#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n99 s HIS 0 N 0.00 1.32 0.34 1.61 4.02 -1.26 -5.05 115.29 116.27 3n99 s HIS 0 Ca 0.00 -0.61 -0.29 0.00 1.02 0.00 0.00 55.06 55.18 3n99 s HIS 0 Cb 0.00 -0.69 -0.11 0.00 -1.02 0.00 0.00 32.58 30.76 3n99 s HIS 0 CO 0.00 0.11 1.51 -1.33 1.02 0.00 0.00 174.74 176.06 3n99 n MET 1 N 0.38 2.65 -1.78 1.40 2.81 -1.26 -4.91 117.12 116.40 3n99 n MET 1 Ca -0.14 0.93 -0.42 0.00 -1.81 0.00 0.00 57.70 56.26 3n99 n MET 1 Cb 0.58 -2.67 -0.03 0.00 -0.71 0.00 0.00 33.22 30.39 3n99 n MET 1 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 3n99 s ARG 2 N -1.52 4.15 0.25 0.03 0.52 -1.26 -4.99 118.95 116.14 3n99 s ARG 2 Ca 0.57 2.52 0.01 0.00 -0.52 0.00 0.00 55.73 58.31 3n99 s ARG 2 Cb -0.49 -3.48 -0.05 0.00 0.52 0.00 0.00 34.95 31.45 3n99 s ARG 2 CO 0.58 -0.78 0.10 0.95 0.02 0.00 0.00 175.30 176.16 3n99 s THR 3 N 2.34 0.52 -0.35 0.02 -4.23 -1.26 -1.25 115.64 111.44 3n99 s THR 3 Ca 0.77 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 59.33 3n99 s THR 3 Cb -0.45 -2.62 0.50 0.00 1.34 0.00 0.00 72.50 71.27 3n99 s THR 3 CO 0.34 -0.01 1.59 -0.46 -0.54 0.00 0.00 174.62 175.55 3n99 n ASN 4 N -0.45 3.72 0.02 3.99 6.94 -1.03 -4.70 115.26 123.75 3n99 n ASN 4 Ca 0.00 -3.04 0.15 0.00 -0.02 0.00 0.00 54.58 51.68 3n99 n ASN 4 Cb 0.66 -0.72 0.62 0.00 -2.36 0.00 0.00 39.78 37.99 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 1.18 0.12 0.00 -3.83 2.10 -1.95 -0.54 116.57 113.65 3n99 h LYS 5 Ca 0.35 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 59.00 3n99 h LYS 5 Cb 2.16 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 33.46 3n99 h LYS 5 CO 0.69 0.08 0.00 -0.44 -2.00 0.00 0.00 179.45 177.78 3n99 h ASP 6 N 0.13 0.00 0.05 7.07 3.32 -2.02 -2.21 116.42 122.75 3n99 h ASP 6 Ca 0.21 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.26 3n99 h ASP 6 Cb 0.67 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.22 3n99 h ASP 6 CO -0.03 0.00 -0.05 0.54 -1.72 0.00 0.00 179.24 177.99 3n99 n ARG 7 N -2.89 1.42 -2.83 3.56 1.74 -0.22 -4.94 116.66 112.50 3n99 n ARG 7 Ca 0.02 -0.76 -0.35 0.00 -0.77 0.00 0.00 57.85 55.98 3n99 n ARG 7 Cb 0.32 -1.48 -0.07 0.00 -1.02 0.00 0.00 32.46 30.21 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 -2.11 4.13 -0.16 0.55 1.43 -0.83 -5.02 118.68 116.67 3n99 s LEU 8 Ca 0.36 1.71 -0.18 0.00 -1.03 0.00 0.00 54.13 55.00 3n99 s LEU 8 Cb 0.21 -4.26 -0.04 0.00 0.03 0.00 0.00 46.19 42.13 3n99 s LEU 8 CO 0.38 -0.22 0.48 -0.69 0.23 0.00 0.00 176.35 176.53 3n99 s VAL 9 N -1.91 5.16 -0.24 -1.59 1.01 -1.26 -5.06 120.40 116.50 3n99 s VAL 9 Ca 0.56 0.93 -0.08 0.00 0.00 0.00 0.00 61.98 63.38 3n99 s VAL 9 Cb -0.13 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 3n99 s VAL 9 CO 0.18 0.26 0.09 -0.60 0.00 0.00 0.00 175.10 175.03 3n99 s ARG 10 N 1.07 3.79 -0.00 2.72 3.52 -1.26 -4.61 118.95 124.17 3n99 s ARG 10 Ca 0.24 -0.42 -0.03 0.00 -0.13 0.00 0.00 55.73 55.40 3n99 s ARG 10 Cb -0.15 -3.36 -0.00 0.00 -1.56 0.00 0.00 34.95 29.87 3n99 s ARG 10 CO 0.10 -0.08 0.05 -1.50 -0.81 0.00 0.00 175.30 173.06 3n99 s ILE 11 N 1.35 0.06 -0.10 4.11 2.07 -0.63 -4.98 121.20 123.07 3n99 s ILE 11 Ca 0.05 -0.47 -0.29 0.00 -1.41 0.00 0.00 60.65 58.53 3n99 s ILE 11 Cb -0.15 -0.23 -0.04 0.00 0.13 0.00 0.00 42.46 42.17 3n99 s ILE 11 CO 0.04 -0.26 1.55 -0.94 -1.91 0.00 0.00 174.94 173.42 3n99 s SER 12 N -0.81 6.70 -0.16 4.50 1.04 -1.26 -1.34 113.70 122.37 3n99 s SER 12 Ca -0.09 2.03 -0.01 0.00 0.48 0.00 0.00 55.95 58.36 3n99 s SER 12 Cb -0.05 -2.53 -0.01 0.00 0.10 0.00 0.00 66.02 63.52 3n99 s SER 12 CO 0.00 -0.92 -0.12 -0.69 0.98 0.00 0.00 173.24 172.48 3n99 s VAL 13 N 4.04 2.94 0.06 5.02 1.01 -0.27 -4.95 120.40 128.24 3n99 s VAL 13 Ca 0.68 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 62.02 3n99 s VAL 13 Cb -0.29 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 3n99 s VAL 13 CO 0.26 0.50 0.01 0.54 0.00 0.00 0.00 175.10 176.41 3n99 s VAL 14 N 0.75 4.11 0.00 2.92 0.11 -1.26 -0.10 120.40 126.92 3n99 s VAL 14 Ca -0.05 -0.83 0.00 0.00 -2.93 0.00 0.00 61.98 58.16 3n99 s VAL 14 Cb -0.15 -2.92 0.00 0.00 -1.53 0.00 0.00 36.38 31.78 3n99 s VAL 14 CO 0.01 0.21 0.00 0.61 -3.33 0.00 0.00 175.10 172.60 3n99 n GLY 15 N 0.85 1.88 3.11 6.54 0.00 -0.45 -4.65 105.19 112.47 3n99 n GLY 15 Ca -0.12 -0.97 -0.08 0.00 0.00 0.00 0.00 46.02 44.86 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 -1.77 0.63 0.01 1.61 -1.05 0.08 -0.64 118.70 117.57 3n99 s GLU 16 Ca 0.00 -1.10 -0.30 0.00 -0.15 0.00 0.00 54.97 53.42 3n99 s GLU 16 Cb 0.00 0.23 -0.06 0.00 -0.44 0.00 0.00 34.13 33.86 3n99 s GLU 16 CO 0.00 -0.14 1.49 0.42 0.95 0.00 0.00 175.26 177.99 3n99 s ILE 17 N -3.65 3.53 0.37 1.83 1.01 -0.52 -1.12 121.20 122.64 3n99 s ILE 17 Ca 0.04 0.90 -0.24 0.00 0.00 0.00 0.00 60.65 61.35 3n99 s ILE 17 Cb 0.06 -3.58 -0.10 0.00 0.01 0.00 0.00 42.46 38.85 3n99 s ILE 17 CO -0.09 -0.01 0.95 0.00 0.00 0.00 0.00 174.94 175.78 3n99 s ALA 18 N 2.69 3.13 0.85 9.38 0.00 -0.22 -0.56 121.76 137.04 3n99 s ALA 18 Ca 0.67 0.48 -0.11 0.00 0.00 0.00 0.00 51.96 53.00 3n99 s ALA 18 Cb -0.34 -3.17 0.10 0.00 0.00 0.00 0.00 23.12 19.72 3n99 s ALA 18 CO 0.28 0.14 1.10 -1.25 0.00 0.00 0.00 175.76 176.03 3n99 s PRO 19 N -2.55 1.60 0.22 0.00 0.04 -1.26 -1.55 135.00 131.49 3n99 s PRO 19 Ca 0.55 1.09 -0.32 0.00 0.04 0.00 0.00 61.00 62.36 3n99 s PRO 19 Cb -0.15 -1.83 -0.12 0.00 0.04 0.00 0.00 34.50 32.44 3n99 s PRO 19 CO 0.19 -2.08 1.66 0.00 0.04 0.00 0.00 177.00 176.81 3n99 n ALA 20 N -3.81 2.45 -2.36 8.56 0.00 -1.26 -2.44 120.51 121.66 3n99 n ALA 20 Ca 0.08 0.40 -0.31 0.00 0.00 0.00 0.00 53.44 53.62 3n99 n ALA 20 Cb 0.54 -2.47 -0.15 0.00 0.00 0.00 0.00 19.45 17.37 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 0.72 2.08 -0.20 0.00 1.02 -0.48 -4.88 119.74 118.00 3n99 s LYS 21 Ca 0.73 -0.95 -0.11 0.00 0.02 0.00 0.00 55.97 55.66 3n99 s LYS 21 Cb -0.54 -2.08 0.06 0.00 -0.52 0.00 0.00 37.83 34.75 3n99 s LYS 21 CO 0.37 0.55 0.49 -1.64 -0.92 0.00 0.00 175.35 174.21 3n99 s MET 22 N -0.88 0.49 0.04 1.68 -1.94 -1.26 -3.74 119.30 113.69 3n99 s MET 22 Ca 0.11 0.91 0.24 0.00 -1.71 0.00 0.00 55.69 55.24 3n99 s MET 22 Cb -0.10 0.03 0.27 0.00 2.01 0.00 0.00 34.83 37.04 3n99 s MET 22 CO 0.01 -0.15 1.23 0.54 -0.01 0.00 0.00 175.02 176.63 3n99 n ARG 23 N 4.23 0.15 -3.72 2.03 1.74 -1.26 -4.90 116.66 114.94 3n99 n ARG 23 Ca -0.22 0.02 -0.12 0.00 -0.77 0.00 0.00 57.85 56.76 3n99 n ARG 23 Cb 0.56 -1.57 -0.07 0.00 -1.02 0.00 0.00 32.46 30.37 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 -3.55 -0.18 0.50 0.55 0.15 -1.26 -5.02 113.70 104.89 3n99 s SER 24 Ca 0.07 -0.16 0.19 0.00 0.70 0.00 0.00 55.95 56.76 3n99 s SER 24 Cb 0.16 0.39 1.25 0.00 -1.71 0.00 0.00 66.02 66.11 3n99 s SER 24 CO 0.75 -0.66 2.08 1.55 1.20 0.00 0.00 173.24 178.16 3n99 h PRO 25 N 3.05 0.00 -5.97 5.44 0.13 -1.97 -3.44 132.00 129.25 3n99 h PRO 25 Ca -0.32 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.20 3n99 h PRO 25 Cb 1.21 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.28 3n99 h PRO 25 CO 0.46 0.11 -0.27 0.71 -0.23 0.00 0.00 178.00 178.77 3n99 s TYR 26 N -4.64 3.66 -0.18 1.56 2.02 -1.26 -4.28 117.35 114.23 3n99 s TYR 26 Ca -0.04 0.84 -0.06 0.00 -0.37 0.00 0.00 57.07 57.44 3n99 s TYR 26 Cb 0.15 -2.18 -0.03 0.00 -0.40 0.00 0.00 41.96 39.50 3n99 s TYR 26 CO 0.65 0.63 0.02 -1.12 -1.57 0.00 0.00 175.55 174.16 3n99 s SER 27 N -1.28 5.24 -0.18 2.29 0.01 0.82 -4.94 113.70 115.66 3n99 s SER 27 Ca 0.25 -0.03 -0.20 0.00 1.31 0.00 0.00 55.95 57.27 3n99 s SER 27 Cb -0.15 -1.88 -0.03 0.00 0.21 0.00 0.00 66.02 64.17 3n99 s SER 27 CO 0.13 0.15 0.60 -0.69 0.41 0.00 0.00 173.24 173.85 3n99 s VAL 28 N 0.48 5.05 0.71 3.43 1.01 -1.26 -1.42 120.40 128.41 3n99 s VAL 28 Ca 0.00 1.15 -0.09 0.00 0.00 0.00 0.00 61.98 63.04 3n99 s VAL 28 Cb -0.13 -3.92 0.05 0.00 0.00 0.00 0.00 36.38 32.37 3n99 s VAL 28 CO 0.02 0.16 1.06 0.42 0.00 0.00 0.00 175.10 176.75 3n99 s THR 29 N 1.63 2.69 0.51 3.92 -4.23 -0.02 -3.79 115.64 116.35 3n99 s THR 29 Ca 0.29 0.01 0.35 0.00 -1.18 0.00 0.00 61.69 61.15 3n99 s THR 29 Cb -0.16 -3.18 0.38 0.00 1.34 0.00 0.00 72.50 70.88 3n99 s THR 29 CO 0.11 -0.21 2.22 0.71 -0.54 0.00 0.00 174.62 176.91 3n99 h THR 30 N -0.67 0.29 -0.07 3.99 1.35 -1.53 -1.96 112.91 114.32 3n99 h THR 30 Ca -0.45 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.20 3n99 h THR 30 Cb 1.30 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 68.87 3n99 h THR 30 CO 0.63 0.03 0.00 -0.62 -0.25 0.00 0.00 175.52 175.31 3n99 n GLU 31 N -3.44 1.40 -2.26 4.72 4.71 -1.26 -4.91 120.64 119.59 3n99 n GLU 31 Ca -0.02 -0.59 -0.07 0.00 -0.01 0.00 0.00 57.16 56.47 3n99 n GLU 31 Cb 0.15 -1.39 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 1.01 0.17 3.63 0.62 0.00 -0.74 -5.05 105.19 104.84 3n99 n GLY 32 Ca 0.17 -0.57 -0.24 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 -2.48 2.67 -0.00 2.61 -4.23 -1.26 -4.91 115.64 108.04 3n99 s THR 33 Ca 0.04 -1.97 0.04 0.00 -1.18 0.00 0.00 61.69 58.62 3n99 s THR 33 Cb -0.02 -2.79 -0.03 0.00 1.34 0.00 0.00 72.50 71.00 3n99 s THR 33 CO 0.04 -0.21 -0.11 0.68 -0.54 0.00 0.00 174.62 174.49 3n99 s VAL 34 N -2.51 3.35 -0.00 2.29 -7.23 -1.26 -0.84 120.40 114.20 3n99 s VAL 34 Ca 0.35 -0.84 0.04 0.00 -1.81 0.00 0.00 61.98 59.71 3n99 s VAL 34 Cb -0.00 -2.42 -0.01 0.00 0.56 0.00 0.00 36.38 34.51 3n99 s VAL 34 CO 0.19 0.43 -0.12 -0.13 -0.31 0.00 0.00 175.10 175.16 3n99 s ARG 35 N -1.27 0.95 -0.49 4.82 0.52 -0.50 -4.96 118.95 118.02 3n99 s ARG 35 Ca 0.15 -0.49 -0.16 0.00 -0.52 0.00 0.00 55.73 54.72 3n99 s ARG 35 Cb -0.11 -0.92 0.08 0.00 0.52 0.00 0.00 34.95 34.52 3n99 s ARG 35 CO 0.05 0.25 0.45 0.08 0.02 0.00 0.00 175.30 176.15 3n99 s VAL 36 N -0.39 5.17 0.05 3.52 1.01 -1.26 -0.13 120.40 128.37 3n99 s VAL 36 Ca 0.04 -1.06 -0.04 0.00 0.00 0.00 0.00 61.98 60.92 3n99 s VAL 36 Cb -0.05 -4.19 -0.02 0.00 0.00 0.00 0.00 36.38 32.12 3n99 s VAL 36 CO -0.00 -0.67 0.06 0.27 0.00 0.00 0.00 175.10 174.77 3n99 s ILE 37 N 1.79 0.16 0.63 2.22 -4.36 -1.26 -5.05 121.20 115.33 3n99 s ILE 37 Ca 0.05 -1.29 -0.18 0.00 -0.26 0.00 0.00 60.65 58.98 3n99 s ILE 37 Cb -0.25 -1.08 -0.02 0.00 1.25 0.00 0.00 42.46 42.37 3n99 s ILE 37 CO 0.07 -0.71 1.22 -2.84 0.24 0.00 0.00 174.94 172.92 3n99 s PRO 38 N -3.05 2.72 0.00 0.37 0.02 -1.26 -4.80 135.00 129.00 3n99 s PRO 38 Ca -0.01 1.85 0.00 0.00 0.02 0.00 0.00 61.00 62.85 3n99 s PRO 38 Cb 0.02 -1.89 0.00 0.00 0.02 0.00 0.00 34.50 32.64 3n99 s PRO 38 CO -0.07 -1.40 0.00 0.28 -0.33 0.00 0.00 177.00 175.48 3n99 n VAL 39 N -1.90 0.00 -3.20 3.83 0.31 -1.26 -1.67 118.33 114.45 3n99 n VAL 39 Ca 0.14 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.27 3n99 n VAL 39 Cb 0.49 0.00 0.03 0.00 -0.91 0.00 0.00 33.84 33.46 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 3.18 0.00 7.52 0.05 -1.25 -4.29 118.68 123.89 3n99 s LEU 40 Ca 0.00 -0.81 0.00 0.00 0.05 0.00 0.00 54.13 53.37 3n99 s LEU 40 Cb 0.00 -1.81 0.00 0.00 -2.05 0.00 0.00 46.19 42.33 3n99 s LEU 40 CO 0.00 -1.14 0.00 0.61 -0.55 0.00 0.00 176.35 175.27 3n99 n GLY 41 N -2.04 -2.20 5.62 -3.48 0.00 -1.26 -1.38 105.19 100.45 3n99 n GLY 41 Ca 0.11 -1.54 0.01 0.00 0.00 0.00 0.00 46.02 44.60 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 -0.27 -1.94 3.53 -0.02 0.00 -0.60 -4.55 105.19 101.33 3n99 n GLY 42 Ca 0.00 -1.37 -0.42 0.00 0.00 0.00 0.00 46.02 44.23 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 -0.25 4.96 -0.37 -0.61 1.01 -1.26 -1.73 121.20 122.95 3n99 s ILE 43 Ca 0.00 0.10 -0.18 0.00 0.00 0.00 0.00 60.65 60.58 3n99 s ILE 43 Cb 0.00 -4.08 0.00 0.00 0.01 0.00 0.00 42.46 38.39 3n99 s ILE 43 CO 0.00 -0.41 0.48 -0.89 0.00 0.00 0.00 174.94 174.12 3n99 s THR 44 N 2.51 5.05 0.11 2.92 2.01 -0.44 -4.96 115.64 122.83 3n99 s THR 44 Ca 0.19 0.15 0.12 0.00 0.31 0.00 0.00 61.69 62.46 3n99 s THR 44 Cb -0.15 -3.96 -0.03 0.00 0.01 0.00 0.00 72.50 68.36 3n99 s THR 44 CO 0.16 -0.25 1.49 1.88 -0.69 0.00 0.00 174.62 177.21 3n99 h TYR 45 N 8.54 0.00 0.00 4.92 0.05 -1.96 -3.34 116.97 125.18 3n99 h TYR 45 Ca -0.28 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.50 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 0.70 0.66 -0.05 0.27 -1.05 0.00 0.00 178.16 178.69 3n99 n ASN 46 N -3.47 1.64 -4.06 3.88 6.94 -1.26 -4.94 115.26 113.99 3n99 n ASN 46 Ca 0.00 -2.25 -0.30 0.00 -0.02 0.00 0.00 54.58 52.02 3n99 n ASN 46 Cb 0.72 -0.17 -0.17 0.00 -2.36 0.00 0.00 39.78 37.81 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 -1.41 1.61 0.16 3.53 1.01 -1.26 -5.12 120.40 118.91 3n99 s VAL 47 Ca 0.11 -0.69 -0.03 0.00 0.00 0.00 0.00 61.98 61.37 3n99 s VAL 47 Cb 0.10 -1.47 -0.03 0.00 0.00 0.00 0.00 36.38 34.97 3n99 s VAL 47 CO 0.01 0.46 0.14 -1.59 0.00 0.00 0.00 175.10 174.12 3n99 s LYS 48 N 1.15 1.08 0.29 2.72 -2.85 -1.26 -2.07 119.74 118.79 3n99 s LYS 48 Ca -0.02 -1.44 -0.30 0.00 -1.00 0.00 0.00 55.97 53.20 3n99 s LYS 48 Cb -0.14 0.28 -0.12 0.00 -2.06 0.00 0.00 37.83 35.79 3n99 s LYS 48 CO -0.05 -0.35 1.47 1.55 0.10 0.00 0.00 175.35 178.07 3n99 n VAL 49 N -0.18 1.23 0.00 1.79 3.14 -1.26 -1.28 118.33 121.77 3n99 n VAL 49 Ca -0.03 -0.31 0.00 0.00 -2.96 0.00 0.00 64.34 61.04 3n99 n VAL 49 Cb 0.64 -1.73 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 1.80 3.06 3.83 7.55 0.00 0.06 -4.92 105.19 116.57 3n99 n GLY 50 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 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 4.98 0.39 1.61 1.01 -0.41 -4.69 116.67 119.79 3n99 s ASP 51 Ca 0.00 1.36 -0.27 0.00 0.71 0.00 0.00 52.55 54.35 3n99 s ASP 51 Cb 0.00 -2.16 -0.09 0.00 1.01 0.00 0.00 42.92 41.68 3n99 s ASP 51 CO 0.00 -1.66 1.35 -0.55 0.21 0.00 0.00 175.17 174.51 3n99 s SER 52 N -3.97 6.34 0.47 0.27 0.15 -1.26 -0.14 113.70 115.56 3n99 s SER 52 Ca 0.59 2.75 0.30 0.00 0.70 0.00 0.00 55.95 60.30 3n99 s SER 52 Cb -0.13 -2.65 1.15 0.00 -1.71 0.00 0.00 66.02 62.68 3n99 s SER 52 CO 0.54 -0.84 1.88 0.00 1.20 0.00 0.00 173.24 176.02 3n99 h ALA 53 N 2.80 1.00 -1.86 5.45 0.00 -1.28 -3.42 119.26 121.96 3n99 h ALA 53 Ca -0.50 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 53.85 3n99 h ALA 53 Cb 1.24 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.94 3n99 h ALA 53 CO 0.63 0.00 -0.57 0.71 0.00 0.00 0.00 179.25 180.02 3n99 s TYR 54 N -3.53 2.62 0.00 0.00 1.51 -1.26 -0.63 117.35 116.06 3n99 s TYR 54 Ca 0.03 -0.43 0.00 0.00 -1.01 0.00 0.00 57.07 55.65 3n99 s TYR 54 Cb 0.09 -1.61 0.00 0.00 -0.11 0.00 0.00 41.96 40.32 3n99 s TYR 54 CO 0.53 0.38 0.00 0.41 -1.11 0.00 0.00 175.55 175.77 3n99 n GLY 55 N -1.07 1.24 3.81 0.71 0.00 -1.26 -5.02 105.19 103.59 3n99 n GLY 55 Ca -0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.00 3.79 -1.30 1.61 0.52 -1.26 -4.98 118.94 114.32 3n99 s TRP 56 Ca 0.00 1.37 -0.18 0.00 0.02 0.00 0.00 56.10 57.31 3n99 s TRP 56 Cb 0.00 -2.57 0.04 0.00 -1.15 0.00 0.00 33.47 29.78 3n99 s TRP 56 CO 0.00 0.52 1.88 0.00 0.02 0.00 0.00 176.95 179.37 3n99 n ALA 57 N 1.44 3.82 -3.60 0.98 0.00 -1.26 -4.82 120.51 117.08 3n99 n ALA 57 Ca -0.07 -3.75 -0.03 0.00 0.00 0.00 0.00 53.44 49.59 3n99 n ALA 57 Cb 0.50 -3.58 -0.02 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 4.26 -0.34 -0.06 0.00 0.00 -1.26 -4.25 107.32 105.67 3n99 s GLY 58 Ca 0.54 1.25 0.03 0.00 0.00 0.00 0.00 44.72 46.54 3n99 s GLY 58 CO 0.05 0.38 -0.14 -0.35 0.00 0.00 0.00 173.10 173.04 3n99 s ASP 59 N -2.46 1.97 -1.50 1.64 2.15 -0.67 -4.74 116.67 113.06 3n99 s ASP 59 Ca 0.11 -0.33 -0.04 0.00 0.43 0.00 0.00 52.55 52.72 3n99 s ASP 59 Cb 0.01 -0.83 0.01 0.00 -0.30 0.00 0.00 42.92 41.81 3n99 s ASP 59 CO -0.04 0.07 0.36 1.41 -0.17 0.00 0.00 175.17 176.80 3n99 n HIS 60 N 3.64 -1.64 -2.24 -5.34 8.25 -0.89 -4.09 115.22 112.92 3n99 n HIS 60 Ca -0.21 0.32 -0.41 0.00 -0.26 0.00 0.00 57.72 57.15 3n99 n HIS 60 Cb 0.52 -3.90 -0.03 0.00 1.12 0.00 0.00 29.99 27.71 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 3.30 -0.24 1.59 1.01 -1.26 -4.20 120.40 117.57 3n99 s VAL 61 Ca 0.21 1.04 -0.09 0.00 0.00 0.00 0.00 61.98 63.14 3n99 s VAL 61 Cb -0.10 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 3n99 s VAL 61 CO 0.25 0.14 0.11 -1.61 0.00 0.00 0.00 175.10 174.00 3n99 s GLU 62 N 0.12 3.86 0.52 2.72 2.02 -1.26 -1.45 118.70 125.23 3n99 s GLU 62 Ca 0.58 -0.38 -0.21 0.00 0.02 0.00 0.00 54.97 54.98 3n99 s GLU 62 Cb -0.36 -3.41 -0.06 0.00 0.10 0.00 0.00 34.13 30.40 3n99 s GLU 62 CO 0.36 -0.05 1.20 -1.25 0.02 0.00 0.00 175.26 175.55 3n99 s PRO 63 N 1.29 3.38 7.41 0.39 0.04 -1.26 -4.60 135.00 141.65 3n99 s PRO 63 Ca 0.06 1.83 0.00 0.00 0.04 0.00 0.00 61.00 62.93 3n99 s PRO 63 Cb -0.15 -2.18 0.00 0.00 0.04 0.00 0.00 34.50 32.21 3n99 s PRO 63 CO 0.05 -0.88 0.00 0.41 0.04 0.00 0.00 177.00 176.62 3n99 n GLY 64 N 0.45 2.89 3.48 0.56 0.00 -0.88 -4.46 105.19 107.24 3n99 n GLY 64 Ca 0.10 -0.25 -0.36 0.00 0.00 0.00 0.00 46.02 45.52 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 4.30 -0.09 1.61 1.01 -0.41 -1.33 120.40 125.49 3n99 s VAL 65 Ca 0.00 -0.19 -0.21 0.00 0.00 0.00 0.00 61.98 61.58 3n99 s VAL 65 Cb 0.00 -2.98 -0.04 0.00 0.00 0.00 0.00 36.38 33.36 3n99 s VAL 65 CO 0.00 0.39 0.62 -0.44 0.00 0.00 0.00 175.10 175.67 3n99 s SER 66 N 1.18 6.87 -0.15 3.32 0.01 -0.70 -0.48 113.70 123.74 3n99 s SER 66 Ca 0.04 1.04 0.01 0.00 1.31 0.00 0.00 55.95 58.35 3n99 s SER 66 Cb -0.14 -2.36 0.01 0.00 0.21 0.00 0.00 66.02 63.73 3n99 s SER 66 CO 0.03 -0.08 -0.19 -0.69 0.41 0.00 0.00 173.24 172.72 3n99 s VAL 67 N 0.79 2.34 0.36 3.43 1.01 0.13 -1.05 120.40 127.41 3n99 s VAL 67 Ca 0.33 -0.88 0.08 0.00 0.00 0.00 0.00 61.98 61.51 3n99 s VAL 67 Cb -0.17 -1.97 -0.05 0.00 0.00 0.00 0.00 36.38 34.20 3n99 s VAL 67 CO 0.15 0.53 0.14 0.00 0.00 0.00 0.00 175.10 175.92 3n99 s MET 68 N 0.85 2.29 0.72 2.72 0.23 -0.28 -0.56 119.30 125.28 3n99 s MET 68 Ca -0.05 -1.66 -0.12 0.00 -1.03 0.00 0.00 55.69 52.83 3n99 s MET 68 Cb -0.15 -2.09 0.03 0.00 -1.53 0.00 0.00 34.83 31.09 3n99 s MET 68 CO -0.02 0.04 1.09 0.00 -2.03 0.00 0.00 175.02 174.11 3n99 s ALA 69 N -2.49 2.39 0.27 3.16 0.00 -1.26 -0.74 121.76 123.09 3n99 s ALA 69 Ca 0.38 0.33 0.21 0.00 0.00 0.00 0.00 51.96 52.88 3n99 s ALA 69 Cb -0.00 -3.27 0.95 0.00 0.00 0.00 0.00 23.12 20.79 3n99 s ALA 69 CO 0.22 -1.52 1.86 0.00 0.00 0.00 0.00 175.76 176.33 3n99 h ARG 70 N -0.68 0.00 -2.35 0.00 3.08 -1.90 -3.43 114.38 109.09 3n99 h ARG 70 Ca -0.45 0.00 0.15 0.00 0.07 0.00 0.00 59.98 59.75 3n99 h ARG 70 Cb 1.23 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 31.18 3n99 h ARG 70 CO 0.53 0.28 0.48 -0.98 -1.07 0.00 0.00 179.97 179.20 3n99 s ARG 71 N -3.90 1.10 0.33 0.04 1.70 -1.26 -5.06 118.95 111.90 3n99 s ARG 71 Ca -0.01 -0.55 0.03 0.00 -0.47 0.00 0.00 55.73 54.73 3n99 s ARG 71 Cb 0.12 0.41 0.59 0.00 -0.57 0.00 0.00 34.95 35.49 3n99 s ARG 71 CO 0.66 -0.50 1.90 -0.22 -1.08 0.00 0.00 175.30 176.06 3n99 h LYS 72 N 2.00 0.62 0.00 3.89 3.64 -2.02 -1.97 116.57 122.73 3n99 h LYS 72 Ca -0.24 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.03 3n99 h LYS 72 Cb 1.24 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.95 3n99 h LYS 72 CO 0.27 0.58 -0.02 0.93 -2.27 0.00 0.00 179.45 178.94 3n99 h GLU 73 N 0.61 0.00 -0.23 1.90 3.07 -2.00 -1.73 114.58 116.20 3n99 h GLU 73 Ca 0.14 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.00 3n99 h GLU 73 Cb 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.15 3n99 h GLU 73 CO -0.00 0.02 0.00 0.39 -1.40 0.00 0.00 179.01 178.02 3n99 n GLU 74 N -4.09 1.89 -0.03 2.33 1.02 -0.74 -4.39 120.64 116.62 3n99 n GLU 74 Ca -0.03 -1.34 -0.14 0.00 -0.02 0.00 0.00 57.16 55.64 3n99 n GLU 74 Cb 0.11 -1.40 -0.11 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 2.62 0.04 -0.24 3.49 5.08 -1.39 -2.74 114.58 121.44 3n99 h GLU 75 Ca 0.00 -0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.39 3n99 h GLU 75 Cb 0.58 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.77 3n99 h GLU 75 CO 0.00 0.71 -0.20 0.82 -1.00 0.00 0.00 179.01 179.34 3n99 h ILE 76 N -0.62 0.46 -0.45 3.13 2.04 -1.77 -1.28 117.51 119.01 3n99 h ILE 76 Ca -0.00 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.80 3n99 h ILE 76 Cb 0.72 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 3n99 h ILE 76 CO 0.01 0.00 0.05 1.55 0.00 0.00 0.00 178.15 179.75 3n99 h PRO 77 N -0.20 0.72 -0.31 2.37 0.13 -1.84 -0.24 132.00 132.62 3n99 h PRO 77 Ca 0.14 -0.16 0.04 0.00 -0.87 0.00 0.00 66.00 65.14 3n99 h PRO 77 Cb 0.41 -0.10 -0.04 0.00 0.13 0.00 0.00 31.00 31.40 3n99 h PRO 77 CO -0.36 0.70 0.08 1.25 -0.23 0.00 0.00 178.00 179.44 3n99 h LEU 78 N 0.68 0.05 -0.03 1.56 5.85 -1.12 -0.99 115.31 121.32 3n99 h LEU 78 Ca 0.14 0.04 -0.17 0.00 0.84 0.00 0.00 57.88 58.74 3n99 h LEU 78 Cb 0.36 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 3n99 h LEU 78 CO 0.01 0.07 -0.80 0.24 -0.34 0.00 0.00 178.44 177.62 3n99 h MET 79 N 0.20 0.00 0.00 1.25 2.86 -0.94 -3.18 114.93 115.12 3n99 h MET 79 Ca 0.14 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.62 3n99 h MET 79 Cb 0.14 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.78 3n99 h MET 79 CO -0.17 0.80 -0.88 1.15 1.06 0.00 0.00 176.91 178.87 3n99 h THR 80 N 0.00 1.18 0.00 2.22 2.02 -0.99 -3.38 112.91 113.96 3n99 h THR 80 Ca -0.01 -2.23 -0.12 0.00 0.77 0.00 0.00 66.41 64.82 3n99 h THR 80 Cb 1.60 2.58 -0.02 0.00 -1.74 0.00 0.00 68.15 70.57 3n99 h THR 80 CO 0.10 0.40 -0.57 -0.07 0.37 0.00 0.00 175.52 175.75 3n99 h LEU 81 N -1.00 0.00 -9.40 2.58 3.38 -1.33 -3.45 115.31 106.10 3n99 h LEU 81 Ca -0.24 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.19 3n99 h LEU 81 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 3n99 h LEU 81 CO -0.15 0.57 0.81 -0.44 0.09 0.00 0.00 178.44 179.33 3n99 s SER 82 N -6.50 6.85 0.04 -0.43 0.01 -1.20 -3.97 113.70 108.50 3n99 s SER 82 Ca 0.03 2.15 0.08 0.00 1.31 0.00 0.00 55.95 59.52 3n99 s SER 82 Cb 0.08 -2.56 -0.03 0.00 0.21 0.00 0.00 66.02 63.72 3n99 s SER 82 CO 0.75 -0.70 -0.22 0.00 0.41 0.00 0.00 173.24 173.48 3n99 n ILE 84 N 1.70 0.35 0.00 0.00 5.41 0.35 -1.43 119.36 125.74 3n99 n ILE 84 Ca -0.17 -0.06 0.00 0.00 1.00 0.00 0.00 62.75 63.52 3n99 n ILE 84 Cb 0.52 -1.82 0.00 0.00 -0.71 0.00 0.00 39.64 37.63 3n99 n ILE 84 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3n99 n GLY 85 N 4.03 1.26 3.76 7.39 0.00 0.24 -0.85 105.19 121.01 3n99 n GLY 85 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 3n99 n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3n99 s ASN 86 N -1.67 5.41 0.28 1.61 0.02 -0.51 -4.62 114.94 115.45 3n99 s ASN 86 Ca 0.00 2.49 -0.29 0.00 -1.02 0.00 0.00 52.86 54.04 3n99 s ASN 86 Cb 0.00 -2.61 -0.09 0.00 0.02 0.00 0.00 41.25 38.56 3n99 s ASN 86 CO 0.00 -1.45 1.14 -0.70 0.02 0.00 0.00 177.10 176.11 3n99 s GLU 87 N -3.06 4.59 -0.05 -0.60 2.12 -1.26 -1.35 118.70 119.09 3n99 s GLU 87 Ca 0.73 1.87 0.02 0.00 0.36 0.00 0.00 54.97 57.95 3n99 s GLU 87 Cb -0.33 -3.18 0.01 0.00 0.26 0.00 0.00 34.13 30.89 3n99 s GLU 87 CO 0.38 0.13 -0.09 0.08 -0.54 0.00 0.00 175.26 175.21 3n99 s VAL 88 N -1.04 0.89 -0.07 3.70 1.01 -0.09 -1.12 120.40 123.68 3n99 s VAL 88 Ca 0.46 -0.36 0.03 0.00 0.00 0.00 0.00 61.98 62.11 3n99 s VAL 88 Cb -0.33 -0.83 0.00 0.00 0.00 0.00 0.00 36.38 35.23 3n99 s VAL 88 CO 0.42 0.29 -0.17 -0.63 0.00 0.00 0.00 175.10 175.02 3n99 s ILE 89 N 0.57 1.45 -0.03 2.22 1.01 0.16 -0.81 121.20 125.78 3n99 s ILE 89 Ca -0.10 -0.69 -0.30 0.00 0.00 0.00 0.00 60.65 59.56 3n99 s ILE 89 Cb -0.13 -1.28 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 3n99 s ILE 89 CO 0.02 0.42 1.00 -0.69 0.00 0.00 0.00 174.94 175.70 3n99 s VAL 90 N 0.38 4.79 -0.51 2.92 1.01 -0.45 -1.35 120.40 127.19 3n99 s VAL 90 Ca -0.12 2.01 0.05 0.00 0.00 0.00 0.00 61.98 63.92 3n99 s VAL 90 Cb -0.15 -4.29 0.08 0.00 0.00 0.00 0.00 36.38 32.02 3n99 s VAL 90 CO 0.04 0.11 0.87 0.23 0.00 0.00 0.00 175.10 176.36 3n99 n MET 91 N 4.24 1.24 -3.99 2.72 2.81 0.28 -0.43 117.12 123.99 3n99 n MET 91 Ca 0.07 -1.25 -0.11 0.00 -1.81 0.00 0.00 57.70 54.61 3n99 n MET 91 Cb 0.50 -1.10 -0.04 0.00 -0.71 0.00 0.00 33.22 31.87 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 -0.69 0.21 0.00 7.83 1.04 -1.24 -4.83 113.70 116.02 3n99 s SER 92 Ca 0.08 -1.11 0.00 0.00 0.48 0.00 0.00 55.95 55.39 3n99 s SER 92 Cb 0.05 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.82 3n99 s SER 92 CO 0.06 -1.28 0.00 0.61 0.98 0.00 0.00 173.24 173.61 3n99 n GLY 93 N -0.46 -2.24 0.21 7.32 0.00 -1.26 -3.85 105.19 104.90 3n99 n GLY 93 Ca -0.02 -1.54 0.15 0.00 0.00 0.00 0.00 46.02 44.61 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 -0.56 1.61 3.32 -1.98 -2.62 116.42 116.19 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 -1.93 2.87 -1.57 3.45 0.00 -1.26 -5.01 120.51 117.06 3n99 n ALA 95 Ca 0.01 -1.59 -0.57 0.00 0.00 0.00 0.00 53.44 51.29 3n99 n ALA 95 Cb 0.25 -0.87 -0.07 0.00 0.00 0.00 0.00 19.45 18.76 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 0.87 0.53 0.00 0.00 4.81 -0.99 -0.87 118.16 122.50 3n99 n LYS 96 Ca 0.23 0.19 0.00 0.00 -0.87 0.00 0.00 58.31 57.86 3n99 n LYS 96 Cb 0.79 -1.76 0.00 0.00 0.02 0.00 0.00 35.03 34.09 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 2.30 2.23 3.77 3.14 0.00 0.42 -4.99 105.19 112.07 3n99 n GLY 97 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.53 6.24 0.00 1.61 0.01 -0.05 -4.77 113.70 115.22 3n99 s SER 98 Ca 0.00 2.22 0.07 0.00 1.31 0.00 0.00 55.95 59.55 3n99 s SER 98 Cb 0.00 -2.59 -0.03 0.00 0.21 0.00 0.00 66.02 63.61 3n99 s SER 98 CO 0.00 -0.86 -0.21 -0.13 0.41 0.00 0.00 173.24 172.45 3n99 s ARG 99 N -2.76 2.14 0.00 12.44 0.52 -1.26 -1.34 118.95 128.69 3n99 s ARG 99 Ca 0.64 -0.92 0.00 0.00 -0.52 0.00 0.00 55.73 54.93 3n99 s ARG 99 Cb -0.26 -2.16 0.00 0.00 0.52 0.00 0.00 34.95 33.05 3n99 s ARG 99 CO 0.31 0.56 0.00 0.41 0.02 0.00 0.00 175.30 176.61 3n99 n GLY 100 N 2.00 3.77 3.00 -3.53 0.00 0.01 -4.63 105.19 105.82 3n99 n GLY 100 Ca -0.16 -1.30 -0.15 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 -3.30 0.55 0.08 1.61 0.08 -0.63 -0.91 117.98 115.46 3n99 s PHE 101 Ca 0.00 -0.23 -0.31 0.00 0.12 0.00 0.00 56.93 56.51 3n99 s PHE 101 Cb 0.00 -0.34 -0.07 0.00 -0.57 0.00 0.00 43.02 42.04 3n99 s PHE 101 CO 0.00 -0.03 1.32 0.08 -0.10 0.00 0.00 175.22 176.49 3n99 s VAL 102 N -0.56 3.63 -0.14 -0.44 1.01 -0.46 -0.55 120.40 122.90 3n99 s VAL 102 Ca -0.02 1.15 0.19 0.00 0.00 0.00 0.00 61.98 63.30 3n99 s VAL 102 Cb -0.05 -3.74 -0.28 0.00 0.00 0.00 0.00 36.38 32.32 3n99 s VAL 102 CO 0.00 0.08 0.45 0.35 0.00 0.00 0.00 175.10 175.98 3n99 n THR 103 N 4.05 0.00 -1.08 3.92 -2.24 0.35 -0.60 114.28 118.69 3n99 n THR 103 Ca 0.11 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 3n99 n THR 103 Cb 0.44 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 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 1.44 -1.34 3.39 3.38 0.00 -1.19 -4.84 105.19 106.04 3n99 n GLY 104 Ca -0.02 -0.99 -0.15 0.00 0.00 0.00 0.00 46.02 44.85 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 -1.42 0.96 -0.11 1.61 -2.85 -1.26 -0.68 119.74 115.99 3n99 s LYS 105 Ca 0.00 -0.10 -0.03 0.00 -1.00 0.00 0.00 55.97 54.84 3n99 s LYS 105 Cb 0.00 0.44 0.04 0.00 -2.06 0.00 0.00 37.83 36.25 3n99 s LYS 105 CO 0.00 -0.32 0.07 -1.58 0.10 0.00 0.00 175.35 173.62 3n99 s HIS 106 N -1.87 0.23 0.56 1.78 2.46 0.68 -4.15 115.29 114.98 3n99 s HIS 106 Ca -0.09 -0.08 -0.12 0.00 0.47 0.00 0.00 55.06 55.24 3n99 s HIS 106 Cb -0.01 -0.63 -0.05 0.00 -0.13 0.00 0.00 32.58 31.75 3n99 s HIS 106 CO 0.03 -0.36 0.98 0.20 -2.47 0.00 0.00 174.74 173.12 3n99 s GLY 107 N 2.12 1.80 0.00 1.59 0.00 -1.26 -1.05 107.32 110.52 3n99 s GLY 107 Ca 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 44.72 44.72 3n99 s GLY 107 CO -0.06 0.23 0.00 0.61 0.00 0.00 0.00 173.10 173.88 3n99 n GLY 108 N -2.24 1.18 0.26 0.20 0.00 -1.26 -4.36 105.19 98.98 3n99 n GLY 108 Ca 0.06 -0.70 0.18 0.00 0.00 0.00 0.00 46.02 45.55 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 -5.17 1.61 -1.51 -2.04 -3.47 116.25 105.67 3n99 h VAL 109 Ca 0.00 -0.28 -0.09 0.00 -1.23 0.00 0.00 66.70 65.10 3n99 h VAL 109 Cb 0.00 1.20 0.07 0.00 -2.13 0.00 0.00 31.29 30.43 3n99 h VAL 109 CO 0.00 0.00 -0.31 0.59 -1.23 0.00 0.00 177.57 176.62 3n99 n ASN 110 N -2.89 -6.82 -4.51 4.19 3.02 -0.82 -4.94 115.26 102.49 3n99 n ASN 110 Ca -0.00 -0.30 -0.31 0.00 -0.03 0.00 0.00 54.58 53.94 3n99 n ASN 110 Cb 0.20 -4.84 -0.12 0.00 -0.61 0.00 0.00 39.78 34.42 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 -3.14 2.67 -0.12 3.10 3.76 -0.22 -4.49 115.29 116.85 3n99 s HIS 111 Ca 0.17 -0.18 -0.03 0.00 -0.15 0.00 0.00 55.06 54.86 3n99 s HIS 111 Cb -0.02 -1.50 -0.03 0.00 1.11 0.00 0.00 32.58 32.14 3n99 s HIS 111 CO 0.67 0.31 0.00 0.08 -0.85 0.00 0.00 174.74 174.95 3n99 s VAL 112 N -0.99 4.29 -0.12 -0.90 1.01 0.28 -0.23 120.40 123.74 3n99 s VAL 112 Ca 0.16 -0.24 -0.03 0.00 0.00 0.00 0.00 61.98 61.88 3n99 s VAL 112 Cb -0.11 -2.84 -0.03 0.00 0.00 0.00 0.00 36.38 33.40 3n99 s VAL 112 CO 0.07 0.55 -0.03 -0.76 0.00 0.00 0.00 175.10 174.94 3n99 s LEU 113 N -0.36 3.35 -0.02 3.92 1.43 0.15 0.20 118.68 127.35 3n99 s LEU 113 Ca 0.07 -0.03 0.02 0.00 -1.03 0.00 0.00 54.13 53.17 3n99 s LEU 113 Cb -0.12 -1.79 0.00 0.00 0.03 0.00 0.00 46.19 44.31 3n99 s LEU 113 CO 0.02 0.26 -0.09 -0.69 0.23 0.00 0.00 176.35 176.08 3n99 s VAL 114 N -0.17 0.72 -0.25 -1.59 1.01 0.36 -0.50 120.40 119.99 3n99 s VAL 114 Ca 0.04 -0.35 -0.11 0.00 0.00 0.00 0.00 61.98 61.55 3n99 s VAL 114 Cb -0.13 -0.63 -0.05 0.00 0.00 0.00 0.00 36.38 35.57 3n99 s VAL 114 CO 0.02 0.22 0.20 -2.28 0.00 0.00 0.00 175.10 173.27 3n99 s HIS 115 N 0.06 3.28 0.23 5.22 2.46 0.29 -1.29 115.29 125.55 3n99 s HIS 115 Ca -0.01 0.24 0.10 0.00 0.47 0.00 0.00 55.06 55.85 3n99 s HIS 115 Cb -0.07 -2.35 -0.04 0.00 -0.13 0.00 0.00 32.58 29.99 3n99 s HIS 115 CO 0.00 -0.03 -0.07 -0.06 -2.47 0.00 0.00 174.74 172.10 3n99 s PHE 116 N 1.38 2.61 0.75 3.88 0.08 -1.26 -1.60 117.98 123.81 3n99 s PHE 116 Ca 0.09 -0.24 -0.14 0.00 0.12 0.00 0.00 56.93 56.76 3n99 s PHE 116 Cb -0.15 -1.21 0.05 0.00 -0.57 0.00 0.00 43.02 41.15 3n99 s PHE 116 CO 0.07 0.58 1.18 -1.21 -0.10 0.00 0.00 175.22 175.74 3n99 s GLU 117 N -3.26 2.10 0.26 0.44 0.41 -1.26 -4.89 118.70 112.50 3n99 s GLU 117 Ca 0.28 1.63 -0.01 0.00 -0.41 0.00 0.00 54.97 56.46 3n99 s GLU 117 Cb -0.07 -1.84 0.50 0.00 -1.78 0.00 0.00 34.13 30.93 3n99 s GLU 117 CO 0.17 -1.84 1.79 1.49 -0.49 0.00 0.00 175.26 176.38 3n99 h GLU 118 N -0.52 0.71 -0.46 1.61 4.81 -2.01 -2.04 114.58 116.69 3n99 h GLU 118 Ca -0.47 -0.04 0.06 0.00 -0.13 0.00 0.00 59.36 58.78 3n99 h GLU 118 Cb 1.28 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 30.47 3n99 h GLU 118 CO 0.49 0.47 0.31 0.93 -0.73 0.00 0.00 179.01 180.48 3n99 h GLU 119 N 0.74 0.35 -0.07 1.92 3.07 -2.04 -2.41 114.58 116.14 3n99 h GLU 119 Ca 0.45 -0.02 -0.11 0.00 -0.50 0.00 0.00 59.36 59.18 3n99 h GLU 119 Cb 0.55 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.36 3n99 h GLU 119 CO -0.31 0.23 -0.46 0.28 -1.40 0.00 0.00 179.01 177.35 3n99 h VAL 120 N 0.36 1.33 -0.56 3.13 2.07 -1.72 -3.34 116.25 117.53 3n99 h VAL 120 Ca 0.20 -1.63 -0.02 0.00 0.82 0.00 0.00 66.70 66.07 3n99 h VAL 120 Cb 0.33 1.79 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 3n99 h VAL 120 CO -0.05 0.48 0.28 -0.07 0.02 0.00 0.00 177.57 178.23 3n99 h LEU 121 N 0.14 0.70 -1.80 2.57 3.38 -1.51 -1.88 115.31 116.92 3n99 h LEU 121 Ca 0.01 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 3n99 h LEU 121 Cb 0.87 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 3n99 h LEU 121 CO 0.07 0.60 -0.15 1.23 0.09 0.00 0.00 178.44 180.27 3n99 h GLY 122 N 0.88 0.00 0.74 0.83 0.00 -1.72 -2.90 103.07 100.90 3n99 h GLY 122 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 3n99 h GLY 122 CO -0.03 0.00 -0.50 0.28 0.00 0.00 0.00 176.54 176.30 3n99 n LYS 123 N -3.76 0.18 -2.55 4.80 5.02 -0.71 -4.96 118.16 116.18 3n99 n LYS 123 Ca -0.02 -0.11 -0.32 0.00 -2.02 0.00 0.00 58.31 55.85 3n99 n LYS 123 Cb 0.26 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.73 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 -2.90 3.70 0.02 -0.35 1.43 -1.10 -4.07 118.68 115.41 3n99 s LEU 124 Ca 0.13 1.45 0.01 0.00 -1.03 0.00 0.00 54.13 54.69 3n99 s LEU 124 Cb 0.18 -4.37 -0.01 0.00 0.03 0.00 0.00 46.19 42.02 3n99 s LEU 124 CO 0.68 -0.52 -0.05 -0.32 0.23 0.00 0.00 176.35 176.37 3n99 s MET 125 N -3.97 0.38 0.34 1.70 -2.45 -1.26 -5.06 119.30 108.98 3n99 s MET 125 Ca 0.57 -0.47 -0.29 0.00 -1.25 0.00 0.00 55.69 54.25 3n99 s MET 125 Cb -0.10 -0.19 -0.11 0.00 1.25 0.00 0.00 34.83 35.68 3n99 s MET 125 CO 0.31 0.04 1.50 0.28 1.05 0.00 0.00 175.02 178.19 3n99 n VAL 126 N 2.11 1.62 0.00 10.11 0.31 -1.26 -1.56 118.33 129.66 3n99 n VAL 126 Ca -0.19 -0.41 0.00 0.00 -0.01 0.00 0.00 64.34 63.73 3n99 n VAL 126 Cb 0.56 -1.91 0.00 0.00 -0.91 0.00 0.00 33.84 31.58 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 1.13 2.91 3.70 2.92 0.00 0.28 -4.92 105.19 111.22 3n99 n GLY 127 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 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 2.62 -4.75 1.61 8.00 -0.60 -4.48 116.55 118.95 3n99 n ASP 128 Ca 0.00 1.12 -0.40 0.00 0.71 0.00 0.00 54.79 56.22 3n99 n ASP 128 Cb 0.00 -1.50 -0.06 0.00 -0.02 0.00 0.00 41.12 39.54 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 -2.19 4.79 -0.05 -1.24 1.02 -1.26 -1.44 119.74 119.38 3n99 s LYS 129 Ca 0.60 1.45 0.04 0.00 0.02 0.00 0.00 55.97 58.08 3n99 s LYS 129 Cb -0.51 -3.30 0.00 0.00 -0.52 0.00 0.00 37.83 33.50 3n99 s LYS 129 CO 0.58 0.45 -0.16 0.42 -0.92 0.00 0.00 175.35 175.73 3n99 s ILE 130 N -0.88 1.33 -0.19 2.17 -1.09 0.19 -0.56 121.20 122.17 3n99 s ILE 130 Ca 0.42 -0.65 -0.02 0.00 -2.23 0.00 0.00 60.65 58.18 3n99 s ILE 130 Cb -0.25 -1.16 -0.00 0.00 -1.58 0.00 0.00 42.46 39.47 3n99 s ILE 130 CO 0.31 0.39 -0.11 -0.22 -1.23 0.00 0.00 174.94 174.08 3n99 s LEU 131 N 0.18 2.61 -0.21 2.97 2.96 -0.45 -1.34 118.68 125.40 3n99 s LEU 131 Ca -0.06 -0.46 -0.06 0.00 -0.22 0.00 0.00 54.13 53.32 3n99 s LEU 131 Cb -0.12 -1.63 -0.03 0.00 0.50 0.00 0.00 46.19 44.91 3n99 s LEU 131 CO 0.03 0.02 0.03 -0.63 -1.32 0.00 0.00 176.35 174.48 3n99 s ILE 132 N 1.21 4.19 -1.18 6.68 1.01 0.85 -0.67 121.20 133.29 3n99 s ILE 132 Ca 0.02 -0.23 -0.17 0.00 0.00 0.00 0.00 60.65 60.27 3n99 s ILE 132 Cb -0.14 -2.91 0.11 0.00 0.01 0.00 0.00 42.46 39.52 3n99 s ILE 132 CO -0.04 0.40 1.52 -0.54 0.00 0.00 0.00 174.94 176.28 3n99 s LYS 133 N 1.09 3.92 0.07 2.79 1.02 -0.28 -1.12 119.74 127.23 3n99 s LYS 133 Ca 0.03 -2.05 -0.31 0.00 0.02 0.00 0.00 55.97 53.67 3n99 s LYS 133 Cb -0.14 -5.27 -0.07 0.00 -0.52 0.00 0.00 37.83 31.82 3n99 s LYS 133 CO 0.02 -2.02 1.49 0.00 -0.92 0.00 0.00 175.35 173.92 3n99 s ALA 134 N 3.24 3.64 -0.30 5.17 0.00 -0.45 -4.32 121.76 128.72 3n99 s ALA 134 Ca 0.46 1.09 -0.07 0.00 0.00 0.00 0.00 51.96 53.44 3n99 s ALA 134 Cb 0.00 -3.61 0.15 0.00 0.00 0.00 0.00 23.12 19.66 3n99 s ALA 134 CO 0.01 -0.88 0.65 -0.46 0.00 0.00 0.00 175.76 175.07 3n99 s TRP 135 N 2.02 -1.40 0.00 0.00 -0.00 -1.25 -1.60 118.94 116.70 3n99 s TRP 135 Ca 0.68 2.06 0.00 0.00 -0.00 0.00 0.00 56.10 58.84 3n99 s TRP 135 Cb -0.37 0.71 0.00 0.00 -0.00 0.00 0.00 33.47 33.81 3n99 s TRP 135 CO 0.30 -0.72 0.00 0.41 -0.00 0.00 0.00 176.95 176.93 3n99 n GLY 136 N 5.43 0.95 3.75 5.86 0.00 -1.26 -4.21 105.19 115.70 3n99 n GLY 136 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 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 4.37 0.00 1.61 -1.52 -1.26 -2.24 119.66 120.62 3n99 s GLN 137 Ca 0.00 2.12 0.00 0.00 -1.95 0.00 0.00 55.36 55.53 3n99 s GLN 137 Cb 0.00 -3.15 0.00 0.00 -0.22 0.00 0.00 33.01 29.64 3n99 s GLN 137 CO 0.00 -0.24 0.00 0.41 -0.25 0.00 0.00 175.29 175.21 3n99 n GLY 138 N 1.92 0.25 3.77 3.09 0.00 -1.26 -4.75 105.19 108.22 3n99 n GLY 138 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 3n99 n GLY 138 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3n99 s LEU 139 N 0.00 4.34 -0.01 0.99 2.96 -0.95 -4.95 118.68 121.06 3n99 s LEU 139 Ca 0.00 2.98 0.00 0.00 -0.22 0.00 0.00 54.13 56.89 3n99 s LEU 139 Cb 0.00 -3.66 0.01 0.00 0.50 0.00 0.00 46.19 43.04 3n99 s LEU 139 CO 0.00 -0.82 0.00 -0.54 -1.32 0.00 0.00 176.35 173.67 3n99 s LYS 140 N -1.86 0.06 -0.61 1.98 1.02 -1.26 -4.43 119.74 114.65 3n99 s LYS 140 Ca 0.53 0.04 -0.23 0.00 0.02 0.00 0.00 55.97 56.33 3n99 s LYS 140 Cb -0.45 -0.15 0.06 0.00 -0.52 0.00 0.00 37.83 36.76 3n99 s LYS 140 CO 0.60 -0.05 0.95 -0.51 -0.92 0.00 0.00 175.35 175.43 3n99 s LEU 141 N 0.36 4.23 0.40 3.17 1.43 -1.26 -2.47 118.68 124.54 3n99 s LEU 141 Ca -0.03 -0.68 0.12 0.00 -1.03 0.00 0.00 54.13 52.50 3n99 s LEU 141 Cb -0.05 -2.60 0.84 0.00 0.03 0.00 0.00 46.19 44.41 3n99 s LEU 141 CO -0.01 -1.34 1.93 -0.07 0.23 0.00 0.00 176.35 177.08 3n99 h LEU 142 N 11.20 0.12 -0.30 1.79 3.38 -1.52 -0.32 115.31 129.66 3n99 h LEU 142 Ca -0.28 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.67 3n99 h LEU 142 Cb 1.07 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.79 3n99 h LEU 142 CO 1.14 0.32 -0.04 0.47 0.09 0.00 0.00 178.44 180.41 3n99 n ASP 143 N -4.26 0.51 -3.22 -0.43 8.00 -1.26 -4.47 116.55 111.41 3n99 n ASP 143 Ca -0.01 -0.90 -0.24 0.00 0.71 0.00 0.00 54.79 54.34 3n99 n ASP 143 Cb 0.28 -0.04 -0.07 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 -0.74 -0.10 0.13 1.24 8.25 -0.13 -4.98 115.22 118.89 3n99 n HIS 144 Ca 0.19 -3.59 0.18 0.00 -0.26 0.00 0.00 57.72 54.24 3n99 n HIS 144 Cb 0.23 -0.33 0.76 0.00 1.12 0.00 0.00 29.99 31.77 3n99 n HIS 144 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3n99 h PRO 145 N 4.10 0.00 -0.19 -0.41 0.13 -1.78 -1.10 132.00 132.76 3n99 h PRO 145 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 3n99 h PRO 145 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 3n99 h PRO 145 CO 0.48 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.00 3n99 n ASP 146 N -3.98 2.39 -4.43 1.44 8.00 -1.26 -4.74 116.55 113.98 3n99 n ASP 146 Ca 0.05 -1.81 -0.38 0.00 0.71 0.00 0.00 54.79 53.35 3n99 n ASP 146 Cb 0.45 -0.11 -0.12 0.00 -0.02 0.00 0.00 41.12 41.32 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 4.52 -0.01 2.53 1.01 -0.42 -4.61 120.40 121.66 3n99 s VAL 147 Ca 0.34 -0.45 -0.13 0.00 0.00 0.00 0.00 61.98 61.75 3n99 s VAL 147 Cb 0.20 -3.31 -0.05 0.00 0.00 0.00 0.00 36.38 33.22 3n99 s VAL 147 CO 0.30 0.07 0.36 -0.54 0.00 0.00 0.00 175.10 175.29 3n99 s LYS 148 N 1.60 3.81 0.19 2.72 -0.14 -0.27 -4.61 119.74 123.04 3n99 s LYS 148 Ca 0.04 0.29 0.11 0.00 -1.36 0.00 0.00 55.97 55.05 3n99 s LYS 148 Cb -0.17 -3.19 -0.04 0.00 -1.68 0.00 0.00 37.83 32.75 3n99 s LYS 148 CO 0.06 0.69 -0.23 0.14 -0.76 0.00 0.00 175.35 175.25 3n99 s VAL 149 N -1.11 2.25 0.09 3.17 -7.23 -1.26 -0.75 120.40 115.57 3n99 s VAL 149 Ca 0.23 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 58.14 3n99 s VAL 149 Cb -0.16 -2.07 0.08 0.00 0.56 0.00 0.00 36.38 34.80 3n99 s VAL 149 CO 0.12 -0.14 0.98 0.00 -0.31 0.00 0.00 175.10 175.75 3n99 s MET 150 N -2.67 1.00 -0.79 4.82 0.23 -0.84 -4.70 119.30 116.36 3n99 s MET 150 Ca 0.20 -0.52 0.00 0.00 -1.03 0.00 0.00 55.69 54.34 3n99 s MET 150 Cb -0.08 0.37 0.00 0.00 -1.53 0.00 0.00 34.83 33.59 3n99 s MET 150 CO 0.09 -0.46 0.00 0.09 -2.03 0.00 0.00 175.02 172.72 3n99 n ASN 151 N -0.41 -5.82 -3.93 -1.18 3.02 -1.26 -4.29 115.26 101.39 3n99 n ASN 151 Ca -0.07 0.18 -0.21 0.00 -0.03 0.00 0.00 54.58 54.46 3n99 n ASN 151 Cb 0.61 -3.97 -0.16 0.00 -0.61 0.00 0.00 39.78 35.65 3n99 n ASN 151 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 3n99 s ILE 152 N -1.63 0.67 0.12 2.41 1.10 -1.26 -0.49 121.20 122.11 3n99 s ILE 152 Ca 0.00 -0.22 -0.33 0.00 -0.51 0.00 0.00 60.65 59.59 3n99 s ILE 152 Cb 0.00 -0.66 -0.13 0.00 0.15 0.00 0.00 42.46 41.82 3n99 s ILE 152 CO 0.00 0.25 1.69 -0.67 -2.11 0.00 0.00 174.94 174.10 3n99 n ASP 153 N 3.90 3.43 0.24 4.50 -0.08 -0.03 -4.57 116.55 123.93 3n99 n ASP 153 Ca -0.24 1.05 0.08 0.00 -1.51 0.00 0.00 54.79 54.16 3n99 n ASP 153 Cb 0.51 -1.46 0.59 0.00 2.34 0.00 0.00 41.12 43.10 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 6.98 0.00 -0.09 -0.67 0.11 -1.90 -0.42 132.00 136.00 3n99 h PRO 154 Ca -0.45 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.47 3n99 h PRO 154 Cb 1.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 3n99 h PRO 154 CO 0.92 0.17 -0.73 -0.44 -0.21 0.00 0.00 178.00 177.71 3n99 h ASP 155 N 0.00 0.55 -0.01 -2.05 3.32 -1.95 -2.95 116.42 113.33 3n99 h ASP 155 Ca -0.00 -0.36 -0.13 0.00 0.02 0.00 0.00 57.03 56.56 3n99 h ASP 155 Cb 0.34 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 3n99 h ASP 155 CO 0.02 1.10 -0.42 0.25 -1.72 0.00 0.00 179.24 178.47 3n99 h LEU 156 N 0.32 0.57 -1.40 1.55 5.85 -1.70 -3.11 115.31 117.39 3n99 h LEU 156 Ca -0.03 -0.26 0.02 0.00 0.84 0.00 0.00 57.88 58.45 3n99 h LEU 156 Cb 1.31 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.15 3n99 h LEU 156 CO 0.13 0.92 0.42 0.15 -0.34 0.00 0.00 178.44 179.71 3n99 h PHE 157 N 0.44 0.76 0.00 1.25 3.57 -1.02 -0.05 116.94 121.89 3n99 h PHE 157 Ca 0.03 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.55 3n99 h PHE 157 Cb 0.92 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 39.40 3n99 h PHE 157 CO 0.04 0.47 0.00 0.39 -2.23 0.00 0.00 178.31 176.98 3n99 n GLU 158 N -4.45 0.20 -0.13 1.11 1.02 -1.12 -2.94 120.64 114.33 3n99 n GLU 158 Ca 0.07 0.13 0.07 0.00 -0.02 0.00 0.00 57.16 57.41 3n99 n GLU 158 Cb 0.07 -1.50 0.14 0.00 -0.02 0.00 0.00 31.44 30.13 3n99 n GLU 158 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3n99 n LYS 159 N -1.33 2.12 0.00 3.49 5.02 -0.04 -4.61 118.16 122.81 3n99 n LYS 159 Ca 0.08 -1.84 0.15 0.00 -2.02 0.00 0.00 58.31 54.67 3n99 n LYS 159 Cb 0.16 -1.30 0.84 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 0.73 0.02 -0.04 -0.35 4.77 -1.15 -4.90 117.00 116.08 3n99 n LEU 160 Ca 0.12 0.14 -0.01 0.00 -0.03 0.00 0.00 56.01 56.23 3n99 n LEU 160 Cb 0.41 -0.15 -0.00 0.00 -2.33 0.00 0.00 43.42 41.35 3n99 n LEU 160 CO 0.09 0.00 -0.01 0.61 -1.33 0.00 0.00 177.39 176.76 3n99 n GLY 161 N 1.15 0.46 3.74 -0.72 0.00 -1.26 -4.72 105.19 103.84 3n99 n GLY 161 Ca 0.19 -0.65 -0.41 0.00 0.00 0.00 0.00 46.02 45.15 3n99 n GLY 161 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3n99 s ILE 162 N -2.00 3.46 -0.08 -0.61 1.01 -1.26 -4.56 121.20 117.16 3n99 s ILE 162 Ca 0.00 1.23 0.01 0.00 0.00 0.00 0.00 60.65 61.88 3n99 s ILE 162 Cb 0.00 -3.78 0.02 0.00 0.01 0.00 0.00 42.46 38.71 3n99 s ILE 162 CO 0.00 0.19 -0.08 -1.10 0.00 0.00 0.00 174.94 173.95 3n99 s GLN 163 N -0.23 1.38 -0.28 2.79 -0.21 -0.83 -4.98 119.66 117.30 3n99 s GLN 163 Ca 0.54 -0.26 -0.22 0.00 0.02 0.00 0.00 55.36 55.44 3n99 s GLN 163 Cb -0.34 -1.32 -0.01 0.00 1.00 0.00 0.00 33.01 32.34 3n99 s GLN 163 CO 0.37 -0.12 0.70 -2.00 -2.12 0.00 0.00 175.29 172.12 3n99 s GLU 164 N 1.18 4.02 -0.04 2.91 2.12 -1.26 -0.33 118.70 127.30 3n99 s GLU 164 Ca -0.06 0.54 -0.02 0.00 0.36 0.00 0.00 54.97 55.80 3n99 s GLU 164 Cb -0.14 -3.69 0.03 0.00 0.26 0.00 0.00 34.13 30.59 3n99 s GLU 164 CO -0.02 -0.54 0.07 0.21 -0.54 0.00 0.00 175.26 174.44 3n99 s LYS 165 N 2.69 -0.04 -1.47 4.30 2.20 -0.10 -4.87 119.74 122.45 3n99 s LYS 165 Ca 0.29 0.35 -0.06 0.00 -0.36 0.00 0.00 55.97 56.19 3n99 s LYS 165 Cb -0.15 -0.38 0.04 0.00 -1.51 0.00 0.00 37.83 35.83 3n99 s LYS 165 CO 0.10 -0.27 0.60 0.09 -0.36 0.00 0.00 175.35 175.52 3n99 n ASN 166 N 4.92 -1.62 0.00 1.43 3.02 -1.26 -1.70 115.26 120.06 3n99 n ASN 166 Ca -0.12 -0.95 0.00 0.00 -0.03 0.00 0.00 54.58 53.48 3n99 n ASN 166 Cb 0.50 -3.24 0.00 0.00 -0.61 0.00 0.00 39.78 36.43 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 -1.77 1.09 3.70 7.41 0.00 -1.26 -5.02 105.19 109.33 3n99 n GLY 167 Ca -0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 3n99 n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n99 s LYS 168 N -0.16 2.74 -0.35 1.61 1.02 -0.69 -4.95 119.74 118.95 3n99 s LYS 168 Ca 0.00 -0.69 -0.10 0.00 0.02 0.00 0.00 55.97 55.20 3n99 s LYS 168 Cb 0.00 -2.64 0.02 0.00 -0.52 0.00 0.00 37.83 34.69 3n99 s LYS 168 CO 0.00 0.59 0.17 0.42 -0.92 0.00 0.00 175.35 175.61 3n99 s ILE 169 N -1.20 4.41 -0.16 2.17 1.01 0.19 -0.93 121.20 126.70 3n99 s ILE 169 Ca 0.23 -0.78 -0.17 0.00 0.00 0.00 0.00 60.65 59.92 3n99 s ILE 169 Cb -0.12 -3.40 -0.04 0.00 0.01 0.00 0.00 42.46 38.91 3n99 s ILE 169 CO 0.15 -0.13 0.46 -1.00 0.00 0.00 0.00 174.94 174.41 3n99 s HIS 170 N 1.54 3.45 -0.16 3.97 3.76 0.55 -0.43 115.29 127.98 3n99 s HIS 170 Ca 0.02 0.78 -0.00 0.00 -0.15 0.00 0.00 55.06 55.71 3n99 s HIS 170 Cb -0.19 -2.56 0.04 0.00 1.11 0.00 0.00 32.58 30.98 3n99 s HIS 170 CO 0.06 0.07 -0.06 0.08 -0.85 0.00 0.00 174.74 174.03 3n99 s VAL 171 N 1.00 1.14 0.11 -0.90 1.01 -0.30 -1.97 120.40 120.48 3n99 s VAL 171 Ca 0.23 -0.58 -0.31 0.00 0.00 0.00 0.00 61.98 61.32 3n99 s VAL 171 Cb -0.15 -1.27 -0.09 0.00 0.00 0.00 0.00 36.38 34.87 3n99 s VAL 171 CO 0.09 0.19 1.64 -2.84 0.00 0.00 0.00 175.10 174.18 3n99 s PRO 172 N 1.63 4.20 0.08 2.72 0.02 -1.26 -0.17 135.00 142.22 3n99 s PRO 172 Ca 0.02 2.36 0.01 0.00 0.02 0.00 0.00 61.00 63.41 3n99 s PRO 172 Cb -0.15 -3.45 -0.04 0.00 0.02 0.00 0.00 34.50 30.89 3n99 s PRO 172 CO -0.08 -0.70 -0.06 0.14 -0.33 0.00 0.00 177.00 175.97 3n99 s VAL 173 N 2.14 0.54 -0.84 3.83 -7.23 -0.56 -4.83 120.40 113.45 3n99 s VAL 173 Ca 0.73 -1.73 0.24 0.00 -1.81 0.00 0.00 61.98 59.41 3n99 s VAL 173 Cb -0.42 -1.42 -0.06 0.00 0.56 0.00 0.00 36.38 35.05 3n99 s VAL 173 CO 0.32 -0.81 1.22 1.33 -0.31 0.00 0.00 175.10 176.86 3n99 n VAL 174 N 0.30 0.09 -3.52 1.32 0.24 0.02 -0.76 118.33 116.02 3n99 n VAL 174 Ca -0.15 -0.10 -0.16 0.00 -2.04 0.00 0.00 64.34 61.89 3n99 n VAL 174 Cb 0.60 0.29 -0.05 0.00 -1.47 0.00 0.00 33.84 33.20 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 -3.08 -1.78 -0.29 2.33 0.00 -1.26 -4.80 121.76 112.88 3n99 s ALA 175 Ca 0.08 1.28 -0.06 0.00 0.00 0.00 0.00 51.96 53.26 3n99 s ALA 175 Cb 0.16 -0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.27 3n99 s ALA 175 CO 0.75 -0.40 0.06 0.15 0.00 0.00 0.00 175.76 176.33 3n99 s LYS 176 N -1.44 3.02 -0.23 0.00 1.02 -1.26 -1.19 119.74 119.65 3n99 s LYS 176 Ca -0.08 -0.90 -0.09 0.00 0.02 0.00 0.00 55.97 54.91 3n99 s LYS 176 Cb -0.00 -3.33 -0.04 0.00 -0.52 0.00 0.00 37.83 33.93 3n99 s LYS 176 CO 0.06 -0.46 0.13 0.42 -0.92 0.00 0.00 175.35 174.58 3n99 s ILE 177 N 1.47 5.06 0.68 2.17 1.01 0.77 -4.91 121.20 127.45 3n99 s ILE 177 Ca 0.02 0.08 -0.14 0.00 0.00 0.00 0.00 60.65 60.60 3n99 s ILE 177 Cb -0.17 -3.35 0.01 0.00 0.01 0.00 0.00 42.46 38.96 3n99 s ILE 177 CO 0.02 0.36 1.11 -2.84 0.00 0.00 0.00 174.94 173.59 3n99 s PRO 178 N 1.05 2.68 0.28 2.79 0.02 -1.26 0.20 135.00 140.75 3n99 s PRO 178 Ca 0.06 1.38 0.01 0.00 0.02 0.00 0.00 61.00 62.47 3n99 s PRO 178 Cb -0.14 -1.94 0.52 0.00 0.02 0.00 0.00 34.50 32.97 3n99 s PRO 178 CO 0.04 -1.34 1.85 0.00 -0.33 0.00 0.00 177.00 177.22 3n99 h ALA 179 N -0.16 1.50 0.00 -1.55 0.00 -1.88 -0.98 119.26 116.19 3n99 h ALA 179 Ca -0.46 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3n99 h ALA 179 Cb 1.25 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.80 3n99 h ALA 179 CO 0.53 0.28 0.00 -2.39 0.00 0.00 0.00 179.25 177.68 3n99 n HIS 180 N -4.58 0.84 1.49 0.00 1.44 -1.26 -1.53 115.22 111.62 3n99 n HIS 180 Ca 0.18 0.33 0.09 0.00 -2.01 0.00 0.00 57.72 56.31 3n99 n HIS 180 Cb 0.31 -1.04 0.41 0.00 0.12 0.00 0.00 29.99 29.79 3n99 n HIS 180 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 3n99 n MET 181 N -2.27 1.46 -3.71 -1.40 2.00 -0.37 -4.84 117.12 108.00 3n99 n MET 181 Ca 0.02 -0.70 -0.37 0.00 0.00 0.00 0.00 57.70 56.65 3n99 n MET 181 Cb 0.23 -1.34 -0.06 0.00 0.00 0.00 0.00 33.22 32.04 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 -1.85 3.76 0.00 0.03 -1.94 -0.58 0.31 119.30 119.04 3n99 s MET 182 Ca 0.29 0.05 0.00 0.00 -1.71 0.00 0.00 55.69 54.32 3n99 s MET 182 Cb 0.15 -3.25 0.00 0.00 2.01 0.00 0.00 34.83 33.73 3n99 s MET 182 CO 0.23 0.63 0.00 0.41 -0.01 0.00 0.00 175.02 176.28 3n99 n GLY 183 N 2.28 3.38 3.57 -0.03 0.00 0.13 -4.86 105.19 109.66 3n99 n GLY 183 Ca -0.17 -0.35 -0.61 0.00 0.00 0.00 0.00 46.02 44.89 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 0.41 0.00 1.61 2.88 -0.54 -1.80 113.62 116.18 3n99 n SER 184 Ca 0.00 1.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.70 3n99 n SER 184 Cb 0.00 -0.92 0.00 0.00 -0.75 0.00 0.00 64.21 62.54 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 2.23 2.25 3.62 0.46 0.00 -1.26 -1.13 105.19 111.36 3n99 n GLY 185 Ca 0.23 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.48 0.95 -0.34 -0.61 5.41 -0.74 -1.40 119.36 122.15 3n99 n ILE 186 Ca 0.00 -0.24 0.00 0.00 1.00 0.00 0.00 62.75 63.51 3n99 n ILE 186 Cb 0.00 -1.16 0.00 0.00 -0.71 0.00 0.00 39.64 37.77 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 2.06 0.81 3.76 7.39 0.00 0.12 -5.00 105.19 114.33 3n99 n GLY 187 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 3n99 n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n99 s ALA 188 N -2.76 3.15 0.49 4.61 0.00 -0.49 -4.76 121.76 121.99 3n99 s ALA 188 Ca 0.00 1.43 0.14 0.00 0.00 0.00 0.00 51.96 53.54 3n99 s ALA 188 Cb 0.00 -3.58 1.15 0.00 0.00 0.00 0.00 23.12 20.68 3n99 s ALA 188 CO 0.00 -1.23 2.10 0.66 0.00 0.00 0.00 175.76 177.28 3n99 h SER 189 N 2.13 0.06 -3.22 0.00 4.64 -1.92 -1.45 113.55 113.80 3n99 h SER 189 Ca -0.51 -0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 60.52 3n99 h SER 189 Cb 1.27 -0.01 -0.35 0.00 -0.31 0.00 0.00 62.40 63.00 3n99 h SER 189 CO 0.60 0.09 -0.63 -0.55 -0.87 0.00 0.00 176.83 175.47 3n99 s SER 190 N -7.01 0.50 0.24 4.97 0.15 -1.26 -3.57 113.70 107.73 3n99 s SER 190 Ca -0.05 0.30 0.18 0.00 0.70 0.00 0.00 55.95 57.08 3n99 s SER 190 Cb 0.17 0.21 0.92 0.00 -1.71 0.00 0.00 66.02 65.61 3n99 s SER 190 CO 0.68 -0.21 1.54 -1.54 1.20 0.00 0.00 173.24 174.92 3n99 n SER 191 N 4.96 0.46 0.08 5.45 3.41 -0.69 -1.92 113.62 125.36 3n99 n SER 191 Ca -0.12 0.69 0.12 0.00 -0.26 0.00 0.00 58.87 59.30 3n99 n SER 191 Cb 0.50 -0.76 0.45 0.00 -0.26 0.00 0.00 64.21 64.14 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 -1.72 1.94 -0.86 7.33 0.00 -1.26 -4.18 120.51 121.76 3n99 n ALA 192 Ca -0.01 -0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 3n99 n ALA 192 Cb 0.06 -1.39 0.03 0.00 0.00 0.00 0.00 19.45 18.15 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 -1.98 1.24 -3.55 0.00 3.41 -0.81 -4.10 113.62 107.83 3n99 n SER 193 Ca 0.04 -2.02 -0.10 0.00 -0.26 0.00 0.00 58.87 56.53 3n99 n SER 193 Cb 0.29 -0.14 -0.02 0.00 -0.26 0.00 0.00 64.21 64.08 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 -1.03 0.00 0.58 6.66 -1.32 -1.24 -4.65 115.64 114.64 3n99 s THR 194 Ca 0.08 -0.27 0.01 0.00 -1.21 0.00 0.00 61.69 60.30 3n99 s THR 194 Cb 0.07 -1.28 0.05 0.00 -1.51 0.00 0.00 72.50 69.83 3n99 s THR 194 CO 0.01 0.00 0.82 1.51 -2.21 0.00 0.00 174.62 174.75 3n99 s ASP 195 N -2.77 5.09 0.07 8.08 -4.77 -1.26 -4.68 116.67 116.43 3n99 s ASP 195 Ca 0.04 -0.10 -0.04 0.00 -3.30 0.00 0.00 52.55 49.15 3n99 s ASP 195 Cb -0.02 -0.68 -0.02 0.00 -1.09 0.00 0.00 42.92 41.11 3n99 s ASP 195 CO -0.07 -1.29 0.07 -0.72 0.70 0.00 0.00 175.17 173.86 3n99 s TYR 196 N -2.83 0.35 -0.12 2.11 1.13 -0.69 -4.68 117.35 112.62 3n99 s TYR 196 Ca 0.59 -0.84 -0.13 0.00 -1.41 0.00 0.00 57.07 55.28 3n99 s TYR 196 Cb -0.09 -0.24 -0.05 0.00 -1.10 0.00 0.00 41.96 40.48 3n99 s TYR 196 CO 0.40 -0.45 0.30 -0.51 -2.51 0.00 0.00 175.55 172.78 3n99 s ASP 197 N -2.85 6.52 -0.35 -0.18 1.11 -0.28 -0.60 116.67 120.04 3n99 s ASP 197 Ca 0.05 0.61 -0.29 0.00 0.18 0.00 0.00 52.55 53.11 3n99 s ASP 197 Cb 0.06 -2.19 0.02 0.00 1.07 0.00 0.00 42.92 41.88 3n99 s ASP 197 CO -0.10 0.19 1.07 -0.63 1.18 0.00 0.00 175.17 176.88 3n99 s ILE 198 N -0.07 4.47 -0.51 0.77 1.01 -0.38 -0.69 121.20 125.79 3n99 s ILE 198 Ca 0.18 1.61 -0.03 0.00 0.00 0.00 0.00 60.65 62.41 3n99 s ILE 198 Cb -0.14 -4.44 0.16 0.00 0.01 0.00 0.00 42.46 38.06 3n99 s ILE 198 CO 0.06 -0.56 2.49 1.15 0.00 0.00 0.00 174.94 178.07 3n99 n MET 199 N 7.01 2.39 -3.17 2.79 0.00 0.15 -2.67 117.12 123.60 3n99 n MET 199 Ca 0.11 -2.48 -0.40 0.00 0.00 0.00 0.00 57.70 54.94 3n99 n MET 199 Cb 0.47 -2.09 -0.06 0.00 0.00 0.00 0.00 33.22 31.54 3n99 n MET 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3n99 s ALA 200 N -2.26 3.54 0.27 3.17 0.00 -1.26 -4.86 121.76 120.35 3n99 s ALA 200 Ca 0.54 -0.32 0.19 0.00 0.00 0.00 0.00 51.96 52.37 3n99 s ALA 200 Cb 0.38 -2.90 0.83 0.00 0.00 0.00 0.00 23.12 21.43 3n99 s ALA 200 CO -0.21 -0.49 1.82 0.77 0.00 0.00 0.00 175.76 177.65 3n99 h SER 201 N 7.45 0.00 -4.37 0.00 0.02 -1.91 -3.45 113.55 111.29 3n99 h SER 201 Ca -0.33 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.36 3n99 h SER 201 Cb 1.15 0.00 -0.24 0.00 0.14 0.00 0.00 62.40 63.44 3n99 h SER 201 CO 0.76 0.33 -0.73 0.20 -1.14 0.00 0.00 176.83 176.25 3n99 s ASN 202 N -6.52 0.50 0.44 3.07 0.01 -1.26 -5.01 114.94 106.18 3n99 s ASN 202 Ca -0.01 -0.31 0.11 0.00 -0.71 0.00 0.00 52.86 51.94 3n99 s ASN 202 Cb 0.12 0.01 0.99 0.00 0.41 0.00 0.00 41.25 42.79 3n99 s ASN 202 CO 0.68 -0.11 2.06 1.55 -1.51 0.00 0.00 177.10 179.77 3n99 h PRO 203 N 5.27 0.38 -0.88 -0.60 0.13 -1.86 -1.65 132.00 132.79 3n99 h PRO 203 Ca -0.31 -0.02 0.10 0.00 -0.87 0.00 0.00 66.00 64.91 3n99 h PRO 203 Cb 1.20 -0.09 -0.06 0.00 0.13 0.00 0.00 31.00 32.18 3n99 h PRO 203 CO 0.45 0.25 0.57 0.93 -0.23 0.00 0.00 178.00 179.97 3n99 h GLU 204 N 0.39 0.81 0.00 0.86 3.07 -1.84 0.11 114.58 117.98 3n99 h GLU 204 Ca 0.14 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.95 3n99 h GLU 204 Cb 0.08 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 27.81 3n99 h GLU 204 CO -0.03 0.53 0.27 -0.44 -1.40 0.00 0.00 179.01 177.94 3n99 h ASP 205 N 0.83 0.00 -0.47 1.42 3.32 -1.61 0.28 116.42 120.19 3n99 h ASP 205 Ca 0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.46 3n99 h ASP 205 Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 3n99 h ASP 205 CO -0.18 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.52 3n99 n LEU 206 N -2.53 3.32 -2.19 1.55 4.77 0.37 -4.98 117.00 117.31 3n99 n LEU 206 Ca -0.02 -2.05 -0.16 0.00 -0.03 0.00 0.00 56.01 53.75 3n99 n LEU 206 Cb 0.31 -0.33 0.02 0.00 -2.33 0.00 0.00 43.42 41.09 3n99 n LEU 206 CO 0.11 0.81 -0.04 0.61 -1.33 0.00 0.00 177.39 177.54 3n99 n GLY 207 N 0.83 -0.22 3.13 -0.72 0.00 0.97 -4.85 105.19 104.33 3n99 n GLY 207 Ca 0.16 -0.13 -0.12 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.96 0.68 -0.08 1.61 -7.23 -1.16 -5.02 120.40 106.24 3n99 s VAL 208 Ca 0.18 -1.58 0.15 0.00 -1.81 0.00 0.00 61.98 58.92 3n99 s VAL 208 Cb -0.08 -1.24 0.06 0.00 0.56 0.00 0.00 36.38 35.68 3n99 s VAL 208 CO 0.22 -0.64 1.49 0.00 -0.31 0.00 0.00 175.10 175.86 3n99 h ALA 209 N 3.62 0.71 -2.63 1.32 0.00 -1.96 -3.04 119.26 117.28 3n99 h ALA 209 Ca -0.36 -0.47 -0.06 0.00 0.00 0.00 0.00 54.91 54.02 3n99 h ALA 209 Cb 1.18 -0.08 -0.15 0.00 0.00 0.00 0.00 17.79 18.74 3n99 h ALA 209 CO 0.54 0.64 -0.07 0.34 0.00 0.00 0.00 179.25 180.70 3n99 s ASP 210 N -6.47 -0.29 -0.06 0.00 2.15 -1.26 -4.79 116.67 105.96 3n99 s ASP 210 Ca 0.03 -0.11 0.01 0.00 0.43 0.00 0.00 52.55 52.91 3n99 s ASP 210 Cb 0.08 0.46 0.02 0.00 -0.30 0.00 0.00 42.92 43.18 3n99 s ASP 210 CO 0.74 -0.75 -0.06 -0.22 -0.17 0.00 0.00 175.17 174.71 3n99 s LEU 211 N -2.35 1.28 0.01 -1.34 2.96 -1.26 -5.02 118.68 112.97 3n99 s LEU 211 Ca -0.02 -0.17 0.02 0.00 -0.22 0.00 0.00 54.13 53.74 3n99 s LEU 211 Cb 0.00 -0.56 -0.04 0.00 0.50 0.00 0.00 46.19 46.10 3n99 s LEU 211 CO -0.07 -0.06 0.02 -0.54 -1.32 0.00 0.00 176.35 174.39 3n99 s LYS 212 N 1.08 2.82 0.13 1.98 1.02 -1.26 -0.84 119.74 124.67 3n99 s LYS 212 Ca -0.08 -0.62 -0.34 0.00 0.02 0.00 0.00 55.97 54.95 3n99 s LYS 212 Cb -0.14 -2.70 -0.14 0.00 -0.52 0.00 0.00 37.83 34.33 3n99 s LYS 212 CO -0.01 0.62 1.60 1.28 -0.92 0.00 0.00 175.35 177.92 3n99 n LEU 213 N 1.19 3.05 0.00 3.17 4.77 0.81 -1.31 117.00 128.67 3n99 n LEU 213 Ca -0.13 1.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.92 3n99 n LEU 213 Cb 0.52 -1.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.21 3n99 n LEU 213 CO 0.36 -0.31 0.00 0.61 -1.33 0.00 0.00 177.39 176.72 3n99 n GLY 214 N 3.47 0.84 3.77 -0.72 0.00 0.53 -0.76 105.19 112.32 3n99 n GLY 214 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.89 6.87 -0.11 1.61 1.01 -0.43 -1.19 116.67 121.54 3n99 s ASP 215 Ca 0.00 2.60 -0.19 0.00 0.71 0.00 0.00 52.55 55.67 3n99 s ASP 215 Cb 0.00 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.25 3n99 s ASP 215 CO 0.00 -0.46 0.52 -0.63 0.21 0.00 0.00 175.17 174.81 3n99 s ILE 216 N -1.12 5.16 0.14 0.77 1.01 -0.61 -0.83 121.20 125.72 3n99 s ILE 216 Ca 0.48 1.05 0.03 0.00 0.00 0.00 0.00 60.65 62.21 3n99 s ILE 216 Cb -0.38 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.18 3n99 s ILE 216 CO 0.50 0.31 -0.06 0.68 0.00 0.00 0.00 174.94 176.37 3n99 s VAL 217 N 0.68 0.90 -0.04 2.92 -7.23 -0.18 -0.80 120.40 116.64 3n99 s VAL 217 Ca 0.28 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.45 3n99 s VAL 217 Cb -0.16 -1.87 -0.04 0.00 0.56 0.00 0.00 36.38 34.88 3n99 s VAL 217 CO 0.12 -0.72 0.02 0.00 -0.31 0.00 0.00 175.10 174.21 3n99 s ALA 218 N -3.50 3.36 -0.28 1.32 0.00 -0.33 -1.27 121.76 121.06 3n99 s ALA 218 Ca 0.17 -0.87 -0.04 0.00 0.00 0.00 0.00 51.96 51.23 3n99 s ALA 218 Cb 0.04 -1.46 0.02 0.00 0.00 0.00 0.00 23.12 21.72 3n99 s ALA 218 CO -0.00 0.63 0.01 0.42 0.00 0.00 0.00 175.76 176.82 3n99 s ILE 219 N -1.02 3.35 0.18 0.00 1.01 0.93 -0.16 121.20 125.48 3n99 s ILE 219 Ca 0.17 -0.95 -0.30 0.00 0.00 0.00 0.00 60.65 59.58 3n99 s ILE 219 Cb -0.12 -2.75 -0.08 0.00 0.01 0.00 0.00 42.46 39.53 3n99 s ILE 219 CO 0.07 0.10 1.13 -1.10 0.00 0.00 0.00 174.94 175.14 3n99 s GLN 220 N 1.39 4.56 -1.49 2.79 -0.21 0.13 -1.53 119.66 125.29 3n99 s GLN 220 Ca 0.00 1.77 0.00 0.00 0.02 0.00 0.00 55.36 57.15 3n99 s GLN 220 Cb -0.17 -3.27 0.00 0.00 1.00 0.00 0.00 33.01 30.57 3n99 s GLN 220 CO -0.01 0.02 0.00 -0.25 -2.12 0.00 0.00 175.29 172.93 3n99 n ASP 221 N 2.42 -4.94 -4.21 5.90 8.00 0.03 -2.98 116.55 120.76 3n99 n ASP 221 Ca 0.03 0.07 -0.32 0.00 0.71 0.00 0.00 54.79 55.28 3n99 n ASP 221 Cb 0.46 -4.02 -0.17 0.00 -0.02 0.00 0.00 41.12 37.37 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 2.57 -0.14 1.24 3.76 -1.25 -1.13 115.29 117.54 3n99 s HIS 222 Ca 0.00 -1.09 -0.15 0.00 -0.15 0.00 0.00 55.06 53.67 3n99 s HIS 222 Cb 0.00 -1.72 -0.05 0.00 1.11 0.00 0.00 32.58 31.92 3n99 s HIS 222 CO 0.00 -0.45 0.35 0.34 -0.85 0.00 0.00 174.74 174.13 3n99 s ASP 223 N 0.42 6.52 -0.20 1.40 2.15 0.28 -3.30 116.67 123.94 3n99 s ASP 223 Ca -0.17 0.61 0.13 0.00 0.43 0.00 0.00 52.55 53.55 3n99 s ASP 223 Cb -0.18 -2.21 0.44 0.00 -0.30 0.00 0.00 42.92 40.67 3n99 s ASP 223 CO 0.07 0.09 1.20 0.59 -0.17 0.00 0.00 175.17 176.95 3n99 n ASN 224 N 3.48 2.28 -0.26 -0.34 3.02 -1.26 -2.30 115.26 119.87 3n99 n ASN 224 Ca -0.11 -3.48 -0.04 0.00 -0.03 0.00 0.00 54.58 50.92 3n99 n ASN 224 Cb 0.52 -0.45 0.11 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 1.34 1.02 0.00 6.41 0.02 -1.94 -3.43 113.55 116.98 3n99 h SER 225 Ca 0.04 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 3n99 h SER 225 Cb 1.27 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.54 3n99 h SER 225 CO 0.19 0.90 0.00 -1.22 -1.14 0.00 0.00 176.83 175.56 3n99 n TYR 226 N -4.29 0.00 -1.84 3.45 4.01 -1.26 -4.93 117.16 112.30 3n99 n TYR 226 Ca 0.07 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.51 3n99 n TYR 226 Cb 0.17 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.27 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 -1.14 1.62 -0.04 2.72 0.00 -1.23 -1.71 107.32 107.53 3n99 s GLY 227 Ca 0.00 -0.42 -0.23 0.00 0.00 0.00 0.00 44.72 44.07 3n99 s GLY 227 CO 0.00 -0.00 0.70 0.14 0.00 0.00 0.00 173.10 173.94 3n99 s VAL 228 N -3.40 4.97 0.00 1.40 1.01 -0.54 -4.45 120.40 119.39 3n99 s VAL 228 Ca 0.60 1.46 0.00 0.00 0.00 0.00 0.00 61.98 64.04 3n99 s VAL 228 Cb -0.12 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.22 3n99 s VAL 228 CO 0.51 0.29 0.00 0.61 0.00 0.00 0.00 175.10 176.52 3n99 n GLY 229 N 2.88 0.66 3.63 4.51 0.00 -1.24 -0.71 105.19 114.92 3n99 n GLY 229 Ca -0.02 -0.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.81 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 -4.20 3.75 0.07 1.61 2.47 -0.97 -4.80 119.74 117.66 3n99 s LYS 230 Ca 0.00 1.66 -0.31 0.00 -1.56 0.00 0.00 55.97 55.76 3n99 s LYS 230 Cb 0.00 -4.06 -0.08 0.00 -1.46 0.00 0.00 37.83 32.23 3n99 s LYS 230 CO 0.00 -1.35 1.61 -0.47 0.16 0.00 0.00 175.35 175.30 3n99 s TYR 231 N 5.38 2.55 -0.20 4.03 5.04 -1.26 -0.55 117.35 132.33 3n99 s TYR 231 Ca 0.73 0.42 -0.07 0.00 -2.44 0.00 0.00 57.07 55.71 3n99 s TYR 231 Cb -0.25 -3.92 0.10 0.00 0.35 0.00 0.00 41.96 38.23 3n99 s TYR 231 CO 0.30 -3.64 0.42 0.50 -1.34 0.00 0.00 175.55 171.80 3n99 s ARG 232 N 2.44 0.33 0.11 4.97 3.52 -0.29 -4.91 118.95 125.13 3n99 s ARG 232 Ca 0.72 1.02 -0.31 0.00 -0.13 0.00 0.00 55.73 57.03 3n99 s ARG 232 Cb -0.39 0.31 -0.09 0.00 -1.56 0.00 0.00 34.95 33.21 3n99 s ARG 232 CO 0.31 -0.27 1.69 0.21 -0.81 0.00 0.00 175.30 176.43 3n99 s LYS 233 N 2.62 4.18 0.00 5.12 2.47 -1.26 -1.53 119.74 131.34 3n99 s LYS 233 Ca -0.01 2.42 0.00 0.00 -1.56 0.00 0.00 55.97 56.83 3n99 s LYS 233 Cb -0.12 -3.47 0.00 0.00 -1.46 0.00 0.00 37.83 32.78 3n99 s LYS 233 CO -0.13 -0.74 0.00 0.41 0.16 0.00 0.00 175.35 175.05 3n99 n GLY 234 N 4.01 1.88 3.77 5.54 0.00 -1.26 -5.04 105.19 114.09 3n99 n GLY 234 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.33 2.66 0.00 4.61 0.00 -0.58 -0.22 121.76 125.89 3n99 s ALA 235 Ca 0.00 0.79 0.03 0.00 0.00 0.00 0.00 51.96 52.79 3n99 s ALA 235 Cb 0.00 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.75 3n99 s ALA 235 CO 0.00 -0.86 -0.11 0.54 0.00 0.00 0.00 175.76 175.33 3n99 s VAL 236 N -1.84 0.83 0.12 0.00 0.11 0.74 -0.79 120.40 119.57 3n99 s VAL 236 Ca 0.72 -0.58 0.10 0.00 -2.93 0.00 0.00 61.98 59.29 3n99 s VAL 236 Cb -0.24 -0.72 -0.04 0.00 -1.53 0.00 0.00 36.38 33.85 3n99 s VAL 236 CO 0.29 0.14 -0.24 -0.44 -3.33 0.00 0.00 175.10 171.52 3n99 s SER 237 N -0.49 3.48 -0.09 3.54 0.01 -0.58 -1.64 113.70 117.93 3n99 s SER 237 Ca 0.03 -0.68 0.02 0.00 1.31 0.00 0.00 55.95 56.62 3n99 s SER 237 Cb -0.05 -0.33 -0.02 0.00 0.21 0.00 0.00 66.02 65.83 3n99 s SER 237 CO -0.00 0.19 -0.14 -0.63 0.41 0.00 0.00 173.24 173.07 3n99 s ILE 238 N -1.07 3.02 0.35 1.44 -1.09 0.47 -0.05 121.20 124.28 3n99 s ILE 238 Ca 0.15 -0.70 0.04 0.00 -2.23 0.00 0.00 60.65 57.90 3n99 s ILE 238 Cb -0.10 -2.22 -0.01 0.00 -1.58 0.00 0.00 42.46 38.54 3n99 s ILE 238 CO 0.07 0.56 0.38 0.61 -1.23 0.00 0.00 174.94 175.33 3n99 n GLY 239 N 2.97 2.54 3.14 6.18 0.00 -0.39 0.01 105.19 119.63 3n99 n GLY 239 Ca -0.18 -1.78 -0.26 0.00 0.00 0.00 0.00 46.02 43.80 3n99 n GLY 239 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3n99 s VAL 240 N -3.15 1.46 -0.03 1.61 1.01 -0.11 -1.01 120.40 120.18 3n99 s VAL 240 Ca 0.36 -0.73 -0.29 0.00 0.00 0.00 0.00 61.98 61.32 3n99 s VAL 240 Cb 0.01 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 35.10 3n99 s VAL 240 CO 0.26 0.42 0.97 -0.69 0.00 0.00 0.00 175.10 176.06 3n99 s VAL 241 N 0.07 4.86 0.00 2.92 1.01 -0.01 -1.40 120.40 127.85 3n99 s VAL 241 Ca -0.05 2.01 0.00 0.00 0.00 0.00 0.00 61.98 63.94 3n99 s VAL 241 Cb -0.12 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 31.96 3n99 s VAL 241 CO 0.03 0.12 0.00 1.33 0.00 0.00 0.00 175.10 176.58 3n99 n VAL 242 N 4.08 0.00 -4.01 2.92 0.24 0.87 -0.35 118.33 122.08 3n99 n VAL 242 Ca 0.06 -0.20 -0.10 0.00 -2.04 0.00 0.00 64.34 62.06 3n99 n VAL 242 Cb 0.50 0.70 -0.06 0.00 -1.47 0.00 0.00 33.84 33.51 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 -1.36 0.48 0.92 6.34 -3.43 -1.25 -4.53 115.29 112.45 3n99 s HIS 243 Ca 0.00 -0.81 -0.14 0.00 -0.80 0.00 0.00 55.06 53.31 3n99 s HIS 243 Cb 0.00 0.02 0.15 0.00 -1.43 0.00 0.00 32.58 31.32 3n99 s HIS 243 CO 0.00 -0.87 1.20 -1.54 -2.00 0.00 0.00 174.74 171.53 3n99 s SER 244 N -3.02 3.52 1.07 7.38 1.04 -0.53 -3.16 113.70 120.00 3n99 s SER 244 Ca 0.23 0.70 -0.12 0.00 0.48 0.00 0.00 55.95 57.24 3n99 s SER 244 Cb 0.01 -1.08 0.22 0.00 0.10 0.00 0.00 66.02 65.28 3n99 s SER 244 CO 0.07 -2.52 0.99 0.00 0.98 0.00 0.00 173.24 172.76 3n99 n ALA 245 N -3.70 -2.17 -2.77 5.32 0.00 0.19 -3.85 120.51 113.54 3n99 n ALA 245 Ca 0.10 -0.93 -0.14 0.00 0.00 0.00 0.00 53.44 52.47 3n99 n ALA 245 Cb 0.60 -2.04 -0.11 0.00 0.00 0.00 0.00 19.45 17.89 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 1.29 0.35 -2.93 0.00 0.24 -1.26 -4.73 118.33 111.27 3n99 n VAL 247 Ca -0.21 -0.36 -0.29 0.00 -2.04 0.00 0.00 64.34 61.44 3n99 n VAL 247 Cb 0.55 -0.06 -0.02 0.00 -1.47 0.00 0.00 33.84 32.84 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 -4.48 6.41 0.26 -1.34 0.01 -1.25 -1.42 113.70 111.89 3n99 s SER 248 Ca 0.02 0.93 -0.31 0.00 1.31 0.00 0.00 55.95 57.91 3n99 s SER 248 Cb 0.13 -2.24 -0.12 0.00 0.21 0.00 0.00 66.02 64.00 3n99 s SER 248 CO 0.78 -0.40 1.63 0.00 0.41 0.00 0.00 173.24 175.67 3n99 n ALA 249 N -1.52 2.55 -0.97 1.44 0.00 -1.26 -2.66 120.51 118.09 3n99 n ALA 249 Ca 0.00 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.83 3n99 n ALA 249 Cb 0.54 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.52 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 2.81 0.73 3.57 0.00 0.00 -1.26 -5.00 105.19 106.04 3n99 n GLY 250 Ca 0.11 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.90 2.47 -1.13 1.61 0.09 -1.09 -1.46 115.29 112.88 3n99 s HIS 251 Ca 0.00 -0.38 0.00 0.00 -0.00 0.00 0.00 55.06 54.68 3n99 s HIS 251 Cb 0.00 -1.27 0.00 0.00 -0.00 0.00 0.00 32.58 31.31 3n99 s HIS 251 CO 0.00 0.59 0.00 0.41 -0.00 0.00 0.00 174.74 175.74 3n99 n GLY 252 N -0.82 -1.28 3.71 -2.22 0.00 -1.23 -4.45 105.19 98.91 3n99 n GLY 252 Ca -0.05 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.65 3n99 n GLY 252 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3n99 n PRO 253 N -0.00 2.69 -2.52 1.61 -0.02 -1.09 -4.45 135.00 131.22 3n99 n PRO 253 Ca 0.00 0.97 -0.32 0.00 -2.02 0.00 0.00 63.50 62.13 3n99 n PRO 253 Cb 0.00 -2.81 -0.04 0.00 -0.02 0.00 0.00 33.50 30.63 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 1.11 2.17 -0.08 -1.23 0.00 -1.19 -1.25 107.32 106.85 3n99 s GLY 254 Ca 0.75 0.26 0.01 0.00 0.00 0.00 0.00 44.72 45.74 3n99 s GLY 254 CO 0.34 0.54 -0.10 0.14 0.00 0.00 0.00 173.10 174.01 3n99 s VAL 255 N -2.48 1.07 -0.22 1.40 1.01 0.24 -0.09 120.40 121.33 3n99 s VAL 255 Ca 0.60 -0.39 -0.14 0.00 0.00 0.00 0.00 61.98 62.05 3n99 s VAL 255 Cb -0.10 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 3n99 s VAL 255 CO 0.26 0.36 0.32 -0.69 0.00 0.00 0.00 175.10 175.34 3n99 s VAL 256 N 1.10 5.25 0.14 2.92 1.01 -0.49 -1.71 120.40 128.63 3n99 s VAL 256 Ca -0.06 0.52 -0.30 0.00 0.00 0.00 0.00 61.98 62.14 3n99 s VAL 256 Cb -0.14 -3.65 -0.07 0.00 0.00 0.00 0.00 36.38 32.51 3n99 s VAL 256 CO -0.01 0.27 1.19 -0.69 0.00 0.00 0.00 175.10 175.85 3n99 s VAL 257 N 1.34 3.75 -0.22 2.92 1.01 -1.26 -0.94 120.40 127.00 3n99 s VAL 257 Ca 0.15 1.40 0.07 0.00 0.00 0.00 0.00 61.98 63.60 3n99 s VAL 257 Cb -0.14 -3.90 -0.08 0.00 0.00 0.00 0.00 36.38 32.26 3n99 s VAL 257 CO 0.07 0.19 0.24 2.30 0.00 0.00 0.00 175.10 177.90 3n99 n ILE 258 N 2.95 0.00 -3.64 2.22 -5.35 0.10 -4.48 119.36 111.16 3n99 n ILE 258 Ca 0.06 -0.28 -0.13 0.00 -0.27 0.00 0.00 62.75 62.12 3n99 n ILE 258 Cb 0.45 0.79 -0.07 0.00 -1.74 0.00 0.00 39.64 39.07 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 -1.89 0.77 -0.03 6.28 0.00 -0.99 -1.99 119.30 121.45 3n99 s MET 259 Ca 0.01 0.98 -0.13 0.00 0.00 0.00 0.00 55.69 56.55 3n99 s MET 259 Cb 0.05 0.35 0.02 0.00 0.00 0.00 0.00 34.83 35.24 3n99 s MET 259 CO 0.28 -0.10 0.28 -0.08 0.00 0.00 0.00 175.02 175.39 3n99 s THR 260 N 0.55 0.05 -2.03 10.11 -1.32 0.08 -0.39 115.64 122.69 3n99 s THR 260 Ca -0.02 -0.43 0.00 0.00 -1.21 0.00 0.00 61.69 60.03 3n99 s THR 260 Cb -0.05 -0.55 0.00 0.00 -1.51 0.00 0.00 72.50 70.39 3n99 s THR 260 CO -0.02 -0.24 0.00 0.61 -2.21 0.00 0.00 174.62 172.76 3n99 n GLY 261 N 1.59 -0.61 3.87 6.08 0.00 -0.65 -1.11 105.19 114.36 3n99 n GLY 261 Ca -0.20 -0.64 -0.31 0.00 0.00 0.00 0.00 46.02 44.87 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 6.09 0.55 1.61 2.15 -1.26 -0.18 116.67 121.62 3n99 s ASP 262 Ca 0.00 0.18 0.22 0.00 0.43 0.00 0.00 52.55 53.39 3n99 s ASP 262 Cb 0.00 -1.81 1.51 0.00 -0.30 0.00 0.00 42.92 42.32 3n99 s ASP 262 CO 0.00 0.17 2.19 1.05 -0.17 0.00 0.00 175.17 178.41 3n99 h GLU 263 N 3.17 0.00 0.00 4.34 4.11 -0.83 -0.66 114.58 124.71 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 1.16 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.41 3n99 h GLU 263 CO 0.73 0.02 -0.00 0.66 0.07 0.00 0.00 179.01 180.48 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 -0.18 0.00 -0.47 0.00 0.00 61.79 61.14 3n99 h SER 264 Cb 0.03 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.09 3n99 h SER 264 CO 0.00 0.00 -1.68 0.29 -0.87 0.00 0.00 176.83 174.57 3n99 n LYS 265 N -3.10 1.80 -3.73 4.77 5.02 -0.60 -4.92 118.16 117.39 3n99 n LYS 265 Ca -0.01 0.02 -0.37 0.00 -2.02 0.00 0.00 58.31 55.93 3n99 n LYS 265 Cb 0.23 -1.25 -0.12 0.00 -0.02 0.00 0.00 35.03 33.87 3n99 n LYS 265 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3n99 s ILE 266 N -2.24 4.35 -0.43 -0.18 1.01 -0.36 -0.64 121.20 122.72 3n99 s ILE 266 Ca -0.08 -0.24 -0.01 0.00 0.00 0.00 0.00 60.65 60.32 3n99 s ILE 266 Cb 0.03 -3.08 0.12 0.00 0.01 0.00 0.00 42.46 39.53 3n99 s ILE 266 CO 0.37 0.27 0.20 -0.76 0.00 0.00 0.00 174.94 175.02 3n99 s LEU 267 N 1.61 5.06 0.16 2.97 1.43 0.43 -4.52 118.68 125.83 3n99 s LEU 267 Ca 0.06 -2.23 -0.30 0.00 -1.03 0.00 0.00 54.13 50.62 3n99 s LEU 267 Cb -0.16 -1.77 -0.08 0.00 0.03 0.00 0.00 46.19 44.22 3n99 s LEU 267 CO 0.04 -0.46 1.26 -2.84 0.23 0.00 0.00 176.35 174.58 3n99 s PRO 268 N 0.83 4.43 -0.29 1.29 0.02 -1.26 -1.15 135.00 138.86 3n99 s PRO 268 Ca 0.11 1.95 0.03 0.00 0.02 0.00 0.00 61.00 63.10 3n99 s PRO 268 Cb -0.22 -3.24 0.07 0.00 0.02 0.00 0.00 34.50 31.13 3n99 s PRO 268 CO -0.05 -0.21 -0.04 -1.21 -0.33 0.00 0.00 177.00 175.16 3n99 s GLU 269 N 0.17 2.02 -0.15 5.54 2.02 0.76 -4.87 118.70 124.19 3n99 s GLU 269 Ca 0.56 -1.52 -0.29 0.00 0.02 0.00 0.00 54.97 53.75 3n99 s GLU 269 Cb -0.34 -3.04 -0.05 0.00 0.10 0.00 0.00 34.13 30.80 3n99 s GLU 269 CO 0.35 -0.70 1.79 -2.00 0.02 0.00 0.00 175.26 174.72 3n99 s GLU 270 N 1.06 3.80 0.50 1.61 2.12 -1.25 -1.50 118.70 125.04 3n99 s GLU 270 Ca -0.02 1.98 0.00 0.00 0.36 0.00 0.00 54.97 57.29 3n99 s GLU 270 Cb -0.20 -4.11 -0.00 0.00 0.26 0.00 0.00 34.13 30.08 3n99 s GLU 270 CO -0.05 -1.31 0.01 1.33 -0.54 0.00 0.00 175.26 174.69 3n99 n VAL 271 N 6.35 0.00 -0.02 3.70 0.24 0.06 -4.92 118.33 123.75 3n99 n VAL 271 Ca 0.21 -2.38 -0.14 0.00 -2.04 0.00 0.00 64.34 59.99 3n99 n VAL 271 Cb 0.44 0.50 -0.02 0.00 -1.47 0.00 0.00 33.84 33.29 3n99 n VAL 271 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 3n99 h GLU 272 N 0.00 0.69 -3.17 7.34 9.09 -1.94 -3.41 114.58 123.17 3n99 h GLU 272 Ca -0.41 -0.50 -0.19 0.00 0.05 0.00 0.00 59.36 58.30 3n99 h GLU 272 Cb 1.27 0.08 -0.28 0.00 -1.65 0.00 0.00 28.75 28.17 3n99 h GLU 272 CO 0.69 1.12 -0.50 0.50 0.05 0.00 0.00 179.01 180.86 3n99 s ARG 273 N -3.87 0.20 -0.33 1.06 3.52 -1.26 -4.99 118.95 113.28 3n99 s ARG 273 Ca -0.09 0.38 0.06 0.00 -0.13 0.00 0.00 55.73 55.95 3n99 s ARG 273 Cb 0.10 -0.01 0.19 0.00 -1.56 0.00 0.00 34.95 33.67 3n99 s ARG 273 CO 0.88 -0.10 0.58 0.00 -0.81 0.00 0.00 175.30 175.85 3n99 s ALA 274 N 0.67 -2.23 -0.10 6.12 0.00 -1.26 -4.94 121.76 120.01 3n99 s ALA 274 Ca -0.05 0.68 -0.05 0.00 0.00 0.00 0.00 51.96 52.55 3n99 s ALA 274 Cb -0.06 -2.54 0.05 0.00 0.00 0.00 0.00 23.12 20.56 3n99 s ALA 274 CO -0.04 -1.95 0.23 1.21 0.00 0.00 0.00 175.76 175.21 3n99 s ASN 275 N 2.48 -0.09 0.64 0.00 3.84 -1.26 -1.57 114.94 118.99 3n99 s ASN 275 Ca 0.12 0.48 0.42 0.00 0.21 0.00 0.00 52.86 54.09 3n99 s ASN 275 Cb -0.09 0.40 2.20 0.00 -0.55 0.00 0.00 41.25 43.21 3n99 s ASN 275 CO -0.20 -0.18 2.30 0.16 -2.79 0.00 0.00 177.10 176.39 3n99 h ILE 276 N 6.00 0.05 0.00 -5.21 3.07 -1.51 -2.41 117.51 117.50 3n99 h ILE 276 Ca -0.36 -0.10 -0.03 0.00 1.55 0.00 0.00 64.86 65.92 3n99 h ILE 276 Cb 1.14 1.10 -0.00 0.00 -0.27 0.00 0.00 36.82 38.79 3n99 h ILE 276 CO 0.34 0.00 -0.12 0.77 -1.05 0.00 0.00 178.15 178.09 3n99 h SER 277 N 0.00 0.00 0.36 2.16 4.64 -1.90 -0.02 113.55 118.79 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 0.10 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.19 3n99 h SER 277 CO 0.00 0.12 -0.01 0.44 -0.87 0.00 0.00 176.83 176.51 3n99 h ASP 278 N 0.00 0.00 -0.09 4.97 3.32 -1.84 -3.18 116.42 119.60 3n99 h ASP 278 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3n99 h ASP 278 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 3n99 h ASP 278 CO 0.02 0.01 0.00 -1.22 -1.72 0.00 0.00 179.24 176.33 3n99 n TYR 279 N -3.17 0.11 1.86 4.55 4.01 -0.03 -5.15 117.16 119.33 3n99 n TYR 279 Ca -0.02 -0.11 0.15 0.00 -0.16 0.00 0.00 57.90 57.77 3n99 n TYR 279 Cb 0.16 -0.01 0.83 0.00 -0.31 0.00 0.00 39.34 40.02 3n99 n TYR 279 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68