#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 1.42 0.51 1.61 4.02 -1.26 -5.02 115.29 116.56 3n99 s HIS 0 Ca 0.00 -0.60 -0.23 0.00 1.02 0.00 0.00 55.06 55.25 3n99 s HIS 0 Cb 0.00 -0.72 -0.06 0.00 -1.02 0.00 0.00 32.58 30.78 3n99 s HIS 0 CO 0.00 0.16 1.33 -1.64 1.02 0.00 0.00 174.74 175.61 3n99 s MET 1 N -3.07 3.40 0.06 1.40 -1.94 -1.26 -4.94 119.30 112.96 3n99 s MET 1 Ca 0.13 2.16 -0.31 0.00 -1.71 0.00 0.00 55.69 55.97 3n99 s MET 1 Cb -0.03 -2.38 -0.06 0.00 2.01 0.00 0.00 34.83 34.38 3n99 s MET 1 CO 0.03 -0.96 1.22 1.03 -0.01 0.00 0.00 175.02 176.33 3n99 s ARG 2 N -2.75 4.42 0.21 2.03 0.52 -1.26 -5.01 118.95 117.11 3n99 s ARG 2 Ca 0.67 1.80 0.01 0.00 -0.52 0.00 0.00 55.73 57.69 3n99 s ARG 2 Cb -0.38 -3.34 -0.05 0.00 0.52 0.00 0.00 34.95 31.70 3n99 s ARG 2 CO 0.46 -0.28 0.07 0.95 0.02 0.00 0.00 175.30 176.52 3n99 s THR 3 N 1.09 0.45 -0.29 0.02 -4.23 -1.26 -0.96 115.64 110.47 3n99 s THR 3 Ca 0.59 -1.98 0.03 0.00 -1.18 0.00 0.00 61.69 59.14 3n99 s THR 3 Cb -0.30 -2.40 0.42 0.00 1.34 0.00 0.00 72.50 71.56 3n99 s THR 3 CO 0.29 -0.19 1.58 -0.46 -0.54 0.00 0.00 174.62 175.30 3n99 n ASN 4 N -0.33 3.48 0.27 3.99 6.94 -1.15 -4.68 115.26 123.78 3n99 n ASN 4 Ca -0.02 -3.01 0.11 0.00 -0.02 0.00 0.00 54.58 51.63 3n99 n ASN 4 Cb 0.65 -0.71 0.72 0.00 -2.36 0.00 0.00 39.78 38.08 3n99 n ASN 4 CO 0.00 0.00 0.00 0.07 -1.03 0.00 0.00 177.26 176.30 3n99 h LYS 5 N 0.65 0.00 0.00 -3.83 2.10 -1.96 -0.35 116.57 113.17 3n99 h LYS 5 Ca 0.40 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 59.04 3n99 h LYS 5 Cb 2.18 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 33.51 3n99 h LYS 5 CO 0.70 0.04 -0.03 -0.44 -2.00 0.00 0.00 179.45 177.72 3n99 h ASP 6 N 0.00 0.00 -0.18 7.07 3.32 -2.02 -2.67 116.42 121.93 3n99 h ASP 6 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3n99 h ASP 6 Cb 0.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.64 3n99 h ASP 6 CO 0.01 0.03 0.00 0.54 -1.72 0.00 0.00 179.24 178.09 3n99 n ARG 7 N -3.14 1.82 -3.03 3.56 1.74 -0.14 -4.95 116.66 112.52 3n99 n ARG 7 Ca 0.00 -1.24 -0.36 0.00 -0.77 0.00 0.00 57.85 55.49 3n99 n ARG 7 Cb 0.31 -1.41 -0.06 0.00 -1.02 0.00 0.00 32.46 30.28 3n99 n ARG 7 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3n99 s LEU 8 N -1.58 4.28 -0.17 0.55 1.43 -1.01 -5.03 118.68 117.15 3n99 s LEU 8 Ca 0.33 1.49 -0.19 0.00 -1.03 0.00 0.00 54.13 54.73 3n99 s LEU 8 Cb 0.18 -3.78 -0.03 0.00 0.03 0.00 0.00 46.19 42.59 3n99 s LEU 8 CO 0.27 -0.04 0.55 -0.69 0.23 0.00 0.00 176.35 176.67 3n99 s VAL 9 N -1.64 5.10 -0.20 -1.59 1.01 -1.26 -5.06 120.40 116.76 3n99 s VAL 9 Ca 0.47 1.04 -0.09 0.00 0.00 0.00 0.00 61.98 63.41 3n99 s VAL 9 Cb -0.16 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.30 3n99 s VAL 9 CO 0.21 0.19 0.10 -0.60 0.00 0.00 0.00 175.10 175.00 3n99 s ARG 10 N 1.45 4.02 -0.05 2.72 3.52 -1.26 -4.66 118.95 124.69 3n99 s ARG 10 Ca 0.26 -0.31 -0.09 0.00 -0.13 0.00 0.00 55.73 55.46 3n99 s ARG 10 Cb -0.16 -3.34 0.02 0.00 -1.56 0.00 0.00 34.95 29.91 3n99 s ARG 10 CO 0.10 0.20 0.22 -1.50 -0.81 0.00 0.00 175.30 173.51 3n99 s ILE 11 N 0.62 0.04 -0.10 4.11 2.07 -0.87 -4.98 121.20 122.08 3n99 s ILE 11 Ca 0.05 -0.29 -0.30 0.00 -1.41 0.00 0.00 60.65 58.70 3n99 s ILE 11 Cb -0.13 -0.42 -0.03 0.00 0.13 0.00 0.00 42.46 42.01 3n99 s ILE 11 CO 0.01 -0.16 1.41 -0.94 -1.91 0.00 0.00 174.94 173.35 3n99 s SER 12 N -0.60 6.85 -0.19 4.50 1.04 -1.26 -1.58 113.70 122.46 3n99 s SER 12 Ca -0.07 1.93 -0.01 0.00 0.48 0.00 0.00 55.95 58.28 3n99 s SER 12 Cb -0.04 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.54 3n99 s SER 12 CO 0.01 -0.80 -0.12 -0.69 0.98 0.00 0.00 173.24 172.62 3n99 s VAL 13 N 3.48 2.78 0.19 5.02 1.01 0.09 -4.95 120.40 128.01 3n99 s VAL 13 Ca 0.62 -0.71 0.06 0.00 0.00 0.00 0.00 61.98 61.96 3n99 s VAL 13 Cb -0.27 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 3n99 s VAL 13 CO 0.21 0.49 0.08 0.68 0.00 0.00 0.00 175.10 176.56 3n99 s VAL 14 N 1.21 4.12 0.00 2.92 -7.23 -1.26 -0.15 120.40 120.02 3n99 s VAL 14 Ca 0.02 -1.31 0.00 0.00 -1.81 0.00 0.00 61.98 58.88 3n99 s VAL 14 Cb -0.14 -3.12 0.00 0.00 0.56 0.00 0.00 36.38 33.68 3n99 s VAL 14 CO -0.05 -0.16 0.00 0.61 -0.31 0.00 0.00 175.10 175.19 3n99 n GLY 15 N -0.40 2.78 3.19 2.32 0.00 -0.39 -4.68 105.19 108.02 3n99 n GLY 15 Ca -0.09 -0.81 -0.09 0.00 0.00 0.00 0.00 46.02 45.03 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 0.33 0.83 -0.03 1.61 -1.05 0.64 -0.74 118.70 120.28 3n99 s GLU 16 Ca 0.00 -1.02 -0.30 0.00 -0.15 0.00 0.00 54.97 53.50 3n99 s GLU 16 Cb 0.00 0.32 -0.05 0.00 -0.44 0.00 0.00 34.13 33.96 3n99 s GLU 16 CO 0.00 -0.25 1.53 0.42 0.95 0.00 0.00 175.26 177.91 3n99 s ILE 17 N -3.88 3.63 0.38 1.83 1.01 -0.43 -0.78 121.20 122.95 3n99 s ILE 17 Ca 0.06 0.90 -0.25 0.00 0.00 0.00 0.00 60.65 61.36 3n99 s ILE 17 Cb 0.05 -3.58 -0.09 0.00 0.01 0.00 0.00 42.46 38.86 3n99 s ILE 17 CO -0.10 -0.04 1.10 0.00 0.00 0.00 0.00 174.94 175.90 3n99 s ALA 18 N 3.26 3.17 0.92 9.38 0.00 0.11 -0.58 121.76 138.02 3n99 s ALA 18 Ca 0.68 0.83 -0.11 0.00 0.00 0.00 0.00 51.96 53.36 3n99 s ALA 18 Cb -0.32 -3.32 0.14 0.00 0.00 0.00 0.00 23.12 19.62 3n99 s ALA 18 CO 0.27 -0.32 1.09 -1.25 0.00 0.00 0.00 175.76 175.56 3n99 s PRO 19 N -2.22 1.06 0.27 0.00 0.04 -1.26 -1.85 135.00 131.03 3n99 s PRO 19 Ca 0.55 0.92 -0.31 0.00 0.04 0.00 0.00 61.00 62.20 3n99 s PRO 19 Cb -0.27 -1.78 -0.12 0.00 0.04 0.00 0.00 34.50 32.37 3n99 s PRO 19 CO 0.34 -2.41 1.53 0.00 0.04 0.00 0.00 177.00 176.51 3n99 n ALA 20 N -4.01 2.04 -2.35 8.56 0.00 -1.26 -2.15 120.51 121.34 3n99 n ALA 20 Ca 0.07 0.39 -0.31 0.00 0.00 0.00 0.00 53.44 53.59 3n99 n ALA 20 Cb 0.55 -2.40 -0.16 0.00 0.00 0.00 0.00 19.45 17.44 3n99 n ALA 20 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3n99 s LYS 21 N -0.38 2.15 -0.19 0.00 1.02 -0.53 -4.88 119.74 116.93 3n99 s LYS 21 Ca 0.66 -0.93 -0.08 0.00 0.02 0.00 0.00 55.97 55.65 3n99 s LYS 21 Cb -0.55 -2.05 0.08 0.00 -0.52 0.00 0.00 37.83 34.79 3n99 s LYS 21 CO 0.48 0.54 0.42 -1.64 -0.92 0.00 0.00 175.35 174.23 3n99 s MET 22 N -0.57 0.35 0.19 1.68 -1.94 -1.26 -3.77 119.30 113.98 3n99 s MET 22 Ca 0.09 0.96 0.25 0.00 -1.71 0.00 0.00 55.69 55.28 3n99 s MET 22 Cb -0.10 0.21 0.62 0.00 2.01 0.00 0.00 34.83 37.56 3n99 s MET 22 CO -0.01 -0.22 1.60 0.00 -0.01 0.00 0.00 175.02 176.39 3n99 h ARG 23 N 7.81 0.00 -3.29 2.03 3.08 -1.99 -3.46 114.38 118.55 3n99 h ARG 23 Ca -0.23 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.72 3n99 h ARG 23 Cb 1.14 0.00 -0.17 0.00 0.08 0.00 0.00 29.97 31.01 3n99 h ARG 23 CO 0.18 0.00 -0.27 0.45 -1.07 0.00 0.00 179.97 179.26 3n99 s SER 24 N -4.53 -0.12 0.46 7.04 0.15 -1.26 -5.01 113.70 110.43 3n99 s SER 24 Ca 0.09 -0.17 0.15 0.00 0.70 0.00 0.00 55.95 56.71 3n99 s SER 24 Cb 0.12 0.34 1.04 0.00 -1.71 0.00 0.00 66.02 65.81 3n99 s SER 24 CO 0.64 -0.58 2.01 1.55 1.20 0.00 0.00 173.24 178.06 3n99 h PRO 25 N 3.34 0.00 -5.89 5.44 0.13 -1.96 -3.44 132.00 129.62 3n99 h PRO 25 Ca -0.31 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.20 3n99 h PRO 25 Cb 1.20 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.26 3n99 h PRO 25 CO 0.45 0.16 -0.26 0.71 -0.23 0.00 0.00 178.00 178.83 3n99 s TYR 26 N -4.69 3.67 -0.14 1.56 2.02 -1.26 -4.27 117.35 114.24 3n99 s TYR 26 Ca -0.04 0.88 -0.06 0.00 -0.37 0.00 0.00 57.07 57.48 3n99 s TYR 26 Cb 0.16 -2.24 -0.04 0.00 -0.40 0.00 0.00 41.96 39.44 3n99 s TYR 26 CO 0.69 0.61 0.06 -1.12 -1.57 0.00 0.00 175.55 174.22 3n99 s SER 27 N -0.86 5.68 -0.20 2.29 0.01 -0.52 -4.95 113.70 115.16 3n99 s SER 27 Ca 0.22 0.18 -0.12 0.00 1.31 0.00 0.00 55.95 57.54 3n99 s SER 27 Cb -0.15 -1.86 -0.05 0.00 0.21 0.00 0.00 66.02 64.17 3n99 s SER 27 CO 0.11 0.28 0.21 -0.69 0.41 0.00 0.00 173.24 173.56 3n99 s VAL 28 N -0.25 5.35 0.59 3.43 1.01 -1.26 -1.75 120.40 127.51 3n99 s VAL 28 Ca 0.08 0.35 -0.06 0.00 0.00 0.00 0.00 61.98 62.35 3n99 s VAL 28 Cb -0.12 -3.55 0.01 0.00 0.00 0.00 0.00 36.38 32.72 3n99 s VAL 28 CO 0.01 0.38 0.90 0.42 0.00 0.00 0.00 175.10 176.82 3n99 s THR 29 N 0.65 3.55 0.61 3.92 -4.23 0.18 -3.64 115.64 116.69 3n99 s THR 29 Ca 0.12 -0.05 0.34 0.00 -1.18 0.00 0.00 61.69 60.92 3n99 s THR 29 Cb -0.13 -3.41 0.38 0.00 1.34 0.00 0.00 72.50 70.68 3n99 s THR 29 CO 0.02 -0.42 2.29 0.74 -0.54 0.00 0.00 174.62 176.71 3n99 h THR 30 N -0.18 0.38 -0.03 3.99 2.02 -1.52 -1.21 112.91 116.36 3n99 h THR 30 Ca -0.45 -0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.73 3n99 h THR 30 Cb 1.26 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.67 3n99 h THR 30 CO 0.60 0.00 0.00 -0.62 0.37 0.00 0.00 175.52 175.87 3n99 n GLU 31 N -3.64 1.45 -1.62 6.66 4.71 -1.26 -4.92 120.64 122.01 3n99 n GLU 31 Ca -0.03 -0.65 -0.03 0.00 -0.01 0.00 0.00 57.16 56.43 3n99 n GLU 31 Cb 0.08 -1.46 -0.01 0.00 -1.01 0.00 0.00 31.44 29.04 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 1.09 0.42 3.80 0.62 0.00 -0.46 -5.06 105.19 105.61 3n99 n GLY 32 Ca 0.20 -0.82 -0.22 0.00 0.00 0.00 0.00 46.02 45.17 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 -2.15 3.08 0.10 2.61 -4.23 -1.26 -4.88 115.64 108.91 3n99 s THR 33 Ca 0.00 -1.51 0.08 0.00 -1.18 0.00 0.00 61.69 59.07 3n99 s THR 33 Cb 0.00 -3.06 -0.04 0.00 1.34 0.00 0.00 72.50 70.74 3n99 s THR 33 CO 0.00 -0.13 -0.14 0.68 -0.54 0.00 0.00 174.62 174.48 3n99 s VAL 34 N -2.40 3.08 0.00 2.29 -7.23 -1.26 -0.64 120.40 114.24 3n99 s VAL 34 Ca 0.41 -1.37 0.00 0.00 -1.81 0.00 0.00 61.98 59.22 3n99 s VAL 34 Cb -0.03 -2.42 -0.00 0.00 0.56 0.00 0.00 36.38 34.49 3n99 s VAL 34 CO 0.25 0.13 -0.01 -0.13 -0.31 0.00 0.00 175.10 175.02 3n99 s ARG 35 N -2.11 0.12 -0.49 4.82 0.52 -0.72 -4.97 118.95 116.12 3n99 s ARG 35 Ca 0.19 -0.12 -0.17 0.00 -0.52 0.00 0.00 55.73 55.11 3n99 s ARG 35 Cb -0.11 -0.06 0.07 0.00 0.52 0.00 0.00 34.95 35.38 3n99 s ARG 35 CO 0.11 0.01 0.48 0.08 0.02 0.00 0.00 175.30 176.01 3n99 s VAL 36 N -0.23 5.11 0.05 3.52 1.01 -1.26 -1.43 120.40 127.16 3n99 s VAL 36 Ca -0.02 -0.89 -0.04 0.00 0.00 0.00 0.00 61.98 61.04 3n99 s VAL 36 Cb -0.02 -4.20 -0.02 0.00 0.00 0.00 0.00 36.38 32.14 3n99 s VAL 36 CO -0.00 -0.67 0.05 0.27 0.00 0.00 0.00 175.10 174.74 3n99 s ILE 37 N 1.99 0.16 0.63 2.22 -4.36 -1.26 -5.06 121.20 115.51 3n99 s ILE 37 Ca 0.08 -1.32 -0.19 0.00 -0.26 0.00 0.00 60.65 58.96 3n99 s ILE 37 Cb -0.23 -1.08 -0.02 0.00 1.25 0.00 0.00 42.46 42.38 3n99 s ILE 37 CO 0.08 -0.73 1.28 -2.84 0.24 0.00 0.00 174.94 172.97 3n99 s PRO 38 N -3.06 2.70 0.00 0.37 0.02 -1.26 -4.79 135.00 128.99 3n99 s PRO 38 Ca -0.01 2.02 0.00 0.00 0.02 0.00 0.00 61.00 63.03 3n99 s PRO 38 Cb 0.02 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.64 3n99 s PRO 38 CO -0.07 -1.47 0.00 0.28 -0.33 0.00 0.00 177.00 175.42 3n99 n VAL 39 N -1.76 0.00 -2.89 3.83 0.31 -1.26 -1.58 118.33 114.98 3n99 n VAL 39 Ca 0.15 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.27 3n99 n VAL 39 Cb 0.48 0.00 0.07 0.00 -0.91 0.00 0.00 33.84 33.48 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 3.11 0.00 7.52 0.05 -1.25 -4.42 118.68 123.69 3n99 s LEU 40 Ca 0.00 -0.67 0.00 0.00 0.05 0.00 0.00 54.13 53.51 3n99 s LEU 40 Cb 0.00 -1.82 0.00 0.00 -2.05 0.00 0.00 46.19 42.32 3n99 s LEU 40 CO 0.00 -1.46 0.00 0.61 -0.55 0.00 0.00 176.35 174.95 3n99 n GLY 41 N -2.40 -2.54 0.15 -3.48 0.00 -1.26 -1.45 105.19 94.21 3n99 n GLY 41 Ca 0.15 -1.79 0.02 0.00 0.00 0.00 0.00 46.02 44.39 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 -0.21 -1.43 3.57 -0.02 0.00 -0.77 -4.59 105.19 101.74 3n99 n GLY 42 Ca 0.00 -1.50 -0.42 0.00 0.00 0.00 0.00 46.02 44.11 3n99 n GLY 42 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3n99 s ILE 43 N -1.27 4.88 -0.40 -0.61 1.01 -1.26 -1.44 121.20 122.11 3n99 s ILE 43 Ca 0.00 0.63 -0.15 0.00 0.00 0.00 0.00 60.65 61.13 3n99 s ILE 43 Cb 0.00 -4.08 0.01 0.00 0.01 0.00 0.00 42.46 38.40 3n99 s ILE 43 CO 0.00 -0.31 0.31 -0.89 0.00 0.00 0.00 174.94 174.05 3n99 s THR 44 N 2.73 5.25 0.05 2.92 2.01 -0.54 -4.97 115.64 123.08 3n99 s THR 44 Ca 0.25 -0.54 0.13 0.00 0.31 0.00 0.00 61.69 61.84 3n99 s THR 44 Cb -0.14 -3.90 -0.00 0.00 0.01 0.00 0.00 72.50 68.46 3n99 s THR 44 CO 0.15 -0.27 1.49 1.88 -0.69 0.00 0.00 174.62 177.18 3n99 h TYR 45 N 8.61 0.00 0.00 4.92 0.05 -1.95 -3.33 116.97 125.27 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 1.13 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.87 3n99 h TYR 45 CO 0.58 0.62 -0.05 0.27 -1.05 0.00 0.00 178.16 178.53 3n99 n ASN 46 N -3.41 1.68 -4.01 3.88 6.94 -1.26 -4.94 115.26 114.15 3n99 n ASN 46 Ca 0.00 -2.28 -0.27 0.00 -0.02 0.00 0.00 54.58 52.01 3n99 n ASN 46 Cb 0.72 -0.18 -0.17 0.00 -2.36 0.00 0.00 39.78 37.79 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 -1.46 1.31 0.11 3.53 1.01 -1.26 -5.12 120.40 118.52 3n99 s VAL 47 Ca 0.12 -0.52 -0.01 0.00 0.00 0.00 0.00 61.98 61.57 3n99 s VAL 47 Cb 0.10 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 3n99 s VAL 47 CO 0.01 0.40 0.03 -1.59 0.00 0.00 0.00 175.10 173.96 3n99 s LYS 48 N 1.11 0.85 0.24 2.72 -2.85 -1.26 -2.05 119.74 118.50 3n99 s LYS 48 Ca -0.05 -1.39 -0.31 0.00 -1.00 0.00 0.00 55.97 53.22 3n99 s LYS 48 Cb -0.14 0.23 -0.13 0.00 -2.06 0.00 0.00 37.83 35.72 3n99 s LYS 48 CO -0.03 -0.22 1.51 1.55 0.10 0.00 0.00 175.35 178.26 3n99 n VAL 49 N -0.05 0.74 0.00 1.79 3.14 -1.26 -1.65 118.33 121.04 3n99 n VAL 49 Ca -0.07 -0.18 0.00 0.00 -2.96 0.00 0.00 64.34 61.12 3n99 n VAL 49 Cb 0.63 -1.65 0.00 0.00 -1.06 0.00 0.00 33.84 31.76 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 2.50 2.56 3.82 7.55 0.00 -0.05 -4.90 105.19 116.67 3n99 n GLY 50 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.33 4.46 0.48 1.61 1.01 -0.66 -4.73 116.67 118.52 3n99 s ASP 51 Ca 0.00 1.15 -0.23 0.00 0.71 0.00 0.00 52.55 54.17 3n99 s ASP 51 Cb 0.00 -1.83 -0.07 0.00 1.01 0.00 0.00 42.92 42.03 3n99 s ASP 51 CO 0.00 -1.97 1.29 -0.55 0.21 0.00 0.00 175.17 174.15 3n99 s SER 52 N -4.08 5.81 0.18 0.27 0.15 -1.26 -0.63 113.70 114.13 3n99 s SER 52 Ca 0.61 2.61 0.27 0.00 0.70 0.00 0.00 55.95 60.14 3n99 s SER 52 Cb -0.13 -2.63 0.88 0.00 -1.71 0.00 0.00 66.02 62.43 3n99 s SER 52 CO 0.53 -1.19 1.80 0.00 1.20 0.00 0.00 173.24 175.59 3n99 n ALA 53 N -0.55 2.29 -2.54 5.45 0.00 0.30 -4.58 120.51 120.88 3n99 n ALA 53 Ca 0.08 -0.04 -0.23 0.00 0.00 0.00 0.00 53.44 53.25 3n99 n ALA 53 Cb 0.45 -1.47 -0.06 0.00 0.00 0.00 0.00 19.45 18.37 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 -3.08 2.70 0.00 0.00 1.51 -1.26 -0.38 117.35 116.84 3n99 s TYR 54 Ca 0.11 -0.37 0.00 0.00 -1.01 0.00 0.00 57.07 55.80 3n99 s TYR 54 Cb 0.13 -1.59 0.00 0.00 -0.11 0.00 0.00 41.96 40.40 3n99 s TYR 54 CO 0.59 0.38 0.00 0.41 -1.11 0.00 0.00 175.55 175.81 3n99 n GLY 55 N -1.12 0.74 3.82 0.71 0.00 -1.26 -5.03 105.19 103.06 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 -2.67 3.67 -1.19 1.61 0.52 -1.26 -4.99 118.94 114.63 3n99 s TRP 56 Ca 0.00 0.88 -0.20 0.00 0.02 0.00 0.00 56.10 56.80 3n99 s TRP 56 Cb 0.00 -2.26 -0.03 0.00 -1.15 0.00 0.00 33.47 30.02 3n99 s TRP 56 CO 0.00 0.58 1.90 0.00 0.02 0.00 0.00 176.95 179.45 3n99 n ALA 57 N 2.15 3.02 -3.61 0.98 0.00 -1.26 -4.80 120.51 116.99 3n99 n ALA 57 Ca -0.14 -3.43 -0.01 0.00 0.00 0.00 0.00 53.44 49.86 3n99 n ALA 57 Cb 0.53 -3.55 -0.01 0.00 0.00 0.00 0.00 19.45 16.41 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 5.15 -0.35 -0.02 0.00 0.00 -1.26 -4.24 107.32 106.60 3n99 s GLY 58 Ca 0.60 1.17 0.02 0.00 0.00 0.00 0.00 44.72 46.50 3n99 s GLY 58 CO 0.09 0.33 -0.06 -0.35 0.00 0.00 0.00 173.10 173.11 3n99 s ASP 59 N -2.58 0.86 -1.46 1.64 2.15 -0.61 -4.77 116.67 111.90 3n99 s ASP 59 Ca 0.12 -0.13 -0.13 0.00 0.43 0.00 0.00 52.55 52.84 3n99 s ASP 59 Cb 0.02 -0.22 0.10 0.00 -0.30 0.00 0.00 42.92 42.52 3n99 s ASP 59 CO -0.04 0.04 0.68 1.41 -0.17 0.00 0.00 175.17 177.09 3n99 n HIS 60 N 3.31 -1.88 -2.32 -5.34 8.25 -1.06 -4.00 115.22 112.17 3n99 n HIS 60 Ca -0.18 0.66 -0.42 0.00 -0.26 0.00 0.00 57.72 57.52 3n99 n HIS 60 Cb 0.55 -3.17 -0.03 0.00 1.12 0.00 0.00 29.99 28.46 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 -3.11 3.67 -0.29 1.59 1.01 -1.26 -4.11 120.40 117.91 3n99 s VAL 61 Ca 0.56 1.25 -0.14 0.00 0.00 0.00 0.00 61.98 63.64 3n99 s VAL 61 Cb -0.29 -3.80 -0.03 0.00 0.00 0.00 0.00 36.38 32.25 3n99 s VAL 61 CO 0.69 0.12 0.34 -1.61 0.00 0.00 0.00 175.10 174.64 3n99 s GLU 62 N 0.77 3.91 0.56 2.72 2.02 -1.26 -0.78 118.70 126.63 3n99 s GLU 62 Ca 0.59 -0.11 -0.20 0.00 0.02 0.00 0.00 54.97 55.27 3n99 s GLU 62 Cb -0.33 -3.69 -0.05 0.00 0.10 0.00 0.00 34.13 30.17 3n99 s GLU 62 CO 0.31 -0.31 1.20 -1.25 0.02 0.00 0.00 175.26 175.23 3n99 s PRO 63 N 2.01 3.20 6.16 0.39 0.04 -1.26 -4.62 135.00 140.92 3n99 s PRO 63 Ca 0.13 1.82 0.00 0.00 0.04 0.00 0.00 61.00 62.99 3n99 s PRO 63 Cb -0.16 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.32 3n99 s PRO 63 CO 0.11 -1.02 0.00 0.41 0.04 0.00 0.00 177.00 176.53 3n99 n GLY 64 N 0.45 2.34 3.57 0.56 0.00 -0.87 -4.50 105.19 106.74 3n99 n GLY 64 Ca 0.12 -0.44 -0.37 0.00 0.00 0.00 0.00 46.02 45.33 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 4.92 -0.08 1.61 1.01 -0.02 -1.46 120.40 126.37 3n99 s VAL 65 Ca 0.00 0.03 -0.19 0.00 0.00 0.00 0.00 61.98 61.82 3n99 s VAL 65 Cb 0.00 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 3n99 s VAL 65 CO 0.00 0.33 0.51 -0.44 0.00 0.00 0.00 175.10 175.51 3n99 s SER 66 N 1.33 6.78 -0.15 3.32 0.01 -0.52 -0.92 113.70 123.55 3n99 s SER 66 Ca 0.06 0.93 0.01 0.00 1.31 0.00 0.00 55.95 58.26 3n99 s SER 66 Cb -0.15 -2.31 0.01 0.00 0.21 0.00 0.00 66.02 63.78 3n99 s SER 66 CO 0.06 0.04 -0.19 -0.69 0.41 0.00 0.00 173.24 172.87 3n99 s VAL 67 N 0.33 2.31 0.36 3.43 1.01 0.11 -0.72 120.40 127.24 3n99 s VAL 67 Ca 0.28 -0.89 0.08 0.00 0.00 0.00 0.00 61.98 61.45 3n99 s VAL 67 Cb -0.16 -1.95 -0.05 0.00 0.00 0.00 0.00 36.38 34.22 3n99 s VAL 67 CO 0.13 0.53 0.13 0.00 0.00 0.00 0.00 175.10 175.89 3n99 s MET 68 N 0.88 2.27 0.52 2.72 0.23 0.04 -0.98 119.30 124.99 3n99 s MET 68 Ca -0.05 -1.67 -0.20 0.00 -1.03 0.00 0.00 55.69 52.74 3n99 s MET 68 Cb -0.15 -2.08 -0.07 0.00 -1.53 0.00 0.00 34.83 31.00 3n99 s MET 68 CO -0.02 0.04 1.10 0.00 -2.03 0.00 0.00 175.02 174.11 3n99 s ALA 69 N -2.49 2.76 0.55 3.16 0.00 -1.26 -0.26 121.76 124.21 3n99 s ALA 69 Ca 0.38 0.76 0.30 0.00 0.00 0.00 0.00 51.96 53.40 3n99 s ALA 69 Cb -0.00 -3.33 1.77 0.00 0.00 0.00 0.00 23.12 21.56 3n99 s ALA 69 CO 0.22 -0.62 2.22 0.00 0.00 0.00 0.00 175.76 177.58 3n99 h ARG 70 N 1.33 0.00 -1.93 0.00 3.08 -1.90 -3.44 114.38 111.51 3n99 h ARG 70 Ca -0.50 0.00 0.19 0.00 0.07 0.00 0.00 59.98 59.74 3n99 h ARG 70 Cb 1.25 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 31.15 3n99 h ARG 70 CO 0.58 0.03 0.63 -0.98 -1.07 0.00 0.00 179.97 179.16 3n99 s ARG 71 N -4.50 0.65 0.35 0.04 1.70 -1.26 -5.05 118.95 110.87 3n99 s ARG 71 Ca -0.04 -0.27 0.07 0.00 -0.47 0.00 0.00 55.73 55.01 3n99 s ARG 71 Cb 0.15 0.28 0.75 0.00 -0.57 0.00 0.00 34.95 35.55 3n99 s ARG 71 CO 0.55 -0.29 1.92 -0.22 -1.08 0.00 0.00 175.30 176.18 3n99 h LYS 72 N 2.00 0.74 0.00 3.89 3.64 -2.03 -1.52 116.57 123.29 3n99 h LYS 72 Ca -0.19 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.13 3n99 h LYS 72 Cb 1.21 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.86 3n99 h LYS 72 CO 0.27 0.49 -0.10 0.93 -2.27 0.00 0.00 179.45 178.77 3n99 h GLU 73 N 0.76 0.00 -0.22 1.90 3.07 -1.99 -1.97 114.58 116.13 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 0.43 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 3n99 h GLU 73 CO -0.14 0.10 0.00 0.39 -1.40 0.00 0.00 179.01 177.96 3n99 n GLU 74 N -3.76 1.92 -0.06 2.33 1.02 -0.57 -4.43 120.64 117.09 3n99 n GLU 74 Ca -0.02 -1.38 -0.14 0.00 -0.02 0.00 0.00 57.16 55.60 3n99 n GLU 74 Cb 0.21 -1.42 -0.07 0.00 -0.02 0.00 0.00 31.44 30.14 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 2.75 0.45 -0.33 3.49 5.08 -1.43 -2.79 114.58 121.80 3n99 h GLU 75 Ca 0.00 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.09 3n99 h GLU 75 Cb 0.61 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.86 3n99 h GLU 75 CO 0.00 0.85 0.16 0.82 -1.00 0.00 0.00 179.01 179.84 3n99 h ILE 76 N 0.08 1.15 -0.28 3.13 2.04 -1.79 -1.82 117.51 120.03 3n99 h ILE 76 Ca 0.02 -0.43 -0.13 0.00 1.00 0.00 0.00 64.86 65.31 3n99 h ILE 76 Cb 0.80 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 3n99 h ILE 76 CO 0.05 0.16 -0.38 1.55 0.00 0.00 0.00 178.15 179.53 3n99 h PRO 77 N 0.40 0.64 -0.48 2.37 0.13 -1.85 0.34 132.00 133.55 3n99 h PRO 77 Ca 0.11 -0.32 0.10 0.00 -0.87 0.00 0.00 66.00 65.02 3n99 h PRO 77 Cb 0.11 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.15 3n99 h PRO 77 CO -0.02 0.92 -0.04 1.25 -0.23 0.00 0.00 178.00 179.88 3n99 h LEU 78 N 0.53 -0.29 0.02 1.56 5.85 -1.20 -1.72 115.31 120.06 3n99 h LEU 78 Ca 0.05 0.13 -0.24 0.00 0.84 0.00 0.00 57.88 58.66 3n99 h LEU 78 Cb 0.90 0.24 -0.03 0.00 0.37 0.00 0.00 40.66 42.14 3n99 h LEU 78 CO 0.08 -0.10 -1.18 0.24 -0.34 0.00 0.00 178.44 177.14 3n99 h MET 79 N 0.07 0.05 0.05 1.25 2.86 -1.03 -3.03 114.93 115.15 3n99 h MET 79 Ca 0.24 -0.09 -0.07 0.00 -2.06 0.00 0.00 59.70 57.72 3n99 h MET 79 Cb 0.37 0.03 0.01 0.00 0.06 0.00 0.00 31.60 32.07 3n99 h MET 79 CO -0.44 0.96 -0.33 1.15 1.06 0.00 0.00 176.91 179.31 3n99 h THR 80 N 0.01 1.68 0.00 2.22 2.02 -0.88 -3.39 112.91 114.58 3n99 h THR 80 Ca -0.09 -2.42 -0.16 0.00 0.77 0.00 0.00 66.41 64.51 3n99 h THR 80 Cb 1.85 3.31 -0.03 0.00 -1.74 0.00 0.00 68.15 71.55 3n99 h THR 80 CO 0.13 0.65 -0.98 -0.07 0.37 0.00 0.00 175.52 175.62 3n99 h LEU 81 N -0.76 0.00 -9.44 2.58 3.38 -1.44 -3.45 115.31 106.17 3n99 h LEU 81 Ca -0.06 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.37 3n99 h LEU 81 Cb 1.25 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.01 3n99 h LEU 81 CO 0.06 0.68 0.83 -0.44 0.09 0.00 0.00 178.44 179.66 3n99 s SER 82 N -6.29 6.80 0.09 -0.43 0.01 -1.15 -4.01 113.70 108.72 3n99 s SER 82 Ca 0.01 2.25 0.09 0.00 1.31 0.00 0.00 55.95 59.60 3n99 s SER 82 Cb 0.08 -2.57 -0.04 0.00 0.21 0.00 0.00 66.02 63.71 3n99 s SER 82 CO 0.79 -0.73 -0.21 0.00 0.41 0.00 0.00 173.24 173.50 3n99 n ILE 84 N 1.17 0.14 0.00 0.00 5.41 0.26 -1.61 119.36 124.73 3n99 n ILE 84 Ca -0.16 -0.03 0.00 0.00 1.00 0.00 0.00 62.75 63.56 3n99 n ILE 84 Cb 0.52 -2.00 0.00 0.00 -0.71 0.00 0.00 39.64 37.45 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 4.04 2.57 3.74 7.39 0.00 0.61 -0.53 105.19 123.00 3n99 n GLY 85 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 3n99 n GLY 85 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3n99 n ASN 86 N 0.00 2.93 -4.77 1.61 5.03 -0.63 -4.56 115.26 114.86 3n99 n ASN 86 Ca 0.00 1.09 -0.41 0.00 0.87 0.00 0.00 54.58 56.13 3n99 n ASN 86 Cb 0.00 -1.56 -0.02 0.00 -1.02 0.00 0.00 39.78 37.18 3n99 n ASN 86 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 3n99 s GLU 87 N -2.43 4.29 -0.03 3.52 2.12 -1.26 -1.88 118.70 123.03 3n99 s GLU 87 Ca 0.63 2.30 0.03 0.00 0.36 0.00 0.00 54.97 58.29 3n99 s GLU 87 Cb -0.46 -3.05 0.00 0.00 0.26 0.00 0.00 34.13 30.88 3n99 s GLU 87 CO 0.56 -0.28 -0.11 0.08 -0.54 0.00 0.00 175.26 174.97 3n99 s VAL 88 N -1.05 0.98 -0.07 3.70 1.01 -0.10 -1.30 120.40 123.58 3n99 s VAL 88 Ca 0.51 -0.46 0.04 0.00 0.00 0.00 0.00 61.98 62.06 3n99 s VAL 88 Cb -0.41 -0.86 0.00 0.00 0.00 0.00 0.00 36.38 35.10 3n99 s VAL 88 CO 0.54 0.30 -0.18 -0.63 0.00 0.00 0.00 175.10 175.13 3n99 s ILE 89 N 0.19 1.58 0.08 2.22 1.09 -0.02 -0.62 121.20 125.72 3n99 s ILE 89 Ca -0.04 -0.77 -0.30 0.00 -1.10 0.00 0.00 60.65 58.44 3n99 s ILE 89 Cb -0.10 -1.38 -0.06 0.00 -1.06 0.00 0.00 42.46 39.87 3n99 s ILE 89 CO 0.01 0.45 1.17 -0.69 -0.10 0.00 0.00 174.94 175.78 3n99 s VAL 90 N 0.26 4.05 -0.17 2.92 1.01 -0.44 -1.64 120.40 126.40 3n99 s VAL 90 Ca -0.11 1.52 0.02 0.00 0.00 0.00 0.00 61.98 63.41 3n99 s VAL 90 Cb -0.15 -3.97 0.04 0.00 0.00 0.00 0.00 36.38 32.30 3n99 s VAL 90 CO 0.05 0.14 0.86 0.23 0.00 0.00 0.00 175.10 176.37 3n99 n MET 91 N 3.67 1.59 -3.96 2.72 2.81 0.20 -0.46 117.12 123.69 3n99 n MET 91 Ca 0.08 -1.22 -0.09 0.00 -1.81 0.00 0.00 57.70 54.66 3n99 n MET 91 Cb 0.47 -1.04 -0.05 0.00 -0.71 0.00 0.00 33.22 31.89 3n99 n MET 91 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3n99 s SER 92 N -0.68 -0.11 0.00 7.83 1.04 -1.24 -4.82 113.70 115.71 3n99 s SER 92 Ca 0.03 -0.86 0.00 0.00 0.48 0.00 0.00 55.95 55.60 3n99 s SER 92 Cb 0.02 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.72 3n99 s SER 92 CO 0.02 -1.12 0.00 0.61 0.98 0.00 0.00 173.24 173.73 3n99 n GLY 93 N -0.37 -2.20 0.15 7.32 0.00 -1.26 -4.04 105.19 104.79 3n99 n GLY 93 Ca -0.03 -1.61 0.13 0.00 0.00 0.00 0.00 46.02 44.51 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 -0.67 1.61 3.32 -1.98 -2.61 116.42 116.09 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 -1.82 2.72 -1.58 3.45 0.00 -1.26 -5.01 120.51 117.01 3n99 n ALA 95 Ca 0.02 -1.46 -0.50 0.00 0.00 0.00 0.00 53.44 51.49 3n99 n ALA 95 Cb 0.24 -0.94 -0.05 0.00 0.00 0.00 0.00 19.45 18.71 3n99 n ALA 95 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3n99 n LYS 96 N 1.29 1.17 0.00 0.00 4.81 -0.99 -0.48 118.16 123.96 3n99 n LYS 96 Ca 0.24 0.42 0.00 0.00 -0.87 0.00 0.00 58.31 58.10 3n99 n LYS 96 Cb 0.75 -1.99 0.00 0.00 0.02 0.00 0.00 35.03 33.81 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 2.27 2.67 3.76 3.14 0.00 0.39 -4.99 105.19 112.42 3n99 n GLY 97 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 3n99 n GLY 97 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3n99 s SER 98 N -1.40 5.61 -0.03 1.61 0.01 0.36 -4.78 113.70 115.08 3n99 s SER 98 Ca 0.00 2.60 0.06 0.00 1.31 0.00 0.00 55.95 59.93 3n99 s SER 98 Cb 0.00 -2.62 -0.02 0.00 0.21 0.00 0.00 66.02 63.58 3n99 s SER 98 CO 0.00 -1.32 -0.22 -0.13 0.41 0.00 0.00 173.24 171.98 3n99 s ARG 99 N -2.82 2.28 0.00 12.44 0.52 -1.26 -1.33 118.95 128.79 3n99 s ARG 99 Ca 0.68 -0.85 0.00 0.00 -0.52 0.00 0.00 55.73 55.04 3n99 s ARG 99 Cb -0.36 -2.16 0.00 0.00 0.52 0.00 0.00 34.95 32.94 3n99 s ARG 99 CO 0.43 0.56 0.00 0.41 0.02 0.00 0.00 175.30 176.73 3n99 n GLY 100 N 2.45 4.62 2.98 -3.53 0.00 0.21 -4.62 105.19 107.30 3n99 n GLY 100 Ca -0.16 -1.42 -0.12 0.00 0.00 0.00 0.00 46.02 44.31 3n99 n GLY 100 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3n99 s PHE 101 N -1.66 -0.05 -0.02 1.61 0.08 -0.59 -0.92 117.98 116.44 3n99 s PHE 101 Ca 0.00 0.12 -0.30 0.00 0.12 0.00 0.00 56.93 56.87 3n99 s PHE 101 Cb 0.00 0.00 -0.04 0.00 -0.57 0.00 0.00 43.02 42.41 3n99 s PHE 101 CO 0.00 -0.09 1.17 0.08 -0.10 0.00 0.00 175.22 176.28 3n99 s VAL 102 N -0.26 4.27 -0.08 -0.44 1.01 -0.79 -0.74 120.40 123.38 3n99 s VAL 102 Ca -0.03 1.61 0.20 0.00 0.00 0.00 0.00 61.98 63.76 3n99 s VAL 102 Cb -0.02 -4.03 -0.30 0.00 0.00 0.00 0.00 36.38 32.02 3n99 s VAL 102 CO 0.00 0.05 0.34 0.35 0.00 0.00 0.00 175.10 175.84 3n99 n THR 103 N 4.33 0.42 -3.98 3.92 -2.24 0.88 -0.28 114.28 117.33 3n99 n THR 103 Ca 0.10 -0.59 0.01 0.00 -2.27 0.00 0.00 64.05 61.29 3n99 n THR 103 Cb 0.47 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.56 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 1.46 0.38 3.39 3.38 0.00 -1.10 -4.85 105.19 107.85 3n99 n GLY 104 Ca -0.13 -0.85 -0.15 0.00 0.00 0.00 0.00 46.02 44.89 3n99 n GLY 104 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3n99 s LYS 105 N -2.00 0.93 -0.14 1.61 -2.85 -1.26 -0.92 119.74 115.11 3n99 s LYS 105 Ca 0.06 -0.05 -0.03 0.00 -1.00 0.00 0.00 55.97 54.95 3n99 s LYS 105 Cb -0.00 0.43 0.05 0.00 -2.06 0.00 0.00 37.83 36.24 3n99 s LYS 105 CO -0.00 -0.30 0.05 -1.58 0.10 0.00 0.00 175.35 173.62 3n99 s HIS 106 N -1.64 0.53 0.65 1.78 2.46 -0.17 -4.14 115.29 114.76 3n99 s HIS 106 Ca -0.10 -0.37 -0.11 0.00 0.47 0.00 0.00 55.06 54.95 3n99 s HIS 106 Cb -0.02 -0.79 -0.02 0.00 -0.13 0.00 0.00 32.58 31.63 3n99 s HIS 106 CO 0.04 -0.46 1.05 0.20 -2.47 0.00 0.00 174.74 173.11 3n99 s GLY 107 N 2.02 1.65 0.00 1.59 0.00 -1.26 -1.29 107.32 110.04 3n99 s GLY 107 Ca 0.02 -0.12 0.00 0.00 0.00 0.00 0.00 44.72 44.62 3n99 s GLY 107 CO -0.07 0.18 0.00 0.61 0.00 0.00 0.00 173.10 173.82 3n99 n GLY 108 N -2.67 1.36 0.26 0.20 0.00 -1.26 -4.31 105.19 98.77 3n99 n GLY 108 Ca 0.06 -0.67 0.14 0.00 0.00 0.00 0.00 46.02 45.56 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 0.33 -4.88 1.61 -1.51 -2.04 -3.47 116.25 106.29 3n99 h VAL 109 Ca 0.00 -0.72 -0.06 0.00 -1.23 0.00 0.00 66.70 64.69 3n99 h VAL 109 Cb 0.00 1.54 0.05 0.00 -2.13 0.00 0.00 31.29 30.75 3n99 h VAL 109 CO 0.00 0.11 -0.21 0.59 -1.23 0.00 0.00 177.57 176.82 3n99 n ASN 110 N -3.32 -6.27 -4.59 4.19 3.02 -0.88 -4.94 115.26 102.47 3n99 n ASN 110 Ca -0.00 -0.21 -0.33 0.00 -0.03 0.00 0.00 54.58 54.00 3n99 n ASN 110 Cb 0.32 -4.33 -0.11 0.00 -0.61 0.00 0.00 39.78 35.06 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 -3.10 2.91 -0.16 3.10 3.76 -0.41 -4.47 115.29 116.93 3n99 s HIS 111 Ca 0.11 -0.01 -0.08 0.00 -0.15 0.00 0.00 55.06 54.93 3n99 s HIS 111 Cb -0.01 -1.65 -0.04 0.00 1.11 0.00 0.00 32.58 31.98 3n99 s HIS 111 CO 0.59 0.35 0.12 0.08 -0.85 0.00 0.00 174.74 175.03 3n99 s VAL 112 N -0.91 5.30 -0.15 -0.90 1.01 -0.15 -0.99 120.40 123.60 3n99 s VAL 112 Ca 0.15 0.14 -0.05 0.00 0.00 0.00 0.00 61.98 62.22 3n99 s VAL 112 Cb -0.11 -3.35 -0.03 0.00 0.00 0.00 0.00 36.38 32.88 3n99 s VAL 112 CO 0.05 0.53 0.01 -0.76 0.00 0.00 0.00 175.10 174.93 3n99 s LEU 113 N -0.33 3.57 -0.01 3.92 1.43 -0.10 -0.71 118.68 126.46 3n99 s LEU 113 Ca 0.11 0.03 0.04 0.00 -1.03 0.00 0.00 54.13 53.27 3n99 s LEU 113 Cb -0.12 -1.87 -0.01 0.00 0.03 0.00 0.00 46.19 44.23 3n99 s LEU 113 CO 0.01 0.23 -0.11 -0.69 0.23 0.00 0.00 176.35 176.01 3n99 s VAL 114 N 0.04 0.90 -0.25 -1.59 1.01 -0.10 -0.08 120.40 120.33 3n99 s VAL 114 Ca 0.03 -0.51 -0.10 0.00 0.00 0.00 0.00 61.98 61.39 3n99 s VAL 114 Cb -0.13 -0.76 -0.05 0.00 0.00 0.00 0.00 36.38 35.45 3n99 s VAL 114 CO 0.02 0.24 0.16 -2.28 0.00 0.00 0.00 175.10 173.23 3n99 s HIS 115 N -0.30 3.24 0.29 5.22 2.46 0.08 -0.84 115.29 125.45 3n99 s HIS 115 Ca 0.04 0.09 0.10 0.00 0.47 0.00 0.00 55.06 55.77 3n99 s HIS 115 Cb -0.05 -2.30 -0.05 0.00 -0.13 0.00 0.00 32.58 30.05 3n99 s HIS 115 CO -0.00 -0.08 -0.06 -0.06 -2.47 0.00 0.00 174.74 172.07 3n99 s PHE 116 N 1.39 2.54 0.68 3.88 0.08 -1.26 -1.54 117.98 123.75 3n99 s PHE 116 Ca 0.07 -0.32 -0.15 0.00 0.12 0.00 0.00 56.93 56.66 3n99 s PHE 116 Cb -0.15 -1.22 0.01 0.00 -0.57 0.00 0.00 43.02 41.09 3n99 s PHE 116 CO 0.07 0.61 1.13 -1.21 -0.10 0.00 0.00 175.22 175.72 3n99 s GLU 117 N -3.64 2.62 0.35 0.44 0.41 -1.26 -4.89 118.70 112.73 3n99 s GLU 117 Ca 0.32 1.46 0.03 0.00 -0.41 0.00 0.00 54.97 56.37 3n99 s GLU 117 Cb -0.04 -1.92 0.66 0.00 -1.78 0.00 0.00 34.13 31.05 3n99 s GLU 117 CO 0.18 -1.40 1.99 1.49 -0.49 0.00 0.00 175.26 177.03 3n99 h GLU 118 N -0.10 0.81 -0.62 1.61 4.81 -2.01 -2.20 114.58 116.88 3n99 h GLU 118 Ca -0.47 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.70 3n99 h GLU 118 Cb 1.26 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 30.42 3n99 h GLU 118 CO 0.53 0.54 0.35 0.93 -0.73 0.00 0.00 179.01 180.63 3n99 h GLU 119 N 0.84 0.85 -0.86 1.92 3.07 -2.04 -2.84 114.58 115.52 3n99 h GLU 119 Ca 0.27 -0.08 -0.01 0.00 -0.50 0.00 0.00 59.36 59.03 3n99 h GLU 119 Cb 0.04 -0.18 -0.04 0.00 -0.84 0.00 0.00 28.75 27.73 3n99 h GLU 119 CO -0.07 0.61 0.48 0.28 -1.40 0.00 0.00 179.01 178.91 3n99 h VAL 120 N 0.86 1.25 -0.85 3.13 2.07 -1.76 -3.24 116.25 117.71 3n99 h VAL 120 Ca 0.22 -0.61 0.08 0.00 0.82 0.00 0.00 66.70 67.22 3n99 h VAL 120 Cb 0.00 0.08 -0.06 0.00 -1.52 0.00 0.00 31.29 29.79 3n99 h VAL 120 CO -0.04 0.28 0.56 -0.07 0.02 0.00 0.00 177.57 178.31 3n99 h LEU 121 N 1.20 0.79 -1.95 2.57 3.38 -1.56 0.60 115.31 120.33 3n99 h LEU 121 Ca 0.30 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.29 3n99 h LEU 121 Cb 0.02 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 3n99 h LEU 121 CO -0.05 0.49 -0.00 1.23 0.09 0.00 0.00 178.44 180.19 3n99 h GLY 122 N 0.88 0.00 0.98 0.83 0.00 -1.71 -2.53 103.07 101.52 3n99 h GLY 122 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 3n99 h GLY 122 CO -0.15 0.00 -0.69 0.28 0.00 0.00 0.00 176.54 175.98 3n99 n LYS 123 N -3.10 0.21 -1.99 4.80 5.02 0.19 -4.98 118.16 118.31 3n99 n LYS 123 Ca -0.01 0.04 -0.32 0.00 -2.02 0.00 0.00 58.31 56.01 3n99 n LYS 123 Cb 0.23 -1.61 0.00 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 -3.81 3.36 -0.02 -0.35 1.43 -0.96 -4.22 118.68 114.12 3n99 s LEU 124 Ca 0.07 1.55 -0.02 0.00 -1.03 0.00 0.00 54.13 54.69 3n99 s LEU 124 Cb 0.15 -4.49 0.00 0.00 0.03 0.00 0.00 46.19 41.88 3n99 s LEU 124 CO 0.73 -0.93 0.06 -0.32 0.23 0.00 0.00 176.35 176.12 3n99 s MET 125 N -4.70 0.12 0.30 1.70 -2.45 -1.26 -5.06 119.30 107.95 3n99 s MET 125 Ca 0.58 -0.02 -0.29 0.00 -1.25 0.00 0.00 55.69 54.71 3n99 s MET 125 Cb -0.12 0.05 -0.12 0.00 1.25 0.00 0.00 34.83 35.89 3n99 s MET 125 CO 0.46 -0.02 1.39 0.28 1.05 0.00 0.00 175.02 178.17 3n99 n VAL 126 N 2.80 1.49 0.00 10.11 0.31 -1.26 -1.59 118.33 130.20 3n99 n VAL 126 Ca -0.14 -0.37 0.00 0.00 -0.01 0.00 0.00 64.34 63.82 3n99 n VAL 126 Cb 0.59 -1.62 0.00 0.00 -0.91 0.00 0.00 33.84 31.90 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 1.43 2.57 3.74 2.92 0.00 0.26 -4.93 105.19 111.18 3n99 n GLY 127 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 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 2.73 -4.74 1.61 8.00 -0.62 -4.48 116.55 119.05 3n99 n ASP 128 Ca 0.00 1.01 -0.41 0.00 0.71 0.00 0.00 54.79 56.11 3n99 n ASP 128 Cb 0.00 -1.57 -0.05 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 -2.73 4.70 -0.06 -1.24 1.02 -1.26 -1.32 119.74 118.84 3n99 s LYS 129 Ca 0.69 1.38 0.04 0.00 0.02 0.00 0.00 55.97 58.09 3n99 s LYS 129 Cb -0.43 -3.34 0.00 0.00 -0.52 0.00 0.00 37.83 33.54 3n99 s LYS 129 CO 0.52 0.32 -0.17 0.42 -0.92 0.00 0.00 175.35 175.51 3n99 s ILE 130 N -0.37 1.50 -0.23 2.17 -1.09 0.08 -0.63 121.20 122.62 3n99 s ILE 130 Ca 0.43 -0.72 -0.05 0.00 -2.23 0.00 0.00 60.65 58.09 3n99 s ILE 130 Cb -0.24 -1.31 -0.01 0.00 -1.58 0.00 0.00 42.46 39.33 3n99 s ILE 130 CO 0.29 0.43 -0.02 -0.22 -1.23 0.00 0.00 174.94 174.20 3n99 s LEU 131 N 0.29 3.06 -0.20 2.97 2.96 -0.65 -1.26 118.68 125.84 3n99 s LEU 131 Ca -0.10 -0.39 -0.09 0.00 -0.22 0.00 0.00 54.13 53.33 3n99 s LEU 131 Cb -0.14 -1.78 -0.04 0.00 0.50 0.00 0.00 46.19 44.72 3n99 s LEU 131 CO 0.04 -0.04 0.10 -0.63 -1.32 0.00 0.00 176.35 174.51 3n99 s ILE 132 N 1.50 5.05 -0.96 6.68 1.01 0.79 -0.84 121.20 134.43 3n99 s ILE 132 Ca 0.06 0.06 -0.17 0.00 0.00 0.00 0.00 60.65 60.60 3n99 s ILE 132 Cb -0.15 -3.30 0.15 0.00 0.01 0.00 0.00 42.46 39.17 3n99 s ILE 132 CO -0.02 0.42 1.12 -0.54 0.00 0.00 0.00 174.94 175.92 3n99 s LYS 133 N 0.58 3.69 0.11 2.79 1.02 -0.42 -0.73 119.74 126.77 3n99 s LYS 133 Ca 0.05 -2.02 -0.30 0.00 0.02 0.00 0.00 55.97 53.72 3n99 s LYS 133 Cb -0.12 -4.86 -0.06 0.00 -0.52 0.00 0.00 37.83 32.27 3n99 s LYS 133 CO 0.01 -1.69 1.03 0.00 -0.92 0.00 0.00 175.35 173.78 3n99 s ALA 134 N 2.05 3.28 -0.29 5.17 0.00 -0.62 -4.25 121.76 127.11 3n99 s ALA 134 Ca 0.32 0.67 -0.15 0.00 0.00 0.00 0.00 51.96 52.80 3n99 s ALA 134 Cb -0.05 -3.33 0.12 0.00 0.00 0.00 0.00 23.12 19.86 3n99 s ALA 134 CO -0.08 -0.16 0.84 -0.46 0.00 0.00 0.00 175.76 175.89 3n99 s TRP 135 N 0.23 -0.86 0.00 0.00 -0.00 -1.26 -2.05 118.94 114.99 3n99 s TRP 135 Ca 0.50 1.65 0.00 0.00 -0.00 0.00 0.00 56.10 58.25 3n99 s TRP 135 Cb -0.25 0.52 0.00 0.00 -0.00 0.00 0.00 33.47 33.73 3n99 s TRP 135 CO 0.31 -0.43 0.00 0.41 -0.00 0.00 0.00 176.95 177.24 3n99 n GLY 136 N 4.35 1.96 3.76 5.86 0.00 -1.26 -4.15 105.19 115.70 3n99 n GLY 136 Ca -0.17 -0.13 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 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 4.58 0.00 1.61 -1.52 -1.26 -1.95 119.66 121.12 3n99 s GLN 137 Ca 0.00 1.88 0.00 0.00 -1.95 0.00 0.00 55.36 55.29 3n99 s GLN 137 Cb 0.00 -3.17 0.00 0.00 -0.22 0.00 0.00 33.01 29.62 3n99 s GLN 137 CO 0.00 0.13 0.00 0.41 -0.25 0.00 0.00 175.29 175.58 3n99 n GLY 138 N 1.17 1.11 3.68 3.09 0.00 -1.26 -4.75 105.19 108.23 3n99 n GLY 138 Ca -0.01 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.56 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 3.21 -4.16 0.99 7.94 -0.82 -4.98 117.00 119.18 3n99 n LEU 139 Ca 0.00 1.11 -0.25 0.00 -1.11 0.00 0.00 56.01 55.76 3n99 n LEU 139 Cb 0.00 -1.44 -0.15 0.00 0.53 0.00 0.00 43.42 42.35 3n99 n LEU 139 CO 0.00 -0.32 -0.50 -0.54 -1.11 0.00 0.00 177.39 174.92 3n99 s LYS 140 N 0.33 1.44 -0.53 1.96 1.02 -1.26 -4.39 119.74 118.32 3n99 s LYS 140 Ca 0.74 -0.61 -0.23 0.00 0.02 0.00 0.00 55.97 55.88 3n99 s LYS 140 Cb -0.65 -1.37 0.04 0.00 -0.52 0.00 0.00 37.83 35.33 3n99 s LYS 140 CO 0.43 0.35 0.88 -0.51 -0.92 0.00 0.00 175.35 175.58 3n99 s LEU 141 N -0.34 4.24 0.36 3.17 1.43 -1.26 -2.94 118.68 123.34 3n99 s LEU 141 Ca 0.05 -0.39 0.17 0.00 -1.03 0.00 0.00 54.13 52.93 3n99 s LEU 141 Cb -0.07 -2.80 0.65 0.00 0.03 0.00 0.00 46.19 44.00 3n99 s LEU 141 CO -0.00 -1.14 1.74 -0.07 0.23 0.00 0.00 176.35 177.11 3n99 h LEU 142 N 10.68 0.00 -0.35 1.79 3.38 -1.39 -1.38 115.31 128.03 3n99 h LEU 142 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 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 1.05 0.42 -0.17 0.47 0.09 0.00 0.00 178.44 180.30 3n99 n ASP 143 N -3.67 0.72 -3.16 -0.43 8.00 -1.26 -4.51 116.55 112.24 3n99 n ASP 143 Ca -0.01 -0.71 -0.24 0.00 0.71 0.00 0.00 54.79 54.54 3n99 n ASP 143 Cb 0.50 0.02 -0.05 0.00 -0.02 0.00 0.00 41.12 41.57 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 -0.81 2.18 0.27 1.24 8.25 -0.52 -4.96 115.22 120.86 3n99 n HIS 144 Ca 0.13 -3.91 0.18 0.00 -0.26 0.00 0.00 57.72 53.86 3n99 n HIS 144 Cb 0.31 -0.46 0.90 0.00 1.12 0.00 0.00 29.99 31.85 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 3.45 0.00 -0.21 -0.41 0.13 -1.78 -0.95 132.00 132.22 3n99 h PRO 145 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 3n99 h PRO 145 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 3n99 h PRO 145 CO 0.68 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.20 3n99 n ASP 146 N -3.29 2.56 -4.48 1.44 8.00 -1.26 -4.79 116.55 114.73 3n99 n ASP 146 Ca -0.00 -1.85 -0.39 0.00 0.71 0.00 0.00 54.79 53.27 3n99 n ASP 146 Cb 0.33 -0.13 -0.11 0.00 -0.02 0.00 0.00 41.12 41.18 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 -1.74 4.84 -0.08 2.53 1.01 -0.36 -4.58 120.40 122.01 3n99 s VAL 147 Ca 0.35 -0.27 -0.13 0.00 0.00 0.00 0.00 61.98 61.93 3n99 s VAL 147 Cb 0.20 -3.43 -0.05 0.00 0.00 0.00 0.00 36.38 33.10 3n99 s VAL 147 CO 0.30 0.10 0.33 -0.54 0.00 0.00 0.00 175.10 175.28 3n99 s LYS 148 N 1.66 3.98 0.21 2.72 -0.14 -0.07 -4.60 119.74 123.49 3n99 s LYS 148 Ca 0.05 0.21 0.09 0.00 -1.36 0.00 0.00 55.97 54.97 3n99 s LYS 148 Cb -0.17 -3.30 -0.04 0.00 -1.68 0.00 0.00 37.83 32.64 3n99 s LYS 148 CO 0.08 0.51 -0.08 0.14 -0.76 0.00 0.00 175.35 175.24 3n99 s VAL 149 N -0.42 3.21 0.02 3.17 -7.23 -1.26 -1.50 120.40 116.39 3n99 s VAL 149 Ca 0.20 -1.80 -0.28 0.00 -1.81 0.00 0.00 61.98 58.29 3n99 s VAL 149 Cb -0.14 -2.63 0.10 0.00 0.56 0.00 0.00 36.38 34.26 3n99 s VAL 149 CO 0.08 -0.21 0.97 0.00 -0.31 0.00 0.00 175.10 175.63 3n99 s MET 150 N -3.14 0.85 -1.75 4.82 0.23 -0.91 -4.69 119.30 114.72 3n99 s MET 150 Ca 0.27 -0.38 0.00 0.00 -1.03 0.00 0.00 55.69 54.55 3n99 s MET 150 Cb -0.08 0.35 0.00 0.00 -1.53 0.00 0.00 34.83 33.57 3n99 s MET 150 CO 0.17 -0.38 0.00 0.09 -2.03 0.00 0.00 175.02 172.86 3n99 n ASN 151 N -0.32 -5.30 -3.76 -1.18 3.02 -1.26 -4.28 115.26 102.19 3n99 n ASN 151 Ca -0.07 0.41 -0.16 0.00 -0.03 0.00 0.00 54.58 54.72 3n99 n ASN 151 Cb 0.61 -4.25 -0.16 0.00 -0.61 0.00 0.00 39.78 35.37 3n99 n ASN 151 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 3n99 s ILE 152 N -2.51 -0.03 0.11 2.41 1.10 -1.26 -0.58 121.20 120.44 3n99 s ILE 152 Ca 0.00 0.24 -0.34 0.00 -0.51 0.00 0.00 60.65 60.05 3n99 s ILE 152 Cb 0.00 -0.12 -0.13 0.00 0.15 0.00 0.00 42.46 42.36 3n99 s ILE 152 CO 0.00 0.12 1.68 -0.67 -2.11 0.00 0.00 174.94 173.95 3n99 n ASP 153 N 4.40 3.33 0.25 4.50 -0.08 0.31 -4.55 116.55 124.70 3n99 n ASP 153 Ca -0.23 1.05 0.08 0.00 -1.51 0.00 0.00 54.79 54.18 3n99 n ASP 153 Cb 0.50 -1.44 0.62 0.00 2.34 0.00 0.00 41.12 43.15 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 6.94 0.00 -0.25 -0.67 0.11 -1.90 -0.53 132.00 135.70 3n99 h PRO 154 Ca -0.46 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.50 3n99 h PRO 154 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3n99 h PRO 154 CO 0.91 0.12 -0.45 -0.44 -0.21 0.00 0.00 178.00 177.93 3n99 h ASP 155 N 0.00 0.83 -0.69 -2.05 3.32 -1.96 -2.88 116.42 112.99 3n99 h ASP 155 Ca -0.00 -0.53 -0.03 0.00 0.02 0.00 0.00 57.03 56.49 3n99 h ASP 155 Cb 0.24 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 3n99 h ASP 155 CO 0.02 1.21 0.31 0.25 -1.72 0.00 0.00 179.24 179.30 3n99 h LEU 156 N 0.49 0.92 -0.92 1.55 5.85 -1.73 -2.82 115.31 118.66 3n99 h LEU 156 Ca 0.02 -0.15 0.15 0.00 0.84 0.00 0.00 57.88 58.74 3n99 h LEU 156 Cb 1.05 -0.24 -0.10 0.00 0.37 0.00 0.00 40.66 41.75 3n99 h LEU 156 CO 0.10 0.82 0.52 0.15 -0.34 0.00 0.00 178.44 179.69 3n99 h PHE 157 N 0.97 0.92 0.00 1.25 3.57 -1.01 -0.21 116.94 122.43 3n99 h PHE 157 Ca 0.23 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.77 3n99 h PHE 157 Cb 0.16 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.63 3n99 h PHE 157 CO 0.01 0.25 0.00 0.39 -2.23 0.00 0.00 178.31 176.73 3n99 n GLU 158 N -4.79 0.06 -0.11 1.11 1.02 -1.06 -2.73 120.64 114.13 3n99 n GLU 158 Ca 0.19 0.30 0.09 0.00 -0.02 0.00 0.00 57.16 57.71 3n99 n GLU 158 Cb 0.45 -1.61 0.14 0.00 -0.02 0.00 0.00 31.44 30.40 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 -1.71 1.97 0.00 3.49 5.02 -0.09 -4.55 118.16 122.28 3n99 n LYS 159 Ca 0.03 -1.87 0.15 0.00 -2.02 0.00 0.00 58.31 54.61 3n99 n LYS 159 Cb 0.19 -1.37 0.80 0.00 -0.02 0.00 0.00 35.03 34.63 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 1.03 0.08 0.00 -0.35 4.77 -1.10 -4.90 117.00 116.52 3n99 n LEU 160 Ca 0.13 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 3n99 n LEU 160 Cb 0.47 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 3n99 n LEU 160 CO 0.12 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.80 3n99 n GLY 161 N 1.19 0.56 3.75 -0.72 0.00 -1.26 -4.72 105.19 104.00 3n99 n GLY 161 Ca 0.18 -0.21 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 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 3.01 -0.06 -0.61 1.01 -1.26 -4.64 121.20 116.66 3n99 s ILE 162 Ca 0.00 0.93 0.02 0.00 0.00 0.00 0.00 60.65 61.60 3n99 s ILE 162 Cb 0.00 -3.59 0.01 0.00 0.01 0.00 0.00 42.46 38.89 3n99 s ILE 162 CO 0.00 0.18 -0.11 -1.10 0.00 0.00 0.00 174.94 173.92 3n99 s GLN 163 N -0.99 1.47 -0.22 2.79 -0.21 -0.70 -4.97 119.66 116.83 3n99 s GLN 163 Ca 0.52 -0.35 -0.18 0.00 0.02 0.00 0.00 55.36 55.38 3n99 s GLN 163 Cb -0.38 -1.26 -0.03 0.00 1.00 0.00 0.00 33.01 32.35 3n99 s GLN 163 CO 0.45 0.02 0.49 -2.00 -2.12 0.00 0.00 175.29 172.13 3n99 s GLU 164 N 0.67 4.15 -0.15 2.91 2.12 -1.26 -0.75 118.70 126.39 3n99 s GLU 164 Ca -0.13 0.34 -0.04 0.00 0.36 0.00 0.00 54.97 55.50 3n99 s GLU 164 Cb -0.15 -3.58 0.07 0.00 0.26 0.00 0.00 34.13 30.73 3n99 s GLU 164 CO 0.03 -0.19 0.25 0.21 -0.54 0.00 0.00 175.26 175.02 3n99 s LYS 165 N 1.77 0.15 -1.28 4.30 2.20 0.40 -4.92 119.74 122.37 3n99 s LYS 165 Ca 0.22 0.59 -0.02 0.00 -0.36 0.00 0.00 55.97 56.40 3n99 s LYS 165 Cb -0.15 -0.35 -0.00 0.00 -1.51 0.00 0.00 37.83 35.81 3n99 s LYS 165 CO 0.09 -0.39 0.70 0.09 -0.36 0.00 0.00 175.35 175.48 3n99 n ASN 166 N 5.34 -1.74 0.00 1.43 3.02 -1.26 -2.18 115.26 119.87 3n99 n ASN 166 Ca -0.06 -0.84 0.00 0.00 -0.03 0.00 0.00 54.58 53.65 3n99 n ASN 166 Cb 0.50 -3.99 0.00 0.00 -0.61 0.00 0.00 39.78 35.68 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 -1.59 1.43 3.65 7.41 0.00 -1.26 -5.01 105.19 109.82 3n99 n GLY 167 Ca -0.27 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.14 2.38 -0.30 1.61 1.02 -0.93 -4.96 119.74 118.42 3n99 s LYS 168 Ca 0.00 -0.92 -0.05 0.00 0.02 0.00 0.00 55.97 55.02 3n99 s LYS 168 Cb 0.00 -2.44 0.02 0.00 -0.52 0.00 0.00 37.83 34.89 3n99 s LYS 168 CO 0.00 0.52 0.05 0.42 -0.92 0.00 0.00 175.35 175.43 3n99 s ILE 169 N -1.30 3.64 -0.20 2.17 1.01 -0.09 -0.45 121.20 125.98 3n99 s ILE 169 Ca 0.24 -0.92 -0.15 0.00 0.00 0.00 0.00 60.65 59.83 3n99 s ILE 169 Cb -0.11 -2.94 -0.04 0.00 0.01 0.00 0.00 42.46 39.38 3n99 s ILE 169 CO 0.17 0.02 0.35 -1.00 0.00 0.00 0.00 174.94 174.48 3n99 s HIS 170 N 1.42 3.37 -0.18 3.97 3.76 0.07 0.25 115.29 127.95 3n99 s HIS 170 Ca 0.00 0.55 0.01 0.00 -0.15 0.00 0.00 55.06 55.47 3n99 s HIS 170 Cb -0.18 -2.47 0.04 0.00 1.11 0.00 0.00 32.58 31.08 3n99 s HIS 170 CO 0.01 0.03 -0.11 0.08 -0.85 0.00 0.00 174.74 173.89 3n99 s VAL 171 N 1.19 1.59 0.10 -0.90 1.01 -0.30 -1.73 120.40 121.36 3n99 s VAL 171 Ca 0.17 -0.88 -0.31 0.00 0.00 0.00 0.00 61.98 60.96 3n99 s VAL 171 Cb -0.14 -1.62 -0.08 0.00 0.00 0.00 0.00 36.38 34.53 3n99 s VAL 171 CO 0.07 0.25 1.54 -2.84 0.00 0.00 0.00 175.10 174.12 3n99 s PRO 172 N 1.44 4.24 0.05 2.72 0.02 -1.26 -0.01 135.00 142.19 3n99 s PRO 172 Ca 0.01 2.24 -0.01 0.00 0.02 0.00 0.00 61.00 63.26 3n99 s PRO 172 Cb -0.15 -3.40 -0.04 0.00 0.02 0.00 0.00 34.50 30.94 3n99 s PRO 172 CO -0.09 -0.62 -0.03 0.14 -0.33 0.00 0.00 177.00 176.07 3n99 s VAL 173 N 1.87 0.23 -0.88 3.83 -7.23 -0.66 -4.84 120.40 112.72 3n99 s VAL 173 Ca 0.70 -1.71 0.23 0.00 -1.81 0.00 0.00 61.98 59.39 3n99 s VAL 173 Cb -0.39 -1.38 -0.13 0.00 0.56 0.00 0.00 36.38 35.04 3n99 s VAL 173 CO 0.31 -0.94 1.09 1.33 -0.31 0.00 0.00 175.10 176.58 3n99 n VAL 174 N 0.28 0.04 -3.52 1.32 0.24 0.00 -0.88 118.33 115.82 3n99 n VAL 174 Ca -0.15 -0.07 -0.12 0.00 -2.04 0.00 0.00 64.34 61.96 3n99 n VAL 174 Cb 0.60 0.53 -0.04 0.00 -1.47 0.00 0.00 33.84 33.46 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 -3.06 -1.82 -0.21 2.33 0.00 -1.26 -4.78 121.76 112.96 3n99 s ALA 175 Ca 0.08 1.21 0.01 0.00 0.00 0.00 0.00 51.96 53.26 3n99 s ALA 175 Cb 0.16 -0.00 0.03 0.00 0.00 0.00 0.00 23.12 23.31 3n99 s ALA 175 CO 0.80 -0.49 -0.15 0.15 0.00 0.00 0.00 175.76 176.06 3n99 s LYS 176 N -2.03 2.74 -0.22 0.00 1.02 -1.26 -1.49 119.74 118.51 3n99 s LYS 176 Ca -0.02 -1.01 -0.07 0.00 0.02 0.00 0.00 55.97 54.90 3n99 s LYS 176 Cb -0.01 -2.72 -0.03 0.00 -0.52 0.00 0.00 37.83 34.55 3n99 s LYS 176 CO -0.01 -0.34 0.05 0.42 -0.92 0.00 0.00 175.35 174.55 3n99 s ILE 177 N 1.24 4.33 0.47 2.17 1.01 -0.09 -4.94 121.20 125.38 3n99 s ILE 177 Ca 0.00 -0.18 -0.23 0.00 0.00 0.00 0.00 60.65 60.24 3n99 s ILE 177 Cb -0.16 -2.99 -0.07 0.00 0.01 0.00 0.00 42.46 39.26 3n99 s ILE 177 CO -0.09 0.39 1.26 -2.84 0.00 0.00 0.00 174.94 173.66 3n99 s PRO 178 N 1.12 3.64 0.32 2.79 0.02 -1.26 -0.42 135.00 141.21 3n99 s PRO 178 Ca 0.04 2.01 0.07 0.00 0.02 0.00 0.00 61.00 63.13 3n99 s PRO 178 Cb -0.14 -2.47 0.88 0.00 0.02 0.00 0.00 34.50 32.79 3n99 s PRO 178 CO 0.03 -0.71 1.61 0.00 -0.33 0.00 0.00 177.00 177.59 3n99 h ALA 179 N 2.06 1.47 0.00 -1.55 0.00 -1.84 -0.74 119.26 118.66 3n99 h ALA 179 Ca -0.50 0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3n99 h ALA 179 Cb 1.26 0.41 0.00 0.00 0.00 0.00 0.00 17.79 19.46 3n99 h ALA 179 CO 0.60 -0.61 0.00 -2.39 0.00 0.00 0.00 179.25 176.85 3n99 n HIS 180 N -5.32 0.70 1.31 0.00 1.44 -1.26 -1.28 115.22 110.81 3n99 n HIS 180 Ca 0.26 0.29 0.11 0.00 -2.01 0.00 0.00 57.72 56.37 3n99 n HIS 180 Cb 0.86 -0.96 0.41 0.00 0.12 0.00 0.00 29.99 30.41 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 -2.15 1.66 -3.73 -1.40 2.00 -0.28 -4.83 117.12 108.40 3n99 n MET 181 Ca 0.02 -1.00 -0.37 0.00 0.00 0.00 0.00 57.70 56.35 3n99 n MET 181 Cb 0.19 -1.40 -0.06 0.00 0.00 0.00 0.00 33.22 31.95 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 -1.83 3.63 0.00 0.03 -1.94 -0.40 0.33 119.30 119.13 3n99 s MET 182 Ca 0.33 0.08 0.00 0.00 -1.71 0.00 0.00 55.69 54.39 3n99 s MET 182 Cb 0.17 -3.19 0.00 0.00 2.01 0.00 0.00 34.83 33.82 3n99 s MET 182 CO 0.27 0.74 0.00 0.41 -0.01 0.00 0.00 175.02 176.42 3n99 n GLY 183 N 1.86 3.46 3.65 -0.03 0.00 0.29 -4.86 105.19 109.57 3n99 n GLY 183 Ca -0.17 -0.41 -0.53 0.00 0.00 0.00 0.00 46.02 44.91 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 2.17 0.00 1.61 2.88 -0.48 -1.87 113.62 117.94 3n99 n SER 184 Ca 0.00 1.09 0.00 0.00 -1.33 0.00 0.00 58.87 58.63 3n99 n SER 184 Cb 0.00 -1.21 0.00 0.00 -0.75 0.00 0.00 64.21 62.25 3n99 n SER 184 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3n99 n GLY 185 N 3.32 2.10 3.61 0.46 0.00 -1.26 -0.94 105.19 112.49 3n99 n GLY 185 Ca 0.21 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.39 0.49 -0.09 -0.61 5.41 -0.78 -1.04 119.36 122.36 3n99 n ILE 186 Ca 0.00 -0.12 0.00 0.00 1.00 0.00 0.00 62.75 63.63 3n99 n ILE 186 Cb 0.00 -1.07 0.00 0.00 -0.71 0.00 0.00 39.64 37.86 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 2.42 0.78 3.61 7.39 0.00 -0.39 -4.99 105.19 114.00 3n99 n GLY 187 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.35 0.10 -0.02 4.61 0.00 -0.20 -4.73 120.51 118.92 3n99 n ALA 188 Ca 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 53.44 53.42 3n99 n ALA 188 Cb 0.00 -2.09 0.22 0.00 0.00 0.00 0.00 19.45 17.58 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 0.49 0.55 -3.28 0.00 0.87 -1.92 -2.14 113.55 108.12 3n99 h SER 189 Ca -0.48 -0.15 -0.24 0.00 -1.23 0.00 0.00 61.79 59.69 3n99 h SER 189 Cb 1.37 -0.15 -0.32 0.00 -0.44 0.00 0.00 62.40 62.86 3n99 h SER 189 CO 0.51 0.70 -0.58 -0.55 -0.53 0.00 0.00 176.83 176.38 3n99 s SER 190 N -6.75 0.10 0.00 6.23 0.15 -1.26 -3.70 113.70 108.46 3n99 s SER 190 Ca -0.08 0.39 0.04 0.00 0.70 0.00 0.00 55.95 57.00 3n99 s SER 190 Cb 0.14 0.31 0.17 0.00 -1.71 0.00 0.00 66.02 64.94 3n99 s SER 190 CO 0.79 -0.18 1.12 -1.54 1.20 0.00 0.00 173.24 174.63 3n99 n SER 191 N 4.59 0.00 0.02 5.45 3.41 -0.27 -1.53 113.62 125.28 3n99 n SER 191 Ca -0.19 0.49 0.13 0.00 -0.26 0.00 0.00 58.87 59.04 3n99 n SER 191 Cb 0.51 -0.49 0.40 0.00 -0.26 0.00 0.00 64.21 64.37 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 -1.49 2.88 0.11 7.33 0.00 -1.26 -4.24 120.51 123.84 3n99 n ALA 192 Ca 0.01 -0.21 0.01 0.00 0.00 0.00 0.00 53.44 53.25 3n99 n ALA 192 Cb 0.05 -1.30 0.01 0.00 0.00 0.00 0.00 19.45 18.21 3n99 n ALA 192 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3n99 n SER 193 N -1.64 1.05 -3.94 0.00 7.64 -0.58 -4.09 113.62 112.06 3n99 n SER 193 Ca 0.06 -1.02 -0.08 0.00 1.01 0.00 0.00 58.87 58.83 3n99 n SER 193 Cb 0.36 0.16 -0.04 0.00 -1.01 0.00 0.00 64.21 63.68 3n99 n SER 193 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 3n99 s THR 194 N -0.39 0.00 0.43 0.44 -1.32 -1.23 -4.61 115.64 108.97 3n99 s THR 194 Ca 0.03 -1.24 0.08 0.00 -1.21 0.00 0.00 61.69 59.35 3n99 s THR 194 Cb 0.02 -2.10 0.01 0.00 -1.51 0.00 0.00 72.50 68.92 3n99 s THR 194 CO 0.04 -0.01 0.58 1.51 -2.21 0.00 0.00 174.62 174.54 3n99 s ASP 195 N -2.98 5.63 0.10 8.08 -4.77 -1.26 -4.66 116.67 116.81 3n99 s ASP 195 Ca 0.18 -0.44 -0.03 0.00 -3.30 0.00 0.00 52.55 48.95 3n99 s ASP 195 Cb -0.02 -0.61 -0.03 0.00 -1.09 0.00 0.00 42.92 41.17 3n99 s ASP 195 CO 0.08 -0.79 0.08 -0.72 0.70 0.00 0.00 175.17 174.51 3n99 s TYR 196 N -2.37 0.56 -0.11 2.11 1.13 -0.31 -4.70 117.35 113.66 3n99 s TYR 196 Ca 0.55 -1.01 -0.12 0.00 -1.41 0.00 0.00 57.07 55.09 3n99 s TYR 196 Cb -0.10 -0.32 -0.05 0.00 -1.10 0.00 0.00 41.96 40.39 3n99 s TYR 196 CO 0.33 -0.50 0.27 -0.51 -2.51 0.00 0.00 175.55 172.64 3n99 s ASP 197 N -2.96 6.50 -0.41 -0.18 1.11 -0.11 -0.16 116.67 120.46 3n99 s ASP 197 Ca 0.14 0.59 -0.29 0.00 0.18 0.00 0.00 52.55 53.17 3n99 s ASP 197 Cb 0.07 -2.17 0.02 0.00 1.07 0.00 0.00 42.92 41.91 3n99 s ASP 197 CO -0.05 0.23 1.14 -0.63 1.18 0.00 0.00 175.17 177.05 3n99 s ILE 198 N -0.27 4.29 -0.53 0.77 1.01 -0.03 -0.55 121.20 125.88 3n99 s ILE 198 Ca 0.17 1.39 -0.03 0.00 0.00 0.00 0.00 60.65 62.18 3n99 s ILE 198 Cb -0.13 -4.49 0.18 0.00 0.01 0.00 0.00 42.46 38.02 3n99 s ILE 198 CO 0.06 -0.78 2.45 1.15 0.00 0.00 0.00 174.94 177.82 3n99 n MET 199 N 7.49 2.41 -3.34 2.79 0.00 0.15 -2.82 117.12 123.80 3n99 n MET 199 Ca 0.12 -2.55 -0.38 0.00 0.00 0.00 0.00 57.70 54.90 3n99 n MET 199 Cb 0.48 -2.10 -0.07 0.00 0.00 0.00 0.00 33.22 31.53 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 -2.39 3.53 0.26 3.17 0.00 -1.26 -4.87 121.76 120.19 3n99 s ALA 200 Ca 0.54 -0.37 0.09 0.00 0.00 0.00 0.00 51.96 52.22 3n99 s ALA 200 Cb 0.38 -2.67 0.31 0.00 0.00 0.00 0.00 23.12 21.15 3n99 s ALA 200 CO -0.21 -0.20 1.59 0.77 0.00 0.00 0.00 175.76 177.71 3n99 h SER 201 N 7.10 0.05 -4.28 0.00 0.02 -1.90 -3.45 113.55 111.09 3n99 h SER 201 Ca -0.38 -0.03 -0.28 0.00 -0.84 0.00 0.00 61.79 60.26 3n99 h SER 201 Cb 1.17 -0.01 -0.25 0.00 0.14 0.00 0.00 62.40 63.44 3n99 h SER 201 CO 0.74 0.67 -0.74 0.20 -1.14 0.00 0.00 176.83 176.56 3n99 s ASN 202 N -6.85 0.61 0.39 3.07 0.02 -1.26 -5.01 114.94 105.91 3n99 s ASN 202 Ca -0.02 -0.28 0.10 0.00 -1.02 0.00 0.00 52.86 51.65 3n99 s ASN 202 Cb 0.12 -0.01 0.89 0.00 0.02 0.00 0.00 41.25 42.28 3n99 s ASN 202 CO 0.77 -0.07 1.95 1.55 0.02 0.00 0.00 177.10 181.32 3n99 h PRO 203 N 5.37 0.56 0.00 -0.60 0.13 -1.87 -1.03 132.00 134.57 3n99 h PRO 203 Ca -0.31 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3n99 h PRO 203 Cb 1.20 -0.13 -0.00 0.00 0.13 0.00 0.00 31.00 32.20 3n99 h PRO 203 CO 0.46 0.37 -0.02 0.93 -0.23 0.00 0.00 178.00 179.51 3n99 h GLU 204 N 0.58 0.00 0.00 0.86 3.07 -1.80 0.42 114.58 117.72 3n99 h GLU 204 Ca 0.33 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.19 3n99 h GLU 204 Cb 0.51 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.42 3n99 h GLU 204 CO -0.11 0.02 -0.01 -0.44 -1.40 0.00 0.00 179.01 177.07 3n99 h ASP 205 N 0.00 0.00 -0.27 1.42 3.32 -1.49 -0.27 116.42 119.13 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 0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.60 3n99 h ASP 205 CO 0.00 0.01 0.00 0.18 -1.72 0.00 0.00 179.24 177.71 3n99 n LEU 206 N -3.25 3.27 0.00 1.55 4.77 0.13 -4.97 117.00 118.50 3n99 n LEU 206 Ca -0.03 -1.31 0.00 0.00 -0.03 0.00 0.00 56.01 54.64 3n99 n LEU 206 Cb 0.10 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 3n99 n LEU 206 CO 0.23 0.66 0.00 0.61 -1.33 0.00 0.00 177.39 177.55 3n99 n GLY 207 N 1.45 0.47 3.29 -0.72 0.00 -0.11 -4.85 105.19 104.72 3n99 n GLY 207 Ca 0.18 -0.66 -0.16 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.00 1.44 -0.17 1.61 -7.23 -1.21 -5.00 120.40 107.85 3n99 s VAL 208 Ca 0.00 -2.10 0.16 0.00 -1.81 0.00 0.00 61.98 58.23 3n99 s VAL 208 Cb 0.00 -1.91 0.05 0.00 0.56 0.00 0.00 36.38 35.09 3n99 s VAL 208 CO 0.00 -0.65 1.39 0.00 -0.31 0.00 0.00 175.10 175.53 3n99 h ALA 209 N 2.75 0.68 -2.82 1.32 0.00 -1.96 -2.80 119.26 116.42 3n99 h ALA 209 Ca -0.38 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.03 3n99 h ALA 209 Cb 1.20 -0.04 -0.11 0.00 0.00 0.00 0.00 17.79 18.84 3n99 h ALA 209 CO 0.62 0.62 -0.02 0.34 0.00 0.00 0.00 179.25 180.81 3n99 s ASP 210 N -6.37 -0.25 -0.04 0.00 2.15 -1.26 -4.78 116.67 106.11 3n99 s ASP 210 Ca 0.03 -0.41 -0.01 0.00 0.43 0.00 0.00 52.55 52.59 3n99 s ASP 210 Cb 0.08 0.53 0.03 0.00 -0.30 0.00 0.00 42.92 43.26 3n99 s ASP 210 CO 0.75 -0.96 0.09 -0.22 -0.17 0.00 0.00 175.17 174.66 3n99 s LEU 211 N -2.85 0.90 0.04 -1.34 2.96 -1.26 -4.99 118.68 112.14 3n99 s LEU 211 Ca 0.07 0.18 0.04 0.00 -0.22 0.00 0.00 54.13 54.19 3n99 s LEU 211 Cb 0.00 0.16 -0.04 0.00 0.50 0.00 0.00 46.19 46.82 3n99 s LEU 211 CO -0.07 -0.14 -0.03 -0.54 -1.32 0.00 0.00 176.35 174.25 3n99 s LYS 212 N 1.11 2.55 0.17 1.98 1.02 -1.26 -0.54 119.74 124.76 3n99 s LYS 212 Ca -0.09 -0.77 -0.34 0.00 0.02 0.00 0.00 55.97 54.79 3n99 s LYS 212 Cb -0.12 -2.53 -0.14 0.00 -0.52 0.00 0.00 37.83 34.53 3n99 s LYS 212 CO -0.04 0.57 1.57 1.28 -0.92 0.00 0.00 175.35 177.81 3n99 n LEU 213 N 1.09 3.11 0.00 3.17 4.77 0.19 -0.89 117.00 128.45 3n99 n LEU 213 Ca -0.13 1.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.93 3n99 n LEU 213 Cb 0.52 -1.43 0.00 0.00 -2.33 0.00 0.00 43.42 40.18 3n99 n LEU 213 CO 0.34 -0.29 0.00 0.61 -1.33 0.00 0.00 177.39 176.73 3n99 n GLY 214 N 3.36 0.80 3.77 -0.72 0.00 0.47 -0.88 105.19 111.99 3n99 n GLY 214 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.72 6.42 -0.17 1.61 1.01 -0.07 -0.95 116.67 121.80 3n99 s ASP 215 Ca 0.00 2.34 -0.15 0.00 0.71 0.00 0.00 52.55 55.45 3n99 s ASP 215 Cb 0.00 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.28 3n99 s ASP 215 CO 0.00 -0.75 0.37 -0.63 0.21 0.00 0.00 175.17 174.37 3n99 s ILE 216 N -1.45 5.24 0.19 0.77 1.01 -0.45 -1.18 121.20 125.33 3n99 s ILE 216 Ca 0.59 0.69 0.07 0.00 0.00 0.00 0.00 60.65 61.99 3n99 s ILE 216 Cb -0.30 -3.71 -0.05 0.00 0.01 0.00 0.00 42.46 38.42 3n99 s ILE 216 CO 0.38 0.32 -0.13 0.68 0.00 0.00 0.00 174.94 176.18 3n99 s VAL 217 N 0.86 1.59 0.02 2.92 -7.23 -0.46 -0.82 120.40 117.29 3n99 s VAL 217 Ca 0.19 -2.16 0.02 0.00 -1.81 0.00 0.00 61.98 58.22 3n99 s VAL 217 Cb -0.14 -1.98 -0.04 0.00 0.56 0.00 0.00 36.38 34.78 3n99 s VAL 217 CO 0.07 -0.62 0.02 0.00 -0.31 0.00 0.00 175.10 174.26 3n99 s ALA 218 N -3.02 3.36 -0.20 1.32 0.00 -0.56 -0.61 121.76 122.06 3n99 s ALA 218 Ca 0.21 -0.97 0.01 0.00 0.00 0.00 0.00 51.96 51.22 3n99 s ALA 218 Cb -0.00 -1.37 0.03 0.00 0.00 0.00 0.00 23.12 21.78 3n99 s ALA 218 CO 0.05 0.67 -0.17 0.42 0.00 0.00 0.00 175.76 176.74 3n99 s ILE 219 N -1.17 2.05 0.15 0.00 1.01 0.68 -0.91 121.20 123.00 3n99 s ILE 219 Ca 0.22 -1.12 -0.27 0.00 0.00 0.00 0.00 60.65 59.48 3n99 s ILE 219 Cb -0.12 -1.95 -0.07 0.00 0.01 0.00 0.00 42.46 40.33 3n99 s ILE 219 CO 0.13 0.36 0.85 -1.10 0.00 0.00 0.00 174.94 175.19 3n99 s GLN 220 N 1.25 4.65 -1.43 2.79 -0.21 0.44 -1.99 119.66 125.15 3n99 s GLN 220 Ca 0.01 1.28 0.00 0.00 0.02 0.00 0.00 55.36 56.66 3n99 s GLN 220 Cb -0.15 -3.31 0.00 0.00 1.00 0.00 0.00 33.01 30.55 3n99 s GLN 220 CO -0.11 0.42 0.00 -0.25 -2.12 0.00 0.00 175.29 173.24 3n99 n ASP 221 N 2.08 -4.71 -4.23 5.90 8.00 -0.08 -2.53 116.55 120.99 3n99 n ASP 221 Ca -0.02 0.13 -0.33 0.00 0.71 0.00 0.00 54.79 55.28 3n99 n ASP 221 Cb 0.49 -3.74 -0.16 0.00 -0.02 0.00 0.00 41.12 37.68 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 -2.70 2.70 -0.13 1.24 3.76 -1.25 -0.80 115.29 118.11 3n99 s HIS 222 Ca 0.00 -1.14 -0.15 0.00 -0.15 0.00 0.00 55.06 53.62 3n99 s HIS 222 Cb 0.00 -1.83 -0.05 0.00 1.11 0.00 0.00 32.58 31.82 3n99 s HIS 222 CO 0.00 -0.50 0.36 0.34 -0.85 0.00 0.00 174.74 174.09 3n99 s ASP 223 N 0.71 6.55 -0.21 1.40 2.15 0.87 -3.41 116.67 124.72 3n99 s ASP 223 Ca -0.09 0.65 0.12 0.00 0.43 0.00 0.00 52.55 53.66 3n99 s ASP 223 Cb -0.16 -2.22 0.44 0.00 -0.30 0.00 0.00 42.92 40.68 3n99 s ASP 223 CO 0.01 0.08 1.20 0.59 -0.17 0.00 0.00 175.17 176.88 3n99 n ASN 224 N 3.47 2.58 -0.20 -0.34 3.02 -1.26 -2.35 115.26 120.18 3n99 n ASN 224 Ca -0.10 -3.54 -0.06 0.00 -0.03 0.00 0.00 54.58 50.85 3n99 n ASN 224 Cb 0.52 -0.45 0.09 0.00 -0.61 0.00 0.00 39.78 39.33 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 1.45 0.96 0.00 6.41 0.02 -1.94 -3.43 113.55 117.02 3n99 h SER 225 Ca 0.08 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 3n99 h SER 225 Cb 1.28 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.56 3n99 h SER 225 CO 0.25 0.96 0.00 -1.22 -1.14 0.00 0.00 176.83 175.68 3n99 n TYR 226 N -4.22 0.00 -1.43 3.45 4.01 -1.26 -4.94 117.16 112.76 3n99 n TYR 226 Ca 0.04 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.49 3n99 n TYR 226 Cb 0.28 0.00 0.13 0.00 -0.31 0.00 0.00 39.34 39.44 3n99 n TYR 226 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 3n99 s GLY 227 N -0.88 1.59 -0.01 2.72 0.00 -1.24 -1.12 107.32 108.39 3n99 s GLY 227 Ca 0.00 -0.33 -0.18 0.00 0.00 0.00 0.00 44.72 44.21 3n99 s GLY 227 CO 0.00 0.19 0.50 0.14 0.00 0.00 0.00 173.10 173.93 3n99 s VAL 228 N -3.14 4.97 -0.44 1.40 1.01 -0.81 -4.51 120.40 118.88 3n99 s VAL 228 Ca 0.63 1.04 -0.01 0.00 0.00 0.00 0.00 61.98 63.64 3n99 s VAL 228 Cb -0.16 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.40 3n99 s VAL 228 CO 0.55 0.48 0.12 0.61 0.00 0.00 0.00 175.10 176.87 3n99 n GLY 229 N 2.25 0.29 3.64 4.51 0.00 -1.25 -1.26 105.19 113.37 3n99 n GLY 229 Ca -0.10 -0.56 -0.43 0.00 0.00 0.00 0.00 46.02 44.93 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 -4.70 3.95 -0.01 1.61 2.47 -0.99 -4.80 119.74 117.28 3n99 s LYS 230 Ca 0.06 1.80 -0.30 0.00 -1.56 0.00 0.00 55.97 55.97 3n99 s LYS 230 Cb -0.03 -3.99 -0.05 0.00 -1.46 0.00 0.00 37.83 32.30 3n99 s LYS 230 CO 0.08 -1.10 1.37 -0.47 0.16 0.00 0.00 175.35 175.39 3n99 s TYR 231 N 4.67 2.89 -0.14 4.03 5.04 -1.26 -0.09 117.35 132.50 3n99 s TYR 231 Ca 0.70 0.87 -0.05 0.00 -2.44 0.00 0.00 57.07 56.14 3n99 s TYR 231 Cb -0.27 -3.63 0.07 0.00 0.35 0.00 0.00 41.96 38.48 3n99 s TYR 231 CO 0.27 -2.30 0.30 0.50 -1.34 0.00 0.00 175.55 172.98 3n99 s ARG 232 N 2.38 0.20 0.04 4.97 3.52 0.02 -4.90 118.95 125.18 3n99 s ARG 232 Ca 0.63 0.79 -0.30 0.00 -0.13 0.00 0.00 55.73 56.71 3n99 s ARG 232 Cb -0.30 0.03 -0.08 0.00 -1.56 0.00 0.00 34.95 33.04 3n99 s ARG 232 CO 0.26 -0.26 1.69 0.21 -0.81 0.00 0.00 175.30 176.39 3n99 s LYS 233 N 2.27 4.19 0.00 5.12 2.47 -1.26 -1.52 119.74 131.01 3n99 s LYS 233 Ca -0.01 2.33 0.00 0.00 -1.56 0.00 0.00 55.97 56.73 3n99 s LYS 233 Cb -0.12 -3.76 0.00 0.00 -1.46 0.00 0.00 37.83 32.49 3n99 s LYS 233 CO -0.10 -0.79 0.00 0.41 0.16 0.00 0.00 175.35 175.03 3n99 n GLY 234 N 4.10 3.26 3.77 5.54 0.00 -1.26 -5.05 105.19 115.54 3n99 n GLY 234 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.87 2.36 -0.02 4.61 0.00 -0.57 -0.36 121.76 124.90 3n99 s ALA 235 Ca 0.00 0.43 -0.07 0.00 0.00 0.00 0.00 51.96 52.32 3n99 s ALA 235 Cb 0.00 -3.30 0.01 0.00 0.00 0.00 0.00 23.12 19.83 3n99 s ALA 235 CO 0.00 -1.51 0.15 0.54 0.00 0.00 0.00 175.76 174.94 3n99 s VAL 236 N -2.59 0.05 0.12 0.00 0.11 0.46 -0.90 120.40 117.65 3n99 s VAL 236 Ca 0.64 -0.42 0.07 0.00 -2.93 0.00 0.00 61.98 59.34 3n99 s VAL 236 Cb -0.19 -0.35 -0.04 0.00 -1.53 0.00 0.00 36.38 34.27 3n99 s VAL 236 CO 0.48 -0.23 -0.16 -0.44 -3.33 0.00 0.00 175.10 171.42 3n99 s SER 237 N -0.79 2.13 -0.02 3.54 0.01 -0.84 -1.11 113.70 116.62 3n99 s SER 237 Ca -0.09 -0.76 0.08 0.00 1.31 0.00 0.00 55.95 56.49 3n99 s SER 237 Cb -0.05 -0.09 -0.02 0.00 0.21 0.00 0.00 66.02 66.07 3n99 s SER 237 CO 0.01 -0.08 -0.26 -0.63 0.41 0.00 0.00 173.24 172.69 3n99 s ILE 238 N -1.82 2.04 0.27 1.44 -1.09 0.47 -0.23 121.20 122.28 3n99 s ILE 238 Ca 0.08 -1.10 -0.05 0.00 -2.23 0.00 0.00 60.65 57.35 3n99 s ILE 238 Cb -0.07 -1.69 -0.01 0.00 -1.58 0.00 0.00 42.46 39.11 3n99 s ILE 238 CO 0.04 0.58 0.36 -0.83 -1.23 0.00 0.00 174.94 173.85 3n99 s GLY 239 N -0.58 1.23 -0.07 6.18 0.00 0.22 -0.55 107.32 113.74 3n99 s GLY 239 Ca 0.09 -1.40 0.04 0.00 0.00 0.00 0.00 44.72 43.45 3n99 s GLY 239 CO -0.01 -1.03 -0.22 0.14 0.00 0.00 0.00 173.10 171.99 3n99 s VAL 240 N -3.72 1.85 0.01 1.40 1.01 0.02 -1.36 120.40 119.61 3n99 s VAL 240 Ca 0.31 -0.92 -0.30 0.00 0.00 0.00 0.00 61.98 61.07 3n99 s VAL 240 Cb 0.02 -1.59 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 3n99 s VAL 240 CO 0.15 0.51 1.17 -0.69 0.00 0.00 0.00 175.10 176.25 3n99 s VAL 241 N 0.18 4.22 0.00 2.92 1.01 -0.32 -1.17 120.40 127.24 3n99 s VAL 241 Ca -0.12 1.58 0.00 0.00 0.00 0.00 0.00 61.98 63.44 3n99 s VAL 241 Cb -0.15 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.21 3n99 s VAL 241 CO 0.06 0.07 0.00 1.33 0.00 0.00 0.00 175.10 176.56 3n99 n VAL 242 N 4.20 0.00 -4.02 2.92 0.24 0.53 -0.39 118.33 121.80 3n99 n VAL 242 Ca 0.09 -0.14 -0.10 0.00 -2.04 0.00 0.00 64.34 62.16 3n99 n VAL 242 Cb 0.47 0.61 -0.06 0.00 -1.47 0.00 0.00 33.84 33.38 3n99 n VAL 242 CO 0.00 0.00 0.00 -1.38 -2.14 0.00 0.00 176.83 173.31 3n99 s HIS 243 N -1.44 0.49 1.00 6.34 -3.43 -1.25 -4.54 115.29 112.45 3n99 s HIS 243 Ca 0.00 -0.82 -0.14 0.00 -0.80 0.00 0.00 55.06 53.30 3n99 s HIS 243 Cb 0.00 0.04 0.19 0.00 -1.43 0.00 0.00 32.58 31.38 3n99 s HIS 243 CO 0.00 -0.89 1.13 -1.54 -2.00 0.00 0.00 174.74 171.43 3n99 s SER 244 N -3.03 2.64 1.04 7.38 1.04 0.04 -3.25 113.70 119.55 3n99 s SER 244 Ca 0.24 0.94 -0.12 0.00 0.48 0.00 0.00 55.95 57.49 3n99 s SER 244 Cb 0.01 -1.45 0.21 0.00 0.10 0.00 0.00 66.02 64.89 3n99 s SER 244 CO 0.08 -3.09 1.07 0.00 0.98 0.00 0.00 173.24 172.28 3n99 s ALA 245 N -3.15 0.48 0.14 5.32 0.00 0.49 -3.74 121.76 121.29 3n99 s ALA 245 Ca 0.66 0.08 0.02 0.00 0.00 0.00 0.00 51.96 52.73 3n99 s ALA 245 Cb -0.15 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 3n99 s ALA 245 CO 0.55 -3.24 -0.05 0.00 0.00 0.00 0.00 175.76 173.02 3n99 n VAL 247 N -0.15 0.00 -3.08 0.00 0.24 -1.26 -4.74 118.33 109.33 3n99 n VAL 247 Ca -0.10 -0.30 -0.30 0.00 -2.04 0.00 0.00 64.34 61.60 3n99 n VAL 247 Cb 0.62 0.39 -0.03 0.00 -1.47 0.00 0.00 33.84 33.34 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 -3.92 6.51 0.08 -1.34 0.01 -1.24 -1.35 113.70 112.46 3n99 s SER 248 Ca -0.02 0.97 -0.33 0.00 1.31 0.00 0.00 55.95 57.88 3n99 s SER 248 Cb 0.15 -2.25 -0.12 0.00 0.21 0.00 0.00 66.02 64.00 3n99 s SER 248 CO 0.89 -0.29 1.73 0.00 0.41 0.00 0.00 173.24 175.98 3n99 n ALA 249 N -1.05 1.48 -0.61 1.44 0.00 -1.26 -2.16 120.51 118.35 3n99 n ALA 249 Ca 0.01 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.82 3n99 n ALA 249 Cb 0.54 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.53 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 3.90 0.78 3.69 0.00 0.00 -1.26 -5.01 105.19 107.29 3n99 n GLY 250 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.93 2.69 -1.22 1.61 0.09 -0.92 -1.38 115.29 113.23 3n99 s HIS 251 Ca 0.00 -0.32 0.00 0.00 -0.00 0.00 0.00 55.06 54.74 3n99 s HIS 251 Cb 0.00 -1.44 0.00 0.00 -0.00 0.00 0.00 32.58 31.14 3n99 s HIS 251 CO 0.00 0.47 0.00 0.41 -0.00 0.00 0.00 174.74 175.62 3n99 n GLY 252 N -1.02 -1.30 3.69 -2.22 0.00 -1.23 -4.43 105.19 98.69 3n99 n GLY 252 Ca -0.05 -0.92 -0.44 0.00 0.00 0.00 0.00 46.02 44.61 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 -0.02 2.46 -2.57 1.61 -0.02 -1.13 -4.40 135.00 130.93 3n99 n PRO 253 Ca 0.00 0.89 -0.34 0.00 -2.02 0.00 0.00 63.50 62.03 3n99 n PRO 253 Cb 0.00 -2.70 -0.04 0.00 -0.02 0.00 0.00 33.50 30.74 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 1.14 2.45 -0.08 -1.23 0.00 -1.20 -0.85 107.32 107.56 3n99 s GLY 254 Ca 0.77 0.54 0.01 0.00 0.00 0.00 0.00 44.72 46.05 3n99 s GLY 254 CO 0.35 0.85 -0.10 0.14 0.00 0.00 0.00 173.10 174.35 3n99 s VAL 255 N -2.06 1.02 -0.27 1.40 1.01 0.78 -0.35 120.40 121.93 3n99 s VAL 255 Ca 0.66 -0.37 -0.12 0.00 0.00 0.00 0.00 61.98 62.15 3n99 s VAL 255 Cb -0.15 -0.98 -0.05 0.00 0.00 0.00 0.00 36.38 35.21 3n99 s VAL 255 CO 0.20 0.34 0.24 -0.69 0.00 0.00 0.00 175.10 175.19 3n99 s VAL 256 N 1.06 5.28 0.15 2.92 1.01 -0.32 -1.16 120.40 129.34 3n99 s VAL 256 Ca -0.07 0.30 -0.30 0.00 0.00 0.00 0.00 61.98 61.90 3n99 s VAL 256 Cb -0.14 -3.57 -0.07 0.00 0.00 0.00 0.00 36.38 32.59 3n99 s VAL 256 CO -0.01 0.25 1.18 -0.69 0.00 0.00 0.00 175.10 175.83 3n99 s VAL 257 N 1.67 3.73 -0.19 2.92 1.01 -1.26 -0.80 120.40 127.48 3n99 s VAL 257 Ca 0.10 1.40 0.05 0.00 0.00 0.00 0.00 61.98 63.53 3n99 s VAL 257 Cb -0.15 -3.90 -0.06 0.00 0.00 0.00 0.00 36.38 32.27 3n99 s VAL 257 CO 0.09 0.20 0.20 2.30 0.00 0.00 0.00 175.10 177.89 3n99 n ILE 258 N 2.82 0.00 -3.66 2.22 -5.35 0.28 -4.52 119.36 111.15 3n99 n ILE 258 Ca 0.05 -0.32 -0.14 0.00 -0.27 0.00 0.00 62.75 62.07 3n99 n ILE 258 Cb 0.45 0.85 -0.08 0.00 -1.74 0.00 0.00 39.64 39.13 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 -1.70 0.73 -0.02 6.28 0.00 -1.10 -2.14 119.30 121.35 3n99 s MET 259 Ca 0.01 0.73 -0.15 0.00 0.00 0.00 0.00 55.69 56.27 3n99 s MET 259 Cb 0.04 0.36 0.03 0.00 0.00 0.00 0.00 34.83 35.25 3n99 s MET 259 CO 0.22 -0.11 0.33 -0.08 0.00 0.00 0.00 175.02 175.37 3n99 s THR 260 N 0.08 0.05 -2.13 10.11 -1.32 -0.57 -0.39 115.64 121.48 3n99 s THR 260 Ca -0.02 -0.45 0.00 0.00 -1.21 0.00 0.00 61.69 60.01 3n99 s THR 260 Cb -0.04 -0.63 0.00 0.00 -1.51 0.00 0.00 72.50 70.32 3n99 s THR 260 CO 0.02 -0.25 0.00 0.61 -2.21 0.00 0.00 174.62 172.79 3n99 n GLY 261 N 1.27 -0.56 3.91 6.08 0.00 -0.27 -0.90 105.19 114.72 3n99 n GLY 261 Ca -0.21 -0.74 -0.32 0.00 0.00 0.00 0.00 46.02 44.75 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 6.36 0.60 1.61 -1.08 -1.26 -0.40 116.67 118.50 3n99 s ASP 262 Ca 0.00 0.30 0.32 0.00 -0.52 0.00 0.00 52.55 52.65 3n99 s ASP 262 Cb 0.00 -1.97 1.86 0.00 -1.46 0.00 0.00 42.92 41.35 3n99 s ASP 262 CO 0.00 0.21 2.22 1.05 0.52 0.00 0.00 175.17 179.17 3n99 h GLU 263 N 3.40 0.00 0.00 4.34 4.11 -0.94 -0.54 114.58 124.95 3n99 h GLU 263 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 3n99 h GLU 263 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3n99 h GLU 263 CO 0.73 0.00 0.00 0.66 0.07 0.00 0.00 179.01 180.47 3n99 h SER 264 N 0.00 0.00 0.00 3.06 4.64 -1.95 -3.34 113.55 115.96 3n99 h SER 264 Ca 0.02 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.08 3n99 h SER 264 Cb 0.16 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.20 3n99 h SER 264 CO -0.00 0.00 -1.99 0.29 -0.87 0.00 0.00 176.83 174.26 3n99 n LYS 265 N -3.01 0.67 -3.65 4.77 4.76 -0.32 -4.91 118.16 116.46 3n99 n LYS 265 Ca 0.01 0.08 -0.37 0.00 -2.87 0.00 0.00 58.31 55.16 3n99 n LYS 265 Cb 0.32 -1.35 -0.11 0.00 -1.84 0.00 0.00 35.03 32.05 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 -2.35 5.16 -0.49 -0.18 1.01 -0.53 -0.92 121.20 122.90 3n99 s ILE 266 Ca -0.21 0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.56 3n99 s ILE 266 Cb 0.06 -3.43 0.13 0.00 0.01 0.00 0.00 42.46 39.22 3n99 s ILE 266 CO 0.43 0.29 0.26 -0.76 0.00 0.00 0.00 174.94 175.17 3n99 s LEU 267 N 1.51 4.86 0.13 2.97 1.43 0.14 -4.55 118.68 125.16 3n99 s LEU 267 Ca 0.07 -2.61 -0.31 0.00 -1.03 0.00 0.00 54.13 50.25 3n99 s LEU 267 Cb -0.15 -1.74 -0.08 0.00 0.03 0.00 0.00 46.19 44.25 3n99 s LEU 267 CO 0.08 -0.36 1.33 -2.84 0.23 0.00 0.00 176.35 174.79 3n99 s PRO 268 N 0.29 4.36 -0.26 1.29 0.02 -1.26 -1.15 135.00 138.29 3n99 s PRO 268 Ca 0.14 2.02 -0.03 0.00 0.02 0.00 0.00 61.00 63.15 3n99 s PRO 268 Cb -0.22 -3.25 0.02 0.00 0.02 0.00 0.00 34.50 31.07 3n99 s PRO 268 CO -0.03 -0.36 -0.03 -1.21 -0.33 0.00 0.00 177.00 175.04 3n99 s GLU 269 N 0.78 2.86 -0.21 5.54 0.41 0.99 -4.87 118.70 124.21 3n99 s GLU 269 Ca 0.61 -0.97 -0.29 0.00 -0.41 0.00 0.00 54.97 53.91 3n99 s GLU 269 Cb -0.35 -3.08 -0.01 0.00 -1.78 0.00 0.00 34.13 28.90 3n99 s GLU 269 CO 0.32 -0.42 1.29 -2.00 -0.49 0.00 0.00 175.26 173.96 3n99 s GLU 270 N 1.36 4.12 0.48 1.61 2.12 -1.26 -1.65 118.70 125.48 3n99 s GLU 270 Ca 0.00 1.55 0.02 0.00 0.36 0.00 0.00 54.97 56.90 3n99 s GLU 270 Cb -0.17 -3.81 -0.03 0.00 0.26 0.00 0.00 34.13 30.38 3n99 s GLU 270 CO -0.03 -0.85 0.02 0.14 -0.54 0.00 0.00 175.26 174.00 3n99 s VAL 271 N 3.83 1.25 0.08 3.70 -7.23 -0.06 -4.93 120.40 117.04 3n99 s VAL 271 Ca 0.56 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.62 3n99 s VAL 271 Cb -0.20 -2.34 -0.26 0.00 0.56 0.00 0.00 36.38 34.13 3n99 s VAL 271 CO 0.18 0.00 1.16 1.05 -0.31 0.00 0.00 175.10 177.18 3n99 h GLU 272 N 1.48 0.53 -4.08 4.82 9.09 -1.94 -3.41 114.58 121.07 3n99 h GLU 272 Ca -0.43 -0.69 -0.32 0.00 0.05 0.00 0.00 59.36 57.96 3n99 h GLU 272 Cb 1.30 0.23 -0.30 0.00 -1.65 0.00 0.00 28.75 28.32 3n99 h GLU 272 CO 0.74 1.30 -0.75 0.50 0.05 0.00 0.00 179.01 180.84 3n99 s ARG 273 N -3.01 0.38 -0.34 1.06 3.52 -1.26 -4.97 118.95 114.32 3n99 s ARG 273 Ca -0.08 -0.10 0.03 0.00 -0.13 0.00 0.00 55.73 55.45 3n99 s ARG 273 Cb 0.07 -0.41 0.19 0.00 -1.56 0.00 0.00 34.95 33.24 3n99 s ARG 273 CO 0.91 0.03 0.71 0.00 -0.81 0.00 0.00 175.30 176.14 3n99 s ALA 274 N 0.22 -2.81 -0.10 6.12 0.00 -1.26 -4.94 121.76 118.99 3n99 s ALA 274 Ca -0.02 0.79 -0.05 0.00 0.00 0.00 0.00 51.96 52.68 3n99 s ALA 274 Cb -0.05 -2.71 0.05 0.00 0.00 0.00 0.00 23.12 20.41 3n99 s ALA 274 CO -0.00 -2.09 0.24 1.21 0.00 0.00 0.00 175.76 175.11 3n99 s ASN 275 N 2.36 -0.16 0.63 0.00 3.84 -1.26 -1.34 114.94 119.00 3n99 s ASN 275 Ca 0.15 0.51 0.40 0.00 0.21 0.00 0.00 52.86 54.13 3n99 s ASN 275 Cb -0.05 0.41 2.12 0.00 -0.55 0.00 0.00 41.25 43.18 3n99 s ASN 275 CO -0.17 -0.17 2.28 0.16 -2.79 0.00 0.00 177.10 176.40 3n99 h ILE 276 N 5.95 0.10 0.00 -5.21 3.07 -1.40 -2.27 117.51 117.75 3n99 h ILE 276 Ca -0.38 -0.13 -0.02 0.00 1.55 0.00 0.00 64.86 65.88 3n99 h ILE 276 Cb 1.15 1.12 -0.00 0.00 -0.27 0.00 0.00 36.82 38.81 3n99 h ILE 276 CO 0.35 0.01 -0.08 0.77 -1.05 0.00 0.00 178.15 178.15 3n99 h SER 277 N 0.00 0.00 0.46 2.16 4.64 -1.90 -1.01 113.55 117.90 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 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 3n99 h SER 277 CO 0.00 0.08 0.00 0.44 -0.87 0.00 0.00 176.83 176.49 3n99 h ASP 278 N 0.00 0.00 -0.13 4.97 3.32 -1.81 -3.17 116.42 119.60 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 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 3n99 h ASP 278 CO 0.01 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.31 3n99 n TYR 279 N -2.30 0.39 -0.62 4.55 4.01 -0.38 -5.15 117.16 117.66 3n99 n TYR 279 Ca 0.01 -0.86 0.00 0.00 -0.16 0.00 0.00 57.90 56.89 3n99 n TYR 279 Cb 0.16 -0.19 0.00 0.00 -0.31 0.00 0.00 39.34 39.00 3n99 n TYR 279 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68