#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n99 s MET 1 N 0.00 3.63 -0.03 -0.41 1.00 -1.26 -4.98 119.30 117.25 3n99 s MET 1 Ca 0.00 1.29 -0.30 0.00 0.00 0.00 0.00 55.69 56.68 3n99 s MET 1 Cb 0.00 -2.07 -0.04 0.00 0.00 0.00 0.00 34.83 32.72 3n99 s MET 1 CO 0.00 -0.57 1.25 1.03 0.00 0.00 0.00 175.02 176.73 3n99 s ARG 2 N -3.58 4.34 0.16 2.03 0.52 -1.26 -5.00 118.95 116.16 3n99 s ARG 2 Ca 0.66 1.76 0.01 0.00 -0.52 0.00 0.00 55.73 57.63 3n99 s ARG 2 Cb -0.16 -3.54 -0.04 0.00 0.52 0.00 0.00 34.95 31.72 3n99 s ARG 2 CO 0.27 -0.47 0.02 0.95 0.02 0.00 0.00 175.30 176.09 3n99 s THR 3 N 2.17 0.52 -0.16 0.02 -4.23 -1.26 -0.45 115.64 112.24 3n99 s THR 3 Ca 0.58 -1.96 0.01 0.00 -1.18 0.00 0.00 61.69 59.14 3n99 s THR 3 Cb -0.27 -2.10 0.22 0.00 1.34 0.00 0.00 72.50 71.69 3n99 s THR 3 CO 0.24 -0.47 1.39 -0.46 -0.54 0.00 0.00 174.62 174.77 3n99 n ASN 4 N -0.20 3.58 0.09 3.99 6.94 -1.13 -4.69 115.26 123.85 3n99 n ASN 4 Ca -0.06 -2.58 0.13 0.00 -0.02 0.00 0.00 54.58 52.04 3n99 n ASN 4 Cb 0.63 -0.67 0.63 0.00 -2.36 0.00 0.00 39.78 38.01 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 0.45 0.09 0.00 -3.83 2.10 -1.96 -1.08 116.57 112.34 3n99 h LYS 5 Ca 0.22 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.86 3n99 h LYS 5 Cb 1.56 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.87 3n99 h LYS 5 CO 0.40 0.06 0.00 -0.44 -2.00 0.00 0.00 179.45 177.46 3n99 h ASP 6 N 0.09 0.00 0.24 7.07 3.32 -2.03 -2.41 116.42 122.70 3n99 h ASP 6 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 3n99 h ASP 6 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.02 3n99 h ASP 6 CO -0.01 0.00 -0.23 0.54 -1.72 0.00 0.00 179.24 177.82 3n99 n ARG 7 N -2.72 0.87 -2.62 3.56 1.74 -0.41 -4.95 116.66 112.12 3n99 n ARG 7 Ca 0.02 -0.49 -0.34 0.00 -0.77 0.00 0.00 57.85 56.27 3n99 n ARG 7 Cb 0.34 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.25 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 -2.47 3.92 -0.14 0.55 1.43 -0.91 -5.04 118.68 116.02 3n99 s LEU 8 Ca 0.26 1.88 -0.14 0.00 -1.03 0.00 0.00 54.13 55.10 3n99 s LEU 8 Cb 0.19 -4.49 -0.05 0.00 0.03 0.00 0.00 46.19 41.88 3n99 s LEU 8 CO 0.50 -0.62 0.30 -0.69 0.23 0.00 0.00 176.35 176.08 3n99 s VAL 9 N -1.98 5.28 -0.22 -1.59 1.01 -1.26 -5.06 120.40 116.58 3n99 s VAL 9 Ca 0.64 0.58 -0.06 0.00 0.00 0.00 0.00 61.98 63.14 3n99 s VAL 9 Cb -0.15 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.57 3n99 s VAL 9 CO 0.19 0.43 0.02 -0.60 0.00 0.00 0.00 175.10 175.14 3n99 s ARG 10 N 0.17 3.60 0.03 2.72 3.52 -1.26 -4.62 118.95 123.10 3n99 s ARG 10 Ca 0.18 -0.52 0.01 0.00 -0.13 0.00 0.00 55.73 55.27 3n99 s ARG 10 Cb -0.13 -3.17 -0.02 0.00 -1.56 0.00 0.00 34.95 30.07 3n99 s ARG 10 CO 0.05 -0.10 -0.05 -1.50 -0.81 0.00 0.00 175.30 172.89 3n99 s ILE 11 N 1.33 0.30 -0.14 4.11 2.07 -0.80 -4.97 121.20 123.09 3n99 s ILE 11 Ca 0.04 -0.86 -0.29 0.00 -1.41 0.00 0.00 60.65 58.13 3n99 s ILE 11 Cb -0.15 -0.39 -0.03 0.00 0.13 0.00 0.00 42.46 42.03 3n99 s ILE 11 CO 0.02 -0.37 1.39 -0.94 -1.91 0.00 0.00 174.94 173.13 3n99 s SER 12 N -1.30 6.83 -0.21 4.50 1.04 -1.26 -1.11 113.70 122.19 3n99 s SER 12 Ca -0.11 1.84 -0.03 0.00 0.48 0.00 0.00 55.95 58.12 3n99 s SER 12 Cb -0.09 -2.54 -0.01 0.00 0.10 0.00 0.00 66.02 63.49 3n99 s SER 12 CO -0.00 -0.84 -0.05 -0.69 0.98 0.00 0.00 173.24 172.64 3n99 s VAL 13 N 3.75 3.32 -0.00 5.02 1.01 0.07 -4.96 120.40 128.61 3n99 s VAL 13 Ca 0.61 -0.51 -0.01 0.00 0.00 0.00 0.00 61.98 62.07 3n99 s VAL 13 Cb -0.25 -2.50 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 3n99 s VAL 13 CO 0.20 0.44 0.10 0.54 0.00 0.00 0.00 175.10 176.37 3n99 s VAL 14 N 1.37 4.84 0.23 2.92 0.11 -1.26 0.12 120.40 128.73 3n99 s VAL 14 Ca 0.05 -0.38 -0.07 0.00 -2.93 0.00 0.00 61.98 58.64 3n99 s VAL 14 Cb -0.14 -3.23 0.03 0.00 -1.53 0.00 0.00 36.38 31.51 3n99 s VAL 14 CO -0.03 0.33 0.42 0.61 -3.33 0.00 0.00 175.10 173.11 3n99 n GLY 15 N 1.10 1.64 3.11 6.54 0.00 -0.37 -4.65 105.19 112.57 3n99 n GLY 15 Ca -0.12 -1.23 -0.10 0.00 0.00 0.00 0.00 46.02 44.57 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 -2.14 0.56 0.08 1.61 -1.05 0.11 -0.78 118.70 117.10 3n99 s GLU 16 Ca 0.11 -0.71 -0.31 0.00 -0.15 0.00 0.00 54.97 53.91 3n99 s GLU 16 Cb -0.02 0.22 -0.09 0.00 -0.44 0.00 0.00 34.13 33.80 3n99 s GLU 16 CO 0.08 -0.14 1.69 0.42 0.95 0.00 0.00 175.26 178.26 3n99 s ILE 17 N -2.42 2.94 0.40 1.83 1.01 -0.69 -0.19 121.20 124.07 3n99 s ILE 17 Ca -0.07 0.40 -0.17 0.00 0.00 0.00 0.00 60.65 60.81 3n99 s ILE 17 Cb -0.02 -3.26 -0.10 0.00 0.01 0.00 0.00 42.46 39.09 3n99 s ILE 17 CO -0.04 -0.00 0.86 0.00 0.00 0.00 0.00 174.94 175.76 3n99 s ALA 18 N 2.66 3.17 0.76 9.38 0.00 -0.32 -0.84 121.76 136.57 3n99 s ALA 18 Ca 0.75 0.20 -0.11 0.00 0.00 0.00 0.00 51.96 52.80 3n99 s ALA 18 Cb -0.41 -2.97 0.05 0.00 0.00 0.00 0.00 23.12 19.78 3n99 s ALA 18 CO 0.33 0.15 1.08 -1.25 0.00 0.00 0.00 175.76 176.07 3n99 s PRO 19 N -3.26 2.40 0.24 0.00 0.04 -1.26 -1.33 135.00 131.83 3n99 s PRO 19 Ca 0.58 1.01 -0.31 0.00 0.04 0.00 0.00 61.00 62.32 3n99 s PRO 19 Cb -0.10 -1.93 -0.13 0.00 0.04 0.00 0.00 34.50 32.39 3n99 s PRO 19 CO 0.18 -1.49 1.41 0.00 0.04 0.00 0.00 177.00 177.14 3n99 n ALA 20 N -3.40 1.17 -2.37 8.56 0.00 -1.26 -2.37 120.51 120.83 3n99 n ALA 20 Ca 0.08 0.41 -0.29 0.00 0.00 0.00 0.00 53.44 53.64 3n99 n ALA 20 Cb 0.54 -2.28 -0.15 0.00 0.00 0.00 0.00 19.45 17.55 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 -0.41 1.85 -0.18 0.00 1.02 -0.45 -4.88 119.74 116.68 3n99 s LYS 21 Ca 0.68 -0.89 -0.07 0.00 0.02 0.00 0.00 55.97 55.71 3n99 s LYS 21 Cb -0.64 -1.83 0.08 0.00 -0.52 0.00 0.00 37.83 34.91 3n99 s LYS 21 CO 0.50 0.50 0.40 -1.64 -0.92 0.00 0.00 175.35 174.18 3n99 s MET 22 N -0.70 0.33 0.21 1.68 -1.94 -1.26 -3.94 119.30 113.67 3n99 s MET 22 Ca 0.09 0.92 0.25 0.00 -1.71 0.00 0.00 55.69 55.24 3n99 s MET 22 Cb -0.09 0.17 0.54 0.00 2.01 0.00 0.00 34.83 37.46 3n99 s MET 22 CO -0.00 -0.22 1.56 0.00 -0.01 0.00 0.00 175.02 176.34 3n99 h ARG 23 N 7.81 0.00 -2.83 2.03 3.08 -1.99 -3.45 114.38 119.02 3n99 h ARG 23 Ca -0.23 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.71 3n99 h ARG 23 Cb 1.14 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 30.98 3n99 h ARG 23 CO 0.19 0.00 -0.19 0.45 -1.07 0.00 0.00 179.97 179.34 3n99 s SER 24 N -4.67 -0.30 0.54 7.04 0.15 -1.26 -5.03 113.70 110.17 3n99 s SER 24 Ca 0.08 0.28 0.22 0.00 0.70 0.00 0.00 55.95 57.23 3n99 s SER 24 Cb 0.12 0.42 1.47 0.00 -1.71 0.00 0.00 66.02 66.32 3n99 s SER 24 CO 0.66 -0.44 2.17 1.55 1.20 0.00 0.00 173.24 178.38 3n99 h PRO 25 N 3.93 0.00 -6.10 5.44 0.13 -1.97 -3.43 132.00 130.00 3n99 h PRO 25 Ca -0.29 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.25 3n99 h PRO 25 Cb 1.17 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.25 3n99 h PRO 25 CO 0.38 0.03 -0.11 0.71 -0.23 0.00 0.00 178.00 178.78 3n99 s TYR 26 N -4.78 3.75 -0.09 1.56 2.02 -1.26 -4.24 117.35 114.30 3n99 s TYR 26 Ca -0.05 1.13 -0.01 0.00 -0.37 0.00 0.00 57.07 57.77 3n99 s TYR 26 Cb 0.16 -2.42 -0.03 0.00 -0.40 0.00 0.00 41.96 39.27 3n99 s TYR 26 CO 0.62 0.57 -0.02 -1.12 -1.57 0.00 0.00 175.55 174.03 3n99 s SER 27 N -0.93 5.04 -0.24 2.29 0.01 0.34 -4.94 113.70 115.27 3n99 s SER 27 Ca 0.27 0.07 -0.12 0.00 1.31 0.00 0.00 55.95 57.48 3n99 s SER 27 Cb -0.18 -1.44 -0.05 0.00 0.21 0.00 0.00 66.02 64.57 3n99 s SER 27 CO 0.16 0.35 0.23 -0.69 0.41 0.00 0.00 173.24 173.69 3n99 s VAL 28 N -0.70 5.31 0.77 3.43 1.01 -1.26 -1.44 120.40 127.51 3n99 s VAL 28 Ca 0.11 0.31 -0.10 0.00 0.00 0.00 0.00 61.98 62.30 3n99 s VAL 28 Cb -0.12 -3.56 0.07 0.00 0.00 0.00 0.00 36.38 32.78 3n99 s VAL 28 CO 0.02 0.30 1.12 0.42 0.00 0.00 0.00 175.10 176.96 3n99 s THR 29 N 1.27 2.11 0.02 3.92 -4.23 0.14 -3.61 115.64 115.26 3n99 s THR 29 Ca 0.10 -0.11 0.32 0.00 -1.18 0.00 0.00 61.69 60.82 3n99 s THR 29 Cb -0.14 -3.00 0.35 0.00 1.34 0.00 0.00 72.50 71.05 3n99 s THR 29 CO 0.06 0.00 1.95 0.71 -0.54 0.00 0.00 174.62 176.81 3n99 h THR 30 N -0.89 0.00 -0.03 3.99 1.35 -1.62 -1.89 112.91 113.82 3n99 h THR 30 Ca -0.45 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.13 3n99 h THR 30 Cb 1.32 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 3n99 h THR 30 CO 0.63 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 175.28 3n99 n GLU 31 N -2.77 1.44 -1.81 4.72 4.71 -1.26 -4.91 120.64 120.76 3n99 n GLU 31 Ca 0.00 -0.65 -0.09 0.00 -0.01 0.00 0.00 57.16 56.41 3n99 n GLU 31 Cb 0.21 -1.46 -0.02 0.00 -1.01 0.00 0.00 31.44 29.16 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 0.42 3.88 0.62 0.00 -0.71 -5.04 105.19 105.46 3n99 n GLY 32 Ca 0.20 -0.55 -0.21 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.41 3.80 0.05 2.61 -4.23 -1.26 -4.89 115.64 109.31 3n99 s THR 33 Ca 0.00 -1.29 0.05 0.00 -1.18 0.00 0.00 61.69 59.28 3n99 s THR 33 Cb 0.00 -3.28 -0.04 0.00 1.34 0.00 0.00 72.50 70.53 3n99 s THR 33 CO 0.00 -0.19 -0.09 0.68 -0.54 0.00 0.00 174.62 174.47 3n99 s VAL 34 N -2.25 3.45 0.01 2.29 -7.23 -1.26 0.29 120.40 115.69 3n99 s VAL 34 Ca 0.41 -1.04 0.01 0.00 -1.81 0.00 0.00 61.98 59.54 3n99 s VAL 34 Cb -0.07 -2.55 -0.01 0.00 0.56 0.00 0.00 36.38 34.32 3n99 s VAL 34 CO 0.27 0.26 -0.03 -0.13 -0.31 0.00 0.00 175.10 175.16 3n99 s ARG 35 N -1.80 0.23 -0.53 4.82 0.52 -0.52 -4.96 118.95 116.72 3n99 s ARG 35 Ca 0.19 -0.24 -0.16 0.00 -0.52 0.00 0.00 55.73 55.01 3n99 s ARG 35 Cb -0.11 -0.14 0.12 0.00 0.52 0.00 0.00 34.95 35.34 3n99 s ARG 35 CO 0.10 0.03 0.48 0.08 0.02 0.00 0.00 175.30 176.01 3n99 s VAL 36 N -0.42 5.17 0.08 3.52 1.01 -1.26 -0.51 120.40 127.98 3n99 s VAL 36 Ca -0.03 -1.45 0.01 0.00 0.00 0.00 0.00 61.98 60.51 3n99 s VAL 36 Cb -0.03 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 32.02 3n99 s VAL 36 CO -0.00 -0.82 -0.06 0.27 0.00 0.00 0.00 175.10 174.48 3n99 s ILE 37 N 1.60 0.55 0.67 2.22 -4.36 -1.26 -5.05 121.20 115.57 3n99 s ILE 37 Ca 0.03 -1.73 -0.17 0.00 -0.26 0.00 0.00 60.65 58.52 3n99 s ILE 37 Cb -0.29 -1.42 0.01 0.00 1.25 0.00 0.00 42.46 42.01 3n99 s ILE 37 CO 0.03 -0.80 1.25 -2.84 0.24 0.00 0.00 174.94 172.82 3n99 s PRO 38 N -3.39 2.45 0.00 0.37 0.02 -1.26 -4.76 135.00 128.42 3n99 s PRO 38 Ca 0.06 1.91 0.00 0.00 0.02 0.00 0.00 61.00 62.99 3n99 s PRO 38 Cb 0.03 -1.85 0.00 0.00 0.02 0.00 0.00 34.50 32.69 3n99 s PRO 38 CO -0.05 -1.64 0.00 0.28 -0.33 0.00 0.00 177.00 175.26 3n99 n VAL 39 N -2.18 0.00 -3.47 3.83 0.31 -1.26 -0.90 118.33 114.66 3n99 n VAL 39 Ca 0.15 0.00 -0.23 0.00 -0.01 0.00 0.00 64.34 64.25 3n99 n VAL 39 Cb 0.49 0.00 0.02 0.00 -0.91 0.00 0.00 33.84 33.44 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 2.97 0.00 7.52 0.05 -1.25 -4.38 118.68 123.59 3n99 s LEU 40 Ca 0.00 -1.00 0.00 0.00 0.05 0.00 0.00 54.13 53.18 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 -1.14 0.00 0.61 -0.55 0.00 0.00 176.35 175.27 3n99 n GLY 41 N -1.94 -2.51 2.39 -3.48 0.00 -1.26 -1.35 105.19 97.04 3n99 n GLY 41 Ca 0.06 -1.69 0.05 0.00 0.00 0.00 0.00 46.02 44.44 3n99 n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n99 n GLY 42 N -0.35 -2.00 3.55 -0.02 0.00 -0.45 -4.55 105.19 101.37 3n99 n GLY 42 Ca 0.00 -1.36 -0.43 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 -1.05 4.71 -0.44 -0.61 1.01 -1.26 -0.99 121.20 122.57 3n99 s ILE 43 Ca 0.00 0.47 -0.19 0.00 0.00 0.00 0.00 60.65 60.93 3n99 s ILE 43 Cb 0.00 -4.26 0.02 0.00 0.01 0.00 0.00 42.46 38.23 3n99 s ILE 43 CO 0.00 -0.62 0.57 -0.89 0.00 0.00 0.00 174.94 174.01 3n99 s THR 44 N 3.14 4.92 0.16 2.92 2.01 -0.39 -4.95 115.64 123.44 3n99 s THR 44 Ca 0.29 -0.07 0.18 0.00 0.31 0.00 0.00 61.69 62.39 3n99 s THR 44 Cb -0.13 -4.15 0.11 0.00 0.01 0.00 0.00 72.50 68.34 3n99 s THR 44 CO 0.20 -0.55 1.70 1.88 -0.69 0.00 0.00 174.62 177.17 3n99 h TYR 45 N 8.83 0.00 0.00 4.92 0.05 -1.95 -3.34 116.97 125.48 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 0.69 0.41 -0.06 0.27 -1.05 0.00 0.00 178.16 178.42 3n99 n ASN 46 N -3.54 1.70 -3.99 3.88 6.94 -1.26 -4.95 115.26 114.04 3n99 n ASN 46 Ca -0.00 -2.37 -0.26 0.00 -0.02 0.00 0.00 54.58 51.93 3n99 n ASN 46 Cb 0.54 -0.21 -0.17 0.00 -2.36 0.00 0.00 39.78 37.58 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 -1.59 1.14 0.10 3.53 1.01 -1.25 -5.12 120.40 118.21 3n99 s VAL 47 Ca 0.14 -0.44 -0.02 0.00 0.00 0.00 0.00 61.98 61.65 3n99 s VAL 47 Cb 0.12 -1.07 -0.03 0.00 0.00 0.00 0.00 36.38 35.39 3n99 s VAL 47 CO 0.01 0.37 0.05 -1.59 0.00 0.00 0.00 175.10 173.94 3n99 s LYS 48 N 0.99 0.80 0.34 2.72 -2.85 -1.26 -2.16 119.74 118.32 3n99 s LYS 48 Ca -0.08 -1.28 -0.29 0.00 -1.00 0.00 0.00 55.97 53.32 3n99 s LYS 48 Cb -0.15 0.25 -0.12 0.00 -2.06 0.00 0.00 37.83 35.75 3n99 s LYS 48 CO -0.00 -0.21 1.45 1.55 0.10 0.00 0.00 175.35 178.23 3n99 n VAL 49 N -0.01 1.73 0.00 1.79 3.14 -1.26 -1.06 118.33 122.65 3n99 n VAL 49 Ca -0.10 -0.43 0.00 0.00 -2.96 0.00 0.00 64.34 60.85 3n99 n VAL 49 Cb 0.62 -1.82 0.00 0.00 -1.06 0.00 0.00 33.84 31.59 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 1.01 2.91 3.71 7.55 0.00 -0.02 -4.92 105.19 115.44 3n99 n GLY 50 Ca 0.04 -0.19 -0.30 0.00 0.00 0.00 0.00 46.02 45.57 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 0.70 3.55 0.41 1.61 1.01 -0.23 -4.60 116.67 119.12 3n99 s ASP 51 Ca 0.00 1.64 -0.26 0.00 0.71 0.00 0.00 52.55 54.64 3n99 s ASP 51 Cb 0.00 -2.30 -0.10 0.00 1.01 0.00 0.00 42.92 41.53 3n99 s ASP 51 CO 0.00 -2.61 1.43 -0.24 0.21 0.00 0.00 175.17 173.96 3n99 n SER 52 N -3.88 3.39 0.10 0.27 2.88 -1.26 0.09 113.62 115.21 3n99 n SER 52 Ca 0.08 1.16 0.13 0.00 -1.33 0.00 0.00 58.87 58.91 3n99 n SER 52 Cb 0.54 -1.59 0.45 0.00 -0.75 0.00 0.00 64.21 62.86 3n99 n SER 52 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3n99 n ALA 53 N 0.06 2.11 -2.57 -1.46 0.00 -0.13 -4.59 120.51 113.92 3n99 n ALA 53 Ca 0.04 -0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.24 3n99 n ALA 53 Cb 0.40 -1.44 -0.08 0.00 0.00 0.00 0.00 19.45 18.33 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 -3.14 2.62 0.00 0.00 1.51 -1.26 -0.11 117.35 116.97 3n99 s TYR 54 Ca 0.09 -0.33 0.00 0.00 -1.01 0.00 0.00 57.07 55.82 3n99 s TYR 54 Cb 0.12 -1.36 0.00 0.00 -0.11 0.00 0.00 41.96 40.61 3n99 s TYR 54 CO 0.53 0.53 0.00 0.41 -1.11 0.00 0.00 175.55 175.90 3n99 n GLY 55 N -0.94 0.76 3.83 0.71 0.00 -1.26 -5.00 105.19 103.29 3n99 n GLY 55 Ca -0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 3n99 n GLY 55 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3n99 s TRP 56 N -2.77 3.68 -1.34 1.61 0.52 -1.26 -4.99 118.94 114.39 3n99 s TRP 56 Ca 0.00 0.90 -0.17 0.00 0.02 0.00 0.00 56.10 56.86 3n99 s TRP 56 Cb 0.00 -2.27 0.04 0.00 -1.15 0.00 0.00 33.47 30.09 3n99 s TRP 56 CO 0.00 0.59 1.98 0.00 0.02 0.00 0.00 176.95 179.54 3n99 n ALA 57 N 2.09 4.37 -3.54 0.98 0.00 -1.26 -4.81 120.51 118.35 3n99 n ALA 57 Ca -0.14 -3.80 -0.07 0.00 0.00 0.00 0.00 53.44 49.43 3n99 n ALA 57 Cb 0.53 -3.57 -0.02 0.00 0.00 0.00 0.00 19.45 16.38 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 3.90 -0.40 -0.07 0.00 0.00 -1.26 -4.28 107.32 105.21 3n99 s GLY 58 Ca 0.52 1.20 0.05 0.00 0.00 0.00 0.00 44.72 46.49 3n99 s GLY 58 CO 0.01 0.40 -0.23 -0.35 0.00 0.00 0.00 173.10 172.92 3n99 s ASP 59 N -2.39 2.88 -1.48 1.64 2.15 -0.08 -4.74 116.67 114.66 3n99 s ASP 59 Ca 0.07 -0.49 -0.13 0.00 0.43 0.00 0.00 52.55 52.43 3n99 s ASP 59 Cb -0.01 -0.96 0.09 0.00 -0.30 0.00 0.00 42.92 41.75 3n99 s ASP 59 CO -0.07 0.20 0.73 1.41 -0.17 0.00 0.00 175.17 177.26 3n99 n HIS 60 N 3.17 -1.95 -2.19 -5.34 8.25 -1.07 -4.00 115.22 112.08 3n99 n HIS 60 Ca -0.18 0.69 -0.41 0.00 -0.26 0.00 0.00 57.72 57.55 3n99 n HIS 60 Cb 0.52 -3.35 -0.03 0.00 1.12 0.00 0.00 29.99 28.26 3n99 n HIS 60 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3n99 s VAL 61 N -3.14 3.08 -0.26 1.59 1.01 -1.26 -4.19 120.40 117.24 3n99 s VAL 61 Ca 0.56 0.93 -0.09 0.00 0.00 0.00 0.00 61.98 63.38 3n99 s VAL 61 Cb -0.29 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 3n99 s VAL 61 CO 0.69 0.16 0.11 -1.61 0.00 0.00 0.00 175.10 174.45 3n99 s GLU 62 N -0.48 3.78 0.63 2.72 2.02 -1.26 -1.50 118.70 124.61 3n99 s GLU 62 Ca 0.55 -0.41 -0.18 0.00 0.02 0.00 0.00 54.97 54.95 3n99 s GLU 62 Cb -0.37 -3.44 -0.02 0.00 0.10 0.00 0.00 34.13 30.40 3n99 s GLU 62 CO 0.41 -0.16 1.23 -1.25 0.02 0.00 0.00 175.26 175.51 3n99 s PRO 63 N 1.59 2.76 7.80 0.39 0.04 -1.26 -4.54 135.00 141.79 3n99 s PRO 63 Ca 0.06 1.87 0.00 0.00 0.04 0.00 0.00 61.00 62.97 3n99 s PRO 63 Cb -0.15 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.49 3n99 s PRO 63 CO 0.06 -1.38 0.00 0.41 0.04 0.00 0.00 177.00 176.13 3n99 n GLY 64 N 0.56 3.70 3.46 0.56 0.00 -0.92 -4.48 105.19 108.08 3n99 n GLY 64 Ca 0.14 -0.06 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 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 4.07 -0.13 1.61 1.01 -0.21 -1.26 120.40 125.48 3n99 s VAL 65 Ca 0.00 -0.27 -0.17 0.00 0.00 0.00 0.00 61.98 61.54 3n99 s VAL 65 Cb 0.00 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 3n99 s VAL 65 CO 0.00 0.42 0.44 -0.44 0.00 0.00 0.00 175.10 175.51 3n99 s SER 66 N 1.03 6.62 -0.14 3.32 0.01 -0.16 -0.42 113.70 123.96 3n99 s SER 66 Ca 0.02 0.73 0.01 0.00 1.31 0.00 0.00 55.95 58.03 3n99 s SER 66 Cb -0.14 -2.26 -0.00 0.00 0.21 0.00 0.00 66.02 63.82 3n99 s SER 66 CO 0.02 0.01 -0.18 -0.69 0.41 0.00 0.00 173.24 172.81 3n99 s VAL 67 N 0.67 2.53 0.45 3.43 1.01 0.11 -1.17 120.40 127.43 3n99 s VAL 67 Ca 0.24 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.43 3n99 s VAL 67 Cb -0.15 -2.04 -0.05 0.00 0.00 0.00 0.00 36.38 34.15 3n99 s VAL 67 CO 0.09 0.53 0.03 0.00 0.00 0.00 0.00 175.10 175.75 3n99 s MET 68 N 0.61 2.08 0.59 2.72 0.23 0.73 -1.27 119.30 124.98 3n99 s MET 68 Ca -0.10 -2.20 -0.14 0.00 -1.03 0.00 0.00 55.69 52.22 3n99 s MET 68 Cb -0.16 -1.63 -0.05 0.00 -1.53 0.00 0.00 34.83 31.46 3n99 s MET 68 CO 0.03 -0.19 1.02 0.00 -2.03 0.00 0.00 175.02 173.85 3n99 s ALA 69 N -2.77 2.98 0.33 3.16 0.00 -1.26 0.09 121.76 124.28 3n99 s ALA 69 Ca 0.24 0.11 0.06 0.00 0.00 0.00 0.00 51.96 52.37 3n99 s ALA 69 Cb 0.06 -3.13 0.57 0.00 0.00 0.00 0.00 23.12 20.62 3n99 s ALA 69 CO 0.13 -0.61 1.80 0.00 0.00 0.00 0.00 175.76 177.07 3n99 h ARG 70 N 0.19 0.35 -2.86 0.00 3.08 -1.90 -3.43 114.38 109.80 3n99 h ARG 70 Ca -0.45 -0.11 0.08 0.00 0.07 0.00 0.00 59.98 59.56 3n99 h ARG 70 Cb 1.20 -0.03 -0.07 0.00 0.08 0.00 0.00 29.97 31.15 3n99 h ARG 70 CO 0.60 0.55 0.28 -0.98 -1.07 0.00 0.00 179.97 179.36 3n99 s ARG 71 N -4.55 1.59 0.26 0.04 1.70 -1.26 -5.07 118.95 111.65 3n99 s ARG 71 Ca -0.06 -0.85 -0.05 0.00 -0.47 0.00 0.00 55.73 54.31 3n99 s ARG 71 Cb 0.14 0.57 0.29 0.00 -0.57 0.00 0.00 34.95 35.38 3n99 s ARG 71 CO 0.76 -0.73 1.88 -0.22 -1.08 0.00 0.00 175.30 175.92 3n99 h LYS 72 N 2.00 1.16 0.00 3.89 3.64 -2.02 -1.98 116.57 123.26 3n99 h LYS 72 Ca -0.22 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.01 3n99 h LYS 72 Cb 1.25 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 32.84 3n99 h LYS 72 CO 0.26 0.85 -0.07 0.93 -2.27 0.00 0.00 179.45 179.15 3n99 h GLU 73 N 1.17 0.00 -0.20 1.90 3.07 -2.00 -2.02 114.58 116.50 3n99 h GLU 73 Ca 0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.16 3n99 h GLU 73 Cb 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 3n99 h GLU 73 CO -0.05 0.07 0.00 0.39 -1.40 0.00 0.00 179.01 178.02 3n99 n GLU 74 N -4.02 1.60 -0.02 2.33 1.02 -0.75 -4.30 120.64 116.50 3n99 n GLU 74 Ca -0.03 -0.92 -0.13 0.00 -0.02 0.00 0.00 57.16 56.07 3n99 n GLU 74 Cb 0.15 -1.30 -0.11 0.00 -0.02 0.00 0.00 31.44 30.17 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 1.67 -0.03 -0.30 3.49 5.08 -1.44 -2.87 114.58 120.18 3n99 h GLU 75 Ca 0.00 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.43 3n99 h GLU 75 Cb 0.37 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.57 3n99 h GLU 75 CO 0.00 0.63 -0.11 0.82 -1.00 0.00 0.00 179.01 179.35 3n99 h ILE 76 N -0.75 0.61 -0.60 3.13 2.04 -1.78 -0.73 117.51 119.44 3n99 h ILE 76 Ca -0.00 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.79 3n99 h ILE 76 Cb 0.68 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 3n99 h ILE 76 CO 0.01 0.00 0.12 1.55 0.00 0.00 0.00 178.15 179.82 3n99 h PRO 77 N -0.06 0.97 -0.49 2.37 0.13 -1.83 -0.03 132.00 133.06 3n99 h PRO 77 Ca 0.15 -0.25 0.10 0.00 -0.87 0.00 0.00 66.00 65.13 3n99 h PRO 77 Cb 0.29 -0.12 -0.09 0.00 0.13 0.00 0.00 31.00 31.21 3n99 h PRO 77 CO -0.34 0.91 -0.10 1.25 -0.23 0.00 0.00 178.00 179.48 3n99 h LEU 78 N 0.88 -0.42 -0.07 1.56 5.85 -1.22 -1.08 115.31 120.81 3n99 h LEU 78 Ca 0.18 0.14 -0.19 0.00 0.84 0.00 0.00 57.88 58.86 3n99 h LEU 78 Cb 0.39 0.29 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 3n99 h LEU 78 CO 0.01 -0.15 -0.90 0.24 -0.34 0.00 0.00 178.44 177.30 3n99 h MET 79 N 0.02 0.00 0.12 1.25 2.86 -0.96 -3.11 114.93 115.10 3n99 h MET 79 Ca 0.24 0.00 -0.27 0.00 -2.06 0.00 0.00 59.70 57.61 3n99 h MET 79 Cb 0.36 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.02 3n99 h MET 79 CO -0.49 0.90 -1.36 1.15 1.06 0.00 0.00 176.91 178.16 3n99 h THR 80 N 0.00 1.07 0.00 2.22 2.02 -0.79 -3.39 112.91 114.04 3n99 h THR 80 Ca -0.01 -2.42 -0.15 0.00 0.77 0.00 0.00 66.41 64.61 3n99 h THR 80 Cb 1.66 2.76 -0.02 0.00 -1.74 0.00 0.00 68.15 70.80 3n99 h THR 80 CO 0.12 0.71 -1.09 -0.07 0.37 0.00 0.00 175.52 175.55 3n99 h LEU 81 N -0.30 0.00 -9.24 2.58 3.38 -1.32 -3.45 115.31 106.95 3n99 h LEU 81 Ca -0.29 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.13 3n99 h LEU 81 Cb 1.76 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.50 3n99 h LEU 81 CO 0.07 0.57 1.10 -0.44 0.09 0.00 0.00 178.44 179.83 3n99 s SER 82 N -6.04 6.62 0.10 -0.43 0.01 -1.17 -3.98 113.70 108.81 3n99 s SER 82 Ca -0.00 2.19 0.05 0.00 1.31 0.00 0.00 55.95 59.50 3n99 s SER 82 Cb 0.08 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.74 3n99 s SER 82 CO 0.79 -0.97 -0.01 0.00 0.41 0.00 0.00 173.24 173.46 3n99 s ILE 84 N -1.36 2.95 0.00 0.00 1.01 0.32 -1.52 121.20 122.61 3n99 s ILE 84 Ca 0.26 0.33 0.00 0.00 0.00 0.00 0.00 60.65 61.24 3n99 s ILE 84 Cb -0.11 -3.22 0.00 0.00 0.01 0.00 0.00 42.46 39.14 3n99 s ILE 84 CO 0.18 -0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.72 3n99 n GLY 85 N 4.14 2.17 3.70 6.18 0.00 -0.07 -0.87 105.19 120.45 3n99 n GLY 85 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 3n99 n GLY 85 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3n99 n ASN 86 N 0.00 2.06 -4.76 1.61 5.03 -0.57 -4.59 115.26 114.05 3n99 n ASN 86 Ca 0.00 0.92 -0.40 0.00 0.87 0.00 0.00 54.58 55.97 3n99 n ASN 86 Cb 0.00 -1.52 -0.04 0.00 -1.02 0.00 0.00 39.78 37.20 3n99 n ASN 86 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 3n99 s GLU 87 N -2.86 4.64 -0.03 3.52 2.12 -1.26 -1.69 118.70 123.13 3n99 s GLU 87 Ca 0.74 1.80 0.04 0.00 0.36 0.00 0.00 54.97 57.90 3n99 s GLU 87 Cb -0.42 -3.19 -0.00 0.00 0.26 0.00 0.00 34.13 30.77 3n99 s GLU 87 CO 0.48 0.21 -0.15 0.08 -0.54 0.00 0.00 175.26 175.34 3n99 s VAL 88 N -1.11 1.26 -0.08 3.70 1.01 -0.06 -1.21 120.40 123.90 3n99 s VAL 88 Ca 0.45 -0.63 0.02 0.00 0.00 0.00 0.00 61.98 61.81 3n99 s VAL 88 Cb -0.32 -1.09 0.01 0.00 0.00 0.00 0.00 36.38 34.99 3n99 s VAL 88 CO 0.41 0.37 -0.14 -0.63 0.00 0.00 0.00 175.10 175.10 3n99 s ILE 89 N 0.01 1.32 0.07 2.22 1.01 0.40 -0.14 121.20 126.09 3n99 s ILE 89 Ca -0.02 -0.56 -0.30 0.00 0.00 0.00 0.00 60.65 59.76 3n99 s ILE 89 Cb -0.10 -1.21 -0.05 0.00 0.01 0.00 0.00 42.46 41.11 3n99 s ILE 89 CO 0.01 0.40 1.08 -0.69 0.00 0.00 0.00 174.94 175.74 3n99 s VAL 90 N 0.80 4.35 -0.24 2.92 1.01 -0.54 -1.43 120.40 127.26 3n99 s VAL 90 Ca -0.11 1.76 0.02 0.00 0.00 0.00 0.00 61.98 63.65 3n99 s VAL 90 Cb -0.16 -4.13 0.04 0.00 0.00 0.00 0.00 36.38 32.14 3n99 s VAL 90 CO 0.02 0.18 0.81 0.23 0.00 0.00 0.00 175.10 176.34 3n99 n MET 91 N 3.52 1.13 -3.90 2.72 0.00 -0.15 -0.80 117.12 119.63 3n99 n MET 91 Ca 0.06 -1.12 -0.08 0.00 0.00 0.00 0.00 57.70 56.56 3n99 n MET 91 Cb 0.48 -1.05 -0.04 0.00 0.00 0.00 0.00 33.22 32.62 3n99 n MET 91 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 3n99 s SER 92 N -0.59 -0.19 0.11 7.83 1.04 -1.24 -4.82 113.70 115.83 3n99 s SER 92 Ca 0.04 -0.73 0.00 0.00 0.48 0.00 0.00 55.95 55.74 3n99 s SER 92 Cb 0.02 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.79 3n99 s SER 92 CO 0.03 -1.21 0.00 0.61 0.98 0.00 0.00 173.24 173.65 3n99 n GLY 93 N -0.41 -1.80 0.02 7.32 0.00 -1.26 -4.11 105.19 104.95 3n99 n GLY 93 Ca -0.04 -1.35 0.13 0.00 0.00 0.00 0.00 46.02 44.76 3n99 n GLY 93 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3n99 n ASP 94 N 0.35 0.11 -1.12 1.61 8.00 -1.26 -2.35 116.55 121.89 3n99 n ASP 94 Ca 0.00 0.51 0.08 0.00 0.71 0.00 0.00 54.79 56.09 3n99 n ASP 94 Cb 0.00 -0.54 0.27 0.00 -0.02 0.00 0.00 41.12 40.83 3n99 n ASP 94 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3n99 n ALA 95 N -1.54 2.87 -1.67 2.24 0.00 -1.26 -5.01 120.51 116.15 3n99 n ALA 95 Ca 0.06 -1.75 -0.40 0.00 0.00 0.00 0.00 53.44 51.34 3n99 n ALA 95 Cb 0.32 -0.76 0.02 0.00 0.00 0.00 0.00 19.45 19.03 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 0.36 1.59 0.00 0.00 4.81 -0.99 -0.70 118.16 123.23 3n99 n LYS 96 Ca 0.21 0.57 0.00 0.00 -0.87 0.00 0.00 58.31 58.22 3n99 n LYS 96 Cb 0.79 -2.27 0.00 0.00 0.02 0.00 0.00 35.03 33.58 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 0.98 3.07 3.76 3.14 0.00 0.02 -4.99 105.19 111.16 3n99 n GLY 97 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.11 5.51 -0.00 1.61 0.01 0.13 -4.76 113.70 115.09 3n99 s SER 98 Ca 0.00 2.72 0.08 0.00 1.31 0.00 0.00 55.95 60.07 3n99 s SER 98 Cb 0.00 -2.63 -0.02 0.00 0.21 0.00 0.00 66.02 63.57 3n99 s SER 98 CO 0.00 -1.40 -0.25 -0.13 0.41 0.00 0.00 173.24 171.86 3n99 s ARG 99 N -2.79 2.05 0.00 12.44 0.52 -1.26 -1.46 118.95 128.44 3n99 s ARG 99 Ca 0.68 -0.97 0.00 0.00 -0.52 0.00 0.00 55.73 54.93 3n99 s ARG 99 Cb -0.39 -2.05 0.00 0.00 0.52 0.00 0.00 34.95 33.03 3n99 s ARG 99 CO 0.47 0.55 0.00 0.41 0.02 0.00 0.00 175.30 176.75 3n99 n GLY 100 N 2.23 4.48 3.26 -3.53 0.00 0.81 -4.63 105.19 107.80 3n99 n GLY 100 Ca -0.16 -1.29 -0.12 0.00 0.00 0.00 0.00 46.02 44.45 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 -1.83 -0.12 0.12 1.61 -0.71 -0.19 -0.88 117.98 115.96 3n99 s PHE 101 Ca 0.00 0.01 -0.30 0.00 -1.04 0.00 0.00 56.93 55.59 3n99 s PHE 101 Cb 0.00 0.11 -0.07 0.00 -1.21 0.00 0.00 43.02 41.85 3n99 s PHE 101 CO 0.00 -0.50 1.19 0.08 -1.34 0.00 0.00 175.22 174.64 3n99 s VAL 102 N -2.48 3.85 -0.19 -2.49 1.01 -0.68 -0.24 120.40 119.17 3n99 s VAL 102 Ca -0.05 1.43 0.14 0.00 0.00 0.00 0.00 61.98 63.50 3n99 s VAL 102 Cb -0.01 -3.92 -0.20 0.00 0.00 0.00 0.00 36.38 32.25 3n99 s VAL 102 CO -0.03 0.17 0.39 0.35 0.00 0.00 0.00 175.10 175.98 3n99 n THR 103 N 3.25 0.00 -2.93 3.92 -2.24 0.82 -0.89 114.28 116.22 3n99 n THR 103 Ca 0.07 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 3n99 n THR 103 Cb 0.46 0.40 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 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 1.59 -1.30 3.50 3.38 0.00 -1.17 -4.83 105.19 106.36 3n99 n GLY 104 Ca -0.01 -0.92 -0.17 0.00 0.00 0.00 0.00 46.02 44.91 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 -0.64 1.08 -0.12 1.61 -2.85 -1.26 -0.62 119.74 116.93 3n99 s LYS 105 Ca 0.00 0.16 -0.02 0.00 -1.00 0.00 0.00 55.97 55.11 3n99 s LYS 105 Cb 0.00 0.51 0.04 0.00 -2.06 0.00 0.00 37.83 36.32 3n99 s LYS 105 CO 0.00 -0.35 0.02 -1.58 0.10 0.00 0.00 175.35 173.53 3n99 s HIS 106 N -1.51 0.80 0.67 1.78 2.46 0.52 -4.13 115.29 115.88 3n99 s HIS 106 Ca -0.10 -0.45 -0.11 0.00 0.47 0.00 0.00 55.06 54.88 3n99 s HIS 106 Cb -0.00 -0.89 0.00 0.00 -0.13 0.00 0.00 32.58 31.56 3n99 s HIS 106 CO 0.07 -0.45 1.06 0.20 -2.47 0.00 0.00 174.74 173.15 3n99 s GLY 107 N 1.93 1.63 0.00 1.59 0.00 -1.26 -1.43 107.32 109.78 3n99 s GLY 107 Ca 0.03 -0.32 0.00 0.00 0.00 0.00 0.00 44.72 44.42 3n99 s GLY 107 CO -0.07 0.01 0.00 0.61 0.00 0.00 0.00 173.10 173.66 3n99 n GLY 108 N -2.90 0.97 0.25 0.20 0.00 -1.26 -4.36 105.19 98.09 3n99 n GLY 108 Ca 0.06 -0.61 0.14 0.00 0.00 0.00 0.00 46.02 45.61 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 0.28 -4.65 1.61 -1.51 -2.04 -3.47 116.25 106.48 3n99 h VAL 109 Ca 0.00 -0.81 -0.08 0.00 -1.23 0.00 0.00 66.70 64.58 3n99 h VAL 109 Cb 0.00 1.64 0.06 0.00 -2.13 0.00 0.00 31.29 30.86 3n99 h VAL 109 CO 0.00 0.11 -0.28 0.59 -1.23 0.00 0.00 177.57 176.76 3n99 n ASN 110 N -3.25 -5.60 -4.57 4.19 3.02 -0.67 -4.95 115.26 103.42 3n99 n ASN 110 Ca 0.00 -0.26 -0.32 0.00 -0.03 0.00 0.00 54.58 53.98 3n99 n ASN 110 Cb 0.37 -3.85 -0.11 0.00 -0.61 0.00 0.00 39.78 35.58 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 -3.13 2.84 -0.12 3.10 3.76 -0.52 -4.49 115.29 116.74 3n99 s HIS 111 Ca 0.15 -0.07 -0.05 0.00 -0.15 0.00 0.00 55.06 54.94 3n99 s HIS 111 Cb -0.02 -1.59 -0.04 0.00 1.11 0.00 0.00 32.58 32.04 3n99 s HIS 111 CO 0.51 0.35 0.07 0.08 -0.85 0.00 0.00 174.74 174.90 3n99 s VAL 112 N -0.98 4.86 -0.10 -0.90 1.01 -0.40 -0.36 120.40 123.53 3n99 s VAL 112 Ca 0.17 -0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.11 3n99 s VAL 112 Cb -0.11 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 3n99 s VAL 112 CO 0.07 0.58 -0.07 -0.76 0.00 0.00 0.00 175.10 174.92 3n99 s LEU 113 N -0.69 3.11 -0.05 3.92 1.43 0.21 0.08 118.68 126.70 3n99 s LEU 113 Ca 0.12 -0.10 0.02 0.00 -1.03 0.00 0.00 54.13 53.14 3n99 s LEU 113 Cb -0.12 -1.70 0.01 0.00 0.03 0.00 0.00 46.19 44.41 3n99 s LEU 113 CO 0.02 0.27 -0.11 -0.69 0.23 0.00 0.00 176.35 176.08 3n99 s VAL 114 N -0.27 0.97 -0.25 -1.59 1.01 0.45 -0.12 120.40 120.59 3n99 s VAL 114 Ca 0.04 -0.42 -0.14 0.00 0.00 0.00 0.00 61.98 61.46 3n99 s VAL 114 Cb -0.13 -0.88 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 3n99 s VAL 114 CO 0.03 0.31 0.32 -2.28 0.00 0.00 0.00 175.10 173.48 3n99 s HIS 115 N 0.48 3.29 0.26 5.22 2.46 0.67 -1.05 115.29 126.63 3n99 s HIS 115 Ca -0.09 0.40 0.10 0.00 0.47 0.00 0.00 55.06 55.94 3n99 s HIS 115 Cb -0.13 -2.49 -0.04 0.00 -0.13 0.00 0.00 32.58 29.79 3n99 s HIS 115 CO 0.02 -0.12 -0.04 -0.06 -2.47 0.00 0.00 174.74 172.08 3n99 s PHE 116 N 1.67 2.63 0.61 3.88 0.08 -1.26 -1.03 117.98 124.56 3n99 s PHE 116 Ca 0.14 -0.24 -0.19 0.00 0.12 0.00 0.00 56.93 56.76 3n99 s PHE 116 Cb -0.15 -1.16 -0.03 0.00 -0.57 0.00 0.00 43.02 41.10 3n99 s PHE 116 CO 0.09 0.63 1.21 0.39 -0.10 0.00 0.00 175.22 177.44 3n99 n GLU 117 N -0.81 1.19 -0.08 0.44 -0.58 -1.26 -4.89 120.64 114.65 3n99 n GLU 117 Ca -0.06 0.46 0.17 0.00 -0.42 0.00 0.00 57.16 57.30 3n99 n GLU 117 Cb 0.59 -2.42 0.59 0.00 -0.57 0.00 0.00 31.44 29.63 3n99 n GLU 117 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 3n99 h GLU 118 N 0.75 0.21 0.00 3.49 4.81 -2.01 -1.89 114.58 119.94 3n99 h GLU 118 Ca -0.50 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 58.67 3n99 h GLU 118 Cb 1.34 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.66 3n99 h GLU 118 CO 0.53 0.14 -0.23 0.93 -0.73 0.00 0.00 179.01 179.65 3n99 h GLU 119 N 0.22 0.00 0.00 1.92 3.07 -2.04 -2.85 114.58 114.90 3n99 h GLU 119 Ca 0.30 0.00 -0.14 0.00 -0.50 0.00 0.00 59.36 59.02 3n99 h GLU 119 Cb 0.88 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.77 3n99 h GLU 119 CO -0.06 0.23 -0.66 0.28 -1.40 0.00 0.00 179.01 177.40 3n99 h VAL 120 N 0.00 1.44 -0.47 3.13 2.07 -1.70 -3.37 116.25 117.34 3n99 h VAL 120 Ca -0.00 -2.30 -0.13 0.00 0.82 0.00 0.00 66.70 65.09 3n99 h VAL 120 Cb 0.76 2.26 -0.01 0.00 -1.52 0.00 0.00 31.29 32.77 3n99 h VAL 120 CO 0.03 0.65 -0.20 -0.07 0.02 0.00 0.00 177.57 178.00 3n99 h LEU 121 N 0.00 0.97 -2.30 2.57 3.38 -1.58 -1.79 115.31 116.56 3n99 h LEU 121 Ca -0.01 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.60 3n99 h LEU 121 Cb 1.20 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.68 3n99 h LEU 121 CO 0.09 1.14 -0.04 1.23 0.09 0.00 0.00 178.44 180.94 3n99 h GLY 122 N 0.90 0.00 1.09 0.83 0.00 -1.73 -2.59 103.07 101.58 3n99 h GLY 122 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 3n99 h GLY 122 CO 0.06 0.00 -0.59 0.28 0.00 0.00 0.00 176.54 176.29 3n99 n LYS 123 N -3.71 0.19 -2.08 4.80 5.02 -0.69 -4.98 118.16 116.72 3n99 n LYS 123 Ca -0.03 0.05 -0.32 0.00 -2.02 0.00 0.00 58.31 55.99 3n99 n LYS 123 Cb 0.14 -1.61 0.00 0.00 -0.02 0.00 0.00 35.03 33.54 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 -3.76 3.49 0.02 -0.35 1.43 -0.98 -4.13 118.68 114.40 3n99 s LEU 124 Ca 0.08 1.73 0.00 0.00 -1.03 0.00 0.00 54.13 54.91 3n99 s LEU 124 Cb 0.15 -4.52 -0.01 0.00 0.03 0.00 0.00 46.19 41.83 3n99 s LEU 124 CO 0.71 -1.05 -0.03 -0.32 0.23 0.00 0.00 176.35 175.89 3n99 s MET 125 N -4.19 0.26 0.31 1.70 -2.45 -1.26 -5.06 119.30 108.62 3n99 s MET 125 Ca 0.62 -0.45 -0.29 0.00 -1.25 0.00 0.00 55.69 54.31 3n99 s MET 125 Cb -0.14 0.03 -0.12 0.00 1.25 0.00 0.00 34.83 35.84 3n99 s MET 125 CO 0.38 -0.02 1.44 0.28 1.05 0.00 0.00 175.02 178.14 3n99 n VAL 126 N 2.01 1.52 0.00 10.11 0.31 -1.26 -1.73 118.33 129.29 3n99 n VAL 126 Ca -0.20 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 63.75 3n99 n VAL 126 Cb 0.56 -1.74 0.00 0.00 -0.91 0.00 0.00 33.84 31.75 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 1.36 1.88 3.75 2.92 0.00 -0.02 -4.94 105.19 110.14 3n99 n GLY 127 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 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 3.00 -4.75 1.61 8.00 -0.70 -4.59 116.55 119.12 3n99 n ASP 128 Ca 0.00 1.08 -0.40 0.00 0.71 0.00 0.00 54.79 56.18 3n99 n ASP 128 Cb 0.00 -1.58 -0.06 0.00 -0.02 0.00 0.00 41.12 39.47 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 -2.53 4.80 -0.05 -1.24 1.02 -1.26 -1.71 119.74 118.77 3n99 s LYS 129 Ca 0.64 1.56 0.03 0.00 0.02 0.00 0.00 55.97 58.22 3n99 s LYS 129 Cb -0.45 -3.26 0.01 0.00 -0.52 0.00 0.00 37.83 33.60 3n99 s LYS 129 CO 0.55 0.44 -0.13 0.42 -0.92 0.00 0.00 175.35 175.71 3n99 s ILE 130 N -1.13 1.16 -0.24 2.17 -1.09 0.04 -0.98 121.20 121.14 3n99 s ILE 130 Ca 0.42 -0.53 -0.04 0.00 -2.23 0.00 0.00 60.65 58.27 3n99 s ILE 130 Cb -0.27 -1.04 -0.00 0.00 -1.58 0.00 0.00 42.46 39.56 3n99 s ILE 130 CO 0.34 0.35 -0.02 -0.22 -1.23 0.00 0.00 174.94 174.17 3n99 s LEU 131 N 0.43 3.09 -0.20 2.97 2.96 -0.52 -1.24 118.68 126.18 3n99 s LEU 131 Ca -0.10 -0.46 -0.10 0.00 -0.22 0.00 0.00 54.13 53.25 3n99 s LEU 131 Cb -0.14 -1.77 -0.05 0.00 0.50 0.00 0.00 46.19 44.74 3n99 s LEU 131 CO 0.03 -0.05 0.13 -0.63 -1.32 0.00 0.00 176.35 174.50 3n99 s ILE 132 N 1.48 5.31 -1.06 6.68 1.01 0.12 -0.45 121.20 134.29 3n99 s ILE 132 Ca 0.05 0.16 -0.16 0.00 0.00 0.00 0.00 60.65 60.69 3n99 s ILE 132 Cb -0.15 -3.43 0.15 0.00 0.01 0.00 0.00 42.46 39.04 3n99 s ILE 132 CO -0.02 0.43 1.26 -0.54 0.00 0.00 0.00 174.94 176.07 3n99 s LYS 133 N 0.49 3.83 0.16 2.79 1.02 -0.35 -0.75 119.74 126.93 3n99 s LYS 133 Ca 0.07 -2.16 -0.30 0.00 0.02 0.00 0.00 55.97 53.60 3n99 s LYS 133 Cb -0.12 -4.97 -0.07 0.00 -0.52 0.00 0.00 37.83 32.15 3n99 s LYS 133 CO -0.01 -1.76 1.14 0.00 -0.92 0.00 0.00 175.35 173.81 3n99 s ALA 134 N 2.10 3.39 -0.30 5.17 0.00 -0.27 -4.26 121.76 127.59 3n99 s ALA 134 Ca 0.37 0.86 -0.12 0.00 0.00 0.00 0.00 51.96 53.06 3n99 s ALA 134 Cb -0.04 -3.38 0.15 0.00 0.00 0.00 0.00 23.12 19.85 3n99 s ALA 134 CO -0.05 -0.29 0.82 -0.46 0.00 0.00 0.00 175.76 175.78 3n99 s TRP 135 N 0.01 -1.01 0.00 0.00 -0.00 -1.26 -1.91 118.94 114.78 3n99 s TRP 135 Ca 0.52 1.69 0.00 0.00 -0.00 0.00 0.00 56.10 58.31 3n99 s TRP 135 Cb -0.30 0.58 0.00 0.00 -0.00 0.00 0.00 33.47 33.75 3n99 s TRP 135 CO 0.35 -0.51 0.00 0.41 -0.00 0.00 0.00 176.95 177.20 3n99 n GLY 136 N 5.22 1.14 3.72 5.86 0.00 -1.26 -4.20 105.19 115.68 3n99 n GLY 136 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 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 4.47 0.00 1.61 -1.52 -1.26 -2.00 119.66 120.96 3n99 s GLN 137 Ca 0.00 1.82 0.00 0.00 -1.95 0.00 0.00 55.36 55.23 3n99 s GLN 137 Cb 0.00 -3.29 0.00 0.00 -0.22 0.00 0.00 33.01 29.50 3n99 s GLN 137 CO 0.00 -0.17 0.00 0.41 -0.25 0.00 0.00 175.29 175.28 3n99 n GLY 138 N 2.72 0.37 3.75 3.09 0.00 -1.26 -4.76 105.19 109.10 3n99 n GLY 138 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 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 4.41 -4.12 0.99 7.94 -0.85 -4.97 117.00 120.39 3n99 n LEU 139 Ca 0.00 1.15 -0.21 0.00 -1.11 0.00 0.00 56.01 55.84 3n99 n LEU 139 Cb 0.00 -1.60 -0.14 0.00 0.53 0.00 0.00 43.42 42.21 3n99 n LEU 139 CO 0.00 0.17 -0.47 -0.54 -1.11 0.00 0.00 177.39 175.44 3n99 s LYS 140 N -0.56 1.04 -0.51 1.96 1.02 -1.26 -4.47 119.74 116.95 3n99 s LYS 140 Ca 0.64 -0.62 -0.23 0.00 0.02 0.00 0.00 55.97 55.78 3n99 s LYS 140 Cb -0.49 -1.03 0.04 0.00 -0.52 0.00 0.00 37.83 35.83 3n99 s LYS 140 CO 0.49 0.27 0.85 -0.51 -0.92 0.00 0.00 175.35 175.53 3n99 s LEU 141 N -0.70 4.27 0.31 3.17 1.43 -1.26 -2.82 118.68 123.08 3n99 s LEU 141 Ca 0.04 -0.35 0.02 0.00 -1.03 0.00 0.00 54.13 52.81 3n99 s LEU 141 Cb -0.06 -2.82 0.50 0.00 0.03 0.00 0.00 46.19 43.84 3n99 s LEU 141 CO 0.00 -1.09 1.84 -0.07 0.23 0.00 0.00 176.35 177.27 3n99 h LEU 142 N 10.54 0.60 -0.74 1.79 3.38 -1.10 -1.29 115.31 128.50 3n99 h LEU 142 Ca -0.26 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.59 3n99 h LEU 142 Cb 1.08 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.67 3n99 h LEU 142 CO 1.03 0.66 0.00 0.47 0.09 0.00 0.00 178.44 180.69 3n99 n ASP 143 N -4.26 1.13 -3.17 -0.43 8.00 -1.26 -4.37 116.55 112.19 3n99 n ASP 143 Ca 0.02 -1.46 -0.19 0.00 0.71 0.00 0.00 54.79 53.87 3n99 n ASP 143 Cb 0.25 -0.03 -0.04 0.00 -0.02 0.00 0.00 41.12 41.29 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 -0.09 -0.12 -0.08 1.24 8.25 -0.49 -4.98 115.22 118.95 3n99 n HIS 144 Ca 0.19 -3.66 0.16 0.00 -0.26 0.00 0.00 57.72 54.14 3n99 n HIS 144 Cb 0.27 -0.30 0.57 0.00 1.12 0.00 0.00 29.99 31.65 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 3.29 0.25 -0.03 -0.41 0.13 -1.75 -1.32 132.00 132.16 3n99 h PRO 145 Ca 0.08 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 3n99 h PRO 145 Cb 0.95 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.02 3n99 h PRO 145 CO 0.47 0.17 0.00 -0.25 -0.23 0.00 0.00 178.00 178.16 3n99 n ASP 146 N -4.44 0.34 -4.17 1.44 8.00 -1.26 -4.68 116.55 111.77 3n99 n ASP 146 Ca 0.11 -1.49 -0.36 0.00 0.71 0.00 0.00 54.79 53.76 3n99 n ASP 146 Cb 0.51 -0.02 -0.12 0.00 -0.02 0.00 0.00 41.12 41.47 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 -1.96 3.30 0.10 2.53 1.01 -0.50 -4.57 120.40 120.31 3n99 s VAL 147 Ca 0.28 -1.61 -0.28 0.00 0.00 0.00 0.00 61.98 60.37 3n99 s VAL 147 Cb 0.13 -3.05 -0.06 0.00 0.00 0.00 0.00 36.38 33.41 3n99 s VAL 147 CO 0.22 -0.37 0.88 -0.54 0.00 0.00 0.00 175.10 175.28 3n99 s LYS 148 N 1.24 4.63 0.16 2.72 -0.14 -0.09 -4.59 119.74 123.66 3n99 s LYS 148 Ca 0.01 1.29 0.10 0.00 -1.36 0.00 0.00 55.97 56.01 3n99 s LYS 148 Cb -0.21 -3.36 -0.04 0.00 -1.68 0.00 0.00 37.83 32.54 3n99 s LYS 148 CO -0.02 0.28 -0.18 0.14 -0.76 0.00 0.00 175.35 174.82 3n99 s VAL 149 N -0.18 2.76 0.09 3.17 -7.23 -1.26 -0.72 120.40 117.03 3n99 s VAL 149 Ca 0.43 -1.72 -0.27 0.00 -1.81 0.00 0.00 61.98 58.61 3n99 s VAL 149 Cb -0.22 -2.31 0.08 0.00 0.56 0.00 0.00 36.38 34.48 3n99 s VAL 149 CO 0.27 -0.02 0.94 0.00 -0.31 0.00 0.00 175.10 175.98 3n99 s MET 150 N -2.49 1.03 -0.86 4.82 0.23 -0.46 -4.71 119.30 116.87 3n99 s MET 150 Ca 0.20 -0.51 0.00 0.00 -1.03 0.00 0.00 55.69 54.35 3n99 s MET 150 Cb -0.09 0.39 0.00 0.00 -1.53 0.00 0.00 34.83 33.60 3n99 s MET 150 CO 0.11 -0.47 0.00 0.09 -2.03 0.00 0.00 175.02 172.72 3n99 n ASN 151 N -0.39 -5.38 -3.90 -1.18 3.02 -1.26 -4.20 115.26 101.97 3n99 n ASN 151 Ca -0.07 0.20 -0.19 0.00 -0.03 0.00 0.00 54.58 54.49 3n99 n ASN 151 Cb 0.61 -3.59 -0.16 0.00 -0.61 0.00 0.00 39.78 36.03 3n99 n ASN 151 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 3n99 s ILE 152 N -1.83 0.50 0.12 2.41 2.07 -1.26 -0.52 121.20 122.69 3n99 s ILE 152 Ca 0.00 -0.13 -0.32 0.00 -1.41 0.00 0.00 60.65 58.79 3n99 s ILE 152 Cb 0.00 -0.51 -0.11 0.00 0.13 0.00 0.00 42.46 41.96 3n99 s ILE 152 CO 0.00 0.20 1.81 -0.67 -1.91 0.00 0.00 174.94 174.37 3n99 n ASP 153 N 3.84 3.92 0.00 4.50 -0.08 -0.05 -4.58 116.55 124.11 3n99 n ASP 153 Ca -0.24 1.00 0.12 0.00 -1.51 0.00 0.00 54.79 54.16 3n99 n ASP 153 Cb 0.52 -1.53 0.55 0.00 2.34 0.00 0.00 41.12 42.99 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 8.14 0.28 -0.21 -0.67 0.11 -1.90 -0.41 132.00 137.35 3n99 h PRO 154 Ca -0.46 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 3n99 h PRO 154 Cb 1.23 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 3n99 h PRO 154 CO 0.94 0.19 -0.21 -0.44 -0.21 0.00 0.00 178.00 178.27 3n99 h ASP 155 N 0.29 0.54 -0.95 -2.05 3.32 -1.97 -2.68 116.42 112.92 3n99 h ASP 155 Ca 0.21 -0.48 0.06 0.00 0.02 0.00 0.00 57.03 56.83 3n99 h ASP 155 Cb 0.44 -0.15 -0.06 0.00 0.22 0.00 0.00 39.33 39.78 3n99 h ASP 155 CO -0.04 0.91 0.62 0.25 -1.72 0.00 0.00 179.24 179.25 3n99 h LEU 156 N 0.18 0.99 -0.91 1.55 5.85 -1.76 -2.52 115.31 118.69 3n99 h LEU 156 Ca 0.03 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.77 3n99 h LEU 156 Cb 0.76 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.53 3n99 h LEU 156 CO 0.05 0.65 0.60 0.15 -0.34 0.00 0.00 178.44 179.54 3n99 h PHE 157 N 1.13 1.13 0.00 1.25 3.57 -0.96 0.28 116.94 123.34 3n99 h PHE 157 Ca 0.40 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.93 3n99 h PHE 157 Cb 0.13 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 38.49 3n99 h PHE 157 CO -0.00 0.69 0.00 0.93 -2.23 0.00 0.00 178.31 177.70 3n99 h GLU 158 N 1.20 0.00 -0.20 1.11 5.08 -1.11 -2.89 114.58 117.76 3n99 h GLU 158 Ca 0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 3n99 h GLU 158 Cb -0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.16 3n99 h GLU 158 CO -0.09 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.55 3n99 n LYS 159 N -2.85 1.75 -0.06 2.33 5.02 0.08 -4.48 118.16 119.95 3n99 n LYS 159 Ca -0.00 -1.14 0.12 0.00 -2.02 0.00 0.00 58.31 55.27 3n99 n LYS 159 Cb 0.21 -1.37 0.39 0.00 -0.02 0.00 0.00 35.03 34.24 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 0.37 1.79 -0.00 -0.35 4.77 -1.09 -4.90 117.00 117.59 3n99 n LEU 160 Ca 0.15 -0.71 -0.00 0.00 -0.03 0.00 0.00 56.01 55.42 3n99 n LEU 160 Cb 0.33 -0.09 -0.00 0.00 -2.33 0.00 0.00 43.42 41.33 3n99 n LEU 160 CO 0.12 0.35 -0.00 0.61 -1.33 0.00 0.00 177.39 177.15 3n99 n GLY 161 N 1.17 0.49 3.77 -0.72 0.00 -1.26 -4.63 105.19 104.01 3n99 n GLY 161 Ca 0.17 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.99 3.22 -0.02 -0.61 1.01 -1.26 -4.58 121.20 116.97 3n99 s ILE 162 Ca 0.00 1.16 0.00 0.00 0.00 0.00 0.00 60.65 61.82 3n99 s ILE 162 Cb 0.00 -3.71 0.02 0.00 0.01 0.00 0.00 42.46 38.77 3n99 s ILE 162 CO 0.00 0.23 0.00 -1.10 0.00 0.00 0.00 174.94 174.07 3n99 s GLN 163 N -1.80 0.14 0.11 2.79 -0.21 -0.65 -4.94 119.66 115.10 3n99 s GLN 163 Ca 0.49 0.07 -0.31 0.00 0.02 0.00 0.00 55.36 55.63 3n99 s GLN 163 Cb -0.33 -0.29 -0.07 0.00 1.00 0.00 0.00 33.01 33.32 3n99 s GLN 163 CO 0.43 -0.09 1.23 -1.21 -2.12 0.00 0.00 175.29 173.53 3n99 s GLU 164 N 0.68 4.43 -0.28 2.91 2.02 -1.26 -0.26 118.70 126.94 3n99 s GLU 164 Ca -0.06 1.86 0.00 0.00 0.02 0.00 0.00 54.97 56.79 3n99 s GLU 164 Cb -0.09 -3.30 0.15 0.00 0.10 0.00 0.00 34.13 30.99 3n99 s GLU 164 CO -0.02 -0.24 0.40 0.21 0.02 0.00 0.00 175.26 175.64 3n99 s LYS 165 N 0.71 0.40 -0.51 1.61 2.20 0.62 -4.96 119.74 119.80 3n99 s LYS 165 Ca 0.58 0.28 -0.01 0.00 -0.36 0.00 0.00 55.97 56.47 3n99 s LYS 165 Cb -0.32 -0.34 -0.01 0.00 -1.51 0.00 0.00 37.83 35.66 3n99 s LYS 165 CO 0.31 -0.90 0.43 0.09 -0.36 0.00 0.00 175.35 174.93 3n99 n ASN 166 N 5.36 -2.53 -1.84 1.43 3.02 -1.26 -2.88 115.26 116.55 3n99 n ASN 166 Ca -0.01 -0.28 -0.20 0.00 -0.03 0.00 0.00 54.58 54.06 3n99 n ASN 166 Cb 0.50 -2.55 -0.06 0.00 -0.61 0.00 0.00 39.78 37.05 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 -1.14 1.09 3.16 7.41 0.00 -1.26 -5.00 105.19 109.45 3n99 n GLY 167 Ca -0.10 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.70 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 -4.12 1.03 -0.28 1.61 1.02 -1.14 -4.83 119.74 113.03 3n99 s LYS 168 Ca 0.00 -0.78 -0.10 0.00 0.02 0.00 0.00 55.97 55.11 3n99 s LYS 168 Cb 0.00 -1.06 -0.04 0.00 -0.52 0.00 0.00 37.83 36.21 3n99 s LYS 168 CO 0.00 0.26 0.16 0.42 -0.92 0.00 0.00 175.35 175.28 3n99 s ILE 169 N -0.81 5.03 -0.12 2.17 -1.09 0.97 -0.28 121.20 127.07 3n99 s ILE 169 Ca 0.03 0.03 -0.15 0.00 -2.23 0.00 0.00 60.65 58.33 3n99 s ILE 169 Cb -0.08 -3.41 -0.05 0.00 -1.58 0.00 0.00 42.46 37.34 3n99 s ILE 169 CO 0.01 0.24 0.35 -1.00 -1.23 0.00 0.00 174.94 173.31 3n99 s HIS 170 N 1.72 3.52 -0.11 3.97 3.76 0.65 0.41 115.29 129.20 3n99 s HIS 170 Ca 0.07 0.72 -0.01 0.00 -0.15 0.00 0.00 55.06 55.69 3n99 s HIS 170 Cb -0.16 -2.36 0.03 0.00 1.11 0.00 0.00 32.58 31.20 3n99 s HIS 170 CO 0.09 0.31 -0.06 0.08 -0.85 0.00 0.00 174.74 174.32 3n99 s VAL 171 N 0.17 0.90 0.12 -0.90 1.01 -0.31 -1.64 120.40 119.75 3n99 s VAL 171 Ca 0.20 -0.23 -0.31 0.00 0.00 0.00 0.00 61.98 61.64 3n99 s VAL 171 Cb -0.14 -0.96 -0.07 0.00 0.00 0.00 0.00 36.38 35.21 3n99 s VAL 171 CO 0.07 0.33 1.32 -2.84 0.00 0.00 0.00 175.10 173.98 3n99 s PRO 172 N 1.76 4.37 0.08 2.72 0.02 -1.26 0.03 135.00 142.71 3n99 s PRO 172 Ca 0.05 1.99 0.02 0.00 0.02 0.00 0.00 61.00 63.08 3n99 s PRO 172 Cb -0.13 -3.26 -0.03 0.00 0.02 0.00 0.00 34.50 31.10 3n99 s PRO 172 CO -0.08 -0.35 -0.08 0.14 -0.33 0.00 0.00 177.00 176.30 3n99 s VAL 173 N 0.90 0.71 -0.57 3.83 -7.23 0.27 -4.86 120.40 113.44 3n99 s VAL 173 Ca 0.61 -1.57 0.24 0.00 -1.81 0.00 0.00 61.98 59.46 3n99 s VAL 173 Cb -0.35 -1.23 0.18 0.00 0.56 0.00 0.00 36.38 35.54 3n99 s VAL 173 CO 0.31 -0.62 1.49 -0.37 -0.31 0.00 0.00 175.10 175.61 3n99 h VAL 174 N 3.65 0.00 -2.13 1.32 -1.51 -1.28 -0.84 116.25 115.46 3n99 h VAL 174 Ca -0.36 -0.67 0.04 0.00 -1.23 0.00 0.00 66.70 64.48 3n99 h VAL 174 Cb 1.18 1.46 -0.18 0.00 -2.13 0.00 0.00 31.29 31.63 3n99 h VAL 174 CO 0.53 0.00 0.39 0.00 -1.23 0.00 0.00 177.57 177.26 3n99 s ALA 175 N -3.18 -1.81 -0.22 5.19 0.00 -1.26 -4.75 121.76 115.73 3n99 s ALA 175 Ca 0.07 1.16 -0.01 0.00 0.00 0.00 0.00 51.96 53.18 3n99 s ALA 175 Cb 0.11 0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.32 3n99 s ALA 175 CO 0.68 -0.52 -0.11 0.15 0.00 0.00 0.00 175.76 175.96 3n99 s LYS 176 N -2.21 3.00 -0.28 0.00 1.02 -1.26 -1.12 119.74 118.89 3n99 s LYS 176 Ca -0.01 -0.85 -0.09 0.00 0.02 0.00 0.00 55.97 55.04 3n99 s LYS 176 Cb -0.01 -2.83 -0.02 0.00 -0.52 0.00 0.00 37.83 34.46 3n99 s LYS 176 CO -0.02 -0.28 0.12 0.42 -0.92 0.00 0.00 175.35 174.66 3n99 s ILE 177 N 1.34 4.52 0.66 2.17 1.01 0.27 -4.94 121.20 126.22 3n99 s ILE 177 Ca 0.03 -0.28 -0.17 0.00 0.00 0.00 0.00 60.65 60.22 3n99 s ILE 177 Cb -0.15 -3.22 -0.01 0.00 0.01 0.00 0.00 42.46 39.10 3n99 s ILE 177 CO -0.07 0.19 1.19 -2.65 0.00 0.00 0.00 174.94 173.60 3n99 n PRO 178 N 4.96 0.92 -0.35 2.79 -0.02 -1.26 -0.72 135.00 141.32 3n99 n PRO 178 Ca -0.15 0.37 0.10 0.00 -2.02 0.00 0.00 63.50 61.80 3n99 n PRO 178 Cb 0.50 -2.42 0.28 0.00 -0.02 0.00 0.00 33.50 31.83 3n99 n PRO 178 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3n99 h ALA 179 N 0.29 1.55 0.00 3.55 0.00 -1.87 -1.79 119.26 120.99 3n99 h ALA 179 Ca -0.50 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3n99 h ALA 179 Cb 1.34 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3n99 h ALA 179 CO 0.51 0.04 0.00 -2.39 0.00 0.00 0.00 179.25 177.41 3n99 n HIS 180 N -4.73 0.81 1.54 0.00 1.44 -1.26 -1.38 115.22 111.63 3n99 n HIS 180 Ca 0.21 0.35 0.14 0.00 -2.01 0.00 0.00 57.72 56.41 3n99 n HIS 180 Cb 0.48 -1.06 0.60 0.00 0.12 0.00 0.00 29.99 30.13 3n99 n HIS 180 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 3n99 n MET 181 N -2.26 1.23 -3.41 -1.40 2.00 -0.67 -4.86 117.12 107.75 3n99 n MET 181 Ca 0.01 -0.58 -0.35 0.00 0.00 0.00 0.00 57.70 56.78 3n99 n MET 181 Cb 0.17 -1.49 -0.06 0.00 0.00 0.00 0.00 33.22 31.85 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 -2.16 3.92 0.00 0.03 -1.94 -0.48 -0.04 119.30 118.62 3n99 s MET 182 Ca 0.36 0.41 0.00 0.00 -1.71 0.00 0.00 55.69 54.75 3n99 s MET 182 Cb 0.21 -2.94 0.00 0.00 2.01 0.00 0.00 34.83 34.11 3n99 s MET 182 CO 0.40 0.49 0.00 0.41 -0.01 0.00 0.00 175.02 176.31 3n99 n GLY 183 N 0.80 4.33 3.64 -0.03 0.00 -0.11 -4.83 105.19 108.99 3n99 n GLY 183 Ca -0.06 -0.56 -0.53 0.00 0.00 0.00 0.00 46.02 44.87 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 2.07 0.00 1.61 2.88 0.10 -2.04 113.62 118.24 3n99 n SER 184 Ca 0.00 1.09 0.00 0.00 -1.33 0.00 0.00 58.87 58.63 3n99 n SER 184 Cb 0.00 -1.19 0.00 0.00 -0.75 0.00 0.00 64.21 62.27 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 3.24 2.36 3.59 0.46 0.00 -1.26 -0.67 105.19 112.91 3n99 n GLY 185 Ca 0.21 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.56 0.19 -0.03 -0.61 5.41 -0.86 -1.82 119.36 121.07 3n99 n ILE 186 Ca 0.00 -0.05 0.00 0.00 1.00 0.00 0.00 62.75 63.70 3n99 n ILE 186 Cb 0.00 -0.86 0.00 0.00 -0.71 0.00 0.00 39.64 38.07 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 2.45 0.39 3.71 7.39 0.00 -0.14 -5.01 105.19 113.97 3n99 n GLY 187 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.76 1.08 -0.32 4.61 0.00 -0.76 -4.74 120.51 118.62 3n99 n ALA 188 Ca 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 53.44 53.49 3n99 n ALA 188 Cb 0.00 -2.28 0.12 0.00 0.00 0.00 0.00 19.45 17.29 3n99 n ALA 188 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3n99 h SER 189 N 0.91 0.91 -3.44 0.00 0.87 -1.93 -1.25 113.55 109.62 3n99 h SER 189 Ca -0.50 -0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 59.77 3n99 h SER 189 Cb 1.33 -0.20 -0.34 0.00 -0.44 0.00 0.00 62.40 62.76 3n99 h SER 189 CO 0.54 0.61 -0.68 -0.55 -0.53 0.00 0.00 176.83 176.23 3n99 s SER 190 N -5.86 0.13 0.12 6.23 0.15 -1.26 -3.42 113.70 109.78 3n99 s SER 190 Ca -0.13 0.16 0.08 0.00 0.70 0.00 0.00 55.95 56.76 3n99 s SER 190 Cb 0.18 0.04 0.41 0.00 -1.71 0.00 0.00 66.02 64.94 3n99 s SER 190 CO 0.79 -0.15 1.22 -1.54 1.20 0.00 0.00 173.24 174.76 3n99 n SER 191 N 4.36 0.20 0.06 5.45 3.41 -0.40 -2.13 113.62 124.57 3n99 n SER 191 Ca -0.24 0.58 0.13 0.00 -0.26 0.00 0.00 58.87 59.08 3n99 n SER 191 Cb 0.51 -0.60 0.40 0.00 -0.26 0.00 0.00 64.21 64.25 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 -1.58 2.52 -0.86 7.33 0.00 -1.26 -4.18 120.51 122.47 3n99 n ALA 192 Ca -0.01 -0.11 0.03 0.00 0.00 0.00 0.00 53.44 53.35 3n99 n ALA 192 Cb 0.03 -1.38 0.04 0.00 0.00 0.00 0.00 19.45 18.14 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 -1.99 1.31 -3.74 0.00 3.41 -0.91 -4.24 113.62 107.45 3n99 n SER 193 Ca 0.05 -2.08 -0.09 0.00 -0.26 0.00 0.00 58.87 56.50 3n99 n SER 193 Cb 0.40 -0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 64.18 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 -1.11 0.01 0.50 6.66 -1.32 -1.24 -4.61 115.64 114.52 3n99 s THR 194 Ca 0.09 -0.76 0.09 0.00 -1.21 0.00 0.00 61.69 59.90 3n99 s THR 194 Cb 0.08 -1.70 0.05 0.00 -1.51 0.00 0.00 72.50 69.42 3n99 s THR 194 CO 0.01 -0.03 0.65 1.51 -2.21 0.00 0.00 174.62 174.55 3n99 s ASP 195 N -2.88 5.27 0.06 8.08 -4.77 -1.26 -4.67 116.67 116.50 3n99 s ASP 195 Ca 0.09 -0.71 -0.06 0.00 -3.30 0.00 0.00 52.55 48.57 3n99 s ASP 195 Cb -0.03 -0.11 -0.01 0.00 -1.09 0.00 0.00 42.92 41.67 3n99 s ASP 195 CO 0.00 -1.06 0.11 -0.72 0.70 0.00 0.00 175.17 174.20 3n99 s TYR 196 N -2.54 0.25 -0.01 2.11 1.13 -0.36 -4.68 117.35 113.25 3n99 s TYR 196 Ca 0.56 -0.65 -0.17 0.00 -1.41 0.00 0.00 57.07 55.40 3n99 s TYR 196 Cb -0.07 -0.16 -0.06 0.00 -1.10 0.00 0.00 41.96 40.57 3n99 s TYR 196 CO 0.35 -0.44 0.49 -0.51 -2.51 0.00 0.00 175.55 172.92 3n99 s ASP 197 N -2.60 6.87 -0.32 -0.18 1.11 0.15 -0.16 116.67 121.54 3n99 s ASP 197 Ca 0.02 1.04 -0.29 0.00 0.18 0.00 0.00 52.55 53.50 3n99 s ASP 197 Cb 0.03 -2.30 0.02 0.00 1.07 0.00 0.00 42.92 41.74 3n99 s ASP 197 CO -0.08 0.22 1.05 -0.63 1.18 0.00 0.00 175.17 176.90 3n99 s ILE 198 N -0.62 4.54 -0.78 0.77 1.01 -0.03 -0.94 121.20 125.14 3n99 s ILE 198 Ca 0.26 1.69 -0.03 0.00 0.00 0.00 0.00 60.65 62.58 3n99 s ILE 198 Cb -0.17 -4.39 0.22 0.00 0.01 0.00 0.00 42.46 38.12 3n99 s ILE 198 CO 0.15 -0.46 2.31 1.15 0.00 0.00 0.00 174.94 178.09 3n99 n MET 199 N 6.81 3.19 -3.56 2.79 0.00 0.94 -2.56 117.12 124.73 3n99 n MET 199 Ca 0.11 -3.25 -0.37 0.00 0.00 0.00 0.00 57.70 54.19 3n99 n MET 199 Cb 0.47 -2.29 -0.09 0.00 0.00 0.00 0.00 33.22 31.31 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 -2.94 3.59 0.34 3.17 0.00 -1.26 -4.90 121.76 119.75 3n99 s ALA 200 Ca 0.53 -0.80 0.04 0.00 0.00 0.00 0.00 51.96 51.72 3n99 s ALA 200 Cb 0.36 -2.45 0.60 0.00 0.00 0.00 0.00 23.12 21.63 3n99 s ALA 200 CO -0.28 -0.29 1.89 0.77 0.00 0.00 0.00 175.76 177.86 3n99 h SER 201 N 7.60 0.54 -4.50 0.00 0.02 -1.90 -3.45 113.55 111.87 3n99 h SER 201 Ca -0.37 -0.09 -0.33 0.00 -0.84 0.00 0.00 61.79 60.16 3n99 h SER 201 Cb 1.17 -0.14 -0.23 0.00 0.14 0.00 0.00 62.40 63.34 3n99 h SER 201 CO 0.66 0.57 -0.75 0.20 -1.14 0.00 0.00 176.83 176.37 3n99 s ASN 202 N -6.70 1.07 0.52 3.07 0.01 -1.26 -5.00 114.94 106.66 3n99 s ASN 202 Ca -0.08 -0.46 0.27 0.00 -0.71 0.00 0.00 52.86 51.88 3n99 s ASN 202 Cb 0.16 -0.02 1.40 0.00 0.41 0.00 0.00 41.25 43.20 3n99 s ASN 202 CO 0.77 -0.10 2.04 1.55 -1.51 0.00 0.00 177.10 179.85 3n99 h PRO 203 N 4.81 0.00 0.00 -0.60 0.13 -1.87 -0.91 132.00 133.56 3n99 h PRO 203 Ca -0.36 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.77 3n99 h PRO 203 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 3n99 h PRO 203 CO 0.43 0.13 -0.03 0.93 -0.23 0.00 0.00 178.00 179.23 3n99 h GLU 204 N 0.00 0.00 0.00 0.86 3.07 -1.83 -0.23 114.58 116.46 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 0.38 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.29 3n99 h GLU 204 CO 0.02 0.03 0.00 -0.44 -1.40 0.00 0.00 179.01 177.21 3n99 h ASP 205 N 0.00 0.00 -0.31 1.42 3.32 -1.45 -1.93 116.42 117.46 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 0.61 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.16 3n99 h ASP 205 CO 0.00 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.70 3n99 n LEU 206 N -2.30 3.22 -1.30 1.55 4.77 -0.12 -4.96 117.00 117.86 3n99 n LEU 206 Ca 0.01 -2.32 -0.13 0.00 -0.03 0.00 0.00 56.01 53.54 3n99 n LEU 206 Cb 0.18 -0.33 -0.02 0.00 -2.33 0.00 0.00 43.42 40.92 3n99 n LEU 206 CO 0.18 0.71 -0.15 0.61 -1.33 0.00 0.00 177.39 177.41 3n99 n GLY 207 N 0.18 0.42 3.32 -0.72 0.00 -0.72 -4.85 105.19 102.82 3n99 n GLY 207 Ca 0.14 -0.37 -0.17 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.58 1.60 0.21 1.61 -7.23 -1.05 -5.00 120.40 107.96 3n99 s VAL 208 Ca 0.00 -2.18 0.03 0.00 -1.81 0.00 0.00 61.98 58.03 3n99 s VAL 208 Cb 0.00 -2.00 -0.07 0.00 0.56 0.00 0.00 36.38 34.87 3n99 s VAL 208 CO 0.00 -0.63 1.50 0.00 -0.31 0.00 0.00 175.10 175.66 3n99 h ALA 209 N 2.61 0.74 -2.63 1.32 0.00 -1.96 -2.96 119.26 116.39 3n99 h ALA 209 Ca -0.38 -0.59 -0.07 0.00 0.00 0.00 0.00 54.91 53.87 3n99 h ALA 209 Cb 1.21 -0.08 -0.13 0.00 0.00 0.00 0.00 17.79 18.79 3n99 h ALA 209 CO 0.62 0.78 -0.23 0.34 0.00 0.00 0.00 179.25 180.76 3n99 s ASP 210 N -6.91 -0.04 -0.05 0.00 2.15 -1.26 -4.79 116.67 105.76 3n99 s ASP 210 Ca -0.04 -0.53 0.00 0.00 0.43 0.00 0.00 52.55 52.42 3n99 s ASP 210 Cb 0.11 0.41 0.02 0.00 -0.30 0.00 0.00 42.92 43.17 3n99 s ASP 210 CO 0.81 -0.80 -0.03 -0.22 -0.17 0.00 0.00 175.17 174.76 3n99 s LEU 211 N -2.85 1.11 0.09 -1.34 2.96 -1.26 -5.01 118.68 112.39 3n99 s LEU 211 Ca 0.05 -0.12 0.05 0.00 -0.22 0.00 0.00 54.13 53.89 3n99 s LEU 211 Cb 0.03 -0.45 -0.04 0.00 0.50 0.00 0.00 46.19 46.23 3n99 s LEU 211 CO -0.10 -0.10 0.02 -0.54 -1.32 0.00 0.00 176.35 174.31 3n99 s LYS 212 N 1.25 2.62 0.19 1.98 1.02 -1.26 -0.96 119.74 124.58 3n99 s LYS 212 Ca -0.06 -0.82 -0.33 0.00 0.02 0.00 0.00 55.97 54.79 3n99 s LYS 212 Cb -0.14 -2.58 -0.13 0.00 -0.52 0.00 0.00 37.83 34.47 3n99 s LYS 212 CO -0.02 0.54 1.66 1.28 -0.92 0.00 0.00 175.35 177.90 3n99 n LEU 213 N 0.50 3.63 0.00 3.17 4.77 0.11 -1.15 117.00 128.04 3n99 n LEU 213 Ca -0.10 1.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.95 3n99 n LEU 213 Cb 0.52 -1.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.09 3n99 n LEU 213 CO 0.40 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 3n99 n GLY 214 N 3.74 0.75 3.78 -0.72 0.00 0.56 -0.84 105.19 112.45 3n99 n GLY 214 Ca 0.16 0.00 -0.36 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 -2.73 6.15 -0.20 1.61 1.01 -0.30 -1.13 116.67 121.08 3n99 s ASP 215 Ca 0.00 2.21 -0.15 0.00 0.71 0.00 0.00 52.55 55.32 3n99 s ASP 215 Cb 0.00 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.30 3n99 s ASP 215 CO 0.00 -0.92 0.38 -0.63 0.21 0.00 0.00 175.17 174.21 3n99 s ILE 216 N -1.65 5.21 0.22 0.77 1.01 -0.12 -1.03 121.20 125.61 3n99 s ILE 216 Ca 0.65 0.67 0.06 0.00 0.00 0.00 0.00 60.65 62.03 3n99 s ILE 216 Cb -0.26 -3.71 -0.05 0.00 0.01 0.00 0.00 42.46 38.45 3n99 s ILE 216 CO 0.31 0.26 -0.08 0.68 0.00 0.00 0.00 174.94 176.11 3n99 s VAL 217 N 1.28 1.43 0.02 2.92 -7.23 0.83 -1.04 120.40 118.60 3n99 s VAL 217 Ca 0.18 -2.11 0.03 0.00 -1.81 0.00 0.00 61.98 58.27 3n99 s VAL 217 Cb -0.15 -2.19 -0.04 0.00 0.56 0.00 0.00 36.38 34.57 3n99 s VAL 217 CO 0.08 -0.48 -0.03 0.00 -0.31 0.00 0.00 175.10 174.35 3n99 s ALA 218 N -3.16 3.15 -0.21 1.32 0.00 -0.27 -1.05 121.76 121.53 3n99 s ALA 218 Ca 0.25 -1.02 -0.01 0.00 0.00 0.00 0.00 51.96 51.18 3n99 s ALA 218 Cb 0.03 -1.21 0.01 0.00 0.00 0.00 0.00 23.12 21.95 3n99 s ALA 218 CO 0.07 0.64 -0.11 0.42 0.00 0.00 0.00 175.76 176.78 3n99 s ILE 219 N -1.08 2.74 0.20 0.00 1.01 0.34 -0.57 121.20 123.85 3n99 s ILE 219 Ca 0.19 -0.81 -0.23 0.00 0.00 0.00 0.00 60.65 59.80 3n99 s ILE 219 Cb -0.11 -2.26 -0.08 0.00 0.01 0.00 0.00 42.46 40.02 3n99 s ILE 219 CO 0.10 0.41 0.77 -1.10 0.00 0.00 0.00 174.94 175.11 3n99 s GLN 220 N 1.36 4.43 -1.77 2.79 -0.21 0.10 -1.72 119.66 124.65 3n99 s GLN 220 Ca 0.04 1.05 0.00 0.00 0.02 0.00 0.00 55.36 56.46 3n99 s GLN 220 Cb -0.14 -3.06 0.00 0.00 1.00 0.00 0.00 33.01 30.81 3n99 s GLN 220 CO -0.07 0.47 0.00 -0.25 -2.12 0.00 0.00 175.29 173.32 3n99 n ASP 221 N 1.14 -5.42 -4.12 5.90 8.00 0.72 -2.89 116.55 119.88 3n99 n ASP 221 Ca -0.04 0.16 -0.29 0.00 0.71 0.00 0.00 54.79 55.33 3n99 n ASP 221 Cb 0.50 -4.52 -0.17 0.00 -0.02 0.00 0.00 41.12 36.92 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 -2.86 2.10 -0.14 1.24 3.76 -1.24 -1.00 115.29 117.14 3n99 s HIS 222 Ca 0.00 -0.87 -0.07 0.00 -0.15 0.00 0.00 55.06 53.97 3n99 s HIS 222 Cb 0.00 -1.45 -0.04 0.00 1.11 0.00 0.00 32.58 32.20 3n99 s HIS 222 CO 0.00 -0.39 0.11 0.34 -0.85 0.00 0.00 174.74 173.94 3n99 s ASP 223 N 0.58 6.08 -0.24 1.40 2.15 0.02 -3.46 116.67 123.20 3n99 s ASP 223 Ca -0.15 0.32 0.16 0.00 0.43 0.00 0.00 52.55 53.31 3n99 s ASP 223 Cb -0.17 -1.97 0.47 0.00 -0.30 0.00 0.00 42.92 40.95 3n99 s ASP 223 CO 0.05 0.32 1.16 0.59 -0.17 0.00 0.00 175.17 177.12 3n99 n ASN 224 N 2.54 2.89 0.15 -0.34 3.02 -1.26 -2.05 115.26 120.22 3n99 n ASN 224 Ca -0.18 -2.89 0.02 0.00 -0.03 0.00 0.00 54.58 51.50 3n99 n ASN 224 Cb 0.54 -0.41 0.19 0.00 -0.61 0.00 0.00 39.78 39.48 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 2.14 0.00 0.00 6.41 0.02 -1.95 -3.44 113.55 116.74 3n99 h SER 225 Ca 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 3n99 h SER 225 Cb 1.41 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.95 3n99 h SER 225 CO 0.39 0.51 0.00 -1.22 -1.14 0.00 0.00 176.83 175.37 3n99 n TYR 226 N -3.47 0.00 -1.04 3.45 4.01 -1.26 -4.96 117.16 113.88 3n99 n TYR 226 Ca 0.00 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.45 3n99 n TYR 226 Cb 0.63 0.00 0.17 0.00 -0.31 0.00 0.00 39.34 39.83 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 -0.45 1.59 -0.03 2.72 0.00 -1.22 -1.28 107.32 108.64 3n99 s GLY 227 Ca 0.00 -0.13 -0.22 0.00 0.00 0.00 0.00 44.72 44.37 3n99 s GLY 227 CO 0.00 0.43 0.63 0.14 0.00 0.00 0.00 173.10 174.31 3n99 s VAL 228 N -2.84 4.97 0.00 1.40 1.01 -0.47 -4.50 120.40 119.97 3n99 s VAL 228 Ca 0.65 1.31 0.00 0.00 0.00 0.00 0.00 61.98 63.95 3n99 s VAL 228 Cb -0.20 -3.97 0.00 0.00 0.00 0.00 0.00 36.38 32.21 3n99 s VAL 228 CO 0.59 0.35 0.00 0.61 0.00 0.00 0.00 175.10 176.64 3n99 n GLY 229 N 2.76 0.75 3.61 4.51 0.00 -1.23 -0.97 105.19 114.62 3n99 n GLY 229 Ca -0.05 -0.74 -0.43 0.00 0.00 0.00 0.00 46.02 44.81 3n99 n GLY 229 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3n99 s LYS 230 N -4.46 3.72 0.11 1.61 2.47 -0.87 -4.81 119.74 117.50 3n99 s LYS 230 Ca 0.00 1.12 -0.31 0.00 -1.56 0.00 0.00 55.97 55.22 3n99 s LYS 230 Cb 0.00 -3.97 -0.10 0.00 -1.46 0.00 0.00 37.83 32.30 3n99 s LYS 230 CO 0.00 -1.38 1.73 -0.47 0.16 0.00 0.00 175.35 175.39 3n99 s TYR 231 N 5.03 2.36 -0.19 4.03 5.04 -1.26 -0.80 117.35 131.55 3n99 s TYR 231 Ca 0.60 0.18 -0.07 0.00 -2.44 0.00 0.00 57.07 55.35 3n99 s TYR 231 Cb -0.16 -4.07 0.09 0.00 0.35 0.00 0.00 41.96 38.17 3n99 s TYR 231 CO 0.29 -4.32 0.41 0.50 -1.34 0.00 0.00 175.55 171.09 3n99 s ARG 232 N 2.52 0.32 0.04 4.97 3.52 -0.17 -4.91 118.95 125.23 3n99 s ARG 232 Ca 0.77 1.00 -0.32 0.00 -0.13 0.00 0.00 55.73 57.05 3n99 s ARG 232 Cb -0.43 0.29 -0.11 0.00 -1.56 0.00 0.00 34.95 33.14 3n99 s ARG 232 CO 0.34 -0.25 1.89 1.17 -0.81 0.00 0.00 175.30 177.64 3n99 n LYS 233 N 5.30 2.62 0.00 5.12 3.00 -1.26 -1.25 118.16 131.69 3n99 n LYS 233 Ca -0.10 0.96 0.00 0.00 -0.00 0.00 0.00 58.31 59.17 3n99 n LYS 233 Cb 0.50 -2.86 0.00 0.00 0.00 0.00 0.00 35.03 32.67 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 4.35 1.51 3.79 3.14 0.00 -1.26 -5.03 105.19 111.68 3n99 n GLY 234 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.39 2.53 -0.04 4.61 0.00 -0.38 -0.34 121.76 125.75 3n99 s ALA 235 Ca 0.00 0.34 -0.08 0.00 0.00 0.00 0.00 51.96 52.22 3n99 s ALA 235 Cb 0.00 -3.25 0.01 0.00 0.00 0.00 0.00 23.12 19.88 3n99 s ALA 235 CO 0.00 -1.27 0.18 0.54 0.00 0.00 0.00 175.76 175.21 3n99 s VAL 236 N -2.66 0.03 0.11 0.00 0.11 0.23 -0.20 120.40 118.02 3n99 s VAL 236 Ca 0.63 -0.27 0.08 0.00 -2.93 0.00 0.00 61.98 59.48 3n99 s VAL 236 Cb -0.17 -0.36 -0.04 0.00 -1.53 0.00 0.00 36.38 34.29 3n99 s VAL 236 CO 0.47 -0.15 -0.19 -0.44 -3.33 0.00 0.00 175.10 171.46 3n99 s SER 237 N -0.51 2.37 -0.03 3.54 0.01 -0.70 -1.64 113.70 116.73 3n99 s SER 237 Ca -0.06 -0.72 0.05 0.00 1.31 0.00 0.00 55.95 56.53 3n99 s SER 237 Cb -0.04 -0.12 -0.02 0.00 0.21 0.00 0.00 66.02 66.05 3n99 s SER 237 CO 0.01 -0.00 -0.18 -0.63 0.41 0.00 0.00 173.24 172.84 3n99 s ILE 238 N -1.45 2.73 0.24 1.44 -1.09 0.15 -0.50 121.20 122.72 3n99 s ILE 238 Ca 0.07 -0.90 -0.11 0.00 -2.23 0.00 0.00 60.65 57.48 3n99 s ILE 238 Cb -0.09 -2.05 -0.01 0.00 -1.58 0.00 0.00 42.46 38.74 3n99 s ILE 238 CO 0.04 0.55 0.43 -0.83 -1.23 0.00 0.00 174.94 173.91 3n99 s GLY 239 N -0.79 0.65 -0.08 6.18 0.00 -0.22 0.02 107.32 113.08 3n99 s GLY 239 Ca 0.11 -0.98 0.03 0.00 0.00 0.00 0.00 44.72 43.89 3n99 s GLY 239 CO 0.01 -0.73 -0.17 0.14 0.00 0.00 0.00 173.10 172.35 3n99 s VAL 240 N -4.03 2.72 -0.12 1.40 1.01 0.69 -0.12 120.40 121.95 3n99 s VAL 240 Ca 0.24 -0.82 -0.28 0.00 0.00 0.00 0.00 61.98 61.13 3n99 s VAL 240 Cb 0.00 -2.07 -0.01 0.00 0.00 0.00 0.00 36.38 34.30 3n99 s VAL 240 CO 0.09 0.56 0.94 -0.69 0.00 0.00 0.00 175.10 176.00 3n99 s VAL 241 N -0.20 4.83 -0.02 2.92 1.01 -0.20 -0.81 120.40 127.92 3n99 s VAL 241 Ca -0.01 1.89 0.01 0.00 0.00 0.00 0.00 61.98 63.88 3n99 s VAL 241 Cb -0.13 -4.25 -0.02 0.00 0.00 0.00 0.00 36.38 31.98 3n99 s VAL 241 CO 0.03 0.02 0.04 1.33 0.00 0.00 0.00 175.10 176.52 3n99 n VAL 242 N 4.57 0.00 -3.92 2.92 0.24 0.25 -0.33 118.33 122.06 3n99 n VAL 242 Ca 0.07 -0.21 -0.09 0.00 -2.04 0.00 0.00 64.34 62.07 3n99 n VAL 242 Cb 0.49 0.68 -0.06 0.00 -1.47 0.00 0.00 33.84 33.48 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 -1.70 0.28 0.89 6.34 -3.43 -1.26 -4.56 115.29 111.85 3n99 s HIS 243 Ca -0.00 -0.63 -0.14 0.00 -0.80 0.00 0.00 55.06 53.49 3n99 s HIS 243 Cb 0.01 0.11 0.15 0.00 -1.43 0.00 0.00 32.58 31.42 3n99 s HIS 243 CO 0.05 -0.84 1.25 -1.54 -2.00 0.00 0.00 174.74 171.66 3n99 s SER 244 N -2.96 3.71 0.98 7.38 1.04 -0.56 -3.09 113.70 120.20 3n99 s SER 244 Ca 0.17 0.43 -0.11 0.00 0.48 0.00 0.00 55.95 56.92 3n99 s SER 244 Cb 0.01 -0.66 0.17 0.00 0.10 0.00 0.00 66.02 65.64 3n99 s SER 244 CO 0.02 -2.37 1.05 0.00 0.98 0.00 0.00 173.24 172.93 3n99 n ALA 245 N -3.54 -1.45 -2.32 5.32 0.00 0.85 -3.81 120.51 115.55 3n99 n ALA 245 Ca 0.12 -0.71 -0.12 0.00 0.00 0.00 0.00 53.44 52.73 3n99 n ALA 245 Cb 0.60 -2.12 -0.10 0.00 0.00 0.00 0.00 19.45 17.83 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 0.23 0.48 -2.75 0.00 0.24 -1.26 -4.71 118.33 110.56 3n99 n VAL 247 Ca -0.14 -0.60 -0.31 0.00 -2.04 0.00 0.00 64.34 61.26 3n99 n VAL 247 Cb 0.59 -0.21 -0.03 0.00 -1.47 0.00 0.00 33.84 32.72 3n99 n VAL 247 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 3n99 s SER 248 N -4.95 6.52 0.23 -1.34 0.01 -1.24 -1.65 113.70 111.28 3n99 s SER 248 Ca -0.07 1.21 -0.32 0.00 1.31 0.00 0.00 55.95 58.08 3n99 s SER 248 Cb 0.11 -2.36 -0.12 0.00 0.21 0.00 0.00 66.02 63.86 3n99 s SER 248 CO 0.87 -0.45 1.66 0.00 0.41 0.00 0.00 173.24 175.73 3n99 n ALA 249 N -1.41 2.51 -0.41 1.44 0.00 -1.26 -2.25 120.51 119.13 3n99 n ALA 249 Ca 0.03 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.87 3n99 n ALA 249 Cb 0.54 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.51 3n99 n ALA 249 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3n99 n GLY 250 N 3.35 1.20 3.64 0.00 0.00 -1.26 -5.00 105.19 107.11 3n99 n GLY 250 Ca 0.14 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.04 2.61 -1.49 1.61 0.09 -0.95 -0.72 115.29 113.38 3n99 s HIS 251 Ca 0.00 -0.34 0.00 0.00 -0.00 0.00 0.00 55.06 54.72 3n99 s HIS 251 Cb 0.00 -1.37 0.00 0.00 -0.00 0.00 0.00 32.58 31.21 3n99 s HIS 251 CO 0.00 0.53 0.00 0.41 -0.00 0.00 0.00 174.74 175.68 3n99 n GLY 252 N -0.94 -1.11 3.66 -2.22 0.00 -1.21 -4.47 105.19 98.90 3n99 n GLY 252 Ca -0.05 -0.89 -0.49 0.00 0.00 0.00 0.00 46.02 44.60 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 1.90 -2.41 1.61 -0.02 -1.06 -4.32 135.00 130.70 3n99 n PRO 253 Ca 0.00 0.69 -0.33 0.00 -2.02 0.00 0.00 63.50 61.84 3n99 n PRO 253 Cb 0.00 -2.45 -0.03 0.00 -0.02 0.00 0.00 33.50 31.01 3n99 n PRO 253 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3n99 s GLY 254 N 1.88 2.32 -0.06 -1.23 0.00 -1.18 -0.85 107.32 108.20 3n99 s GLY 254 Ca 0.85 0.46 0.02 0.00 0.00 0.00 0.00 44.72 46.05 3n99 s GLY 254 CO 0.45 0.77 -0.11 0.14 0.00 0.00 0.00 173.10 174.35 3n99 s VAL 255 N -2.23 1.02 -0.21 1.40 1.01 0.77 -0.58 120.40 121.56 3n99 s VAL 255 Ca 0.64 -0.41 -0.08 0.00 0.00 0.00 0.00 61.98 62.14 3n99 s VAL 255 Cb -0.14 -0.94 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 3n99 s VAL 255 CO 0.26 0.33 0.07 -0.69 0.00 0.00 0.00 175.10 175.07 3n99 s VAL 256 N 0.68 4.64 0.13 2.92 1.01 0.01 -1.23 120.40 128.57 3n99 s VAL 256 Ca -0.14 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.47 3n99 s VAL 256 Cb -0.15 -3.12 -0.06 0.00 0.00 0.00 0.00 36.38 33.04 3n99 s VAL 256 CO 0.03 0.40 1.00 -0.69 0.00 0.00 0.00 175.10 175.85 3n99 s VAL 257 N 0.91 4.30 -0.08 2.92 1.01 -1.26 -0.22 120.40 127.98 3n99 s VAL 257 Ca 0.04 1.94 0.03 0.00 0.00 0.00 0.00 61.98 63.98 3n99 s VAL 257 Cb -0.14 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 31.97 3n99 s VAL 257 CO 0.03 0.31 0.10 2.30 0.00 0.00 0.00 175.10 177.83 3n99 n ILE 258 N 2.65 0.00 -3.70 2.22 -5.35 0.10 -4.47 119.36 110.82 3n99 n ILE 258 Ca 0.02 -0.28 -0.12 0.00 -0.27 0.00 0.00 62.75 62.10 3n99 n ILE 258 Cb 0.48 0.76 -0.09 0.00 -1.74 0.00 0.00 39.64 39.05 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 -1.67 0.56 -0.03 6.28 0.00 -0.89 -1.36 119.30 122.20 3n99 s MET 259 Ca 0.00 0.76 -0.09 0.00 0.00 0.00 0.00 55.69 56.37 3n99 s MET 259 Cb 0.02 0.22 0.01 0.00 0.00 0.00 0.00 34.83 35.08 3n99 s MET 259 CO 0.12 -0.09 0.19 -0.08 0.00 0.00 0.00 175.02 175.15 3n99 s THR 260 N 0.59 0.05 -2.71 10.11 -1.32 0.10 0.34 115.64 122.81 3n99 s THR 260 Ca -0.03 -0.44 0.00 0.00 -1.21 0.00 0.00 61.69 60.01 3n99 s THR 260 Cb -0.05 -0.42 0.00 0.00 -1.51 0.00 0.00 72.50 70.52 3n99 s THR 260 CO -0.04 -0.24 0.00 0.61 -2.21 0.00 0.00 174.62 172.74 3n99 n GLY 261 N 1.88 -0.57 3.93 6.08 0.00 -0.65 -0.92 105.19 114.93 3n99 n GLY 261 Ca -0.19 -0.73 -0.29 0.00 0.00 0.00 0.00 46.02 44.81 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 6.38 0.59 1.61 -1.08 -1.26 -0.60 116.67 118.30 3n99 s ASP 262 Ca 0.00 0.32 0.30 0.00 -0.52 0.00 0.00 52.55 52.65 3n99 s ASP 262 Cb 0.00 -1.98 1.80 0.00 -1.46 0.00 0.00 42.92 41.28 3n99 s ASP 262 CO 0.00 0.07 2.24 1.05 0.52 0.00 0.00 175.17 179.05 3n99 h GLU 263 N 2.52 0.00 0.00 4.34 4.11 -0.92 -1.08 114.58 123.54 3n99 h GLU 263 Ca -0.47 0.00 -0.01 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 0.72 0.01 -0.03 0.66 0.07 0.00 0.00 179.01 180.44 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 -0.10 0.00 -0.47 0.00 0.00 61.79 61.22 3n99 h SER 264 Cb 0.04 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.11 3n99 h SER 264 CO 0.00 0.03 -1.38 0.29 -0.87 0.00 0.00 176.83 174.89 3n99 n LYS 265 N -3.23 2.89 -3.90 4.77 4.76 -0.52 -4.87 118.16 118.06 3n99 n LYS 265 Ca -0.02 0.00 -0.35 0.00 -2.87 0.00 0.00 58.31 55.07 3n99 n LYS 265 Cb 0.18 -1.14 -0.14 0.00 -1.84 0.00 0.00 35.03 32.09 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 -2.14 3.36 -0.54 -0.18 1.01 -0.54 -0.02 121.20 122.16 3n99 s ILE 266 Ca -0.03 -0.56 -0.01 0.00 0.00 0.00 0.00 60.65 60.06 3n99 s ILE 266 Cb 0.02 -2.56 0.14 0.00 0.01 0.00 0.00 42.46 40.07 3n99 s ILE 266 CO 0.22 0.38 0.32 -0.76 0.00 0.00 0.00 174.94 175.11 3n99 s LEU 267 N 1.47 4.99 0.25 2.97 1.02 0.16 -4.54 118.68 125.00 3n99 s LEU 267 Ca 0.05 -2.68 -0.30 0.00 0.02 0.00 0.00 54.13 51.22 3n99 s LEU 267 Cb -0.15 -1.78 -0.09 0.00 0.02 0.00 0.00 46.19 44.19 3n99 s LEU 267 CO -0.03 -0.37 1.23 -2.84 0.02 0.00 0.00 176.35 174.36 3n99 s PRO 268 N 0.19 4.47 -0.15 1.29 0.02 -1.26 -1.16 135.00 138.38 3n99 s PRO 268 Ca 0.15 1.99 0.00 0.00 0.02 0.00 0.00 61.00 63.16 3n99 s PRO 268 Cb -0.22 -3.18 0.02 0.00 0.02 0.00 0.00 34.50 31.15 3n99 s PRO 268 CO -0.03 -0.09 -0.15 -1.21 -0.33 0.00 0.00 177.00 175.20 3n99 s GLU 269 N -0.85 2.37 0.09 5.54 2.02 0.10 -4.86 118.70 123.11 3n99 s GLU 269 Ca 0.51 -0.59 -0.31 0.00 0.02 0.00 0.00 54.97 54.60 3n99 s GLU 269 Cb -0.35 -2.16 -0.06 0.00 0.10 0.00 0.00 34.13 31.65 3n99 s GLU 269 CO 0.42 -0.24 1.22 -2.00 0.02 0.00 0.00 175.26 174.68 3n99 s GLU 270 N 1.46 4.43 0.22 1.61 2.12 -1.26 -0.57 118.70 126.72 3n99 s GLU 270 Ca 0.05 1.82 0.01 0.00 0.36 0.00 0.00 54.97 57.20 3n99 s GLU 270 Cb -0.13 -3.32 -0.05 0.00 0.26 0.00 0.00 34.13 30.89 3n99 s GLU 270 CO -0.11 -0.25 0.07 0.14 -0.54 0.00 0.00 175.26 174.58 3n99 s VAL 271 N 0.89 0.46 0.13 3.70 -7.23 -0.32 -4.88 120.40 113.15 3n99 s VAL 271 Ca 0.58 -1.99 -0.11 0.00 -1.81 0.00 0.00 61.98 58.65 3n99 s VAL 271 Cb -0.31 -2.44 -0.08 0.00 0.56 0.00 0.00 36.38 34.11 3n99 s VAL 271 CO 0.30 -0.16 1.42 -0.33 -0.31 0.00 0.00 175.10 176.02 3n99 h GLU 272 N 2.54 0.88 -3.79 4.82 5.08 -1.93 -3.39 114.58 118.79 3n99 h GLU 272 Ca -0.37 -0.55 -0.35 0.00 -1.00 0.00 0.00 59.36 57.09 3n99 h GLU 272 Cb 1.23 0.06 -0.34 0.00 0.50 0.00 0.00 28.75 30.21 3n99 h GLU 272 CO 0.60 1.19 -0.75 0.50 -1.00 0.00 0.00 179.01 179.54 3n99 s ARG 273 N -4.16 0.39 -0.41 2.33 3.52 -1.26 -4.95 118.95 114.41 3n99 s ARG 273 Ca -0.11 0.03 0.07 0.00 -0.13 0.00 0.00 55.73 55.60 3n99 s ARG 273 Cb 0.10 -0.53 0.18 0.00 -1.56 0.00 0.00 34.95 33.15 3n99 s ARG 273 CO 0.89 -0.11 0.61 0.00 -0.81 0.00 0.00 175.30 175.87 3n99 s ALA 274 N 0.93 -2.12 -0.09 6.12 0.00 -1.26 -4.95 121.76 120.38 3n99 s ALA 274 Ca -0.10 0.03 -0.05 0.00 0.00 0.00 0.00 51.96 51.84 3n99 s ALA 274 Cb -0.13 -2.66 0.04 0.00 0.00 0.00 0.00 23.12 20.37 3n99 s ALA 274 CO -0.01 -2.21 0.20 1.21 0.00 0.00 0.00 175.76 174.95 3n99 s ASN 275 N 1.73 -0.20 0.50 0.00 3.84 -1.26 -0.94 114.94 118.61 3n99 s ASN 275 Ca 0.17 0.43 0.33 0.00 0.21 0.00 0.00 52.86 54.00 3n99 s ASN 275 Cb -0.05 0.34 1.54 0.00 -0.55 0.00 0.00 41.25 42.53 3n99 s ASN 275 CO -0.06 -0.14 2.00 0.16 -2.79 0.00 0.00 177.10 176.26 3n99 h ILE 276 N 5.73 0.00 0.00 -5.21 3.07 -1.47 -2.50 117.51 117.13 3n99 h ILE 276 Ca -0.38 -0.29 -0.00 0.00 1.55 0.00 0.00 64.86 65.73 3n99 h ILE 276 Cb 1.16 1.19 -0.00 0.00 -0.27 0.00 0.00 36.82 38.90 3n99 h ILE 276 CO 0.39 0.00 -0.02 0.77 -1.05 0.00 0.00 178.15 178.24 3n99 h SER 277 N 0.00 0.00 0.42 2.16 4.64 -1.91 -0.84 113.55 118.02 3n99 h SER 277 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 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 -0.13 0.44 -0.87 0.00 0.00 176.83 176.29 3n99 h ASP 278 N 0.00 0.00 -0.41 4.97 3.32 -1.86 -2.92 116.42 119.53 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 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 3n99 h ASP 278 CO 0.00 0.13 0.00 -1.22 -1.72 0.00 0.00 179.24 176.43 3n99 n TYR 279 N -3.62 0.96 0.00 4.55 4.01 -0.33 -5.16 117.16 117.56 3n99 n TYR 279 Ca -0.02 -0.67 0.00 0.00 -0.16 0.00 0.00 57.90 57.06 3n99 n TYR 279 Cb 0.26 -0.20 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 3n99 n TYR 279 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68