#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n99 s MET 1 N 0.00 2.98 -0.11 -0.41 1.00 -1.26 -5.04 119.30 116.45 3n99 s MET 1 Ca 0.00 -0.56 -0.30 0.00 0.00 0.00 0.00 55.69 54.83 3n99 s MET 1 Cb 0.00 -2.80 -0.02 0.00 0.00 0.00 0.00 34.83 32.01 3n99 s MET 1 CO 0.00 0.62 1.18 1.03 0.00 0.00 0.00 175.02 177.84 3n99 s ARG 2 N -1.93 4.31 0.20 2.03 0.52 -1.26 -4.97 118.95 117.85 3n99 s ARG 2 Ca 0.25 1.60 0.04 0.00 -0.52 0.00 0.00 55.73 57.10 3n99 s ARG 2 Cb -0.12 -3.63 -0.05 0.00 0.52 0.00 0.00 34.95 31.67 3n99 s ARG 2 CO 0.16 -0.53 -0.05 0.95 0.02 0.00 0.00 175.30 175.85 3n99 s THR 3 N 2.68 1.17 -0.25 0.02 -4.23 -1.26 0.85 115.64 114.61 3n99 s THR 3 Ca 0.53 -2.06 0.02 0.00 -1.18 0.00 0.00 61.69 59.00 3n99 s THR 3 Cb -0.22 -2.15 0.35 0.00 1.34 0.00 0.00 72.50 71.82 3n99 s THR 3 CO 0.17 -0.50 1.55 -0.46 -0.54 0.00 0.00 174.62 174.84 3n99 n ASN 4 N -0.34 3.71 0.11 3.99 6.94 -1.12 -4.69 115.26 123.86 3n99 n ASN 4 Ca -0.07 -2.89 0.11 0.00 -0.02 0.00 0.00 54.58 51.70 3n99 n ASN 4 Cb 0.62 -0.72 0.60 0.00 -2.36 0.00 0.00 39.78 37.92 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 0.63 0.14 0.00 -3.83 2.10 -1.95 -0.21 116.57 113.46 3n99 h LYS 5 Ca 0.34 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.98 3n99 h LYS 5 Cb 1.90 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 33.20 3n99 h LYS 5 CO 0.62 0.10 0.00 -0.44 -2.00 0.00 0.00 179.45 177.73 3n99 h ASP 6 N 0.15 0.00 0.20 7.07 3.32 -2.02 -2.04 116.42 123.09 3n99 h ASP 6 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 3n99 h ASP 6 Cb 0.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.86 3n99 h ASP 6 CO -0.02 0.00 -0.16 0.54 -1.72 0.00 0.00 179.24 177.88 3n99 n ARG 7 N -2.71 1.00 -2.68 3.56 1.74 -0.09 -4.95 116.66 112.54 3n99 n ARG 7 Ca 0.02 -0.54 -0.34 0.00 -0.77 0.00 0.00 57.85 56.23 3n99 n ARG 7 Cb 0.32 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.22 3n99 n ARG 7 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3n99 s LEU 8 N -2.37 3.89 -0.17 0.55 1.43 -0.77 -5.03 118.68 116.22 3n99 s LEU 8 Ca 0.29 1.81 -0.10 0.00 -1.03 0.00 0.00 54.13 55.11 3n99 s LEU 8 Cb 0.20 -4.55 -0.05 0.00 0.03 0.00 0.00 46.19 41.82 3n99 s LEU 8 CO 0.46 -0.57 0.16 -0.69 0.23 0.00 0.00 176.35 175.94 3n99 s VAL 9 N -2.07 5.42 -0.16 -1.59 1.01 -1.26 -5.07 120.40 116.67 3n99 s VAL 9 Ca 0.65 0.25 -0.03 0.00 0.00 0.00 0.00 61.98 62.85 3n99 s VAL 9 Cb -0.13 -3.47 -0.02 0.00 0.00 0.00 0.00 36.38 32.76 3n99 s VAL 9 CO 0.17 0.49 -0.07 -0.60 0.00 0.00 0.00 175.10 175.09 3n99 s ARG 10 N -0.06 3.54 -0.05 2.72 3.52 -1.26 -4.65 118.95 122.72 3n99 s ARG 10 Ca 0.11 -0.58 -0.07 0.00 -0.13 0.00 0.00 55.73 55.06 3n99 s ARG 10 Cb -0.12 -2.85 0.01 0.00 -1.56 0.00 0.00 34.95 30.44 3n99 s ARG 10 CO 0.01 0.17 0.18 -1.50 -0.81 0.00 0.00 175.30 173.34 3n99 s ILE 11 N 0.52 0.03 -0.19 4.11 2.07 -0.69 -4.97 121.20 122.08 3n99 s ILE 11 Ca -0.05 -0.23 -0.29 0.00 -1.41 0.00 0.00 60.65 58.67 3n99 s ILE 11 Cb -0.15 -0.33 -0.03 0.00 0.13 0.00 0.00 42.46 42.08 3n99 s ILE 11 CO 0.03 -0.13 1.66 -0.94 -1.91 0.00 0.00 174.94 173.66 3n99 s SER 12 N -0.41 6.37 -0.25 4.50 1.04 -1.26 -0.91 113.70 122.78 3n99 s SER 12 Ca -0.05 1.76 -0.03 0.00 0.48 0.00 0.00 55.95 58.10 3n99 s SER 12 Cb -0.03 -2.53 0.01 0.00 0.10 0.00 0.00 66.02 63.57 3n99 s SER 12 CO 0.01 -1.24 -0.03 -0.69 0.98 0.00 0.00 173.24 172.27 3n99 s VAL 13 N 5.17 3.22 0.20 5.02 1.01 -0.32 -4.96 120.40 129.75 3n99 s VAL 13 Ca 0.74 -0.80 0.05 0.00 0.00 0.00 0.00 61.98 61.96 3n99 s VAL 13 Cb -0.27 -2.59 -0.03 0.00 0.00 0.00 0.00 36.38 33.49 3n99 s VAL 13 CO 0.30 0.25 0.26 0.68 0.00 0.00 0.00 175.10 176.58 3n99 s VAL 14 N 1.40 4.93 0.00 2.92 -7.23 -1.26 -0.33 120.40 120.83 3n99 s VAL 14 Ca 0.02 -1.02 0.00 0.00 -1.81 0.00 0.00 61.98 59.17 3n99 s VAL 14 Cb -0.16 -3.61 0.00 0.00 0.56 0.00 0.00 36.38 33.17 3n99 s VAL 14 CO -0.03 -0.23 0.00 0.61 -0.31 0.00 0.00 175.10 175.14 3n99 n GLY 15 N -0.91 1.94 3.09 2.32 0.00 0.04 -4.65 105.19 107.02 3n99 n GLY 15 Ca -0.08 -0.89 -0.09 0.00 0.00 0.00 0.00 46.02 44.96 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 -1.03 0.56 0.17 1.61 -1.05 0.22 -0.34 118.70 118.83 3n99 s GLU 16 Ca 0.00 -0.81 -0.31 0.00 -0.15 0.00 0.00 54.97 53.70 3n99 s GLU 16 Cb 0.00 0.21 -0.10 0.00 -0.44 0.00 0.00 34.13 33.81 3n99 s GLU 16 CO 0.00 -0.13 1.54 0.42 0.95 0.00 0.00 175.26 178.04 3n99 s ILE 17 N -2.67 2.70 0.18 1.83 1.01 -0.62 -0.84 121.20 122.78 3n99 s ILE 17 Ca -0.04 0.51 -0.15 0.00 0.00 0.00 0.00 60.65 60.97 3n99 s ILE 17 Cb -0.01 -3.33 -0.07 0.00 0.01 0.00 0.00 42.46 39.06 3n99 s ILE 17 CO -0.05 0.04 0.59 0.00 0.00 0.00 0.00 174.94 175.52 3n99 s ALA 18 N 1.04 3.53 0.78 9.38 0.00 0.52 -1.13 121.76 135.88 3n99 s ALA 18 Ca 0.68 -0.09 -0.11 0.00 0.00 0.00 0.00 51.96 52.45 3n99 s ALA 18 Cb -0.43 -2.58 0.07 0.00 0.00 0.00 0.00 23.12 20.18 3n99 s ALA 18 CO 0.32 0.43 1.11 -1.25 0.00 0.00 0.00 175.76 176.37 3n99 s PRO 19 N -2.12 2.07 0.28 0.00 0.04 -1.26 -1.26 135.00 132.75 3n99 s PRO 19 Ca 0.41 1.31 -0.30 0.00 0.04 0.00 0.00 61.00 62.46 3n99 s PRO 19 Cb -0.15 -1.87 -0.13 0.00 0.04 0.00 0.00 34.50 32.40 3n99 s PRO 19 CO 0.20 -1.81 1.42 0.00 0.04 0.00 0.00 177.00 176.85 3n99 n ALA 20 N -3.48 1.50 -2.54 8.56 0.00 -1.26 -2.69 120.51 120.59 3n99 n ALA 20 Ca 0.10 0.39 -0.25 0.00 0.00 0.00 0.00 53.44 53.68 3n99 n ALA 20 Cb 0.52 -2.31 -0.15 0.00 0.00 0.00 0.00 19.45 17.51 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 -0.88 1.50 -0.19 0.00 1.02 -0.44 -4.89 119.74 115.86 3n99 s LYS 21 Ca 0.63 -0.64 -0.08 0.00 0.02 0.00 0.00 55.97 55.90 3n99 s LYS 21 Cb -0.59 -1.43 0.07 0.00 -0.52 0.00 0.00 37.83 35.37 3n99 s LYS 21 CO 0.53 0.37 0.42 -1.64 -0.92 0.00 0.00 175.35 174.11 3n99 s MET 22 N -0.36 0.36 0.07 1.68 -1.94 -1.26 -3.82 119.30 114.03 3n99 s MET 22 Ca 0.05 0.92 0.25 0.00 -1.71 0.00 0.00 55.69 55.20 3n99 s MET 22 Cb -0.08 0.15 0.44 0.00 2.01 0.00 0.00 34.83 37.35 3n99 s MET 22 CO -0.00 -0.20 1.38 0.54 -0.01 0.00 0.00 175.02 176.72 3n99 n ARG 23 N 4.81 0.17 -3.68 2.03 1.74 -1.26 -4.86 116.66 115.61 3n99 n ARG 23 Ca -0.16 0.05 -0.15 0.00 -0.77 0.00 0.00 57.85 56.82 3n99 n ARG 23 Cb 0.52 -1.61 -0.08 0.00 -1.02 0.00 0.00 32.46 30.28 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 -3.73 -0.33 0.49 0.55 0.15 -1.26 -5.03 113.70 104.54 3n99 s SER 24 Ca 0.08 0.27 0.14 0.00 0.70 0.00 0.00 55.95 57.14 3n99 s SER 24 Cb 0.15 0.38 1.18 0.00 -1.71 0.00 0.00 66.02 66.02 3n99 s SER 24 CO 0.71 -0.51 2.12 1.55 1.20 0.00 0.00 173.24 178.30 3n99 h PRO 25 N 3.56 0.14 -5.99 5.44 0.13 -1.96 -3.43 132.00 129.88 3n99 h PRO 25 Ca -0.29 -0.01 -0.61 0.00 -0.87 0.00 0.00 66.00 64.22 3n99 h PRO 25 Cb 1.17 -0.03 -0.05 0.00 0.13 0.00 0.00 31.00 32.22 3n99 h PRO 25 CO 0.40 0.09 -0.29 0.71 -0.23 0.00 0.00 178.00 178.68 3n99 s TYR 26 N -5.17 3.63 -0.11 1.56 2.02 -1.26 -4.19 117.35 113.82 3n99 s TYR 26 Ca -0.06 0.78 -0.02 0.00 -0.37 0.00 0.00 57.07 57.40 3n99 s TYR 26 Cb 0.17 -2.14 -0.03 0.00 -0.40 0.00 0.00 41.96 39.56 3n99 s TYR 26 CO 0.69 0.60 -0.03 -1.12 -1.57 0.00 0.00 175.55 174.12 3n99 s SER 27 N -1.46 4.91 -0.18 2.29 0.01 -0.12 -4.94 113.70 114.21 3n99 s SER 27 Ca 0.27 -0.01 -0.16 0.00 1.31 0.00 0.00 55.95 57.36 3n99 s SER 27 Cb -0.14 -1.51 -0.04 0.00 0.21 0.00 0.00 66.02 64.53 3n99 s SER 27 CO 0.15 0.29 0.39 -0.69 0.41 0.00 0.00 173.24 173.79 3n99 s VAL 28 N -0.36 5.22 0.72 3.43 1.01 -1.26 -1.39 120.40 127.77 3n99 s VAL 28 Ca 0.06 0.71 -0.07 0.00 0.00 0.00 0.00 61.98 62.68 3n99 s VAL 28 Cb -0.12 -3.72 0.07 0.00 0.00 0.00 0.00 36.38 32.61 3n99 s VAL 28 CO 0.02 0.29 1.03 0.42 0.00 0.00 0.00 175.10 176.86 3n99 s THR 29 N 1.07 2.25 -0.13 3.92 -4.23 0.51 -3.66 115.64 115.37 3n99 s THR 29 Ca 0.19 -0.28 0.30 0.00 -1.18 0.00 0.00 61.69 60.72 3n99 s THR 29 Cb -0.14 -2.97 0.34 0.00 1.34 0.00 0.00 72.50 71.07 3n99 s THR 29 CO 0.07 0.00 1.88 0.71 -0.54 0.00 0.00 174.62 176.74 3n99 h THR 30 N -0.65 0.00 -0.01 3.99 1.35 -1.72 -1.75 112.91 114.12 3n99 h THR 30 Ca -0.44 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 64.98 3n99 h THR 30 Cb 1.31 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 69.08 3n99 h THR 30 CO 0.57 0.00 -0.01 -0.62 -0.25 0.00 0.00 175.52 175.21 3n99 n GLU 31 N -2.79 1.25 -1.50 4.72 4.71 -1.26 -4.91 120.64 120.85 3n99 n GLU 31 Ca 0.01 -0.43 -0.04 0.00 -0.01 0.00 0.00 57.16 56.69 3n99 n GLU 31 Cb 0.29 -1.49 -0.01 0.00 -1.01 0.00 0.00 31.44 29.22 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 1.10 0.48 3.88 0.62 0.00 -0.66 -5.05 105.19 105.57 3n99 n GLY 32 Ca 0.21 -0.84 -0.21 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.16 3.92 -0.02 2.61 -4.23 -1.26 -4.89 115.64 109.61 3n99 s THR 33 Ca 0.00 -1.29 0.02 0.00 -1.18 0.00 0.00 61.69 59.25 3n99 s THR 33 Cb 0.00 -3.31 -0.03 0.00 1.34 0.00 0.00 72.50 70.50 3n99 s THR 33 CO 0.00 -0.22 -0.07 0.68 -0.54 0.00 0.00 174.62 174.48 3n99 s VAL 34 N -2.23 3.67 0.07 2.29 -7.23 -1.26 -0.36 120.40 115.34 3n99 s VAL 34 Ca 0.40 -0.69 0.05 0.00 -1.81 0.00 0.00 61.98 59.93 3n99 s VAL 34 Cb -0.07 -2.57 -0.03 0.00 0.56 0.00 0.00 36.38 34.28 3n99 s VAL 34 CO 0.27 0.45 -0.14 -0.13 -0.31 0.00 0.00 175.10 175.25 3n99 s ARG 35 N -1.24 0.82 -0.46 4.82 0.52 -0.48 -4.95 118.95 117.98 3n99 s ARG 35 Ca 0.16 -0.92 -0.11 0.00 -0.52 0.00 0.00 55.73 54.33 3n99 s ARG 35 Cb -0.11 -0.82 0.09 0.00 0.52 0.00 0.00 34.95 34.63 3n99 s ARG 35 CO 0.06 0.18 0.34 0.08 0.02 0.00 0.00 175.30 175.98 3n99 s VAL 36 N -1.22 4.58 0.03 3.52 1.01 -1.26 -0.94 120.40 126.12 3n99 s VAL 36 Ca -0.02 -1.43 -0.03 0.00 0.00 0.00 0.00 61.98 60.50 3n99 s VAL 36 Cb -0.10 -3.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.41 3n99 s VAL 36 CO 0.02 -0.63 0.04 0.27 0.00 0.00 0.00 175.10 174.79 3n99 s ILE 37 N 1.48 0.14 0.67 2.22 -4.36 -1.26 -5.05 121.20 115.04 3n99 s ILE 37 Ca 0.04 -1.18 -0.16 0.00 -0.26 0.00 0.00 60.65 59.09 3n99 s ILE 37 Cb -0.25 -0.83 0.01 0.00 1.25 0.00 0.00 42.46 42.64 3n99 s ILE 37 CO 0.03 -0.65 1.18 -2.84 0.24 0.00 0.00 174.94 172.89 3n99 s PRO 38 N -2.52 2.55 0.00 0.37 0.02 -1.26 -4.79 135.00 129.37 3n99 s PRO 38 Ca -0.06 1.67 0.00 0.00 0.02 0.00 0.00 61.00 62.63 3n99 s PRO 38 Cb -0.02 -1.89 0.00 0.00 0.02 0.00 0.00 34.50 32.61 3n99 s PRO 38 CO -0.04 -1.50 0.00 0.28 -0.33 0.00 0.00 177.00 175.40 3n99 n VAL 39 N -2.33 0.00 -3.35 3.83 0.31 -1.26 -1.51 118.33 114.02 3n99 n VAL 39 Ca 0.13 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.24 3n99 n VAL 39 Cb 0.51 0.00 0.02 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 3.11 0.00 7.52 0.05 -1.25 -4.34 118.68 123.77 3n99 s LEU 40 Ca 0.00 -0.89 0.00 0.00 0.05 0.00 0.00 54.13 53.29 3n99 s LEU 40 Cb 0.00 -1.71 0.00 0.00 -2.05 0.00 0.00 46.19 42.43 3n99 s LEU 40 CO 0.00 -1.09 0.00 0.61 -0.55 0.00 0.00 176.35 175.32 3n99 n GLY 41 N -1.95 -2.35 0.03 -3.48 0.00 -1.26 -1.33 105.19 94.85 3n99 n GLY 41 Ca 0.08 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.40 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 -0.22 -1.50 3.55 -0.02 0.00 -0.39 -4.56 105.19 102.05 3n99 n GLY 42 Ca 0.00 -1.52 -0.43 0.00 0.00 0.00 0.00 46.02 44.07 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 -1.34 4.55 -0.41 -0.61 1.01 -1.26 -1.06 121.20 122.07 3n99 s ILE 43 Ca 0.00 0.57 -0.18 0.00 0.00 0.00 0.00 60.65 61.05 3n99 s ILE 43 Cb 0.00 -4.39 0.02 0.00 0.01 0.00 0.00 42.46 38.10 3n99 s ILE 43 CO 0.00 -0.79 0.48 -0.89 0.00 0.00 0.00 174.94 173.74 3n99 s THR 44 N 3.54 5.04 0.13 2.92 2.01 -0.51 -4.97 115.64 123.80 3n99 s THR 44 Ca 0.33 -0.15 0.12 0.00 0.31 0.00 0.00 61.69 62.31 3n99 s THR 44 Cb -0.11 -4.04 -0.02 0.00 0.01 0.00 0.00 72.50 68.34 3n99 s THR 44 CO 0.24 -0.40 1.53 1.88 -0.69 0.00 0.00 174.62 177.18 3n99 h TYR 45 N 8.70 0.00 0.00 4.92 0.05 -1.95 -3.32 116.97 125.37 3n99 h TYR 45 Ca -0.27 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.51 3n99 h TYR 45 Cb 1.11 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.85 3n99 h TYR 45 CO 0.66 0.64 -0.12 0.27 -1.05 0.00 0.00 178.16 178.56 3n99 n ASN 46 N -3.51 1.94 -3.88 3.88 6.94 -1.26 -4.94 115.26 114.43 3n99 n ASN 46 Ca -0.00 -2.97 -0.22 0.00 -0.02 0.00 0.00 54.58 51.37 3n99 n ASN 46 Cb 0.69 -0.40 -0.17 0.00 -2.36 0.00 0.00 39.78 37.55 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 -2.44 0.64 0.14 3.53 1.01 -1.26 -5.12 120.40 116.91 3n99 s VAL 47 Ca 0.28 -0.12 -0.06 0.00 0.00 0.00 0.00 61.98 62.08 3n99 s VAL 47 Cb 0.25 -0.68 -0.02 0.00 0.00 0.00 0.00 36.38 35.92 3n99 s VAL 47 CO 0.02 0.27 0.18 -1.59 0.00 0.00 0.00 175.10 173.98 3n99 s LYS 48 N 1.29 1.04 0.33 2.72 -2.85 -1.26 -1.90 119.74 119.12 3n99 s LYS 48 Ca -0.05 -1.26 -0.29 0.00 -1.00 0.00 0.00 55.97 53.37 3n99 s LYS 48 Cb -0.14 0.32 -0.12 0.00 -2.06 0.00 0.00 37.83 35.84 3n99 s LYS 48 CO -0.02 -0.34 1.46 1.55 0.10 0.00 0.00 175.35 178.10 3n99 n VAL 49 N -0.15 1.65 0.00 1.79 3.14 -1.26 -1.48 118.33 122.02 3n99 n VAL 49 Ca -0.07 -0.41 0.00 0.00 -2.96 0.00 0.00 64.34 60.90 3n99 n VAL 49 Cb 0.63 -1.83 0.00 0.00 -1.06 0.00 0.00 33.84 31.58 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 1.13 2.86 3.69 7.55 0.00 0.17 -4.91 105.19 115.68 3n99 n GLY 50 Ca 0.05 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 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 0.69 3.18 0.45 1.61 1.01 -0.55 -4.68 116.67 118.38 3n99 s ASP 51 Ca 0.00 1.66 -0.24 0.00 0.71 0.00 0.00 52.55 54.68 3n99 s ASP 51 Cb 0.00 -2.30 -0.07 0.00 1.01 0.00 0.00 42.92 41.55 3n99 s ASP 51 CO 0.00 -2.85 1.26 -0.55 0.21 0.00 0.00 175.17 173.24 3n99 s SER 52 N -3.17 6.06 0.26 0.27 0.15 -1.26 -0.65 113.70 115.37 3n99 s SER 52 Ca 0.64 2.54 0.26 0.00 0.70 0.00 0.00 55.95 60.09 3n99 s SER 52 Cb -0.20 -2.62 0.78 0.00 -1.71 0.00 0.00 66.02 62.27 3n99 s SER 52 CO 0.58 -1.01 1.75 0.00 1.20 0.00 0.00 173.24 175.76 3n99 h ALA 53 N 2.21 1.00 -2.00 5.45 0.00 -0.99 -3.41 119.26 121.52 3n99 h ALA 53 Ca -0.50 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 53.88 3n99 h ALA 53 Cb 1.26 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.98 3n99 h ALA 53 CO 0.61 0.00 -0.54 0.71 0.00 0.00 0.00 179.25 180.03 3n99 s TYR 54 N -3.16 2.83 0.00 0.00 1.51 -1.26 -0.65 117.35 116.62 3n99 s TYR 54 Ca 0.09 -0.28 0.00 0.00 -1.01 0.00 0.00 57.07 55.87 3n99 s TYR 54 Cb 0.11 -1.54 0.00 0.00 -0.11 0.00 0.00 41.96 40.42 3n99 s TYR 54 CO 0.58 0.40 0.00 0.41 -1.11 0.00 0.00 175.55 175.83 3n99 n GLY 55 N -1.15 0.78 3.85 0.71 0.00 -1.26 -5.02 105.19 103.10 3n99 n GLY 55 Ca -0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 3n99 n GLY 55 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3n99 s TRP 56 N -2.92 3.61 -1.33 1.61 0.52 -1.26 -4.98 118.94 114.18 3n99 s TRP 56 Ca 0.00 0.94 -0.14 0.00 0.02 0.00 0.00 56.10 56.92 3n99 s TRP 56 Cb 0.00 -2.27 0.10 0.00 -1.15 0.00 0.00 33.47 30.14 3n99 s TRP 56 CO 0.00 0.49 1.87 0.00 0.02 0.00 0.00 176.95 179.33 3n99 n ALA 57 N 0.93 4.60 -3.83 0.98 0.00 -1.26 -4.82 120.51 117.12 3n99 n ALA 57 Ca -0.07 -4.02 -0.02 0.00 0.00 0.00 0.00 53.44 49.33 3n99 n ALA 57 Cb 0.52 -3.37 0.01 0.00 0.00 0.00 0.00 19.45 16.61 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 3.01 -0.06 -0.04 0.00 0.00 -1.26 -4.22 107.32 104.76 3n99 s GLY 58 Ca 0.47 -0.07 0.01 0.00 0.00 0.00 0.00 44.72 45.13 3n99 s GLY 58 CO -0.00 1.81 -0.04 -0.35 0.00 0.00 0.00 173.10 174.52 3n99 s ASP 59 N -3.27 0.82 -1.54 1.64 2.15 -0.57 -4.75 116.67 111.15 3n99 s ASP 59 Ca 0.19 -0.11 -0.14 0.00 0.43 0.00 0.00 52.55 52.92 3n99 s ASP 59 Cb -0.01 -0.40 0.10 0.00 -0.30 0.00 0.00 42.92 42.31 3n99 s ASP 59 CO 0.03 -0.05 0.90 1.41 -0.17 0.00 0.00 175.17 177.28 3n99 n HIS 60 N 4.00 -2.16 -2.28 -5.34 8.25 -1.09 -4.05 115.22 112.54 3n99 n HIS 60 Ca -0.25 0.83 -0.41 0.00 -0.26 0.00 0.00 57.72 57.63 3n99 n HIS 60 Cb 0.51 -3.72 -0.03 0.00 1.12 0.00 0.00 29.99 27.87 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 -3.25 3.19 -0.27 1.59 1.01 -1.26 -4.09 120.40 117.31 3n99 s VAL 61 Ca 0.65 1.11 -0.07 0.00 0.00 0.00 0.00 61.98 63.66 3n99 s VAL 61 Cb -0.33 -3.70 -0.02 0.00 0.00 0.00 0.00 36.38 32.33 3n99 s VAL 61 CO 0.80 0.23 0.08 -1.61 0.00 0.00 0.00 175.10 174.60 3n99 s GLU 62 N -1.04 3.46 0.56 2.72 2.02 -1.26 -1.08 118.70 124.08 3n99 s GLU 62 Ca 0.50 -0.61 -0.20 0.00 0.02 0.00 0.00 54.97 54.68 3n99 s GLU 62 Cb -0.36 -3.36 -0.05 0.00 0.10 0.00 0.00 34.13 30.47 3n99 s GLU 62 CO 0.43 -0.28 1.22 -1.25 0.02 0.00 0.00 175.26 175.40 3n99 s PRO 63 N 1.58 3.16 6.49 0.39 0.04 -1.26 -4.58 135.00 140.81 3n99 s PRO 63 Ca 0.05 1.88 0.00 0.00 0.04 0.00 0.00 61.00 62.98 3n99 s PRO 63 Cb -0.16 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.30 3n99 s PRO 63 CO 0.03 -1.07 0.00 0.41 0.04 0.00 0.00 177.00 176.41 3n99 n GLY 64 N 0.53 2.78 3.54 0.56 0.00 -0.80 -4.54 105.19 107.26 3n99 n GLY 64 Ca 0.12 -0.35 -0.37 0.00 0.00 0.00 0.00 46.02 45.42 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 4.77 -0.13 1.61 1.01 -0.39 -1.42 120.40 125.85 3n99 s VAL 65 Ca 0.00 -0.02 -0.20 0.00 0.00 0.00 0.00 61.98 61.76 3n99 s VAL 65 Cb 0.00 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 33.11 3n99 s VAL 65 CO 0.00 0.33 0.57 -0.44 0.00 0.00 0.00 175.10 175.56 3n99 s SER 66 N 1.40 6.74 -0.17 3.32 0.01 -0.23 -1.34 113.70 123.43 3n99 s SER 66 Ca 0.06 0.88 -0.01 0.00 1.31 0.00 0.00 55.95 58.19 3n99 s SER 66 Cb -0.15 -2.33 -0.01 0.00 0.21 0.00 0.00 66.02 63.75 3n99 s SER 66 CO 0.05 -0.11 -0.11 -0.69 0.41 0.00 0.00 173.24 172.80 3n99 s VAL 67 N 1.07 3.02 0.34 3.43 1.01 0.43 -0.36 120.40 129.35 3n99 s VAL 67 Ca 0.29 -0.64 0.09 0.00 0.00 0.00 0.00 61.98 61.71 3n99 s VAL 67 Cb -0.16 -2.31 -0.05 0.00 0.00 0.00 0.00 36.38 33.86 3n99 s VAL 67 CO 0.12 0.49 0.05 0.00 0.00 0.00 0.00 175.10 175.76 3n99 s MET 68 N 0.87 2.17 0.61 2.72 0.23 -0.02 -0.88 119.30 124.99 3n99 s MET 68 Ca -0.03 -1.69 -0.16 0.00 -1.03 0.00 0.00 55.69 52.77 3n99 s MET 68 Cb -0.15 -2.00 -0.03 0.00 -1.53 0.00 0.00 34.83 31.12 3n99 s MET 68 CO 0.00 0.12 1.10 0.00 -2.03 0.00 0.00 175.02 174.21 3n99 s ALA 69 N -2.49 2.61 0.30 3.16 0.00 -1.26 -0.61 121.76 123.46 3n99 s ALA 69 Ca 0.36 0.57 0.37 0.00 0.00 0.00 0.00 51.96 53.26 3n99 s ALA 69 Cb -0.01 -3.30 1.79 0.00 0.00 0.00 0.00 23.12 21.61 3n99 s ALA 69 CO 0.20 -1.00 2.12 0.00 0.00 0.00 0.00 175.76 177.09 3n99 h ARG 70 N 0.46 0.00 -1.58 0.00 3.08 -1.90 -3.44 114.38 110.99 3n99 h ARG 70 Ca -0.48 0.00 0.24 0.00 0.07 0.00 0.00 59.98 59.82 3n99 h ARG 70 Cb 1.24 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 31.11 3n99 h ARG 70 CO 0.56 0.00 0.77 -0.98 -1.07 0.00 0.00 179.97 179.25 3n99 s ARG 71 N -3.85 0.38 0.23 0.04 1.70 -1.26 -5.06 118.95 111.14 3n99 s ARG 71 Ca -0.01 -0.15 -0.06 0.00 -0.47 0.00 0.00 55.73 55.04 3n99 s ARG 71 Cb 0.11 0.17 0.34 0.00 -0.57 0.00 0.00 34.95 35.00 3n99 s ARG 71 CO 0.47 -0.17 1.82 -0.22 -1.08 0.00 0.00 175.30 176.12 3n99 h LYS 72 N 2.00 0.77 0.00 3.89 3.64 -2.03 -1.89 116.57 122.95 3n99 h LYS 72 Ca -0.12 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.20 3n99 h LYS 72 Cb 1.18 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.82 3n99 h LYS 72 CO 0.24 0.51 -0.04 1.05 -2.27 0.00 0.00 179.45 178.94 3n99 h GLU 73 N 0.79 0.00 -0.15 1.90 9.09 -2.00 -1.13 114.58 123.08 3n99 h GLU 73 Ca 0.37 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.78 3n99 h GLU 73 Cb 0.28 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.38 3n99 h GLU 73 CO -0.22 0.04 0.00 0.39 0.05 0.00 0.00 179.01 179.27 3n99 n GLU 74 N -3.18 1.61 -0.05 1.06 1.02 -0.71 -4.28 120.64 116.11 3n99 n GLU 74 Ca -0.01 -0.93 -0.15 0.00 -0.02 0.00 0.00 57.16 56.06 3n99 n GLU 74 Cb 0.26 -1.36 -0.08 0.00 -0.02 0.00 0.00 31.44 30.24 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 1.83 0.45 -0.45 3.49 5.08 -1.23 -2.93 114.58 120.82 3n99 h GLU 75 Ca 0.00 -0.31 -0.03 0.00 -1.00 0.00 0.00 59.36 58.02 3n99 h GLU 75 Cb 0.40 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 3n99 h GLU 75 CO 0.00 0.92 0.18 0.82 -1.00 0.00 0.00 179.01 179.93 3n99 h ILE 76 N 0.05 1.21 -0.40 3.13 2.04 -1.77 -1.73 117.51 120.04 3n99 h ILE 76 Ca -0.00 -0.64 -0.13 0.00 1.00 0.00 0.00 64.86 65.08 3n99 h ILE 76 Cb 0.93 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.79 3n99 h ILE 76 CO 0.07 0.24 -0.27 1.55 0.00 0.00 0.00 178.15 179.74 3n99 h PRO 77 N 0.58 0.84 -0.54 2.37 0.13 -1.84 0.48 132.00 134.02 3n99 h PRO 77 Ca 0.15 -0.37 0.11 0.00 -0.87 0.00 0.00 66.00 65.02 3n99 h PRO 77 Cb 0.20 -0.02 -0.10 0.00 0.13 0.00 0.00 31.00 31.21 3n99 h PRO 77 CO -0.01 1.01 -0.15 1.25 -0.23 0.00 0.00 178.00 179.86 3n99 h LEU 78 N 0.72 -0.56 0.00 1.56 5.85 -1.30 -0.82 115.31 120.76 3n99 h LEU 78 Ca 0.09 0.17 -0.19 0.00 0.84 0.00 0.00 57.88 58.79 3n99 h LEU 78 Cb 0.81 0.35 -0.03 0.00 0.37 0.00 0.00 40.66 42.17 3n99 h LEU 78 CO 0.07 -0.19 -1.00 0.24 -0.34 0.00 0.00 178.44 177.21 3n99 h MET 79 N -0.02 0.00 0.13 1.25 2.86 -1.07 -3.11 114.93 114.97 3n99 h MET 79 Ca 0.26 0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 57.64 3n99 h MET 79 Cb 0.41 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.08 3n99 h MET 79 CO -0.57 0.72 -1.29 1.15 1.06 0.00 0.00 176.91 177.98 3n99 h THR 80 N 0.00 1.15 0.06 2.22 2.02 -0.81 -3.37 112.91 114.18 3n99 h THR 80 Ca -0.06 -2.45 -0.26 0.00 0.77 0.00 0.00 66.41 64.40 3n99 h THR 80 Cb 1.68 2.84 -0.02 0.00 -1.74 0.00 0.00 68.15 70.91 3n99 h THR 80 CO 0.10 0.72 -1.32 -0.07 0.37 0.00 0.00 175.52 175.31 3n99 h LEU 81 N -0.29 0.21 -9.52 2.58 3.38 -1.28 -3.44 115.31 106.94 3n99 h LEU 81 Ca -0.27 -0.26 -0.53 0.00 0.09 0.00 0.00 57.88 56.91 3n99 h LEU 81 Cb 1.76 -0.07 0.03 0.00 0.09 0.00 0.00 40.66 42.47 3n99 h LEU 81 CO 0.09 1.21 0.94 -0.44 0.09 0.00 0.00 178.44 180.34 3n99 s SER 82 N -6.79 6.60 0.10 -0.43 0.01 -1.17 -3.99 113.70 108.03 3n99 s SER 82 Ca -0.04 2.53 0.09 0.00 1.31 0.00 0.00 55.95 59.85 3n99 s SER 82 Cb 0.08 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.70 3n99 s SER 82 CO 0.84 -0.85 -0.21 0.00 0.41 0.00 0.00 173.24 173.43 3n99 s ILE 84 N -1.06 2.65 0.00 0.00 1.01 0.36 -1.28 121.20 122.88 3n99 s ILE 84 Ca 0.16 0.12 0.00 0.00 0.00 0.00 0.00 60.65 60.93 3n99 s ILE 84 Cb -0.10 -3.08 0.00 0.00 0.01 0.00 0.00 42.46 39.29 3n99 s ILE 84 CO 0.08 -0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.63 3n99 n GLY 85 N 4.21 1.12 3.75 6.18 0.00 0.54 -0.97 105.19 120.03 3n99 n GLY 85 Ca 0.18 0.00 -0.37 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 -1.71 5.09 0.39 1.61 0.02 -0.40 -4.59 114.94 115.35 3n99 s ASN 86 Ca 0.00 2.64 -0.25 0.00 -1.02 0.00 0.00 52.86 54.22 3n99 s ASN 86 Cb 0.00 -2.62 -0.09 0.00 0.02 0.00 0.00 41.25 38.56 3n99 s ASN 86 CO 0.00 -1.68 1.16 -0.70 0.02 0.00 0.00 177.10 175.89 3n99 s GLU 87 N -3.11 4.12 -0.04 -0.60 2.12 -1.26 -1.33 118.70 118.59 3n99 s GLU 87 Ca 0.76 1.81 0.02 0.00 0.36 0.00 0.00 54.97 57.92 3n99 s GLU 87 Cb -0.37 -2.71 0.01 0.00 0.26 0.00 0.00 34.13 31.32 3n99 s GLU 87 CO 0.42 -0.26 -0.08 0.08 -0.54 0.00 0.00 175.26 174.88 3n99 s VAL 88 N -1.41 0.77 -0.07 3.70 1.01 -0.48 -1.20 120.40 122.71 3n99 s VAL 88 Ca 0.56 -0.29 0.05 0.00 0.00 0.00 0.00 61.98 62.30 3n99 s VAL 88 Cb -0.30 -0.72 -0.01 0.00 0.00 0.00 0.00 36.38 35.35 3n99 s VAL 88 CO 0.38 0.26 -0.23 -0.63 0.00 0.00 0.00 175.10 174.88 3n99 s ILE 89 N 0.61 1.92 0.10 2.22 1.09 -0.01 -0.48 121.20 126.64 3n99 s ILE 89 Ca -0.10 -0.97 -0.29 0.00 -1.10 0.00 0.00 60.65 58.19 3n99 s ILE 89 Cb -0.13 -1.64 -0.06 0.00 -1.06 0.00 0.00 42.46 39.58 3n99 s ILE 89 CO 0.01 0.53 0.94 -0.69 -0.10 0.00 0.00 174.94 175.63 3n99 s VAL 90 N 0.05 4.53 0.00 2.92 1.01 -0.39 -1.37 120.40 127.16 3n99 s VAL 90 Ca -0.09 2.02 0.00 0.00 0.00 0.00 0.00 61.98 63.92 3n99 s VAL 90 Cb -0.15 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 31.93 3n99 s VAL 90 CO 0.05 0.32 0.67 0.23 0.00 0.00 0.00 175.10 176.37 3n99 n MET 91 N 2.81 0.77 -3.97 2.72 2.81 -0.41 -0.30 117.12 121.55 3n99 n MET 91 Ca 0.02 -0.88 -0.09 0.00 -1.81 0.00 0.00 57.70 54.94 3n99 n MET 91 Cb 0.49 -0.94 -0.04 0.00 -0.71 0.00 0.00 33.22 32.03 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 -0.41 -0.03 0.25 7.83 1.04 -1.25 -4.85 113.70 116.29 3n99 s SER 92 Ca 0.00 -0.94 0.00 0.00 0.48 0.00 0.00 55.95 55.49 3n99 s SER 92 Cb 0.00 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.75 3n99 s SER 92 CO 0.00 -1.22 0.00 0.61 0.98 0.00 0.00 173.24 173.61 3n99 n GLY 93 N -0.42 -1.42 0.27 7.32 0.00 -1.26 -3.90 105.19 105.78 3n99 n GLY 93 Ca -0.02 -1.27 0.17 0.00 0.00 0.00 0.00 46.02 44.90 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 -0.44 1.61 3.32 -1.98 -2.72 116.42 116.21 3n99 h ASP 94 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3n99 h ASP 94 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 3n99 h ASP 94 CO 0.00 0.01 0.02 0.00 -1.72 0.00 0.00 179.24 177.54 3n99 n ALA 95 N -2.09 3.55 -1.55 3.45 0.00 -1.26 -5.01 120.51 117.60 3n99 n ALA 95 Ca 0.01 -2.16 -0.51 0.00 0.00 0.00 0.00 53.44 50.77 3n99 n ALA 95 Cb 0.33 -0.94 -0.05 0.00 0.00 0.00 0.00 19.45 18.79 3n99 n ALA 95 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3n99 n LYS 96 N 0.02 0.83 0.00 0.00 4.81 -1.03 -0.77 118.16 122.02 3n99 n LYS 96 Ca 0.26 0.30 0.00 0.00 -0.87 0.00 0.00 58.31 58.00 3n99 n LYS 96 Cb 1.08 -1.78 0.00 0.00 0.02 0.00 0.00 35.03 34.35 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 2.02 2.96 3.75 3.14 0.00 0.59 -4.98 105.19 112.66 3n99 n GLY 97 Ca 0.17 0.00 -0.37 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 -1.39 5.19 0.07 1.61 0.01 0.05 -4.74 113.70 114.50 3n99 s SER 98 Ca 0.00 2.61 0.10 0.00 1.31 0.00 0.00 55.95 59.97 3n99 s SER 98 Cb 0.00 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.58 3n99 s SER 98 CO 0.00 -1.61 -0.26 -0.13 0.41 0.00 0.00 173.24 171.65 3n99 s ARG 99 N -3.08 1.66 0.00 12.44 0.52 -1.26 -1.26 118.95 127.97 3n99 s ARG 99 Ca 0.75 -1.16 0.00 0.00 -0.52 0.00 0.00 55.73 54.79 3n99 s ARG 99 Cb -0.37 -1.92 0.00 0.00 0.52 0.00 0.00 34.95 33.19 3n99 s ARG 99 CO 0.42 0.48 0.00 0.41 0.02 0.00 0.00 175.30 176.63 3n99 n GLY 100 N 1.55 4.66 3.32 -3.53 0.00 0.37 -4.64 105.19 106.91 3n99 n GLY 100 Ca -0.17 -1.16 -0.14 0.00 0.00 0.00 0.00 46.02 44.55 3n99 n GLY 100 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3n99 s PHE 101 N -1.02 -0.29 0.03 1.61 -0.12 -0.69 -1.39 117.98 116.11 3n99 s PHE 101 Ca 0.00 0.38 -0.30 0.00 -0.05 0.00 0.00 56.93 56.95 3n99 s PHE 101 Cb 0.00 0.20 -0.07 0.00 -0.63 0.00 0.00 43.02 42.52 3n99 s PHE 101 CO 0.00 -0.51 1.47 0.08 -0.05 0.00 0.00 175.22 176.22 3n99 s VAL 102 N -1.83 3.47 -0.12 -2.49 1.01 -0.44 -0.98 120.40 119.03 3n99 s VAL 102 Ca -0.09 0.90 0.22 0.00 0.00 0.00 0.00 61.98 63.01 3n99 s VAL 102 Cb -0.02 -3.58 -0.29 0.00 0.00 0.00 0.00 36.38 32.49 3n99 s VAL 102 CO 0.02 0.01 0.58 0.35 0.00 0.00 0.00 175.10 176.06 3n99 n THR 103 N 4.60 0.08 -0.62 3.92 -2.24 0.83 -0.34 114.28 120.51 3n99 n THR 103 Ca 0.14 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 3n99 n THR 103 Cb 0.43 0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 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 1.27 -1.60 3.37 3.38 0.00 -1.13 -4.86 105.19 105.62 3n99 n GLY 104 Ca -0.03 -1.08 -0.13 0.00 0.00 0.00 0.00 46.02 44.78 3n99 n GLY 104 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3n99 s LYS 105 N -1.74 1.01 -0.12 1.61 -2.85 -1.26 -0.78 119.74 115.61 3n99 s LYS 105 Ca 0.00 -0.30 -0.01 0.00 -1.00 0.00 0.00 55.97 54.66 3n99 s LYS 105 Cb 0.00 0.46 0.04 0.00 -2.06 0.00 0.00 37.83 36.27 3n99 s LYS 105 CO 0.00 -0.37 -0.01 -1.58 0.10 0.00 0.00 175.35 173.49 3n99 s HIS 106 N -2.56 1.05 0.67 1.78 2.46 0.28 -4.15 115.29 114.81 3n99 s HIS 106 Ca -0.05 -0.57 -0.11 0.00 0.47 0.00 0.00 55.06 54.81 3n99 s HIS 106 Cb -0.01 -1.01 -0.01 0.00 -0.13 0.00 0.00 32.58 31.43 3n99 s HIS 106 CO -0.03 -0.47 1.06 0.20 -2.47 0.00 0.00 174.74 173.03 3n99 s GLY 107 N 1.85 1.65 0.00 1.59 0.00 -1.26 -1.54 107.32 109.61 3n99 s GLY 107 Ca 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 44.72 44.65 3n99 s GLY 107 CO -0.07 0.21 0.00 0.61 0.00 0.00 0.00 173.10 173.85 3n99 n GLY 108 N -2.54 0.83 0.29 0.20 0.00 -1.26 -4.31 105.19 98.39 3n99 n GLY 108 Ca 0.07 -0.74 0.14 0.00 0.00 0.00 0.00 46.02 45.49 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 0.54 -4.21 1.61 -1.51 -2.04 -3.47 116.25 107.17 3n99 h VAL 109 Ca 0.00 -0.19 -0.04 0.00 -1.23 0.00 0.00 66.70 65.24 3n99 h VAL 109 Cb 0.00 1.12 0.03 0.00 -2.13 0.00 0.00 31.29 30.31 3n99 h VAL 109 CO 0.00 0.04 -0.13 0.59 -1.23 0.00 0.00 177.57 176.84 3n99 n ASN 110 N -3.77 -4.75 -4.40 4.19 3.02 -0.93 -4.93 115.26 103.68 3n99 n ASN 110 Ca -0.03 -0.13 -0.32 0.00 -0.03 0.00 0.00 54.58 54.07 3n99 n ASN 110 Cb 0.14 -3.09 -0.14 0.00 -0.61 0.00 0.00 39.78 36.08 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 -3.06 2.60 -0.16 3.10 3.76 -0.59 -4.42 115.29 116.53 3n99 s HIS 111 Ca 0.07 -0.34 -0.08 0.00 -0.15 0.00 0.00 55.06 54.56 3n99 s HIS 111 Cb -0.01 -1.62 -0.04 0.00 1.11 0.00 0.00 32.58 32.01 3n99 s HIS 111 CO 0.38 0.05 0.12 0.08 -0.85 0.00 0.00 174.74 174.51 3n99 s VAL 112 N -0.52 5.30 -0.12 -0.90 1.01 -0.06 -0.56 120.40 124.56 3n99 s VAL 112 Ca 0.07 0.14 -0.03 0.00 0.00 0.00 0.00 61.98 62.16 3n99 s VAL 112 Cb -0.11 -3.36 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 3n99 s VAL 112 CO 0.01 0.52 0.00 -0.76 0.00 0.00 0.00 175.10 174.88 3n99 s LEU 113 N -0.26 3.55 -0.02 3.92 1.43 0.04 -0.43 118.68 126.91 3n99 s LEU 113 Ca 0.10 0.07 0.03 0.00 -1.03 0.00 0.00 54.13 53.30 3n99 s LEU 113 Cb -0.12 -1.84 -0.00 0.00 0.03 0.00 0.00 46.19 44.26 3n99 s LEU 113 CO 0.01 0.29 -0.09 -0.69 0.23 0.00 0.00 176.35 176.10 3n99 s VAL 114 N -0.34 0.73 -0.27 -1.59 1.01 -0.45 -0.12 120.40 119.37 3n99 s VAL 114 Ca 0.07 -0.36 -0.10 0.00 0.00 0.00 0.00 61.98 61.58 3n99 s VAL 114 Cb -0.12 -0.63 -0.05 0.00 0.00 0.00 0.00 36.38 35.58 3n99 s VAL 114 CO 0.02 0.22 0.17 -2.28 0.00 0.00 0.00 175.10 173.23 3n99 s HIS 115 N -0.01 3.21 0.25 5.22 2.46 -0.15 -1.26 115.29 125.01 3n99 s HIS 115 Ca 0.00 0.06 0.08 0.00 0.47 0.00 0.00 55.06 55.67 3n99 s HIS 115 Cb -0.06 -2.35 -0.04 0.00 -0.13 0.00 0.00 32.58 30.01 3n99 s HIS 115 CO -0.00 -0.16 0.12 -0.06 -2.47 0.00 0.00 174.74 172.17 3n99 s PHE 116 N 1.65 2.97 0.69 3.88 0.08 -1.26 -1.70 117.98 124.28 3n99 s PHE 116 Ca 0.07 -0.14 -0.16 0.00 0.12 0.00 0.00 56.93 56.82 3n99 s PHE 116 Cb -0.16 -1.34 0.01 0.00 -0.57 0.00 0.00 43.02 40.97 3n99 s PHE 116 CO 0.09 0.55 1.20 -1.21 -0.10 0.00 0.00 175.22 175.76 3n99 s GLU 117 N -3.69 2.43 0.24 0.44 2.02 -1.26 -4.91 118.70 113.98 3n99 s GLU 117 Ca 0.32 1.75 -0.04 0.00 0.02 0.00 0.00 54.97 57.02 3n99 s GLU 117 Cb -0.08 -1.87 0.45 0.00 0.10 0.00 0.00 34.13 32.73 3n99 s GLU 117 CO 0.23 -1.61 1.73 1.49 0.02 0.00 0.00 175.26 177.12 3n99 h GLU 118 N 0.07 0.43 -0.76 1.61 4.81 -2.01 -1.48 114.58 117.24 3n99 h GLU 118 Ca -0.48 -0.03 0.11 0.00 -0.13 0.00 0.00 59.36 58.83 3n99 h GLU 118 Cb 1.29 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 30.52 3n99 h GLU 118 CO 0.52 0.28 0.50 0.93 -0.73 0.00 0.00 179.01 180.51 3n99 h GLU 119 N 0.44 0.61 -0.35 1.92 3.07 -2.03 -2.42 114.58 115.81 3n99 h GLU 119 Ca 0.41 -0.04 -0.12 0.00 -0.50 0.00 0.00 59.36 59.11 3n99 h GLU 119 Cb 0.62 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.38 3n99 h GLU 119 CO -0.40 0.40 -0.27 0.28 -1.40 0.00 0.00 179.01 177.63 3n99 h VAL 120 N 0.63 1.28 -0.53 3.13 2.07 -1.63 -3.30 116.25 117.89 3n99 h VAL 120 Ca 0.36 -1.38 -0.02 0.00 0.82 0.00 0.00 66.70 66.48 3n99 h VAL 120 Cb 0.54 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 3n99 h VAL 120 CO -0.13 0.46 0.27 -0.07 0.02 0.00 0.00 177.57 178.11 3n99 h LEU 121 N 0.62 0.66 -0.79 2.57 3.38 -1.44 -0.67 115.31 119.65 3n99 h LEU 121 Ca 0.08 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3n99 h LEU 121 Cb 0.77 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.35 3n99 h LEU 121 CO 0.06 0.55 0.00 0.61 0.09 0.00 0.00 178.44 179.76 3n99 n GLY 122 N -1.23 -1.10 0.09 0.83 0.00 -1.24 -2.36 105.19 100.17 3n99 n GLY 122 Ca 0.05 0.10 0.10 0.00 0.00 0.00 0.00 46.02 46.27 3n99 n GLY 122 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3n99 n LYS 123 N -2.13 0.21 -2.44 1.61 5.02 -0.26 -4.99 118.16 115.17 3n99 n LYS 123 Ca 0.01 -0.17 -0.33 0.00 -2.02 0.00 0.00 58.31 55.80 3n99 n LYS 123 Cb 0.16 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.64 3n99 n LYS 123 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3n99 s LEU 124 N -2.91 3.73 -0.00 -0.35 1.43 -0.99 -4.09 118.68 115.50 3n99 s LEU 124 Ca 0.10 1.76 0.01 0.00 -1.03 0.00 0.00 54.13 54.98 3n99 s LEU 124 Cb 0.17 -4.54 -0.00 0.00 0.03 0.00 0.00 46.19 41.85 3n99 s LEU 124 CO 0.80 -0.74 -0.03 -0.32 0.23 0.00 0.00 176.35 176.29 3n99 s MET 125 N -3.63 0.26 0.24 1.70 -2.45 -1.26 -5.06 119.30 109.09 3n99 s MET 125 Ca 0.63 -0.12 -0.31 0.00 -1.25 0.00 0.00 55.69 54.64 3n99 s MET 125 Cb -0.13 -0.24 -0.14 0.00 1.25 0.00 0.00 34.83 35.57 3n99 s MET 125 CO 0.25 0.07 1.31 0.28 1.05 0.00 0.00 175.02 177.98 3n99 n VAL 126 N 2.97 1.11 0.00 10.11 0.31 -1.26 -1.20 118.33 130.36 3n99 n VAL 126 Ca -0.13 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 63.92 3n99 n VAL 126 Cb 0.59 -1.31 0.00 0.00 -0.91 0.00 0.00 33.84 32.21 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 1.93 1.69 3.73 2.92 0.00 -0.29 -4.94 105.19 110.25 3n99 n GLY 127 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 3.19 -4.74 1.61 8.00 -0.34 -4.56 116.55 119.70 3n99 n ASP 128 Ca 0.00 1.19 -0.41 0.00 0.71 0.00 0.00 54.79 56.29 3n99 n ASP 128 Cb 0.00 -1.55 -0.04 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 -2.07 4.60 -0.04 -1.24 1.02 -1.26 -1.59 119.74 119.16 3n99 s LYS 129 Ca 0.56 1.76 0.05 0.00 0.02 0.00 0.00 55.97 58.36 3n99 s LYS 129 Cb -0.51 -3.24 -0.01 0.00 -0.52 0.00 0.00 37.83 33.55 3n99 s LYS 129 CO 0.62 0.11 -0.19 0.42 -0.92 0.00 0.00 175.35 175.39 3n99 s ILE 130 N -0.54 1.53 -0.20 2.17 -1.09 0.54 -1.29 121.20 122.33 3n99 s ILE 130 Ca 0.48 -0.79 -0.02 0.00 -2.23 0.00 0.00 60.65 58.08 3n99 s ILE 130 Cb -0.31 -1.30 -0.00 0.00 -1.58 0.00 0.00 42.46 39.27 3n99 s ILE 130 CO 0.37 0.44 -0.09 -0.22 -1.23 0.00 0.00 174.94 174.21 3n99 s LEU 131 N -0.13 2.71 -0.23 2.97 2.96 -0.47 -0.78 118.68 125.71 3n99 s LEU 131 Ca -0.00 -0.44 -0.07 0.00 -0.22 0.00 0.00 54.13 53.40 3n99 s LEU 131 Cb -0.11 -1.67 -0.03 0.00 0.50 0.00 0.00 46.19 44.88 3n99 s LEU 131 CO 0.01 0.00 0.06 -0.63 -1.32 0.00 0.00 176.35 174.48 3n99 s ILE 132 N 1.32 4.39 -1.10 6.68 1.01 0.55 -0.83 121.20 133.22 3n99 s ILE 132 Ca 0.04 -0.16 -0.19 0.00 0.00 0.00 0.00 60.65 60.34 3n99 s ILE 132 Cb -0.14 -3.02 0.09 0.00 0.01 0.00 0.00 42.46 39.39 3n99 s ILE 132 CO -0.05 0.38 1.46 -0.54 0.00 0.00 0.00 174.94 176.19 3n99 s LYS 133 N 1.21 3.77 0.14 2.79 1.02 -0.34 -1.17 119.74 127.17 3n99 s LYS 133 Ca 0.04 -1.71 -0.30 0.00 0.02 0.00 0.00 55.97 54.02 3n99 s LYS 133 Cb -0.14 -5.27 -0.07 0.00 -0.52 0.00 0.00 37.83 31.82 3n99 s LYS 133 CO 0.03 -2.07 1.18 0.00 -0.92 0.00 0.00 175.35 173.57 3n99 s ALA 134 N 3.80 3.41 -0.30 5.17 0.00 -0.09 -4.30 121.76 129.45 3n99 s ALA 134 Ca 0.45 0.89 -0.14 0.00 0.00 0.00 0.00 51.96 53.15 3n99 s ALA 134 Cb -0.00 -3.41 0.15 0.00 0.00 0.00 0.00 23.12 19.85 3n99 s ALA 134 CO -0.04 -0.36 0.90 -0.46 0.00 0.00 0.00 175.76 175.81 3n99 s TRP 135 N 0.33 -0.80 0.00 0.00 -0.00 -1.26 -1.70 118.94 115.51 3n99 s TRP 135 Ca 0.54 1.44 0.00 0.00 -0.00 0.00 0.00 56.10 58.08 3n99 s TRP 135 Cb -0.31 0.48 0.00 0.00 -0.00 0.00 0.00 33.47 33.64 3n99 s TRP 135 CO 0.33 -0.40 0.00 0.41 -0.00 0.00 0.00 176.95 177.30 3n99 n GLY 136 N 4.70 1.14 3.73 5.86 0.00 -1.26 -4.19 105.19 115.16 3n99 n GLY 136 Ca -0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 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 4.55 0.00 1.61 -1.52 -1.26 -2.14 119.66 120.90 3n99 s GLN 137 Ca 0.00 1.69 0.00 0.00 -1.95 0.00 0.00 55.36 55.10 3n99 s GLN 137 Cb 0.00 -3.32 0.00 0.00 -0.22 0.00 0.00 33.01 29.47 3n99 s GLN 137 CO 0.00 -0.03 0.00 0.41 -0.25 0.00 0.00 175.29 175.42 3n99 n GLY 138 N 2.49 0.64 3.69 3.09 0.00 -1.26 -4.77 105.19 109.08 3n99 n GLY 138 Ca 0.05 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.63 3n99 n GLY 138 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3n99 n LEU 139 N 0.00 3.53 -4.07 0.99 7.94 -0.91 -4.96 117.00 119.52 3n99 n LEU 139 Ca 0.00 1.12 -0.21 0.00 -1.11 0.00 0.00 56.01 55.81 3n99 n LEU 139 Cb 0.00 -1.49 -0.15 0.00 0.53 0.00 0.00 43.42 42.31 3n99 n LEU 139 CO 0.00 -0.19 -0.46 -0.54 -1.11 0.00 0.00 177.39 175.10 3n99 s LYS 140 N 0.15 0.96 -0.40 1.96 1.02 -1.26 -4.43 119.74 117.73 3n99 s LYS 140 Ca 0.71 -0.44 -0.24 0.00 0.02 0.00 0.00 55.97 56.03 3n99 s LYS 140 Cb -0.60 -0.92 0.02 0.00 -0.52 0.00 0.00 37.83 35.80 3n99 s LYS 140 CO 0.44 0.25 0.81 -0.51 -0.92 0.00 0.00 175.35 175.42 3n99 s LEU 141 N -0.32 4.14 0.29 3.17 1.43 -1.26 -2.80 118.68 123.33 3n99 s LEU 141 Ca 0.04 0.20 0.07 0.00 -1.03 0.00 0.00 54.13 53.41 3n99 s LEU 141 Cb -0.05 -3.04 0.43 0.00 0.03 0.00 0.00 46.19 43.56 3n99 s LEU 141 CO -0.00 -0.84 1.68 -0.07 0.23 0.00 0.00 176.35 177.35 3n99 h LEU 142 N 9.98 0.23 -1.51 1.79 3.38 0.11 -2.60 115.31 126.70 3n99 h LEU 142 Ca -0.25 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.62 3n99 h LEU 142 Cb 1.09 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.77 3n99 h LEU 142 CO 0.95 0.65 0.00 0.47 0.09 0.00 0.00 178.44 180.60 3n99 n ASP 143 N -4.00 2.29 -3.19 -0.43 8.00 -1.26 -4.43 116.55 113.53 3n99 n ASP 143 Ca -0.02 -1.79 -0.22 0.00 0.71 0.00 0.00 54.79 53.47 3n99 n ASP 143 Cb 0.50 -0.11 -0.06 0.00 -0.02 0.00 0.00 41.12 41.43 3n99 n ASP 143 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3n99 n HIS 144 N 0.74 -0.17 0.31 1.24 8.25 -0.98 -4.99 115.22 119.63 3n99 n HIS 144 Ca 0.17 -3.65 0.19 0.00 -0.26 0.00 0.00 57.72 54.17 3n99 n HIS 144 Cb 0.44 -0.37 1.06 0.00 1.12 0.00 0.00 29.99 32.24 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 3.68 0.00 -0.02 -0.41 0.13 -1.77 -1.21 132.00 132.40 3n99 h PRO 145 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 3n99 h PRO 145 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 3n99 h PRO 145 CO 0.48 0.00 -0.03 -0.25 -0.23 0.00 0.00 178.00 177.96 3n99 n ASP 146 N -3.46 1.84 -4.41 1.44 8.00 -1.26 -4.72 116.55 113.98 3n99 n ASP 146 Ca -0.03 -1.58 -0.43 0.00 0.71 0.00 0.00 54.79 53.47 3n99 n ASP 146 Cb 0.10 0.02 -0.10 0.00 -0.02 0.00 0.00 41.12 41.12 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 -2.05 5.01 0.03 2.53 1.01 -0.46 -4.60 120.40 121.87 3n99 s VAL 147 Ca 0.34 -0.87 -0.18 0.00 0.00 0.00 0.00 61.98 61.28 3n99 s VAL 147 Cb 0.21 -3.86 -0.06 0.00 0.00 0.00 0.00 36.38 32.66 3n99 s VAL 147 CO 0.35 -0.37 0.52 -0.54 0.00 0.00 0.00 175.10 175.05 3n99 s LYS 148 N 1.62 4.14 0.20 2.72 -0.14 -0.15 -4.57 119.74 123.56 3n99 s LYS 148 Ca 0.04 0.62 0.10 0.00 -1.36 0.00 0.00 55.97 55.36 3n99 s LYS 148 Cb -0.21 -3.26 -0.04 0.00 -1.68 0.00 0.00 37.83 32.64 3n99 s LYS 148 CO 0.08 0.59 -0.19 0.14 -0.76 0.00 0.00 175.35 175.20 3n99 s VAL 149 N -0.88 2.07 -0.08 3.17 -7.23 -1.26 -0.78 120.40 115.41 3n99 s VAL 149 Ca 0.27 -2.08 -0.32 0.00 -1.81 0.00 0.00 61.98 58.04 3n99 s VAL 149 Cb -0.18 -2.03 0.12 0.00 0.56 0.00 0.00 36.38 34.85 3n99 s VAL 149 CO 0.16 -0.32 1.16 0.00 -0.31 0.00 0.00 175.10 175.80 3n99 s MET 150 N -3.02 0.49 -1.56 4.82 0.23 -0.76 -4.71 119.30 114.79 3n99 s MET 150 Ca 0.21 -0.22 0.00 0.00 -1.03 0.00 0.00 55.69 54.64 3n99 s MET 150 Cb -0.05 0.20 0.00 0.00 -1.53 0.00 0.00 34.83 33.44 3n99 s MET 150 CO 0.09 -0.22 0.00 0.09 -2.03 0.00 0.00 175.02 172.95 3n99 n ASN 151 N -0.27 -5.61 -3.88 -1.18 3.02 -1.26 -4.23 115.26 101.85 3n99 n ASN 151 Ca -0.04 0.36 -0.17 0.00 -0.03 0.00 0.00 54.58 54.70 3n99 n ASN 151 Cb 0.60 -4.40 -0.15 0.00 -0.61 0.00 0.00 39.78 35.22 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 -2.26 0.32 0.23 2.41 2.07 -1.26 -0.49 121.20 122.22 3n99 s ILE 152 Ca 0.00 -0.07 -0.31 0.00 -1.41 0.00 0.00 60.65 58.86 3n99 s ILE 152 Cb 0.00 -0.34 -0.11 0.00 0.13 0.00 0.00 42.46 42.14 3n99 s ILE 152 CO 0.00 0.14 1.61 -0.62 -1.91 0.00 0.00 174.94 174.16 3n99 s ASP 153 N 0.56 6.46 0.47 4.50 -1.08 -0.14 -4.54 116.67 122.89 3n99 s ASP 153 Ca -0.06 2.81 0.15 0.00 -0.52 0.00 0.00 52.55 54.93 3n99 s ASP 153 Cb -0.09 -2.61 1.09 0.00 -1.46 0.00 0.00 42.92 39.84 3n99 s ASP 153 CO -0.01 -0.88 2.05 -0.65 0.52 0.00 0.00 175.17 176.20 3n99 h PRO 154 N 5.91 0.02 -0.25 4.34 0.11 -1.91 -0.63 132.00 139.59 3n99 h PRO 154 Ca -0.45 -0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.46 3n99 h PRO 154 Cb 1.21 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3n99 h PRO 154 CO 0.87 0.12 -0.62 -0.44 -0.21 0.00 0.00 178.00 177.73 3n99 h ASP 155 N 0.02 0.98 -0.26 -2.05 3.32 -1.96 -2.73 116.42 113.74 3n99 h ASP 155 Ca 0.00 -0.56 -0.05 0.00 0.02 0.00 0.00 57.03 56.44 3n99 h ASP 155 Cb 0.20 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 3n99 h ASP 155 CO 0.01 1.36 -0.00 0.25 -1.72 0.00 0.00 179.24 179.14 3n99 h LEU 156 N 0.64 0.54 -1.00 1.55 5.85 -1.72 -2.67 115.31 118.51 3n99 h LEU 156 Ca -0.01 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.59 3n99 h LEU 156 Cb 1.23 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.08 3n99 h LEU 156 CO 0.13 0.62 0.49 0.15 -0.34 0.00 0.00 178.44 179.49 3n99 h PHE 157 N 0.55 1.17 0.00 1.25 3.57 -0.96 -2.07 116.94 120.44 3n99 h PHE 157 Ca 0.12 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 3n99 h PHE 157 Cb 0.36 -0.38 -0.00 0.00 2.79 0.00 0.00 35.95 38.72 3n99 h PHE 157 CO 0.01 0.79 -0.02 0.93 -2.23 0.00 0.00 178.31 177.80 3n99 h GLU 158 N 1.20 0.00 -0.49 1.11 5.08 -1.17 -2.96 114.58 117.35 3n99 h GLU 158 Ca 0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 3n99 h GLU 158 Cb -0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.24 3n99 h GLU 158 CO -0.05 0.02 0.00 1.63 -1.00 0.00 0.00 179.01 179.61 3n99 n LYS 159 N -3.20 2.30 -0.07 2.33 5.02 -0.78 -4.49 118.16 119.28 3n99 n LYS 159 Ca -0.02 -2.01 0.12 0.00 -2.02 0.00 0.00 58.31 54.38 3n99 n LYS 159 Cb 0.17 -1.46 0.38 0.00 -0.02 0.00 0.00 35.03 34.10 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 1.15 1.89 -0.09 -0.35 4.77 -1.12 -4.90 117.00 118.35 3n99 n LEU 160 Ca 0.19 -0.75 -0.01 0.00 -0.03 0.00 0.00 56.01 55.41 3n99 n LEU 160 Cb 0.49 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.49 3n99 n LEU 160 CO 0.14 0.37 -0.01 0.61 -1.33 0.00 0.00 177.39 177.17 3n99 n GLY 161 N 1.19 0.50 3.76 -0.72 0.00 -1.26 -4.64 105.19 104.02 3n99 n GLY 161 Ca 0.17 -0.47 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 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 -1.98 3.36 0.00 -0.61 1.01 -1.26 -4.59 121.20 117.13 3n99 s ILE 162 Ca 0.00 1.38 0.00 0.00 0.00 0.00 0.00 60.65 62.03 3n99 s ILE 162 Cb 0.00 -3.87 -0.00 0.00 0.01 0.00 0.00 42.46 38.59 3n99 s ILE 162 CO 0.00 0.33 -0.01 -1.10 0.00 0.00 0.00 174.94 174.16 3n99 s GLN 163 N -1.51 0.07 -0.08 2.79 -0.21 -0.87 -4.98 119.66 114.88 3n99 s GLN 163 Ca 0.45 -0.14 -0.12 0.00 0.02 0.00 0.00 55.36 55.57 3n99 s GLN 163 Cb -0.33 0.02 -0.05 0.00 1.00 0.00 0.00 33.01 33.65 3n99 s GLN 163 CO 0.43 -0.01 0.31 -2.00 -2.12 0.00 0.00 175.29 171.89 3n99 s GLU 164 N -0.33 3.89 -0.30 2.91 2.12 -1.26 -0.15 118.70 125.59 3n99 s GLU 164 Ca -0.04 0.18 -0.02 0.00 0.36 0.00 0.00 54.97 55.46 3n99 s GLU 164 Cb -0.02 -3.27 0.19 0.00 0.26 0.00 0.00 34.13 31.28 3n99 s GLU 164 CO -0.00 0.58 0.71 0.21 -0.54 0.00 0.00 175.26 176.21 3n99 s LYS 165 N -0.60 0.47 -1.14 4.30 2.20 0.47 -4.97 119.74 120.47 3n99 s LYS 165 Ca 0.19 0.70 -0.07 0.00 -0.36 0.00 0.00 55.97 56.43 3n99 s LYS 165 Cb -0.14 0.37 -0.03 0.00 -1.51 0.00 0.00 37.83 36.52 3n99 s LYS 165 CO 0.08 -0.64 0.86 0.09 -0.36 0.00 0.00 175.35 175.38 3n99 n ASN 166 N 5.41 -4.55 -1.48 1.43 3.02 -1.26 -2.49 115.26 115.33 3n99 n ASN 166 Ca 0.00 -0.79 -0.18 0.00 -0.03 0.00 0.00 54.58 53.58 3n99 n ASN 166 Cb 0.53 -4.53 -0.07 0.00 -0.61 0.00 0.00 39.78 35.09 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 -1.39 1.55 3.06 7.41 0.00 -1.26 -4.98 105.19 109.57 3n99 n GLY 167 Ca -0.15 -0.14 -0.16 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.70 0.61 -0.22 1.61 1.02 -1.04 -4.85 119.74 113.17 3n99 s LYS 168 Ca 0.00 -0.61 -0.04 0.00 0.02 0.00 0.00 55.97 55.34 3n99 s LYS 168 Cb 0.00 -0.51 -0.01 0.00 -0.52 0.00 0.00 37.83 36.79 3n99 s LYS 168 CO 0.00 0.12 -0.04 0.42 -0.92 0.00 0.00 175.35 174.93 3n99 s ILE 169 N -0.89 3.44 -0.21 2.17 1.01 -0.23 -0.39 121.20 126.08 3n99 s ILE 169 Ca -0.04 -0.47 -0.10 0.00 0.00 0.00 0.00 60.65 60.04 3n99 s ILE 169 Cb -0.07 -2.56 -0.05 0.00 0.01 0.00 0.00 42.46 39.78 3n99 s ILE 169 CO 0.00 0.42 0.14 -1.00 0.00 0.00 0.00 174.94 174.51 3n99 s HIS 170 N 1.43 3.37 -0.13 3.97 3.76 0.79 -0.10 115.29 128.38 3n99 s HIS 170 Ca 0.05 0.28 0.00 0.00 -0.15 0.00 0.00 55.06 55.25 3n99 s HIS 170 Cb -0.14 -2.20 0.02 0.00 1.11 0.00 0.00 32.58 31.37 3n99 s HIS 170 CO -0.02 0.20 -0.13 0.08 -0.85 0.00 0.00 174.74 174.02 3n99 s VAL 171 N 0.63 1.42 0.09 -0.90 1.01 -0.34 -2.05 120.40 120.26 3n99 s VAL 171 Ca 0.08 -0.55 -0.31 0.00 0.00 0.00 0.00 61.98 61.20 3n99 s VAL 171 Cb -0.12 -1.34 -0.07 0.00 0.00 0.00 0.00 36.38 34.85 3n99 s VAL 171 CO 0.01 0.43 1.30 -2.84 0.00 0.00 0.00 175.10 174.00 3n99 s PRO 172 N 1.42 4.37 0.04 2.72 0.02 -1.26 0.56 135.00 142.87 3n99 s PRO 172 Ca 0.02 1.93 0.02 0.00 0.02 0.00 0.00 61.00 62.99 3n99 s PRO 172 Cb -0.13 -3.29 -0.03 0.00 0.02 0.00 0.00 34.50 31.07 3n99 s PRO 172 CO -0.08 -0.35 -0.07 0.14 -0.33 0.00 0.00 177.00 176.31 3n99 s VAL 173 N 1.08 0.46 -0.55 3.83 -7.23 -0.45 -4.84 120.40 112.69 3n99 s VAL 173 Ca 0.62 -1.17 0.24 0.00 -1.81 0.00 0.00 61.98 59.86 3n99 s VAL 173 Cb -0.33 -0.70 0.28 0.00 0.56 0.00 0.00 36.38 36.18 3n99 s VAL 173 CO 0.30 -0.49 1.61 -0.37 -0.31 0.00 0.00 175.10 175.84 3n99 h VAL 174 N 4.30 0.00 -2.35 1.32 -1.51 -1.48 0.11 116.25 116.64 3n99 h VAL 174 Ca -0.35 -0.77 0.04 0.00 -1.23 0.00 0.00 66.70 64.39 3n99 h VAL 174 Cb 1.20 1.71 -0.16 0.00 -2.13 0.00 0.00 31.29 31.90 3n99 h VAL 174 CO 0.44 0.00 0.36 0.00 -1.23 0.00 0.00 177.57 177.15 3n99 s ALA 175 N -3.18 -1.76 -0.22 5.19 0.00 -1.26 -4.76 121.76 115.77 3n99 s ALA 175 Ca 0.08 0.99 -0.02 0.00 0.00 0.00 0.00 51.96 53.01 3n99 s ALA 175 Cb 0.09 0.33 0.01 0.00 0.00 0.00 0.00 23.12 23.55 3n99 s ALA 175 CO 0.65 -0.61 -0.09 0.15 0.00 0.00 0.00 175.76 175.86 3n99 s LYS 176 N -2.71 3.09 -0.24 0.00 1.02 -1.26 -1.73 119.74 117.91 3n99 s LYS 176 Ca 0.00 -0.80 -0.08 0.00 0.02 0.00 0.00 55.97 55.11 3n99 s LYS 176 Cb -0.01 -2.87 -0.04 0.00 -0.52 0.00 0.00 37.83 34.39 3n99 s LYS 176 CO -0.06 -0.27 0.09 0.42 -0.92 0.00 0.00 175.35 174.62 3n99 s ILE 177 N 1.37 4.63 0.60 2.17 1.01 0.17 -4.94 121.20 126.21 3n99 s ILE 177 Ca 0.04 -0.07 -0.18 0.00 0.00 0.00 0.00 60.65 60.43 3n99 s ILE 177 Cb -0.15 -3.15 -0.03 0.00 0.01 0.00 0.00 42.46 39.14 3n99 s ILE 177 CO -0.06 0.36 1.19 -2.84 0.00 0.00 0.00 174.94 173.58 3n99 s PRO 178 N 1.29 2.96 0.30 2.79 0.02 -1.26 0.14 135.00 141.24 3n99 s PRO 178 Ca 0.05 1.77 0.05 0.00 0.02 0.00 0.00 61.00 62.90 3n99 s PRO 178 Cb -0.15 -1.93 0.77 0.00 0.02 0.00 0.00 34.50 33.21 3n99 s PRO 178 CO 0.04 -1.20 1.70 0.00 -0.33 0.00 0.00 177.00 177.22 3n99 h ALA 179 N 0.81 1.52 0.00 -1.55 0.00 -1.88 -0.90 119.26 117.27 3n99 h ALA 179 Ca -0.50 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3n99 h ALA 179 Cb 1.29 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.20 3n99 h ALA 179 CO 0.55 -0.32 0.00 -2.39 0.00 0.00 0.00 179.25 177.08 3n99 n HIS 180 N -5.01 0.00 1.44 0.00 1.44 -1.26 -1.68 115.22 110.15 3n99 n HIS 180 Ca 0.23 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 56.08 3n99 n HIS 180 Cb 0.68 -0.50 0.49 0.00 0.12 0.00 0.00 29.99 30.77 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 -1.50 1.71 -3.46 -1.40 2.00 -0.34 -4.87 117.12 109.26 3n99 n MET 181 Ca 0.05 -1.04 -0.38 0.00 0.00 0.00 0.00 57.70 56.33 3n99 n MET 181 Cb 0.24 -1.47 -0.06 0.00 0.00 0.00 0.00 33.22 31.92 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 -1.97 3.97 0.00 0.03 -1.94 -0.68 0.69 119.30 119.39 3n99 s MET 182 Ca 0.37 0.47 0.00 0.00 -1.71 0.00 0.00 55.69 54.82 3n99 s MET 182 Cb 0.21 -3.22 0.00 0.00 2.01 0.00 0.00 34.83 33.83 3n99 s MET 182 CO 0.33 0.68 0.00 0.41 -0.01 0.00 0.00 175.02 176.43 3n99 n GLY 183 N 1.78 3.36 3.66 -0.03 0.00 -0.14 -4.83 105.19 109.00 3n99 n GLY 183 Ca -0.13 -0.43 -0.52 0.00 0.00 0.00 0.00 46.02 44.94 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 2.45 0.00 1.61 2.88 -0.43 -1.82 113.62 118.30 3n99 n SER 184 Ca 0.00 1.07 0.00 0.00 -1.33 0.00 0.00 58.87 58.61 3n99 n SER 184 Cb 0.00 -1.24 0.00 0.00 -0.75 0.00 0.00 64.21 62.22 3n99 n SER 184 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3n99 n GLY 185 N 3.57 2.31 3.63 0.46 0.00 -1.26 -1.46 105.19 112.45 3n99 n GLY 185 Ca 0.22 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.52 0.61 0.00 -0.61 5.41 -0.76 -1.44 119.36 122.05 3n99 n ILE 186 Ca 0.00 -0.15 0.00 0.00 1.00 0.00 0.00 62.75 63.60 3n99 n ILE 186 Cb 0.00 -1.22 0.00 0.00 -0.71 0.00 0.00 39.64 37.71 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 0.72 3.61 7.39 0.00 0.34 -5.00 105.19 114.67 3n99 n GLY 187 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.62 0.16 -0.23 4.61 0.00 -0.52 -4.72 120.51 118.19 3n99 n ALA 188 Ca 0.00 0.11 -0.04 0.00 0.00 0.00 0.00 53.44 53.51 3n99 n ALA 188 Cb 0.00 -2.09 0.07 0.00 0.00 0.00 0.00 19.45 17.43 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 1.02 0.68 -3.46 0.00 0.87 -1.93 -2.16 113.55 108.58 3n99 h SER 189 Ca -0.47 -0.00 -0.39 0.00 -1.23 0.00 0.00 61.79 59.71 3n99 h SER 189 Cb 1.35 -0.15 -0.34 0.00 -0.44 0.00 0.00 62.40 62.82 3n99 h SER 189 CO 0.54 0.48 -0.76 -0.55 -0.53 0.00 0.00 176.83 176.00 3n99 s SER 190 N -5.72 0.81 0.23 6.23 0.15 -1.26 -3.54 113.70 110.60 3n99 s SER 190 Ca -0.13 -0.09 0.15 0.00 0.70 0.00 0.00 55.95 56.59 3n99 s SER 190 Cb 0.15 -0.36 0.82 0.00 -1.71 0.00 0.00 66.02 64.92 3n99 s SER 190 CO 0.76 -0.08 1.45 -1.54 1.20 0.00 0.00 173.24 175.03 3n99 n SER 191 N 4.17 0.39 0.04 5.45 3.41 0.35 -2.38 113.62 125.06 3n99 n SER 191 Ca -0.24 0.67 0.13 0.00 -0.26 0.00 0.00 58.87 59.17 3n99 n SER 191 Cb 0.51 -0.71 0.52 0.00 -0.26 0.00 0.00 64.21 64.26 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 -1.68 2.24 -1.16 7.33 0.00 -1.26 -4.01 120.51 121.97 3n99 n ALA 192 Ca -0.01 -0.06 0.03 0.00 0.00 0.00 0.00 53.44 53.40 3n99 n ALA 192 Cb 0.05 -1.45 0.04 0.00 0.00 0.00 0.00 19.45 18.09 3n99 n ALA 192 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3n99 n SER 193 N -1.80 1.06 -3.79 0.00 3.41 -1.00 -4.15 113.62 107.36 3n99 n SER 193 Ca 0.06 -2.13 -0.08 0.00 -0.26 0.00 0.00 58.87 56.46 3n99 n SER 193 Cb 0.36 -0.19 -0.02 0.00 -0.26 0.00 0.00 64.21 64.09 3n99 n SER 193 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3n99 s THR 194 N -1.04 0.00 0.50 6.66 -1.32 -1.25 -4.59 115.64 114.60 3n99 s THR 194 Ca 0.10 -0.84 0.08 0.00 -1.21 0.00 0.00 61.69 59.82 3n99 s THR 194 Cb 0.08 -1.83 0.04 0.00 -1.51 0.00 0.00 72.50 69.28 3n99 s THR 194 CO 0.01 -0.00 0.60 1.51 -2.21 0.00 0.00 174.62 174.53 3n99 s ASP 195 N -2.89 5.20 0.07 8.08 -4.77 -1.26 -4.68 116.67 116.42 3n99 s ASP 195 Ca 0.10 -0.75 -0.10 0.00 -3.30 0.00 0.00 52.55 48.49 3n99 s ASP 195 Cb -0.05 -0.13 0.00 0.00 -1.09 0.00 0.00 42.92 41.66 3n99 s ASP 195 CO 0.03 -1.01 0.22 -0.72 0.70 0.00 0.00 175.17 174.39 3n99 s TYR 196 N -2.55 0.06 -0.08 2.11 1.13 -0.31 -4.68 117.35 113.03 3n99 s TYR 196 Ca 0.54 -0.37 -0.12 0.00 -1.41 0.00 0.00 57.07 55.70 3n99 s TYR 196 Cb -0.06 -0.01 -0.05 0.00 -1.10 0.00 0.00 41.96 40.74 3n99 s TYR 196 CO 0.33 -0.50 0.30 -0.51 -2.51 0.00 0.00 175.55 172.66 3n99 s ASP 197 N -2.46 6.59 -0.43 -0.18 1.11 -0.53 0.33 116.67 121.09 3n99 s ASP 197 Ca -0.00 0.70 -0.27 0.00 0.18 0.00 0.00 52.55 53.15 3n99 s ASP 197 Cb 0.02 -2.18 0.02 0.00 1.07 0.00 0.00 42.92 41.85 3n99 s ASP 197 CO -0.07 0.28 1.02 -0.63 1.18 0.00 0.00 175.17 176.94 3n99 s ILE 198 N -0.58 4.41 -0.38 0.77 1.01 -0.41 -0.96 121.20 125.07 3n99 s ILE 198 Ca 0.19 1.14 -0.01 0.00 0.00 0.00 0.00 60.65 61.97 3n99 s ILE 198 Cb -0.14 -4.47 0.24 0.00 0.01 0.00 0.00 42.46 38.10 3n99 s ILE 198 CO 0.08 -0.78 2.08 1.15 0.00 0.00 0.00 174.94 177.47 3n99 n MET 199 N 7.27 1.98 -2.85 2.79 0.00 0.22 -2.83 117.12 123.69 3n99 n MET 199 Ca 0.09 -1.88 -0.42 0.00 0.00 0.00 0.00 57.70 55.50 3n99 n MET 199 Cb 0.48 -1.75 -0.04 0.00 0.00 0.00 0.00 33.22 31.91 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 -2.11 3.50 0.23 3.17 0.00 -1.26 -4.82 121.76 120.47 3n99 s ALA 200 Ca 0.38 0.10 0.19 0.00 0.00 0.00 0.00 51.96 52.63 3n99 s ALA 200 Cb 0.29 -3.27 0.76 0.00 0.00 0.00 0.00 23.12 20.90 3n99 s ALA 200 CO -0.02 -0.64 1.78 0.77 0.00 0.00 0.00 175.76 177.64 3n99 h SER 201 N 7.28 0.00 -3.89 0.00 0.02 -1.90 -3.45 113.55 111.62 3n99 h SER 201 Ca -0.29 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.37 3n99 h SER 201 Cb 1.13 0.00 -0.28 0.00 0.14 0.00 0.00 62.40 63.39 3n99 h SER 201 CO 0.84 0.35 -0.74 0.20 -1.14 0.00 0.00 176.83 176.35 3n99 s ASN 202 N -6.48 0.36 0.45 3.07 0.02 -1.26 -5.01 114.94 106.08 3n99 s ASN 202 Ca -0.01 -0.08 0.19 0.00 -1.02 0.00 0.00 52.86 51.95 3n99 s ASN 202 Cb 0.12 -0.03 1.15 0.00 0.02 0.00 0.00 41.25 42.50 3n99 s ASN 202 CO 0.68 0.02 1.90 1.55 0.02 0.00 0.00 177.10 181.27 3n99 h PRO 203 N 5.99 0.31 -0.65 -0.60 0.14 -1.86 0.92 132.00 136.25 3n99 h PRO 203 Ca -0.27 -0.02 0.07 0.00 0.14 0.00 0.00 66.00 65.92 3n99 h PRO 203 Cb 1.20 -0.07 -0.04 0.00 0.14 0.00 0.00 31.00 32.23 3n99 h PRO 203 CO 0.50 0.21 0.43 0.93 0.14 0.00 0.00 178.00 180.21 3n99 h GLU 204 N 0.32 0.61 0.00 0.86 3.07 -1.82 0.30 114.58 117.93 3n99 h GLU 204 Ca 0.40 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 59.23 3n99 h GLU 204 Cb 1.08 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 28.86 3n99 h GLU 204 CO -0.12 0.40 0.20 -0.44 -1.40 0.00 0.00 179.01 177.66 3n99 h ASP 205 N 0.63 0.00 -0.48 1.42 3.32 -1.12 0.71 116.42 120.90 3n99 h ASP 205 Ca 0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.34 3n99 h ASP 205 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 3n99 h ASP 205 CO -0.09 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.61 3n99 n LEU 206 N -2.96 3.59 -1.55 1.55 4.77 0.11 -4.97 117.00 117.53 3n99 n LEU 206 Ca -0.02 -2.19 -0.14 0.00 -0.03 0.00 0.00 56.01 53.63 3n99 n LEU 206 Cb 0.26 -0.39 -0.01 0.00 -2.33 0.00 0.00 43.42 40.95 3n99 n LEU 206 CO 0.16 0.80 -0.18 0.61 -1.33 0.00 0.00 177.39 177.45 3n99 n GLY 207 N 0.77 -0.05 3.23 -0.72 0.00 0.24 -4.83 105.19 103.83 3n99 n GLY 207 Ca 0.18 -0.30 -0.13 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.68 1.06 0.05 1.61 -7.23 -1.15 -5.01 120.40 107.05 3n99 s VAL 208 Ca 0.00 -2.03 0.11 0.00 -1.81 0.00 0.00 61.98 58.24 3n99 s VAL 208 Cb 0.00 -1.83 -0.08 0.00 0.56 0.00 0.00 36.38 35.03 3n99 s VAL 208 CO 0.00 -0.76 1.39 0.00 -0.31 0.00 0.00 175.10 175.42 3n99 h ALA 209 N 2.81 0.55 -2.71 1.32 0.00 -1.96 -2.92 119.26 116.36 3n99 h ALA 209 Ca -0.36 -0.70 -0.06 0.00 0.00 0.00 0.00 54.91 53.79 3n99 h ALA 209 Cb 1.19 -0.12 -0.12 0.00 0.00 0.00 0.00 17.79 18.73 3n99 h ALA 209 CO 0.64 0.96 -0.17 0.34 0.00 0.00 0.00 179.25 181.01 3n99 s ASP 210 N -6.62 -0.10 -0.02 0.00 2.15 -1.26 -4.80 116.67 106.02 3n99 s ASP 210 Ca 0.02 -0.60 -0.00 0.00 0.43 0.00 0.00 52.55 52.40 3n99 s ASP 210 Cb 0.09 0.47 0.03 0.00 -0.30 0.00 0.00 42.92 43.21 3n99 s ASP 210 CO 0.78 -0.90 0.03 -0.22 -0.17 0.00 0.00 175.17 174.69 3n99 s LEU 211 N -2.89 0.94 0.09 -1.34 2.96 -1.26 -5.00 118.68 112.18 3n99 s LEU 211 Ca 0.10 0.04 0.05 0.00 -0.22 0.00 0.00 54.13 54.09 3n99 s LEU 211 Cb 0.02 -0.09 -0.04 0.00 0.50 0.00 0.00 46.19 46.58 3n99 s LEU 211 CO -0.05 -0.15 -0.01 -0.54 -1.32 0.00 0.00 176.35 174.28 3n99 s LYS 212 N 1.24 2.52 0.16 1.98 1.02 -1.26 -0.36 119.74 125.03 3n99 s LYS 212 Ca -0.07 -0.84 -0.33 0.00 0.02 0.00 0.00 55.97 54.75 3n99 s LYS 212 Cb -0.13 -2.52 -0.12 0.00 -0.52 0.00 0.00 37.83 34.54 3n99 s LYS 212 CO -0.03 0.54 1.71 1.28 -0.92 0.00 0.00 175.35 177.94 3n99 n LEU 213 N 0.64 3.70 0.00 3.17 4.77 0.18 -1.02 117.00 128.44 3n99 n LEU 213 Ca -0.11 1.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.91 3n99 n LEU 213 Cb 0.52 -1.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.10 3n99 n LEU 213 CO 0.38 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 3n99 n GLY 214 N 3.88 0.15 3.78 -0.72 0.00 0.14 -0.65 105.19 111.76 3n99 n GLY 214 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.06 5.92 -0.21 1.61 1.01 -0.19 -1.46 116.67 121.30 3n99 s ASP 215 Ca 0.00 2.14 -0.11 0.00 0.71 0.00 0.00 52.55 55.29 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 -1.08 0.19 -0.63 0.21 0.00 0.00 175.17 173.86 3n99 s ILE 216 N -1.78 5.36 0.17 0.77 1.01 0.17 -0.59 121.20 126.30 3n99 s ILE 216 Ca 0.70 0.28 0.05 0.00 0.00 0.00 0.00 60.65 61.68 3n99 s ILE 216 Cb -0.23 -3.53 -0.05 0.00 0.01 0.00 0.00 42.46 38.67 3n99 s ILE 216 CO 0.26 0.38 -0.10 0.68 0.00 0.00 0.00 174.94 176.16 3n99 s VAL 217 N 0.73 1.30 0.02 2.92 -7.23 0.12 -1.62 120.40 116.64 3n99 s VAL 217 Ca 0.10 -2.10 0.00 0.00 -1.81 0.00 0.00 61.98 58.18 3n99 s VAL 217 Cb -0.13 -1.94 -0.04 0.00 0.56 0.00 0.00 36.38 34.83 3n99 s VAL 217 CO 0.02 -0.67 0.11 0.00 -0.31 0.00 0.00 175.10 174.25 3n99 s ALA 218 N -3.25 3.68 -0.21 1.32 0.00 -0.71 -0.24 121.76 122.35 3n99 s ALA 218 Ca 0.19 -0.89 0.01 0.00 0.00 0.00 0.00 51.96 51.27 3n99 s ALA 218 Cb 0.02 -1.61 0.03 0.00 0.00 0.00 0.00 23.12 21.56 3n99 s ALA 218 CO 0.03 0.73 -0.16 0.42 0.00 0.00 0.00 175.76 176.78 3n99 s ILE 219 N -1.29 2.26 0.19 0.00 1.01 -0.01 -0.66 121.20 122.70 3n99 s ILE 219 Ca 0.26 -1.06 -0.29 0.00 0.00 0.00 0.00 60.65 59.56 3n99 s ILE 219 Cb -0.12 -2.06 -0.08 0.00 0.01 0.00 0.00 42.46 40.21 3n99 s ILE 219 CO 0.18 0.38 0.91 -1.10 0.00 0.00 0.00 174.94 175.31 3n99 s GLN 220 N 1.27 4.76 -1.33 2.79 -0.21 0.12 -2.09 119.66 124.97 3n99 s GLN 220 Ca 0.02 1.41 0.00 0.00 0.02 0.00 0.00 55.36 56.80 3n99 s GLN 220 Cb -0.15 -3.30 0.00 0.00 1.00 0.00 0.00 33.01 30.56 3n99 s GLN 220 CO -0.10 0.45 0.00 -0.25 -2.12 0.00 0.00 175.29 173.28 3n99 n ASP 221 N 1.83 -4.53 -4.19 5.90 8.00 0.45 -2.89 116.55 121.12 3n99 n ASP 221 Ca -0.02 0.09 -0.31 0.00 0.71 0.00 0.00 54.79 55.26 3n99 n ASP 221 Cb 0.48 -3.58 -0.17 0.00 -0.02 0.00 0.00 41.12 37.83 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 -2.68 2.49 -0.13 1.24 3.76 -1.24 -0.73 115.29 118.00 3n99 s HIS 222 Ca 0.00 -1.06 -0.13 0.00 -0.15 0.00 0.00 55.06 53.72 3n99 s HIS 222 Cb 0.00 -1.68 -0.05 0.00 1.11 0.00 0.00 32.58 31.97 3n99 s HIS 222 CO 0.00 -0.44 0.29 0.34 -0.85 0.00 0.00 174.74 174.07 3n99 s ASP 223 N 0.45 6.48 -0.22 1.40 2.15 0.17 -3.30 116.67 123.80 3n99 s ASP 223 Ca -0.17 0.57 0.14 0.00 0.43 0.00 0.00 52.55 53.52 3n99 s ASP 223 Cb -0.17 -2.18 0.46 0.00 -0.30 0.00 0.00 42.92 40.73 3n99 s ASP 223 CO 0.07 0.18 1.18 0.59 -0.17 0.00 0.00 175.17 177.01 3n99 n ASN 224 N 3.08 2.80 0.02 -0.34 3.02 -1.26 -1.92 115.26 120.67 3n99 n ASN 224 Ca -0.13 -3.16 -0.13 0.00 -0.03 0.00 0.00 54.58 51.13 3n99 n ASN 224 Cb 0.52 -0.41 -0.01 0.00 -0.61 0.00 0.00 39.78 39.27 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 1.80 0.65 0.00 6.41 0.02 -1.95 -3.43 113.55 117.06 3n99 h SER 225 Ca 0.08 -0.43 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 3n99 h SER 225 Cb 1.40 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.74 3n99 h SER 225 CO 0.34 1.19 0.00 -1.22 -1.14 0.00 0.00 176.83 176.00 3n99 n TYR 226 N -3.88 0.00 -1.57 3.45 4.01 -1.26 -4.89 117.16 113.02 3n99 n TYR 226 Ca -0.05 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.39 3n99 n TYR 226 Cb 0.72 0.00 0.12 0.00 -0.31 0.00 0.00 39.34 39.86 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 -0.92 1.59 -0.04 2.72 0.00 -1.23 -0.49 107.32 108.94 3n99 s GLY 227 Ca 0.00 -0.42 -0.21 0.00 0.00 0.00 0.00 44.72 44.09 3n99 s GLY 227 CO 0.00 0.08 0.60 0.14 0.00 0.00 0.00 173.10 173.92 3n99 s VAL 228 N -3.26 5.00 -0.14 1.40 1.01 -0.81 -4.48 120.40 119.12 3n99 s VAL 228 Ca 0.63 1.24 -0.00 0.00 0.00 0.00 0.00 61.98 63.84 3n99 s VAL 228 Cb -0.14 -3.94 0.00 0.00 0.00 0.00 0.00 36.38 32.30 3n99 s VAL 228 CO 0.53 0.35 0.06 0.61 0.00 0.00 0.00 175.10 176.66 3n99 n GLY 229 N 2.79 0.60 3.62 4.51 0.00 -1.24 -0.51 105.19 114.96 3n99 n GLY 229 Ca -0.05 -0.69 -0.43 0.00 0.00 0.00 0.00 46.02 44.85 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 -4.68 3.79 0.04 1.61 2.47 -0.81 -4.80 119.74 117.37 3n99 s LYS 230 Ca 0.03 1.35 -0.31 0.00 -1.56 0.00 0.00 55.97 55.49 3n99 s LYS 230 Cb -0.01 -3.97 -0.07 0.00 -1.46 0.00 0.00 37.83 32.31 3n99 s LYS 230 CO 0.04 -1.29 1.52 -0.47 0.16 0.00 0.00 175.35 175.31 3n99 s TYR 231 N 4.96 2.68 -0.18 4.03 5.04 -1.26 -0.66 117.35 131.96 3n99 s TYR 231 Ca 0.64 0.59 -0.07 0.00 -2.44 0.00 0.00 57.07 55.79 3n99 s TYR 231 Cb -0.19 -3.81 0.08 0.00 0.35 0.00 0.00 41.96 38.39 3n99 s TYR 231 CO 0.27 -3.14 0.39 0.50 -1.34 0.00 0.00 175.55 172.23 3n99 s ARG 232 N 2.40 0.29 -0.07 4.97 3.52 0.09 -4.91 118.95 125.24 3n99 s ARG 232 Ca 0.69 0.96 -0.34 0.00 -0.13 0.00 0.00 55.73 56.91 3n99 s ARG 232 Cb -0.36 0.24 -0.11 0.00 -1.56 0.00 0.00 34.95 33.16 3n99 s ARG 232 CO 0.29 -0.25 1.89 1.17 -0.81 0.00 0.00 175.30 177.59 3n99 n LYS 233 N 5.33 2.26 -0.25 5.12 3.00 -1.26 -1.14 118.16 131.22 3n99 n LYS 233 Ca -0.09 0.83 0.00 0.00 -0.00 0.00 0.00 58.31 59.05 3n99 n LYS 233 Cb 0.50 -2.69 0.00 0.00 0.00 0.00 0.00 35.03 32.84 3n99 n LYS 233 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3n99 n GLY 234 N 4.40 0.92 3.81 3.14 0.00 -1.26 -5.04 105.19 111.16 3n99 n GLY 234 Ca 0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.67 2.77 -0.01 4.61 0.00 -0.29 -0.66 121.76 125.50 3n99 s ALA 235 Ca 0.00 0.32 -0.05 0.00 0.00 0.00 0.00 51.96 52.24 3n99 s ALA 235 Cb 0.00 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.91 3n99 s ALA 235 CO 0.00 -0.81 0.10 0.54 0.00 0.00 0.00 175.76 175.59 3n99 s VAL 236 N -2.56 0.05 0.12 0.00 0.11 -0.30 -0.41 120.40 117.40 3n99 s VAL 236 Ca 0.62 -0.42 0.08 0.00 -2.93 0.00 0.00 61.98 59.33 3n99 s VAL 236 Cb -0.15 -0.29 -0.04 0.00 -1.53 0.00 0.00 36.38 34.38 3n99 s VAL 236 CO 0.39 -0.23 -0.20 -0.44 -3.33 0.00 0.00 175.10 171.29 3n99 s SER 237 N -0.76 2.51 -0.03 3.54 0.01 -0.89 -1.72 113.70 116.37 3n99 s SER 237 Ca -0.08 -0.73 0.05 0.00 1.31 0.00 0.00 55.95 56.49 3n99 s SER 237 Cb -0.05 -0.14 -0.03 0.00 0.21 0.00 0.00 66.02 66.02 3n99 s SER 237 CO 0.01 0.02 -0.16 -0.63 0.41 0.00 0.00 173.24 172.89 3n99 s ILE 238 N -1.41 2.93 0.32 1.44 -1.09 0.56 -0.83 121.20 123.12 3n99 s ILE 238 Ca 0.08 -0.84 -0.05 0.00 -2.23 0.00 0.00 60.65 57.61 3n99 s ILE 238 Cb -0.09 -2.15 0.00 0.00 -1.58 0.00 0.00 42.46 38.64 3n99 s ILE 238 CO 0.05 0.54 0.48 -0.83 -1.23 0.00 0.00 174.94 173.95 3n99 s GLY 239 N -0.86 1.26 -0.05 6.18 0.00 0.66 -0.06 107.32 114.46 3n99 s GLY 239 Ca 0.12 -1.38 0.03 0.00 0.00 0.00 0.00 44.72 43.49 3n99 s GLY 239 CO 0.01 -0.91 -0.13 0.14 0.00 0.00 0.00 173.10 172.21 3n99 s VAL 240 N -3.21 1.19 -0.00 1.40 1.01 -0.25 -0.70 120.40 119.84 3n99 s VAL 240 Ca 0.29 -0.54 -0.30 0.00 0.00 0.00 0.00 61.98 61.43 3n99 s VAL 240 Cb -0.00 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 3n99 s VAL 240 CO 0.18 0.36 1.08 -0.69 0.00 0.00 0.00 175.10 176.03 3n99 s VAL 241 N 0.42 4.51 -0.00 2.92 1.01 0.24 -1.63 120.40 127.87 3n99 s VAL 241 Ca -0.10 1.80 0.00 0.00 0.00 0.00 0.00 61.98 63.68 3n99 s VAL 241 Cb -0.14 -4.15 -0.00 0.00 0.00 0.00 0.00 36.38 32.09 3n99 s VAL 241 CO 0.03 0.10 0.00 1.33 0.00 0.00 0.00 175.10 176.57 3n99 n VAL 242 N 4.09 0.00 -4.07 2.92 0.24 0.10 -0.69 118.33 120.93 3n99 n VAL 242 Ca 0.08 -0.05 -0.10 0.00 -2.04 0.00 0.00 64.34 62.23 3n99 n VAL 242 Cb 0.49 0.54 -0.07 0.00 -1.47 0.00 0.00 33.84 33.33 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 -1.92 0.63 0.91 6.34 -3.43 -1.25 -4.57 115.29 112.01 3n99 s HIS 243 Ca -0.00 -0.95 -0.13 0.00 -0.80 0.00 0.00 55.06 53.19 3n99 s HIS 243 Cb 0.00 -0.07 0.14 0.00 -1.43 0.00 0.00 32.58 31.22 3n99 s HIS 243 CO 0.01 -0.87 1.15 -1.54 -2.00 0.00 0.00 174.74 171.49 3n99 s SER 244 N -3.06 3.49 0.80 7.38 1.04 -0.24 -3.25 113.70 119.85 3n99 s SER 244 Ca 0.28 0.90 -0.14 0.00 0.48 0.00 0.00 55.95 57.47 3n99 s SER 244 Cb 0.02 -1.44 0.03 0.00 0.10 0.00 0.00 66.02 64.73 3n99 s SER 244 CO 0.10 -2.55 0.84 0.00 0.98 0.00 0.00 173.24 172.61 3n99 n ALA 245 N -3.76 -0.91 -2.42 5.32 0.00 0.18 -3.75 120.51 115.17 3n99 n ALA 245 Ca 0.07 -0.33 -0.19 0.00 0.00 0.00 0.00 53.44 52.99 3n99 n ALA 245 Cb 0.59 -2.04 -0.11 0.00 0.00 0.00 0.00 19.45 17.89 3n99 n ALA 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3n99 n VAL 247 N 0.12 0.51 -3.02 0.00 0.24 -1.26 -4.66 118.33 110.26 3n99 n VAL 247 Ca -0.12 -0.47 -0.32 0.00 -2.04 0.00 0.00 64.34 61.39 3n99 n VAL 247 Cb 0.58 -0.24 -0.05 0.00 -1.47 0.00 0.00 33.84 32.66 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 -5.00 6.72 0.15 -1.34 0.01 -1.24 -2.03 113.70 110.98 3n99 s SER 248 Ca 0.01 1.29 -0.34 0.00 1.31 0.00 0.00 55.95 58.22 3n99 s SER 248 Cb 0.11 -2.38 -0.15 0.00 0.21 0.00 0.00 66.02 63.81 3n99 s SER 248 CO 0.78 -0.28 1.47 0.00 0.41 0.00 0.00 173.24 175.62 3n99 n ALA 249 N -0.65 0.53 -0.67 1.44 0.00 -1.26 -1.92 120.51 117.98 3n99 n ALA 249 Ca 0.04 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.94 3n99 n ALA 249 Cb 0.53 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.74 3n99 n ALA 249 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3n99 n GLY 250 N 2.94 0.91 3.69 0.00 0.00 -1.26 -5.01 105.19 106.46 3n99 n GLY 250 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 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 -3.38 2.58 -3.64 1.61 0.09 -0.81 -1.32 115.29 110.43 3n99 s HIS 251 Ca 0.00 -0.57 0.00 0.00 -0.00 0.00 0.00 55.06 54.49 3n99 s HIS 251 Cb 0.00 -1.82 0.00 0.00 -0.00 0.00 0.00 32.58 30.76 3n99 s HIS 251 CO 0.00 0.30 0.00 0.41 -0.00 0.00 0.00 174.74 175.45 3n99 n GLY 252 N -1.12 -1.22 3.69 -2.22 0.00 -1.24 -4.36 105.19 98.72 3n99 n GLY 252 Ca -0.03 -1.09 -0.44 0.00 0.00 0.00 0.00 46.02 44.46 3n99 n GLY 252 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3n99 n PRO 253 N 0.00 2.33 -2.70 1.61 -0.02 -1.13 -4.39 135.00 130.70 3n99 n PRO 253 Ca 0.00 0.84 -0.35 0.00 -2.02 0.00 0.00 63.50 61.97 3n99 n PRO 253 Cb 0.00 -2.58 -0.06 0.00 -0.02 0.00 0.00 33.50 30.84 3n99 n PRO 253 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3n99 s GLY 254 N 0.66 2.58 -0.08 -1.23 0.00 -1.20 -1.28 107.32 106.77 3n99 s GLY 254 Ca 0.72 0.53 0.03 0.00 0.00 0.00 0.00 44.72 46.00 3n99 s GLY 254 CO 0.43 0.89 -0.18 0.14 0.00 0.00 0.00 173.10 174.38 3n99 s VAL 255 N -1.90 1.60 -0.24 1.40 1.01 0.15 0.02 120.40 122.43 3n99 s VAL 255 Ca 0.60 -0.76 -0.10 0.00 0.00 0.00 0.00 61.98 61.72 3n99 s VAL 255 Cb -0.15 -1.40 -0.05 0.00 0.00 0.00 0.00 36.38 34.78 3n99 s VAL 255 CO 0.20 0.46 0.14 -0.69 0.00 0.00 0.00 175.10 175.20 3n99 s VAL 256 N 0.44 5.09 0.24 2.92 1.01 -0.64 -1.17 120.40 128.29 3n99 s VAL 256 Ca -0.15 0.09 -0.30 0.00 0.00 0.00 0.00 61.98 61.62 3n99 s VAL 256 Cb -0.16 -3.37 -0.09 0.00 0.00 0.00 0.00 36.38 32.75 3n99 s VAL 256 CO 0.06 0.34 1.11 -0.69 0.00 0.00 0.00 175.10 175.92 3n99 s VAL 257 N 1.22 3.59 0.00 2.92 1.01 -1.26 -1.09 120.40 126.80 3n99 s VAL 257 Ca 0.06 1.50 0.00 0.00 0.00 0.00 0.00 61.98 63.55 3n99 s VAL 257 Cb -0.14 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.28 3n99 s VAL 257 CO 0.05 0.32 0.00 2.30 0.00 0.00 0.00 175.10 177.77 3n99 n ILE 258 N 1.65 0.00 -3.65 2.22 -5.35 0.91 -4.49 119.36 110.66 3n99 n ILE 258 Ca 0.00 -0.32 -0.15 0.00 -0.27 0.00 0.00 62.75 62.02 3n99 n ILE 258 Cb 0.45 0.83 -0.08 0.00 -1.74 0.00 0.00 39.64 39.10 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 -1.21 0.80 -0.05 6.28 0.00 -1.04 -1.83 119.30 122.25 3n99 s MET 259 Ca 0.00 0.37 -0.19 0.00 0.00 0.00 0.00 55.69 55.87 3n99 s MET 259 Cb 0.00 0.38 0.04 0.00 0.00 0.00 0.00 34.83 35.25 3n99 s MET 259 CO 0.00 -0.19 0.43 -0.08 0.00 0.00 0.00 175.02 175.18 3n99 s THR 260 N -0.60 0.03 -2.48 10.11 -1.32 0.04 -0.32 115.64 121.10 3n99 s THR 260 Ca -0.07 -0.26 0.00 0.00 -1.21 0.00 0.00 61.69 60.15 3n99 s THR 260 Cb -0.03 -0.72 0.00 0.00 -1.51 0.00 0.00 72.50 70.24 3n99 s THR 260 CO 0.05 -0.14 0.00 0.61 -2.21 0.00 0.00 174.62 172.92 3n99 n GLY 261 N 1.49 -0.66 3.77 6.08 0.00 -0.70 -0.98 105.19 114.20 3n99 n GLY 261 Ca -0.19 -0.51 -0.31 0.00 0.00 0.00 0.00 46.02 45.01 3n99 n GLY 261 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3n99 s ASP 262 N -4.00 5.53 0.51 1.61 -1.08 -1.26 -1.15 116.67 116.83 3n99 s ASP 262 Ca 0.00 -0.01 0.34 0.00 -0.52 0.00 0.00 52.55 52.37 3n99 s ASP 262 Cb 0.00 -1.49 1.70 0.00 -1.46 0.00 0.00 42.92 41.67 3n99 s ASP 262 CO 0.00 0.17 2.04 1.05 0.52 0.00 0.00 175.17 178.95 3n99 h GLU 263 N 3.32 0.00 0.00 4.34 4.11 -1.11 0.48 114.58 125.71 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 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 3n99 h GLU 263 CO 0.66 0.00 0.00 -1.13 0.07 0.00 0.00 179.01 178.61 3n99 n SER 264 N -2.81 0.66 -0.04 3.06 3.41 -1.26 -4.02 113.62 112.63 3n99 n SER 264 Ca -0.01 0.59 -0.05 0.00 -0.26 0.00 0.00 58.87 59.14 3n99 n SER 264 Cb 0.15 -0.76 -0.06 0.00 -0.26 0.00 0.00 64.21 63.28 3n99 n SER 264 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3n99 n LYS 265 N -2.15 2.10 -3.85 4.33 4.76 -0.09 -4.89 118.16 118.36 3n99 n LYS 265 Ca 0.05 0.01 -0.36 0.00 -2.87 0.00 0.00 58.31 55.14 3n99 n LYS 265 Cb 0.36 -1.21 -0.13 0.00 -1.84 0.00 0.00 35.03 32.20 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 -2.20 3.72 -0.42 -0.18 1.01 -0.03 -1.07 121.20 122.02 3n99 s ILE 266 Ca -0.06 -0.37 0.01 0.00 0.00 0.00 0.00 60.65 60.22 3n99 s ILE 266 Cb 0.03 -2.71 0.11 0.00 0.01 0.00 0.00 42.46 39.90 3n99 s ILE 266 CO 0.32 0.39 0.18 -0.76 0.00 0.00 0.00 174.94 175.07 3n99 s LEU 267 N 1.52 4.95 0.21 2.97 1.02 0.86 -4.47 118.68 125.74 3n99 s LEU 267 Ca 0.06 -2.30 -0.30 0.00 0.02 0.00 0.00 54.13 51.61 3n99 s LEU 267 Cb -0.15 -1.73 -0.09 0.00 0.02 0.00 0.00 46.19 44.25 3n99 s LEU 267 CO -0.01 -0.42 1.20 -2.84 0.02 0.00 0.00 176.35 174.31 3n99 s PRO 268 N 0.73 4.49 -0.23 1.29 0.02 -1.26 -1.19 135.00 138.84 3n99 s PRO 268 Ca 0.11 1.91 -0.03 0.00 0.02 0.00 0.00 61.00 63.01 3n99 s PRO 268 Cb -0.21 -3.21 0.00 0.00 0.02 0.00 0.00 34.50 31.09 3n99 s PRO 268 CO -0.05 -0.07 -0.04 -1.21 -0.33 0.00 0.00 177.00 175.30 3n99 s GLU 269 N -0.52 3.25 0.10 5.54 0.41 0.19 -4.84 118.70 122.83 3n99 s GLU 269 Ca 0.52 -0.71 -0.31 0.00 -0.41 0.00 0.00 54.97 54.06 3n99 s GLU 269 Cb -0.34 -3.01 -0.08 0.00 -1.78 0.00 0.00 34.13 28.92 3n99 s GLU 269 CO 0.39 -0.25 1.40 -2.00 -0.49 0.00 0.00 175.26 174.30 3n99 s GLU 270 N 1.45 4.31 0.24 1.61 2.12 -1.26 -1.35 118.70 125.82 3n99 s GLU 270 Ca 0.05 2.08 0.01 0.00 0.36 0.00 0.00 54.97 57.46 3n99 s GLU 270 Cb -0.15 -3.28 -0.05 0.00 0.26 0.00 0.00 34.13 30.91 3n99 s GLU 270 CO -0.04 -0.46 0.08 0.14 -0.54 0.00 0.00 175.26 174.45 3n99 s VAL 271 N 1.25 0.54 0.11 3.70 -7.23 0.40 -4.88 120.40 114.29 3n99 s VAL 271 Ca 0.65 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.76 3n99 s VAL 271 Cb -0.37 -2.54 -0.21 0.00 0.56 0.00 0.00 36.38 33.83 3n99 s VAL 271 CO 0.30 -0.09 1.25 -0.33 -0.31 0.00 0.00 175.10 175.92 3n99 h GLU 272 N 2.46 0.44 -4.07 4.82 5.08 -1.93 -3.38 114.58 117.99 3n99 h GLU 272 Ca -0.38 -0.51 -0.46 0.00 -1.00 0.00 0.00 59.36 57.01 3n99 h GLU 272 Cb 1.24 0.16 -0.36 0.00 0.50 0.00 0.00 28.75 30.29 3n99 h GLU 272 CO 0.61 1.17 -0.78 0.50 -1.00 0.00 0.00 179.01 179.50 3n99 s ARG 273 N -3.15 1.07 -0.36 2.33 3.52 -1.26 -4.95 118.95 116.14 3n99 s ARG 273 Ca -0.06 -0.13 0.04 0.00 -0.13 0.00 0.00 55.73 55.44 3n99 s ARG 273 Cb 0.08 -1.13 0.16 0.00 -1.56 0.00 0.00 34.95 32.50 3n99 s ARG 273 CO 0.88 -0.16 0.42 0.00 -0.81 0.00 0.00 175.30 175.63 3n99 s ALA 274 N 1.32 -0.84 -0.06 6.12 0.00 -1.26 -4.94 121.76 122.10 3n99 s ALA 274 Ca -0.04 -0.59 -0.02 0.00 0.00 0.00 0.00 51.96 51.31 3n99 s ALA 274 Cb -0.14 -2.15 0.04 0.00 0.00 0.00 0.00 23.12 20.87 3n99 s ALA 274 CO -0.03 -2.07 0.13 1.21 0.00 0.00 0.00 175.76 175.00 3n99 s ASN 275 N 1.71 0.07 0.49 0.00 3.84 -1.26 -0.65 114.94 119.14 3n99 s ASN 275 Ca 0.15 0.26 0.33 0.00 0.21 0.00 0.00 52.86 53.82 3n99 s ASN 275 Cb -0.13 0.15 1.70 0.00 -0.55 0.00 0.00 41.25 42.42 3n99 s ASN 275 CO -0.09 -0.16 2.01 0.16 -2.79 0.00 0.00 177.10 176.22 3n99 h ILE 276 N 6.16 0.00 0.00 -5.21 3.07 -1.59 -2.00 117.51 117.93 3n99 h ILE 276 Ca -0.38 -0.10 -0.03 0.00 1.55 0.00 0.00 64.86 65.89 3n99 h ILE 276 Cb 1.13 0.90 -0.00 0.00 -0.27 0.00 0.00 36.82 38.58 3n99 h ILE 276 CO 0.38 0.00 -0.15 0.77 -1.05 0.00 0.00 178.15 178.10 3n99 h SER 277 N 0.00 0.00 0.32 2.16 4.64 -1.90 -1.03 113.55 117.74 3n99 h SER 277 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3n99 h SER 277 Cb 0.12 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3n99 h SER 277 CO 0.00 0.15 -0.03 0.44 -0.87 0.00 0.00 176.83 176.52 3n99 h ASP 278 N 0.00 0.00 -0.23 4.97 3.32 -1.77 -3.23 116.42 119.48 3n99 h ASP 278 Ca -0.00 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.93 3n99 h ASP 278 Cb 0.66 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.14 3n99 h ASP 278 CO 0.02 0.03 -0.21 -1.22 -1.72 0.00 0.00 179.24 176.14 3n99 n TYR 279 N -3.29 0.71 -1.73 4.55 4.01 -0.39 -5.16 117.16 115.86 3n99 n TYR 279 Ca -0.02 -1.54 0.00 0.00 -0.16 0.00 0.00 57.90 56.18 3n99 n TYR 279 Cb 0.16 -0.40 0.00 0.00 -0.31 0.00 0.00 39.34 38.79 3n99 n TYR 279 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68