#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c37 n GLU 3 N 0.00 0.63 0.19 5.56 1.02 -1.26 -3.88 120.64 122.91 2c37 n GLU 3 Ca 0.00 0.01 0.12 0.00 -0.02 0.00 0.00 57.16 57.27 2c37 n GLU 3 Cb 0.00 -1.70 0.13 0.00 -0.02 0.00 0.00 31.44 29.85 2c37 n GLU 3 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 2c37 h MET 4 N 0.00 0.00 -5.47 3.49 2.86 -2.14 -3.43 114.93 110.24 2c37 h MET 4 Ca -0.04 0.00 -0.54 0.00 -2.06 0.00 0.00 59.70 57.06 2c37 h MET 4 Cb 1.12 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.73 2c37 h MET 4 CO 0.01 0.00 1.83 -0.11 1.06 0.00 0.00 176.91 179.70 2c37 n LEU 5 N -3.00 4.27 -4.72 1.22 7.94 -1.25 -4.93 117.00 116.53 2c37 n LEU 5 Ca 0.03 -3.57 -0.32 0.00 -1.11 0.00 0.00 56.01 51.04 2c37 n LEU 5 Cb 0.53 -1.70 0.12 0.00 0.53 0.00 0.00 43.42 42.90 2c37 n LEU 5 CO 0.35 -0.61 0.72 -1.58 -1.11 0.00 0.00 177.39 175.16 2c37 s GLN 6 N 5.10 1.82 0.00 1.96 0.74 -1.26 -5.03 119.66 122.99 2c37 s GLN 6 Ca 0.59 1.46 0.00 0.00 0.05 0.00 0.00 55.36 57.47 2c37 s GLN 6 Cb 0.04 -1.83 0.00 0.00 1.10 0.00 0.00 33.01 32.32 2c37 s GLN 6 CO 0.09 -2.02 0.00 1.33 -0.55 0.00 0.00 175.29 174.15 2c37 n VAL 7 N -3.50 0.00 0.00 1.34 0.24 -1.26 -5.04 118.33 110.11 2c37 n VAL 7 Ca 0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.41 2c37 n VAL 7 Cb 0.52 -0.01 0.00 0.00 -1.47 0.00 0.00 33.84 32.88 2c37 n VAL 7 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 2c37 n GLU 8 N 0.00 0.00 -2.09 7.34 0.00 -1.26 -5.05 120.64 119.58 2c37 n GLU 8 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 57.16 56.75 2c37 n GLU 8 Cb 0.00 -0.50 -0.02 0.00 0.00 0.00 0.00 31.44 30.92 2c37 n GLU 8 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 2c37 s ARG 9 N -1.00 4.33 0.54 3.44 3.52 -1.26 -5.02 118.95 123.50 2c37 s ARG 9 Ca 0.00 2.23 -0.18 0.00 -0.13 0.00 0.00 55.73 57.65 2c37 s ARG 9 Cb 0.00 -3.09 -0.06 0.00 -1.56 0.00 0.00 34.95 30.24 2c37 s ARG 9 CO 0.00 -0.26 1.05 -1.25 -0.81 0.00 0.00 175.30 174.03 2c37 s PRO 10 N -1.29 3.56 0.31 5.12 0.04 -1.26 -5.05 135.00 136.43 2c37 s PRO 10 Ca 0.52 1.28 -0.29 0.00 0.04 0.00 0.00 61.00 62.55 2c37 s PRO 10 Cb -0.40 -2.06 -0.10 0.00 0.04 0.00 0.00 34.50 31.98 2c37 s PRO 10 CO 0.49 -0.62 1.21 0.15 0.04 0.00 0.00 177.00 178.28 2c37 s LYS 11 N -3.67 4.48 -0.03 4.56 -0.14 -1.26 -4.95 119.74 118.73 2c37 s LYS 11 Ca 0.65 2.03 0.12 0.00 -1.36 0.00 0.00 55.97 57.41 2c37 s LYS 11 Cb -0.16 -3.12 -0.18 0.00 -1.68 0.00 0.00 37.83 32.68 2c37 s LYS 11 CO 0.29 -0.01 0.23 1.28 -0.76 0.00 0.00 175.35 176.38 2c37 n LEU 12 N 0.98 0.00 -4.37 3.17 4.77 -1.26 -4.86 117.00 115.43 2c37 n LEU 12 Ca -0.01 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.62 2c37 n LEU 12 Cb 0.43 0.05 -0.13 0.00 -2.33 0.00 0.00 43.42 41.43 2c37 n LEU 12 CO 0.57 0.05 -0.32 -0.63 -1.33 0.00 0.00 177.39 175.72 2c37 s ILE 13 N -2.76 3.85 0.00 -0.08 -1.09 -1.26 -3.71 121.20 116.15 2c37 s ILE 13 Ca -0.05 -0.40 0.00 0.00 -2.23 0.00 0.00 60.65 57.97 2c37 s ILE 13 Cb 0.07 -2.81 0.00 0.00 -1.58 0.00 0.00 42.46 38.14 2c37 s ILE 13 CO 0.50 0.33 0.00 0.18 -1.23 0.00 0.00 174.94 174.72 2c37 n LEU 14 N 4.86 0.00 -4.66 2.97 4.77 0.25 -4.93 117.00 120.26 2c37 n LEU 14 Ca -0.17 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.43 2c37 n LEU 14 Cb 0.51 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.65 2c37 n LEU 14 CO 0.30 0.00 0.70 -0.67 -1.33 0.00 0.00 177.39 176.39 2c37 n ASP 15 N 0.00 1.42 0.00 -1.43 2.03 -1.26 -3.41 116.55 113.90 2c37 n ASP 15 Ca 0.00 0.85 0.00 0.00 0.52 0.00 0.00 54.79 56.16 2c37 n ASP 15 Cb 0.00 -1.46 0.00 0.00 -0.72 0.00 0.00 41.12 38.94 2c37 n ASP 15 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2c37 n ASP 16 N -0.99 0.00 -1.52 1.67 8.00 -1.26 -1.34 116.55 121.10 2c37 n ASP 16 Ca 0.13 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.50 2c37 n ASP 16 Cb 0.47 0.00 0.12 0.00 -0.02 0.00 0.00 41.12 41.68 2c37 n ASP 16 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2c37 n GLY 17 N 0.00 5.64 3.92 0.44 0.00 -1.26 -5.08 105.19 108.84 2c37 n GLY 17 Ca 0.00 -1.92 -0.26 0.00 0.00 0.00 0.00 46.02 43.85 2c37 n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c37 s LYS 18 N -3.45 3.33 0.53 1.61 1.02 -0.45 -4.18 119.74 118.15 2c37 s LYS 18 Ca 0.48 -0.66 0.04 0.00 0.02 0.00 0.00 55.97 55.85 2c37 s LYS 18 Cb 0.41 -2.90 0.04 0.00 -0.52 0.00 0.00 37.83 34.87 2c37 s LYS 18 CO -0.00 0.51 0.73 1.03 -0.92 0.00 0.00 175.35 176.70 2c37 s ARG 19 N -3.24 2.52 0.55 1.68 0.52 0.52 0.86 118.95 122.36 2c37 s ARG 19 Ca 0.34 -1.06 0.26 0.00 -0.52 0.00 0.00 55.73 54.75 2c37 s ARG 19 Cb -0.11 -2.58 1.44 0.00 0.52 0.00 0.00 34.95 34.23 2c37 s ARG 19 CO 0.27 -0.66 1.99 1.79 0.02 0.00 0.00 175.30 178.72 2c37 h THR 20 N 0.20 0.64 -0.56 0.02 1.35 -1.88 0.21 112.91 112.90 2c37 h THR 20 Ca -0.39 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.47 2c37 h THR 20 Cb 1.29 0.73 0.00 0.00 -1.73 0.00 0.00 68.15 68.44 2c37 h THR 20 CO 0.47 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 174.84 2c37 n ASP 21 N -4.21 3.30 0.00 5.36 3.85 -1.26 -4.94 116.55 118.66 2c37 n ASP 21 Ca 0.09 -1.98 0.00 0.00 -0.71 0.00 0.00 54.79 52.19 2c37 n ASP 21 Cb 0.59 -0.37 0.00 0.00 -1.35 0.00 0.00 41.12 39.99 2c37 n ASP 21 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2c37 n GLY 22 N 1.49 0.78 3.82 6.12 0.00 0.74 -5.05 105.19 113.09 2c37 n GLY 22 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 2c37 n GLY 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c37 s ARG 23 N -0.41 3.93 0.72 1.61 0.52 -1.26 -4.63 118.95 119.44 2c37 s ARG 23 Ca 0.00 1.10 -0.12 0.00 -0.52 0.00 0.00 55.73 56.20 2c37 s ARG 23 Cb 0.00 -2.13 0.03 0.00 0.52 0.00 0.00 34.95 33.37 2c37 s ARG 23 CO 0.00 -0.29 1.10 0.15 0.02 0.00 0.00 175.30 176.28 2c37 s LYS 24 N -3.66 2.70 0.56 3.54 1.02 -1.26 -0.36 119.74 122.29 2c37 s LYS 24 Ca 0.62 0.45 0.25 0.00 0.02 0.00 0.00 55.97 57.30 2c37 s LYS 24 Cb -0.11 -2.01 1.61 0.00 -0.52 0.00 0.00 37.83 36.80 2c37 s LYS 24 CO 0.24 -1.14 2.20 -1.35 -0.92 0.00 0.00 175.35 174.38 2c37 h PRO 25 N -0.73 0.00 -0.66 -1.68 0.11 -1.90 -2.70 132.00 124.44 2c37 h PRO 25 Ca -0.45 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.50 2c37 h PRO 25 Cb 1.26 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.28 2c37 h PRO 25 CO 0.64 0.00 0.18 -0.40 -0.21 0.00 0.00 178.00 178.21 2c37 n ASP 26 N -4.10 4.92 -4.42 -2.05 5.75 -1.26 -0.68 116.55 114.71 2c37 n ASP 26 Ca -0.02 -3.17 -0.33 0.00 -0.01 0.00 0.00 54.79 51.26 2c37 n ASP 26 Cb 0.12 -0.72 -0.14 0.00 -1.03 0.00 0.00 41.12 39.36 2c37 n ASP 26 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2c37 s GLU 27 N -2.95 3.26 0.60 0.11 2.02 -1.02 -0.49 118.70 120.23 2c37 s GLU 27 Ca 0.54 -0.65 -0.13 0.00 0.02 0.00 0.00 54.97 54.75 2c37 s GLU 27 Cb 0.43 -2.64 -0.04 0.00 0.10 0.00 0.00 34.13 31.98 2c37 s GLU 27 CO 0.13 0.31 1.03 -0.51 0.02 0.00 0.00 175.26 176.25 2c37 s LEU 28 N 0.10 3.36 0.87 1.80 1.43 -1.11 -4.74 118.68 120.39 2c37 s LEU 28 Ca -0.05 1.56 -0.12 0.00 -1.03 0.00 0.00 54.13 54.49 2c37 s LEU 28 Cb -0.14 -4.49 0.11 0.00 0.03 0.00 0.00 46.19 41.69 2c37 s LEU 28 CO 0.04 -0.95 1.12 -0.13 0.23 0.00 0.00 176.35 176.66 2c37 s ARG 29 N -4.69 1.52 0.47 1.70 0.52 -1.26 -3.81 118.95 113.40 2c37 s ARG 29 Ca 0.58 0.45 -0.24 0.00 -0.52 0.00 0.00 55.73 56.00 2c37 s ARG 29 Cb -0.12 -1.87 -0.07 0.00 0.52 0.00 0.00 34.95 33.41 2c37 s ARG 29 CO 0.46 -1.97 1.29 -1.54 0.02 0.00 0.00 175.30 173.56 2c37 s SER 30 N -3.96 5.90 -0.04 0.23 1.04 -1.26 -4.56 113.70 111.05 2c37 s SER 30 Ca 0.63 2.61 0.05 0.00 0.48 0.00 0.00 55.95 59.72 2c37 s SER 30 Cb -0.15 -2.63 -0.01 0.00 0.10 0.00 0.00 66.02 63.34 2c37 s SER 30 CO 0.54 -1.13 -0.20 -0.63 0.98 0.00 0.00 173.24 172.80 2c37 s ILE 31 N -1.35 1.66 -0.04 -1.02 1.01 0.34 -0.63 121.20 121.18 2c37 s ILE 31 Ca 0.64 -0.86 0.01 0.00 0.00 0.00 0.00 60.65 60.44 2c37 s ILE 31 Cb -0.37 -1.41 0.02 0.00 0.01 0.00 0.00 42.46 40.71 2c37 s ILE 31 CO 0.45 0.47 -0.05 -0.75 0.00 0.00 0.00 174.94 175.06 2c37 s LYS 32 N -0.14 0.76 -0.03 2.79 2.20 -0.58 -0.25 119.74 124.49 2c37 s LYS 32 Ca -0.01 -0.13 0.01 0.00 -0.36 0.00 0.00 55.97 55.48 2c37 s LYS 32 Cb -0.11 -0.76 0.02 0.00 -1.51 0.00 0.00 37.83 35.46 2c37 s LYS 32 CO 0.02 -0.03 -0.02 0.42 -0.36 0.00 0.00 175.35 175.37 2c37 s ILE 33 N 0.69 0.34 0.01 5.43 1.01 -0.39 -0.16 121.20 128.12 2c37 s ILE 33 Ca -0.09 -0.03 -0.00 0.00 0.00 0.00 0.00 60.65 60.53 2c37 s ILE 33 Cb -0.12 -0.39 -0.01 0.00 0.01 0.00 0.00 42.46 41.95 2c37 s ILE 33 CO 0.00 0.17 -0.00 -1.83 0.00 0.00 0.00 174.94 173.28 2c37 s GLU 34 N 0.85 0.15 0.23 2.79 -1.05 -0.68 -0.67 118.70 120.32 2c37 s GLU 34 Ca -0.10 -0.25 0.10 0.00 -0.15 0.00 0.00 54.97 54.57 2c37 s GLU 34 Cb -0.13 0.05 -0.04 0.00 -0.44 0.00 0.00 34.13 33.57 2c37 s GLU 34 CO -0.01 -0.02 -0.11 -0.51 0.95 0.00 0.00 175.26 175.56 2c37 s LEU 35 N -0.63 2.89 -1.06 1.83 1.02 -0.37 -0.45 118.68 121.91 2c37 s LEU 35 Ca -0.07 -0.73 -0.07 0.00 0.02 0.00 0.00 54.13 53.29 2c37 s LEU 35 Cb -0.04 -1.50 0.01 0.00 0.02 0.00 0.00 46.19 44.68 2c37 s LEU 35 CO -0.00 0.06 0.90 0.61 0.02 0.00 0.00 176.35 177.94 2c37 n GLY 36 N -0.34 -0.21 0.13 -3.19 0.00 -0.08 -4.92 105.19 96.57 2c37 n GLY 36 Ca -0.09 0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.09 2c37 n GLY 36 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2c37 h VAL 37 N -2.06 0.00 -3.48 1.61 3.04 -1.85 -3.44 116.25 110.07 2c37 h VAL 37 Ca -0.44 -0.95 -0.65 0.00 -1.01 0.00 0.00 66.70 63.65 2c37 h VAL 37 Cb 1.29 1.53 -0.24 0.00 -2.01 0.00 0.00 31.29 31.86 2c37 h VAL 37 CO 0.44 0.00 -0.67 -0.76 -1.01 0.00 0.00 177.57 175.57 2c37 s LEU 38 N -5.39 3.21 0.23 3.16 1.43 -1.26 -5.01 118.68 115.05 2c37 s LEU 38 Ca 0.01 -0.25 0.01 0.00 -1.03 0.00 0.00 54.13 52.87 2c37 s LEU 38 Cb 0.09 -1.83 0.23 0.00 0.03 0.00 0.00 46.19 44.72 2c37 s LEU 38 CO 0.77 0.02 1.57 0.11 0.23 0.00 0.00 176.35 179.05 2c37 h LYS 39 N 7.85 0.41 -0.14 1.70 6.56 -2.01 -3.25 116.57 127.69 2c37 h LYS 39 Ca -0.38 -0.24 0.00 0.00 -1.06 0.00 0.00 60.65 58.97 2c37 h LYS 39 Cb 1.17 0.02 0.00 0.00 -0.57 0.00 0.00 32.23 32.85 2c37 h LYS 39 CO 0.60 0.83 0.00 0.09 -2.06 0.00 0.00 179.45 178.91 2c37 n ASN 40 N -3.96 2.35 -4.96 0.86 3.02 -1.26 -4.88 115.26 106.43 2c37 n ASN 40 Ca -0.02 -1.79 -0.22 0.00 -0.03 0.00 0.00 54.58 52.51 2c37 n ASN 40 Cb 0.57 -0.08 -0.00 0.00 -0.61 0.00 0.00 39.78 39.65 2c37 n ASN 40 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2c37 s ALA 41 N -1.84 3.83 0.10 5.41 0.00 -1.23 -5.02 121.76 123.01 2c37 s ALA 41 Ca 0.34 -1.09 0.02 0.00 0.00 0.00 0.00 51.96 51.22 2c37 s ALA 41 Cb 0.20 -2.02 -0.24 0.00 0.00 0.00 0.00 23.12 21.06 2c37 s ALA 41 CO 0.30 -0.16 1.22 -0.44 0.00 0.00 0.00 175.76 176.68 2c37 h ASP 42 N 0.65 0.20 -4.99 0.00 3.32 -1.18 -3.46 116.42 110.97 2c37 h ASP 42 Ca -0.48 -0.22 -0.12 0.00 0.02 0.00 0.00 57.03 56.23 2c37 h ASP 42 Cb 1.24 -0.07 -0.20 0.00 0.22 0.00 0.00 39.33 40.52 2c37 h ASP 42 CO 0.58 1.17 -0.34 -0.83 -1.72 0.00 0.00 179.24 178.09 2c37 s GLY 43 N -4.68 -0.09 0.08 2.75 0.00 -1.03 -3.91 107.32 100.44 2c37 s GLY 43 Ca -0.01 0.16 -0.14 0.00 0.00 0.00 0.00 44.72 44.73 2c37 s GLY 43 CO 0.85 -0.03 0.32 -1.35 0.00 0.00 0.00 173.10 172.89 2c37 s SER 44 N -1.39 -0.12 -0.12 1.64 1.04 -1.26 -0.42 113.70 113.08 2c37 s SER 44 Ca -0.14 -0.32 -0.21 0.00 0.48 0.00 0.00 55.95 55.76 2c37 s SER 44 Cb -0.06 0.40 0.05 0.00 0.10 0.00 0.00 66.02 66.51 2c37 s SER 44 CO 0.03 -0.73 0.52 0.00 0.98 0.00 0.00 173.24 174.05 2c37 s ALA 45 N -3.27 -1.32 -0.12 5.32 0.00 -0.65 -0.91 121.76 120.81 2c37 s ALA 45 Ca -0.00 1.21 -0.02 0.00 0.00 0.00 0.00 51.96 53.15 2c37 s ALA 45 Cb 0.01 -0.45 -0.03 0.00 0.00 0.00 0.00 23.12 22.66 2c37 s ALA 45 CO -0.08 -0.29 -0.06 0.42 0.00 0.00 0.00 175.76 175.75 2c37 s ILE 46 N -0.44 3.71 -0.03 0.00 1.01 0.41 -1.03 121.20 124.83 2c37 s ILE 46 Ca -0.06 -0.44 0.05 0.00 0.00 0.00 0.00 60.65 60.21 2c37 s ILE 46 Cb -0.03 -2.58 -0.01 0.00 0.01 0.00 0.00 42.46 39.85 2c37 s ILE 46 CO 0.04 0.53 -0.19 0.12 0.00 0.00 0.00 174.94 175.45 2c37 s PHE 47 N -0.04 1.75 -0.08 3.97 5.36 -0.20 -1.68 117.98 127.05 2c37 s PHE 47 Ca 0.00 -0.40 -0.00 0.00 -0.96 0.00 0.00 56.93 55.57 2c37 s PHE 47 Cb -0.13 -1.14 0.02 0.00 -0.34 0.00 0.00 43.02 41.43 2c37 s PHE 47 CO 0.03 -0.09 -0.04 -1.21 -1.46 0.00 0.00 175.22 172.45 2c37 s GLU 48 N -0.26 1.04 -0.27 10.12 2.02 0.77 -1.06 118.70 131.06 2c37 s GLU 48 Ca 0.03 -0.10 0.01 0.00 0.02 0.00 0.00 54.97 54.93 2c37 s GLU 48 Cb -0.09 -1.17 0.05 0.00 0.10 0.00 0.00 34.13 33.02 2c37 s GLU 48 CO 0.00 -0.21 -0.08 -1.64 0.02 0.00 0.00 175.26 173.36 2c37 s MET 49 N 1.51 2.40 4.77 1.61 -1.94 -0.13 -1.53 119.30 126.00 2c37 s MET 49 Ca -0.01 -1.26 0.00 0.00 -1.71 0.00 0.00 55.69 52.71 2c37 s MET 49 Cb -0.13 -2.96 0.00 0.00 2.01 0.00 0.00 34.83 33.75 2c37 s MET 49 CO -0.04 -0.55 0.00 0.41 -0.01 0.00 0.00 175.02 174.83 2c37 n GLY 50 N 4.52 3.37 0.84 -0.03 0.00 0.20 -0.94 105.19 113.14 2c37 n GLY 50 Ca -0.14 0.12 0.08 0.00 0.00 0.00 0.00 46.02 46.08 2c37 n GLY 50 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2c37 n ASN 51 N 5.10 2.45 -4.58 1.61 3.02 -1.26 -4.79 115.26 116.80 2c37 n ASN 51 Ca 0.00 -1.95 -0.42 0.00 -0.03 0.00 0.00 54.58 52.19 2c37 n ASN 51 Cb 0.00 -0.27 -0.07 0.00 -0.61 0.00 0.00 39.78 38.83 2c37 n ASN 51 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2c37 s THR 52 N -1.46 4.90 -0.12 3.41 2.01 -0.11 -4.30 115.64 119.98 2c37 s THR 52 Ca 0.32 0.66 0.01 0.00 0.31 0.00 0.00 61.69 63.00 2c37 s THR 52 Cb 0.17 -4.05 -0.01 0.00 0.01 0.00 0.00 72.50 68.62 2c37 s THR 52 CO 0.23 -0.26 -0.16 -0.54 -0.69 0.00 0.00 174.62 173.20 2c37 s LYS 53 N 2.68 3.27 0.02 4.92 1.02 -0.62 -0.95 119.74 130.07 2c37 s LYS 53 Ca 0.25 -0.73 0.03 0.00 0.02 0.00 0.00 55.97 55.54 2c37 s LYS 53 Cb -0.15 -2.54 -0.01 0.00 -0.52 0.00 0.00 37.83 34.61 2c37 s LYS 53 CO 0.14 0.23 -0.10 0.00 -0.92 0.00 0.00 175.35 174.70 2c37 s ALA 54 N 0.30 0.81 -0.03 5.17 0.00 -0.23 -0.73 121.76 127.05 2c37 s ALA 54 Ca -0.12 -0.58 0.06 0.00 0.00 0.00 0.00 51.96 51.32 2c37 s ALA 54 Cb -0.16 -0.13 -0.02 0.00 0.00 0.00 0.00 23.12 22.80 2c37 s ALA 54 CO 0.06 0.15 -0.19 -1.50 0.00 0.00 0.00 175.76 174.28 2c37 s ILE 55 N -0.62 2.69 -0.04 0.00 2.07 -0.01 -1.03 121.20 124.25 2c37 s ILE 55 Ca 0.00 -0.91 0.02 0.00 -1.41 0.00 0.00 60.65 58.35 2c37 s ILE 55 Cb -0.06 -2.03 0.01 0.00 0.13 0.00 0.00 42.46 40.51 2c37 s ILE 55 CO 0.00 0.55 -0.09 0.00 -1.91 0.00 0.00 174.94 173.49 2c37 s ALA 56 N -0.72 0.95 -0.04 1.50 0.00 -0.20 -0.40 121.76 122.86 2c37 s ALA 56 Ca 0.11 -0.29 0.07 0.00 0.00 0.00 0.00 51.96 51.85 2c37 s ALA 56 Cb -0.10 -0.42 -0.01 0.00 0.00 0.00 0.00 23.12 22.58 2c37 s ALA 56 CO 0.01 0.10 -0.24 0.00 0.00 0.00 0.00 175.76 175.63 2c37 s ALA 57 N 0.51 2.03 -0.15 0.00 0.00 -0.33 -1.64 121.76 122.18 2c37 s ALA 57 Ca -0.09 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 50.86 2c37 s ALA 57 Cb -0.12 -0.57 -0.00 0.00 0.00 0.00 0.00 23.12 22.42 2c37 s ALA 57 CO 0.01 0.45 -0.17 0.08 0.00 0.00 0.00 175.76 176.14 2c37 s VAL 58 N -0.36 2.57 -0.41 0.00 1.01 0.44 -0.90 120.40 122.74 2c37 s VAL 58 Ca 0.03 -0.81 -0.09 0.00 0.00 0.00 0.00 61.98 61.11 2c37 s VAL 58 Cb -0.11 -2.07 0.07 0.00 0.00 0.00 0.00 36.38 34.27 2c37 s VAL 58 CO 0.01 0.52 0.24 -0.31 0.00 0.00 0.00 175.10 175.56 2c37 s TYR 59 N 0.76 3.32 1.10 5.22 1.51 0.24 -0.60 117.35 128.90 2c37 s TYR 59 Ca -0.07 -1.43 -0.18 0.00 -1.01 0.00 0.00 57.07 54.39 2c37 s TYR 59 Cb -0.15 -2.82 0.28 0.00 -0.11 0.00 0.00 41.96 39.15 2c37 s TYR 59 CO 0.00 -0.81 0.62 0.41 -1.11 0.00 0.00 175.55 174.67 2c37 n GLY 60 N 4.92 -3.55 3.68 0.71 0.00 -1.26 -2.18 105.19 107.50 2c37 n GLY 60 Ca -0.10 -1.15 -0.47 0.00 0.00 0.00 0.00 46.02 44.29 2c37 n GLY 60 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2c37 n PRO 61 N -4.34 2.29 -3.77 1.61 -0.02 -1.26 -4.64 135.00 124.87 2c37 n PRO 61 Ca 0.10 0.84 -0.13 0.00 -2.02 0.00 0.00 63.50 62.28 2c37 n PRO 61 Cb 0.43 -2.68 -0.10 0.00 -0.02 0.00 0.00 33.50 31.13 2c37 n PRO 61 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2c37 s LYS 62 N 3.41 0.51 0.32 -0.52 -2.85 -1.00 -4.95 119.74 114.67 2c37 s LYS 62 Ca 0.89 0.13 -0.27 0.00 -1.00 0.00 0.00 55.97 55.72 2c37 s LYS 62 Cb -0.65 0.24 -0.13 0.00 -2.06 0.00 0.00 37.83 35.22 2c37 s LYS 62 CO 0.47 -0.11 1.00 0.39 0.10 0.00 0.00 175.35 177.20 2c37 n GLU 63 N 2.12 1.35 -3.38 1.78 1.02 -1.26 0.48 120.64 122.74 2c37 n GLU 63 Ca -0.17 0.47 -0.38 0.00 -0.02 0.00 0.00 57.16 57.06 2c37 n GLU 63 Cb 0.57 -1.88 -0.06 0.00 -0.02 0.00 0.00 31.44 30.05 2c37 n GLU 63 CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 2c37 s MET 64 N -1.65 4.13 0.00 3.49 1.75 -1.17 -4.69 119.30 121.16 2c37 s MET 64 Ca 0.59 0.51 0.00 0.00 -1.25 0.00 0.00 55.69 55.54 2c37 s MET 64 Cb -0.66 -3.30 0.00 0.00 2.84 0.00 0.00 34.83 33.71 2c37 s MET 64 CO 0.59 0.50 0.78 -2.39 -0.65 0.00 0.00 175.02 173.85 2c37 n HIS 65 N 2.43 0.00 -3.16 4.11 1.44 -1.26 -3.93 115.22 114.85 2c37 n HIS 65 Ca -0.11 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.20 2c37 n HIS 65 Cb 0.52 -0.28 -0.07 0.00 0.12 0.00 0.00 29.99 30.28 2c37 n HIS 65 CO 0.00 0.00 0.00 -1.25 -2.81 0.00 0.00 176.34 172.28 2c37 s PRO 66 N -2.10 3.99 0.34 -1.40 0.05 -1.26 -4.97 135.00 129.66 2c37 s PRO 66 Ca 0.00 0.35 0.10 0.00 0.05 0.00 0.00 61.00 61.50 2c37 s PRO 66 Cb 0.00 -3.69 0.63 0.00 0.05 0.00 0.00 34.50 31.49 2c37 s PRO 66 CO 0.00 -0.47 1.79 -0.09 0.05 0.00 0.00 177.00 178.29 2c37 h ARG 67 N 8.07 0.13 -0.00 4.56 2.43 -1.99 -2.41 114.38 125.17 2c37 h ARG 67 Ca -0.27 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 2c37 h ARG 67 Cb 1.13 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.67 2c37 h ARG 67 CO 0.77 0.47 0.01 1.12 -1.51 0.00 0.00 179.97 180.82 2c37 h HIS 68 N 0.12 0.00 -0.00 2.20 2.07 -1.93 -0.12 115.15 117.49 2c37 h HIS 68 Ca 0.01 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.53 2c37 h HIS 68 Cb 0.67 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.65 2c37 h HIS 68 CO 0.01 0.00 -0.25 1.28 -3.07 0.00 0.00 177.93 175.90 2c37 n LEU 69 N -3.25 0.32 -4.90 6.12 4.77 -0.91 -4.90 117.00 114.24 2c37 n LEU 69 Ca -0.03 0.18 -0.28 0.00 -0.03 0.00 0.00 56.01 55.85 2c37 n LEU 69 Cb 0.08 -0.33 0.06 0.00 -2.33 0.00 0.00 43.42 40.90 2c37 n LEU 69 CO 0.22 0.07 0.71 -0.94 -1.33 0.00 0.00 177.39 176.12 2c37 s SER 70 N -2.92 4.99 -0.02 -1.43 1.04 -0.06 -4.99 113.70 110.32 2c37 s SER 70 Ca 0.15 0.82 0.05 0.00 0.48 0.00 0.00 55.95 57.45 2c37 s SER 70 Cb 0.18 -1.50 -0.03 0.00 0.10 0.00 0.00 66.02 64.78 2c37 s SER 70 CO 0.60 -1.57 -0.16 -0.76 0.98 0.00 0.00 173.24 172.33 2c37 s LEU 71 N -5.37 2.64 0.51 2.42 1.43 -1.26 -4.99 118.68 114.05 2c37 s LEU 71 Ca 0.59 -0.29 0.29 0.00 -1.03 0.00 0.00 54.13 53.70 2c37 s LEU 71 Cb -0.11 -1.53 1.20 0.00 0.03 0.00 0.00 46.19 45.77 2c37 s LEU 71 CO 0.49 0.31 1.93 1.55 0.23 0.00 0.00 176.35 180.86 2c37 h PRO 72 N 5.09 0.00 0.00 1.29 0.13 -1.97 -0.09 132.00 136.45 2c37 h PRO 72 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2c37 h PRO 72 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2c37 h PRO 72 CO 0.49 0.10 -0.06 -0.40 -0.23 0.00 0.00 178.00 177.91 2c37 n ASP 73 N -3.25 0.28 -4.17 1.44 5.75 -1.26 -4.62 116.55 110.71 2c37 n ASP 73 Ca 0.00 -0.43 -0.11 0.00 -0.01 0.00 0.00 54.79 54.24 2c37 n ASP 73 Cb 0.35 0.92 -0.10 0.00 -1.03 0.00 0.00 41.12 41.26 2c37 n ASP 73 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2c37 s ARG 74 N -0.98 0.98 0.26 0.11 0.52 -1.25 -4.34 118.95 114.26 2c37 s ARG 74 Ca 0.00 -1.47 -0.18 0.00 -0.52 0.00 0.00 55.73 53.56 2c37 s ARG 74 Cb 0.00 0.11 -0.09 0.00 0.52 0.00 0.00 34.95 35.49 2c37 s ARG 74 CO 0.00 -0.23 0.74 0.00 0.02 0.00 0.00 175.30 175.83 2c37 s ALA 75 N -3.95 3.37 -0.04 2.13 0.00 0.05 -2.43 121.76 120.90 2c37 s ALA 75 Ca 0.24 0.15 -0.22 0.00 0.00 0.00 0.00 51.96 52.13 2c37 s ALA 75 Cb 0.07 -2.83 -0.04 0.00 0.00 0.00 0.00 23.12 20.32 2c37 s ALA 75 CO 0.02 0.32 0.64 0.08 0.00 0.00 0.00 175.76 176.83 2c37 s VAL 76 N -1.69 4.98 -0.15 0.00 1.01 -0.01 -4.91 120.40 119.64 2c37 s VAL 76 Ca 0.47 1.33 -0.19 0.00 0.00 0.00 0.00 61.98 63.60 2c37 s VAL 76 Cb -0.15 -3.98 -0.04 0.00 0.00 0.00 0.00 36.38 32.22 2c37 s VAL 76 CO 0.20 0.33 0.53 -0.76 0.00 0.00 0.00 175.10 175.39 2c37 s LEU 77 N 0.35 4.22 -0.28 3.92 1.43 -1.26 -0.81 118.68 126.25 2c37 s LEU 77 Ca 0.34 0.81 -0.03 0.00 -1.03 0.00 0.00 54.13 54.21 2c37 s LEU 77 Cb -0.18 -2.75 0.03 0.00 0.03 0.00 0.00 46.19 43.32 2c37 s LEU 77 CO 0.17 -0.10 0.00 -0.13 0.23 0.00 0.00 176.35 176.53 2c37 s ARG 78 N 1.09 2.74 -0.07 1.70 0.52 -0.37 -4.97 118.95 119.60 2c37 s ARG 78 Ca 0.27 -1.06 0.04 0.00 -0.52 0.00 0.00 55.73 54.46 2c37 s ARG 78 Cb -0.15 -3.18 -0.02 0.00 0.52 0.00 0.00 34.95 32.12 2c37 s ARG 78 CO 0.11 -0.50 -0.20 0.08 0.02 0.00 0.00 175.30 174.81 2c37 s VAL 79 N 1.35 2.56 -0.18 3.52 1.01 -1.26 -0.47 120.40 126.92 2c37 s VAL 79 Ca -0.01 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.08 2c37 s VAL 79 Cb -0.18 -1.98 0.04 0.00 0.00 0.00 0.00 36.38 34.26 2c37 s VAL 79 CO -0.01 0.57 -0.07 -0.60 0.00 0.00 0.00 175.10 174.99 2c37 s ARG 80 N -0.29 1.65 -0.24 2.72 3.52 -0.52 -4.91 118.95 120.88 2c37 s ARG 80 Ca 0.01 -0.67 -0.14 0.00 -0.13 0.00 0.00 55.73 54.80 2c37 s ARG 80 Cb -0.13 -2.21 -0.04 0.00 -1.56 0.00 0.00 34.95 31.01 2c37 s ARG 80 CO 0.03 -0.45 0.31 -0.47 -0.81 0.00 0.00 175.30 173.91 2c37 s TYR 81 N 1.53 3.30 -0.05 5.12 5.04 -1.26 -0.49 117.35 130.53 2c37 s TYR 81 Ca -0.01 0.40 -0.05 0.00 -2.44 0.00 0.00 57.07 54.97 2c37 s TYR 81 Cb -0.16 -2.47 0.01 0.00 0.35 0.00 0.00 41.96 39.70 2c37 s TYR 81 CO -0.08 -0.09 0.15 -1.58 -1.34 0.00 0.00 175.55 172.62 2c37 s HIS 82 N 1.57 -0.16 -0.18 4.97 2.46 -1.03 -4.81 115.29 118.12 2c37 s HIS 82 Ca 0.14 0.38 -0.06 0.00 0.47 0.00 0.00 55.06 55.99 2c37 s HIS 82 Cb -0.15 0.05 -0.03 0.00 -0.13 0.00 0.00 32.58 32.32 2c37 s HIS 82 CO 0.08 -0.10 0.02 -1.64 -2.47 0.00 0.00 174.74 170.64 2c37 s MET 83 N -0.02 3.80 0.51 2.88 -1.94 -1.26 -0.35 119.30 122.91 2c37 s MET 83 Ca -0.01 -0.44 -0.21 0.00 -1.71 0.00 0.00 55.69 53.32 2c37 s MET 83 Cb -0.02 -3.11 -0.06 0.00 2.01 0.00 0.00 34.83 33.66 2c37 s MET 83 CO 0.00 0.18 1.19 0.95 -0.01 0.00 0.00 175.02 177.34 2c37 s THR 84 N 0.58 2.90 0.66 2.05 -4.23 -0.67 -4.83 115.64 112.09 2c37 s THR 84 Ca 0.01 0.63 0.41 0.00 -1.18 0.00 0.00 61.69 61.56 2c37 s THR 84 Cb -0.14 -3.30 0.42 0.00 1.34 0.00 0.00 72.50 70.82 2c37 s THR 84 CO 0.02 -0.05 2.29 -0.65 -0.54 0.00 0.00 174.62 175.69 2c37 h PRO 85 N 1.62 0.00 -0.43 3.99 0.11 -1.91 -1.90 132.00 133.49 2c37 h PRO 85 Ca -0.50 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.47 2c37 h PRO 85 Cb 1.27 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.29 2c37 h PRO 85 CO 0.58 0.00 0.07 1.97 -0.21 0.00 0.00 178.00 180.41 2c37 n PHE 86 N -3.10 1.42 0.14 0.65 1.16 -1.26 -2.27 117.46 114.20 2c37 n PHE 86 Ca -0.03 -1.25 0.09 0.00 -1.87 0.00 0.00 57.45 54.39 2c37 n PHE 86 Cb 0.13 -0.49 0.05 0.00 -1.61 0.00 0.00 39.48 37.56 2c37 n PHE 86 CO 0.00 0.00 0.00 0.66 -1.87 0.00 0.00 176.76 175.55 2c37 h SER 87 N 1.64 0.00 -4.49 5.98 4.64 -1.46 -3.46 113.55 116.40 2c37 h SER 87 Ca 0.17 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 61.11 2c37 h SER 87 Cb 1.78 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.82 2c37 h SER 87 CO 0.44 0.15 -0.24 0.35 -0.87 0.00 0.00 176.83 176.66 2c37 n THR 88 N -2.94 0.00 0.03 2.95 -2.24 -1.26 -0.59 114.28 110.23 2c37 n THR 88 Ca 0.00 -1.38 -0.10 0.00 -2.27 0.00 0.00 64.05 60.30 2c37 n THR 88 Cb 0.61 0.08 -0.07 0.00 -2.10 0.00 0.00 70.33 68.85 2c37 n THR 88 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2c37 h ASP 89 N 0.59 -0.15 -3.32 3.42 3.32 -1.92 -3.43 116.42 114.94 2c37 h ASP 89 Ca -0.23 -0.39 -0.57 0.00 0.02 0.00 0.00 57.03 55.86 2c37 h ASP 89 Cb 0.76 0.04 -0.06 0.00 0.22 0.00 0.00 39.33 40.29 2c37 h ASP 89 CO 0.38 0.45 -0.05 -1.61 -1.72 0.00 0.00 179.24 176.69 2c37 s GLU 90 N -3.10 4.34 -0.13 3.56 0.41 -1.26 -5.02 118.70 117.50 2c37 s GLU 90 Ca -0.12 0.64 -0.33 0.00 -0.41 0.00 0.00 54.97 54.74 2c37 s GLU 90 Cb 0.00 -3.40 -0.11 0.00 -1.78 0.00 0.00 34.13 28.84 2c37 s GLU 90 CO 0.45 0.22 1.96 -2.13 -0.49 0.00 0.00 175.26 175.26 2c37 n ARG 91 N 3.34 2.07 -2.52 1.61 0.63 -1.26 -4.96 116.66 115.57 2c37 n ARG 91 Ca -0.06 0.73 -0.41 0.00 -0.92 0.00 0.00 57.85 57.19 2c37 n ARG 91 Cb 0.51 -2.70 -0.04 0.00 0.45 0.00 0.00 32.46 30.68 2c37 n ARG 91 CO 0.00 0.00 0.00 -1.59 -2.51 0.00 0.00 177.63 173.53 2c37 s LYS 92 N 4.58 4.63 0.09 -0.14 0.00 -0.96 -5.02 119.74 122.92 2c37 s LYS 92 Ca 0.95 1.72 -0.31 0.00 0.00 0.00 0.00 55.97 58.34 2c37 s LYS 92 Cb -0.66 -3.25 -0.08 0.00 0.00 0.00 0.00 37.83 33.83 2c37 s LYS 92 CO 0.49 0.14 1.49 1.21 0.00 0.00 0.00 175.35 178.69 2c37 s ASN 93 N -0.39 6.72 0.52 0.03 3.84 -1.26 -4.26 114.94 120.14 2c37 s ASN 93 Ca 0.47 2.39 0.17 0.00 0.21 0.00 0.00 52.86 56.10 2c37 s ASN 93 Cb -0.30 -2.58 1.29 0.00 -0.55 0.00 0.00 41.25 39.12 2c37 s ASN 93 CO 0.36 -0.76 2.14 1.55 -2.79 0.00 0.00 177.10 177.61 2c37 h PRO 94 N 7.36 0.00 -6.56 0.43 0.13 -1.95 -3.43 132.00 127.98 2c37 h PRO 94 Ca -0.42 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.13 2c37 h PRO 94 Cb 1.20 0.00 0.07 0.00 0.13 0.00 0.00 31.00 32.40 2c37 h PRO 94 CO 0.90 0.00 0.68 0.00 -0.23 0.00 0.00 178.00 179.35 2c37 n ALA 95 N -2.54 1.22 -1.76 -0.56 0.00 -1.26 -4.87 120.51 110.73 2c37 n ALA 95 Ca -0.02 0.42 -0.42 0.00 0.00 0.00 0.00 53.44 53.42 2c37 n ALA 95 Cb 0.13 -2.30 -0.03 0.00 0.00 0.00 0.00 19.45 17.24 2c37 n ALA 95 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2c37 s PRO 96 N 0.04 4.14 0.54 0.00 0.02 -1.26 -4.99 135.00 133.50 2c37 s PRO 96 Ca 0.72 2.56 -0.04 0.00 0.02 0.00 0.00 61.00 64.26 2c37 s PRO 96 Cb -0.66 -3.22 -0.00 0.00 0.02 0.00 0.00 34.50 30.64 2c37 s PRO 96 CO 0.46 -0.75 0.82 -1.54 -0.33 0.00 0.00 177.00 175.65 2c37 s SER 97 N 1.58 5.76 0.26 2.53 1.04 -1.26 -4.92 113.70 118.69 2c37 s SER 97 Ca 0.76 0.63 -0.02 0.00 0.48 0.00 0.00 55.95 57.80 2c37 s SER 97 Cb -0.48 -1.75 0.46 0.00 0.10 0.00 0.00 66.02 64.35 2c37 s SER 97 CO 0.33 -0.89 1.82 0.03 0.98 0.00 0.00 173.24 175.51 2c37 h ARG 98 N 0.04 0.86 -0.49 4.02 3.08 -2.00 -0.09 114.38 119.80 2c37 h ARG 98 Ca -0.46 -0.05 0.05 0.00 0.07 0.00 0.00 59.98 59.60 2c37 h ARG 98 Cb 1.25 -0.19 -0.05 0.00 0.08 0.00 0.00 29.97 31.05 2c37 h ARG 98 CO 0.60 0.57 0.21 -0.09 -1.07 0.00 0.00 179.97 180.18 2c37 h ARG 99 N 0.88 0.40 -0.34 0.04 2.43 -2.00 -1.95 114.38 113.84 2c37 h ARG 99 Ca 0.44 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.51 2c37 h ARG 99 Cb 0.40 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 2c37 h ARG 99 CO -0.25 0.26 -0.08 0.93 -1.51 0.00 0.00 179.97 179.32 2c37 h GLU 100 N 0.41 0.57 -0.26 0.20 5.08 -1.42 -1.29 114.58 117.86 2c37 h GLU 100 Ca 0.22 -0.16 -0.07 0.00 -1.00 0.00 0.00 59.36 58.36 2c37 h GLU 100 Cb 0.19 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2c37 h GLU 100 CO -0.20 0.65 -0.09 0.82 -1.00 0.00 0.00 179.01 179.20 2c37 h ILE 101 N 0.53 1.29 -0.37 3.13 2.04 -1.01 -1.26 117.51 121.86 2c37 h ILE 101 Ca 0.10 -1.14 -0.04 0.00 1.00 0.00 0.00 64.86 64.78 2c37 h ILE 101 Cb 0.47 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 38.02 2c37 h ILE 101 CO 0.03 0.36 0.08 -0.08 0.00 0.00 0.00 178.15 178.53 2c37 h GLU 102 N 0.27 0.61 -0.21 2.37 4.81 -1.12 -2.67 114.58 118.63 2c37 h GLU 102 Ca 0.06 -0.15 -0.11 0.00 -0.13 0.00 0.00 59.36 59.03 2c37 h GLU 102 Cb 0.58 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 2c37 h GLU 102 CO 0.03 0.65 -0.33 -0.07 -0.73 0.00 0.00 179.01 178.56 2c37 h LEU 103 N 0.46 0.45 -0.56 1.64 3.38 -1.26 -0.20 115.31 119.22 2c37 h LEU 103 Ca 0.12 -0.17 0.08 0.00 0.09 0.00 0.00 57.88 58.00 2c37 h LEU 103 Cb 0.33 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 40.89 2c37 h LEU 103 CO 0.00 0.76 0.19 0.28 0.09 0.00 0.00 178.44 179.77 2c37 h SER 104 N 0.38 0.18 0.13 -0.43 0.02 -1.05 0.32 113.55 113.10 2c37 h SER 104 Ca 0.04 0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 2c37 h SER 104 Cb 0.77 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.37 2c37 h SER 104 CO 0.06 0.12 -0.06 0.50 -1.14 0.00 0.00 176.83 176.31 2c37 h LYS 105 N 0.37 -0.17 -0.61 3.45 3.64 -1.08 -0.72 116.57 121.45 2c37 h LYS 105 Ca 0.28 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.74 2c37 h LYS 105 Cb 0.34 0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.14 2c37 h LYS 105 CO -0.29 0.08 0.30 0.28 -2.27 0.00 0.00 179.45 177.55 2c37 h VAL 106 N -0.41 0.91 -0.52 2.00 2.07 -0.80 -0.15 116.25 119.35 2c37 h VAL 106 Ca -0.02 -0.19 -0.09 0.00 0.82 0.00 0.00 66.70 67.22 2c37 h VAL 106 Cb 0.33 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 2c37 h VAL 106 CO 0.03 0.10 -0.04 0.40 0.02 0.00 0.00 177.57 178.08 2c37 h ILE 107 N 0.56 1.27 -0.12 4.57 2.04 -0.93 -1.78 117.51 123.12 2c37 h ILE 107 Ca 0.28 -1.16 0.01 0.00 1.00 0.00 0.00 64.86 65.00 2c37 h ILE 107 Cb 0.23 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 2c37 h ILE 107 CO -0.21 0.41 0.03 -0.09 0.00 0.00 0.00 178.15 178.29 2c37 h ARG 108 N 0.82 0.08 -0.82 2.37 2.43 -0.30 -1.27 114.38 117.68 2c37 h ARG 108 Ca 0.14 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.30 2c37 h ARG 108 Cb 0.58 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.07 2c37 h ARG 108 CO 0.03 0.06 0.48 0.93 -1.51 0.00 0.00 179.97 179.96 2c37 h GLU 109 N 0.09 1.13 -0.49 0.20 5.08 -0.98 0.16 114.58 119.76 2c37 h GLU 109 Ca 0.05 -0.11 0.07 0.00 -1.00 0.00 0.00 59.36 58.36 2c37 h GLU 109 Cb 0.03 -0.23 -0.06 0.00 0.50 0.00 0.00 28.75 29.00 2c37 h GLU 109 CO -0.06 0.80 0.17 0.00 -1.00 0.00 0.00 179.01 178.93 2c37 h ALA 110 N 1.26 0.59 -0.20 3.43 0.00 -0.94 -2.37 119.26 121.04 2c37 h ALA 110 Ca 0.29 0.07 -0.15 0.00 0.00 0.00 0.00 54.91 55.12 2c37 h ALA 110 Cb -0.02 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2c37 h ALA 110 CO -0.05 -0.23 -0.49 -0.07 0.00 0.00 0.00 179.25 178.41 2c37 h LEU 111 N 0.34 0.57 -1.95 0.00 3.38 -0.29 -2.93 115.31 114.43 2c37 h LEU 111 Ca 0.23 -0.28 0.01 0.00 0.09 0.00 0.00 57.88 57.93 2c37 h LEU 111 Cb 0.25 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2c37 h LEU 111 CO -0.24 0.97 0.06 -0.33 0.09 0.00 0.00 178.44 178.99 2c37 h GLU 112 N 0.42 0.06 0.00 1.13 5.08 -0.27 0.15 114.58 121.15 2c37 h GLU 112 Ca 0.02 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2c37 h GLU 112 Cb 1.01 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.24 2c37 h GLU 112 CO 0.09 0.04 0.00 -1.13 -1.00 0.00 0.00 179.01 177.01 2c37 n SER 113 N -4.52 0.37 -0.07 1.42 3.41 -0.93 -3.99 113.62 109.31 2c37 n SER 113 Ca -0.01 0.55 -0.12 0.00 -0.26 0.00 0.00 58.87 59.03 2c37 n SER 113 Cb 0.13 -0.64 -0.06 0.00 -0.26 0.00 0.00 64.21 63.38 2c37 n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2c37 n ALA 114 N -1.64 1.82 -2.14 7.33 0.00 -0.18 -4.88 120.51 120.83 2c37 n ALA 114 Ca 0.05 -0.60 -0.41 0.00 0.00 0.00 0.00 53.44 52.47 2c37 n ALA 114 Cb 0.33 0.22 -0.03 0.00 0.00 0.00 0.00 19.45 19.97 2c37 n ALA 114 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2c37 s VAL 115 N -2.28 3.61 -1.34 0.00 1.01 0.36 0.06 120.40 121.82 2c37 s VAL 115 Ca -0.20 1.28 -0.14 0.00 0.00 0.00 0.00 61.98 62.93 2c37 s VAL 115 Cb 0.06 -3.82 0.10 0.00 0.00 0.00 0.00 36.38 32.72 2c37 s VAL 115 CO 0.30 0.17 1.92 0.18 0.00 0.00 0.00 175.10 177.68 2c37 n LEU 116 N 2.95 6.18 0.25 3.92 4.77 -1.00 -4.80 117.00 129.27 2c37 n LEU 116 Ca 0.06 -4.27 0.11 0.00 -0.03 0.00 0.00 56.01 51.88 2c37 n LEU 116 Cb 0.45 -1.62 0.68 0.00 -2.33 0.00 0.00 43.42 40.59 2c37 n LEU 116 CO 0.56 0.93 0.96 -0.37 -1.33 0.00 0.00 177.39 178.14 2c37 h VAL 117 N 4.35 0.69 -0.20 4.08 -1.51 -1.89 -2.70 116.25 119.07 2c37 h VAL 117 Ca 0.46 -0.55 0.06 0.00 -1.23 0.00 0.00 66.70 65.45 2c37 h VAL 117 Cb 0.72 1.34 -0.01 0.00 -2.13 0.00 0.00 31.29 31.20 2c37 h VAL 117 CO 1.64 0.13 0.17 -0.33 -1.23 0.00 0.00 177.57 177.95 2c37 h GLU 118 N 0.00 0.00 0.00 5.19 3.07 -1.87 0.41 114.58 121.38 2c37 h GLU 118 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2c37 h GLU 118 Cb 0.33 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.24 2c37 h GLU 118 CO 0.02 0.00 0.00 -0.07 -1.40 0.00 0.00 179.01 177.56 2c37 h LEU 119 N 0.00 0.00 -6.18 1.33 4.07 -1.74 -3.35 115.31 109.44 2c37 h LEU 119 Ca 0.10 0.00 -0.58 0.00 0.08 0.00 0.00 57.88 57.47 2c37 h LEU 119 Cb 0.43 0.00 -0.40 0.00 1.08 0.00 0.00 40.66 41.76 2c37 h LEU 119 CO -0.00 0.00 -0.88 0.49 -1.08 0.00 0.00 178.44 176.97 2c37 n PHE 120 N -2.77 1.19 -1.85 1.13 3.01 -0.68 -5.05 117.46 112.44 2c37 n PHE 120 Ca -0.00 -3.79 -0.35 0.00 1.01 0.00 0.00 57.45 54.32 2c37 n PHE 120 Cb 0.20 -0.37 0.05 0.00 -0.01 0.00 0.00 39.48 39.34 2c37 n PHE 120 CO 0.00 0.00 0.00 -2.14 1.01 0.00 0.00 176.76 175.63 2c37 s PRO 121 N -1.51 2.77 -0.60 -1.08 0.02 -1.26 -1.95 135.00 131.40 2c37 s PRO 121 Ca 0.36 1.74 0.00 0.00 0.02 0.00 0.00 61.00 63.12 2c37 s PRO 121 Cb 0.13 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.74 2c37 s PRO 121 CO -0.09 -1.34 0.00 0.54 -0.33 0.00 0.00 177.00 175.77 2c37 n ARG 122 N -1.96 -1.26 -4.38 5.54 5.12 -0.05 -4.85 116.66 114.82 2c37 n ARG 122 Ca 0.13 0.60 -0.24 0.00 -1.93 0.00 0.00 57.85 56.41 2c37 n ARG 122 Cb 0.50 -4.68 -0.09 0.00 -1.16 0.00 0.00 32.46 27.03 2c37 n ARG 122 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2c37 s THR 123 N -1.78 2.78 -0.07 0.55 -4.23 -1.19 -3.06 115.64 108.65 2c37 s THR 123 Ca 0.00 -2.11 0.04 0.00 -1.18 0.00 0.00 61.69 58.44 2c37 s THR 123 Cb 0.00 -2.64 -0.02 0.00 1.34 0.00 0.00 72.50 71.18 2c37 s THR 123 CO 0.00 -0.31 -0.18 0.00 -0.54 0.00 0.00 174.62 173.58 2c37 s ALA 124 N -2.47 2.45 -0.26 3.99 0.00 0.18 -0.83 121.76 124.82 2c37 s ALA 124 Ca 0.32 -0.99 -0.06 0.00 0.00 0.00 0.00 51.96 51.23 2c37 s ALA 124 Cb -0.03 -0.89 -0.01 0.00 0.00 0.00 0.00 23.12 22.18 2c37 s ALA 124 CO 0.18 0.44 0.04 0.42 0.00 0.00 0.00 175.76 176.84 2c37 s ILE 125 N -0.30 3.90 -0.17 0.00 1.01 0.01 -2.36 121.20 123.30 2c37 s ILE 125 Ca 0.01 -0.45 -0.14 0.00 0.00 0.00 0.00 60.65 60.07 2c37 s ILE 125 Cb -0.13 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.42 2c37 s ILE 125 CO 0.03 0.27 0.32 -1.81 0.00 0.00 0.00 174.94 173.74 2c37 s ASP 126 N 1.53 6.44 -0.25 3.58 1.01 -0.93 -1.24 116.67 126.81 2c37 s ASP 126 Ca 0.05 0.51 0.01 0.00 0.71 0.00 0.00 52.55 53.82 2c37 s ASP 126 Cb -0.16 -2.19 0.07 0.00 1.01 0.00 0.00 42.92 41.65 2c37 s ASP 126 CO 0.01 0.06 -0.01 -0.69 0.21 0.00 0.00 175.17 174.75 2c37 s VAL 127 N 0.64 1.44 -0.18 -1.27 1.01 0.38 -0.59 120.40 121.84 2c37 s VAL 127 Ca 0.17 -1.32 -0.05 0.00 0.00 0.00 0.00 61.98 60.78 2c37 s VAL 127 Cb -0.13 -1.82 -0.03 0.00 0.00 0.00 0.00 36.38 34.40 2c37 s VAL 127 CO 0.05 -0.25 0.01 -0.36 0.00 0.00 0.00 175.10 174.55 2c37 s PHE 128 N 1.41 3.10 -0.06 5.22 2.99 -0.08 -1.44 117.98 129.11 2c37 s PHE 128 Ca -0.01 -0.23 0.04 0.00 0.00 0.00 0.00 56.93 56.73 2c37 s PHE 128 Cb -0.19 -2.03 -0.02 0.00 0.00 0.00 0.00 43.02 40.78 2c37 s PHE 128 CO -0.09 -0.04 -0.19 0.99 -0.00 0.00 0.00 175.22 175.89 2c37 s THR 129 N 0.56 2.64 -0.10 0.64 2.01 0.36 -1.18 115.64 120.57 2c37 s THR 129 Ca -0.00 -0.86 -0.01 0.00 0.31 0.00 0.00 61.69 61.13 2c37 s THR 129 Cb -0.14 -2.01 0.03 0.00 0.01 0.00 0.00 72.50 70.38 2c37 s THR 129 CO 0.02 0.57 -0.06 -1.61 -0.69 0.00 0.00 174.62 172.86 2c37 s GLU 130 N -0.39 1.26 -0.23 4.92 0.41 0.47 -2.47 118.70 122.67 2c37 s GLU 130 Ca 0.04 -0.16 -0.29 0.00 -0.41 0.00 0.00 54.97 54.16 2c37 s GLU 130 Cb -0.12 -1.39 0.01 0.00 -1.78 0.00 0.00 34.13 30.84 2c37 s GLU 130 CO 0.02 -0.26 1.01 0.42 -0.49 0.00 0.00 175.26 175.96 2c37 s ILE 131 N 1.72 4.70 -0.08 -1.63 1.09 0.52 -0.83 121.20 126.69 2c37 s ILE 131 Ca 0.04 1.98 0.14 0.00 -1.10 0.00 0.00 60.65 61.70 2c37 s ILE 131 Cb -0.13 -4.29 -0.24 0.00 -1.06 0.00 0.00 42.46 36.75 2c37 s ILE 131 CO -0.07 -0.16 0.51 0.18 -0.10 0.00 0.00 174.94 175.30 2c37 n LEU 132 N 6.23 0.67 -3.73 2.97 4.77 0.09 -1.67 117.00 126.34 2c37 n LEU 132 Ca 0.11 0.31 -0.13 0.00 -0.03 0.00 0.00 56.01 56.27 2c37 n LEU 132 Cb 0.46 0.24 -0.14 0.00 -2.33 0.00 0.00 43.42 41.65 2c37 n LEU 132 CO 0.51 0.42 -0.17 -1.10 -1.33 0.00 0.00 177.39 175.73 2c37 s GLN 133 N -2.57 0.15 -0.22 3.23 -0.21 -1.18 -3.94 119.66 114.92 2c37 s GLN 133 Ca -0.06 0.49 -0.10 0.00 0.02 0.00 0.00 55.36 55.71 2c37 s GLN 133 Cb 0.07 -0.15 -0.05 0.00 1.00 0.00 0.00 33.01 33.89 2c37 s GLN 133 CO 0.83 -0.18 0.13 0.00 -2.12 0.00 0.00 175.29 173.94 2c37 s ALA 134 N 1.38 3.56 -0.28 6.09 0.00 0.24 -1.59 121.76 131.17 2c37 s ALA 134 Ca -0.08 -0.84 0.21 0.00 0.00 0.00 0.00 51.96 51.25 2c37 s ALA 134 Cb -0.11 -2.20 0.49 0.00 0.00 0.00 0.00 23.12 21.29 2c37 s ALA 134 CO -0.07 -0.07 1.17 -3.47 0.00 0.00 0.00 175.76 173.31 2c37 n ASP 135 N 4.03 1.00 -0.51 0.00 2.03 -1.26 -4.77 116.55 117.06 2c37 n ASP 135 Ca -0.16 -2.14 0.00 0.00 0.52 0.00 0.00 54.79 53.01 2c37 n ASP 135 Cb 0.52 -0.27 0.00 0.00 -0.72 0.00 0.00 41.12 40.65 2c37 n ASP 135 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2c37 n ALA 136 N -0.68 -1.11 -1.05 -1.67 0.00 -1.26 -3.38 120.51 111.35 2c37 n ALA 136 Ca 0.03 0.16 -0.02 0.00 0.00 0.00 0.00 53.44 53.61 2c37 n ALA 136 Cb 0.82 -0.81 -0.01 0.00 0.00 0.00 0.00 19.45 19.45 2c37 n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c37 n GLY 137 N -1.67 0.51 0.36 0.00 0.00 -1.26 -4.80 105.19 98.32 2c37 n GLY 137 Ca 0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 46.02 45.72 2c37 n GLY 137 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2c37 h SER 138 N 0.00 1.12 -0.81 1.61 4.64 -1.95 -1.17 113.55 116.99 2c37 h SER 138 Ca -0.04 -0.09 0.11 0.00 -0.47 0.00 0.00 61.79 61.31 2c37 h SER 138 Cb 0.29 -0.28 -0.06 0.00 -0.31 0.00 0.00 62.40 62.03 2c37 h SER 138 CO 0.05 0.88 0.53 0.08 -0.87 0.00 0.00 176.83 177.50 2c37 h ARG 139 N 1.26 0.67 0.02 4.77 0.11 -1.99 0.33 114.38 119.56 2c37 h ARG 139 Ca 0.32 -0.04 -0.21 0.00 0.10 0.00 0.00 59.98 60.16 2c37 h ARG 139 Cb 0.00 -0.15 0.02 0.00 1.11 0.00 0.00 29.97 30.95 2c37 h ARG 139 CO -0.05 0.44 -0.81 -0.07 0.10 0.00 0.00 179.97 179.58 2c37 h LEU 140 N 0.69 0.68 -0.92 0.08 3.38 -1.75 -2.16 115.31 115.31 2c37 h LEU 140 Ca 0.38 -0.77 -0.00 0.00 0.09 0.00 0.00 57.88 57.58 2c37 h LEU 140 Cb 0.53 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.03 2c37 h LEU 140 CO -0.15 1.37 0.57 0.58 0.09 0.00 0.00 178.44 180.90 2c37 h VAL 141 N 0.07 1.25 0.09 1.22 2.07 -0.70 0.25 116.25 120.50 2c37 h VAL 141 Ca -0.11 -0.52 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 2c37 h VAL 141 Cb 1.51 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 2c37 h VAL 141 CO 0.16 0.25 -0.04 -1.28 0.02 0.00 0.00 177.57 176.68 2c37 h SER 142 N 1.26 -0.10 -0.93 0.57 0.87 -0.40 -0.78 113.55 114.03 2c37 h SER 142 Ca 0.33 0.00 0.03 0.00 -1.23 0.00 0.00 61.79 60.93 2c37 h SER 142 Cb -0.08 0.03 -0.05 0.00 -0.44 0.00 0.00 62.40 61.85 2c37 h SER 142 CO -0.07 -0.07 0.61 0.25 -0.53 0.00 0.00 176.83 177.03 2c37 h LEU 143 N -0.13 1.02 -0.20 2.23 5.85 -0.90 -0.19 115.31 122.99 2c37 h LEU 143 Ca -0.01 -0.01 -0.20 0.00 0.84 0.00 0.00 57.88 58.50 2c37 h LEU 143 Cb 0.10 -0.24 0.01 0.00 0.37 0.00 0.00 40.66 40.90 2c37 h LEU 143 CO 0.02 0.70 -0.65 0.24 -0.34 0.00 0.00 178.44 178.41 2c37 h MET 144 N 1.18 0.79 -0.84 1.25 2.86 -0.82 -0.57 114.93 118.79 2c37 h MET 144 Ca 0.37 -0.59 -0.00 0.00 -2.06 0.00 0.00 59.70 57.42 2c37 h MET 144 Cb 0.00 0.10 -0.04 0.00 0.06 0.00 0.00 31.60 31.72 2c37 h MET 144 CO -0.11 1.20 0.52 0.00 1.06 0.00 0.00 176.91 179.58 2c37 h ALA 145 N 0.59 1.07 0.29 6.32 0.00 -0.81 0.67 119.26 127.39 2c37 h ALA 145 Ca -0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2c37 h ALA 145 Cb 1.27 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2c37 h ALA 145 CO 0.14 0.52 -0.14 0.00 0.00 0.00 0.00 179.25 179.77 2c37 h ALA 146 N 1.28 -0.38 -0.65 0.00 0.00 -0.90 0.13 119.26 118.74 2c37 h ALA 146 Ca 0.30 -0.11 0.13 0.00 0.00 0.00 0.00 54.91 55.23 2c37 h ALA 146 Cb -0.06 0.15 -0.10 0.00 0.00 0.00 0.00 17.79 17.77 2c37 h ALA 146 CO -0.06 -0.67 0.08 1.03 0.00 0.00 0.00 179.25 179.63 2c37 h SER 147 N -0.47 -0.12 -0.02 0.00 0.87 -0.59 -0.46 113.55 112.75 2c37 h SER 147 Ca -0.04 0.14 -0.15 0.00 -1.23 0.00 0.00 61.79 60.51 2c37 h SER 147 Cb 0.35 0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.53 2c37 h SER 147 CO 0.06 -0.06 -0.50 -0.07 -0.53 0.00 0.00 176.83 175.73 2c37 h LEU 148 N 0.19 0.64 -1.18 2.23 3.38 -0.64 -2.36 115.31 117.57 2c37 h LEU 148 Ca 0.35 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 2c37 h LEU 148 Cb 0.57 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2c37 h LEU 148 CO -0.49 1.03 0.08 0.00 0.09 0.00 0.00 178.44 179.15 2c37 h ALA 149 N 0.99 1.34 -0.61 1.53 0.00 0.04 0.30 119.26 122.85 2c37 h ALA 149 Ca 0.02 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 2c37 h ALA 149 Cb 1.04 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 2c37 h ALA 149 CO 0.10 0.47 0.20 -0.07 0.00 0.00 0.00 179.25 179.94 2c37 h LEU 150 N 0.64 0.89 -0.91 0.00 3.38 -0.91 -0.19 115.31 118.20 2c37 h LEU 150 Ca 0.14 -0.20 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 2c37 h LEU 150 Cb 0.27 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2c37 h LEU 150 CO 0.00 0.85 -0.16 0.00 0.09 0.00 0.00 178.44 179.22 2c37 h ALA 151 N 1.07 1.08 -0.29 1.53 0.00 -0.97 -1.11 119.26 120.57 2c37 h ALA 151 Ca 0.20 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 2c37 h ALA 151 Cb 0.28 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2c37 h ALA 151 CO -0.01 0.56 -0.08 0.22 0.00 0.00 0.00 179.25 179.94 2c37 h ASP 152 N 0.56 0.46 0.73 0.00 3.58 -0.56 -1.63 116.42 119.55 2c37 h ASP 152 Ca 0.09 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.44 2c37 h ASP 152 Cb 0.60 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 41.53 2c37 h ASP 152 CO 0.04 0.58 0.00 0.00 -2.88 0.00 0.00 179.24 176.98 2c37 n ALA 153 N -2.48 2.31 -1.76 -0.78 0.00 -0.12 -4.65 120.51 113.04 2c37 n ALA 153 Ca 0.01 -0.11 -0.05 0.00 0.00 0.00 0.00 53.44 53.29 2c37 n ALA 153 Cb 0.29 -1.45 -0.01 0.00 0.00 0.00 0.00 19.45 18.29 2c37 n ALA 153 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c37 n GLY 154 N 1.19 0.37 3.65 0.00 0.00 -0.61 -4.88 105.19 104.91 2c37 n GLY 154 Ca 0.10 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.96 2c37 n GLY 154 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2c37 s ILE 155 N -2.22 4.85 0.22 -0.61 1.01 -0.47 -4.99 121.20 118.98 2c37 s ILE 155 Ca 0.00 1.60 -0.31 0.00 0.00 0.00 0.00 60.65 61.94 2c37 s ILE 155 Cb 0.00 -4.13 -0.11 0.00 0.01 0.00 0.00 42.46 38.23 2c37 s ILE 155 CO 0.00 -0.04 1.63 -2.84 0.00 0.00 0.00 174.94 173.69 2c37 s PRO 156 N 2.59 4.16 0.05 2.79 0.02 -1.26 -4.56 135.00 138.79 2c37 s PRO 156 Ca 0.36 2.50 0.00 0.00 0.02 0.00 0.00 61.00 63.89 2c37 s PRO 156 Cb -0.16 -3.09 -0.03 0.00 0.02 0.00 0.00 34.50 31.24 2c37 s PRO 156 CO 0.09 -0.66 -0.04 -1.64 -0.33 0.00 0.00 177.00 174.42 2c37 s MET 157 N 0.71 0.56 0.24 5.54 -1.94 -1.26 -2.39 119.30 120.76 2c37 s MET 157 Ca 0.70 -1.00 -0.06 0.00 -1.71 0.00 0.00 55.69 53.61 2c37 s MET 157 Cb -0.47 0.03 0.23 0.00 2.01 0.00 0.00 34.83 36.63 2c37 s MET 157 CO 0.36 -0.05 1.87 0.00 -0.01 0.00 0.00 175.02 177.19 2c37 h ARG 158 N 3.73 1.27 -2.24 2.03 3.08 -0.71 -3.47 114.38 118.08 2c37 h ARG 158 Ca -0.34 -0.13 0.17 0.00 0.07 0.00 0.00 59.98 59.75 2c37 h ARG 158 Cb 1.17 -0.26 -0.11 0.00 0.08 0.00 0.00 29.97 30.86 2c37 h ARG 158 CO 0.55 0.91 0.52 0.34 -1.07 0.00 0.00 179.97 181.22 2c37 s ASP 159 N -6.22 -0.22 0.70 7.04 2.15 -1.26 -5.02 116.67 113.84 2c37 s ASP 159 Ca -0.13 -0.26 -0.11 0.00 0.43 0.00 0.00 52.55 52.48 2c37 s ASP 159 Cb 0.17 0.43 0.01 0.00 -0.30 0.00 0.00 42.92 43.23 2c37 s ASP 159 CO 0.83 -0.76 1.07 -0.76 -0.17 0.00 0.00 175.17 175.37 2c37 s LEU 160 N -2.80 3.01 -0.14 -1.34 1.43 -1.26 -4.92 118.68 112.66 2c37 s LEU 160 Ca 0.10 1.43 -0.01 0.00 -1.03 0.00 0.00 54.13 54.62 2c37 s LEU 160 Cb -0.01 -4.28 -0.02 0.00 0.03 0.00 0.00 46.19 41.91 2c37 s LEU 160 CO -0.02 -1.41 -0.10 -0.63 0.23 0.00 0.00 176.35 174.43 2c37 s ILE 161 N -3.15 3.37 0.01 -0.59 1.01 -1.26 -4.22 121.20 116.37 2c37 s ILE 161 Ca 0.58 -0.55 0.06 0.00 0.00 0.00 0.00 60.65 60.74 2c37 s ILE 161 Cb -0.13 -2.44 -0.02 0.00 0.01 0.00 0.00 42.46 39.89 2c37 s ILE 161 CO 0.54 0.52 -0.17 0.00 0.00 0.00 0.00 174.94 175.83 2c37 s ALA 162 N 0.31 1.44 0.11 9.38 0.00 -0.52 -4.66 121.76 127.83 2c37 s ALA 162 Ca -0.08 -0.84 -0.09 0.00 0.00 0.00 0.00 51.96 50.96 2c37 s ALA 162 Cb -0.15 -0.31 -0.00 0.00 0.00 0.00 0.00 23.12 22.65 2c37 s ALA 162 CO 0.05 0.33 0.22 0.20 0.00 0.00 0.00 175.76 176.55 2c37 s GLY 163 N -0.78 0.22 -0.04 0.00 0.00 -1.26 -0.58 107.32 104.88 2c37 s GLY 163 Ca 0.06 -0.71 -0.19 0.00 0.00 0.00 0.00 44.72 43.88 2c37 s GLY 163 CO 0.00 -0.82 0.42 -1.34 0.00 0.00 0.00 173.10 171.37 2c37 s VAL 164 N -3.90 0.04 -0.28 1.40 -7.23 -0.44 -4.89 120.40 105.10 2c37 s VAL 164 Ca 0.09 -0.29 -0.25 0.00 -1.81 0.00 0.00 61.98 59.72 2c37 s VAL 164 Cb 0.04 -0.71 0.00 0.00 0.56 0.00 0.00 36.38 36.28 2c37 s VAL 164 CO -0.07 -0.16 0.87 0.00 -0.31 0.00 0.00 175.10 175.42 2c37 s ALA 165 N -1.07 3.57 0.18 1.32 0.00 -1.26 -1.55 121.76 122.95 2c37 s ALA 165 Ca -0.11 -0.23 0.03 0.00 0.00 0.00 0.00 51.96 51.65 2c37 s ALA 165 Cb -0.04 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 19.67 2c37 s ALA 165 CO 0.05 -1.15 0.31 0.54 0.00 0.00 0.00 175.76 175.51 2c37 s VAL 166 N 3.06 5.30 0.09 0.00 0.11 -0.56 -0.28 120.40 128.12 2c37 s VAL 166 Ca 0.36 -0.74 -0.03 0.00 -2.93 0.00 0.00 61.98 58.64 2c37 s VAL 166 Cb -0.14 -3.77 0.01 0.00 -1.53 0.00 0.00 36.38 30.95 2c37 s VAL 166 CO 0.11 -0.16 0.18 0.61 -3.33 0.00 0.00 175.10 172.52 2c37 n GLY 167 N -0.77 1.72 2.90 6.54 0.00 -0.27 -0.03 105.19 115.27 2c37 n GLY 167 Ca -0.07 -1.06 -0.24 0.00 0.00 0.00 0.00 46.02 44.65 2c37 n GLY 167 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2c37 s LYS 168 N -2.02 1.20 0.00 1.61 2.20 -1.10 -1.00 119.74 120.63 2c37 s LYS 168 Ca 0.04 -0.18 0.00 0.00 -0.36 0.00 0.00 55.97 55.47 2c37 s LYS 168 Cb -0.01 -1.23 0.00 0.00 -1.51 0.00 0.00 37.83 35.08 2c37 s LYS 168 CO 0.03 -0.16 0.00 0.00 -0.36 0.00 0.00 175.35 174.86 2c37 n ALA 169 N 4.49 0.02 -2.96 3.13 0.00 0.90 -1.22 120.51 124.86 2c37 n ALA 169 Ca -0.17 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 52.99 2c37 n ALA 169 Cb 0.51 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.92 2c37 n ALA 169 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2c37 n ASP 170 N -1.06 4.59 0.00 0.00 8.00 -1.26 -4.24 116.55 122.57 2c37 n ASP 170 Ca 0.00 -3.67 0.00 0.00 0.71 0.00 0.00 54.79 51.83 2c37 n ASP 170 Cb 0.00 -0.60 0.00 0.00 -0.02 0.00 0.00 41.12 40.50 2c37 n ASP 170 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2c37 n GLY 171 N -0.15 1.13 3.62 0.44 0.00 -1.26 -4.98 105.19 103.98 2c37 n GLY 171 Ca 0.32 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.99 2c37 n GLY 171 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c37 s VAL 172 N -3.64 4.61 -0.16 1.61 1.01 -1.26 -5.07 120.40 117.50 2c37 s VAL 172 Ca 0.00 -0.10 -0.29 0.00 0.00 0.00 0.00 61.98 61.59 2c37 s VAL 172 Cb 0.00 -3.06 -0.00 0.00 0.00 0.00 0.00 36.38 33.31 2c37 s VAL 172 CO 0.00 0.48 1.05 -0.63 0.00 0.00 0.00 175.10 176.00 2c37 s ILE 173 N 0.28 4.67 0.19 2.22 1.01 -1.26 -0.07 121.20 128.24 2c37 s ILE 173 Ca 0.02 1.98 0.08 0.00 0.00 0.00 0.00 60.65 62.74 2c37 s ILE 173 Cb -0.13 -4.28 -0.04 0.00 0.01 0.00 0.00 42.46 38.02 2c37 s ILE 173 CO 0.01 -0.09 -0.16 0.27 0.00 0.00 0.00 174.94 174.97 2c37 s ILE 174 N 2.65 1.81 -0.16 2.92 -4.36 -0.17 -4.81 121.20 119.07 2c37 s ILE 174 Ca 0.47 -2.08 -0.02 0.00 -0.26 0.00 0.00 60.65 58.76 2c37 s ILE 174 Cb -0.17 -1.96 -0.01 0.00 1.25 0.00 0.00 42.46 41.57 2c37 s ILE 174 CO 0.13 -0.46 -0.10 -0.22 0.24 0.00 0.00 174.94 174.53 2c37 s LEU 175 N -3.02 2.78 -0.18 0.37 2.96 0.14 -1.12 118.68 120.62 2c37 s LEU 175 Ca 0.20 -0.35 -0.00 0.00 -0.22 0.00 0.00 54.13 53.76 2c37 s LEU 175 Cb -0.03 -1.66 0.00 0.00 0.50 0.00 0.00 46.19 45.00 2c37 s LEU 175 CO 0.07 0.10 0.00 -0.67 -1.32 0.00 0.00 176.35 174.54 2c37 n ASP 176 N 3.98 -5.38 -4.80 3.68 2.03 0.62 -4.63 116.55 112.05 2c37 n ASP 176 Ca -0.18 0.84 -0.35 0.00 0.52 0.00 0.00 54.79 55.61 2c37 n ASP 176 Cb 0.52 -3.53 -0.06 0.00 -0.72 0.00 0.00 41.12 37.33 2c37 n ASP 176 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2c37 s LEU 177 N -0.93 4.22 0.90 -2.67 1.43 -1.23 -4.77 118.68 115.63 2c37 s LEU 177 Ca -0.00 1.67 -0.12 0.00 -1.03 0.00 0.00 54.13 54.64 2c37 s LEU 177 Cb 0.00 -4.05 0.13 0.00 0.03 0.00 0.00 46.19 42.30 2c37 s LEU 177 CO 0.46 -0.13 1.09 0.20 0.23 0.00 0.00 176.35 178.21 2c37 s ASN 178 N -1.81 3.47 0.13 2.29 0.02 -1.26 -4.63 114.94 113.15 2c37 s ASN 178 Ca 0.52 1.40 -0.25 0.00 -1.02 0.00 0.00 52.86 53.51 2c37 s ASN 178 Cb -0.15 -2.08 -0.02 0.00 0.02 0.00 0.00 41.25 39.01 2c37 s ASN 178 CO 0.20 -2.63 1.62 -0.08 0.02 0.00 0.00 177.10 176.24 2c37 h GLU 179 N -1.54 -0.35 -0.21 -0.60 4.81 -1.91 0.32 114.58 115.10 2c37 h GLU 179 Ca -0.50 0.02 0.03 0.00 -0.13 0.00 0.00 59.36 58.79 2c37 h GLU 179 Cb 1.29 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.72 2c37 h GLU 179 CO 0.56 -0.24 0.00 1.15 -0.73 0.00 0.00 179.01 179.76 2c37 h THR 180 N -0.37 0.86 -0.66 0.32 2.02 -1.93 -0.42 112.91 112.73 2c37 h THR 180 Ca 0.09 -0.02 -0.02 0.00 0.77 0.00 0.00 66.41 67.23 2c37 h THR 180 Cb 0.50 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 2c37 h THR 180 CO -0.31 0.01 0.34 -0.33 0.37 0.00 0.00 175.52 175.60 2c37 h GLU 181 N 0.07 0.94 -0.33 6.66 5.08 -1.89 -1.99 114.58 123.13 2c37 h GLU 181 Ca 0.10 -0.12 0.04 0.00 -1.00 0.00 0.00 59.36 58.37 2c37 h GLU 181 Cb 0.12 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.16 2c37 h GLU 181 CO -0.16 0.73 0.10 0.22 -1.00 0.00 0.00 179.01 178.89 2c37 h ASP 182 N 0.91 0.08 0.99 1.42 1.82 -0.60 0.20 116.42 121.25 2c37 h ASP 182 Ca 0.23 0.04 0.00 0.00 -0.39 0.00 0.00 57.03 56.91 2c37 h ASP 182 Cb 0.08 0.04 0.00 0.00 0.68 0.00 0.00 39.33 40.13 2c37 h ASP 182 CO -0.03 0.08 0.00 -0.03 -1.61 0.00 0.00 179.24 177.65 2c37 h MET 183 N 0.23 0.00 0.00 0.28 4.05 -0.79 -3.31 114.93 115.39 2c37 h MET 183 Ca 0.15 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.57 2c37 h MET 183 Cb 0.14 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.94 2c37 h MET 183 CO -0.17 0.00 0.00 0.91 0.23 0.00 0.00 176.91 177.88 2c37 n TRP 184 N -2.70 0.00 -1.33 1.39 7.02 -0.77 -5.07 117.44 115.99 2c37 n TRP 184 Ca 0.02 0.00 -0.30 0.00 -1.02 0.00 0.00 57.50 56.20 2c37 n TRP 184 Cb 0.30 0.00 0.12 0.00 -2.42 0.00 0.00 31.31 29.30 2c37 n TRP 184 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 2c37 s GLY 185 N -0.17 1.63 0.23 6.99 0.00 0.70 -4.98 107.32 111.72 2c37 s GLY 185 Ca 0.00 -0.06 0.14 0.00 0.00 0.00 0.00 44.72 44.80 2c37 s GLY 185 CO 0.00 0.39 1.36 0.83 0.00 0.00 0.00 173.10 175.67 2c37 h GLU 186 N -1.33 0.00 -3.01 2.90 3.07 -1.34 -3.47 114.58 111.40 2c37 h GLU 186 Ca -0.48 0.00 -0.11 0.00 -0.50 0.00 0.00 59.36 58.27 2c37 h GLU 186 Cb 1.27 0.00 -0.20 0.00 -0.84 0.00 0.00 28.75 28.98 2c37 h GLU 186 CO 0.56 0.56 -0.25 0.00 -1.40 0.00 0.00 179.01 178.48 2c37 s ALA 187 N -2.91 -0.83 -0.16 3.43 0.00 -1.20 -1.09 121.76 119.00 2c37 s ALA 187 Ca 0.03 0.34 -0.04 0.00 0.00 0.00 0.00 51.96 52.29 2c37 s ALA 187 Cb 0.08 0.10 0.08 0.00 0.00 0.00 0.00 23.12 23.38 2c37 s ALA 187 CO 0.76 -0.28 0.22 0.34 0.00 0.00 0.00 175.76 176.80 2c37 s ASP 188 N -1.41 0.98 -0.50 0.00 2.15 -0.16 -2.72 116.67 115.01 2c37 s ASP 188 Ca -0.12 0.10 0.03 0.00 0.43 0.00 0.00 52.55 52.99 2c37 s ASP 188 Cb -0.04 0.45 0.15 0.00 -0.30 0.00 0.00 42.92 43.17 2c37 s ASP 188 CO 0.04 -0.29 0.32 -0.32 -0.17 0.00 0.00 175.17 174.75 2c37 s MET 189 N 2.34 1.51 0.09 4.34 -2.45 0.95 -1.05 119.30 125.05 2c37 s MET 189 Ca 0.05 -2.37 -0.31 0.00 -1.25 0.00 0.00 55.69 51.81 2c37 s MET 189 Cb -0.14 -2.43 -0.08 0.00 1.25 0.00 0.00 34.83 33.43 2c37 s MET 189 CO -0.10 -1.24 1.45 -1.25 1.05 0.00 0.00 175.02 174.94 2c37 s PRO 190 N -0.17 4.28 -0.03 4.11 0.04 -0.96 -1.49 135.00 140.78 2c37 s PRO 190 Ca 0.23 2.13 0.02 0.00 0.04 0.00 0.00 61.00 63.42 2c37 s PRO 190 Cb -0.13 -3.34 0.01 0.00 0.04 0.00 0.00 34.50 31.07 2c37 s PRO 190 CO -0.08 -0.53 -0.09 0.42 0.04 0.00 0.00 177.00 176.76 2c37 s ILE 191 N 1.56 0.82 -0.01 0.56 1.01 -0.59 -1.49 121.20 123.05 2c37 s ILE 191 Ca 0.66 -0.37 0.02 0.00 0.00 0.00 0.00 60.65 60.97 2c37 s ILE 191 Cb -0.37 -0.74 -0.00 0.00 0.01 0.00 0.00 42.46 41.36 2c37 s ILE 191 CO 0.30 0.26 -0.06 0.00 0.00 0.00 0.00 174.94 175.44 2c37 s ALA 192 N 0.28 0.56 0.22 9.38 0.00 -0.01 -1.32 121.76 130.86 2c37 s ALA 192 Ca -0.05 -0.25 0.03 0.00 0.00 0.00 0.00 51.96 51.69 2c37 s ALA 192 Cb -0.10 -0.17 -0.05 0.00 0.00 0.00 0.00 23.12 22.80 2c37 s ALA 192 CO 0.01 0.12 0.00 -1.64 0.00 0.00 0.00 175.76 174.25 2c37 s MET 193 N -0.02 1.28 -0.73 0.00 1.00 0.25 0.65 119.30 121.72 2c37 s MET 193 Ca 0.01 -1.64 -0.16 0.00 0.00 0.00 0.00 55.69 53.89 2c37 s MET 193 Cb -0.04 -0.51 0.17 0.00 0.00 0.00 0.00 34.83 34.44 2c37 s MET 193 CO -0.00 -0.11 0.74 -1.64 0.00 0.00 0.00 175.02 174.01 2c37 s MET 194 N -3.88 3.36 0.39 2.03 -1.94 0.62 -1.43 119.30 118.43 2c37 s MET 194 Ca 0.28 -1.98 0.05 0.00 -1.71 0.00 0.00 55.69 52.33 2c37 s MET 194 Cb 0.06 -4.43 0.77 0.00 2.01 0.00 0.00 34.83 33.23 2c37 s MET 194 CO 0.08 -1.41 2.03 -1.35 -0.01 0.00 0.00 175.02 174.36 2c37 h PRO 195 N 8.44 0.65 0.00 2.03 0.11 -1.83 -1.07 132.00 140.33 2c37 h PRO 195 Ca -0.06 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.92 2c37 h PRO 195 Cb 1.06 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.02 2c37 h PRO 195 CO 0.93 0.44 -0.42 0.77 -0.21 0.00 0.00 178.00 179.51 2c37 h SER 196 N 0.66 0.00 0.12 -2.05 0.02 -1.93 -2.90 113.55 107.47 2c37 h SER 196 Ca 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 2c37 h SER 196 Cb -0.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.48 2c37 h SER 196 CO -0.04 0.42 -0.61 0.18 -1.14 0.00 0.00 176.83 175.64 2c37 n LEU 197 N -3.87 1.25 -3.91 5.07 4.77 -0.49 -4.96 117.00 114.85 2c37 n LEU 197 Ca -0.01 -0.45 -0.30 0.00 -0.03 0.00 0.00 56.01 55.22 2c37 n LEU 197 Cb 0.47 -0.07 0.03 0.00 -2.33 0.00 0.00 43.42 41.52 2c37 n LEU 197 CO 0.39 0.26 0.09 0.59 -1.33 0.00 0.00 177.39 177.39 2c37 n ASN 198 N -0.88 -4.53 -4.39 -1.43 5.03 -0.67 -4.97 115.26 103.42 2c37 n ASN 198 Ca 0.07 -0.79 -0.34 0.00 0.87 0.00 0.00 54.58 54.39 2c37 n ASN 198 Cb 0.38 -3.86 -0.13 0.00 -1.02 0.00 0.00 39.78 35.14 2c37 n ASN 198 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 2c37 s GLN 199 N -6.59 3.48 -0.03 3.52 -1.52 -1.07 -4.98 119.66 112.47 2c37 s GLN 199 Ca 0.62 -0.60 -0.25 0.00 -1.95 0.00 0.00 55.36 53.18 2c37 s GLN 199 Cb -0.31 -2.92 -0.04 0.00 -0.22 0.00 0.00 33.01 29.52 2c37 s GLN 199 CO 0.83 0.02 0.77 0.08 -0.25 0.00 0.00 175.29 176.75 2c37 s VAL 200 N 0.91 4.94 -0.17 1.09 1.01 -1.26 -0.28 120.40 126.64 2c37 s VAL 200 Ca -0.01 1.62 0.01 0.00 0.00 0.00 0.00 61.98 63.60 2c37 s VAL 200 Cb -0.15 -4.12 -0.11 0.00 0.00 0.00 0.00 36.38 32.01 2c37 s VAL 200 CO 0.01 0.26 -0.15 0.41 0.00 0.00 0.00 175.10 175.63 2c37 n THR 201 N 3.58 0.96 -4.41 3.92 -1.04 0.21 -4.94 114.28 112.57 2c37 n THR 201 Ca 0.00 -0.37 -0.20 0.00 -2.04 0.00 0.00 64.05 61.45 2c37 n THR 201 Cb 0.51 -1.11 -0.15 0.00 -1.82 0.00 0.00 70.33 67.76 2c37 n THR 201 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 2c37 s LEU 202 N -6.00 1.92 -0.21 -4.42 0.20 -0.88 -4.19 118.68 105.09 2c37 s LEU 202 Ca -0.23 -0.18 -0.05 0.00 0.69 0.00 0.00 54.13 54.36 2c37 s LEU 202 Cb 0.06 -0.53 0.11 0.00 -0.43 0.00 0.00 46.19 45.40 2c37 s LEU 202 CO 0.39 0.10 0.38 0.12 -0.29 0.00 0.00 176.35 177.05 2c37 s PHE 203 N -0.06 -0.77 0.02 5.38 5.36 -1.26 -0.83 117.98 125.82 2c37 s PHE 203 Ca 0.01 1.10 -0.01 0.00 -0.96 0.00 0.00 56.93 57.07 2c37 s PHE 203 Cb -0.06 0.12 -0.02 0.00 -0.34 0.00 0.00 43.02 42.72 2c37 s PHE 203 CO -0.00 -0.59 -0.01 -0.65 -1.46 0.00 0.00 175.22 172.51 2c37 s GLN 204 N 2.56 0.35 -0.05 10.12 -0.21 -0.56 -5.04 119.66 126.82 2c37 s GLN 204 Ca 0.06 -0.61 -0.02 0.00 0.02 0.00 0.00 55.36 54.82 2c37 s GLN 204 Cb -0.14 0.13 0.03 0.00 1.00 0.00 0.00 33.01 34.03 2c37 s GLN 204 CO -0.14 -0.06 0.04 -1.17 -2.12 0.00 0.00 175.29 171.84 2c37 s LEU 205 N -1.51 0.38 -0.09 2.90 2.96 -1.26 -2.26 118.68 119.80 2c37 s LEU 205 Ca -0.15 0.02 0.01 0.00 -0.22 0.00 0.00 54.13 53.79 2c37 s LEU 205 Cb -0.09 -0.24 -0.02 0.00 0.50 0.00 0.00 46.19 46.34 2c37 s LEU 205 CO -0.01 -0.22 -0.12 0.54 -1.32 0.00 0.00 176.35 175.22 2c37 s ASN 206 N 1.99 4.18 0.00 3.68 2.20 -0.21 -4.99 114.94 121.79 2c37 s ASN 206 Ca 0.04 -0.20 0.00 0.00 -0.94 0.00 0.00 52.86 51.75 2c37 s ASN 206 Cb -0.12 -1.22 0.00 0.00 -2.00 0.00 0.00 41.25 37.91 2c37 s ASN 206 CO -0.04 0.28 0.00 0.61 -2.94 0.00 0.00 177.10 175.01 2c37 n GLY 207 N 2.78 0.20 3.13 0.45 0.00 -1.26 -0.99 105.19 109.50 2c37 n GLY 207 Ca -0.18 -1.91 -0.13 0.00 0.00 0.00 0.00 46.02 43.80 2c37 n GLY 207 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2c37 s SER 208 N -4.00 -0.28 -0.06 1.61 0.15 -0.25 -4.97 113.70 105.91 2c37 s SER 208 Ca 0.00 0.54 -0.24 0.00 0.70 0.00 0.00 55.95 56.95 2c37 s SER 208 Cb 0.00 0.52 0.05 0.00 -1.71 0.00 0.00 66.02 64.88 2c37 s SER 208 CO 0.00 -0.11 0.54 -0.04 1.20 0.00 0.00 173.24 174.83 2c37 s MET 209 N 0.36 0.87 0.52 5.44 -1.94 -1.26 -4.40 119.30 118.89 2c37 s MET 209 Ca -0.02 0.17 -0.15 0.00 -1.71 0.00 0.00 55.69 53.98 2c37 s MET 209 Cb -0.03 0.41 -0.07 0.00 2.01 0.00 0.00 34.83 37.14 2c37 s MET 209 CO -0.01 -0.25 0.97 0.95 -0.01 0.00 0.00 175.02 176.67 2c37 s THR 210 N -1.05 4.58 0.29 2.05 -4.23 -1.26 -4.86 115.64 111.16 2c37 s THR 210 Ca -0.11 1.10 0.03 0.00 -1.18 0.00 0.00 61.69 61.54 2c37 s THR 210 Cb -0.02 -3.74 0.28 0.00 1.34 0.00 0.00 72.50 70.35 2c37 s THR 210 CO 0.07 -0.74 1.74 -0.65 -0.54 0.00 0.00 174.62 174.50 2c37 h PRO 211 N 0.78 0.55 -0.13 3.99 0.11 -2.01 0.11 132.00 135.40 2c37 h PRO 211 Ca -0.46 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.63 2c37 h PRO 211 Cb 1.19 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 2c37 h PRO 211 CO 0.62 0.36 0.01 -0.44 -0.21 0.00 0.00 178.00 178.34 2c37 h ASP 212 N 0.56 -0.03 -0.84 -2.05 3.32 -1.99 0.24 116.42 115.62 2c37 h ASP 212 Ca 0.54 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.60 2c37 h ASP 212 Cb 0.92 0.04 -0.04 0.00 0.22 0.00 0.00 39.33 40.47 2c37 h ASP 212 CO -0.44 0.00 0.44 -0.33 -1.72 0.00 0.00 179.24 177.20 2c37 h GLU 213 N 0.05 1.19 -0.16 3.56 5.08 -1.60 -0.98 114.58 121.73 2c37 h GLU 213 Ca 0.06 -0.15 0.03 0.00 -1.00 0.00 0.00 59.36 58.30 2c37 h GLU 213 Cb 0.07 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.06 2c37 h GLU 213 CO -0.10 0.89 -0.03 0.35 -1.00 0.00 0.00 179.01 179.12 2c37 h PHE 214 N 1.19 -0.07 -0.63 4.33 3.57 -0.42 -0.24 116.94 124.66 2c37 h PHE 214 Ca 0.30 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.74 2c37 h PHE 214 Cb 0.06 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.83 2c37 h PHE 214 CO 0.01 -0.06 0.10 0.00 -2.23 0.00 0.00 178.31 176.13 2c37 h ARG 215 N 0.01 1.04 -0.20 1.11 3.08 -0.34 -1.30 114.38 117.78 2c37 h ARG 215 Ca 0.08 -0.27 -0.02 0.00 0.07 0.00 0.00 59.98 59.84 2c37 h ARG 215 Cb 0.11 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 2c37 h ARG 215 CO -0.16 0.95 0.06 1.96 -1.07 0.00 0.00 179.97 181.71 2c37 h GLN 216 N 0.97 0.31 -0.75 0.04 4.20 -0.98 -2.11 115.11 116.79 2c37 h GLN 216 Ca 0.19 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.85 2c37 h GLN 216 Cb 0.42 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.12 2c37 h GLN 216 CO 0.01 0.42 0.49 0.00 -0.67 0.00 0.00 178.83 179.08 2c37 h ALA 217 N 0.88 0.97 -0.57 3.87 0.00 -0.96 -2.40 119.26 121.05 2c37 h ALA 217 Ca 0.06 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.99 2c37 h ALA 217 Cb 0.24 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 2c37 h ALA 217 CO -0.00 0.34 0.28 0.35 0.00 0.00 0.00 179.25 180.21 2c37 h PHE 218 N 0.99 0.51 -0.80 0.00 3.57 -1.04 -1.39 116.94 118.78 2c37 h PHE 218 Ca 0.29 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.81 2c37 h PHE 218 Cb -0.07 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.49 2c37 h PHE 218 CO -0.03 0.23 0.52 -0.44 -2.23 0.00 0.00 178.31 176.36 2c37 h ASP 219 N 0.53 0.92 -0.64 0.41 3.32 -0.94 -2.83 116.42 117.19 2c37 h ASP 219 Ca 0.26 -0.03 -0.09 0.00 0.02 0.00 0.00 57.03 57.19 2c37 h ASP 219 Cb 0.19 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 2c37 h ASP 219 CO -0.19 0.68 0.06 0.25 -1.72 0.00 0.00 179.24 178.32 2c37 h LEU 220 N 1.08 1.05 -0.85 1.55 5.85 -0.95 -2.81 115.31 120.23 2c37 h LEU 220 Ca 0.29 -0.28 0.06 0.00 0.84 0.00 0.00 57.88 58.79 2c37 h LEU 220 Cb -0.11 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 40.58 2c37 h LEU 220 CO -0.06 1.07 0.53 0.00 -0.34 0.00 0.00 178.44 179.63 2c37 h ALA 221 N 1.02 1.16 -0.44 1.25 0.00 -1.13 -2.42 119.26 118.70 2c37 h ALA 221 Ca 0.19 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.11 2c37 h ALA 221 Cb 0.49 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2c37 h ALA 221 CO 0.02 0.28 0.25 0.28 0.00 0.00 0.00 179.25 180.08 2c37 h VAL 222 N 0.97 1.03 -0.55 0.00 2.07 -1.26 0.27 116.25 118.78 2c37 h VAL 222 Ca 0.37 -0.17 -0.03 0.00 0.82 0.00 0.00 66.70 67.68 2c37 h VAL 222 Cb 0.15 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 2c37 h VAL 222 CO -0.17 0.09 0.22 0.11 0.02 0.00 0.00 177.57 177.85 2c37 h LYS 223 N 0.50 0.82 -0.35 1.57 1.57 -1.37 0.98 116.57 120.30 2c37 h LYS 223 Ca 0.18 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 2c37 h LYS 223 Cb 0.03 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 2c37 h LYS 223 CO -0.09 0.71 0.18 0.78 -0.57 0.00 0.00 179.45 180.46 2c37 h GLY 224 N 0.75 0.52 1.00 3.86 0.00 -1.18 -2.64 103.07 105.39 2c37 h GLY 224 Ca 0.18 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2c37 h GLY 224 CO -0.02 0.24 0.41 -2.22 0.00 0.00 0.00 176.54 174.95 2c37 h ILE 225 N 0.43 1.16 -0.30 2.60 2.04 -0.05 -1.97 117.51 121.41 2c37 h ILE 225 Ca 0.12 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.67 2c37 h ILE 225 Cb 0.09 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.40 2c37 h ILE 225 CO -0.02 0.16 0.19 0.78 0.00 0.00 0.00 178.15 179.27 2c37 h ASN 226 N 0.85 0.35 -0.11 1.72 2.35 -0.69 0.62 115.58 120.68 2c37 h ASN 226 Ca 0.23 -0.01 -0.08 0.00 -0.55 0.00 0.00 56.30 55.88 2c37 h ASN 226 Cb -0.09 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.20 2c37 h ASN 226 CO -0.05 0.26 -0.26 0.40 -1.65 0.00 0.00 177.43 176.13 2c37 h ILE 227 N 0.41 1.39 -0.91 2.81 2.04 -1.05 -3.06 117.51 119.15 2c37 h ILE 227 Ca 0.11 -1.57 -0.00 0.00 1.00 0.00 0.00 64.86 64.40 2c37 h ILE 227 Cb -0.04 2.13 -0.04 0.00 -0.74 0.00 0.00 36.82 38.14 2c37 h ILE 227 CO -0.02 0.46 0.55 0.40 0.00 0.00 0.00 178.15 179.54 2c37 h ILE 228 N -0.07 1.25 -0.38 -0.67 2.04 -0.97 -2.87 117.51 115.83 2c37 h ILE 228 Ca -0.00 -0.53 0.04 0.00 1.00 0.00 0.00 64.86 65.36 2c37 h ILE 228 Cb 0.87 -0.04 -0.04 0.00 -0.74 0.00 0.00 36.82 36.87 2c37 h ILE 228 CO 0.06 0.26 0.16 0.22 0.00 0.00 0.00 178.15 178.85 2c37 h TYR 229 N 1.25 0.29 -0.73 1.37 3.20 -0.90 -0.73 116.97 120.73 2c37 h TYR 229 Ca 0.33 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.22 2c37 h TYR 229 Cb -0.06 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.10 2c37 h TYR 229 CO 0.00 0.14 0.48 -0.91 -1.64 0.00 0.00 178.16 176.23 2c37 h ASN 230 N 0.34 0.83 -0.42 -2.11 2.35 -1.41 -0.52 115.58 114.65 2c37 h ASN 230 Ca 0.17 -0.02 -0.08 0.00 -0.55 0.00 0.00 56.30 55.81 2c37 h ASN 230 Cb 0.12 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 2c37 h ASN 230 CO -0.15 0.60 -0.06 -0.07 -1.65 0.00 0.00 177.43 176.10 2c37 h LEU 231 N 0.98 0.79 -0.10 1.61 3.38 -1.28 -1.26 115.31 119.43 2c37 h LEU 231 Ca 0.27 -0.34 0.03 0.00 0.09 0.00 0.00 57.88 57.92 2c37 h LEU 231 Cb -0.11 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.40 2c37 h LEU 231 CO -0.06 0.95 -0.08 -0.33 0.09 0.00 0.00 178.44 179.01 2c37 h GLU 232 N 0.62 -0.09 -0.82 1.13 5.08 -0.54 0.18 114.58 120.14 2c37 h GLU 232 Ca 0.11 0.01 0.14 0.00 -1.00 0.00 0.00 59.36 58.61 2c37 h GLU 232 Cb 0.58 0.02 -0.09 0.00 0.50 0.00 0.00 28.75 29.76 2c37 h GLU 232 CO 0.03 -0.06 0.41 0.00 -1.00 0.00 0.00 179.01 178.40 2c37 h ARG 233 N -0.09 0.59 -0.20 2.33 3.08 -0.98 -1.59 114.38 117.52 2c37 h ARG 233 Ca 0.07 -0.04 -0.19 0.00 0.07 0.00 0.00 59.98 59.89 2c37 h ARG 233 Cb 0.19 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2c37 h ARG 233 CO -0.16 0.39 -0.65 1.49 -1.07 0.00 0.00 179.97 179.97 2c37 h GLU 234 N 0.60 0.73 -0.12 0.04 4.57 -0.71 -2.85 114.58 116.84 2c37 h GLU 234 Ca 0.44 -0.52 0.04 0.00 -1.18 0.00 0.00 59.36 58.13 2c37 h GLU 234 Cb 0.60 0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.27 2c37 h GLU 234 CO -0.35 1.14 0.09 0.00 -1.18 0.00 0.00 179.01 178.71 2c37 h ALA 235 N 0.73 2.10 -0.47 2.92 0.00 0.10 -1.17 119.26 123.47 2c37 h ALA 235 Ca -0.02 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 2c37 h ALA 235 Cb 1.25 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 2c37 h ALA 235 CO 0.13 -0.15 -0.17 1.25 0.00 0.00 0.00 179.25 180.31 2c37 h LEU 236 N 0.00 0.91 0.15 0.00 5.85 -1.07 0.23 115.31 121.37 2c37 h LEU 236 Ca 0.06 -0.32 -0.21 0.00 0.84 0.00 0.00 57.88 58.25 2c37 h LEU 236 Cb 0.24 -0.25 0.02 0.00 0.37 0.00 0.00 40.66 41.04 2c37 h LEU 236 CO -0.00 1.07 -0.96 0.11 -0.34 0.00 0.00 178.44 178.32 2c37 h LYS 237 N 0.80 0.31 -0.01 1.25 1.57 -1.34 -3.39 116.57 115.76 2c37 h LYS 237 Ca 0.12 -0.53 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 2c37 h LYS 237 Cb 0.71 0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.22 2c37 h LYS 237 CO 0.05 1.25 -0.71 -1.13 -0.57 0.00 0.00 179.45 178.35 2c37 n SER 238 N -4.06 1.41 0.00 0.86 3.41 -0.52 -4.97 113.62 109.75 2c37 n SER 238 Ca -0.16 -1.21 0.00 0.00 -0.26 0.00 0.00 58.87 57.25 2c37 n SER 238 Cb 0.86 0.75 0.00 0.00 -0.26 0.00 0.00 64.21 65.56 2c37 n SER 238 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2c37 n LYS 239 N -0.80 0.00 -3.68 4.33 4.01 0.79 -4.90 118.16 117.92 2c37 n LYS 239 Ca 0.06 0.00 -0.09 0.00 -0.51 0.00 0.00 58.31 57.77 2c37 n LYS 239 Cb 0.37 -3.25 -0.09 0.00 -0.51 0.00 0.00 35.03 31.54 2c37 n LYS 239 CO 0.00 0.00 0.00 -0.47 -1.11 0.00 0.00 177.40 175.82 2c37 s TYR 240 N -2.02 -0.77 -0.02 2.13 5.04 -1.26 -1.23 117.35 119.21 2c37 s TYR 240 Ca 0.00 1.56 -0.00 0.00 -2.44 0.00 0.00 57.07 56.19 2c37 s TYR 240 Cb 0.00 0.38 0.03 0.00 0.35 0.00 0.00 41.96 42.72 2c37 s TYR 240 CO 0.00 -0.42 0.04 0.08 -1.34 0.00 0.00 175.55 173.91 2c37 s VAL 241 N 1.71 -0.06 -0.06 3.14 1.01 0.15 -4.81 120.40 121.48 2c37 s VAL 241 Ca -0.08 0.23 0.05 0.00 0.00 0.00 0.00 61.98 62.17 2c37 s VAL 241 Cb -0.08 -0.09 -0.02 0.00 0.00 0.00 0.00 36.38 36.18 2c37 s VAL 241 CO -0.15 0.09 -0.20 -1.61 0.00 0.00 0.00 175.10 173.24 2c37 s GLU 242 N 1.14 2.59 -0.14 2.72 2.02 -1.26 -1.26 118.70 124.51 2c37 s GLU 242 Ca -0.08 -0.81 -0.04 0.00 0.02 0.00 0.00 54.97 54.06 2c37 s GLU 242 Cb -0.13 -2.28 0.05 0.00 0.10 0.00 0.00 34.13 31.87 2c37 s GLU 242 CO -0.03 0.46 0.06 0.12 0.02 0.00 0.00 175.26 175.89 2c37 s PHE 243 N -0.34 0.39 0.48 1.61 5.36 0.66 -5.00 117.98 121.14 2c37 s PHE 243 Ca 0.02 -0.30 -0.21 0.00 -0.96 0.00 0.00 56.93 55.49 2c37 s PHE 243 Cb -0.12 -0.73 -0.08 0.00 -0.34 0.00 0.00 43.02 41.74 2c37 s PHE 243 CO 0.02 -0.45 1.06 -1.59 -1.46 0.00 0.00 175.22 172.81 2c37 s LYS 244 N 2.07 3.76 0.29 10.12 -2.85 -1.26 -0.50 119.74 131.37 2c37 s LYS 244 Ca 0.02 1.45 -0.29 0.00 -1.00 0.00 0.00 55.97 56.16 2c37 s LYS 244 Cb -0.15 -2.15 -0.14 0.00 -2.06 0.00 0.00 37.83 33.33 2c37 s LYS 244 CO -0.07 -0.48 1.12 0.39 0.10 0.00 0.00 175.35 176.41 2c37 n GLU 245 N -0.88 1.59 -3.70 1.78 1.02 -1.26 -4.84 120.64 114.36 2c37 n GLU 245 Ca 0.09 0.56 -0.07 0.00 -0.02 0.00 0.00 57.16 57.72 2c37 n GLU 245 Cb 0.52 -2.02 -0.02 0.00 -0.02 0.00 0.00 31.44 29.90 2c37 n GLU 245 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2c37 s GLU 246 N -1.47 1.35 0.55 3.49 -1.05 -1.25 -5.00 118.70 115.33 2c37 s GLU 246 Ca 0.59 -0.69 -0.20 0.00 -0.15 0.00 0.00 54.97 54.53 2c37 s GLU 246 Cb -0.67 0.50 -0.05 0.00 -0.44 0.00 0.00 34.13 33.47 2c37 s GLU 246 CO 0.59 -0.61 1.18 0.20 0.95 0.00 0.00 175.26 177.57 2c37 s GLY 247 N -2.84 2.71 0.00 -3.83 0.00 -1.26 -2.74 107.32 99.37 2c37 s GLY 247 Ca 0.09 0.94 0.13 0.00 0.00 0.00 0.00 44.72 45.88 2c37 s GLY 247 CO -0.00 1.34 1.18 -0.62 0.00 0.00 0.00 173.10 175.00