#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 1.84 0.60 1.61 4.02 -1.26 -5.02 115.29 117.08 3n99 s HIS 0 Ca 0.00 -0.48 -0.20 0.00 1.02 0.00 0.00 55.06 55.40 3n99 s HIS 0 Cb 0.00 -0.89 -0.03 0.00 -1.02 0.00 0.00 32.58 30.64 3n99 s HIS 0 CO 0.00 0.37 1.31 -1.64 1.02 0.00 0.00 174.74 175.80 3n99 s MET 1 N -3.02 2.87 0.04 1.40 -1.94 -1.26 -4.93 119.30 112.46 3n99 s MET 1 Ca 0.18 2.11 -0.31 0.00 -1.71 0.00 0.00 55.69 55.97 3n99 s MET 1 Cb -0.05 -2.04 -0.06 0.00 2.01 0.00 0.00 34.83 34.69 3n99 s MET 1 CO 0.07 -1.37 1.38 1.03 -0.01 0.00 0.00 175.02 176.13 3n99 s ARG 2 N -3.16 4.31 0.22 2.03 0.52 -1.26 -4.99 118.95 116.62 3n99 s ARG 2 Ca 0.77 1.98 0.03 0.00 -0.52 0.00 0.00 55.73 57.99 3n99 s ARG 2 Cb -0.38 -3.45 -0.05 0.00 0.52 0.00 0.00 34.95 31.59 3n99 s ARG 2 CO 0.42 -0.50 0.01 0.95 0.02 0.00 0.00 175.30 176.20 3n99 s THR 3 N 1.86 0.93 -0.14 0.02 -4.23 -1.26 -0.88 115.64 111.94 3n99 s THR 3 Ca 0.64 -2.02 0.01 0.00 -1.18 0.00 0.00 61.69 59.14 3n99 s THR 3 Cb -0.33 -2.32 0.18 0.00 1.34 0.00 0.00 72.50 71.37 3n99 s THR 3 CO 0.28 -0.33 1.24 -0.46 -0.54 0.00 0.00 174.62 174.81 3n99 n ASN 4 N -0.39 3.18 0.25 3.99 6.94 -1.11 -4.65 115.26 123.46 3n99 n ASN 4 Ca -0.05 -2.43 0.08 0.00 -0.02 0.00 0.00 54.58 52.16 3n99 n ASN 4 Cb 0.64 -0.59 0.62 0.00 -2.36 0.00 0.00 39.78 38.09 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 0.29 0.00 0.00 -3.83 2.10 -1.96 -1.03 116.57 112.14 3n99 h LYS 5 Ca 0.17 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.80 3n99 h LYS 5 Cb 1.49 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.81 3n99 h LYS 5 CO 0.29 0.07 -0.10 -0.44 -2.00 0.00 0.00 179.45 177.27 3n99 h ASP 6 N 0.00 0.00 -0.11 7.07 3.32 -2.02 -2.69 116.42 121.99 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 0.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.68 3n99 h ASP 6 CO 0.01 0.10 0.00 0.54 -1.72 0.00 0.00 179.24 178.17 3n99 n ARG 7 N -3.41 1.99 -2.87 3.56 1.74 -0.39 -4.93 116.66 112.35 3n99 n ARG 7 Ca -0.01 -1.46 -0.36 0.00 -0.77 0.00 0.00 57.85 55.25 3n99 n ARG 7 Cb 0.27 -1.46 -0.06 0.00 -1.02 0.00 0.00 32.46 30.18 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 -1.82 4.22 -0.13 0.55 1.43 -1.01 -5.03 118.68 116.88 3n99 s LEU 8 Ca 0.34 1.70 -0.19 0.00 -1.03 0.00 0.00 54.13 54.95 3n99 s LEU 8 Cb 0.20 -4.08 -0.04 0.00 0.03 0.00 0.00 46.19 42.30 3n99 s LEU 8 CO 0.31 -0.13 0.50 -0.69 0.23 0.00 0.00 176.35 176.56 3n99 s VAL 9 N -1.77 5.17 -0.20 -1.59 1.01 -1.26 -5.06 120.40 116.70 3n99 s VAL 9 Ca 0.52 0.98 -0.08 0.00 0.00 0.00 0.00 61.98 63.40 3n99 s VAL 9 Cb -0.15 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 3n99 s VAL 9 CO 0.20 0.29 0.09 -0.60 0.00 0.00 0.00 175.10 175.08 3n99 s ARG 10 N 0.82 4.01 -0.11 2.72 3.52 -1.26 -4.62 118.95 124.03 3n99 s ARG 10 Ca 0.26 -0.32 -0.12 0.00 -0.13 0.00 0.00 55.73 55.43 3n99 s ARG 10 Cb -0.15 -3.30 0.03 0.00 -1.56 0.00 0.00 34.95 29.97 3n99 s ARG 10 CO 0.11 0.23 0.32 -1.50 -0.81 0.00 0.00 175.30 173.65 3n99 s ILE 11 N 0.50 0.00 -0.09 4.11 2.07 -0.78 -4.98 121.20 122.03 3n99 s ILE 11 Ca 0.05 -0.04 -0.29 0.00 -1.41 0.00 0.00 60.65 58.95 3n99 s ILE 11 Cb -0.12 -0.47 -0.06 0.00 0.13 0.00 0.00 42.46 41.94 3n99 s ILE 11 CO 0.00 -0.02 1.81 -0.94 -1.91 0.00 0.00 174.94 173.88 3n99 s SER 12 N 0.05 6.37 -0.17 4.50 1.04 -1.26 -1.16 113.70 123.06 3n99 s SER 12 Ca -0.01 2.17 -0.01 0.00 0.48 0.00 0.00 55.95 58.57 3n99 s SER 12 Cb -0.03 -2.53 -0.01 0.00 0.10 0.00 0.00 66.02 63.56 3n99 s SER 12 CO 0.01 -1.18 -0.11 -0.69 0.98 0.00 0.00 173.24 172.24 3n99 s VAL 13 N 5.02 2.97 -0.02 5.02 1.01 0.15 -4.94 120.40 129.61 3n99 s VAL 13 Ca 0.81 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 62.14 3n99 s VAL 13 Cb -0.34 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.71 3n99 s VAL 13 CO 0.34 0.49 0.03 0.54 0.00 0.00 0.00 175.10 176.50 3n99 s VAL 14 N 0.96 4.40 0.00 2.92 0.11 -1.26 -0.23 120.40 127.31 3n99 s VAL 14 Ca -0.02 -0.46 0.00 0.00 -2.93 0.00 0.00 61.98 58.57 3n99 s VAL 14 Cb -0.15 -2.96 0.00 0.00 -1.53 0.00 0.00 36.38 31.74 3n99 s VAL 14 CO -0.01 0.41 0.00 0.61 -3.33 0.00 0.00 175.10 172.78 3n99 n GLY 15 N 1.45 2.70 3.13 6.54 0.00 -0.46 -4.66 105.19 113.89 3n99 n GLY 15 Ca -0.15 -1.06 -0.08 0.00 0.00 0.00 0.00 46.02 44.73 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 -1.09 0.74 -0.07 1.61 -1.05 0.33 -0.94 118.70 118.23 3n99 s GLU 16 Ca 0.00 -1.22 -0.30 0.00 -0.15 0.00 0.00 54.97 53.30 3n99 s GLU 16 Cb 0.00 0.25 -0.05 0.00 -0.44 0.00 0.00 34.13 33.89 3n99 s GLU 16 CO 0.00 -0.18 1.59 0.42 0.95 0.00 0.00 175.26 178.04 3n99 s ILE 17 N -3.94 3.67 0.43 1.83 1.01 -0.68 -0.69 121.20 122.84 3n99 s ILE 17 Ca 0.11 0.83 -0.24 0.00 0.00 0.00 0.00 60.65 61.34 3n99 s ILE 17 Cb 0.07 -3.53 -0.08 0.00 0.01 0.00 0.00 42.46 38.93 3n99 s ILE 17 CO -0.07 -0.07 1.23 0.00 0.00 0.00 0.00 174.94 176.02 3n99 s ALA 18 N 3.91 3.09 0.89 9.38 0.00 -0.19 -0.91 121.76 137.93 3n99 s ALA 18 Ca 0.71 1.07 -0.12 0.00 0.00 0.00 0.00 51.96 53.62 3n99 s ALA 18 Cb -0.32 -3.43 0.12 0.00 0.00 0.00 0.00 23.12 19.50 3n99 s ALA 18 CO 0.27 -0.74 1.09 -1.25 0.00 0.00 0.00 175.76 175.14 3n99 s PRO 19 N -2.46 1.32 0.26 0.00 0.04 -1.26 -1.78 135.00 131.12 3n99 s PRO 19 Ca 0.60 0.75 -0.31 0.00 0.04 0.00 0.00 61.00 62.09 3n99 s PRO 19 Cb -0.33 -1.82 -0.12 0.00 0.04 0.00 0.00 34.50 32.27 3n99 s PRO 19 CO 0.41 -2.18 1.66 0.00 0.04 0.00 0.00 177.00 176.93 3n99 n ALA 20 N -3.83 2.75 -2.53 8.56 0.00 -1.26 -2.22 120.51 121.97 3n99 n ALA 20 Ca 0.07 0.38 -0.30 0.00 0.00 0.00 0.00 53.44 53.59 3n99 n ALA 20 Cb 0.56 -2.50 -0.16 0.00 0.00 0.00 0.00 19.45 17.35 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 0.13 2.18 -0.13 0.00 1.02 -0.74 -4.87 119.74 117.33 3n99 s LYS 21 Ca 0.68 -0.87 -0.06 0.00 0.02 0.00 0.00 55.97 55.74 3n99 s LYS 21 Cb -0.49 -1.98 0.05 0.00 -0.52 0.00 0.00 37.83 34.89 3n99 s LYS 21 CO 0.42 0.45 0.30 -1.64 -0.92 0.00 0.00 175.35 173.96 3n99 s MET 22 N -0.38 0.25 0.01 1.68 -1.94 -1.26 -3.76 119.30 113.91 3n99 s MET 22 Ca 0.04 0.65 0.27 0.00 -1.71 0.00 0.00 55.69 54.93 3n99 s MET 22 Cb -0.11 -0.06 0.80 0.00 2.01 0.00 0.00 34.83 37.46 3n99 s MET 22 CO 0.01 -0.18 1.62 0.54 -0.01 0.00 0.00 175.02 177.00 3n99 n ARG 23 N 4.45 0.03 -3.55 2.03 1.74 -1.26 -4.89 116.66 115.20 3n99 n ARG 23 Ca -0.21 0.01 -0.13 0.00 -0.77 0.00 0.00 57.85 56.75 3n99 n ARG 23 Cb 0.53 -1.52 -0.04 0.00 -1.02 0.00 0.00 32.46 30.40 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 -3.13 -0.42 0.44 0.55 0.15 -1.26 -5.02 113.70 105.02 3n99 s SER 24 Ca 0.12 0.01 0.20 0.00 0.70 0.00 0.00 55.95 56.98 3n99 s SER 24 Cb 0.18 0.51 1.05 0.00 -1.71 0.00 0.00 66.02 66.05 3n99 s SER 24 CO 0.63 -0.81 1.94 1.55 1.20 0.00 0.00 173.24 177.75 3n99 h PRO 25 N 2.48 0.00 -6.05 5.44 0.13 -1.96 -3.44 132.00 128.60 3n99 h PRO 25 Ca -0.32 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.20 3n99 h PRO 25 Cb 1.25 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.33 3n99 h PRO 25 CO 0.42 0.24 -0.23 0.71 -0.23 0.00 0.00 178.00 178.91 3n99 s TYR 26 N -4.19 3.66 -0.13 1.56 2.02 -1.26 -4.25 117.35 114.75 3n99 s TYR 26 Ca -0.03 0.89 -0.03 0.00 -0.37 0.00 0.00 57.07 57.54 3n99 s TYR 26 Cb 0.14 -2.22 -0.03 0.00 -0.40 0.00 0.00 41.96 39.45 3n99 s TYR 26 CO 0.66 0.59 -0.04 -1.12 -1.57 0.00 0.00 175.55 174.07 3n99 s SER 27 N -1.38 4.85 -0.22 2.29 0.01 -0.02 -4.93 113.70 114.30 3n99 s SER 27 Ca 0.28 -0.06 -0.16 0.00 1.31 0.00 0.00 55.95 57.32 3n99 s SER 27 Cb -0.15 -1.61 -0.04 0.00 0.21 0.00 0.00 66.02 64.43 3n99 s SER 27 CO 0.15 0.24 0.41 -0.69 0.41 0.00 0.00 173.24 173.76 3n99 s VAL 28 N -0.08 5.18 0.76 3.43 1.01 -1.26 -1.13 120.40 128.31 3n99 s VAL 28 Ca 0.02 0.71 -0.09 0.00 0.00 0.00 0.00 61.98 62.62 3n99 s VAL 28 Cb -0.13 -3.74 0.08 0.00 0.00 0.00 0.00 36.38 32.59 3n99 s VAL 28 CO 0.02 0.22 1.10 0.42 0.00 0.00 0.00 175.10 176.86 3n99 s THR 29 N 1.56 2.15 0.35 3.92 -4.23 0.22 -3.56 115.64 116.05 3n99 s THR 29 Ca 0.19 -0.17 0.28 0.00 -1.18 0.00 0.00 61.69 60.80 3n99 s THR 29 Cb -0.15 -2.98 0.29 0.00 1.34 0.00 0.00 72.50 70.99 3n99 s THR 29 CO 0.08 0.00 2.02 0.71 -0.54 0.00 0.00 174.62 176.90 3n99 h THR 30 N -0.84 0.51 -0.00 3.99 1.35 -1.60 -2.30 112.91 114.02 3n99 h THR 30 Ca -0.45 -0.65 0.00 0.00 -0.55 0.00 0.00 66.41 64.77 3n99 h THR 30 Cb 1.31 1.43 0.00 0.00 -1.73 0.00 0.00 68.15 69.17 3n99 h THR 30 CO 0.60 0.13 -0.04 -0.62 -0.25 0.00 0.00 175.52 175.34 3n99 n GLU 31 N -3.53 0.85 -1.57 4.72 4.71 -1.26 -4.88 120.64 119.67 3n99 n GLU 31 Ca -0.01 -0.18 0.00 0.00 -0.01 0.00 0.00 57.16 56.96 3n99 n GLU 31 Cb 0.28 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.21 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 1.17 0.38 3.70 0.62 0.00 -0.87 -5.06 105.19 105.14 3n99 n GLY 32 Ca 0.18 -0.97 -0.24 0.00 0.00 0.00 0.00 46.02 44.99 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 -2.00 2.55 0.07 2.61 -4.23 -1.26 -4.90 115.64 108.48 3n99 s THR 33 Ca 0.00 -1.78 0.08 0.00 -1.18 0.00 0.00 61.69 58.81 3n99 s THR 33 Cb 0.00 -2.94 -0.04 0.00 1.34 0.00 0.00 72.50 70.87 3n99 s THR 33 CO 0.00 -0.10 -0.17 0.68 -0.54 0.00 0.00 174.62 174.49 3n99 s VAL 34 N -2.54 2.90 0.03 2.29 -7.23 -1.26 -0.61 120.40 113.98 3n99 s VAL 34 Ca 0.38 -1.29 0.03 0.00 -1.81 0.00 0.00 61.98 59.30 3n99 s VAL 34 Cb 0.01 -2.28 -0.02 0.00 0.56 0.00 0.00 36.38 34.66 3n99 s VAL 34 CO 0.22 0.23 -0.10 -0.13 -0.31 0.00 0.00 175.10 175.01 3n99 s ARG 35 N -1.76 0.67 -0.52 4.82 0.52 -0.28 -4.94 118.95 117.46 3n99 s ARG 35 Ca 0.17 -0.61 -0.17 0.00 -0.52 0.00 0.00 55.73 54.60 3n99 s ARG 35 Cb -0.11 -0.59 0.10 0.00 0.52 0.00 0.00 34.95 34.87 3n99 s ARG 35 CO 0.08 0.14 0.51 0.08 0.02 0.00 0.00 175.30 176.13 3n99 s VAL 36 N -0.84 5.12 0.04 3.52 1.01 -1.26 -0.84 120.40 127.15 3n99 s VAL 36 Ca -0.02 -1.20 -0.02 0.00 0.00 0.00 0.00 61.98 60.74 3n99 s VAL 36 Cb -0.07 -4.30 -0.02 0.00 0.00 0.00 0.00 36.38 31.99 3n99 s VAL 36 CO 0.01 -0.82 0.01 0.27 0.00 0.00 0.00 175.10 174.57 3n99 s ILE 37 N 1.88 0.16 0.53 2.22 -4.36 -1.26 -5.06 121.20 115.32 3n99 s ILE 37 Ca 0.06 -1.31 -0.22 0.00 -0.26 0.00 0.00 60.65 58.93 3n99 s ILE 37 Cb -0.26 -0.94 -0.05 0.00 1.25 0.00 0.00 42.46 42.45 3n99 s ILE 37 CO 0.05 -0.72 1.30 -2.84 0.24 0.00 0.00 174.94 172.98 3n99 s PRO 38 N -2.77 3.24 0.00 0.37 0.02 -1.26 -4.76 135.00 129.84 3n99 s PRO 38 Ca -0.04 2.09 0.00 0.00 0.02 0.00 0.00 61.00 63.08 3n99 s PRO 38 Cb -0.00 -2.25 0.00 0.00 0.02 0.00 0.00 34.50 32.27 3n99 s PRO 38 CO -0.06 -1.07 0.00 0.28 -0.33 0.00 0.00 177.00 175.83 3n99 n VAL 39 N -0.99 0.00 -3.07 3.83 0.31 -1.26 -1.30 118.33 115.86 3n99 n VAL 39 Ca 0.10 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.23 3n99 n VAL 39 Cb 0.46 0.00 0.06 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 3.03 0.00 7.52 0.05 -1.25 -4.41 118.68 123.62 3n99 s LEU 40 Ca 0.00 -0.91 0.00 0.00 0.05 0.00 0.00 54.13 53.27 3n99 s LEU 40 Cb 0.00 -1.51 0.00 0.00 -2.05 0.00 0.00 46.19 42.63 3n99 s LEU 40 CO 0.00 -1.40 0.00 0.61 -0.55 0.00 0.00 176.35 175.01 3n99 n GLY 41 N -2.27 -2.82 2.21 -3.48 0.00 -1.26 -1.79 105.19 95.78 3n99 n GLY 41 Ca 0.16 -1.77 0.06 0.00 0.00 0.00 0.00 46.02 44.46 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 -0.38 -2.01 3.53 -0.02 0.00 -0.73 -4.58 105.19 101.00 3n99 n GLY 42 Ca 0.00 -1.36 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 3n99 n GLY 42 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3n99 s ILE 43 N -1.08 4.92 -0.42 -0.61 1.01 -1.26 -1.47 121.20 122.28 3n99 s ILE 43 Ca 0.00 0.20 -0.19 0.00 0.00 0.00 0.00 60.65 60.66 3n99 s ILE 43 Cb 0.00 -4.10 0.02 0.00 0.01 0.00 0.00 42.46 38.39 3n99 s ILE 43 CO 0.00 -0.42 0.55 -0.89 0.00 0.00 0.00 174.94 174.17 3n99 s THR 44 N 2.60 4.95 -0.05 2.92 2.01 -0.33 -4.97 115.64 122.77 3n99 s THR 44 Ca 0.21 -0.07 0.18 0.00 0.31 0.00 0.00 61.69 62.31 3n99 s THR 44 Cb -0.15 -4.12 0.11 0.00 0.01 0.00 0.00 72.50 68.36 3n99 s THR 44 CO 0.16 -0.50 1.57 1.88 -0.69 0.00 0.00 174.62 177.04 3n99 h TYR 45 N 8.78 0.00 0.00 4.92 0.05 -1.95 -3.33 116.97 125.44 3n99 h TYR 45 Ca -0.26 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.52 3n99 h TYR 45 Cb 1.10 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.84 3n99 h TYR 45 CO 0.68 0.42 -0.21 0.27 -1.05 0.00 0.00 178.16 178.26 3n99 n ASN 46 N -3.31 1.32 -3.86 3.88 6.94 -1.26 -4.96 115.26 114.01 3n99 n ASN 46 Ca 0.01 -2.60 -0.22 0.00 -0.02 0.00 0.00 54.58 51.76 3n99 n ASN 46 Cb 0.63 -0.32 -0.17 0.00 -2.36 0.00 0.00 39.78 37.56 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 -1.61 0.57 0.11 3.53 1.01 -1.26 -5.12 120.40 117.64 3n99 s VAL 47 Ca 0.18 -0.08 -0.07 0.00 0.00 0.00 0.00 61.98 62.00 3n99 s VAL 47 Cb 0.16 -0.63 -0.01 0.00 0.00 0.00 0.00 36.38 35.90 3n99 s VAL 47 CO 0.02 0.26 0.17 -1.59 0.00 0.00 0.00 175.10 173.96 3n99 s LYS 48 N 1.29 0.91 0.29 2.72 -2.85 -1.26 -1.80 119.74 119.04 3n99 s LYS 48 Ca -0.05 -1.10 -0.29 0.00 -1.00 0.00 0.00 55.97 53.53 3n99 s LYS 48 Cb -0.14 0.32 -0.13 0.00 -2.06 0.00 0.00 37.83 35.83 3n99 s LYS 48 CO -0.02 -0.29 1.26 1.55 0.10 0.00 0.00 175.35 177.95 3n99 n VAL 49 N -0.08 1.64 0.00 1.79 3.14 -1.26 -1.36 118.33 122.20 3n99 n VAL 49 Ca -0.12 -0.41 0.00 0.00 -2.96 0.00 0.00 64.34 60.85 3n99 n VAL 49 Cb 0.62 -1.39 0.00 0.00 -1.06 0.00 0.00 33.84 32.01 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 1.33 3.27 3.87 7.55 0.00 0.36 -4.92 105.19 116.64 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 -0.12 5.16 0.42 1.61 1.01 -0.46 -4.72 116.67 119.56 3n99 s ASP 51 Ca 0.00 1.14 -0.26 0.00 0.71 0.00 0.00 52.55 54.14 3n99 s ASP 51 Cb 0.00 -1.90 -0.09 0.00 1.01 0.00 0.00 42.92 41.94 3n99 s ASP 51 CO 0.00 -1.53 1.42 -0.55 0.21 0.00 0.00 175.17 174.72 3n99 s SER 52 N -4.28 6.11 0.12 0.27 0.15 -1.26 -0.44 113.70 114.38 3n99 s SER 52 Ca 0.59 2.91 0.25 0.00 0.70 0.00 0.00 55.95 60.40 3n99 s SER 52 Cb -0.12 -2.66 0.95 0.00 -1.71 0.00 0.00 66.02 62.49 3n99 s SER 52 CO 0.52 -1.01 1.77 0.00 1.20 0.00 0.00 173.24 175.72 3n99 n ALA 53 N 0.08 2.12 -2.48 5.45 0.00 0.27 -4.60 120.51 121.35 3n99 n ALA 53 Ca 0.03 -0.03 -0.25 0.00 0.00 0.00 0.00 53.44 53.19 3n99 n ALA 53 Cb 0.41 -1.43 -0.08 0.00 0.00 0.00 0.00 19.45 18.36 3n99 n ALA 53 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3n99 s TYR 54 N -3.09 2.60 0.00 0.00 1.51 -1.26 0.41 117.35 117.52 3n99 s TYR 54 Ca 0.10 -0.54 0.00 0.00 -1.01 0.00 0.00 57.07 55.62 3n99 s TYR 54 Cb 0.14 -1.82 0.00 0.00 -0.11 0.00 0.00 41.96 40.17 3n99 s TYR 54 CO 0.50 0.28 0.00 0.41 -1.11 0.00 0.00 175.55 175.63 3n99 n GLY 55 N -1.15 0.76 3.84 0.71 0.00 -1.26 -5.01 105.19 103.08 3n99 n GLY 55 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.97 3.69 -1.37 1.61 0.52 -1.26 -4.99 118.94 114.18 3n99 s TRP 56 Ca 0.00 1.00 -0.16 0.00 0.02 0.00 0.00 56.10 56.96 3n99 s TRP 56 Cb 0.00 -2.30 0.05 0.00 -1.15 0.00 0.00 33.47 30.06 3n99 s TRP 56 CO 0.00 0.57 1.99 0.00 0.02 0.00 0.00 176.95 179.53 3n99 n ALA 57 N 1.43 4.49 -3.63 0.98 0.00 -1.26 -4.83 120.51 117.69 3n99 n ALA 57 Ca -0.11 -3.84 -0.01 0.00 0.00 0.00 0.00 53.44 49.48 3n99 n ALA 57 Cb 0.52 -3.57 -0.01 0.00 0.00 0.00 0.00 19.45 16.39 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 3.78 -0.36 -0.01 0.00 0.00 -1.26 -4.18 107.32 105.28 3n99 s GLY 58 Ca 0.51 0.81 0.04 0.00 0.00 0.00 0.00 44.72 46.08 3n99 s GLY 58 CO -0.00 0.20 -0.14 -0.35 0.00 0.00 0.00 173.10 172.81 3n99 s ASP 59 N -2.76 1.68 -1.51 1.64 2.15 -0.42 -4.76 116.67 112.69 3n99 s ASP 59 Ca 0.12 -0.26 -0.14 0.00 0.43 0.00 0.00 52.55 52.70 3n99 s ASP 59 Cb 0.02 -0.21 0.11 0.00 -0.30 0.00 0.00 42.92 42.54 3n99 s ASP 59 CO -0.03 0.17 0.73 1.41 -0.17 0.00 0.00 175.17 177.28 3n99 n HIS 60 N 2.77 -1.90 -2.27 -5.34 8.25 -1.09 -4.10 115.22 111.54 3n99 n HIS 60 Ca -0.15 0.70 -0.42 0.00 -0.26 0.00 0.00 57.72 57.60 3n99 n HIS 60 Cb 0.55 -3.20 -0.03 0.00 1.12 0.00 0.00 29.99 28.43 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 -3.15 3.45 -0.27 1.59 1.01 -1.26 -4.08 120.40 117.69 3n99 s VAL 61 Ca 0.60 1.13 -0.11 0.00 0.00 0.00 0.00 61.98 63.60 3n99 s VAL 61 Cb -0.32 -3.72 -0.05 0.00 0.00 0.00 0.00 36.38 32.30 3n99 s VAL 61 CO 0.74 0.13 0.17 -1.61 0.00 0.00 0.00 175.10 174.53 3n99 s GLU 62 N 0.40 3.94 0.62 2.72 2.02 -1.26 -0.98 118.70 126.15 3n99 s GLU 62 Ca 0.58 -0.33 -0.17 0.00 0.02 0.00 0.00 54.97 55.07 3n99 s GLU 62 Cb -0.35 -3.60 -0.02 0.00 0.10 0.00 0.00 34.13 30.26 3n99 s GLU 62 CO 0.34 -0.14 1.15 -1.25 0.02 0.00 0.00 175.26 175.38 3n99 s PRO 63 N 1.62 2.93 6.89 0.39 0.04 -1.26 -4.59 135.00 141.02 3n99 s PRO 63 Ca 0.07 1.62 0.00 0.00 0.04 0.00 0.00 61.00 62.73 3n99 s PRO 63 Cb -0.15 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.44 3n99 s PRO 63 CO 0.09 -1.19 0.00 0.41 0.04 0.00 0.00 177.00 176.35 3n99 n GLY 64 N 0.07 2.94 3.51 0.56 0.00 -0.74 -4.44 105.19 107.08 3n99 n GLY 64 Ca 0.12 -0.29 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 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 4.48 -0.02 1.61 1.01 -0.42 -1.19 120.40 125.87 3n99 s VAL 65 Ca 0.00 -0.12 -0.19 0.00 0.00 0.00 0.00 61.98 61.66 3n99 s VAL 65 Cb 0.00 -3.07 -0.05 0.00 0.00 0.00 0.00 36.38 33.26 3n99 s VAL 65 CO 0.00 0.37 0.55 -0.44 0.00 0.00 0.00 175.10 175.58 3n99 s SER 66 N 1.21 6.90 -0.11 3.32 0.01 -0.54 -1.34 113.70 123.15 3n99 s SER 66 Ca 0.05 1.07 0.03 0.00 1.31 0.00 0.00 55.95 58.40 3n99 s SER 66 Cb -0.14 -2.33 0.01 0.00 0.21 0.00 0.00 66.02 63.76 3n99 s SER 66 CO 0.03 0.12 -0.20 -0.69 0.41 0.00 0.00 173.24 172.91 3n99 s VAL 67 N -0.17 1.81 0.35 3.43 1.01 0.06 -1.03 120.40 125.86 3n99 s VAL 67 Ca 0.29 -0.85 0.09 0.00 0.00 0.00 0.00 61.98 61.51 3n99 s VAL 67 Cb -0.17 -1.60 -0.06 0.00 0.00 0.00 0.00 36.38 34.55 3n99 s VAL 67 CO 0.15 0.50 -0.03 0.00 0.00 0.00 0.00 175.10 175.73 3n99 s MET 68 N 0.70 1.97 0.60 2.72 0.23 0.14 -1.11 119.30 124.54 3n99 s MET 68 Ca -0.11 -1.85 -0.18 0.00 -1.03 0.00 0.00 55.69 52.51 3n99 s MET 68 Cb -0.16 -1.82 -0.03 0.00 -1.53 0.00 0.00 34.83 31.28 3n99 s MET 68 CO 0.02 0.12 1.19 0.00 -2.03 0.00 0.00 175.02 174.32 3n99 s ALA 69 N -2.57 2.54 0.46 3.16 0.00 -1.26 -0.51 121.76 123.57 3n99 s ALA 69 Ca 0.34 0.96 0.18 0.00 0.00 0.00 0.00 51.96 53.44 3n99 s ALA 69 Cb 0.02 -3.43 1.18 0.00 0.00 0.00 0.00 23.12 20.89 3n99 s ALA 69 CO 0.18 -1.16 2.05 0.00 0.00 0.00 0.00 175.76 176.83 3n99 h ARG 70 N 0.82 0.00 -2.79 0.00 3.08 -1.89 -3.43 114.38 110.16 3n99 h ARG 70 Ca -0.50 0.00 0.07 0.00 0.07 0.00 0.00 59.98 59.62 3n99 h ARG 70 Cb 1.29 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.26 3n99 h ARG 70 CO 0.55 0.13 0.30 -0.98 -1.07 0.00 0.00 179.97 178.91 3n99 s ARG 71 N -4.61 1.43 0.35 0.04 1.70 -1.26 -5.05 118.95 111.55 3n99 s ARG 71 Ca -0.04 -0.72 0.02 0.00 -0.47 0.00 0.00 55.73 54.52 3n99 s ARG 71 Cb 0.15 0.54 0.62 0.00 -0.57 0.00 0.00 34.95 35.69 3n99 s ARG 71 CO 0.66 -0.65 2.00 -0.22 -1.08 0.00 0.00 175.30 176.02 3n99 h LYS 72 N 2.00 0.85 0.00 3.89 3.64 -2.02 -1.01 116.57 123.91 3n99 h LYS 72 Ca -0.24 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.08 3n99 h LYS 72 Cb 1.26 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.89 3n99 h LYS 72 CO 0.28 0.57 -0.03 0.93 -2.27 0.00 0.00 179.45 178.93 3n99 h GLU 73 N 0.87 0.00 -0.08 1.90 3.07 -2.00 -2.17 114.58 116.18 3n99 h GLU 73 Ca 0.23 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.09 3n99 h GLU 73 Cb -0.09 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.82 3n99 h GLU 73 CO -0.05 0.03 0.00 0.39 -1.40 0.00 0.00 179.01 177.98 3n99 n GLU 74 N -3.59 1.83 -0.03 2.33 1.02 -0.39 -4.38 120.64 117.44 3n99 n GLU 74 Ca -0.03 -1.22 -0.14 0.00 -0.02 0.00 0.00 57.16 55.75 3n99 n GLU 74 Cb 0.13 -1.46 -0.10 0.00 -0.02 0.00 0.00 31.44 30.00 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 2.81 0.19 -0.21 3.49 5.08 -1.44 -2.83 114.58 121.67 3n99 h GLU 75 Ca 0.00 -0.14 0.03 0.00 -1.00 0.00 0.00 59.36 58.25 3n99 h GLU 75 Cb 0.60 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 3n99 h GLU 75 CO 0.00 0.76 0.05 0.82 -1.00 0.00 0.00 179.01 179.63 3n99 h ILE 76 N -0.34 0.92 -0.26 3.13 2.04 -1.78 -1.10 117.51 120.12 3n99 h ILE 76 Ca -0.00 -0.05 -0.13 0.00 1.00 0.00 0.00 64.86 65.68 3n99 h ILE 76 Cb 0.77 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 3n99 h ILE 76 CO 0.03 0.02 -0.37 1.55 0.00 0.00 0.00 178.15 179.39 3n99 h PRO 77 N 0.14 0.58 -0.39 2.37 0.13 -1.84 0.35 132.00 133.33 3n99 h PRO 77 Ca 0.09 -0.28 0.08 0.00 -0.87 0.00 0.00 66.00 65.03 3n99 h PRO 77 Cb 0.08 -0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.13 3n99 h PRO 77 CO -0.12 0.86 -0.11 1.25 -0.23 0.00 0.00 178.00 179.65 3n99 h LEU 78 N 0.48 -0.41 -0.15 1.56 5.85 -1.23 -1.35 115.31 120.07 3n99 h LEU 78 Ca 0.05 0.12 -0.17 0.00 0.84 0.00 0.00 57.88 58.72 3n99 h LEU 78 Cb 0.86 0.26 -0.02 0.00 0.37 0.00 0.00 40.66 42.13 3n99 h LEU 78 CO 0.07 -0.15 -0.81 0.24 -0.34 0.00 0.00 178.44 177.46 3n99 h MET 79 N -0.02 0.00 0.10 1.25 2.86 -0.94 -3.13 114.93 115.05 3n99 h MET 79 Ca 0.19 0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 57.57 3n99 h MET 79 Cb 0.31 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 3n99 h MET 79 CO -0.41 0.81 -1.31 1.15 1.06 0.00 0.00 176.91 178.21 3n99 h THR 80 N 0.00 1.07 0.00 2.22 2.02 -0.86 -3.38 112.91 113.98 3n99 h THR 80 Ca -0.01 -2.38 -0.17 0.00 0.77 0.00 0.00 66.41 64.62 3n99 h THR 80 Cb 1.55 2.72 -0.03 0.00 -1.74 0.00 0.00 68.15 70.66 3n99 h THR 80 CO 0.11 0.67 -1.15 -0.07 0.37 0.00 0.00 175.52 175.44 3n99 h LEU 81 N -0.40 0.00 -9.42 2.58 3.38 -1.39 -3.45 115.31 106.61 3n99 h LEU 81 Ca -0.29 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.15 3n99 h LEU 81 Cb 1.68 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.44 3n99 h LEU 81 CO 0.04 0.65 0.97 -0.44 0.09 0.00 0.00 178.44 179.75 3n99 s SER 82 N -6.11 6.67 0.02 -0.43 0.01 -1.18 -4.13 113.70 108.54 3n99 s SER 82 Ca -0.01 2.38 0.07 0.00 1.31 0.00 0.00 55.95 59.70 3n99 s SER 82 Cb 0.08 -2.56 -0.03 0.00 0.21 0.00 0.00 66.02 63.73 3n99 s SER 82 CO 0.80 -0.85 -0.19 0.00 0.41 0.00 0.00 173.24 173.41 3n99 n ILE 84 N 1.81 0.15 0.00 0.00 5.41 -0.01 -1.31 119.36 125.41 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 -1.67 0.00 0.00 -0.71 0.00 0.00 39.64 37.78 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 3.71 2.57 3.75 7.39 0.00 0.49 -0.61 105.19 122.49 3n99 n GLY 85 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.32 5.33 0.32 1.61 0.02 -0.43 -4.60 114.94 115.87 3n99 s ASN 86 Ca 0.00 2.69 -0.28 0.00 -1.02 0.00 0.00 52.86 54.24 3n99 s ASN 86 Cb 0.00 -2.63 -0.10 0.00 0.02 0.00 0.00 41.25 38.54 3n99 s ASN 86 CO 0.00 -1.52 1.23 -0.70 0.02 0.00 0.00 177.10 176.12 3n99 s GLU 87 N -2.93 4.40 -0.05 -0.60 2.12 -1.26 -1.98 118.70 118.41 3n99 s GLU 87 Ca 0.71 2.04 0.02 0.00 0.36 0.00 0.00 54.97 58.11 3n99 s GLU 87 Cb -0.38 -3.06 0.01 0.00 0.26 0.00 0.00 34.13 30.96 3n99 s GLU 87 CO 0.45 -0.08 -0.10 0.08 -0.54 0.00 0.00 175.26 175.07 3n99 s VAL 88 N -1.18 0.91 -0.08 3.70 1.01 0.13 -1.27 120.40 123.62 3n99 s VAL 88 Ca 0.49 -0.38 0.03 0.00 0.00 0.00 0.00 61.98 62.12 3n99 s VAL 88 Cb -0.36 -0.83 0.00 0.00 0.00 0.00 0.00 36.38 35.19 3n99 s VAL 88 CO 0.47 0.29 -0.19 -0.63 0.00 0.00 0.00 175.10 175.05 3n99 s ILE 89 N 0.51 1.66 0.02 2.22 1.01 0.75 -0.29 121.20 127.08 3n99 s ILE 89 Ca -0.09 -0.79 -0.30 0.00 0.00 0.00 0.00 60.65 59.46 3n99 s ILE 89 Cb -0.13 -1.46 -0.04 0.00 0.01 0.00 0.00 42.46 40.84 3n99 s ILE 89 CO 0.02 0.47 1.10 -0.69 0.00 0.00 0.00 174.94 175.84 3n99 s VAL 90 N 0.45 4.44 -0.38 2.92 1.01 0.29 -1.11 120.40 128.03 3n99 s VAL 90 Ca -0.16 1.75 0.03 0.00 0.00 0.00 0.00 61.98 63.60 3n99 s VAL 90 Cb -0.17 -4.12 0.03 0.00 0.00 0.00 0.00 36.38 32.12 3n99 s VAL 90 CO 0.07 0.12 0.67 0.23 0.00 0.00 0.00 175.10 176.19 3n99 n MET 91 N 4.03 -0.03 -4.04 2.72 2.81 0.23 -0.84 117.12 121.99 3n99 n MET 91 Ca 0.08 -0.84 -0.11 0.00 -1.81 0.00 0.00 57.70 55.02 3n99 n MET 91 Cb 0.48 -1.06 -0.05 0.00 -0.71 0.00 0.00 33.22 31.88 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 -0.38 0.29 0.00 7.83 1.04 -1.24 -4.84 113.70 116.41 3n99 s SER 92 Ca 0.04 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.29 3n99 s SER 92 Cb 0.03 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.75 3n99 s SER 92 CO 0.04 -1.19 0.00 0.61 0.98 0.00 0.00 173.24 173.68 3n99 n GLY 93 N -0.44 -2.12 0.14 7.32 0.00 -1.26 -3.85 105.19 104.98 3n99 n GLY 93 Ca -0.01 -1.59 0.13 0.00 0.00 0.00 0.00 46.02 44.55 3n99 n GLY 93 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3n99 h ASP 94 N 0.00 0.00 -0.59 1.61 3.32 -1.98 -2.88 116.42 115.90 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 -1.81 2.69 -1.56 3.45 0.00 -1.26 -5.00 120.51 117.02 3n99 n ALA 95 Ca 0.03 -1.48 -0.52 0.00 0.00 0.00 0.00 53.44 51.47 3n99 n ALA 95 Cb 0.28 -0.85 -0.05 0.00 0.00 0.00 0.00 19.45 18.82 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 1.06 0.90 0.00 0.00 4.81 -1.09 -0.68 118.16 123.15 3n99 n LYS 96 Ca 0.22 0.32 0.00 0.00 -0.87 0.00 0.00 58.31 57.99 3n99 n LYS 96 Cb 0.72 -1.84 0.00 0.00 0.02 0.00 0.00 35.03 33.94 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 2.10 2.84 3.77 3.14 0.00 -0.02 -5.00 105.19 112.02 3n99 n GLY 97 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.32 6.08 0.07 1.61 0.01 0.14 -4.75 113.70 115.54 3n99 s SER 98 Ca 0.00 2.28 0.09 0.00 1.31 0.00 0.00 55.95 59.63 3n99 s SER 98 Cb 0.00 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.60 3n99 s SER 98 CO 0.00 -0.98 -0.25 -0.13 0.41 0.00 0.00 173.24 172.29 3n99 s ARG 99 N -2.82 1.58 0.00 12.44 0.52 -1.26 -0.54 118.95 128.86 3n99 s ARG 99 Ca 0.65 -1.15 0.00 0.00 -0.52 0.00 0.00 55.73 54.72 3n99 s ARG 99 Cb -0.27 -1.83 0.00 0.00 0.52 0.00 0.00 34.95 33.36 3n99 s ARG 99 CO 0.33 0.46 0.00 0.41 0.02 0.00 0.00 175.30 176.52 3n99 n GLY 100 N 1.52 3.36 2.94 -3.53 0.00 0.60 -4.64 105.19 105.44 3n99 n GLY 100 Ca -0.17 -1.20 -0.13 0.00 0.00 0.00 0.00 46.02 44.52 3n99 n GLY 100 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3n99 s PHE 101 N -4.30 0.27 0.01 1.61 0.08 -0.66 -0.69 117.98 114.30 3n99 s PHE 101 Ca 0.00 -0.17 -0.30 0.00 0.12 0.00 0.00 56.93 56.58 3n99 s PHE 101 Cb 0.00 -0.17 -0.06 0.00 -0.57 0.00 0.00 43.02 42.22 3n99 s PHE 101 CO 0.00 -0.04 1.44 0.08 -0.10 0.00 0.00 175.22 176.60 3n99 s VAL 102 N -0.42 3.61 -0.44 -0.44 1.01 -0.84 -0.29 120.40 122.59 3n99 s VAL 102 Ca -0.03 1.00 0.22 0.00 0.00 0.00 0.00 61.98 63.17 3n99 s VAL 102 Cb -0.03 -3.65 -0.25 0.00 0.00 0.00 0.00 36.38 32.45 3n99 s VAL 102 CO -0.00 -0.00 0.74 0.35 0.00 0.00 0.00 175.10 176.19 3n99 n THR 103 N 4.67 0.06 -3.07 3.92 -2.24 0.44 -0.38 114.28 117.68 3n99 n THR 103 Ca 0.13 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 3n99 n THR 103 Cb 0.43 0.32 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 3n99 n THR 103 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3n99 n GLY 104 N 1.35 -1.36 3.51 3.38 0.00 -1.15 -4.86 105.19 106.06 3n99 n GLY 104 Ca -0.00 -1.00 -0.16 0.00 0.00 0.00 0.00 46.02 44.86 3n99 n GLY 104 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3n99 s LYS 105 N -0.96 1.02 -0.10 1.61 -2.85 -1.26 -0.56 119.74 116.64 3n99 s LYS 105 Ca 0.00 0.12 -0.03 0.00 -1.00 0.00 0.00 55.97 55.06 3n99 s LYS 105 Cb 0.00 0.48 0.04 0.00 -2.06 0.00 0.00 37.83 36.29 3n99 s LYS 105 CO 0.00 -0.34 0.05 -1.58 0.10 0.00 0.00 175.35 173.58 3n99 s HIS 106 N -1.61 0.31 0.61 1.78 2.46 0.27 -4.17 115.29 114.93 3n99 s HIS 106 Ca -0.07 -0.10 -0.13 0.00 0.47 0.00 0.00 55.06 55.23 3n99 s HIS 106 Cb -0.00 -0.66 -0.04 0.00 -0.13 0.00 0.00 32.58 31.75 3n99 s HIS 106 CO 0.05 -0.35 1.03 0.20 -2.47 0.00 0.00 174.74 173.20 3n99 s GLY 107 N 2.09 1.78 0.00 1.59 0.00 -1.26 -1.31 107.32 110.21 3n99 s GLY 107 Ca 0.04 0.03 0.00 0.00 0.00 0.00 0.00 44.72 44.79 3n99 s GLY 107 CO -0.06 0.32 0.00 0.61 0.00 0.00 0.00 173.10 173.97 3n99 n GLY 108 N -2.24 1.24 0.30 0.20 0.00 -1.26 -4.31 105.19 99.13 3n99 n GLY 108 Ca 0.07 -0.69 0.16 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 0.48 -4.99 1.61 -1.51 -2.04 -3.47 116.25 106.33 3n99 h VAL 109 Ca 0.00 0.00 -0.16 0.00 -1.23 0.00 0.00 66.70 65.31 3n99 h VAL 109 Cb 0.00 0.99 0.12 0.00 -2.13 0.00 0.00 31.29 30.28 3n99 h VAL 109 CO 0.00 0.00 -0.54 0.59 -1.23 0.00 0.00 177.57 176.39 3n99 n ASN 110 N -3.79 -6.05 -4.61 4.19 3.02 -0.89 -4.97 115.26 102.16 3n99 n ASN 110 Ca -0.03 -0.46 -0.31 0.00 -0.03 0.00 0.00 54.58 53.76 3n99 n ASN 110 Cb 0.09 -4.41 -0.10 0.00 -0.61 0.00 0.00 39.78 34.75 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 -3.24 2.88 -0.11 3.10 3.76 -0.43 -4.51 115.29 116.73 3n99 s HIS 111 Ca 0.29 -0.07 -0.02 0.00 -0.15 0.00 0.00 55.06 55.11 3n99 s HIS 111 Cb -0.04 -1.55 -0.03 0.00 1.11 0.00 0.00 32.58 32.08 3n99 s HIS 111 CO 0.61 0.41 -0.03 0.08 -0.85 0.00 0.00 174.74 174.96 3n99 s VAL 112 N -1.13 3.98 -0.06 -0.90 1.01 -0.27 -0.57 120.40 122.45 3n99 s VAL 112 Ca 0.20 -0.36 -0.00 0.00 0.00 0.00 0.00 61.98 61.83 3n99 s VAL 112 Cb -0.11 -2.69 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 3n99 s VAL 112 CO 0.12 0.56 -0.02 -0.76 0.00 0.00 0.00 175.10 174.99 3n99 s LEU 113 N -0.36 3.42 -0.02 3.92 1.43 0.28 -0.76 118.68 126.60 3n99 s LEU 113 Ca 0.06 0.06 -0.01 0.00 -1.03 0.00 0.00 54.13 53.21 3n99 s LEU 113 Cb -0.12 -1.81 0.01 0.00 0.03 0.00 0.00 46.19 44.30 3n99 s LEU 113 CO 0.02 0.35 0.03 -0.69 0.23 0.00 0.00 176.35 176.30 3n99 s VAL 114 N -0.90 -0.02 -0.25 -1.59 1.01 -0.45 -0.42 120.40 117.79 3n99 s VAL 114 Ca 0.14 0.08 -0.11 0.00 0.00 0.00 0.00 61.98 62.09 3n99 s VAL 114 Cb -0.11 -0.07 -0.05 0.00 0.00 0.00 0.00 36.38 36.15 3n99 s VAL 114 CO 0.03 0.03 0.17 -2.28 0.00 0.00 0.00 175.10 173.05 3n99 s HIS 115 N 0.40 3.30 0.31 5.22 2.46 0.60 -1.30 115.29 126.28 3n99 s HIS 115 Ca -0.03 0.21 0.09 0.00 0.47 0.00 0.00 55.06 55.80 3n99 s HIS 115 Cb -0.05 -2.29 -0.05 0.00 -0.13 0.00 0.00 32.58 30.07 3n99 s HIS 115 CO -0.01 0.03 0.01 -0.06 -2.47 0.00 0.00 174.74 172.23 3n99 s PHE 116 N 1.18 2.60 0.72 3.88 0.08 -1.26 -1.65 117.98 123.53 3n99 s PHE 116 Ca 0.07 -0.34 -0.13 0.00 0.12 0.00 0.00 56.93 56.65 3n99 s PHE 116 Cb -0.14 -1.37 0.03 0.00 -0.57 0.00 0.00 43.02 40.97 3n99 s PHE 116 CO 0.06 0.52 1.11 -1.83 -0.10 0.00 0.00 175.22 174.98 3n99 s GLU 117 N -3.71 2.45 0.23 0.44 -1.05 -1.26 -4.90 118.70 110.90 3n99 s GLU 117 Ca 0.34 1.35 -0.08 0.00 -0.15 0.00 0.00 54.97 56.43 3n99 s GLU 117 Cb -0.03 -1.91 0.20 0.00 -0.44 0.00 0.00 34.13 31.95 3n99 s GLU 117 CO 0.20 -1.52 1.87 1.49 0.95 0.00 0.00 175.26 178.25 3n99 h GLU 118 N -0.51 1.19 0.00 -4.83 4.81 -2.01 -1.50 114.58 111.72 3n99 h GLU 118 Ca -0.45 -0.11 -0.00 0.00 -0.13 0.00 0.00 59.36 58.66 3n99 h GLU 118 Cb 1.25 -0.25 -0.00 0.00 0.63 0.00 0.00 28.75 30.38 3n99 h GLU 118 CO 0.52 0.84 -0.01 1.05 -0.73 0.00 0.00 179.01 180.68 3n99 h GLU 119 N 1.20 0.00 -0.23 1.92 4.11 -2.04 -2.64 114.58 116.90 3n99 h GLU 119 Ca 0.31 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 59.59 3n99 h GLU 119 Cb -0.04 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 3n99 h GLU 119 CO -0.06 0.01 -0.47 0.28 0.07 0.00 0.00 179.01 178.85 3n99 h VAL 120 N 0.00 1.31 -0.92 -1.06 2.07 -1.62 -3.35 116.25 112.68 3n99 h VAL 120 Ca -0.00 -1.67 0.01 0.00 0.82 0.00 0.00 66.70 65.86 3n99 h VAL 120 Cb 0.07 1.63 -0.05 0.00 -1.52 0.00 0.00 31.29 31.42 3n99 h VAL 120 CO 0.00 0.53 0.60 -0.07 0.02 0.00 0.00 177.57 178.64 3n99 h LEU 121 N 0.48 1.06 -2.33 2.57 3.38 -1.54 -0.73 115.31 118.21 3n99 h LEU 121 Ca 0.03 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3n99 h LEU 121 Cb 1.00 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.48 3n99 h LEU 121 CO 0.09 0.78 -0.04 1.23 0.09 0.00 0.00 178.44 180.59 3n99 h GLY 122 N 1.25 0.00 0.61 0.83 0.00 -1.72 -2.53 103.07 101.51 3n99 h GLY 122 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.66 3n99 h GLY 122 CO -0.07 0.00 -0.73 0.28 0.00 0.00 0.00 176.54 176.02 3n99 n LYS 123 N -3.37 0.03 -2.46 4.80 5.02 -0.29 -4.98 118.16 116.90 3n99 n LYS 123 Ca -0.02 -0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.94 3n99 n LYS 123 Cb 0.16 -1.51 -0.03 0.00 -0.02 0.00 0.00 35.03 33.63 3n99 n LYS 123 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3n99 s LEU 124 N -3.11 3.74 0.01 -0.35 1.43 -0.95 -4.10 118.68 115.35 3n99 s LEU 124 Ca 0.09 1.76 0.02 0.00 -1.03 0.00 0.00 54.13 54.97 3n99 s LEU 124 Cb 0.17 -4.54 -0.01 0.00 0.03 0.00 0.00 46.19 41.84 3n99 s LEU 124 CO 0.77 -0.72 -0.07 -0.32 0.23 0.00 0.00 176.35 176.25 3n99 s MET 125 N -3.61 0.50 0.23 1.70 -2.45 -1.26 -5.06 119.30 109.34 3n99 s MET 125 Ca 0.63 -0.41 -0.32 0.00 -1.25 0.00 0.00 55.69 54.34 3n99 s MET 125 Cb -0.13 -0.42 -0.14 0.00 1.25 0.00 0.00 34.83 35.40 3n99 s MET 125 CO 0.25 0.10 1.42 0.28 1.05 0.00 0.00 175.02 178.12 3n99 n VAL 126 N 2.40 0.81 0.00 10.11 0.31 -1.26 -1.46 118.33 129.24 3n99 n VAL 126 Ca -0.16 -0.20 0.00 0.00 -0.01 0.00 0.00 64.34 63.96 3n99 n VAL 126 Cb 0.57 -1.46 0.00 0.00 -0.91 0.00 0.00 33.84 32.03 3n99 n VAL 126 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3n99 n GLY 127 N 2.32 1.70 3.72 2.92 0.00 -0.09 -4.94 105.19 110.83 3n99 n GLY 127 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 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 2.91 -4.77 1.61 8.00 -0.54 -4.55 116.55 119.22 3n99 n ASP 128 Ca 0.00 1.14 -0.38 0.00 0.71 0.00 0.00 54.79 56.26 3n99 n ASP 128 Cb 0.00 -1.54 -0.05 0.00 -0.02 0.00 0.00 41.12 39.51 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 -2.20 4.57 -0.05 -1.24 1.02 -1.26 -1.68 119.74 118.90 3n99 s LYS 129 Ca 0.59 1.53 0.02 0.00 0.02 0.00 0.00 55.97 58.13 3n99 s LYS 129 Cb -0.50 -2.96 0.01 0.00 -0.52 0.00 0.00 37.83 33.87 3n99 s LYS 129 CO 0.59 0.23 -0.09 0.42 -0.92 0.00 0.00 175.35 175.58 3n99 s ILE 130 N -1.41 0.91 -0.26 2.17 -1.09 -0.12 -0.60 121.20 120.80 3n99 s ILE 130 Ca 0.48 -0.36 -0.05 0.00 -2.23 0.00 0.00 60.65 58.49 3n99 s ILE 130 Cb -0.24 -0.85 0.00 0.00 -1.58 0.00 0.00 42.46 39.79 3n99 s ILE 130 CO 0.31 0.30 0.02 -0.22 -1.23 0.00 0.00 174.94 174.12 3n99 s LEU 131 N 0.66 3.39 -0.25 2.97 2.96 -0.26 -1.35 118.68 126.79 3n99 s LEU 131 Ca -0.12 -0.55 -0.09 0.00 -0.22 0.00 0.00 54.13 53.14 3n99 s LEU 131 Cb -0.14 -1.81 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 3n99 s LEU 131 CO 0.02 -0.10 0.14 -0.63 -1.32 0.00 0.00 176.35 174.46 3n99 s ILE 132 N 1.49 4.99 -1.04 6.68 1.01 0.68 -0.18 121.20 134.84 3n99 s ILE 132 Ca 0.04 0.06 -0.18 0.00 0.00 0.00 0.00 60.65 60.56 3n99 s ILE 132 Cb -0.16 -3.34 0.12 0.00 0.01 0.00 0.00 42.46 39.09 3n99 s ILE 132 CO -0.00 0.32 1.30 -0.54 0.00 0.00 0.00 174.94 176.02 3n99 s LYS 133 N 1.40 3.74 0.01 2.79 1.02 -0.40 -0.67 119.74 127.63 3n99 s LYS 133 Ca 0.06 -1.86 -0.30 0.00 0.02 0.00 0.00 55.97 53.89 3n99 s LYS 133 Cb -0.15 -5.07 -0.05 0.00 -0.52 0.00 0.00 37.83 32.04 3n99 s LYS 133 CO 0.06 -1.88 1.31 0.00 -0.92 0.00 0.00 175.35 173.92 3n99 s ALA 134 N 2.94 3.52 -0.25 5.17 0.00 -0.31 -4.24 121.76 128.59 3n99 s ALA 134 Ca 0.39 0.84 -0.11 0.00 0.00 0.00 0.00 51.96 53.08 3n99 s ALA 134 Cb -0.03 -3.54 0.09 0.00 0.00 0.00 0.00 23.12 19.65 3n99 s ALA 134 CO -0.06 -0.74 0.57 -0.46 0.00 0.00 0.00 175.76 175.07 3n99 s TRP 135 N 1.91 -1.01 0.00 0.00 -0.00 -1.26 -1.87 118.94 116.71 3n99 s TRP 135 Ca 0.61 1.91 0.00 0.00 -0.00 0.00 0.00 56.10 58.62 3n99 s TRP 135 Cb -0.30 0.55 0.00 0.00 -0.00 0.00 0.00 33.47 33.72 3n99 s TRP 135 CO 0.26 -0.53 0.00 0.41 -0.00 0.00 0.00 176.95 177.10 3n99 n GLY 136 N 4.89 0.97 3.75 5.86 0.00 -1.26 -4.10 105.19 115.31 3n99 n GLY 136 Ca -0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 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 4.49 0.00 1.61 -1.52 -1.26 -2.14 119.66 120.83 3n99 s GLN 137 Ca 0.00 1.98 0.00 0.00 -1.95 0.00 0.00 55.36 55.39 3n99 s GLN 137 Cb 0.00 -3.16 0.00 0.00 -0.22 0.00 0.00 33.01 29.63 3n99 s GLN 137 CO 0.00 -0.04 0.00 0.41 -0.25 0.00 0.00 175.29 175.41 3n99 n GLY 138 N 1.46 0.15 3.70 3.09 0.00 -1.26 -4.74 105.19 107.59 3n99 n GLY 138 Ca 0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.60 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 3.56 -4.13 0.99 7.94 -0.91 -4.96 117.00 119.48 3n99 n LEU 139 Ca 0.00 1.12 -0.22 0.00 -1.11 0.00 0.00 56.01 55.80 3n99 n LEU 139 Cb 0.00 -1.49 -0.14 0.00 0.53 0.00 0.00 43.42 42.31 3n99 n LEU 139 CO 0.00 -0.19 -0.48 -0.54 -1.11 0.00 0.00 177.39 175.07 3n99 s LYS 140 N -0.01 1.12 -0.51 1.96 1.02 -1.26 -4.46 119.74 117.59 3n99 s LYS 140 Ca 0.70 -0.62 -0.23 0.00 0.02 0.00 0.00 55.97 55.83 3n99 s LYS 140 Cb -0.60 -1.11 0.04 0.00 -0.52 0.00 0.00 37.83 35.64 3n99 s LYS 140 CO 0.45 0.29 0.86 -0.51 -0.92 0.00 0.00 175.35 175.53 3n99 s LEU 141 N -0.64 4.25 0.34 3.17 1.43 -1.26 -2.77 118.68 123.20 3n99 s LEU 141 Ca 0.05 -0.33 0.13 0.00 -1.03 0.00 0.00 54.13 52.95 3n99 s LEU 141 Cb -0.06 -2.84 0.62 0.00 0.03 0.00 0.00 46.19 43.93 3n99 s LEU 141 CO 0.00 -1.09 1.75 -0.07 0.23 0.00 0.00 176.35 177.17 3n99 h LEU 142 N 10.57 0.00 -0.70 1.79 3.38 -1.36 -1.90 115.31 127.09 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 1.04 0.45 -0.03 0.47 0.09 0.00 0.00 178.44 180.46 3n99 n ASP 143 N -3.90 1.12 -3.19 -0.43 8.00 -1.26 -4.47 116.55 112.41 3n99 n ASP 143 Ca -0.01 -1.30 -0.22 0.00 0.71 0.00 0.00 54.79 53.96 3n99 n ASP 143 Cb 0.49 0.01 -0.05 0.00 -0.02 0.00 0.00 41.12 41.54 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 -0.18 0.45 0.30 1.24 8.25 -0.71 -4.98 115.22 119.60 3n99 n HIS 144 Ca 0.19 -3.73 0.17 0.00 -0.26 0.00 0.00 57.72 54.09 3n99 n HIS 144 Cb 0.30 -0.40 0.95 0.00 1.12 0.00 0.00 29.99 31.97 3n99 n HIS 144 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3n99 h PRO 145 N 3.60 0.00 -0.06 -0.41 0.13 -1.78 -0.66 132.00 132.82 3n99 h PRO 145 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 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 0.53 0.03 0.00 -0.25 -0.23 0.00 0.00 178.00 178.08 3n99 n ASP 146 N -3.49 1.25 -4.44 1.44 8.00 -1.26 -4.70 116.55 113.35 3n99 n ASP 146 Ca -0.02 -1.49 -0.39 0.00 0.71 0.00 0.00 54.79 53.59 3n99 n ASP 146 Cb 0.13 -0.03 -0.11 0.00 -0.02 0.00 0.00 41.12 41.09 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 -1.94 4.70 -0.07 2.53 1.01 -0.26 -4.60 120.40 121.78 3n99 s VAL 147 Ca 0.37 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 61.78 3n99 s VAL 147 Cb 0.20 -3.43 -0.05 0.00 0.00 0.00 0.00 36.38 33.09 3n99 s VAL 147 CO 0.31 0.01 0.29 -0.54 0.00 0.00 0.00 175.10 175.17 3n99 s LYS 148 N 1.62 3.78 0.24 2.72 -0.14 -0.15 -4.58 119.74 123.22 3n99 s LYS 148 Ca 0.04 0.16 0.12 0.00 -1.36 0.00 0.00 55.97 54.93 3n99 s LYS 148 Cb -0.17 -3.23 -0.05 0.00 -1.68 0.00 0.00 37.83 32.69 3n99 s LYS 148 CO 0.07 0.67 -0.21 0.14 -0.76 0.00 0.00 175.35 175.26 3n99 s VAL 149 N -0.87 2.48 0.05 3.17 -7.23 -1.26 -1.11 120.40 115.63 3n99 s VAL 149 Ca 0.19 -2.21 -0.28 0.00 -1.81 0.00 0.00 61.98 57.88 3n99 s VAL 149 Cb -0.14 -2.26 0.09 0.00 0.56 0.00 0.00 36.38 34.63 3n99 s VAL 149 CO 0.09 -0.27 1.07 0.00 -0.31 0.00 0.00 175.10 175.67 3n99 s MET 150 N -3.14 0.83 -1.38 4.82 0.23 -0.62 -4.69 119.30 115.35 3n99 s MET 150 Ca 0.26 -0.43 0.00 0.00 -1.03 0.00 0.00 55.69 54.49 3n99 s MET 150 Cb -0.06 0.30 0.00 0.00 -1.53 0.00 0.00 34.83 33.54 3n99 s MET 150 CO 0.13 -0.38 0.00 0.09 -2.03 0.00 0.00 175.02 172.83 3n99 n ASN 151 N -0.41 -5.57 -3.89 -1.18 3.02 -1.26 -4.18 115.26 101.78 3n99 n ASN 151 Ca -0.07 0.32 -0.19 0.00 -0.03 0.00 0.00 54.58 54.62 3n99 n ASN 151 Cb 0.61 -4.22 -0.16 0.00 -0.61 0.00 0.00 39.78 35.41 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 -2.14 0.45 0.09 2.41 2.07 -1.26 -0.83 121.20 121.99 3n99 s ILE 152 Ca 0.00 -0.10 -0.33 0.00 -1.41 0.00 0.00 60.65 58.81 3n99 s ILE 152 Cb 0.00 -0.48 -0.12 0.00 0.13 0.00 0.00 42.46 41.99 3n99 s ILE 152 CO 0.00 0.19 1.73 -0.67 -1.91 0.00 0.00 174.94 174.29 3n99 n ASP 153 N 3.89 3.49 -0.01 4.50 -0.08 0.22 -4.53 116.55 124.02 3n99 n ASP 153 Ca -0.24 1.03 0.10 0.00 -1.51 0.00 0.00 54.79 54.17 3n99 n ASP 153 Cb 0.52 -1.45 0.52 0.00 2.34 0.00 0.00 41.12 43.04 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 7.53 0.34 -0.36 -0.67 0.11 -1.91 0.40 132.00 137.44 3n99 h PRO 154 Ca -0.46 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.50 3n99 h PRO 154 Cb 1.25 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 3n99 h PRO 154 CO 0.92 0.23 -0.28 -0.44 -0.21 0.00 0.00 178.00 178.22 3n99 h ASP 155 N 0.36 0.88 -0.72 -2.05 3.32 -1.96 -2.81 116.42 113.43 3n99 h ASP 155 Ca 0.20 -0.44 -0.07 0.00 0.02 0.00 0.00 57.03 56.74 3n99 h ASP 155 Cb 0.35 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 3n99 h ASP 155 CO -0.05 1.14 0.17 0.25 -1.72 0.00 0.00 179.24 179.03 3n99 h LEU 156 N 0.63 1.09 -0.77 1.55 5.85 -1.72 -3.04 115.31 118.89 3n99 h LEU 156 Ca 0.07 -0.23 0.12 0.00 0.84 0.00 0.00 57.88 58.67 3n99 h LEU 156 Cb 0.86 -0.29 -0.08 0.00 0.37 0.00 0.00 40.66 41.52 3n99 h LEU 156 CO 0.07 1.04 0.38 0.15 -0.34 0.00 0.00 178.44 179.74 3n99 h PHE 157 N 1.09 0.67 0.00 1.25 3.57 -0.75 0.23 116.94 122.99 3n99 h PHE 157 Ca 0.23 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.76 3n99 h PHE 157 Cb 0.38 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 38.93 3n99 h PHE 157 CO 0.03 0.19 0.00 0.39 -2.23 0.00 0.00 178.31 176.69 3n99 n GLU 158 N -4.89 0.08 -0.05 1.11 1.02 -1.08 -2.50 120.64 114.33 3n99 n GLU 158 Ca 0.14 0.26 0.05 0.00 -0.02 0.00 0.00 57.16 57.59 3n99 n GLU 158 Cb 0.35 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.34 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 -1.38 1.11 0.00 3.49 5.02 0.06 -4.61 118.16 121.85 3n99 n LYS 159 Ca 0.04 -1.36 0.15 0.00 -2.02 0.00 0.00 58.31 55.12 3n99 n LYS 159 Cb 0.09 -1.21 0.90 0.00 -0.02 0.00 0.00 35.03 34.79 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 0.52 0.00 -0.00 -0.35 4.77 -1.04 -4.88 117.00 116.02 3n99 n LEU 160 Ca 0.07 0.03 -0.00 0.00 -0.03 0.00 0.00 56.01 56.08 3n99 n LEU 160 Cb 0.30 -0.03 -0.00 0.00 -2.33 0.00 0.00 43.42 41.35 3n99 n LEU 160 CO 0.07 -0.00 -0.00 0.61 -1.33 0.00 0.00 177.39 176.73 3n99 n GLY 161 N 0.97 0.40 3.77 -0.72 0.00 -1.26 -4.71 105.19 103.63 3n99 n GLY 161 Ca 0.22 -0.96 -0.39 0.00 0.00 0.00 0.00 46.02 44.89 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 3.57 -0.06 -0.61 1.01 -1.26 -4.54 121.20 117.31 3n99 s ILE 162 Ca 0.00 1.42 -0.01 0.00 0.00 0.00 0.00 60.65 62.06 3n99 s ILE 162 Cb 0.00 -3.84 0.03 0.00 0.01 0.00 0.00 42.46 38.66 3n99 s ILE 162 CO 0.00 0.21 0.01 -1.10 0.00 0.00 0.00 174.94 174.07 3n99 s GLN 163 N -1.89 0.44 -0.10 2.79 -0.21 -0.69 -4.98 119.66 115.02 3n99 s GLN 163 Ca 0.50 0.16 -0.28 0.00 0.02 0.00 0.00 55.36 55.76 3n99 s GLN 163 Cb -0.28 -0.83 -0.02 0.00 1.00 0.00 0.00 33.01 32.89 3n99 s GLN 163 CO 0.35 -0.29 0.96 -2.00 -2.12 0.00 0.00 175.29 172.19 3n99 s GLU 164 N 1.91 4.41 -0.16 2.91 2.12 -1.26 -0.49 118.70 128.15 3n99 s GLU 164 Ca 0.03 1.30 -0.04 0.00 0.36 0.00 0.00 54.97 56.62 3n99 s GLU 164 Cb -0.12 -3.53 0.08 0.00 0.26 0.00 0.00 34.13 30.81 3n99 s GLU 164 CO -0.04 -0.27 0.27 0.21 -0.54 0.00 0.00 175.26 174.89 3n99 s LYS 165 N 1.87 0.18 -1.39 4.30 2.20 -0.30 -4.90 119.74 121.70 3n99 s LYS 165 Ca 0.46 0.63 -0.08 0.00 -0.36 0.00 0.00 55.97 56.62 3n99 s LYS 165 Cb -0.18 -0.30 0.03 0.00 -1.51 0.00 0.00 37.83 35.87 3n99 s LYS 165 CO 0.18 -0.40 1.03 0.09 -0.36 0.00 0.00 175.35 175.89 3n99 n ASN 166 N 5.35 -4.57 0.00 1.43 3.02 -1.26 -2.36 115.26 116.87 3n99 n ASN 166 Ca -0.06 -0.67 0.00 0.00 -0.03 0.00 0.00 54.58 53.82 3n99 n ASN 166 Cb 0.50 -4.53 0.00 0.00 -0.61 0.00 0.00 39.78 35.14 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 -1.73 0.79 3.41 7.41 0.00 -1.26 -5.02 105.19 108.79 3n99 n GLY 167 Ca -0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.09 1.64 -0.32 1.61 1.02 -0.99 -4.94 119.74 117.66 3n99 s LYS 168 Ca 0.00 -1.22 -0.09 0.00 0.02 0.00 0.00 55.97 54.68 3n99 s LYS 168 Cb 0.00 -1.99 0.01 0.00 -0.52 0.00 0.00 37.83 35.33 3n99 s LYS 168 CO 0.00 0.48 0.13 0.42 -0.92 0.00 0.00 175.35 175.46 3n99 s ILE 169 N -1.01 4.29 -0.21 2.17 1.01 0.51 -1.15 121.20 126.82 3n99 s ILE 169 Ca 0.14 -0.65 -0.14 0.00 0.00 0.00 0.00 60.65 60.00 3n99 s ILE 169 Cb -0.10 -3.25 -0.04 0.00 0.01 0.00 0.00 42.46 39.07 3n99 s ILE 169 CO 0.06 0.00 0.30 -1.00 0.00 0.00 0.00 174.94 174.30 3n99 s HIS 170 N 1.54 3.37 -0.17 3.97 3.76 0.36 0.14 115.29 128.26 3n99 s HIS 170 Ca 0.03 0.48 0.01 0.00 -0.15 0.00 0.00 55.06 55.43 3n99 s HIS 170 Cb -0.18 -2.41 0.02 0.00 1.11 0.00 0.00 32.58 31.13 3n99 s HIS 170 CO 0.05 0.05 -0.16 0.08 -0.85 0.00 0.00 174.74 173.91 3n99 s VAL 171 N 1.10 1.77 0.07 -0.90 1.01 -0.18 -1.70 120.40 121.56 3n99 s VAL 171 Ca 0.15 -0.79 -0.31 0.00 0.00 0.00 0.00 61.98 61.03 3n99 s VAL 171 Cb -0.14 -1.65 -0.07 0.00 0.00 0.00 0.00 36.38 34.52 3n99 s VAL 171 CO 0.06 0.46 1.40 -2.84 0.00 0.00 0.00 175.10 174.19 3n99 s PRO 172 N 1.40 4.30 0.07 2.72 0.02 -1.26 -0.45 135.00 141.80 3n99 s PRO 172 Ca 0.04 2.04 0.02 0.00 0.02 0.00 0.00 61.00 63.12 3n99 s PRO 172 Cb -0.13 -3.40 -0.03 0.00 0.02 0.00 0.00 34.50 30.96 3n99 s PRO 172 CO -0.11 -0.50 -0.07 0.14 -0.33 0.00 0.00 177.00 176.13 3n99 s VAL 173 N 1.69 0.56 -0.38 3.83 -7.23 -0.55 -4.82 120.40 113.50 3n99 s VAL 173 Ca 0.65 -1.48 0.23 0.00 -1.81 0.00 0.00 61.98 59.56 3n99 s VAL 173 Cb -0.35 -1.11 -0.04 0.00 0.56 0.00 0.00 36.38 35.45 3n99 s VAL 173 CO 0.29 -0.64 1.06 1.33 -0.31 0.00 0.00 175.10 176.83 3n99 n VAL 174 N 0.74 0.43 -3.54 1.32 0.24 0.29 -0.80 118.33 117.01 3n99 n VAL 174 Ca -0.18 -0.43 -0.14 0.00 -2.04 0.00 0.00 64.34 61.55 3n99 n VAL 174 Cb 0.58 -0.16 -0.05 0.00 -1.47 0.00 0.00 33.84 32.74 3n99 n VAL 174 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3n99 s ALA 175 N -3.30 -1.46 -0.24 2.33 0.00 -1.26 -4.76 121.76 113.07 3n99 s ALA 175 Ca 0.01 0.73 -0.05 0.00 0.00 0.00 0.00 51.96 52.65 3n99 s ALA 175 Cb 0.12 0.38 -0.01 0.00 0.00 0.00 0.00 23.12 23.60 3n99 s ALA 175 CO 0.79 -0.51 0.01 0.15 0.00 0.00 0.00 175.76 176.19 3n99 s LYS 176 N -2.37 3.40 -0.19 0.00 1.02 -1.26 -1.20 119.74 119.14 3n99 s LYS 176 Ca -0.06 -0.63 -0.05 0.00 0.02 0.00 0.00 55.97 55.26 3n99 s LYS 176 Cb -0.01 -3.15 -0.02 0.00 -0.52 0.00 0.00 37.83 34.13 3n99 s LYS 176 CO -0.01 -0.24 -0.01 0.42 -0.92 0.00 0.00 175.35 174.59 3n99 s ILE 177 N 1.52 3.86 0.53 2.17 1.01 0.38 -4.94 121.20 125.72 3n99 s ILE 177 Ca 0.05 -0.35 -0.19 0.00 0.00 0.00 0.00 60.65 60.16 3n99 s ILE 177 Cb -0.15 -2.73 -0.07 0.00 0.01 0.00 0.00 42.46 39.52 3n99 s ILE 177 CO -0.01 0.44 1.09 -2.16 0.00 0.00 0.00 174.94 174.31 3n99 s PRO 178 N 0.91 3.52 0.28 2.79 0.04 -1.26 -0.24 135.00 141.03 3n99 s PRO 178 Ca 0.01 1.49 -0.08 0.00 0.04 0.00 0.00 61.00 62.45 3n99 s PRO 178 Cb -0.14 -2.04 0.45 0.00 0.04 0.00 0.00 34.50 32.81 3n99 s PRO 178 CO 0.02 -0.69 1.56 0.00 0.04 0.00 0.00 177.00 177.93 3n99 h ALA 179 N 1.27 0.65 0.00 8.56 0.00 -1.82 -0.83 119.26 127.09 3n99 h ALA 179 Ca -0.50 0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3n99 h ALA 179 Cb 1.24 0.76 0.00 0.00 0.00 0.00 0.00 17.79 19.79 3n99 h ALA 179 CO 0.58 -0.38 0.00 -2.39 0.00 0.00 0.00 179.25 177.05 3n99 n HIS 180 N -5.62 0.27 1.59 0.00 1.44 -1.26 -1.14 115.22 110.49 3n99 n HIS 180 Ca 0.16 0.12 0.14 0.00 -2.01 0.00 0.00 57.72 56.13 3n99 n HIS 180 Cb 0.49 -0.70 0.61 0.00 0.12 0.00 0.00 29.99 30.51 3n99 n HIS 180 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 3n99 n MET 181 N -1.76 1.48 -3.52 -1.40 2.00 -0.32 -4.87 117.12 108.73 3n99 n MET 181 Ca 0.01 -0.74 -0.38 0.00 0.00 0.00 0.00 57.70 56.60 3n99 n MET 181 Cb 0.10 -1.48 -0.06 0.00 0.00 0.00 0.00 33.22 31.78 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 -2.03 3.95 0.00 0.03 -1.94 -0.29 0.49 119.30 119.50 3n99 s MET 182 Ca 0.39 0.35 0.00 0.00 -1.71 0.00 0.00 55.69 54.72 3n99 s MET 182 Cb 0.21 -3.25 0.00 0.00 2.01 0.00 0.00 34.83 33.80 3n99 s MET 182 CO 0.35 0.61 0.00 0.41 -0.01 0.00 0.00 175.02 176.38 3n99 n GLY 183 N 2.09 2.96 3.63 -0.03 0.00 0.21 -4.84 105.19 109.20 3n99 n GLY 183 Ca -0.14 -0.29 -0.49 0.00 0.00 0.00 0.00 46.02 45.10 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 2.32 0.00 1.61 2.88 0.36 -2.05 113.62 118.74 3n99 n SER 184 Ca 0.00 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 58.64 3n99 n SER 184 Cb 0.00 -1.30 0.00 0.00 -0.75 0.00 0.00 64.21 62.16 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 2.97 2.08 3.68 0.46 0.00 -1.26 -1.33 105.19 111.79 3n99 n GLY 185 Ca 0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 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 1.41 0.00 -0.61 5.41 -0.87 -1.17 119.36 123.13 3n99 n ILE 186 Ca 0.00 -0.35 0.00 0.00 1.00 0.00 0.00 62.75 63.40 3n99 n ILE 186 Cb 0.00 -1.51 0.00 0.00 -0.71 0.00 0.00 39.64 37.42 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 1.58 1.05 3.65 7.39 0.00 -0.30 -5.01 105.19 113.55 3n99 n GLY 187 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.72 0.58 -0.11 4.61 0.00 -0.32 -4.71 120.51 118.85 3n99 n ALA 188 Ca 0.00 0.11 -0.03 0.00 0.00 0.00 0.00 53.44 53.52 3n99 n ALA 188 Cb 0.00 -2.17 0.20 0.00 0.00 0.00 0.00 19.45 17.48 3n99 n ALA 188 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3n99 h SER 189 N 1.10 0.74 -3.29 0.00 0.87 -1.92 -0.92 113.55 110.13 3n99 h SER 189 Ca -0.48 -0.14 -0.24 0.00 -1.23 0.00 0.00 61.79 59.70 3n99 h SER 189 Cb 1.34 -0.19 -0.32 0.00 -0.44 0.00 0.00 62.40 62.78 3n99 h SER 189 CO 0.54 0.74 -0.58 -0.55 -0.53 0.00 0.00 176.83 176.46 3n99 s SER 190 N -6.60 0.09 0.18 6.23 0.15 -1.26 -3.67 113.70 108.82 3n99 s SER 190 Ca -0.09 0.38 0.13 0.00 0.70 0.00 0.00 55.95 57.06 3n99 s SER 190 Cb 0.15 0.30 0.68 0.00 -1.71 0.00 0.00 66.02 65.45 3n99 s SER 190 CO 0.80 -0.18 1.39 -1.54 1.20 0.00 0.00 173.24 174.91 3n99 n SER 191 N 4.56 0.33 0.12 5.45 3.41 -0.33 -1.60 113.62 125.56 3n99 n SER 191 Ca -0.20 0.65 0.13 0.00 -0.26 0.00 0.00 58.87 59.19 3n99 n SER 191 Cb 0.51 -0.69 0.42 0.00 -0.26 0.00 0.00 64.21 64.19 3n99 n SER 191 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3n99 h ALA 192 N 2.02 1.00 0.00 7.33 0.00 -1.91 -3.37 119.26 124.33 3n99 h ALA 192 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3n99 h ALA 192 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3n99 h ALA 192 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.12 3n99 n SER 193 N -2.33 1.72 -3.59 0.00 3.41 -0.63 -4.18 113.62 108.02 3n99 n SER 193 Ca 0.05 -1.85 -0.10 0.00 -0.26 0.00 0.00 58.87 56.70 3n99 n SER 193 Cb 0.38 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.31 3n99 n SER 193 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3n99 s THR 194 N -0.85 0.02 0.47 6.66 -1.32 -1.23 -4.62 115.64 114.77 3n99 s THR 194 Ca 0.00 -0.41 0.06 0.00 -1.21 0.00 0.00 61.69 60.13 3n99 s THR 194 Cb 0.00 -1.31 0.02 0.00 -1.51 0.00 0.00 72.50 69.70 3n99 s THR 194 CO 0.00 -0.07 0.65 1.51 -2.21 0.00 0.00 174.62 174.50 3n99 s ASP 195 N -2.81 5.51 0.10 8.08 -4.77 -1.26 -4.65 116.67 116.86 3n99 s ASP 195 Ca 0.05 -0.29 -0.01 0.00 -3.30 0.00 0.00 52.55 48.99 3n99 s ASP 195 Cb -0.01 -0.71 -0.04 0.00 -1.09 0.00 0.00 42.92 41.07 3n99 s ASP 195 CO -0.07 -0.91 0.03 -0.72 0.70 0.00 0.00 175.17 174.19 3n99 s TYR 196 N -2.50 0.71 -0.16 2.11 1.13 -0.53 -4.71 117.35 113.40 3n99 s TYR 196 Ca 0.56 -1.15 -0.14 0.00 -1.41 0.00 0.00 57.07 54.93 3n99 s TYR 196 Cb -0.10 -0.43 -0.05 0.00 -1.10 0.00 0.00 41.96 40.28 3n99 s TYR 196 CO 0.35 -0.47 0.31 -0.51 -2.51 0.00 0.00 175.55 172.72 3n99 s ASP 197 N -2.99 6.46 -0.36 -0.18 1.11 -0.44 -0.33 116.67 119.93 3n99 s ASP 197 Ca 0.17 0.54 -0.29 0.00 0.18 0.00 0.00 52.55 53.15 3n99 s ASP 197 Cb 0.08 -2.19 0.01 0.00 1.07 0.00 0.00 42.92 41.89 3n99 s ASP 197 CO -0.03 0.09 1.20 -0.63 1.18 0.00 0.00 175.17 176.99 3n99 s ILE 198 N 0.46 4.24 -0.46 0.77 1.01 0.07 0.65 121.20 127.94 3n99 s ILE 198 Ca 0.17 1.37 -0.02 0.00 0.00 0.00 0.00 60.65 62.17 3n99 s ILE 198 Cb -0.13 -4.35 0.25 0.00 0.01 0.00 0.00 42.46 38.23 3n99 s ILE 198 CO 0.04 -0.64 2.17 1.15 0.00 0.00 0.00 174.94 177.66 3n99 n MET 199 N 7.40 2.18 -3.00 2.79 0.00 0.18 -2.66 117.12 124.01 3n99 n MET 199 Ca 0.13 -2.23 -0.41 0.00 0.00 0.00 0.00 57.70 55.19 3n99 n MET 199 Cb 0.47 -1.91 -0.05 0.00 0.00 0.00 0.00 33.22 31.73 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 -2.40 3.61 -0.29 3.17 0.00 -1.26 -4.86 121.76 119.71 3n99 s ALA 200 Ca 0.45 -0.24 0.27 0.00 0.00 0.00 0.00 51.96 52.44 3n99 s ALA 200 Cb 0.34 -3.15 0.77 0.00 0.00 0.00 0.00 23.12 21.08 3n99 s ALA 200 CO -0.07 -0.80 1.76 0.66 0.00 0.00 0.00 175.76 177.30 3n99 h SER 201 N 7.69 0.00 -4.56 0.00 4.64 -1.90 -3.45 113.55 115.97 3n99 h SER 201 Ca -0.26 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 60.81 3n99 h SER 201 Cb 1.11 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 62.97 3n99 h SER 201 CO 0.82 0.00 -0.73 0.20 -0.87 0.00 0.00 176.83 176.26 3n99 s ASN 202 N -5.74 0.52 0.50 4.97 0.01 -1.26 -5.00 114.94 108.94 3n99 s ASN 202 Ca 0.05 -0.39 0.18 0.00 -0.71 0.00 0.00 52.86 51.99 3n99 s ASN 202 Cb 0.07 0.03 1.26 0.00 0.41 0.00 0.00 41.25 43.03 3n99 s ASN 202 CO 0.60 -0.16 2.11 1.55 -1.51 0.00 0.00 177.10 179.69 3n99 h PRO 203 N 5.01 0.00 0.00 -0.60 0.13 -1.86 -1.96 132.00 132.72 3n99 h PRO 203 Ca -0.32 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.77 3n99 h PRO 203 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 3n99 h PRO 203 CO 0.44 0.07 -0.20 0.93 -0.23 0.00 0.00 178.00 179.00 3n99 h GLU 204 N 0.00 0.00 0.00 0.86 3.07 -1.80 -0.65 114.58 116.06 3n99 h GLU 204 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3n99 h GLU 204 Cb 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.04 3n99 h GLU 204 CO 0.01 0.20 0.00 -0.44 -1.40 0.00 0.00 179.01 177.38 3n99 h ASP 205 N 0.00 0.00 -0.55 1.42 3.32 -1.64 0.43 116.42 119.40 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 0.40 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.95 3n99 h ASP 205 CO 0.03 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.73 3n99 n LEU 206 N -2.47 3.47 -0.63 1.55 4.77 -0.26 -4.96 117.00 118.47 3n99 n LEU 206 Ca -0.01 -1.96 -0.07 0.00 -0.03 0.00 0.00 56.01 53.93 3n99 n LEU 206 Cb 0.07 -0.36 -0.02 0.00 -2.33 0.00 0.00 43.42 40.78 3n99 n LEU 206 CO 0.14 0.86 -0.08 0.61 -1.33 0.00 0.00 177.39 177.59 3n99 n GLY 207 N 1.15 0.67 3.25 -0.72 0.00 0.14 -4.87 105.19 104.82 3n99 n GLY 207 Ca 0.19 -0.68 -0.15 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.30 1.20 -0.24 1.61 -7.23 -1.13 -5.00 120.40 107.33 3n99 s VAL 208 Ca 0.00 -2.05 0.18 0.00 -1.81 0.00 0.00 61.98 58.29 3n99 s VAL 208 Cb 0.00 -1.84 0.12 0.00 0.56 0.00 0.00 36.38 35.22 3n99 s VAL 208 CO 0.00 -0.73 1.42 0.00 -0.31 0.00 0.00 175.10 175.49 3n99 h ALA 209 N 2.81 0.75 -2.93 1.32 0.00 -1.96 -2.77 119.26 116.48 3n99 h ALA 209 Ca -0.37 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.18 3n99 h ALA 209 Cb 1.19 -0.03 -0.11 0.00 0.00 0.00 0.00 17.79 18.84 3n99 h ALA 209 CO 0.63 0.45 0.12 0.34 0.00 0.00 0.00 179.25 180.79 3n99 s ASP 210 N -6.29 -0.41 -0.11 0.00 2.15 -1.26 -4.81 116.67 105.94 3n99 s ASP 210 Ca 0.04 -0.22 -0.05 0.00 0.43 0.00 0.00 52.55 52.75 3n99 s ASP 210 Cb 0.07 0.58 0.05 0.00 -0.30 0.00 0.00 42.92 43.33 3n99 s ASP 210 CO 0.73 -1.00 0.24 -0.22 -0.17 0.00 0.00 175.17 174.75 3n99 s LEU 211 N -2.80 0.12 0.07 -1.34 2.96 -1.26 -5.00 118.68 111.42 3n99 s LEU 211 Ca 0.04 0.53 0.03 0.00 -0.22 0.00 0.00 54.13 54.51 3n99 s LEU 211 Cb -0.01 0.67 -0.04 0.00 0.50 0.00 0.00 46.19 47.31 3n99 s LEU 211 CO -0.09 -0.20 0.03 -0.54 -1.32 0.00 0.00 176.35 174.24 3n99 s LYS 212 N 1.77 2.74 0.15 1.98 1.02 -1.26 -0.56 119.74 125.57 3n99 s LYS 212 Ca -0.04 -0.73 -0.31 0.00 0.02 0.00 0.00 55.97 54.90 3n99 s LYS 212 Cb -0.11 -2.65 -0.10 0.00 -0.52 0.00 0.00 37.83 34.45 3n99 s LYS 212 CO -0.08 0.57 1.65 -0.51 -0.92 0.00 0.00 175.35 176.06 3n99 s LEU 213 N -2.19 4.37 0.00 3.17 1.43 0.42 -1.71 118.68 124.17 3n99 s LEU 213 Ca 0.26 2.66 0.00 0.00 -1.03 0.00 0.00 54.13 56.02 3n99 s LEU 213 Cb -0.12 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.52 3n99 s LEU 213 CO 0.18 -0.89 0.00 0.61 0.23 0.00 0.00 176.35 176.48 3n99 n GLY 214 N 3.92 0.38 3.77 -3.19 0.00 0.37 -0.49 105.19 109.96 3n99 n GLY 214 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 3n99 n GLY 214 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3n99 s ASP 215 N -2.38 5.77 -0.18 1.61 1.01 -0.69 -0.76 116.67 121.06 3n99 s ASP 215 Ca 0.00 2.17 -0.10 0.00 0.71 0.00 0.00 52.55 55.33 3n99 s ASP 215 Cb 0.00 -2.58 -0.05 0.00 1.01 0.00 0.00 42.92 41.30 3n99 s ASP 215 CO 0.00 -1.19 0.17 -0.63 0.21 0.00 0.00 175.17 173.73 3n99 s ILE 216 N -1.77 5.40 0.14 0.77 1.01 -0.21 -1.64 121.20 124.89 3n99 s ILE 216 Ca 0.72 0.28 0.05 0.00 0.00 0.00 0.00 60.65 61.69 3n99 s ILE 216 Cb -0.24 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.69 3n99 s ILE 216 CO 0.27 0.46 -0.11 0.68 0.00 0.00 0.00 174.94 176.24 3n99 s VAL 217 N 0.13 1.18 -0.04 2.92 -7.23 -0.55 -0.55 120.40 116.27 3n99 s VAL 217 Ca 0.11 -1.95 -0.02 0.00 -1.81 0.00 0.00 61.98 58.32 3n99 s VAL 217 Cb -0.12 -1.73 -0.04 0.00 0.56 0.00 0.00 36.38 35.06 3n99 s VAL 217 CO 0.00 -0.66 0.07 0.00 -0.31 0.00 0.00 175.10 174.20 3n99 s ALA 218 N -2.98 3.54 -0.22 1.32 0.00 -0.34 -1.52 121.76 121.56 3n99 s ALA 218 Ca 0.14 -0.82 -0.02 0.00 0.00 0.00 0.00 51.96 51.25 3n99 s ALA 218 Cb 0.00 -1.60 0.01 0.00 0.00 0.00 0.00 23.12 21.53 3n99 s ALA 218 CO 0.01 0.65 -0.08 0.42 0.00 0.00 0.00 175.76 176.77 3n99 s ILE 219 N -1.08 2.99 0.11 0.00 1.01 0.46 -0.47 121.20 124.22 3n99 s ILE 219 Ca 0.19 -0.73 -0.28 0.00 0.00 0.00 0.00 60.65 59.83 3n99 s ILE 219 Cb -0.12 -2.39 -0.06 0.00 0.01 0.00 0.00 42.46 39.89 3n99 s ILE 219 CO 0.09 0.37 0.87 -1.10 0.00 0.00 0.00 174.94 175.17 3n99 s GLN 220 N 1.40 4.64 -1.46 2.79 -0.21 0.67 -1.79 119.66 125.69 3n99 s GLN 220 Ca 0.04 1.29 0.00 0.00 0.02 0.00 0.00 55.36 56.71 3n99 s GLN 220 Cb -0.15 -3.34 0.00 0.00 1.00 0.00 0.00 33.01 30.52 3n99 s GLN 220 CO -0.05 0.33 0.00 -0.25 -2.12 0.00 0.00 175.29 173.19 3n99 n ASP 221 N 2.45 -4.87 -4.16 5.90 8.00 0.34 -2.46 116.55 121.76 3n99 n ASP 221 Ca -0.01 0.06 -0.31 0.00 0.71 0.00 0.00 54.79 55.24 3n99 n ASP 221 Cb 0.49 -3.94 -0.17 0.00 -0.02 0.00 0.00 41.12 37.48 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 -2.77 2.44 -0.12 1.24 3.76 -1.25 -1.16 115.29 117.42 3n99 s HIS 222 Ca 0.00 -1.12 -0.14 0.00 -0.15 0.00 0.00 55.06 53.64 3n99 s HIS 222 Cb 0.00 -1.67 -0.05 0.00 1.11 0.00 0.00 32.58 31.98 3n99 s HIS 222 CO 0.00 -0.50 0.34 0.34 -0.85 0.00 0.00 174.74 174.07 3n99 s ASP 223 N 0.67 6.54 -0.21 1.40 2.15 0.82 -3.57 116.67 124.47 3n99 s ASP 223 Ca -0.12 0.64 0.14 0.00 0.43 0.00 0.00 52.55 53.64 3n99 s ASP 223 Cb -0.16 -2.21 0.45 0.00 -0.30 0.00 0.00 42.92 40.70 3n99 s ASP 223 CO 0.02 0.13 1.18 0.59 -0.17 0.00 0.00 175.17 176.93 3n99 n ASN 224 N 3.21 2.72 -0.28 -0.34 3.02 -1.26 -1.87 115.26 120.45 3n99 n ASN 224 Ca -0.12 -3.27 -0.06 0.00 -0.03 0.00 0.00 54.58 51.10 3n99 n ASN 224 Cb 0.52 -0.42 0.06 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 1.67 1.09 0.00 6.41 0.02 -1.94 -3.43 113.55 117.36 3n99 h SER 225 Ca 0.07 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 3n99 h SER 225 Cb 1.37 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 63.62 3n99 h SER 225 CO 0.31 0.97 0.00 -1.22 -1.14 0.00 0.00 176.83 175.76 3n99 n TYR 226 N -4.28 0.00 -1.48 3.45 4.01 -1.26 -4.92 117.16 112.68 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 0.20 0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.34 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 -0.77 1.61 -0.03 2.72 0.00 -1.24 -1.19 107.32 108.41 3n99 s GLY 227 Ca 0.00 -0.27 -0.25 0.00 0.00 0.00 0.00 44.72 44.20 3n99 s GLY 227 CO 0.00 0.20 0.77 0.14 0.00 0.00 0.00 173.10 174.22 3n99 s VAL 228 N -3.15 4.96 0.00 1.40 1.01 -0.35 -4.52 120.40 119.75 3n99 s VAL 228 Ca 0.62 1.61 0.00 0.00 0.00 0.00 0.00 61.98 64.21 3n99 s VAL 228 Cb -0.15 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 32.12 3n99 s VAL 228 CO 0.55 0.25 0.00 0.61 0.00 0.00 0.00 175.10 176.50 3n99 n GLY 229 N 2.95 0.92 3.66 4.51 0.00 -1.24 -1.14 105.19 114.84 3n99 n GLY 229 Ca 0.00 -0.69 -0.43 0.00 0.00 0.00 0.00 46.02 44.91 3n99 n GLY 229 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3n99 s LYS 230 N -4.85 4.19 0.08 1.61 2.47 -0.78 -4.79 119.74 117.67 3n99 s LYS 230 Ca 0.00 1.64 -0.31 0.00 -1.56 0.00 0.00 55.97 55.75 3n99 s LYS 230 Cb 0.00 -3.79 -0.07 0.00 -1.46 0.00 0.00 37.83 32.51 3n99 s LYS 230 CO 0.00 -0.76 1.36 -0.47 0.16 0.00 0.00 175.35 175.63 3n99 s TYR 231 N 3.64 3.18 -0.24 4.03 5.04 -1.26 -0.12 117.35 131.61 3n99 s TYR 231 Ca 0.56 0.99 -0.08 0.00 -2.44 0.00 0.00 57.07 56.10 3n99 s TYR 231 Cb -0.22 -3.63 0.11 0.00 0.35 0.00 0.00 41.96 38.58 3n99 s TYR 231 CO 0.16 -2.19 0.52 0.50 -1.34 0.00 0.00 175.55 173.20 3n99 s ARG 232 N 1.42 0.43 0.06 4.97 3.52 -0.31 -4.88 118.95 124.16 3n99 s ARG 232 Ca 0.63 1.20 -0.31 0.00 -0.13 0.00 0.00 55.73 57.12 3n99 s ARG 232 Cb -0.34 0.54 -0.08 0.00 -1.56 0.00 0.00 34.95 33.52 3n99 s ARG 232 CO 0.29 -0.25 1.59 0.21 -0.81 0.00 0.00 175.30 176.34 3n99 s LYS 233 N 2.73 4.22 0.00 5.12 2.47 -1.26 -1.36 119.74 131.66 3n99 s LYS 233 Ca -0.03 2.25 0.00 0.00 -1.56 0.00 0.00 55.97 56.64 3n99 s LYS 233 Cb -0.12 -3.57 0.00 0.00 -1.46 0.00 0.00 37.83 32.68 3n99 s LYS 233 CO -0.16 -0.69 0.00 0.41 0.16 0.00 0.00 175.35 175.07 3n99 n GLY 234 N 3.91 3.28 3.77 5.54 0.00 -1.26 -5.04 105.19 115.39 3n99 n GLY 234 Ca 0.15 0.00 -0.34 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 -2.86 2.60 0.00 4.61 0.00 -0.47 -0.37 121.76 125.27 3n99 s ALA 235 Ca 0.00 0.70 0.00 0.00 0.00 0.00 0.00 51.96 52.66 3n99 s ALA 235 Cb 0.00 -3.34 -0.00 0.00 0.00 0.00 0.00 23.12 19.78 3n99 s ALA 235 CO 0.00 -0.99 -0.01 0.54 0.00 0.00 0.00 175.76 175.30 3n99 s VAL 236 N -2.03 0.07 0.17 0.00 0.11 0.27 -0.51 120.40 118.48 3n99 s VAL 236 Ca 0.70 -0.15 0.09 0.00 -2.93 0.00 0.00 61.98 59.69 3n99 s VAL 236 Cb -0.22 -0.09 -0.04 0.00 -1.53 0.00 0.00 36.38 34.50 3n99 s VAL 236 CO 0.33 -0.05 -0.20 -0.44 -3.33 0.00 0.00 175.10 171.41 3n99 s SER 237 N -0.21 2.85 -0.01 3.54 0.01 -0.74 -1.19 113.70 117.95 3n99 s SER 237 Ca -0.02 -0.85 0.07 0.00 1.31 0.00 0.00 55.95 56.47 3n99 s SER 237 Cb -0.02 -0.18 -0.02 0.00 0.21 0.00 0.00 66.02 66.02 3n99 s SER 237 CO -0.00 0.01 -0.22 -0.63 0.41 0.00 0.00 173.24 172.81 3n99 s ILE 238 N -1.87 1.76 0.34 1.44 -1.09 0.68 -0.41 121.20 122.05 3n99 s ILE 238 Ca 0.16 -1.00 -0.05 0.00 -2.23 0.00 0.00 60.65 57.53 3n99 s ILE 238 Cb -0.07 -1.47 0.01 0.00 -1.58 0.00 0.00 42.46 39.35 3n99 s ILE 238 CO 0.07 0.46 0.50 -0.83 -1.23 0.00 0.00 174.94 173.91 3n99 s GLY 239 N -0.63 1.29 -0.05 6.18 0.00 -0.57 -0.63 107.32 112.90 3n99 s GLY 239 Ca 0.09 -1.38 0.06 0.00 0.00 0.00 0.00 44.72 43.49 3n99 s GLY 239 CO -0.00 -0.90 -0.24 0.14 0.00 0.00 0.00 173.10 172.09 3n99 s VAL 240 N -3.08 2.13 -0.00 1.40 1.01 0.01 -1.48 120.40 120.40 3n99 s VAL 240 Ca 0.28 -1.05 -0.30 0.00 0.00 0.00 0.00 61.98 60.91 3n99 s VAL 240 Cb -0.01 -1.77 -0.03 0.00 0.00 0.00 0.00 36.38 34.57 3n99 s VAL 240 CO 0.18 0.57 1.01 -0.69 0.00 0.00 0.00 175.10 176.17 3n99 s VAL 241 N -0.28 4.78 0.00 2.92 1.01 -0.65 -0.80 120.40 127.37 3n99 s VAL 241 Ca -0.00 2.00 0.00 0.00 0.00 0.00 0.00 61.98 63.97 3n99 s VAL 241 Cb -0.13 -4.28 0.00 0.00 0.00 0.00 0.00 36.38 31.97 3n99 s VAL 241 CO 0.03 0.14 0.00 1.33 0.00 0.00 0.00 175.10 176.60 3n99 n VAL 242 N 3.95 0.00 -4.10 2.92 0.24 0.96 -0.48 118.33 121.83 3n99 n VAL 242 Ca 0.06 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.26 3n99 n VAL 242 Cb 0.50 0.41 -0.08 0.00 -1.47 0.00 0.00 33.84 33.20 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 -1.73 0.77 1.00 6.34 -3.43 -1.25 -4.49 115.29 112.50 3n99 s HIS 243 Ca 0.00 -1.08 -0.13 0.00 -0.80 0.00 0.00 55.06 53.06 3n99 s HIS 243 Cb 0.00 -0.27 0.19 0.00 -1.43 0.00 0.00 32.58 31.07 3n99 s HIS 243 CO 0.00 -0.73 1.10 -1.54 -2.00 0.00 0.00 174.74 171.58 3n99 s SER 244 N -3.07 2.63 1.07 7.38 1.04 -0.15 -3.32 113.70 119.28 3n99 s SER 244 Ca 0.29 1.09 -0.12 0.00 0.48 0.00 0.00 55.95 57.69 3n99 s SER 244 Cb 0.04 -1.72 0.23 0.00 0.10 0.00 0.00 66.02 64.68 3n99 s SER 244 CO 0.07 -3.12 1.07 0.00 0.98 0.00 0.00 173.24 172.25 3n99 s ALA 245 N -3.03 0.26 0.05 5.32 0.00 0.17 -3.89 121.76 120.63 3n99 s ALA 245 Ca 0.65 0.11 0.03 0.00 0.00 0.00 0.00 51.96 52.76 3n99 s ALA 245 Cb -0.17 -3.31 -0.02 0.00 0.00 0.00 0.00 23.12 19.61 3n99 s ALA 245 CO 0.57 -3.42 -0.09 0.00 0.00 0.00 0.00 175.76 172.82 3n99 n VAL 247 N 1.44 0.59 -2.85 0.00 0.24 -1.26 -4.72 118.33 111.77 3n99 n VAL 247 Ca -0.23 -0.57 -0.30 0.00 -2.04 0.00 0.00 64.34 61.20 3n99 n VAL 247 Cb 0.55 -0.32 -0.03 0.00 -1.47 0.00 0.00 33.84 32.56 3n99 n VAL 247 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 3n99 s SER 248 N -5.22 6.51 0.26 -1.34 0.01 -1.23 -1.60 113.70 111.10 3n99 s SER 248 Ca -0.03 1.12 -0.30 0.00 1.31 0.00 0.00 55.95 58.05 3n99 s SER 248 Cb 0.10 -2.32 -0.13 0.00 0.21 0.00 0.00 66.02 63.88 3n99 s SER 248 CO 0.83 -0.41 1.39 0.00 0.41 0.00 0.00 173.24 175.46 3n99 n ALA 249 N -1.33 1.20 -0.51 1.44 0.00 -1.26 -2.54 120.51 117.50 3n99 n ALA 249 Ca 0.02 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.86 3n99 n ALA 249 Cb 0.54 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.71 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 1.88 1.44 3.61 0.00 0.00 -1.26 -4.99 105.19 105.87 3n99 n GLY 250 Ca 0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.87 3n99 n GLY 250 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3n99 s HIS 251 N -3.32 2.52 -1.78 1.61 0.09 -1.05 -0.49 115.29 112.87 3n99 s HIS 251 Ca 0.00 -0.43 0.00 0.00 -0.00 0.00 0.00 55.06 54.63 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 0.51 0.00 0.41 -0.00 0.00 0.00 174.74 175.66 3n99 n GLY 252 N -0.92 -1.36 3.75 -2.22 0.00 -1.24 -4.41 105.19 98.80 3n99 n GLY 252 Ca -0.04 -0.98 -0.41 0.00 0.00 0.00 0.00 46.02 44.58 3n99 n GLY 252 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3n99 s PRO 253 N -0.89 4.11 0.37 1.61 0.02 -1.09 -4.48 135.00 134.66 3n99 s PRO 253 Ca 0.00 2.59 -0.19 0.00 0.02 0.00 0.00 61.00 63.42 3n99 s PRO 253 Cb 0.00 -3.01 -0.10 0.00 0.02 0.00 0.00 34.50 31.41 3n99 s PRO 253 CO 0.00 -0.63 0.86 0.20 -0.33 0.00 0.00 177.00 177.10 3n99 s GLY 254 N 0.41 2.40 -0.09 0.52 0.00 -1.21 -0.75 107.32 108.60 3n99 s GLY 254 Ca 0.62 0.26 0.01 0.00 0.00 0.00 0.00 44.72 45.60 3n99 s GLY 254 CO 0.50 0.52 -0.09 0.14 0.00 0.00 0.00 173.10 174.18 3n99 s VAL 255 N -2.04 1.01 -0.19 1.40 1.01 0.55 -0.03 120.40 122.11 3n99 s VAL 255 Ca 0.57 -0.34 -0.19 0.00 0.00 0.00 0.00 61.98 62.03 3n99 s VAL 255 Cb -0.10 -0.99 -0.03 0.00 0.00 0.00 0.00 36.38 35.25 3n99 s VAL 255 CO 0.16 0.35 0.54 -0.69 0.00 0.00 0.00 175.10 175.45 3n99 s VAL 256 N 1.24 5.10 0.19 2.92 1.01 0.02 -1.46 120.40 129.41 3n99 s VAL 256 Ca -0.04 0.99 -0.30 0.00 0.00 0.00 0.00 61.98 62.64 3n99 s VAL 256 Cb -0.14 -3.86 -0.08 0.00 0.00 0.00 0.00 36.38 32.30 3n99 s VAL 256 CO -0.03 0.18 1.13 -0.69 0.00 0.00 0.00 175.10 175.68 3n99 s VAL 257 N 1.61 3.76 -0.06 2.92 1.01 -1.26 -0.81 120.40 127.58 3n99 s VAL 257 Ca 0.25 1.53 0.04 0.00 0.00 0.00 0.00 61.98 63.80 3n99 s VAL 257 Cb -0.15 -3.97 -0.06 0.00 0.00 0.00 0.00 36.38 32.20 3n99 s VAL 257 CO 0.10 0.26 0.11 2.30 0.00 0.00 0.00 175.10 177.87 3n99 n ILE 258 N 2.33 0.00 -3.66 2.22 -5.35 0.20 -4.46 119.36 110.64 3n99 n ILE 258 Ca 0.03 -0.19 -0.14 0.00 -0.27 0.00 0.00 62.75 62.18 3n99 n ILE 258 Cb 0.46 0.58 -0.08 0.00 -1.74 0.00 0.00 39.64 38.86 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 -2.01 0.72 -0.08 6.28 0.00 -1.04 -1.59 119.30 121.58 3n99 s MET 259 Ca -0.01 0.69 -0.17 0.00 0.00 0.00 0.00 55.69 56.21 3n99 s MET 259 Cb 0.03 0.35 0.04 0.00 0.00 0.00 0.00 34.83 35.24 3n99 s MET 259 CO 0.16 -0.11 0.40 -0.08 0.00 0.00 0.00 175.02 175.39 3n99 s THR 260 N 0.05 0.02 -1.93 10.11 -1.32 -0.27 -0.23 115.64 122.07 3n99 s THR 260 Ca -0.02 -0.20 0.00 0.00 -1.21 0.00 0.00 61.69 60.26 3n99 s THR 260 Cb -0.04 -0.65 0.00 0.00 -1.51 0.00 0.00 72.50 70.31 3n99 s THR 260 CO 0.02 -0.11 0.00 0.61 -2.21 0.00 0.00 174.62 172.93 3n99 n GLY 261 N 1.97 -0.62 3.91 6.08 0.00 -0.34 -0.97 105.19 115.22 3n99 n GLY 261 Ca -0.17 -0.60 -0.29 0.00 0.00 0.00 0.00 46.02 44.96 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 6.43 0.52 1.61 2.15 -1.26 -0.56 116.67 121.56 3n99 s ASP 262 Ca 0.00 0.56 0.26 0.00 0.43 0.00 0.00 52.55 53.80 3n99 s ASP 262 Cb 0.00 -2.08 1.43 0.00 -0.30 0.00 0.00 42.92 41.98 3n99 s ASP 262 CO 0.00 -0.07 2.08 1.05 -0.17 0.00 0.00 175.17 178.05 3n99 h GLU 263 N 2.08 0.00 0.00 4.34 4.11 -0.96 -1.27 114.58 122.88 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 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 3n99 h GLU 263 CO 0.68 0.12 0.00 0.66 0.07 0.00 0.00 179.01 180.54 3n99 h SER 264 N 0.00 0.00 0.00 3.06 4.64 -1.94 -3.33 113.55 115.98 3n99 h SER 264 Ca -0.00 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.10 3n99 h SER 264 Cb 0.31 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.36 3n99 h SER 264 CO 0.02 0.00 -1.82 0.29 -0.87 0.00 0.00 176.83 174.44 3n99 n LYS 265 N -2.49 1.35 -3.68 4.77 4.76 -0.61 -4.93 118.16 117.33 3n99 n LYS 265 Ca 0.02 0.03 -0.38 0.00 -2.87 0.00 0.00 58.31 55.12 3n99 n LYS 265 Cb 0.30 -1.30 -0.12 0.00 -1.84 0.00 0.00 35.03 32.07 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 -2.29 4.55 -0.43 -0.18 1.01 -0.58 -0.36 121.20 122.92 3n99 s ILE 266 Ca -0.12 -0.36 -0.02 0.00 0.00 0.00 0.00 60.65 60.14 3n99 s ILE 266 Cb 0.04 -3.28 0.12 0.00 0.01 0.00 0.00 42.46 39.35 3n99 s ILE 266 CO 0.42 0.12 0.23 -0.76 0.00 0.00 0.00 174.94 174.95 3n99 s LEU 267 N 1.61 5.22 0.16 2.97 1.43 0.12 -4.59 118.68 125.60 3n99 s LEU 267 Ca 0.05 -2.15 -0.30 0.00 -1.03 0.00 0.00 54.13 50.70 3n99 s LEU 267 Cb -0.17 -1.82 -0.07 0.00 0.03 0.00 0.00 46.19 44.16 3n99 s LEU 267 CO 0.06 -0.51 1.14 -2.84 0.23 0.00 0.00 176.35 174.43 3n99 s PRO 268 N 0.96 4.54 -0.26 1.29 0.02 -1.26 -1.01 135.00 139.28 3n99 s PRO 268 Ca 0.10 1.77 -0.01 0.00 0.02 0.00 0.00 61.00 62.87 3n99 s PRO 268 Cb -0.22 -3.28 0.03 0.00 0.02 0.00 0.00 34.50 31.05 3n99 s PRO 268 CO -0.04 -0.02 -0.05 -1.21 -0.33 0.00 0.00 177.00 175.34 3n99 s GLU 269 N -0.10 2.71 -0.19 5.54 0.41 0.41 -4.88 118.70 122.60 3n99 s GLU 269 Ca 0.52 -1.06 -0.29 0.00 -0.41 0.00 0.00 54.97 53.72 3n99 s GLU 269 Cb -0.30 -3.03 -0.01 0.00 -1.78 0.00 0.00 34.13 29.01 3n99 s GLU 269 CO 0.35 -0.46 1.20 -2.00 -0.49 0.00 0.00 175.26 173.86 3n99 s GLU 270 N 1.30 4.23 0.43 1.61 2.12 -1.26 -1.48 118.70 125.65 3n99 s GLU 270 Ca -0.02 1.57 0.03 0.00 0.36 0.00 0.00 54.97 56.92 3n99 s GLU 270 Cb -0.17 -3.73 -0.03 0.00 0.26 0.00 0.00 34.13 30.45 3n99 s GLU 270 CO -0.04 -0.70 0.07 0.14 -0.54 0.00 0.00 175.26 174.19 3n99 s VAL 271 N 3.44 0.99 0.12 3.70 -7.23 0.02 -4.93 120.40 116.51 3n99 s VAL 271 Ca 0.52 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 58.59 3n99 s VAL 271 Cb -0.20 -2.40 -0.16 0.00 0.56 0.00 0.00 36.38 34.18 3n99 s VAL 271 CO 0.12 0.00 1.31 1.05 -0.31 0.00 0.00 175.10 177.28 3n99 h GLU 272 N 1.68 0.66 -3.48 4.82 9.09 -1.94 -3.41 114.58 122.00 3n99 h GLU 272 Ca -0.40 -0.59 -0.27 0.00 0.05 0.00 0.00 59.36 58.16 3n99 h GLU 272 Cb 1.28 0.14 -0.32 0.00 -1.65 0.00 0.00 28.75 28.19 3n99 h GLU 272 CO 0.67 1.20 -0.69 0.50 0.05 0.00 0.00 179.01 180.73 3n99 s ARG 273 N -3.59 0.01 -0.40 1.06 3.52 -1.26 -4.99 118.95 113.30 3n99 s ARG 273 Ca -0.09 0.20 0.08 0.00 -0.13 0.00 0.00 55.73 55.80 3n99 s ARG 273 Cb 0.09 -0.18 0.18 0.00 -1.56 0.00 0.00 34.95 33.48 3n99 s ARG 273 CO 0.89 -0.14 0.63 0.00 -0.81 0.00 0.00 175.30 175.87 3n99 s ALA 274 N 0.90 -2.37 -0.03 6.12 0.00 -1.26 -4.97 121.76 120.15 3n99 s ALA 274 Ca -0.07 0.29 -0.00 0.00 0.00 0.00 0.00 51.96 52.18 3n99 s ALA 274 Cb -0.10 -2.72 0.03 0.00 0.00 0.00 0.00 23.12 20.33 3n99 s ALA 274 CO -0.03 -2.18 0.05 1.21 0.00 0.00 0.00 175.76 174.80 3n99 s ASN 275 N 1.94 0.05 0.55 0.00 3.84 -1.26 -1.04 114.94 119.01 3n99 s ASN 275 Ca 0.15 0.07 0.36 0.00 0.21 0.00 0.00 52.86 53.65 3n99 s ASN 275 Cb -0.05 -0.04 1.66 0.00 -0.55 0.00 0.00 41.25 42.28 3n99 s ASN 275 CO -0.09 -0.13 2.07 0.16 -2.79 0.00 0.00 177.10 176.32 3n99 h ILE 276 N 6.27 0.00 0.00 -5.21 3.07 -1.29 -2.21 117.51 118.14 3n99 h ILE 276 Ca -0.46 -0.29 -0.00 0.00 1.55 0.00 0.00 64.86 65.65 3n99 h ILE 276 Cb 1.12 1.24 -0.00 0.00 -0.27 0.00 0.00 36.82 38.91 3n99 h ILE 276 CO 0.47 0.00 -0.02 0.77 -1.05 0.00 0.00 178.15 178.32 3n99 h SER 277 N 0.00 0.00 0.66 2.16 4.64 -1.90 -1.51 113.55 117.60 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 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3n99 h SER 277 CO 0.00 0.02 0.00 0.44 -0.87 0.00 0.00 176.83 176.42 3n99 h ASP 278 N 0.00 0.00 -0.08 4.97 3.32 -1.80 -3.11 116.42 119.71 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 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 3n99 h ASP 278 CO 0.00 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.30 3n99 n TYR 279 N -2.55 0.19 0.42 4.55 4.01 -0.57 -5.16 117.16 118.04 3n99 n TYR 279 Ca 0.01 -0.71 0.05 0.00 -0.16 0.00 0.00 57.90 57.09 3n99 n TYR 279 Cb 0.21 -0.11 0.04 0.00 -0.31 0.00 0.00 39.34 39.17 3n99 n TYR 279 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68