#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 1.67 0.62 1.61 4.02 -1.26 -5.03 115.29 116.92 3n99 s HIS 0 Ca 0.00 -0.38 -0.18 0.00 1.02 0.00 0.00 55.06 55.52 3n99 s HIS 0 Cb 0.00 -0.98 -0.02 0.00 -1.02 0.00 0.00 32.58 30.56 3n99 s HIS 0 CO 0.00 0.10 1.21 -1.64 1.02 0.00 0.00 174.74 175.43 3n99 s MET 1 N -1.28 2.80 -0.03 1.40 -1.94 -1.26 -4.95 119.30 114.04 3n99 s MET 1 Ca 0.06 1.83 -0.30 0.00 -1.71 0.00 0.00 55.69 55.57 3n99 s MET 1 Cb -0.09 -1.91 -0.03 0.00 2.01 0.00 0.00 34.83 34.81 3n99 s MET 1 CO 0.02 -1.34 1.10 1.03 -0.01 0.00 0.00 175.02 175.82 3n99 s ARG 2 N -3.45 4.44 0.19 2.03 0.52 -1.26 -5.01 118.95 116.42 3n99 s ARG 2 Ca 0.77 1.56 0.02 0.00 -0.52 0.00 0.00 55.73 57.56 3n99 s ARG 2 Cb -0.31 -3.48 -0.05 0.00 0.52 0.00 0.00 34.95 31.64 3n99 s ARG 2 CO 0.36 -0.27 0.03 0.95 0.02 0.00 0.00 175.30 176.38 3n99 s THR 3 N 1.59 0.63 -0.19 0.02 -4.23 -1.26 -0.72 115.64 111.48 3n99 s THR 3 Ca 0.54 -1.98 0.02 0.00 -1.18 0.00 0.00 61.69 59.08 3n99 s THR 3 Cb -0.23 -2.24 0.28 0.00 1.34 0.00 0.00 72.50 71.65 3n99 s THR 3 CO 0.24 -0.36 1.38 -0.46 -0.54 0.00 0.00 174.62 174.88 3n99 n ASN 4 N -0.29 3.31 0.20 3.99 6.94 -1.17 -4.67 115.26 123.57 3n99 n ASN 4 Ca -0.05 -2.66 0.15 0.00 -0.02 0.00 0.00 54.58 52.00 3n99 n ASN 4 Cb 0.64 -0.64 0.76 0.00 -2.36 0.00 0.00 39.78 38.18 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 0.41 0.00 0.00 -3.83 2.10 -1.95 -0.87 116.57 112.43 3n99 h LYS 5 Ca 0.26 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.91 3n99 h LYS 5 Cb 1.77 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.10 3n99 h LYS 5 CO 0.46 0.00 0.00 -0.44 -2.00 0.00 0.00 179.45 177.47 3n99 h ASP 6 N 0.00 0.00 -0.01 7.07 3.32 -2.03 -2.87 116.42 121.90 3n99 h ASP 6 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3n99 h ASP 6 Cb 0.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.91 3n99 h ASP 6 CO -0.00 0.00 -0.01 0.54 -1.72 0.00 0.00 179.24 178.05 3n99 n ARG 7 N -2.70 1.65 -2.80 3.56 1.74 -0.33 -4.93 116.66 112.85 3n99 n ARG 7 Ca 0.03 -0.96 -0.37 0.00 -0.77 0.00 0.00 57.85 55.78 3n99 n ARG 7 Cb 0.38 -1.48 -0.06 0.00 -1.02 0.00 0.00 32.46 30.28 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 -2.01 4.36 -0.09 0.55 1.43 -1.09 -5.03 118.68 116.80 3n99 s LEU 8 Ca 0.38 1.82 -0.16 0.00 -1.03 0.00 0.00 54.13 55.13 3n99 s LEU 8 Cb 0.21 -3.96 -0.05 0.00 0.03 0.00 0.00 46.19 42.42 3n99 s LEU 8 CO 0.34 -0.04 0.42 -0.69 0.23 0.00 0.00 176.35 176.60 3n99 s VAL 9 N -1.58 5.16 -0.21 -1.59 1.01 -1.26 -5.05 120.40 116.88 3n99 s VAL 9 Ca 0.49 0.83 -0.07 0.00 0.00 0.00 0.00 61.98 63.23 3n99 s VAL 9 Cb -0.19 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 3n99 s VAL 9 CO 0.24 0.42 0.06 -0.60 0.00 0.00 0.00 175.10 175.23 3n99 s ARG 10 N 0.05 3.83 -0.05 2.72 3.52 -1.26 -4.62 118.95 123.14 3n99 s ARG 10 Ca 0.23 -0.41 -0.11 0.00 -0.13 0.00 0.00 55.73 55.31 3n99 s ARG 10 Cb -0.15 -3.26 0.02 0.00 -1.56 0.00 0.00 34.95 30.00 3n99 s ARG 10 CO 0.10 0.07 0.27 -1.50 -0.81 0.00 0.00 175.30 173.43 3n99 s ILE 11 N 0.91 0.04 -0.09 4.11 2.07 -0.79 -4.99 121.20 122.46 3n99 s ILE 11 Ca 0.04 -0.32 -0.30 0.00 -1.41 0.00 0.00 60.65 58.66 3n99 s ILE 11 Cb -0.14 -0.49 -0.04 0.00 0.13 0.00 0.00 42.46 41.92 3n99 s ILE 11 CO 0.03 -0.17 1.51 -0.94 -1.91 0.00 0.00 174.94 173.45 3n99 s SER 12 N -0.72 6.77 -0.19 4.50 1.04 -1.26 -1.21 113.70 122.62 3n99 s SER 12 Ca -0.08 2.04 -0.01 0.00 0.48 0.00 0.00 55.95 58.39 3n99 s SER 12 Cb -0.04 -2.54 0.01 0.00 0.10 0.00 0.00 66.02 63.55 3n99 s SER 12 CO 0.02 -0.86 -0.14 -0.69 0.98 0.00 0.00 173.24 172.54 3n99 s VAL 13 N 3.81 2.52 0.15 5.02 1.01 0.01 -4.94 120.40 127.98 3n99 s VAL 13 Ca 0.67 -0.78 0.05 0.00 0.00 0.00 0.00 61.98 61.92 3n99 s VAL 13 Cb -0.29 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 3n99 s VAL 13 CO 0.24 0.50 0.08 0.68 0.00 0.00 0.00 175.10 176.60 3n99 s VAL 14 N 1.36 4.23 0.00 2.92 -7.23 -1.26 -0.51 120.40 119.90 3n99 s VAL 14 Ca 0.05 -1.13 0.00 0.00 -1.81 0.00 0.00 61.98 59.09 3n99 s VAL 14 Cb -0.13 -3.12 0.00 0.00 0.56 0.00 0.00 36.38 33.68 3n99 s VAL 14 CO -0.10 -0.06 0.00 0.61 -0.31 0.00 0.00 175.10 175.24 3n99 n GLY 15 N -0.10 3.27 3.15 2.32 0.00 -0.72 -4.66 105.19 108.45 3n99 n GLY 15 Ca -0.09 -0.94 -0.08 0.00 0.00 0.00 0.00 46.02 44.91 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 0.46 0.72 0.13 1.61 -1.05 0.07 -0.97 118.70 119.66 3n99 s GLU 16 Ca 0.00 -0.99 -0.31 0.00 -0.15 0.00 0.00 54.97 53.52 3n99 s GLU 16 Cb 0.00 0.28 -0.08 0.00 -0.44 0.00 0.00 34.13 33.88 3n99 s GLU 16 CO 0.00 -0.19 1.40 0.42 0.95 0.00 0.00 175.26 177.83 3n99 s ILE 17 N -3.60 3.22 0.28 1.83 1.01 -0.24 -0.94 121.20 122.76 3n99 s ILE 17 Ca 0.03 0.89 -0.20 0.00 0.00 0.00 0.00 60.65 61.38 3n99 s ILE 17 Cb 0.05 -3.57 -0.09 0.00 0.01 0.00 0.00 42.46 38.85 3n99 s ILE 17 CO -0.09 0.08 0.78 0.00 0.00 0.00 0.00 174.94 175.70 3n99 s ALA 18 N 0.98 3.33 0.91 9.38 0.00 -0.28 -0.83 121.76 135.24 3n99 s ALA 18 Ca 0.64 0.21 -0.11 0.00 0.00 0.00 0.00 51.96 52.69 3n99 s ALA 18 Cb -0.37 -2.89 0.13 0.00 0.00 0.00 0.00 23.12 19.99 3n99 s ALA 18 CO 0.31 0.29 1.09 -1.25 0.00 0.00 0.00 175.76 176.21 3n99 s PRO 19 N -2.34 1.17 0.25 0.00 0.04 -1.26 -1.72 135.00 131.15 3n99 s PRO 19 Ca 0.48 0.86 -0.31 0.00 0.04 0.00 0.00 61.00 62.08 3n99 s PRO 19 Cb -0.15 -1.80 -0.11 0.00 0.04 0.00 0.00 34.50 32.48 3n99 s PRO 19 CO 0.20 -2.31 1.63 0.00 0.04 0.00 0.00 177.00 176.56 3n99 s ALA 20 N -2.90 3.82 -0.03 8.56 0.00 -1.26 -2.17 121.76 127.78 3n99 s ALA 20 Ca 0.64 1.56 0.06 0.00 0.00 0.00 0.00 51.96 54.22 3n99 s ALA 20 Cb -0.18 -3.66 -0.01 0.00 0.00 0.00 0.00 23.12 19.26 3n99 s ALA 20 CO 0.57 -0.94 -0.22 0.15 0.00 0.00 0.00 175.76 175.32 3n99 s LYS 21 N 0.23 1.92 -0.13 0.00 1.02 -0.75 -4.89 119.74 117.15 3n99 s LYS 21 Ca 0.68 -0.79 -0.09 0.00 0.02 0.00 0.00 55.97 55.78 3n99 s LYS 21 Cb -0.48 -1.79 0.04 0.00 -0.52 0.00 0.00 37.83 35.08 3n99 s LYS 21 CO 0.41 0.44 0.32 -1.64 -0.92 0.00 0.00 175.35 173.95 3n99 s MET 22 N -0.40 0.33 0.08 1.68 -1.94 -1.26 -3.75 119.30 114.03 3n99 s MET 22 Ca 0.05 0.54 0.24 0.00 -1.71 0.00 0.00 55.69 54.82 3n99 s MET 22 Cb -0.10 0.05 0.38 0.00 2.01 0.00 0.00 34.83 37.17 3n99 s MET 22 CO 0.00 -0.10 1.33 0.54 -0.01 0.00 0.00 175.02 176.78 3n99 n ARG 23 N 3.58 0.22 -3.62 2.03 1.74 -1.26 -4.88 116.66 114.46 3n99 n ARG 23 Ca -0.19 0.06 -0.15 0.00 -0.77 0.00 0.00 57.85 56.80 3n99 n ARG 23 Cb 0.56 -1.63 -0.07 0.00 -1.02 0.00 0.00 32.46 30.30 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 -3.89 -0.42 0.49 0.55 0.15 -1.26 -5.03 113.70 104.30 3n99 s SER 24 Ca 0.07 0.31 0.25 0.00 0.70 0.00 0.00 55.95 57.28 3n99 s SER 24 Cb 0.15 0.45 1.29 0.00 -1.71 0.00 0.00 66.02 66.20 3n99 s SER 24 CO 0.72 -0.60 2.02 1.55 1.20 0.00 0.00 173.24 178.13 3n99 h PRO 25 N 3.20 0.00 -5.80 5.44 0.13 -1.96 -3.44 132.00 129.57 3n99 h PRO 25 Ca -0.29 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.19 3n99 h PRO 25 Cb 1.18 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.24 3n99 h PRO 25 CO 0.40 0.16 -0.36 0.71 -0.23 0.00 0.00 178.00 178.68 3n99 s TYR 26 N -4.17 3.65 -0.17 1.56 2.02 -1.26 -4.20 117.35 114.79 3n99 s TYR 26 Ca -0.03 0.72 -0.06 0.00 -0.37 0.00 0.00 57.07 57.34 3n99 s TYR 26 Cb 0.13 -2.09 -0.03 0.00 -0.40 0.00 0.00 41.96 39.57 3n99 s TYR 26 CO 0.61 0.70 0.02 -1.12 -1.57 0.00 0.00 175.55 174.18 3n99 s SER 27 N -1.08 5.27 -0.11 2.29 0.01 0.50 -4.92 113.70 115.66 3n99 s SER 27 Ca 0.19 -0.00 -0.21 0.00 1.31 0.00 0.00 55.95 57.24 3n99 s SER 27 Cb -0.14 -1.87 -0.04 0.00 0.21 0.00 0.00 66.02 64.19 3n99 s SER 27 CO 0.08 0.18 0.60 -0.69 0.41 0.00 0.00 173.24 173.83 3n99 s VAL 28 N 0.29 5.10 0.71 3.43 1.01 -1.26 -1.14 120.40 128.54 3n99 s VAL 28 Ca 0.00 1.20 -0.07 0.00 0.00 0.00 0.00 61.98 63.12 3n99 s VAL 28 Cb -0.13 -3.93 0.06 0.00 0.00 0.00 0.00 36.38 32.37 3n99 s VAL 28 CO 0.01 0.26 1.03 0.42 0.00 0.00 0.00 175.10 176.81 3n99 s THR 29 N 0.93 2.39 0.35 3.92 -4.23 0.55 -3.44 115.64 116.12 3n99 s THR 29 Ca 0.31 -0.20 0.24 0.00 -1.18 0.00 0.00 61.69 60.87 3n99 s THR 29 Cb -0.16 -3.05 0.25 0.00 1.34 0.00 0.00 72.50 70.88 3n99 s THR 29 CO 0.14 -0.05 1.99 0.71 -0.54 0.00 0.00 174.62 176.86 3n99 h THR 30 N -0.62 0.67 0.00 3.99 1.35 -1.71 -2.03 112.91 114.56 3n99 h THR 30 Ca -0.45 -0.75 0.00 0.00 -0.55 0.00 0.00 66.41 64.66 3n99 h THR 30 Cb 1.31 1.47 0.00 0.00 -1.73 0.00 0.00 68.15 69.21 3n99 h THR 30 CO 0.61 0.17 0.00 -0.62 -0.25 0.00 0.00 175.52 175.43 3n99 n GLU 31 N -3.67 0.81 -2.02 4.72 4.71 -1.26 -4.92 120.64 119.01 3n99 n GLU 31 Ca -0.01 0.00 -0.06 0.00 -0.01 0.00 0.00 57.16 57.07 3n99 n GLU 31 Cb 0.30 -1.50 -0.01 0.00 -1.01 0.00 0.00 31.44 29.22 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 1.07 0.19 3.81 0.62 0.00 -0.76 -5.06 105.19 105.06 3n99 n GLY 32 Ca 0.21 -0.63 -0.22 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.31 3.02 0.00 2.61 -4.23 -1.26 -4.90 115.64 108.57 3n99 s THR 33 Ca 0.00 -1.50 0.07 0.00 -1.18 0.00 0.00 61.69 59.08 3n99 s THR 33 Cb 0.00 -3.05 -0.03 0.00 1.34 0.00 0.00 72.50 70.76 3n99 s THR 33 CO 0.00 -0.11 -0.21 0.68 -0.54 0.00 0.00 174.62 174.44 3n99 s VAL 34 N -2.42 2.52 0.03 2.29 -7.23 -1.26 -0.33 120.40 114.01 3n99 s VAL 34 Ca 0.42 -1.09 0.05 0.00 -1.81 0.00 0.00 61.98 59.55 3n99 s VAL 34 Cb -0.03 -1.98 -0.02 0.00 0.56 0.00 0.00 36.38 34.91 3n99 s VAL 34 CO 0.25 0.48 -0.13 -0.13 -0.31 0.00 0.00 175.10 175.25 3n99 s ARG 35 N -0.99 0.90 -0.46 4.82 0.52 -0.29 -4.93 118.95 118.52 3n99 s ARG 35 Ca 0.12 -0.72 -0.16 0.00 -0.52 0.00 0.00 55.73 54.45 3n99 s ARG 35 Cb -0.10 -0.89 0.05 0.00 0.52 0.00 0.00 34.95 34.53 3n99 s ARG 35 CO 0.02 0.22 0.39 0.08 0.02 0.00 0.00 175.30 176.03 3n99 s VAL 36 N -0.83 5.20 0.03 3.52 1.01 -1.26 -0.37 120.40 127.70 3n99 s VAL 36 Ca 0.01 -0.85 -0.07 0.00 0.00 0.00 0.00 61.98 61.07 3n99 s VAL 36 Cb -0.08 -4.08 -0.00 0.00 0.00 0.00 0.00 36.38 32.22 3n99 s VAL 36 CO 0.01 -0.52 0.13 0.27 0.00 0.00 0.00 175.10 174.99 3n99 s ILE 37 N 1.78 0.12 0.54 2.22 -4.36 -1.26 -5.04 121.20 115.20 3n99 s ILE 37 Ca 0.06 -0.98 -0.22 0.00 -0.26 0.00 0.00 60.65 59.26 3n99 s ILE 37 Cb -0.22 -0.83 -0.06 0.00 1.25 0.00 0.00 42.46 42.60 3n99 s ILE 37 CO 0.09 -0.54 1.25 -2.65 0.24 0.00 0.00 174.94 173.33 3n99 n PRO 38 N 0.84 1.53 0.00 0.37 -0.02 -1.26 -4.79 135.00 131.68 3n99 n PRO 38 Ca -0.19 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 3n99 n PRO 38 Cb 0.58 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 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 -1.06 0.00 -3.06 -1.45 0.31 -1.26 -1.77 118.33 110.04 3n99 n VAL 39 Ca 0.11 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.24 3n99 n VAL 39 Cb 0.44 0.00 0.06 0.00 -0.91 0.00 0.00 33.84 33.43 3n99 n VAL 39 CO 0.00 0.00 0.00 -1.48 -1.32 0.00 0.00 176.83 174.03 3n99 s LEU 40 N 0.00 3.14 0.00 7.52 0.05 -1.25 -4.34 118.68 123.80 3n99 s LEU 40 Ca 0.00 -0.82 0.00 0.00 0.05 0.00 0.00 54.13 53.36 3n99 s LEU 40 Cb 0.00 -1.71 0.00 0.00 -2.05 0.00 0.00 46.19 42.43 3n99 s LEU 40 CO 0.00 -1.29 0.00 0.61 -0.55 0.00 0.00 176.35 175.12 3n99 n GLY 41 N -2.20 -2.72 0.17 -3.48 0.00 -1.26 -1.80 105.19 93.90 3n99 n GLY 41 Ca 0.15 -1.76 0.01 0.00 0.00 0.00 0.00 46.02 44.41 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 -0.35 -2.26 3.56 -0.02 0.00 -0.70 -4.56 105.19 100.86 3n99 n GLY 42 Ca 0.00 -1.53 -0.42 0.00 0.00 0.00 0.00 46.02 44.07 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 -1.01 4.90 -0.38 -0.61 1.01 -1.26 -1.35 121.20 122.50 3n99 s ILE 43 Ca 0.00 0.43 -0.19 0.00 0.00 0.00 0.00 60.65 60.88 3n99 s ILE 43 Cb 0.00 -4.08 0.01 0.00 0.01 0.00 0.00 42.46 38.39 3n99 s ILE 43 CO 0.00 -0.36 0.56 -0.89 0.00 0.00 0.00 174.94 174.25 3n99 s THR 44 N 2.67 4.95 0.06 2.92 2.01 -0.54 -4.97 115.64 122.74 3n99 s THR 44 Ca 0.23 0.26 0.17 0.00 0.31 0.00 0.00 61.69 62.66 3n99 s THR 44 Cb -0.15 -4.05 0.09 0.00 0.01 0.00 0.00 72.50 68.40 3n99 s THR 44 CO 0.15 -0.35 1.61 1.88 -0.69 0.00 0.00 174.62 177.23 3n99 h TYR 45 N 8.59 0.00 0.00 4.92 0.05 -1.96 -3.35 116.97 125.22 3n99 h TYR 45 Ca -0.27 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.51 3n99 h TYR 45 Cb 1.11 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.85 3n99 h TYR 45 CO 0.72 0.46 -0.09 0.27 -1.05 0.00 0.00 178.16 178.46 3n99 n ASN 46 N -3.41 1.45 -4.08 3.88 6.94 -1.26 -4.95 115.26 113.82 3n99 n ASN 46 Ca 0.01 -2.24 -0.28 0.00 -0.02 0.00 0.00 54.58 52.04 3n99 n ASN 46 Cb 0.61 -0.19 -0.17 0.00 -2.36 0.00 0.00 39.78 37.67 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 -1.34 1.51 0.18 3.53 1.01 -1.26 -5.12 120.40 118.90 3n99 s VAL 47 Ca 0.12 -0.67 -0.05 0.00 0.00 0.00 0.00 61.98 61.38 3n99 s VAL 47 Cb 0.10 -1.36 -0.02 0.00 0.00 0.00 0.00 36.38 35.10 3n99 s VAL 47 CO 0.01 0.44 0.21 -1.59 0.00 0.00 0.00 175.10 174.17 3n99 s LYS 48 N 0.80 1.16 0.30 2.72 -2.85 -1.26 -2.03 119.74 118.59 3n99 s LYS 48 Ca -0.11 -1.38 -0.30 0.00 -1.00 0.00 0.00 55.97 53.18 3n99 s LYS 48 Cb -0.16 0.33 -0.12 0.00 -2.06 0.00 0.00 37.83 35.82 3n99 s LYS 48 CO 0.01 -0.40 1.58 1.55 0.10 0.00 0.00 175.35 178.19 3n99 n VAL 49 N -0.22 1.12 0.00 1.79 3.14 -1.26 -1.29 118.33 121.61 3n99 n VAL 49 Ca -0.03 -0.28 0.00 0.00 -2.96 0.00 0.00 64.34 61.07 3n99 n VAL 49 Cb 0.64 -1.95 0.00 0.00 -1.06 0.00 0.00 33.84 31.47 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 1.99 2.93 3.77 7.55 0.00 -0.24 -4.92 105.19 116.27 3n99 n GLY 50 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 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 0.04 4.42 0.42 1.61 1.01 -0.41 -4.72 116.67 119.04 3n99 s ASP 51 Ca 0.00 1.58 -0.26 0.00 0.71 0.00 0.00 52.55 54.58 3n99 s ASP 51 Cb 0.00 -2.32 -0.10 0.00 1.01 0.00 0.00 42.92 41.52 3n99 s ASP 51 CO 0.00 -2.05 1.35 -0.24 0.21 0.00 0.00 175.17 174.44 3n99 n SER 52 N -3.51 2.99 0.17 0.27 2.88 -1.26 0.03 113.62 115.19 3n99 n SER 52 Ca 0.08 1.14 0.13 0.00 -1.33 0.00 0.00 58.87 58.89 3n99 n SER 52 Cb 0.54 -1.55 0.37 0.00 -0.75 0.00 0.00 64.21 62.82 3n99 n SER 52 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3n99 h ALA 53 N 2.32 1.00 -1.85 -1.46 0.00 -1.32 -3.41 119.26 114.55 3n99 h ALA 53 Ca -0.49 0.00 -0.51 0.00 0.00 0.00 0.00 54.91 53.91 3n99 h ALA 53 Cb 1.28 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.02 3n99 h ALA 53 CO 0.61 0.00 -0.47 0.71 0.00 0.00 0.00 179.25 180.10 3n99 s TYR 54 N -3.23 2.86 0.00 0.00 1.51 -1.26 -0.79 117.35 116.44 3n99 s TYR 54 Ca 0.08 -0.32 0.00 0.00 -1.01 0.00 0.00 57.07 55.81 3n99 s TYR 54 Cb 0.09 -1.77 0.00 0.00 -0.11 0.00 0.00 41.96 40.17 3n99 s TYR 54 CO 0.59 0.21 0.00 0.41 -1.11 0.00 0.00 175.55 175.65 3n99 n GLY 55 N -1.33 0.78 3.81 0.71 0.00 -1.26 -5.03 105.19 102.88 3n99 n GLY 55 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.02 3.74 -1.31 1.61 0.52 -1.26 -4.98 118.94 114.24 3n99 s TRP 56 Ca 0.00 1.10 -0.16 0.00 0.02 0.00 0.00 56.10 57.06 3n99 s TRP 56 Cb 0.00 -2.41 -0.00 0.00 -1.15 0.00 0.00 33.47 29.91 3n99 s TRP 56 CO 0.00 0.57 2.14 0.00 0.02 0.00 0.00 176.95 179.68 3n99 n ALA 57 N 2.00 4.95 -3.81 0.98 0.00 -1.26 -4.79 120.51 118.57 3n99 n ALA 57 Ca -0.12 -3.75 -0.05 0.00 0.00 0.00 0.00 53.44 49.52 3n99 n ALA 57 Cb 0.52 -3.56 -0.01 0.00 0.00 0.00 0.00 19.45 16.39 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 3.66 -0.10 -0.03 0.00 0.00 -1.26 -4.27 107.32 105.31 3n99 s GLY 58 Ca 0.50 -0.15 0.01 0.00 0.00 0.00 0.00 44.72 45.08 3n99 s GLY 58 CO -0.04 0.11 -0.04 -0.35 0.00 0.00 0.00 173.10 172.78 3n99 s ASP 59 N -2.98 0.77 -1.44 1.64 2.15 -0.73 -4.79 116.67 111.30 3n99 s ASP 59 Ca 0.13 -0.10 -0.07 0.00 0.43 0.00 0.00 52.55 52.94 3n99 s ASP 59 Cb -0.03 -0.30 0.03 0.00 -0.30 0.00 0.00 42.92 42.32 3n99 s ASP 59 CO 0.05 -0.02 0.55 1.41 -0.17 0.00 0.00 175.17 176.99 3n99 n HIS 60 N 3.73 -1.90 -2.26 -5.34 8.25 -1.06 -4.14 115.22 112.50 3n99 n HIS 60 Ca -0.22 0.49 -0.41 0.00 -0.26 0.00 0.00 57.72 57.32 3n99 n HIS 60 Cb 0.53 -3.84 -0.03 0.00 1.12 0.00 0.00 29.99 27.77 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 -3.07 3.30 -0.27 1.59 1.01 -1.26 -4.11 120.40 117.59 3n99 s VAL 61 Ca 0.34 1.08 -0.09 0.00 0.00 0.00 0.00 61.98 63.31 3n99 s VAL 61 Cb -0.16 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 3n99 s VAL 61 CO 0.42 0.17 0.14 -1.61 0.00 0.00 0.00 175.10 174.22 3n99 s GLU 62 N -0.21 3.76 0.66 2.72 2.02 -1.26 -1.19 118.70 125.20 3n99 s GLU 62 Ca 0.55 -0.43 -0.17 0.00 0.02 0.00 0.00 54.97 54.95 3n99 s GLU 62 Cb -0.35 -3.53 -0.00 0.00 0.10 0.00 0.00 34.13 30.35 3n99 s GLU 62 CO 0.38 -0.21 1.19 -1.25 0.02 0.00 0.00 175.26 175.39 3n99 s PRO 63 N 1.69 2.61 5.38 0.39 0.04 -1.26 -4.59 135.00 139.26 3n99 s PRO 63 Ca 0.07 1.73 0.00 0.00 0.04 0.00 0.00 61.00 62.83 3n99 s PRO 63 Cb -0.16 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.49 3n99 s PRO 63 CO 0.08 -1.46 0.00 0.41 0.04 0.00 0.00 177.00 176.06 3n99 n GLY 64 N 0.29 2.13 3.60 0.56 0.00 -0.86 -4.50 105.19 106.41 3n99 n GLY 64 Ca 0.13 -0.55 -0.37 0.00 0.00 0.00 0.00 46.02 45.24 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 5.07 -0.08 1.61 1.01 0.21 -1.47 120.40 126.74 3n99 s VAL 65 Ca 0.00 0.08 -0.19 0.00 0.00 0.00 0.00 61.98 61.87 3n99 s VAL 65 Cb 0.00 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.97 3n99 s VAL 65 CO 0.00 0.34 0.52 -0.44 0.00 0.00 0.00 175.10 175.52 3n99 s SER 66 N 1.24 6.78 -0.15 3.32 0.01 -0.46 -0.99 113.70 123.45 3n99 s SER 66 Ca 0.06 0.93 0.01 0.00 1.31 0.00 0.00 55.95 58.26 3n99 s SER 66 Cb -0.14 -2.31 0.00 0.00 0.21 0.00 0.00 66.02 63.78 3n99 s SER 66 CO 0.05 0.03 -0.18 -0.69 0.41 0.00 0.00 173.24 172.86 3n99 s VAL 67 N 0.38 2.43 0.38 3.43 1.01 0.48 -1.13 120.40 127.38 3n99 s VAL 67 Ca 0.28 -0.85 0.08 0.00 0.00 0.00 0.00 61.98 61.49 3n99 s VAL 67 Cb -0.16 -2.01 -0.04 0.00 0.00 0.00 0.00 36.38 34.17 3n99 s VAL 67 CO 0.13 0.53 0.19 0.00 0.00 0.00 0.00 175.10 175.94 3n99 s MET 68 N 0.84 2.34 0.56 2.72 0.23 -0.12 -0.74 119.30 125.13 3n99 s MET 68 Ca -0.05 -1.66 -0.19 0.00 -1.03 0.00 0.00 55.69 52.75 3n99 s MET 68 Cb -0.15 -2.13 -0.05 0.00 -1.53 0.00 0.00 34.83 30.97 3n99 s MET 68 CO -0.01 -0.02 1.15 0.00 -2.03 0.00 0.00 175.02 174.10 3n99 s ALA 69 N -2.50 2.65 0.50 3.16 0.00 -1.26 -0.75 121.76 123.56 3n99 s ALA 69 Ca 0.41 0.87 0.26 0.00 0.00 0.00 0.00 51.96 53.50 3n99 s ALA 69 Cb -0.00 -3.38 1.56 0.00 0.00 0.00 0.00 23.12 21.29 3n99 s ALA 69 CO 0.23 -0.88 2.15 0.00 0.00 0.00 0.00 175.76 177.26 3n99 h ARG 70 N 1.10 0.00 -2.21 0.00 3.08 -1.90 -3.44 114.38 111.02 3n99 h ARG 70 Ca -0.50 0.00 0.16 0.00 0.07 0.00 0.00 59.98 59.71 3n99 h ARG 70 Cb 1.27 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 31.20 3n99 h ARG 70 CO 0.56 0.07 0.53 -0.98 -1.07 0.00 0.00 179.97 179.08 3n99 s ARG 71 N -4.48 0.92 0.21 0.04 1.70 -1.26 -5.06 118.95 111.02 3n99 s ARG 71 Ca -0.04 -0.44 -0.09 0.00 -0.47 0.00 0.00 55.73 54.69 3n99 s ARG 71 Cb 0.14 0.36 0.25 0.00 -0.57 0.00 0.00 34.95 35.13 3n99 s ARG 71 CO 0.58 -0.41 1.82 -0.22 -1.08 0.00 0.00 175.30 175.99 3n99 h LYS 72 N 2.00 0.72 -1.09 3.89 3.64 -2.03 -1.69 116.57 122.01 3n99 h LYS 72 Ca -0.23 -0.04 0.32 0.00 -1.27 0.00 0.00 60.65 59.42 3n99 h LYS 72 Cb 1.23 -0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 32.84 3n99 h LYS 72 CO 0.28 0.48 0.78 0.93 -2.27 0.00 0.00 179.45 179.65 3n99 h GLU 73 N 0.74 0.01 -0.42 1.90 3.07 -2.00 -1.56 114.58 116.33 3n99 h GLU 73 Ca 0.31 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.17 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 -0.17 0.01 0.00 0.39 -1.40 0.00 0.00 179.01 177.84 3n99 n GLU 74 N -4.22 2.30 -0.00 2.33 1.02 -0.64 -4.42 120.64 117.02 3n99 n GLU 74 Ca 0.23 -1.99 -0.17 0.00 -0.02 0.00 0.00 57.16 55.22 3n99 n GLU 74 Cb 1.15 -1.47 -0.11 0.00 -0.02 0.00 0.00 31.44 30.99 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 3.65 0.43 -0.03 3.49 5.08 -1.37 -3.00 114.58 122.83 3n99 h GLU 75 Ca 0.00 -0.44 0.02 0.00 -1.00 0.00 0.00 59.36 57.94 3n99 h GLU 75 Cb 0.81 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.16 3n99 h GLU 75 CO 0.00 1.10 -0.10 0.82 -1.00 0.00 0.00 179.01 179.82 3n99 h ILE 76 N -0.06 0.73 -0.44 3.13 2.04 -1.78 -0.76 117.51 120.37 3n99 h ILE 76 Ca -0.07 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.70 3n99 h ILE 76 Cb 1.29 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 38.08 3n99 h ILE 76 CO 0.12 0.00 -0.09 1.55 0.00 0.00 0.00 178.15 179.73 3n99 h PRO 77 N -0.16 0.78 -0.29 2.37 0.13 -1.86 0.20 132.00 133.17 3n99 h PRO 77 Ca 0.05 -0.25 0.06 0.00 -0.87 0.00 0.00 66.00 64.99 3n99 h PRO 77 Cb 0.23 -0.07 -0.06 0.00 0.13 0.00 0.00 31.00 31.23 3n99 h PRO 77 CO -0.13 0.84 -0.09 1.25 -0.23 0.00 0.00 178.00 179.65 3n99 h LEU 78 N 0.71 -0.31 -0.07 1.56 5.85 -1.35 -0.57 115.31 121.12 3n99 h LEU 78 Ca 0.12 0.09 -0.21 0.00 0.84 0.00 0.00 57.88 58.73 3n99 h LEU 78 Cb 0.56 0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.76 3n99 h LEU 78 CO 0.03 -0.11 -0.98 0.24 -0.34 0.00 0.00 178.44 177.28 3n99 h MET 79 N -0.02 0.03 0.05 1.25 2.86 -0.81 -3.20 114.93 115.09 3n99 h MET 79 Ca 0.14 -0.05 -0.13 0.00 -2.06 0.00 0.00 59.70 57.61 3n99 h MET 79 Cb 0.24 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.91 3n99 h MET 79 CO -0.31 0.98 -0.64 1.15 1.06 0.00 0.00 176.91 179.15 3n99 h THR 80 N 0.01 1.45 0.00 2.22 2.02 -0.50 -3.38 112.91 114.73 3n99 h THR 80 Ca -0.02 -2.37 -0.04 0.00 0.77 0.00 0.00 66.41 64.74 3n99 h THR 80 Cb 1.71 3.04 -0.01 0.00 -1.74 0.00 0.00 68.15 71.15 3n99 h THR 80 CO 0.13 0.60 -0.56 -0.07 0.37 0.00 0.00 175.52 175.99 3n99 h LEU 81 N -0.73 0.00 -9.33 2.58 3.38 -1.26 -3.45 115.31 106.50 3n99 h LEU 81 Ca -0.14 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.28 3n99 h LEU 81 Cb 1.33 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.07 3n99 h LEU 81 CO 0.01 0.18 0.76 -0.44 0.09 0.00 0.00 178.44 179.04 3n99 s SER 82 N -5.98 6.97 0.14 -0.43 0.01 -1.21 -3.95 113.70 109.26 3n99 s SER 82 Ca 0.03 1.92 0.11 0.00 1.31 0.00 0.00 55.95 59.32 3n99 s SER 82 Cb 0.07 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.70 3n99 s SER 82 CO 0.74 -0.64 -0.25 0.00 0.41 0.00 0.00 173.24 173.49 3n99 s ILE 84 N -1.27 2.60 0.00 0.00 1.01 0.15 -1.57 121.20 122.12 3n99 s ILE 84 Ca 0.15 0.36 0.00 0.00 0.00 0.00 0.00 60.65 61.16 3n99 s ILE 84 Cb -0.09 -3.23 0.00 0.00 0.01 0.00 0.00 42.46 39.15 3n99 s ILE 84 CO 0.07 0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.64 3n99 n GLY 85 N 3.86 2.88 3.69 6.18 0.00 -0.03 -0.88 105.19 120.90 3n99 n GLY 85 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 3n99 n GLY 85 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3n99 n ASN 86 N 0.00 1.94 -4.76 1.61 5.03 -0.61 -4.57 115.26 113.91 3n99 n ASN 86 Ca 0.00 0.91 -0.40 0.00 0.87 0.00 0.00 54.58 55.96 3n99 n ASN 86 Cb 0.00 -1.50 -0.04 0.00 -1.02 0.00 0.00 39.78 37.22 3n99 n ASN 86 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 3n99 s GLU 87 N -2.86 4.59 0.00 3.52 2.12 -1.26 -1.95 118.70 122.86 3n99 s GLU 87 Ca 0.74 1.83 0.05 0.00 0.36 0.00 0.00 54.97 57.95 3n99 s GLU 87 Cb -0.42 -3.15 -0.01 0.00 0.26 0.00 0.00 34.13 30.80 3n99 s GLU 87 CO 0.48 0.16 -0.14 0.08 -0.54 0.00 0.00 175.26 175.29 3n99 s VAL 88 N -1.18 1.13 -0.04 3.70 1.01 -0.19 -0.93 120.40 123.91 3n99 s VAL 88 Ca 0.45 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.75 3n99 s VAL 88 Cb -0.32 -0.96 0.01 0.00 0.00 0.00 0.00 36.38 35.11 3n99 s VAL 88 CO 0.42 0.25 -0.09 -0.63 0.00 0.00 0.00 175.10 175.05 3n99 s ILE 89 N -0.45 0.80 -0.01 2.22 1.01 0.38 -0.84 121.20 124.30 3n99 s ILE 89 Ca 0.05 -0.33 -0.29 0.00 0.00 0.00 0.00 60.65 60.07 3n99 s ILE 89 Cb -0.06 -0.74 -0.03 0.00 0.01 0.00 0.00 42.46 41.64 3n99 s ILE 89 CO -0.00 0.26 0.95 -0.69 0.00 0.00 0.00 174.94 175.47 3n99 s VAL 90 N 0.46 4.88 -0.97 2.92 1.01 -0.23 -1.35 120.40 127.12 3n99 s VAL 90 Ca -0.08 2.00 0.08 0.00 0.00 0.00 0.00 61.98 63.98 3n99 s VAL 90 Cb -0.12 -4.29 0.07 0.00 0.00 0.00 0.00 36.38 32.04 3n99 s VAL 90 CO 0.01 0.16 0.77 0.23 0.00 0.00 0.00 175.10 176.28 3n99 n MET 91 N 3.93 0.25 -4.00 2.72 2.81 0.41 -0.20 117.12 123.03 3n99 n MET 91 Ca 0.05 -1.02 -0.10 0.00 -1.81 0.00 0.00 57.70 54.82 3n99 n MET 91 Cb 0.51 -1.15 -0.04 0.00 -0.71 0.00 0.00 33.22 31.82 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 -0.68 0.17 0.25 7.83 1.04 -1.24 -4.86 113.70 116.22 3n99 s SER 92 Ca 0.10 -1.09 0.00 0.00 0.48 0.00 0.00 55.95 55.43 3n99 s SER 92 Cb 0.07 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.82 3n99 s SER 92 CO 0.10 -1.24 0.00 0.61 0.98 0.00 0.00 173.24 173.69 3n99 n GLY 93 N -0.44 -1.81 0.21 7.32 0.00 -1.26 -3.84 105.19 105.36 3n99 n GLY 93 Ca -0.02 -1.32 0.15 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.01 0.00 -0.67 1.61 3.32 -1.98 -2.63 116.42 116.06 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 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 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 -1.94 2.39 -1.57 3.45 0.00 -1.26 -5.00 120.51 116.58 3n99 n ALA 95 Ca 0.02 -1.21 -0.52 0.00 0.00 0.00 0.00 53.44 51.72 3n99 n ALA 95 Cb 0.29 -0.94 -0.06 0.00 0.00 0.00 0.00 19.45 18.74 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 1.56 0.95 0.00 0.00 4.81 -0.99 -0.42 118.16 124.06 3n99 n LYS 96 Ca 0.23 0.34 0.00 0.00 -0.87 0.00 0.00 58.31 58.01 3n99 n LYS 96 Cb 0.60 -1.90 0.00 0.00 0.02 0.00 0.00 35.03 33.74 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 2.21 2.35 3.76 3.14 0.00 0.72 -4.99 105.19 112.38 3n99 n GLY 97 Ca 0.18 0.00 -0.38 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 -2.04 5.79 -0.01 1.61 0.01 0.44 -4.72 113.70 114.78 3n99 s SER 98 Ca 0.00 2.62 0.06 0.00 1.31 0.00 0.00 55.95 59.94 3n99 s SER 98 Cb 0.00 -2.63 -0.03 0.00 0.21 0.00 0.00 66.02 63.58 3n99 s SER 98 CO 0.00 -1.20 -0.20 -0.13 0.41 0.00 0.00 173.24 172.12 3n99 s ARG 99 N -2.68 2.20 0.00 12.44 0.52 -1.26 -1.07 118.95 129.11 3n99 s ARG 99 Ca 0.65 -0.88 0.00 0.00 -0.52 0.00 0.00 55.73 54.98 3n99 s ARG 99 Cb -0.37 -2.18 0.00 0.00 0.52 0.00 0.00 34.95 32.92 3n99 s ARG 99 CO 0.45 0.57 0.00 0.41 0.02 0.00 0.00 175.30 176.75 3n99 n GLY 100 N 2.12 4.00 2.87 -3.53 0.00 -0.02 -4.65 105.19 105.97 3n99 n GLY 100 Ca -0.17 -1.32 -0.12 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 -2.79 0.01 0.04 1.61 0.08 -0.56 -1.02 117.98 115.35 3n99 s PHE 101 Ca 0.00 -0.01 -0.30 0.00 0.12 0.00 0.00 56.93 56.73 3n99 s PHE 101 Cb 0.00 -0.01 -0.06 0.00 -0.57 0.00 0.00 43.02 42.38 3n99 s PHE 101 CO 0.00 -0.00 1.42 0.08 -0.10 0.00 0.00 175.22 176.61 3n99 s VAL 102 N -0.03 3.55 -0.03 -0.44 1.01 -0.82 -0.62 120.40 123.02 3n99 s VAL 102 Ca -0.00 1.01 0.21 0.00 0.00 0.00 0.00 61.98 63.20 3n99 s VAL 102 Cb -0.00 -3.65 -0.33 0.00 0.00 0.00 0.00 36.38 32.40 3n99 s VAL 102 CO -0.00 0.02 0.46 0.35 0.00 0.00 0.00 175.10 175.93 3n99 n THR 103 N 4.46 0.02 -0.43 3.92 -2.24 0.75 -0.85 114.28 119.91 3n99 n THR 103 Ca 0.13 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 3n99 n THR 103 Cb 0.43 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 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 1.30 -1.30 3.37 3.38 0.00 -1.15 -4.86 105.19 105.93 3n99 n GLY 104 Ca -0.04 -1.02 -0.15 0.00 0.00 0.00 0.00 46.02 44.81 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 -1.76 0.89 -0.13 1.61 -2.85 -1.26 -0.42 119.74 115.82 3n99 s LYS 105 Ca 0.00 -0.07 -0.01 0.00 -1.00 0.00 0.00 55.97 54.89 3n99 s LYS 105 Cb 0.00 0.41 0.04 0.00 -2.06 0.00 0.00 37.83 36.22 3n99 s LYS 105 CO 0.00 -0.28 -0.02 -1.58 0.10 0.00 0.00 175.35 173.57 3n99 s HIS 106 N -1.61 1.14 0.51 1.78 2.46 0.28 -4.13 115.29 115.73 3n99 s HIS 106 Ca -0.10 -0.64 -0.18 0.00 0.47 0.00 0.00 55.06 54.61 3n99 s HIS 106 Cb -0.02 -1.05 -0.07 0.00 -0.13 0.00 0.00 32.58 31.30 3n99 s HIS 106 CO 0.04 -0.49 1.01 0.20 -2.47 0.00 0.00 174.74 173.03 3n99 s GLY 107 N 1.82 2.23 0.00 1.59 0.00 -1.26 -1.35 107.32 110.35 3n99 s GLY 107 Ca 0.03 0.36 0.00 0.00 0.00 0.00 0.00 44.72 45.11 3n99 s GLY 107 CO -0.07 0.66 0.00 0.61 0.00 0.00 0.00 173.10 174.30 3n99 n GLY 108 N -0.98 1.82 0.25 0.20 0.00 -1.26 -4.39 105.19 100.83 3n99 n GLY 108 Ca 0.08 -0.69 0.13 0.00 0.00 0.00 0.00 46.02 45.54 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 0.38 -4.63 1.61 -1.51 -2.04 -3.47 116.25 106.59 3n99 h VAL 109 Ca 0.00 -0.76 -0.01 0.00 -1.23 0.00 0.00 66.70 64.70 3n99 h VAL 109 Cb 0.00 1.56 0.01 0.00 -2.13 0.00 0.00 31.29 30.72 3n99 h VAL 109 CO 0.00 0.13 -0.03 0.59 -1.23 0.00 0.00 177.57 177.02 3n99 n ASN 110 N -3.35 -5.95 -4.44 4.19 3.02 -0.81 -4.94 115.26 102.98 3n99 n ASN 110 Ca -0.00 -0.07 -0.32 0.00 -0.03 0.00 0.00 54.58 54.15 3n99 n ASN 110 Cb 0.33 -3.95 -0.14 0.00 -0.61 0.00 0.00 39.78 35.41 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 -3.02 2.60 -0.13 3.10 3.76 -0.45 -4.47 115.29 116.68 3n99 s HIS 111 Ca 0.02 -0.23 -0.09 0.00 -0.15 0.00 0.00 55.06 54.60 3n99 s HIS 111 Cb -0.00 -1.58 -0.05 0.00 1.11 0.00 0.00 32.58 32.06 3n99 s HIS 111 CO 0.51 0.14 0.18 0.08 -0.85 0.00 0.00 174.74 174.81 3n99 s VAL 112 N -0.72 5.41 -0.13 -0.90 1.01 0.08 -0.56 120.40 124.60 3n99 s VAL 112 Ca 0.11 0.31 -0.03 0.00 0.00 0.00 0.00 61.98 62.37 3n99 s VAL 112 Cb -0.10 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 3n99 s VAL 112 CO 0.01 0.54 -0.02 -0.76 0.00 0.00 0.00 175.10 174.86 3n99 s LEU 113 N -0.47 3.39 -0.01 3.92 1.43 0.43 -0.39 118.68 126.98 3n99 s LEU 113 Ca 0.14 -0.02 0.02 0.00 -1.03 0.00 0.00 54.13 53.24 3n99 s LEU 113 Cb -0.12 -1.80 0.00 0.00 0.03 0.00 0.00 46.19 44.30 3n99 s LEU 113 CO 0.03 0.25 -0.05 -0.69 0.23 0.00 0.00 176.35 176.12 3n99 s VAL 114 N -0.14 0.45 -0.23 -1.59 1.01 -0.16 -0.18 120.40 119.56 3n99 s VAL 114 Ca 0.04 -0.20 -0.11 0.00 0.00 0.00 0.00 61.98 61.70 3n99 s VAL 114 Cb -0.13 -0.41 -0.05 0.00 0.00 0.00 0.00 36.38 35.79 3n99 s VAL 114 CO 0.02 0.15 0.18 -2.28 0.00 0.00 0.00 175.10 173.17 3n99 s HIS 115 N 0.12 3.32 0.26 5.22 2.46 0.21 -0.62 115.29 126.27 3n99 s HIS 115 Ca -0.01 0.27 0.10 0.00 0.47 0.00 0.00 55.06 55.89 3n99 s HIS 115 Cb -0.05 -2.29 -0.04 0.00 -0.13 0.00 0.00 32.58 30.06 3n99 s HIS 115 CO -0.00 0.06 -0.06 -0.06 -2.47 0.00 0.00 174.74 172.21 3n99 s PHE 116 N 1.06 2.60 0.74 3.88 0.08 -1.26 -1.49 117.98 123.59 3n99 s PHE 116 Ca 0.09 -0.25 -0.15 0.00 0.12 0.00 0.00 56.93 56.74 3n99 s PHE 116 Cb -0.14 -1.16 0.05 0.00 -0.57 0.00 0.00 43.02 41.20 3n99 s PHE 116 CO 0.05 0.63 1.22 -1.21 -0.10 0.00 0.00 175.22 175.80 3n99 s GLU 117 N -3.54 2.03 0.24 0.44 2.02 -1.26 -4.90 118.70 113.72 3n99 s GLU 117 Ca 0.30 1.79 -0.07 0.00 0.02 0.00 0.00 54.97 57.02 3n99 s GLU 117 Cb -0.06 -1.82 0.27 0.00 0.10 0.00 0.00 34.13 32.62 3n99 s GLU 117 CO 0.18 -1.93 1.89 1.49 0.02 0.00 0.00 175.26 176.92 3n99 h GLU 118 N -0.40 1.12 -0.91 1.61 4.81 -2.01 -1.92 114.58 116.89 3n99 h GLU 118 Ca -0.48 -0.07 0.18 0.00 -0.13 0.00 0.00 59.36 58.87 3n99 h GLU 118 Cb 1.30 -0.25 -0.07 0.00 0.63 0.00 0.00 28.75 30.36 3n99 h GLU 118 CO 0.49 0.74 0.59 0.93 -0.73 0.00 0.00 179.01 181.03 3n99 h GLU 119 N 1.15 0.51 -0.27 1.92 3.07 -2.04 -1.96 114.58 116.96 3n99 h GLU 119 Ca 0.35 -0.03 -0.08 0.00 -0.50 0.00 0.00 59.36 59.11 3n99 h GLU 119 Cb -0.03 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 27.76 3n99 h GLU 119 CO -0.11 0.33 -0.16 0.28 -1.40 0.00 0.00 179.01 177.96 3n99 h VAL 120 N 0.52 1.24 -0.57 3.13 2.07 -1.70 -3.34 116.25 117.60 3n99 h VAL 120 Ca 0.47 -1.06 -0.05 0.00 0.82 0.00 0.00 66.70 66.88 3n99 h VAL 120 Cb 1.01 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.96 3n99 h VAL 120 CO -0.21 0.34 0.13 -0.07 0.02 0.00 0.00 177.57 177.79 3n99 h LEU 121 N 0.43 0.82 -0.99 2.57 3.38 -1.42 -0.25 115.31 119.85 3n99 h LEU 121 Ca 0.08 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.89 3n99 h LEU 121 Cb 0.53 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3n99 h LEU 121 CO 0.03 0.81 0.00 1.23 0.09 0.00 0.00 178.44 180.60 3n99 h GLY 122 N 0.99 0.00 0.33 0.83 0.00 -1.70 -2.82 103.07 100.71 3n99 h GLY 122 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 3n99 h GLY 122 CO -0.00 0.00 -1.18 0.28 0.00 0.00 0.00 176.54 175.64 3n99 n LYS 123 N -2.32 0.27 -1.69 4.80 5.02 -0.11 -5.00 118.16 119.12 3n99 n LYS 123 Ca 0.01 -0.04 -0.31 0.00 -2.02 0.00 0.00 58.31 55.95 3n99 n LYS 123 Cb 0.18 -1.55 0.04 0.00 -0.02 0.00 0.00 35.03 33.68 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 -3.75 3.23 -0.04 -0.35 1.43 -1.07 -4.19 118.68 113.95 3n99 s LEU 124 Ca 0.03 1.68 -0.04 0.00 -1.03 0.00 0.00 54.13 54.77 3n99 s LEU 124 Cb 0.15 -4.51 0.01 0.00 0.03 0.00 0.00 46.19 41.88 3n99 s LEU 124 CO 0.84 -1.39 0.12 -0.32 0.23 0.00 0.00 176.35 175.82 3n99 s MET 125 N -4.77 0.13 0.18 1.70 1.75 -1.26 -5.05 119.30 111.97 3n99 s MET 125 Ca 0.60 0.17 -0.33 0.00 -1.25 0.00 0.00 55.69 54.88 3n99 s MET 125 Cb -0.15 0.04 -0.14 0.00 2.84 0.00 0.00 34.83 37.43 3n99 s MET 125 CO 0.50 -0.03 1.53 0.28 -0.65 0.00 0.00 175.02 176.65 3n99 n VAL 126 N 3.11 0.23 0.00 10.11 0.31 -1.26 -1.15 118.33 129.69 3n99 n VAL 126 Ca -0.13 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 3n99 n VAL 126 Cb 0.59 -1.50 0.00 0.00 -0.91 0.00 0.00 33.84 32.01 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 3.08 2.78 3.78 2.92 0.00 -0.01 -4.93 105.19 112.81 3n99 n GLY 127 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.28 6.32 0.20 1.61 1.01 -0.30 -4.49 116.67 119.75 3n99 s ASP 128 Ca 0.00 3.07 -0.30 0.00 0.71 0.00 0.00 52.55 56.03 3n99 s ASP 128 Cb 0.00 -2.67 -0.08 0.00 1.01 0.00 0.00 42.92 41.18 3n99 s ASP 128 CO 0.00 -0.89 1.18 -0.54 0.21 0.00 0.00 175.17 175.13 3n99 s LYS 129 N -2.10 4.51 -0.05 8.23 1.02 -1.26 -1.08 119.74 129.01 3n99 s LYS 129 Ca 0.53 1.86 0.04 0.00 0.02 0.00 0.00 55.97 58.42 3n99 s LYS 129 Cb -0.47 -3.24 -0.00 0.00 -0.52 0.00 0.00 37.83 33.60 3n99 s LYS 129 CO 0.64 -0.04 -0.18 0.42 -0.92 0.00 0.00 175.35 175.26 3n99 s ILE 130 N -0.21 1.51 -0.18 2.17 -1.09 -0.14 -0.44 121.20 122.82 3n99 s ILE 130 Ca 0.51 -0.75 0.00 0.00 -2.23 0.00 0.00 60.65 58.18 3n99 s ILE 130 Cb -0.32 -1.31 0.01 0.00 -1.58 0.00 0.00 42.46 39.26 3n99 s ILE 130 CO 0.37 0.43 -0.17 -0.22 -1.23 0.00 0.00 174.94 174.13 3n99 s LEU 131 N 0.11 2.30 -0.25 2.97 2.96 -0.46 -1.75 118.68 124.56 3n99 s LEU 131 Ca -0.06 -0.58 -0.08 0.00 -0.22 0.00 0.00 54.13 53.18 3n99 s LEU 131 Cb -0.13 -1.53 -0.04 0.00 0.50 0.00 0.00 46.19 45.00 3n99 s LEU 131 CO 0.03 0.01 0.11 -0.63 -1.32 0.00 0.00 176.35 174.55 3n99 s ILE 132 N 1.22 4.65 -1.10 6.68 1.01 0.34 -0.47 121.20 133.52 3n99 s ILE 132 Ca 0.03 -0.06 -0.20 0.00 0.00 0.00 0.00 60.65 60.42 3n99 s ILE 132 Cb -0.14 -3.18 0.08 0.00 0.01 0.00 0.00 42.46 39.23 3n99 s ILE 132 CO -0.09 0.32 1.48 -0.54 0.00 0.00 0.00 174.94 176.11 3n99 s LYS 133 N 1.59 3.75 -0.00 2.79 1.02 -0.10 -0.81 119.74 127.97 3n99 s LYS 133 Ca 0.06 -1.60 -0.30 0.00 0.02 0.00 0.00 55.97 54.15 3n99 s LYS 133 Cb -0.15 -5.31 -0.04 0.00 -0.52 0.00 0.00 37.83 31.80 3n99 s LYS 133 CO 0.06 -2.11 1.20 0.00 -0.92 0.00 0.00 175.35 173.58 3n99 s ALA 134 N 4.09 3.44 -0.30 5.17 0.00 -0.35 -4.21 121.76 129.60 3n99 s ALA 134 Ca 0.46 0.72 -0.09 0.00 0.00 0.00 0.00 51.96 53.05 3n99 s ALA 134 Cb 0.00 -3.48 0.14 0.00 0.00 0.00 0.00 23.12 19.77 3n99 s ALA 134 CO -0.04 -0.62 0.65 -0.46 0.00 0.00 0.00 175.76 175.30 3n99 s TRP 135 N 1.71 -1.36 0.00 0.00 -0.00 -1.25 -1.88 118.94 116.15 3n99 s TRP 135 Ca 0.57 2.26 0.00 0.00 -0.00 0.00 0.00 56.10 58.94 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 0.25 -0.68 0.00 0.41 -0.00 0.00 0.00 176.95 176.93 3n99 n GLY 136 N 5.44 0.87 3.75 5.86 0.00 -1.26 -4.14 105.19 115.70 3n99 n GLY 136 Ca -0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 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 4.60 0.00 1.61 -1.52 -1.26 -2.31 119.66 120.78 3n99 s GLN 137 Ca 0.00 1.79 0.00 0.00 -1.95 0.00 0.00 55.36 55.20 3n99 s GLN 137 Cb 0.00 -3.23 0.00 0.00 -0.22 0.00 0.00 33.01 29.56 3n99 s GLN 137 CO 0.00 0.11 0.00 0.41 -0.25 0.00 0.00 175.29 175.56 3n99 n GLY 138 N 1.67 0.29 3.74 3.09 0.00 -1.26 -4.75 105.19 107.98 3n99 n GLY 138 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 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 4.28 -4.06 0.99 7.94 -0.98 -4.95 117.00 120.22 3n99 n LEU 139 Ca 0.00 1.18 -0.22 0.00 -1.11 0.00 0.00 56.01 55.86 3n99 n LEU 139 Cb 0.00 -1.57 -0.16 0.00 0.53 0.00 0.00 43.42 42.22 3n99 n LEU 139 CO 0.00 0.01 -0.46 -0.54 -1.11 0.00 0.00 177.39 175.29 3n99 s LYS 140 N -1.18 1.21 -0.49 1.96 1.02 -1.26 -4.43 119.74 116.56 3n99 s LYS 140 Ca 0.60 -0.42 -0.26 0.00 0.02 0.00 0.00 55.97 55.90 3n99 s LYS 140 Cb -0.51 -1.10 0.03 0.00 -0.52 0.00 0.00 37.83 35.72 3n99 s LYS 140 CO 0.55 0.18 1.01 -0.51 -0.92 0.00 0.00 175.35 175.67 3n99 s LEU 141 N 0.04 3.86 0.33 3.17 1.43 -1.26 -3.02 118.68 123.23 3n99 s LEU 141 Ca -0.02 0.13 0.13 0.00 -1.03 0.00 0.00 54.13 53.34 3n99 s LEU 141 Cb -0.09 -3.23 0.56 0.00 0.03 0.00 0.00 46.19 43.46 3n99 s LEU 141 CO 0.01 -1.18 1.72 -0.07 0.23 0.00 0.00 176.35 177.05 3n99 h LEU 142 N 10.95 0.00 -0.97 1.79 3.38 -1.27 -1.37 115.31 127.82 3n99 h LEU 142 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3n99 h LEU 142 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 3n99 h LEU 142 CO 1.08 0.49 0.00 0.47 0.09 0.00 0.00 178.44 180.57 3n99 n ASP 143 N -3.86 1.47 -3.24 -0.43 8.00 -1.26 -4.49 116.55 112.74 3n99 n ASP 143 Ca -0.01 -1.58 -0.25 0.00 0.71 0.00 0.00 54.79 53.66 3n99 n ASP 143 Cb 0.52 -0.05 -0.08 0.00 -0.02 0.00 0.00 41.12 41.49 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 0.17 -0.01 0.32 1.24 8.25 -0.52 -4.98 115.22 119.69 3n99 n HIS 144 Ca 0.18 -3.60 0.21 0.00 -0.26 0.00 0.00 57.72 54.24 3n99 n HIS 144 Cb 0.32 -0.30 1.07 0.00 1.12 0.00 0.00 29.99 32.20 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 4.22 0.00 -0.05 -0.41 0.13 -1.78 -1.20 132.00 132.91 3n99 h PRO 145 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3n99 h PRO 145 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 3n99 h PRO 145 CO 0.49 0.01 0.00 -0.25 -0.23 0.00 0.00 178.00 178.02 3n99 n ASP 146 N -3.17 1.87 -4.45 1.44 8.00 -1.26 -4.76 116.55 114.21 3n99 n ASP 146 Ca -0.02 -1.64 -0.40 0.00 0.71 0.00 0.00 54.79 53.44 3n99 n ASP 146 Cb 0.13 -0.02 -0.11 0.00 -0.02 0.00 0.00 41.12 41.10 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 -1.95 4.85 0.02 2.53 1.01 -0.46 -4.61 120.40 121.79 3n99 s VAL 147 Ca 0.35 -0.50 -0.19 0.00 0.00 0.00 0.00 61.98 61.64 3n99 s VAL 147 Cb 0.20 -3.56 -0.06 0.00 0.00 0.00 0.00 36.38 32.96 3n99 s VAL 147 CO 0.32 -0.07 0.55 -0.54 0.00 0.00 0.00 175.10 175.36 3n99 s LYS 148 N 1.64 4.23 0.14 2.72 -0.14 -0.38 -4.58 119.74 123.36 3n99 s LYS 148 Ca 0.04 0.68 0.10 0.00 -1.36 0.00 0.00 55.97 55.43 3n99 s LYS 148 Cb -0.18 -3.29 -0.04 0.00 -1.68 0.00 0.00 37.83 32.64 3n99 s LYS 148 CO 0.08 0.50 -0.23 0.14 -0.76 0.00 0.00 175.35 175.08 3n99 s VAL 149 N -0.60 2.48 0.15 3.17 -7.23 -1.26 -1.21 120.40 115.90 3n99 s VAL 149 Ca 0.29 -1.75 -0.25 0.00 -1.81 0.00 0.00 61.98 58.46 3n99 s VAL 149 Cb -0.18 -2.14 0.06 0.00 0.56 0.00 0.00 36.38 34.68 3n99 s VAL 149 CO 0.17 0.03 0.85 0.00 -0.31 0.00 0.00 175.10 175.84 3n99 s MET 150 N -2.27 1.25 -1.23 4.82 0.23 -0.63 -4.66 119.30 116.81 3n99 s MET 150 Ca 0.17 -0.63 0.00 0.00 -1.03 0.00 0.00 55.69 54.20 3n99 s MET 150 Cb -0.10 0.47 0.00 0.00 -1.53 0.00 0.00 34.83 33.67 3n99 s MET 150 CO 0.08 -0.57 0.00 0.09 -2.03 0.00 0.00 175.02 172.60 3n99 n ASN 151 N -0.41 -5.70 -3.85 -1.18 3.02 -1.26 -4.24 115.26 101.64 3n99 n ASN 151 Ca -0.07 0.29 -0.19 0.00 -0.03 0.00 0.00 54.58 54.57 3n99 n ASN 151 Cb 0.61 -4.24 -0.16 0.00 -0.61 0.00 0.00 39.78 35.37 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 -1.98 0.38 -0.09 2.41 2.07 -1.26 -0.68 121.20 122.05 3n99 s ILE 152 Ca 0.00 -0.01 -0.35 0.00 -1.41 0.00 0.00 60.65 58.88 3n99 s ILE 152 Cb 0.00 -0.45 -0.13 0.00 0.13 0.00 0.00 42.46 42.02 3n99 s ILE 152 CO 0.00 0.20 1.81 -0.67 -1.91 0.00 0.00 174.94 174.37 3n99 n ASP 153 N 4.22 3.20 0.16 4.50 2.03 -0.06 -4.63 116.55 125.98 3n99 n ASP 153 Ca -0.23 1.00 0.14 0.00 0.52 0.00 0.00 54.79 56.22 3n99 n ASP 153 Cb 0.51 -1.34 0.70 0.00 -0.72 0.00 0.00 41.12 40.26 3n99 n ASP 153 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3n99 h PRO 154 N 8.42 0.00 -0.14 -0.67 0.11 -1.90 0.11 132.00 137.93 3n99 h PRO 154 Ca -0.48 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.41 3n99 h PRO 154 Cb 1.28 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.40 3n99 h PRO 154 CO 0.94 0.00 -0.78 -0.44 -0.21 0.00 0.00 178.00 177.51 3n99 h ASP 155 N 0.00 0.86 -0.51 -2.05 3.32 -1.96 -2.90 116.42 113.18 3n99 h ASP 155 Ca 0.10 -0.57 -0.05 0.00 0.02 0.00 0.00 57.03 56.53 3n99 h ASP 155 Cb 0.42 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 3n99 h ASP 155 CO -0.00 1.36 0.14 0.25 -1.72 0.00 0.00 179.24 179.27 3n99 h LEU 156 N 0.49 0.81 -1.13 1.55 5.85 -1.38 -2.86 115.31 118.63 3n99 h LEU 156 Ca -0.05 -0.14 0.07 0.00 0.84 0.00 0.00 57.88 58.59 3n99 h LEU 156 Cb 1.40 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 42.16 3n99 h LEU 156 CO 0.16 0.79 0.59 0.15 -0.34 0.00 0.00 178.44 179.79 3n99 h PHE 157 N 0.84 1.06 0.00 1.25 3.57 -0.71 -0.84 116.94 122.10 3n99 h PHE 157 Ca 0.18 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.71 3n99 h PHE 157 Cb 0.29 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 38.69 3n99 h PHE 157 CO 0.02 0.55 0.00 0.39 -2.23 0.00 0.00 178.31 177.04 3n99 n GLU 158 N -4.49 0.01 -0.12 1.11 1.02 -1.08 -2.86 120.64 114.23 3n99 n GLU 158 Ca 0.14 0.22 0.09 0.00 -0.02 0.00 0.00 57.16 57.58 3n99 n GLU 158 Cb 0.20 -1.50 0.14 0.00 -0.02 0.00 0.00 31.44 30.26 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 -1.49 2.01 0.00 3.49 5.02 -0.32 -4.53 118.16 122.34 3n99 n LYS 159 Ca 0.04 -1.89 0.15 0.00 -2.02 0.00 0.00 58.31 54.59 3n99 n LYS 159 Cb 0.19 -1.37 0.69 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 1.01 0.56 0.00 -0.35 4.77 -1.13 -4.89 117.00 116.96 3n99 n LEU 160 Ca 0.13 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 3n99 n LEU 160 Cb 0.47 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 3n99 n LEU 160 CO 0.11 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.88 3n99 n GLY 161 N 1.18 0.41 3.73 -0.72 0.00 -1.26 -4.74 105.19 103.78 3n99 n GLY 161 Ca 0.18 -0.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.80 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 4.19 -0.07 -0.61 1.01 -1.26 -4.53 121.20 117.93 3n99 s ILE 162 Ca 0.00 1.77 0.03 0.00 0.00 0.00 0.00 60.65 62.45 3n99 s ILE 162 Cb 0.00 -4.13 0.01 0.00 0.01 0.00 0.00 42.46 38.35 3n99 s ILE 162 CO 0.00 0.25 -0.14 -1.10 0.00 0.00 0.00 174.94 173.95 3n99 s GLN 163 N 0.13 1.91 -0.11 2.79 -0.21 -0.63 -4.97 119.66 118.56 3n99 s GLN 163 Ca 0.51 -0.49 -0.22 0.00 0.02 0.00 0.00 55.36 55.18 3n99 s GLN 163 Cb -0.27 -1.54 -0.03 0.00 1.00 0.00 0.00 33.01 32.17 3n99 s GLN 163 CO 0.32 0.06 0.64 -2.00 -2.12 0.00 0.00 175.29 172.19 3n99 s GLU 164 N 0.60 4.36 -0.21 2.91 2.12 -1.26 -0.53 118.70 126.69 3n99 s GLU 164 Ca -0.15 0.73 -0.06 0.00 0.36 0.00 0.00 54.97 55.86 3n99 s GLU 164 Cb -0.16 -3.48 0.10 0.00 0.26 0.00 0.00 34.13 30.85 3n99 s GLU 164 CO 0.05 -0.01 0.40 0.21 -0.54 0.00 0.00 175.26 175.36 3n99 s LYS 165 N 1.10 0.32 -1.36 4.30 2.20 -0.21 -4.90 119.74 121.19 3n99 s LYS 165 Ca 0.33 0.88 -0.04 0.00 -0.36 0.00 0.00 55.97 56.78 3n99 s LYS 165 Cb -0.17 0.09 0.02 0.00 -1.51 0.00 0.00 37.83 36.27 3n99 s LYS 165 CO 0.14 -0.36 0.84 0.09 -0.36 0.00 0.00 175.35 175.69 3n99 n ASN 166 N 5.38 -2.58 -0.14 1.43 3.02 -1.26 -1.66 115.26 119.45 3n99 n ASN 166 Ca -0.07 -0.77 -0.02 0.00 -0.03 0.00 0.00 54.58 53.69 3n99 n ASN 166 Cb 0.50 -4.17 -0.01 0.00 -0.61 0.00 0.00 39.78 35.49 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 -1.60 0.41 3.43 7.41 0.00 -1.26 -5.01 105.19 108.56 3n99 n GLY 167 Ca -0.19 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.35 1.85 -0.34 1.61 1.02 -0.67 -4.94 119.74 116.92 3n99 s LYS 168 Ca 0.00 -1.11 -0.10 0.00 0.02 0.00 0.00 55.97 54.78 3n99 s LYS 168 Cb 0.00 -2.08 0.01 0.00 -0.52 0.00 0.00 37.83 35.24 3n99 s LYS 168 CO 0.00 0.51 0.18 0.42 -0.92 0.00 0.00 175.35 175.54 3n99 s ILE 169 N -0.96 4.60 -0.16 2.17 1.01 0.05 -1.05 121.20 126.86 3n99 s ILE 169 Ca 0.15 -0.64 -0.17 0.00 0.00 0.00 0.00 60.65 59.99 3n99 s ILE 169 Cb -0.10 -3.46 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 3n99 s ILE 169 CO 0.06 -0.09 0.43 -1.00 0.00 0.00 0.00 174.94 174.34 3n99 s HIS 170 N 1.59 3.45 -0.16 3.97 3.76 0.31 0.11 115.29 128.31 3n99 s HIS 170 Ca 0.03 0.76 -0.01 0.00 -0.15 0.00 0.00 55.06 55.70 3n99 s HIS 170 Cb -0.18 -2.53 0.04 0.00 1.11 0.00 0.00 32.58 31.02 3n99 s HIS 170 CO 0.07 0.09 -0.05 0.08 -0.85 0.00 0.00 174.74 174.08 3n99 s VAL 171 N 0.92 1.08 0.10 -0.90 1.01 -0.56 -1.61 120.40 120.44 3n99 s VAL 171 Ca 0.22 -0.59 -0.31 0.00 0.00 0.00 0.00 61.98 61.30 3n99 s VAL 171 Cb -0.15 -1.25 -0.09 0.00 0.00 0.00 0.00 36.38 34.89 3n99 s VAL 171 CO 0.09 0.14 1.72 -2.84 0.00 0.00 0.00 175.10 174.21 3n99 s PRO 172 N 1.65 4.17 0.11 2.72 0.02 -1.26 -0.35 135.00 142.05 3n99 s PRO 172 Ca 0.01 2.45 0.04 0.00 0.02 0.00 0.00 61.00 63.52 3n99 s PRO 172 Cb -0.15 -3.55 -0.04 0.00 0.02 0.00 0.00 34.50 30.78 3n99 s PRO 172 CO -0.08 -0.77 -0.10 0.14 -0.33 0.00 0.00 177.00 175.86 3n99 s VAL 173 N 2.55 1.00 -0.36 3.83 -7.23 -0.31 -4.83 120.40 115.05 3n99 s VAL 173 Ca 0.77 -1.72 0.23 0.00 -1.81 0.00 0.00 61.98 59.45 3n99 s VAL 173 Cb -0.43 -1.46 0.09 0.00 0.56 0.00 0.00 36.38 35.14 3n99 s VAL 173 CO 0.34 -0.58 1.23 -0.37 -0.31 0.00 0.00 175.10 175.41 3n99 h VAL 174 N 3.42 0.00 -2.58 1.32 -1.51 -1.15 0.25 116.25 116.00 3n99 h VAL 174 Ca -0.37 -0.90 -0.04 0.00 -1.23 0.00 0.00 66.70 64.15 3n99 h VAL 174 Cb 1.19 1.53 -0.16 0.00 -2.13 0.00 0.00 31.29 31.73 3n99 h VAL 174 CO 0.55 0.00 0.16 0.00 -1.23 0.00 0.00 177.57 177.05 3n99 s ALA 175 N -3.29 -1.59 -0.27 5.19 0.00 -1.26 -4.75 121.76 115.79 3n99 s ALA 175 Ca 0.03 0.82 0.00 0.00 0.00 0.00 0.00 51.96 52.81 3n99 s ALA 175 Cb 0.09 0.44 0.05 0.00 0.00 0.00 0.00 23.12 23.70 3n99 s ALA 175 CO 0.75 -0.56 -0.07 0.15 0.00 0.00 0.00 175.76 176.03 3n99 s LYS 176 N -2.49 2.44 -0.25 0.00 1.02 -1.26 -2.12 119.74 117.08 3n99 s LYS 176 Ca -0.05 -1.23 -0.09 0.00 0.02 0.00 0.00 55.97 54.62 3n99 s LYS 176 Cb -0.01 -2.99 -0.04 0.00 -0.52 0.00 0.00 37.83 34.27 3n99 s LYS 176 CO -0.02 -0.54 0.13 0.42 -0.92 0.00 0.00 175.35 174.42 3n99 s ILE 177 N 1.20 4.97 0.63 2.17 1.01 -0.19 -4.94 121.20 126.06 3n99 s ILE 177 Ca -0.05 0.05 -0.18 0.00 0.00 0.00 0.00 60.65 60.46 3n99 s ILE 177 Cb -0.19 -3.32 -0.02 0.00 0.01 0.00 0.00 42.46 38.94 3n99 s ILE 177 CO -0.04 0.33 1.27 -2.84 0.00 0.00 0.00 174.94 173.67 3n99 s PRO 178 N 1.31 2.65 0.33 2.79 0.02 -1.26 -0.32 135.00 140.53 3n99 s PRO 178 Ca 0.06 2.01 0.07 0.00 0.02 0.00 0.00 61.00 63.17 3n99 s PRO 178 Cb -0.15 -1.86 0.76 0.00 0.02 0.00 0.00 34.50 33.27 3n99 s PRO 178 CO 0.06 -1.51 1.84 0.00 -0.33 0.00 0.00 177.00 177.06 3n99 h ALA 179 N 0.63 1.76 0.00 -1.55 0.00 -1.86 -1.28 119.26 116.96 3n99 h ALA 179 Ca -0.51 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3n99 h ALA 179 Cb 1.33 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3n99 h ALA 179 CO 0.54 -0.03 0.00 -2.39 0.00 0.00 0.00 179.25 177.36 3n99 n HIS 180 N -4.61 0.81 1.76 0.00 1.44 -1.26 -1.43 115.22 111.93 3n99 n HIS 180 Ca 0.19 0.28 0.11 0.00 -2.01 0.00 0.00 57.72 56.29 3n99 n HIS 180 Cb 0.48 -0.96 0.55 0.00 0.12 0.00 0.00 29.99 30.19 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 -2.20 1.24 -3.70 -1.40 2.00 -0.48 -4.84 117.12 107.73 3n99 n MET 181 Ca 0.04 -0.35 -0.36 0.00 0.00 0.00 0.00 57.70 57.02 3n99 n MET 181 Cb 0.31 -1.36 -0.06 0.00 0.00 0.00 0.00 33.22 32.12 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 -1.94 3.66 0.00 0.03 -1.94 -0.52 -0.32 119.30 118.27 3n99 s MET 182 Ca 0.32 0.06 0.00 0.00 -1.71 0.00 0.00 55.69 54.36 3n99 s MET 182 Cb 0.16 -3.11 0.00 0.00 2.01 0.00 0.00 34.83 33.88 3n99 s MET 182 CO 0.25 0.67 0.00 0.41 -0.01 0.00 0.00 175.02 176.34 3n99 n GLY 183 N 1.38 2.93 3.69 -0.03 0.00 0.67 -4.85 105.19 108.98 3n99 n GLY 183 Ca -0.13 -0.36 -0.44 0.00 0.00 0.00 0.00 46.02 45.10 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 3.62 0.00 1.61 2.88 -0.19 -1.76 113.62 119.78 3n99 n SER 184 Ca 0.00 1.05 0.00 0.00 -1.33 0.00 0.00 58.87 58.59 3n99 n SER 184 Cb 0.00 -1.50 0.00 0.00 -0.75 0.00 0.00 64.21 61.96 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 3.82 2.75 3.60 0.46 0.00 -1.26 -0.86 105.19 113.71 3n99 n GLY 185 Ca 0.17 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.88 1.52 -0.21 -0.61 5.41 -0.72 -1.71 119.36 122.16 3n99 n ILE 186 Ca 0.00 -0.38 0.00 0.00 1.00 0.00 0.00 62.75 63.37 3n99 n ILE 186 Cb 0.00 -1.05 0.00 0.00 -0.71 0.00 0.00 39.64 37.88 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 1.56 1.35 3.60 7.39 0.00 0.37 -4.99 105.19 114.48 3n99 n GLY 187 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.66 0.11 -0.27 4.61 0.00 -0.70 -4.73 120.51 118.88 3n99 n ALA 188 Ca 0.00 0.15 0.08 0.00 0.00 0.00 0.00 53.44 53.67 3n99 n ALA 188 Cb 0.00 -2.07 0.32 0.00 0.00 0.00 0.00 19.45 17.70 3n99 n ALA 188 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3n99 h SER 189 N 1.19 0.76 -3.01 0.00 0.02 -1.92 -1.47 113.55 109.11 3n99 h SER 189 Ca -0.46 0.02 -0.25 0.00 -0.84 0.00 0.00 61.79 60.27 3n99 h SER 189 Cb 1.35 -0.13 -0.34 0.00 0.14 0.00 0.00 62.40 63.42 3n99 h SER 189 CO 0.55 0.44 -0.57 -0.55 -1.14 0.00 0.00 176.83 175.56 3n99 s SER 190 N -5.93 0.44 0.45 3.07 0.15 -1.26 -3.45 113.70 107.17 3n99 s SER 190 Ca -0.11 0.48 0.25 0.00 0.70 0.00 0.00 55.95 57.27 3n99 s SER 190 Cb 0.21 0.49 1.37 0.00 -1.71 0.00 0.00 66.02 66.38 3n99 s SER 190 CO 0.79 -0.23 1.75 0.77 1.20 0.00 0.00 173.24 177.51 3n99 h SER 191 N 8.19 0.00 0.90 5.45 4.64 -1.37 -1.60 113.55 129.77 3n99 h SER 191 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 3n99 h SER 191 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 3n99 h SER 191 CO 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.13 3n99 n ALA 192 N -1.80 2.00 -1.19 5.18 0.00 -1.26 -4.08 120.51 119.35 3n99 n ALA 192 Ca -0.02 -0.03 0.03 0.00 0.00 0.00 0.00 53.44 53.42 3n99 n ALA 192 Cb 0.17 -1.39 0.04 0.00 0.00 0.00 0.00 19.45 18.27 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 -1.81 0.97 -3.70 0.00 3.41 -0.60 -4.19 113.62 107.70 3n99 n SER 193 Ca 0.05 -2.07 -0.07 0.00 -0.26 0.00 0.00 58.87 56.51 3n99 n SER 193 Cb 0.29 -0.18 -0.02 0.00 -0.26 0.00 0.00 64.21 64.04 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 -0.94 0.00 0.45 6.66 -1.32 -1.24 -4.66 115.64 114.59 3n99 s THR 194 Ca 0.09 -0.58 0.08 0.00 -1.21 0.00 0.00 61.69 60.06 3n99 s THR 194 Cb 0.07 -1.66 0.02 0.00 -1.51 0.00 0.00 72.50 69.42 3n99 s THR 194 CO 0.01 0.00 0.61 1.51 -2.21 0.00 0.00 174.62 174.54 3n99 s ASP 195 N -2.84 5.56 0.16 8.08 -4.77 -1.26 -4.65 116.67 116.95 3n99 s ASP 195 Ca 0.08 -0.49 -0.02 0.00 -3.30 0.00 0.00 52.55 48.83 3n99 s ASP 195 Cb -0.03 -0.50 -0.04 0.00 -1.09 0.00 0.00 42.92 41.26 3n99 s ASP 195 CO -0.00 -0.87 0.11 -0.72 0.70 0.00 0.00 175.17 174.39 3n99 s TYR 196 N -2.41 0.94 -0.10 2.11 1.13 -0.46 -4.68 117.35 113.88 3n99 s TYR 196 Ca 0.56 -1.25 -0.05 0.00 -1.41 0.00 0.00 57.07 54.92 3n99 s TYR 196 Cb -0.09 -0.47 -0.04 0.00 -1.10 0.00 0.00 41.96 40.26 3n99 s TYR 196 CO 0.34 -0.59 0.10 -0.51 -2.51 0.00 0.00 175.55 172.38 3n99 s ASP 197 N -3.09 6.01 -0.41 -0.18 1.11 -0.04 -0.24 116.67 119.84 3n99 s ASP 197 Ca 0.29 0.35 -0.24 0.00 0.18 0.00 0.00 52.55 53.13 3n99 s ASP 197 Cb 0.07 -1.87 0.02 0.00 1.07 0.00 0.00 42.92 42.21 3n99 s ASP 197 CO 0.06 0.39 0.85 -0.63 1.18 0.00 0.00 175.17 177.01 3n99 s ILE 198 N -1.01 4.62 -1.07 0.77 1.01 -0.38 -0.24 121.20 124.90 3n99 s ILE 198 Ca 0.16 0.81 -0.04 0.00 0.00 0.00 0.00 60.65 61.58 3n99 s ILE 198 Cb -0.12 -4.31 0.19 0.00 0.01 0.00 0.00 42.46 38.23 3n99 s ILE 198 CO 0.05 -0.61 2.23 1.15 0.00 0.00 0.00 174.94 177.76 3n99 n MET 199 N 6.74 4.42 -3.88 2.79 0.00 0.57 -2.91 117.12 124.84 3n99 n MET 199 Ca 0.04 -3.70 -0.35 0.00 0.00 0.00 0.00 57.70 53.69 3n99 n MET 199 Cb 0.48 -2.48 -0.11 0.00 0.00 0.00 0.00 33.22 31.11 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 -2.49 3.36 0.27 3.17 0.00 -1.26 -4.89 121.76 119.92 3n99 s ALA 200 Ca 0.50 -0.90 0.11 0.00 0.00 0.00 0.00 51.96 51.67 3n99 s ALA 200 Cb 0.24 -2.04 0.39 0.00 0.00 0.00 0.00 23.12 21.71 3n99 s ALA 200 CO -0.15 -0.10 1.63 0.77 0.00 0.00 0.00 175.76 177.91 3n99 h SER 201 N 7.34 0.00 -4.54 0.00 0.02 -1.90 -3.45 113.55 111.02 3n99 h SER 201 Ca -0.37 0.00 -0.30 0.00 -0.84 0.00 0.00 61.79 60.28 3n99 h SER 201 Cb 1.17 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 63.48 3n99 h SER 201 CO 0.65 0.59 -0.74 0.20 -1.14 0.00 0.00 176.83 176.39 3n99 s ASN 202 N -6.83 0.86 0.52 3.07 0.01 -1.26 -5.00 114.94 106.32 3n99 s ASN 202 Ca -0.01 -0.44 0.17 0.00 -0.71 0.00 0.00 52.86 51.86 3n99 s ASN 202 Cb 0.13 0.00 1.31 0.00 0.41 0.00 0.00 41.25 43.10 3n99 s ASN 202 CO 0.76 -0.13 2.16 1.55 -1.51 0.00 0.00 177.10 179.93 3n99 h PRO 203 N 4.85 0.00 0.00 -0.60 0.13 -1.87 -1.51 132.00 133.00 3n99 h PRO 203 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3n99 h PRO 203 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3n99 h PRO 203 CO 0.43 0.00 0.00 0.93 -0.23 0.00 0.00 178.00 179.13 3n99 h GLU 204 N 0.00 0.00 0.00 0.86 3.07 -1.81 0.08 114.58 116.78 3n99 h GLU 204 Ca -0.00 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.85 3n99 h GLU 204 Cb 0.01 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3n99 h GLU 204 CO 0.00 0.00 -0.02 -0.44 -1.40 0.00 0.00 179.01 177.15 3n99 h ASP 205 N 0.00 0.00 -0.71 1.42 3.32 -1.56 -1.24 116.42 117.65 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 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 3n99 h ASP 205 CO 0.00 0.02 0.00 0.18 -1.72 0.00 0.00 179.24 177.72 3n99 n LEU 206 N -3.16 3.93 -2.36 1.55 4.77 -0.00 -4.96 117.00 116.76 3n99 n LEU 206 Ca -0.01 -1.95 -0.17 0.00 -0.03 0.00 0.00 56.01 53.85 3n99 n LEU 206 Cb 0.23 -0.47 0.03 0.00 -2.33 0.00 0.00 43.42 40.88 3n99 n LEU 206 CO 0.26 0.97 -0.02 0.61 -1.33 0.00 0.00 177.39 177.88 3n99 n GLY 207 N 1.65 -0.27 3.20 -0.72 0.00 -0.47 -4.84 105.19 103.75 3n99 n GLY 207 Ca 0.24 -0.08 -0.12 0.00 0.00 0.00 0.00 46.02 46.06 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 -3.02 0.57 -0.12 1.61 -7.23 -1.11 -4.99 120.40 106.11 3n99 s VAL 208 Ca 0.22 -1.95 0.15 0.00 -1.81 0.00 0.00 61.98 58.58 3n99 s VAL 208 Cb -0.10 -1.99 -0.04 0.00 0.56 0.00 0.00 36.38 34.82 3n99 s VAL 208 CO 0.27 -0.58 1.20 0.00 -0.31 0.00 0.00 175.10 175.67 3n99 h ALA 209 N 2.80 0.63 -2.89 1.32 0.00 -1.96 -2.79 119.26 116.37 3n99 h ALA 209 Ca -0.36 -0.65 -0.03 0.00 0.00 0.00 0.00 54.91 53.88 3n99 h ALA 209 Cb 1.19 0.05 -0.11 0.00 0.00 0.00 0.00 17.79 18.91 3n99 h ALA 209 CO 0.63 0.80 0.08 0.34 0.00 0.00 0.00 179.25 181.09 3n99 s ASP 210 N -6.24 -0.37 -0.03 0.00 2.15 -1.26 -4.82 116.67 106.10 3n99 s ASP 210 Ca 0.01 -0.25 -0.01 0.00 0.43 0.00 0.00 52.55 52.73 3n99 s ASP 210 Cb 0.08 0.56 0.03 0.00 -0.30 0.00 0.00 42.92 43.29 3n99 s ASP 210 CO 0.78 -0.97 0.05 -0.22 -0.17 0.00 0.00 175.17 174.63 3n99 s LEU 211 N -2.81 0.71 0.01 -1.34 2.96 -1.26 -5.01 118.68 111.94 3n99 s LEU 211 Ca 0.04 0.07 0.01 0.00 -0.22 0.00 0.00 54.13 54.04 3n99 s LEU 211 Cb -0.00 -0.07 -0.04 0.00 0.50 0.00 0.00 46.19 46.58 3n99 s LEU 211 CO -0.09 -0.18 0.02 -0.54 -1.32 0.00 0.00 176.35 174.25 3n99 s LYS 212 N 1.49 2.84 0.12 1.98 1.02 -1.26 -0.92 119.74 125.01 3n99 s LYS 212 Ca -0.04 -0.60 -0.35 0.00 0.02 0.00 0.00 55.97 55.01 3n99 s LYS 212 Cb -0.13 -2.71 -0.15 0.00 -0.52 0.00 0.00 37.83 34.33 3n99 s LYS 212 CO -0.03 0.62 1.53 1.28 -0.92 0.00 0.00 175.35 177.83 3n99 n LEU 213 N 1.27 2.71 0.00 3.17 4.77 0.11 -1.46 117.00 127.56 3n99 n LEU 213 Ca -0.14 1.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.93 3n99 n LEU 213 Cb 0.53 -1.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.26 3n99 n LEU 213 CO 0.35 -0.49 0.00 0.61 -1.33 0.00 0.00 177.39 176.54 3n99 n GLY 214 N 3.22 0.67 3.77 -0.72 0.00 0.10 -1.08 105.19 111.16 3n99 n GLY 214 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.79 6.41 -0.18 1.61 1.01 -0.53 -1.45 116.67 120.74 3n99 s ASP 215 Ca 0.00 2.25 -0.18 0.00 0.71 0.00 0.00 52.55 55.33 3n99 s ASP 215 Cb 0.00 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.29 3n99 s ASP 215 CO 0.00 -0.75 0.49 -0.63 0.21 0.00 0.00 175.17 174.49 3n99 s ILE 216 N -1.54 5.14 0.20 0.77 1.01 0.36 -1.39 121.20 125.75 3n99 s ILE 216 Ca 0.60 0.91 0.08 0.00 0.00 0.00 0.00 60.65 62.24 3n99 s ILE 216 Cb -0.27 -3.82 -0.05 0.00 0.01 0.00 0.00 42.46 38.33 3n99 s ILE 216 CO 0.34 0.22 -0.15 0.68 0.00 0.00 0.00 174.94 176.03 3n99 s VAL 217 N 1.38 1.71 -0.01 2.92 -7.23 -0.00 -0.75 120.40 118.42 3n99 s VAL 217 Ca 0.24 -2.18 0.01 0.00 -1.81 0.00 0.00 61.98 58.24 3n99 s VAL 217 Cb -0.15 -2.01 -0.04 0.00 0.56 0.00 0.00 36.38 34.74 3n99 s VAL 217 CO 0.09 -0.58 0.02 0.00 -0.31 0.00 0.00 175.10 174.33 3n99 s ALA 218 N -2.90 3.37 -0.21 1.32 0.00 -0.90 -0.05 121.76 122.39 3n99 s ALA 218 Ca 0.21 -0.92 0.02 0.00 0.00 0.00 0.00 51.96 51.28 3n99 s ALA 218 Cb -0.01 -1.42 0.04 0.00 0.00 0.00 0.00 23.12 21.73 3n99 s ALA 218 CO 0.06 0.66 -0.16 0.42 0.00 0.00 0.00 175.76 176.74 3n99 s ILE 219 N -1.10 2.11 0.14 0.00 1.01 0.71 -1.02 121.20 123.04 3n99 s ILE 219 Ca 0.20 -1.24 -0.29 0.00 0.00 0.00 0.00 60.65 59.32 3n99 s ILE 219 Cb -0.12 -2.04 -0.07 0.00 0.01 0.00 0.00 42.46 40.25 3n99 s ILE 219 CO 0.11 0.30 0.94 -1.10 0.00 0.00 0.00 174.94 175.18 3n99 s GLN 220 N 1.21 4.71 -1.47 2.79 -0.21 0.57 -1.78 119.66 125.48 3n99 s GLN 220 Ca -0.01 1.42 0.00 0.00 0.02 0.00 0.00 55.36 56.79 3n99 s GLN 220 Cb -0.16 -3.35 0.00 0.00 1.00 0.00 0.00 33.01 30.50 3n99 s GLN 220 CO -0.10 0.30 0.00 -0.25 -2.12 0.00 0.00 175.29 173.12 3n99 n ASP 221 N 2.47 -4.91 -4.17 5.90 8.00 0.54 -2.71 116.55 121.67 3n99 n ASP 221 Ca 0.01 0.06 -0.31 0.00 0.71 0.00 0.00 54.79 55.26 3n99 n ASP 221 Cb 0.49 -3.99 -0.17 0.00 -0.02 0.00 0.00 41.12 37.43 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 -2.78 2.42 -0.13 1.24 3.76 -1.24 -1.63 115.29 116.92 3n99 s HIS 222 Ca 0.00 -1.09 -0.11 0.00 -0.15 0.00 0.00 55.06 53.72 3n99 s HIS 222 Cb 0.00 -1.65 -0.05 0.00 1.11 0.00 0.00 32.58 31.99 3n99 s HIS 222 CO 0.00 -0.48 0.22 0.34 -0.85 0.00 0.00 174.74 173.97 3n99 s ASP 223 N 0.61 6.42 -0.14 1.40 -1.08 0.68 -3.46 116.67 121.10 3n99 s ASP 223 Ca -0.13 0.49 0.16 0.00 -0.52 0.00 0.00 52.55 52.55 3n99 s ASP 223 Cb -0.17 -2.13 0.42 0.00 -1.46 0.00 0.00 42.92 39.58 3n99 s ASP 223 CO 0.04 0.26 1.20 0.59 0.52 0.00 0.00 175.17 177.78 3n99 n ASN 224 N 2.76 1.49 -0.31 -0.34 3.02 -1.26 -2.07 115.26 118.54 3n99 n ASN 224 Ca -0.16 -3.29 -0.04 0.00 -0.03 0.00 0.00 54.58 51.06 3n99 n ASN 224 Cb 0.53 -0.45 0.08 0.00 -0.61 0.00 0.00 39.78 39.32 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 0.97 1.04 0.00 6.41 0.02 -1.94 -3.43 113.55 116.62 3n99 h SER 225 Ca -0.07 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 3n99 h SER 225 Cb 1.28 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.56 3n99 h SER 225 CO 0.03 0.84 0.00 -1.22 -1.14 0.00 0.00 176.83 175.34 3n99 n TYR 226 N -4.39 0.00 -1.79 3.45 4.01 -1.26 -4.91 117.16 112.26 3n99 n TYR 226 Ca 0.08 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.53 3n99 n TYR 226 Cb 0.09 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.20 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 -1.02 1.60 -0.11 2.72 0.00 -1.22 -1.12 107.32 108.17 3n99 s GLY 227 Ca 0.00 -0.48 -0.25 0.00 0.00 0.00 0.00 44.72 43.99 3n99 s GLY 227 CO 0.00 -0.02 0.78 0.14 0.00 0.00 0.00 173.10 174.00 3n99 s VAL 228 N -3.41 4.96 0.00 1.40 1.01 -0.55 -4.54 120.40 119.26 3n99 s VAL 228 Ca 0.61 1.58 0.00 0.00 0.00 0.00 0.00 61.98 64.17 3n99 s VAL 228 Cb -0.12 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 32.15 3n99 s VAL 228 CO 0.51 0.14 0.00 0.61 0.00 0.00 0.00 175.10 176.36 3n99 n GLY 229 N 3.26 0.88 3.63 4.51 0.00 -1.22 -0.48 105.19 115.78 3n99 n GLY 229 Ca 0.02 -0.67 -0.43 0.00 0.00 0.00 0.00 46.02 44.94 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 -4.53 3.83 0.06 1.61 2.47 -0.88 -4.77 119.74 117.54 3n99 s LYS 230 Ca 0.00 1.63 -0.31 0.00 -1.56 0.00 0.00 55.97 55.74 3n99 s LYS 230 Cb 0.00 -4.01 -0.08 0.00 -1.46 0.00 0.00 37.83 32.28 3n99 s LYS 230 CO 0.00 -1.24 1.71 -0.47 0.16 0.00 0.00 175.35 175.51 3n99 s TYR 231 N 5.02 2.23 -0.23 4.03 5.04 -1.26 -0.23 117.35 131.95 3n99 s TYR 231 Ca 0.69 0.18 -0.05 0.00 -2.44 0.00 0.00 57.07 55.46 3n99 s TYR 231 Cb -0.24 -4.02 0.12 0.00 0.35 0.00 0.00 41.96 38.17 3n99 s TYR 231 CO 0.28 -4.17 0.44 0.50 -1.34 0.00 0.00 175.55 171.26 3n99 s ARG 232 N 2.96 0.38 0.11 4.97 3.52 -0.65 -4.92 118.95 125.32 3n99 s ARG 232 Ca 0.76 0.89 -0.31 0.00 -0.13 0.00 0.00 55.73 56.94 3n99 s ARG 232 Cb -0.40 0.11 -0.10 0.00 -1.56 0.00 0.00 34.95 32.99 3n99 s ARG 232 CO 0.33 -0.43 1.80 0.21 -0.81 0.00 0.00 175.30 176.40 3n99 s LYS 233 N 2.64 4.15 0.00 5.12 2.47 -1.26 -0.95 119.74 131.90 3n99 s LYS 233 Ca 0.06 2.55 0.00 0.00 -1.56 0.00 0.00 55.97 57.02 3n99 s LYS 233 Cb -0.14 -3.59 0.00 0.00 -1.46 0.00 0.00 37.83 32.65 3n99 s LYS 233 CO -0.15 -0.82 0.00 0.41 0.16 0.00 0.00 175.35 174.95 3n99 n GLY 234 N 4.19 1.10 3.80 5.54 0.00 -1.26 -5.04 105.19 113.51 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 -2.32 2.74 0.01 4.61 0.00 -0.13 -0.84 121.76 125.83 3n99 s ALA 235 Ca 0.00 0.45 0.01 0.00 0.00 0.00 0.00 51.96 52.42 3n99 s ALA 235 Cb 0.00 -3.25 -0.01 0.00 0.00 0.00 0.00 23.12 19.87 3n99 s ALA 235 CO 0.00 -0.75 -0.03 0.54 0.00 0.00 0.00 175.76 175.52 3n99 s VAL 236 N -2.34 0.17 0.10 0.00 0.11 0.36 -0.34 120.40 118.46 3n99 s VAL 236 Ca 0.65 -0.32 0.08 0.00 -2.93 0.00 0.00 61.98 59.46 3n99 s VAL 236 Cb -0.17 -0.20 -0.03 0.00 -1.53 0.00 0.00 36.38 34.45 3n99 s VAL 236 CO 0.34 -0.09 -0.21 -0.44 -3.33 0.00 0.00 175.10 171.36 3n99 s SER 237 N -0.43 2.61 -0.04 3.54 0.01 -0.73 -1.34 113.70 117.31 3n99 s SER 237 Ca -0.03 -0.68 0.04 0.00 1.31 0.00 0.00 55.95 56.59 3n99 s SER 237 Cb -0.03 -0.15 -0.03 0.00 0.21 0.00 0.00 66.02 66.02 3n99 s SER 237 CO -0.00 0.08 -0.15 -0.63 0.41 0.00 0.00 173.24 172.95 3n99 s ILE 238 N -1.12 3.00 0.23 1.44 -1.09 0.11 -0.21 121.20 123.57 3n99 s ILE 238 Ca 0.07 -0.76 -0.06 0.00 -2.23 0.00 0.00 60.65 57.67 3n99 s ILE 238 Cb -0.10 -2.18 -0.02 0.00 -1.58 0.00 0.00 42.46 38.58 3n99 s ILE 238 CO 0.04 0.58 0.31 -0.83 -1.23 0.00 0.00 174.94 173.81 3n99 s GLY 239 N -0.76 1.07 -0.11 6.18 0.00 0.93 -0.55 107.32 114.08 3n99 s GLY 239 Ca 0.12 -1.33 0.03 0.00 0.00 0.00 0.00 44.72 43.53 3n99 s GLY 239 CO 0.01 -1.03 -0.21 0.14 0.00 0.00 0.00 173.10 172.01 3n99 s VAL 240 N -4.01 2.36 0.01 1.40 1.01 -0.03 -0.82 120.40 120.33 3n99 s VAL 240 Ca 0.31 -0.91 -0.30 0.00 0.00 0.00 0.00 61.98 61.08 3n99 s VAL 240 Cb 0.03 -1.93 -0.05 0.00 0.00 0.00 0.00 36.38 34.43 3n99 s VAL 240 CO 0.12 0.55 1.27 -0.69 0.00 0.00 0.00 175.10 176.35 3n99 s VAL 241 N 0.33 3.96 0.00 2.92 1.01 -0.49 -1.26 120.40 126.87 3n99 s VAL 241 Ca -0.16 1.35 0.00 0.00 0.00 0.00 0.00 61.98 63.17 3n99 s VAL 241 Cb -0.17 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.34 3n99 s VAL 241 CO 0.08 0.04 0.00 1.33 0.00 0.00 0.00 175.10 176.55 3n99 n VAL 242 N 4.38 0.00 -4.02 2.92 0.24 0.64 0.00 118.33 122.50 3n99 n VAL 242 Ca 0.11 -0.18 -0.10 0.00 -2.04 0.00 0.00 64.34 62.13 3n99 n VAL 242 Cb 0.45 0.67 -0.07 0.00 -1.47 0.00 0.00 33.84 33.42 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 -1.55 0.53 0.88 6.34 -3.43 -1.25 -4.53 115.29 112.28 3n99 s HIS 243 Ca 0.00 -0.87 -0.12 0.00 -0.80 0.00 0.00 55.06 53.27 3n99 s HIS 243 Cb 0.00 -0.08 0.12 0.00 -1.43 0.00 0.00 32.58 31.19 3n99 s HIS 243 CO 0.00 -0.79 1.12 -1.54 -2.00 0.00 0.00 174.74 171.53 3n99 s SER 244 N -3.02 3.73 0.92 7.38 1.04 -0.33 -3.28 113.70 120.13 3n99 s SER 244 Ca 0.23 1.14 -0.12 0.00 0.48 0.00 0.00 55.95 57.68 3n99 s SER 244 Cb 0.03 -1.79 0.08 0.00 0.10 0.00 0.00 66.02 64.43 3n99 s SER 244 CO 0.05 -2.43 0.73 0.00 0.98 0.00 0.00 173.24 172.56 3n99 n ALA 245 N -3.71 -1.77 -2.58 5.32 0.00 0.03 -3.85 120.51 113.95 3n99 n ALA 245 Ca 0.07 -0.56 -0.17 0.00 0.00 0.00 0.00 53.44 52.77 3n99 n ALA 245 Cb 0.58 -1.97 -0.11 0.00 0.00 0.00 0.00 19.45 17.94 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 0.84 1.19 -2.27 0.00 0.24 -1.26 -4.75 118.33 112.32 3n99 n VAL 247 Ca -0.18 -0.72 -0.32 0.00 -2.04 0.00 0.00 64.34 61.08 3n99 n VAL 247 Cb 0.56 -0.68 -0.02 0.00 -1.47 0.00 0.00 33.84 32.23 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 -5.68 6.46 0.22 -1.34 0.01 -1.22 -2.04 113.70 110.11 3n99 s SER 248 Ca -0.05 1.57 -0.32 0.00 1.31 0.00 0.00 55.95 58.47 3n99 s SER 248 Cb 0.09 -2.50 -0.12 0.00 0.21 0.00 0.00 66.02 63.70 3n99 s SER 248 CO 0.82 -0.70 1.68 0.00 0.41 0.00 0.00 173.24 175.46 3n99 s ALA 249 N -2.71 3.89 0.00 1.44 0.00 -1.26 -2.76 121.76 120.36 3n99 s ALA 249 Ca 0.59 1.57 0.00 0.00 0.00 0.00 0.00 51.96 54.11 3n99 s ALA 249 Cb -0.11 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.33 3n99 s ALA 249 CO 0.36 -0.92 0.00 0.41 0.00 0.00 0.00 175.76 175.61 3n99 n GLY 250 N 3.61 0.81 3.68 0.00 0.00 -1.26 -5.02 105.19 107.01 3n99 n GLY 250 Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 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 -3.22 2.58 -2.72 1.61 0.09 -1.11 -1.02 115.29 111.50 3n99 s HIS 251 Ca 0.00 -0.51 0.00 0.00 -0.00 0.00 0.00 55.06 54.55 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 0.35 0.00 0.41 -0.00 0.00 0.00 174.74 175.50 3n99 n GLY 252 N -1.08 -1.48 3.69 -2.22 0.00 -1.23 -4.33 105.19 98.53 3n99 n GLY 252 Ca -0.03 -1.06 -0.44 0.00 0.00 0.00 0.00 46.02 44.48 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 -0.11 2.24 -2.84 1.61 -0.02 -1.15 -4.36 135.00 130.38 3n99 n PRO 253 Ca 0.00 0.80 -0.32 0.00 -2.02 0.00 0.00 63.50 61.96 3n99 n PRO 253 Cb 0.00 -2.52 -0.05 0.00 -0.02 0.00 0.00 33.50 30.91 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 0.52 2.23 -0.07 -1.23 0.00 -1.21 -1.25 107.32 106.31 3n99 s GLY 254 Ca 0.70 0.15 0.02 0.00 0.00 0.00 0.00 44.72 45.59 3n99 s GLY 254 CO 0.46 0.39 -0.13 0.14 0.00 0.00 0.00 173.10 173.96 3n99 s VAL 255 N -2.24 1.22 -0.23 1.40 1.01 0.67 -0.26 120.40 121.98 3n99 s VAL 255 Ca 0.57 -0.52 -0.12 0.00 0.00 0.00 0.00 61.98 61.91 3n99 s VAL 255 Cb -0.10 -1.12 -0.05 0.00 0.00 0.00 0.00 36.38 35.12 3n99 s VAL 255 CO 0.21 0.38 0.24 -0.69 0.00 0.00 0.00 175.10 175.24 3n99 s VAL 256 N 0.73 5.30 0.05 2.92 1.01 -0.39 -1.35 120.40 128.68 3n99 s VAL 256 Ca -0.13 0.36 -0.31 0.00 0.00 0.00 0.00 61.98 61.91 3n99 s VAL 256 Cb -0.16 -3.58 -0.05 0.00 0.00 0.00 0.00 36.38 32.59 3n99 s VAL 256 CO 0.03 0.31 1.18 -0.69 0.00 0.00 0.00 175.10 175.93 3n99 s VAL 257 N 1.17 4.12 -0.16 2.92 1.01 -1.26 -0.85 120.40 127.35 3n99 s VAL 257 Ca 0.11 1.52 0.13 0.00 0.00 0.00 0.00 61.98 63.74 3n99 s VAL 257 Cb -0.14 -3.98 -0.18 0.00 0.00 0.00 0.00 36.38 32.08 3n99 s VAL 257 CO 0.06 0.12 0.34 2.30 0.00 0.00 0.00 175.10 177.92 3n99 n ILE 258 N 3.93 0.00 -3.71 2.22 -5.35 0.29 -4.48 119.36 112.26 3n99 n ILE 258 Ca 0.09 -0.27 -0.13 0.00 -0.27 0.00 0.00 62.75 62.17 3n99 n ILE 258 Cb 0.47 0.40 -0.10 0.00 -1.74 0.00 0.00 39.64 38.67 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 -2.72 0.52 -0.03 6.28 0.00 -1.02 -1.60 119.30 120.73 3n99 s MET 259 Ca -0.02 0.68 -0.13 0.00 0.00 0.00 0.00 55.69 56.22 3n99 s MET 259 Cb 0.09 0.21 0.02 0.00 0.00 0.00 0.00 34.83 35.15 3n99 s MET 259 CO 0.53 -0.08 0.28 -0.08 0.00 0.00 0.00 175.02 175.67 3n99 s THR 260 N 0.46 0.05 -2.29 10.11 -1.32 -0.35 0.04 115.64 122.35 3n99 s THR 260 Ca -0.02 -0.42 0.00 0.00 -1.21 0.00 0.00 61.69 60.04 3n99 s THR 260 Cb -0.04 -0.54 0.00 0.00 -1.51 0.00 0.00 72.50 70.41 3n99 s THR 260 CO -0.02 -0.23 0.00 0.61 -2.21 0.00 0.00 174.62 172.77 3n99 n GLY 261 N 1.63 -0.57 3.90 6.08 0.00 -0.45 -1.25 105.19 114.53 3n99 n GLY 261 Ca -0.20 -0.73 -0.33 0.00 0.00 0.00 0.00 46.02 44.77 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 6.32 0.64 1.61 2.15 -1.26 -0.49 116.67 121.64 3n99 s ASP 262 Ca 0.00 0.31 0.39 0.00 0.43 0.00 0.00 52.55 53.68 3n99 s ASP 262 Cb 0.00 -1.96 2.21 0.00 -0.30 0.00 0.00 42.92 42.87 3n99 s ASP 262 CO 0.00 0.23 2.33 1.05 -0.17 0.00 0.00 175.17 178.61 3n99 h GLU 263 N 3.59 0.00 0.00 4.34 4.11 -1.23 0.72 114.58 126.12 3n99 h GLU 263 Ca -0.48 0.00 -0.01 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 0.71 0.00 -0.04 0.66 0.07 0.00 0.00 179.01 180.41 3n99 h SER 264 N 0.00 0.00 0.00 3.06 4.64 -1.94 -3.34 113.55 115.97 3n99 h SER 264 Ca -0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 3n99 h SER 264 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.07 3n99 h SER 264 CO 0.00 0.04 -1.53 0.29 -0.87 0.00 0.00 176.83 174.77 3n99 n LYS 265 N -3.18 2.25 -3.83 4.77 4.76 0.13 -4.93 118.16 118.14 3n99 n LYS 265 Ca -0.00 0.01 -0.36 0.00 -2.87 0.00 0.00 58.31 55.09 3n99 n LYS 265 Cb 0.29 -1.19 -0.13 0.00 -1.84 0.00 0.00 35.03 32.16 3n99 n LYS 265 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3n99 s ILE 266 N -2.19 4.00 -0.44 -0.18 1.01 -0.49 -0.77 121.20 122.14 3n99 s ILE 266 Ca -0.06 -0.28 -0.02 0.00 0.00 0.00 0.00 60.65 60.30 3n99 s ILE 266 Cb 0.02 -2.85 0.12 0.00 0.01 0.00 0.00 42.46 39.76 3n99 s ILE 266 CO 0.29 0.37 0.23 -0.76 0.00 0.00 0.00 174.94 175.07 3n99 s LEU 267 N 1.51 5.14 0.16 2.97 1.43 0.30 -4.54 118.68 125.64 3n99 s LEU 267 Ca 0.06 -2.24 -0.30 0.00 -1.03 0.00 0.00 54.13 50.61 3n99 s LEU 267 Cb -0.15 -1.80 -0.08 0.00 0.03 0.00 0.00 46.19 44.20 3n99 s LEU 267 CO 0.01 -0.48 1.26 -2.84 0.23 0.00 0.00 176.35 174.54 3n99 s PRO 268 N 0.83 4.42 -0.26 1.29 0.02 -1.26 -1.50 135.00 138.54 3n99 s PRO 268 Ca 0.11 1.95 -0.04 0.00 0.02 0.00 0.00 61.00 63.04 3n99 s PRO 268 Cb -0.22 -3.24 0.02 0.00 0.02 0.00 0.00 34.50 31.08 3n99 s PRO 268 CO -0.04 -0.22 -0.01 -1.21 -0.33 0.00 0.00 177.00 175.19 3n99 s GLU 269 N 0.16 2.98 -0.22 5.54 0.41 0.52 -4.86 118.70 123.24 3n99 s GLU 269 Ca 0.57 -0.90 -0.29 0.00 -0.41 0.00 0.00 54.97 53.94 3n99 s GLU 269 Cb -0.34 -3.13 -0.00 0.00 -1.78 0.00 0.00 34.13 28.88 3n99 s GLU 269 CO 0.35 -0.40 1.17 -2.00 -0.49 0.00 0.00 175.26 173.90 3n99 s GLU 270 N 1.40 4.19 0.42 1.61 2.12 -1.26 -1.16 118.70 126.03 3n99 s GLU 270 Ca 0.02 1.46 0.03 0.00 0.36 0.00 0.00 54.97 56.84 3n99 s GLU 270 Cb -0.17 -3.73 -0.04 0.00 0.26 0.00 0.00 34.13 30.46 3n99 s GLU 270 CO -0.02 -0.74 0.06 0.14 -0.54 0.00 0.00 175.26 174.16 3n99 s VAL 271 N 3.50 1.12 0.09 3.70 -7.23 0.87 -4.92 120.40 117.53 3n99 s VAL 271 Ca 0.50 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.58 3n99 s VAL 271 Cb -0.18 -2.49 -0.23 0.00 0.56 0.00 0.00 36.38 34.04 3n99 s VAL 271 CO 0.12 0.00 1.21 1.05 -0.31 0.00 0.00 175.10 177.18 3n99 h GLU 272 N 1.72 0.53 -4.25 4.82 9.09 -1.94 -3.40 114.58 121.16 3n99 h GLU 272 Ca -0.40 -0.63 -0.35 0.00 0.05 0.00 0.00 59.36 58.03 3n99 h GLU 272 Cb 1.27 0.19 -0.30 0.00 -1.65 0.00 0.00 28.75 28.26 3n99 h GLU 272 CO 0.69 1.24 -0.76 0.50 0.05 0.00 0.00 179.01 180.73 3n99 s ARG 273 N -3.17 0.54 -0.40 1.06 3.52 -1.26 -4.97 118.95 114.27 3n99 s ARG 273 Ca -0.08 -0.17 0.06 0.00 -0.13 0.00 0.00 55.73 55.42 3n99 s ARG 273 Cb 0.07 -0.55 0.18 0.00 -1.56 0.00 0.00 34.95 33.10 3n99 s ARG 273 CO 0.90 0.06 0.68 0.00 -0.81 0.00 0.00 175.30 176.13 3n99 s ALA 274 N 0.18 -2.63 -0.07 6.12 0.00 -1.26 -4.95 121.76 119.16 3n99 s ALA 274 Ca -0.02 0.36 -0.03 0.00 0.00 0.00 0.00 51.96 52.27 3n99 s ALA 274 Cb -0.06 -2.77 0.04 0.00 0.00 0.00 0.00 23.12 20.33 3n99 s ALA 274 CO -0.00 -2.25 0.16 1.21 0.00 0.00 0.00 175.76 174.88 3n99 s ASN 275 N 1.88 -0.04 0.41 0.00 3.84 -1.26 -0.48 114.94 119.29 3n99 s ASN 275 Ca 0.16 0.33 0.29 0.00 0.21 0.00 0.00 52.86 53.85 3n99 s ASN 275 Cb -0.03 0.22 1.32 0.00 -0.55 0.00 0.00 41.25 42.21 3n99 s ASN 275 CO -0.08 -0.16 1.88 0.16 -2.79 0.00 0.00 177.10 176.10 3n99 h ILE 276 N 6.08 0.00 0.00 -5.21 3.07 -1.60 -2.33 117.51 117.53 3n99 h ILE 276 Ca -0.40 -0.26 -0.01 0.00 1.55 0.00 0.00 64.86 65.75 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 0.39 0.00 -0.05 0.77 -1.05 0.00 0.00 178.15 178.20 3n99 h SER 277 N 0.00 0.00 0.69 2.16 4.64 -1.90 -1.62 113.55 117.52 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 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3n99 h SER 277 CO 0.00 0.05 0.00 0.44 -0.87 0.00 0.00 176.83 176.45 3n99 h ASP 278 N 0.00 0.00 -0.02 4.97 3.32 -1.83 -3.18 116.42 119.69 3n99 h ASP 278 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3n99 h ASP 278 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 3n99 h ASP 278 CO 0.01 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.31 3n99 n TYR 279 N -3.00 0.01 0.91 4.55 4.01 -0.62 -5.16 117.16 117.86 3n99 n TYR 279 Ca -0.00 -0.01 0.11 0.00 -0.16 0.00 0.00 57.90 57.83 3n99 n TYR 279 Cb 0.23 -0.00 0.09 0.00 -0.31 0.00 0.00 39.34 39.35 3n99 n TYR 279 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68