#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5o h SER 2 N 0.00 -0.31 -0.58 1.61 0.87 -2.15 -3.47 113.55 109.52 1x5o h SER 2 Ca 0.00 -0.22 -0.67 0.00 -1.23 0.00 0.00 61.79 59.67 1x5o h SER 2 Cb 0.00 0.08 -0.13 0.00 -0.44 0.00 0.00 62.40 61.91 1x5o h SER 2 CO 0.00 0.13 -0.53 -0.94 -0.53 0.00 0.00 176.83 174.96 1x5o s SER 3 N -5.19 4.08 0.05 6.23 1.04 -1.26 -5.16 113.70 113.49 1x5o s SER 3 Ca -0.13 -1.61 0.00 0.00 0.48 0.00 0.00 55.95 54.69 1x5o s SER 3 Cb 0.01 0.38 0.00 0.00 0.10 0.00 0.00 66.02 66.51 1x5o s SER 3 CO 0.50 -0.79 0.00 0.61 0.98 0.00 0.00 173.24 174.54 1x5o n GLY 4 N -1.22 1.42 3.63 7.32 0.00 -1.26 -5.14 105.19 109.94 1x5o n GLY 4 Ca -0.17 -1.99 -0.11 0.00 0.00 0.00 0.00 46.02 43.75 1x5o n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x5o s SER 5 N -1.00 -0.76 0.00 1.61 0.15 -1.26 -5.02 113.70 107.42 1x5o s SER 5 Ca 0.00 1.38 0.00 0.00 0.70 0.00 0.00 55.95 58.03 1x5o s SER 5 Cb 0.00 1.37 0.00 0.00 -1.71 0.00 0.00 66.02 65.68 1x5o s SER 5 CO 0.00 -0.23 0.00 -1.54 1.20 0.00 0.00 173.24 172.67 1x5o n SER 6 N 3.09 2.43 0.00 5.45 3.41 -1.26 -5.15 113.62 121.59 1x5o n SER 6 Ca -0.16 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 1x5o n SER 6 Cb 0.56 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.51 1x5o n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x5o n GLY 7 N 3.19 2.75 3.21 5.00 0.00 -1.26 -5.13 105.19 112.94 1x5o n GLY 7 Ca 0.00 -1.32 -0.20 0.00 0.00 0.00 0.00 46.02 44.50 1x5o n GLY 7 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1x5o s LEU 8 N 0.00 2.29 0.13 0.99 2.34 -1.26 -5.10 118.68 118.07 1x5o s LEU 8 Ca 0.00 -0.65 -0.35 0.00 0.06 0.00 0.00 54.13 53.20 1x5o s LEU 8 Cb 0.00 -0.62 -0.15 0.00 -0.56 0.00 0.00 46.19 44.86 1x5o s LEU 8 CO 0.00 -0.04 1.53 1.17 -1.06 0.00 0.00 176.35 177.94 1x5o n LYS 9 N 1.19 1.89 -0.03 1.48 4.81 -1.26 -4.88 118.16 121.36 1x5o n LYS 9 Ca -0.20 0.68 -0.05 0.00 -0.87 0.00 0.00 58.31 57.87 1x5o n LYS 9 Cb 0.54 -2.42 -0.03 0.00 0.02 0.00 0.00 35.03 33.14 1x5o n LYS 9 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1x5o n ALA 10 N 3.29 1.95 -3.13 3.14 0.00 -1.26 -5.07 120.51 119.43 1x5o n ALA 10 Ca 0.18 -0.26 -0.12 0.00 0.00 0.00 0.00 53.44 53.23 1x5o n ALA 10 Cb 0.26 0.36 -0.11 0.00 0.00 0.00 0.00 19.45 19.97 1x5o n ALA 10 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1x5o s SER 11 N -4.71 -0.17 0.00 0.00 0.01 -1.26 -5.08 113.70 102.49 1x5o s SER 11 Ca -0.08 0.26 0.00 0.00 1.31 0.00 0.00 55.95 57.43 1x5o s SER 11 Cb 0.02 0.39 0.00 0.00 0.21 0.00 0.00 66.02 66.64 1x5o s SER 11 CO 0.14 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.20 1x5o n GLY 12 N 2.37 -1.81 3.71 3.44 0.00 -1.26 -5.16 105.19 106.48 1x5o n GLY 12 Ca -0.16 0.75 -0.35 0.00 0.00 0.00 0.00 46.02 46.25 1x5o n GLY 12 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x5o s VAL 13 N 0.00 5.01 0.91 1.61 1.01 -1.26 -5.07 120.40 122.61 1x5o s VAL 13 Ca 0.00 0.04 -0.15 0.00 0.00 0.00 0.00 61.98 61.87 1x5o s VAL 13 Cb 0.00 -3.24 -0.07 0.00 0.00 0.00 0.00 36.38 33.07 1x5o s VAL 13 CO 0.00 0.50 -0.15 0.00 0.00 0.00 0.00 175.10 175.45 1x5o n GLN 14 N 3.07 -0.06 -0.04 2.72 -0.00 -1.26 -4.97 117.38 116.85 1x5o n GLN 14 Ca -0.17 0.00 -0.08 0.00 -0.00 0.00 0.00 57.00 56.75 1x5o n GLN 14 Cb 0.53 -1.41 -0.03 0.00 -0.00 0.00 0.00 30.24 29.33 1x5o n GLN 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1x5o n ALA 15 N -2.80 2.44 -3.28 2.61 0.00 -1.26 -5.07 120.51 113.15 1x5o n ALA 15 Ca 0.03 -0.33 -0.13 0.00 0.00 0.00 0.00 53.44 53.02 1x5o n ALA 15 Cb 0.54 0.37 -0.11 0.00 0.00 0.00 0.00 19.45 20.24 1x5o n ALA 15 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1x5o s GLN 16 N -2.17 0.32 0.03 0.00 1.03 -1.26 -5.08 119.66 112.54 1x5o s GLN 16 Ca -0.12 0.44 -0.19 0.00 0.04 0.00 0.00 55.36 55.54 1x5o s GLN 16 Cb 0.04 0.12 -0.10 0.00 0.03 0.00 0.00 33.01 33.10 1x5o s GLN 16 CO 0.15 -0.06 1.29 0.52 -2.54 0.00 0.00 175.29 174.64 1x5o h MET 17 N 5.97 -0.61 -3.58 9.60 2.86 -2.04 -3.47 114.93 123.65 1x5o h MET 17 Ca -0.29 0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.33 1x5o h MET 17 Cb 1.19 0.14 -0.12 0.00 0.06 0.00 0.00 31.60 32.87 1x5o h MET 17 CO 0.33 -0.41 -0.15 0.00 1.06 0.00 0.00 176.91 177.74 1x5o s ALA 18 N -4.54 -0.50 -0.19 6.32 0.00 -1.26 -5.08 121.76 116.51 1x5o s ALA 18 Ca -0.10 -0.51 -0.17 0.00 0.00 0.00 0.00 51.96 51.19 1x5o s ALA 18 Cb 0.01 0.82 -0.20 0.00 0.00 0.00 0.00 23.12 23.75 1x5o s ALA 18 CO 0.30 -0.71 0.21 1.63 0.00 0.00 0.00 175.76 177.20 1x5o n LYS 19 N -0.26 0.62 -3.45 0.00 4.76 -1.26 -4.87 118.16 113.70 1x5o n LYS 19 Ca -0.10 0.47 -0.38 0.00 -2.87 0.00 0.00 58.31 55.44 1x5o n LYS 19 Cb 0.63 -1.72 -0.08 0.00 -1.84 0.00 0.00 35.03 32.02 1x5o n LYS 19 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 1x5o s GLN 20 N -2.43 4.19 0.14 1.97 0.74 -1.26 -5.08 119.66 117.92 1x5o s GLN 20 Ca -0.28 0.13 0.03 0.00 0.05 0.00 0.00 55.36 55.29 1x5o s GLN 20 Cb 0.07 -3.51 -0.04 0.00 1.10 0.00 0.00 33.01 30.63 1x5o s GLN 20 CO 0.63 0.04 0.22 -0.65 -0.55 0.00 0.00 175.29 174.98 1x5o s GLN 21 N 1.08 3.27 0.11 1.67 -1.52 -1.26 -5.03 119.66 117.98 1x5o s GLN 21 Ca 0.17 -0.65 -0.24 0.00 -1.95 0.00 0.00 55.36 52.70 1x5o s GLN 21 Cb -0.14 -2.88 -0.14 0.00 -0.22 0.00 0.00 33.01 29.63 1x5o s GLN 21 CO 0.07 0.53 0.51 -0.85 -0.25 0.00 0.00 175.29 175.30 1x5o n GLU 22 N -0.32 0.00 -2.10 2.91 0.28 -1.26 -4.89 120.64 115.27 1x5o n GLU 22 Ca -0.07 0.00 -0.07 0.00 -0.16 0.00 0.00 57.16 56.86 1x5o n GLU 22 Cb 0.54 -0.87 0.06 0.00 1.43 0.00 0.00 31.44 32.59 1x5o n GLU 22 CO 0.00 0.00 0.00 0.94 -0.16 0.00 0.00 177.13 177.91 1x5o n GLN 23 N 0.87 2.09 -3.30 3.44 7.27 -1.26 -4.90 117.38 121.59 1x5o n GLN 23 Ca 0.14 -3.49 -0.26 0.00 0.07 0.00 0.00 57.00 53.47 1x5o n GLN 23 Cb 0.15 -1.60 -0.07 0.00 2.41 0.00 0.00 30.24 31.13 1x5o n GLN 23 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 1x5o n ASP 24 N -0.54 2.56 0.00 1.69 2.03 -1.26 -4.90 116.55 116.14 1x5o n ASP 24 Ca 0.21 -3.21 0.07 0.00 0.52 0.00 0.00 54.79 52.38 1x5o n ASP 24 Cb 0.89 -0.65 0.34 0.00 -0.72 0.00 0.00 41.12 40.98 1x5o n ASP 24 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1x5o n PRO 25 N 0.91 0.10 -0.18 -0.67 -0.04 -1.26 -2.94 135.00 130.92 1x5o n PRO 25 Ca 0.27 0.20 -0.09 0.00 -0.04 0.00 0.00 63.50 63.84 1x5o n PRO 25 Cb 0.46 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.46 1x5o n PRO 25 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1x5o h THR 26 N 0.00 1.27 -3.26 0.52 1.35 -1.88 -3.43 112.91 107.48 1x5o h THR 26 Ca 0.00 -1.22 -0.55 0.00 -0.55 0.00 0.00 66.41 64.09 1x5o h THR 26 Cb 0.19 0.92 -0.03 0.00 -1.73 0.00 0.00 68.15 67.50 1x5o h THR 26 CO 0.00 0.43 0.55 0.21 -0.25 0.00 0.00 175.52 176.46 1x5o s ASN 27 N -6.64 7.23 -0.19 5.36 3.84 -1.15 -3.05 114.94 120.34 1x5o s ASN 27 Ca -0.11 1.63 -0.08 0.00 0.21 0.00 0.00 52.86 54.51 1x5o s ASN 27 Cb 0.13 -2.56 -0.04 0.00 -0.55 0.00 0.00 41.25 38.23 1x5o s ASN 27 CO 0.85 -0.43 0.08 -0.76 -2.79 0.00 0.00 177.10 174.05 1x5o s LEU 28 N 1.79 3.92 -0.68 3.21 1.43 -1.03 -0.28 118.68 127.04 1x5o s LEU 28 Ca 0.51 0.12 -0.24 0.00 -1.03 0.00 0.00 54.13 53.49 1x5o s LEU 28 Cb -0.20 -2.00 0.05 0.00 0.03 0.00 0.00 46.19 44.07 1x5o s LEU 28 CO 0.21 0.18 1.08 -0.47 0.23 0.00 0.00 176.35 177.58 1x5o s TYR 29 N 0.36 2.54 -0.26 0.29 6.14 -0.53 -3.87 117.35 122.01 1x5o s TYR 29 Ca 0.04 -0.32 -0.06 0.00 0.64 0.00 0.00 57.07 57.38 1x5o s TYR 29 Cb -0.12 -4.41 -0.01 0.00 0.42 0.00 0.00 41.96 37.85 1x5o s TYR 29 CO -0.00 -1.79 0.04 0.42 0.64 0.00 0.00 175.55 174.86 1x5o s ILE 30 N 4.68 3.89 0.26 3.14 1.01 -1.18 -2.15 121.20 130.86 1x5o s ILE 30 Ca 0.28 -0.50 0.00 0.00 0.00 0.00 0.00 60.65 60.43 1x5o s ILE 30 Cb -0.13 -2.89 -0.00 0.00 0.01 0.00 0.00 42.46 39.44 1x5o s ILE 30 CO 0.13 0.24 0.01 -1.20 0.00 0.00 0.00 174.94 174.12 1x5o n SER 31 N 4.86 2.56 -3.01 3.58 7.64 -0.74 -0.96 113.62 127.55 1x5o n SER 31 Ca -0.16 -2.18 -0.19 0.00 1.01 0.00 0.00 58.87 57.36 1x5o n SER 31 Cb 0.50 0.23 0.07 0.00 -1.01 0.00 0.00 64.21 63.99 1x5o n SER 31 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1x5o n ASN 32 N -1.23 -5.07 -4.88 6.43 4.13 -0.15 -3.11 115.26 111.38 1x5o n ASN 32 Ca -0.10 -0.45 -0.26 0.00 1.68 0.00 0.00 54.58 55.45 1x5o n ASN 32 Cb 0.34 -4.19 -0.04 0.00 -1.54 0.00 0.00 39.78 34.34 1x5o n ASN 32 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1x5o s LEU 33 N -6.04 4.10 0.37 3.41 1.43 -0.37 -4.65 118.68 116.92 1x5o s LEU 33 Ca 0.41 0.04 -0.27 0.00 -1.03 0.00 0.00 54.13 53.28 1x5o s LEU 33 Cb -0.18 -2.69 -0.09 0.00 0.03 0.00 0.00 46.19 43.26 1x5o s LEU 33 CO 0.59 0.06 1.21 -2.16 0.23 0.00 0.00 176.35 176.28 1x5o s PRO 34 N -3.16 4.21 0.50 1.29 0.04 -1.26 -3.94 135.00 132.68 1x5o s PRO 34 Ca 0.33 1.96 0.16 0.00 0.04 0.00 0.00 61.00 63.49 1x5o s PRO 34 Cb -0.11 -2.86 1.23 0.00 0.04 0.00 0.00 34.50 32.80 1x5o s PRO 34 CO 0.26 -0.22 2.11 -0.07 0.04 0.00 0.00 177.00 179.12 1x5o h LEU 35 N 3.00 0.00 -1.62 -3.56 3.38 -1.95 -0.62 115.31 113.94 1x5o h LEU 35 Ca -0.49 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.48 1x5o h LEU 35 Cb 1.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.98 1x5o h LEU 35 CO 0.64 0.05 0.00 -0.24 0.09 0.00 0.00 178.44 178.98 1x5o n SER 36 N -4.44 2.13 -4.79 -0.43 2.88 -1.26 -4.38 113.62 103.34 1x5o n SER 36 Ca -0.03 -2.22 -0.35 0.00 -1.33 0.00 0.00 58.87 54.94 1x5o n SER 36 Cb 0.13 -0.54 -0.03 0.00 -0.75 0.00 0.00 64.21 63.02 1x5o n SER 36 CO 0.00 0.00 0.00 -0.32 -1.23 0.00 0.00 175.04 173.49 1x5o s MET 37 N -1.40 3.85 0.02 -1.46 0.00 -0.24 -5.02 119.30 115.05 1x5o s MET 37 Ca 0.13 1.44 0.02 0.00 0.00 0.00 0.00 55.69 57.28 1x5o s MET 37 Cb 0.10 -2.21 -0.01 0.00 0.00 0.00 0.00 34.83 32.70 1x5o s MET 37 CO 0.04 -0.40 -0.08 0.16 0.00 0.00 0.00 175.02 174.74 1x5o s ASP 38 N -1.83 0.89 0.38 1.11 -4.77 -1.26 -4.99 116.67 106.19 1x5o s ASP 38 Ca 0.65 -0.34 0.26 0.00 -3.30 0.00 0.00 52.55 49.82 1x5o s ASP 38 Cb -0.19 -0.03 1.30 0.00 -1.09 0.00 0.00 42.92 42.91 1x5o s ASP 38 CO 0.23 -0.05 1.41 -0.62 0.70 0.00 0.00 175.17 176.85 1x5o n GLU 39 N 2.19 -0.04 0.13 2.11 1.02 -1.26 0.53 120.64 125.31 1x5o n GLU 39 Ca -0.18 1.17 -0.13 0.00 -0.02 0.00 0.00 57.16 58.00 1x5o n GLU 39 Cb 0.56 -2.23 -0.06 0.00 -0.02 0.00 0.00 31.44 29.69 1x5o n GLU 39 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1x5o h GLN 40 N 0.00 -0.54 0.55 3.49 4.15 -1.97 -1.54 115.11 119.25 1x5o h GLN 40 Ca 0.79 0.04 -0.02 0.00 0.77 0.00 0.00 58.65 60.22 1x5o h GLN 40 Cb 2.39 0.12 -0.01 0.00 0.21 0.00 0.00 27.48 30.18 1x5o h GLN 40 CO -0.51 -0.36 -0.41 1.49 -1.93 0.00 0.00 178.83 177.11 1x5o h GLU 41 N -0.56 -0.91 -1.36 1.69 4.57 -0.33 0.79 114.58 118.47 1x5o h GLU 41 Ca 0.02 0.06 0.40 0.00 -1.18 0.00 0.00 59.36 58.67 1x5o h GLU 41 Cb 0.58 0.21 -0.08 0.00 -0.16 0.00 0.00 28.75 29.30 1x5o h GLU 41 CO -0.17 -0.60 0.95 1.25 -1.18 0.00 0.00 179.01 179.26 1x5o h LEU 42 N -0.94 0.11 0.00 1.64 5.85 -1.37 0.82 115.31 121.42 1x5o h LEU 42 Ca -0.06 0.04 -0.29 0.00 0.84 0.00 0.00 57.88 58.40 1x5o h LEU 42 Cb 0.79 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.79 1x5o h LEU 42 CO 0.02 -0.02 -1.73 1.21 -0.34 0.00 0.00 178.44 177.58 1x5o n GLU 43 N -4.29 0.63 -0.08 1.25 2.13 -0.59 -3.68 120.64 116.01 1x5o n GLU 43 Ca 0.32 0.29 -0.06 0.00 0.66 0.00 0.00 57.16 58.37 1x5o n GLU 43 Cb 1.39 -1.79 0.12 0.00 0.27 0.00 0.00 31.44 31.44 1x5o n GLU 43 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1x5o h ASN 44 N 0.00 0.74 0.65 4.31 2.35 0.72 0.32 115.58 124.68 1x5o h ASN 44 Ca -0.29 -0.24 -0.12 0.00 -0.55 0.00 0.00 56.30 55.10 1x5o h ASN 44 Cb 2.02 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 40.17 1x5o h ASN 44 CO 0.08 0.91 -0.58 0.00 -1.65 0.00 0.00 177.43 176.19 1x5o h MET 45 N 0.67 0.00 -0.00 0.81 -0.00 -0.96 -2.94 114.93 112.51 1x5o h MET 45 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.81 1x5o h MET 45 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.24 1x5o h MET 45 CO 0.04 0.58 -0.63 1.28 -0.00 0.00 0.00 176.91 178.19 1x5o n LEU 46 N -3.77 0.82 0.49 -0.10 4.77 -1.04 -4.33 117.00 113.83 1x5o n LEU 46 Ca -0.01 -0.24 -0.19 0.00 -0.03 0.00 0.00 56.01 55.54 1x5o n LEU 46 Cb 0.60 -0.14 -0.09 0.00 -2.33 0.00 0.00 43.42 41.45 1x5o n LEU 46 CO 0.41 0.19 0.51 0.11 -1.33 0.00 0.00 177.39 177.28 1x5o h LYS 47 N 0.30 -1.21 0.00 3.23 1.79 -0.16 0.34 116.57 120.86 1x5o h LYS 47 Ca 0.00 0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.55 1x5o h LYS 47 Cb 0.52 0.27 0.00 0.00 -1.58 0.00 0.00 32.23 31.44 1x5o h LYS 47 CO 0.00 -0.80 0.00 -0.35 -1.08 0.00 0.00 179.45 177.22 1x5o n PRO 48 N -5.61 0.49 -0.10 3.15 -0.04 -1.25 -2.80 135.00 128.84 1x5o n PRO 48 Ca -0.16 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.14 1x5o n PRO 48 Cb 0.50 -1.35 -0.09 0.00 -0.04 0.00 0.00 33.50 32.52 1x5o n PRO 48 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1x5o n PHE 49 N -0.85 0.00 -3.75 0.54 3.01 -0.98 -5.10 117.46 110.33 1x5o n PHE 49 Ca 0.08 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.55 1x5o n PHE 49 Cb 0.04 -0.76 0.00 0.00 -0.01 0.00 0.00 39.48 38.74 1x5o n PHE 49 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1x5o s GLY 50 N -5.76 -0.26 -0.51 1.37 0.00 0.07 -4.97 107.32 97.25 1x5o s GLY 50 Ca -0.28 0.35 -0.27 0.00 0.00 0.00 0.00 44.72 44.52 1x5o s GLY 50 CO 0.43 1.57 1.96 1.62 0.00 0.00 0.00 173.10 178.68 1x5o s GLN 51 N -2.42 2.70 -0.08 2.90 0.74 -1.26 -4.26 119.66 117.98 1x5o s GLN 51 Ca 0.18 1.00 -0.30 0.00 0.05 0.00 0.00 55.36 56.29 1x5o s GLN 51 Cb 0.02 -4.38 -0.04 0.00 1.10 0.00 0.00 33.01 29.71 1x5o s GLN 51 CO -0.01 -2.62 1.35 0.08 -0.55 0.00 0.00 175.29 173.54 1x5o s VAL 52 N 9.16 4.00 -0.16 1.34 1.01 -1.26 -3.02 120.40 131.47 1x5o s VAL 52 Ca 0.77 1.29 -0.16 0.00 0.00 0.00 0.00 61.98 63.88 1x5o s VAL 52 Cb -0.16 -3.83 -0.13 0.00 0.00 0.00 0.00 36.38 32.25 1x5o s VAL 52 CO 0.25 -0.06 0.19 0.40 0.00 0.00 0.00 175.10 175.89 1x5o h ILE 53 N 5.23 0.71 -3.37 2.22 1.08 -1.60 -3.49 117.51 118.30 1x5o h ILE 53 Ca -0.33 -1.72 -0.12 0.00 -0.39 0.00 0.00 64.86 62.30 1x5o h ILE 53 Cb 1.15 1.53 -0.19 0.00 -3.07 0.00 0.00 36.82 36.24 1x5o h ILE 53 CO 0.93 0.24 -0.36 -0.55 -0.69 0.00 0.00 178.15 177.72 1x5o s SER 54 N -6.23 -0.05 -0.06 1.72 0.15 -1.22 -4.98 113.70 103.03 1x5o s SER 54 Ca -0.19 -0.19 -0.04 0.00 0.70 0.00 0.00 55.95 56.24 1x5o s SER 54 Cb 0.02 0.29 0.02 0.00 -1.71 0.00 0.00 66.02 64.64 1x5o s SER 54 CO 0.42 -0.50 0.14 0.42 1.20 0.00 0.00 173.24 174.92 1x5o s THR 55 N -2.01 -0.02 0.04 6.45 -4.23 -1.26 -0.74 115.64 113.87 1x5o s THR 55 Ca -0.09 0.06 -0.01 0.00 -1.18 0.00 0.00 61.69 60.47 1x5o s THR 55 Cb -0.03 -0.21 -0.03 0.00 1.34 0.00 0.00 72.50 73.57 1x5o s THR 55 CO -0.01 0.03 -0.01 -0.60 -0.54 0.00 0.00 174.62 173.49 1x5o s ARG 56 N 0.46 0.51 -0.18 3.99 3.52 0.30 -4.97 118.95 122.58 1x5o s ARG 56 Ca -0.03 -0.95 -0.00 0.00 -0.13 0.00 0.00 55.73 54.62 1x5o s ARG 56 Cb -0.05 0.18 0.05 0.00 -1.56 0.00 0.00 34.95 33.57 1x5o s ARG 56 CO -0.02 -0.10 -0.05 0.42 -0.81 0.00 0.00 175.30 174.74 1x5o s ILE 57 N -2.92 1.16 0.45 4.11 -1.09 -1.26 -0.56 121.20 121.10 1x5o s ILE 57 Ca -0.02 -0.73 -0.23 0.00 -2.23 0.00 0.00 60.65 57.43 1x5o s ILE 57 Cb 0.01 -1.37 -0.10 0.00 -1.58 0.00 0.00 42.46 39.42 1x5o s ILE 57 CO -0.06 0.08 1.00 0.18 -1.23 0.00 0.00 174.94 174.91 1x5o n LEU 58 N 4.85 2.80 -4.23 2.97 4.77 -0.88 -4.90 117.00 122.37 1x5o n LEU 58 Ca -0.12 1.00 -0.22 0.00 -0.03 0.00 0.00 56.01 56.64 1x5o n LEU 58 Cb 0.47 -1.36 -0.13 0.00 -2.33 0.00 0.00 43.42 40.07 1x5o n LEU 58 CO 0.17 -1.53 -0.49 -0.13 -1.33 0.00 0.00 177.39 174.07 1x5o s ARG 59 N -2.14 1.04 0.66 3.23 0.52 -1.26 -1.89 118.95 119.11 1x5o s ARG 59 Ca 0.65 -1.03 -0.02 0.00 -0.52 0.00 0.00 55.73 54.81 1x5o s ARG 59 Cb -0.53 -1.19 0.08 0.00 0.52 0.00 0.00 34.95 33.83 1x5o s ARG 59 CO 0.55 0.28 0.92 0.34 0.02 0.00 0.00 175.30 177.42 1x5o s ASP 60 N -1.69 4.78 0.53 0.23 2.15 -0.21 -4.84 116.67 117.62 1x5o s ASP 60 Ca 0.04 0.00 0.19 0.00 0.43 0.00 0.00 52.55 53.20 1x5o s ASP 60 Cb -0.10 -0.63 1.01 0.00 -0.30 0.00 0.00 42.92 42.90 1x5o s ASP 60 CO 0.03 -1.55 1.52 0.77 -0.17 0.00 0.00 175.17 175.78 1x5o h SER 61 N -0.35 0.00 -0.68 -0.34 4.64 -2.00 0.98 113.55 115.80 1x5o h SER 61 Ca -0.41 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 60.63 1x5o h SER 61 Cb 1.29 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.21 1x5o h SER 61 CO 0.50 0.00 0.28 -1.20 -0.87 0.00 0.00 176.83 175.54 1x5o n SER 62 N -2.49 3.87 -2.27 4.97 7.64 -1.26 -4.91 113.62 119.17 1x5o n SER 62 Ca -0.01 -3.45 -0.10 0.00 1.01 0.00 0.00 58.87 56.31 1x5o n SER 62 Cb 0.46 -0.73 -0.01 0.00 -1.01 0.00 0.00 64.21 62.92 1x5o n SER 62 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x5o n GLY 63 N -0.72 -0.26 3.38 0.23 0.00 0.34 -4.92 105.19 103.23 1x5o n GLY 63 Ca 0.43 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.11 1x5o n GLY 63 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x5o s THR 64 N -2.42 3.44 0.33 2.61 2.01 -1.24 -4.77 115.64 115.59 1x5o s THR 64 Ca 0.00 -0.50 -0.16 0.00 0.31 0.00 0.00 61.69 61.35 1x5o s THR 64 Cb 0.00 -2.52 -0.12 0.00 0.01 0.00 0.00 72.50 69.87 1x5o s THR 64 CO 0.00 0.47 0.03 -0.24 -0.69 0.00 0.00 174.62 174.18 1x5o n SER 65 N 4.14 -2.36 -1.26 3.53 2.88 -1.26 -1.04 113.62 118.25 1x5o n SER 65 Ca -0.18 0.60 -0.04 0.00 -1.33 0.00 0.00 58.87 57.92 1x5o n SER 65 Cb 0.52 -0.68 0.21 0.00 -0.75 0.00 0.00 64.21 63.52 1x5o n SER 65 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1x5o n ARG 66 N 1.06 2.19 -2.49 -1.46 1.74 -0.79 -4.63 116.66 112.28 1x5o n ARG 66 Ca 0.08 -3.09 -0.21 0.00 -0.77 0.00 0.00 57.85 53.86 1x5o n ARG 66 Cb 0.32 -1.88 -0.00 0.00 -1.02 0.00 0.00 32.46 29.88 1x5o n ARG 66 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1x5o n GLY 67 N -0.96 -0.48 3.00 -0.13 0.00 -1.25 -4.88 105.19 100.49 1x5o n GLY 67 Ca 0.34 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.24 1x5o n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x5o s VAL 68 N -3.05 0.03 -0.07 1.61 1.01 -1.26 -0.98 120.40 117.69 1x5o s VAL 68 Ca 0.05 -0.26 -0.06 0.00 0.00 0.00 0.00 61.98 61.71 1x5o s VAL 68 Cb -0.02 -0.22 0.02 0.00 0.00 0.00 0.00 36.38 36.16 1x5o s VAL 68 CO 0.06 -0.14 0.19 -0.83 0.00 0.00 0.00 175.10 174.38 1x5o s GLY 69 N -0.43 -0.14 -0.17 4.51 0.00 -0.13 -2.06 107.32 108.89 1x5o s GLY 69 Ca -0.05 0.57 -0.05 0.00 0.00 0.00 0.00 44.72 45.19 1x5o s GLY 69 CO 0.00 0.52 -0.01 -1.36 0.00 0.00 0.00 173.10 172.26 1x5o s PHE 70 N 0.20 3.07 -0.02 1.90 0.08 0.28 -3.10 117.98 120.40 1x5o s PHE 70 Ca -0.01 -0.26 0.05 0.00 0.12 0.00 0.00 56.93 56.83 1x5o s PHE 70 Cb -0.02 -2.02 -0.01 0.00 -0.57 0.00 0.00 43.02 40.40 1x5o s PHE 70 CO -0.00 -0.05 -0.18 0.00 -0.10 0.00 0.00 175.22 174.89 1x5o s ALA 71 N 0.54 1.48 -0.42 5.36 0.00 -1.25 -0.54 121.76 126.93 1x5o s ALA 71 Ca -0.01 -0.75 -0.11 0.00 0.00 0.00 0.00 51.96 51.10 1x5o s ALA 71 Cb -0.14 -0.40 0.07 0.00 0.00 0.00 0.00 23.12 22.65 1x5o s ALA 71 CO 0.02 0.34 0.28 0.50 0.00 0.00 0.00 175.76 176.90 1x5o s ARG 72 N -0.31 2.70 0.29 0.00 3.52 0.08 -2.45 118.95 122.77 1x5o s ARG 72 Ca 0.04 -1.40 -0.27 0.00 -0.13 0.00 0.00 55.73 53.97 1x5o s ARG 72 Cb -0.08 -3.85 -0.10 0.00 -1.56 0.00 0.00 34.95 29.37 1x5o s ARG 72 CO -0.00 -0.94 0.93 -1.64 -0.81 0.00 0.00 175.30 172.84 1x5o s MET 73 N 1.48 4.65 0.44 5.12 -1.94 -1.17 -1.46 119.30 126.41 1x5o s MET 73 Ca 0.03 1.35 0.37 0.00 -1.71 0.00 0.00 55.69 55.73 1x5o s MET 73 Cb -0.23 -2.94 1.41 0.00 2.01 0.00 0.00 34.83 35.08 1x5o s MET 73 CO 0.03 0.35 1.35 -0.85 -0.01 0.00 0.00 175.02 175.90 1x5o n GLU 74 N 0.83 -0.01 -2.68 2.03 0.28 -1.17 -4.66 120.64 115.27 1x5o n GLU 74 Ca 0.01 1.00 -0.02 0.00 -0.16 0.00 0.00 57.16 57.99 1x5o n GLU 74 Cb 0.49 -2.15 0.01 0.00 1.43 0.00 0.00 31.44 31.22 1x5o n GLU 74 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1x5o n SER 75 N -4.00 -0.90 0.01 -1.84 7.64 -1.26 -5.05 113.62 108.22 1x5o n SER 75 Ca 0.37 -1.48 -0.19 0.00 1.01 0.00 0.00 58.87 58.59 1x5o n SER 75 Cb 1.58 1.47 -0.09 0.00 -1.01 0.00 0.00 64.21 66.16 1x5o n SER 75 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 1x5o h THR 76 N 1.51 1.31 -0.96 0.44 2.02 -1.85 -3.26 112.91 112.11 1x5o h THR 76 Ca -0.14 -2.09 0.31 0.00 0.77 0.00 0.00 66.41 65.26 1x5o h THR 76 Cb 0.62 2.26 -0.17 0.00 -1.74 0.00 0.00 68.15 69.12 1x5o h THR 76 CO 0.19 0.64 0.28 1.05 0.37 0.00 0.00 175.52 178.05 1x5o h GLU 77 N 0.35 0.09 -0.09 6.66 -0.00 -1.96 0.29 114.58 119.92 1x5o h GLU 77 Ca -0.09 -0.01 -0.02 0.00 -0.00 0.00 0.00 59.36 59.24 1x5o h GLU 77 Cb 1.49 -0.02 -0.00 0.00 -0.00 0.00 0.00 28.75 30.22 1x5o h GLU 77 CO 0.17 0.06 -0.04 0.87 -0.00 0.00 0.00 179.01 180.07 1x5o h LYS 78 N 0.10 0.18 -0.90 1.06 1.79 -1.96 -3.27 116.57 113.56 1x5o h LYS 78 Ca 0.67 -0.08 0.10 0.00 -2.18 0.00 0.00 60.65 59.16 1x5o h LYS 78 Cb 1.51 -0.01 -0.12 0.00 -1.58 0.00 0.00 32.23 32.03 1x5o h LYS 78 CO -0.78 0.53 -0.47 0.00 -1.08 0.00 0.00 179.45 177.66 1x5o h GLU 80 N 0.00 -0.02 -0.33 0.00 5.08 -1.55 0.23 114.58 117.99 1x5o h GLU 80 Ca 0.21 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.64 1x5o h GLU 80 Cb 0.43 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.61 1x5o h GLU 80 CO -0.86 -0.01 -0.20 0.00 -1.00 0.00 0.00 179.01 176.93 1x5o h ALA 81 N 1.24 0.02 0.44 3.43 0.00 -0.63 0.84 119.26 124.60 1x5o h ALA 81 Ca 0.31 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.32 1x5o h ALA 81 Cb 0.57 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1x5o h ALA 81 CO -0.95 -0.59 -0.31 0.28 0.00 0.00 0.00 179.25 177.68 1x5o h VAL 82 N -0.16 0.00 -0.56 0.00 2.07 -0.25 -0.94 116.25 116.41 1x5o h VAL 82 Ca 0.17 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.78 1x5o h VAL 82 Cb 0.42 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.08 1x5o h VAL 82 CO -0.43 0.00 -0.40 0.40 0.02 0.00 0.00 177.57 177.16 1x5o h ILE 83 N -0.71 0.12 -0.68 4.57 2.04 -0.80 1.54 117.51 123.58 1x5o h ILE 83 Ca -0.06 0.00 0.15 0.00 1.00 0.00 0.00 64.86 65.95 1x5o h ILE 83 Cb 0.58 0.12 -0.04 0.00 -0.74 0.00 0.00 36.82 36.74 1x5o h ILE 83 CO 0.04 0.00 0.47 1.23 0.00 0.00 0.00 178.15 179.88 1x5o h GLY 84 N -0.22 0.50 0.00 5.37 0.00 -0.77 -0.21 103.07 107.75 1x5o h GLY 84 Ca 0.19 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1x5o h GLY 84 CO -0.67 0.05 0.00 1.42 0.00 0.00 0.00 176.54 177.34 1x5o n HIS 85 N -4.45 0.00 -0.37 5.60 8.25 0.11 -4.53 115.22 119.83 1x5o n HIS 85 Ca 0.13 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.57 1x5o n HIS 85 Cb 0.54 -0.19 0.03 0.00 1.12 0.00 0.00 29.99 31.48 1x5o n HIS 85 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 1x5o h PHE 86 N 0.00 -1.15 0.00 4.41 -1.00 0.19 -3.39 116.94 116.00 1x5o h PHE 86 Ca 0.00 0.11 -0.40 0.00 2.81 0.00 0.00 57.97 60.49 1x5o h PHE 86 Cb 0.00 0.64 -0.08 0.00 3.61 0.00 0.00 35.95 40.12 1x5o h PHE 86 CO 0.00 -0.40 1.53 -1.71 -1.61 0.00 0.00 178.31 176.12 1x5o n ASN 87 N -5.45 -0.08 -0.09 2.17 5.15 -0.09 0.22 115.26 117.10 1x5o n ASN 87 Ca 0.09 0.02 0.00 0.00 -0.60 0.00 0.00 54.58 54.09 1x5o n ASN 87 Cb 0.39 -0.70 0.00 0.00 -0.53 0.00 0.00 39.78 38.93 1x5o n ASN 87 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1x5o n GLY 88 N 5.30 1.06 3.33 8.20 0.00 -1.17 -4.96 105.19 116.95 1x5o n GLY 88 Ca 0.56 -0.46 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 1x5o n GLY 88 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1x5o s LYS 89 N -2.70 1.58 -0.35 1.61 2.47 0.61 -4.90 119.74 118.05 1x5o s LYS 89 Ca 0.00 -1.13 -0.06 0.00 -1.56 0.00 0.00 55.97 53.22 1x5o s LYS 89 Cb 0.00 -1.82 0.05 0.00 -1.46 0.00 0.00 37.83 34.61 1x5o s LYS 89 CO 0.00 0.46 0.11 -0.06 0.16 0.00 0.00 175.35 176.02 1x5o s PHE 90 N -0.89 3.30 0.61 4.03 0.40 -1.26 -1.99 117.98 122.19 1x5o s PHE 90 Ca 0.11 -1.62 -0.13 0.00 -0.60 0.00 0.00 56.93 54.69 1x5o s PHE 90 Cb -0.10 -2.42 -0.03 0.00 0.51 0.00 0.00 43.02 40.97 1x5o s PHE 90 CO 0.03 -0.78 1.03 0.96 0.70 0.00 0.00 175.22 177.16 1x5o s ILE 91 N 1.35 4.32 0.59 0.64 -4.36 -1.26 -5.08 121.20 117.40 1x5o s ILE 91 Ca -0.01 0.89 -0.03 0.00 -0.26 0.00 0.00 60.65 61.25 1x5o s ILE 91 Cb -0.20 -3.62 0.12 0.00 1.25 0.00 0.00 42.46 40.01 1x5o s ILE 91 CO 0.01 -0.85 0.80 2.29 0.24 0.00 0.00 174.94 177.44 1x5o n LYS 92 N -2.47 -0.14 -4.20 0.37 2.85 -1.26 -4.72 118.16 108.60 1x5o n LYS 92 Ca 0.07 -1.95 -0.15 0.00 -1.05 0.00 0.00 58.31 55.23 1x5o n LYS 92 Cb 0.54 -0.60 -0.11 0.00 -0.65 0.00 0.00 35.03 34.20 1x5o n LYS 92 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1x5o s THR 93 N -2.45 1.03 1.02 0.58 -4.23 -1.26 -4.98 115.64 105.35 1x5o s THR 93 Ca 0.51 -1.71 -0.13 0.00 -1.18 0.00 0.00 61.69 59.19 1x5o s THR 93 Cb -0.03 -1.45 0.20 0.00 1.34 0.00 0.00 72.50 72.56 1x5o s THR 93 CO 0.34 -0.56 1.09 -2.16 -0.54 0.00 0.00 174.62 172.80 1x5o s PRO 94 N -2.90 0.28 -0.84 3.99 0.04 -1.26 -4.90 135.00 129.41 1x5o s PRO 94 Ca 0.07 0.48 -0.25 0.00 0.04 0.00 0.00 61.00 61.34 1x5o s PRO 94 Cb -0.02 -1.72 -0.04 0.00 0.04 0.00 0.00 34.50 32.75 1x5o s PRO 94 CO 0.01 -2.82 1.93 -1.25 0.04 0.00 0.00 177.00 174.90 1x5o s PRO 95 N -4.97 2.57 0.00 0.56 0.04 -1.26 -2.37 135.00 129.58 1x5o s PRO 95 Ca 0.66 -0.11 0.00 0.00 0.04 0.00 0.00 61.00 61.59 1x5o s PRO 95 Cb -0.19 -4.92 0.00 0.00 0.04 0.00 0.00 34.50 29.43 1x5o s PRO 95 CO 0.58 -3.24 0.00 0.41 0.04 0.00 0.00 177.00 174.79 1x5o n GLY 96 N 6.62 -0.78 3.39 0.56 0.00 -1.26 -5.15 105.19 108.56 1x5o n GLY 96 Ca 0.36 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.15 1x5o n GLY 96 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x5o s VAL 97 N -0.13 2.08 -0.18 1.61 1.01 -1.00 -5.13 120.40 118.65 1x5o s VAL 97 Ca 0.00 -2.11 -0.16 0.00 0.00 0.00 0.00 61.98 59.71 1x5o s VAL 97 Cb 0.00 -2.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 1x5o s VAL 97 CO 0.00 -0.34 0.38 -0.55 0.00 0.00 0.00 175.10 174.59 1x5o s SER 98 N -2.99 6.46 0.34 3.32 0.15 -1.26 -4.75 113.70 114.97 1x5o s SER 98 Ca 0.21 0.54 -0.29 0.00 0.70 0.00 0.00 55.95 57.12 1x5o s SER 98 Cb -0.05 -2.23 -0.10 0.00 -1.71 0.00 0.00 66.02 61.93 1x5o s SER 98 CO 0.09 -0.03 1.35 0.00 1.20 0.00 0.00 173.24 175.85 1x5o s ALA 99 N 1.07 3.51 1.00 5.45 0.00 -1.26 -4.95 121.76 126.58 1x5o s ALA 99 Ca 0.19 1.33 -0.12 0.00 0.00 0.00 0.00 51.96 53.36 1x5o s ALA 99 Cb -0.14 -3.51 0.19 0.00 0.00 0.00 0.00 23.12 19.66 1x5o s ALA 99 CO 0.07 -0.73 1.09 -1.25 0.00 0.00 0.00 175.76 174.94 1x5o s PRO 100 N -1.87 0.39 -0.11 0.00 0.04 -1.26 -5.01 135.00 127.17 1x5o s PRO 100 Ca 0.50 0.51 0.10 0.00 0.04 0.00 0.00 61.00 62.14 1x5o s PRO 100 Cb -0.41 -1.73 -0.14 0.00 0.04 0.00 0.00 34.50 32.26 1x5o s PRO 100 CO 0.55 -2.76 0.04 2.41 0.04 0.00 0.00 177.00 177.28 1x5o n THR 101 N -4.19 0.78 -3.28 1.26 -1.04 -1.26 -5.01 114.28 101.54 1x5o n THR 101 Ca 0.05 -0.48 -0.32 0.00 -2.04 0.00 0.00 64.05 61.26 1x5o n THR 101 Cb 0.57 -0.70 -0.06 0.00 -1.82 0.00 0.00 70.33 68.32 1x5o n THR 101 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1x5o s GLU 102 N -2.27 3.90 0.00 -2.82 2.02 -1.26 -5.09 118.70 113.17 1x5o s GLU 102 Ca -0.06 0.47 0.00 0.00 0.02 0.00 0.00 54.97 55.40 1x5o s GLU 102 Cb 0.03 -2.54 0.00 0.00 0.10 0.00 0.00 34.13 31.73 1x5o s GLU 102 CO 0.46 0.24 0.00 -0.35 0.02 0.00 0.00 175.26 175.63 1x5o n PRO 103 N -0.26 -0.06 -3.98 0.39 -0.04 -1.26 -4.92 135.00 124.87 1x5o n PRO 103 Ca 0.02 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.14 1x5o n PRO 103 Cb 0.53 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.84 1x5o n PRO 103 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1x5o s LEU 104 N 0.00 3.20 -0.27 1.53 1.43 -0.84 -4.64 118.68 119.09 1x5o s LEU 104 Ca 0.00 -0.95 -0.21 0.00 -1.03 0.00 0.00 54.13 51.94 1x5o s LEU 104 Cb 0.00 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.57 1x5o s LEU 104 CO 0.00 -0.14 0.67 -0.22 0.23 0.00 0.00 176.35 176.90 1x5o s LEU 105 N 1.29 4.09 -0.05 1.79 2.96 -1.18 -3.05 118.68 124.53 1x5o s LEU 105 Ca -0.01 0.66 0.05 0.00 -0.22 0.00 0.00 54.13 54.61 1x5o s LEU 105 Cb -0.17 -2.91 -0.02 0.00 0.50 0.00 0.00 46.19 43.59 1x5o s LEU 105 CO -0.05 -0.45 -0.19 0.00 -1.32 0.00 0.00 176.35 174.34 1x5o s LYS 107 N -0.44 0.66 -0.46 0.00 -2.85 -0.91 -4.93 119.74 110.81 1x5o s LYS 107 Ca 0.05 1.21 -0.32 0.00 -1.00 0.00 0.00 55.97 55.91 1x5o s LYS 107 Cb -0.12 0.23 -0.15 0.00 -2.06 0.00 0.00 37.83 35.73 1x5o s LYS 107 CO 0.01 -0.15 1.74 1.19 0.10 0.00 0.00 175.35 178.25 1x5o n PHE 108 N 4.43 0.82 -1.69 1.78 3.72 -1.26 -1.45 117.46 123.80 1x5o n PHE 108 Ca -0.19 0.55 -0.17 0.00 -0.05 0.00 0.00 57.45 57.59 1x5o n PHE 108 Cb 0.58 -1.79 0.12 0.00 -0.94 0.00 0.00 39.48 37.44 1x5o n PHE 108 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1x5o n SER 109 N 6.24 0.17 0.00 4.37 2.88 0.61 -4.77 113.62 123.13 1x5o n SER 109 Ca 0.44 -1.35 0.00 0.00 -1.33 0.00 0.00 58.87 56.63 1x5o n SER 109 Cb -0.02 -0.58 0.00 0.00 -0.75 0.00 0.00 64.21 62.85 1x5o n SER 109 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5o n GLY 110 N -0.18 5.78 3.58 0.46 0.00 -1.26 -4.35 105.19 109.22 1x5o n GLY 110 Ca 0.10 -1.73 -0.41 0.00 0.00 0.00 0.00 46.02 43.98 1x5o n GLY 110 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5o s PRO 111 N 1.69 3.03 -0.01 1.61 0.04 -1.26 -4.74 135.00 135.37 1x5o s PRO 111 Ca 0.00 0.98 -0.03 0.00 0.04 0.00 0.00 61.00 61.99 1x5o s PRO 111 Cb 0.00 -4.27 -0.11 0.00 0.04 0.00 0.00 34.50 30.16 1x5o s PRO 111 CO 0.00 -2.24 2.73 0.43 0.04 0.00 0.00 177.00 177.96 1x5o n SER 112 N 11.27 5.33 -2.38 6.66 7.64 -1.26 -4.41 113.62 136.47 1x5o n SER 112 Ca 0.21 -2.46 -0.34 0.00 1.01 0.00 0.00 58.87 57.29 1x5o n SER 112 Cb 0.49 -1.26 0.07 0.00 -1.01 0.00 0.00 64.21 62.50 1x5o n SER 112 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1x5o n SER 113 N 1.91 7.31 0.00 6.43 2.88 -1.26 -5.24 113.62 125.66 1x5o n SER 113 Ca 0.20 -3.79 0.00 0.00 -1.33 0.00 0.00 58.87 53.95 1x5o n SER 113 Cb 0.69 -0.91 0.00 0.00 -0.75 0.00 0.00 64.21 63.24 1x5o n SER 113 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42