#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 3.85 -0.08 -0.41 1.00 -1.26 -5.01 119.30 117.39 3n99 s MET 1 Ca 0.00 0.86 -0.30 0.00 0.00 0.00 0.00 55.69 56.25 3n99 s MET 1 Cb 0.00 -2.15 -0.02 0.00 0.00 0.00 0.00 34.83 32.67 3n99 s MET 1 CO 0.00 -0.32 1.06 1.03 0.00 0.00 0.00 175.02 176.79 3n99 s ARG 2 N -4.32 4.41 0.22 2.03 0.52 -1.26 -5.00 118.95 115.55 3n99 s ARG 2 Ca 0.57 1.47 0.07 0.00 -0.52 0.00 0.00 55.73 57.32 3n99 s ARG 2 Cb -0.10 -3.54 -0.05 0.00 0.52 0.00 0.00 34.95 31.78 3n99 s ARG 2 CO 0.37 -0.33 -0.11 0.95 0.02 0.00 0.00 175.30 176.19 3n99 s THR 3 N 2.00 1.65 -0.34 0.02 -4.23 -1.26 0.06 115.64 113.54 3n99 s THR 3 Ca 0.51 -2.18 0.02 0.00 -1.18 0.00 0.00 61.69 58.86 3n99 s THR 3 Cb -0.20 -2.14 0.21 0.00 1.34 0.00 0.00 72.50 71.70 3n99 s THR 3 CO 0.20 -0.52 1.13 -0.46 -0.54 0.00 0.00 174.62 174.43 3n99 n ASN 4 N -0.42 2.94 -0.32 3.99 6.94 -1.11 -4.66 115.26 122.61 3n99 n ASN 4 Ca -0.07 -2.40 0.18 0.00 -0.02 0.00 0.00 54.58 52.27 3n99 n ASN 4 Cb 0.61 -0.58 0.43 0.00 -2.36 0.00 0.00 39.78 37.88 3n99 n ASN 4 CO 0.00 0.00 0.00 0.50 -1.03 0.00 0.00 177.26 176.73 3n99 h LYS 5 N 0.57 0.53 0.00 -3.83 3.64 -1.95 0.34 116.57 115.86 3n99 h LYS 5 Ca 0.12 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3n99 h LYS 5 Cb 1.34 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 3n99 h LYS 5 CO 0.26 0.35 0.00 -0.25 -2.27 0.00 0.00 179.45 177.54 3n99 n ASP 6 N -4.70 0.15 -0.37 4.20 8.00 -1.26 -2.22 116.55 120.35 3n99 n ASP 6 Ca 0.24 0.52 0.12 0.00 0.71 0.00 0.00 54.79 56.39 3n99 n ASP 6 Cb 0.73 -0.56 0.22 0.00 -0.02 0.00 0.00 41.12 41.49 3n99 n ASP 6 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3n99 n ARG 7 N -1.65 1.05 -2.53 -1.24 1.74 0.12 -4.97 116.66 109.18 3n99 n ARG 7 Ca 0.05 -0.75 -0.35 0.00 -0.77 0.00 0.00 57.85 56.04 3n99 n ARG 7 Cb 0.26 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.19 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 -2.47 3.90 -0.18 0.55 1.43 -0.94 -5.03 118.68 115.94 3n99 s LEU 8 Ca 0.22 1.96 -0.14 0.00 -1.03 0.00 0.00 54.13 55.15 3n99 s LEU 8 Cb 0.19 -4.49 -0.04 0.00 0.03 0.00 0.00 46.19 41.87 3n99 s LEU 8 CO 0.53 -0.75 0.30 -0.69 0.23 0.00 0.00 176.35 175.97 3n99 s VAL 9 N -1.91 5.29 -0.21 -1.59 1.01 -1.26 -5.06 120.40 116.67 3n99 s VAL 9 Ca 0.66 0.54 -0.07 0.00 0.00 0.00 0.00 61.98 63.10 3n99 s VAL 9 Cb -0.18 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 3n99 s VAL 9 CO 0.22 0.35 0.07 -0.60 0.00 0.00 0.00 175.10 175.14 3n99 s ARG 10 N 0.76 3.85 0.01 2.72 3.52 -1.26 -4.60 118.95 123.94 3n99 s ARG 10 Ca 0.16 -0.40 -0.01 0.00 -0.13 0.00 0.00 55.73 55.35 3n99 s ARG 10 Cb -0.13 -3.27 -0.01 0.00 -1.56 0.00 0.00 34.95 29.97 3n99 s ARG 10 CO 0.05 0.07 0.00 -1.50 -0.81 0.00 0.00 175.30 173.11 3n99 s ILE 11 N 0.92 0.08 -0.12 4.11 2.07 -0.69 -4.97 121.20 122.60 3n99 s ILE 11 Ca 0.04 -0.69 -0.29 0.00 -1.41 0.00 0.00 60.65 58.30 3n99 s ILE 11 Cb -0.14 -0.23 -0.02 0.00 0.13 0.00 0.00 42.46 42.20 3n99 s ILE 11 CO 0.03 -0.38 1.23 -0.94 -1.91 0.00 0.00 174.94 172.97 3n99 s SER 12 N -1.13 6.99 -0.17 4.50 1.04 -1.26 -0.93 113.70 122.74 3n99 s SER 12 Ca -0.12 1.74 0.01 0.00 0.48 0.00 0.00 55.95 58.05 3n99 s SER 12 Cb -0.08 -2.55 0.01 0.00 0.10 0.00 0.00 66.02 63.51 3n99 s SER 12 CO -0.00 -0.69 -0.19 -0.69 0.98 0.00 0.00 173.24 172.65 3n99 s VAL 13 N 2.98 2.26 0.14 5.02 1.01 0.06 -4.94 120.40 126.93 3n99 s VAL 13 Ca 0.55 -0.89 0.02 0.00 0.00 0.00 0.00 61.98 61.66 3n99 s VAL 13 Cb -0.23 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 3n99 s VAL 13 CO 0.17 0.53 0.27 0.68 0.00 0.00 0.00 175.10 176.76 3n99 s VAL 14 N 1.06 5.30 0.00 2.92 -7.23 -1.26 -0.25 120.40 120.96 3n99 s VAL 14 Ca -0.01 -0.68 -0.00 0.00 -1.81 0.00 0.00 61.98 59.48 3n99 s VAL 14 Cb -0.14 -3.72 0.00 0.00 0.56 0.00 0.00 36.38 33.08 3n99 s VAL 14 CO -0.06 -0.08 0.01 0.61 -0.31 0.00 0.00 175.10 175.27 3n99 n GLY 15 N -0.48 2.06 3.07 2.32 0.00 -0.62 -4.70 105.19 106.84 3n99 n GLY 15 Ca -0.07 -1.04 -0.08 0.00 0.00 0.00 0.00 46.02 44.83 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 -2.00 0.54 0.04 1.61 -1.05 -0.05 -0.89 118.70 116.90 3n99 s GLU 16 Ca 0.00 -0.98 -0.30 0.00 -0.15 0.00 0.00 54.97 53.54 3n99 s GLU 16 Cb -0.00 0.19 -0.07 0.00 -0.44 0.00 0.00 34.13 33.81 3n99 s GLU 16 CO 0.00 -0.11 1.55 0.42 0.95 0.00 0.00 175.26 178.07 3n99 s ILE 17 N -3.08 3.33 0.47 1.83 1.01 -0.37 -1.15 121.20 123.23 3n99 s ILE 17 Ca -0.01 0.74 -0.19 0.00 0.00 0.00 0.00 60.65 61.19 3n99 s ILE 17 Cb 0.02 -3.48 -0.10 0.00 0.01 0.00 0.00 42.46 38.92 3n99 s ILE 17 CO -0.07 -0.00 0.97 0.00 0.00 0.00 0.00 174.94 175.84 3n99 s ALA 18 N 2.57 3.04 0.69 9.38 0.00 0.12 -0.99 121.76 136.57 3n99 s ALA 18 Ca 0.70 0.33 -0.11 0.00 0.00 0.00 0.00 51.96 52.87 3n99 s ALA 18 Cb -0.36 -3.14 0.00 0.00 0.00 0.00 0.00 23.12 19.62 3n99 s ALA 18 CO 0.30 -0.04 1.08 -1.25 0.00 0.00 0.00 175.76 175.84 3n99 s PRO 19 N -3.54 3.02 0.33 0.00 0.04 -1.26 -1.93 135.00 131.66 3n99 s PRO 19 Ca 0.61 0.56 -0.29 0.00 0.04 0.00 0.00 61.00 61.92 3n99 s PRO 19 Cb -0.10 -2.03 -0.11 0.00 0.04 0.00 0.00 34.50 32.30 3n99 s PRO 19 CO 0.21 -0.94 1.53 0.00 0.04 0.00 0.00 177.00 177.83 3n99 s ALA 20 N -3.29 3.65 0.02 8.56 0.00 -1.26 -2.40 121.76 127.04 3n99 s ALA 20 Ca 0.57 1.55 0.07 0.00 0.00 0.00 0.00 51.96 54.15 3n99 s ALA 20 Cb -0.11 -3.62 -0.02 0.00 0.00 0.00 0.00 23.12 19.37 3n99 s ALA 20 CO 0.53 -0.99 -0.21 0.15 0.00 0.00 0.00 175.76 175.23 3n99 s LYS 21 N -1.26 1.53 -0.22 0.00 1.02 -0.63 -4.87 119.74 115.33 3n99 s LYS 21 Ca 0.58 -0.87 -0.11 0.00 0.02 0.00 0.00 55.97 55.59 3n99 s LYS 21 Cb -0.47 -1.58 0.08 0.00 -0.52 0.00 0.00 37.83 35.34 3n99 s LYS 21 CO 0.55 0.42 0.51 -1.64 -0.92 0.00 0.00 175.35 174.26 3n99 s MET 22 N -0.91 0.48 0.13 1.68 -1.94 -1.26 -3.68 119.30 113.80 3n99 s MET 22 Ca 0.08 1.00 0.24 0.00 -1.71 0.00 0.00 55.69 55.30 3n99 s MET 22 Cb -0.09 0.15 0.25 0.00 2.01 0.00 0.00 34.83 37.15 3n99 s MET 22 CO 0.01 -0.17 1.24 0.00 -0.01 0.00 0.00 175.02 176.08 3n99 h ARG 23 N 7.33 0.00 -2.77 2.03 3.08 -2.00 -3.46 114.38 118.59 3n99 h ARG 23 Ca -0.30 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.65 3n99 h ARG 23 Cb 1.18 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 31.03 3n99 h ARG 23 CO 0.21 0.00 -0.16 0.45 -1.07 0.00 0.00 179.97 179.41 3n99 s SER 24 N -4.38 -0.31 0.51 7.04 0.15 -1.26 -5.03 113.70 110.42 3n99 s SER 24 Ca 0.05 0.24 0.21 0.00 0.70 0.00 0.00 55.95 57.15 3n99 s SER 24 Cb 0.13 0.37 1.35 0.00 -1.71 0.00 0.00 66.02 66.16 3n99 s SER 24 CO 0.74 -0.49 2.10 1.55 1.20 0.00 0.00 173.24 178.35 3n99 h PRO 25 N 3.64 0.00 -5.78 5.44 0.13 -1.96 -3.43 132.00 130.04 3n99 h PRO 25 Ca -0.29 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.19 3n99 h PRO 25 Cb 1.17 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.23 3n99 h PRO 25 CO 0.40 0.09 -0.38 0.71 -0.23 0.00 0.00 178.00 178.59 3n99 s TYR 26 N -4.62 3.65 -0.16 1.56 2.02 -1.26 -4.25 117.35 114.28 3n99 s TYR 26 Ca -0.04 0.70 -0.06 0.00 -0.37 0.00 0.00 57.07 57.29 3n99 s TYR 26 Cb 0.15 -2.06 -0.04 0.00 -0.40 0.00 0.00 41.96 39.61 3n99 s TYR 26 CO 0.63 0.71 0.05 -1.12 -1.57 0.00 0.00 175.55 174.25 3n99 s SER 27 N -1.06 5.59 -0.16 2.29 0.01 -0.30 -4.93 113.70 115.13 3n99 s SER 27 Ca 0.18 0.11 -0.19 0.00 1.31 0.00 0.00 55.95 57.36 3n99 s SER 27 Cb -0.14 -1.90 -0.04 0.00 0.21 0.00 0.00 66.02 64.16 3n99 s SER 27 CO 0.07 0.22 0.52 -0.69 0.41 0.00 0.00 173.24 173.77 3n99 s VAL 28 N 0.09 5.13 0.74 3.43 1.01 -1.26 -1.76 120.40 127.78 3n99 s VAL 28 Ca 0.05 0.99 -0.09 0.00 0.00 0.00 0.00 61.98 62.93 3n99 s VAL 28 Cb -0.12 -3.85 0.06 0.00 0.00 0.00 0.00 36.38 32.47 3n99 s VAL 28 CO 0.01 0.24 1.08 0.42 0.00 0.00 0.00 175.10 176.85 3n99 s THR 29 N 1.18 2.47 0.15 3.92 -4.23 0.61 -3.45 115.64 116.29 3n99 s THR 29 Ca 0.26 -0.02 0.35 0.00 -1.18 0.00 0.00 61.69 61.09 3n99 s THR 29 Cb -0.15 -3.11 0.39 0.00 1.34 0.00 0.00 72.50 70.97 3n99 s THR 29 CO 0.10 -0.14 2.03 0.71 -0.54 0.00 0.00 174.62 176.78 3n99 h THR 30 N -0.76 0.00 -0.01 3.99 1.35 -1.62 -2.22 112.91 113.65 3n99 h THR 30 Ca -0.45 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 64.99 3n99 h THR 30 Cb 1.31 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 69.12 3n99 h THR 30 CO 0.63 0.00 -0.00 -0.62 -0.25 0.00 0.00 175.52 175.28 3n99 n GLU 31 N -3.03 1.26 -2.03 4.72 4.71 -1.26 -4.91 120.64 120.10 3n99 n GLU 31 Ca 0.00 -0.38 -0.01 0.00 -0.01 0.00 0.00 57.16 56.76 3n99 n GLU 31 Cb 0.26 -1.49 -0.00 0.00 -1.01 0.00 0.00 31.44 29.20 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 0.36 3.61 0.62 0.00 -0.83 -5.06 105.19 104.95 3n99 n GLY 32 Ca 0.22 -0.86 -0.24 0.00 0.00 0.00 0.00 46.02 45.14 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 -2.06 2.80 0.01 2.61 -4.23 -1.26 -4.89 115.64 108.62 3n99 s THR 33 Ca 0.00 -2.02 0.03 0.00 -1.18 0.00 0.00 61.69 58.52 3n99 s THR 33 Cb -0.00 -2.73 -0.03 0.00 1.34 0.00 0.00 72.50 71.07 3n99 s THR 33 CO 0.00 -0.27 -0.07 0.68 -0.54 0.00 0.00 174.62 174.42 3n99 s VAL 34 N -2.47 3.64 0.02 2.29 -7.23 -1.26 -0.28 120.40 115.11 3n99 s VAL 34 Ca 0.33 -0.80 0.03 0.00 -1.81 0.00 0.00 61.98 59.73 3n99 s VAL 34 Cb -0.02 -2.59 -0.02 0.00 0.56 0.00 0.00 36.38 34.31 3n99 s VAL 34 CO 0.19 0.37 -0.10 -0.13 -0.31 0.00 0.00 175.10 175.13 3n99 s ARG 35 N -1.47 0.69 -0.56 4.82 0.52 -0.72 -4.96 118.95 117.26 3n99 s ARG 35 Ca 0.17 -0.56 -0.14 0.00 -0.52 0.00 0.00 55.73 54.68 3n99 s ARG 35 Cb -0.11 -0.62 0.14 0.00 0.52 0.00 0.00 34.95 34.88 3n99 s ARG 35 CO 0.08 0.15 0.50 0.08 0.02 0.00 0.00 175.30 176.13 3n99 s VAL 36 N -0.72 5.02 0.06 3.52 1.01 -1.26 -1.15 120.40 126.88 3n99 s VAL 36 Ca -0.01 -1.72 0.01 0.00 0.00 0.00 0.00 61.98 60.27 3n99 s VAL 36 Cb -0.06 -4.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.07 3n99 s VAL 36 CO 0.00 -0.87 -0.06 0.27 0.00 0.00 0.00 175.10 174.44 3n99 s ILE 37 N 1.33 0.49 0.66 2.22 -4.36 -1.26 -5.06 121.20 115.22 3n99 s ILE 37 Ca 0.06 -1.50 -0.17 0.00 -0.26 0.00 0.00 60.65 58.77 3n99 s ILE 37 Cb -0.26 -1.12 -0.00 0.00 1.25 0.00 0.00 42.46 42.32 3n99 s ILE 37 CO 0.01 -0.69 1.24 -2.84 0.24 0.00 0.00 174.94 172.90 3n99 s PRO 38 N -2.80 2.53 0.00 0.37 0.02 -1.26 -4.80 135.00 129.06 3n99 s PRO 38 Ca 0.00 1.89 0.00 0.00 0.02 0.00 0.00 61.00 62.92 3n99 s PRO 38 Cb -0.01 -1.87 0.00 0.00 0.02 0.00 0.00 34.50 32.64 3n99 s PRO 38 CO -0.03 -1.57 0.00 0.28 -0.33 0.00 0.00 177.00 175.35 3n99 n VAL 39 N -2.09 0.00 -3.30 3.83 0.31 -1.26 -1.30 118.33 114.53 3n99 n VAL 39 Ca 0.14 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 64.25 3n99 n VAL 39 Cb 0.49 0.00 0.05 0.00 -0.91 0.00 0.00 33.84 33.47 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 2.91 0.00 7.52 0.05 -1.24 -4.30 118.68 123.62 3n99 s LEU 40 Ca 0.00 -1.02 0.00 0.00 0.05 0.00 0.00 54.13 53.16 3n99 s LEU 40 Cb 0.00 -1.39 0.00 0.00 -2.05 0.00 0.00 46.19 42.75 3n99 s LEU 40 CO 0.00 -1.34 0.00 0.61 -0.55 0.00 0.00 176.35 175.07 3n99 n GLY 41 N -2.15 -2.37 4.12 -3.48 0.00 -1.26 -1.60 105.19 98.46 3n99 n GLY 41 Ca 0.11 -1.57 0.02 0.00 0.00 0.00 0.00 46.02 44.58 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 -0.58 -1.95 3.54 -0.02 0.00 -0.81 -4.57 105.19 100.80 3n99 n GLY 42 Ca 0.00 -1.36 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 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 -0.59 5.07 -0.35 -0.61 1.01 -1.26 -1.01 121.20 123.47 3n99 s ILE 43 Ca 0.00 0.10 -0.14 0.00 0.00 0.00 0.00 60.65 60.61 3n99 s ILE 43 Cb 0.00 -3.94 -0.01 0.00 0.01 0.00 0.00 42.46 38.51 3n99 s ILE 43 CO 0.00 -0.23 0.31 -0.89 0.00 0.00 0.00 174.94 174.12 3n99 s THR 44 N 2.24 5.22 0.10 2.92 2.01 -0.68 -4.98 115.64 122.48 3n99 s THR 44 Ca 0.15 -0.12 0.08 0.00 0.31 0.00 0.00 61.69 62.12 3n99 s THR 44 Cb -0.16 -3.78 -0.16 0.00 0.01 0.00 0.00 72.50 68.41 3n99 s THR 44 CO 0.13 -0.07 1.33 1.88 -0.69 0.00 0.00 174.62 177.20 3n99 h TYR 45 N 8.49 0.00 0.00 4.92 0.05 -1.96 -3.33 116.97 125.14 3n99 h TYR 45 Ca -0.30 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.48 3n99 h TYR 45 Cb 1.15 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.89 3n99 h TYR 45 CO 0.67 0.90 -0.06 0.27 -1.05 0.00 0.00 178.16 178.90 3n99 n ASN 46 N -3.37 1.82 -4.00 3.88 6.94 -1.26 -4.94 115.26 114.33 3n99 n ASN 46 Ca 0.00 -2.49 -0.27 0.00 -0.02 0.00 0.00 54.58 51.80 3n99 n ASN 46 Cb 0.89 -0.24 -0.17 0.00 -2.36 0.00 0.00 39.78 37.90 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 1.29 0.07 3.53 1.01 -1.26 -5.12 120.40 118.14 3n99 s VAL 47 Ca 0.16 -0.50 -0.01 0.00 0.00 0.00 0.00 61.98 61.63 3n99 s VAL 47 Cb 0.14 -1.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.27 3n99 s VAL 47 CO 0.02 0.40 0.00 -1.59 0.00 0.00 0.00 175.10 173.93 3n99 s LYS 48 N 1.18 0.69 0.22 2.72 -2.85 -1.26 -1.99 119.74 118.45 3n99 s LYS 48 Ca -0.04 -1.25 -0.32 0.00 -1.00 0.00 0.00 55.97 53.36 3n99 s LYS 48 Cb -0.14 0.23 -0.13 0.00 -2.06 0.00 0.00 37.83 35.72 3n99 s LYS 48 CO -0.03 -0.15 1.58 1.55 0.10 0.00 0.00 175.35 178.39 3n99 n VAL 49 N 0.06 0.43 0.00 1.79 3.14 -1.26 -1.39 118.33 121.09 3n99 n VAL 49 Ca -0.12 -0.11 0.00 0.00 -2.96 0.00 0.00 64.34 61.15 3n99 n VAL 49 Cb 0.62 -1.71 0.00 0.00 -1.06 0.00 0.00 33.84 31.69 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 2.99 2.41 3.78 7.55 0.00 -0.50 -4.90 105.19 116.53 3n99 n GLY 50 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 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 4.71 0.42 1.61 1.01 -0.49 -4.72 116.67 118.97 3n99 s ASP 51 Ca 0.00 1.70 -0.26 0.00 0.71 0.00 0.00 52.55 54.70 3n99 s ASP 51 Cb 0.00 -2.46 -0.09 0.00 1.01 0.00 0.00 42.92 41.38 3n99 s ASP 51 CO 0.00 -1.89 1.41 -0.55 0.21 0.00 0.00 175.17 174.35 3n99 s SER 52 N -3.55 6.11 0.38 0.27 0.15 -1.26 -0.49 113.70 115.31 3n99 s SER 52 Ca 0.60 2.88 0.27 0.00 0.70 0.00 0.00 55.95 60.41 3n99 s SER 52 Cb -0.16 -2.65 0.94 0.00 -1.71 0.00 0.00 66.02 62.44 3n99 s SER 52 CO 0.56 -1.01 1.79 0.00 1.20 0.00 0.00 173.24 175.78 3n99 h ALA 53 N 2.60 1.00 -1.89 5.45 0.00 -1.05 -3.42 119.26 121.95 3n99 h ALA 53 Ca -0.50 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 53.88 3n99 h ALA 53 Cb 1.25 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.98 3n99 h ALA 53 CO 0.62 0.00 -0.51 0.71 0.00 0.00 0.00 179.25 180.07 3n99 s TYR 54 N -3.36 2.79 0.00 0.00 1.51 -1.26 -0.18 117.35 116.84 3n99 s TYR 54 Ca 0.05 -0.34 0.00 0.00 -1.01 0.00 0.00 57.07 55.77 3n99 s TYR 54 Cb 0.09 -1.67 0.00 0.00 -0.11 0.00 0.00 41.96 40.27 3n99 s TYR 54 CO 0.54 0.30 0.00 0.41 -1.11 0.00 0.00 175.55 175.69 3n99 n GLY 55 N -1.21 0.71 3.85 0.71 0.00 -1.26 -5.01 105.19 102.98 3n99 n GLY 55 Ca -0.03 0.00 -0.37 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 -2.81 3.68 -1.26 1.61 0.52 -1.26 -5.00 118.94 114.41 3n99 s TRP 56 Ca 0.00 0.91 -0.19 0.00 0.02 0.00 0.00 56.10 56.84 3n99 s TRP 56 Cb 0.00 -2.23 0.02 0.00 -1.15 0.00 0.00 33.47 30.11 3n99 s TRP 56 CO 0.00 0.61 1.85 0.00 0.02 0.00 0.00 176.95 179.43 3n99 n ALA 57 N 1.56 3.30 -3.71 0.98 0.00 -1.26 -4.80 120.51 116.58 3n99 n ALA 57 Ca -0.13 -3.62 0.01 0.00 0.00 0.00 0.00 53.44 49.71 3n99 n ALA 57 Cb 0.52 -3.57 -0.00 0.00 0.00 0.00 0.00 19.45 16.40 3n99 n ALA 57 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3n99 s GLY 58 N 4.73 -0.32 -0.04 0.00 0.00 -1.26 -4.35 107.32 106.08 3n99 s GLY 58 Ca 0.57 0.48 0.01 0.00 0.00 0.00 0.00 44.72 45.78 3n99 s GLY 58 CO 0.08 1.23 -0.04 -0.35 0.00 0.00 0.00 173.10 174.01 3n99 s ASP 59 N -3.15 0.84 -1.39 1.64 2.15 -0.42 -4.76 116.67 111.59 3n99 s ASP 59 Ca 0.17 -0.12 -0.07 0.00 0.43 0.00 0.00 52.55 52.96 3n99 s ASP 59 Cb 0.03 -0.38 0.05 0.00 -0.30 0.00 0.00 42.92 42.31 3n99 s ASP 59 CO -0.02 -0.04 0.54 1.41 -0.17 0.00 0.00 175.17 176.89 3n99 n HIS 60 N 3.91 -1.88 -2.27 -5.34 8.25 -1.08 -4.04 115.22 112.77 3n99 n HIS 60 Ca -0.24 0.50 -0.42 0.00 -0.26 0.00 0.00 57.72 57.30 3n99 n HIS 60 Cb 0.51 -3.58 -0.03 0.00 1.12 0.00 0.00 29.99 28.02 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 -3.03 3.49 -0.27 1.59 1.01 -1.26 -4.11 120.40 117.81 3n99 s VAL 61 Ca 0.36 1.13 -0.10 0.00 0.00 0.00 0.00 61.98 63.37 3n99 s VAL 61 Cb -0.18 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 3n99 s VAL 61 CO 0.45 0.12 0.16 -1.61 0.00 0.00 0.00 175.10 174.21 3n99 s GLU 62 N 0.60 3.82 0.53 2.72 2.02 -1.26 -1.30 118.70 125.84 3n99 s GLU 62 Ca 0.60 -0.39 -0.22 0.00 0.02 0.00 0.00 54.97 54.98 3n99 s GLU 62 Cb -0.34 -3.56 -0.05 0.00 0.10 0.00 0.00 34.13 30.27 3n99 s GLU 62 CO 0.33 -0.20 1.28 -1.25 0.02 0.00 0.00 175.26 175.43 3n99 s PRO 63 N 1.71 3.28 5.80 0.39 0.04 -1.26 -4.59 135.00 140.36 3n99 s PRO 63 Ca 0.07 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.15 3n99 s PRO 63 Cb -0.16 -2.24 0.00 0.00 0.04 0.00 0.00 34.50 32.14 3n99 s PRO 63 CO 0.09 -1.02 0.00 0.41 0.04 0.00 0.00 177.00 176.52 3n99 n GLY 64 N 0.62 2.13 3.46 0.56 0.00 -0.84 -4.50 105.19 106.61 3n99 n GLY 64 Ca 0.10 -0.51 -0.36 0.00 0.00 0.00 0.00 46.02 45.25 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 4.29 -0.06 1.61 1.01 -0.04 -1.69 120.40 125.52 3n99 s VAL 65 Ca 0.00 -0.19 -0.22 0.00 0.00 0.00 0.00 61.98 61.57 3n99 s VAL 65 Cb 0.00 -2.99 -0.04 0.00 0.00 0.00 0.00 36.38 33.35 3n99 s VAL 65 CO 0.00 0.37 0.64 -0.44 0.00 0.00 0.00 175.10 175.67 3n99 s SER 66 N 1.40 6.94 -0.12 3.32 0.01 -0.18 -0.89 113.70 124.18 3n99 s SER 66 Ca 0.05 1.12 0.03 0.00 1.31 0.00 0.00 55.95 58.46 3n99 s SER 66 Cb -0.15 -2.38 0.01 0.00 0.21 0.00 0.00 66.02 63.71 3n99 s SER 66 CO 0.03 -0.05 -0.21 -0.69 0.41 0.00 0.00 173.24 172.73 3n99 s VAL 67 N 0.55 1.97 0.46 3.43 1.01 0.75 -0.70 120.40 127.86 3n99 s VAL 67 Ca 0.34 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.44 3n99 s VAL 67 Cb -0.17 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 3n99 s VAL 67 CO 0.17 0.53 0.14 0.00 0.00 0.00 0.00 175.10 175.94 3n99 s MET 68 N 0.72 2.17 0.53 2.72 0.23 -0.30 -0.47 119.30 124.91 3n99 s MET 68 Ca -0.10 -2.06 -0.17 0.00 -1.03 0.00 0.00 55.69 52.33 3n99 s MET 68 Cb -0.16 -1.83 -0.07 0.00 -1.53 0.00 0.00 34.83 31.25 3n99 s MET 68 CO 0.01 -0.25 1.01 0.00 -2.03 0.00 0.00 175.02 173.76 3n99 s ALA 69 N -2.72 2.96 0.50 3.16 0.00 -1.26 -0.87 121.76 123.53 3n99 s ALA 69 Ca 0.30 0.28 0.21 0.00 0.00 0.00 0.00 51.96 52.74 3n99 s ALA 69 Cb 0.03 -3.16 1.36 0.00 0.00 0.00 0.00 23.12 21.36 3n99 s ALA 69 CO 0.17 -0.39 2.12 0.00 0.00 0.00 0.00 175.76 177.66 3n99 h ARG 70 N 0.85 0.00 -1.92 0.00 3.08 -1.90 -3.44 114.38 111.06 3n99 h ARG 70 Ca -0.47 0.00 0.20 0.00 0.07 0.00 0.00 59.98 59.78 3n99 h ARG 70 Cb 1.20 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 31.10 3n99 h ARG 70 CO 0.60 0.07 0.64 -0.98 -1.07 0.00 0.00 179.97 179.23 3n99 s ARG 71 N -4.70 0.66 0.23 0.04 1.70 -1.26 -5.07 118.95 110.55 3n99 s ARG 71 Ca -0.04 -0.29 -0.07 0.00 -0.47 0.00 0.00 55.73 54.86 3n99 s ARG 71 Cb 0.16 0.27 0.34 0.00 -0.57 0.00 0.00 34.95 35.15 3n99 s ARG 71 CO 0.63 -0.30 1.78 -0.22 -1.08 0.00 0.00 175.30 176.12 3n99 h LYS 72 N 2.00 0.61 0.00 3.89 3.64 -2.02 -0.26 116.57 124.43 3n99 h LYS 72 Ca -0.20 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.14 3n99 h LYS 72 Cb 1.21 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.89 3n99 h LYS 72 CO 0.27 0.41 -0.02 0.93 -2.27 0.00 0.00 179.45 178.77 3n99 h GLU 73 N 0.63 0.00 -0.16 1.90 3.07 -2.00 -1.10 114.58 116.91 3n99 h GLU 73 Ca 0.36 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.22 3n99 h GLU 73 Cb 0.36 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.27 3n99 h GLU 73 CO -0.26 0.02 0.00 0.39 -1.40 0.00 0.00 179.01 177.75 3n99 n GLU 74 N -3.25 2.08 -0.04 2.33 1.02 -0.11 -4.41 120.64 118.26 3n99 n GLU 74 Ca -0.02 -1.61 -0.13 0.00 -0.02 0.00 0.00 57.16 55.38 3n99 n GLU 74 Cb 0.14 -1.46 -0.08 0.00 -0.02 0.00 0.00 31.44 30.01 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 3.49 0.21 -0.32 3.49 5.08 -1.21 -2.88 114.58 122.45 3n99 h GLU 75 Ca 0.00 -0.11 0.04 0.00 -1.00 0.00 0.00 59.36 58.28 3n99 h GLU 75 Cb 0.76 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.97 3n99 h GLU 75 CO 0.00 0.65 0.09 0.82 -1.00 0.00 0.00 179.01 179.57 3n99 h ILE 76 N -0.22 0.89 -0.44 3.13 2.04 -1.77 -0.67 117.51 120.47 3n99 h ILE 76 Ca 0.01 -0.08 -0.08 0.00 1.00 0.00 0.00 64.86 65.71 3n99 h ILE 76 Cb 0.62 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 3n99 h ILE 76 CO 0.02 0.04 -0.07 1.55 0.00 0.00 0.00 178.15 179.69 3n99 h PRO 77 N 0.22 0.76 -0.33 2.37 0.13 -1.84 -0.11 132.00 133.20 3n99 h PRO 77 Ca 0.14 -0.23 0.01 0.00 -0.87 0.00 0.00 66.00 65.05 3n99 h PRO 77 Cb 0.13 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 31.17 3n99 h PRO 77 CO -0.17 0.82 0.20 1.25 -0.23 0.00 0.00 178.00 179.88 3n99 h LEU 78 N 0.70 0.34 -0.21 1.56 5.85 -1.19 -1.86 115.31 120.50 3n99 h LEU 78 Ca 0.13 -0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.69 3n99 h LEU 78 Cb 0.53 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 3n99 h LEU 78 CO 0.03 0.25 -0.71 0.24 -0.34 0.00 0.00 178.44 177.90 3n99 h MET 79 N 0.42 0.00 0.00 1.25 2.86 -0.97 -3.17 114.93 115.31 3n99 h MET 79 Ca 0.13 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.62 3n99 h MET 79 Cb -0.02 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 3n99 h MET 79 CO -0.05 0.71 -0.78 1.15 1.06 0.00 0.00 176.91 179.00 3n99 h THR 80 N 0.00 1.25 -0.00 2.22 2.02 -0.92 -3.39 112.91 114.09 3n99 h THR 80 Ca -0.01 -2.25 -0.20 0.00 0.77 0.00 0.00 66.41 64.72 3n99 h THR 80 Cb 1.45 2.67 -0.01 0.00 -1.74 0.00 0.00 68.15 70.53 3n99 h THR 80 CO 0.09 0.43 -0.88 -0.07 0.37 0.00 0.00 175.52 175.46 3n99 h LEU 81 N -0.99 0.32 -9.54 2.58 3.38 -1.49 -3.45 115.31 106.11 3n99 h LEU 81 Ca -0.22 -0.26 -0.53 0.00 0.09 0.00 0.00 57.88 56.97 3n99 h LEU 81 Cb 1.20 -0.10 0.04 0.00 0.09 0.00 0.00 40.66 41.89 3n99 h LEU 81 CO -0.13 1.05 1.02 -0.44 0.09 0.00 0.00 178.44 180.03 3n99 s SER 82 N -6.96 6.49 0.07 -0.43 0.01 -1.20 -4.01 113.70 107.67 3n99 s SER 82 Ca -0.04 2.68 0.09 0.00 1.31 0.00 0.00 55.95 60.00 3n99 s SER 82 Cb 0.10 -2.58 -0.03 0.00 0.21 0.00 0.00 66.02 63.72 3n99 s SER 82 CO 0.84 -0.93 -0.24 0.00 0.41 0.00 0.00 173.24 173.31 3n99 s ILE 84 N -0.90 2.44 0.00 0.00 1.01 -0.36 -1.55 121.20 121.84 3n99 s ILE 84 Ca 0.10 0.20 0.00 0.00 0.00 0.00 0.00 60.65 60.95 3n99 s ILE 84 Cb -0.10 -3.13 0.00 0.00 0.01 0.00 0.00 42.46 39.24 3n99 s ILE 84 CO 0.03 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.59 3n99 n GLY 85 N 3.98 3.39 3.71 6.18 0.00 0.13 -1.20 105.19 121.37 3n99 n GLY 85 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 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 2.56 -4.76 1.61 5.03 -0.60 -4.57 115.26 114.53 3n99 n ASN 86 Ca 0.00 1.08 -0.41 0.00 0.87 0.00 0.00 54.58 56.13 3n99 n ASN 86 Cb 0.00 -1.51 -0.03 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 -2.32 4.41 -0.05 3.52 2.12 -1.26 -1.33 118.70 123.78 3n99 s GLU 87 Ca 0.63 2.12 0.02 0.00 0.36 0.00 0.00 54.97 58.10 3n99 s GLU 87 Cb -0.49 -3.11 0.01 0.00 0.26 0.00 0.00 34.13 30.80 3n99 s GLU 87 CO 0.57 -0.13 -0.11 0.08 -0.54 0.00 0.00 175.26 175.13 3n99 s VAL 88 N -0.92 0.98 -0.06 3.70 1.01 -0.03 -1.47 120.40 123.61 3n99 s VAL 88 Ca 0.50 -0.41 0.05 0.00 0.00 0.00 0.00 61.98 62.12 3n99 s VAL 88 Cb -0.38 -0.91 -0.01 0.00 0.00 0.00 0.00 36.38 35.09 3n99 s VAL 88 CO 0.48 0.32 -0.23 -0.63 0.00 0.00 0.00 175.10 175.04 3n99 s ILE 89 N 0.59 1.94 -0.06 2.22 1.01 0.51 -0.22 121.20 127.19 3n99 s ILE 89 Ca -0.12 -0.99 -0.29 0.00 0.00 0.00 0.00 60.65 59.25 3n99 s ILE 89 Cb -0.14 -1.65 -0.02 0.00 0.01 0.00 0.00 42.46 40.66 3n99 s ILE 89 CO 0.02 0.54 0.98 -0.69 0.00 0.00 0.00 174.94 175.79 3n99 s VAL 90 N -0.03 4.83 -0.85 2.92 1.01 -0.17 -1.14 120.40 126.97 3n99 s VAL 90 Ca -0.06 2.02 0.07 0.00 0.00 0.00 0.00 61.98 64.00 3n99 s VAL 90 Cb -0.14 -4.30 0.07 0.00 0.00 0.00 0.00 36.38 32.00 3n99 s VAL 90 CO 0.04 0.08 0.76 0.23 0.00 0.00 0.00 175.10 176.21 3n99 n MET 91 N 4.53 0.24 -4.00 2.72 2.81 -0.20 -0.39 117.12 122.82 3n99 n MET 91 Ca 0.07 -1.00 -0.09 0.00 -1.81 0.00 0.00 57.70 54.87 3n99 n MET 91 Cb 0.50 -1.14 -0.05 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 -0.62 -0.10 0.01 7.83 1.04 -1.24 -4.82 113.70 115.80 3n99 s SER 92 Ca 0.09 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.60 3n99 s SER 92 Cb 0.06 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.77 3n99 s SER 92 CO 0.09 -1.15 0.00 0.61 0.98 0.00 0.00 173.24 173.77 3n99 n GLY 93 N -0.38 -1.79 0.15 7.32 0.00 -1.26 -3.84 105.19 105.39 3n99 n GLY 93 Ca -0.02 -1.37 0.13 0.00 0.00 0.00 0.00 46.02 44.77 3n99 n GLY 93 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3n99 h ASP 94 N 0.00 0.00 -0.59 1.61 3.32 -1.98 -2.79 116.42 115.99 3n99 h ASP 94 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3n99 h ASP 94 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3n99 h ASP 94 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 3n99 n ALA 95 N -1.88 2.82 -1.59 3.45 0.00 -1.26 -4.99 120.51 117.06 3n99 n ALA 95 Ca 0.04 -1.55 -0.53 0.00 0.00 0.00 0.00 53.44 51.39 3n99 n ALA 95 Cb 0.37 -0.89 -0.06 0.00 0.00 0.00 0.00 19.45 18.87 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 0.99 1.02 0.00 0.00 4.81 -1.06 -0.58 118.16 123.34 3n99 n LYS 96 Ca 0.23 0.37 0.00 0.00 -0.87 0.00 0.00 58.31 58.04 3n99 n LYS 96 Cb 0.78 -2.00 0.00 0.00 0.02 0.00 0.00 35.03 33.83 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 2.57 2.03 3.77 3.14 0.00 0.47 -5.00 105.19 112.17 3n99 n GLY 97 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.62 6.83 -0.06 1.61 0.01 0.25 -4.75 113.70 115.97 3n99 s SER 98 Ca 0.00 2.44 0.02 0.00 1.31 0.00 0.00 55.95 59.72 3n99 s SER 98 Cb 0.00 -2.63 -0.03 0.00 0.21 0.00 0.00 66.02 63.57 3n99 s SER 98 CO 0.00 -0.47 -0.11 -0.13 0.41 0.00 0.00 173.24 172.94 3n99 s ARG 99 N -1.87 2.68 0.00 12.44 0.52 -1.26 -1.00 118.95 130.46 3n99 s ARG 99 Ca 0.50 -0.64 0.00 0.00 -0.52 0.00 0.00 55.73 55.08 3n99 s ARG 99 Cb -0.34 -2.48 0.00 0.00 0.52 0.00 0.00 34.95 32.64 3n99 s ARG 99 CO 0.44 0.60 0.00 0.41 0.02 0.00 0.00 175.30 176.77 3n99 n GLY 100 N 2.40 4.75 2.99 -3.53 0.00 0.69 -4.67 105.19 107.82 3n99 n GLY 100 Ca -0.18 -1.50 -0.15 0.00 0.00 0.00 0.00 46.02 44.19 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 -1.39 0.55 0.00 1.61 0.08 -0.69 -0.85 117.98 117.30 3n99 s PHE 101 Ca 0.00 -0.23 -0.30 0.00 0.12 0.00 0.00 56.93 56.52 3n99 s PHE 101 Cb 0.00 -0.34 -0.06 0.00 -0.57 0.00 0.00 43.02 42.05 3n99 s PHE 101 CO 0.00 -0.03 1.50 0.08 -0.10 0.00 0.00 175.22 176.67 3n99 s VAL 102 N -0.54 3.53 -0.40 -0.44 1.01 -0.44 -1.06 120.40 122.06 3n99 s VAL 102 Ca -0.02 0.89 0.22 0.00 0.00 0.00 0.00 61.98 63.06 3n99 s VAL 102 Cb -0.05 -3.57 -0.30 0.00 0.00 0.00 0.00 36.38 32.47 3n99 s VAL 102 CO 0.00 -0.02 0.64 0.35 0.00 0.00 0.00 175.10 176.07 3n99 n THR 103 N 4.84 0.00 0.00 3.92 -2.24 0.61 0.18 114.28 121.59 3n99 n THR 103 Ca 0.15 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 3n99 n THR 103 Cb 0.43 0.37 0.00 0.00 -2.10 0.00 0.00 70.33 69.03 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 1.35 -0.37 3.37 3.38 0.00 -1.17 -4.85 105.19 106.90 3n99 n GLY 104 Ca -0.01 -1.00 -0.14 0.00 0.00 0.00 0.00 46.02 44.86 3n99 n GLY 104 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3n99 s LYS 105 N -2.00 0.93 -0.13 1.61 -2.85 -1.26 -0.67 119.74 115.37 3n99 s LYS 105 Ca 0.00 -0.13 -0.02 0.00 -1.00 0.00 0.00 55.97 54.82 3n99 s LYS 105 Cb 0.00 0.42 0.04 0.00 -2.06 0.00 0.00 37.83 36.24 3n99 s LYS 105 CO 0.00 -0.31 0.01 -1.58 0.10 0.00 0.00 175.35 173.58 3n99 s HIS 106 N -1.89 0.88 0.70 1.78 2.46 0.44 -4.14 115.29 115.53 3n99 s HIS 106 Ca -0.09 -0.51 -0.11 0.00 0.47 0.00 0.00 55.06 54.82 3n99 s HIS 106 Cb -0.02 -0.93 0.01 0.00 -0.13 0.00 0.00 32.58 31.51 3n99 s HIS 106 CO 0.02 -0.46 1.09 0.20 -2.47 0.00 0.00 174.74 173.12 3n99 s GLY 107 N 1.90 1.63 0.00 1.59 0.00 -1.26 -1.74 107.32 109.44 3n99 s GLY 107 Ca 0.02 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.45 3n99 s GLY 107 CO -0.07 0.06 0.00 0.61 0.00 0.00 0.00 173.10 173.71 3n99 n GLY 108 N -2.90 1.04 0.30 0.20 0.00 -1.26 -4.27 105.19 98.29 3n99 n GLY 108 Ca 0.07 -0.50 0.17 0.00 0.00 0.00 0.00 46.02 45.76 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 0.32 -5.12 1.61 -1.51 -2.04 -3.47 116.25 106.04 3n99 h VAL 109 Ca 0.00 -0.17 -0.03 0.00 -1.23 0.00 0.00 66.70 65.27 3n99 h VAL 109 Cb 0.00 1.13 0.02 0.00 -2.13 0.00 0.00 31.29 30.31 3n99 h VAL 109 CO 0.00 0.03 -0.09 0.59 -1.23 0.00 0.00 177.57 176.87 3n99 n ASN 110 N -3.48 -7.05 -4.47 4.19 3.02 -0.78 -4.95 115.26 101.73 3n99 n ASN 110 Ca -0.02 -0.13 -0.33 0.00 -0.03 0.00 0.00 54.58 54.07 3n99 n ASN 110 Cb 0.13 -4.83 -0.13 0.00 -0.61 0.00 0.00 39.78 34.34 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 -3.04 2.69 -0.15 3.10 3.76 -0.71 -4.46 115.29 116.47 3n99 s HIS 111 Ca 0.05 -0.17 -0.08 0.00 -0.15 0.00 0.00 55.06 54.72 3n99 s HIS 111 Cb -0.01 -1.62 -0.04 0.00 1.11 0.00 0.00 32.58 32.02 3n99 s HIS 111 CO 0.67 0.18 0.12 0.08 -0.85 0.00 0.00 174.74 174.94 3n99 s VAL 112 N -0.74 5.29 -0.13 -0.90 1.01 0.38 -0.42 120.40 124.89 3n99 s VAL 112 Ca 0.12 0.13 -0.04 0.00 0.00 0.00 0.00 61.98 62.19 3n99 s VAL 112 Cb -0.11 -3.34 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 3n99 s VAL 112 CO 0.01 0.54 0.01 -0.76 0.00 0.00 0.00 175.10 174.90 3n99 s LEU 113 N -0.40 3.57 -0.04 3.92 1.43 0.15 -0.18 118.68 127.15 3n99 s LEU 113 Ca 0.11 0.07 0.01 0.00 -1.03 0.00 0.00 54.13 53.30 3n99 s LEU 113 Cb -0.12 -1.85 0.02 0.00 0.03 0.00 0.00 46.19 44.27 3n99 s LEU 113 CO 0.01 0.28 -0.05 -0.69 0.23 0.00 0.00 176.35 176.13 3n99 s VAL 114 N -0.29 0.56 -0.19 -1.59 1.01 -0.06 -0.28 120.40 119.55 3n99 s VAL 114 Ca 0.07 -0.18 -0.17 0.00 0.00 0.00 0.00 61.98 61.70 3n99 s VAL 114 Cb -0.12 -0.56 -0.04 0.00 0.00 0.00 0.00 36.38 35.67 3n99 s VAL 114 CO 0.02 0.21 0.45 -2.28 0.00 0.00 0.00 175.10 173.50 3n99 s HIS 115 N 0.65 3.39 0.24 5.22 2.46 -0.22 -0.86 115.29 126.16 3n99 s HIS 115 Ca -0.09 0.69 0.11 0.00 0.47 0.00 0.00 55.06 56.25 3n99 s HIS 115 Cb -0.12 -2.58 -0.05 0.00 -0.13 0.00 0.00 32.58 29.70 3n99 s HIS 115 CO 0.00 -0.03 -0.16 -0.06 -2.47 0.00 0.00 174.74 172.03 3n99 s PHE 116 N 1.37 2.41 0.59 3.88 0.08 -1.26 -1.71 117.98 123.34 3n99 s PHE 116 Ca 0.21 -0.30 -0.18 0.00 0.12 0.00 0.00 56.93 56.78 3n99 s PHE 116 Cb -0.15 -1.10 -0.07 0.00 -0.57 0.00 0.00 43.02 41.13 3n99 s PHE 116 CO 0.09 0.62 0.76 0.39 -0.10 0.00 0.00 175.22 176.97 3n99 n GLU 117 N -0.36 0.71 -0.30 0.44 1.02 -1.26 -4.90 120.64 115.99 3n99 n GLU 117 Ca -0.08 0.28 0.10 0.00 -0.02 0.00 0.00 57.16 57.44 3n99 n GLU 117 Cb 0.58 -1.94 0.27 0.00 -0.02 0.00 0.00 31.44 30.33 3n99 n GLU 117 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 3n99 h GLU 118 N 0.36 0.46 0.00 3.49 4.81 -2.00 -2.05 114.58 119.66 3n99 h GLU 118 Ca -0.47 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 58.68 3n99 h GLU 118 Cb 1.38 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.65 3n99 h GLU 118 CO 0.49 0.31 -0.25 0.93 -0.73 0.00 0.00 179.01 179.76 3n99 h GLU 119 N 0.48 0.00 -0.00 1.92 3.07 -2.04 -2.37 114.58 115.64 3n99 h GLU 119 Ca 0.52 0.00 -0.13 0.00 -0.50 0.00 0.00 59.36 59.25 3n99 h GLU 119 Cb 0.89 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.78 3n99 h GLU 119 CO -0.46 0.25 -0.61 0.28 -1.40 0.00 0.00 179.01 177.07 3n99 h VAL 120 N 0.00 1.44 -0.67 3.13 2.07 -1.72 -3.35 116.25 117.14 3n99 h VAL 120 Ca -0.00 -2.09 -0.07 0.00 0.82 0.00 0.00 66.70 65.36 3n99 h VAL 120 Cb 0.58 2.12 -0.03 0.00 -1.52 0.00 0.00 31.29 32.44 3n99 h VAL 120 CO 0.03 0.60 0.13 -0.07 0.02 0.00 0.00 177.57 178.28 3n99 h LEU 121 N 0.01 1.03 -1.80 2.57 3.38 -1.46 -1.69 115.31 117.35 3n99 h LEU 121 Ca -0.01 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3n99 h LEU 121 Cb 1.08 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.56 3n99 h LEU 121 CO 0.08 1.01 0.00 1.23 0.09 0.00 0.00 178.44 180.85 3n99 h GLY 122 N 1.06 0.00 0.69 0.83 0.00 -1.70 -2.19 103.07 101.75 3n99 h GLY 122 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.54 3n99 h GLY 122 CO 0.01 0.00 -0.70 0.28 0.00 0.00 0.00 176.54 176.13 3n99 n LYS 123 N -2.89 0.04 -2.44 4.80 5.02 -0.64 -4.99 118.16 117.05 3n99 n LYS 123 Ca -0.00 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.97 3n99 n LYS 123 Cb 0.20 -1.51 -0.04 0.00 -0.02 0.00 0.00 35.03 33.66 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 -3.12 3.65 0.02 -0.35 1.43 -0.83 -4.19 118.68 115.29 3n99 s LEU 124 Ca 0.09 1.55 0.02 0.00 -1.03 0.00 0.00 54.13 54.76 3n99 s LEU 124 Cb 0.17 -4.48 -0.01 0.00 0.03 0.00 0.00 46.19 41.89 3n99 s LEU 124 CO 0.76 -0.57 -0.06 -0.32 0.23 0.00 0.00 176.35 176.39 3n99 s MET 125 N -4.03 0.46 0.25 1.70 -2.45 -1.26 -5.06 119.30 108.92 3n99 s MET 125 Ca 0.59 -0.49 -0.31 0.00 -1.25 0.00 0.00 55.69 54.23 3n99 s MET 125 Cb -0.10 -0.33 -0.13 0.00 1.25 0.00 0.00 34.83 35.52 3n99 s MET 125 CO 0.31 0.07 1.45 0.28 1.05 0.00 0.00 175.02 178.18 3n99 n VAL 126 N 2.16 0.95 0.00 10.11 0.31 -1.26 -1.09 118.33 129.51 3n99 n VAL 126 Ca -0.18 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 63.91 3n99 n VAL 126 Cb 0.56 -1.59 0.00 0.00 -0.91 0.00 0.00 33.84 31.91 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 2.18 1.72 3.75 2.92 0.00 -0.16 -4.94 105.19 110.66 3n99 n GLY 127 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.01 5.27 0.29 1.61 1.01 -0.25 -4.52 116.67 118.07 3n99 s ASP 128 Ca 0.00 2.70 -0.28 0.00 0.71 0.00 0.00 52.55 55.68 3n99 s ASP 128 Cb 0.00 -2.63 -0.09 0.00 1.01 0.00 0.00 42.92 41.21 3n99 s ASP 128 CO 0.00 -1.57 0.95 -0.54 0.21 0.00 0.00 175.17 174.23 3n99 s LYS 129 N -2.96 4.68 -0.04 8.23 1.02 -1.26 -1.23 119.74 128.17 3n99 s LYS 129 Ca 0.72 1.42 0.03 0.00 0.02 0.00 0.00 55.97 58.16 3n99 s LYS 129 Cb -0.39 -2.99 0.01 0.00 -0.52 0.00 0.00 37.83 33.94 3n99 s LYS 129 CO 0.45 0.35 -0.11 0.42 -0.92 0.00 0.00 175.35 175.54 3n99 s ILE 130 N -1.43 0.99 -0.16 2.17 -1.09 -0.07 -1.04 121.20 120.57 3n99 s ILE 130 Ca 0.47 -0.44 -0.01 0.00 -2.23 0.00 0.00 60.65 58.44 3n99 s ILE 130 Cb -0.22 -0.89 -0.01 0.00 -1.58 0.00 0.00 42.46 39.75 3n99 s ILE 130 CO 0.28 0.31 -0.10 -0.22 -1.23 0.00 0.00 174.94 173.98 3n99 s LEU 131 N 0.41 2.76 -0.21 2.97 2.96 -0.29 -1.59 118.68 125.69 3n99 s LEU 131 Ca -0.08 -0.36 -0.05 0.00 -0.22 0.00 0.00 54.13 53.42 3n99 s LEU 131 Cb -0.12 -1.65 -0.02 0.00 0.50 0.00 0.00 46.19 44.89 3n99 s LEU 131 CO 0.02 0.10 0.00 -0.63 -1.32 0.00 0.00 176.35 174.52 3n99 s ILE 132 N 0.76 3.93 -1.00 6.68 1.01 0.66 -0.36 121.20 132.88 3n99 s ILE 132 Ca -0.04 -0.32 -0.21 0.00 0.00 0.00 0.00 60.65 60.08 3n99 s ILE 132 Cb -0.15 -2.79 0.08 0.00 0.01 0.00 0.00 42.46 39.62 3n99 s ILE 132 CO 0.01 0.42 1.34 -0.54 0.00 0.00 0.00 174.94 176.17 3n99 s LYS 133 N 1.11 3.63 0.10 2.79 1.02 -0.54 -0.76 119.74 127.08 3n99 s LYS 133 Ca 0.03 -1.44 -0.30 0.00 0.02 0.00 0.00 55.97 54.27 3n99 s LYS 133 Cb -0.14 -5.19 -0.06 0.00 -0.52 0.00 0.00 37.83 31.92 3n99 s LYS 133 CO 0.01 -2.03 1.05 0.00 -0.92 0.00 0.00 175.35 173.46 3n99 s ALA 134 N 3.98 3.29 -0.29 5.17 0.00 -0.11 -4.28 121.76 129.52 3n99 s ALA 134 Ca 0.41 0.68 -0.14 0.00 0.00 0.00 0.00 51.96 52.92 3n99 s ALA 134 Cb -0.02 -3.34 0.13 0.00 0.00 0.00 0.00 23.12 19.89 3n99 s ALA 134 CO -0.09 -0.19 0.80 -0.46 0.00 0.00 0.00 175.76 175.82 3n99 s TRP 135 N 0.32 -0.99 0.00 0.00 -0.00 -1.26 -1.71 118.94 115.31 3n99 s TRP 135 Ca 0.51 1.80 0.00 0.00 -0.00 0.00 0.00 56.10 58.40 3n99 s TRP 135 Cb -0.26 0.59 0.00 0.00 -0.00 0.00 0.00 33.47 33.80 3n99 s TRP 135 CO 0.31 -0.49 0.00 0.41 -0.00 0.00 0.00 176.95 177.18 3n99 n GLY 136 N 4.79 1.07 3.73 5.86 0.00 -1.26 -4.15 105.19 115.24 3n99 n GLY 136 Ca -0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 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 4.51 0.00 1.61 -1.52 -1.26 -2.35 119.66 120.64 3n99 s GLN 137 Ca 0.00 1.81 0.00 0.00 -1.95 0.00 0.00 55.36 55.22 3n99 s GLN 137 Cb 0.00 -3.27 0.00 0.00 -0.22 0.00 0.00 33.01 29.52 3n99 s GLN 137 CO 0.00 -0.08 0.00 0.41 -0.25 0.00 0.00 175.29 175.37 3n99 n GLY 138 N 2.38 1.60 3.75 3.09 0.00 -1.26 -4.77 105.19 109.98 3n99 n GLY 138 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 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 4.37 -3.99 0.99 7.94 -0.99 -4.95 117.00 120.36 3n99 n LEU 139 Ca 0.00 1.16 -0.17 0.00 -1.11 0.00 0.00 56.01 55.89 3n99 n LEU 139 Cb 0.00 -1.59 -0.14 0.00 0.53 0.00 0.00 43.42 42.22 3n99 n LEU 139 CO 0.00 0.11 -0.42 -0.54 -1.11 0.00 0.00 177.39 175.43 3n99 s LYS 140 N -0.85 0.57 -0.40 1.96 1.02 -1.26 -4.45 119.74 116.33 3n99 s LYS 140 Ca 0.62 -0.27 -0.24 0.00 0.02 0.00 0.00 55.97 56.10 3n99 s LYS 140 Cb -0.50 -0.54 0.02 0.00 -0.52 0.00 0.00 37.83 36.28 3n99 s LYS 140 CO 0.52 0.15 0.84 -0.51 -0.92 0.00 0.00 175.35 175.43 3n99 s LEU 141 N -0.22 4.09 0.38 3.17 1.43 -1.26 -2.77 118.68 123.50 3n99 s LEU 141 Ca 0.02 0.28 0.19 0.00 -1.03 0.00 0.00 54.13 53.60 3n99 s LEU 141 Cb -0.03 -3.10 0.67 0.00 0.03 0.00 0.00 46.19 43.76 3n99 s LEU 141 CO -0.00 -0.85 1.72 -0.07 0.23 0.00 0.00 176.35 177.38 3n99 h LEU 142 N 10.04 0.00 -2.25 1.79 3.38 -0.71 -2.56 115.31 124.99 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 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3n99 h LEU 142 CO 0.96 0.36 0.00 0.47 0.09 0.00 0.00 178.44 180.31 3n99 n ASP 143 N -3.47 3.33 -3.13 -0.43 8.00 -1.26 -4.56 116.55 115.03 3n99 n ASP 143 Ca 0.00 -1.97 -0.19 0.00 0.71 0.00 0.00 54.79 53.35 3n99 n ASP 143 Cb 0.51 -0.32 -0.03 0.00 -0.02 0.00 0.00 41.12 41.27 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 1.36 -0.37 0.11 1.24 8.25 -0.96 -5.00 115.22 119.85 3n99 n HIS 144 Ca 0.20 -3.52 0.18 0.00 -0.26 0.00 0.00 57.72 54.32 3n99 n HIS 144 Cb 0.56 -0.15 0.74 0.00 1.12 0.00 0.00 29.99 32.26 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 3.32 0.00 -0.19 -0.41 0.13 -1.80 -0.36 132.00 132.69 3n99 h PRO 145 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 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 0.45 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.97 3n99 n ASP 146 N -4.13 1.71 -4.32 1.44 8.00 -1.26 -4.65 116.55 113.34 3n99 n ASP 146 Ca 0.05 -1.75 -0.40 0.00 0.71 0.00 0.00 54.79 53.40 3n99 n ASP 146 Cb 0.44 -0.12 -0.11 0.00 -0.02 0.00 0.00 41.12 41.31 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 -1.75 4.34 0.02 2.53 1.01 -0.15 -4.55 120.40 121.85 3n99 s VAL 147 Ca 0.31 -1.13 -0.24 0.00 0.00 0.00 0.00 61.98 60.93 3n99 s VAL 147 Cb 0.17 -3.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.97 3n99 s VAL 147 CO 0.25 -0.35 0.72 -0.54 0.00 0.00 0.00 175.10 175.17 3n99 s LYS 148 N 1.48 4.44 0.15 2.72 -0.14 -0.44 -4.58 119.74 123.39 3n99 s LYS 148 Ca 0.02 0.96 0.11 0.00 -1.36 0.00 0.00 55.97 55.70 3n99 s LYS 148 Cb -0.21 -3.37 -0.04 0.00 -1.68 0.00 0.00 37.83 32.53 3n99 s LYS 148 CO 0.04 0.28 -0.24 0.14 -0.76 0.00 0.00 175.35 174.82 3n99 s VAL 149 N 0.00 2.44 0.00 3.17 -7.23 -1.26 -0.81 120.40 116.71 3n99 s VAL 149 Ca 0.37 -1.81 -0.29 0.00 -1.81 0.00 0.00 61.98 58.44 3n99 s VAL 149 Cb -0.20 -2.13 0.10 0.00 0.56 0.00 0.00 36.38 34.72 3n99 s VAL 149 CO 0.21 0.01 0.97 0.00 -0.31 0.00 0.00 175.10 175.98 3n99 s MET 150 N -2.33 0.80 -2.12 4.82 0.23 -0.68 -4.70 119.30 115.31 3n99 s MET 150 Ca 0.18 -0.34 0.00 0.00 -1.03 0.00 0.00 55.69 54.49 3n99 s MET 150 Cb -0.09 0.34 0.00 0.00 -1.53 0.00 0.00 34.83 33.54 3n99 s MET 150 CO 0.08 -0.36 0.00 0.09 -2.03 0.00 0.00 175.02 172.81 3n99 n ASN 151 N -0.28 -5.52 -3.74 -1.18 3.02 -1.26 -4.17 115.26 102.13 3n99 n ASN 151 Ca -0.07 0.44 -0.16 0.00 -0.03 0.00 0.00 54.58 54.76 3n99 n ASN 151 Cb 0.61 -4.78 -0.16 0.00 -0.61 0.00 0.00 39.78 34.83 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 -2.80 -0.07 0.04 2.41 2.07 -1.26 -1.23 121.20 120.36 3n99 s ILE 152 Ca 0.00 0.28 -0.35 0.00 -1.41 0.00 0.00 60.65 59.16 3n99 s ILE 152 Cb 0.00 -0.10 -0.14 0.00 0.13 0.00 0.00 42.46 42.34 3n99 s ILE 152 CO 0.00 0.11 1.59 -0.67 -1.91 0.00 0.00 174.94 174.06 3n99 n ASP 153 N 4.50 2.66 0.25 4.50 -0.08 -0.34 -4.60 116.55 123.43 3n99 n ASP 153 Ca -0.21 1.07 0.07 0.00 -1.51 0.00 0.00 54.79 54.21 3n99 n ASP 153 Cb 0.50 -1.31 0.59 0.00 2.34 0.00 0.00 41.12 43.24 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 6.30 0.00 -0.37 -0.67 0.11 -1.91 -0.01 132.00 135.46 3n99 h PRO 154 Ca -0.47 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.53 3n99 h PRO 154 Cb 1.29 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 3n99 h PRO 154 CO 0.88 0.07 -0.23 -0.44 -0.21 0.00 0.00 178.00 178.06 3n99 h ASP 155 N 0.00 0.85 -0.72 -2.05 3.32 -1.97 -2.88 116.42 112.97 3n99 h ASP 155 Ca -0.00 -0.42 -0.04 0.00 0.02 0.00 0.00 57.03 56.58 3n99 h ASP 155 Cb 0.12 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.40 3n99 h ASP 155 CO 0.01 1.09 0.29 0.25 -1.72 0.00 0.00 179.24 179.16 3n99 h LEU 156 N 0.62 0.99 -0.76 1.55 5.85 -1.73 -2.90 115.31 118.93 3n99 h LEU 156 Ca 0.08 -0.17 0.12 0.00 0.84 0.00 0.00 57.88 58.75 3n99 h LEU 156 Cb 0.79 -0.26 -0.09 0.00 0.37 0.00 0.00 40.66 41.48 3n99 h LEU 156 CO 0.06 0.89 0.35 0.15 -0.34 0.00 0.00 178.44 179.56 3n99 h PHE 157 N 1.03 0.62 0.00 1.25 3.57 -0.96 -1.35 116.94 121.11 3n99 h PHE 157 Ca 0.24 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.77 3n99 h PHE 157 Cb 0.21 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 38.79 3n99 h PHE 157 CO 0.02 0.16 0.00 0.39 -2.23 0.00 0.00 178.31 176.64 3n99 n GLU 158 N -4.92 0.14 0.00 1.11 1.02 -1.10 -2.50 120.64 114.40 3n99 n GLU 158 Ca 0.14 0.50 0.09 0.00 -0.02 0.00 0.00 57.16 57.87 3n99 n GLU 158 Cb 0.36 -1.85 0.06 0.00 -0.02 0.00 0.00 31.44 30.00 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 -2.12 1.52 0.00 3.49 5.02 -0.51 -4.47 118.16 121.09 3n99 n LYS 159 Ca 0.01 -1.46 0.16 0.00 -2.02 0.00 0.00 58.31 54.99 3n99 n LYS 159 Cb 0.13 -1.34 0.91 0.00 -0.02 0.00 0.00 35.03 34.71 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 0.84 0.03 -0.30 -0.35 4.77 -1.04 -4.88 117.00 116.07 3n99 n LEU 160 Ca 0.10 0.03 -0.04 0.00 -0.03 0.00 0.00 56.01 56.07 3n99 n LEU 160 Cb 0.44 -0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 41.48 3n99 n LEU 160 CO 0.13 0.01 -0.04 0.61 -1.33 0.00 0.00 177.39 176.77 3n99 n GLY 161 N 1.04 0.57 3.73 -0.72 0.00 -1.26 -4.63 105.19 103.93 3n99 n GLY 161 Ca 0.23 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.96 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 -2.14 4.28 -0.01 -0.61 1.01 -1.26 -4.57 121.20 117.89 3n99 s ILE 162 Ca 0.00 1.88 -0.01 0.00 0.00 0.00 0.00 60.65 62.52 3n99 s ILE 162 Cb 0.00 -4.20 0.01 0.00 0.01 0.00 0.00 42.46 38.28 3n99 s ILE 162 CO 0.00 0.28 0.03 -1.10 0.00 0.00 0.00 174.94 174.15 3n99 s GLN 163 N 0.02 0.02 -0.57 2.79 -0.21 -0.75 -4.97 119.66 116.00 3n99 s GLN 163 Ca 0.49 0.06 -0.22 0.00 0.02 0.00 0.00 55.36 55.71 3n99 s GLN 163 Cb -0.26 -0.02 0.06 0.00 1.00 0.00 0.00 33.01 33.80 3n99 s GLN 163 CO 0.31 -0.02 0.84 -2.00 -2.12 0.00 0.00 175.29 172.30 3n99 s GLU 164 N 0.15 3.19 -0.03 2.91 2.12 -1.26 -0.32 118.70 125.46 3n99 s GLU 164 Ca -0.01 -0.69 0.00 0.00 0.36 0.00 0.00 54.97 54.63 3n99 s GLU 164 Cb -0.02 -4.13 0.03 0.00 0.26 0.00 0.00 34.13 30.27 3n99 s GLU 164 CO -0.00 -1.51 0.01 0.15 -0.54 0.00 0.00 175.26 173.37 3n99 s LYS 165 N 3.50 0.21 -1.42 4.30 1.02 -0.32 -4.92 119.74 122.11 3n99 s LYS 165 Ca 0.22 0.11 -0.10 0.00 0.02 0.00 0.00 55.97 56.22 3n99 s LYS 165 Cb -0.17 -0.43 0.04 0.00 -0.52 0.00 0.00 37.83 36.76 3n99 s LYS 165 CO 0.13 -0.15 1.06 -1.71 -0.92 0.00 0.00 175.35 173.77 3n99 n ASN 166 N 4.17 -5.14 -2.05 2.83 5.15 -1.26 -1.65 115.26 117.31 3n99 n ASN 166 Ca -0.27 -0.66 -0.18 0.00 -0.60 0.00 0.00 54.58 52.87 3n99 n ASN 166 Cb 0.50 -4.49 -0.01 0.00 -0.53 0.00 0.00 39.78 35.25 3n99 n ASN 166 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3n99 n GLY 167 N -1.80 -0.32 3.26 8.20 0.00 -1.26 -5.02 105.19 108.25 3n99 n GLY 167 Ca -0.01 -0.13 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 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 -4.87 0.98 -0.38 1.61 1.02 -0.66 -4.81 119.74 112.63 3n99 s LYS 168 Ca 0.00 -1.01 -0.17 0.00 0.02 0.00 0.00 55.97 54.80 3n99 s LYS 168 Cb 0.00 0.37 0.01 0.00 -0.52 0.00 0.00 37.83 37.68 3n99 s LYS 168 CO 0.00 -0.34 0.47 0.42 -0.92 0.00 0.00 175.35 174.98 3n99 s ILE 169 N -3.89 5.05 -0.04 2.17 1.01 0.37 -1.17 121.20 124.69 3n99 s ILE 169 Ca 0.09 0.01 -0.19 0.00 0.00 0.00 0.00 60.65 60.56 3n99 s ILE 169 Cb 0.04 -3.99 -0.05 0.00 0.01 0.00 0.00 42.46 38.47 3n99 s ILE 169 CO -0.07 -0.31 0.54 -1.00 0.00 0.00 0.00 174.94 174.10 3n99 s HIS 170 N 2.27 3.63 -0.11 3.97 3.76 0.56 -0.41 115.29 128.95 3n99 s HIS 170 Ca 0.15 1.07 -0.02 0.00 -0.15 0.00 0.00 55.06 56.12 3n99 s HIS 170 Cb -0.16 -2.56 0.04 0.00 1.11 0.00 0.00 32.58 31.01 3n99 s HIS 170 CO 0.14 0.31 0.00 0.08 -0.85 0.00 0.00 174.74 174.42 3n99 s VAL 171 N 0.03 0.51 0.11 -0.90 1.01 -0.31 -1.81 120.40 119.03 3n99 s VAL 171 Ca 0.29 -0.14 -0.30 0.00 0.00 0.00 0.00 61.98 61.82 3n99 s VAL 171 Cb -0.17 -0.76 -0.07 0.00 0.00 0.00 0.00 36.38 35.39 3n99 s VAL 171 CO 0.14 0.13 1.21 -2.84 0.00 0.00 0.00 175.10 173.74 3n99 s PRO 172 N 1.90 4.45 0.04 2.72 0.02 -1.26 0.11 135.00 142.98 3n99 s PRO 172 Ca 0.03 1.83 0.00 0.00 0.02 0.00 0.00 61.00 62.88 3n99 s PRO 172 Cb -0.14 -3.30 -0.03 0.00 0.02 0.00 0.00 34.50 31.05 3n99 s PRO 172 CO -0.06 -0.21 -0.04 0.14 -0.33 0.00 0.00 177.00 176.50 3n99 s VAL 173 N 0.69 0.25 -0.51 3.83 -7.23 -0.56 -4.85 120.40 112.01 3n99 s VAL 173 Ca 0.57 -1.35 0.24 0.00 -1.81 0.00 0.00 61.98 59.63 3n99 s VAL 173 Cb -0.31 -0.88 0.20 0.00 0.56 0.00 0.00 36.38 35.95 3n99 s VAL 173 CO 0.32 -0.70 1.48 -0.37 -0.31 0.00 0.00 175.10 175.52 3n99 h VAL 174 N 3.94 0.00 -2.49 1.32 -1.51 -0.86 -0.38 116.25 116.27 3n99 h VAL 174 Ca -0.33 -0.77 -0.00 0.00 -1.23 0.00 0.00 66.70 64.36 3n99 h VAL 174 Cb 1.18 1.59 -0.15 0.00 -2.13 0.00 0.00 31.29 31.78 3n99 h VAL 174 CO 0.52 0.00 0.28 0.00 -1.23 0.00 0.00 177.57 177.14 3n99 s ALA 175 N -3.21 -1.71 -0.28 5.19 0.00 -1.26 -4.68 121.76 115.82 3n99 s ALA 175 Ca 0.06 0.89 -0.00 0.00 0.00 0.00 0.00 51.96 52.91 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 0.69 -0.61 -0.05 0.15 0.00 0.00 0.00 175.76 175.94 3n99 s LYS 176 N -2.74 2.46 -0.25 0.00 1.02 -1.26 -0.88 119.74 118.09 3n99 s LYS 176 Ca -0.02 -1.23 -0.16 0.00 0.02 0.00 0.00 55.97 54.59 3n99 s LYS 176 Cb -0.01 -3.05 -0.04 0.00 -0.52 0.00 0.00 37.83 34.22 3n99 s LYS 176 CO -0.05 -0.56 0.40 0.42 -0.92 0.00 0.00 175.35 174.64 3n99 s ILE 177 N 1.22 5.17 0.61 2.17 1.01 0.12 -4.89 121.20 126.61 3n99 s ILE 177 Ca -0.05 0.65 -0.19 0.00 0.00 0.00 0.00 60.65 61.06 3n99 s ILE 177 Cb -0.19 -3.72 -0.03 0.00 0.01 0.00 0.00 42.46 38.53 3n99 s ILE 177 CO -0.03 0.18 1.23 -2.84 0.00 0.00 0.00 174.94 173.48 3n99 s PRO 178 N 1.87 2.85 0.29 2.79 0.02 -1.26 -0.86 135.00 140.70 3n99 s PRO 178 Ca 0.17 1.89 0.00 0.00 0.02 0.00 0.00 61.00 63.08 3n99 s PRO 178 Cb -0.15 -1.91 0.68 0.00 0.02 0.00 0.00 34.50 33.14 3n99 s PRO 178 CO 0.09 -1.32 1.61 0.00 -0.33 0.00 0.00 177.00 177.06 3n99 h ALA 179 N 0.79 1.14 0.00 -1.55 0.00 -1.84 -1.28 119.26 116.51 3n99 h ALA 179 Ca -0.51 0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3n99 h ALA 179 Cb 1.31 0.45 0.00 0.00 0.00 0.00 0.00 17.79 19.55 3n99 h ALA 179 CO 0.55 -0.51 0.00 -2.39 0.00 0.00 0.00 179.25 176.90 3n99 n HIS 180 N -5.36 0.00 0.85 0.00 1.44 -1.26 -1.34 115.22 109.55 3n99 n HIS 180 Ca 0.21 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 56.04 3n99 n HIS 180 Cb 0.68 -0.35 0.25 0.00 0.12 0.00 0.00 29.99 30.69 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 -1.35 2.19 -3.39 -1.40 2.00 -0.48 -4.88 117.12 109.81 3n99 n MET 181 Ca 0.06 -1.78 -0.38 0.00 0.00 0.00 0.00 57.70 55.61 3n99 n MET 181 Cb 0.15 -1.47 -0.06 0.00 0.00 0.00 0.00 33.22 31.84 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 -1.76 4.10 0.00 0.03 -1.94 -0.45 0.50 119.30 119.78 3n99 s MET 182 Ca 0.34 0.52 0.00 0.00 -1.71 0.00 0.00 55.69 54.84 3n99 s MET 182 Cb 0.21 -3.28 0.00 0.00 2.01 0.00 0.00 34.83 33.77 3n99 s MET 182 CO 0.30 0.55 0.00 0.41 -0.01 0.00 0.00 175.02 176.27 3n99 n GLY 183 N 2.13 3.19 3.58 -0.03 0.00 0.54 -4.83 105.19 109.76 3n99 n GLY 183 Ca -0.11 -0.31 -0.54 0.00 0.00 0.00 0.00 46.02 45.06 3n99 n GLY 183 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3n99 n SER 184 N 0.00 1.33 0.00 1.61 2.88 0.05 -2.20 113.62 117.29 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 -1.13 0.00 0.00 -0.75 0.00 0.00 64.21 62.33 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 2.41 2.64 3.64 0.46 0.00 -1.26 -0.94 105.19 112.13 3n99 n GLY 185 Ca 0.19 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.79 0.37 -0.13 -0.61 5.41 -0.94 -1.60 119.36 121.08 3n99 n ILE 186 Ca 0.00 -0.09 0.00 0.00 1.00 0.00 0.00 62.75 63.66 3n99 n ILE 186 Cb 0.00 -1.26 0.00 0.00 -0.71 0.00 0.00 39.64 37.67 3n99 n ILE 186 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3n99 n GLY 187 N 2.69 0.56 3.75 7.39 0.00 0.48 -5.00 105.19 115.06 3n99 n GLY 187 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 3n99 n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n99 s ALA 188 N -2.29 2.82 0.19 4.61 0.00 -0.62 -4.73 121.76 121.74 3n99 s ALA 188 Ca 0.00 1.34 -0.12 0.00 0.00 0.00 0.00 51.96 53.18 3n99 s ALA 188 Cb 0.00 -3.57 0.15 0.00 0.00 0.00 0.00 23.12 19.70 3n99 s ALA 188 CO 0.00 -1.38 1.81 1.03 0.00 0.00 0.00 175.76 177.21 3n99 h SER 189 N 1.46 0.49 -3.46 0.00 0.87 -1.92 -1.95 113.55 109.02 3n99 h SER 189 Ca -0.51 0.02 -0.41 0.00 -1.23 0.00 0.00 61.79 59.66 3n99 h SER 189 Cb 1.30 -0.08 -0.34 0.00 -0.44 0.00 0.00 62.40 62.84 3n99 h SER 189 CO 0.57 0.33 -0.77 -0.55 -0.53 0.00 0.00 176.83 175.88 3n99 s SER 190 N -5.57 0.96 0.42 6.23 0.15 -1.26 -3.40 113.70 111.23 3n99 s SER 190 Ca -0.13 -0.13 0.28 0.00 0.70 0.00 0.00 55.95 56.67 3n99 s SER 190 Cb 0.14 -0.46 1.53 0.00 -1.71 0.00 0.00 66.02 65.53 3n99 s SER 190 CO 0.74 -0.05 1.87 0.77 1.20 0.00 0.00 173.24 177.77 3n99 h SER 191 N 7.16 0.00 1.03 5.45 4.64 -1.23 -2.12 113.55 128.48 3n99 h SER 191 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3n99 h SER 191 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3n99 h SER 191 CO 0.47 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.43 3n99 n ALA 192 N -1.87 1.92 -1.15 5.18 0.00 -1.26 -4.12 120.51 119.21 3n99 n ALA 192 Ca -0.02 0.04 0.04 0.00 0.00 0.00 0.00 53.44 53.50 3n99 n ALA 192 Cb 0.05 -1.42 0.06 0.00 0.00 0.00 0.00 19.45 18.13 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 -2.24 1.28 -3.65 0.00 3.41 -0.80 -4.18 113.62 107.45 3n99 n SER 193 Ca 0.04 -2.30 -0.07 0.00 -0.26 0.00 0.00 58.87 56.27 3n99 n SER 193 Cb 0.31 -0.23 -0.02 0.00 -0.26 0.00 0.00 64.21 64.01 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 -1.32 0.00 0.44 6.66 -1.32 -1.25 -4.61 115.64 114.25 3n99 s THR 194 Ca 0.13 -0.45 0.08 0.00 -1.21 0.00 0.00 61.69 60.24 3n99 s THR 194 Cb 0.11 -1.56 0.02 0.00 -1.51 0.00 0.00 72.50 69.56 3n99 s THR 194 CO 0.01 0.00 0.57 1.51 -2.21 0.00 0.00 174.62 174.50 3n99 s ASP 195 N -2.79 5.52 0.12 8.08 -4.77 -1.26 -4.62 116.67 116.96 3n99 s ASP 195 Ca 0.08 -0.51 -0.05 0.00 -3.30 0.00 0.00 52.55 48.77 3n99 s ASP 195 Cb -0.02 -0.54 -0.02 0.00 -1.09 0.00 0.00 42.92 41.25 3n99 s ASP 195 CO -0.02 -0.81 0.15 -0.72 0.70 0.00 0.00 175.17 174.46 3n99 s TYR 196 N -2.40 0.50 -0.11 2.11 1.13 -0.02 -4.68 117.35 113.88 3n99 s TYR 196 Ca 0.55 -0.91 -0.12 0.00 -1.41 0.00 0.00 57.07 55.17 3n99 s TYR 196 Cb -0.09 -0.23 -0.05 0.00 -1.10 0.00 0.00 41.96 40.49 3n99 s TYR 196 CO 0.33 -0.58 0.29 -0.51 -2.51 0.00 0.00 175.55 172.57 3n99 s ASP 197 N -2.96 6.52 -0.41 -0.18 1.11 -0.11 0.42 116.67 121.05 3n99 s ASP 197 Ca 0.15 0.62 -0.29 0.00 0.18 0.00 0.00 52.55 53.21 3n99 s ASP 197 Cb 0.06 -2.17 0.02 0.00 1.07 0.00 0.00 42.92 41.89 3n99 s ASP 197 CO -0.03 0.23 1.13 -0.63 1.18 0.00 0.00 175.17 177.05 3n99 s ILE 198 N -0.28 4.30 -0.50 0.77 1.01 0.15 -0.34 121.20 126.32 3n99 s ILE 198 Ca 0.18 1.40 -0.02 0.00 0.00 0.00 0.00 60.65 62.20 3n99 s ILE 198 Cb -0.14 -4.51 0.20 0.00 0.01 0.00 0.00 42.46 38.03 3n99 s ILE 198 CO 0.06 -0.79 2.35 1.15 0.00 0.00 0.00 174.94 177.71 3n99 n MET 199 N 7.49 2.31 -3.37 2.79 0.00 0.18 -2.84 117.12 123.68 3n99 n MET 199 Ca 0.12 -2.40 -0.38 0.00 0.00 0.00 0.00 57.70 55.05 3n99 n MET 199 Cb 0.48 -2.02 -0.06 0.00 0.00 0.00 0.00 33.22 31.61 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 -2.35 3.52 0.08 3.17 0.00 -1.26 -4.83 121.76 120.08 3n99 s ALA 200 Ca 0.51 -0.31 0.22 0.00 0.00 0.00 0.00 51.96 52.38 3n99 s ALA 200 Cb 0.37 -2.60 0.77 0.00 0.00 0.00 0.00 23.12 21.66 3n99 s ALA 200 CO -0.16 -0.05 1.76 0.77 0.00 0.00 0.00 175.76 178.09 3n99 h SER 201 N 6.84 0.00 -3.98 0.00 0.02 -1.90 -3.45 113.55 111.08 3n99 h SER 201 Ca -0.40 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.37 3n99 h SER 201 Cb 1.17 0.00 -0.25 0.00 0.14 0.00 0.00 62.40 63.46 3n99 h SER 201 CO 0.75 0.27 -0.52 0.20 -1.14 0.00 0.00 176.83 176.39 3n99 s ASN 202 N -6.25 -0.14 0.44 3.07 0.01 -1.26 -5.02 114.94 105.79 3n99 s ASN 202 Ca 0.01 0.24 0.15 0.00 -0.71 0.00 0.00 52.86 52.56 3n99 s ASN 202 Cb 0.10 0.31 1.07 0.00 0.41 0.00 0.00 41.25 43.14 3n99 s ASN 202 CO 0.66 -0.11 1.96 1.55 -1.51 0.00 0.00 177.10 179.65 3n99 h PRO 203 N 5.63 0.37 0.00 -0.60 0.13 -1.88 -0.19 132.00 135.46 3n99 h PRO 203 Ca -0.26 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.83 3n99 h PRO 203 Cb 1.20 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 3n99 h PRO 203 CO 0.40 0.24 -0.09 0.93 -0.23 0.00 0.00 178.00 179.25 3n99 h GLU 204 N 0.38 0.00 0.00 0.86 3.07 -1.83 0.13 114.58 117.19 3n99 h GLU 204 Ca 0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.16 3n99 h GLU 204 Cb 0.67 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.58 3n99 h GLU 204 CO -0.08 0.09 0.00 -0.44 -1.40 0.00 0.00 179.01 177.18 3n99 h ASP 205 N 0.00 0.00 -0.46 1.42 3.32 -1.33 -0.86 116.42 118.51 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 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 3n99 h ASP 205 CO 0.01 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.71 3n99 n LEU 206 N -2.53 3.27 -1.46 1.55 4.77 0.45 -4.97 117.00 118.08 3n99 n LEU 206 Ca -0.01 -1.88 -0.12 0.00 -0.03 0.00 0.00 56.01 53.96 3n99 n LEU 206 Cb 0.09 -0.31 -0.00 0.00 -2.33 0.00 0.00 43.42 40.87 3n99 n LEU 206 CO 0.15 0.80 -0.14 0.61 -1.33 0.00 0.00 177.39 177.48 3n99 n GLY 207 N 1.01 -0.12 3.16 -0.72 0.00 -0.33 -4.83 105.19 103.36 3n99 n GLY 207 Ca 0.16 -0.36 -0.11 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.65 0.68 -0.07 1.61 -7.23 -1.14 -5.01 120.40 106.58 3n99 s VAL 208 Ca 0.02 -1.86 0.19 0.00 -1.81 0.00 0.00 61.98 58.52 3n99 s VAL 208 Cb -0.01 -1.58 0.14 0.00 0.56 0.00 0.00 36.38 35.49 3n99 s VAL 208 CO 0.03 -0.83 1.59 0.00 -0.31 0.00 0.00 175.10 175.58 3n99 h ALA 209 N 3.11 0.83 -2.48 1.32 0.00 -1.97 -3.01 119.26 117.06 3n99 h ALA 209 Ca -0.35 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.20 3n99 h ALA 209 Cb 1.17 -0.06 -0.16 0.00 0.00 0.00 0.00 17.79 18.74 3n99 h ALA 209 CO 0.62 0.46 0.23 0.34 0.00 0.00 0.00 179.25 180.90 3n99 s ASP 210 N -6.36 -0.59 -0.06 0.00 2.15 -1.26 -4.78 116.67 105.77 3n99 s ASP 210 Ca 0.03 0.32 0.02 0.00 0.43 0.00 0.00 52.55 53.34 3n99 s ASP 210 Cb 0.08 0.55 0.02 0.00 -0.30 0.00 0.00 42.92 43.27 3n99 s ASP 210 CO 0.70 -0.77 -0.10 -0.22 -0.17 0.00 0.00 175.17 174.61 3n99 s LEU 211 N -2.01 1.52 0.11 -1.34 2.96 -1.26 -5.02 118.68 113.63 3n99 s LEU 211 Ca -0.04 -0.25 0.06 0.00 -0.22 0.00 0.00 54.13 53.68 3n99 s LEU 211 Cb -0.01 -0.72 -0.04 0.00 0.50 0.00 0.00 46.19 45.92 3n99 s LEU 211 CO -0.03 -0.00 -0.03 -0.54 -1.32 0.00 0.00 176.35 174.44 3n99 s LYS 212 N 0.81 2.41 0.18 1.98 1.02 -1.26 -0.47 119.74 124.41 3n99 s LYS 212 Ca -0.12 -0.93 -0.33 0.00 0.02 0.00 0.00 55.97 54.60 3n99 s LYS 212 Cb -0.15 -2.45 -0.13 0.00 -0.52 0.00 0.00 37.83 34.58 3n99 s LYS 212 CO 0.02 0.52 1.62 1.28 -0.92 0.00 0.00 175.35 177.86 3n99 n LEU 213 N 0.47 3.39 0.00 3.17 4.77 0.36 -1.31 117.00 127.85 3n99 n LEU 213 Ca -0.11 1.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.95 3n99 n LEU 213 Cb 0.53 -1.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.14 3n99 n LEU 213 CO 0.38 -0.14 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 3n99 n GLY 214 N 3.53 0.66 3.77 -0.72 0.00 -0.18 -1.41 105.19 110.84 3n99 n GLY 214 Ca 0.16 0.00 -0.36 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 -2.51 6.02 -0.20 1.61 1.01 -0.43 -1.00 116.67 121.18 3n99 s ASP 215 Ca 0.00 2.21 -0.13 0.00 0.71 0.00 0.00 52.55 55.34 3n99 s ASP 215 Cb 0.00 -2.59 -0.05 0.00 1.01 0.00 0.00 42.92 41.30 3n99 s ASP 215 CO 0.00 -1.01 0.28 -0.63 0.21 0.00 0.00 175.17 174.02 3n99 s ILE 216 N -1.68 5.29 0.13 0.77 1.01 -0.17 -0.65 121.20 125.91 3n99 s ILE 216 Ca 0.67 0.47 0.06 0.00 0.00 0.00 0.00 60.65 61.85 3n99 s ILE 216 Cb -0.25 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.56 3n99 s ILE 216 CO 0.30 0.34 -0.13 0.68 0.00 0.00 0.00 174.94 176.13 3n99 s VAL 217 N 0.88 1.29 -0.01 2.92 -7.23 0.19 -0.33 120.40 118.12 3n99 s VAL 217 Ca 0.14 -1.79 0.00 0.00 -1.81 0.00 0.00 61.98 58.53 3n99 s VAL 217 Cb -0.13 -1.59 -0.04 0.00 0.56 0.00 0.00 36.38 35.18 3n99 s VAL 217 CO 0.05 -0.49 0.04 0.00 -0.31 0.00 0.00 175.10 174.39 3n99 s ALA 218 N -2.38 3.42 -0.26 1.32 0.00 -0.06 -1.26 121.76 122.54 3n99 s ALA 218 Ca 0.10 -0.90 -0.02 0.00 0.00 0.00 0.00 51.96 51.15 3n99 s ALA 218 Cb -0.03 -1.46 0.03 0.00 0.00 0.00 0.00 23.12 21.65 3n99 s ALA 218 CO 0.03 0.66 -0.05 0.42 0.00 0.00 0.00 175.76 176.82 3n99 s ILE 219 N -1.12 2.89 0.18 0.00 1.01 -0.17 0.12 121.20 124.12 3n99 s ILE 219 Ca 0.20 -1.08 -0.30 0.00 0.00 0.00 0.00 60.65 59.47 3n99 s ILE 219 Cb -0.12 -2.50 -0.08 0.00 0.01 0.00 0.00 42.46 39.77 3n99 s ILE 219 CO 0.11 0.15 1.14 -1.10 0.00 0.00 0.00 174.94 175.24 3n99 s GLN 220 N 1.31 4.55 -1.41 2.79 -0.21 -0.04 -1.76 119.66 124.89 3n99 s GLN 220 Ca -0.01 1.78 0.00 0.00 0.02 0.00 0.00 55.36 57.15 3n99 s GLN 220 Cb -0.17 -3.26 0.00 0.00 1.00 0.00 0.00 33.01 30.57 3n99 s GLN 220 CO -0.04 0.01 0.00 -0.25 -2.12 0.00 0.00 175.29 172.89 3n99 n ASP 221 N 2.44 -4.70 -4.13 5.90 8.00 0.03 -2.57 116.55 121.53 3n99 n ASP 221 Ca 0.03 0.11 -0.29 0.00 0.71 0.00 0.00 54.79 55.35 3n99 n ASP 221 Cb 0.46 -3.74 -0.17 0.00 -0.02 0.00 0.00 41.12 37.64 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 -2.71 2.08 -0.15 1.24 3.76 -1.25 -0.97 115.29 117.29 3n99 s HIS 222 Ca 0.00 -0.84 -0.08 0.00 -0.15 0.00 0.00 55.06 53.98 3n99 s HIS 222 Cb 0.00 -1.43 -0.04 0.00 1.11 0.00 0.00 32.58 32.21 3n99 s HIS 222 CO 0.00 -0.37 0.14 0.34 -0.85 0.00 0.00 174.74 174.00 3n99 s ASP 223 N 0.54 6.33 -0.15 1.40 2.15 0.14 -3.17 116.67 123.90 3n99 s ASP 223 Ca -0.16 0.39 0.20 0.00 0.43 0.00 0.00 52.55 53.41 3n99 s ASP 223 Cb -0.17 -2.08 0.45 0.00 -0.30 0.00 0.00 42.92 40.83 3n99 s ASP 223 CO 0.06 0.33 1.17 0.59 -0.17 0.00 0.00 175.17 177.14 3n99 n ASN 224 N 2.52 1.82 -0.29 -0.34 3.02 -1.26 -2.31 115.26 118.42 3n99 n ASN 224 Ca -0.19 -2.63 -0.03 0.00 -0.03 0.00 0.00 54.58 51.70 3n99 n ASN 224 Cb 0.54 -0.40 0.13 0.00 -0.61 0.00 0.00 39.78 39.44 3n99 n ASN 224 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3n99 h SER 225 N 1.58 1.04 0.00 6.41 0.02 -1.94 -3.43 113.55 117.23 3n99 h SER 225 Ca -0.08 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 3n99 h SER 225 Cb 1.50 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.78 3n99 h SER 225 CO 0.19 0.85 0.00 -1.22 -1.14 0.00 0.00 176.83 175.50 3n99 n TYR 226 N -4.34 0.00 -1.46 3.45 4.01 -1.26 -4.92 117.16 112.65 3n99 n TYR 226 Ca 0.09 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.53 3n99 n TYR 226 Cb 0.11 0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.25 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 -1.04 1.61 -0.05 2.72 0.00 -1.22 -0.84 107.32 108.50 3n99 s GLY 227 Ca 0.00 -0.25 -0.19 0.00 0.00 0.00 0.00 44.72 44.27 3n99 s GLY 227 CO 0.00 0.22 0.55 0.14 0.00 0.00 0.00 173.10 174.01 3n99 s VAL 228 N -3.13 5.03 0.00 1.40 1.01 -0.73 -4.43 120.40 119.54 3n99 s VAL 228 Ca 0.62 1.13 0.00 0.00 0.00 0.00 0.00 61.98 63.73 3n99 s VAL 228 Cb -0.15 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.34 3n99 s VAL 228 CO 0.55 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.64 3n99 n GLY 229 N 2.73 0.75 3.63 4.51 0.00 -1.23 -0.38 105.19 115.20 3n99 n GLY 229 Ca -0.07 -0.70 -0.43 0.00 0.00 0.00 0.00 46.02 44.82 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 -4.04 3.95 0.20 1.61 2.47 -0.98 -4.80 119.74 118.15 3n99 s LYS 230 Ca 0.00 1.26 -0.31 0.00 -1.56 0.00 0.00 55.97 55.36 3n99 s LYS 230 Cb 0.00 -3.86 -0.10 0.00 -1.46 0.00 0.00 37.83 32.42 3n99 s LYS 230 CO 0.00 -1.08 1.45 -0.47 0.16 0.00 0.00 175.35 175.41 3n99 s TYR 231 N 4.25 3.10 -0.30 4.03 5.04 -1.26 -0.69 117.35 131.53 3n99 s TYR 231 Ca 0.55 0.93 -0.09 0.00 -2.44 0.00 0.00 57.07 56.03 3n99 s TYR 231 Cb -0.17 -3.80 0.15 0.00 0.35 0.00 0.00 41.96 38.50 3n99 s TYR 231 CO 0.22 -2.72 0.70 0.50 -1.34 0.00 0.00 175.55 172.90 3n99 s ARG 232 N 0.30 0.52 0.05 4.97 3.52 -0.15 -4.91 118.95 123.26 3n99 s ARG 232 Ca 0.63 1.21 -0.33 0.00 -0.13 0.00 0.00 55.73 57.11 3n99 s ARG 232 Cb -0.41 0.72 -0.12 0.00 -1.56 0.00 0.00 34.95 33.58 3n99 s ARG 232 CO 0.37 -0.29 1.80 1.17 -0.81 0.00 0.00 175.30 177.55 3n99 n LYS 233 N 5.38 2.42 -0.10 5.12 3.00 -1.26 -1.15 118.16 131.58 3n99 n LYS 233 Ca -0.09 0.88 0.00 0.00 -0.00 0.00 0.00 58.31 59.10 3n99 n LYS 233 Cb 0.50 -2.73 0.00 0.00 0.00 0.00 0.00 35.03 32.80 3n99 n LYS 233 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3n99 n GLY 234 N 4.12 1.24 3.79 3.14 0.00 -1.26 -5.04 105.19 111.19 3n99 n GLY 234 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.56 2.60 -0.00 4.61 0.00 -0.30 -0.30 121.76 125.81 3n99 s ALA 235 Ca 0.00 0.42 -0.01 0.00 0.00 0.00 0.00 51.96 52.37 3n99 s ALA 235 Cb 0.00 -3.26 -0.00 0.00 0.00 0.00 0.00 23.12 19.85 3n99 s ALA 235 CO 0.00 -1.09 0.02 0.54 0.00 0.00 0.00 175.76 175.23 3n99 s VAL 236 N -2.48 0.03 0.16 0.00 0.11 0.55 -0.79 120.40 117.97 3n99 s VAL 236 Ca 0.64 -0.21 0.09 0.00 -2.93 0.00 0.00 61.98 59.57 3n99 s VAL 236 Cb -0.18 -0.11 -0.04 0.00 -1.53 0.00 0.00 36.38 34.52 3n99 s VAL 236 CO 0.41 -0.12 -0.20 -0.44 -3.33 0.00 0.00 175.10 171.43 3n99 s SER 237 N -0.34 2.84 -0.05 3.54 0.01 -0.72 -1.47 113.70 117.50 3n99 s SER 237 Ca -0.04 -0.84 0.06 0.00 1.31 0.00 0.00 55.95 56.44 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 -0.00 0.02 -0.22 -0.63 0.41 0.00 0.00 173.24 172.82 3n99 s ILE 238 N -1.83 2.38 0.32 1.44 -1.09 0.64 -1.00 121.20 122.07 3n99 s ILE 238 Ca 0.15 -0.96 -0.01 0.00 -2.23 0.00 0.00 60.65 57.60 3n99 s ILE 238 Cb -0.07 -1.89 -0.01 0.00 -1.58 0.00 0.00 42.46 38.92 3n99 s ILE 238 CO 0.07 0.57 0.39 -0.83 -1.23 0.00 0.00 174.94 173.92 3n99 s GLY 239 N -0.39 1.60 -0.08 6.18 0.00 -0.39 -0.01 107.32 114.24 3n99 s GLY 239 Ca 0.03 -1.62 0.04 0.00 0.00 0.00 0.00 44.72 43.18 3n99 s GLY 239 CO 0.02 -1.12 -0.20 0.14 0.00 0.00 0.00 173.10 171.94 3n99 s VAL 240 N -3.34 1.72 -0.03 1.40 1.01 0.13 -0.63 120.40 120.66 3n99 s VAL 240 Ca 0.33 -0.84 -0.30 0.00 0.00 0.00 0.00 61.98 61.17 3n99 s VAL 240 Cb 0.01 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 3n99 s VAL 240 CO 0.20 0.49 1.25 -0.69 0.00 0.00 0.00 175.10 176.35 3n99 s VAL 241 N 0.33 4.09 -0.00 2.92 1.01 0.18 -0.89 120.40 128.04 3n99 s VAL 241 Ca -0.14 1.45 0.00 0.00 0.00 0.00 0.00 61.98 63.29 3n99 s VAL 241 Cb -0.16 -3.93 -0.01 0.00 0.00 0.00 0.00 36.38 32.29 3n99 s VAL 241 CO 0.06 0.01 0.01 1.33 0.00 0.00 0.00 175.10 176.51 3n99 n VAL 242 N 4.53 0.00 -3.99 2.92 0.24 0.40 -1.01 118.33 121.41 3n99 n VAL 242 Ca 0.11 -0.13 -0.10 0.00 -2.04 0.00 0.00 64.34 62.18 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 -1.77 0.46 1.02 6.34 -3.43 -1.26 -4.53 115.29 112.13 3n99 s HIS 243 Ca -0.00 -0.81 -0.13 0.00 -0.80 0.00 0.00 55.06 53.32 3n99 s HIS 243 Cb 0.00 -0.03 0.20 0.00 -1.43 0.00 0.00 32.58 31.33 3n99 s HIS 243 CO 0.01 -0.80 1.10 -1.54 -2.00 0.00 0.00 174.74 171.51 3n99 s SER 244 N -3.00 2.45 1.04 7.38 1.04 -0.42 -3.48 113.70 118.70 3n99 s SER 244 Ca 0.21 1.09 -0.14 0.00 0.48 0.00 0.00 55.95 57.60 3n99 s SER 244 Cb 0.02 -1.71 0.14 0.00 0.10 0.00 0.00 66.02 64.57 3n99 s SER 244 CO 0.04 -3.23 0.59 0.00 0.98 0.00 0.00 173.24 171.62 3n99 n ALA 245 N -4.23 -2.71 -2.22 5.32 0.00 0.74 -3.75 120.51 113.66 3n99 n ALA 245 Ca 0.06 -0.91 -0.12 0.00 0.00 0.00 0.00 53.44 52.48 3n99 n ALA 245 Cb 0.58 -1.85 -0.10 0.00 0.00 0.00 0.00 19.45 18.07 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 -0.01 0.88 -2.68 0.00 0.24 -1.26 -4.72 118.33 110.78 3n99 n VAL 247 Ca -0.12 -0.69 -0.31 0.00 -2.04 0.00 0.00 64.34 61.17 3n99 n VAL 247 Cb 0.60 -0.40 -0.04 0.00 -1.47 0.00 0.00 33.84 32.54 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 -5.27 6.62 0.36 -1.34 0.01 -1.22 -1.66 113.70 111.19 3n99 s SER 248 Ca -0.07 1.37 -0.28 0.00 1.31 0.00 0.00 55.95 58.28 3n99 s SER 248 Cb 0.09 -2.42 -0.11 0.00 0.21 0.00 0.00 66.02 63.79 3n99 s SER 248 CO 0.85 -0.46 1.47 0.00 0.41 0.00 0.00 173.24 175.51 3n99 n ALA 249 N -1.29 2.20 -0.88 1.44 0.00 -1.26 -2.00 120.51 118.72 3n99 n ALA 249 Ca 0.05 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.84 3n99 n ALA 249 Cb 0.54 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.59 3n99 n ALA 249 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3n99 n GLY 250 N 0.81 0.62 3.68 0.00 0.00 -1.26 -4.99 105.19 104.05 3n99 n GLY 250 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.79 2.68 -1.71 1.61 0.09 -0.85 -0.77 115.29 113.56 3n99 s HIS 251 Ca 0.00 -0.34 0.00 0.00 -0.00 0.00 0.00 55.06 54.72 3n99 s HIS 251 Cb 0.00 -1.46 0.00 0.00 -0.00 0.00 0.00 32.58 31.12 3n99 s HIS 251 CO 0.00 0.46 0.00 0.41 -0.00 0.00 0.00 174.74 175.61 3n99 n GLY 252 N -1.03 -1.07 3.74 -2.22 0.00 -1.22 -4.41 105.19 98.97 3n99 n GLY 252 Ca -0.04 -0.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.66 3n99 n GLY 252 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3n99 s PRO 253 N -0.68 4.12 0.53 1.61 0.02 -1.13 -4.44 135.00 135.03 3n99 s PRO 253 Ca 0.00 2.60 -0.17 0.00 0.02 0.00 0.00 61.00 63.45 3n99 s PRO 253 Cb 0.00 -3.05 -0.07 0.00 0.02 0.00 0.00 34.50 31.40 3n99 s PRO 253 CO 0.00 -0.69 1.01 0.20 -0.33 0.00 0.00 177.00 177.18 3n99 s GLY 254 N 0.83 2.13 -0.05 0.52 0.00 -1.23 -0.67 107.32 108.86 3n99 s GLY 254 Ca 0.69 0.28 0.01 0.00 0.00 0.00 0.00 44.72 45.71 3n99 s GLY 254 CO 0.40 0.57 -0.07 0.14 0.00 0.00 0.00 173.10 174.15 3n99 s VAL 255 N -2.51 0.69 -0.22 1.40 1.01 0.17 -0.46 120.40 120.49 3n99 s VAL 255 Ca 0.61 -0.22 -0.09 0.00 0.00 0.00 0.00 61.98 62.28 3n99 s VAL 255 Cb -0.12 -0.68 -0.05 0.00 0.00 0.00 0.00 36.38 35.53 3n99 s VAL 255 CO 0.31 0.26 0.12 -0.69 0.00 0.00 0.00 175.10 175.10 3n99 s VAL 256 N 0.81 5.12 0.19 2.92 1.01 -0.06 -0.84 120.40 129.55 3n99 s VAL 256 Ca -0.12 0.09 -0.30 0.00 0.00 0.00 0.00 61.98 61.65 3n99 s VAL 256 Cb -0.15 -3.36 -0.08 0.00 0.00 0.00 0.00 36.38 32.80 3n99 s VAL 256 CO 0.01 0.39 1.12 -0.69 0.00 0.00 0.00 175.10 175.94 3n99 s VAL 257 N 0.81 3.74 -0.05 2.92 1.01 -1.26 -0.70 120.40 126.88 3n99 s VAL 257 Ca 0.06 1.53 0.02 0.00 0.00 0.00 0.00 61.98 63.59 3n99 s VAL 257 Cb -0.13 -3.97 -0.02 0.00 0.00 0.00 0.00 36.38 32.25 3n99 s VAL 257 CO 0.02 0.27 0.06 2.30 0.00 0.00 0.00 175.10 177.76 3n99 n ILE 258 N 2.22 0.00 -3.66 2.22 -5.35 0.99 -4.46 119.36 111.33 3n99 n ILE 258 Ca 0.02 -0.29 -0.14 0.00 -0.27 0.00 0.00 62.75 62.07 3n99 n ILE 258 Cb 0.46 0.78 -0.08 0.00 -1.74 0.00 0.00 39.64 39.05 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 -1.56 0.75 -0.07 6.28 0.00 -0.96 -1.69 119.30 122.05 3n99 s MET 259 Ca 0.00 0.55 -0.20 0.00 0.00 0.00 0.00 55.69 56.04 3n99 s MET 259 Cb 0.01 0.36 0.04 0.00 0.00 0.00 0.00 34.83 35.24 3n99 s MET 259 CO 0.07 -0.15 0.45 -0.08 0.00 0.00 0.00 175.02 175.32 3n99 s THR 260 N -0.23 0.03 -2.33 10.11 -1.32 0.01 -0.26 115.64 121.65 3n99 s THR 260 Ca -0.04 -0.22 0.00 0.00 -1.21 0.00 0.00 61.69 60.22 3n99 s THR 260 Cb -0.03 -0.73 0.00 0.00 -1.51 0.00 0.00 72.50 70.22 3n99 s THR 260 CO 0.03 -0.12 0.00 0.61 -2.21 0.00 0.00 174.62 172.93 3n99 n GLY 261 N 1.58 -0.63 3.87 6.08 0.00 -0.54 -1.32 105.19 114.22 3n99 n GLY 261 Ca -0.19 -0.58 -0.31 0.00 0.00 0.00 0.00 46.02 44.94 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 6.11 0.49 1.61 2.15 -1.26 -0.33 116.67 121.44 3n99 s ASP 262 Ca 0.00 0.21 0.33 0.00 0.43 0.00 0.00 52.55 53.52 3n99 s ASP 262 Cb 0.00 -1.83 1.75 0.00 -0.30 0.00 0.00 42.92 42.54 3n99 s ASP 262 CO 0.00 0.19 2.02 1.05 -0.17 0.00 0.00 175.17 178.26 3n99 h GLU 263 N 3.33 0.00 0.00 4.34 4.11 -0.87 0.28 114.58 125.77 3n99 h GLU 263 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 3n99 h GLU 263 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3n99 h GLU 263 CO 0.71 0.00 0.00 -1.13 0.07 0.00 0.00 179.01 178.66 3n99 n SER 264 N -2.70 0.43 -0.00 3.06 3.41 -1.26 -3.89 113.62 112.66 3n99 n SER 264 Ca -0.02 0.58 0.01 0.00 -0.26 0.00 0.00 58.87 59.18 3n99 n SER 264 Cb 0.09 -0.68 -0.02 0.00 -0.26 0.00 0.00 64.21 63.34 3n99 n SER 264 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3n99 n LYS 265 N -1.94 1.04 -4.72 4.33 4.76 -0.02 -4.84 118.16 116.76 3n99 n LYS 265 Ca 0.04 -0.02 -0.30 0.00 -2.87 0.00 0.00 58.31 55.16 3n99 n LYS 265 Cb 0.28 -1.06 -0.17 0.00 -1.84 0.00 0.00 35.03 32.24 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 -2.15 1.72 -0.32 -0.18 1.01 -0.54 -0.48 121.20 120.27 3n99 s ILE 266 Ca -0.01 -0.80 0.03 0.00 0.00 0.00 0.00 60.65 59.87 3n99 s ILE 266 Cb 0.01 -1.53 0.09 0.00 0.01 0.00 0.00 42.46 41.04 3n99 s ILE 266 CO 0.11 0.49 0.02 -0.22 0.00 0.00 0.00 174.94 175.33 3n99 s LEU 267 N 0.73 4.38 0.16 2.97 2.96 0.45 -4.46 118.68 125.87 3n99 s LEU 267 Ca -0.11 -1.86 -0.31 0.00 -0.22 0.00 0.00 54.13 51.63 3n99 s LEU 267 Cb -0.16 -1.64 -0.09 0.00 0.50 0.00 0.00 46.19 44.81 3n99 s LEU 267 CO 0.02 -0.34 1.40 -2.84 -1.32 0.00 0.00 176.35 173.27 3n99 s PRO 268 N 1.01 4.32 -0.32 0.98 0.02 -1.26 -1.16 135.00 138.59 3n99 s PRO 268 Ca 0.04 2.14 -0.05 0.00 0.02 0.00 0.00 61.00 63.14 3n99 s PRO 268 Cb -0.20 -3.21 0.04 0.00 0.02 0.00 0.00 34.50 31.15 3n99 s PRO 268 CO -0.06 -0.41 0.06 -1.21 -0.33 0.00 0.00 177.00 175.05 3n99 s GLU 269 N 0.65 2.64 -0.18 5.54 2.02 0.12 -4.86 118.70 124.63 3n99 s GLU 269 Ca 0.63 -1.15 -0.29 0.00 0.02 0.00 0.00 54.97 54.18 3n99 s GLU 269 Cb -0.38 -3.35 -0.01 0.00 0.10 0.00 0.00 34.13 30.48 3n99 s GLU 269 CO 0.34 -0.61 1.29 -2.00 0.02 0.00 0.00 175.26 174.29 3n99 s GLU 270 N 1.37 4.18 0.40 1.61 2.12 -1.26 -1.50 118.70 125.63 3n99 s GLU 270 Ca -0.02 1.62 0.03 0.00 0.36 0.00 0.00 54.97 56.97 3n99 s GLU 270 Cb -0.19 -3.79 -0.03 0.00 0.26 0.00 0.00 34.13 30.38 3n99 s GLU 270 CO 0.01 -0.78 0.10 0.14 -0.54 0.00 0.00 175.26 174.19 3n99 s VAL 271 N 3.66 0.81 -0.06 3.70 -7.23 -0.15 -4.95 120.40 116.18 3n99 s VAL 271 Ca 0.56 -2.00 0.13 0.00 -1.81 0.00 0.00 61.98 58.86 3n99 s VAL 271 Cb -0.21 -2.43 -0.08 0.00 0.56 0.00 0.00 36.38 34.22 3n99 s VAL 271 CO 0.16 0.00 1.19 -0.33 -0.31 0.00 0.00 175.10 175.81 3n99 h GLU 272 N 1.80 0.00 -3.14 4.82 5.08 -1.90 -3.38 114.58 117.85 3n99 h GLU 272 Ca -0.38 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 57.69 3n99 h GLU 272 Cb 1.27 0.00 -0.36 0.00 0.50 0.00 0.00 28.75 30.17 3n99 h GLU 272 CO 0.62 0.58 -0.64 0.50 -1.00 0.00 0.00 179.01 179.07 3n99 s ARG 273 N -2.85 0.03 -0.33 2.33 6.06 -1.26 -4.96 118.95 117.96 3n99 s ARG 273 Ca 0.01 0.51 0.03 0.00 -2.50 0.00 0.00 55.73 53.78 3n99 s ARG 273 Cb 0.08 -0.29 0.16 0.00 0.06 0.00 0.00 34.95 34.97 3n99 s ARG 273 CO 0.79 -0.29 0.44 0.00 -2.50 0.00 0.00 175.30 173.74 3n99 s ALA 274 N 2.12 -1.22 -0.10 6.12 0.00 -1.26 -4.94 121.76 122.48 3n99 s ALA 274 Ca 0.02 -0.07 -0.05 0.00 0.00 0.00 0.00 51.96 51.85 3n99 s ALA 274 Cb -0.12 -2.19 0.04 0.00 0.00 0.00 0.00 23.12 20.85 3n99 s ALA 274 CO -0.05 -1.93 0.23 1.21 0.00 0.00 0.00 175.76 175.22 3n99 s ASN 275 N 2.16 -0.24 0.55 0.00 3.84 -1.26 -1.00 114.94 119.00 3n99 s ASN 275 Ca 0.12 0.48 0.33 0.00 0.21 0.00 0.00 52.86 54.01 3n99 s ASN 275 Cb -0.12 0.39 1.55 0.00 -0.55 0.00 0.00 41.25 42.52 3n99 s ASN 275 CO -0.20 -0.14 2.06 0.16 -2.79 0.00 0.00 177.10 176.19 3n99 h ILE 276 N 5.66 0.20 0.00 -5.21 3.07 -1.40 -2.42 117.51 117.40 3n99 h ILE 276 Ca -0.38 -0.49 -0.01 0.00 1.55 0.00 0.00 64.86 65.53 3n99 h ILE 276 Cb 1.16 1.40 -0.00 0.00 -0.27 0.00 0.00 36.82 39.12 3n99 h ILE 276 CO 0.38 0.06 -0.05 0.77 -1.05 0.00 0.00 178.15 178.26 3n99 h SER 277 N 0.00 0.00 0.44 2.16 4.64 -1.90 -1.53 113.55 117.36 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 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 3n99 h SER 277 CO 0.01 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 0.00 4.97 3.32 -1.84 -2.99 116.42 119.87 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 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.80 3n99 h ASP 278 CO 0.01 0.00 -0.68 -1.22 -1.72 0.00 0.00 179.24 175.63 3n99 n TYR 279 N -2.62 0.00 -0.19 4.55 4.02 -0.59 -5.15 117.16 117.18 3n99 n TYR 279 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 3n99 n TYR 279 Cb 0.16 -0.05 0.00 0.00 -0.02 0.00 0.00 39.34 39.43 3n99 n TYR 279 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13