#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 3.72 -0.14 -1.40 1.00 -1.26 -5.02 119.30 116.20 3n99 s MET 1 Ca 0.00 0.62 -0.29 0.00 0.00 0.00 0.00 55.69 56.02 3n99 s MET 1 Cb 0.00 -2.23 -0.02 0.00 0.00 0.00 0.00 34.83 32.58 3n99 s MET 1 CO 0.00 -0.29 1.26 1.03 0.00 0.00 0.00 175.02 177.02 3n99 s ARG 2 N -4.50 4.25 0.37 2.03 0.52 -1.26 -5.01 118.95 115.36 3n99 s ARG 2 Ca 0.54 1.68 0.06 0.00 -0.52 0.00 0.00 55.73 57.49 3n99 s ARG 2 Cb -0.10 -3.73 -0.07 0.00 0.52 0.00 0.00 34.95 31.56 3n99 s ARG 2 CO 0.41 -0.66 0.01 0.95 0.02 0.00 0.00 175.30 176.03 3n99 s THR 3 N 3.26 1.79 -0.42 0.02 -4.23 -1.26 -0.66 115.64 114.15 3n99 s THR 3 Ca 0.55 -2.03 0.04 0.00 -1.18 0.00 0.00 61.69 59.08 3n99 s THR 3 Cb -0.23 -2.88 0.33 0.00 1.34 0.00 0.00 72.50 71.07 3n99 s THR 3 CO 0.16 -0.04 1.25 -0.46 -0.54 0.00 0.00 174.62 174.99 3n99 n ASN 4 N -0.86 3.24 -0.18 3.99 6.94 -1.14 -4.72 115.26 122.53 3n99 n ASN 4 Ca -0.04 -2.58 0.24 0.00 -0.02 0.00 0.00 54.58 52.18 3n99 n ASN 4 Cb 0.66 -0.62 0.64 0.00 -2.36 0.00 0.00 39.78 38.10 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 1.08 0.15 0.00 -3.83 2.10 -1.96 0.22 116.57 114.34 3n99 h LYS 5 Ca 0.15 -0.01 -0.00 0.00 -2.00 0.00 0.00 60.65 58.79 3n99 h LYS 5 Cb 1.52 -0.03 -0.00 0.00 -0.90 0.00 0.00 32.23 32.82 3n99 h LYS 5 CO 0.37 0.10 -0.00 -0.44 -2.00 0.00 0.00 179.45 177.48 3n99 h ASP 6 N 0.16 0.00 0.04 7.07 3.32 -2.03 -2.53 116.42 122.45 3n99 h ASP 6 Ca 0.42 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.47 3n99 h ASP 6 Cb 1.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.97 3n99 h ASP 6 CO -0.07 0.00 -0.13 0.54 -1.72 0.00 0.00 179.24 177.86 3n99 n ARG 7 N -3.10 1.58 -2.55 3.56 1.74 0.77 -4.94 116.66 113.73 3n99 n ARG 7 Ca 0.00 -1.11 -0.35 0.00 -0.77 0.00 0.00 57.85 55.62 3n99 n ARG 7 Cb 0.30 -1.48 -0.04 0.00 -1.02 0.00 0.00 32.46 30.23 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 -2.18 3.96 -0.17 0.55 1.43 -0.96 -5.03 118.68 116.29 3n99 s LEU 8 Ca 0.29 1.97 -0.12 0.00 -1.03 0.00 0.00 54.13 55.24 3n99 s LEU 8 Cb 0.20 -4.41 -0.05 0.00 0.03 0.00 0.00 46.19 41.96 3n99 s LEU 8 CO 0.40 -0.66 0.24 -0.69 0.23 0.00 0.00 176.35 175.87 3n99 s VAL 9 N -1.86 5.34 -0.20 -1.59 1.01 -1.26 -5.07 120.40 116.77 3n99 s VAL 9 Ca 0.63 0.43 -0.06 0.00 0.00 0.00 0.00 61.98 62.98 3n99 s VAL 9 Cb -0.18 -3.57 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 3n99 s VAL 9 CO 0.23 0.42 0.04 -0.60 0.00 0.00 0.00 175.10 175.18 3n99 s ARG 10 N 0.34 3.75 -0.03 2.72 3.52 -1.26 -4.68 118.95 123.32 3n99 s ARG 10 Ca 0.14 -0.45 -0.14 0.00 -0.13 0.00 0.00 55.73 55.15 3n99 s ARG 10 Cb -0.12 -3.18 0.02 0.00 -1.56 0.00 0.00 34.95 30.11 3n99 s ARG 10 CO 0.02 0.07 0.30 -1.50 -0.81 0.00 0.00 175.30 173.37 3n99 s ILE 11 N 0.90 0.05 -0.16 4.11 2.07 -0.75 -4.99 121.20 122.43 3n99 s ILE 11 Ca 0.02 -0.42 -0.29 0.00 -1.41 0.00 0.00 60.65 58.55 3n99 s ILE 11 Cb -0.14 -0.57 -0.02 0.00 0.13 0.00 0.00 42.46 41.86 3n99 s ILE 11 CO 0.02 -0.23 1.37 -0.94 -1.91 0.00 0.00 174.94 173.25 3n99 s SER 12 N -1.10 6.82 -0.19 4.50 1.04 -1.26 -1.05 113.70 122.45 3n99 s SER 12 Ca -0.12 1.74 -0.02 0.00 0.48 0.00 0.00 55.95 58.03 3n99 s SER 12 Cb -0.05 -2.54 -0.01 0.00 0.10 0.00 0.00 66.02 63.53 3n99 s SER 12 CO 0.03 -0.86 -0.08 -0.69 0.98 0.00 0.00 173.24 172.62 3n99 s VAL 13 N 3.82 3.14 0.15 5.02 1.01 0.45 -4.96 120.40 129.03 3n99 s VAL 13 Ca 0.60 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 62.03 3n99 s VAL 13 Cb -0.24 -2.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.72 3n99 s VAL 13 CO 0.19 0.47 0.14 0.68 0.00 0.00 0.00 175.10 176.58 3n99 s VAL 14 N 1.14 4.57 0.00 2.92 -7.23 -1.26 0.08 120.40 120.62 3n99 s VAL 14 Ca 0.01 -0.99 0.00 0.00 -1.81 0.00 0.00 61.98 59.19 3n99 s VAL 14 Cb -0.14 -3.31 0.00 0.00 0.56 0.00 0.00 36.38 33.48 3n99 s VAL 14 CO -0.02 -0.06 0.00 0.61 -0.31 0.00 0.00 175.10 175.31 3n99 n GLY 15 N -0.22 3.05 3.17 2.32 0.00 -0.32 -4.64 105.19 108.56 3n99 n GLY 15 Ca -0.08 -0.95 -0.10 0.00 0.00 0.00 0.00 46.02 44.89 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 0.04 0.68 0.15 1.61 -1.05 -0.05 -1.70 118.70 118.38 3n99 s GLU 16 Ca 0.00 -0.69 -0.31 0.00 -0.15 0.00 0.00 54.97 53.82 3n99 s GLU 16 Cb 0.00 0.28 -0.10 0.00 -0.44 0.00 0.00 34.13 33.87 3n99 s GLU 16 CO 0.00 -0.19 1.61 0.42 0.95 0.00 0.00 175.26 178.04 3n99 s ILE 17 N -2.69 2.64 0.32 1.83 1.01 -0.26 -1.37 121.20 122.68 3n99 s ILE 17 Ca -0.04 0.40 -0.19 0.00 0.00 0.00 0.00 60.65 60.82 3n99 s ILE 17 Cb -0.00 -3.26 -0.09 0.00 0.01 0.00 0.00 42.46 39.11 3n99 s ILE 17 CO -0.05 0.02 0.80 0.00 0.00 0.00 0.00 174.94 175.72 3n99 s ALA 18 N 1.47 3.27 0.81 9.38 0.00 0.30 -1.32 121.76 135.68 3n99 s ALA 18 Ca 0.72 0.21 -0.11 0.00 0.00 0.00 0.00 51.96 52.77 3n99 s ALA 18 Cb -0.44 -2.92 0.08 0.00 0.00 0.00 0.00 23.12 19.84 3n99 s ALA 18 CO 0.32 0.27 1.10 -1.25 0.00 0.00 0.00 175.76 176.19 3n99 s PRO 19 N -2.62 1.99 0.24 0.00 0.04 -1.26 -1.41 135.00 131.98 3n99 s PRO 19 Ca 0.52 0.68 -0.31 0.00 0.04 0.00 0.00 61.00 61.93 3n99 s PRO 19 Cb -0.13 -1.90 -0.13 0.00 0.04 0.00 0.00 34.50 32.38 3n99 s PRO 19 CO 0.18 -1.70 1.47 0.00 0.04 0.00 0.00 177.00 177.00 3n99 n ALA 20 N -3.49 1.49 -2.45 8.56 0.00 -1.26 -2.60 120.51 120.76 3n99 n ALA 20 Ca 0.07 0.41 -0.27 0.00 0.00 0.00 0.00 53.44 53.65 3n99 n ALA 20 Cb 0.56 -2.33 -0.15 0.00 0.00 0.00 0.00 19.45 17.53 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 -0.25 1.57 -0.25 0.00 1.02 -0.73 -4.88 119.74 116.22 3n99 s LYS 21 Ca 0.69 -0.83 -0.09 0.00 0.02 0.00 0.00 55.97 55.76 3n99 s LYS 21 Cb -0.62 -1.58 0.11 0.00 -0.52 0.00 0.00 37.83 35.22 3n99 s LYS 21 CO 0.48 0.42 0.54 -1.64 -0.92 0.00 0.00 175.35 174.23 3n99 s MET 22 N -0.77 0.47 0.04 1.68 -1.94 -1.26 -3.73 119.30 113.78 3n99 s MET 22 Ca 0.08 1.24 0.27 0.00 -1.71 0.00 0.00 55.69 55.56 3n99 s MET 22 Cb -0.08 0.57 0.79 0.00 2.01 0.00 0.00 34.83 38.12 3n99 s MET 22 CO 0.00 -0.22 1.63 0.54 -0.01 0.00 0.00 175.02 176.97 3n99 n ARG 23 N 5.32 0.07 -3.64 2.03 1.74 -1.26 -4.86 116.66 116.07 3n99 n ARG 23 Ca -0.11 0.03 -0.14 0.00 -0.77 0.00 0.00 57.85 56.86 3n99 n ARG 23 Cb 0.50 -1.56 -0.06 0.00 -1.02 0.00 0.00 32.46 30.32 3n99 n ARG 23 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3n99 s SER 24 N -3.33 -0.36 0.56 0.55 0.15 -1.26 -5.02 113.70 104.98 3n99 s SER 24 Ca 0.11 0.16 0.27 0.00 0.70 0.00 0.00 55.95 57.20 3n99 s SER 24 Cb 0.17 0.44 1.63 0.00 -1.71 0.00 0.00 66.02 66.55 3n99 s SER 24 CO 0.63 -0.64 2.18 1.55 1.20 0.00 0.00 173.24 178.16 3n99 h PRO 25 N 3.09 0.00 -5.70 5.44 0.13 -1.97 -3.43 132.00 129.56 3n99 h PRO 25 Ca -0.30 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.17 3n99 h PRO 25 Cb 1.19 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.25 3n99 h PRO 25 CO 0.42 0.05 -0.42 0.71 -0.23 0.00 0.00 178.00 178.52 3n99 s TYR 26 N -4.52 3.62 -0.17 1.56 2.02 -1.26 -4.34 117.35 114.25 3n99 s TYR 26 Ca -0.04 0.62 -0.09 0.00 -0.37 0.00 0.00 57.07 57.19 3n99 s TYR 26 Cb 0.15 -2.03 -0.05 0.00 -0.40 0.00 0.00 41.96 39.63 3n99 s TYR 26 CO 0.57 0.69 0.12 -1.12 -1.57 0.00 0.00 175.55 174.25 3n99 s SER 27 N -0.95 6.16 -0.23 2.29 0.01 0.22 -4.95 113.70 116.24 3n99 s SER 27 Ca 0.17 0.28 -0.17 0.00 1.31 0.00 0.00 55.95 57.53 3n99 s SER 27 Cb -0.13 -2.05 -0.03 0.00 0.21 0.00 0.00 66.02 64.02 3n99 s SER 27 CO 0.06 0.25 0.48 -0.69 0.41 0.00 0.00 173.24 173.75 3n99 s VAL 28 N -0.08 5.12 0.82 3.43 1.01 -1.26 -1.38 120.40 128.06 3n99 s VAL 28 Ca 0.10 0.84 -0.12 0.00 0.00 0.00 0.00 61.98 62.79 3n99 s VAL 28 Cb -0.11 -3.80 0.10 0.00 0.00 0.00 0.00 36.38 32.56 3n99 s VAL 28 CO 0.00 0.16 1.19 0.42 0.00 0.00 0.00 175.10 176.87 3n99 s THR 29 N 1.85 2.02 0.39 3.92 -4.23 -0.05 -3.60 115.64 115.95 3n99 s THR 29 Ca 0.21 -0.02 0.27 0.00 -1.18 0.00 0.00 61.69 60.97 3n99 s THR 29 Cb -0.15 -3.00 0.29 0.00 1.34 0.00 0.00 72.50 70.98 3n99 s THR 29 CO 0.09 0.00 2.05 0.74 -0.54 0.00 0.00 174.62 176.96 3n99 h THR 30 N -1.11 0.57 -0.01 3.99 2.02 -1.75 -1.43 112.91 115.20 3n99 h THR 30 Ca -0.46 -0.58 0.00 0.00 0.77 0.00 0.00 66.41 66.15 3n99 h THR 30 Cb 1.32 1.38 0.00 0.00 -1.74 0.00 0.00 68.15 69.10 3n99 h THR 30 CO 0.62 0.13 -0.02 -0.62 0.37 0.00 0.00 175.52 175.99 3n99 n GLU 31 N -3.63 1.22 -2.12 6.66 4.71 -1.26 -4.91 120.64 121.31 3n99 n GLU 31 Ca -0.02 -0.43 -0.06 0.00 -0.01 0.00 0.00 57.16 56.64 3n99 n GLU 31 Cb 0.25 -1.49 -0.00 0.00 -1.01 0.00 0.00 31.44 29.19 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 1.12 0.11 3.80 0.62 0.00 -0.54 -5.06 105.19 105.24 3n99 n GLY 32 Ca 0.20 -0.62 -0.22 0.00 0.00 0.00 0.00 46.02 45.38 3n99 n GLY 32 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3n99 s THR 33 N -2.31 2.80 0.01 2.61 -4.23 -1.26 -4.90 115.64 108.35 3n99 s THR 33 Ca 0.00 -1.53 0.08 0.00 -1.18 0.00 0.00 61.69 59.06 3n99 s THR 33 Cb -0.00 -3.02 -0.03 0.00 1.34 0.00 0.00 72.50 70.79 3n99 s THR 33 CO 0.00 -0.08 -0.24 0.68 -0.54 0.00 0.00 174.62 174.45 3n99 s VAL 34 N -2.47 2.30 0.07 2.29 -7.23 -1.26 -0.87 120.40 113.23 3n99 s VAL 34 Ca 0.42 -1.20 0.05 0.00 -1.81 0.00 0.00 61.98 59.45 3n99 s VAL 34 Cb -0.02 -1.87 -0.03 0.00 0.56 0.00 0.00 36.38 35.02 3n99 s VAL 34 CO 0.25 0.46 -0.15 -0.13 -0.31 0.00 0.00 175.10 175.22 3n99 s ARG 35 N -1.00 0.87 -0.45 4.82 0.52 -0.48 -4.96 118.95 118.26 3n99 s ARG 35 Ca 0.12 -0.93 -0.09 0.00 -0.52 0.00 0.00 55.73 54.30 3n99 s ARG 35 Cb -0.10 -0.90 0.10 0.00 0.52 0.00 0.00 34.95 34.58 3n99 s ARG 35 CO 0.01 0.20 0.32 0.08 0.02 0.00 0.00 175.30 175.93 3n99 s VAL 36 N -1.18 4.24 0.05 3.52 1.01 -1.26 -0.61 120.40 126.17 3n99 s VAL 36 Ca -0.01 -1.63 0.00 0.00 0.00 0.00 0.00 61.98 60.35 3n99 s VAL 36 Cb -0.10 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.54 3n99 s VAL 36 CO 0.02 -0.67 -0.04 0.27 0.00 0.00 0.00 175.10 174.68 3n99 s ILE 37 N 1.39 0.32 0.71 2.22 -4.36 -1.26 -5.06 121.20 115.17 3n99 s ILE 37 Ca 0.05 -1.46 -0.15 0.00 -0.26 0.00 0.00 60.65 58.83 3n99 s ILE 37 Cb -0.25 -1.04 0.03 0.00 1.25 0.00 0.00 42.46 42.45 3n99 s ILE 37 CO 0.00 -0.74 1.18 -2.84 0.24 0.00 0.00 174.94 172.79 3n99 s PRO 38 N -2.83 2.30 0.00 0.37 0.02 -1.26 -4.80 135.00 128.79 3n99 s PRO 38 Ca -0.01 1.67 0.00 0.00 0.02 0.00 0.00 61.00 62.68 3n99 s PRO 38 Cb -0.01 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.65 3n99 s PRO 38 CO -0.05 -1.70 0.00 0.28 -0.33 0.00 0.00 177.00 175.21 3n99 n VAL 39 N -2.64 0.00 -3.18 3.83 0.31 -1.26 -1.52 118.33 113.88 3n99 n VAL 39 Ca 0.13 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.25 3n99 n VAL 39 Cb 0.51 0.00 0.05 0.00 -0.91 0.00 0.00 33.84 33.49 3n99 n VAL 39 CO 0.00 0.00 0.00 -1.48 -1.32 0.00 0.00 176.83 174.03 3n99 s LEU 40 N 0.00 3.00 0.00 7.52 0.05 -1.24 -4.35 118.68 123.66 3n99 s LEU 40 Ca 0.00 -0.94 0.00 0.00 0.05 0.00 0.00 54.13 53.24 3n99 s LEU 40 Cb 0.00 -1.50 0.00 0.00 -2.05 0.00 0.00 46.19 42.64 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 -2.19 -2.29 2.24 -3.48 0.00 -1.26 -1.77 105.19 96.45 3n99 n GLY 41 Ca 0.13 -1.58 0.04 0.00 0.00 0.00 0.00 46.02 44.61 3n99 n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n99 n GLY 42 N -0.35 -2.07 3.45 -0.02 0.00 -0.50 -4.56 105.19 101.14 3n99 n GLY 42 Ca 0.00 -1.41 -0.43 0.00 0.00 0.00 0.00 46.02 44.18 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 -0.95 5.08 -0.32 -0.61 1.01 -1.26 -1.39 121.20 122.77 3n99 s ILE 43 Ca 0.00 -0.55 -0.20 0.00 0.00 0.00 0.00 60.65 59.90 3n99 s ILE 43 Cb 0.00 -4.11 -0.01 0.00 0.01 0.00 0.00 42.46 38.35 3n99 s ILE 43 CO 0.00 -0.54 0.60 -0.89 0.00 0.00 0.00 174.94 174.11 3n99 s THR 44 N 2.12 4.95 -0.39 2.92 2.01 -0.43 -4.96 115.64 121.86 3n99 s THR 44 Ca 0.11 0.74 0.22 0.00 0.31 0.00 0.00 61.69 63.06 3n99 s THR 44 Cb -0.19 -3.99 0.29 0.00 0.01 0.00 0.00 72.50 68.62 3n99 s THR 44 CO 0.12 -0.16 1.58 1.88 -0.69 0.00 0.00 174.62 177.35 3n99 h TYR 45 N 8.26 0.00 0.00 4.92 0.05 -1.96 -3.35 116.97 124.90 3n99 h TYR 45 Ca -0.27 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.51 3n99 h TYR 45 Cb 1.12 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.86 3n99 h TYR 45 CO 0.75 0.09 -0.21 0.27 -1.05 0.00 0.00 178.16 178.01 3n99 n ASN 46 N -3.12 0.78 -3.97 3.88 6.94 -1.26 -4.96 115.26 113.55 3n99 n ASN 46 Ca 0.04 -2.02 -0.26 0.00 -0.02 0.00 0.00 54.58 52.31 3n99 n ASN 46 Cb 0.56 -0.18 -0.17 0.00 -2.36 0.00 0.00 39.78 37.63 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 -0.78 1.14 0.14 3.53 1.01 -1.26 -5.12 120.40 119.06 3n99 s VAL 47 Ca 0.07 -0.41 -0.01 0.00 0.00 0.00 0.00 61.98 61.63 3n99 s VAL 47 Cb 0.06 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 3n99 s VAL 47 CO 0.01 0.38 0.05 -1.59 0.00 0.00 0.00 175.10 173.95 3n99 s LYS 48 N 1.25 0.95 0.19 2.72 -2.85 -1.26 -2.11 119.74 118.63 3n99 s LYS 48 Ca -0.03 -1.45 -0.33 0.00 -1.00 0.00 0.00 55.97 53.16 3n99 s LYS 48 Cb -0.14 0.21 -0.14 0.00 -2.06 0.00 0.00 37.83 35.70 3n99 s LYS 48 CO -0.04 -0.26 1.49 1.55 0.10 0.00 0.00 175.35 178.20 3n99 n VAL 49 N -0.11 0.38 0.00 1.79 3.14 -1.26 -0.76 118.33 121.51 3n99 n VAL 49 Ca -0.05 -0.09 0.00 0.00 -2.96 0.00 0.00 64.34 61.23 3n99 n VAL 49 Cb 0.64 -1.47 0.00 0.00 -1.06 0.00 0.00 33.84 31.95 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 2.86 2.74 3.81 7.55 0.00 -0.16 -4.92 105.19 117.07 3n99 n GLY 50 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.23 5.01 0.45 1.61 1.01 0.06 -4.72 116.67 118.85 3n99 s ASP 51 Ca 0.00 1.49 -0.25 0.00 0.71 0.00 0.00 52.55 54.50 3n99 s ASP 51 Cb 0.00 -2.31 -0.08 0.00 1.01 0.00 0.00 42.92 41.54 3n99 s ASP 51 CO 0.00 -1.66 1.42 -0.55 0.21 0.00 0.00 175.17 174.59 3n99 s SER 52 N -3.84 5.89 0.01 0.27 0.15 -1.26 0.31 113.70 115.22 3n99 s SER 52 Ca 0.59 2.91 0.25 0.00 0.70 0.00 0.00 55.95 60.41 3n99 s SER 52 Cb -0.14 -2.65 1.08 0.00 -1.71 0.00 0.00 66.02 62.59 3n99 s SER 52 CO 0.55 -1.17 1.81 0.00 1.20 0.00 0.00 173.24 175.63 3n99 n ALA 53 N -0.19 2.16 -2.54 5.45 0.00 0.40 -4.62 120.51 121.19 3n99 n ALA 53 Ca 0.05 -0.08 -0.25 0.00 0.00 0.00 0.00 53.44 53.15 3n99 n ALA 53 Cb 0.42 -1.41 -0.10 0.00 0.00 0.00 0.00 19.45 18.36 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 -3.01 2.44 0.00 0.00 1.51 -1.26 0.12 117.35 117.15 3n99 s TYR 54 Ca 0.12 -0.46 0.00 0.00 -1.01 0.00 0.00 57.07 55.73 3n99 s TYR 54 Cb 0.16 -1.36 0.00 0.00 -0.11 0.00 0.00 41.96 40.65 3n99 s TYR 54 CO 0.47 0.57 0.00 0.41 -1.11 0.00 0.00 175.55 175.89 3n99 n GLY 55 N -0.82 0.81 3.80 0.71 0.00 -1.26 -5.02 105.19 103.40 3n99 n GLY 55 Ca -0.05 0.00 -0.39 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 -3.21 3.83 -1.29 1.61 0.52 -1.26 -4.98 118.94 114.16 3n99 s TRP 56 Ca 0.00 1.44 -0.18 0.00 0.02 0.00 0.00 56.10 57.39 3n99 s TRP 56 Cb 0.00 -2.63 0.03 0.00 -1.15 0.00 0.00 33.47 29.72 3n99 s TRP 56 CO 0.00 0.52 1.90 0.00 0.02 0.00 0.00 176.95 179.39 3n99 n ALA 57 N 1.51 3.81 -3.61 0.98 0.00 -1.26 -4.82 120.51 117.13 3n99 n ALA 57 Ca -0.07 -3.71 -0.00 0.00 0.00 0.00 0.00 53.44 49.65 3n99 n ALA 57 Cb 0.50 -3.58 -0.01 0.00 0.00 0.00 0.00 19.45 16.36 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 4.31 -0.35 -0.04 0.00 0.00 -1.26 -4.37 107.32 105.61 3n99 s GLY 58 Ca 0.54 1.28 0.02 0.00 0.00 0.00 0.00 44.72 46.57 3n99 s GLY 58 CO 0.05 0.37 -0.08 -0.35 0.00 0.00 0.00 173.10 173.08 3n99 s ASP 59 N -2.54 1.27 -1.45 1.64 2.15 -0.57 -4.76 116.67 112.40 3n99 s ASP 59 Ca 0.12 -0.20 -0.08 0.00 0.43 0.00 0.00 52.55 52.82 3n99 s ASP 59 Cb 0.02 -0.52 0.04 0.00 -0.30 0.00 0.00 42.92 42.16 3n99 s ASP 59 CO -0.04 0.01 0.70 1.41 -0.17 0.00 0.00 175.17 177.08 3n99 n HIS 60 N 3.73 -2.07 -2.24 -5.34 8.25 -0.98 -4.08 115.22 112.49 3n99 n HIS 60 Ca -0.23 0.63 -0.42 0.00 -0.26 0.00 0.00 57.72 57.44 3n99 n HIS 60 Cb 0.52 -3.98 -0.03 0.00 1.12 0.00 0.00 29.99 27.62 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 -3.14 3.35 -0.27 1.59 1.01 -1.26 -4.17 120.40 117.52 3n99 s VAL 61 Ca 0.43 1.06 -0.10 0.00 0.00 0.00 0.00 61.98 63.37 3n99 s VAL 61 Cb -0.21 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.45 3n99 s VAL 61 CO 0.53 0.13 0.16 -1.61 0.00 0.00 0.00 175.10 174.30 3n99 s GLU 62 N 0.33 3.87 0.54 2.72 2.02 -1.26 -0.59 118.70 126.32 3n99 s GLU 62 Ca 0.59 -0.36 -0.20 0.00 0.02 0.00 0.00 54.97 55.02 3n99 s GLU 62 Cb -0.35 -3.56 -0.06 0.00 0.10 0.00 0.00 34.13 30.25 3n99 s GLU 62 CO 0.35 -0.18 1.13 -1.25 0.02 0.00 0.00 175.26 175.34 3n99 s PRO 63 N 1.70 3.39 6.94 0.39 0.04 -1.26 -4.60 135.00 141.60 3n99 s PRO 63 Ca 0.07 1.63 0.00 0.00 0.04 0.00 0.00 61.00 62.74 3n99 s PRO 63 Cb -0.16 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.34 3n99 s PRO 63 CO 0.09 -0.82 0.00 0.41 0.04 0.00 0.00 177.00 176.71 3n99 n GLY 64 N 0.19 2.94 3.49 0.56 0.00 -0.89 -4.53 105.19 106.95 3n99 n GLY 64 Ca 0.11 -0.29 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 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 4.55 -0.09 1.61 1.01 -0.16 -1.32 120.40 126.01 3n99 s VAL 65 Ca 0.00 -0.09 -0.24 0.00 0.00 0.00 0.00 61.98 61.65 3n99 s VAL 65 Cb 0.00 -3.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.22 3n99 s VAL 65 CO 0.00 0.33 0.72 -0.44 0.00 0.00 0.00 175.10 175.71 3n99 s SER 66 N 1.55 6.97 -0.11 3.32 0.01 -0.49 -0.50 113.70 124.45 3n99 s SER 66 Ca 0.06 1.17 0.01 0.00 1.31 0.00 0.00 55.95 58.51 3n99 s SER 66 Cb -0.15 -2.42 -0.01 0.00 0.21 0.00 0.00 66.02 63.65 3n99 s SER 66 CO 0.05 -0.17 -0.15 -0.69 0.41 0.00 0.00 173.24 172.68 3n99 s VAL 67 N 1.09 2.88 0.35 3.43 1.01 0.11 -0.54 120.40 128.74 3n99 s VAL 67 Ca 0.37 -0.74 0.07 0.00 0.00 0.00 0.00 61.98 61.69 3n99 s VAL 67 Cb -0.18 -2.18 -0.07 0.00 0.00 0.00 0.00 36.38 33.96 3n99 s VAL 67 CO 0.17 0.54 -0.02 0.00 0.00 0.00 0.00 175.10 175.79 3n99 s MET 68 N 0.17 1.80 0.61 2.72 0.23 -0.47 -0.45 119.30 123.91 3n99 s MET 68 Ca -0.08 -1.97 -0.15 0.00 -1.03 0.00 0.00 55.69 52.45 3n99 s MET 68 Cb -0.15 -1.44 -0.03 0.00 -1.53 0.00 0.00 34.83 31.68 3n99 s MET 68 CO 0.05 -0.01 1.06 0.00 -2.03 0.00 0.00 175.02 174.10 3n99 s ALA 69 N -2.84 2.70 0.45 3.16 0.00 -1.26 -0.87 121.76 123.11 3n99 s ALA 69 Ca 0.34 0.37 0.18 0.00 0.00 0.00 0.00 51.96 52.85 3n99 s ALA 69 Cb 0.07 -3.23 1.17 0.00 0.00 0.00 0.00 23.12 21.13 3n99 s ALA 69 CO 0.16 -0.91 2.03 0.00 0.00 0.00 0.00 175.76 177.05 3n99 h ARG 70 N 0.26 0.00 -2.45 0.00 3.08 -1.89 -3.44 114.38 109.94 3n99 h ARG 70 Ca -0.46 0.00 0.11 0.00 0.07 0.00 0.00 59.98 59.70 3n99 h ARG 70 Cb 1.22 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 31.16 3n99 h ARG 70 CO 0.57 0.15 0.43 -0.98 -1.07 0.00 0.00 179.97 179.07 3n99 s ARG 71 N -4.55 1.08 0.29 0.04 1.70 -1.26 -5.07 118.95 111.18 3n99 s ARG 71 Ca -0.04 -0.50 -0.01 0.00 -0.47 0.00 0.00 55.73 54.71 3n99 s ARG 71 Cb 0.15 0.43 0.46 0.00 -0.57 0.00 0.00 34.95 35.42 3n99 s ARG 71 CO 0.66 -0.48 1.93 -0.22 -1.08 0.00 0.00 175.30 176.10 3n99 h LYS 72 N 2.00 1.08 0.00 3.89 3.64 -2.02 -0.91 116.57 124.25 3n99 h LYS 72 Ca -0.24 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.07 3n99 h LYS 72 Cb 1.25 -0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 32.82 3n99 h LYS 72 CO 0.29 0.72 -0.02 0.93 -2.27 0.00 0.00 179.45 179.10 3n99 h GLU 73 N 1.11 0.00 -0.22 1.90 3.07 -2.00 -1.68 114.58 116.77 3n99 h GLU 73 Ca 0.37 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.23 3n99 h GLU 73 Cb 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.97 3n99 h GLU 73 CO -0.12 0.02 0.00 0.39 -1.40 0.00 0.00 179.01 177.90 3n99 n GLU 74 N -3.28 2.19 0.01 2.33 1.02 -0.35 -4.46 120.64 118.11 3n99 n GLU 74 Ca -0.02 -1.78 -0.13 0.00 -0.02 0.00 0.00 57.16 55.21 3n99 n GLU 74 Cb 0.13 -1.47 -0.09 0.00 -0.02 0.00 0.00 31.44 29.99 3n99 n GLU 74 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3n99 h GLU 75 N 3.75 -0.05 0.09 3.49 5.08 -1.33 -2.85 114.58 122.76 3n99 h GLU 75 Ca 0.00 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3n99 h GLU 75 Cb 0.81 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 3n99 h GLU 75 CO 0.00 0.34 -0.14 0.82 -1.00 0.00 0.00 179.01 179.03 3n99 h ILE 76 N -0.44 0.68 -0.88 3.13 2.04 -1.78 -1.00 117.51 119.26 3n99 h ILE 76 Ca -0.00 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.87 3n99 h ILE 76 Cb 0.41 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.12 3n99 h ILE 76 CO 0.01 0.00 0.58 1.55 0.00 0.00 0.00 178.15 180.29 3n99 h PRO 77 N -0.28 1.15 -0.76 2.37 0.13 -1.85 0.17 132.00 132.93 3n99 h PRO 77 Ca 0.02 -0.07 0.07 0.00 -0.87 0.00 0.00 66.00 65.15 3n99 h PRO 77 Cb 0.29 -0.26 -0.06 0.00 0.13 0.00 0.00 31.00 31.10 3n99 h PRO 77 CO -0.07 0.76 0.44 1.25 -0.23 0.00 0.00 178.00 180.15 3n99 h LEU 78 N 1.18 0.66 0.00 1.56 5.85 -1.20 -0.35 115.31 123.02 3n99 h LEU 78 Ca 0.32 0.03 -0.18 0.00 0.84 0.00 0.00 57.88 58.89 3n99 h LEU 78 Cb -0.13 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 40.77 3n99 h LEU 78 CO -0.07 0.41 -1.05 0.24 -0.34 0.00 0.00 178.44 177.63 3n99 h MET 79 N 0.79 0.00 0.11 1.25 2.86 -0.75 -3.18 114.93 116.01 3n99 h MET 79 Ca 0.34 0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 57.72 3n99 h MET 79 Cb 0.22 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.88 3n99 h MET 79 CO -0.20 0.62 -1.35 1.15 1.06 0.00 0.00 176.91 178.20 3n99 h THR 80 N 0.00 1.07 0.00 2.22 2.02 -0.51 -3.38 112.91 114.32 3n99 h THR 80 Ca -0.09 -2.40 -0.08 0.00 0.77 0.00 0.00 66.41 64.61 3n99 h THR 80 Cb 1.66 2.73 -0.01 0.00 -1.74 0.00 0.00 68.15 70.79 3n99 h THR 80 CO 0.09 0.69 -0.81 -0.07 0.37 0.00 0.00 175.52 175.78 3n99 h LEU 81 N -0.35 0.00 -9.33 2.58 3.38 -1.20 -3.45 115.31 106.94 3n99 h LEU 81 Ca -0.29 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.13 3n99 h LEU 81 Cb 1.72 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.46 3n99 h LEU 81 CO 0.05 0.33 0.87 -0.44 0.09 0.00 0.00 178.44 179.35 3n99 s SER 82 N -5.96 6.84 0.14 -0.43 0.01 -1.20 -3.88 113.70 109.22 3n99 s SER 82 Ca 0.01 2.07 0.09 0.00 1.31 0.00 0.00 55.95 59.43 3n99 s SER 82 Cb 0.08 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.71 3n99 s SER 82 CO 0.76 -0.75 -0.13 0.00 0.41 0.00 0.00 173.24 173.53 3n99 s ILE 84 N -1.38 2.70 0.00 0.00 1.01 0.36 -1.69 121.20 122.21 3n99 s ILE 84 Ca 0.21 0.45 0.00 0.00 0.00 0.00 0.00 60.65 61.31 3n99 s ILE 84 Cb -0.10 -3.29 0.00 0.00 0.01 0.00 0.00 42.46 39.08 3n99 s ILE 84 CO 0.13 0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.71 3n99 n GLY 85 N 3.80 2.46 3.66 6.18 0.00 0.93 -0.67 105.19 121.55 3n99 n GLY 85 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 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 0.98 -4.79 1.61 5.03 -0.68 -4.58 115.26 112.82 3n99 n ASN 86 Ca 0.00 0.67 -0.37 0.00 0.87 0.00 0.00 54.58 55.75 3n99 n ASN 86 Cb 0.00 -1.47 -0.06 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 -3.63 4.46 -0.03 3.52 2.12 -1.26 -1.27 118.70 122.61 3n99 s GLU 87 Ca 0.75 1.16 -0.00 0.00 0.36 0.00 0.00 54.97 57.24 3n99 s GLU 87 Cb -0.33 -2.84 0.03 0.00 0.26 0.00 0.00 34.13 31.25 3n99 s GLU 87 CO 0.49 0.33 0.01 0.08 -0.54 0.00 0.00 175.26 175.62 3n99 s VAL 88 N -1.57 0.16 -0.09 3.70 1.01 -0.43 -0.90 120.40 122.27 3n99 s VAL 88 Ca 0.47 0.13 0.04 0.00 0.00 0.00 0.00 61.98 62.63 3n99 s VAL 88 Cb -0.18 -0.28 -0.00 0.00 0.00 0.00 0.00 36.38 35.92 3n99 s VAL 88 CO 0.23 0.16 -0.24 -0.63 0.00 0.00 0.00 175.10 174.62 3n99 s ILE 89 N 1.23 2.14 -0.07 2.22 1.09 0.42 -0.30 121.20 127.93 3n99 s ILE 89 Ca -0.07 -1.01 -0.30 0.00 -1.10 0.00 0.00 60.65 58.17 3n99 s ILE 89 Cb -0.13 -1.80 -0.03 0.00 -1.06 0.00 0.00 42.46 39.43 3n99 s ILE 89 CO -0.02 0.56 1.18 -0.69 -0.10 0.00 0.00 174.94 175.87 3n99 s VAL 90 N 0.15 4.31 -1.30 2.92 1.01 -0.74 -1.31 120.40 125.45 3n99 s VAL 90 Ca -0.13 1.63 0.12 0.00 0.00 0.00 0.00 61.98 63.60 3n99 s VAL 90 Cb -0.16 -4.05 0.19 0.00 0.00 0.00 0.00 36.38 32.36 3n99 s VAL 90 CO 0.07 -0.01 1.03 0.23 0.00 0.00 0.00 175.10 176.42 3n99 n MET 91 N 5.26 1.53 -3.95 2.72 2.81 0.39 -1.41 117.12 124.48 3n99 n MET 91 Ca 0.11 -1.56 -0.10 0.00 -1.81 0.00 0.00 57.70 54.34 3n99 n MET 91 Cb 0.46 -1.25 -0.03 0.00 -0.71 0.00 0.00 33.22 31.69 3n99 n MET 91 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3n99 s SER 92 N -1.00 0.09 0.43 7.83 1.04 -1.24 -4.82 113.70 116.04 3n99 s SER 92 Ca 0.18 -1.02 0.00 0.00 0.48 0.00 0.00 55.95 55.59 3n99 s SER 92 Cb 0.11 0.69 0.00 0.00 0.10 0.00 0.00 66.02 66.92 3n99 s SER 92 CO 0.16 -1.33 0.00 0.61 0.98 0.00 0.00 173.24 173.65 3n99 n GLY 93 N -0.47 -1.11 0.19 7.32 0.00 -1.26 -3.95 105.19 105.93 3n99 n GLY 93 Ca -0.03 -1.18 0.14 0.00 0.00 0.00 0.00 46.02 44.95 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 -0.46 1.61 3.32 -1.98 -2.65 116.42 116.26 3n99 h ASP 94 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3n99 h ASP 94 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 3n99 h ASP 94 CO 0.00 0.00 0.02 0.00 -1.72 0.00 0.00 179.24 177.54 3n99 n ALA 95 N -1.96 3.61 -1.67 3.45 0.00 -1.26 -4.99 120.51 117.68 3n99 n ALA 95 Ca 0.03 -2.15 -0.45 0.00 0.00 0.00 0.00 53.44 50.87 3n99 n ALA 95 Cb 0.38 -0.96 -0.03 0.00 0.00 0.00 0.00 19.45 18.84 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 0.06 2.06 0.00 0.00 4.81 -1.00 -1.15 118.16 122.93 3n99 n LYS 96 Ca 0.27 0.73 0.00 0.00 -0.87 0.00 0.00 58.31 58.44 3n99 n LYS 96 Cb 1.09 -2.41 0.00 0.00 0.02 0.00 0.00 35.03 33.73 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 2.35 3.35 3.75 3.14 0.00 -0.50 -5.01 105.19 112.28 3n99 n GLY 97 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 3n99 n GLY 97 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3n99 s SER 98 N -0.57 5.16 0.08 1.61 0.01 -0.30 -4.74 113.70 114.95 3n99 s SER 98 Ca 0.00 2.60 0.10 0.00 1.31 0.00 0.00 55.95 59.96 3n99 s SER 98 Cb 0.00 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.58 3n99 s SER 98 CO 0.00 -1.63 -0.26 -0.13 0.41 0.00 0.00 173.24 171.63 3n99 s ARG 99 N -3.11 1.66 0.00 12.44 0.52 -1.26 -1.79 118.95 127.42 3n99 s ARG 99 Ca 0.75 -1.20 0.00 0.00 -0.52 0.00 0.00 55.73 54.76 3n99 s ARG 99 Cb -0.36 -1.96 0.00 0.00 0.52 0.00 0.00 34.95 33.15 3n99 s ARG 99 CO 0.41 0.49 0.00 0.41 0.02 0.00 0.00 175.30 176.63 3n99 n GLY 100 N 1.45 3.95 2.90 -3.53 0.00 0.59 -4.59 105.19 105.95 3n99 n GLY 100 Ca -0.17 -1.28 -0.16 0.00 0.00 0.00 0.00 46.02 44.41 3n99 n GLY 100 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3n99 s PHE 101 N -2.87 0.40 0.09 1.61 0.08 -0.37 -1.31 117.98 115.62 3n99 s PHE 101 Ca 0.00 -0.07 -0.31 0.00 0.12 0.00 0.00 56.93 56.67 3n99 s PHE 101 Cb 0.00 -0.33 -0.07 0.00 -0.57 0.00 0.00 43.02 42.04 3n99 s PHE 101 CO 0.00 -0.06 1.39 0.08 -0.10 0.00 0.00 175.22 176.53 3n99 s VAL 102 N 0.31 3.39 -0.55 -0.44 1.01 -0.40 -0.69 120.40 123.03 3n99 s VAL 102 Ca -0.03 0.97 0.15 0.00 0.00 0.00 0.00 61.98 63.07 3n99 s VAL 102 Cb -0.06 -3.62 -0.17 0.00 0.00 0.00 0.00 36.38 32.52 3n99 s VAL 102 CO -0.01 0.06 0.56 0.35 0.00 0.00 0.00 175.10 176.07 3n99 n THR 103 N 4.08 0.00 -0.55 3.92 -2.24 0.13 -0.05 114.28 119.57 3n99 n THR 103 Ca 0.12 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 3n99 n THR 103 Cb 0.43 0.83 0.00 0.00 -2.10 0.00 0.00 70.33 69.48 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 1.41 -2.09 3.33 3.38 0.00 -1.19 -4.83 105.19 105.20 3n99 n GLY 104 Ca 0.02 -1.18 -0.12 0.00 0.00 0.00 0.00 46.02 44.73 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 -1.88 1.00 -0.14 1.61 -2.85 -1.26 -0.38 119.74 115.84 3n99 s LYS 105 Ca 0.00 -0.48 -0.03 0.00 -1.00 0.00 0.00 55.97 54.46 3n99 s LYS 105 Cb 0.00 0.44 0.05 0.00 -2.06 0.00 0.00 37.83 36.26 3n99 s LYS 105 CO 0.00 -0.36 0.06 -1.58 0.10 0.00 0.00 175.35 173.56 3n99 s HIS 106 N -2.99 0.45 0.81 1.78 2.46 0.14 -4.16 115.29 113.78 3n99 s HIS 106 Ca -0.02 -0.32 -0.12 0.00 0.47 0.00 0.00 55.06 55.07 3n99 s HIS 106 Cb 0.00 -0.75 0.07 0.00 -0.13 0.00 0.00 32.58 31.77 3n99 s HIS 106 CO -0.06 -0.45 1.11 0.20 -2.47 0.00 0.00 174.74 173.07 3n99 s GLY 107 N 2.05 1.61 0.00 1.59 0.00 -1.26 -1.52 107.32 109.79 3n99 s GLY 107 Ca 0.02 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.44 3n99 s GLY 107 CO -0.07 0.15 0.00 0.61 0.00 0.00 0.00 173.10 173.78 3n99 n GLY 108 N -2.30 1.45 0.29 0.20 0.00 -1.26 -4.18 105.19 99.39 3n99 n GLY 108 Ca 0.07 -0.43 0.19 0.00 0.00 0.00 0.00 46.02 45.85 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 0.00 -5.18 1.61 -1.51 -2.04 -3.47 116.25 105.67 3n99 h VAL 109 Ca 0.00 -0.31 -0.03 0.00 -1.23 0.00 0.00 66.70 65.13 3n99 h VAL 109 Cb 0.00 1.28 0.03 0.00 -2.13 0.00 0.00 31.29 30.46 3n99 h VAL 109 CO 0.00 0.00 -0.11 0.59 -1.23 0.00 0.00 177.57 176.82 3n99 n ASN 110 N -3.02 -7.16 -4.45 4.19 3.02 -0.86 -4.95 115.26 102.04 3n99 n ASN 110 Ca -0.01 -0.15 -0.31 0.00 -0.03 0.00 0.00 54.58 54.08 3n99 n ASN 110 Cb 0.21 -4.93 -0.13 0.00 -0.61 0.00 0.00 39.78 34.32 3n99 n ASN 110 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3n99 s HIS 111 N -3.05 2.58 -0.09 3.10 3.76 -0.58 -4.48 115.29 116.54 3n99 s HIS 111 Ca 0.06 -0.24 -0.06 0.00 -0.15 0.00 0.00 55.06 54.67 3n99 s HIS 111 Cb -0.01 -1.53 -0.04 0.00 1.11 0.00 0.00 32.58 32.11 3n99 s HIS 111 CO 0.68 0.19 0.15 0.08 -0.85 0.00 0.00 174.74 175.00 3n99 s VAL 112 N -0.82 5.47 -0.10 -0.90 1.01 0.41 -0.68 120.40 124.78 3n99 s VAL 112 Ca 0.13 0.09 -0.00 0.00 0.00 0.00 0.00 61.98 62.20 3n99 s VAL 112 Cb -0.10 -3.43 -0.03 0.00 0.00 0.00 0.00 36.38 32.82 3n99 s VAL 112 CO 0.03 0.53 -0.08 -0.76 0.00 0.00 0.00 175.10 174.82 3n99 s LEU 113 N -1.31 3.06 -0.01 3.92 1.43 0.49 0.09 118.68 126.35 3n99 s LEU 113 Ca 0.19 -0.12 0.02 0.00 -1.03 0.00 0.00 54.13 53.19 3n99 s LEU 113 Cb -0.12 -1.68 -0.00 0.00 0.03 0.00 0.00 46.19 44.41 3n99 s LEU 113 CO 0.09 0.28 -0.08 -0.69 0.23 0.00 0.00 176.35 176.17 3n99 s VAL 114 N -0.32 0.68 -0.23 -1.59 1.01 0.35 0.19 120.40 120.48 3n99 s VAL 114 Ca 0.04 -0.34 -0.09 0.00 0.00 0.00 0.00 61.98 61.60 3n99 s VAL 114 Cb -0.13 -0.59 -0.04 0.00 0.00 0.00 0.00 36.38 35.62 3n99 s VAL 114 CO 0.02 0.21 0.11 -2.28 0.00 0.00 0.00 175.10 173.15 3n99 s HIS 115 N 0.00 3.19 0.35 5.22 2.46 0.13 -0.99 115.29 125.66 3n99 s HIS 115 Ca 0.00 -0.07 0.09 0.00 0.47 0.00 0.00 55.06 55.55 3n99 s HIS 115 Cb -0.06 -2.22 -0.05 0.00 -0.13 0.00 0.00 32.58 30.12 3n99 s HIS 115 CO -0.00 -0.11 0.06 -0.06 -2.47 0.00 0.00 174.74 172.17 3n99 s PHE 116 N 1.20 2.60 0.41 3.88 0.08 -1.26 -1.23 117.98 123.65 3n99 s PHE 116 Ca 0.06 -0.44 -0.26 0.00 0.12 0.00 0.00 56.93 56.40 3n99 s PHE 116 Cb -0.14 -1.58 -0.09 0.00 -0.57 0.00 0.00 43.02 40.64 3n99 s PHE 116 CO 0.04 0.41 1.36 -1.21 -0.10 0.00 0.00 175.22 175.72 3n99 s GLU 117 N -3.77 3.91 0.32 0.44 0.41 -1.26 -4.91 118.70 113.84 3n99 s GLU 117 Ca 0.36 2.27 0.07 0.00 -0.41 0.00 0.00 54.97 57.27 3n99 s GLU 117 Cb -0.00 -2.76 0.91 0.00 -1.78 0.00 0.00 34.13 30.50 3n99 s GLU 117 CO 0.21 -0.58 1.60 1.49 -0.49 0.00 0.00 175.26 177.48 3n99 h GLU 118 N 2.63 0.09 -0.06 1.61 4.57 -2.01 0.65 114.58 122.05 3n99 h GLU 118 Ca -0.50 -0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 57.63 3n99 h GLU 118 Cb 1.25 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.81 3n99 h GLU 118 CO 0.62 0.06 -0.15 0.93 -1.18 0.00 0.00 179.01 179.29 3n99 h GLU 119 N 0.09 0.09 -0.44 1.92 3.07 -2.04 -2.63 114.58 114.64 3n99 h GLU 119 Ca 0.66 -0.02 -0.11 0.00 -0.50 0.00 0.00 59.36 59.38 3n99 h GLU 119 Cb 1.48 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 29.36 3n99 h GLU 119 CO -0.78 0.25 -0.18 0.28 -1.40 0.00 0.00 179.01 177.18 3n99 h VAL 120 N 0.09 1.27 -0.88 3.13 2.07 -1.22 -3.32 116.25 117.38 3n99 h VAL 120 Ca 0.02 -1.30 0.11 0.00 0.82 0.00 0.00 66.70 66.34 3n99 h VAL 120 Cb 0.33 1.12 -0.08 0.00 -1.52 0.00 0.00 31.29 31.14 3n99 h VAL 120 CO 0.02 0.44 0.51 -0.07 0.02 0.00 0.00 177.57 178.50 3n99 h LEU 121 N 0.75 0.73 -2.34 2.57 3.38 -1.46 -0.82 115.31 118.12 3n99 h LEU 121 Ca 0.11 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 3n99 h LEU 121 Cb 0.71 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 3n99 h LEU 121 CO 0.05 0.39 -0.04 1.23 0.09 0.00 0.00 178.44 180.17 3n99 h GLY 122 N 0.83 0.00 0.08 0.83 0.00 -1.70 -2.53 103.07 100.58 3n99 h GLY 122 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.76 3n99 h GLY 122 CO -0.27 0.00 -0.68 0.28 0.00 0.00 0.00 176.54 175.88 3n99 n LYS 123 N -3.57 0.35 -2.39 4.80 5.02 -0.33 -4.98 118.16 117.07 3n99 n LYS 123 Ca -0.02 -0.26 -0.32 0.00 -2.02 0.00 0.00 58.31 55.68 3n99 n LYS 123 Cb 0.15 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.63 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 -2.83 3.65 0.01 -0.35 1.43 -0.95 -4.11 118.68 115.51 3n99 s LEU 124 Ca 0.13 1.64 0.01 0.00 -1.03 0.00 0.00 54.13 54.89 3n99 s LEU 124 Cb 0.17 -4.52 -0.01 0.00 0.03 0.00 0.00 46.19 41.87 3n99 s LEU 124 CO 0.72 -0.68 -0.05 -0.32 0.23 0.00 0.00 176.35 176.26 3n99 s MET 125 N -3.94 0.38 0.20 1.70 -2.45 -1.26 -5.05 119.30 108.89 3n99 s MET 125 Ca 0.60 -0.27 -0.32 0.00 -1.25 0.00 0.00 55.69 54.46 3n99 s MET 125 Cb -0.11 -0.32 -0.15 0.00 1.25 0.00 0.00 34.83 35.50 3n99 s MET 125 CO 0.30 0.08 1.16 0.28 1.05 0.00 0.00 175.02 177.88 3n99 n VAL 126 N 2.67 1.14 0.00 10.11 0.31 -1.26 -1.31 118.33 129.99 3n99 n VAL 126 Ca -0.15 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 3n99 n VAL 126 Cb 0.58 -0.94 0.00 0.00 -0.91 0.00 0.00 33.84 32.56 3n99 n VAL 126 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3n99 n GLY 127 N 1.87 1.57 3.73 2.92 0.00 -0.43 -4.94 105.19 109.92 3n99 n GLY 127 Ca 0.13 0.00 -0.39 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 2.63 -4.80 1.61 8.00 -0.42 -4.50 116.55 119.06 3n99 n ASP 128 Ca 0.00 1.00 -0.35 0.00 0.71 0.00 0.00 54.79 56.15 3n99 n ASP 128 Cb 0.00 -1.56 -0.07 0.00 -0.02 0.00 0.00 41.12 39.48 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 -2.72 4.40 -0.03 -1.24 1.02 -1.26 -1.10 119.74 118.81 3n99 s LYS 129 Ca 0.69 1.21 -0.00 0.00 0.02 0.00 0.00 55.97 57.89 3n99 s LYS 129 Cb -0.43 -2.49 0.03 0.00 -0.52 0.00 0.00 37.83 34.42 3n99 s LYS 129 CO 0.51 0.13 0.03 0.42 -0.92 0.00 0.00 175.35 175.52 3n99 s ILE 130 N -1.90 0.00 -0.18 2.17 -1.09 -0.69 -0.46 121.20 119.06 3n99 s ILE 130 Ca 0.56 0.21 -0.03 0.00 -2.23 0.00 0.00 60.65 59.16 3n99 s ILE 130 Cb -0.14 -0.15 -0.02 0.00 -1.58 0.00 0.00 42.46 40.58 3n99 s ILE 130 CO 0.18 0.12 -0.06 -0.22 -1.23 0.00 0.00 174.94 173.73 3n99 s LEU 131 N 1.24 2.97 -0.17 2.97 2.96 -0.43 -1.17 118.68 127.04 3n99 s LEU 131 Ca -0.07 -0.29 -0.04 0.00 -0.22 0.00 0.00 54.13 53.51 3n99 s LEU 131 Cb -0.13 -1.73 -0.03 0.00 0.50 0.00 0.00 46.19 44.81 3n99 s LEU 131 CO -0.03 0.08 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.43 3n99 s ILE 132 N 0.88 3.88 -1.05 6.68 1.01 0.11 -0.43 121.20 132.28 3n99 s ILE 132 Ca -0.01 -0.35 -0.14 0.00 0.00 0.00 0.00 60.65 60.14 3n99 s ILE 132 Cb -0.15 -2.72 0.19 0.00 0.01 0.00 0.00 42.46 39.79 3n99 s ILE 132 CO 0.01 0.47 1.18 -0.54 0.00 0.00 0.00 174.94 176.06 3n99 s LYS 133 N 0.62 3.90 0.25 2.79 1.02 -0.08 -0.41 119.74 127.82 3n99 s LYS 133 Ca -0.02 -2.46 -0.30 0.00 0.02 0.00 0.00 55.97 53.21 3n99 s LYS 133 Cb -0.14 -4.82 -0.09 0.00 -0.52 0.00 0.00 37.83 32.25 3n99 s LYS 133 CO 0.02 -1.59 1.06 0.00 -0.92 0.00 0.00 175.35 173.93 3n99 s ALA 134 N 1.10 3.38 -0.29 5.17 0.00 -0.22 -4.20 121.76 126.69 3n99 s ALA 134 Ca 0.34 0.82 -0.16 0.00 0.00 0.00 0.00 51.96 52.95 3n99 s ALA 134 Cb -0.06 -3.31 0.16 0.00 0.00 0.00 0.00 23.12 19.92 3n99 s ALA 134 CO -0.06 -0.09 1.02 -0.46 0.00 0.00 0.00 175.76 176.18 3n99 s TRP 135 N -0.94 -0.54 0.00 0.00 -0.00 -1.25 -1.81 118.94 114.40 3n99 s TRP 135 Ca 0.45 1.01 0.00 0.00 -0.00 0.00 0.00 56.10 57.55 3n99 s TRP 135 Cb -0.30 0.32 0.00 0.00 -0.00 0.00 0.00 33.47 33.49 3n99 s TRP 135 CO 0.38 -0.27 0.00 0.41 -0.00 0.00 0.00 176.95 177.47 3n99 n GLY 136 N 4.15 2.55 3.72 5.86 0.00 -1.26 -4.24 105.19 115.97 3n99 n GLY 136 Ca -0.14 -0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 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 4.41 0.00 1.61 -1.52 -1.26 -1.64 119.66 121.25 3n99 s GLN 137 Ca 0.00 1.93 0.00 0.00 -1.95 0.00 0.00 55.36 55.34 3n99 s GLN 137 Cb 0.00 -3.26 0.00 0.00 -0.22 0.00 0.00 33.01 29.53 3n99 s GLN 137 CO 0.00 -0.26 0.00 0.41 -0.25 0.00 0.00 175.29 175.19 3n99 n GLY 138 N 2.84 1.14 3.63 3.09 0.00 -1.26 -4.77 105.19 109.86 3n99 n GLY 138 Ca 0.08 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.63 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 2.36 -3.97 0.99 7.94 -0.65 -4.97 117.00 118.70 3n99 n LEU 139 Ca 0.00 1.15 -0.18 0.00 -1.11 0.00 0.00 56.01 55.87 3n99 n LEU 139 Cb 0.00 -1.33 -0.15 0.00 0.53 0.00 0.00 43.42 42.47 3n99 n LEU 139 CO 0.00 -0.90 -0.41 -0.54 -1.11 0.00 0.00 177.39 174.43 3n99 s LYS 140 N -0.54 0.61 -0.43 1.96 1.02 -1.26 -4.52 119.74 116.59 3n99 s LYS 140 Ca 0.69 -0.22 -0.25 0.00 0.02 0.00 0.00 55.97 56.22 3n99 s LYS 140 Cb -0.73 -0.60 0.02 0.00 -0.52 0.00 0.00 37.83 36.00 3n99 s LYS 140 CO 0.52 0.10 0.89 -0.51 -0.92 0.00 0.00 175.35 175.43 3n99 s LEU 141 N 0.06 4.05 0.44 3.17 1.43 -1.26 -2.88 118.68 123.69 3n99 s LEU 141 Ca -0.00 0.22 0.24 0.00 -1.03 0.00 0.00 54.13 53.55 3n99 s LEU 141 Cb -0.05 -3.16 0.96 0.00 0.03 0.00 0.00 46.19 43.97 3n99 s LEU 141 CO -0.00 -0.95 1.85 -0.07 0.23 0.00 0.00 176.35 177.40 3n99 h LEU 142 N 10.30 0.00 -0.17 1.79 3.38 -1.22 -2.67 115.31 126.71 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 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 3n99 h LEU 142 CO 0.99 0.23 -0.48 0.47 0.09 0.00 0.00 178.44 179.74 3n99 n ASP 143 N -3.45 0.75 -3.20 -0.43 8.00 -1.26 -4.53 116.55 112.44 3n99 n ASP 143 Ca -0.00 -0.55 -0.23 0.00 0.71 0.00 0.00 54.79 54.72 3n99 n ASP 143 Cb 0.42 0.30 -0.06 0.00 -0.02 0.00 0.00 41.12 41.76 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 -1.21 1.05 0.20 1.24 8.25 -1.01 -4.96 115.22 118.78 3n99 n HIS 144 Ca 0.07 -3.80 0.14 0.00 -0.26 0.00 0.00 57.72 53.87 3n99 n HIS 144 Cb 0.34 -0.42 0.73 0.00 1.12 0.00 0.00 29.99 31.76 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 3.60 0.00 -0.19 -0.41 0.13 -1.79 -1.42 132.00 131.91 3n99 h PRO 145 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3n99 h PRO 145 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 3n99 h PRO 145 CO 0.58 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.10 3n99 n ASP 146 N -2.44 3.18 -4.35 1.44 8.00 -1.26 -4.75 116.55 116.37 3n99 n ASP 146 Ca -0.02 -1.99 -0.41 0.00 0.71 0.00 0.00 54.79 53.09 3n99 n ASP 146 Cb 0.04 -0.11 -0.11 0.00 -0.02 0.00 0.00 41.12 40.92 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 -1.77 4.54 -0.03 2.53 1.01 -0.53 -4.53 120.40 121.61 3n99 s VAL 147 Ca 0.33 -1.01 -0.17 0.00 0.00 0.00 0.00 61.98 61.13 3n99 s VAL 147 Cb 0.21 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 32.93 3n99 s VAL 147 CO 0.31 -0.33 0.47 -0.54 0.00 0.00 0.00 175.10 175.00 3n99 s LYS 148 N 1.53 4.13 0.13 2.72 1.02 0.46 -4.55 119.74 125.18 3n99 s LYS 148 Ca 0.02 0.50 0.10 0.00 0.02 0.00 0.00 55.97 56.61 3n99 s LYS 148 Cb -0.21 -3.30 -0.04 0.00 -0.52 0.00 0.00 37.83 33.76 3n99 s LYS 148 CO 0.06 0.48 -0.24 0.14 -0.92 0.00 0.00 175.35 174.87 3n99 s VAL 149 N -0.46 2.07 0.05 3.17 -7.23 -1.26 -0.43 120.40 116.31 3n99 s VAL 149 Ca 0.26 -1.72 -0.28 0.00 -1.81 0.00 0.00 61.98 58.43 3n99 s VAL 149 Cb -0.17 -1.86 0.09 0.00 0.56 0.00 0.00 36.38 35.01 3n99 s VAL 149 CO 0.13 0.01 0.96 0.00 -0.31 0.00 0.00 175.10 175.89 3n99 s MET 150 N -2.09 0.93 -1.02 4.82 0.23 -0.67 -4.67 119.30 116.82 3n99 s MET 150 Ca 0.12 -0.44 0.00 0.00 -1.03 0.00 0.00 55.69 54.34 3n99 s MET 150 Cb -0.10 0.36 0.00 0.00 -1.53 0.00 0.00 34.83 33.57 3n99 s MET 150 CO 0.06 -0.42 0.00 0.09 -2.03 0.00 0.00 175.02 172.72 3n99 n ASN 151 N -0.35 -5.21 -3.88 -1.18 3.02 -1.26 -4.15 115.26 102.25 3n99 n ASN 151 Ca -0.07 0.24 -0.19 0.00 -0.03 0.00 0.00 54.58 54.53 3n99 n ASN 151 Cb 0.61 -3.55 -0.16 0.00 -0.61 0.00 0.00 39.78 36.07 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 -2.01 0.45 0.17 2.41 1.10 -1.26 -0.48 121.20 121.58 3n99 s ILE 152 Ca 0.00 -0.08 -0.32 0.00 -0.51 0.00 0.00 60.65 59.75 3n99 s ILE 152 Cb 0.00 -0.49 -0.11 0.00 0.15 0.00 0.00 42.46 42.01 3n99 s ILE 152 CO 0.00 0.20 1.78 -0.62 -2.11 0.00 0.00 174.94 174.20 3n99 s ASP 153 N 0.90 6.39 0.49 4.50 -1.08 0.15 -4.54 116.67 123.49 3n99 s ASP 153 Ca -0.11 2.84 0.17 0.00 -0.52 0.00 0.00 52.55 54.92 3n99 s ASP 153 Cb -0.14 -2.58 1.20 0.00 -1.46 0.00 0.00 42.92 39.93 3n99 s ASP 153 CO -0.00 -1.00 2.06 -0.65 0.52 0.00 0.00 175.17 176.10 3n99 h PRO 154 N 7.65 0.16 -0.03 4.34 0.11 -1.90 0.15 132.00 142.46 3n99 h PRO 154 Ca -0.45 -0.01 -0.22 0.00 0.11 0.00 0.00 66.00 65.43 3n99 h PRO 154 Cb 1.21 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 32.29 3n99 h PRO 154 CO 0.96 0.10 -0.90 -0.44 -0.21 0.00 0.00 178.00 177.51 3n99 h ASP 155 N 0.16 0.64 -0.14 -2.05 3.32 -1.97 -2.94 116.42 113.45 3n99 h ASP 155 Ca 0.15 -0.48 -0.13 0.00 0.02 0.00 0.00 57.03 56.58 3n99 h ASP 155 Cb 0.38 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 3n99 h ASP 155 CO -0.02 1.27 -0.34 0.25 -1.72 0.00 0.00 179.24 178.68 3n99 h LEU 156 N 0.31 0.67 -0.59 1.55 5.85 -1.61 -3.15 115.31 118.34 3n99 h LEU 156 Ca -0.08 -0.28 0.09 0.00 0.84 0.00 0.00 57.88 58.45 3n99 h LEU 156 Cb 1.52 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 42.30 3n99 h LEU 156 CO 0.16 0.96 0.23 0.15 -0.34 0.00 0.00 178.44 179.60 3n99 h PHE 157 N 0.54 0.39 0.00 1.25 3.57 -0.94 -0.69 116.94 121.06 3n99 h PHE 157 Ca 0.06 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.59 3n99 h PHE 157 Cb 0.85 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.50 3n99 h PHE 157 CO 0.04 0.11 0.00 0.39 -2.23 0.00 0.00 178.31 176.62 3n99 n GLU 158 N -4.99 0.13 -0.15 1.11 1.02 -1.12 -2.47 120.64 114.17 3n99 n GLU 158 Ca 0.08 0.58 0.11 0.00 -0.02 0.00 0.00 57.16 57.91 3n99 n GLU 158 Cb 0.26 -1.88 0.26 0.00 -0.02 0.00 0.00 31.44 30.06 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 -2.14 2.26 -0.13 3.49 5.02 -0.27 -4.48 118.16 121.91 3n99 n LYS 159 Ca -0.01 -1.90 0.11 0.00 -2.02 0.00 0.00 58.31 54.49 3n99 n LYS 159 Cb 0.07 -1.47 0.29 0.00 -0.02 0.00 0.00 35.03 33.89 3n99 n LYS 159 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3n99 n LEU 160 N 1.13 2.47 -0.76 -0.35 4.77 -1.03 -4.92 117.00 118.31 3n99 n LEU 160 Ca 0.18 -1.06 -0.07 0.00 -0.03 0.00 0.00 56.01 55.03 3n99 n LEU 160 Cb 0.52 -0.17 -0.01 0.00 -2.33 0.00 0.00 43.42 41.43 3n99 n LEU 160 CO 0.15 0.53 -0.09 0.61 -1.33 0.00 0.00 177.39 177.26 3n99 n GLY 161 N 1.29 0.28 3.75 -0.72 0.00 -1.26 -4.62 105.19 103.92 3n99 n GLY 161 Ca 0.17 -0.62 -0.40 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.34 4.61 -0.03 -0.61 1.01 -1.26 -4.48 121.20 118.10 3n99 s ILE 162 Ca 0.00 1.75 0.01 0.00 0.00 0.00 0.00 60.65 62.40 3n99 s ILE 162 Cb 0.00 -4.17 0.02 0.00 0.01 0.00 0.00 42.46 38.32 3n99 s ILE 162 CO 0.00 0.38 -0.02 -1.10 0.00 0.00 0.00 174.94 174.20 3n99 s GLN 163 N -0.25 0.49 -0.22 2.79 -0.21 -0.76 -4.85 119.66 116.66 3n99 s GLN 163 Ca 0.40 -0.01 -0.22 0.00 0.02 0.00 0.00 55.36 55.55 3n99 s GLN 163 Cb -0.22 -0.59 -0.02 0.00 1.00 0.00 0.00 33.01 33.19 3n99 s GLN 163 CO 0.25 -0.09 0.69 -1.83 -2.12 0.00 0.00 175.29 172.19 3n99 s GLU 164 N 0.86 4.19 -0.29 2.91 -1.05 -1.26 0.01 118.70 124.07 3n99 s GLU 164 Ca -0.10 0.70 -0.03 0.00 -0.15 0.00 0.00 54.97 55.39 3n99 s GLU 164 Cb -0.13 -3.61 0.11 0.00 -0.44 0.00 0.00 34.13 30.06 3n99 s GLU 164 CO -0.01 -0.34 0.16 0.21 0.95 0.00 0.00 175.26 176.23 3n99 s LYS 165 N 2.25 0.23 -0.66 -4.83 2.20 0.77 -4.85 119.74 114.84 3n99 s LYS 165 Ca 0.30 -0.53 -0.01 0.00 -0.36 0.00 0.00 55.97 55.37 3n99 s LYS 165 Cb -0.16 -1.10 -0.01 0.00 -1.51 0.00 0.00 37.83 35.05 3n99 s LYS 165 CO 0.10 -1.03 0.55 0.09 -0.36 0.00 0.00 175.35 174.70 3n99 n ASN 166 N 5.19 -2.83 0.00 1.43 3.02 -1.26 -3.20 115.26 117.60 3n99 n ASN 166 Ca -0.05 -0.37 0.00 0.00 -0.03 0.00 0.00 54.58 54.14 3n99 n ASN 166 Cb 0.42 -3.15 0.00 0.00 -0.61 0.00 0.00 39.78 36.45 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 -1.16 0.16 3.29 7.41 0.00 -1.26 -4.98 105.19 108.65 3n99 n GLY 167 Ca -0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.62 3n99 n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n99 s LYS 168 N -1.35 1.56 -0.24 1.61 1.02 -1.20 -4.88 119.74 116.27 3n99 s LYS 168 Ca 0.00 -1.01 -0.08 0.00 0.02 0.00 0.00 55.97 54.90 3n99 s LYS 168 Cb 0.00 -1.70 -0.03 0.00 -0.52 0.00 0.00 37.83 35.58 3n99 s LYS 168 CO 0.00 0.44 0.08 0.42 -0.92 0.00 0.00 175.35 175.37 3n99 s ILE 169 N -0.80 4.47 -0.23 2.17 1.01 0.63 -0.17 121.20 128.29 3n99 s ILE 169 Ca 0.09 -0.12 -0.10 0.00 0.00 0.00 0.00 60.65 60.52 3n99 s ILE 169 Cb -0.09 -3.08 -0.05 0.00 0.01 0.00 0.00 42.46 39.25 3n99 s ILE 169 CO 0.02 0.35 0.13 -1.00 0.00 0.00 0.00 174.94 174.44 3n99 s HIS 170 N 1.40 3.29 -0.15 3.97 3.76 0.10 -0.38 115.29 127.28 3n99 s HIS 170 Ca 0.05 0.14 -0.00 0.00 -0.15 0.00 0.00 55.06 55.11 3n99 s HIS 170 Cb -0.15 -2.23 0.03 0.00 1.11 0.00 0.00 32.58 31.35 3n99 s HIS 170 CO 0.04 0.05 -0.08 0.08 -0.85 0.00 0.00 174.74 173.98 3n99 s VAL 171 N 0.95 1.23 0.12 -0.90 1.01 -0.16 -1.83 120.40 120.83 3n99 s VAL 171 Ca 0.07 -0.55 -0.31 0.00 0.00 0.00 0.00 61.98 61.19 3n99 s VAL 171 Cb -0.13 -1.29 -0.07 0.00 0.00 0.00 0.00 36.38 34.89 3n99 s VAL 171 CO 0.03 0.29 1.27 -2.84 0.00 0.00 0.00 175.10 173.85 3n99 s PRO 172 N 1.60 4.41 0.06 2.72 0.02 -1.26 -0.35 135.00 142.20 3n99 s PRO 172 Ca 0.03 1.92 0.02 0.00 0.02 0.00 0.00 61.00 62.98 3n99 s PRO 172 Cb -0.14 -3.28 -0.03 0.00 0.02 0.00 0.00 34.50 31.08 3n99 s PRO 172 CO -0.09 -0.27 -0.07 0.14 -0.33 0.00 0.00 177.00 176.38 3n99 s VAL 173 N 0.72 0.54 -0.65 3.83 -7.23 -0.55 -4.84 120.40 112.22 3n99 s VAL 173 Ca 0.59 -1.35 0.24 0.00 -1.81 0.00 0.00 61.98 59.65 3n99 s VAL 173 Cb -0.33 -0.94 0.07 0.00 0.56 0.00 0.00 36.38 35.74 3n99 s VAL 173 CO 0.32 -0.56 1.35 1.33 -0.31 0.00 0.00 175.10 177.23 3n99 n VAL 174 N 0.97 0.38 -3.53 1.32 0.24 -0.55 -0.06 118.33 117.10 3n99 n VAL 174 Ca -0.19 -0.28 -0.10 0.00 -2.04 0.00 0.00 64.34 61.73 3n99 n VAL 174 Cb 0.57 -0.16 -0.03 0.00 -1.47 0.00 0.00 33.84 32.74 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 -3.16 -1.87 -0.20 2.33 0.00 -1.26 -4.78 121.76 112.82 3n99 s ALA 175 Ca 0.07 1.26 0.01 0.00 0.00 0.00 0.00 51.96 53.29 3n99 s ALA 175 Cb 0.13 -0.04 0.02 0.00 0.00 0.00 0.00 23.12 23.23 3n99 s ALA 175 CO 0.71 -0.53 -0.17 0.15 0.00 0.00 0.00 175.76 175.93 3n99 s LYS 176 N -2.24 2.95 -0.20 0.00 1.02 -1.26 -1.34 119.74 118.67 3n99 s LYS 176 Ca 0.02 -0.87 -0.07 0.00 0.02 0.00 0.00 55.97 55.07 3n99 s LYS 176 Cb -0.01 -2.67 -0.04 0.00 -0.52 0.00 0.00 37.83 34.60 3n99 s LYS 176 CO -0.04 -0.25 0.05 0.42 -0.92 0.00 0.00 175.35 174.61 3n99 s ILE 177 N 1.29 4.54 0.60 2.17 1.01 0.13 -4.93 121.20 126.01 3n99 s ILE 177 Ca 0.03 -0.11 -0.17 0.00 0.00 0.00 0.00 60.65 60.40 3n99 s ILE 177 Cb -0.14 -3.06 -0.03 0.00 0.01 0.00 0.00 42.46 39.24 3n99 s ILE 177 CO -0.11 0.42 1.12 -2.84 0.00 0.00 0.00 174.94 173.53 3n99 s PRO 178 N 0.76 3.09 0.36 2.79 0.02 -1.26 -0.47 135.00 140.29 3n99 s PRO 178 Ca 0.03 1.49 0.13 0.00 0.02 0.00 0.00 61.00 62.67 3n99 s PRO 178 Cb -0.14 -1.98 0.97 0.00 0.02 0.00 0.00 34.50 33.38 3n99 s PRO 178 CO 0.02 -1.04 1.76 0.00 -0.33 0.00 0.00 177.00 177.41 3n99 h ALA 179 N 0.61 2.00 0.00 -1.55 0.00 -1.89 -0.66 119.26 117.77 3n99 h ALA 179 Ca -0.48 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3n99 h ALA 179 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3n99 h ALA 179 CO 0.56 -0.41 0.00 -2.39 0.00 0.00 0.00 179.25 177.00 3n99 n HIS 180 N -4.72 0.20 1.40 0.00 1.44 -1.26 -1.74 115.22 110.54 3n99 n HIS 180 Ca 0.25 0.07 0.13 0.00 -2.01 0.00 0.00 57.72 56.16 3n99 n HIS 180 Cb 0.77 -0.62 0.47 0.00 0.12 0.00 0.00 29.99 30.74 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 -1.67 1.71 -3.49 -1.40 2.00 -0.25 -4.87 117.12 109.13 3n99 n MET 181 Ca 0.04 -1.04 -0.38 0.00 0.00 0.00 0.00 57.70 56.33 3n99 n MET 181 Cb 0.24 -1.46 -0.06 0.00 0.00 0.00 0.00 33.22 31.94 3n99 n MET 181 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 175.97 174.33 3n99 s MET 182 N -1.94 3.98 0.00 0.03 -1.94 -0.71 -0.22 119.30 118.50 3n99 s MET 182 Ca 0.36 0.38 0.00 0.00 -1.71 0.00 0.00 55.69 54.73 3n99 s MET 182 Cb 0.20 -3.26 0.00 0.00 2.01 0.00 0.00 34.83 33.78 3n99 s MET 182 CO 0.32 0.60 0.00 0.41 -0.01 0.00 0.00 175.02 176.34 3n99 n GLY 183 N 2.09 2.91 3.61 -0.03 0.00 -0.07 -4.87 105.19 108.82 3n99 n GLY 183 Ca -0.13 -0.27 -0.51 0.00 0.00 0.00 0.00 46.02 45.11 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 1.96 0.00 1.61 2.88 -0.37 -1.97 113.62 117.72 3n99 n SER 184 Ca 0.00 1.11 0.00 0.00 -1.33 0.00 0.00 58.87 58.65 3n99 n SER 184 Cb 0.00 -1.24 0.00 0.00 -0.75 0.00 0.00 64.21 62.22 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 2.74 1.39 3.59 0.46 0.00 -1.26 -1.33 105.19 110.77 3n99 n GLY 185 Ca 0.18 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.12 0.44 -0.06 -0.61 5.41 -0.83 -1.39 119.36 122.21 3n99 n ILE 186 Ca 0.00 -0.11 0.00 0.00 1.00 0.00 0.00 62.75 63.64 3n99 n ILE 186 Cb 0.00 -0.88 0.00 0.00 -0.71 0.00 0.00 39.64 38.05 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 2.31 1.03 3.61 7.39 0.00 0.06 -4.99 105.19 114.60 3n99 n GLY 187 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.21 0.16 -0.34 4.61 0.00 -0.48 -4.72 120.51 118.53 3n99 n ALA 188 Ca 0.00 0.16 0.05 0.00 0.00 0.00 0.00 53.44 53.65 3n99 n ALA 188 Cb 0.00 -2.08 0.23 0.00 0.00 0.00 0.00 19.45 17.60 3n99 n ALA 188 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3n99 h SER 189 N 1.23 0.94 -3.36 0.00 0.87 -1.92 -2.10 113.55 109.21 3n99 h SER 189 Ca -0.46 0.02 -0.26 0.00 -1.23 0.00 0.00 61.79 59.86 3n99 h SER 189 Cb 1.35 -0.18 -0.33 0.00 -0.44 0.00 0.00 62.40 62.80 3n99 h SER 189 CO 0.55 0.57 -0.62 -0.55 -0.53 0.00 0.00 176.83 176.25 3n99 s SER 190 N -5.88 0.11 0.00 6.23 0.15 -1.26 -3.45 113.70 109.60 3n99 s SER 190 Ca -0.12 0.28 0.08 0.00 0.70 0.00 0.00 55.95 56.89 3n99 s SER 190 Cb 0.21 0.18 0.34 0.00 -1.71 0.00 0.00 66.02 65.03 3n99 s SER 190 CO 0.81 -0.17 1.24 -1.54 1.20 0.00 0.00 173.24 174.78 3n99 n SER 191 N 4.46 0.00 0.05 5.45 3.41 0.19 -1.80 113.62 125.38 3n99 n SER 191 Ca -0.22 0.48 0.13 0.00 -0.26 0.00 0.00 58.87 59.00 3n99 n SER 191 Cb 0.51 -0.48 0.51 0.00 -0.26 0.00 0.00 64.21 64.49 3n99 n SER 191 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3n99 n ALA 192 N -1.48 2.28 -0.29 7.33 0.00 -1.26 -4.20 120.51 122.89 3n99 n ALA 192 Ca 0.02 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3n99 n ALA 192 Cb 0.09 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.08 3n99 n ALA 192 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3n99 n SER 193 N -1.87 1.33 -3.81 0.00 3.41 -0.75 -4.20 113.62 107.73 3n99 n SER 193 Ca 0.06 -1.62 -0.08 0.00 -0.26 0.00 0.00 58.87 56.97 3n99 n SER 193 Cb 0.38 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.30 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 -0.62 0.00 0.58 6.66 -1.32 -1.24 -4.62 115.64 115.08 3n99 s THR 194 Ca 0.00 -0.90 0.06 0.00 -1.21 0.00 0.00 61.69 59.64 3n99 s THR 194 Cb 0.00 -1.84 0.08 0.00 -1.51 0.00 0.00 72.50 69.23 3n99 s THR 194 CO 0.00 -0.02 0.80 1.51 -2.21 0.00 0.00 174.62 174.70 3n99 s ASP 195 N -2.91 5.02 0.12 8.08 -4.77 -1.26 -4.70 116.67 116.25 3n99 s ASP 195 Ca 0.11 -0.59 -0.10 0.00 -3.30 0.00 0.00 52.55 48.67 3n99 s ASP 195 Cb -0.04 -0.03 0.00 0.00 -1.09 0.00 0.00 42.92 41.77 3n99 s ASP 195 CO 0.03 -1.36 0.26 -0.72 0.70 0.00 0.00 175.17 174.08 3n99 s TYR 196 N -2.74 0.14 -0.11 2.11 1.13 -0.41 -4.68 117.35 112.78 3n99 s TYR 196 Ca 0.61 -0.54 -0.10 0.00 -1.41 0.00 0.00 57.07 55.64 3n99 s TYR 196 Cb -0.07 0.01 -0.05 0.00 -1.10 0.00 0.00 41.96 40.75 3n99 s TYR 196 CO 0.39 -0.62 0.22 -0.51 -2.51 0.00 0.00 175.55 172.52 3n99 s ASP 197 N -2.88 6.46 -0.32 -0.18 1.11 -0.44 0.26 116.67 120.68 3n99 s ASP 197 Ca 0.08 0.55 -0.25 0.00 0.18 0.00 0.00 52.55 53.10 3n99 s ASP 197 Cb 0.04 -2.13 0.01 0.00 1.07 0.00 0.00 42.92 41.91 3n99 s ASP 197 CO -0.08 0.31 0.87 -0.63 1.18 0.00 0.00 175.17 176.82 3n99 s ILE 198 N -0.62 4.70 -1.06 0.77 1.01 0.14 -0.89 121.20 125.25 3n99 s ILE 198 Ca 0.16 1.27 -0.02 0.00 0.00 0.00 0.00 60.65 62.06 3n99 s ILE 198 Cb -0.13 -4.23 0.27 0.00 0.01 0.00 0.00 42.46 38.37 3n99 s ILE 198 CO 0.05 -0.35 2.01 1.15 0.00 0.00 0.00 174.94 177.80 3n99 n MET 199 N 6.44 4.89 -3.76 2.79 0.00 0.70 -2.52 117.12 125.66 3n99 n MET 199 Ca 0.06 -4.20 -0.36 0.00 0.00 0.00 0.00 57.70 53.20 3n99 n MET 199 Cb 0.48 -2.48 -0.10 0.00 0.00 0.00 0.00 33.22 31.12 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 -3.49 3.48 0.26 3.17 0.00 -1.26 -4.90 121.76 119.01 3n99 s ALA 200 Ca 0.44 -0.91 0.02 0.00 0.00 0.00 0.00 51.96 51.51 3n99 s ALA 200 Cb 0.22 -2.20 0.34 0.00 0.00 0.00 0.00 23.12 21.48 3n99 s ALA 200 CO -0.15 -0.18 1.66 0.77 0.00 0.00 0.00 175.76 177.85 3n99 h SER 201 N 7.51 0.46 -4.59 0.00 0.02 -1.90 -3.44 113.55 111.60 3n99 h SER 201 Ca -0.37 -0.19 -0.35 0.00 -0.84 0.00 0.00 61.79 60.03 3n99 h SER 201 Cb 1.17 -0.13 -0.21 0.00 0.14 0.00 0.00 62.40 63.37 3n99 h SER 201 CO 0.64 0.79 -0.76 0.20 -1.14 0.00 0.00 176.83 176.57 3n99 s ASN 202 N -6.85 1.33 0.49 3.07 0.01 -1.26 -5.01 114.94 106.73 3n99 s ASN 202 Ca -0.06 -0.60 0.14 0.00 -0.71 0.00 0.00 52.86 51.63 3n99 s ASN 202 Cb 0.13 -0.01 1.14 0.00 0.41 0.00 0.00 41.25 42.92 3n99 s ASN 202 CO 0.80 -0.13 2.10 1.55 -1.51 0.00 0.00 177.10 179.90 3n99 h PRO 203 N 4.35 0.08 0.00 -0.60 0.13 -1.87 -1.34 132.00 132.75 3n99 h PRO 203 Ca -0.39 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 64.71 3n99 h PRO 203 Cb 1.20 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 3n99 h PRO 203 CO 0.41 0.10 -0.10 0.93 -0.23 0.00 0.00 178.00 179.10 3n99 h GLU 204 N 0.08 0.00 -0.00 0.86 3.07 -1.79 -0.62 114.58 116.18 3n99 h GLU 204 Ca 0.02 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 3n99 h GLU 204 Cb 0.07 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.98 3n99 h GLU 204 CO 0.00 0.10 0.00 -0.44 -1.40 0.00 0.00 179.01 177.28 3n99 h ASP 205 N 0.00 0.00 -0.41 1.42 3.32 -1.54 0.12 116.42 119.33 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 0.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.79 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 -3.18 3.29 -0.81 1.55 4.77 -0.25 -4.97 117.00 117.40 3n99 n LEU 206 Ca -0.03 -1.64 -0.09 0.00 -0.03 0.00 0.00 56.01 54.21 3n99 n LEU 206 Cb 0.07 -0.27 -0.03 0.00 -2.33 0.00 0.00 43.42 40.87 3n99 n LEU 206 CO 0.21 0.75 -0.10 0.61 -1.33 0.00 0.00 177.39 177.53 3n99 n GLY 207 N 1.24 0.81 3.40 -0.72 0.00 0.03 -4.84 105.19 105.10 3n99 n GLY 207 Ca 0.17 -0.58 -0.22 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.38 2.11 -0.27 1.61 -7.23 -1.13 -5.00 120.40 108.11 3n99 s VAL 208 Ca 0.00 -2.22 0.24 0.00 -1.81 0.00 0.00 61.98 58.19 3n99 s VAL 208 Cb 0.00 -2.12 0.31 0.00 0.56 0.00 0.00 36.38 35.13 3n99 s VAL 208 CO 0.00 -0.41 1.67 0.00 -0.31 0.00 0.00 175.10 176.04 3n99 h ALA 209 N 2.65 0.96 -2.65 1.32 0.00 -1.97 -2.65 119.26 116.91 3n99 h ALA 209 Ca -0.41 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 3n99 h ALA 209 Cb 1.23 -0.01 -0.14 0.00 0.00 0.00 0.00 17.79 18.87 3n99 h ALA 209 CO 0.58 0.10 0.25 0.34 0.00 0.00 0.00 179.25 180.52 3n99 s ASP 210 N -6.15 -0.56 -0.04 0.00 2.15 -1.26 -4.83 116.67 105.98 3n99 s ASP 210 Ca 0.05 0.16 0.02 0.00 0.43 0.00 0.00 52.55 53.21 3n99 s ASP 210 Cb 0.06 0.55 0.02 0.00 -0.30 0.00 0.00 42.92 43.25 3n99 s ASP 210 CO 0.66 -0.83 -0.07 -0.22 -0.17 0.00 0.00 175.17 174.54 3n99 s LEU 211 N -2.34 1.52 0.04 -1.34 2.96 -1.26 -5.01 118.68 113.24 3n99 s LEU 211 Ca -0.01 -0.16 0.04 0.00 -0.22 0.00 0.00 54.13 53.77 3n99 s LEU 211 Cb -0.01 -0.52 -0.04 0.00 0.50 0.00 0.00 46.19 46.13 3n99 s LEU 211 CO -0.07 -0.01 -0.05 -0.54 -1.32 0.00 0.00 176.35 174.36 3n99 s LYS 212 N 0.66 2.53 0.15 1.98 1.02 -1.26 -0.45 119.74 124.36 3n99 s LYS 212 Ca -0.10 -0.77 -0.33 0.00 0.02 0.00 0.00 55.97 54.79 3n99 s LYS 212 Cb -0.13 -2.51 -0.13 0.00 -0.52 0.00 0.00 37.83 34.54 3n99 s LYS 212 CO 0.01 0.58 1.65 1.28 -0.92 0.00 0.00 175.35 177.94 3n99 n LEU 213 N 1.19 3.34 0.00 3.17 4.77 0.15 -1.24 117.00 128.38 3n99 n LEU 213 Ca -0.14 1.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.90 3n99 n LEU 213 Cb 0.52 -1.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.16 3n99 n LEU 213 CO 0.33 -0.16 0.00 0.61 -1.33 0.00 0.00 177.39 176.85 3n99 n GLY 214 N 3.65 1.67 3.75 -0.72 0.00 -0.00 -0.99 105.19 112.54 3n99 n GLY 214 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 3n99 n GLY 214 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3n99 s ASP 215 N -1.57 5.11 -0.20 1.61 1.01 -0.37 -1.48 116.67 120.78 3n99 s ASP 215 Ca 0.00 2.64 -0.12 0.00 0.71 0.00 0.00 52.55 55.78 3n99 s ASP 215 Cb 0.00 -2.62 -0.05 0.00 1.01 0.00 0.00 42.92 41.26 3n99 s ASP 215 CO 0.00 -1.67 0.22 -0.63 0.21 0.00 0.00 175.17 173.30 3n99 s ILE 216 N -1.39 5.34 0.15 0.77 1.01 0.03 -0.97 121.20 126.14 3n99 s ILE 216 Ca 0.75 0.36 0.04 0.00 0.00 0.00 0.00 60.65 61.80 3n99 s ILE 216 Cb -0.37 -3.56 -0.05 0.00 0.01 0.00 0.00 42.46 38.50 3n99 s ILE 216 CO 0.42 0.38 -0.07 0.68 0.00 0.00 0.00 174.94 176.35 3n99 s VAL 217 N 0.67 1.04 -0.01 2.92 -7.23 0.33 -1.48 120.40 116.65 3n99 s VAL 217 Ca 0.12 -2.03 0.04 0.00 -1.81 0.00 0.00 61.98 58.29 3n99 s VAL 217 Cb -0.13 -1.92 -0.03 0.00 0.56 0.00 0.00 36.38 34.87 3n99 s VAL 217 CO 0.02 -0.68 -0.10 0.00 -0.31 0.00 0.00 175.10 174.03 3n99 s ALA 218 N -3.41 2.86 -0.25 1.32 0.00 -0.45 -0.94 121.76 120.89 3n99 s ALA 218 Ca 0.18 -1.02 -0.00 0.00 0.00 0.00 0.00 51.96 51.11 3n99 s ALA 218 Cb 0.04 -1.04 0.04 0.00 0.00 0.00 0.00 23.12 22.15 3n99 s ALA 218 CO 0.01 0.59 -0.08 0.42 0.00 0.00 0.00 175.76 176.70 3n99 s ILE 219 N -0.90 2.66 0.20 0.00 1.01 0.17 0.18 121.20 124.53 3n99 s ILE 219 Ca 0.15 -1.19 -0.30 0.00 0.00 0.00 0.00 60.65 59.31 3n99 s ILE 219 Cb -0.11 -2.39 -0.08 0.00 0.01 0.00 0.00 42.46 39.89 3n99 s ILE 219 CO 0.05 0.15 0.97 -1.10 0.00 0.00 0.00 174.94 175.01 3n99 s GLN 220 N 1.27 4.78 -1.54 2.79 -0.21 0.38 -1.68 119.66 125.44 3n99 s GLN 220 Ca -0.02 1.53 0.00 0.00 0.02 0.00 0.00 55.36 56.89 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 -0.05 0.37 0.00 -0.25 -2.12 0.00 0.00 175.29 173.24 3n99 n ASP 221 N 1.89 -5.02 -4.08 5.90 8.00 0.27 -3.00 116.55 120.51 3n99 n ASP 221 Ca -0.00 0.09 -0.28 0.00 0.71 0.00 0.00 54.79 55.31 3n99 n ASP 221 Cb 0.47 -4.09 -0.17 0.00 -0.02 0.00 0.00 41.12 37.32 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 -2.79 1.92 -0.16 1.24 3.76 -1.25 -0.96 115.29 117.05 3n99 s HIS 222 Ca 0.00 -0.81 -0.09 0.00 -0.15 0.00 0.00 55.06 54.01 3n99 s HIS 222 Cb 0.00 -1.36 -0.05 0.00 1.11 0.00 0.00 32.58 32.29 3n99 s HIS 222 CO 0.00 -0.39 0.15 0.34 -0.85 0.00 0.00 174.74 173.99 3n99 s ASP 223 N 0.71 6.31 -0.17 1.40 -1.08 0.13 -3.40 116.67 120.57 3n99 s ASP 223 Ca -0.13 0.36 0.16 0.00 -0.52 0.00 0.00 52.55 52.42 3n99 s ASP 223 Cb -0.16 -2.09 0.44 0.00 -1.46 0.00 0.00 42.92 39.65 3n99 s ASP 223 CO 0.03 0.26 1.19 0.59 0.52 0.00 0.00 175.17 177.76 3n99 n ASN 224 N 2.90 2.08 -0.26 -0.34 3.02 -1.26 -2.13 115.26 119.27 3n99 n ASN 224 Ca -0.17 -3.16 -0.06 0.00 -0.03 0.00 0.00 54.58 51.16 3n99 n ASN 224 Cb 0.53 -0.43 0.08 0.00 -0.61 0.00 0.00 39.78 39.35 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 1.39 1.05 0.00 6.41 0.02 -1.94 -3.43 113.55 117.05 3n99 h SER 225 Ca -0.01 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.75 3n99 h SER 225 Cb 1.37 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.63 3n99 h SER 225 CO 0.18 0.96 0.00 -1.22 -1.14 0.00 0.00 176.83 175.62 3n99 n TYR 226 N -4.26 0.00 -1.42 3.45 4.01 -1.26 -4.91 117.16 112.76 3n99 n TYR 226 Ca 0.06 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.51 3n99 n TYR 226 Cb 0.21 0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.36 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 -1.18 1.61 0.01 2.72 0.00 -1.22 -0.64 107.32 108.62 3n99 s GLY 227 Ca 0.00 -0.21 -0.22 0.00 0.00 0.00 0.00 44.72 44.30 3n99 s GLY 227 CO 0.00 0.26 0.64 0.14 0.00 0.00 0.00 173.10 174.14 3n99 s VAL 228 N -3.09 4.86 0.00 1.40 1.01 -0.79 -4.48 120.40 119.32 3n99 s VAL 228 Ca 0.62 1.34 0.00 0.00 0.00 0.00 0.00 61.98 63.94 3n99 s VAL 228 Cb -0.16 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.25 3n99 s VAL 228 CO 0.55 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.67 3n99 n GLY 229 N 2.43 0.65 3.60 4.51 0.00 -1.25 -0.76 105.19 114.38 3n99 n GLY 229 Ca -0.06 -0.78 -0.43 0.00 0.00 0.00 0.00 46.02 44.75 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 -4.39 3.52 0.13 1.61 2.20 -0.90 -4.82 119.74 117.08 3n99 s LYS 230 Ca 0.00 1.08 -0.31 0.00 -0.36 0.00 0.00 55.97 56.38 3n99 s LYS 230 Cb 0.00 -4.07 -0.09 0.00 -1.51 0.00 0.00 37.83 32.16 3n99 s LYS 230 CO 0.00 -1.63 1.59 -0.47 -0.36 0.00 0.00 175.35 174.47 3n99 s TYR 231 N 5.79 2.86 -0.21 4.03 5.04 -1.26 -0.69 117.35 132.91 3n99 s TYR 231 Ca 0.66 0.54 -0.07 0.00 -2.44 0.00 0.00 57.07 55.76 3n99 s TYR 231 Cb -0.16 -3.92 0.09 0.00 0.35 0.00 0.00 41.96 38.32 3n99 s TYR 231 CO 0.33 -3.50 0.44 0.50 -1.34 0.00 0.00 175.55 171.98 3n99 s ARG 232 N 1.66 0.35 0.05 4.97 3.52 -0.13 -4.92 118.95 124.45 3n99 s ARG 232 Ca 0.71 1.07 -0.30 0.00 -0.13 0.00 0.00 55.73 57.07 3n99 s ARG 232 Cb -0.42 0.37 -0.08 0.00 -1.56 0.00 0.00 34.95 33.26 3n99 s ARG 232 CO 0.31 -0.24 1.74 0.21 -0.81 0.00 0.00 175.30 176.52 3n99 s LYS 233 N 2.57 4.17 0.00 5.12 2.47 -1.26 -1.46 119.74 131.35 3n99 s LYS 233 Ca -0.03 2.40 0.00 0.00 -1.56 0.00 0.00 55.97 56.79 3n99 s LYS 233 Cb -0.12 -3.78 0.00 0.00 -1.46 0.00 0.00 37.83 32.48 3n99 s LYS 233 CO -0.13 -0.82 0.00 0.41 0.16 0.00 0.00 175.35 174.97 3n99 n GLY 234 N 4.16 1.47 3.77 5.54 0.00 -1.26 -5.03 105.19 113.84 3n99 n GLY 234 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.40 2.30 -0.08 4.61 0.00 -0.54 -0.63 121.76 125.02 3n99 s ALA 235 Ca 0.00 0.29 -0.10 0.00 0.00 0.00 0.00 51.96 52.15 3n99 s ALA 235 Cb 0.00 -3.27 0.02 0.00 0.00 0.00 0.00 23.12 19.87 3n99 s ALA 235 CO 0.00 -1.69 0.27 0.54 0.00 0.00 0.00 175.76 174.88 3n99 s VAL 236 N -2.85 0.02 0.09 0.00 0.11 0.05 -0.56 120.40 117.25 3n99 s VAL 236 Ca 0.62 -0.15 0.07 0.00 -2.93 0.00 0.00 61.98 59.58 3n99 s VAL 236 Cb -0.17 -0.43 -0.03 0.00 -1.53 0.00 0.00 36.38 34.21 3n99 s VAL 236 CO 0.54 -0.08 -0.18 -0.44 -3.33 0.00 0.00 175.10 171.61 3n99 s SER 237 N -0.26 2.15 -0.06 3.54 0.01 -0.68 -1.51 113.70 116.90 3n99 s SER 237 Ca -0.04 -0.66 0.04 0.00 1.31 0.00 0.00 55.95 56.60 3n99 s SER 237 Cb -0.03 -0.10 -0.02 0.00 0.21 0.00 0.00 66.02 66.08 3n99 s SER 237 CO 0.01 -0.01 -0.18 -0.63 0.41 0.00 0.00 173.24 172.85 3n99 s ILE 238 N -1.25 2.73 0.31 1.44 -1.09 0.89 -0.65 121.20 123.57 3n99 s ILE 238 Ca 0.03 -0.84 -0.02 0.00 -2.23 0.00 0.00 60.65 57.60 3n99 s ILE 238 Cb -0.10 -2.05 -0.01 0.00 -1.58 0.00 0.00 42.46 38.72 3n99 s ILE 238 CO 0.03 0.58 0.39 -0.83 -1.23 0.00 0.00 174.94 173.88 3n99 s GLY 239 N -0.46 1.52 -0.06 6.18 0.00 -0.11 0.29 107.32 114.68 3n99 s GLY 239 Ca 0.06 -1.57 0.05 0.00 0.00 0.00 0.00 44.72 43.27 3n99 s GLY 239 CO 0.01 -1.09 -0.23 0.14 0.00 0.00 0.00 173.10 171.93 3n99 s VAL 240 N -3.40 1.88 0.05 1.40 1.01 0.14 -0.51 120.40 120.97 3n99 s VAL 240 Ca 0.33 -0.97 -0.31 0.00 0.00 0.00 0.00 61.98 61.03 3n99 s VAL 240 Cb 0.01 -1.60 -0.06 0.00 0.00 0.00 0.00 36.38 34.73 3n99 s VAL 240 CO 0.19 0.53 1.23 -0.69 0.00 0.00 0.00 175.10 176.36 3n99 s VAL 241 N -0.07 3.97 0.00 2.92 1.01 -0.15 -0.90 120.40 127.18 3n99 s VAL 241 Ca -0.05 1.40 0.00 0.00 0.00 0.00 0.00 61.98 63.33 3n99 s VAL 241 Cb -0.13 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.35 3n99 s VAL 241 CO 0.04 0.09 0.00 1.33 0.00 0.00 0.00 175.10 176.56 3n99 n VAL 242 N 4.05 0.00 -4.05 2.92 0.24 0.01 -0.82 118.33 120.68 3n99 n VAL 242 Ca 0.10 -0.05 -0.10 0.00 -2.04 0.00 0.00 64.34 62.24 3n99 n VAL 242 Cb 0.46 0.54 -0.07 0.00 -1.47 0.00 0.00 33.84 33.29 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 -1.80 0.62 0.91 6.34 -3.43 -1.26 -4.49 115.29 112.18 3n99 s HIS 243 Ca 0.00 -0.94 -0.14 0.00 -0.80 0.00 0.00 55.06 53.19 3n99 s HIS 243 Cb 0.00 -0.11 0.14 0.00 -1.43 0.00 0.00 32.58 31.19 3n99 s HIS 243 CO 0.00 -0.81 1.19 -1.54 -2.00 0.00 0.00 174.74 171.58 3n99 s SER 244 N -3.05 3.56 1.02 7.38 1.04 0.24 -3.40 113.70 120.50 3n99 s SER 244 Ca 0.26 0.72 -0.14 0.00 0.48 0.00 0.00 55.95 57.27 3n99 s SER 244 Cb 0.03 -1.12 0.11 0.00 0.10 0.00 0.00 66.02 65.14 3n99 s SER 244 CO 0.08 -2.49 0.53 0.00 0.98 0.00 0.00 173.24 172.33 3n99 n ALA 245 N -3.69 -2.72 -2.55 5.32 0.00 0.12 -3.77 120.51 113.23 3n99 n ALA 245 Ca 0.09 -0.86 -0.14 0.00 0.00 0.00 0.00 53.44 52.53 3n99 n ALA 245 Cb 0.60 -1.83 -0.11 0.00 0.00 0.00 0.00 19.45 18.11 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 0.74 0.80 -2.70 0.00 0.24 -1.26 -4.69 118.33 111.46 3n99 n VAL 247 Ca -0.17 -0.61 -0.30 0.00 -2.04 0.00 0.00 64.34 61.22 3n99 n VAL 247 Cb 0.57 -0.46 -0.02 0.00 -1.47 0.00 0.00 33.84 32.45 3n99 n VAL 247 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 3n99 s SER 248 N -5.44 6.47 0.17 -1.34 0.01 -1.24 -2.17 113.70 110.16 3n99 s SER 248 Ca -0.02 1.17 -0.34 0.00 1.31 0.00 0.00 55.95 58.07 3n99 s SER 248 Cb 0.10 -2.34 -0.14 0.00 0.21 0.00 0.00 66.02 63.84 3n99 s SER 248 CO 0.81 -0.48 1.57 0.00 0.41 0.00 0.00 173.24 175.55 3n99 n ALA 249 N -1.59 1.44 -0.45 1.44 0.00 -1.26 -2.08 120.51 118.01 3n99 n ALA 249 Ca 0.03 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.91 3n99 n ALA 249 Cb 0.54 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.64 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 3.33 1.06 3.72 0.00 0.00 -1.26 -4.99 105.19 107.05 3n99 n GLY 250 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 3n99 n GLY 250 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3n99 s HIS 251 N -3.06 2.63 -2.88 1.61 0.09 -0.88 -1.24 115.29 111.56 3n99 s HIS 251 Ca 0.00 -0.49 0.00 0.00 -0.00 0.00 0.00 55.06 54.57 3n99 s HIS 251 Cb 0.00 -1.77 0.00 0.00 -0.00 0.00 0.00 32.58 30.81 3n99 s HIS 251 CO 0.00 0.28 0.00 0.41 -0.00 0.00 0.00 174.74 175.43 3n99 n GLY 252 N -1.17 -1.51 3.65 -2.22 0.00 -1.24 -4.35 105.19 98.36 3n99 n GLY 252 Ca -0.02 -1.08 -0.47 0.00 0.00 0.00 0.00 46.02 44.44 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 -0.13 1.93 -2.53 1.61 -0.02 -1.05 -4.36 135.00 130.45 3n99 n PRO 253 Ca 0.00 0.70 -0.33 0.00 -2.02 0.00 0.00 63.50 61.84 3n99 n PRO 253 Cb 0.00 -2.44 -0.04 0.00 -0.02 0.00 0.00 33.50 31.00 3n99 n PRO 253 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3n99 s GLY 254 N 0.95 2.39 -0.08 -1.23 0.00 -1.22 -0.68 107.32 107.45 3n99 s GLY 254 Ca 0.81 0.49 0.01 0.00 0.00 0.00 0.00 44.72 46.03 3n99 s GLY 254 CO 0.40 0.80 -0.10 0.14 0.00 0.00 0.00 173.10 174.34 3n99 s VAL 255 N -2.15 1.04 -0.20 1.40 1.01 0.14 -0.81 120.40 120.84 3n99 s VAL 255 Ca 0.65 -0.38 -0.14 0.00 0.00 0.00 0.00 61.98 62.11 3n99 s VAL 255 Cb -0.14 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 3n99 s VAL 255 CO 0.21 0.35 0.32 -0.69 0.00 0.00 0.00 175.10 175.30 3n99 s VAL 256 N 1.08 5.25 0.10 2.92 1.01 -0.08 -1.29 120.40 129.40 3n99 s VAL 256 Ca -0.07 0.55 -0.30 0.00 0.00 0.00 0.00 61.98 62.16 3n99 s VAL 256 Cb -0.14 -3.66 -0.06 0.00 0.00 0.00 0.00 36.38 32.52 3n99 s VAL 256 CO -0.01 0.30 0.98 -0.69 0.00 0.00 0.00 175.10 175.67 3n99 s VAL 257 N 1.12 4.49 -0.11 2.92 1.01 -1.26 -0.69 120.40 127.89 3n99 s VAL 257 Ca 0.16 2.03 0.03 0.00 0.00 0.00 0.00 61.98 64.20 3n99 s VAL 257 Cb -0.14 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 31.90 3n99 s VAL 257 CO 0.06 0.29 0.11 2.30 0.00 0.00 0.00 175.10 177.87 3n99 n ILE 258 N 2.90 0.00 -3.66 2.22 -5.35 0.15 -4.44 119.36 111.18 3n99 n ILE 258 Ca 0.03 -0.33 -0.14 0.00 -0.27 0.00 0.00 62.75 62.04 3n99 n ILE 258 Cb 0.49 0.84 -0.08 0.00 -1.74 0.00 0.00 39.64 39.15 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 -1.54 0.73 -0.08 6.28 0.00 -0.93 -1.67 119.30 122.09 3n99 s MET 259 Ca 0.01 0.59 -0.20 0.00 0.00 0.00 0.00 55.69 56.09 3n99 s MET 259 Cb 0.02 0.35 0.04 0.00 0.00 0.00 0.00 34.83 35.25 3n99 s MET 259 CO 0.13 -0.13 0.47 -0.08 0.00 0.00 0.00 175.02 175.40 3n99 s THR 260 N -0.13 0.02 0.00 10.11 -1.32 0.43 -0.08 115.64 124.68 3n99 s THR 260 Ca -0.03 -0.20 0.00 0.00 -1.21 0.00 0.00 61.69 60.25 3n99 s THR 260 Cb -0.03 -0.74 0.00 0.00 -1.51 0.00 0.00 72.50 70.21 3n99 s THR 260 CO 0.03 -0.11 0.00 0.61 -2.21 0.00 0.00 174.62 172.94 3n99 n GLY 261 N 1.64 -0.71 3.72 6.08 0.00 -0.57 -0.40 105.19 114.95 3n99 n GLY 261 Ca -0.18 -0.20 -0.31 0.00 0.00 0.00 0.00 46.02 45.33 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 5.26 0.59 1.61 2.15 -1.26 -0.77 116.67 120.25 3n99 s ASP 262 Ca 0.00 -0.07 0.34 0.00 0.43 0.00 0.00 52.55 53.25 3n99 s ASP 262 Cb 0.00 -1.35 1.89 0.00 -0.30 0.00 0.00 42.92 43.16 3n99 s ASP 262 CO 0.00 0.20 2.23 1.05 -0.17 0.00 0.00 175.17 178.48 3n99 h GLU 263 N 3.58 0.00 0.00 4.34 4.11 -1.09 -0.30 114.58 125.22 3n99 h GLU 263 Ca -0.48 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 58.93 3n99 h GLU 263 Cb 1.17 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.41 3n99 h GLU 263 CO 0.62 0.03 -0.11 0.66 0.07 0.00 0.00 179.01 180.28 3n99 h SER 264 N 0.00 0.00 0.00 3.06 4.64 -1.95 -3.32 113.55 115.98 3n99 h SER 264 Ca -0.00 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.16 3n99 h SER 264 Cb 0.12 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.18 3n99 h SER 264 CO 0.00 0.11 -1.69 0.29 -0.87 0.00 0.00 176.83 174.67 3n99 n LYS 265 N -3.80 2.00 -4.82 4.77 4.76 -0.28 -4.86 118.16 115.93 3n99 n LYS 265 Ca -0.02 -0.02 -0.33 0.00 -2.87 0.00 0.00 58.31 55.07 3n99 n LYS 265 Cb 0.21 -1.27 -0.15 0.00 -1.84 0.00 0.00 35.03 31.98 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 -2.33 2.77 -0.32 -0.18 1.01 -0.30 -0.27 121.20 121.58 3n99 s ILE 266 Ca -0.05 -0.76 0.01 0.00 0.00 0.00 0.00 60.65 59.86 3n99 s ILE 266 Cb 0.04 -2.15 0.10 0.00 0.01 0.00 0.00 42.46 40.46 3n99 s ILE 266 CO 0.44 0.53 0.06 -0.76 0.00 0.00 0.00 174.94 175.21 3n99 s LEU 267 N 0.44 3.34 0.32 2.97 1.43 0.48 -4.46 118.68 123.21 3n99 s LEU 267 Ca -0.11 -1.82 -0.27 0.00 -1.03 0.00 0.00 54.13 50.90 3n99 s LEU 267 Cb -0.16 -1.22 -0.09 0.00 0.03 0.00 0.00 46.19 44.75 3n99 s LEU 267 CO 0.05 -0.38 1.00 -2.84 0.23 0.00 0.00 176.35 174.41 3n99 s PRO 268 N 1.29 4.54 -0.18 1.29 0.02 -1.26 -0.99 135.00 139.71 3n99 s PRO 268 Ca 0.09 1.50 -0.01 0.00 0.02 0.00 0.00 61.00 62.60 3n99 s PRO 268 Cb -0.18 -2.90 0.05 0.00 0.02 0.00 0.00 34.50 31.49 3n99 s PRO 268 CO -0.16 0.21 -0.02 -1.21 -0.33 0.00 0.00 177.00 175.49 3n99 s GLU 269 N -1.88 1.13 0.25 5.54 2.02 0.52 -4.87 118.70 121.41 3n99 s GLU 269 Ca 0.49 -0.53 -0.31 0.00 0.02 0.00 0.00 54.97 54.65 3n99 s GLU 269 Cb -0.23 -2.08 -0.11 0.00 0.10 0.00 0.00 34.13 31.80 3n99 s GLU 269 CO 0.30 -0.53 1.62 -2.00 0.02 0.00 0.00 175.26 174.67 3n99 s GLU 270 N 1.69 4.14 0.22 1.61 2.12 -1.25 -1.49 118.70 125.74 3n99 s GLU 270 Ca -0.01 2.55 -0.00 0.00 0.36 0.00 0.00 54.97 57.87 3n99 s GLU 270 Cb -0.16 -3.05 -0.04 0.00 0.26 0.00 0.00 34.13 31.13 3n99 s GLU 270 CO -0.07 -0.65 0.14 0.14 -0.54 0.00 0.00 175.26 174.28 3n99 s VAL 271 N 0.44 0.03 0.18 3.70 -7.23 0.91 -4.86 120.40 113.58 3n99 s VAL 271 Ca 0.67 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.89 3n99 s VAL 271 Cb -0.48 -2.51 -0.14 0.00 0.56 0.00 0.00 36.38 33.82 3n99 s VAL 271 CO 0.41 0.00 1.41 -0.08 -0.31 0.00 0.00 175.10 176.53 3n99 h GLU 272 N 2.56 0.11 -2.76 4.82 4.81 -1.94 -3.39 114.58 118.78 3n99 h GLU 272 Ca -0.35 -0.12 -0.16 0.00 -0.13 0.00 0.00 59.36 58.60 3n99 h GLU 272 Cb 1.25 0.03 -0.29 0.00 0.63 0.00 0.00 28.75 30.37 3n99 h GLU 272 CO 0.52 0.89 -0.43 0.50 -0.73 0.00 0.00 179.01 179.76 3n99 s ARG 273 N -3.19 0.26 -0.36 1.92 3.52 -1.26 -5.00 118.95 114.84 3n99 s ARG 273 Ca -0.02 0.78 0.03 0.00 -0.13 0.00 0.00 55.73 56.39 3n99 s ARG 273 Cb 0.11 0.04 0.15 0.00 -1.56 0.00 0.00 34.95 33.69 3n99 s ARG 273 CO 0.81 -0.22 0.38 0.00 -0.81 0.00 0.00 175.30 175.46 3n99 s ALA 274 N 1.98 -0.52 -0.04 6.12 0.00 -1.26 -4.98 121.76 123.05 3n99 s ALA 274 Ca -0.04 -0.83 -0.00 0.00 0.00 0.00 0.00 51.96 51.09 3n99 s ALA 274 Cb -0.11 -2.05 0.03 0.00 0.00 0.00 0.00 23.12 20.99 3n99 s ALA 274 CO -0.11 -2.08 0.00 1.21 0.00 0.00 0.00 175.76 174.79 3n99 s ASN 275 N 1.59 0.78 0.29 0.00 3.84 -1.26 -0.79 114.94 119.38 3n99 s ASN 275 Ca 0.16 -0.03 0.22 0.00 0.21 0.00 0.00 52.86 53.41 3n99 s ASN 275 Cb -0.15 -0.27 1.08 0.00 -0.55 0.00 0.00 41.25 41.36 3n99 s ASN 275 CO -0.08 -0.13 1.67 2.30 -2.79 0.00 0.00 177.10 178.07 3n99 n ILE 276 N 4.46 0.98 0.29 -5.21 -5.35 -0.55 -1.43 119.36 112.55 3n99 n ILE 276 Ca -0.20 0.55 0.18 0.00 -0.27 0.00 0.00 62.75 63.00 3n99 n ILE 276 Cb 0.50 -1.52 0.78 0.00 -1.74 0.00 0.00 39.64 37.66 3n99 n ILE 276 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 3n99 h SER 277 N 0.00 0.00 0.38 7.28 4.64 -1.90 -2.08 113.55 121.88 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 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 3n99 h SER 277 CO 0.00 0.02 0.00 0.47 -0.87 0.00 0.00 176.83 176.45 3n99 n ASP 278 N -3.14 0.45 -0.54 4.97 8.00 -0.52 -2.33 116.55 123.44 3n99 n ASP 278 Ca -0.00 0.65 0.06 0.00 0.71 0.00 0.00 54.79 56.20 3n99 n ASP 278 Cb 0.27 -0.73 0.19 0.00 -0.02 0.00 0.00 41.12 40.83 3n99 n ASP 278 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3n99 n TYR 279 N -2.04 0.22 0.00 1.24 4.01 -0.78 -5.15 117.16 114.65 3n99 n TYR 279 Ca 0.01 -1.32 0.00 0.00 -0.16 0.00 0.00 57.90 56.43 3n99 n TYR 279 Cb 0.13 -0.26 0.00 0.00 -0.31 0.00 0.00 39.34 38.90 3n99 n TYR 279 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68