#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n99 s HIS 0 N 0.00 2.11 0.51 1.61 4.02 -1.26 -5.01 115.29 117.27 3n99 s HIS 0 Ca 0.00 -0.55 -0.21 0.00 1.02 0.00 0.00 55.06 55.32 3n99 s HIS 0 Cb 0.00 -1.11 -0.06 0.00 -1.02 0.00 0.00 32.58 30.39 3n99 s HIS 0 CO 0.00 0.47 1.20 -1.64 1.02 0.00 0.00 174.74 175.79 3n99 s MET 1 N -3.64 3.43 0.04 1.40 -1.94 -1.26 -4.97 119.30 112.37 3n99 s MET 1 Ca 0.29 1.84 -0.31 0.00 -1.71 0.00 0.00 55.69 55.81 3n99 s MET 1 Cb 0.01 -2.22 -0.06 0.00 2.01 0.00 0.00 34.83 34.56 3n99 s MET 1 CO 0.13 -0.84 1.40 1.03 -0.01 0.00 0.00 175.02 176.73 3n99 s ARG 2 N -2.95 4.30 0.18 2.03 0.52 -1.26 -5.01 118.95 116.77 3n99 s ARG 2 Ca 0.69 2.00 0.02 0.00 -0.52 0.00 0.00 55.73 57.93 3n99 s ARG 2 Cb -0.30 -3.46 -0.05 0.00 0.52 0.00 0.00 34.95 31.66 3n99 s ARG 2 CO 0.35 -0.52 -0.00 0.95 0.02 0.00 0.00 175.30 176.10 3n99 s THR 3 N 1.92 0.77 -0.29 0.02 -4.23 -1.26 -1.11 115.64 111.46 3n99 s THR 3 Ca 0.64 -1.99 0.01 0.00 -1.18 0.00 0.00 61.69 59.17 3n99 s THR 3 Cb -0.33 -2.15 0.13 0.00 1.34 0.00 0.00 72.50 71.49 3n99 s THR 3 CO 0.28 -0.46 1.06 -0.46 -0.54 0.00 0.00 174.62 174.50 3n99 n ASN 4 N -0.27 2.81 0.24 3.99 6.94 -1.13 -4.67 115.26 123.17 3n99 n ASN 4 Ca -0.06 -2.27 0.13 0.00 -0.02 0.00 0.00 54.58 52.35 3n99 n ASN 4 Cb 0.63 -0.56 0.75 0.00 -2.36 0.00 0.00 39.78 38.25 3n99 n ASN 4 CO 0.00 0.00 0.00 0.07 -1.03 0.00 0.00 177.26 176.30 3n99 h LYS 5 N 0.34 0.00 0.00 -3.83 2.10 -1.96 -0.63 116.57 112.59 3n99 h LYS 5 Ca 0.09 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.74 3n99 h LYS 5 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 3n99 h LYS 5 CO 0.18 0.00 0.00 -0.44 -2.00 0.00 0.00 179.45 177.19 3n99 h ASP 6 N 0.00 0.00 -0.05 7.07 3.32 -2.02 -2.38 116.42 122.36 3n99 h ASP 6 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 3n99 h ASP 6 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 3n99 h ASP 6 CO -0.00 0.00 0.00 0.54 -1.72 0.00 0.00 179.24 178.06 3n99 n ARG 7 N -2.82 1.97 -2.72 3.56 1.74 -0.25 -4.95 116.66 113.20 3n99 n ARG 7 Ca 0.01 -1.41 -0.38 0.00 -0.77 0.00 0.00 57.85 55.30 3n99 n ARG 7 Cb 0.29 -1.47 -0.06 0.00 -1.02 0.00 0.00 32.46 30.20 3n99 n ARG 7 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3n99 s LEU 8 N -1.95 4.40 -0.12 0.55 1.43 -0.90 -5.02 118.68 117.07 3n99 s LEU 8 Ca 0.34 1.92 -0.23 0.00 -1.03 0.00 0.00 54.13 55.13 3n99 s LEU 8 Cb 0.20 -3.92 -0.03 0.00 0.03 0.00 0.00 46.19 42.48 3n99 s LEU 8 CO 0.32 -0.08 0.69 -0.69 0.23 0.00 0.00 176.35 176.81 3n99 s VAL 9 N -1.49 5.03 -0.21 -1.59 1.01 -1.26 -5.05 120.40 116.83 3n99 s VAL 9 Ca 0.49 1.38 -0.07 0.00 0.00 0.00 0.00 61.98 63.78 3n99 s VAL 9 Cb -0.22 -4.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.11 3n99 s VAL 9 CO 0.27 0.19 0.06 -0.60 0.00 0.00 0.00 175.10 175.02 3n99 s ARG 10 N 1.24 3.79 -0.02 2.72 3.52 -1.26 -4.65 118.95 124.30 3n99 s ARG 10 Ca 0.35 -0.42 -0.09 0.00 -0.13 0.00 0.00 55.73 55.43 3n99 s ARG 10 Cb -0.17 -3.24 0.01 0.00 -1.56 0.00 0.00 34.95 29.99 3n99 s ARG 10 CO 0.15 0.05 0.19 -1.50 -0.81 0.00 0.00 175.30 173.38 3n99 s ILE 11 N 0.97 0.06 -0.11 4.11 2.07 -0.84 -4.97 121.20 122.49 3n99 s ILE 11 Ca 0.04 -0.51 -0.30 0.00 -1.41 0.00 0.00 60.65 58.47 3n99 s ILE 11 Cb -0.14 -0.45 -0.03 0.00 0.13 0.00 0.00 42.46 41.97 3n99 s ILE 11 CO 0.03 -0.28 1.30 -0.94 -1.91 0.00 0.00 174.94 173.13 3n99 s SER 12 N -1.10 6.94 -0.21 4.50 1.04 -1.26 -0.69 113.70 122.91 3n99 s SER 12 Ca -0.12 1.81 -0.01 0.00 0.48 0.00 0.00 55.95 58.11 3n99 s SER 12 Cb -0.06 -2.54 0.01 0.00 0.10 0.00 0.00 66.02 63.53 3n99 s SER 12 CO 0.02 -0.73 -0.11 -0.69 0.98 0.00 0.00 173.24 172.71 3n99 s VAL 13 N 3.15 2.69 0.14 5.02 1.01 -0.39 -4.93 120.40 127.09 3n99 s VAL 13 Ca 0.57 -0.84 0.05 0.00 0.00 0.00 0.00 61.98 61.76 3n99 s VAL 13 Cb -0.24 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 3n99 s VAL 13 CO 0.19 0.40 0.10 0.68 0.00 0.00 0.00 175.10 176.46 3n99 s VAL 14 N 1.35 4.38 0.00 2.92 -7.23 -1.26 0.27 120.40 120.84 3n99 s VAL 14 Ca 0.04 -1.02 0.00 0.00 -1.81 0.00 0.00 61.98 59.18 3n99 s VAL 14 Cb -0.15 -3.19 0.00 0.00 0.56 0.00 0.00 36.38 33.61 3n99 s VAL 14 CO -0.07 -0.03 0.00 0.61 -0.31 0.00 0.00 175.10 175.30 3n99 n GLY 15 N -0.04 3.19 3.15 2.32 0.00 -0.17 -4.66 105.19 108.97 3n99 n GLY 15 Ca -0.09 -0.90 -0.09 0.00 0.00 0.00 0.00 46.02 44.94 3n99 n GLY 15 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3n99 s GLU 16 N 0.54 0.67 0.05 1.61 -1.05 0.14 -0.62 118.70 120.04 3n99 s GLU 16 Ca 0.00 -0.83 -0.30 0.00 -0.15 0.00 0.00 54.97 53.68 3n99 s GLU 16 Cb 0.00 0.26 -0.08 0.00 -0.44 0.00 0.00 34.13 33.87 3n99 s GLU 16 CO 0.00 -0.18 1.72 0.42 0.95 0.00 0.00 175.26 178.17 3n99 s ILE 17 N -3.04 3.06 0.32 1.83 1.01 -0.18 -1.07 121.20 123.14 3n99 s ILE 17 Ca -0.01 0.40 -0.24 0.00 0.00 0.00 0.00 60.65 60.81 3n99 s ILE 17 Cb 0.01 -3.26 -0.10 0.00 0.01 0.00 0.00 42.46 39.13 3n99 s ILE 17 CO -0.07 -0.01 0.89 0.00 0.00 0.00 0.00 174.94 175.75 3n99 s ALA 18 N 3.14 3.23 0.94 9.38 0.00 -0.34 -0.50 121.76 137.62 3n99 s ALA 18 Ca 0.77 0.41 -0.11 0.00 0.00 0.00 0.00 51.96 53.02 3n99 s ALA 18 Cb -0.40 -3.09 0.15 0.00 0.00 0.00 0.00 23.12 19.79 3n99 s ALA 18 CO 0.34 0.21 1.09 -1.25 0.00 0.00 0.00 175.76 176.14 3n99 s PRO 19 N -2.24 0.90 0.26 0.00 0.04 -1.26 -1.56 135.00 131.14 3n99 s PRO 19 Ca 0.51 0.96 -0.30 0.00 0.04 0.00 0.00 61.00 62.21 3n99 s PRO 19 Cb -0.16 -1.76 -0.10 0.00 0.04 0.00 0.00 34.50 32.52 3n99 s PRO 19 CO 0.21 -2.53 1.42 0.00 0.04 0.00 0.00 177.00 176.14 3n99 s ALA 20 N -2.81 3.60 0.01 8.56 0.00 -1.26 -2.04 121.76 127.83 3n99 s ALA 20 Ca 0.65 1.32 0.08 0.00 0.00 0.00 0.00 51.96 54.00 3n99 s ALA 20 Cb -0.20 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.35 3n99 s ALA 20 CO 0.58 -0.73 -0.24 0.15 0.00 0.00 0.00 175.76 175.52 3n99 s LYS 21 N -0.62 1.78 -0.21 0.00 1.02 -0.73 -4.88 119.74 116.11 3n99 s LYS 21 Ca 0.58 -0.94 -0.11 0.00 0.02 0.00 0.00 55.97 55.52 3n99 s LYS 21 Cb -0.41 -1.82 0.07 0.00 -0.52 0.00 0.00 37.83 35.15 3n99 s LYS 21 CO 0.45 0.48 0.50 -1.64 -0.92 0.00 0.00 175.35 174.22 3n99 s MET 22 N -0.88 0.47 0.00 1.68 -1.94 -1.26 -3.87 119.30 113.50 3n99 s MET 22 Ca 0.10 0.98 0.26 0.00 -1.71 0.00 0.00 55.69 55.31 3n99 s MET 22 Cb -0.09 0.13 0.62 0.00 2.01 0.00 0.00 34.83 37.49 3n99 s MET 22 CO 0.00 -0.17 1.48 0.54 -0.01 0.00 0.00 175.02 176.86 3n99 n ARG 23 N 4.52 0.54 -3.49 2.03 1.74 -1.26 -4.89 116.66 115.85 3n99 n ARG 23 Ca -0.20 -0.33 -0.16 0.00 -0.77 0.00 0.00 57.85 56.40 3n99 n ARG 23 Cb 0.55 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.45 3n99 n ARG 23 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3n99 s SER 24 N -2.69 -0.62 0.53 0.55 0.15 -1.26 -5.03 113.70 105.34 3n99 s SER 24 Ca 0.19 0.44 0.31 0.00 0.70 0.00 0.00 55.95 57.58 3n99 s SER 24 Cb 0.18 0.56 1.38 0.00 -1.71 0.00 0.00 66.02 66.43 3n99 s SER 24 CO 0.59 -0.74 2.00 1.55 1.20 0.00 0.00 173.24 177.84 3n99 h PRO 25 N 2.64 0.00 -5.69 5.44 0.13 -1.96 -3.44 132.00 129.12 3n99 h PRO 25 Ca -0.30 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.17 3n99 h PRO 25 Cb 1.20 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.27 3n99 h PRO 25 CO 0.39 0.09 -0.48 0.71 -0.23 0.00 0.00 178.00 178.48 3n99 s TYR 26 N -3.84 3.59 -0.11 1.56 2.02 -1.26 -4.24 117.35 115.07 3n99 s TYR 26 Ca -0.01 0.48 -0.03 0.00 -0.37 0.00 0.00 57.07 57.15 3n99 s TYR 26 Cb 0.11 -1.91 -0.03 0.00 -0.40 0.00 0.00 41.96 39.72 3n99 s TYR 26 CO 0.56 0.71 0.00 -1.12 -1.57 0.00 0.00 175.55 174.14 3n99 s SER 27 N -1.29 5.23 -0.26 2.29 0.01 0.50 -4.94 113.70 115.25 3n99 s SER 27 Ca 0.18 0.09 -0.12 0.00 1.31 0.00 0.00 55.95 57.41 3n99 s SER 27 Cb -0.12 -1.61 -0.05 0.00 0.21 0.00 0.00 66.02 64.45 3n99 s SER 27 CO 0.08 0.31 0.25 -0.69 0.41 0.00 0.00 173.24 173.60 3n99 s VAL 28 N -0.47 5.28 0.70 3.43 1.01 -1.26 -1.30 120.40 127.78 3n99 s VAL 28 Ca 0.08 0.34 -0.10 0.00 0.00 0.00 0.00 61.98 62.30 3n99 s VAL 28 Cb -0.12 -3.59 0.03 0.00 0.00 0.00 0.00 36.38 32.70 3n99 s VAL 28 CO 0.02 0.26 1.06 0.42 0.00 0.00 0.00 175.10 176.86 3n99 s THR 29 N 1.58 3.19 0.45 3.92 -4.23 0.50 -3.46 115.64 117.58 3n99 s THR 29 Ca 0.11 0.24 0.35 0.00 -1.18 0.00 0.00 61.69 61.21 3n99 s THR 29 Cb -0.15 -3.36 0.37 0.00 1.34 0.00 0.00 72.50 70.70 3n99 s THR 29 CO 0.08 -0.45 2.17 0.71 -0.54 0.00 0.00 174.62 176.60 3n99 h THR 30 N -0.61 0.27 -0.00 3.99 1.35 -1.68 -0.73 112.91 115.49 3n99 h THR 30 Ca -0.45 -0.31 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 3n99 h THR 30 Cb 1.27 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.92 3n99 h THR 30 CO 0.63 0.04 -0.00 -0.62 -0.25 0.00 0.00 175.52 175.32 3n99 n GLU 31 N -3.37 1.19 -1.98 4.72 4.71 -1.26 -4.92 120.64 119.73 3n99 n GLU 31 Ca -0.02 -0.30 -0.05 0.00 -0.01 0.00 0.00 57.16 56.78 3n99 n GLU 31 Cb 0.18 -1.49 -0.01 0.00 -1.01 0.00 0.00 31.44 29.11 3n99 n GLU 31 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3n99 n GLY 32 N 1.06 0.24 3.75 0.62 0.00 -0.28 -5.05 105.19 105.52 3n99 n GLY 32 Ca 0.22 -0.69 -0.24 0.00 0.00 0.00 0.00 46.02 45.32 3n99 n GLY 32 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3n99 s THR 33 N -2.25 2.62 0.01 2.61 -4.23 -1.26 -4.90 115.64 108.24 3n99 s THR 33 Ca 0.00 -1.67 0.07 0.00 -1.18 0.00 0.00 61.69 58.91 3n99 s THR 33 Cb 0.00 -2.98 -0.03 0.00 1.34 0.00 0.00 72.50 70.83 3n99 s THR 33 CO 0.00 -0.08 -0.21 0.68 -0.54 0.00 0.00 174.62 174.48 3n99 s VAL 34 N -2.52 2.57 0.02 2.29 -7.23 -1.26 -0.37 120.40 113.90 3n99 s VAL 34 Ca 0.40 -1.13 0.05 0.00 -1.81 0.00 0.00 61.98 59.49 3n99 s VAL 34 Cb 0.01 -2.02 -0.02 0.00 0.56 0.00 0.00 36.38 34.91 3n99 s VAL 34 CO 0.23 0.44 -0.14 -0.13 -0.31 0.00 0.00 175.10 175.19 3n99 s ARG 35 N -1.11 1.01 -0.51 4.82 0.52 -0.42 -4.95 118.95 118.31 3n99 s ARG 35 Ca 0.13 -0.65 -0.17 0.00 -0.52 0.00 0.00 55.73 54.52 3n99 s ARG 35 Cb -0.10 -1.00 0.09 0.00 0.52 0.00 0.00 34.95 34.45 3n99 s ARG 35 CO 0.03 0.26 0.49 0.08 0.02 0.00 0.00 175.30 176.17 3n99 s VAL 36 N -0.63 5.13 0.04 3.52 1.01 -1.26 -0.37 120.40 127.83 3n99 s VAL 36 Ca 0.03 -1.07 -0.05 0.00 0.00 0.00 0.00 61.98 60.89 3n99 s VAL 36 Cb -0.07 -4.24 -0.01 0.00 0.00 0.00 0.00 36.38 32.06 3n99 s VAL 36 CO 0.01 -0.74 0.09 0.27 0.00 0.00 0.00 175.10 174.73 3n99 s ILE 37 N 1.90 0.14 0.77 2.22 -4.36 -1.26 -5.05 121.20 115.55 3n99 s ILE 37 Ca 0.06 -1.13 -0.14 0.00 -0.26 0.00 0.00 60.65 59.18 3n99 s ILE 37 Cb -0.25 -0.94 0.05 0.00 1.25 0.00 0.00 42.46 42.57 3n99 s ILE 37 CO 0.07 -0.62 1.15 -2.65 0.24 0.00 0.00 174.94 173.12 3n99 n PRO 38 N 0.70 0.37 0.00 0.37 -0.02 -1.26 -4.78 135.00 130.38 3n99 n PRO 38 Ca -0.19 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 3n99 n PRO 38 Cb 0.59 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 3n99 n PRO 38 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3n99 n VAL 39 N -2.94 0.00 -3.00 -1.45 0.31 -1.26 -1.43 118.33 108.56 3n99 n VAL 39 Ca 0.14 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.29 3n99 n VAL 39 Cb 0.50 0.00 0.06 0.00 -0.91 0.00 0.00 33.84 33.49 3n99 n VAL 39 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3n99 n LEU 40 N 0.00 0.00 0.00 7.52 -0.00 -1.25 -4.32 117.00 118.95 3n99 n LEU 40 Ca 0.00 -2.19 0.00 0.00 -0.00 0.00 0.00 56.01 53.82 3n99 n LEU 40 Cb 0.00 -0.39 0.00 0.00 -0.00 0.00 0.00 43.42 43.03 3n99 n LEU 40 CO 0.00 -0.70 0.00 0.61 -0.00 0.00 0.00 177.39 177.30 3n99 n GLY 41 N -1.28 -2.86 1.71 1.47 0.00 -1.26 -1.77 105.19 101.20 3n99 n GLY 41 Ca 0.15 -1.75 0.03 0.00 0.00 0.00 0.00 46.02 44.45 3n99 n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n99 n GLY 42 N -0.47 -2.13 3.58 -0.02 0.00 -0.60 -4.59 105.19 100.96 3n99 n GLY 42 Ca 0.00 -1.44 -0.41 0.00 0.00 0.00 0.00 46.02 44.17 3n99 n GLY 42 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3n99 s ILE 43 N -0.97 4.95 -0.35 -0.61 1.01 -1.26 -1.61 121.20 122.37 3n99 s ILE 43 Ca 0.00 0.64 -0.14 0.00 0.00 0.00 0.00 60.65 61.14 3n99 s ILE 43 Cb 0.00 -4.00 -0.01 0.00 0.01 0.00 0.00 42.46 38.46 3n99 s ILE 43 CO 0.00 -0.19 0.32 -0.89 0.00 0.00 0.00 174.94 174.18 3n99 s THR 44 N 2.56 5.21 -0.18 2.92 2.01 -0.25 -4.97 115.64 122.93 3n99 s THR 44 Ca 0.23 -0.11 0.16 0.00 0.31 0.00 0.00 61.69 62.28 3n99 s THR 44 Cb -0.15 -3.80 0.07 0.00 0.01 0.00 0.00 72.50 68.62 3n99 s THR 44 CO 0.13 -0.10 1.38 1.88 -0.69 0.00 0.00 174.62 177.23 3n99 h TYR 45 N 8.50 0.00 0.00 4.92 0.05 -1.96 -3.35 116.97 125.13 3n99 h TYR 45 Ca -0.30 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.48 3n99 h TYR 45 Cb 1.14 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.88 3n99 h TYR 45 CO 0.67 0.45 -0.05 0.27 -1.05 0.00 0.00 178.16 178.44 3n99 n ASN 46 N -3.16 1.82 -3.86 3.88 6.94 -1.26 -4.94 115.26 114.69 3n99 n ASN 46 Ca 0.01 -2.47 -0.26 0.00 -0.02 0.00 0.00 54.58 51.84 3n99 n ASN 46 Cb 0.72 -0.23 -0.17 0.00 -2.36 0.00 0.00 39.78 37.74 3n99 n ASN 46 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3n99 s VAL 47 N -1.75 0.87 0.19 3.53 1.01 -1.26 -5.11 120.40 117.87 3n99 s VAL 47 Ca 0.16 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 61.85 3n99 s VAL 47 Cb 0.14 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.47 3n99 s VAL 47 CO 0.01 0.24 0.00 -1.59 0.00 0.00 0.00 175.10 173.76 3n99 s LYS 48 N 1.76 1.18 0.37 2.72 -2.85 -1.26 -1.64 119.74 120.02 3n99 s LYS 48 Ca 0.03 -1.58 -0.27 0.00 -1.00 0.00 0.00 55.97 53.15 3n99 s LYS 48 Cb -0.14 -0.36 -0.11 0.00 -2.06 0.00 0.00 37.83 35.16 3n99 s LYS 48 CO -0.07 -0.13 1.37 1.55 0.10 0.00 0.00 175.35 178.17 3n99 n VAL 49 N -0.29 2.12 0.00 1.79 3.14 -1.26 -1.58 118.33 122.25 3n99 n VAL 49 Ca -0.06 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.82 3n99 n VAL 49 Cb 0.63 -1.74 0.00 0.00 -1.06 0.00 0.00 33.84 31.67 3n99 n VAL 49 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3n99 n GLY 50 N 0.64 3.08 3.77 7.55 0.00 0.15 -4.91 105.19 115.47 3n99 n GLY 50 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 3n99 n GLY 50 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3n99 s ASP 51 N 0.24 4.32 0.46 1.61 1.01 -0.61 -4.71 116.67 118.98 3n99 s ASP 51 Ca 0.00 1.61 -0.25 0.00 0.71 0.00 0.00 52.55 54.63 3n99 s ASP 51 Cb 0.00 -2.34 -0.08 0.00 1.01 0.00 0.00 42.92 41.51 3n99 s ASP 51 CO 0.00 -2.12 1.38 -0.55 0.21 0.00 0.00 175.17 174.09 3n99 s SER 52 N -3.54 5.86 0.19 0.27 0.15 -1.26 -0.12 113.70 115.24 3n99 s SER 52 Ca 0.61 2.82 0.25 0.00 0.70 0.00 0.00 55.95 60.33 3n99 s SER 52 Cb -0.16 -2.65 0.49 0.00 -1.71 0.00 0.00 66.02 61.98 3n99 s SER 52 CO 0.56 -1.17 1.49 0.00 1.20 0.00 0.00 173.24 175.31 3n99 h ALA 53 N 2.23 0.76 -2.07 5.45 0.00 -1.55 -3.42 119.26 120.66 3n99 h ALA 53 Ca -0.51 0.00 -0.51 0.00 0.00 0.00 0.00 54.91 53.90 3n99 h ALA 53 Cb 1.27 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.01 3n99 h ALA 53 CO 0.61 0.00 -0.51 0.71 0.00 0.00 0.00 179.25 180.05 3n99 s TYR 54 N -3.16 2.99 0.00 0.00 1.51 -1.26 0.49 117.35 117.91 3n99 s TYR 54 Ca 0.07 -0.20 0.00 0.00 -1.01 0.00 0.00 57.07 55.94 3n99 s TYR 54 Cb 0.12 -1.52 0.00 0.00 -0.11 0.00 0.00 41.96 40.45 3n99 s TYR 54 CO 0.68 0.41 0.00 0.41 -1.11 0.00 0.00 175.55 175.94 3n99 n GLY 55 N -1.21 0.75 3.83 0.71 0.00 -1.26 -5.00 105.19 103.00 3n99 n GLY 55 Ca -0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 3n99 n GLY 55 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3n99 s TRP 56 N -2.73 3.66 -1.08 1.61 0.52 -1.26 -5.00 118.94 114.66 3n99 s TRP 56 Ca 0.00 0.84 -0.20 0.00 0.02 0.00 0.00 56.10 56.76 3n99 s TRP 56 Cb 0.00 -2.24 -0.07 0.00 -1.15 0.00 0.00 33.47 30.01 3n99 s TRP 56 CO 0.00 0.59 1.94 0.00 0.02 0.00 0.00 176.95 179.50 3n99 n ALA 57 N 2.17 3.21 -3.63 0.98 0.00 -1.26 -4.80 120.51 117.17 3n99 n ALA 57 Ca -0.15 -3.39 -0.02 0.00 0.00 0.00 0.00 53.44 49.88 3n99 n ALA 57 Cb 0.53 -3.57 -0.01 0.00 0.00 0.00 0.00 19.45 16.40 3n99 n ALA 57 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3n99 s GLY 58 N 5.08 -0.35 -0.05 0.00 0.00 -1.26 -4.24 107.32 106.51 3n99 s GLY 58 Ca 0.59 0.77 0.01 0.00 0.00 0.00 0.00 44.72 46.09 3n99 s GLY 58 CO 0.09 0.20 -0.06 -0.35 0.00 0.00 0.00 173.10 172.98 3n99 s ASP 59 N -2.73 1.09 -1.46 1.64 2.15 -0.51 -4.76 116.67 112.08 3n99 s ASP 59 Ca 0.11 -0.16 -0.10 0.00 0.43 0.00 0.00 52.55 52.83 3n99 s ASP 59 Cb 0.01 -0.51 0.06 0.00 -0.30 0.00 0.00 42.92 42.18 3n99 s ASP 59 CO -0.03 -0.03 0.77 1.41 -0.17 0.00 0.00 175.17 177.12 3n99 n HIS 60 N 3.93 -2.12 -2.17 -5.34 8.25 -1.04 -4.03 115.22 112.70 3n99 n HIS 60 Ca -0.25 0.70 -0.42 0.00 -0.26 0.00 0.00 57.72 57.49 3n99 n HIS 60 Cb 0.51 -3.85 -0.03 0.00 1.12 0.00 0.00 29.99 27.74 3n99 n HIS 60 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3n99 s VAL 61 N -3.16 3.34 -0.29 1.59 1.01 -1.26 -4.06 120.40 117.56 3n99 s VAL 61 Ca 0.50 0.94 -0.13 0.00 0.00 0.00 0.00 61.98 63.29 3n99 s VAL 61 Cb -0.25 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 3n99 s VAL 61 CO 0.62 0.06 0.27 -1.61 0.00 0.00 0.00 175.10 174.44 3n99 s GLU 62 N 1.30 3.88 0.55 2.72 2.02 -1.26 -0.97 118.70 126.95 3n99 s GLU 62 Ca 0.65 -0.25 -0.21 0.00 0.02 0.00 0.00 54.97 55.18 3n99 s GLU 62 Cb -0.36 -3.69 -0.05 0.00 0.10 0.00 0.00 34.13 30.13 3n99 s GLU 62 CO 0.30 -0.27 1.31 -1.25 0.02 0.00 0.00 175.26 175.37 3n99 s PRO 63 N 1.88 3.12 7.62 0.39 0.04 -1.26 -4.63 135.00 142.15 3n99 s PRO 63 Ca 0.10 2.12 0.00 0.00 0.04 0.00 0.00 61.00 63.26 3n99 s PRO 63 Cb -0.16 -2.19 0.00 0.00 0.04 0.00 0.00 34.50 32.19 3n99 s PRO 63 CO 0.11 -1.17 0.00 0.41 0.04 0.00 0.00 177.00 176.39 3n99 n GLY 64 N 0.69 3.18 3.44 0.56 0.00 -0.65 -4.48 105.19 107.94 3n99 n GLY 64 Ca 0.11 -0.19 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 3n99 n GLY 64 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3n99 s VAL 65 N 0.00 4.46 -0.02 1.61 1.01 -0.41 -1.09 120.40 125.97 3n99 s VAL 65 Ca 0.00 -0.30 -0.24 0.00 0.00 0.00 0.00 61.98 61.44 3n99 s VAL 65 Cb 0.00 -3.19 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 3n99 s VAL 65 CO 0.00 0.20 0.74 -0.44 0.00 0.00 0.00 175.10 175.60 3n99 s SER 66 N 1.61 7.10 -0.17 3.32 0.01 -0.63 -0.95 113.70 124.00 3n99 s SER 66 Ca 0.05 1.32 0.00 0.00 1.31 0.00 0.00 55.95 58.63 3n99 s SER 66 Cb -0.16 -2.44 0.00 0.00 0.21 0.00 0.00 66.02 63.63 3n99 s SER 66 CO 0.05 -0.07 -0.16 -0.69 0.41 0.00 0.00 173.24 172.78 3n99 s VAL 67 N 0.46 2.54 0.37 3.43 1.01 0.46 -1.20 120.40 127.48 3n99 s VAL 67 Ca 0.39 -0.80 0.08 0.00 0.00 0.00 0.00 61.98 61.65 3n99 s VAL 67 Cb -0.19 -2.08 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 3n99 s VAL 67 CO 0.21 0.51 0.19 0.00 0.00 0.00 0.00 175.10 176.01 3n99 s MET 68 N 0.99 2.35 0.65 2.72 0.23 -0.23 -0.70 119.30 125.31 3n99 s MET 68 Ca -0.02 -1.63 -0.15 0.00 -1.03 0.00 0.00 55.69 52.86 3n99 s MET 68 Cb -0.15 -2.15 -0.00 0.00 -1.53 0.00 0.00 34.83 31.00 3n99 s MET 68 CO -0.03 -0.00 1.10 0.00 -2.03 0.00 0.00 175.02 174.05 3n99 s ALA 69 N -2.48 2.51 0.38 3.16 0.00 -1.26 -0.68 121.76 123.38 3n99 s ALA 69 Ca 0.40 0.50 0.19 0.00 0.00 0.00 0.00 51.96 53.05 3n99 s ALA 69 Cb -0.01 -3.30 1.03 0.00 0.00 0.00 0.00 23.12 20.84 3n99 s ALA 69 CO 0.23 -1.22 1.93 0.00 0.00 0.00 0.00 175.76 176.71 3n99 h ARG 70 N 0.04 0.00 -2.35 0.00 3.08 -1.90 -3.43 114.38 109.81 3n99 h ARG 70 Ca -0.47 0.00 0.12 0.00 0.07 0.00 0.00 59.98 59.70 3n99 h ARG 70 Cb 1.24 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 31.16 3n99 h ARG 70 CO 0.55 0.24 0.47 -0.98 -1.07 0.00 0.00 179.97 179.18 3n99 s ARG 71 N -4.22 0.95 0.33 0.04 1.70 -1.26 -5.06 118.95 111.43 3n99 s ARG 71 Ca -0.03 -0.41 0.02 0.00 -0.47 0.00 0.00 55.73 54.85 3n99 s ARG 71 Cb 0.14 0.40 0.61 0.00 -0.57 0.00 0.00 34.95 35.52 3n99 s ARG 71 CO 0.67 -0.42 1.94 -0.22 -1.08 0.00 0.00 175.30 176.19 3n99 h LYS 72 N 2.00 0.90 0.00 3.89 3.64 -2.02 -1.21 116.57 123.77 3n99 h LYS 72 Ca -0.23 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.08 3n99 h LYS 72 Cb 1.24 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 32.86 3n99 h LYS 72 CO 0.30 0.59 -0.05 0.93 -2.27 0.00 0.00 179.45 178.96 3n99 h GLU 73 N 0.93 0.00 -0.03 1.90 3.07 -2.00 -2.16 114.58 116.29 3n99 h GLU 73 Ca 0.34 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.20 3n99 h GLU 73 Cb 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.07 3n99 h GLU 73 CO -0.11 0.05 0.00 0.39 -1.40 0.00 0.00 179.01 177.93 3n99 n GLU 74 N -4.22 1.49 -0.03 2.33 1.02 -0.46 -4.35 120.64 116.42 3n99 n GLU 74 Ca -0.03 -0.71 -0.13 0.00 -0.02 0.00 0.00 57.16 56.27 3n99 n GLU 74 Cb 0.13 -1.47 -0.09 0.00 -0.02 0.00 0.00 31.44 29.99 3n99 n GLU 74 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3n99 h GLU 75 N 1.69 0.12 -0.26 3.49 5.08 -1.43 -2.80 114.58 120.47 3n99 h GLU 75 Ca 0.00 -0.06 0.04 0.00 -1.00 0.00 0.00 59.36 58.33 3n99 h GLU 75 Cb 0.36 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.58 3n99 h GLU 75 CO 0.00 0.57 0.05 0.82 -1.00 0.00 0.00 179.01 179.45 3n99 h ILE 76 N -0.33 0.87 -0.21 3.13 2.04 -1.78 -1.15 117.51 120.08 3n99 h ILE 76 Ca 0.01 -0.05 -0.12 0.00 1.00 0.00 0.00 64.86 65.70 3n99 h ILE 76 Cb 0.55 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 3n99 h ILE 76 CO 0.01 0.03 -0.36 1.55 0.00 0.00 0.00 178.15 179.38 3n99 h PRO 77 N 0.14 0.47 -0.49 2.37 0.13 -1.84 0.52 132.00 133.29 3n99 h PRO 77 Ca 0.12 -0.22 0.06 0.00 -0.87 0.00 0.00 66.00 65.09 3n99 h PRO 77 Cb 0.13 -0.01 -0.05 0.00 0.13 0.00 0.00 31.00 31.20 3n99 h PRO 77 CO -0.16 0.76 0.20 1.25 -0.23 0.00 0.00 178.00 179.82 3n99 h LEU 78 N 0.39 0.25 0.00 1.56 5.85 -1.15 -0.69 115.31 121.52 3n99 h LEU 78 Ca 0.04 0.05 -0.17 0.00 0.84 0.00 0.00 57.88 58.64 3n99 h LEU 78 Cb 0.82 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 3n99 h LEU 78 CO 0.07 0.17 -0.90 0.24 -0.34 0.00 0.00 178.44 177.68 3n99 h MET 79 N 0.40 0.00 0.07 1.25 2.86 -0.92 -3.16 114.93 115.42 3n99 h MET 79 Ca 0.23 0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 57.61 3n99 h MET 79 Cb 0.21 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.85 3n99 h MET 79 CO -0.21 0.73 -1.37 1.15 1.06 0.00 0.00 176.91 178.27 3n99 h THR 80 N 0.00 0.97 0.00 2.22 2.02 -0.76 -3.38 112.91 113.99 3n99 h THR 80 Ca -0.04 -2.32 -0.10 0.00 0.77 0.00 0.00 66.41 64.72 3n99 h THR 80 Cb 1.63 2.56 -0.02 0.00 -1.74 0.00 0.00 68.15 70.59 3n99 h THR 80 CO 0.10 0.60 -0.81 -0.07 0.37 0.00 0.00 175.52 175.71 3n99 h LEU 81 N -0.51 0.00 -9.41 2.58 3.38 -1.28 -3.45 115.31 106.62 3n99 h LEU 81 Ca -0.32 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.11 3n99 h LEU 81 Cb 1.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.36 3n99 h LEU 81 CO -0.03 0.42 0.81 -0.44 0.09 0.00 0.00 178.44 179.28 3n99 s SER 82 N -6.08 6.85 0.11 -0.43 0.01 -1.20 -3.93 113.70 109.04 3n99 s SER 82 Ca 0.01 2.15 0.10 0.00 1.31 0.00 0.00 55.95 59.53 3n99 s SER 82 Cb 0.08 -2.57 -0.04 0.00 0.21 0.00 0.00 66.02 63.71 3n99 s SER 82 CO 0.77 -0.70 -0.26 0.00 0.41 0.00 0.00 173.24 173.46 3n99 s ILE 84 N -1.03 2.57 0.00 0.00 1.01 -0.69 -0.98 121.20 122.08 3n99 s ILE 84 Ca 0.14 0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.94 3n99 s ILE 84 Cb -0.10 -3.10 0.00 0.00 0.01 0.00 0.00 42.46 39.27 3n99 s ILE 84 CO 0.06 0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.61 3n99 n GLY 85 N 4.13 2.44 3.75 6.18 0.00 0.39 -1.15 105.19 120.93 3n99 n GLY 85 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 3n99 n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3n99 s ASN 86 N -1.36 5.42 0.42 1.61 0.02 -0.15 -4.55 114.94 116.35 3n99 s ASN 86 Ca 0.00 2.76 -0.25 0.00 -1.02 0.00 0.00 52.86 54.35 3n99 s ASN 86 Cb 0.00 -2.64 -0.08 0.00 0.02 0.00 0.00 41.25 38.55 3n99 s ASN 86 CO 0.00 -1.47 1.21 -0.70 0.02 0.00 0.00 177.10 176.16 3n99 s GLU 87 N -2.82 3.92 -0.03 -0.60 2.12 -1.26 -1.71 118.70 118.32 3n99 s GLU 87 Ca 0.69 1.92 0.01 0.00 0.36 0.00 0.00 54.97 57.95 3n99 s GLU 87 Cb -0.40 -2.61 0.02 0.00 0.26 0.00 0.00 34.13 31.39 3n99 s GLU 87 CO 0.48 -0.46 -0.04 0.08 -0.54 0.00 0.00 175.26 174.78 3n99 s VAL 88 N -1.40 0.48 -0.06 3.70 1.01 -0.47 -0.29 120.40 123.37 3n99 s VAL 88 Ca 0.59 -0.13 0.05 0.00 0.00 0.00 0.00 61.98 62.49 3n99 s VAL 88 Cb -0.32 -0.48 -0.01 0.00 0.00 0.00 0.00 36.38 35.57 3n99 s VAL 88 CO 0.41 0.19 -0.23 -0.63 0.00 0.00 0.00 175.10 174.84 3n99 s ILE 89 N 0.64 1.87 -0.05 2.22 1.09 0.43 -1.20 121.20 126.20 3n99 s ILE 89 Ca -0.08 -0.95 -0.30 0.00 -1.10 0.00 0.00 60.65 58.22 3n99 s ILE 89 Cb -0.11 -1.59 -0.03 0.00 -1.06 0.00 0.00 42.46 39.66 3n99 s ILE 89 CO -0.00 0.52 1.15 -0.69 -0.10 0.00 0.00 174.94 175.82 3n99 s VAL 90 N -0.02 4.38 -0.83 2.92 1.01 -0.40 -1.60 120.40 125.86 3n99 s VAL 90 Ca -0.06 1.69 0.08 0.00 0.00 0.00 0.00 61.98 63.69 3n99 s VAL 90 Cb -0.14 -4.09 0.01 0.00 0.00 0.00 0.00 36.38 32.17 3n99 s VAL 90 CO 0.04 0.02 0.61 0.23 0.00 0.00 0.00 175.10 176.01 3n99 n MET 91 N 4.93 1.73 -4.11 2.72 2.81 -0.13 -0.18 117.12 124.89 3n99 n MET 91 Ca 0.10 -0.65 -0.13 0.00 -1.81 0.00 0.00 57.70 55.20 3n99 n MET 91 Cb 0.47 -1.06 -0.06 0.00 -0.71 0.00 0.00 33.22 31.86 3n99 n MET 91 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3n99 s SER 92 N -1.08 0.57 0.00 7.83 1.04 -1.24 -4.86 113.70 115.97 3n99 s SER 92 Ca 0.08 -1.36 0.00 0.00 0.48 0.00 0.00 55.95 55.15 3n99 s SER 92 Cb 0.07 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.75 3n99 s SER 92 CO 0.18 -1.13 0.00 0.61 0.98 0.00 0.00 173.24 173.88 3n99 n GLY 93 N -0.46 -2.28 0.17 7.32 0.00 -1.26 -3.93 105.19 104.74 3n99 n GLY 93 Ca 0.01 -1.55 0.13 0.00 0.00 0.00 0.00 46.02 44.62 3n99 n GLY 93 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3n99 h ASP 94 N 0.00 0.00 -0.69 1.61 3.32 -1.98 -2.84 116.42 115.84 3n99 h ASP 94 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3n99 h ASP 94 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3n99 h ASP 94 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 3n99 n ALA 95 N -1.84 2.88 -1.60 3.45 0.00 -1.26 -5.00 120.51 117.13 3n99 n ALA 95 Ca 0.02 -1.52 -0.49 0.00 0.00 0.00 0.00 53.44 51.45 3n99 n ALA 95 Cb 0.23 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.64 3n99 n ALA 95 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3n99 n LYS 96 N 1.32 1.37 0.00 0.00 4.81 -1.08 -0.77 118.16 123.82 3n99 n LYS 96 Ca 0.26 0.49 0.00 0.00 -0.87 0.00 0.00 58.31 58.19 3n99 n LYS 96 Cb 0.82 -2.08 0.00 0.00 0.02 0.00 0.00 35.03 33.79 3n99 n LYS 96 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3n99 n GLY 97 N 2.31 3.41 3.77 3.14 0.00 0.75 -4.99 105.19 113.58 3n99 n GLY 97 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 3n99 n GLY 97 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3n99 s SER 98 N -0.95 6.01 0.01 1.61 0.01 0.05 -4.74 113.70 115.69 3n99 s SER 98 Ca 0.00 2.35 0.08 0.00 1.31 0.00 0.00 55.95 59.69 3n99 s SER 98 Cb 0.00 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.60 3n99 s SER 98 CO 0.00 -1.03 -0.25 -0.13 0.41 0.00 0.00 173.24 172.24 3n99 s ARG 99 N -2.79 2.00 0.00 12.44 0.52 -1.26 -1.28 118.95 128.58 3n99 s ARG 99 Ca 0.66 -1.00 0.00 0.00 -0.52 0.00 0.00 55.73 54.87 3n99 s ARG 99 Cb -0.29 -2.04 0.00 0.00 0.52 0.00 0.00 34.95 33.13 3n99 s ARG 99 CO 0.35 0.54 0.00 0.41 0.02 0.00 0.00 175.30 176.62 3n99 n GLY 100 N 2.08 4.27 2.95 -3.53 0.00 -0.34 -4.66 105.19 105.96 3n99 n GLY 100 Ca -0.16 -1.32 -0.13 0.00 0.00 0.00 0.00 46.02 44.41 3n99 n GLY 100 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3n99 s PHE 101 N -2.24 0.32 -0.00 1.61 0.08 -0.76 -1.36 117.98 115.62 3n99 s PHE 101 Ca 0.00 -0.22 -0.30 0.00 0.12 0.00 0.00 56.93 56.53 3n99 s PHE 101 Cb 0.00 -0.20 -0.05 0.00 -0.57 0.00 0.00 43.02 42.20 3n99 s PHE 101 CO 0.00 -0.05 1.35 0.08 -0.10 0.00 0.00 175.22 176.50 3n99 s VAL 102 N -0.57 3.81 -0.07 -0.44 1.01 -0.69 -0.90 120.40 122.55 3n99 s VAL 102 Ca -0.04 1.20 0.21 0.00 0.00 0.00 0.00 61.98 63.35 3n99 s VAL 102 Cb -0.04 -3.77 -0.31 0.00 0.00 0.00 0.00 36.38 32.26 3n99 s VAL 102 CO -0.00 0.01 0.42 0.35 0.00 0.00 0.00 175.10 175.87 3n99 n THR 103 N 4.58 0.33 -2.44 3.92 -2.24 0.41 -0.46 114.28 118.38 3n99 n THR 103 Ca 0.12 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 61.32 3n99 n THR 103 Cb 0.44 -0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 3n99 n THR 103 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3n99 n GLY 104 N 1.36 -1.30 3.30 3.38 0.00 -1.18 -4.86 105.19 105.89 3n99 n GLY 104 Ca -0.10 -0.92 -0.14 0.00 0.00 0.00 0.00 46.02 44.86 3n99 n GLY 104 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3n99 s LYS 105 N -0.73 0.79 -0.11 1.61 -2.85 -1.26 -0.42 119.74 116.78 3n99 s LYS 105 Ca 0.00 -0.17 -0.01 0.00 -1.00 0.00 0.00 55.97 54.79 3n99 s LYS 105 Cb 0.00 0.36 0.03 0.00 -2.06 0.00 0.00 37.83 36.15 3n99 s LYS 105 CO 0.00 -0.24 -0.05 -1.58 0.10 0.00 0.00 175.35 173.58 3n99 s HIS 106 N -1.62 1.23 0.48 1.78 2.46 0.20 -4.17 115.29 115.65 3n99 s HIS 106 Ca -0.11 -0.59 -0.12 0.00 0.47 0.00 0.00 55.06 54.71 3n99 s HIS 106 Cb -0.03 -1.10 -0.06 0.00 -0.13 0.00 0.00 32.58 31.25 3n99 s HIS 106 CO 0.03 -0.47 0.89 0.20 -2.47 0.00 0.00 174.74 172.93 3n99 s GLY 107 N 1.79 1.92 0.00 1.59 0.00 -1.26 -1.53 107.32 109.82 3n99 s GLY 107 Ca 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 44.72 44.70 3n99 s GLY 107 CO -0.07 0.17 0.00 0.61 0.00 0.00 0.00 173.10 173.80 3n99 n GLY 108 N -1.68 1.67 0.31 0.20 0.00 -1.26 -4.28 105.19 100.15 3n99 n GLY 108 Ca 0.04 -0.70 0.20 0.00 0.00 0.00 0.00 46.02 45.56 3n99 n GLY 108 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3n99 h VAL 109 N 0.00 0.06 -5.44 1.61 -1.51 -2.04 -3.47 116.25 105.46 3n99 h VAL 109 Ca 0.00 -0.25 -0.05 0.00 -1.23 0.00 0.00 66.70 65.17 3n99 h VAL 109 Cb 0.00 1.23 0.02 0.00 -2.13 0.00 0.00 31.29 30.41 3n99 h VAL 109 CO 0.00 0.01 -0.15 0.59 -1.23 0.00 0.00 177.57 176.79 3n99 n ASN 110 N -3.15 -7.54 -4.46 4.19 3.02 -0.95 -4.94 115.26 101.43 3n99 n ASN 110 Ca -0.02 -0.19 -0.31 0.00 -0.03 0.00 0.00 54.58 54.04 3n99 n ASN 110 Cb 0.18 -5.14 -0.12 0.00 -0.61 0.00 0.00 39.78 34.08 3n99 n ASN 110 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3n99 s HIS 111 N -3.05 2.56 -0.10 3.10 3.76 -0.58 -4.42 115.29 116.56 3n99 s HIS 111 Ca 0.06 -0.25 -0.03 0.00 -0.15 0.00 0.00 55.06 54.69 3n99 s HIS 111 Cb -0.01 -1.45 -0.03 0.00 1.11 0.00 0.00 32.58 32.20 3n99 s HIS 111 CO 0.76 0.28 0.00 0.08 -0.85 0.00 0.00 174.74 175.01 3n99 s VAL 112 N -0.96 4.33 -0.12 -0.90 1.01 0.12 -0.63 120.40 123.24 3n99 s VAL 112 Ca 0.15 -0.23 -0.01 0.00 0.00 0.00 0.00 61.98 61.89 3n99 s VAL 112 Cb -0.11 -2.84 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 3n99 s VAL 112 CO 0.06 0.58 -0.08 -0.76 0.00 0.00 0.00 175.10 174.91 3n99 s LEU 113 N -0.64 3.07 -0.03 3.92 1.43 0.44 -0.40 118.68 126.46 3n99 s LEU 113 Ca 0.10 -0.15 0.02 0.00 -1.03 0.00 0.00 54.13 53.07 3n99 s LEU 113 Cb -0.12 -1.70 0.01 0.00 0.03 0.00 0.00 46.19 44.41 3n99 s LEU 113 CO 0.02 0.23 -0.06 -0.69 0.23 0.00 0.00 176.35 176.08 3n99 s VAL 114 N -0.04 0.61 -0.18 -1.59 1.01 -0.12 -0.44 120.40 119.64 3n99 s VAL 114 Ca -0.00 -0.23 -0.12 0.00 0.00 0.00 0.00 61.98 61.63 3n99 s VAL 114 Cb -0.13 -0.58 -0.05 0.00 0.00 0.00 0.00 36.38 35.62 3n99 s VAL 114 CO 0.03 0.22 0.21 -2.28 0.00 0.00 0.00 175.10 173.27 3n99 s HIS 115 N 0.48 3.43 0.18 5.22 2.46 -0.08 -1.29 115.29 125.71 3n99 s HIS 115 Ca -0.07 0.46 0.08 0.00 0.47 0.00 0.00 55.06 56.00 3n99 s HIS 115 Cb -0.10 -2.24 -0.04 0.00 -0.13 0.00 0.00 32.58 30.06 3n99 s HIS 115 CO 0.00 0.27 -0.16 -0.06 -2.47 0.00 0.00 174.74 172.32 3n99 s PHE 116 N 0.41 1.73 0.63 3.88 0.08 -1.26 -1.83 117.98 121.62 3n99 s PHE 116 Ca 0.12 -0.53 -0.18 0.00 0.12 0.00 0.00 56.93 56.46 3n99 s PHE 116 Cb -0.12 -0.83 -0.02 0.00 -0.57 0.00 0.00 43.02 41.48 3n99 s PHE 116 CO 0.01 0.34 1.25 -1.83 -0.10 0.00 0.00 175.22 174.89 3n99 s GLU 117 N -3.23 2.72 0.26 0.44 -1.05 -1.26 -4.89 118.70 111.69 3n99 s GLU 117 Ca 0.19 1.95 -0.02 0.00 -0.15 0.00 0.00 54.97 56.94 3n99 s GLU 117 Cb -0.03 -1.88 0.45 0.00 -0.44 0.00 0.00 34.13 32.23 3n99 s GLU 117 CO 0.07 -1.44 1.84 1.49 0.95 0.00 0.00 175.26 178.17 3n99 h GLU 118 N 0.66 0.94 0.00 -4.83 4.81 -2.01 -1.07 114.58 113.09 3n99 h GLU 118 Ca -0.51 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 58.66 3n99 h GLU 118 Cb 1.32 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 30.49 3n99 h GLU 118 CO 0.54 0.62 -0.02 1.05 -0.73 0.00 0.00 179.01 180.47 3n99 h GLU 119 N 0.97 0.00 -0.19 1.92 9.09 -2.04 -2.64 114.58 121.68 3n99 h GLU 119 Ca 0.44 0.00 -0.15 0.00 0.05 0.00 0.00 59.36 59.70 3n99 h GLU 119 Cb 0.35 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.44 3n99 h GLU 119 CO -0.23 0.02 -0.50 0.28 0.05 0.00 0.00 179.01 178.63 3n99 h VAL 120 N 0.00 1.32 -0.48 -1.06 2.07 -1.54 -3.36 116.25 113.20 3n99 h VAL 120 Ca -0.00 -1.73 -0.03 0.00 0.82 0.00 0.00 66.70 65.75 3n99 h VAL 120 Cb 0.05 1.71 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 3n99 h VAL 120 CO 0.00 0.54 0.15 -0.07 0.02 0.00 0.00 177.57 178.22 3n99 h LEU 121 N 0.42 0.65 -1.72 2.57 3.38 -1.52 -0.61 115.31 118.48 3n99 h LEU 121 Ca 0.02 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3n99 h LEU 121 Cb 1.03 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.61 3n99 h LEU 121 CO 0.09 0.61 0.00 1.23 0.09 0.00 0.00 178.44 180.47 3n99 h GLY 122 N 0.87 0.00 0.36 0.83 0.00 -1.71 -2.78 103.07 100.64 3n99 h GLY 122 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 3n99 h GLY 122 CO -0.01 0.00 -0.61 0.28 0.00 0.00 0.00 176.54 176.20 3n99 n LYS 123 N -2.82 0.26 -2.36 4.80 5.02 -0.24 -4.97 118.16 117.85 3n99 n LYS 123 Ca -0.00 -0.18 -0.28 0.00 -2.02 0.00 0.00 58.31 55.82 3n99 n LYS 123 Cb 0.20 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.72 3n99 n LYS 123 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3n99 s LEU 124 N -2.87 3.37 -0.03 -0.35 1.43 -1.05 -4.18 118.68 115.00 3n99 s LEU 124 Ca 0.13 0.97 -0.05 0.00 -1.03 0.00 0.00 54.13 54.16 3n99 s LEU 124 Cb 0.17 -3.89 0.01 0.00 0.03 0.00 0.00 46.19 42.51 3n99 s LEU 124 CO 0.71 -0.84 0.11 -0.32 0.23 0.00 0.00 176.35 176.24 3n99 s MET 125 N -4.95 0.24 0.30 1.70 -2.45 -1.26 -5.06 119.30 107.82 3n99 s MET 125 Ca 0.52 -0.04 -0.29 0.00 -1.25 0.00 0.00 55.69 54.63 3n99 s MET 125 Cb -0.11 0.10 -0.13 0.00 1.25 0.00 0.00 34.83 35.95 3n99 s MET 125 CO 0.47 -0.04 1.32 0.28 1.05 0.00 0.00 175.02 178.10 3n99 n VAL 126 N 2.51 1.60 0.00 10.11 0.31 -1.26 -1.68 118.33 129.92 3n99 n VAL 126 Ca -0.16 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 63.77 3n99 n VAL 126 Cb 0.58 -1.52 0.00 0.00 -0.91 0.00 0.00 33.84 31.99 3n99 n VAL 126 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3n99 n GLY 127 N 1.32 2.36 3.77 2.92 0.00 0.35 -4.95 105.19 110.96 3n99 n GLY 127 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 3n99 n GLY 127 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3n99 s ASP 128 N -1.48 6.50 0.28 1.61 1.01 -0.68 -4.53 116.67 119.38 3n99 s ASP 128 Ca 0.00 2.92 -0.29 0.00 0.71 0.00 0.00 52.55 55.88 3n99 s ASP 128 Cb 0.00 -2.66 -0.09 0.00 1.01 0.00 0.00 42.92 41.18 3n99 s ASP 128 CO 0.00 -0.76 1.07 -0.54 0.21 0.00 0.00 175.17 175.16 3n99 s LYS 129 N -1.89 4.66 -0.06 8.23 1.02 -1.26 -1.01 119.74 129.43 3n99 s LYS 129 Ca 0.52 1.75 0.02 0.00 0.02 0.00 0.00 55.97 58.28 3n99 s LYS 129 Cb -0.44 -3.19 0.01 0.00 -0.52 0.00 0.00 37.83 33.70 3n99 s LYS 129 CO 0.59 0.25 -0.12 0.42 -0.92 0.00 0.00 175.35 175.57 3n99 s ILE 130 N -1.18 1.09 -0.20 2.17 -1.09 0.21 -0.95 121.20 121.24 3n99 s ILE 130 Ca 0.44 -0.45 -0.04 0.00 -2.23 0.00 0.00 60.65 58.38 3n99 s ILE 130 Cb -0.31 -1.00 -0.01 0.00 -1.58 0.00 0.00 42.46 39.56 3n99 s ILE 130 CO 0.39 0.35 -0.05 -0.22 -1.23 0.00 0.00 174.94 174.18 3n99 s LEU 131 N 0.69 2.95 -0.21 2.97 2.96 -0.63 -1.00 118.68 126.42 3n99 s LEU 131 Ca -0.14 -0.34 -0.08 0.00 -0.22 0.00 0.00 54.13 53.35 3n99 s LEU 131 Cb -0.16 -1.74 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 3n99 s LEU 131 CO 0.03 0.03 0.09 -0.63 -1.32 0.00 0.00 176.35 174.55 3n99 s ILE 132 N 1.20 4.82 -0.99 6.68 1.01 0.14 -0.43 121.20 133.64 3n99 s ILE 132 Ca 0.03 -0.01 -0.19 0.00 0.00 0.00 0.00 60.65 60.47 3n99 s ILE 132 Cb -0.14 -3.21 0.12 0.00 0.01 0.00 0.00 42.46 39.23 3n99 s ILE 132 CO -0.01 0.41 1.25 -0.54 0.00 0.00 0.00 174.94 176.05 3n99 s LYS 133 N 0.77 3.66 0.00 2.79 1.02 0.60 -1.26 119.74 127.33 3n99 s LYS 133 Ca 0.04 -1.72 -0.30 0.00 0.02 0.00 0.00 55.97 54.02 3n99 s LYS 133 Cb -0.13 -5.05 -0.04 0.00 -0.52 0.00 0.00 37.83 32.08 3n99 s LYS 133 CO 0.02 -1.88 1.18 0.00 -0.92 0.00 0.00 175.35 173.75 3n99 s ALA 134 N 3.12 3.42 -0.30 5.17 0.00 0.13 -4.33 121.76 128.98 3n99 s ALA 134 Ca 0.37 0.72 -0.11 0.00 0.00 0.00 0.00 51.96 52.95 3n99 s ALA 134 Cb -0.03 -3.47 0.13 0.00 0.00 0.00 0.00 23.12 19.74 3n99 s ALA 134 CO -0.08 -0.57 0.67 -0.46 0.00 0.00 0.00 175.76 175.32 3n99 s TRP 135 N 1.58 -1.30 0.00 0.00 -0.00 -1.25 -1.98 118.94 116.00 3n99 s TRP 135 Ca 0.57 2.28 0.00 0.00 -0.00 0.00 0.00 56.10 58.95 3n99 s TRP 135 Cb -0.27 0.78 0.00 0.00 -0.00 0.00 0.00 33.47 33.98 3n99 s TRP 135 CO 0.26 -0.64 0.00 0.41 -0.00 0.00 0.00 176.95 176.98 3n99 n GLY 136 N 5.30 0.87 3.75 5.86 0.00 -1.26 -4.18 105.19 115.53 3n99 n GLY 136 Ca -0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 3n99 n GLY 136 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3n99 s GLN 137 N 0.00 4.68 0.00 1.61 -1.52 -1.26 -2.14 119.66 121.03 3n99 s GLN 137 Ca 0.00 1.67 0.00 0.00 -1.95 0.00 0.00 55.36 55.08 3n99 s GLN 137 Cb 0.00 -3.25 0.00 0.00 -0.22 0.00 0.00 33.01 29.54 3n99 s GLN 137 CO 0.00 0.25 0.00 0.41 -0.25 0.00 0.00 175.29 175.70 3n99 n GLY 138 N 1.62 0.25 3.75 3.09 0.00 -1.26 -4.72 105.19 107.92 3n99 n GLY 138 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3n99 n GLY 138 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3n99 n LEU 139 N 0.00 4.40 -4.06 0.99 7.94 -0.91 -4.98 117.00 120.38 3n99 n LEU 139 Ca 0.00 1.16 -0.17 0.00 -1.11 0.00 0.00 56.01 55.89 3n99 n LEU 139 Cb 0.00 -1.59 -0.13 0.00 0.53 0.00 0.00 43.42 42.22 3n99 n LEU 139 CO 0.00 0.13 -0.43 -0.54 -1.11 0.00 0.00 177.39 175.44 3n99 s LYS 140 N -0.85 0.68 -0.53 1.96 1.02 -1.26 -4.44 119.74 116.33 3n99 s LYS 140 Ca 0.62 -0.55 -0.21 0.00 0.02 0.00 0.00 55.97 55.85 3n99 s LYS 140 Cb -0.50 -0.62 0.05 0.00 -0.52 0.00 0.00 37.83 36.25 3n99 s LYS 140 CO 0.52 0.15 0.74 -0.51 -0.92 0.00 0.00 175.35 175.33 3n99 s LEU 141 N -0.85 4.66 0.36 3.17 1.43 -1.26 -2.83 118.68 123.36 3n99 s LEU 141 Ca -0.01 -0.73 0.12 0.00 -1.03 0.00 0.00 54.13 52.48 3n99 s LEU 141 Cb -0.06 -2.58 0.69 0.00 0.03 0.00 0.00 46.19 44.27 3n99 s LEU 141 CO 0.00 -1.02 1.81 -0.07 0.23 0.00 0.00 176.35 177.31 3n99 h LEU 142 N 10.18 0.04 -0.32 1.79 3.38 -1.47 -1.73 115.31 127.18 3n99 h LEU 142 Ca -0.27 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3n99 h LEU 142 Cb 1.09 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.83 3n99 h LEU 142 CO 1.01 0.41 -0.06 0.47 0.09 0.00 0.00 178.44 180.36 3n99 n ASP 143 N -4.10 0.56 -3.20 -0.43 8.00 -1.26 -4.47 116.55 111.66 3n99 n ASP 143 Ca -0.02 -0.86 -0.23 0.00 0.71 0.00 0.00 54.79 54.39 3n99 n ASP 143 Cb 0.41 -0.04 -0.05 0.00 -0.02 0.00 0.00 41.12 41.41 3n99 n ASP 143 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3n99 n HIS 144 N -0.74 0.70 0.33 1.24 8.25 -0.65 -4.97 115.22 119.38 3n99 n HIS 144 Ca 0.18 -3.76 0.21 0.00 -0.26 0.00 0.00 57.72 54.08 3n99 n HIS 144 Cb 0.25 -0.41 1.12 0.00 1.12 0.00 0.00 29.99 32.07 3n99 n HIS 144 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3n99 h PRO 145 N 3.59 0.00 -0.45 -0.41 0.13 -1.78 -0.47 132.00 132.62 3n99 h PRO 145 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 3n99 h PRO 145 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 3n99 h PRO 145 CO 0.55 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.07 3n99 n ASP 146 N -3.25 2.98 -4.38 1.44 8.00 -1.26 -4.76 116.55 115.32 3n99 n ASP 146 Ca -0.03 -1.95 -0.36 0.00 0.71 0.00 0.00 54.79 53.17 3n99 n ASP 146 Cb 0.11 -0.29 -0.13 0.00 -0.02 0.00 0.00 41.12 40.78 3n99 n ASP 146 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3n99 s VAL 147 N -1.41 3.87 -0.10 2.53 1.01 -0.18 -4.58 120.40 121.53 3n99 s VAL 147 Ca 0.38 -0.37 -0.09 0.00 0.00 0.00 0.00 61.98 61.90 3n99 s VAL 147 Cb 0.21 -2.81 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 3n99 s VAL 147 CO 0.28 0.35 0.21 -0.54 0.00 0.00 0.00 175.10 175.40 3n99 s LYS 148 N 1.54 3.66 0.20 2.72 -0.14 -0.41 -4.61 119.74 122.72 3n99 s LYS 148 Ca 0.06 -0.00 0.11 0.00 -1.36 0.00 0.00 55.97 54.78 3n99 s LYS 148 Cb -0.15 -3.23 -0.04 0.00 -1.68 0.00 0.00 37.83 32.72 3n99 s LYS 148 CO 0.01 0.68 -0.23 0.14 -0.76 0.00 0.00 175.35 175.19 3n99 s VAL 149 N -0.83 2.32 0.06 3.17 -7.23 -1.26 -1.06 120.40 115.57 3n99 s VAL 149 Ca 0.16 -2.07 -0.27 0.00 -1.81 0.00 0.00 61.98 57.99 3n99 s VAL 149 Cb -0.13 -2.12 0.09 0.00 0.56 0.00 0.00 36.38 34.78 3n99 s VAL 149 CO 0.06 -0.17 0.96 0.00 -0.31 0.00 0.00 175.10 175.63 3n99 s MET 150 N -2.79 0.94 -1.90 4.82 0.23 -0.77 -4.68 119.30 115.14 3n99 s MET 150 Ca 0.21 -0.45 0.00 0.00 -1.03 0.00 0.00 55.69 54.43 3n99 s MET 150 Cb -0.07 0.37 0.00 0.00 -1.53 0.00 0.00 34.83 33.59 3n99 s MET 150 CO 0.10 -0.42 0.00 0.09 -2.03 0.00 0.00 175.02 172.76 3n99 n ASN 151 N -0.35 -5.11 -3.79 -1.18 3.02 -1.26 -4.25 115.26 102.34 3n99 n ASN 151 Ca -0.07 0.35 -0.14 0.00 -0.03 0.00 0.00 54.58 54.69 3n99 n ASN 151 Cb 0.61 -4.47 -0.15 0.00 -0.61 0.00 0.00 39.78 35.15 3n99 n ASN 151 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 3n99 s ILE 152 N -2.69 -0.05 0.14 2.41 1.10 -1.26 -1.71 121.20 119.14 3n99 s ILE 152 Ca 0.00 0.17 -0.31 0.00 -0.51 0.00 0.00 60.65 60.00 3n99 s ILE 152 Cb 0.00 -0.09 -0.10 0.00 0.15 0.00 0.00 42.46 42.42 3n99 s ILE 152 CO 0.00 0.07 1.67 -0.62 -2.11 0.00 0.00 174.94 173.95 3n99 s ASP 153 N 0.89 6.52 0.44 4.50 -1.08 -0.30 -4.53 116.67 123.11 3n99 s ASP 153 Ca -0.07 2.65 0.10 0.00 -0.52 0.00 0.00 52.55 54.71 3n99 s ASP 153 Cb -0.10 -2.58 0.97 0.00 -1.46 0.00 0.00 42.92 39.75 3n99 s ASP 153 CO -0.03 -0.90 2.08 -0.65 0.52 0.00 0.00 175.17 176.19 3n99 h PRO 154 N 7.54 0.37 -0.34 4.34 0.11 -1.90 0.04 132.00 142.16 3n99 h PRO 154 Ca -0.43 -0.02 -0.16 0.00 0.11 0.00 0.00 66.00 65.49 3n99 h PRO 154 Cb 1.21 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3n99 h PRO 154 CO 0.93 0.26 -0.44 -0.44 -0.21 0.00 0.00 178.00 178.10 3n99 h ASP 155 N 0.38 0.94 -0.61 -2.05 3.32 -1.96 -2.87 116.42 113.57 3n99 h ASP 155 Ca 0.10 -0.45 -0.09 0.00 0.02 0.00 0.00 57.03 56.61 3n99 h ASP 155 Cb -0.03 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.23 3n99 h ASP 155 CO -0.02 1.24 0.04 0.25 -1.72 0.00 0.00 179.24 179.02 3n99 h LEU 156 N 0.70 1.04 -0.81 1.55 5.85 -1.69 -2.94 115.31 119.00 3n99 h LEU 156 Ca 0.05 -0.28 0.16 0.00 0.84 0.00 0.00 57.88 58.65 3n99 h LEU 156 Cb 1.02 -0.28 -0.10 0.00 0.37 0.00 0.00 40.66 41.68 3n99 h LEU 156 CO 0.10 1.07 0.37 0.15 -0.34 0.00 0.00 178.44 179.78 3n99 h PHE 157 N 0.99 0.63 0.00 1.25 3.57 -0.91 0.39 116.94 122.85 3n99 h PHE 157 Ca 0.18 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.72 3n99 h PHE 157 Cb 0.51 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.10 3n99 h PHE 157 CO 0.04 0.09 0.00 0.39 -2.23 0.00 0.00 178.31 176.59 3n99 n GLU 158 N -4.96 0.08 -0.05 1.11 1.02 -1.09 -2.53 120.64 114.21 3n99 n GLU 158 Ca 0.17 0.38 0.10 0.00 -0.02 0.00 0.00 57.16 57.78 3n99 n GLU 158 Cb 0.46 -1.67 0.11 0.00 -0.02 0.00 0.00 31.44 30.33 3n99 n GLU 158 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3n99 n LYS 159 N -1.82 1.98 0.00 3.49 5.02 0.12 -4.51 118.16 122.44 3n99 n LYS 159 Ca 0.02 -1.84 0.15 0.00 -2.02 0.00 0.00 58.31 54.62 3n99 n LYS 159 Cb 0.16 -1.41 0.76 0.00 -0.02 0.00 0.00 35.03 34.52 3n99 n LYS 159 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3n99 n LEU 160 N 1.19 0.02 0.00 -0.35 4.77 -1.05 -4.88 117.00 116.70 3n99 n LEU 160 Ca 0.13 0.26 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 3n99 n LEU 160 Cb 0.52 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 3n99 n LEU 160 CO 0.13 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.80 3n99 n GLY 161 N 1.27 0.47 3.72 -0.72 0.00 -1.26 -4.75 105.19 103.91 3n99 n GLY 161 Ca 0.15 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 45.00 3n99 n GLY 161 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3n99 s ILE 162 N -2.00 3.98 -0.12 -0.61 1.01 -1.26 -4.56 121.20 117.63 3n99 s ILE 162 Ca 0.00 1.44 0.03 0.00 0.00 0.00 0.00 60.65 62.12 3n99 s ILE 162 Cb 0.00 -3.92 0.00 0.00 0.01 0.00 0.00 42.46 38.55 3n99 s ILE 162 CO 0.00 0.12 -0.23 -1.10 0.00 0.00 0.00 174.94 173.74 3n99 s GLN 163 N 0.95 3.05 -0.09 2.79 -0.21 -0.88 -4.98 119.66 120.30 3n99 s GLN 163 Ca 0.58 -0.86 -0.21 0.00 0.02 0.00 0.00 55.36 54.89 3n99 s GLN 163 Cb -0.30 -2.37 -0.04 0.00 1.00 0.00 0.00 33.01 31.30 3n99 s GLN 163 CO 0.30 0.11 0.59 -2.00 -2.12 0.00 0.00 175.29 172.16 3n99 s GLU 164 N 0.53 4.39 -0.22 2.91 2.12 -1.26 -0.39 118.70 126.78 3n99 s GLU 164 Ca -0.14 0.67 -0.10 0.00 0.36 0.00 0.00 54.97 55.77 3n99 s GLU 164 Cb -0.17 -3.44 0.09 0.00 0.26 0.00 0.00 34.13 30.87 3n99 s GLU 164 CO 0.05 0.13 0.50 0.21 -0.54 0.00 0.00 175.26 175.61 3n99 s LYS 165 N 0.66 0.46 -1.54 4.30 2.20 -0.08 -4.92 119.74 120.82 3n99 s LYS 165 Ca 0.32 1.06 -0.10 0.00 -0.36 0.00 0.00 55.97 56.89 3n99 s LYS 165 Cb -0.17 0.27 0.08 0.00 -1.51 0.00 0.00 37.83 36.50 3n99 s LYS 165 CO 0.14 -0.20 0.68 0.09 -0.36 0.00 0.00 175.35 175.71 3n99 n ASN 166 N 4.85 -2.35 0.00 1.43 3.02 -1.26 -1.28 115.26 119.68 3n99 n ASN 166 Ca -0.16 -0.95 0.00 0.00 -0.03 0.00 0.00 54.58 53.44 3n99 n ASN 166 Cb 0.53 -3.16 0.00 0.00 -0.61 0.00 0.00 39.78 36.54 3n99 n ASN 166 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3n99 n GLY 167 N -1.69 0.60 3.63 7.41 0.00 -1.26 -5.02 105.19 108.87 3n99 n GLY 167 Ca -0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 3n99 n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n99 s LYS 168 N -0.41 2.46 -0.37 1.61 1.02 -0.40 -4.96 119.74 118.69 3n99 s LYS 168 Ca 0.00 -0.84 -0.12 0.00 0.02 0.00 0.00 55.97 55.03 3n99 s LYS 168 Cb 0.00 -2.48 0.01 0.00 -0.52 0.00 0.00 37.83 34.84 3n99 s LYS 168 CO 0.00 0.56 0.24 0.42 -0.92 0.00 0.00 175.35 175.64 3n99 s ILE 169 N -1.18 4.97 -0.16 2.17 1.01 -0.06 -0.90 121.20 127.05 3n99 s ILE 169 Ca 0.22 -0.56 -0.18 0.00 0.00 0.00 0.00 60.65 60.13 3n99 s ILE 169 Cb -0.11 -3.68 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 3n99 s ILE 169 CO 0.14 -0.15 0.48 -1.00 0.00 0.00 0.00 174.94 174.40 3n99 s HIS 170 N 1.65 3.44 -0.16 3.97 3.76 0.48 0.03 115.29 128.46 3n99 s HIS 170 Ca 0.04 0.80 0.00 0.00 -0.15 0.00 0.00 55.06 55.76 3n99 s HIS 170 Cb -0.18 -2.59 0.03 0.00 1.11 0.00 0.00 32.58 30.95 3n99 s HIS 170 CO 0.09 0.05 -0.13 0.08 -0.85 0.00 0.00 174.74 173.98 3n99 s VAL 171 N 1.08 1.52 0.07 -0.90 1.01 -0.38 -2.07 120.40 120.74 3n99 s VAL 171 Ca 0.24 -0.68 -0.31 0.00 0.00 0.00 0.00 61.98 61.23 3n99 s VAL 171 Cb -0.15 -1.48 -0.08 0.00 0.00 0.00 0.00 36.38 34.67 3n99 s VAL 171 CO 0.09 0.38 1.51 -2.84 0.00 0.00 0.00 175.10 174.24 3n99 s PRO 172 N 1.49 4.25 0.10 2.72 0.02 -1.26 -0.39 135.00 141.93 3n99 s PRO 172 Ca 0.04 2.17 0.02 0.00 0.02 0.00 0.00 61.00 63.24 3n99 s PRO 172 Cb -0.14 -3.46 -0.04 0.00 0.02 0.00 0.00 34.50 30.88 3n99 s PRO 172 CO -0.10 -0.61 -0.06 0.14 -0.33 0.00 0.00 177.00 176.04 3n99 s VAL 173 N 2.06 0.67 -0.31 3.83 -7.23 -0.20 -4.84 120.40 114.39 3n99 s VAL 173 Ca 0.68 -1.93 0.23 0.00 -1.81 0.00 0.00 61.98 59.15 3n99 s VAL 173 Cb -0.37 -1.70 -0.06 0.00 0.56 0.00 0.00 36.38 34.82 3n99 s VAL 173 CO 0.30 -0.86 1.00 1.33 -0.31 0.00 0.00 175.10 176.55 3n99 n VAL 174 N -0.05 0.44 -3.55 1.32 0.24 -0.07 -0.82 118.33 115.85 3n99 n VAL 174 Ca -0.12 -0.47 -0.16 0.00 -2.04 0.00 0.00 64.34 61.56 3n99 n VAL 174 Cb 0.61 -0.19 -0.06 0.00 -1.47 0.00 0.00 33.84 32.73 3n99 n VAL 174 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3n99 s ALA 175 N -3.34 -1.52 -0.24 2.33 0.00 -1.26 -4.75 121.76 112.98 3n99 s ALA 175 Ca -0.00 0.92 -0.01 0.00 0.00 0.00 0.00 51.96 52.87 3n99 s ALA 175 Cb 0.11 0.22 0.03 0.00 0.00 0.00 0.00 23.12 23.48 3n99 s ALA 175 CO 0.80 -0.44 -0.08 0.15 0.00 0.00 0.00 175.76 176.19 3n99 s LYS 176 N -1.85 2.80 -0.26 0.00 1.02 -1.26 -1.76 119.74 118.43 3n99 s LYS 176 Ca -0.08 -0.99 -0.09 0.00 0.02 0.00 0.00 55.97 54.82 3n99 s LYS 176 Cb -0.01 -2.93 -0.04 0.00 -0.52 0.00 0.00 37.83 34.33 3n99 s LYS 176 CO 0.03 -0.39 0.13 0.42 -0.92 0.00 0.00 175.35 174.63 3n99 s ILE 177 N 1.30 4.89 0.67 2.17 1.01 0.67 -4.93 121.20 126.97 3n99 s ILE 177 Ca -0.00 0.03 -0.16 0.00 0.00 0.00 0.00 60.65 60.51 3n99 s ILE 177 Cb -0.16 -3.31 0.00 0.00 0.01 0.00 0.00 42.46 39.00 3n99 s ILE 177 CO -0.06 0.30 1.17 -2.84 0.00 0.00 0.00 174.94 173.52 3n99 s PRO 178 N 1.59 2.61 0.25 2.79 0.02 -1.26 -0.60 135.00 140.40 3n99 s PRO 178 Ca 0.07 1.65 -0.04 0.00 0.02 0.00 0.00 61.00 62.69 3n99 s PRO 178 Cb -0.15 -1.90 0.50 0.00 0.02 0.00 0.00 34.50 32.97 3n99 s PRO 178 CO 0.07 -1.45 1.68 0.00 -0.33 0.00 0.00 177.00 176.98 3n99 h ALA 179 N 0.16 1.02 0.00 -1.55 0.00 -1.84 -1.20 119.26 115.85 3n99 h ALA 179 Ca -0.48 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3n99 h ALA 179 Cb 1.28 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.30 3n99 h ALA 179 CO 0.53 -0.34 0.00 -2.39 0.00 0.00 0.00 179.25 177.04 3n99 n HIS 180 N -5.15 0.70 1.64 0.00 1.44 -1.26 -1.27 115.22 111.31 3n99 n HIS 180 Ca 0.15 0.29 0.12 0.00 -2.01 0.00 0.00 57.72 56.27 3n99 n HIS 180 Cb 0.49 -0.96 0.56 0.00 0.12 0.00 0.00 29.99 30.20 3n99 n HIS 180 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 3n99 n MET 181 N -2.15 1.38 -3.72 -1.40 2.00 -0.45 -4.88 117.12 107.90 3n99 n MET 181 Ca 0.02 -0.57 -0.34 0.00 0.00 0.00 0.00 57.70 56.81 3n99 n MET 181 Cb 0.20 -1.40 -0.05 0.00 0.00 0.00 0.00 33.22 31.96 3n99 n MET 181 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 175.97 174.33 3n99 s MET 182 N -1.93 3.61 0.00 0.03 -1.94 -0.40 -0.15 119.30 118.53 3n99 s MET 182 Ca 0.35 -0.05 0.00 0.00 -1.71 0.00 0.00 55.69 54.28 3n99 s MET 182 Cb 0.18 -3.04 0.00 0.00 2.01 0.00 0.00 34.83 33.98 3n99 s MET 182 CO 0.28 0.61 0.00 0.41 -0.01 0.00 0.00 175.02 176.31 3n99 n GLY 183 N 0.92 3.03 3.67 -0.03 0.00 0.12 -4.84 105.19 108.06 3n99 n GLY 183 Ca -0.09 -0.37 -0.50 0.00 0.00 0.00 0.00 46.02 45.06 3n99 n GLY 183 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3n99 n SER 184 N 0.00 3.00 0.00 1.61 2.88 -0.28 -1.57 113.62 119.26 3n99 n SER 184 Ca 0.00 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.57 3n99 n SER 184 Cb 0.00 -1.33 0.00 0.00 -0.75 0.00 0.00 64.21 62.13 3n99 n SER 184 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3n99 n GLY 185 N 3.94 2.28 3.66 0.46 0.00 -1.26 -1.00 105.19 113.28 3n99 n GLY 185 Ca 0.21 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.79 3n99 n GLY 185 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3n99 n ILE 186 N -0.86 1.06 -0.09 -0.61 5.41 -0.61 -1.46 119.36 122.20 3n99 n ILE 186 Ca 0.00 -0.26 0.00 0.00 1.00 0.00 0.00 62.75 63.49 3n99 n ILE 186 Cb 0.00 -1.41 0.00 0.00 -0.71 0.00 0.00 39.64 37.52 3n99 n ILE 186 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3n99 n GLY 187 N 2.01 0.91 3.58 7.39 0.00 0.26 -5.00 105.19 114.34 3n99 n GLY 187 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 3n99 n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n99 n ALA 188 N -1.25 -0.11 0.22 4.61 0.00 -0.54 -4.72 120.51 118.72 3n99 n ALA 188 Ca 0.00 -0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.54 3n99 n ALA 188 Cb 0.00 -2.05 0.41 0.00 0.00 0.00 0.00 19.45 17.81 3n99 n ALA 188 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3n99 h SER 189 N 0.43 0.00 -3.39 0.00 4.64 -1.92 -1.89 113.55 111.40 3n99 h SER 189 Ca -0.48 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 60.54 3n99 h SER 189 Cb 1.37 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 63.12 3n99 h SER 189 CO 0.50 0.21 -0.68 -0.55 -0.87 0.00 0.00 176.83 175.44 3n99 s SER 190 N -6.16 0.32 0.27 4.97 0.15 -1.26 -3.61 113.70 108.38 3n99 s SER 190 Ca 0.02 0.16 0.20 0.00 0.70 0.00 0.00 55.95 57.03 3n99 s SER 190 Cb 0.09 0.03 1.02 0.00 -1.71 0.00 0.00 66.02 65.46 3n99 s SER 190 CO 0.64 -0.17 1.62 -1.54 1.20 0.00 0.00 173.24 174.99 3n99 n SER 191 N 4.57 0.54 0.02 5.45 3.41 -0.49 -2.06 113.62 125.05 3n99 n SER 191 Ca -0.20 0.71 0.12 0.00 -0.26 0.00 0.00 58.87 59.25 3n99 n SER 191 Cb 0.50 -0.80 0.53 0.00 -0.26 0.00 0.00 64.21 64.18 3n99 n SER 191 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3n99 n ALA 192 N -1.75 2.16 -0.82 7.33 0.00 -1.26 -4.10 120.51 122.07 3n99 n ALA 192 Ca -0.00 -0.07 0.01 0.00 0.00 0.00 0.00 53.44 53.38 3n99 n ALA 192 Cb 0.09 -1.42 0.02 0.00 0.00 0.00 0.00 19.45 18.14 3n99 n ALA 192 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3n99 n SER 193 N -1.61 1.02 -3.47 0.00 3.41 -0.88 -4.18 113.62 107.91 3n99 n SER 193 Ca 0.06 -1.80 -0.12 0.00 -0.26 0.00 0.00 58.87 56.76 3n99 n SER 193 Cb 0.31 -0.09 -0.03 0.00 -0.26 0.00 0.00 64.21 64.14 3n99 n SER 193 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3n99 s THR 194 N -0.76 0.02 0.55 6.66 -1.32 -1.24 -4.67 115.64 114.87 3n99 s THR 194 Ca 0.05 -0.14 0.02 0.00 -1.21 0.00 0.00 61.69 60.41 3n99 s THR 194 Cb 0.04 -1.04 0.04 0.00 -1.51 0.00 0.00 72.50 70.03 3n99 s THR 194 CO 0.00 -0.08 0.77 1.51 -2.21 0.00 0.00 174.62 174.62 3n99 s ASP 195 N -2.74 5.26 0.13 8.08 -4.77 -1.26 -4.65 116.67 116.72 3n99 s ASP 195 Ca 0.01 -0.08 -0.04 0.00 -3.30 0.00 0.00 52.55 49.13 3n99 s ASP 195 Cb -0.00 -0.79 -0.03 0.00 -1.09 0.00 0.00 42.92 41.02 3n99 s ASP 195 CO -0.12 -1.15 0.14 -0.72 0.70 0.00 0.00 175.17 174.01 3n99 s TYR 196 N -2.74 0.59 -0.17 2.11 1.13 -0.14 -4.68 117.35 113.45 3n99 s TYR 196 Ca 0.58 -0.99 -0.09 0.00 -1.41 0.00 0.00 57.07 55.15 3n99 s TYR 196 Cb -0.10 -0.28 -0.05 0.00 -1.10 0.00 0.00 41.96 40.43 3n99 s TYR 196 CO 0.38 -0.57 0.15 -0.51 -2.51 0.00 0.00 175.55 172.48 3n99 s ASP 197 N -2.99 6.28 -0.43 -0.18 1.11 -0.17 0.25 116.67 120.55 3n99 s ASP 197 Ca 0.18 0.33 -0.29 0.00 0.18 0.00 0.00 52.55 52.94 3n99 s ASP 197 Cb 0.06 -2.09 0.02 0.00 1.07 0.00 0.00 42.92 41.98 3n99 s ASP 197 CO -0.02 0.24 1.16 -0.63 1.18 0.00 0.00 175.17 177.11 3n99 s ILE 198 N -0.05 4.24 -0.56 0.77 1.01 -0.54 0.10 121.20 126.16 3n99 s ILE 198 Ca 0.11 1.31 -0.03 0.00 0.00 0.00 0.00 60.65 62.04 3n99 s ILE 198 Cb -0.11 -4.51 0.21 0.00 0.01 0.00 0.00 42.46 38.06 3n99 s ILE 198 CO 0.00 -0.85 2.36 1.15 0.00 0.00 0.00 174.94 177.60 3n99 n MET 199 N 7.64 2.42 -3.23 2.79 0.00 0.79 -2.82 117.12 124.71 3n99 n MET 199 Ca 0.13 -2.63 -0.39 0.00 0.00 0.00 0.00 57.70 54.81 3n99 n MET 199 Cb 0.48 -2.10 -0.06 0.00 0.00 0.00 0.00 33.22 31.54 3n99 n MET 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3n99 s ALA 200 N -2.61 3.48 0.31 3.17 0.00 -1.26 -4.87 121.76 119.99 3n99 s ALA 200 Ca 0.53 -0.22 0.06 0.00 0.00 0.00 0.00 51.96 52.34 3n99 s ALA 200 Cb 0.39 -2.78 0.51 0.00 0.00 0.00 0.00 23.12 21.25 3n99 s ALA 200 CO -0.21 -0.21 1.75 0.77 0.00 0.00 0.00 175.76 177.86 3n99 h SER 201 N 7.03 0.28 -4.74 0.00 0.02 -1.90 -3.45 113.55 110.80 3n99 h SER 201 Ca -0.38 -0.10 -0.28 0.00 -0.84 0.00 0.00 61.79 60.19 3n99 h SER 201 Cb 1.17 -0.08 -0.21 0.00 0.14 0.00 0.00 62.40 63.42 3n99 h SER 201 CO 0.75 0.60 -0.74 0.20 -1.14 0.00 0.00 176.83 176.51 3n99 s ASN 202 N -6.87 0.93 0.39 3.07 0.01 -1.26 -5.00 114.94 106.22 3n99 s ASN 202 Ca -0.05 -0.56 0.07 0.00 -0.71 0.00 0.00 52.86 51.60 3n99 s ASN 202 Cb 0.14 0.03 0.80 0.00 0.41 0.00 0.00 41.25 42.62 3n99 s ASN 202 CO 0.77 -0.20 1.99 1.55 -1.51 0.00 0.00 177.10 179.70 3n99 h PRO 203 N 4.45 0.48 0.00 -0.60 0.13 -1.87 -1.83 132.00 132.76 3n99 h PRO 203 Ca -0.36 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 64.70 3n99 h PRO 203 Cb 1.20 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 3n99 h PRO 203 CO 0.41 0.40 -0.03 0.93 -0.23 0.00 0.00 178.00 179.48 3n99 h GLU 204 N 0.48 0.00 0.00 0.86 3.07 -1.69 0.22 114.58 117.52 3n99 h GLU 204 Ca 0.12 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.98 3n99 h GLU 204 Cb 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.01 3n99 h GLU 204 CO -0.01 0.03 0.04 -0.44 -1.40 0.00 0.00 179.01 177.23 3n99 h ASP 205 N 0.00 0.00 -0.42 1.42 3.32 -1.61 0.13 116.42 119.25 3n99 h ASP 205 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3n99 h ASP 205 Cb 0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.60 3n99 h ASP 205 CO 0.00 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.70 3n99 n LEU 206 N -3.02 3.40 -0.99 1.55 4.77 0.75 -4.97 117.00 118.49 3n99 n LEU 206 Ca -0.03 -1.62 -0.09 0.00 -0.03 0.00 0.00 56.01 54.24 3n99 n LEU 206 Cb 0.11 -0.28 -0.01 0.00 -2.33 0.00 0.00 43.42 40.91 3n99 n LEU 206 CO 0.19 0.77 -0.11 0.61 -1.33 0.00 0.00 177.39 177.51 3n99 n GLY 207 N 1.35 0.17 3.22 -0.72 0.00 0.45 -4.86 105.19 104.79 3n99 n GLY 207 Ca 0.19 -0.52 -0.13 0.00 0.00 0.00 0.00 46.02 45.55 3n99 n GLY 207 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3n99 s VAL 208 N -2.44 0.99 -0.11 1.61 -7.23 -1.07 -4.98 120.40 107.17 3n99 s VAL 208 Ca 0.00 -1.97 0.14 0.00 -1.81 0.00 0.00 61.98 58.34 3n99 s VAL 208 Cb 0.00 -1.73 -0.00 0.00 0.56 0.00 0.00 36.38 35.20 3n99 s VAL 208 CO 0.00 -0.76 1.33 0.00 -0.31 0.00 0.00 175.10 175.36 3n99 h ALA 209 N 2.94 0.62 -2.66 1.32 0.00 -1.96 -2.15 119.26 117.37 3n99 h ALA 209 Ca -0.36 -0.58 -0.06 0.00 0.00 0.00 0.00 54.91 53.90 3n99 h ALA 209 Cb 1.18 -0.04 -0.13 0.00 0.00 0.00 0.00 17.79 18.80 3n99 h ALA 209 CO 0.62 0.76 -0.19 0.34 0.00 0.00 0.00 179.25 180.79 3n99 s ASP 210 N -6.40 -0.10 -0.05 0.00 2.15 -1.26 -4.79 116.67 106.21 3n99 s ASP 210 Ca 0.03 -0.46 -0.02 0.00 0.43 0.00 0.00 52.55 52.53 3n99 s ASP 210 Cb 0.08 0.43 0.04 0.00 -0.30 0.00 0.00 42.92 43.16 3n99 s ASP 210 CO 0.77 -0.81 0.11 -0.22 -0.17 0.00 0.00 175.17 174.84 3n99 s LEU 211 N -2.83 0.65 0.01 -1.34 2.96 -1.26 -4.99 118.68 111.88 3n99 s LEU 211 Ca 0.04 0.21 0.02 0.00 -0.22 0.00 0.00 54.13 54.19 3n99 s LEU 211 Cb 0.03 0.19 -0.04 0.00 0.50 0.00 0.00 46.19 46.87 3n99 s LEU 211 CO -0.11 -0.17 -0.02 -0.54 -1.32 0.00 0.00 176.35 174.20 3n99 s LYS 212 N 1.40 2.70 0.14 1.98 1.02 -1.26 -1.44 119.74 124.28 3n99 s LYS 212 Ca -0.06 -0.66 -0.34 0.00 0.02 0.00 0.00 55.97 54.92 3n99 s LYS 212 Cb -0.12 -2.61 -0.14 0.00 -0.52 0.00 0.00 37.83 34.43 3n99 s LYS 212 CO -0.05 0.61 1.54 1.28 -0.92 0.00 0.00 175.35 177.82 3n99 n LEU 213 N 1.35 2.83 0.00 3.17 4.77 0.82 -1.04 117.00 128.90 3n99 n LEU 213 Ca -0.14 1.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.92 3n99 n LEU 213 Cb 0.53 -1.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.24 3n99 n LEU 213 CO 0.34 -0.42 0.00 0.61 -1.33 0.00 0.00 177.39 176.58 3n99 n GLY 214 N 3.28 0.74 3.77 -0.72 0.00 0.26 0.32 105.19 112.85 3n99 n GLY 214 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 3n99 n GLY 214 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3n99 s ASP 215 N -2.19 6.28 -0.17 1.61 1.01 -0.21 -1.26 116.67 121.74 3n99 s ASP 215 Ca 0.00 2.43 -0.18 0.00 0.71 0.00 0.00 52.55 55.51 3n99 s ASP 215 Cb 0.00 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.28 3n99 s ASP 215 CO 0.00 -0.85 0.50 -0.63 0.21 0.00 0.00 175.17 174.40 3n99 s ILE 216 N -1.41 5.14 0.21 0.77 1.01 -0.52 -1.14 121.20 125.25 3n99 s ILE 216 Ca 0.60 0.94 0.08 0.00 0.00 0.00 0.00 60.65 62.27 3n99 s ILE 216 Cb -0.32 -3.83 -0.05 0.00 0.01 0.00 0.00 42.46 38.27 3n99 s ILE 216 CO 0.40 0.23 -0.14 0.68 0.00 0.00 0.00 174.94 176.11 3n99 s VAL 217 N 1.29 1.75 -0.05 2.92 -7.23 -0.23 -0.89 120.40 117.96 3n99 s VAL 217 Ca 0.24 -2.22 0.02 0.00 -1.81 0.00 0.00 61.98 58.22 3n99 s VAL 217 Cb -0.15 -2.05 -0.03 0.00 0.56 0.00 0.00 36.38 34.71 3n99 s VAL 217 CO 0.10 -0.59 -0.10 0.00 -0.31 0.00 0.00 175.10 174.19 3n99 s ALA 218 N -2.97 2.84 -0.26 1.32 0.00 -0.72 -1.28 121.76 120.69 3n99 s ALA 218 Ca 0.23 -0.95 -0.01 0.00 0.00 0.00 0.00 51.96 51.22 3n99 s ALA 218 Cb -0.01 -1.09 0.03 0.00 0.00 0.00 0.00 23.12 22.05 3n99 s ALA 218 CO 0.07 0.57 -0.05 0.42 0.00 0.00 0.00 175.76 176.77 3n99 s ILE 219 N -0.81 2.86 0.18 0.00 1.01 0.16 -0.24 121.20 124.37 3n99 s ILE 219 Ca 0.13 -1.13 -0.30 0.00 0.00 0.00 0.00 60.65 59.35 3n99 s ILE 219 Cb -0.11 -2.50 -0.08 0.00 0.01 0.00 0.00 42.46 39.78 3n99 s ILE 219 CO 0.02 0.13 0.99 -1.10 0.00 0.00 0.00 174.94 174.97 3n99 s GLN 220 N 1.30 4.74 -1.42 2.79 -0.21 0.23 -1.51 119.66 125.59 3n99 s GLN 220 Ca -0.01 1.54 0.00 0.00 0.02 0.00 0.00 55.36 56.91 3n99 s GLN 220 Cb -0.17 -3.31 0.00 0.00 1.00 0.00 0.00 33.01 30.53 3n99 s GLN 220 CO -0.04 0.31 0.00 -0.25 -2.12 0.00 0.00 175.29 173.19 3n99 n ASP 221 N 2.10 -4.64 -4.17 5.90 8.00 -0.17 -2.53 116.55 121.04 3n99 n ASP 221 Ca 0.00 0.16 -0.31 0.00 0.71 0.00 0.00 54.79 55.36 3n99 n ASP 221 Cb 0.47 -3.63 -0.17 0.00 -0.02 0.00 0.00 41.12 37.77 3n99 n ASP 221 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 3n99 s HIS 222 N -2.66 2.34 -0.19 1.24 3.76 -1.25 -0.84 115.29 117.69 3n99 s HIS 222 Ca 0.00 -0.98 -0.11 0.00 -0.15 0.00 0.00 55.06 53.82 3n99 s HIS 222 Cb 0.00 -1.59 -0.05 0.00 1.11 0.00 0.00 32.58 32.05 3n99 s HIS 222 CO 0.00 -0.42 0.17 0.34 -0.85 0.00 0.00 174.74 173.98 3n99 s ASP 223 N 0.49 6.25 -0.19 1.40 2.15 0.35 -3.39 116.67 123.74 3n99 s ASP 223 Ca -0.16 0.28 0.14 0.00 0.43 0.00 0.00 52.55 53.24 3n99 s ASP 223 Cb -0.17 -2.11 0.44 0.00 -0.30 0.00 0.00 42.92 40.77 3n99 s ASP 223 CO 0.06 0.15 1.20 0.59 -0.17 0.00 0.00 175.17 177.00 3n99 n ASN 224 N 3.59 2.20 -0.16 -0.34 3.02 -1.26 -2.07 115.26 120.23 3n99 n ASN 224 Ca -0.15 -3.37 -0.05 0.00 -0.03 0.00 0.00 54.58 50.97 3n99 n ASN 224 Cb 0.52 -0.44 0.12 0.00 -0.61 0.00 0.00 39.78 39.37 3n99 n ASN 224 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3n99 h SER 225 N 1.35 0.88 0.00 6.41 0.02 -1.94 -3.43 113.55 116.84 3n99 h SER 225 Ca 0.02 -0.20 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 3n99 h SER 225 Cb 1.30 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.61 3n99 h SER 225 CO 0.18 0.90 0.00 -1.22 -1.14 0.00 0.00 176.83 175.55 3n99 n TYR 226 N -4.22 0.00 -1.67 3.45 4.01 -1.26 -4.92 117.16 112.54 3n99 n TYR 226 Ca 0.04 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.48 3n99 n TYR 226 Cb 0.28 0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.42 3n99 n TYR 226 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 3n99 s GLY 227 N -0.67 1.59 -0.04 2.72 0.00 -1.24 -1.39 107.32 108.30 3n99 s GLY 227 Ca 0.00 -0.48 -0.24 0.00 0.00 0.00 0.00 44.72 44.00 3n99 s GLY 227 CO 0.00 0.01 0.73 0.14 0.00 0.00 0.00 173.10 173.99 3n99 s VAL 228 N -3.35 4.99 -0.48 1.40 1.01 -0.71 -4.47 120.40 118.79 3n99 s VAL 228 Ca 0.62 1.52 -0.03 0.00 0.00 0.00 0.00 61.98 64.09 3n99 s VAL 228 Cb -0.13 -4.07 0.00 0.00 0.00 0.00 0.00 36.38 32.18 3n99 s VAL 228 CO 0.52 0.26 0.42 0.61 0.00 0.00 0.00 175.10 176.91 3n99 n GLY 229 N 2.97 0.39 3.63 4.51 0.00 -1.24 -0.57 105.19 114.87 3n99 n GLY 229 Ca -0.01 -0.34 -0.43 0.00 0.00 0.00 0.00 46.02 45.25 3n99 n GLY 229 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3n99 s LYS 230 N -5.35 3.79 0.05 1.61 2.47 -0.88 -4.78 119.74 116.64 3n99 s LYS 230 Ca 0.18 1.73 -0.31 0.00 -1.56 0.00 0.00 55.97 56.01 3n99 s LYS 230 Cb -0.08 -4.05 -0.07 0.00 -1.46 0.00 0.00 37.83 32.16 3n99 s LYS 230 CO 0.26 -1.31 1.51 -0.47 0.16 0.00 0.00 175.35 175.50 3n99 s TYR 231 N 5.29 2.73 -0.19 4.03 5.04 -1.26 -0.49 117.35 132.50 3n99 s TYR 231 Ca 0.73 0.62 -0.06 0.00 -2.44 0.00 0.00 57.07 55.92 3n99 s TYR 231 Cb -0.26 -3.80 0.09 0.00 0.35 0.00 0.00 41.96 38.34 3n99 s TYR 231 CO 0.30 -3.07 0.38 0.50 -1.34 0.00 0.00 175.55 172.31 3n99 s ARG 232 N 2.28 0.28 0.03 4.97 3.52 -0.02 -4.91 118.95 125.11 3n99 s ARG 232 Ca 0.68 0.90 -0.30 0.00 -0.13 0.00 0.00 55.73 56.88 3n99 s ARG 232 Cb -0.36 0.13 -0.08 0.00 -1.56 0.00 0.00 34.95 33.09 3n99 s ARG 232 CO 0.29 -0.31 1.69 0.21 -0.81 0.00 0.00 175.30 176.38 3n99 s LYS 233 N 2.56 4.19 0.00 5.12 2.47 -1.26 -1.45 119.74 131.37 3n99 s LYS 233 Ca 0.01 2.33 0.00 0.00 -1.56 0.00 0.00 55.97 56.74 3n99 s LYS 233 Cb -0.12 -3.77 0.00 0.00 -1.46 0.00 0.00 37.83 32.47 3n99 s LYS 233 CO -0.12 -0.79 0.00 0.41 0.16 0.00 0.00 175.35 175.01 3n99 n GLY 234 N 4.10 1.74 3.78 5.54 0.00 -1.26 -5.04 105.19 114.04 3n99 n GLY 234 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 3n99 n GLY 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n99 s ALA 235 N -2.39 2.54 -0.04 4.61 0.00 -0.52 -0.23 121.76 125.73 3n99 s ALA 235 Ca 0.00 0.46 -0.05 0.00 0.00 0.00 0.00 51.96 52.37 3n99 s ALA 235 Cb 0.00 -3.28 0.01 0.00 0.00 0.00 0.00 23.12 19.85 3n99 s ALA 235 CO 0.00 -1.19 0.13 0.54 0.00 0.00 0.00 175.76 175.24 3n99 s VAL 236 N -2.45 0.02 0.11 0.00 0.11 0.19 -1.00 120.40 117.38 3n99 s VAL 236 Ca 0.65 -0.17 0.08 0.00 -2.93 0.00 0.00 61.98 59.61 3n99 s VAL 236 Cb -0.19 -0.24 -0.04 0.00 -1.53 0.00 0.00 36.38 34.39 3n99 s VAL 236 CO 0.42 -0.09 -0.19 -0.44 -3.33 0.00 0.00 175.10 171.47 3n99 s SER 237 N -0.27 2.43 -0.04 3.54 0.01 -0.57 -1.06 113.70 117.75 3n99 s SER 237 Ca -0.03 -0.72 0.06 0.00 1.31 0.00 0.00 55.95 56.57 3n99 s SER 237 Cb -0.03 -0.13 -0.02 0.00 0.21 0.00 0.00 66.02 66.06 3n99 s SER 237 CO 0.00 0.01 -0.22 -0.63 0.41 0.00 0.00 173.24 172.81 3n99 s ILE 238 N -1.40 2.36 0.24 1.44 -1.09 0.11 0.40 121.20 123.26 3n99 s ILE 238 Ca 0.07 -0.98 -0.09 0.00 -2.23 0.00 0.00 60.65 57.42 3n99 s ILE 238 Cb -0.09 -1.86 -0.01 0.00 -1.58 0.00 0.00 42.46 38.91 3n99 s ILE 238 CO 0.04 0.58 0.39 -0.83 -1.23 0.00 0.00 174.94 173.89 3n99 s GLY 239 N -0.52 0.82 -0.06 6.18 0.00 -0.41 -0.54 107.32 112.79 3n99 s GLY 239 Ca 0.07 -1.12 0.04 0.00 0.00 0.00 0.00 44.72 43.71 3n99 s GLY 239 CO 0.01 -0.85 -0.19 0.14 0.00 0.00 0.00 173.10 172.21 3n99 s VAL 240 N -4.02 2.65 -0.02 1.40 1.01 0.40 -1.07 120.40 120.75 3n99 s VAL 240 Ca 0.27 -0.86 -0.30 0.00 0.00 0.00 0.00 61.98 61.10 3n99 s VAL 240 Cb 0.01 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.35 3n99 s VAL 240 CO 0.10 0.57 0.97 -0.69 0.00 0.00 0.00 175.10 176.05 3n99 s VAL 241 N -0.40 4.87 0.00 2.92 1.01 -0.29 -1.18 120.40 127.32 3n99 s VAL 241 Ca 0.04 2.02 0.00 0.00 0.00 0.00 0.00 61.98 64.04 3n99 s VAL 241 Cb -0.12 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 31.96 3n99 s VAL 241 CO 0.02 0.14 0.00 1.33 0.00 0.00 0.00 175.10 176.59 3n99 n VAL 242 N 3.99 0.00 -4.15 2.92 0.24 0.55 -0.57 118.33 121.30 3n99 n VAL 242 Ca 0.06 -0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.24 3n99 n VAL 242 Cb 0.51 0.37 -0.09 0.00 -1.47 0.00 0.00 33.84 33.16 3n99 n VAL 242 CO 0.00 0.00 0.00 -1.38 -2.14 0.00 0.00 176.83 173.31 3n99 s HIS 243 N -1.43 0.98 0.89 6.34 -3.43 -1.25 -4.48 115.29 112.91 3n99 s HIS 243 Ca 0.00 -1.23 -0.12 0.00 -0.80 0.00 0.00 55.06 52.91 3n99 s HIS 243 Cb 0.00 -0.38 0.13 0.00 -1.43 0.00 0.00 32.58 30.90 3n99 s HIS 243 CO 0.00 -0.74 1.13 -1.54 -2.00 0.00 0.00 174.74 171.59 3n99 s SER 244 N -3.13 3.68 1.09 7.38 1.04 -0.14 -3.19 113.70 120.42 3n99 s SER 244 Ca 0.35 1.01 -0.13 0.00 0.48 0.00 0.00 55.95 57.65 3n99 s SER 244 Cb 0.05 -1.61 0.20 0.00 0.10 0.00 0.00 66.02 64.76 3n99 s SER 244 CO 0.12 -2.45 0.77 0.00 0.98 0.00 0.00 173.24 172.66 3n99 n ALA 245 N -3.71 -2.70 -2.46 5.32 0.00 0.18 -3.75 120.51 113.39 3n99 n ALA 245 Ca 0.07 -1.01 -0.13 0.00 0.00 0.00 0.00 53.44 52.37 3n99 n ALA 245 Cb 0.59 -1.92 -0.11 0.00 0.00 0.00 0.00 19.45 18.01 3n99 n ALA 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3n99 n VAL 247 N 0.56 0.88 -2.76 0.00 0.24 -1.26 -4.75 118.33 111.25 3n99 n VAL 247 Ca -0.16 -0.65 -0.28 0.00 -2.04 0.00 0.00 64.34 61.20 3n99 n VAL 247 Cb 0.58 -0.49 -0.01 0.00 -1.47 0.00 0.00 33.84 32.45 3n99 n VAL 247 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 3n99 s SER 248 N -5.42 6.37 0.26 -1.34 0.01 -1.22 -1.83 113.70 110.52 3n99 s SER 248 Ca -0.04 0.99 -0.30 0.00 1.31 0.00 0.00 55.95 57.90 3n99 s SER 248 Cb 0.09 -2.27 -0.10 0.00 0.21 0.00 0.00 66.02 63.95 3n99 s SER 248 CO 0.83 -0.49 1.46 0.00 0.41 0.00 0.00 173.24 175.44 3n99 s ALA 249 N -2.57 3.64 0.00 1.44 0.00 -1.26 -2.23 121.76 120.78 3n99 s ALA 249 Ca 0.49 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.80 3n99 s ALA 249 Cb -0.10 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.45 3n99 s ALA 249 CO 0.39 -0.77 0.00 0.41 0.00 0.00 0.00 175.76 175.79 3n99 n GLY 250 N 2.15 1.37 3.74 0.00 0.00 -1.26 -5.00 105.19 106.20 3n99 n GLY 250 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 3n99 n GLY 250 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3n99 s HIS 251 N -3.30 2.70 -2.84 1.61 0.09 -0.95 -1.13 115.29 111.47 3n99 s HIS 251 Ca 0.00 -0.41 0.00 0.00 -0.00 0.00 0.00 55.06 54.65 3n99 s HIS 251 Cb 0.00 -1.71 0.00 0.00 -0.00 0.00 0.00 32.58 30.87 3n99 s HIS 251 CO 0.00 0.29 0.00 0.41 -0.00 0.00 0.00 174.74 175.44 3n99 n GLY 252 N -1.19 -1.21 3.68 -2.22 0.00 -1.24 -4.40 105.19 98.62 3n99 n GLY 252 Ca -0.02 -1.02 -0.45 0.00 0.00 0.00 0.00 46.02 44.53 3n99 n GLY 252 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3n99 n PRO 253 N 0.00 2.28 -2.79 1.61 -0.02 -1.13 -4.40 135.00 130.56 3n99 n PRO 253 Ca 0.00 0.82 -0.37 0.00 -2.02 0.00 0.00 63.50 61.93 3n99 n PRO 253 Cb 0.00 -2.59 -0.06 0.00 -0.02 0.00 0.00 33.50 30.83 3n99 n PRO 253 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3n99 s GLY 254 N 0.83 2.78 -0.10 -1.23 0.00 -1.19 -1.47 107.32 106.93 3n99 s GLY 254 Ca 0.75 0.51 0.04 0.00 0.00 0.00 0.00 44.72 46.02 3n99 s GLY 254 CO 0.39 0.95 -0.22 0.14 0.00 0.00 0.00 173.10 174.36 3n99 s VAL 255 N -1.65 1.96 -0.21 1.40 1.01 0.14 -0.33 120.40 122.72 3n99 s VAL 255 Ca 0.51 -0.95 -0.13 0.00 0.00 0.00 0.00 61.98 61.41 3n99 s VAL 255 Cb -0.18 -1.70 -0.05 0.00 0.00 0.00 0.00 36.38 34.45 3n99 s VAL 255 CO 0.23 0.54 0.26 -0.69 0.00 0.00 0.00 175.10 175.44 3n99 s VAL 256 N 0.46 5.30 0.15 2.92 1.01 -0.33 -0.97 120.40 128.95 3n99 s VAL 256 Ca -0.16 0.43 -0.30 0.00 0.00 0.00 0.00 61.98 61.95 3n99 s VAL 256 Cb -0.17 -3.60 -0.07 0.00 0.00 0.00 0.00 36.38 32.54 3n99 s VAL 256 CO 0.07 0.33 1.04 -0.69 0.00 0.00 0.00 175.10 175.85 3n99 s VAL 257 N 0.96 4.14 -0.07 2.92 1.01 -1.26 -0.46 120.40 127.63 3n99 s VAL 257 Ca 0.13 1.81 0.04 0.00 0.00 0.00 0.00 61.98 63.96 3n99 s VAL 257 Cb -0.14 -4.15 -0.05 0.00 0.00 0.00 0.00 36.38 32.04 3n99 s VAL 257 CO 0.05 0.29 0.11 2.30 0.00 0.00 0.00 175.10 177.85 3n99 n ILE 258 N 2.58 0.00 -3.68 2.22 -5.35 0.30 -4.47 119.36 110.96 3n99 n ILE 258 Ca 0.03 -0.22 -0.14 0.00 -0.27 0.00 0.00 62.75 62.15 3n99 n ILE 258 Cb 0.47 0.65 -0.08 0.00 -1.74 0.00 0.00 39.64 38.94 3n99 n ILE 258 CO 0.00 0.00 0.00 -0.32 -1.76 0.00 0.00 176.55 174.47 3n99 s MET 259 N -1.90 0.68 -0.02 6.28 0.00 -0.94 -1.86 119.30 121.55 3n99 s MET 259 Ca -0.00 0.63 -0.13 0.00 0.00 0.00 0.00 55.69 56.19 3n99 s MET 259 Cb 0.03 0.33 0.02 0.00 0.00 0.00 0.00 34.83 35.20 3n99 s MET 259 CO 0.16 -0.11 0.26 -0.08 0.00 0.00 0.00 175.02 175.25 3n99 s THR 260 N 0.02 0.06 -2.45 10.11 -1.32 -0.22 0.05 115.64 121.89 3n99 s THR 260 Ca -0.02 -0.50 0.00 0.00 -1.21 0.00 0.00 61.69 59.96 3n99 s THR 260 Cb -0.04 -0.55 0.00 0.00 -1.51 0.00 0.00 72.50 70.40 3n99 s THR 260 CO 0.02 -0.28 0.00 0.61 -2.21 0.00 0.00 174.62 172.76 3n99 n GLY 261 N 1.42 -0.55 3.88 6.08 0.00 -0.22 -1.28 105.19 114.51 3n99 n GLY 261 Ca -0.21 -0.79 -0.33 0.00 0.00 0.00 0.00 46.02 44.68 3n99 n GLY 261 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3n99 s ASP 262 N -4.00 6.58 0.43 1.61 2.15 -1.26 -0.64 116.67 121.54 3n99 s ASP 262 Ca 0.00 0.71 0.30 0.00 0.43 0.00 0.00 52.55 53.98 3n99 s ASP 262 Cb 0.00 -2.14 1.53 0.00 -0.30 0.00 0.00 42.92 42.01 3n99 s ASP 262 CO 0.00 0.13 1.91 1.05 -0.17 0.00 0.00 175.17 178.09 3n99 h GLU 263 N 3.40 0.00 0.00 4.34 4.11 -0.84 -0.07 114.58 125.53 3n99 h GLU 263 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 3n99 h GLU 263 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 3n99 h GLU 263 CO 0.68 0.00 0.00 0.66 0.07 0.00 0.00 179.01 180.42 3n99 h SER 264 N 0.00 0.00 0.00 3.06 4.64 -1.94 -3.36 113.55 115.95 3n99 h SER 264 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 3n99 h SER 264 Cb 0.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 3n99 h SER 264 CO 0.00 0.00 -1.13 0.29 -0.87 0.00 0.00 176.83 175.12 3n99 n LYS 265 N -2.40 2.98 -3.91 4.77 5.02 -0.16 -4.93 118.16 119.54 3n99 n LYS 265 Ca 0.04 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.97 3n99 n LYS 265 Cb 0.34 -1.05 -0.12 0.00 -0.02 0.00 0.00 35.03 34.19 3n99 n LYS 265 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3n99 s ILE 266 N -2.04 4.36 -0.36 -0.18 1.01 -0.50 -0.88 121.20 122.61 3n99 s ILE 266 Ca -0.01 -0.17 0.03 0.00 0.00 0.00 0.00 60.65 60.50 3n99 s ILE 266 Cb 0.01 -3.01 0.10 0.00 0.01 0.00 0.00 42.46 39.57 3n99 s ILE 266 CO 0.07 0.39 0.08 -0.76 0.00 0.00 0.00 174.94 174.72 3n99 s LEU 267 N 1.15 4.80 0.30 2.97 1.43 0.10 -4.52 118.68 124.92 3n99 s LEU 267 Ca 0.04 -2.20 -0.29 0.00 -1.03 0.00 0.00 54.13 50.65 3n99 s LEU 267 Cb -0.14 -1.65 -0.10 0.00 0.03 0.00 0.00 46.19 44.32 3n99 s LEU 267 CO 0.03 -0.39 1.17 -2.84 0.23 0.00 0.00 176.35 174.55 3n99 s PRO 268 N 0.84 4.53 -0.27 1.29 0.02 -1.26 -1.24 135.00 138.91 3n99 s PRO 268 Ca 0.11 1.93 0.01 0.00 0.02 0.00 0.00 61.00 63.08 3n99 s PRO 268 Cb -0.20 -3.13 0.08 0.00 0.02 0.00 0.00 34.50 31.26 3n99 s PRO 268 CO -0.07 0.07 -0.01 -2.00 -0.33 0.00 0.00 177.00 174.66 3n99 s GLU 269 N -1.59 1.46 -0.20 5.54 2.56 0.48 -4.87 118.70 122.08 3n99 s GLU 269 Ca 0.46 -1.21 -0.29 0.00 0.00 0.00 0.00 54.97 53.93 3n99 s GLU 269 Cb -0.34 -2.63 -0.02 0.00 2.00 0.00 0.00 34.13 33.13 3n99 s GLU 269 CO 0.45 -0.74 1.49 -2.00 -0.56 0.00 0.00 175.26 173.90 3n99 s GLU 270 N 1.31 3.96 0.43 4.30 2.12 -1.26 -1.03 118.70 128.54 3n99 s GLU 270 Ca 0.00 1.66 0.03 0.00 0.36 0.00 0.00 54.97 57.03 3n99 s GLU 270 Cb -0.19 -3.94 -0.03 0.00 0.26 0.00 0.00 34.13 30.23 3n99 s GLU 270 CO -0.10 -1.08 0.08 0.14 -0.54 0.00 0.00 175.26 173.77 3n99 s VAL 271 N 4.52 0.86 0.08 3.70 -7.23 0.00 -4.93 120.40 117.41 3n99 s VAL 271 Ca 0.65 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.73 3n99 s VAL 271 Cb -0.24 -2.35 -0.26 0.00 0.56 0.00 0.00 36.38 34.09 3n99 s VAL 271 CO 0.25 0.00 1.17 1.05 -0.31 0.00 0.00 175.10 177.26 3n99 h GLU 272 N 1.68 0.48 -3.98 4.82 9.09 -1.93 -3.40 114.58 121.34 3n99 h GLU 272 Ca -0.39 -0.64 -0.35 0.00 0.05 0.00 0.00 59.36 58.03 3n99 h GLU 272 Cb 1.28 0.21 -0.32 0.00 -1.65 0.00 0.00 28.75 28.28 3n99 h GLU 272 CO 0.64 1.27 -0.75 0.50 0.05 0.00 0.00 179.01 180.71 3n99 s ARG 273 N -2.98 0.46 -0.34 1.06 3.52 -1.26 -4.96 118.95 114.44 3n99 s ARG 273 Ca -0.07 -0.06 0.06 0.00 -0.13 0.00 0.00 55.73 55.53 3n99 s ARG 273 Cb 0.07 -0.52 0.18 0.00 -1.56 0.00 0.00 34.95 33.12 3n99 s ARG 273 CO 0.90 -0.03 0.55 0.00 -0.81 0.00 0.00 175.30 175.91 3n99 s ALA 274 N 0.57 -1.95 -0.09 6.12 0.00 -1.26 -4.94 121.76 120.21 3n99 s ALA 274 Ca -0.06 0.38 -0.04 0.00 0.00 0.00 0.00 51.96 52.24 3n99 s ALA 274 Cb -0.10 -2.47 0.05 0.00 0.00 0.00 0.00 23.12 20.60 3n99 s ALA 274 CO -0.01 -1.98 0.20 1.21 0.00 0.00 0.00 175.76 175.18 3n99 s ASN 275 N 2.28 0.00 0.52 0.00 3.84 -1.26 -1.43 114.94 118.90 3n99 s ASN 275 Ca 0.13 0.43 0.35 0.00 0.21 0.00 0.00 52.86 53.98 3n99 s ASN 275 Cb -0.09 0.35 1.72 0.00 -0.55 0.00 0.00 41.25 42.68 3n99 s ASN 275 CO -0.18 -0.18 2.06 0.16 -2.79 0.00 0.00 177.10 176.17 3n99 h ILE 276 N 6.06 0.00 0.00 -5.21 3.07 -1.53 -2.18 117.51 117.72 3n99 h ILE 276 Ca -0.35 -0.19 -0.01 0.00 1.55 0.00 0.00 64.86 65.87 3n99 h ILE 276 Cb 1.14 1.07 -0.00 0.00 -0.27 0.00 0.00 36.82 38.75 3n99 h ILE 276 CO 0.33 0.00 -0.06 0.77 -1.05 0.00 0.00 178.15 178.14 3n99 h SER 277 N 0.00 0.00 0.42 2.16 4.64 -1.90 -1.00 113.55 117.87 3n99 h SER 277 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3n99 h SER 277 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 3n99 h SER 277 CO 0.00 0.06 0.00 0.47 -0.87 0.00 0.00 176.83 176.49 3n99 n ASP 278 N -3.88 0.51 -0.54 4.97 8.00 -0.82 -3.19 116.55 121.60 3n99 n ASP 278 Ca -0.03 0.66 0.06 0.00 0.71 0.00 0.00 54.79 56.20 3n99 n ASP 278 Cb 0.15 -0.76 0.19 0.00 -0.02 0.00 0.00 41.12 40.69 3n99 n ASP 278 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3n99 n TYR 279 N -2.10 0.26 -1.00 1.24 4.01 -0.38 -5.14 117.16 114.04 3n99 n TYR 279 Ca 0.01 -1.30 0.00 0.00 -0.16 0.00 0.00 57.90 56.45 3n99 n TYR 279 Cb 0.14 -0.26 0.00 0.00 -0.31 0.00 0.00 39.34 38.91 3n99 n TYR 279 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68