#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n99 s MET 1 N 0.00 4.30 0.03 -1.40 1.00 -1.26 -5.00 119.30 116.97 3n99 s MET 1 Ca 0.00 1.15 -0.30 0.00 0.00 0.00 0.00 55.69 56.54 3n99 s MET 1 Cb 0.00 -2.32 -0.05 0.00 0.00 0.00 0.00 34.83 32.45 3n99 s MET 1 CO 0.00 0.04 1.30 1.03 0.00 0.00 0.00 175.02 177.40 3n99 s ARG 2 N -2.92 4.34 0.26 2.03 0.52 -1.26 -4.99 118.95 116.93 3n99 s ARG 2 Ca 0.59 1.87 0.03 0.00 -0.52 0.00 0.00 55.73 57.70 3n99 s ARG 2 Cb -0.11 -3.45 -0.05 0.00 0.52 0.00 0.00 34.95 31.85 3n99 s ARG 2 CO 0.15 -0.44 0.03 0.95 0.02 0.00 0.00 175.30 176.02 3n99 s THR 3 N 1.77 0.96 -0.25 0.02 -4.23 -1.26 -0.23 115.64 112.43 3n99 s THR 3 Ca 0.61 -2.02 0.02 0.00 -1.18 0.00 0.00 61.69 59.12 3n99 s THR 3 Cb -0.30 -2.51 0.32 0.00 1.34 0.00 0.00 72.50 71.35 3n99 s THR 3 CO 0.27 -0.18 1.41 -0.46 -0.54 0.00 0.00 174.62 175.13 3n99 n ASN 4 N -0.49 3.35 -0.17 3.99 6.94 -1.14 -4.67 115.26 123.07 3n99 n ASN 4 Ca -0.03 -2.74 0.19 0.00 -0.02 0.00 0.00 54.58 51.97 3n99 n ASN 4 Cb 0.65 -0.66 0.56 0.00 -2.36 0.00 0.00 39.78 37.97 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 0.58 0.30 0.00 -3.83 2.10 -1.96 0.64 116.57 114.40 3n99 h LYS 5 Ca 0.28 -0.02 -0.00 0.00 -2.00 0.00 0.00 60.65 58.91 3n99 h LYS 5 Cb 1.84 -0.07 -0.00 0.00 -0.90 0.00 0.00 32.23 33.11 3n99 h LYS 5 CO 0.51 0.20 -0.02 -0.44 -2.00 0.00 0.00 179.45 177.70 3n99 h ASP 6 N 0.31 0.00 -0.05 7.07 3.32 -2.02 -2.55 116.42 122.50 3n99 h ASP 6 Ca 0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.45 3n99 h ASP 6 Cb 1.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.64 3n99 h ASP 6 CO -0.11 0.02 0.00 0.54 -1.72 0.00 0.00 179.24 177.97 3n99 n ARG 7 N -3.13 1.81 -2.87 3.56 1.74 0.21 -4.95 116.66 113.03 3n99 n ARG 7 Ca -0.00 -1.18 -0.35 0.00 -0.77 0.00 0.00 57.85 55.54 3n99 n ARG 7 Cb 0.26 -1.47 -0.07 0.00 -1.02 0.00 0.00 32.46 30.17 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 -1.93 4.17 -0.14 0.55 1.43 -0.96 -5.04 118.68 116.76 3n99 s LEU 8 Ca 0.36 1.67 -0.15 0.00 -1.03 0.00 0.00 54.13 54.98 3n99 s LEU 8 Cb 0.20 -4.16 -0.05 0.00 0.03 0.00 0.00 46.19 42.22 3n99 s LEU 8 CO 0.32 -0.18 0.36 -0.69 0.23 0.00 0.00 176.35 176.39 3n99 s VAL 9 N -1.85 5.25 -0.22 -1.59 1.01 -1.26 -5.06 120.40 116.68 3n99 s VAL 9 Ca 0.54 0.69 -0.06 0.00 0.00 0.00 0.00 61.98 63.15 3n99 s VAL 9 Cb -0.14 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 3n99 s VAL 9 CO 0.19 0.38 0.04 -0.60 0.00 0.00 0.00 175.10 175.11 3n99 s ARG 10 N 0.39 3.68 0.04 2.72 3.52 -1.26 -4.65 118.95 123.39 3n99 s ARG 10 Ca 0.20 -0.48 0.02 0.00 -0.13 0.00 0.00 55.73 55.34 3n99 s ARG 10 Cb -0.14 -3.19 -0.02 0.00 -1.56 0.00 0.00 34.95 30.03 3n99 s ARG 10 CO 0.06 -0.03 -0.07 -1.50 -0.81 0.00 0.00 175.30 172.95 3n99 s ILE 11 N 1.16 0.47 -0.14 4.11 2.07 -0.51 -4.95 121.20 123.41 3n99 s ILE 11 Ca 0.04 -1.03 -0.29 0.00 -1.41 0.00 0.00 60.65 57.96 3n99 s ILE 11 Cb -0.14 -0.54 -0.02 0.00 0.13 0.00 0.00 42.46 41.88 3n99 s ILE 11 CO 0.02 -0.39 1.34 -0.94 -1.91 0.00 0.00 174.94 173.07 3n99 s SER 12 N -1.52 6.89 -0.21 4.50 1.04 -1.26 -1.03 113.70 122.11 3n99 s SER 12 Ca -0.11 1.80 -0.02 0.00 0.48 0.00 0.00 55.95 58.11 3n99 s SER 12 Cb -0.10 -2.54 0.01 0.00 0.10 0.00 0.00 66.02 63.49 3n99 s SER 12 CO 0.00 -0.79 -0.11 -0.69 0.98 0.00 0.00 173.24 172.63 3n99 s VAL 13 N 3.60 2.81 0.02 5.02 1.01 0.25 -4.95 120.40 128.15 3n99 s VAL 13 Ca 0.58 -0.72 -0.02 0.00 0.00 0.00 0.00 61.98 61.82 3n99 s VAL 13 Cb -0.24 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.84 3n99 s VAL 13 CO 0.18 0.45 0.21 0.54 0.00 0.00 0.00 175.10 176.47 3n99 s VAL 14 N 1.39 5.40 0.00 2.92 0.11 -1.26 -0.09 120.40 128.87 3n99 s VAL 14 Ca 0.05 -0.20 0.00 0.00 -2.93 0.00 0.00 61.98 58.90 3n99 s VAL 14 Cb -0.14 -3.57 0.00 0.00 -1.53 0.00 0.00 36.38 31.14 3n99 s VAL 14 CO -0.07 0.26 0.00 0.61 -3.33 0.00 0.00 175.10 172.57 3n99 n GLY 15 N 0.72 2.82 3.10 6.54 0.00 -0.33 -4.70 105.19 113.34 3n99 n GLY 15 Ca -0.09 -1.03 -0.08 0.00 0.00 0.00 0.00 46.02 44.82 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 -0.74 0.59 0.11 1.61 -1.05 0.15 -1.26 118.70 118.11 3n99 s GLU 16 Ca 0.00 -0.96 -0.31 0.00 -0.15 0.00 0.00 54.97 53.55 3n99 s GLU 16 Cb 0.00 0.22 -0.09 0.00 -0.44 0.00 0.00 34.13 33.82 3n99 s GLU 16 CO 0.00 -0.13 1.54 0.42 0.95 0.00 0.00 175.26 178.03 3n99 s ILE 17 N -3.19 3.00 0.34 1.83 1.01 -0.74 -0.31 121.20 123.15 3n99 s ILE 17 Ca 0.00 0.63 -0.17 0.00 0.00 0.00 0.00 60.65 61.11 3n99 s ILE 17 Cb 0.02 -3.41 -0.09 0.00 0.01 0.00 0.00 42.46 38.99 3n99 s ILE 17 CO -0.07 0.03 0.80 0.00 0.00 0.00 0.00 174.94 175.70 3n99 s ALA 18 N 1.69 3.25 0.77 9.38 0.00 0.13 -1.52 121.76 135.46 3n99 s ALA 18 Ca 0.69 0.17 -0.11 0.00 0.00 0.00 0.00 51.96 52.72 3n99 s ALA 18 Cb -0.40 -2.89 0.05 0.00 0.00 0.00 0.00 23.12 19.88 3n99 s ALA 18 CO 0.31 0.27 1.09 -1.25 0.00 0.00 0.00 175.76 176.18 3n99 s PRO 19 N -2.90 2.32 0.23 0.00 0.04 -1.26 -1.91 135.00 131.52 3n99 s PRO 19 Ca 0.55 1.11 -0.32 0.00 0.04 0.00 0.00 61.00 62.39 3n99 s PRO 19 Cb -0.11 -1.91 -0.13 0.00 0.04 0.00 0.00 34.50 32.40 3n99 s PRO 19 CO 0.17 -1.58 1.56 0.00 0.04 0.00 0.00 177.00 177.19 3n99 n ALA 20 N -3.47 1.91 -2.35 8.56 0.00 -1.26 -1.87 120.51 122.03 3n99 n ALA 20 Ca 0.09 0.41 -0.30 0.00 0.00 0.00 0.00 53.44 53.63 3n99 n ALA 20 Cb 0.53 -2.39 -0.15 0.00 0.00 0.00 0.00 19.45 17.44 3n99 n ALA 20 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3n99 s LYS 21 N 0.15 1.84 -0.21 0.00 1.02 -0.81 -4.86 119.74 116.88 3n99 s LYS 21 Ca 0.71 -1.06 -0.09 0.00 0.02 0.00 0.00 55.97 55.54 3n99 s LYS 21 Cb -0.59 -1.96 0.08 0.00 -0.52 0.00 0.00 37.83 34.85 3n99 s LYS 21 CO 0.43 0.51 0.48 -1.64 -0.92 0.00 0.00 175.35 174.22 3n99 s MET 22 N -1.10 0.43 0.15 1.68 -1.94 -1.26 -3.91 119.30 113.35 3n99 s MET 22 Ca 0.11 1.03 0.23 0.00 -1.71 0.00 0.00 55.69 55.35 3n99 s MET 22 Cb -0.10 0.25 0.20 0.00 2.01 0.00 0.00 34.83 37.19 3n99 s MET 22 CO 0.01 -0.20 1.21 0.00 -0.01 0.00 0.00 175.02 176.03 3n99 h ARG 23 N 7.65 0.00 -3.22 2.03 3.08 -2.00 -3.46 114.38 118.46 3n99 h ARG 23 Ca -0.25 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.69 3n99 h ARG 23 Cb 1.15 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 31.01 3n99 h ARG 23 CO 0.18 0.00 -0.30 0.45 -1.07 0.00 0.00 179.97 179.23 3n99 s SER 24 N -4.65 -0.12 0.47 7.04 0.15 -1.26 -5.02 113.70 110.30 3n99 s SER 24 Ca 0.04 -0.08 0.14 0.00 0.70 0.00 0.00 55.95 56.74 3n99 s SER 24 Cb 0.12 0.31 1.07 0.00 -1.71 0.00 0.00 66.02 65.82 3n99 s SER 24 CO 0.75 -0.51 2.05 1.55 1.20 0.00 0.00 173.24 178.28 3n99 h PRO 25 N 3.64 0.06 -6.27 5.44 0.13 -1.96 -3.43 132.00 129.61 3n99 h PRO 25 Ca -0.31 -0.01 -0.57 0.00 -0.87 0.00 0.00 66.00 64.25 3n99 h PRO 25 Cb 1.19 -0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.26 3n99 h PRO 25 CO 0.43 0.14 -0.07 0.71 -0.23 0.00 0.00 178.00 178.99 3n99 s TYR 26 N -4.88 3.71 -0.10 1.56 2.02 -1.26 -4.24 117.35 114.15 3n99 s TYR 26 Ca -0.05 1.16 -0.02 0.00 -0.37 0.00 0.00 57.07 57.79 3n99 s TYR 26 Cb 0.16 -2.43 -0.03 0.00 -0.40 0.00 0.00 41.96 39.26 3n99 s TYR 26 CO 0.69 0.51 -0.02 -1.12 -1.57 0.00 0.00 175.55 174.05 3n99 s SER 27 N -1.40 5.02 -0.22 2.29 0.01 0.47 -4.93 113.70 114.94 3n99 s SER 27 Ca 0.33 0.04 -0.12 0.00 1.31 0.00 0.00 55.95 57.50 3n99 s SER 27 Cb -0.17 -1.51 -0.05 0.00 0.21 0.00 0.00 66.02 64.50 3n99 s SER 27 CO 0.19 0.31 0.24 -0.69 0.41 0.00 0.00 173.24 173.70 3n99 s VAL 28 N -0.48 5.31 0.72 3.43 1.01 -1.26 -1.44 120.40 127.68 3n99 s VAL 28 Ca 0.08 0.37 -0.07 0.00 0.00 0.00 0.00 61.98 62.36 3n99 s VAL 28 Cb -0.12 -3.58 0.07 0.00 0.00 0.00 0.00 36.38 32.75 3n99 s VAL 28 CO 0.02 0.32 1.03 0.42 0.00 0.00 0.00 175.10 176.90 3n99 s THR 29 N 1.06 2.24 0.10 3.92 -4.23 0.12 -3.52 115.64 115.33 3n99 s THR 29 Ca 0.12 -0.27 0.33 0.00 -1.18 0.00 0.00 61.69 60.69 3n99 s THR 29 Cb -0.14 -2.98 0.38 0.00 1.34 0.00 0.00 72.50 71.11 3n99 s THR 29 CO 0.05 0.00 1.97 0.71 -0.54 0.00 0.00 174.62 176.81 3n99 h THR 30 N -0.66 0.04 -0.00 3.99 1.35 -1.71 -2.10 112.91 113.82 3n99 h THR 30 Ca -0.44 -0.56 0.00 0.00 -0.55 0.00 0.00 66.41 64.86 3n99 h THR 30 Cb 1.31 1.54 0.00 0.00 -1.73 0.00 0.00 68.15 69.27 3n99 h THR 30 CO 0.58 0.02 -0.01 -0.62 -0.25 0.00 0.00 175.52 175.24 3n99 n GLU 31 N -3.12 0.49 -2.04 4.72 4.71 -1.26 -4.92 120.64 119.22 3n99 n GLU 31 Ca 0.01 -0.02 -0.01 0.00 -0.01 0.00 0.00 57.16 57.12 3n99 n GLU 31 Cb 0.32 -1.50 -0.00 0.00 -1.01 0.00 0.00 31.44 29.25 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 1.27 0.33 3.82 0.62 0.00 -0.79 -5.06 105.19 105.37 3n99 n GLY 32 Ca 0.15 -0.83 -0.23 0.00 0.00 0.00 0.00 46.02 45.11 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 -2.09 2.38 0.10 2.61 -4.23 -1.26 -4.88 115.64 108.27 3n99 s THR 33 Ca 0.00 -1.51 0.10 0.00 -1.18 0.00 0.00 61.69 59.10 3n99 s THR 33 Cb -0.00 -2.89 -0.04 0.00 1.34 0.00 0.00 72.50 70.91 3n99 s THR 33 CO 0.00 0.00 -0.24 0.68 -0.54 0.00 0.00 174.62 174.52 3n99 s VAL 34 N -2.56 2.43 0.01 2.29 -7.23 -1.26 0.13 120.40 114.21 3n99 s VAL 34 Ca 0.43 -1.57 0.01 0.00 -1.81 0.00 0.00 61.98 59.04 3n99 s VAL 34 Cb -0.00 -2.05 -0.01 0.00 0.56 0.00 0.00 36.38 34.87 3n99 s VAL 34 CO 0.25 0.17 -0.03 -0.13 -0.31 0.00 0.00 175.10 175.05 3n99 s ARG 35 N -1.85 0.28 -0.51 4.82 0.52 -0.52 -4.95 118.95 116.74 3n99 s ARG 35 Ca 0.14 -0.36 -0.14 0.00 -0.52 0.00 0.00 55.73 54.85 3n99 s ARG 35 Cb -0.10 -0.11 0.11 0.00 0.52 0.00 0.00 34.95 35.37 3n99 s ARG 35 CO 0.06 0.02 0.44 0.08 0.02 0.00 0.00 175.30 175.92 3n99 s VAL 36 N -0.71 4.98 0.05 3.52 1.01 -1.26 -0.40 120.40 127.58 3n99 s VAL 36 Ca -0.06 -1.47 -0.01 0.00 0.00 0.00 0.00 61.98 60.45 3n99 s VAL 36 Cb -0.05 -4.16 -0.03 0.00 0.00 0.00 0.00 36.38 32.14 3n99 s VAL 36 CO -0.00 -0.78 -0.03 0.27 0.00 0.00 0.00 175.10 174.56 3n99 s ILE 37 N 1.55 0.23 0.82 2.22 -4.36 -1.26 -5.05 121.20 115.34 3n99 s ILE 37 Ca 0.04 -1.58 -0.13 0.00 -0.26 0.00 0.00 60.65 58.72 3n99 s ILE 37 Cb -0.28 -1.19 0.09 0.00 1.25 0.00 0.00 42.46 42.32 3n99 s ILE 37 CO 0.03 -0.85 1.20 -2.84 0.24 0.00 0.00 174.94 172.72 3n99 s PRO 38 N -3.25 1.58 0.00 0.37 0.02 -1.26 -4.77 135.00 127.70 3n99 s PRO 38 Ca 0.01 1.73 0.00 0.00 0.02 0.00 0.00 61.00 62.76 3n99 s PRO 38 Cb 0.03 -1.77 0.00 0.00 0.02 0.00 0.00 34.50 32.78 3n99 s PRO 38 CO -0.07 -2.25 0.00 0.28 -0.33 0.00 0.00 177.00 174.63 3n99 n VAL 39 N -3.38 0.00 -3.03 3.83 0.31 -1.26 -1.12 118.33 113.68 3n99 n VAL 39 Ca 0.13 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.34 3n99 n VAL 39 Cb 0.51 0.00 0.04 0.00 -0.91 0.00 0.00 33.84 33.48 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 -1.63 0.00 0.00 -0.00 0.00 0.00 56.01 54.38 3n99 n LEU 40 Cb 0.00 -0.28 0.00 0.00 -0.00 0.00 0.00 43.42 43.14 3n99 n LEU 40 CO 0.00 -0.64 0.00 0.61 -0.00 0.00 0.00 177.39 177.36 3n99 n GLY 41 N 0.41 -2.20 4.77 1.47 0.00 -1.26 -1.92 105.19 106.46 3n99 n GLY 41 Ca 0.11 -1.54 0.06 0.00 0.00 0.00 0.00 46.02 44.64 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 -0.26 -1.49 3.59 -0.02 0.00 -0.78 -4.60 105.19 101.63 3n99 n GLY 42 Ca 0.00 -1.15 -0.41 0.00 0.00 0.00 0.00 46.02 44.46 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 -0.74 4.95 -0.32 -0.61 1.01 -1.26 -1.16 121.20 123.06 3n99 s ILE 43 Ca 0.00 0.73 -0.12 0.00 0.00 0.00 0.00 60.65 61.25 3n99 s ILE 43 Cb 0.00 -4.00 -0.02 0.00 0.01 0.00 0.00 42.46 38.45 3n99 s ILE 43 CO 0.00 -0.17 0.22 -0.89 0.00 0.00 0.00 174.94 174.10 3n99 s THR 44 N 2.58 5.20 0.01 2.92 2.01 -0.51 -4.97 115.64 122.87 3n99 s THR 44 Ca 0.24 -0.16 0.11 0.00 0.31 0.00 0.00 61.69 62.18 3n99 s THR 44 Cb -0.15 -3.63 -0.08 0.00 0.01 0.00 0.00 72.50 68.65 3n99 s THR 44 CO 0.12 0.05 1.37 1.88 -0.69 0.00 0.00 174.62 177.36 3n99 h TYR 45 N 8.45 0.00 0.00 4.92 0.05 -1.95 -3.33 116.97 125.11 3n99 h TYR 45 Ca -0.32 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.46 3n99 h TYR 45 Cb 1.16 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.90 3n99 h TYR 45 CO 0.68 0.77 -0.09 0.27 -1.05 0.00 0.00 178.16 178.74 3n99 n ASN 46 N -3.31 1.70 -3.94 3.88 6.94 -1.26 -4.96 115.26 114.31 3n99 n ASN 46 Ca 0.01 -2.53 -0.22 0.00 -0.02 0.00 0.00 54.58 51.83 3n99 n ASN 46 Cb 0.84 -0.27 -0.16 0.00 -2.36 0.00 0.00 39.78 37.82 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 -1.78 0.77 0.18 3.53 1.01 -1.26 -5.12 120.40 117.73 3n99 s VAL 47 Ca 0.17 -0.26 -0.15 0.00 0.00 0.00 0.00 61.98 61.75 3n99 s VAL 47 Cb 0.15 -0.74 0.02 0.00 0.00 0.00 0.00 36.38 35.81 3n99 s VAL 47 CO 0.02 0.27 0.43 -1.59 0.00 0.00 0.00 175.10 174.23 3n99 s LYS 48 N 0.80 1.27 0.28 2.72 -2.85 -1.26 -1.78 119.74 118.92 3n99 s LYS 48 Ca -0.13 -0.94 -0.30 0.00 -1.00 0.00 0.00 55.97 53.60 3n99 s LYS 48 Cb -0.15 0.47 -0.12 0.00 -2.06 0.00 0.00 37.83 35.97 3n99 s LYS 48 CO 0.02 -0.51 1.58 1.55 0.10 0.00 0.00 175.35 178.08 3n99 n VAL 49 N -0.28 0.95 0.00 1.79 3.14 -1.26 -0.83 118.33 121.84 3n99 n VAL 49 Ca -0.10 -0.24 0.00 0.00 -2.96 0.00 0.00 64.34 61.04 3n99 n VAL 49 Cb 0.63 -1.90 0.00 0.00 -1.06 0.00 0.00 33.84 31.51 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 2.26 2.42 3.79 7.55 0.00 -0.16 -4.92 105.19 116.14 3n99 n GLY 50 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 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 0.23 4.77 0.49 1.61 1.01 -0.01 -4.69 116.67 120.08 3n99 s ASP 51 Ca 0.00 1.58 -0.23 0.00 0.71 0.00 0.00 52.55 54.61 3n99 s ASP 51 Cb 0.00 -2.36 -0.07 0.00 1.01 0.00 0.00 42.92 41.50 3n99 s ASP 51 CO 0.00 -1.83 1.28 -0.55 0.21 0.00 0.00 175.17 174.28 3n99 s SER 52 N -3.69 5.79 0.20 0.27 0.15 -1.26 -0.45 113.70 114.71 3n99 s SER 52 Ca 0.60 2.59 0.26 0.00 0.70 0.00 0.00 55.95 60.10 3n99 s SER 52 Cb -0.15 -2.63 0.80 0.00 -1.71 0.00 0.00 66.02 62.33 3n99 s SER 52 CO 0.55 -1.20 1.76 0.00 1.20 0.00 0.00 173.24 175.55 3n99 n ALA 53 N -0.61 2.32 -2.67 5.45 0.00 0.41 -4.60 120.51 120.81 3n99 n ALA 53 Ca 0.08 -0.04 -0.22 0.00 0.00 0.00 0.00 53.44 53.26 3n99 n ALA 53 Cb 0.46 -1.45 -0.06 0.00 0.00 0.00 0.00 19.45 18.40 3n99 n ALA 53 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3n99 s TYR 54 N -3.10 2.88 0.00 0.00 1.51 -1.26 -0.46 117.35 116.92 3n99 s TYR 54 Ca 0.11 -0.22 0.00 0.00 -1.01 0.00 0.00 57.07 55.95 3n99 s TYR 54 Cb 0.13 -1.42 0.00 0.00 -0.11 0.00 0.00 41.96 40.56 3n99 s TYR 54 CO 0.60 0.49 0.00 0.41 -1.11 0.00 0.00 175.55 175.94 3n99 n GLY 55 N -1.10 0.69 3.85 0.71 0.00 -1.26 -5.02 105.19 103.06 3n99 n GLY 55 Ca -0.06 0.00 -0.37 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 -2.52 3.68 -1.30 1.61 0.52 -1.26 -4.99 118.94 114.67 3n99 s TRP 56 Ca 0.00 0.88 -0.14 0.00 0.02 0.00 0.00 56.10 56.86 3n99 s TRP 56 Cb 0.00 -2.21 0.11 0.00 -1.15 0.00 0.00 33.47 30.22 3n99 s TRP 56 CO 0.00 0.63 1.76 0.00 0.02 0.00 0.00 176.95 179.36 3n99 n ALA 57 N 1.63 4.36 -3.63 0.98 0.00 -1.26 -4.81 120.51 117.78 3n99 n ALA 57 Ca -0.13 -4.06 -0.06 0.00 0.00 0.00 0.00 53.44 49.19 3n99 n ALA 57 Cb 0.53 -3.31 -0.02 0.00 0.00 0.00 0.00 19.45 16.65 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 2.97 -0.35 -0.05 0.00 0.00 -1.26 -4.31 107.32 104.31 3n99 s GLY 58 Ca 0.47 0.59 0.02 0.00 0.00 0.00 0.00 44.72 45.80 3n99 s GLY 58 CO 0.01 0.17 -0.10 -0.35 0.00 0.00 0.00 173.10 172.83 3n99 s ASP 59 N -2.72 1.52 -1.43 1.64 2.15 -0.27 -4.78 116.67 112.78 3n99 s ASP 59 Ca 0.09 -0.25 -0.04 0.00 0.43 0.00 0.00 52.55 52.78 3n99 s ASP 59 Cb -0.01 -0.66 0.02 0.00 -0.30 0.00 0.00 42.92 41.98 3n99 s ASP 59 CO -0.03 0.02 0.39 1.41 -0.17 0.00 0.00 175.17 176.79 3n99 n HIS 60 N 3.75 -1.69 -2.11 -5.34 8.25 -1.07 -3.88 115.22 113.13 3n99 n HIS 60 Ca -0.23 0.34 -0.42 0.00 -0.26 0.00 0.00 57.72 57.16 3n99 n HIS 60 Cb 0.52 -3.71 -0.03 0.00 1.12 0.00 0.00 29.99 27.89 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 -3.00 3.26 -0.26 1.59 1.01 -1.26 -4.06 120.40 117.68 3n99 s VAL 61 Ca 0.23 0.82 -0.14 0.00 0.00 0.00 0.00 61.98 62.90 3n99 s VAL 61 Cb -0.11 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 3n99 s VAL 61 CO 0.29 0.04 0.31 -1.61 0.00 0.00 0.00 175.10 174.13 3n99 s GLU 62 N 1.68 4.03 0.49 2.72 2.02 -1.26 -1.43 118.70 126.95 3n99 s GLU 62 Ca 0.67 -0.05 -0.23 0.00 0.02 0.00 0.00 54.97 55.38 3n99 s GLU 62 Cb -0.37 -3.63 -0.06 0.00 0.10 0.00 0.00 34.13 30.17 3n99 s GLU 62 CO 0.30 -0.18 1.25 -1.25 0.02 0.00 0.00 175.26 175.39 3n99 s PRO 63 N 1.77 3.53 6.75 0.39 0.04 -1.26 -4.59 135.00 141.63 3n99 s PRO 63 Ca 0.13 1.97 0.00 0.00 0.04 0.00 0.00 61.00 63.14 3n99 s PRO 63 Cb -0.15 -2.36 0.00 0.00 0.04 0.00 0.00 34.50 32.02 3n99 s PRO 63 CO 0.09 -0.80 0.00 0.41 0.04 0.00 0.00 177.00 176.75 3n99 n GLY 64 N 0.56 2.47 3.44 0.56 0.00 -0.74 -4.54 105.19 106.95 3n99 n GLY 64 Ca 0.08 -0.36 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 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 4.15 -0.06 1.61 1.01 -0.38 -1.43 120.40 125.30 3n99 s VAL 65 Ca 0.00 -0.23 -0.23 0.00 0.00 0.00 0.00 61.98 61.52 3n99 s VAL 65 Cb 0.00 -2.92 -0.04 0.00 0.00 0.00 0.00 36.38 33.42 3n99 s VAL 65 CO 0.00 0.37 0.68 -0.44 0.00 0.00 0.00 175.10 175.71 3n99 s SER 66 N 1.40 6.97 -0.14 3.32 0.01 -0.31 -0.75 113.70 124.19 3n99 s SER 66 Ca 0.05 1.17 0.01 0.00 1.31 0.00 0.00 55.95 58.49 3n99 s SER 66 Cb -0.15 -2.40 0.00 0.00 0.21 0.00 0.00 66.02 63.68 3n99 s SER 66 CO 0.02 -0.09 -0.18 -0.69 0.41 0.00 0.00 173.24 172.71 3n99 s VAL 67 N 0.70 2.44 0.39 3.43 1.01 0.12 -0.70 120.40 127.80 3n99 s VAL 67 Ca 0.36 -0.85 0.08 0.00 0.00 0.00 0.00 61.98 61.57 3n99 s VAL 67 Cb -0.18 -2.01 -0.06 0.00 0.00 0.00 0.00 36.38 34.14 3n99 s VAL 67 CO 0.18 0.53 0.10 0.00 0.00 0.00 0.00 175.10 175.91 3n99 s MET 68 N 0.76 2.14 0.67 2.72 0.23 0.57 -1.07 119.30 125.32 3n99 s MET 68 Ca -0.07 -1.86 -0.14 0.00 -1.03 0.00 0.00 55.69 52.58 3n99 s MET 68 Cb -0.16 -1.91 0.01 0.00 -1.53 0.00 0.00 34.83 31.25 3n99 s MET 68 CO 0.00 -0.03 1.10 0.00 -2.03 0.00 0.00 175.02 174.06 3n99 s ALA 69 N -2.60 2.46 0.20 3.16 0.00 -1.26 0.33 121.76 124.05 3n99 s ALA 69 Ca 0.38 0.47 0.30 0.00 0.00 0.00 0.00 51.96 53.11 3n99 s ALA 69 Cb 0.04 -3.30 1.29 0.00 0.00 0.00 0.00 23.12 21.15 3n99 s ALA 69 CO 0.21 -1.32 1.97 0.00 0.00 0.00 0.00 175.76 176.61 3n99 h ARG 70 N -0.17 0.00 -2.03 0.00 3.08 -1.90 -3.43 114.38 109.93 3n99 h ARG 70 Ca -0.46 0.00 0.19 0.00 0.07 0.00 0.00 59.98 59.78 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 0.54 0.10 0.60 -0.98 -1.07 0.00 0.00 179.97 179.16 3n99 s ARG 71 N -3.77 0.78 0.25 0.04 1.70 -1.26 -5.07 118.95 111.62 3n99 s ARG 71 Ca -0.00 -0.37 -0.04 0.00 -0.47 0.00 0.00 55.73 54.85 3n99 s ARG 71 Cb 0.10 0.31 0.36 0.00 -0.57 0.00 0.00 34.95 35.15 3n99 s ARG 71 CO 0.57 -0.35 1.86 -0.22 -1.08 0.00 0.00 175.30 176.08 3n99 h LYS 72 N 2.00 1.00 0.00 3.89 3.64 -2.03 -0.18 116.57 124.89 3n99 h LYS 72 Ca -0.22 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 3n99 h LYS 72 Cb 1.22 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 3n99 h LYS 72 CO 0.27 0.66 0.00 0.93 -2.27 0.00 0.00 179.45 179.05 3n99 h GLU 73 N 1.03 0.00 -0.39 1.90 3.07 -2.00 -1.79 114.58 116.40 3n99 h GLU 73 Ca 0.40 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.26 3n99 h GLU 73 Cb 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.09 3n99 h GLU 73 CO -0.18 0.00 0.00 0.39 -1.40 0.00 0.00 179.01 177.82 3n99 n GLU 74 N -2.30 2.41 -0.03 2.33 1.02 -0.08 -4.46 120.64 119.53 3n99 n GLU 74 Ca 0.00 -2.14 -0.15 0.00 -0.02 0.00 0.00 57.16 54.86 3n99 n GLU 74 Cb 0.13 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 29.95 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 4.10 0.25 0.03 3.49 5.08 -1.38 -2.93 114.58 123.21 3n99 h GLU 75 Ca 0.00 -0.20 0.01 0.00 -1.00 0.00 0.00 59.36 58.17 3n99 h GLU 75 Cb 0.91 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.18 3n99 h GLU 75 CO 0.00 0.85 -0.09 0.82 -1.00 0.00 0.00 179.01 179.59 3n99 h ILE 76 N -0.30 0.78 -0.62 3.13 2.04 -1.78 -1.28 117.51 119.47 3n99 h ILE 76 Ca -0.02 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.83 3n99 h ILE 76 Cb 0.90 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 3n99 h ILE 76 CO 0.05 0.00 0.31 1.55 0.00 0.00 0.00 178.15 180.06 3n99 h PRO 77 N -0.17 0.87 -0.38 2.37 0.13 -1.85 0.17 132.00 133.14 3n99 h PRO 77 Ca 0.03 -0.10 -0.00 0.00 -0.87 0.00 0.00 66.00 65.05 3n99 h PRO 77 Cb 0.20 -0.17 -0.02 0.00 0.13 0.00 0.00 31.00 31.14 3n99 h PRO 77 CO -0.07 0.66 0.24 1.25 -0.23 0.00 0.00 178.00 179.85 3n99 h LEU 78 N 0.87 0.45 0.00 1.56 5.85 -1.25 -1.18 115.31 121.62 3n99 h LEU 78 Ca 0.22 -0.04 -0.21 0.00 0.84 0.00 0.00 57.88 58.69 3n99 h LEU 78 Cb 0.07 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 3n99 h LEU 78 CO -0.03 0.36 -1.00 0.24 -0.34 0.00 0.00 178.44 177.67 3n99 h MET 79 N 0.51 0.00 0.04 1.25 2.86 -0.96 -3.25 114.93 115.38 3n99 h MET 79 Ca 0.14 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.69 3n99 h MET 79 Cb -0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.64 3n99 h MET 79 CO -0.03 0.93 -0.43 1.15 1.06 0.00 0.00 176.91 179.59 3n99 h THR 80 N 0.00 1.58 0.00 2.22 2.02 -0.57 -3.38 112.91 114.79 3n99 h THR 80 Ca -0.02 -2.38 -0.07 0.00 0.77 0.00 0.00 66.41 64.71 3n99 h THR 80 Cb 1.75 3.18 -0.01 0.00 -1.74 0.00 0.00 68.15 71.33 3n99 h THR 80 CO 0.12 0.61 -0.37 -0.07 0.37 0.00 0.00 175.52 176.19 3n99 h LEU 81 N -0.80 0.00 -9.40 2.58 3.38 -1.37 -3.45 115.31 106.24 3n99 h LEU 81 Ca -0.09 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.34 3n99 h LEU 81 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 3n99 h LEU 81 CO 0.02 0.32 0.84 -0.44 0.09 0.00 0.00 178.44 179.26 3n99 s SER 82 N -6.33 6.82 0.09 -0.43 0.01 -1.23 -3.86 113.70 108.77 3n99 s SER 82 Ca 0.05 2.18 0.10 0.00 1.31 0.00 0.00 55.95 59.59 3n99 s SER 82 Cb 0.07 -2.56 -0.03 0.00 0.21 0.00 0.00 66.02 63.70 3n99 s SER 82 CO 0.72 -0.73 -0.25 0.00 0.41 0.00 0.00 173.24 173.39 3n99 n ILE 84 N 1.31 0.44 0.00 0.00 5.41 0.18 -1.21 119.36 125.49 3n99 n ILE 84 Ca -0.17 -0.08 0.00 0.00 1.00 0.00 0.00 62.75 63.50 3n99 n ILE 84 Cb 0.52 -2.00 0.00 0.00 -0.71 0.00 0.00 39.64 37.46 3n99 n ILE 84 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3n99 n GLY 85 N 4.21 2.08 3.73 7.39 0.00 0.72 -1.04 105.19 122.29 3n99 n GLY 85 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.53 4.56 0.30 1.61 0.02 -0.35 -4.58 114.94 114.96 3n99 s ASN 86 Ca 0.00 2.50 -0.28 0.00 -1.02 0.00 0.00 52.86 54.07 3n99 s ASN 86 Cb 0.00 -2.61 -0.09 0.00 0.02 0.00 0.00 41.25 38.57 3n99 s ASN 86 CO 0.00 -2.03 0.98 -0.70 0.02 0.00 0.00 177.10 175.37 3n99 s GLU 87 N -3.54 4.64 -0.03 -0.60 2.12 -1.26 -1.28 118.70 118.75 3n99 s GLU 87 Ca 0.79 1.48 0.02 0.00 0.36 0.00 0.00 54.97 57.63 3n99 s GLU 87 Cb -0.34 -3.00 0.01 0.00 0.26 0.00 0.00 34.13 31.06 3n99 s GLU 87 CO 0.40 0.31 -0.07 0.08 -0.54 0.00 0.00 175.26 175.43 3n99 s VAL 88 N -1.39 0.69 -0.06 3.70 1.01 0.13 -1.07 120.40 123.41 3n99 s VAL 88 Ca 0.47 -0.27 0.05 0.00 0.00 0.00 0.00 61.98 62.22 3n99 s VAL 88 Cb -0.24 -0.64 -0.00 0.00 0.00 0.00 0.00 36.38 35.49 3n99 s VAL 88 CO 0.30 0.23 -0.20 -0.63 0.00 0.00 0.00 175.10 174.80 3n99 s ILE 89 N 0.45 1.68 -0.06 2.22 1.01 0.67 -0.37 121.20 126.80 3n99 s ILE 89 Ca -0.07 -0.85 -0.29 0.00 0.00 0.00 0.00 60.65 59.45 3n99 s ILE 89 Cb -0.11 -1.44 -0.02 0.00 0.01 0.00 0.00 42.46 40.90 3n99 s ILE 89 CO 0.01 0.48 0.94 -0.69 0.00 0.00 0.00 174.94 175.68 3n99 s VAL 90 N 0.05 4.86 -1.28 2.92 1.01 -0.47 -1.17 120.40 126.32 3n99 s VAL 90 Ca -0.06 1.94 0.11 0.00 0.00 0.00 0.00 61.98 63.97 3n99 s VAL 90 Cb -0.13 -4.27 0.12 0.00 0.00 0.00 0.00 36.38 32.10 3n99 s VAL 90 CO 0.04 0.10 0.90 0.23 0.00 0.00 0.00 175.10 176.37 3n99 n MET 91 N 4.43 0.86 -4.00 2.72 0.00 0.11 -0.64 117.12 120.61 3n99 n MET 91 Ca 0.06 -1.28 -0.11 0.00 0.00 0.00 0.00 57.70 56.37 3n99 n MET 91 Cb 0.50 -1.21 -0.03 0.00 0.00 0.00 0.00 33.22 32.47 3n99 n MET 91 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 3n99 s SER 92 N -0.91 0.33 0.25 7.83 1.04 -1.23 -4.82 113.70 116.19 3n99 s SER 92 Ca 0.14 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.38 3n99 s SER 92 Cb 0.09 0.67 0.00 0.00 0.10 0.00 0.00 66.02 66.88 3n99 s SER 92 CO 0.14 -1.31 0.00 0.61 0.98 0.00 0.00 173.24 173.66 3n99 n GLY 93 N -0.48 -1.87 0.25 7.32 0.00 -1.26 -3.87 105.19 105.28 3n99 n GLY 93 Ca -0.02 -1.33 0.17 0.00 0.00 0.00 0.00 46.02 44.84 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 -0.16 0.00 -0.62 1.61 3.32 -1.98 -2.34 116.42 116.26 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 0.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.70 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 -2.02 2.60 -1.56 3.45 0.00 -1.25 -4.99 120.51 116.74 3n99 n ALA 95 Ca 0.00 -1.20 -0.50 0.00 0.00 0.00 0.00 53.44 51.74 3n99 n ALA 95 Cb 0.25 -0.97 -0.05 0.00 0.00 0.00 0.00 19.45 18.68 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 1.25 0.95 0.00 0.00 4.81 -0.88 -0.96 118.16 123.33 3n99 n LYS 96 Ca 0.22 0.34 0.00 0.00 -0.87 0.00 0.00 58.31 58.00 3n99 n LYS 96 Cb 0.62 -1.82 0.00 0.00 0.02 0.00 0.00 35.03 33.85 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 2.02 2.30 3.76 3.14 0.00 0.19 -5.00 105.19 111.61 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 -1.90 5.62 0.03 1.61 0.01 -0.13 -4.76 113.70 114.18 3n99 s SER 98 Ca 0.00 2.50 0.09 0.00 1.31 0.00 0.00 55.95 59.85 3n99 s SER 98 Cb 0.00 -2.61 -0.03 0.00 0.21 0.00 0.00 66.02 63.59 3n99 s SER 98 CO 0.00 -1.31 -0.26 -0.13 0.41 0.00 0.00 173.24 171.95 3n99 s ARG 99 N -2.91 1.88 0.00 12.44 0.52 -1.26 -1.37 118.95 128.25 3n99 s ARG 99 Ca 0.70 -1.07 0.00 0.00 -0.52 0.00 0.00 55.73 54.84 3n99 s ARG 99 Cb -0.34 -2.01 0.00 0.00 0.52 0.00 0.00 34.95 33.12 3n99 s ARG 99 CO 0.39 0.52 0.00 0.41 0.02 0.00 0.00 175.30 176.65 3n99 n GLY 100 N 1.86 3.49 2.93 -3.53 0.00 0.51 -4.60 105.19 105.84 3n99 n GLY 100 Ca -0.17 -1.40 -0.16 0.00 0.00 0.00 0.00 46.02 44.29 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 -4.01 0.47 0.01 1.61 0.40 -0.49 -0.70 117.98 115.26 3n99 s PHE 101 Ca 0.00 -0.09 -0.30 0.00 -0.60 0.00 0.00 56.93 55.94 3n99 s PHE 101 Cb 0.00 -0.36 -0.06 0.00 0.51 0.00 0.00 43.02 43.12 3n99 s PHE 101 CO 0.00 -0.05 1.40 0.08 0.70 0.00 0.00 175.22 177.35 3n99 s VAL 102 N 0.19 3.69 -0.26 -0.44 1.01 -0.41 -0.19 120.40 123.99 3n99 s VAL 102 Ca -0.02 1.08 0.20 0.00 0.00 0.00 0.00 61.98 63.24 3n99 s VAL 102 Cb -0.05 -3.69 -0.29 0.00 0.00 0.00 0.00 36.38 32.34 3n99 s VAL 102 CO -0.00 0.00 0.55 0.35 0.00 0.00 0.00 175.10 176.00 3n99 n THR 103 N 4.64 0.00 -2.20 3.92 -2.24 0.89 -0.20 114.28 119.08 3n99 n THR 103 Ca 0.13 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 3n99 n THR 103 Cb 0.44 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.95 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 1.38 -1.46 3.40 3.38 0.00 -1.14 -4.86 105.19 105.89 3n99 n GLY 104 Ca -0.02 -1.02 -0.15 0.00 0.00 0.00 0.00 46.02 44.84 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 -1.17 0.99 -0.16 1.61 -2.85 -1.26 -0.92 119.74 115.98 3n99 s LYS 105 Ca 0.00 -0.11 -0.02 0.00 -1.00 0.00 0.00 55.97 54.84 3n99 s LYS 105 Cb 0.00 0.46 0.05 0.00 -2.06 0.00 0.00 37.83 36.28 3n99 s LYS 105 CO 0.00 -0.34 0.01 -1.58 0.10 0.00 0.00 175.35 173.54 3n99 s HIS 106 N -2.01 1.16 0.81 1.78 2.46 0.55 -4.15 115.29 115.88 3n99 s HIS 106 Ca -0.08 -0.80 -0.12 0.00 0.47 0.00 0.00 55.06 54.53 3n99 s HIS 106 Cb -0.01 -1.07 0.07 0.00 -0.13 0.00 0.00 32.58 31.45 3n99 s HIS 106 CO 0.02 -0.56 1.10 0.20 -2.47 0.00 0.00 174.74 173.03 3n99 s GLY 107 N 1.81 1.62 0.00 1.59 0.00 -1.26 -1.70 107.32 109.38 3n99 s GLY 107 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 44.72 44.48 3n99 s GLY 107 CO -0.07 0.20 0.00 0.61 0.00 0.00 0.00 173.10 173.83 3n99 n GLY 108 N -2.14 0.99 0.26 0.20 0.00 -1.26 -4.22 105.19 99.01 3n99 n GLY 108 Ca 0.07 -0.58 0.12 0.00 0.00 0.00 0.00 46.02 45.63 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 0.64 -4.46 1.61 -1.51 -2.04 -3.47 116.25 107.03 3n99 h VAL 109 Ca 0.00 -0.52 -0.02 0.00 -1.23 0.00 0.00 66.70 64.94 3n99 h VAL 109 Cb 0.00 1.32 0.01 0.00 -2.13 0.00 0.00 31.29 30.50 3n99 h VAL 109 CO 0.00 0.12 -0.05 0.59 -1.23 0.00 0.00 177.57 177.00 3n99 n ASN 110 N -3.75 -5.49 -4.45 4.19 3.02 -0.82 -4.96 115.26 103.00 3n99 n ASN 110 Ca -0.02 -0.08 -0.32 0.00 -0.03 0.00 0.00 54.58 54.13 3n99 n ASN 110 Cb 0.23 -3.63 -0.13 0.00 -0.61 0.00 0.00 39.78 35.64 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 2.62 -0.11 3.10 3.76 -0.69 -4.50 115.29 116.44 3n99 s HIS 111 Ca 0.03 -0.22 -0.04 0.00 -0.15 0.00 0.00 55.06 54.68 3n99 s HIS 111 Cb -0.00 -1.57 -0.04 0.00 1.11 0.00 0.00 32.58 32.08 3n99 s HIS 111 CO 0.46 0.18 0.06 0.08 -0.85 0.00 0.00 174.74 174.66 3n99 s VAL 112 N -0.77 4.80 -0.11 -0.90 1.01 -0.23 -0.33 120.40 123.87 3n99 s VAL 112 Ca 0.12 -0.06 -0.00 0.00 0.00 0.00 0.00 61.98 62.04 3n99 s VAL 112 Cb -0.10 -3.06 -0.02 0.00 0.00 0.00 0.00 36.38 33.19 3n99 s VAL 112 CO 0.02 0.59 -0.09 -0.76 0.00 0.00 0.00 175.10 174.86 3n99 s LEU 113 N -0.79 2.99 -0.05 3.92 1.43 -0.10 0.16 118.68 126.24 3n99 s LEU 113 Ca 0.13 -0.17 0.02 0.00 -1.03 0.00 0.00 54.13 53.08 3n99 s LEU 113 Cb -0.12 -1.67 0.01 0.00 0.03 0.00 0.00 46.19 44.45 3n99 s LEU 113 CO 0.03 0.25 -0.09 -0.69 0.23 0.00 0.00 176.35 176.08 3n99 s VAL 114 N -0.16 0.87 -0.27 -1.59 1.01 0.07 -0.08 120.40 120.26 3n99 s VAL 114 Ca 0.01 -0.35 -0.19 0.00 0.00 0.00 0.00 61.98 61.45 3n99 s VAL 114 Cb -0.13 -0.81 -0.02 0.00 0.00 0.00 0.00 36.38 35.41 3n99 s VAL 114 CO 0.03 0.29 0.58 -2.28 0.00 0.00 0.00 175.10 173.72 3n99 s HIS 115 N 0.58 3.26 0.33 5.22 2.46 0.74 -1.25 115.29 126.63 3n99 s HIS 115 Ca -0.10 0.69 0.08 0.00 0.47 0.00 0.00 55.06 56.20 3n99 s HIS 115 Cb -0.13 -2.82 -0.04 0.00 -0.13 0.00 0.00 32.58 29.46 3n99 s HIS 115 CO 0.02 -0.34 0.12 -0.06 -2.47 0.00 0.00 174.74 172.01 3n99 s PHE 116 N 2.44 2.71 0.69 3.88 0.08 -1.26 -1.40 117.98 125.12 3n99 s PHE 116 Ca 0.24 -0.35 -0.14 0.00 0.12 0.00 0.00 56.93 56.79 3n99 s PHE 116 Cb -0.15 -1.56 0.02 0.00 -0.57 0.00 0.00 43.02 40.75 3n99 s PHE 116 CO 0.09 0.39 1.13 -1.21 -0.10 0.00 0.00 175.22 175.52 3n99 s GLU 117 N -3.81 2.58 0.29 0.44 2.02 -1.26 -4.91 118.70 114.04 3n99 s GLU 117 Ca 0.36 1.45 0.04 0.00 0.02 0.00 0.00 54.97 56.84 3n99 s GLU 117 Cb -0.03 -1.92 0.68 0.00 0.10 0.00 0.00 34.13 32.96 3n99 s GLU 117 CO 0.22 -1.43 1.77 1.49 0.02 0.00 0.00 175.26 177.33 3n99 h GLU 118 N -0.18 0.69 -0.28 1.61 4.81 -2.01 -1.57 114.58 117.65 3n99 h GLU 118 Ca -0.47 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 58.67 3n99 h GLU 118 Cb 1.25 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.46 3n99 h GLU 118 CO 0.53 0.45 -0.04 0.93 -0.73 0.00 0.00 179.01 180.15 3n99 h GLU 119 N 0.71 0.43 -0.18 1.92 3.07 -2.04 -2.69 114.58 115.79 3n99 h GLU 119 Ca 0.54 -0.09 -0.10 0.00 -0.50 0.00 0.00 59.36 59.22 3n99 h GLU 119 Cb 0.83 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.67 3n99 h GLU 119 CO -0.38 0.49 -0.30 0.28 -1.40 0.00 0.00 179.01 177.69 3n99 h VAL 120 N 0.41 1.27 -0.88 3.13 2.07 -1.64 -3.31 116.25 117.30 3n99 h VAL 120 Ca 0.09 -1.32 0.03 0.00 0.82 0.00 0.00 66.70 66.32 3n99 h VAL 120 Cb 0.34 1.47 -0.05 0.00 -1.52 0.00 0.00 31.29 31.53 3n99 h VAL 120 CO 0.01 0.41 0.57 -0.07 0.02 0.00 0.00 177.57 178.51 3n99 h LEU 121 N 0.32 0.95 -2.66 2.57 3.38 -1.52 -0.92 115.31 117.43 3n99 h LEU 121 Ca 0.04 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 3n99 h LEU 121 Cb 0.70 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 3n99 h LEU 121 CO 0.05 0.66 -0.00 1.23 0.09 0.00 0.00 178.44 180.47 3n99 h GLY 122 N 1.12 0.00 -0.74 0.83 0.00 -1.71 -2.68 103.07 99.89 3n99 h GLY 122 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.68 3n99 h GLY 122 CO -0.11 0.00 -0.53 0.28 0.00 0.00 0.00 176.54 176.18 3n99 n LYS 123 N -3.09 1.01 -2.35 4.80 5.02 -0.36 -4.97 118.16 118.22 3n99 n LYS 123 Ca -0.02 -0.82 -0.32 0.00 -2.02 0.00 0.00 58.31 55.13 3n99 n LYS 123 Cb 0.12 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.62 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 -2.56 3.63 -0.00 -0.35 1.43 -1.01 -3.93 118.68 115.88 3n99 s LEU 124 Ca 0.18 1.65 0.00 0.00 -1.03 0.00 0.00 54.13 54.93 3n99 s LEU 124 Cb 0.18 -4.52 0.00 0.00 0.03 0.00 0.00 46.19 41.88 3n99 s LEU 124 CO 0.61 -0.72 -0.01 -0.32 0.23 0.00 0.00 176.35 176.14 3n99 s MET 125 N -3.97 0.09 0.18 1.70 -2.45 -1.26 -5.05 119.30 108.53 3n99 s MET 125 Ca 0.61 -0.01 -0.33 0.00 -1.25 0.00 0.00 55.69 54.71 3n99 s MET 125 Cb -0.12 -0.13 -0.15 0.00 1.25 0.00 0.00 34.83 35.69 3n99 s MET 125 CO 0.31 -0.01 1.35 0.28 1.05 0.00 0.00 175.02 178.00 3n99 n VAL 126 N 3.25 0.61 0.00 10.11 0.31 -1.26 -1.53 118.33 129.82 3n99 n VAL 126 Ca -0.15 -0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 3n99 n VAL 126 Cb 0.58 -1.19 0.00 0.00 -0.91 0.00 0.00 33.84 32.32 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 2.39 2.48 3.73 2.92 0.00 -0.57 -4.95 105.19 111.19 3n99 n GLY 127 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3n99 n GLY 127 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3n99 n ASP 128 N 0.00 3.08 -4.74 1.61 8.00 -0.58 -4.56 116.55 119.35 3n99 n ASP 128 Ca 0.00 1.16 -0.41 0.00 0.71 0.00 0.00 54.79 56.26 3n99 n ASP 128 Cb 0.00 -1.55 -0.05 0.00 -0.02 0.00 0.00 41.12 39.50 3n99 n ASP 128 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3n99 s LYS 129 N -2.16 4.69 -0.07 -1.24 1.02 -1.26 -1.79 119.74 118.93 3n99 s LYS 129 Ca 0.58 1.60 0.03 0.00 0.02 0.00 0.00 55.97 58.20 3n99 s LYS 129 Cb -0.50 -3.29 0.01 0.00 -0.52 0.00 0.00 37.83 33.53 3n99 s LYS 129 CO 0.60 0.24 -0.15 0.42 -0.92 0.00 0.00 175.35 175.54 3n99 s ILE 130 N -0.54 1.38 -0.19 2.17 -1.09 -0.39 0.06 121.20 122.60 3n99 s ILE 130 Ca 0.46 -0.62 -0.04 0.00 -2.23 0.00 0.00 60.65 58.22 3n99 s ILE 130 Cb -0.27 -1.23 -0.02 0.00 -1.58 0.00 0.00 42.46 39.36 3n99 s ILE 130 CO 0.34 0.41 -0.04 -0.22 -1.23 0.00 0.00 174.94 174.19 3n99 s LEU 131 N 0.54 3.05 -0.18 2.97 2.96 -0.32 -1.19 118.68 126.52 3n99 s LEU 131 Ca -0.15 -0.28 -0.04 0.00 -0.22 0.00 0.00 54.13 53.45 3n99 s LEU 131 Cb -0.16 -1.76 -0.02 0.00 0.50 0.00 0.00 46.19 44.75 3n99 s LEU 131 CO 0.05 0.07 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.48 3n99 s ILE 132 N 0.96 3.72 -0.98 6.68 1.01 0.88 -0.24 121.20 133.23 3n99 s ILE 132 Ca 0.00 -0.40 -0.18 0.00 0.00 0.00 0.00 60.65 60.07 3n99 s ILE 132 Cb -0.15 -2.65 0.14 0.00 0.01 0.00 0.00 42.46 39.81 3n99 s ILE 132 CO 0.01 0.46 1.18 -0.54 0.00 0.00 0.00 174.94 176.05 3n99 s LYS 133 N 0.74 3.69 0.18 2.79 1.02 -0.23 -0.59 119.74 127.35 3n99 s LYS 133 Ca -0.02 -1.93 -0.30 0.00 0.02 0.00 0.00 55.97 53.74 3n99 s LYS 133 Cb -0.14 -4.94 -0.08 0.00 -0.52 0.00 0.00 37.83 32.15 3n99 s LYS 133 CO 0.02 -1.76 1.02 0.00 -0.92 0.00 0.00 175.35 173.71 3n99 s ALA 134 N 2.43 3.33 -0.30 5.17 0.00 -0.20 -4.22 121.76 127.98 3n99 s ALA 134 Ca 0.34 0.71 -0.14 0.00 0.00 0.00 0.00 51.96 52.87 3n99 s ALA 134 Cb -0.04 -3.30 0.15 0.00 0.00 0.00 0.00 23.12 19.92 3n99 s ALA 134 CO -0.08 -0.06 0.87 -0.46 0.00 0.00 0.00 175.76 176.03 3n99 s TRP 135 N -0.46 -0.88 0.00 0.00 -0.00 -1.25 -1.42 118.94 114.92 3n99 s TRP 135 Ca 0.46 1.58 0.00 0.00 -0.00 0.00 0.00 56.10 58.14 3n99 s TRP 135 Cb -0.27 0.53 0.00 0.00 -0.00 0.00 0.00 33.47 33.73 3n99 s TRP 135 CO 0.33 -0.44 0.00 0.41 -0.00 0.00 0.00 176.95 177.25 3n99 n GLY 136 N 4.88 1.32 3.71 5.86 0.00 -1.26 -4.23 105.19 115.47 3n99 n GLY 136 Ca -0.12 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 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 4.44 0.00 1.61 -1.52 -1.26 -2.46 119.66 120.47 3n99 s GLN 137 Ca 0.00 1.76 0.00 0.00 -1.95 0.00 0.00 55.36 55.17 3n99 s GLN 137 Cb 0.00 -3.35 0.00 0.00 -0.22 0.00 0.00 33.01 29.44 3n99 s GLN 137 CO 0.00 -0.24 0.00 0.41 -0.25 0.00 0.00 175.29 175.21 3n99 n GLY 138 N 3.17 0.82 3.77 3.09 0.00 -1.26 -4.76 105.19 110.01 3n99 n GLY 138 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 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 4.70 -3.93 0.99 7.94 -1.03 -4.98 117.00 120.69 3n99 n LEU 139 Ca 0.00 1.20 -0.13 0.00 -1.11 0.00 0.00 56.01 55.97 3n99 n LEU 139 Cb 0.00 -1.62 -0.14 0.00 0.53 0.00 0.00 43.42 42.19 3n99 n LEU 139 CO 0.00 0.19 -0.38 -0.54 -1.11 0.00 0.00 177.39 175.55 3n99 s LYS 140 N -1.56 0.22 -0.48 1.96 1.02 -1.26 -4.44 119.74 115.21 3n99 s LYS 140 Ca 0.57 -0.19 -0.23 0.00 0.02 0.00 0.00 55.97 56.14 3n99 s LYS 140 Cb -0.48 -0.16 0.03 0.00 -0.52 0.00 0.00 37.83 36.71 3n99 s LYS 140 CO 0.59 0.04 0.83 -0.51 -0.92 0.00 0.00 175.35 175.37 3n99 s LEU 141 N -0.31 4.24 0.33 3.17 1.43 -1.26 -2.88 118.68 123.40 3n99 s LEU 141 Ca -0.02 -0.20 0.04 0.00 -1.03 0.00 0.00 54.13 52.92 3n99 s LEU 141 Cb -0.03 -2.92 0.59 0.00 0.03 0.00 0.00 46.19 43.86 3n99 s LEU 141 CO -0.00 -1.00 1.87 -0.07 0.23 0.00 0.00 176.35 177.38 3n99 h LEU 142 N 10.35 0.51 -0.97 1.79 3.38 -0.94 -2.40 115.31 127.03 3n99 h LEU 142 Ca -0.25 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.62 3n99 h LEU 142 Cb 1.08 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.70 3n99 h LEU 142 CO 1.00 0.57 -0.01 0.47 0.09 0.00 0.00 178.44 180.56 3n99 n ASP 143 N -4.28 1.52 -3.12 -0.43 8.00 -1.26 -4.35 116.55 112.62 3n99 n ASP 143 Ca 0.02 -1.48 -0.18 0.00 0.71 0.00 0.00 54.79 53.85 3n99 n ASP 143 Cb 0.24 0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.32 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 0.52 0.29 1.24 8.25 -0.90 -4.97 115.22 119.82 3n99 n HIS 144 Ca 0.19 -3.72 0.17 0.00 -0.26 0.00 0.00 57.72 54.10 3n99 n HIS 144 Cb 0.36 -0.42 0.88 0.00 1.12 0.00 0.00 29.99 31.93 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 3.00 0.00 -0.14 -0.41 0.13 -1.75 0.33 132.00 133.16 3n99 h PRO 145 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 3n99 h PRO 145 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 3n99 h PRO 145 CO 0.52 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.04 3n99 n ASP 146 N -3.15 1.97 -4.34 1.44 8.00 -1.26 -4.72 116.55 114.50 3n99 n ASP 146 Ca -0.00 -1.71 -0.40 0.00 0.71 0.00 0.00 54.79 53.38 3n99 n ASP 146 Cb 0.35 -0.09 -0.11 0.00 -0.02 0.00 0.00 41.12 41.26 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 -1.83 4.38 0.11 2.53 1.01 0.10 -4.59 120.40 122.12 3n99 s VAL 147 Ca 0.34 -1.02 -0.22 0.00 0.00 0.00 0.00 61.98 61.08 3n99 s VAL 147 Cb 0.19 -3.50 -0.07 0.00 0.00 0.00 0.00 36.38 33.00 3n99 s VAL 147 CO 0.29 -0.29 0.66 -0.54 0.00 0.00 0.00 175.10 175.23 3n99 s LYS 148 N 1.50 4.36 0.15 2.72 -0.14 -0.50 -4.54 119.74 123.30 3n99 s LYS 148 Ca 0.01 0.92 0.10 0.00 -1.36 0.00 0.00 55.97 55.64 3n99 s LYS 148 Cb -0.20 -3.25 -0.04 0.00 -1.68 0.00 0.00 37.83 32.66 3n99 s LYS 148 CO 0.05 0.60 -0.22 0.14 -0.76 0.00 0.00 175.35 175.16 3n99 s VAL 149 N -1.09 2.01 0.11 3.17 -7.23 -1.26 -0.94 120.40 115.16 3n99 s VAL 149 Ca 0.32 -1.83 -0.26 0.00 -1.81 0.00 0.00 61.98 58.40 3n99 s VAL 149 Cb -0.21 -1.87 0.07 0.00 0.56 0.00 0.00 36.38 34.93 3n99 s VAL 149 CO 0.22 -0.13 0.86 0.00 -0.31 0.00 0.00 175.10 175.74 3n99 s MET 150 N -2.42 1.13 -1.45 4.82 0.23 -0.62 -4.69 119.30 116.29 3n99 s MET 150 Ca 0.14 -0.53 0.00 0.00 -1.03 0.00 0.00 55.69 54.28 3n99 s MET 150 Cb -0.08 0.44 0.00 0.00 -1.53 0.00 0.00 34.83 33.66 3n99 s MET 150 CO 0.07 -0.51 0.00 0.09 -2.03 0.00 0.00 175.02 172.64 3n99 n ASN 151 N -0.37 -4.86 -3.76 -1.18 3.02 -1.26 -4.12 115.26 102.72 3n99 n ASN 151 Ca -0.08 0.34 -0.15 0.00 -0.03 0.00 0.00 54.58 54.66 3n99 n ASN 151 Cb 0.62 -3.57 -0.16 0.00 -0.61 0.00 0.00 39.78 36.06 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 -2.44 -0.06 0.13 2.41 2.07 -1.26 -0.64 121.20 121.41 3n99 s ILE 152 Ca 0.00 0.21 -0.31 0.00 -1.41 0.00 0.00 60.65 59.14 3n99 s ILE 152 Cb 0.00 -0.12 -0.11 0.00 0.13 0.00 0.00 42.46 42.36 3n99 s ILE 152 CO 0.00 0.09 1.82 -0.67 -1.91 0.00 0.00 174.94 174.26 3n99 n ASP 153 N 4.20 4.00 -0.06 4.50 -0.08 -0.21 -4.58 116.55 124.33 3n99 n ASP 153 Ca -0.28 1.00 0.08 0.00 -1.51 0.00 0.00 54.79 54.08 3n99 n ASP 153 Cb 0.50 -1.54 0.45 0.00 2.34 0.00 0.00 41.12 42.87 3n99 n ASP 153 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3n99 h PRO 154 N 8.22 0.50 -0.42 -0.67 0.11 -1.90 0.43 132.00 138.27 3n99 h PRO 154 Ca -0.46 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 3n99 h PRO 154 Cb 1.22 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 3n99 h PRO 154 CO 0.95 0.33 -0.06 -0.44 -0.21 0.00 0.00 178.00 178.57 3n99 h ASP 155 N 0.52 0.78 -0.54 -2.05 3.32 -1.97 -2.83 116.42 113.65 3n99 h ASP 155 Ca 0.23 -0.34 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 3n99 h ASP 155 Cb 0.25 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 3n99 h ASP 155 CO -0.06 0.94 0.32 0.25 -1.72 0.00 0.00 179.24 178.96 3n99 h LEU 156 N 0.62 0.68 -0.80 1.55 5.85 -1.60 -2.61 115.31 118.99 3n99 h LEU 156 Ca 0.11 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.84 3n99 h LEU 156 Cb 0.57 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.37 3n99 h LEU 156 CO 0.03 0.54 0.50 0.15 -0.34 0.00 0.00 178.44 179.32 3n99 h PHE 157 N 0.77 0.93 0.00 1.25 3.57 -0.72 -0.58 116.94 122.16 3n99 h PHE 157 Ca 0.20 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.73 3n99 h PHE 157 Cb 0.00 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.44 3n99 h PHE 157 CO 0.00 0.50 0.00 0.93 -2.23 0.00 0.00 178.31 177.51 3n99 h GLU 158 N 0.94 0.00 -0.02 1.11 5.08 -1.29 -2.90 114.58 117.49 3n99 h GLU 158 Ca 0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 3n99 h GLU 158 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 3n99 h GLU 158 CO -0.15 0.00 -0.06 1.63 -1.00 0.00 0.00 179.01 179.44 3n99 n LYS 159 N -2.51 1.97 0.00 2.33 5.02 -0.23 -4.32 118.16 120.42 3n99 n LYS 159 Ca 0.00 -1.50 0.16 0.00 -2.02 0.00 0.00 58.31 54.95 3n99 n LYS 159 Cb 0.19 -1.47 0.87 0.00 -0.02 0.00 0.00 35.03 34.60 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 0.80 0.03 -0.03 -0.35 4.77 -1.10 -4.89 117.00 116.23 3n99 n LEU 160 Ca 0.15 0.09 -0.00 0.00 -0.03 0.00 0.00 56.01 56.22 3n99 n LEU 160 Cb 0.51 -0.10 -0.00 0.00 -2.33 0.00 0.00 43.42 41.50 3n99 n LEU 160 CO 0.17 0.00 -0.00 0.61 -1.33 0.00 0.00 177.39 176.84 3n99 n GLY 161 N 1.10 0.39 3.74 -0.72 0.00 -1.26 -4.60 105.19 103.84 3n99 n GLY 161 Ca 0.20 -1.02 -0.40 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 -2.01 4.47 -0.04 -0.61 1.01 -1.26 -4.55 121.20 118.21 3n99 s ILE 162 Ca 0.00 1.91 0.03 0.00 0.00 0.00 0.00 60.65 62.59 3n99 s ILE 162 Cb 0.00 -4.24 0.00 0.00 0.01 0.00 0.00 42.46 38.23 3n99 s ILE 162 CO 0.00 0.39 -0.12 -1.10 0.00 0.00 0.00 174.94 174.11 3n99 s GLN 163 N -0.37 1.29 0.11 2.79 -0.21 -0.85 -4.96 119.66 117.45 3n99 s GLN 163 Ca 0.42 -0.41 -0.26 0.00 0.02 0.00 0.00 55.36 55.14 3n99 s GLN 163 Cb -0.23 -1.15 -0.07 0.00 1.00 0.00 0.00 33.01 32.56 3n99 s GLN 163 CO 0.28 0.14 0.80 -1.83 -2.12 0.00 0.00 175.29 172.56 3n99 s GLU 164 N 0.21 4.56 -0.26 2.91 -1.05 -1.26 -0.91 118.70 122.90 3n99 s GLU 164 Ca -0.05 1.16 -0.02 0.00 -0.15 0.00 0.00 54.97 55.91 3n99 s GLU 164 Cb -0.10 -3.32 0.15 0.00 -0.44 0.00 0.00 34.13 30.41 3n99 s GLU 164 CO 0.01 0.40 0.41 0.21 0.95 0.00 0.00 175.26 177.25 3n99 s LYS 165 N -0.54 0.39 -0.70 -4.83 2.20 0.01 -4.96 119.74 111.31 3n99 s LYS 165 Ca 0.38 0.55 -0.01 0.00 -0.36 0.00 0.00 55.97 56.53 3n99 s LYS 165 Cb -0.22 -0.31 0.00 0.00 -1.51 0.00 0.00 37.83 35.79 3n99 s LYS 165 CO 0.25 -0.69 0.59 0.09 -0.36 0.00 0.00 175.35 175.23 3n99 n ASN 166 N 5.37 -2.58 -1.09 1.43 3.02 -1.26 -2.44 115.26 117.71 3n99 n ASN 166 Ca -0.03 -0.34 -0.14 0.00 -0.03 0.00 0.00 54.58 54.04 3n99 n ASN 166 Cb 0.50 -3.11 -0.06 0.00 -0.61 0.00 0.00 39.78 36.50 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 -1.14 1.41 3.31 7.41 0.00 -1.26 -5.01 105.19 109.92 3n99 n GLY 167 Ca -0.13 -0.11 -0.27 0.00 0.00 0.00 0.00 46.02 45.51 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 -3.15 1.40 -0.24 1.61 1.02 -1.02 -4.85 119.74 114.51 3n99 s LYS 168 Ca 0.00 -1.13 -0.05 0.00 0.02 0.00 0.00 55.97 54.81 3n99 s LYS 168 Cb 0.00 -1.66 -0.01 0.00 -0.52 0.00 0.00 37.83 35.64 3n99 s LYS 168 CO 0.00 0.41 -0.00 0.42 -0.92 0.00 0.00 175.35 175.26 3n99 s ILE 169 N -0.96 3.64 -0.19 2.17 1.01 0.94 -0.81 121.20 127.00 3n99 s ILE 169 Ca 0.10 -0.47 -0.16 0.00 0.00 0.00 0.00 60.65 60.11 3n99 s ILE 169 Cb -0.10 -2.71 -0.04 0.00 0.01 0.00 0.00 42.46 39.63 3n99 s ILE 169 CO 0.03 0.35 0.42 -1.00 0.00 0.00 0.00 174.94 174.75 3n99 s HIS 170 N 1.51 3.38 -0.16 3.97 3.76 -0.09 0.12 115.29 127.77 3n99 s HIS 170 Ca 0.05 0.66 -0.00 0.00 -0.15 0.00 0.00 55.06 55.62 3n99 s HIS 170 Cb -0.15 -2.55 0.04 0.00 1.11 0.00 0.00 32.58 31.03 3n99 s HIS 170 CO -0.01 -0.01 -0.06 0.08 -0.85 0.00 0.00 174.74 173.89 3n99 s VAL 171 N 1.30 1.18 0.22 -0.90 1.01 -0.32 -2.02 120.40 120.87 3n99 s VAL 171 Ca 0.20 -0.64 -0.30 0.00 0.00 0.00 0.00 61.98 61.24 3n99 s VAL 171 Cb -0.15 -1.32 -0.09 0.00 0.00 0.00 0.00 36.38 34.82 3n99 s VAL 171 CO 0.08 0.16 1.34 -2.84 0.00 0.00 0.00 175.10 173.85 3n99 s PRO 172 N 1.61 4.36 0.03 2.72 0.02 -1.26 -1.00 135.00 141.48 3n99 s PRO 172 Ca 0.01 2.13 -0.01 0.00 0.02 0.00 0.00 61.00 63.15 3n99 s PRO 172 Cb -0.15 -3.16 -0.03 0.00 0.02 0.00 0.00 34.50 31.18 3n99 s PRO 172 CO -0.08 -0.29 -0.02 0.14 -0.33 0.00 0.00 177.00 176.42 3n99 s VAL 173 N -0.02 0.15 -0.94 3.83 -7.23 -0.29 -4.85 120.40 111.06 3n99 s VAL 173 Ca 0.57 -1.26 0.26 0.00 -1.81 0.00 0.00 61.98 59.74 3n99 s VAL 173 Cb -0.38 -0.77 0.10 0.00 0.56 0.00 0.00 36.38 35.90 3n99 s VAL 173 CO 0.40 -0.69 1.59 1.33 -0.31 0.00 0.00 175.10 177.42 3n99 n VAL 174 N 1.00 0.08 -3.59 1.32 0.24 -0.23 -1.04 118.33 116.11 3n99 n VAL 174 Ca -0.20 -0.05 -0.09 0.00 -2.04 0.00 0.00 64.34 61.96 3n99 n VAL 174 Cb 0.57 -0.10 -0.05 0.00 -1.47 0.00 0.00 33.84 32.80 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 -3.03 -1.97 -0.19 2.33 0.00 -1.26 -4.75 121.76 112.89 3n99 s ALA 175 Ca 0.11 1.66 -0.01 0.00 0.00 0.00 0.00 51.96 53.72 3n99 s ALA 175 Cb 0.17 -0.89 0.00 0.00 0.00 0.00 0.00 23.12 22.41 3n99 s ALA 175 CO 0.64 -0.29 -0.13 0.15 0.00 0.00 0.00 175.76 176.13 3n99 s LYS 176 N -1.09 3.19 -0.21 0.00 1.02 -1.26 -1.20 119.74 120.19 3n99 s LYS 176 Ca 0.01 -0.73 -0.07 0.00 0.02 0.00 0.00 55.97 55.20 3n99 s LYS 176 Cb -0.01 -2.75 -0.03 0.00 -0.52 0.00 0.00 37.83 34.52 3n99 s LYS 176 CO -0.01 -0.16 0.05 0.42 -0.92 0.00 0.00 175.35 174.73 3n99 s ILE 177 N 1.27 4.38 0.55 2.17 1.01 0.23 -4.92 121.20 125.89 3n99 s ILE 177 Ca 0.03 -0.16 -0.20 0.00 0.00 0.00 0.00 60.65 60.32 3n99 s ILE 177 Cb -0.14 -3.00 -0.05 0.00 0.01 0.00 0.00 42.46 39.28 3n99 s ILE 177 CO -0.07 0.40 1.20 -2.84 0.00 0.00 0.00 174.94 173.63 3n99 s PRO 178 N 1.01 3.25 0.31 2.79 0.02 -1.26 -0.11 135.00 141.01 3n99 s PRO 178 Ca 0.03 1.82 0.05 0.00 0.02 0.00 0.00 61.00 62.92 3n99 s PRO 178 Cb -0.14 -2.09 0.82 0.00 0.02 0.00 0.00 34.50 33.11 3n99 s PRO 178 CO 0.03 -0.98 1.61 0.00 -0.33 0.00 0.00 177.00 177.33 3n99 h ALA 179 N 1.28 1.38 0.00 -1.55 0.00 -1.88 -1.32 119.26 117.17 3n99 h ALA 179 Ca -0.50 0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3n99 h ALA 179 Cb 1.28 0.41 0.00 0.00 0.00 0.00 0.00 17.79 19.48 3n99 h ALA 179 CO 0.57 -0.58 0.00 -2.39 0.00 0.00 0.00 179.25 176.85 3n99 n HIS 180 N -5.32 0.49 1.29 0.00 1.44 -1.26 -1.61 115.22 110.26 3n99 n HIS 180 Ca 0.25 0.19 0.12 0.00 -2.01 0.00 0.00 57.72 56.27 3n99 n HIS 180 Cb 0.80 -0.81 0.42 0.00 0.12 0.00 0.00 29.99 30.52 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 -1.95 1.79 -3.55 -1.40 2.00 -0.50 -4.85 117.12 108.67 3n99 n MET 181 Ca 0.03 -1.17 -0.37 0.00 0.00 0.00 0.00 57.70 56.19 3n99 n MET 181 Cb 0.21 -1.45 -0.06 0.00 0.00 0.00 0.00 33.22 31.93 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 -1.89 3.83 0.00 0.03 -1.94 -0.63 0.11 119.30 118.81 3n99 s MET 182 Ca 0.35 0.29 0.00 0.00 -1.71 0.00 0.00 55.69 54.62 3n99 s MET 182 Cb 0.20 -3.12 0.00 0.00 2.01 0.00 0.00 34.83 33.91 3n99 s MET 182 CO 0.30 0.64 0.00 0.41 -0.01 0.00 0.00 175.02 176.36 3n99 n GLY 183 N 1.43 3.86 3.58 -0.03 0.00 0.23 -4.84 105.19 109.43 3n99 n GLY 183 Ca -0.12 -0.48 -0.50 0.00 0.00 0.00 0.00 46.02 44.92 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 1.44 0.00 1.61 2.88 -0.40 -2.12 113.62 117.03 3n99 n SER 184 Ca 0.00 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.67 3n99 n SER 184 Cb 0.00 -1.21 0.00 0.00 -0.75 0.00 0.00 64.21 62.25 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 2.18 3.00 3.64 0.46 0.00 -1.26 -0.92 105.19 112.29 3n99 n GLY 185 Ca 0.16 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.22 0.04 -0.12 -0.61 5.41 -0.90 -1.70 119.36 120.26 3n99 n ILE 186 Ca 0.00 -0.01 0.00 0.00 1.00 0.00 0.00 62.75 63.74 3n99 n ILE 186 Cb 0.00 -1.29 0.00 0.00 -0.71 0.00 0.00 39.64 37.64 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 3.18 0.55 3.61 7.39 0.00 -0.11 -5.00 105.19 114.81 3n99 n GLY 187 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.58 0.21 -0.28 4.61 0.00 -0.69 -4.76 120.51 118.02 3n99 n ALA 188 Ca 0.00 0.06 -0.03 0.00 0.00 0.00 0.00 53.44 53.47 3n99 n ALA 188 Cb 0.00 -2.10 0.12 0.00 0.00 0.00 0.00 19.45 17.47 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 0.76 1.04 -3.40 0.00 0.02 -1.92 -1.93 113.55 108.13 3n99 h SER 189 Ca -0.48 -0.11 -0.31 0.00 -0.84 0.00 0.00 61.79 60.06 3n99 h SER 189 Cb 1.36 -0.27 -0.35 0.00 0.14 0.00 0.00 62.40 63.28 3n99 h SER 189 CO 0.52 0.86 -0.70 -0.55 -1.14 0.00 0.00 176.83 175.82 3n99 s SER 190 N -6.33 0.41 0.12 3.07 0.15 -1.26 -3.11 113.70 106.76 3n99 s SER 190 Ca -0.12 0.13 0.13 0.00 0.70 0.00 0.00 55.95 56.79 3n99 s SER 190 Cb 0.17 -0.00 0.60 0.00 -1.71 0.00 0.00 66.02 65.07 3n99 s SER 190 CO 0.82 -0.18 1.39 -1.54 1.20 0.00 0.00 173.24 174.93 3n99 n SER 191 N 4.63 0.25 0.15 5.45 3.41 -0.45 -2.25 113.62 124.81 3n99 n SER 191 Ca -0.18 0.59 0.13 0.00 -0.26 0.00 0.00 58.87 59.15 3n99 n SER 191 Cb 0.50 -0.63 0.46 0.00 -0.26 0.00 0.00 64.21 64.28 3n99 n SER 191 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3n99 h ALA 192 N 2.17 1.00 0.00 7.33 0.00 -1.91 -3.36 119.26 124.48 3n99 h ALA 192 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3n99 h ALA 192 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3n99 h ALA 192 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.12 3n99 n SER 193 N -2.41 1.12 -3.89 0.00 3.41 -0.95 -4.19 113.62 106.70 3n99 n SER 193 Ca 0.03 -1.50 -0.09 0.00 -0.26 0.00 0.00 58.87 57.05 3n99 n SER 193 Cb 0.33 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.23 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 -0.50 0.01 0.43 6.66 -1.32 -1.24 -4.60 115.64 115.09 3n99 s THR 194 Ca 0.00 -1.15 0.08 0.00 -1.21 0.00 0.00 61.69 59.41 3n99 s THR 194 Cb 0.00 -1.95 0.01 0.00 -1.51 0.00 0.00 72.50 69.05 3n99 s THR 194 CO 0.00 -0.06 0.54 1.51 -2.21 0.00 0.00 174.62 174.40 3n99 s ASP 195 N -2.95 5.48 0.16 8.08 -4.77 -1.26 -4.67 116.67 116.73 3n99 s ASP 195 Ca 0.16 -0.53 -0.00 0.00 -3.30 0.00 0.00 52.55 48.88 3n99 s ASP 195 Cb -0.01 -0.57 -0.04 0.00 -1.09 0.00 0.00 42.92 41.21 3n99 s ASP 195 CO 0.04 -0.78 0.05 -0.72 0.70 0.00 0.00 175.17 174.47 3n99 s TYR 196 N -2.40 1.04 -0.13 2.11 1.13 -0.55 -4.66 117.35 113.89 3n99 s TYR 196 Ca 0.54 -1.19 -0.11 0.00 -1.41 0.00 0.00 57.07 54.90 3n99 s TYR 196 Cb -0.08 -0.58 -0.05 0.00 -1.10 0.00 0.00 41.96 40.15 3n99 s TYR 196 CO 0.32 -0.44 0.23 -0.51 -2.51 0.00 0.00 175.55 172.64 3n99 s ASP 197 N -3.11 6.43 -0.27 -0.18 1.11 -0.10 -0.20 116.67 120.35 3n99 s ASP 197 Ca 0.27 0.51 -0.29 0.00 0.18 0.00 0.00 52.55 53.21 3n99 s ASP 197 Cb 0.07 -2.14 0.01 0.00 1.07 0.00 0.00 42.92 41.93 3n99 s ASP 197 CO 0.04 0.25 1.15 -0.63 1.18 0.00 0.00 175.17 177.16 3n99 s ILE 198 N -0.27 4.44 -0.66 0.77 1.01 -0.35 -0.60 121.20 125.54 3n99 s ILE 198 Ca 0.15 1.69 -0.03 0.00 0.00 0.00 0.00 60.65 62.46 3n99 s ILE 198 Cb -0.13 -4.26 0.26 0.00 0.01 0.00 0.00 42.46 38.34 3n99 s ILE 198 CO 0.04 -0.34 2.28 1.15 0.00 0.00 0.00 174.94 178.06 3n99 n MET 199 N 6.78 2.56 -3.39 2.79 0.00 0.30 -2.86 117.12 123.29 3n99 n MET 199 Ca 0.13 -2.96 -0.38 0.00 0.00 0.00 0.00 57.70 54.49 3n99 n MET 199 Cb 0.46 -2.18 -0.07 0.00 0.00 0.00 0.00 33.22 31.43 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 -3.10 3.53 0.20 3.17 0.00 -1.26 -4.89 121.76 119.40 3n99 s ALA 200 Ca 0.54 -0.35 0.14 0.00 0.00 0.00 0.00 51.96 52.30 3n99 s ALA 200 Cb 0.42 -2.58 0.45 0.00 0.00 0.00 0.00 23.12 21.40 3n99 s ALA 200 CO -0.27 -0.06 1.64 0.77 0.00 0.00 0.00 175.76 177.83 3n99 h SER 201 N 6.89 0.00 -4.42 0.00 0.02 -1.91 -3.45 113.55 110.69 3n99 h SER 201 Ca -0.40 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.29 3n99 h SER 201 Cb 1.17 0.00 -0.24 0.00 0.14 0.00 0.00 62.40 63.47 3n99 h SER 201 CO 0.75 0.53 -0.73 0.20 -1.14 0.00 0.00 176.83 176.43 3n99 s ASN 202 N -6.64 0.53 0.48 3.07 0.01 -1.26 -5.02 114.94 106.12 3n99 s ASN 202 Ca -0.00 -0.33 0.14 0.00 -0.71 0.00 0.00 52.86 51.95 3n99 s ASN 202 Cb 0.12 0.02 1.13 0.00 0.41 0.00 0.00 41.25 42.92 3n99 s ASN 202 CO 0.73 -0.12 2.09 1.55 -1.51 0.00 0.00 177.10 179.84 3n99 h PRO 203 N 5.19 0.21 -0.24 -0.60 0.13 -1.87 -1.75 132.00 133.07 3n99 h PRO 203 Ca -0.31 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.81 3n99 h PRO 203 Cb 1.20 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 3n99 h PRO 203 CO 0.45 0.14 0.14 0.93 -0.23 0.00 0.00 178.00 179.43 3n99 h GLU 204 N 0.22 0.31 0.00 0.86 3.07 -1.81 0.23 114.58 117.46 3n99 h GLU 204 Ca 0.09 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 3n99 h GLU 204 Cb 0.12 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 3n99 h GLU 204 CO -0.02 0.22 0.06 -0.44 -1.40 0.00 0.00 179.01 177.43 3n99 h ASP 205 N 0.32 0.00 -0.19 1.42 3.32 -1.62 0.34 116.42 120.00 3n99 h ASP 205 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 3n99 h ASP 205 Cb -0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.53 3n99 h ASP 205 CO -0.02 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.68 3n99 n LEU 206 N -2.50 2.67 -0.88 1.55 4.77 0.78 -4.99 117.00 118.41 3n99 n LEU 206 Ca -0.02 -1.37 -0.08 0.00 -0.03 0.00 0.00 56.01 54.51 3n99 n LEU 206 Cb 0.10 -0.12 -0.01 0.00 -2.33 0.00 0.00 43.42 41.07 3n99 n LEU 206 CO 0.12 0.57 -0.10 0.61 -1.33 0.00 0.00 177.39 177.26 3n99 n GLY 207 N 0.89 0.10 3.18 -0.72 0.00 0.12 -4.83 105.19 103.94 3n99 n GLY 207 Ca 0.12 -0.57 -0.14 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.39 0.94 0.24 1.61 -7.23 -1.13 -5.00 120.40 107.44 3n99 s VAL 208 Ca 0.00 -1.71 -0.00 0.00 -1.81 0.00 0.00 61.98 58.46 3n99 s VAL 208 Cb 0.00 -1.44 0.01 0.00 0.56 0.00 0.00 36.38 35.51 3n99 s VAL 208 CO 0.00 -0.61 1.62 0.00 -0.31 0.00 0.00 175.10 175.80 3n99 h ALA 209 N 3.42 0.90 -2.58 1.32 0.00 -1.96 -2.94 119.26 117.43 3n99 h ALA 209 Ca -0.37 -0.43 -0.08 0.00 0.00 0.00 0.00 54.91 54.03 3n99 h ALA 209 Cb 1.19 -0.11 -0.15 0.00 0.00 0.00 0.00 17.79 18.72 3n99 h ALA 209 CO 0.55 0.63 -0.25 0.34 0.00 0.00 0.00 179.25 180.53 3n99 s ASP 210 N -6.85 -0.08 -0.06 0.00 2.15 -1.26 -4.75 116.67 105.81 3n99 s ASP 210 Ca -0.07 -0.34 0.01 0.00 0.43 0.00 0.00 52.55 52.58 3n99 s ASP 210 Cb 0.13 0.38 0.02 0.00 -0.30 0.00 0.00 42.92 43.14 3n99 s ASP 210 CO 0.81 -0.69 -0.08 -0.22 -0.17 0.00 0.00 175.17 174.82 3n99 s LEU 211 N -2.42 1.39 0.09 -1.34 2.96 -1.26 -5.03 118.68 113.06 3n99 s LEU 211 Ca -0.01 -0.22 0.06 0.00 -0.22 0.00 0.00 54.13 53.74 3n99 s LEU 211 Cb 0.01 -0.65 -0.04 0.00 0.50 0.00 0.00 46.19 46.01 3n99 s LEU 211 CO -0.07 -0.04 -0.05 -0.54 -1.32 0.00 0.00 176.35 174.33 3n99 s LYS 212 N 0.98 2.37 0.21 1.98 1.02 -1.26 -0.45 119.74 124.59 3n99 s LYS 212 Ca -0.09 -0.90 -0.32 0.00 0.02 0.00 0.00 55.97 54.67 3n99 s LYS 212 Cb -0.15 -2.44 -0.13 0.00 -0.52 0.00 0.00 37.83 34.60 3n99 s LYS 212 CO 0.00 0.53 1.60 1.28 -0.92 0.00 0.00 175.35 177.84 3n99 n LEU 213 N 0.75 3.58 0.00 3.17 4.77 0.41 -1.15 117.00 128.53 3n99 n LEU 213 Ca -0.12 1.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.95 3n99 n LEU 213 Cb 0.52 -1.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.11 3n99 n LEU 213 CO 0.36 -0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 3n99 n GLY 214 N 3.18 0.83 3.76 -0.72 0.00 0.46 -0.99 105.19 111.71 3n99 n GLY 214 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.61 6.07 -0.18 1.61 1.11 -0.30 -1.17 116.67 121.20 3n99 s ASP 215 Ca 0.00 2.61 -0.16 0.00 0.18 0.00 0.00 52.55 55.19 3n99 s ASP 215 Cb 0.00 -2.63 -0.04 0.00 1.07 0.00 0.00 42.92 41.32 3n99 s ASP 215 CO 0.00 -1.01 0.38 -0.63 1.18 0.00 0.00 175.17 175.09 3n99 s ILE 216 N -1.33 5.23 0.14 0.77 1.01 -0.63 -0.22 121.20 126.16 3n99 s ILE 216 Ca 0.61 0.69 0.04 0.00 0.00 0.00 0.00 60.65 61.99 3n99 s ILE 216 Cb -0.37 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.35 3n99 s ILE 216 CO 0.46 0.30 -0.10 0.68 0.00 0.00 0.00 174.94 176.28 3n99 s VAL 217 N 1.02 1.11 -0.07 2.92 -7.23 0.01 -1.06 120.40 117.09 3n99 s VAL 217 Ca 0.19 -2.04 -0.03 0.00 -1.81 0.00 0.00 61.98 58.30 3n99 s VAL 217 Cb -0.14 -1.82 -0.04 0.00 0.56 0.00 0.00 36.38 34.95 3n99 s VAL 217 CO 0.07 -0.76 0.06 0.00 -0.31 0.00 0.00 175.10 174.16 3n99 s ALA 218 N -3.34 3.50 -0.27 1.32 0.00 -0.34 -0.75 121.76 121.89 3n99 s ALA 218 Ca 0.16 -0.79 -0.04 0.00 0.00 0.00 0.00 51.96 51.29 3n99 s ALA 218 Cb 0.03 -1.62 0.02 0.00 0.00 0.00 0.00 23.12 21.55 3n99 s ALA 218 CO -0.00 0.62 0.00 0.42 0.00 0.00 0.00 175.76 176.81 3n99 s ILE 219 N -1.00 3.35 0.18 0.00 1.01 0.24 0.78 121.20 125.76 3n99 s ILE 219 Ca 0.16 -0.91 -0.30 0.00 0.00 0.00 0.00 60.65 59.61 3n99 s ILE 219 Cb -0.12 -2.73 -0.08 0.00 0.01 0.00 0.00 42.46 39.55 3n99 s ILE 219 CO 0.06 0.13 1.02 -1.10 0.00 0.00 0.00 174.94 175.05 3n99 s GLN 220 N 1.39 4.69 -1.28 2.79 -0.21 0.84 -1.77 119.66 126.12 3n99 s GLN 220 Ca 0.01 1.59 0.00 0.00 0.02 0.00 0.00 55.36 56.98 3n99 s GLN 220 Cb -0.17 -3.30 0.00 0.00 1.00 0.00 0.00 33.01 30.54 3n99 s GLN 220 CO -0.01 0.24 0.00 -0.25 -2.12 0.00 0.00 175.29 173.15 3n99 n ASP 221 N 2.14 -4.39 -4.17 5.90 8.00 0.53 -2.96 116.55 121.61 3n99 n ASP 221 Ca 0.01 0.14 -0.32 0.00 0.71 0.00 0.00 54.79 55.33 3n99 n ASP 221 Cb 0.47 -3.35 -0.17 0.00 -0.02 0.00 0.00 41.12 38.05 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 -2.60 2.58 -0.01 1.24 3.76 -1.25 -0.94 115.29 118.08 3n99 s HIS 222 Ca 0.00 -1.24 -0.15 0.00 -0.15 0.00 0.00 55.06 53.52 3n99 s HIS 222 Cb 0.00 -1.75 -0.06 0.00 1.11 0.00 0.00 32.58 31.88 3n99 s HIS 222 CO 0.00 -0.55 0.41 0.34 -0.85 0.00 0.00 174.74 174.09 3n99 s ASP 223 N 0.71 6.80 -0.22 1.40 -1.08 0.90 -3.52 116.67 121.67 3n99 s ASP 223 Ca -0.10 0.95 0.17 0.00 -0.52 0.00 0.00 52.55 53.05 3n99 s ASP 223 Cb -0.16 -2.25 0.47 0.00 -1.46 0.00 0.00 42.92 39.52 3n99 s ASP 223 CO 0.01 0.30 1.16 0.59 0.52 0.00 0.00 175.17 177.74 3n99 n ASN 224 N 1.98 2.57 -0.08 -0.34 3.02 -1.26 -2.03 115.26 119.12 3n99 n ASN 224 Ca -0.13 -2.79 -0.11 0.00 -0.03 0.00 0.00 54.58 51.51 3n99 n ASN 224 Cb 0.52 -0.41 0.03 0.00 -0.61 0.00 0.00 39.78 39.31 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 2.03 0.86 0.00 6.41 0.02 -1.94 -3.43 113.55 117.50 3n99 h SER 225 Ca 0.03 -0.38 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 3n99 h SER 225 Cb 1.42 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.72 3n99 h SER 225 CO 0.33 1.14 0.00 -1.22 -1.14 0.00 0.00 176.83 175.94 3n99 n TYR 226 N -4.05 0.00 -1.31 3.45 4.01 -1.26 -4.92 117.16 113.07 3n99 n TYR 226 Ca -0.02 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.43 3n99 n TYR 226 Cb 0.53 0.00 0.17 0.00 -0.31 0.00 0.00 39.34 39.73 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 -0.83 1.57 -0.11 2.72 0.00 -1.18 -1.34 107.32 108.15 3n99 s GLY 227 Ca 0.00 -0.52 -0.15 0.00 0.00 0.00 0.00 44.72 44.05 3n99 s GLY 227 CO 0.00 0.11 0.37 0.14 0.00 0.00 0.00 173.10 173.73 3n99 s VAL 228 N -3.11 5.21 -0.29 1.40 1.01 -0.73 -4.48 120.40 119.41 3n99 s VAL 228 Ca 0.66 0.73 -0.01 0.00 0.00 0.00 0.00 61.98 63.36 3n99 s VAL 228 Cb -0.16 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.52 3n99 s VAL 228 CO 0.56 0.42 0.16 0.61 0.00 0.00 0.00 175.10 176.84 3n99 n GLY 229 N 2.95 0.51 3.64 4.51 0.00 -1.23 -0.94 105.19 114.64 3n99 n GLY 229 Ca -0.11 -0.57 -0.43 0.00 0.00 0.00 0.00 46.02 44.91 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 -4.91 3.98 0.05 1.61 2.47 -0.86 -4.82 119.74 117.27 3n99 s LYS 230 Ca 0.08 1.72 -0.31 0.00 -1.56 0.00 0.00 55.97 55.90 3n99 s LYS 230 Cb -0.03 -3.95 -0.06 0.00 -1.46 0.00 0.00 37.83 32.33 3n99 s LYS 230 CO 0.10 -1.06 1.31 -0.47 0.16 0.00 0.00 175.35 175.39 3n99 s TYR 231 N 4.50 3.20 -0.21 4.03 5.04 -1.26 -0.07 117.35 132.58 3n99 s TYR 231 Ca 0.66 1.06 -0.05 0.00 -2.44 0.00 0.00 57.07 56.30 3n99 s TYR 231 Cb -0.25 -3.57 0.11 0.00 0.35 0.00 0.00 41.96 38.60 3n99 s TYR 231 CO 0.25 -1.94 0.38 0.50 -1.34 0.00 0.00 175.55 173.41 3n99 s ARG 232 N 1.54 0.31 0.21 4.97 3.52 -0.11 -4.90 118.95 124.50 3n99 s ARG 232 Ca 0.62 0.78 -0.32 0.00 -0.13 0.00 0.00 55.73 56.68 3n99 s ARG 232 Cb -0.32 -0.07 -0.12 0.00 -1.56 0.00 0.00 34.95 32.89 3n99 s ARG 232 CO 0.28 -0.43 1.68 0.21 -0.81 0.00 0.00 175.30 176.24 3n99 s LYS 233 N 2.56 4.14 0.00 5.12 2.20 -1.26 -0.31 119.74 132.19 3n99 s LYS 233 Ca 0.05 2.56 0.00 0.00 -0.36 0.00 0.00 55.97 58.22 3n99 s LYS 233 Cb -0.14 -3.08 0.00 0.00 -1.51 0.00 0.00 37.83 33.10 3n99 s LYS 233 CO -0.14 -0.72 0.00 0.41 -0.36 0.00 0.00 175.35 174.55 3n99 n GLY 234 N 3.78 1.72 3.80 5.54 0.00 -1.26 -5.04 105.19 113.72 3n99 n GLY 234 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.38 2.77 -0.02 4.61 0.00 0.58 -0.12 121.76 127.19 3n99 s ALA 235 Ca 0.00 0.50 -0.02 0.00 0.00 0.00 0.00 51.96 52.44 3n99 s ALA 235 Cb 0.00 -3.25 0.01 0.00 0.00 0.00 0.00 23.12 19.88 3n99 s ALA 235 CO 0.00 -0.67 0.06 0.54 0.00 0.00 0.00 175.76 175.69 3n99 s VAL 236 N -2.25 -0.01 0.13 0.00 0.11 0.11 -0.35 120.40 118.15 3n99 s VAL 236 Ca 0.66 0.03 0.09 0.00 -2.93 0.00 0.00 61.98 59.83 3n99 s VAL 236 Cb -0.17 -0.09 -0.04 0.00 -1.53 0.00 0.00 36.38 34.55 3n99 s VAL 236 CO 0.31 0.01 -0.22 -0.44 -3.33 0.00 0.00 175.10 171.43 3n99 s SER 237 N 0.20 2.86 -0.06 3.54 0.01 -0.73 -1.40 113.70 118.12 3n99 s SER 237 Ca -0.01 -0.75 0.04 0.00 1.31 0.00 0.00 55.95 56.53 3n99 s SER 237 Cb -0.02 -0.18 -0.02 0.00 0.21 0.00 0.00 66.02 66.01 3n99 s SER 237 CO -0.01 0.08 -0.18 -0.63 0.41 0.00 0.00 173.24 172.91 3n99 s ILE 238 N -1.35 2.73 0.27 1.44 -1.09 0.53 -0.60 121.20 123.13 3n99 s ILE 238 Ca 0.12 -0.84 -0.07 0.00 -2.23 0.00 0.00 60.65 57.63 3n99 s ILE 238 Cb -0.09 -2.05 -0.01 0.00 -1.58 0.00 0.00 42.46 38.73 3n99 s ILE 238 CO 0.06 0.58 0.40 -0.83 -1.23 0.00 0.00 174.94 173.91 3n99 s GLY 239 N -0.47 1.04 -0.07 6.18 0.00 0.07 -0.58 107.32 113.49 3n99 s GLY 239 Ca 0.06 -1.26 0.05 0.00 0.00 0.00 0.00 44.72 43.57 3n99 s GLY 239 CO 0.01 -0.92 -0.24 0.14 0.00 0.00 0.00 173.10 172.10 3n99 s VAL 240 N -3.75 2.10 0.00 1.40 1.01 0.24 -0.81 120.40 120.60 3n99 s VAL 240 Ca 0.29 -1.04 -0.30 0.00 0.00 0.00 0.00 61.98 60.93 3n99 s VAL 240 Cb 0.01 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 3n99 s VAL 240 CO 0.13 0.57 1.19 -0.69 0.00 0.00 0.00 175.10 176.30 3n99 s VAL 241 N -0.01 4.17 0.00 2.92 1.01 0.69 -0.49 120.40 128.69 3n99 s VAL 241 Ca -0.08 1.54 0.00 0.00 0.00 0.00 0.00 61.98 63.44 3n99 s VAL 241 Cb -0.15 -3.99 0.00 0.00 0.00 0.00 0.00 36.38 32.24 3n99 s VAL 241 CO 0.05 0.06 0.00 1.33 0.00 0.00 0.00 175.10 176.55 3n99 n VAL 242 N 4.25 0.00 -4.01 2.92 0.24 -0.00 -0.41 118.33 121.33 3n99 n VAL 242 Ca 0.10 -0.14 -0.10 0.00 -2.04 0.00 0.00 64.34 62.16 3n99 n VAL 242 Cb 0.46 0.62 -0.07 0.00 -1.47 0.00 0.00 33.84 33.38 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 -1.07 0.49 0.81 6.34 -3.43 -1.25 -4.54 115.29 112.64 3n99 s HIS 243 Ca 0.00 -0.83 -0.12 0.00 -0.80 0.00 0.00 55.06 53.31 3n99 s HIS 243 Cb 0.00 -0.04 0.09 0.00 -1.43 0.00 0.00 32.58 31.20 3n99 s HIS 243 CO 0.00 -0.81 1.17 -1.54 -2.00 0.00 0.00 174.74 171.56 3n99 s SER 244 N -3.01 4.41 0.86 7.38 1.04 -0.52 -3.13 113.70 120.74 3n99 s SER 244 Ca 0.22 0.68 -0.14 0.00 0.48 0.00 0.00 55.95 57.19 3n99 s SER 244 Cb 0.02 -1.15 0.01 0.00 0.10 0.00 0.00 66.02 65.00 3n99 s SER 244 CO 0.05 -1.94 0.49 0.00 0.98 0.00 0.00 173.24 172.82 3n99 n ALA 245 N -3.30 -2.07 -2.31 5.32 0.00 0.39 -3.86 120.51 114.68 3n99 n ALA 245 Ca 0.09 -0.46 -0.17 0.00 0.00 0.00 0.00 53.44 52.90 3n99 n ALA 245 Cb 0.61 -1.84 -0.10 0.00 0.00 0.00 0.00 19.45 18.12 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 -0.32 0.68 -2.46 0.00 0.24 -1.26 -4.74 118.33 110.47 3n99 n VAL 247 Ca -0.08 -0.64 -0.32 0.00 -2.04 0.00 0.00 64.34 61.26 3n99 n VAL 247 Cb 0.61 -0.30 -0.03 0.00 -1.47 0.00 0.00 33.84 32.65 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 -5.11 6.56 0.25 -1.34 0.01 -1.23 -2.01 113.70 110.83 3n99 s SER 248 Ca -0.07 1.45 -0.31 0.00 1.31 0.00 0.00 55.95 58.33 3n99 s SER 248 Cb 0.10 -2.46 -0.12 0.00 0.21 0.00 0.00 66.02 63.76 3n99 s SER 248 CO 0.86 -0.57 1.67 0.00 0.41 0.00 0.00 173.24 175.61 3n99 s ALA 249 N -2.62 3.85 0.00 1.44 0.00 -1.26 -2.50 121.76 120.68 3n99 s ALA 249 Ca 0.57 1.60 0.00 0.00 0.00 0.00 0.00 51.96 54.12 3n99 s ALA 249 Cb -0.10 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.34 3n99 s ALA 249 CO 0.33 -0.97 0.00 0.41 0.00 0.00 0.00 175.76 175.54 3n99 n GLY 250 N 3.08 1.01 3.75 0.00 0.00 -1.26 -5.00 105.19 106.78 3n99 n GLY 250 Ca 0.12 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.57 2.77 -2.39 1.61 0.09 -1.04 -1.28 115.29 112.47 3n99 s HIS 251 Ca 0.00 -0.33 0.00 0.00 -0.00 0.00 0.00 55.06 54.73 3n99 s HIS 251 Cb 0.00 -1.61 0.00 0.00 -0.00 0.00 0.00 32.58 30.97 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 -1.17 -0.94 3.67 -2.22 0.00 -1.23 -4.47 105.19 98.83 3n99 n GLY 252 Ca -0.03 -0.93 -0.48 0.00 0.00 0.00 0.00 46.02 44.58 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 2.03 -2.18 1.61 -0.02 -1.14 -4.33 135.00 130.97 3n99 n PRO 253 Ca 0.00 0.74 -0.35 0.00 -2.02 0.00 0.00 63.50 61.87 3n99 n PRO 253 Cb 0.00 -2.52 0.01 0.00 -0.02 0.00 0.00 33.50 30.97 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 2.23 2.57 -0.06 -1.23 0.00 -1.18 -1.21 107.32 108.43 3n99 s GLY 254 Ca 0.86 0.79 0.02 0.00 0.00 0.00 0.00 44.72 46.39 3n99 s GLY 254 CO 0.45 1.15 -0.09 0.14 0.00 0.00 0.00 173.10 174.75 3n99 s VAL 255 N -1.85 0.93 -0.24 1.40 1.01 0.72 -0.82 120.40 121.55 3n99 s VAL 255 Ca 0.72 -0.35 -0.12 0.00 0.00 0.00 0.00 61.98 62.23 3n99 s VAL 255 Cb -0.24 -0.88 -0.05 0.00 0.00 0.00 0.00 36.38 35.22 3n99 s VAL 255 CO 0.29 0.31 0.21 -0.69 0.00 0.00 0.00 175.10 175.22 3n99 s VAL 256 N 0.78 5.32 0.12 2.92 1.01 0.35 -1.48 120.40 129.42 3n99 s VAL 256 Ca -0.13 0.27 -0.30 0.00 0.00 0.00 0.00 61.98 61.82 3n99 s VAL 256 Cb -0.15 -3.55 -0.07 0.00 0.00 0.00 0.00 36.38 32.61 3n99 s VAL 256 CO 0.02 0.30 1.19 -0.69 0.00 0.00 0.00 175.10 175.93 3n99 s VAL 257 N 1.28 3.83 -0.12 2.92 1.01 -1.26 -0.59 120.40 127.47 3n99 s VAL 257 Ca 0.09 1.42 0.04 0.00 0.00 0.00 0.00 61.98 63.54 3n99 s VAL 257 Cb -0.14 -3.91 -0.06 0.00 0.00 0.00 0.00 36.38 32.27 3n99 s VAL 257 CO 0.06 0.17 0.15 2.30 0.00 0.00 0.00 175.10 177.78 3n99 n ILE 258 N 3.23 0.00 -3.65 2.22 -5.35 0.25 -4.44 119.36 111.62 3n99 n ILE 258 Ca 0.07 -0.27 -0.11 0.00 -0.27 0.00 0.00 62.75 62.17 3n99 n ILE 258 Cb 0.46 0.74 -0.08 0.00 -1.74 0.00 0.00 39.64 39.02 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 -1.81 0.70 -0.01 6.28 0.00 -0.91 -1.59 119.30 121.96 3n99 s MET 259 Ca 0.00 1.03 -0.05 0.00 0.00 0.00 0.00 55.69 56.68 3n99 s MET 259 Cb 0.03 0.23 -0.00 0.00 0.00 0.00 0.00 34.83 35.09 3n99 s MET 259 CO 0.18 -0.12 0.10 -0.08 0.00 0.00 0.00 175.02 175.10 3n99 s THR 260 N 1.01 0.07 -2.11 10.11 -1.32 -0.12 -0.34 115.64 122.93 3n99 s THR 260 Ca -0.05 -0.56 0.00 0.00 -1.21 0.00 0.00 61.69 59.87 3n99 s THR 260 Cb -0.05 -0.33 0.00 0.00 -1.51 0.00 0.00 72.50 70.61 3n99 s THR 260 CO -0.09 -0.31 0.00 0.61 -2.21 0.00 0.00 174.62 172.62 3n99 n GLY 261 N 1.89 -0.66 3.91 6.08 0.00 -0.50 -1.40 105.19 114.51 3n99 n GLY 261 Ca -0.20 -0.46 -0.32 0.00 0.00 0.00 0.00 46.02 45.04 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 6.37 0.56 1.61 2.15 -1.26 -0.71 116.67 121.38 3n99 s ASP 262 Ca 0.00 0.30 0.26 0.00 0.43 0.00 0.00 52.55 53.54 3n99 s ASP 262 Cb 0.00 -1.98 1.48 0.00 -0.30 0.00 0.00 42.92 42.13 3n99 s ASP 262 CO 0.00 0.20 2.02 1.05 -0.17 0.00 0.00 175.17 178.27 3n99 h GLU 263 N 3.31 0.00 0.00 4.34 4.11 -0.75 -1.54 114.58 124.04 3n99 h GLU 263 Ca -0.46 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 58.93 3n99 h GLU 263 Cb 1.17 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 3n99 h GLU 263 CO 0.74 0.00 -0.17 0.66 0.07 0.00 0.00 179.01 180.30 3n99 h SER 264 N 0.00 0.00 0.00 3.06 4.64 -1.95 -3.33 113.55 115.98 3n99 h SER 264 Ca 0.18 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.27 3n99 h SER 264 Cb 0.83 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.87 3n99 h SER 264 CO -0.00 0.17 -1.87 0.29 -0.87 0.00 0.00 176.83 174.55 3n99 n LYS 265 N -3.68 1.71 -4.05 4.77 4.76 -0.67 -4.88 118.16 116.12 3n99 n LYS 265 Ca -0.02 0.01 -0.35 0.00 -2.87 0.00 0.00 58.31 55.08 3n99 n LYS 265 Cb 0.29 -1.32 -0.13 0.00 -1.84 0.00 0.00 35.03 32.03 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 -2.31 3.94 -0.33 -0.18 1.01 -0.68 -0.04 121.20 122.61 3n99 s ILE 266 Ca -0.09 -0.32 0.04 0.00 0.00 0.00 0.00 60.65 60.29 3n99 s ILE 266 Cb 0.04 -2.78 0.10 0.00 0.01 0.00 0.00 42.46 39.82 3n99 s ILE 266 CO 0.49 0.42 0.03 -0.76 0.00 0.00 0.00 174.94 175.13 3n99 s LEU 267 N 1.06 4.56 0.13 2.97 1.43 0.12 -4.51 118.68 124.43 3n99 s LEU 267 Ca 0.02 -2.06 -0.30 0.00 -1.03 0.00 0.00 54.13 50.77 3n99 s LEU 267 Cb -0.14 -1.60 -0.06 0.00 0.03 0.00 0.00 46.19 44.41 3n99 s LEU 267 CO 0.02 -0.36 0.94 -2.84 0.23 0.00 0.00 176.35 174.34 3n99 s PRO 268 N 0.94 4.71 -0.13 1.29 0.02 -1.26 -1.17 135.00 139.39 3n99 s PRO 268 Ca 0.09 1.42 0.01 0.00 0.02 0.00 0.00 61.00 62.54 3n99 s PRO 268 Cb -0.19 -3.36 0.02 0.00 0.02 0.00 0.00 34.50 30.99 3n99 s PRO 268 CO -0.08 0.28 -0.14 -1.21 -0.33 0.00 0.00 177.00 175.52 3n99 s GLU 269 N -0.24 2.23 0.14 5.54 2.02 -0.17 -4.88 118.70 123.33 3n99 s GLU 269 Ca 0.45 -0.54 -0.30 0.00 0.02 0.00 0.00 54.97 54.59 3n99 s GLU 269 Cb -0.24 -2.01 -0.07 0.00 0.10 0.00 0.00 34.13 31.91 3n99 s GLU 269 CO 0.30 -0.18 1.26 -2.00 0.02 0.00 0.00 175.26 174.66 3n99 s GLU 270 N 1.34 4.42 0.26 1.61 2.12 -1.25 -1.14 118.70 126.06 3n99 s GLU 270 Ca 0.01 1.93 0.02 0.00 0.36 0.00 0.00 54.97 57.29 3n99 s GLU 270 Cb -0.13 -3.26 -0.04 0.00 0.26 0.00 0.00 34.13 30.95 3n99 s GLU 270 CO -0.08 -0.25 0.15 0.14 -0.54 0.00 0.00 175.26 174.68 3n99 s VAL 271 N 0.56 0.25 0.14 3.70 -7.23 -0.20 -4.89 120.40 112.73 3n99 s VAL 271 Ca 0.58 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.76 3n99 s VAL 271 Cb -0.33 -2.54 -0.18 0.00 0.56 0.00 0.00 36.38 33.89 3n99 s VAL 271 CO 0.33 0.00 1.32 -0.33 -0.31 0.00 0.00 175.10 176.11 3n99 h GLU 272 N 2.37 0.21 -3.50 4.82 5.08 -1.94 -3.40 114.58 118.22 3n99 h GLU 272 Ca -0.35 -0.26 -0.32 0.00 -1.00 0.00 0.00 59.36 57.44 3n99 h GLU 272 Cb 1.25 0.08 -0.35 0.00 0.50 0.00 0.00 28.75 30.23 3n99 h GLU 272 CO 0.53 1.02 -0.73 0.50 -1.00 0.00 0.00 179.01 179.32 3n99 s ARG 273 N -3.06 -0.00 -0.33 2.33 3.52 -1.26 -4.97 118.95 115.18 3n99 s ARG 273 Ca -0.03 0.22 0.05 0.00 -0.13 0.00 0.00 55.73 55.84 3n99 s ARG 273 Cb 0.09 -0.34 0.18 0.00 -1.56 0.00 0.00 34.95 33.32 3n99 s ARG 273 CO 0.84 -0.20 0.53 0.00 -0.81 0.00 0.00 175.30 175.65 3n99 s ALA 274 N 1.32 -1.85 -0.15 6.12 0.00 -1.26 -4.95 121.76 120.99 3n99 s ALA 274 Ca -0.06 0.40 -0.07 0.00 0.00 0.00 0.00 51.96 52.24 3n99 s ALA 274 Cb -0.13 -2.41 0.06 0.00 0.00 0.00 0.00 23.12 20.64 3n99 s ALA 274 CO -0.03 -1.94 0.33 1.21 0.00 0.00 0.00 175.76 175.34 3n99 s ASN 275 N 2.36 -0.22 0.61 0.00 3.84 -1.26 -1.61 114.94 118.67 3n99 s ASN 275 Ca 0.12 0.74 0.38 0.00 0.21 0.00 0.00 52.86 54.31 3n99 s ASN 275 Cb -0.10 0.75 1.98 0.00 -0.55 0.00 0.00 41.25 43.33 3n99 s ASN 275 CO -0.20 -0.20 2.23 0.16 -2.79 0.00 0.00 177.10 176.30 3n99 h ILE 276 N 5.90 0.15 0.00 -5.21 3.07 -1.48 -2.31 117.51 117.63 3n99 h ILE 276 Ca -0.30 -0.20 -0.02 0.00 1.55 0.00 0.00 64.86 65.89 3n99 h ILE 276 Cb 1.15 1.17 -0.00 0.00 -0.27 0.00 0.00 36.82 38.86 3n99 h ILE 276 CO 0.26 0.02 -0.09 0.77 -1.05 0.00 0.00 178.15 178.05 3n99 h SER 277 N 0.00 0.00 0.29 2.16 4.64 -1.89 -0.57 113.55 118.17 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 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 3n99 h SER 277 CO 0.00 0.09 0.00 0.47 -0.87 0.00 0.00 176.83 176.52 3n99 n ASP 278 N -3.88 0.15 -0.08 4.97 8.00 -0.87 -2.84 116.55 122.00 3n99 n ASP 278 Ca -0.02 0.55 0.04 0.00 0.71 0.00 0.00 54.79 56.07 3n99 n ASP 278 Cb 0.19 -0.58 0.06 0.00 -0.02 0.00 0.00 41.12 40.77 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 -1.68 0.00 0.00 1.24 4.01 -0.23 -5.15 117.16 115.35 3n99 n TYR 279 Ca 0.01 -0.60 0.00 0.00 -0.16 0.00 0.00 57.90 57.15 3n99 n TYR 279 Cb 0.10 -0.09 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 3n99 n TYR 279 CO 0.00 0.00 0.00 1.47 -0.46 0.00 0.00 176.86 177.87