.21 -0.04 -4.37 0.11 -0.24 -4.94 120.40 109.79 3mcg s VAL 100 Ca 0.66 -0.99 -0.03 0.00 -2.93 0.00 0.00 61.98 58.69 3mcg s VAL 100 Cb -0.51 -0.39 0.01 0.00 -1.53 0.00 0.00 36.38 33.96 3mcg s VAL 100 CO 0.54 -0.50 0.11 0.72 -3.33 0.00 0.00 175.10 172.65 3mcg s PHE 101 N -1.55 -0.12 0.27 1.54 -0.12 -1.22 -0.08 117.98 116.70 3mcg s PHE 101 Ca -0.14 0.30 -0.21 0.00 -0.05 0.00 0.00 56.93 56.83 3mcg s PHE 101 Cb -0.09 0.02 -0.09 0.00 -0.63 0.00 0.00 43.02 42.23 3mcg s PHE 101 CO -0.01 -0.07 0.81 0.20 -0.05 0.00 0.00 175.22 176.10 3mcg s GLY 102 N 0.18 2.64 0.30 1.99 0.00 0.80 -3.59 107.32 109.64 3mcg s GLY 102 Ca -0.01 0.28 0.09 0.00 0.00 0.00 0.00 44.72 45.08 3mcg s GLY 102 CO -0.00 0.65 0.05 -1.08 0.00 0.00 0.00 173.10 172.72 3mcg s THR 103 N -1.63 3.21 0.00 0.90 -1.32 -1.23 -2.63 115.64 112.95 3mcg s THR 103 Ca 0.47 -1.84 0.00 0.00 -1.21 0.00 0.00 61.69 59.11 3mcg s THR 103 Cb -0.16 -2.89 0.00 0.00 -1.51 0.00 0.00 72.50 67.93 3mcg s THR 103 CO 0.21 -0.29 0.00 0.61 -2.21 0.00 0.00 174.62 172.94 3mcg n GLY 104 N -0.99 0.35 7.00 6.08 0.00 -1.23 -4.59 105.19 111.80 3mcg n GLY 104 Ca -0.05 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.18 3mcg n GLY 104 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3mcg n THR 105 N 0.00 0.00 -0.23 2.61 -1.04 -1.15 -0.82 114.28 113.65 3mcg n THR 105 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3mcg n THR 105 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 3mcg n THR 105 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 3mcg n LYS 106 N 0.00 0.00 -3.60 -2.82 2.85 -0.90 -3.42 118.16 110.28 3mcg n LYS 106 Ca 0.00 0.00 -0.06 0.00 -1.05 0.00 0.00 58.31 57.20 3mcg n LYS 106 Cb 0.00 0.00 -0.04 0.00 -0.65 0.00 0.00 35.03 34.34 3mcg n LYS 106 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 3mcg s VAL 107 N 0.00 0.00 -0.47 0.58 1.01 -1.25 -4.38 120.40 115.89 3mcg s VAL 107 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 61.98 62.01 3mcg s VAL 107 Cb 0.00 -1.00 0.15 0.00 0.00 0.00 0.00 36.38 35.53 3mcg s VAL 107 CO 0.00 0.00 0.29 -0.89 0.00 0.00 0.00 175.10 174.50 3mcg s THR 108 N -1.57 1.39 -0.24 3.92 2.01 0.16 -4.82 115.64 116.49 3mcg s THR 108 Ca 0.05 -2.78 -0.01 0.00 0.31 0.00 0.00 61.69 59.26 3mcg s THR 108 Cb -0.01 -1.96 0.03 0.00 0.01 0.00 0.00 72.50 70.57 3mcg s THR 108 CO -0.04 -0.97 -0.09 0.54 -0.69 0.00 0.00 174.62 173.38 3mcg s VAL 109 N 0.08 2.65 0.00 3.82 0.11 -1.25 0.71 120.40 126.52 3mcg s VAL 109 Ca 0.21 -1.12 0.00 0.00 -2.93 0.00 0.00 61.98 58.14 3mcg s VAL 109 Cb -0.17 -2.35 0.00 0.00 -1.53 0.00 0.00 36.38 32.33 3mcg s VAL 109 CO -0.05 0.20 0.00 -0.11 -3.33 0.00 0.00 175.10 171.81 3mcg n LEU 110 N 4.62 0.00 -2.76 2.54 -0.00 -0.38 -4.55 117.00 116.48 3mcg n LEU 110 Ca -0.17 0.00 -0.05 0.00 -0.00 0.00 0.00 56.01 55.80 3mcg n LEU 110 Cb 0.47 0.00 0.02 0.00 -0.00 0.00 0.00 43.42 43.91 3mcg n LEU 110 CO 0.26 -0.53 0.17 0.61 -0.00 0.00 0.00 177.39 177.89 3mcg n GLY 111 N 0.06 -0.89 0.00 -3.96 0.00 -1.26 -4.57 105.19 94.58 3mcg n GLY 111 Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.37 3mcg n GLY 111 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3mcg n GLN 112 N -2.11 0.00 -2.63 1.61 1.13 -1.26 -4.61 117.38 109.51 3mcg n GLN 112 Ca -0.02 0.00 -0.43 0.00 -1.94 0.00 0.00 57.00 54.61 3mcg n GLN 112 Cb 0.54 0.00 -0.02 0.00 0.11 0.00 0.00 30.24 30.87 3mcg n GLN 112 CO 0.00 0.00 0.00 -2.14 -1.44 0.00 0.00 177.06 173.48 3mcg s PRO 113 N 0.00 3.90 0.55 -1.09 0.02 -1.26 -5.05 135.00 132.06 3mcg s PRO 113 Ca 0.00 0.81 -0.11 0.00 0.02 0.00 0.00 61.00 61.72 3mcg s PRO 113 Cb 0.00 -3.82 -0.10 0.00 0.02 0.00 0.00 34.50 30.60 3mcg s PRO 113 CO 0.00 -1.13 -0.38 1.17 -0.33 0.00 0.00 177.00 176.33 3mcg n LYS 114 N 7.31 0.00 -4.54 5.54 4.81 -1.26 -4.65 118.16 125.37 3mcg n LYS 114 Ca 0.12 0.00 -0.26 0.00 -0.87 0.00 0.00 58.31 57.30 3mcg n LYS 114 Cb 0.48 -0.66 -0.08 0.00 0.02 0.00 0.00 35.03 34.78 3mcg n LYS 114 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3mcg s ALA 115 N -1.32 3.00 0.44 3.14 0.00 -1.26 -4.73 121.76 121.02 3mcg s ALA 115 Ca 0.30 -1.27 0.07 0.00 0.00 0.00 0.00 51.96 51.06 3mcg s ALA 115 Cb -0.19 0.63 -0.04 0.00 0.00 0.00 0.00 23.12 23.52 3mcg s ALA 115 CO 0.51 -0.29 0.20 -0.80 0.00 0.00 0.00 175.76 175.38 3mcg s ASN 116 N -3.63 4.43 -0.13 0.00 0.01 -1.26 -4.36 114.94 110.00 3mcg s ASN 116 Ca 0.23 -1.14 -0.06 0.00 -0.71 0.00 0.00 52.86 51.19 3mcg s ASN 116 Cb 0.04 -0.29 -0.04 0.00 0.41 0.00 0.00 41.25 41.37 3mcg s ASN 116 CO 0.13 -0.64 0.07 -2.84 -1.51 0.00 0.00 177.10 172.31 3mcg s PRO 117 N -3.95 3.50 -0.35 -0.60 0.02 -1.14 -3.28 135.00 129.20 3mcg s PRO 117 Ca 0.37 -0.29 0.01 0.00 0.02 0.00 0.00 61.00 61.12 3mcg s PRO 117 Cb 0.03 -3.08 0.09 0.00 0.02 0.00 0.00 34.50 31.56 3mcg s PRO 117 CO 0.21 0.58 0.07 -0.08 -0.33 0.00 0.00 177.00 177.45 3mcg s THR 118 N -0.49 2.68 0.23 0.99 -1.32 -1.05 -4.93 115.64 111.75 3mcg s THR 118 Ca 0.10 -2.04 -0.07 0.00 -1.21 0.00 0.00 61.69 58.48 3mcg s THR 118 Cb -0.12 -2.82 -0.06 0.00 -1.51 0.00 0.00 72.50 67.99 3mcg s THR 118 CO 0.02 -0.49 0.51 0.68 -2.21 0.00 0.00 174.62 173.13 3mcg s VAL 119 N 1.05 5.01 -0.10 5.08 -7.23 -1.26 -1.08 120.40 121.87 3mcg s VAL 119 Ca 0.05 0.26 -0.05 0.00 -1.81 0.00 0.00 61.98 60.43 3mcg s VAL 119 Cb -0.20 -3.65 0.05 0.00 0.56 0.00 0.00 36.38 33.13 3mcg s VAL 119 CO -0.05 -0.12 0.23 0.42 -0.31 0.00 0.00 175.10 175.27 3mcg s THR 120 N -1.85 -0.04 0.04 5.32 -4.23 0.03 -4.94 115.64 109.96 3mcg s THR 120 Ca 0.45 0.15 0.03 0.00 -1.18 0.00 0.00 61.69 61.14 3mcg s THR 120 Cb -0.11 -0.37 -0.02 0.00 1.34 0.00 0.00 72.50 73.34 3mcg s THR 120 CO 0.24 0.06 -0.09 -0.22 -0.54 0.00 0.00 174.62 174.08 3mcg s LEU 121 N 1.24 2.21 -0.45 4.79 0.20 -1.26 0.84 118.68 126.25 3mcg s LEU 121 Ca -0.09 -0.47 0.06 0.00 0.69 0.00 0.00 54.13 54.31 3mcg s LEU 121 Cb -0.10 -0.27 0.20 0.00 -0.43 0.00 0.00 46.19 45.59 3mcg s LEU 121 CO -0.08 -0.12 0.56 0.49 -0.29 0.00 0.00 176.35 176.91 3mcg n PHE 122 N 1.73 -2.03 0.27 5.38 3.72 -0.25 -4.96 117.46 121.33 3mcg n PHE 122 Ca -0.20 -2.57 0.13 0.00 -0.05 0.00 0.00 57.45 54.76 3mcg n PHE 122 Cb 0.55 0.69 0.79 0.00 -0.94 0.00 0.00 39.48 40.57 3mcg n PHE 122 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3mcg h PRO 123 N 4.94 0.00 -5.70 -1.08 0.13 -1.80 -3.41 132.00 125.08 3mcg h PRO 123 Ca 0.12 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.63 3mcg h PRO 123 Cb 0.98 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 31.99 3mcg h PRO 123 CO 0.27 0.06 -0.56 -1.25 -0.23 0.00 0.00 178.00 176.30 3mcg s PRO 124 N -4.50 2.06 0.00 1.56 0.04 -1.26 -4.26 135.00 128.64 3mcg s PRO 124 Ca -0.04 -2.05 0.00 0.00 0.04 0.00 0.00 61.00 58.95 3mcg s PRO 124 Cb 0.15 -1.74 0.00 0.00 0.04 0.00 0.00 34.50 32.95 3mcg s PRO 124 CO 0.58 -0.10 0.00 0.45 0.04 0.00 0.00 177.00 177.97 3mcg n SER 125 N -1.08 0.00 0.00 6.66 2.88 -1.26 -4.67 113.62 116.14 3mcg n SER 125 Ca -0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.49 3mcg n SER 125 Cb 0.66 0.02 0.00 0.00 -0.75 0.00 0.00 64.21 64.14 3mcg n SER 125 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 3mcg n SER 126 N -1.81 0.00 0.00 -3.46 2.88 -1.26 -4.43 113.62 105.54 3mcg n SER 126 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 3mcg n SER 126 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 3mcg n SER 126 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 3mcg n GLU 127 N 0.00 0.00 -0.28 -1.46 0.00 -1.26 -4.92 120.64 112.72 3mcg n GLU 127 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 3mcg n GLU 127 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 31.44 31.48 3mcg n GLU 127 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 3mcg n GLU 128 N -0.50 -0.16 -0.03 3.44 0.00 -1.26 -0.02 120.64 122.12 3mcg n GLU 128 Ca 0.00 1.13 -0.15 0.00 0.00 0.00 0.00 57.16 58.14 3mcg n GLU 128 Cb 0.00 -1.68 -0.10 0.00 0.00 0.00 0.00 31.44 29.66 3mcg n GLU 128 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 3mcg h LEU 129 N 0.00 0.38 -1.81 -1.84 -0.00 -1.90 0.15 115.31 110.28 3mcg h LEU 129 Ca 0.27 -0.67 -0.03 0.00 -0.00 0.00 0.00 57.88 57.45 3mcg h LEU 129 Cb 0.45 -0.11 -0.00 0.00 -0.00 0.00 0.00 40.66 41.00 3mcg h LEU 129 CO -0.73 0.99 -0.12 1.56 -0.00 0.00 0.00 178.44 180.14 3mcg h GLN 130 N -0.21 0.00 0.00 1.13 4.20 -0.82 -3.32 115.11 116.09 3mcg h GLN 130 Ca -0.03 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.56 3mcg h GLN 130 Cb 1.00 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.75 3mcg h GLN 130 CO 0.07 0.12 -1.83 0.00 -0.67 0.00 0.00 178.83 176.52 3mcg n ALA 131 N -2.48 2.11 -0.90 3.87 0.00 0.51 -5.06 120.51 118.56 3mcg n ALA 131 Ca -0.03 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.77 3mcg n ALA 131 Cb 0.20 -0.28 0.00 0.00 0.00 0.00 0.00 19.45 19.36 3mcg n ALA 131 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3mcg n ASN 132 N -2.27 0.00 0.00 0.00 4.13 0.01 -5.05 115.26 112.08 3mcg n ASN 132 Ca -0.13 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.13 3mcg n ASN 132 Cb 0.68 0.05 0.00 0.00 -1.54 0.00 0.00 39.78 38.96 3mcg n ASN 132 CO 0.00 0.00 0.00 2.29 0.28 0.00 0.00 177.26 179.83 3mcg n LYS 133 N -1.12 0.00 0.00 3.52 0.00 0.30 -3.38 118.16 117.48 3mcg n LYS 133 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 3mcg n LYS 133 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.03 3mcg n LYS 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3mcg n ALA 134 N -1.30 0.00 -3.55 0.58 0.00 -1.26 -4.45 120.51 110.53 3mcg n ALA 134 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 3mcg n ALA 134 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 3mcg n ALA 134 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3mcg s THR 135 N 0.00 0.00 -0.06 0.00 -1.32 -1.26 -4.74 115.64 108.26 3mcg s THR 135 Ca 0.00 0.00 -0.22 0.00 -1.21 0.00 0.00 61.69 60.26 3mcg s THR 135 Cb 0.00 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.95 3mcg s THR 135 CO 0.00 0.00 0.65 -0.76 -2.21 0.00 0.00 174.62 172.30 3mcg s LEU 136 N -1.55 4.33 -0.03 9.08 1.43 0.19 -4.38 118.68 127.74 3mcg s LEU 136 Ca 0.00 1.13 0.03 0.00 -1.03 0.00 0.00 54.13 54.26 3mcg s LEU 136 Cb -0.01 -3.00 0.01 0.00 0.03 0.00 0.00 46.19 43.22 3mcg s LEU 136 CO -0.01 -0.06 -0.10 -0.69 0.23 0.00 0.00 176.35 175.72 3mcg s VAL 137 N 0.59 0.89 -0.05 -1.59 1.01 -1.26 -1.08 120.40 118.92 3mcg s VAL 137 Ca 0.35 -0.40 0.06 0.00 0.00 0.00 0.00 61.98 61.98 3mcg s VAL 137 Cb -0.17 -0.80 -0.01 0.00 0.00 0.00 0.00 36.38 35.40 3mcg s VAL 137 CO 0.17 0.28 -0.22 0.00 0.00 0.00 0.00 175.10 175.33 3mcg s LEU 139 N -0.13 2.96 -0.11 0.00 1.02 0.25 -0.45 118.68 122.22 3mcg s LEU 139 Ca -0.02 -1.30 -0.21 0.00 0.02 0.00 0.00 54.13 52.62 3mcg s LEU 139 Cb -0.12 -1.33 -0.04 0.00 0.02 0.00 0.00 46.19 44.72 3mcg s LEU 139 CO 0.03 -0.23 0.60 0.27 0.02 0.00 0.00 176.35 177.04 3mcg s ILE 140 N 1.27 5.09 -0.15 -0.59 -0.00 0.63 -0.79 121.20 126.66 3mcg s ILE 140 Ca -0.06 1.21 -0.27 0.00 -0.00 0.00 0.00 60.65 61.54 3mcg s ILE 140 Cb -0.19 -3.94 -0.25 0.00 -0.00 0.00 0.00 42.46 38.08 3mcg s ILE 140 CO -0.06 0.25 0.66 -1.28 -0.00 0.00 0.00 174.94 174.51 3mcg h SER 141 N 6.89 0.05 -5.74 4.36 0.87 -1.41 -3.28 113.55 115.29 3mcg h SER 141 Ca -0.39 -0.89 0.30 0.00 -1.23 0.00 0.00 61.79 59.58 3mcg h SER 141 Cb 1.18 -0.02 -0.07 0.00 -0.44 0.00 0.00 62.40 63.05 3mcg h SER 141 CO 0.76 1.15 0.83 1.51 -0.53 0.00 0.00 176.83 180.54 3mcg s ASP 142 N -6.43 -0.01 0.00 6.23 -4.77 -1.26 -4.64 116.67 105.80 3mcg s ASP 142 Ca -0.21 -0.28 0.00 0.00 -3.30 0.00 0.00 52.55 48.76 3mcg s ASP 142 Cb -0.01 0.22 0.00 0.00 -1.09 0.00 0.00 42.92 42.04 3mcg s ASP 142 CO 0.68 -0.43 0.00 2.22 0.70 0.00 0.00 175.17 178.34 3mcg n PHE 143 N -0.79 0.00 -0.16 2.11 1.16 -1.21 -2.54 117.46 116.03 3mcg n PHE 143 Ca 0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 57.45 55.54 3mcg n PHE 143 Cb 0.59 0.00 0.04 0.00 -1.61 0.00 0.00 39.48 38.51 3mcg n PHE 143 CO 0.00 0.00 0.00 -0.92 -1.87 0.00 0.00 176.76 173.97 3mcg h TYR 144 N 0.00 0.44 -0.11 2.97 -0.00 -1.83 -3.30 116.97 115.14 3mcg h TYR 144 Ca 0.00 0.02 0.04 0.00 -0.00 0.00 0.00 58.73 58.79 3mcg h TYR 144 Cb 0.00 -0.13 -0.04 0.00 -0.00 0.00 0.00 36.73 36.56 3mcg h TYR 144 CO 0.00 0.21 -0.12 -1.35 -0.00 0.00 0.00 178.16 176.90 3mcg h PRO 145 N 0.47 -0.15 -3.96 1.82 0.11 -1.89 -3.40 132.00 125.00 3mcg h PRO 145 Ca 0.21 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.33 3mcg h PRO 145 Cb 0.13 0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.27 3mcg h PRO 145 CO -0.15 -0.10 -0.05 0.41 -0.21 0.00 0.00 178.00 177.90 3mcg n GLY 146 N -1.26 -0.75 2.74 -0.55 0.00 -1.25 -5.01 105.19 99.11 3mcg n GLY 146 Ca -0.03 0.17 -0.05 0.00 0.00 0.00 0.00 46.02 46.10 3mcg n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mcg n ALA 147 N -1.10 -1.99 -3.66 4.61 0.00 -1.26 -5.13 120.51 111.97 3mcg n ALA 147 Ca 0.01 -1.02 -0.06 0.00 0.00 0.00 0.00 53.44 52.37 3mcg n ALA 147 Cb 0.43 -1.70 -0.01 0.00 0.00 0.00 0.00 19.45 18.17 3mcg n ALA 147 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 3mcg n VAL 148 N 2.38 0.00 -3.68 0.00 3.14 -1.26 -3.82 118.33 115.09 3mcg n VAL 148 Ca 0.13 -1.05 -0.15 0.00 -2.96 0.00 0.00 64.34 60.32 3mcg n VAL 148 Cb 0.60 0.73 -0.08 0.00 -1.06 0.00 0.00 33.84 34.03 3mcg n VAL 148 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 3mcg s THR 149 N -2.59 0.02 -0.02 1.55 2.01 -0.00 -5.03 115.64 111.58 3mcg s THR 149 Ca 0.17 -0.20 0.05 0.00 0.31 0.00 0.00 61.69 62.02 3mcg s THR 149 Cb -0.02 -0.74 -0.01 0.00 0.01 0.00 0.00 72.50 71.74 3mcg s THR 149 CO 0.12 -0.11 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.09 3mcg s VAL 150 N -0.79 1.30 0.38 3.82 1.01 -1.25 -0.55 120.40 124.31 3mcg s VAL 150 Ca -0.09 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.24 3mcg s VAL 150 Cb -0.03 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 3mcg s VAL 150 CO 0.05 0.37 0.08 0.00 0.00 0.00 0.00 175.10 175.59 3mcg s ALA 151 N -0.32 2.79 -0.06 5.51 0.00 0.91 -4.96 121.76 125.65 3mcg s ALA 151 Ca 0.05 -1.59 -0.04 0.00 0.00 0.00 0.00 51.96 50.38 3mcg s ALA 151 Cb -0.07 0.60 0.02 0.00 0.00 0.00 0.00 23.12 23.67 3mcg s ALA 151 CO -0.00 -0.28 0.14 -1.58 0.00 0.00 0.00 175.76 174.04 3mcg s TRP 152 N -3.19 -0.16 -0.08 0.00 0.52 -1.26 -0.04 118.94 114.73 3mcg s TRP 152 Ca 0.28 0.41 0.03 0.00 0.02 0.00 0.00 56.10 56.84 3mcg s TRP 152 Cb 0.06 0.02 0.01 0.00 -1.15 0.00 0.00 33.47 32.41 3mcg s TRP 152 CO 0.14 -0.10 -0.17 0.21 0.02 0.00 0.00 176.95 177.05 3mcg s LYS 153 N 0.34 2.22 -0.48 4.98 2.47 0.07 -4.32 119.74 125.03 3mcg s LYS 153 Ca -0.02 -0.60 -0.16 0.00 -1.56 0.00 0.00 55.97 53.62 3mcg s LYS 153 Cb -0.04 -1.75 0.07 0.00 -1.46 0.00 0.00 37.83 34.65 3mcg s LYS 153 CO -0.01 0.10 0.44 0.00 0.16 0.00 0.00 175.35 176.03 3mcg s ALA 154 N 0.50 3.53 0.00 3.13 0.00 0.13 -0.87 121.76 128.19 3mcg s ALA 154 Ca -0.16 -2.04 0.00 0.00 0.00 0.00 0.00 51.96 49.77 3mcg s ALA 154 Cb -0.16 -3.12 0.00 0.00 0.00 0.00 0.00 23.12 19.84 3mcg s ALA 154 CO 0.06 -1.78 0.00 -3.47 0.00 0.00 0.00 175.76 170.57 3mcg n ASP 155 N 5.38 -1.04 0.00 0.00 -0.08 0.30 -2.32 116.55 118.80 3mcg n ASP 155 Ca -0.11 0.09 0.00 0.00 -1.51 0.00 0.00 54.79 53.26 3mcg n ASP 155 Cb 0.44 -0.23 0.00 0.00 2.34 0.00 0.00 41.12 43.67 3mcg n ASP 155 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3mcg n GLY 156 N 0.84 1.63 3.09 0.27 0.00 -1.26 -4.94 105.19 104.81 3mcg n GLY 156 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 3mcg n GLY 156 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3mcg s SER 157 N -0.54 1.82 0.22 1.61 0.01 -0.98 -5.05 113.70 110.80 3mcg s SER 157 Ca 0.00 -0.29 -0.31 0.00 1.31 0.00 0.00 55.95 56.66 3mcg s SER 157 Cb 0.00 -0.49 -0.11 0.00 0.21 0.00 0.00 66.02 65.63 3mcg s SER 157 CO 0.00 0.12 1.57 -2.16 0.41 0.00 0.00 173.24 173.18 3mcg s PRO 158 N 0.09 4.19 0.67 12.44 0.04 -1.26 -0.69 135.00 150.47 3mcg s PRO 158 Ca -0.03 2.44 -0.05 0.00 0.04 0.00 0.00 61.00 63.40 3mcg s PRO 158 Cb -0.10 -3.10 0.05 0.00 0.04 0.00 0.00 34.50 31.39 3mcg s PRO 158 CO 0.01 -0.59 0.96 0.14 0.04 0.00 0.00 177.00 177.57 3mcg s VAL 159 N 0.59 2.42 0.07 -0.36 -7.23 -1.26 -4.88 120.40 109.76 3mcg s VAL 159 Ca 0.67 -0.33 0.02 0.00 -1.81 0.00 0.00 61.98 60.53 3mcg s VAL 159 Cb -0.45 -3.03 -0.03 0.00 0.56 0.00 0.00 36.38 33.43 3mcg s VAL 159 CO 0.38 -0.03 -0.07 -0.54 -0.31 0.00 0.00 175.10 174.54 3mcg s LYS 160 N -5.14 0.69 -1.39 4.82 -0.14 -1.26 -4.79 119.74 112.54 3mcg s LYS 160 Ca 0.59 -1.08 -0.09 0.00 -1.36 0.00 0.00 55.97 54.03 3mcg s LYS 160 Cb -0.11 -0.23 0.03 0.00 -1.68 0.00 0.00 37.83 35.85 3mcg s LYS 160 CO 0.44 0.01 1.07 0.00 -0.76 0.00 0.00 175.35 176.10 3mcg n ALA 161 N 0.61 -1.44 -2.74 5.17 0.00 -1.26 -4.84 120.51 116.00 3mcg n ALA 161 Ca -0.17 0.25 -0.08 0.00 0.00 0.00 0.00 53.44 53.44 3mcg n ALA 161 Cb 0.58 -4.60 0.06 0.00 0.00 0.00 0.00 19.45 15.49 3mcg n ALA 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mcg n GLY 162 N -1.79 0.02 3.65 0.00 0.00 -1.26 -5.07 105.19 100.74 3mcg n GLY 162 Ca -0.04 0.17 -0.02 0.00 0.00 0.00 0.00 46.02 46.12 3mcg n GLY 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mcg s VAL 163 N 0.63 0.00 -0.18 1.61 0.11 -1.26 -4.82 120.40 116.49 3mcg s VAL 163 Ca 0.31 0.00 -0.09 0.00 -2.93 0.00 0.00 61.98 59.27 3mcg s VAL 163 Cb 0.24 -1.00 0.07 0.00 -1.53 0.00 0.00 36.38 34.15 3mcg s VAL 163 CO -0.22 0.00 0.41 -1.61 -3.33 0.00 0.00 175.10 170.35 3mcg s GLU 164 N -0.04 0.37 0.05 1.54 0.41 -0.27 -4.99 118.70 115.78 3mcg s GLU 164 Ca 0.08 0.85 -0.07 0.00 -0.41 0.00 0.00 54.97 55.42 3mcg s GLU 164 Cb -0.05 0.06 -0.01 0.00 -1.78 0.00 0.00 34.13 32.36 3mcg s GLU 164 CO -0.16 -0.18 0.14 0.99 -0.49 0.00 0.00 175.26 175.56 3mcg s THR 165 N 1.71 0.14 0.00 3.63 2.01 -1.26 -1.17 115.64 120.70 3mcg s THR 165 Ca -0.08 -1.11 0.00 0.00 0.31 0.00 0.00 61.69 60.81 3mcg s THR 165 Cb -0.09 -1.07 0.00 0.00 0.01 0.00 0.00 72.50 71.35 3mcg s THR 165 CO -0.13 -0.61 0.00 0.35 -0.69 0.00 0.00 174.62 173.54 3mcg n THR 166 N 0.47 0.00 0.00 -0.82 -2.24 -1.26 -5.11 114.28 105.32 3mcg n THR 166 Ca -0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 3mcg n THR 166 Cb 0.60 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 3mcg n THR 166 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 3mcg n LYS 167 N 0.00 0.00 -0.12 -0.78 0.00 -1.26 -4.94 118.16 111.06 3mcg n LYS 167 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 58.31 58.10 3mcg n LYS 167 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 35.03 34.96 3mcg n LYS 167 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 3mcg n PRO 168 N -0.22 0.56 -3.29 -1.58 -0.04 -1.26 -4.61 135.00 124.55 3mcg n PRO 168 Ca 0.00 0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.70 3mcg n PRO 168 Cb 0.00 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.01 3mcg n PRO 168 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3mcg n SER 169 N -4.31 0.00 0.00 3.54 3.41 -1.26 -1.15 113.62 113.85 3mcg n SER 169 Ca -0.38 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.23 3mcg n SER 169 Cb 0.73 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.68 3mcg n SER 169 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 3mcg n LYS 170 N 0.00 0.00 0.00 4.33 3.00 -1.26 -5.03 118.16 119.20 3mcg n LYS 170 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 3mcg n LYS 170 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 3mcg n LYS 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3mcg n GLN 171 N 0.00 0.00 -0.11 1.64 0.00 -1.26 -4.79 117.38 112.86 3mcg n GLN 171 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 57.00 56.79 3mcg n GLN 171 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 30.24 30.16 3mcg n GLN 171 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 3mcg n SER 172 N -3.35 1.71 0.00 2.61 2.88 -1.26 -4.93 113.62 111.27 3mcg n SER 172 Ca 0.00 0.18 0.00 0.00 -1.33 0.00 0.00 58.87 57.72 3mcg n SER 172 Cb 0.00 -0.56 0.00 0.00 -0.75 0.00 0.00 64.21 62.90 3mcg n SER 172 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 3mcg n ASN 173 N -3.77 0.00 0.00 -3.46 5.15 -1.26 -5.00 115.26 106.92 3mcg n ASN 173 Ca -0.41 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.57 3mcg n ASN 173 Cb 0.82 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 40.07 3mcg n ASN 173 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 3mcg n ASN 174 N 0.00 0.00 -0.59 1.20 5.03 -1.26 -5.06 115.26 114.59 3mcg n ASN 174 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 3mcg n ASN 174 Cb 0.00 0.06 0.00 0.00 -1.02 0.00 0.00 39.78 38.82 3mcg n ASN 174 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3mcg n LYS 175 N -1.36 0.00 -3.74 3.52 5.02 -1.26 -4.74 118.16 115.59 3mcg n LYS 175 Ca 0.00 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.13 3mcg n LYS 175 Cb 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 35.03 34.85 3mcg n LYS 175 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3mcg s TYR 176 N -4.61 -0.02 -0.01 2.13 1.51 -1.24 -4.61 117.35 110.49 3mcg s TYR 176 Ca 0.00 0.26 -0.28 0.00 -1.01 0.00 0.00 57.07 56.04 3mcg s TYR 176 Cb 0.00 -0.26 0.10 0.00 -0.11 0.00 0.00 41.96 41.69 3mcg s TYR 176 CO 0.00 -0.14 0.87 0.00 -1.11 0.00 0.00 175.55 175.17 3mcg s ALA 177 N 1.41 -1.81 0.03 3.71 0.00 -0.30 -4.15 121.76 120.64 3mcg s ALA 177 Ca -0.05 1.04 0.01 0.00 0.00 0.00 0.00 51.96 52.96 3mcg s ALA 177 Cb -0.12 0.32 -0.00 0.00 0.00 0.00 0.00 23.12 23.31 3mcg s ALA 177 CO -0.04 -0.64 0.02 0.00 0.00 0.00 0.00 175.76 175.10 3mcg n ALA 178 N -0.11 0.06 -3.11 0.00 0.00 -1.24 -4.11 120.51 112.00 3mcg n ALA 178 Ca -0.10 -0.17 -0.17 0.00 0.00 0.00 0.00 53.44 53.00 3mcg n ALA 178 Cb 0.61 0.13 -0.15 0.00 0.00 0.00 0.00 19.45 20.04 3mcg n ALA 178 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3mcg s SER 179 N -1.20 0.72 0.24 0.00 1.04 -1.26 -0.27 113.70 112.97 3mcg s SER 179 Ca 0.03 -0.10 0.06 0.00 0.48 0.00 0.00 55.95 56.42 3mcg s SER 179 Cb 0.00 -0.20 -0.03 0.00 0.10 0.00 0.00 66.02 65.89 3mcg s SER 179 CO 0.02 0.02 0.25 -0.44 0.98 0.00 0.00 173.24 174.07 3mcg s SER 180 N 0.29 5.83 -0.15 7.02 0.01 0.40 -4.59 113.70 122.52 3mcg s SER 180 Ca -0.03 -0.11 -0.09 0.00 1.31 0.00 0.00 55.95 57.03 3mcg s SER 180 Cb -0.07 -1.59 0.05 0.00 0.21 0.00 0.00 66.02 64.62 3mcg s SER 180 CO -0.00 -0.04 0.36 -0.72 0.41 0.00 0.00 173.24 173.25 3mcg s TYR 181 N -2.03 -0.50 -0.04 2.43 1.13 -0.31 -0.61 117.35 117.42 3mcg s TYR 181 Ca 0.33 1.11 0.06 0.00 -1.41 0.00 0.00 57.07 57.16 3mcg s TYR 181 Cb -0.09 0.19 -0.01 0.00 -1.10 0.00 0.00 41.96 40.95 3mcg s TYR 181 CO 0.26 -0.29 -0.23 -0.51 -2.51 0.00 0.00 175.55 172.28 3mcg s LEU 182 N 1.13 2.03 0.40 -3.49 1.02 -0.24 -1.11 118.68 118.41 3mcg s LEU 182 Ca -0.08 -0.45 0.23 0.00 0.02 0.00 0.00 54.13 53.86 3mcg s LEU 182 Cb -0.08 -1.23 0.30 0.00 0.02 0.00 0.00 46.19 45.20 3mcg s LEU 182 CO -0.09 0.25 1.53 0.28 0.02 0.00 0.00 176.35 178.33 3mcg h SER 183 N 5.88 0.00 0.00 2.29 0.02 -1.88 0.58 113.55 120.45 3mcg h SER 183 Ca -0.36 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 3mcg h SER 183 Cb 1.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.70 3mcg h SER 183 CO 0.47 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 176.34 3mcg n LEU 184 N -3.01 0.00 -4.78 5.07 7.99 -1.26 -4.41 117.00 116.60 3mcg n LEU 184 Ca 0.03 0.00 -0.34 0.00 -0.01 0.00 0.00 56.01 55.70 3mcg n LEU 184 Cb 0.53 0.00 0.01 0.00 -0.11 0.00 0.00 43.42 43.85 3mcg n LEU 184 CO 0.35 0.00 0.75 0.42 -1.51 0.00 0.00 177.39 177.40 3mcg s THR 185 N 0.00 3.35 0.00 -5.08 -4.23 -1.26 -4.21 115.64 104.21 3mcg s THR 185 Ca 0.00 0.74 0.00 0.00 -1.18 0.00 0.00 61.69 61.25 3mcg s THR 185 Cb 0.00 -3.26 0.00 0.00 1.34 0.00 0.00 72.50 70.58 3mcg s THR 185 CO 0.00 -0.29 0.00 -2.65 -0.54 0.00 0.00 174.62 171.14 3mcg n PRO 186 N -1.75 0.00 0.18 3.99 -0.01 -1.22 0.18 135.00 136.37 3mcg n PRO 186 Ca 0.10 0.00 0.05 0.00 -0.01 0.00 0.00 63.50 63.64 3mcg n PRO 186 Cb 0.52 0.00 0.49 0.00 -0.01 0.00 0.00 33.50 34.50 3mcg n PRO 186 CO 0.00 0.00 0.00 1.05 -0.01 0.00 0.00 175.50 176.54 3mcg h GLU 187 N 0.00 0.11 -0.35 -0.52 -0.00 -1.92 1.73 114.58 113.63 3mcg h GLU 187 Ca 0.00 -0.02 -0.04 0.00 -0.00 0.00 0.00 59.36 59.30 3mcg h GLU 187 Cb 0.00 -0.02 -0.02 0.00 -0.00 0.00 0.00 28.75 28.71 3mcg h GLU 187 CO 0.00 0.21 0.04 1.96 -0.00 0.00 0.00 179.01 181.22 3mcg h GLN 188 N 0.11 0.53 0.00 1.06 7.50 0.16 0.14 115.11 124.61 3mcg h GLN 188 Ca 0.03 -0.10 0.00 0.00 0.50 0.00 0.00 58.65 59.07 3mcg h GLN 188 Cb 0.23 -0.08 0.00 0.00 0.05 0.00 0.00 27.48 27.68 3mcg h GLN 188 CO 0.01 0.53 0.00 1.87 -1.50 0.00 0.00 178.83 179.74 3mcg n TRP 189 N -4.30 0.00 -0.29 2.96 -0.00 0.55 -4.08 117.44 112.28 3mcg n TRP 189 Ca 0.02 0.00 0.07 0.00 -0.00 0.00 0.00 57.50 57.59 3mcg n TRP 189 Cb 0.22 0.00 0.22 0.00 -0.00 0.00 0.00 31.31 31.75 3mcg n TRP 189 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 177.69 179.26 3mcg h LYS 190 N 0.00 0.57 -1.18 5.87 2.10 -0.62 3.01 116.57 126.33 3mcg h LYS 190 Ca 0.00 -0.03 0.34 0.00 -2.00 0.00 0.00 60.65 58.96 3mcg h LYS 190 Cb 0.00 -0.13 -0.05 0.00 -0.90 0.00 0.00 32.23 31.15 3mcg h LYS 190 CO 0.00 0.38 1.03 1.03 -2.00 0.00 0.00 179.45 179.89 3mcg h SER 191 N 0.59 0.00 0.00 7.07 0.87 -0.92 1.33 113.55 122.50 3mcg h SER 191 Ca 0.46 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.02 3mcg h SER 191 Cb 0.66 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.62 3mcg h SER 191 CO -0.37 0.00 0.00 1.41 -0.53 0.00 0.00 176.83 177.34 3mcg n HIS 192 N -3.73 0.00 0.00 2.24 8.25 1.01 -4.91 115.22 118.07 3mcg n HIS 192 Ca 0.26 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.72 3mcg n HIS 192 Cb 1.40 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.51 3mcg n HIS 192 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3mcg n ARG 193 N -0.70 0.00 0.00 -0.41 5.12 0.46 -3.62 116.66 117.50 3mcg n ARG 193 Ca 0.05 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.97 3mcg n ARG 193 Cb 0.02 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.32 3mcg n ARG 193 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3mcg n SER 194 N 3.88 0.00 -4.32 0.55 2.88 -1.26 -4.87 113.62 110.48 3mcg n SER 194 Ca 0.00 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.18 3mcg n SER 194 Cb 0.00 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.32 3mcg n SER 194 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 3mcg s TYR 195 N -1.44 3.02 0.24 0.66 1.51 -0.43 0.11 117.35 121.03 3mcg s TYR 195 Ca 0.00 -0.95 -0.03 0.00 -1.01 0.00 0.00 57.07 55.08 3mcg s TYR 195 Cb 0.00 -2.15 -0.05 0.00 -0.11 0.00 0.00 41.96 39.66 3mcg s TYR 195 CO 0.00 -0.55 0.47 -1.54 -1.11 0.00 0.00 175.55 172.82 3mcg s SER 196 N 1.48 6.42 -0.06 2.29 1.04 -0.04 0.71 113.70 125.54 3mcg s SER 196 Ca 0.05 0.56 -0.05 0.00 0.48 0.00 0.00 55.95 56.99 3mcg s SER 196 Cb -0.15 -2.08 -0.04 0.00 0.10 0.00 0.00 66.02 63.85 3mcg s SER 196 CO -0.01 -0.11 0.16 0.00 0.98 0.00 0.00 173.24 174.26 3mcg s GLN 198 N -1.51 1.91 -0.96 0.00 0.74 0.94 -1.45 119.66 119.32 3mcg s GLN 198 Ca 0.21 -2.08 -0.18 0.00 0.05 0.00 0.00 55.36 53.36 3mcg s GLN 198 Cb -0.12 -3.44 0.13 0.00 1.10 0.00 0.00 33.01 30.68 3mcg s GLN 198 CO 0.12 -1.05 1.17 0.08 -0.55 0.00 0.00 175.29 175.06 3mcg s VAL 199 N 0.64 4.73 -0.44 1.34 1.01 0.65 -0.06 120.40 128.27 3mcg s VAL 199 Ca 0.12 -1.66 -0.26 0.00 0.00 0.00 0.00 61.98 60.17 3mcg s VAL 199 Cb -0.22 -4.80 0.02 0.00 0.00 0.00 0.00 36.38 31.38 3mcg s VAL 199 CO -0.05 -1.54 0.98 0.28 0.00 0.00 0.00 175.10 174.78 3mcg s THR 200 N 2.65 4.43 -0.07 3.92 -1.32 0.29 0.32 115.64 125.86 3mcg s THR 200 Ca 0.34 1.00 -0.02 0.00 -1.21 0.00 0.00 61.69 61.80 3mcg s THR 200 Cb -0.04 -4.45 0.04 0.00 -1.51 0.00 0.00 72.50 66.53 3mcg s THR 200 CO -0.08 -0.80 0.05 -2.28 -2.21 0.00 0.00 174.62 169.30 3mcg s HIS 201 N 3.86 0.22 -0.98 9.09 5.65 0.05 -0.82 115.29 132.36 3mcg s HIS 201 Ca 0.40 0.04 -0.14 0.00 0.25 0.00 0.00 55.06 55.62 3mcg s HIS 201 Cb -0.10 -0.59 0.02 0.00 -1.18 0.00 0.00 32.58 30.72 3mcg s HIS 201 CO 0.25 -0.29 0.65 -1.91 -0.65 0.00 0.00 174.74 172.80 3mcg n GLU 202 N 5.26 -1.04 0.00 2.88 0.00 -1.25 -0.78 120.64 125.71 3mcg n GLU 202 Ca -0.05 0.53 0.00 0.00 0.00 0.00 0.00 57.16 57.64 3mcg n GLU 202 Cb 0.50 -2.67 0.00 0.00 0.00 0.00 0.00 31.44 29.27 3mcg n GLU 202 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3mcg n GLY 203 N -1.82 1.37 3.71 8.31 0.00 -1.26 -4.87 105.19 110.63 3mcg n GLY 203 Ca -0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.42 3mcg n GLY 203 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3mcg s SER 204 N 0.00 6.66 -0.14 1.61 1.04 0.04 -5.07 113.70 117.84 3mcg s SER 204 Ca 0.00 0.78 -0.10 0.00 0.48 0.00 0.00 55.95 57.11 3mcg s SER 204 Cb 0.00 -2.28 -0.05 0.00 0.10 0.00 0.00 66.02 63.79 3mcg s SER 204 CO 0.00 -0.02 0.19 0.28 0.98 0.00 0.00 173.24 174.66 3mcg s THR 205 N 0.78 5.40 0.20 2.02 -1.32 -1.26 -0.77 115.64 120.69 3mcg s THR 205 Ca 0.25 0.32 0.06 0.00 -1.21 0.00 0.00 61.69 61.11 3mcg s THR 205 Cb -0.15 -3.49 -0.05 0.00 -1.51 0.00 0.00 72.50 67.30 3mcg s THR 205 CO 0.10 0.52 -0.09 0.68 -2.21 0.00 0.00 174.62 173.63 3mcg s VAL 206 N -0.37 1.38 0.00 5.08 -7.23 0.15 -4.95 120.40 114.46 3mcg s VAL 206 Ca 0.14 -2.11 0.00 0.00 -1.81 0.00 0.00 61.98 58.20 3mcg s VAL 206 Cb -0.12 -2.10 0.00 0.00 0.56 0.00 0.00 36.38 34.72 3mcg s VAL 206 CO 0.03 -0.55 0.00 -1.84 -0.31 0.00 0.00 175.10 172.43 3mcg n GLU 207 N -0.35 0.00 -4.02 4.82 0.28 -1.26 -0.26 120.64 119.85 3mcg n GLU 207 Ca -0.08 0.00 -0.24 0.00 -0.16 0.00 0.00 57.16 56.68 3mcg n GLU 207 Cb 0.62 0.00 -0.17 0.00 1.43 0.00 0.00 31.44 33.32 3mcg n GLU 207 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 3mcg s LYS 208 N -1.74 1.18 0.15 3.44 1.02 -0.53 -4.92 119.74 118.34 3mcg s LYS 208 Ca 0.00 -0.15 -0.08 0.00 0.02 0.00 0.00 55.97 55.76 3mcg s LYS 208 Cb 0.00 -1.26 -0.06 0.00 -0.52 0.00 0.00 37.83 35.99 3mcg s LYS 208 CO 0.00 -0.20 0.44 -0.08 -0.92 0.00 0.00 175.35 174.59 3mcg s THR 209 N 1.47 5.07 -0.02 2.17 -1.32 -1.26 0.11 115.64 121.86 3mcg s THR 209 Ca -0.01 0.30 -0.01 0.00 -1.21 0.00 0.00 61.69 60.76 3mcg s THR 209 Cb -0.13 -3.63 0.01 0.00 -1.51 0.00 0.00 72.50 67.24 3mcg s THR 209 CO -0.04 0.08 0.03 -0.69 -2.21 0.00 0.00 174.62 171.79 3mcg s VAL 210 N -1.63 -0.02 0.00 5.08 1.01 0.22 -4.77 120.40 120.29 3mcg s VAL 210 Ca 0.41 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.48 3mcg s VAL 210 Cb -0.12 -0.07 0.00 0.00 0.00 0.00 0.00 36.38 36.19 3mcg s VAL 210 CO 0.22 0.04 0.00 0.00 0.00 0.00 0.00 175.10 175.35 3mcg n ALA 211 N 3.55 0.00 -3.04 5.51 0.00 -1.26 -1.31 120.51 123.95 3mcg n ALA 211 Ca -0.19 0.00 -0.45 0.00 0.00 0.00 0.00 53.44 52.81 3mcg n ALA 211 Cb 0.56 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.98 3mcg n ALA 211 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3mcg s PRO 212 N 1.23 3.40 -0.02 0.00 0.04 -1.26 -4.65 135.00 133.73 3mcg s PRO 212 Ca 0.00 -1.67 0.09 0.00 0.04 0.00 0.00 61.00 59.46 3mcg s PRO 212 Cb 0.00 -4.57 -0.14 0.00 0.04 0.00 0.00 34.50 29.83 3mcg s PRO 212 CO 0.00 -1.63 0.18 -2.37 0.04 0.00 0.00 177.00 173.22 3mcg n THR 213 N 5.27 0.09 0.00 1.26 5.66 -1.26 -5.08 114.28 120.22 3mcg n THR 213 Ca 0.10 -0.24 0.00 0.00 -3.05 0.00 0.00 64.05 60.86 3mcg n THR 213 Cb 0.46 0.12 0.00 0.00 -1.55 0.00 0.00 70.33 69.37 3mcg n THR 213 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 3mcg n GLU 214 N -1.91 0.00 -2.94 1.09 2.13 -1.26 -4.01 120.64 113.74 3mcg n GLU 214 Ca -0.04 0.00 -0.43 0.00 0.66 0.00 0.00 57.16 57.35 3mcg n GLU 214 Cb 0.33 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 31.99 3mcg n GLU 214 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72