#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lbl s ARG 3 N 0.00 1.95 0.16 -0.52 1.81 0.38 -4.74 118.95 118.00 1lbl s ARG 3 Ca 0.00 -0.35 -0.31 0.00 -1.72 0.00 0.00 55.73 53.35 1lbl s ARG 3 Cb 0.00 -2.14 -0.09 0.00 -0.45 0.00 0.00 34.95 32.27 1lbl s ARG 3 CO 0.00 -1.41 1.43 -0.47 -0.68 0.00 0.00 175.30 174.17 1lbl s TYR 4 N -3.32 3.16 0.09 -0.53 6.14 -1.26 -4.98 117.35 116.65 1lbl s TYR 4 Ca 0.62 0.93 0.01 0.00 0.64 0.00 0.00 57.07 59.28 1lbl s TYR 4 Cb -0.09 -3.75 -0.04 0.00 0.42 0.00 0.00 41.96 38.49 1lbl s TYR 4 CO 0.46 -2.61 -0.06 -0.51 0.64 0.00 0.00 175.55 173.46 1lbl s LEU 5 N 0.66 2.49 0.32 6.97 1.43 -1.26 -5.07 118.68 124.22 1lbl s LEU 5 Ca 0.64 -0.97 0.03 0.00 -1.03 0.00 0.00 54.13 52.79 1lbl s LEU 5 Cb -0.39 -0.05 -0.05 0.00 0.03 0.00 0.00 46.19 45.73 1lbl s LEU 5 CO 0.34 -0.46 0.11 -0.54 0.23 0.00 0.00 176.35 176.03 1lbl s LYS 6 N -3.68 1.62 2.38 1.70 1.02 -1.26 -4.71 119.74 116.81 1lbl s LYS 6 Ca 0.10 -1.92 0.00 0.00 0.02 0.00 0.00 55.97 54.17 1lbl s LYS 6 Cb 0.04 -0.45 0.00 0.00 -0.52 0.00 0.00 37.83 36.91 1lbl s LYS 6 CO -0.05 -0.34 0.00 0.41 -0.92 0.00 0.00 175.35 174.45 1lbl n GLY 7 N -0.64 0.91 0.35 -3.33 0.00 -1.26 -2.60 105.19 98.63 1lbl n GLY 7 Ca -0.01 -0.69 0.18 0.00 0.00 0.00 0.00 46.02 45.50 1lbl n GLY 7 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1lbl h TRP 8 N 0.00 0.00 -0.46 1.61 5.08 -1.97 -0.43 115.95 119.78 1lbl h TRP 8 Ca 0.00 0.00 -0.10 0.00 1.08 0.00 0.00 58.89 59.87 1lbl h TRP 8 Cb 0.00 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.14 1lbl h TRP 8 CO 0.00 0.00 -0.11 -0.07 -1.28 0.00 0.00 178.44 176.98 1lbl h LEU 9 N 0.00 0.82 -0.74 0.11 3.38 -1.89 -1.58 115.31 115.41 1lbl h LEU 9 Ca 0.16 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 1lbl h LEU 9 Cb 0.74 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1lbl h LEU 9 CO -0.00 0.95 0.31 0.50 0.09 0.00 0.00 178.44 180.29 1lbl h LYS 10 N 0.75 1.10 0.16 1.13 3.11 -0.82 -2.28 116.57 119.71 1lbl h LYS 10 Ca 0.13 -0.19 -0.01 0.00 -2.81 0.00 0.00 60.65 57.76 1lbl h LYS 10 Cb 0.61 -0.18 0.00 0.00 -1.00 0.00 0.00 32.23 31.66 1lbl h LYS 10 CO 0.04 0.89 -0.08 0.22 -2.81 0.00 0.00 179.45 177.72 1lbl h ASP 11 N 1.06 -0.18 -0.41 4.20 1.82 -1.16 -2.60 116.42 119.15 1lbl h ASP 11 Ca 0.25 -0.25 -0.01 0.00 -0.39 0.00 0.00 57.03 56.62 1lbl h ASP 11 Cb 0.20 0.05 -0.02 0.00 0.68 0.00 0.00 39.33 40.23 1lbl h ASP 11 CO -0.02 0.16 0.21 1.62 -1.61 0.00 0.00 179.24 179.61 1lbl h VAL 12 N -0.54 1.15 -0.40 2.25 3.04 -1.33 -0.77 116.25 119.65 1lbl h VAL 12 Ca -0.02 -0.43 -0.09 0.00 -1.01 0.00 0.00 66.70 65.15 1lbl h VAL 12 Cb 0.42 0.59 -0.02 0.00 -2.01 0.00 0.00 31.29 30.27 1lbl h VAL 12 CO 0.04 0.18 -0.12 0.58 -1.01 0.00 0.00 177.57 177.23 1lbl h VAL 13 N 0.62 1.25 -0.35 1.51 2.07 -1.38 -1.23 116.25 118.74 1lbl h VAL 13 Ca 0.16 -1.15 -0.07 0.00 0.82 0.00 0.00 66.70 66.46 1lbl h VAL 13 Cb 0.07 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1lbl h VAL 13 CO -0.02 0.39 -0.04 1.56 0.02 0.00 0.00 177.57 179.48 1lbl h GLN 14 N 0.65 0.65 -0.96 1.57 1.08 -0.87 -2.05 115.11 115.18 1lbl h GLN 14 Ca 0.11 -0.23 0.09 0.00 -1.45 0.00 0.00 58.65 57.17 1lbl h GLN 14 Cb 0.58 -0.05 -0.07 0.00 -0.05 0.00 0.00 27.48 27.89 1lbl h GLN 14 CO 0.04 0.79 0.62 -0.07 -0.95 0.00 0.00 178.83 179.25 1lbl h LEU 15 N 0.45 0.93 -0.66 1.46 3.38 -0.83 -2.30 115.31 117.74 1lbl h LEU 15 Ca 0.10 0.02 -0.14 0.00 0.09 0.00 0.00 57.88 57.95 1lbl h LEU 15 Cb 0.52 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1lbl h LEU 15 CO 0.03 0.56 -0.45 0.28 0.09 0.00 0.00 178.44 178.95 1lbl h SER 16 N 1.04 0.55 0.02 -0.43 0.02 -0.87 -2.81 113.55 111.07 1lbl h SER 16 Ca 0.44 -0.26 -0.01 0.00 -0.84 0.00 0.00 61.79 61.12 1lbl h SER 16 Cb 0.31 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.69 1lbl h SER 16 CO -0.19 0.92 -0.03 -0.07 -1.14 0.00 0.00 176.83 176.31 1lbl h LEU 17 N 0.41 0.05 -3.08 5.07 3.38 -0.80 -2.25 115.31 118.10 1lbl h LEU 17 Ca 0.03 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1lbl h LEU 17 Cb 0.95 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1lbl h LEU 17 CO 0.08 0.10 0.00 0.54 0.09 0.00 0.00 178.44 179.26 1lbl n ARG 18 N -4.46 3.48 -2.28 1.13 1.74 -1.14 -4.96 116.66 110.17 1lbl n ARG 18 Ca -0.02 -2.78 -0.43 0.00 -0.77 0.00 0.00 57.85 53.85 1lbl n ARG 18 Cb 0.14 -1.79 -0.02 0.00 -1.02 0.00 0.00 32.46 29.77 1lbl n ARG 18 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1lbl s ARG 19 N -1.74 3.92 0.37 5.56 6.06 -0.85 -4.99 118.95 127.29 1lbl s ARG 19 Ca 0.47 1.50 -0.28 0.00 -2.50 0.00 0.00 55.73 54.93 1lbl s ARG 19 Cb 0.30 -3.93 -0.11 0.00 0.06 0.00 0.00 34.95 31.26 1lbl s ARG 19 CO 0.24 -1.13 1.47 -2.30 -2.50 0.00 0.00 175.30 171.08 1lbl n PRO 20 N 7.36 2.63 -1.60 5.12 -0.02 -1.26 -4.97 135.00 142.26 1lbl n PRO 20 Ca 0.16 0.92 -0.32 0.00 -2.02 0.00 0.00 63.50 62.25 1lbl n PRO 20 Cb 0.46 -2.64 0.05 0.00 -0.02 0.00 0.00 33.50 31.35 1lbl n PRO 20 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1lbl s SER 21 N -0.13 5.14 -0.16 2.55 1.04 -1.26 -5.04 113.70 115.83 1lbl s SER 21 Ca 0.54 1.79 0.00 0.00 0.48 0.00 0.00 55.95 58.76 1lbl s SER 21 Cb -0.48 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.12 1lbl s SER 21 CO 0.63 -1.61 -0.16 0.12 0.98 0.00 0.00 173.24 173.21 1lbl s PHE 22 N -2.76 2.78 -0.24 5.02 5.36 -1.26 -5.10 117.98 121.78 1lbl s PHE 22 Ca 0.62 -1.17 -0.14 0.00 -0.96 0.00 0.00 56.93 55.28 1lbl s PHE 22 Cb -0.16 -1.90 -0.04 0.00 -0.34 0.00 0.00 43.02 40.57 1lbl s PHE 22 CO 0.49 -0.55 0.35 0.50 -1.46 0.00 0.00 175.22 174.55 1lbl s ARG 23 N 0.94 4.08 -0.02 10.12 3.52 -1.26 -4.73 118.95 131.60 1lbl s ARG 23 Ca -0.03 0.04 -0.29 0.00 -0.13 0.00 0.00 55.73 55.33 1lbl s ARG 23 Cb -0.15 -3.60 0.10 0.00 -1.56 0.00 0.00 34.95 29.75 1lbl s ARG 23 CO -0.03 -0.14 0.86 0.00 -0.81 0.00 0.00 175.30 175.19 1lbl s ALA 24 N 1.64 -1.82 0.06 6.12 0.00 -1.26 -5.11 121.76 121.40 1lbl s ALA 24 Ca 0.15 1.09 -0.19 0.00 0.00 0.00 0.00 51.96 53.01 1lbl s ALA 24 Cb -0.15 0.23 -0.06 0.00 0.00 0.00 0.00 23.12 23.13 1lbl s ALA 24 CO 0.08 -0.60 0.57 -1.12 0.00 0.00 0.00 175.76 174.69 1lbl s SER 25 N -2.16 7.04 -0.23 0.00 0.01 -1.26 -4.79 113.70 112.30 1lbl s SER 25 Ca 0.02 1.24 -0.15 0.00 1.31 0.00 0.00 55.95 58.37 1lbl s SER 25 Cb -0.01 -2.36 -0.04 0.00 0.21 0.00 0.00 66.02 63.83 1lbl s SER 25 CO -0.06 0.25 0.39 -0.60 0.41 0.00 0.00 173.24 173.63 1lbl s ARG 26 N -0.98 4.10 -0.01 12.44 3.52 -1.26 -4.95 118.95 131.81 1lbl s ARG 26 Ca 0.29 0.13 -0.02 0.00 -0.13 0.00 0.00 55.73 56.00 1lbl s ARG 26 Cb -0.19 -3.59 -0.01 0.00 -1.56 0.00 0.00 34.95 29.59 1lbl s ARG 26 CO 0.19 -0.15 0.35 1.96 -0.81 0.00 0.00 175.30 176.83 1lbl h GLN 27 N 7.74 -0.08 -6.31 5.12 7.50 -1.94 -3.47 115.11 123.66 1lbl h GLN 27 Ca -0.34 0.01 -0.56 0.00 0.50 0.00 0.00 58.65 58.26 1lbl h GLN 27 Cb 1.16 0.02 -0.03 0.00 0.05 0.00 0.00 27.48 28.68 1lbl h GLN 27 CO 0.69 -0.05 -0.21 -0.98 -1.50 0.00 0.00 178.83 176.77 1lbl s ARG 28 N -1.88 3.71 1.01 1.46 1.04 -1.26 -5.09 118.95 117.94 1lbl s ARG 28 Ca -0.01 0.09 -0.12 0.00 -1.04 0.00 0.00 55.73 54.65 1lbl s ARG 28 Cb 0.00 -2.74 0.20 0.00 -2.04 0.00 0.00 34.95 30.36 1lbl s ARG 28 CO 0.04 0.38 1.08 -2.14 -0.04 0.00 0.00 175.30 174.62 1lbl s PRO 29 N -2.77 0.32 0.23 3.89 0.02 -1.26 -4.98 135.00 130.45 1lbl s PRO 29 Ca 0.44 0.96 -0.30 0.00 0.02 0.00 0.00 61.00 62.13 1lbl s PRO 29 Cb -0.12 -1.69 -0.09 0.00 0.02 0.00 0.00 34.50 32.63 1lbl s PRO 29 CO 0.23 -2.92 1.21 0.42 -0.33 0.00 0.00 177.00 175.61 1lbl s ILE 30 N -2.70 3.37 -0.30 2.83 1.01 -1.26 -5.02 121.20 119.13 1lbl s ILE 30 Ca 0.66 1.23 -0.03 0.00 0.00 0.00 0.00 60.65 62.51 1lbl s ILE 30 Cb -0.22 -3.78 0.04 0.00 0.01 0.00 0.00 42.46 38.52 1lbl s ILE 30 CO 0.60 0.23 0.02 -0.63 0.00 0.00 0.00 174.94 175.16 1lbl s ILE 31 N -0.46 3.16 0.00 2.92 1.01 -1.26 -5.08 121.20 121.48 1lbl s ILE 31 Ca 0.51 -1.29 -0.30 0.00 0.00 0.00 0.00 60.65 59.57 1lbl s ILE 31 Cb -0.34 -2.79 -0.07 0.00 0.01 0.00 0.00 42.46 39.27 1lbl s ILE 31 CO 0.40 -0.09 1.81 -0.55 0.00 0.00 0.00 174.94 176.51 1lbl s SER 32 N 1.29 6.55 0.09 3.58 0.15 -1.26 -4.68 113.70 119.42 1lbl s SER 32 Ca -0.04 2.47 -0.15 0.00 0.70 0.00 0.00 55.95 58.94 1lbl s SER 32 Cb -0.19 -2.53 -0.13 0.00 -1.71 0.00 0.00 66.02 61.45 1lbl s SER 32 CO -0.00 -0.99 1.34 0.25 1.20 0.00 0.00 173.24 175.03 1lbl h LEU 33 N 10.29 0.79 -0.83 3.45 5.85 -1.93 -2.96 115.31 129.97 1lbl h LEU 33 Ca -0.45 -0.56 -0.12 0.00 0.84 0.00 0.00 57.88 57.59 1lbl h LEU 33 Cb 1.21 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 1lbl h LEU 33 CO 0.95 1.21 -0.58 -0.55 -0.34 0.00 0.00 178.44 179.12 1lbl h ASN 34 N 0.40 0.01 0.25 1.25 -0.00 -1.92 -2.15 115.58 113.42 1lbl h ASN 34 Ca -0.00 -0.00 -0.18 0.00 -0.00 0.00 0.00 56.30 56.11 1lbl h ASN 34 Cb 1.10 -0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 39.41 1lbl h ASN 34 CO 0.11 0.59 -0.72 -0.33 -0.00 0.00 0.00 177.43 177.08 1lbl h GLU 35 N 0.00 0.41 -0.04 4.14 5.08 -1.98 -2.77 114.58 119.43 1lbl h GLU 35 Ca -0.01 -0.33 -0.13 0.00 -1.00 0.00 0.00 59.36 57.90 1lbl h GLU 35 Cb 1.04 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 1lbl h GLU 35 CO 0.08 0.97 -0.56 -0.09 -1.00 0.00 0.00 179.01 178.41 1lbl h ARG 36 N 0.28 0.11 -0.39 2.33 2.43 -1.34 -2.48 114.38 115.32 1lbl h ARG 36 Ca -0.03 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.03 1lbl h ARG 36 Cb 1.29 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.84 1lbl h ARG 36 CO 0.12 0.64 0.06 0.82 -1.51 0.00 0.00 179.97 180.10 1lbl h ILE 37 N 0.08 1.24 -0.50 1.20 2.04 -1.31 -2.19 117.51 118.07 1lbl h ILE 37 Ca -0.00 -0.86 -0.02 0.00 1.00 0.00 0.00 64.86 64.98 1lbl h ILE 37 Cb 1.01 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 38.12 1lbl h ILE 37 CO 0.08 0.29 0.23 -0.07 0.00 0.00 0.00 178.15 178.68 1lbl h LEU 38 N 0.49 0.63 -0.64 1.44 4.07 -1.34 -1.20 115.31 118.76 1lbl h LEU 38 Ca 0.12 -0.06 -0.08 0.00 0.08 0.00 0.00 57.88 57.94 1lbl h LEU 38 Cb 0.37 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 41.94 1lbl h LEU 38 CO 0.01 0.55 -0.39 1.05 -1.08 0.00 0.00 178.44 178.58 1lbl h GLU 39 N 0.70 0.00 0.00 1.13 4.11 -1.23 -2.25 114.58 117.04 1lbl h GLU 39 Ca 0.17 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 59.42 1lbl h GLU 39 Cb 0.10 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1lbl h GLU 39 CO -0.02 0.39 -0.85 0.74 0.07 0.00 0.00 179.01 179.34 1lbl h PHE 40 N 0.00 0.09 0.22 2.06 -1.00 -0.75 -2.53 116.94 115.03 1lbl h PHE 40 Ca -0.00 -0.05 -0.01 0.00 2.81 0.00 0.00 57.97 60.71 1lbl h PHE 40 Cb 1.04 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 40.59 1lbl h PHE 40 CO 0.00 0.88 -0.11 -0.91 -1.61 0.00 0.00 178.31 176.56 1lbl h ASN 41 N 0.03 -0.25 0.52 2.17 2.35 -0.98 0.13 115.58 119.54 1lbl h ASN 41 Ca -0.02 -0.17 -0.02 0.00 -0.55 0.00 0.00 56.30 55.54 1lbl h ASN 41 Cb 1.48 0.07 -0.00 0.00 0.05 0.00 0.00 38.32 39.91 1lbl h ASN 41 CO 0.12 0.03 -0.12 0.07 -1.65 0.00 0.00 177.43 175.88 1lbl h LYS 42 N -0.55 0.00 -0.27 0.81 2.10 -1.44 0.82 116.57 118.05 1lbl h LYS 42 Ca -0.03 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.62 1lbl h LYS 42 Cb 0.40 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.73 1lbl h LYS 42 CO 0.05 0.12 0.00 0.54 -2.00 0.00 0.00 179.45 178.16 1lbl n ARG 43 N -3.48 1.86 -3.80 0.07 1.74 -0.96 -4.92 116.66 107.17 1lbl n ARG 43 Ca -0.01 -1.31 -0.29 0.00 -0.77 0.00 0.00 57.85 55.47 1lbl n ARG 43 Cb 0.27 -1.37 0.03 0.00 -1.02 0.00 0.00 32.46 30.37 1lbl n ARG 43 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1lbl n ASN 44 N 0.54 -4.87 -4.48 0.55 4.05 0.28 -4.97 115.26 106.36 1lbl n ASN 44 Ca 0.15 -0.70 -0.34 0.00 0.45 0.00 0.00 54.58 54.14 1lbl n ASN 44 Cb 0.35 -3.90 -0.12 0.00 1.23 0.00 0.00 39.78 37.34 1lbl n ASN 44 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1lbl s ILE 45 N -3.25 3.91 0.15 -1.44 1.01 0.36 -5.03 121.20 116.91 1lbl s ILE 45 Ca 0.62 -0.34 -0.31 0.00 0.00 0.00 0.00 60.65 60.61 1lbl s ILE 45 Cb -0.31 -2.73 -0.11 0.00 0.01 0.00 0.00 42.46 39.32 1lbl s ILE 45 CO 0.77 0.48 1.81 0.41 0.00 0.00 0.00 174.94 178.40 1lbl n THR 46 N 3.74 0.27 -3.26 2.92 -1.04 -1.26 -4.34 114.28 111.30 1lbl n THR 46 Ca -0.17 -0.05 -0.43 0.00 -2.04 0.00 0.00 64.05 61.36 1lbl n THR 46 Cb 0.52 -2.09 -0.08 0.00 -1.82 0.00 0.00 70.33 66.87 1lbl n THR 46 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1lbl s ALA 47 N 2.30 3.42 -0.12 2.41 0.00 -1.26 -4.85 121.76 123.67 1lbl s ALA 47 Ca 0.80 -1.62 -0.00 0.00 0.00 0.00 0.00 51.96 51.14 1lbl s ALA 47 Cb -0.49 -3.16 -0.02 0.00 0.00 0.00 0.00 23.12 19.45 1lbl s ALA 47 CO 0.36 -1.74 -0.12 0.42 0.00 0.00 0.00 175.76 174.68 1lbl s ILE 48 N 2.28 3.17 -0.46 0.00 1.01 -1.26 -1.72 121.20 124.21 1lbl s ILE 48 Ca 0.13 -0.63 -0.14 0.00 0.00 0.00 0.00 60.65 60.02 1lbl s ILE 48 Cb -0.18 -2.33 0.08 0.00 0.01 0.00 0.00 42.46 40.04 1lbl s ILE 48 CO 0.13 0.53 0.36 -0.63 0.00 0.00 0.00 174.94 175.33 1lbl s ILE 49 N 0.19 4.92 -0.04 2.92 1.01 0.61 0.37 121.20 131.18 1lbl s ILE 49 Ca -0.07 -1.20 -0.29 0.00 0.00 0.00 0.00 60.65 59.09 1lbl s ILE 49 Cb -0.15 -3.98 -0.03 0.00 0.01 0.00 0.00 42.46 38.32 1lbl s ILE 49 CO 0.05 -0.58 0.93 0.00 0.00 0.00 0.00 174.94 175.34 1lbl s ALA 50 N 1.57 3.25 -0.07 9.38 0.00 -0.90 -1.88 121.76 133.11 1lbl s ALA 50 Ca 0.04 0.42 -0.03 0.00 0.00 0.00 0.00 51.96 52.38 1lbl s ALA 50 Cb -0.24 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.55 1lbl s ALA 50 CO 0.05 -0.31 0.08 -2.00 0.00 0.00 0.00 175.76 173.58 1lbl s GLU 51 N 1.24 3.18 -0.28 0.00 2.12 -0.32 -1.86 118.70 122.78 1lbl s GLU 51 Ca 0.48 -0.34 -0.07 0.00 0.36 0.00 0.00 54.97 55.41 1lbl s GLU 51 Cb -0.20 -2.96 0.00 0.00 0.26 0.00 0.00 34.13 31.24 1lbl s GLU 51 CO 0.24 0.71 0.07 -0.47 -0.54 0.00 0.00 175.26 175.26 1lbl s TYR 52 N -1.05 3.12 -0.16 5.30 6.14 -0.42 -4.66 117.35 125.61 1lbl s TYR 52 Ca 0.17 -0.89 -0.08 0.00 0.64 0.00 0.00 57.07 56.91 1lbl s TYR 52 Cb -0.12 -2.24 0.06 0.00 0.42 0.00 0.00 41.96 40.09 1lbl s TYR 52 CO 0.07 -0.54 0.38 -1.59 0.64 0.00 0.00 175.55 174.51 1lbl s LYS 53 N 1.51 0.34 0.08 4.97 -2.85 -1.26 -2.91 119.74 119.63 1lbl s LYS 53 Ca 0.03 0.79 -0.12 0.00 -1.00 0.00 0.00 55.97 55.67 1lbl s LYS 53 Cb -0.17 0.01 -0.23 0.00 -2.06 0.00 0.00 37.83 35.39 1lbl s LYS 53 CO 0.02 -0.18 1.18 0.00 0.10 0.00 0.00 175.35 176.47 1lbl h ARG 54 N 7.36 0.61 -4.80 1.78 3.08 -1.83 -3.45 114.38 117.12 1lbl h ARG 54 Ca -0.33 -0.72 -0.32 0.00 0.07 0.00 0.00 59.98 58.68 1lbl h ARG 54 Cb 1.16 0.22 -0.15 0.00 0.08 0.00 0.00 29.97 31.29 1lbl h ARG 54 CO 0.27 1.31 -0.62 0.21 -1.07 0.00 0.00 179.97 180.07 1lbl s LYS 55 N -3.15 1.34 -0.15 0.04 2.20 -1.14 -1.80 119.74 117.08 1lbl s LYS 55 Ca -0.09 -1.72 -0.28 0.00 -0.36 0.00 0.00 55.97 53.52 1lbl s LYS 55 Cb 0.07 -0.12 0.08 0.00 -1.51 0.00 0.00 37.83 36.35 1lbl s LYS 55 CO 0.92 -0.31 0.74 -1.54 -0.36 0.00 0.00 175.35 174.79 1lbl s SER 56 N -3.27 -0.66 0.47 1.43 1.04 -1.17 -4.44 113.70 107.11 1lbl s SER 56 Ca 0.38 0.97 0.31 0.00 0.48 0.00 0.00 55.95 58.08 1lbl s SER 56 Cb 0.08 0.88 1.69 0.00 0.10 0.00 0.00 66.02 68.76 1lbl s SER 56 CO 0.13 -0.43 1.95 1.55 0.98 0.00 0.00 173.24 177.41 1lbl h PRO 57 N 3.76 0.00 -0.18 4.02 0.13 -1.92 -0.41 132.00 137.40 1lbl h PRO 57 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1lbl h PRO 57 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1lbl h PRO 57 CO 0.24 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 176.88 1lbl n SER 58 N -2.60 1.37 0.00 1.44 3.41 -1.26 -4.92 113.62 111.06 1lbl n SER 58 Ca -0.02 -1.75 0.00 0.00 -0.26 0.00 0.00 58.87 56.83 1lbl n SER 58 Cb 0.06 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 1lbl n SER 58 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1lbl n GLY 59 N 1.02 1.92 3.68 5.00 0.00 -0.16 -5.10 105.19 111.55 1lbl n GLY 59 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 1lbl n GLY 59 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1lbl n LEU 60 N 0.00 4.72 -3.01 0.99 7.94 -1.24 -4.86 117.00 121.54 1lbl n LEU 60 Ca 0.00 0.90 0.02 0.00 -1.11 0.00 0.00 56.01 55.82 1lbl n LEU 60 Cb 0.00 -1.49 -0.00 0.00 0.53 0.00 0.00 43.42 42.46 1lbl n LEU 60 CO 0.00 -1.18 0.27 -0.62 -1.11 0.00 0.00 177.39 174.76 1lbl s ASP 61 N -1.09 -0.97 -0.01 1.96 -1.08 -1.25 -3.02 116.67 111.22 1lbl s ASP 61 Ca 0.74 -0.43 0.02 0.00 -0.52 0.00 0.00 52.55 52.37 1lbl s ASP 61 Cb -0.42 1.27 -0.01 0.00 -1.46 0.00 0.00 42.92 42.30 1lbl s ASP 61 CO 0.48 -0.11 -0.08 0.68 0.52 0.00 0.00 175.17 176.66 1lbl s VAL 62 N 2.00 0.60 -0.20 1.11 -7.23 -0.74 -5.04 120.40 110.89 1lbl s VAL 62 Ca 0.16 -0.32 -0.15 0.00 -1.81 0.00 0.00 61.98 59.85 1lbl s VAL 62 Cb -0.01 -0.50 -0.04 0.00 0.56 0.00 0.00 36.38 36.39 1lbl s VAL 62 CO -0.12 0.17 0.35 -1.61 -0.31 0.00 0.00 175.10 173.58 1lbl s GLU 63 N -0.18 4.17 -0.28 4.82 2.02 -1.26 -4.68 118.70 123.31 1lbl s GLU 63 Ca 0.03 0.12 -0.18 0.00 0.02 0.00 0.00 54.97 54.96 1lbl s GLU 63 Cb -0.03 -3.52 0.08 0.00 0.10 0.00 0.00 34.13 30.75 1lbl s GLU 63 CO -0.00 0.01 0.70 0.50 0.02 0.00 0.00 175.26 176.48 1lbl s ARG 64 N 1.18 0.74 0.00 1.61 3.52 -1.26 -5.13 118.95 119.62 1lbl s ARG 64 Ca 0.17 1.17 -0.31 0.00 -0.13 0.00 0.00 55.73 56.63 1lbl s ARG 64 Cb -0.14 0.21 -0.10 0.00 -1.56 0.00 0.00 34.95 33.36 1lbl s ARG 64 CO 0.07 -0.14 1.96 -3.47 -0.81 0.00 0.00 175.30 172.92 1lbl n ASP 65 N 3.91 3.99 -0.07 -2.12 2.03 -1.26 -4.89 116.55 118.14 1lbl n ASP 65 Ca -0.19 0.90 -0.00 0.00 0.52 0.00 0.00 54.79 56.02 1lbl n ASP 65 Cb 0.58 -1.49 0.28 0.00 -0.72 0.00 0.00 41.12 39.77 1lbl n ASP 65 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1lbl h PRO 66 N 10.41 0.69 -0.27 -0.67 0.13 -1.99 -2.38 132.00 137.92 1lbl h PRO 66 Ca -0.49 -0.11 -0.15 0.00 -0.87 0.00 0.00 66.00 64.38 1lbl h PRO 66 Cb 1.25 -0.12 -0.00 0.00 0.13 0.00 0.00 31.00 32.25 1lbl h PRO 66 CO 0.94 0.59 -0.40 0.82 -0.23 0.00 0.00 178.00 179.72 1lbl h ILE 67 N 0.68 1.30 -0.12 -3.56 1.08 -1.96 -2.69 117.51 112.24 1lbl h ILE 67 Ca 0.16 -1.60 -0.05 0.00 -0.39 0.00 0.00 64.86 62.99 1lbl h ILE 67 Cb 0.18 1.66 -0.00 0.00 -3.07 0.00 0.00 36.82 35.59 1lbl h ILE 67 CO -0.01 0.51 -0.12 -0.08 -0.69 0.00 0.00 178.15 177.76 1lbl h GLU 68 N 0.50 0.30 -0.72 2.37 4.57 -1.95 -1.35 114.58 118.30 1lbl h GLU 68 Ca 0.03 -0.16 0.10 0.00 -1.18 0.00 0.00 59.36 58.14 1lbl h GLU 68 Cb 1.00 0.00 -0.07 0.00 -0.16 0.00 0.00 28.75 29.52 1lbl h GLU 68 CO 0.09 0.70 0.36 -0.92 -1.18 0.00 0.00 179.01 178.06 1lbl h TYR 69 N -0.09 0.64 -0.26 0.92 5.03 -1.50 -0.05 116.97 121.67 1lbl h TYR 69 Ca 0.02 0.03 -0.12 0.00 2.58 0.00 0.00 58.73 61.24 1lbl h TYR 69 Cb 0.64 -0.18 -0.00 0.00 1.55 0.00 0.00 36.73 38.74 1lbl h TYR 69 CO 0.08 0.23 -0.29 0.77 -1.32 0.00 0.00 178.16 177.63 1lbl h SER 70 N 0.61 0.71 -0.56 -2.11 0.02 -1.40 0.13 113.55 110.95 1lbl h SER 70 Ca 0.36 -0.49 -0.02 0.00 -0.84 0.00 0.00 61.79 60.80 1lbl h SER 70 Cb 0.38 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.69 1lbl h SER 70 CO -0.27 1.05 0.28 0.11 -1.14 0.00 0.00 176.83 176.85 1lbl h LYS 71 N 0.38 0.83 0.46 3.45 1.57 -0.89 0.55 116.57 122.92 1lbl h LYS 71 Ca 0.04 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 1lbl h LYS 71 Cb 0.86 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.02 1lbl h LYS 71 CO 0.07 0.64 -0.22 0.35 -0.57 0.00 0.00 179.45 179.72 1lbl h PHE 72 N 0.83 -0.57 -0.32 -1.35 3.57 -0.82 -3.05 116.94 115.23 1lbl h PHE 72 Ca 0.20 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.78 1lbl h PHE 72 Cb 0.09 0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 1lbl h PHE 72 CO 0.01 -0.25 0.27 0.52 -2.23 0.00 0.00 178.31 176.63 1lbl h MET 73 N -0.98 0.00 -0.26 1.11 2.86 -0.79 -1.46 114.93 115.42 1lbl h MET 73 Ca -0.06 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.65 1lbl h MET 73 Cb 0.58 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.23 1lbl h MET 73 CO 0.10 0.00 0.21 1.49 1.06 0.00 0.00 176.91 179.77 1lbl h GLU 74 N 0.00 0.00 0.00 1.72 4.81 -0.77 0.21 114.58 120.55 1lbl h GLU 74 Ca 0.15 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.37 1lbl h GLU 74 Cb 0.69 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.07 1lbl h GLU 74 CO -0.00 0.00 -0.07 0.00 -0.73 0.00 0.00 179.01 178.20 1lbl h ARG 75 N 0.00 0.00 0.00 1.92 3.08 -1.37 -3.38 114.38 114.63 1lbl h ARG 75 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1lbl h ARG 75 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1lbl h ARG 75 CO -0.00 0.07 -0.71 0.66 -1.07 0.00 0.00 179.97 178.92 1lbl n TYR 76 N -3.18 0.00 -2.27 3.04 4.02 -0.57 -5.11 117.16 113.09 1lbl n TYR 76 Ca 0.01 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.55 1lbl n TYR 76 Cb 0.37 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.69 1lbl n TYR 76 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1lbl s ALA 77 N -1.71 2.73 -0.03 -0.72 0.00 0.62 -4.78 121.76 117.87 1lbl s ALA 77 Ca 0.00 0.83 0.14 0.00 0.00 0.00 0.00 51.96 52.93 1lbl s ALA 77 Cb 0.00 -3.36 0.12 0.00 0.00 0.00 0.00 23.12 19.88 1lbl s ALA 77 CO 0.00 -0.75 1.46 -0.24 0.00 0.00 0.00 175.76 176.23 1lbl h VAL 78 N 1.27 1.07 -2.18 0.00 3.04 -0.41 -3.47 116.25 115.57 1lbl h VAL 78 Ca -0.50 -2.36 0.21 0.00 -1.01 0.00 0.00 66.70 63.04 1lbl h VAL 78 Cb 1.26 2.42 -0.08 0.00 -2.01 0.00 0.00 31.29 32.89 1lbl h VAL 78 CO 0.57 0.58 0.60 -0.83 -1.01 0.00 0.00 177.57 177.48 1lbl s GLY 79 N -4.50 -0.18 0.19 3.17 0.00 -1.23 -4.36 107.32 100.42 1lbl s GLY 79 Ca 0.03 0.13 0.10 0.00 0.00 0.00 0.00 44.72 44.97 1lbl s GLY 79 CO 0.75 0.81 -0.13 1.08 0.00 0.00 0.00 173.10 175.61 1lbl s LEU 80 N -3.10 2.83 -0.15 0.66 1.43 0.28 -2.12 118.68 118.51 1lbl s LEU 80 Ca 0.16 -0.68 -0.01 0.00 -1.03 0.00 0.00 54.13 52.57 1lbl s LEU 80 Cb -0.00 -1.51 0.04 0.00 0.03 0.00 0.00 46.19 44.75 1lbl s LEU 80 CO 0.02 0.10 -0.02 -0.55 0.23 0.00 0.00 176.35 176.12 1lbl s SER 81 N -2.86 2.61 -0.18 2.29 0.15 -0.77 -0.02 113.70 114.92 1lbl s SER 81 Ca 0.24 -0.59 -0.05 0.00 0.70 0.00 0.00 55.95 56.25 1lbl s SER 81 Cb -0.08 -0.75 -0.03 0.00 -1.71 0.00 0.00 66.02 63.45 1lbl s SER 81 CO 0.14 -0.21 -0.01 -0.63 1.20 0.00 0.00 173.24 173.73 1lbl s ILE 82 N 1.75 4.04 -0.01 6.45 -1.09 -0.64 -1.30 121.20 130.39 1lbl s ILE 82 Ca 0.01 -0.29 -0.30 0.00 -2.23 0.00 0.00 60.65 57.84 1lbl s ILE 82 Cb -0.15 -2.81 -0.03 0.00 -1.58 0.00 0.00 42.46 37.89 1lbl s ILE 82 CO -0.07 0.46 1.07 -0.76 -1.23 0.00 0.00 174.94 174.40 1lbl s LEU 83 N 0.68 4.34 0.00 2.97 2.01 -1.14 -1.24 118.68 126.29 1lbl s LEU 83 Ca -0.00 1.75 0.09 0.00 0.01 0.00 0.00 54.13 55.97 1lbl s LEU 83 Cb -0.14 -3.57 0.13 0.00 0.01 0.00 0.00 46.19 42.62 1lbl s LEU 83 CO 0.02 -0.39 0.92 0.35 1.01 0.00 0.00 176.35 178.26 1lbl n THR 84 N 4.11 0.35 -2.45 5.49 -2.24 -0.10 -3.85 114.28 115.59 1lbl n THR 84 Ca 0.08 -0.67 -0.42 0.00 -2.27 0.00 0.00 64.05 60.77 1lbl n THR 84 Cb 0.49 0.94 -0.03 0.00 -2.10 0.00 0.00 70.33 69.63 1lbl n THR 84 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1lbl s GLU 85 N -0.82 4.47 -0.09 -0.78 -6.30 -1.25 -3.89 118.70 110.04 1lbl s GLU 85 Ca 0.13 1.76 -0.19 0.00 -2.50 0.00 0.00 54.97 54.16 1lbl s GLU 85 Cb 0.08 -3.33 -0.28 0.00 0.00 0.00 0.00 34.13 30.60 1lbl s GLU 85 CO 0.11 -0.18 0.68 0.93 0.02 0.00 0.00 175.26 176.83 1lbl h GLU 86 N 6.36 0.24 0.11 4.30 5.08 -1.94 0.87 114.58 129.61 1lbl h GLU 86 Ca -0.42 -0.41 -0.29 0.00 -1.00 0.00 0.00 59.36 57.24 1lbl h GLU 86 Cb 1.21 0.15 0.02 0.00 0.50 0.00 0.00 28.75 30.64 1lbl h GLU 86 CO 0.79 1.20 -1.22 -0.22 -1.00 0.00 0.00 179.01 178.56 1lbl h LYS 87 N -0.40 0.52 0.00 2.33 3.64 -1.93 -2.79 116.57 117.94 1lbl h LYS 87 Ca -0.23 -0.72 -0.25 0.00 -1.27 0.00 0.00 60.65 58.19 1lbl h LYS 87 Cb 1.65 0.24 -0.05 0.00 -0.41 0.00 0.00 32.23 33.67 1lbl h LYS 87 CO 0.08 1.31 -2.16 0.66 -2.27 0.00 0.00 179.45 177.07 1lbl n TYR 88 N -3.73 0.14 0.46 1.91 4.01 -1.26 -4.54 117.16 114.15 1lbl n TYR 88 Ca -0.12 0.05 0.05 0.00 -0.16 0.00 0.00 57.90 57.72 1lbl n TYR 88 Cb 0.98 -0.88 -0.01 0.00 -0.31 0.00 0.00 39.34 39.12 1lbl n TYR 88 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1lbl n PHE 89 N -2.64 0.00 -3.02 -0.72 3.72 -1.25 -3.54 117.46 110.01 1lbl n PHE 89 Ca -0.22 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 56.95 1lbl n PHE 89 Cb 0.96 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 39.54 1lbl n PHE 89 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1lbl n ASN 90 N -0.41 -6.19 -4.74 4.37 4.05 -1.05 -2.89 115.26 108.40 1lbl n ASN 90 Ca 0.04 -0.29 -0.23 0.00 0.45 0.00 0.00 54.58 54.55 1lbl n ASN 90 Cb 0.21 -5.00 0.11 0.00 1.23 0.00 0.00 39.78 36.33 1lbl n ASN 90 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 1lbl s GLY 91 N -2.71 1.74 -0.03 8.20 0.00 0.29 -4.75 107.32 110.07 1lbl s GLY 91 Ca 0.30 -1.93 -0.29 0.00 0.00 0.00 0.00 44.72 42.81 1lbl s GLY 91 CO 0.38 -1.35 0.82 -1.35 0.00 0.00 0.00 173.10 171.60 1lbl s SER 92 N -4.77 -0.46 0.41 1.64 1.04 -1.25 -3.97 113.70 106.34 1lbl s SER 92 Ca 0.66 0.26 0.13 0.00 0.48 0.00 0.00 55.95 57.48 1lbl s SER 92 Cb -0.05 0.43 0.86 0.00 0.10 0.00 0.00 66.02 67.37 1lbl s SER 92 CO 0.44 -0.61 1.92 1.88 0.98 0.00 0.00 173.24 177.85 1lbl h TYR 93 N 2.35 0.06 -0.62 5.02 0.99 -1.92 -2.74 116.97 120.11 1lbl h TYR 93 Ca -0.24 -0.01 -0.05 0.00 2.00 0.00 0.00 58.73 60.43 1lbl h TYR 93 Cb 1.21 -0.02 -0.03 0.00 1.00 0.00 0.00 36.73 38.90 1lbl h TYR 93 CO 0.29 0.29 0.19 1.49 -0.00 0.00 0.00 178.16 180.42 1lbl h GLU 94 N 0.06 0.94 -0.35 4.88 4.57 -1.98 -2.31 114.58 120.39 1lbl h GLU 94 Ca 0.01 -0.18 -0.02 0.00 -1.18 0.00 0.00 59.36 57.99 1lbl h GLU 94 Cb 0.44 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.87 1lbl h GLU 94 CO 0.03 0.81 0.13 1.15 -1.18 0.00 0.00 179.01 179.95 1lbl h THR 95 N 0.91 1.19 -0.60 0.32 2.02 -1.89 -2.00 112.91 112.86 1lbl h THR 95 Ca 0.20 -0.61 0.03 0.00 0.77 0.00 0.00 66.41 66.81 1lbl h THR 95 Cb 0.26 0.94 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 1lbl h THR 95 CO -0.01 0.21 0.36 0.25 0.37 0.00 0.00 175.52 176.71 1lbl h LEU 96 N 0.41 0.59 0.03 2.58 6.46 -1.48 -1.57 115.31 122.33 1lbl h LEU 96 Ca 0.12 0.00 0.01 0.00 -0.12 0.00 0.00 57.88 57.88 1lbl h LEU 96 Cb 0.20 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.00 1lbl h LEU 96 CO -0.01 0.41 -0.05 -0.09 -0.62 0.00 0.00 178.44 178.08 1lbl h ARG 97 N 0.72 -0.10 -0.77 1.25 2.43 -1.25 0.10 114.38 116.76 1lbl h ARG 97 Ca 0.24 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.43 1lbl h ARG 97 Cb 0.02 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.56 1lbl h ARG 97 CO -0.10 -0.07 0.51 0.87 -1.51 0.00 0.00 179.97 179.67 1lbl h LYS 98 N -0.10 1.00 0.09 0.20 1.57 -1.03 -2.22 116.57 116.08 1lbl h LYS 98 Ca 0.01 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1lbl h LYS 98 Cb 0.11 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.20 1lbl h LYS 98 CO -0.03 0.66 -0.04 0.82 -0.57 0.00 0.00 179.45 180.29 1lbl h ILE 99 N 1.03 0.98 -0.63 1.86 2.04 -1.04 -2.82 117.51 118.94 1lbl h ILE 99 Ca 0.28 -0.25 0.07 0.00 1.00 0.00 0.00 64.86 65.96 1lbl h ILE 99 Cb -0.11 1.14 -0.04 0.00 -0.74 0.00 0.00 36.82 37.08 1lbl h ILE 99 CO -0.07 0.06 0.42 0.00 0.00 0.00 0.00 178.15 178.56 1lbl h ALA 100 N 0.67 1.81 0.00 1.87 0.00 -0.47 0.39 119.26 123.52 1lbl h ALA 100 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1lbl h ALA 100 Cb 0.19 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1lbl h ALA 100 CO 0.02 0.09 0.00 0.43 0.00 0.00 0.00 179.25 179.79 1lbl n SER 101 N -4.48 0.37 -0.07 0.00 7.64 -0.86 -3.87 113.62 112.35 1lbl n SER 101 Ca 0.09 0.56 -0.07 0.00 1.01 0.00 0.00 58.87 60.46 1lbl n SER 101 Cb 0.25 -0.65 -0.15 0.00 -1.01 0.00 0.00 64.21 62.65 1lbl n SER 101 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1lbl n SER 102 N -1.87 0.22 -4.60 6.43 7.64 0.10 -5.03 113.62 116.52 1lbl n SER 102 Ca 0.05 0.10 -0.29 0.00 1.01 0.00 0.00 58.87 59.74 1lbl n SER 102 Cb 0.31 0.84 -0.09 0.00 -1.01 0.00 0.00 64.21 64.26 1lbl n SER 102 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1lbl s VAL 103 N -2.64 1.45 -0.12 0.44 -7.23 -1.06 -4.97 120.40 106.26 1lbl s VAL 103 Ca -0.08 -2.00 0.20 0.00 -1.81 0.00 0.00 61.98 58.28 1lbl s VAL 103 Cb 0.07 -2.60 0.44 0.00 0.56 0.00 0.00 36.38 34.85 1lbl s VAL 103 CO 0.84 0.00 1.18 -1.54 -0.31 0.00 0.00 175.10 175.26 1lbl n SER 104 N -1.07 1.63 -4.68 4.85 3.41 -1.26 -4.87 113.62 111.62 1lbl n SER 104 Ca -0.10 -2.70 -0.23 0.00 -0.26 0.00 0.00 58.87 55.58 1lbl n SER 104 Cb 0.67 -0.40 -0.07 0.00 -0.26 0.00 0.00 64.21 64.15 1lbl n SER 104 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1lbl s ILE 105 N -1.88 3.48 0.41 -1.33 -4.36 -1.26 -5.09 121.20 111.16 1lbl s ILE 105 Ca 0.36 -1.82 -0.25 0.00 -0.26 0.00 0.00 60.65 58.68 1lbl s ILE 105 Cb 0.38 -2.93 -0.10 0.00 1.25 0.00 0.00 42.46 41.05 1lbl s ILE 105 CO -0.10 -0.33 1.14 -2.65 0.24 0.00 0.00 174.94 173.23 1lbl n PRO 106 N -0.98 1.64 -4.92 0.37 -0.02 -1.26 -4.80 135.00 125.03 1lbl n PRO 106 Ca -0.06 0.58 -0.30 0.00 -2.02 0.00 0.00 63.50 61.71 1lbl n PRO 106 Cb 0.59 -2.20 -0.17 0.00 -0.02 0.00 0.00 33.50 31.71 1lbl n PRO 106 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1lbl s ILE 107 N -1.22 1.75 -0.15 4.25 1.01 -1.26 -0.56 121.20 125.02 1lbl s ILE 107 Ca 0.62 -0.83 -0.06 0.00 0.00 0.00 0.00 60.65 60.38 1lbl s ILE 107 Cb -0.54 -1.54 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 1lbl s ILE 107 CO 0.58 0.49 0.06 -0.22 0.00 0.00 0.00 174.94 175.85 1lbl s LEU 108 N 0.54 3.85 -0.26 2.97 2.96 0.97 0.13 118.68 129.84 1lbl s LEU 108 Ca -0.15 0.16 -0.16 0.00 -0.22 0.00 0.00 54.13 53.76 1lbl s LEU 108 Cb -0.17 -1.95 -0.04 0.00 0.50 0.00 0.00 46.19 44.54 1lbl s LEU 108 CO 0.06 0.26 0.40 -0.32 -1.32 0.00 0.00 176.35 175.43 1lbl s MET 109 N -0.14 4.04 -0.31 1.98 -2.45 -0.83 -1.63 119.30 119.96 1lbl s MET 109 Ca 0.07 0.11 -0.10 0.00 -1.25 0.00 0.00 55.69 54.52 1lbl s MET 109 Cb -0.12 -3.65 -0.01 0.00 1.25 0.00 0.00 34.83 32.30 1lbl s MET 109 CO 0.01 -0.28 0.16 0.21 1.05 0.00 0.00 175.02 176.18 1lbl s LYS 110 N 2.08 3.36 0.16 4.11 2.47 -0.38 -3.22 119.74 128.33 1lbl s LYS 110 Ca 0.16 -0.70 -0.08 0.00 -1.56 0.00 0.00 55.97 53.79 1lbl s LYS 110 Cb -0.16 -3.59 0.03 0.00 -1.46 0.00 0.00 37.83 32.65 1lbl s LYS 110 CO 0.10 -0.42 0.41 -3.47 0.16 0.00 0.00 175.35 172.13 1lbl n ASP 111 N 5.00 -1.01 -4.16 1.43 4.64 -1.26 -0.92 116.55 120.26 1lbl n ASP 111 Ca -0.14 -1.66 -0.39 0.00 -1.38 0.00 0.00 54.79 51.23 1lbl n ASP 111 Cb 0.49 1.67 -0.06 0.00 -1.04 0.00 0.00 41.12 42.18 1lbl n ASP 111 CO 0.00 0.00 0.00 -0.36 -0.82 0.00 0.00 177.20 176.02 1lbl s PHE 112 N -5.27 3.71 -0.45 -0.67 0.40 -1.26 -4.88 117.98 109.56 1lbl s PHE 112 Ca 0.09 -2.69 -0.29 0.00 -0.60 0.00 0.00 56.93 53.44 1lbl s PHE 112 Cb -0.02 -3.38 0.01 0.00 0.51 0.00 0.00 43.02 40.14 1lbl s PHE 112 CO 0.05 -0.84 1.40 0.42 0.70 0.00 0.00 175.22 176.95 1lbl s ILE 113 N -0.58 3.89 -0.48 0.64 1.01 -1.26 -4.84 121.20 119.58 1lbl s ILE 113 Ca 0.22 0.87 0.04 0.00 0.00 0.00 0.00 60.65 61.78 1lbl s ILE 113 Cb -0.13 -4.27 0.04 0.00 0.01 0.00 0.00 42.46 38.10 1lbl s ILE 113 CO -0.08 -0.87 0.65 1.33 0.00 0.00 0.00 174.94 175.98 1lbl n VAL 114 N 7.03 0.07 -3.69 2.92 0.24 -1.26 -4.84 118.33 118.80 1lbl n VAL 114 Ca 0.15 -0.53 -0.13 0.00 -2.04 0.00 0.00 64.34 61.79 1lbl n VAL 114 Cb 0.48 1.04 -0.07 0.00 -1.47 0.00 0.00 33.84 33.82 1lbl n VAL 114 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 1lbl s LYS 115 N -0.37 0.83 0.39 7.34 -2.85 -1.26 -4.86 119.74 118.96 1lbl s LYS 115 Ca 0.05 -0.24 0.13 0.00 -1.00 0.00 0.00 55.97 54.90 1lbl s LYS 115 Cb 0.03 0.37 0.95 0.00 -2.06 0.00 0.00 37.83 37.12 1lbl s LYS 115 CO 0.05 -0.26 1.88 0.93 0.10 0.00 0.00 175.35 178.05 1lbl h GLU 116 N 3.35 0.53 0.00 1.78 5.08 -1.99 -2.34 114.58 120.99 1lbl h GLU 116 Ca -0.30 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.02 1lbl h GLU 116 Cb 1.19 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.32 1lbl h GLU 116 CO 0.42 0.35 -0.03 0.66 -1.00 0.00 0.00 179.01 179.41 1lbl h SER 117 N 0.54 0.00 0.51 1.42 4.64 -1.98 -1.53 113.55 117.15 1lbl h SER 117 Ca 0.43 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.65 1lbl h SER 117 Cb 0.87 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.95 1lbl h SER 117 CO -0.18 0.03 -0.50 1.56 -0.87 0.00 0.00 176.83 176.87 1lbl h GLN 118 N 0.00 0.00 -0.01 4.77 4.20 -1.79 0.63 115.11 122.90 1lbl h GLN 118 Ca -0.00 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.47 1lbl h GLN 118 Cb 0.09 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.88 1lbl h GLN 118 CO 0.00 0.50 -0.95 0.82 -0.67 0.00 0.00 178.83 178.53 1lbl h ILE 119 N 0.00 1.36 -0.55 2.54 2.04 -1.43 -0.47 117.51 121.00 1lbl h ILE 119 Ca -0.01 -2.35 -0.01 0.00 1.00 0.00 0.00 64.86 63.49 1lbl h ILE 119 Cb 0.89 2.37 -0.03 0.00 -0.74 0.00 0.00 36.82 39.31 1lbl h ILE 119 CO 0.07 0.71 0.29 0.44 0.00 0.00 0.00 178.15 179.66 1lbl h ASP 120 N 0.30 0.70 -0.25 1.72 3.32 -1.10 -0.29 116.42 120.82 1lbl h ASP 120 Ca -0.09 -0.10 0.05 0.00 0.02 0.00 0.00 57.03 56.90 1lbl h ASP 120 Cb 1.59 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 40.92 1lbl h ASP 120 CO 0.17 0.60 -0.03 0.44 -1.72 0.00 0.00 179.24 178.70 1lbl h ASP 121 N 0.74 -0.16 -0.58 6.45 3.45 -0.60 0.17 116.42 125.87 1lbl h ASP 121 Ca 0.19 0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.72 1lbl h ASP 121 Cb 0.07 0.13 -0.03 0.00 -0.56 0.00 0.00 39.33 38.93 1lbl h ASP 121 CO -0.03 -0.05 0.38 0.00 -1.57 0.00 0.00 179.24 177.97 1lbl h ALA 122 N 1.23 0.74 -0.06 3.45 0.00 -0.42 -0.66 119.26 123.54 1lbl h ALA 122 Ca 0.12 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1lbl h ALA 122 Cb 0.17 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1lbl h ALA 122 CO -0.23 0.18 0.02 -0.92 0.00 0.00 0.00 179.25 178.31 1lbl h TYR 123 N 0.79 0.10 0.00 0.00 5.03 -0.61 -1.37 116.97 120.91 1lbl h TYR 123 Ca 0.21 -0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.47 1lbl h TYR 123 Cb -0.08 -0.03 -0.01 0.00 1.55 0.00 0.00 36.73 38.16 1lbl h TYR 123 CO -0.03 0.23 -0.21 -0.91 -1.32 0.00 0.00 178.16 175.92 1lbl h ASN 124 N -0.06 0.00 1.22 -2.11 -0.26 -0.80 -2.89 115.58 110.68 1lbl h ASN 124 Ca 0.02 0.00 -0.10 0.00 -0.56 0.00 0.00 56.30 55.66 1lbl h ASN 124 Cb 0.18 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.42 1lbl h ASN 124 CO -0.00 0.21 -0.47 -0.07 -1.06 0.00 0.00 177.43 176.04 1lbl h LEU 125 N 0.00 0.00 0.00 1.61 4.07 -0.98 -3.40 115.31 116.61 1lbl h LEU 125 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1lbl h LEU 125 Cb 0.41 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.15 1lbl h LEU 125 CO 0.03 0.47 0.00 0.61 -1.08 0.00 0.00 178.44 178.47 1lbl n GLY 126 N 0.85 0.92 3.76 0.83 0.00 -1.01 -4.40 105.19 106.14 1lbl n GLY 126 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 1lbl n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lbl s ALA 127 N -2.00 2.44 -0.10 4.61 0.00 -0.55 -4.85 121.76 121.30 1lbl s ALA 127 Ca 0.00 0.64 0.20 0.00 0.00 0.00 0.00 51.96 52.81 1lbl s ALA 127 Cb 0.00 -3.35 -0.28 0.00 0.00 0.00 0.00 23.12 19.49 1lbl s ALA 127 CO 0.00 -1.32 0.41 -0.25 0.00 0.00 0.00 175.76 174.60 1lbl n ASP 128 N -2.32 0.12 -3.18 0.00 9.92 0.12 -4.59 116.55 116.62 1lbl n ASP 128 Ca 0.11 0.05 -0.12 0.00 -0.53 0.00 0.00 54.79 54.30 1lbl n ASP 128 Cb 0.51 1.43 -0.02 0.00 -0.64 0.00 0.00 41.12 42.41 1lbl n ASP 128 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 1lbl s THR 129 N -3.13 0.00 0.06 -3.53 -1.32 -0.76 -4.71 115.64 102.25 1lbl s THR 129 Ca -0.08 -1.39 -0.01 0.00 -1.21 0.00 0.00 61.69 59.00 1lbl s THR 129 Cb 0.11 -2.69 -0.04 0.00 -1.51 0.00 0.00 72.50 68.37 1lbl s THR 129 CO 0.87 0.00 -0.02 -0.69 -2.21 0.00 0.00 174.62 172.57 1lbl s VAL 130 N -2.86 0.21 -0.14 5.08 1.01 -1.26 -1.96 120.40 120.49 1lbl s VAL 130 Ca 0.25 -1.79 -0.06 0.00 0.00 0.00 0.00 61.98 60.38 1lbl s VAL 130 Cb -0.02 -1.55 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 1lbl s VAL 130 CO 0.17 -0.95 0.06 -0.22 0.00 0.00 0.00 175.10 174.16 1lbl s LEU 131 N -2.93 3.89 -0.12 3.92 2.96 -1.20 -0.66 118.68 124.55 1lbl s LEU 131 Ca 0.08 0.20 0.01 0.00 -0.22 0.00 0.00 54.13 54.21 1lbl s LEU 131 Cb 0.08 -1.95 0.02 0.00 0.50 0.00 0.00 46.19 44.84 1lbl s LEU 131 CO -0.09 0.30 -0.15 -0.76 -1.32 0.00 0.00 176.35 174.33 1lbl s LEU 132 N -0.38 1.70 -0.40 -0.68 1.43 -0.01 -4.51 118.68 115.84 1lbl s LEU 132 Ca 0.09 -0.44 -0.17 0.00 -1.03 0.00 0.00 54.13 52.58 1lbl s LEU 132 Cb -0.12 -1.11 0.01 0.00 0.03 0.00 0.00 46.19 45.00 1lbl s LEU 132 CO 0.02 -0.01 0.41 -0.63 0.23 0.00 0.00 176.35 176.37 1lbl s ILE 133 N 1.15 5.12 0.29 -0.59 1.01 -1.26 -0.92 121.20 126.01 1lbl s ILE 133 Ca -0.03 -0.27 -0.00 0.00 0.00 0.00 0.00 60.65 60.35 1lbl s ILE 133 Cb -0.14 -3.97 0.28 0.00 0.01 0.00 0.00 42.46 38.63 1lbl s ILE 133 CO -0.04 -0.33 1.90 0.58 0.00 0.00 0.00 174.94 177.05 1lbl h VAL 134 N 5.67 1.06 0.00 2.92 2.07 -1.84 -2.64 116.25 123.50 1lbl h VAL 134 Ca -0.27 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 66.88 1lbl h VAL 134 Cb 1.12 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1lbl h VAL 134 CO 0.76 0.20 0.00 2.29 0.02 0.00 0.00 177.57 180.84 1lbl n LYS 135 N -4.50 0.08 0.00 1.57 2.85 -1.26 -2.68 118.16 114.22 1lbl n LYS 135 Ca 0.14 0.38 0.08 0.00 -1.05 0.00 0.00 58.31 57.87 1lbl n LYS 135 Cb 0.20 -1.68 -0.01 0.00 -0.65 0.00 0.00 35.03 32.89 1lbl n LYS 135 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 177.40 177.79 1lbl n ILE 136 N -1.84 0.00 -4.36 0.58 -5.35 -1.00 -4.84 119.36 102.55 1lbl n ILE 136 Ca 0.02 -0.30 -0.25 0.00 -0.27 0.00 0.00 62.75 61.95 1lbl n ILE 136 Cb 0.16 1.17 -0.10 0.00 -1.74 0.00 0.00 39.64 39.13 1lbl n ILE 136 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1lbl s LEU 137 N -2.16 2.80 0.65 7.28 1.02 -1.09 -0.47 118.68 126.71 1lbl s LEU 137 Ca 0.13 -0.76 -0.04 0.00 0.02 0.00 0.00 54.13 53.47 1lbl s LEU 137 Cb 0.13 -1.43 0.05 0.00 0.02 0.00 0.00 46.19 44.96 1lbl s LEU 137 CO 0.45 0.07 0.94 0.42 0.02 0.00 0.00 176.35 178.25 1lbl s THR 138 N -2.00 2.46 0.22 5.49 -4.23 -1.26 -4.69 115.64 111.63 1lbl s THR 138 Ca 0.26 -0.37 -0.09 0.00 -1.18 0.00 0.00 61.69 60.32 1lbl s THR 138 Cb -0.07 -3.03 0.17 0.00 1.34 0.00 0.00 72.50 70.91 1lbl s THR 138 CO 0.15 -0.02 1.83 -0.08 -0.54 0.00 0.00 174.62 175.96 1lbl h GLU 139 N -0.38 1.14 -0.26 3.99 4.81 -2.00 -2.05 114.58 119.83 1lbl h GLU 139 Ca -0.44 -0.14 -0.03 0.00 -0.13 0.00 0.00 59.36 58.62 1lbl h GLU 139 Cb 1.31 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 30.46 1lbl h GLU 139 CO 0.58 0.84 0.04 0.00 -0.73 0.00 0.00 179.01 179.75 1lbl h ARG 140 N 1.13 0.43 -0.54 1.92 3.08 -1.99 -1.33 114.38 117.08 1lbl h ARG 140 Ca 0.29 -0.12 0.05 0.00 0.07 0.00 0.00 59.98 60.27 1lbl h ARG 140 Cb 0.04 -0.05 -0.05 0.00 0.08 0.00 0.00 29.97 29.99 1lbl h ARG 140 CO -0.04 0.55 0.28 0.93 -1.07 0.00 0.00 179.97 180.62 1lbl h GLU 141 N 0.25 0.52 -0.14 0.04 5.08 -1.91 -0.62 114.58 117.80 1lbl h GLU 141 Ca 0.08 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1lbl h GLU 141 Cb 0.33 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1lbl h GLU 141 CO 0.00 0.34 0.07 1.25 -1.00 0.00 0.00 179.01 179.67 1lbl h LEU 142 N 0.53 0.10 -0.76 1.33 6.46 -1.24 0.85 115.31 122.59 1lbl h LEU 142 Ca 0.24 0.01 0.02 0.00 -0.12 0.00 0.00 57.88 58.03 1lbl h LEU 142 Cb 0.15 -0.01 -0.04 0.00 -0.73 0.00 0.00 40.66 40.03 1lbl h LEU 142 CO -0.17 0.08 0.49 -0.08 -0.62 0.00 0.00 178.44 178.14 1lbl h GLU 143 N 0.15 0.95 -0.15 1.25 4.81 -0.90 0.62 114.58 121.31 1lbl h GLU 143 Ca 0.06 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1lbl h GLU 143 Cb 0.01 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.17 1lbl h GLU 143 CO -0.04 0.63 -0.02 0.77 -0.73 0.00 0.00 179.01 179.62 1lbl h SER 144 N 0.98 0.28 -0.19 1.04 0.02 -0.64 -2.28 113.55 112.76 1lbl h SER 144 Ca 0.29 -0.34 -0.06 0.00 -0.84 0.00 0.00 61.79 60.83 1lbl h SER 144 Cb -0.05 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 1lbl h SER 144 CO -0.08 0.56 -0.07 -0.07 -1.14 0.00 0.00 176.83 176.02 1lbl h LEU 145 N -0.00 0.50 -0.12 5.07 4.07 -0.75 -1.79 115.31 122.27 1lbl h LEU 145 Ca 0.04 -0.11 -0.01 0.00 0.08 0.00 0.00 57.88 57.88 1lbl h LEU 145 Cb 0.43 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.03 1lbl h LEU 145 CO 0.01 0.61 0.06 0.25 -1.08 0.00 0.00 178.44 178.29 1lbl h LEU 146 N 0.49 0.17 -0.68 1.67 5.85 -0.76 -2.27 115.31 119.77 1lbl h LEU 146 Ca 0.10 -0.14 -0.05 0.00 0.84 0.00 0.00 57.88 58.63 1lbl h LEU 146 Cb 0.42 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 1lbl h LEU 146 CO 0.02 0.26 0.24 -0.33 -0.34 0.00 0.00 178.44 178.29 1lbl h GLU 147 N 0.06 1.04 -0.27 1.25 4.39 -1.26 -2.45 114.58 117.35 1lbl h GLU 147 Ca 0.04 -0.21 0.03 0.00 0.34 0.00 0.00 59.36 59.56 1lbl h GLU 147 Cb 0.14 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.61 1lbl h GLU 147 CO -0.00 0.89 0.10 -0.92 -1.16 0.00 0.00 179.01 177.91 1lbl h TYR 148 N 0.98 0.18 -0.73 4.33 3.20 -1.25 -0.69 116.97 123.00 1lbl h TYR 148 Ca 0.22 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.08 1lbl h TYR 148 Cb 0.26 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 1lbl h TYR 148 CO 0.02 0.09 0.34 0.00 -1.64 0.00 0.00 178.16 176.96 1lbl h ALA 149 N 1.16 1.23 0.00 1.82 0.00 -1.33 -1.68 119.26 120.46 1lbl h ALA 149 Ca 0.12 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1lbl h ALA 149 Cb 0.08 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1lbl h ALA 149 CO -0.11 0.59 -0.32 0.00 0.00 0.00 0.00 179.25 179.40 1lbl h ARG 150 N 1.03 0.00 0.00 0.00 3.08 -0.89 -1.87 114.38 115.73 1lbl h ARG 150 Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.30 1lbl h ARG 150 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1lbl h ARG 150 CO -0.03 0.32 0.00 0.66 -1.07 0.00 0.00 179.97 179.85 1lbl h SER 151 N 0.00 0.00 -0.52 7.04 4.64 -0.16 0.42 113.55 124.97 1lbl h SER 151 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1lbl h SER 151 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1lbl h SER 151 CO 0.04 0.00 0.00 -1.22 -0.87 0.00 0.00 176.83 174.78 1lbl n TYR 152 N -2.53 0.69 -1.14 4.77 4.02 -0.76 -4.96 117.16 117.23 1lbl n TYR 152 Ca -0.00 -0.36 -0.02 0.00 -0.01 0.00 0.00 57.90 57.50 1lbl n TYR 152 Cb 0.15 -0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.46 1lbl n TYR 152 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1lbl n GLY 153 N 1.50 0.52 3.75 2.72 0.00 0.15 -4.99 105.19 108.83 1lbl n GLY 153 Ca 0.21 -0.97 -0.32 0.00 0.00 0.00 0.00 46.02 44.94 1lbl n GLY 153 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1lbl s MET 154 N -2.34 2.91 -0.33 1.61 -1.94 -0.85 -4.97 119.30 113.38 1lbl s MET 154 Ca 0.00 -0.60 0.00 0.00 -1.71 0.00 0.00 55.69 53.39 1lbl s MET 154 Cb 0.00 -2.75 0.08 0.00 2.01 0.00 0.00 34.83 34.17 1lbl s MET 154 CO 0.00 0.61 0.04 -2.00 -0.01 0.00 0.00 175.02 173.67 1lbl s GLU 155 N -1.88 2.08 0.85 2.03 2.56 -1.26 -3.50 118.70 119.57 1lbl s GLU 155 Ca 0.24 -1.55 -0.11 0.00 0.00 0.00 0.00 54.97 53.55 1lbl s GLU 155 Cb -0.12 -3.24 0.10 0.00 2.00 0.00 0.00 34.13 32.88 1lbl s GLU 155 CO 0.15 -0.79 1.10 -1.25 -0.56 0.00 0.00 175.26 173.91 1lbl s PRO 156 N 1.12 1.63 -0.32 4.30 0.04 -1.26 -4.66 135.00 135.85 1lbl s PRO 156 Ca 0.01 1.11 -0.14 0.00 0.04 0.00 0.00 61.00 62.02 1lbl s PRO 156 Cb -0.20 -1.83 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 1lbl s PRO 156 CO -0.04 -2.07 0.30 -1.17 0.04 0.00 0.00 177.00 174.06 1lbl s LEU 157 N -6.17 4.31 -0.26 -3.56 2.96 0.16 -4.55 118.68 111.57 1lbl s LEU 157 Ca 0.63 -0.15 -0.14 0.00 -0.22 0.00 0.00 54.13 54.26 1lbl s LEU 157 Cb -0.19 -2.26 -0.04 0.00 0.50 0.00 0.00 46.19 44.20 1lbl s LEU 157 CO 0.57 -0.23 0.30 -0.63 -1.32 0.00 0.00 176.35 175.04 1lbl s ILE 158 N 1.91 5.24 -0.20 6.68 1.01 -0.47 -0.83 121.20 134.53 1lbl s ILE 158 Ca 0.10 0.45 -0.10 0.00 0.00 0.00 0.00 60.65 61.09 1lbl s ILE 158 Cb -0.16 -3.64 -0.05 0.00 0.01 0.00 0.00 42.46 38.62 1lbl s ILE 158 CO 0.11 0.22 0.15 -0.70 0.00 0.00 0.00 174.94 174.72 1lbl s GLU 159 N 1.72 4.19 0.24 2.79 2.12 -0.10 -0.63 118.70 129.03 1lbl s GLU 159 Ca 0.13 -0.19 0.12 0.00 0.36 0.00 0.00 54.97 55.39 1lbl s GLU 159 Cb -0.15 -3.43 -0.05 0.00 0.26 0.00 0.00 34.13 30.76 1lbl s GLU 159 CO 0.09 0.28 -0.20 0.96 -0.54 0.00 0.00 175.26 175.85 1lbl s ILE 160 N 0.41 2.50 0.00 -3.70 -4.36 -0.19 -2.41 121.20 113.44 1lbl s ILE 160 Ca 0.09 -2.21 0.00 0.00 -0.26 0.00 0.00 60.65 58.27 1lbl s ILE 160 Cb -0.11 -2.27 0.00 0.00 1.25 0.00 0.00 42.46 41.33 1lbl s ILE 160 CO -0.01 -0.27 0.00 -3.20 0.24 0.00 0.00 174.94 171.70 1lbl n ASN 161 N -0.25 0.21 -3.57 4.36 2.85 -1.26 -1.41 115.26 116.18 1lbl n ASN 161 Ca -0.08 -0.02 -0.14 0.00 -0.11 0.00 0.00 54.58 54.23 1lbl n ASN 161 Cb 0.58 0.09 -0.06 0.00 1.24 0.00 0.00 39.78 41.63 1lbl n ASN 161 CO 0.00 0.00 0.00 1.51 -2.11 0.00 0.00 177.26 176.66 1lbl s ASP 162 N -0.13 0.67 0.38 1.20 1.47 -1.26 -4.95 116.67 114.04 1lbl s ASP 162 Ca 0.00 -1.39 0.09 0.00 1.18 0.00 0.00 52.55 52.44 1lbl s ASP 162 Cb 0.00 0.59 0.75 0.00 -0.34 0.00 0.00 42.92 43.92 1lbl s ASP 162 CO 0.00 -1.16 1.89 -0.33 0.68 0.00 0.00 175.17 176.25 1lbl h GLU 163 N 2.23 0.22 -0.60 2.11 5.08 -1.99 -2.63 114.58 119.00 1lbl h GLU 163 Ca -0.29 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 57.94 1lbl h GLU 163 Cb 1.24 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.44 1lbl h GLU 163 CO 0.40 0.40 0.06 -0.97 -1.00 0.00 0.00 179.01 177.90 1lbl h ASN 164 N 0.21 0.98 -0.62 1.42 -1.24 -2.00 -1.18 115.58 113.16 1lbl h ASN 164 Ca 0.04 -0.28 -0.04 0.00 0.71 0.00 0.00 56.30 56.73 1lbl h ASN 164 Cb 0.43 -0.26 -0.03 0.00 0.73 0.00 0.00 38.32 39.19 1lbl h ASN 164 CO 0.03 1.02 0.22 0.44 -1.29 0.00 0.00 177.43 177.84 1lbl h ASP 165 N 0.92 0.88 -0.24 1.15 3.45 -1.92 -2.71 116.42 117.95 1lbl h ASP 165 Ca 0.18 -0.19 -0.10 0.00 0.43 0.00 0.00 57.03 57.35 1lbl h ASP 165 Cb 0.47 -0.23 -0.02 0.00 -0.56 0.00 0.00 39.33 39.00 1lbl h ASP 165 CO 0.02 0.83 -0.17 0.25 -1.57 0.00 0.00 179.24 178.60 1lbl h LEU 166 N 0.87 0.67 -0.04 1.55 5.85 -1.12 -0.30 115.31 122.79 1lbl h LEU 166 Ca 0.20 -0.21 0.01 0.00 0.84 0.00 0.00 57.88 58.73 1lbl h LEU 166 Cb 0.25 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 1lbl h LEU 166 CO -0.01 0.85 -0.04 0.44 -0.34 0.00 0.00 178.44 179.33 1lbl h ASP 167 N 0.60 -0.13 -0.00 1.25 3.45 -0.98 -1.53 116.42 119.08 1lbl h ASP 167 Ca 0.10 0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.58 1lbl h ASP 167 Cb 0.63 0.07 -0.00 0.00 -0.56 0.00 0.00 39.33 39.46 1lbl h ASP 167 CO 0.04 -0.06 0.00 0.40 -1.57 0.00 0.00 179.24 178.05 1lbl h ILE 168 N -0.06 1.02 -0.68 0.35 2.04 -1.29 -1.34 117.51 117.55 1lbl h ILE 168 Ca 0.03 -0.06 0.01 0.00 1.00 0.00 0.00 64.86 65.84 1lbl h ILE 168 Cb 0.10 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 1lbl h ILE 168 CO -0.08 0.02 0.45 0.00 0.00 0.00 0.00 178.15 178.54 1lbl h ALA 169 N 0.98 1.54 -0.25 1.87 0.00 -0.94 -2.17 119.26 120.27 1lbl h ALA 169 Ca 0.00 -0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.68 1lbl h ALA 169 Cb 0.03 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1lbl h ALA 169 CO -0.00 0.42 -0.59 -0.07 0.00 0.00 0.00 179.25 179.01 1lbl h LEU 170 N 0.90 0.96 -0.64 0.00 4.07 -1.04 -2.16 115.31 117.41 1lbl h LEU 170 Ca 0.26 -0.56 -0.01 0.00 0.08 0.00 0.00 57.88 57.65 1lbl h LEU 170 Cb -0.07 -0.28 -0.03 0.00 1.08 0.00 0.00 40.66 41.37 1lbl h LEU 170 CO -0.06 1.34 0.36 -0.09 -1.08 0.00 0.00 178.44 178.91 1lbl h ARG 171 N 0.62 0.89 -0.01 1.13 2.43 -0.64 -1.97 114.38 116.83 1lbl h ARG 171 Ca -0.00 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1lbl h ARG 171 Cb 1.20 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.58 1lbl h ARG 171 CO 0.13 0.66 0.00 0.44 -1.51 0.00 0.00 179.97 179.69 1lbl n ILE 172 N -4.55 0.01 -2.22 1.20 -5.35 -0.92 -4.92 119.36 102.62 1lbl n ILE 172 Ca 0.05 -0.01 -0.04 0.00 -0.27 0.00 0.00 62.75 62.48 1lbl n ILE 172 Cb 0.08 -0.18 0.00 0.00 -1.74 0.00 0.00 39.64 37.80 1lbl n ILE 172 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1lbl n GLY 173 N 0.71 0.34 3.77 3.28 0.00 -0.74 -5.02 105.19 107.54 1lbl n GLY 173 Ca 0.10 -0.69 -0.40 0.00 0.00 0.00 0.00 46.02 45.03 1lbl n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lbl s ALA 174 N -2.39 3.45 -0.09 4.61 0.00 -0.82 -4.94 121.76 121.59 1lbl s ALA 174 Ca 0.02 1.36 0.01 0.00 0.00 0.00 0.00 51.96 53.36 1lbl s ALA 174 Cb -0.01 -3.53 -0.00 0.00 0.00 0.00 0.00 23.12 19.58 1lbl s ALA 174 CO 0.03 -0.84 0.22 0.54 0.00 0.00 0.00 175.76 175.71 1lbl n ARG 175 N 0.48 3.94 -3.57 0.00 1.74 -1.26 -4.90 116.66 113.08 1lbl n ARG 175 Ca 0.01 -0.21 -0.29 0.00 -0.77 0.00 0.00 57.85 56.60 1lbl n ARG 175 Cb 0.41 -0.72 -0.15 0.00 -1.02 0.00 0.00 32.46 30.98 1lbl n ARG 175 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 1lbl s PHE 176 N -0.74 0.57 0.01 -1.55 5.36 -1.26 -1.78 117.98 118.60 1lbl s PHE 176 Ca 0.01 -1.04 0.05 0.00 -0.96 0.00 0.00 56.93 54.99 1lbl s PHE 176 Cb 0.01 -1.05 -0.03 0.00 -0.34 0.00 0.00 43.02 41.61 1lbl s PHE 176 CO 0.03 -0.84 -0.11 0.42 -1.46 0.00 0.00 175.22 173.27 1lbl s ILE 177 N 2.01 3.35 -0.15 3.12 1.01 -0.67 -1.37 121.20 128.50 1lbl s ILE 177 Ca 0.09 -0.91 -0.00 0.00 0.00 0.00 0.00 60.65 59.83 1lbl s ILE 177 Cb -0.16 -2.44 -0.01 0.00 0.01 0.00 0.00 42.46 39.86 1lbl s ILE 177 CO -0.35 0.38 -0.14 -0.83 0.00 0.00 0.00 174.94 174.00 1lbl s GLY 178 N -1.41 1.51 -0.30 6.18 0.00 0.19 -0.66 107.32 112.84 1lbl s GLY 178 Ca 0.16 -0.98 -0.11 0.00 0.00 0.00 0.00 44.72 43.80 1lbl s GLY 178 CO 0.07 -0.06 0.18 -0.42 0.00 0.00 0.00 173.10 172.86 1lbl s ILE 179 N 0.62 5.01 -0.24 0.90 1.09 0.62 -1.03 121.20 128.18 1lbl s ILE 179 Ca -0.08 -0.10 -0.09 0.00 -1.10 0.00 0.00 60.65 59.28 1lbl s ILE 179 Cb -0.16 -3.46 -0.04 0.00 -1.06 0.00 0.00 42.46 37.74 1lbl s ILE 179 CO 0.03 0.16 0.13 0.21 -0.10 0.00 0.00 174.94 175.37 1lbl s ASN 180 N 1.70 5.83 0.44 3.58 3.84 -0.50 -0.77 114.94 129.07 1lbl s ASN 180 Ca 0.06 0.03 0.24 0.00 0.21 0.00 0.00 52.86 53.41 1lbl s ASN 180 Cb -0.16 -2.05 0.60 0.00 -0.55 0.00 0.00 41.25 39.08 1lbl s ASN 180 CO 0.09 0.05 1.70 0.77 -2.79 0.00 0.00 177.10 176.91 1lbl h SER 181 N 7.61 0.00 -3.20 -4.21 4.64 -1.74 -3.42 113.55 113.23 1lbl h SER 181 Ca -0.37 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.35 1lbl h SER 181 Cb 1.17 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.18 1lbl h SER 181 CO 0.63 0.10 -0.26 -0.60 -0.87 0.00 0.00 176.83 175.84 1lbl s ARG 182 N -3.33 4.16 -0.35 4.77 3.52 -1.26 -1.29 118.95 125.17 1lbl s ARG 182 Ca 0.05 0.25 -0.26 0.00 -0.13 0.00 0.00 55.73 55.63 1lbl s ARG 182 Cb 0.07 -3.37 0.01 0.00 -1.56 0.00 0.00 34.95 30.10 1lbl s ARG 182 CO 0.65 0.35 0.95 0.34 -0.81 0.00 0.00 175.30 176.78 1lbl s ASP 183 N 0.08 6.73 0.38 -2.12 -1.08 -0.42 -4.95 116.67 115.28 1lbl s ASP 183 Ca 0.21 0.69 0.13 0.00 -0.52 0.00 0.00 52.55 53.06 1lbl s ASP 183 Cb -0.14 -2.48 0.95 0.00 -1.46 0.00 0.00 42.92 39.79 1lbl s ASP 183 CO 0.08 -0.84 1.84 -0.07 0.52 0.00 0.00 175.17 176.69 1lbl h LEU 184 N 10.03 0.55 -0.01 -1.34 3.38 -1.96 0.31 115.31 126.28 1lbl h LEU 184 Ca -0.23 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 1lbl h LEU 184 Cb 1.08 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 1lbl h LEU 184 CO 0.99 0.22 -0.01 -0.08 0.09 0.00 0.00 178.44 179.65 1lbl h GLU 185 N 0.55 0.02 -0.00 1.13 4.81 -1.98 -3.36 114.58 115.74 1lbl h GLU 185 Ca 0.50 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.71 1lbl h GLU 185 Cb 1.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.41 1lbl h GLU 185 CO -0.23 0.56 -0.92 0.25 -0.73 0.00 0.00 179.01 177.93 1lbl n THR 186 N -4.81 0.00 -0.93 0.32 -2.24 -1.19 -4.95 114.28 100.48 1lbl n THR 186 Ca -0.09 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1lbl n THR 186 Cb 0.28 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 1lbl n THR 186 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1lbl n LEU 187 N -1.30 0.42 -4.76 3.22 4.77 0.09 -5.00 117.00 114.45 1lbl n LEU 187 Ca 0.05 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.63 1lbl n LEU 187 Cb 0.34 -1.11 -0.05 0.00 -2.33 0.00 0.00 43.42 40.27 1lbl n LEU 187 CO 0.41 -0.35 0.70 -1.61 -1.33 0.00 0.00 177.39 175.21 1lbl s GLU 188 N -0.71 4.73 -0.13 3.23 2.02 -1.26 -4.74 118.70 121.85 1lbl s GLU 188 Ca 0.00 1.59 -0.05 0.00 0.02 0.00 0.00 54.97 56.53 1lbl s GLU 188 Cb 0.00 -3.18 -0.04 0.00 0.10 0.00 0.00 34.13 31.02 1lbl s GLU 188 CO 0.00 0.36 0.06 0.42 0.02 0.00 0.00 175.26 176.12 1lbl s ILE 189 N -1.23 4.81 -0.33 -1.63 1.01 -1.26 -1.31 121.20 121.26 1lbl s ILE 189 Ca 0.44 -0.04 -0.01 0.00 0.00 0.00 0.00 60.65 61.03 1lbl s ILE 189 Cb -0.27 -3.10 0.13 0.00 0.01 0.00 0.00 42.46 39.23 1lbl s ILE 189 CO 0.34 0.55 0.19 0.21 0.00 0.00 0.00 174.94 176.24 1lbl s ASN 190 N -0.43 3.07 0.40 3.58 3.84 -0.41 -5.00 114.94 119.99 1lbl s ASN 190 Ca 0.10 -1.94 0.07 0.00 0.21 0.00 0.00 52.86 51.30 1lbl s ASN 190 Cb -0.12 -0.36 0.84 0.00 -0.55 0.00 0.00 41.25 41.06 1lbl s ASN 190 CO 0.02 -0.34 2.04 0.11 -2.79 0.00 0.00 177.10 176.14 1lbl h LYS 191 N 7.38 0.53 0.40 0.43 1.79 -1.98 -2.78 116.57 122.35 1lbl h LYS 191 Ca -0.01 -0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.40 1lbl h LYS 191 Cb 0.98 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.52 1lbl h LYS 191 CO 0.31 0.37 -0.19 1.49 -1.08 0.00 0.00 179.45 180.35 1lbl h GLU 192 N 0.55 -0.52 -0.72 3.15 4.57 -1.98 -1.77 114.58 117.86 1lbl h GLU 192 Ca 0.14 0.04 0.09 0.00 -1.18 0.00 0.00 59.36 58.45 1lbl h GLU 192 Cb -0.02 0.12 -0.05 0.00 -0.16 0.00 0.00 28.75 28.64 1lbl h GLU 192 CO -0.03 -0.26 0.47 -0.97 -1.18 0.00 0.00 179.01 177.04 1lbl h ASN 193 N -0.69 0.56 -0.53 1.04 -0.00 -1.96 -0.70 115.58 113.30 1lbl h ASN 193 Ca -0.06 0.01 -0.10 0.00 -0.00 0.00 0.00 56.30 56.16 1lbl h ASN 193 Cb 0.49 -0.10 -0.02 0.00 -0.00 0.00 0.00 38.32 38.69 1lbl h ASN 193 CO 0.09 0.34 -0.06 -0.61 -0.00 0.00 0.00 177.43 177.18 1lbl h GLN 194 N 0.62 1.00 -0.53 6.67 4.15 -1.25 -2.74 115.11 123.03 1lbl h GLN 194 Ca 0.33 -0.34 -0.11 0.00 0.77 0.00 0.00 58.65 59.30 1lbl h GLN 194 Cb 0.47 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.06 1lbl h GLN 194 CO -0.11 1.01 -0.10 0.00 -1.93 0.00 0.00 178.83 177.70 1lbl h ARG 195 N 0.90 1.00 -0.06 1.69 3.08 -0.25 -1.94 114.38 118.80 1lbl h ARG 195 Ca 0.15 -0.37 0.02 0.00 0.07 0.00 0.00 59.98 59.85 1lbl h ARG 195 Cb 0.61 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.57 1lbl h ARG 195 CO 0.04 1.05 -0.05 -0.22 -1.07 0.00 0.00 179.97 179.72 1lbl h LYS 196 N 0.87 -0.06 -0.17 0.04 3.64 -1.27 -2.75 116.57 116.86 1lbl h LYS 196 Ca 0.14 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1lbl h LYS 196 Cb 0.67 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.49 1lbl h LYS 196 CO 0.05 -0.04 0.09 -0.07 -2.27 0.00 0.00 179.45 177.21 1lbl h LEU 197 N -0.07 0.15 -1.47 5.20 3.38 -1.44 -2.32 115.31 118.75 1lbl h LEU 197 Ca 0.04 0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.20 1lbl h LEU 197 Cb 0.13 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 40.79 1lbl h LEU 197 CO -0.10 0.11 0.58 0.40 0.09 0.00 0.00 178.44 179.52 1lbl h ILE 198 N 0.20 0.73 0.00 1.22 2.04 -1.23 0.23 117.51 120.70 1lbl h ILE 198 Ca 0.07 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1lbl h ILE 198 Cb 0.00 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 36.30 1lbl h ILE 198 CO -0.04 0.09 0.00 0.28 0.00 0.00 0.00 178.15 178.48 1lbl h SER 199 N 0.47 0.00 0.17 1.72 0.02 -1.12 -3.06 113.55 111.75 1lbl h SER 199 Ca 0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.40 1lbl h SER 199 Cb 1.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.56 1lbl h SER 199 CO -0.18 0.00 -0.28 0.23 -1.14 0.00 0.00 176.83 175.46 1lbl n MET 200 N -2.61 0.98 -3.01 3.45 2.81 0.06 -4.95 117.12 113.85 1lbl n MET 200 Ca 0.03 -0.64 -0.40 0.00 -1.81 0.00 0.00 57.70 54.89 1lbl n MET 200 Cb 0.37 -1.49 -0.05 0.00 -0.71 0.00 0.00 33.22 31.34 1lbl n MET 200 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1lbl s ILE 201 N -2.46 4.74 0.39 2.02 1.01 -1.16 -5.02 121.20 120.73 1lbl s ILE 201 Ca 0.24 1.58 -0.25 0.00 0.00 0.00 0.00 60.65 62.22 1lbl s ILE 201 Cb 0.19 -4.09 -0.11 0.00 0.01 0.00 0.00 42.46 38.46 1lbl s ILE 201 CO 0.51 0.38 0.98 -2.65 0.00 0.00 0.00 174.94 174.16 1lbl n PRO 202 N 2.73 1.31 0.05 2.79 -0.02 -1.26 -4.85 135.00 135.75 1lbl n PRO 202 Ca -0.03 0.47 0.10 0.00 -2.02 0.00 0.00 63.50 62.01 1lbl n PRO 202 Cb 0.50 -1.97 0.41 0.00 -0.02 0.00 0.00 33.50 32.43 1lbl n PRO 202 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1lbl n SER 203 N 0.71 0.28 -0.47 2.55 3.41 -1.26 -2.65 113.62 116.20 1lbl n SER 203 Ca 0.09 0.56 0.11 0.00 -0.26 0.00 0.00 58.87 59.38 1lbl n SER 203 Cb 0.38 -0.62 0.45 0.00 -0.26 0.00 0.00 64.21 64.15 1lbl n SER 203 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1lbl n ASN 204 N -1.80 1.41 -4.78 4.04 2.04 -1.26 -4.84 115.26 110.07 1lbl n ASN 204 Ca 0.04 -1.61 -0.36 0.00 -0.44 0.00 0.00 54.58 52.21 1lbl n ASN 204 Cb 0.23 -0.07 -0.08 0.00 -2.53 0.00 0.00 39.78 37.34 1lbl n ASN 204 CO 0.00 0.00 0.00 0.68 -0.44 0.00 0.00 177.26 177.50 1lbl s VAL 205 N -1.86 5.09 -0.06 3.53 -7.23 -1.09 -5.02 120.40 113.76 1lbl s VAL 205 Ca 0.34 0.06 -0.30 0.00 -1.81 0.00 0.00 61.98 60.26 1lbl s VAL 205 Cb 0.18 -3.22 -0.04 0.00 0.56 0.00 0.00 36.38 33.86 1lbl s VAL 205 CO 0.28 0.58 1.39 -0.69 -0.31 0.00 0.00 175.10 176.35 1lbl s VAL 206 N -0.70 3.90 -0.10 1.32 1.01 -0.74 -4.91 120.40 120.19 1lbl s VAL 206 Ca 0.12 1.20 -0.03 0.00 0.00 0.00 0.00 61.98 63.27 1lbl s VAL 206 Cb -0.12 -3.77 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 1lbl s VAL 206 CO 0.03 -0.05 0.03 -0.54 0.00 0.00 0.00 175.10 174.57 1lbl s LYS 207 N 2.98 3.16 -0.11 2.72 1.02 -1.26 -1.67 119.74 126.58 1lbl s LYS 207 Ca 0.62 -0.35 0.01 0.00 0.02 0.00 0.00 55.97 56.27 1lbl s LYS 207 Cb -0.28 -2.91 0.02 0.00 -0.52 0.00 0.00 37.83 34.14 1lbl s LYS 207 CO 0.23 0.68 -0.11 0.08 -0.92 0.00 0.00 175.35 175.31 1lbl s VAL 208 N -0.81 1.24 0.03 3.17 1.01 0.17 -1.90 120.40 123.31 1lbl s VAL 208 Ca 0.13 -0.46 -0.23 0.00 0.00 0.00 0.00 61.98 61.42 1lbl s VAL 208 Cb -0.12 -1.19 -0.05 0.00 0.00 0.00 0.00 36.38 35.02 1lbl s VAL 208 CO 0.03 0.40 0.70 0.00 0.00 0.00 0.00 175.10 176.23 1lbl s ALA 209 N 1.34 3.41 0.07 5.51 0.00 -0.50 -0.27 121.76 131.33 1lbl s ALA 209 Ca -0.01 0.19 0.07 0.00 0.00 0.00 0.00 51.96 52.22 1lbl s ALA 209 Cb -0.14 -2.90 -0.03 0.00 0.00 0.00 0.00 23.12 20.05 1lbl s ALA 209 CO -0.05 0.10 -0.20 -1.21 0.00 0.00 0.00 175.76 174.40 1lbl s GLU 210 N -0.10 1.21 0.09 0.00 2.02 0.05 -1.27 118.70 120.70 1lbl s GLU 210 Ca 0.36 -1.03 0.00 0.00 0.02 0.00 0.00 54.97 54.32 1lbl s GLU 210 Cb -0.20 -1.39 0.00 0.00 0.10 0.00 0.00 34.13 32.65 1lbl s GLU 210 CO 0.21 0.34 0.00 0.43 0.02 0.00 0.00 175.26 176.26 1lbl n SER 211 N 1.48 -1.84 -0.48 -0.19 7.64 -1.23 -2.20 113.62 116.80 1lbl n SER 211 Ca -0.18 0.25 -0.06 0.00 1.01 0.00 0.00 58.87 59.88 1lbl n SER 211 Cb 0.54 0.03 -0.03 0.00 -1.01 0.00 0.00 64.21 63.74 1lbl n SER 211 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1lbl n GLY 212 N -1.30 0.67 3.70 0.23 0.00 -1.26 -4.75 105.19 102.47 1lbl n GLY 212 Ca 0.00 -0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 1lbl n GLY 212 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1lbl s ILE 213 N -1.68 5.09 0.00 -0.61 1.01 -1.26 -4.89 121.20 118.85 1lbl s ILE 213 Ca 0.00 1.19 0.00 0.00 0.00 0.00 0.00 60.65 61.84 1lbl s ILE 213 Cb 0.00 -3.93 0.00 0.00 0.01 0.00 0.00 42.46 38.54 1lbl s ILE 213 CO 0.00 0.23 0.00 -1.54 0.00 0.00 0.00 174.94 173.63 1lbl n SER 214 N 4.20 1.10 -4.54 3.58 3.41 -1.26 -4.59 113.62 115.52 1lbl n SER 214 Ca -0.03 -0.01 -0.29 0.00 -0.26 0.00 0.00 58.87 58.28 1lbl n SER 214 Cb 0.51 0.23 -0.10 0.00 -0.26 0.00 0.00 64.21 64.58 1lbl n SER 214 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1lbl s GLU 215 N -0.45 1.96 0.42 4.33 0.41 -1.26 -5.04 118.70 119.06 1lbl s GLU 215 Ca 0.00 -1.11 0.18 0.00 -0.41 0.00 0.00 54.97 53.63 1lbl s GLU 215 Cb 0.00 -2.21 0.91 0.00 -1.78 0.00 0.00 34.13 31.06 1lbl s GLU 215 CO 0.00 0.49 1.87 -0.09 -0.49 0.00 0.00 175.26 177.04 1lbl h ARG 216 N 3.63 0.00 -0.44 1.61 2.43 -1.95 -2.69 114.38 116.97 1lbl h ARG 216 Ca -0.49 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 58.62 1lbl h ARG 216 Cb 1.17 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.70 1lbl h ARG 216 CO 0.49 0.30 0.02 -2.95 -1.51 0.00 0.00 179.97 176.32 1lbl h ASN 217 N 0.00 0.66 -0.54 -3.80 7.08 -1.98 -1.58 115.58 115.43 1lbl h ASN 217 Ca -0.00 -0.14 0.00 0.00 -3.08 0.00 0.00 56.30 53.08 1lbl h ASN 217 Cb 0.63 -0.18 -0.03 0.00 -2.08 0.00 0.00 38.32 36.67 1lbl h ASN 217 CO 0.04 0.73 0.34 -0.33 -2.08 0.00 0.00 177.43 176.13 1lbl h GLU 218 N 0.66 0.73 -0.20 4.14 4.39 -1.91 -0.95 114.58 121.44 1lbl h GLU 218 Ca 0.14 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 1lbl h GLU 218 Cb 0.39 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1lbl h GLU 218 CO 0.01 0.50 0.07 0.82 -1.16 0.00 0.00 179.01 179.26 1lbl h ILE 219 N 0.73 1.17 -0.37 3.13 2.04 -1.47 -1.61 117.51 121.13 1lbl h ILE 219 Ca 0.20 -0.54 0.06 0.00 1.00 0.00 0.00 64.86 65.58 1lbl h ILE 219 Cb -0.05 1.16 -0.06 0.00 -0.74 0.00 0.00 36.82 37.13 1lbl h ILE 219 CO -0.04 0.17 0.03 -0.33 0.00 0.00 0.00 178.15 177.98 1lbl h GLU 220 N 0.16 0.13 -0.09 2.37 3.07 -0.90 -0.40 114.58 118.93 1lbl h GLU 220 Ca 0.06 -0.01 0.01 0.00 -0.50 0.00 0.00 59.36 58.92 1lbl h GLU 220 Cb 0.20 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.07 1lbl h GLU 220 CO -0.00 0.09 0.04 0.93 -1.40 0.00 0.00 179.01 178.66 1lbl h GLU 221 N 0.14 0.08 -0.89 2.33 5.08 -1.04 -2.79 114.58 117.49 1lbl h GLU 221 Ca 0.18 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.55 1lbl h GLU 221 Cb 0.24 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 1lbl h GLU 221 CO -0.28 0.06 0.59 -0.07 -1.00 0.00 0.00 179.01 178.31 1lbl h LEU 222 N 0.09 1.02 -0.56 1.33 4.07 -0.91 -3.06 115.31 117.29 1lbl h LEU 222 Ca 0.03 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.97 1lbl h LEU 222 Cb 0.01 -0.25 -0.03 0.00 1.08 0.00 0.00 40.66 41.47 1lbl h LEU 222 CO -0.03 0.74 0.37 -0.09 -1.08 0.00 0.00 178.44 178.35 1lbl h ARG 223 N 1.21 0.75 0.00 1.13 9.65 -0.81 -1.75 114.38 124.55 1lbl h ARG 223 Ca 0.33 -0.05 -0.00 0.00 -1.10 0.00 0.00 59.98 59.15 1lbl h ARG 223 Cb -0.14 -0.17 -0.00 0.00 -1.39 0.00 0.00 29.97 28.28 1lbl h ARG 223 CO -0.07 0.50 -0.01 1.57 2.80 0.00 0.00 179.97 184.76 1lbl h LYS 224 N 0.76 0.00 0.00 0.20 5.09 -1.43 -0.95 116.57 120.25 1lbl h LYS 224 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.95 1lbl h LYS 224 Cb -0.07 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.26 1lbl h LYS 224 CO -0.04 0.01 0.00 -0.11 -2.09 0.00 0.00 179.45 177.22 1lbl n LEU 225 N -3.12 0.00 0.00 7.07 7.94 -0.67 -4.88 117.00 123.34 1lbl n LEU 225 Ca -0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1lbl n LEU 225 Cb 0.27 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.22 1lbl n LEU 225 CO 0.26 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.15 1lbl n GLY 226 N 0.76 0.77 3.74 -3.96 0.00 -0.36 -4.82 105.19 101.32 1lbl n GLY 226 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1lbl n GLY 226 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lbl s VAL 227 N -2.24 3.59 -0.05 1.61 1.01 -1.14 -4.82 120.40 118.36 1lbl s VAL 227 Ca 0.00 1.37 -0.04 0.00 0.00 0.00 0.00 61.98 63.31 1lbl s VAL 227 Cb 0.00 -3.87 -0.27 0.00 0.00 0.00 0.00 36.38 32.23 1lbl s VAL 227 CO 0.00 0.23 0.64 0.78 0.00 0.00 0.00 175.10 176.75 1lbl h ASN 228 N 5.10 0.40 -5.30 3.32 4.21 -1.74 -3.42 115.58 118.15 1lbl h ASN 228 Ca -0.45 -0.69 -0.12 0.00 1.21 0.00 0.00 56.30 56.25 1lbl h ASN 228 Cb 1.21 -0.13 -0.13 0.00 -1.12 0.00 0.00 38.32 38.15 1lbl h ASN 228 CO 0.74 1.60 -0.41 0.00 -1.29 0.00 0.00 177.43 178.06 1lbl s ALA 229 N -2.59 0.23 -0.05 -0.83 0.00 -0.82 -4.37 121.76 113.33 1lbl s ALA 229 Ca -0.14 -1.03 0.03 0.00 0.00 0.00 0.00 51.96 50.81 1lbl s ALA 229 Cb 0.07 0.85 0.01 0.00 0.00 0.00 0.00 23.12 24.04 1lbl s ALA 229 CO 0.82 -0.60 -0.13 -0.06 0.00 0.00 0.00 175.76 175.80 1lbl s PHE 230 N -3.99 1.41 -0.30 0.00 0.08 -0.70 -1.40 117.98 113.07 1lbl s PHE 230 Ca 0.19 -0.45 -0.09 0.00 0.12 0.00 0.00 56.93 56.69 1lbl s PHE 230 Cb 0.04 -1.00 -0.01 0.00 -0.57 0.00 0.00 43.02 41.48 1lbl s PHE 230 CO 0.00 -0.20 0.15 -1.17 -0.10 0.00 0.00 175.22 173.89 1lbl s LEU 231 N 0.38 4.04 -0.13 -0.37 0.20 -0.40 -0.29 118.68 122.12 1lbl s LEU 231 Ca -0.09 -0.47 0.01 0.00 0.69 0.00 0.00 54.13 54.27 1lbl s LEU 231 Cb -0.13 -2.00 0.02 0.00 -0.43 0.00 0.00 46.19 43.65 1lbl s LEU 231 CO 0.03 -0.17 -0.15 -0.63 -0.29 0.00 0.00 176.35 175.13 1lbl s ILE 232 N 1.62 1.55 0.00 6.68 1.01 -0.79 -3.50 121.20 127.77 1lbl s ILE 232 Ca 0.05 -0.65 0.00 0.00 0.00 0.00 0.00 60.65 60.05 1lbl s ILE 232 Cb -0.17 -1.43 0.00 0.00 0.01 0.00 0.00 42.46 40.87 1lbl s ILE 232 CO 0.06 0.45 0.00 0.61 0.00 0.00 0.00 174.94 176.06 1lbl n GLY 233 N 4.44 -0.03 0.30 6.18 0.00 -1.26 -1.17 105.19 113.65 1lbl n GLY 233 Ca -0.18 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.81 1lbl n GLY 233 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1lbl h SER 234 N 0.00 -0.92 -0.86 1.61 0.02 -1.92 -1.24 113.55 110.24 1lbl h SER 234 Ca 0.00 0.21 -0.02 0.00 -0.84 0.00 0.00 61.79 61.14 1lbl h SER 234 Cb 0.00 0.50 -0.04 0.00 0.14 0.00 0.00 62.40 63.00 1lbl h SER 234 CO 0.00 -0.27 0.46 0.77 -1.14 0.00 0.00 176.83 176.65 1lbl h SER 235 N -0.11 1.09 0.43 3.07 4.64 -1.92 -1.13 113.55 119.62 1lbl h SER 235 Ca 0.26 -0.10 -0.14 0.00 -0.47 0.00 0.00 61.79 61.34 1lbl h SER 235 Cb 0.52 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.32 1lbl h SER 235 CO -0.67 0.88 -0.62 -0.07 -0.87 0.00 0.00 176.83 175.49 1lbl h LEU 236 N 1.22 0.21 -0.24 5.97 3.38 -1.66 -1.30 115.31 122.89 1lbl h LEU 236 Ca 0.30 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 58.04 1lbl h LEU 236 Cb 0.05 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 1lbl h LEU 236 CO -0.05 0.78 -0.26 0.24 0.09 0.00 0.00 178.44 179.24 1lbl h MET 237 N 0.13 0.60 -0.45 1.13 2.86 -0.84 -1.48 114.93 116.90 1lbl h MET 237 Ca -0.01 -0.33 -0.11 0.00 -2.06 0.00 0.00 59.70 57.20 1lbl h MET 237 Cb 1.12 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.78 1lbl h MET 237 CO 0.09 0.93 -0.15 0.00 1.06 0.00 0.00 176.91 178.84 1lbl h ARG 238 N 0.31 0.84 -2.28 1.72 3.08 -1.20 -3.40 114.38 113.44 1lbl h ARG 238 Ca 0.04 -0.30 -0.50 0.00 0.07 0.00 0.00 59.98 59.28 1lbl h ARG 238 Cb 0.83 -0.06 -0.35 0.00 0.08 0.00 0.00 29.97 30.47 1lbl h ARG 238 CO 0.06 0.93 -0.81 1.21 -1.07 0.00 0.00 179.97 180.29 1lbl s ASN 239 N -6.70 1.92 0.49 7.04 3.84 -0.50 -5.01 114.94 116.02 1lbl s ASN 239 Ca -0.10 -2.17 0.28 0.00 0.21 0.00 0.00 52.86 51.09 1lbl s ASN 239 Cb 0.13 -0.02 1.36 0.00 -0.55 0.00 0.00 41.25 42.17 1lbl s ASN 239 CO 0.84 -0.26 1.82 -0.65 -2.79 0.00 0.00 177.10 176.06 1lbl h PRO 240 N 6.67 0.15 -0.26 0.43 0.11 -1.49 -2.22 132.00 135.39 1lbl h PRO 240 Ca 0.10 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 66.24 1lbl h PRO 240 Cb 0.99 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 1lbl h PRO 240 CO 0.25 0.10 0.18 1.49 -0.21 0.00 0.00 178.00 179.81 1lbl h GLU 241 N 0.16 0.16 -0.18 1.05 4.57 -1.94 -2.63 114.58 115.78 1lbl h GLU 241 Ca 0.53 -0.01 0.05 0.00 -1.18 0.00 0.00 59.36 58.76 1lbl h GLU 241 Cb 1.80 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 30.35 1lbl h GLU 241 CO -0.11 0.11 0.34 0.87 -1.18 0.00 0.00 179.01 179.04 1lbl h LYS 242 N 0.17 0.00 -0.71 1.92 1.79 -1.74 -1.45 116.57 116.54 1lbl h LYS 242 Ca 0.11 0.00 0.16 0.00 -2.18 0.00 0.00 60.65 58.75 1lbl h LYS 242 Cb 0.24 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.85 1lbl h LYS 242 CO -0.02 0.00 0.49 0.97 -1.08 0.00 0.00 179.45 179.81 1lbl h ILE 243 N 0.00 0.75 -0.19 1.86 6.09 -1.70 0.16 117.51 124.48 1lbl h ILE 243 Ca 0.09 -0.09 -0.11 0.00 -1.37 0.00 0.00 64.86 63.37 1lbl h ILE 243 Cb 0.77 0.46 -0.01 0.00 0.47 0.00 0.00 36.82 38.51 1lbl h ILE 243 CO -0.00 0.05 -0.36 0.11 -3.07 0.00 0.00 178.15 174.87 1lbl h LYS 244 N 0.26 0.40 0.02 2.19 1.57 -1.52 -2.11 116.57 117.39 1lbl h LYS 244 Ca 0.35 -0.18 -0.18 0.00 -1.87 0.00 0.00 60.65 58.76 1lbl h LYS 244 Cb 0.99 -0.01 0.02 0.00 0.08 0.00 0.00 32.23 33.31 1lbl h LYS 244 CO -0.08 0.71 -0.73 0.93 -0.57 0.00 0.00 179.45 179.71 1lbl h GLU 245 N 0.34 0.45 -0.27 3.15 5.08 -0.91 -3.24 114.58 119.18 1lbl h GLU 245 Ca 0.04 -0.52 -0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1lbl h GLU 245 Cb 0.80 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.19 1lbl h GLU 245 CO 0.06 1.17 0.17 0.74 -1.00 0.00 0.00 179.01 180.15 1lbl h PHE 246 N -0.04 0.35 0.00 4.33 0.04 -1.10 -2.94 116.94 117.57 1lbl h PHE 246 Ca -0.10 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.67 1lbl h PHE 246 Cb 1.45 -0.12 -0.00 0.00 2.20 0.00 0.00 35.95 39.48 1lbl h PHE 246 CO 0.14 0.23 -0.03 0.82 -0.60 0.00 0.00 178.31 178.88 1lbl h ILE 247 N 0.37 0.05 0.00 -0.55 5.03 -1.44 -3.48 117.51 117.49 1lbl h ILE 247 Ca 0.10 -1.01 0.00 0.00 -0.12 0.00 0.00 64.86 63.82 1lbl h ILE 247 Cb -0.02 1.97 0.00 0.00 -3.03 0.00 0.00 36.82 35.74 1lbl h ILE 247 CO -0.02 0.03 0.00 0.00 -0.68 0.00 0.00 178.15 177.48