#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rfl s SER 2 N 0.00 -0.77 0.34 1.61 0.15 -1.26 -5.16 113.70 108.61 1rfl s SER 2 Ca 0.00 1.23 -0.08 0.00 0.70 0.00 0.00 55.95 57.80 1rfl s SER 2 Cb 0.00 1.33 -0.06 0.00 -1.71 0.00 0.00 66.02 65.58 1rfl s SER 2 CO 0.00 -0.19 0.67 -1.48 1.20 0.00 0.00 173.24 173.43 1rfl s LEU 3 N 1.55 3.96 0.26 3.45 0.05 -1.26 -4.86 118.68 121.82 1rfl s LEU 3 Ca -0.10 0.96 0.00 0.00 0.05 0.00 0.00 54.13 55.04 1rfl s LEU 3 Cb -0.05 -3.80 0.00 0.00 -2.05 0.00 0.00 46.19 40.29 1rfl s LEU 3 CO -0.18 -0.28 0.00 0.18 -0.55 0.00 0.00 176.35 175.52 1rfl n LEU 4 N -1.02 -5.18 -3.81 1.48 4.77 -1.26 -5.05 117.00 106.92 1rfl n LEU 4 Ca 0.01 2.36 -0.13 0.00 -0.03 0.00 0.00 56.01 58.22 1rfl n LEU 4 Cb 0.54 -2.07 -0.14 0.00 -2.33 0.00 0.00 43.42 39.42 1rfl n LEU 4 CO 0.47 -0.58 -0.27 0.00 -1.33 0.00 0.00 177.39 175.69 1rfl s ARG 5 N -2.46 0.09 0.19 3.23 1.70 -1.26 -5.12 118.95 115.32 1rfl s ARG 5 Ca 0.00 0.18 0.09 0.00 -0.47 0.00 0.00 55.73 55.53 1rfl s ARG 5 Cb 0.00 -0.03 -0.04 0.00 -0.57 0.00 0.00 34.95 34.31 1rfl s ARG 5 CO 0.00 -0.06 -0.12 -1.83 -1.08 0.00 0.00 175.30 172.21 1rfl s GLU 6 N 0.38 1.97 0.00 3.89 4.04 -1.26 -2.01 118.70 125.71 1rfl s GLU 6 Ca -0.03 -1.33 0.00 0.00 0.04 0.00 0.00 54.97 53.65 1rfl s GLU 6 Cb -0.04 -2.10 0.00 0.00 0.02 0.00 0.00 34.13 32.01 1rfl s GLU 6 CO -0.01 0.42 0.00 0.41 -1.84 0.00 0.00 175.26 174.24 1rfl n GLY 7 N 0.00 -2.18 3.72 -3.83 0.00 -1.20 -4.83 105.19 96.88 1rfl n GLY 7 Ca -0.11 1.06 -0.23 0.00 0.00 0.00 0.00 46.02 46.74 1rfl n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1rfl s MET 8 N 0.00 2.42 -0.16 1.61 1.75 -1.26 -4.73 119.30 118.93 1rfl s MET 8 Ca 0.00 -1.44 0.00 0.00 -1.25 0.00 0.00 55.69 53.00 1rfl s MET 8 Cb 0.00 -2.22 0.04 0.00 2.84 0.00 0.00 34.83 35.48 1rfl s MET 8 CO 0.00 0.22 -0.09 -1.59 -0.65 0.00 0.00 175.02 172.91 1rfl s LYS 9 N -3.80 1.77 -0.12 4.11 0.00 -1.26 -5.00 119.74 115.45 1rfl s LYS 9 Ca 0.35 -0.56 -0.06 0.00 0.00 0.00 0.00 55.97 55.69 1rfl s LYS 9 Cb -0.04 -2.06 -0.04 0.00 0.00 0.00 0.00 37.83 35.69 1rfl s LYS 9 CO 0.22 -0.36 0.12 0.08 0.00 0.00 0.00 175.35 175.41 1rfl s VAL 10 N 1.56 5.35 -0.24 1.79 1.01 -1.26 -4.17 120.40 124.45 1rfl s VAL 10 Ca 0.02 0.15 -0.13 0.00 0.00 0.00 0.00 61.98 62.02 1rfl s VAL 10 Cb -0.15 -3.33 -0.04 0.00 0.00 0.00 0.00 36.38 32.87 1rfl s VAL 10 CO -0.09 0.62 0.28 0.54 0.00 0.00 0.00 175.10 176.45 1rfl s VAL 11 N -0.99 5.27 -0.77 2.92 0.11 -1.17 -5.02 120.40 120.74 1rfl s VAL 11 Ca 0.15 0.43 -0.12 0.00 -2.93 0.00 0.00 61.98 59.51 1rfl s VAL 11 Cb -0.12 -3.62 0.20 0.00 -1.53 0.00 0.00 36.38 31.31 1rfl s VAL 11 CO 0.04 0.27 0.69 -0.63 -3.33 0.00 0.00 175.10 172.14 1rfl s ILE 12 N 1.39 5.28 0.40 7.04 1.01 -1.26 -2.89 121.20 132.16 1rfl s ILE 12 Ca 0.13 -2.46 0.01 0.00 0.00 0.00 0.00 60.65 58.33 1rfl s ILE 12 Cb -0.15 -4.29 -0.01 0.00 0.01 0.00 0.00 42.46 38.02 1rfl s ILE 12 CO 0.07 -0.99 0.60 0.00 0.00 0.00 0.00 174.94 174.62 1rfl s ALA 13 N 0.26 3.79 0.00 9.38 0.00 -1.25 -4.96 121.76 128.97 1rfl s ALA 13 Ca 0.16 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 51.07 1rfl s ALA 13 Cb -0.13 -2.07 0.00 0.00 0.00 0.00 0.00 23.12 20.91 1rfl s ALA 13 CO -0.07 -0.21 0.00 0.41 0.00 0.00 0.00 175.76 175.89 1rfl n GLY 14 N -1.92 -1.54 3.62 0.00 0.00 -1.26 -3.06 105.19 101.03 1rfl n GLY 14 Ca -0.01 0.67 -0.03 0.00 0.00 0.00 0.00 46.02 46.64 1rfl n GLY 14 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1rfl s ARG 15 N 0.00 0.16 0.24 1.61 1.70 -1.26 -4.89 118.95 116.51 1rfl s ARG 15 Ca 0.00 -0.03 -0.30 0.00 -0.47 0.00 0.00 55.73 54.93 1rfl s ARG 15 Cb 0.00 0.07 -0.09 0.00 -0.57 0.00 0.00 34.95 34.37 1rfl s ARG 15 CO 0.00 -0.06 1.09 -1.25 -1.08 0.00 0.00 175.30 174.00 1rfl s PRO 16 N -1.83 4.64 -0.33 3.89 0.04 -1.26 -4.23 135.00 135.91 1rfl s PRO 16 Ca 0.09 1.76 -0.10 0.00 0.04 0.00 0.00 61.00 62.79 1rfl s PRO 16 Cb -0.01 -3.22 0.01 0.00 0.04 0.00 0.00 34.50 31.32 1rfl s PRO 16 CO -0.04 0.18 0.43 0.09 0.04 0.00 0.00 177.00 177.70 1rfl n ASN 17 N 1.62 -6.23 0.00 6.66 4.13 -1.26 -4.94 115.26 115.24 1rfl n ASN 17 Ca 0.00 0.34 0.00 0.00 1.68 0.00 0.00 54.58 56.60 1rfl n ASN 17 Cb 0.45 -4.13 0.00 0.00 -1.54 0.00 0.00 39.78 34.57 1rfl n ASN 17 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1rfl n ALA 18 N -0.49 0.00 0.00 5.41 0.00 -1.26 -4.98 120.51 119.19 1rfl n ALA 18 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1rfl n ALA 18 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.80 1rfl n ALA 18 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rfl n GLY 19 N -0.96 -0.35 0.37 0.00 0.00 -1.26 -4.60 105.19 98.38 1rfl n GLY 19 Ca 0.00 0.05 -0.15 0.00 0.00 0.00 0.00 46.02 45.92 1rfl n GLY 19 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1rfl n LYS 20 N 0.00 0.41 0.11 1.61 4.81 -1.26 -4.10 118.16 119.73 1rfl n LYS 20 Ca 0.00 0.17 0.13 0.00 -0.87 0.00 0.00 58.31 57.74 1rfl n LYS 20 Cb 0.00 -1.20 0.45 0.00 0.02 0.00 0.00 35.03 34.30 1rfl n LYS 20 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1rfl n SER 21 N -4.03 0.71 -0.05 3.14 3.41 -1.26 -3.21 113.62 112.32 1rfl n SER 21 Ca -0.27 0.60 -0.13 0.00 -0.26 0.00 0.00 58.87 58.82 1rfl n SER 21 Cb 0.61 -0.78 -0.12 0.00 -0.26 0.00 0.00 64.21 63.66 1rfl n SER 21 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1rfl h SER 22 N 0.00 -0.01 -0.94 4.04 0.02 -1.97 -3.28 113.55 111.41 1rfl h SER 22 Ca 0.00 -0.82 0.15 0.00 -0.84 0.00 0.00 61.79 60.27 1rfl h SER 22 Cb 0.58 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.04 1rfl h SER 22 CO 0.00 0.85 0.60 -0.07 -1.14 0.00 0.00 176.83 177.07 1rfl h LEU 23 N -0.89 0.74 0.00 5.07 3.38 -1.70 -2.67 115.31 119.23 1rfl h LEU 23 Ca -0.00 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1rfl h LEU 23 Cb 0.83 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1rfl h LEU 23 CO 0.00 0.36 0.00 0.18 0.09 0.00 0.00 178.44 179.07 1rfl n LEU 24 N -4.60 0.00 -3.23 1.67 4.32 -1.20 -0.95 117.00 113.00 1rfl n LEU 24 Ca 0.19 0.99 -0.24 0.00 -0.02 0.00 0.00 56.01 56.92 1rfl n LEU 24 Cb 0.47 -0.49 -0.02 0.00 -1.62 0.00 0.00 43.42 41.75 1rfl n LEU 24 CO 0.28 -0.49 2.24 -0.46 -1.22 0.00 0.00 177.39 177.74 1rfl n ASN 25 N -2.98 4.27 0.00 -1.43 0.23 -1.00 -2.25 115.26 112.10 1rfl n ASN 25 Ca 0.00 -2.36 0.00 0.00 -0.53 0.00 0.00 54.58 51.69 1rfl n ASN 25 Cb 0.00 -1.06 0.00 0.00 -2.08 0.00 0.00 39.78 36.64 1rfl n ASN 25 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1rfl n ALA 26 N 4.77 0.00 -1.10 -2.53 0.00 -0.13 -4.92 120.51 116.60 1rfl n ALA 26 Ca 0.43 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.61 1rfl n ALA 26 Cb 0.17 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.68 1rfl n ALA 26 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1rfl n LEU 27 N -1.94 7.05 0.15 0.00 4.77 -0.64 -4.26 117.00 122.14 1rfl n LEU 27 Ca 0.00 -3.77 0.00 0.00 -0.03 0.00 0.00 56.01 52.21 1rfl n LEU 27 Cb 0.00 -1.01 0.00 0.00 -2.33 0.00 0.00 43.42 40.08 1rfl n LEU 27 CO 0.00 1.33 0.00 0.00 -1.33 0.00 0.00 177.39 177.39 1rfl n ALA 28 N -0.31 2.07 -0.50 -1.18 0.00 -1.25 -4.90 120.51 114.44 1rfl n ALA 28 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1rfl n ALA 28 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.10 1rfl n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rfl n GLY 29 N 0.57 1.28 0.15 0.00 0.00 -1.26 -4.96 105.19 100.97 1rfl n GLY 29 Ca 0.00 -0.17 0.06 0.00 0.00 0.00 0.00 46.02 45.91 1rfl n GLY 29 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1rfl h ARG 30 N 0.00 0.00 0.00 1.61 2.47 -1.94 -3.47 114.38 113.05 1rfl h ARG 30 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1rfl h ARG 30 Cb 0.22 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.54 1rfl h ARG 30 CO 0.00 0.26 0.00 0.39 0.56 0.00 0.00 179.97 181.18 1rfl n GLU 31 N -3.05 0.00 -3.39 0.04 1.02 -1.26 -4.49 120.64 109.52 1rfl n GLU 31 Ca -0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.72 1rfl n GLU 31 Cb 0.68 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 32.08 1rfl n GLU 31 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1rfl n ALA 32 N 0.00 4.22 -2.73 0.62 0.00 -1.26 -5.02 120.51 116.34 1rfl n ALA 32 Ca 0.00 -4.67 -0.14 0.00 0.00 0.00 0.00 53.44 48.63 1rfl n ALA 32 Cb 0.00 -2.22 0.06 0.00 0.00 0.00 0.00 19.45 17.29 1rfl n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rfl n ALA 33 N 2.39 0.42 -3.49 0.00 0.00 -1.26 -5.12 120.51 113.44 1rfl n ALA 33 Ca 0.24 -1.23 -0.17 0.00 0.00 0.00 0.00 53.44 52.27 1rfl n ALA 33 Cb 0.38 0.27 -0.16 0.00 0.00 0.00 0.00 19.45 19.94 1rfl n ALA 33 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1rfl s ILE 34 N -1.51 0.31 -0.48 0.00 1.10 -1.26 -5.11 121.20 114.25 1rfl s ILE 34 Ca 0.39 -0.03 -0.18 0.00 -0.51 0.00 0.00 60.65 60.32 1rfl s ILE 34 Cb -0.03 -0.35 0.05 0.00 0.15 0.00 0.00 42.46 42.29 1rfl s ILE 34 CO 0.25 0.15 0.53 -0.69 -2.11 0.00 0.00 174.94 173.08 1rfl s VAL 35 N 0.74 5.00 -0.46 4.00 1.01 -1.26 -5.02 120.40 124.40 1rfl s VAL 35 Ca -0.08 -0.56 -0.25 0.00 0.00 0.00 0.00 61.98 61.09 1rfl s VAL 35 Cb -0.11 -4.20 0.03 0.00 0.00 0.00 0.00 36.38 32.09 1rfl s VAL 35 CO -0.01 -0.66 0.88 0.42 0.00 0.00 0.00 175.10 175.73 1rfl s THR 36 N 2.31 4.52 -0.94 3.92 -4.23 -1.26 -4.98 115.64 114.99 1rfl s THR 36 Ca 0.12 0.64 -0.14 0.00 -1.18 0.00 0.00 61.69 61.13 1rfl s THR 36 Cb -0.20 -4.40 0.21 0.00 1.34 0.00 0.00 72.50 69.45 1rfl s THR 36 CO 0.11 -0.81 0.97 -1.81 -0.54 0.00 0.00 174.62 172.54 1rfl s ASP 37 N 2.24 6.88 0.10 3.99 1.11 -1.26 -4.99 116.67 124.74 1rfl s ASP 37 Ca 0.35 -2.78 0.03 0.00 0.18 0.00 0.00 52.55 50.33 1rfl s ASP 37 Cb -0.11 -2.26 -0.04 0.00 1.07 0.00 0.00 42.92 41.58 1rfl s ASP 37 CO 0.25 -0.63 -0.08 -0.51 1.18 0.00 0.00 175.17 175.38 1rfl s ILE 38 N 0.49 0.82 -0.26 0.77 1.10 -1.26 -5.07 121.20 117.79 1rfl s ILE 38 Ca 0.26 -1.75 -0.11 0.00 -0.51 0.00 0.00 60.65 58.53 1rfl s ILE 38 Cb -0.08 -1.47 -0.12 0.00 0.15 0.00 0.00 42.46 40.94 1rfl s ILE 38 CO -0.08 -0.69 -0.32 0.00 -2.11 0.00 0.00 174.94 171.73 1rfl n ALA 39 N 0.31 1.32 -1.51 1.50 0.00 -1.26 -4.87 120.51 116.00 1rfl n ALA 39 Ca -0.14 -1.05 -0.28 0.00 0.00 0.00 0.00 53.44 51.97 1rfl n ALA 39 Cb 0.59 0.13 -0.17 0.00 0.00 0.00 0.00 19.45 20.00 1rfl n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rfl n GLY 40 N 1.48 -0.39 3.65 0.00 0.00 -1.26 -4.74 105.19 103.94 1rfl n GLY 40 Ca -0.51 0.45 -0.58 0.00 0.00 0.00 0.00 46.02 45.38 1rfl n GLY 40 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1rfl n THR 41 N 6.79 0.12 -1.73 2.61 -1.04 -1.26 -4.81 114.28 114.96 1rfl n THR 41 Ca 0.62 -0.02 -0.42 0.00 -2.04 0.00 0.00 64.05 62.19 1rfl n THR 41 Cb 0.19 -0.79 -0.02 0.00 -1.82 0.00 0.00 70.33 67.88 1rfl n THR 41 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1rfl n THR 42 N 3.43 0.48 0.12 12.58 -2.24 -1.26 -4.89 114.28 122.50 1rfl n THR 42 Ca 0.24 -0.12 -0.02 0.00 -2.27 0.00 0.00 64.05 61.88 1rfl n THR 42 Cb 0.10 -1.96 0.09 0.00 -2.10 0.00 0.00 70.33 66.47 1rfl n THR 42 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1rfl h ARG 43 N 5.82 0.00 0.00 -0.78 3.08 -1.98 -2.74 114.38 117.78 1rfl h ARG 43 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.60 1rfl h ARG 43 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 1rfl h ARG 43 CO 0.88 0.69 -0.15 -0.25 -1.07 0.00 0.00 179.97 180.07 1rfl n ASP 44 N -3.59 0.22 0.00 7.04 10.43 -1.26 -4.26 116.55 125.13 1rfl n ASP 44 Ca -0.00 0.31 0.00 0.00 2.57 0.00 0.00 54.79 57.66 1rfl n ASP 44 Cb 0.71 -0.32 0.00 0.00 1.84 0.00 0.00 41.12 43.35 1rfl n ASP 44 CO 0.00 0.00 0.00 0.52 -1.07 0.00 0.00 177.20 176.65 1rfl n VAL 45 N -1.60 0.00 -1.32 2.53 0.31 -1.04 -4.05 118.33 113.16 1rfl n VAL 45 Ca 0.06 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.06 1rfl n VAL 45 Cb 0.35 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 33.14 1rfl n VAL 45 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1rfl n LEU 46 N 0.00 -0.04 0.00 7.52 7.94 -1.23 -4.50 117.00 126.69 1rfl n LEU 46 Ca 0.00 0.04 0.00 0.00 -1.11 0.00 0.00 56.01 54.94 1rfl n LEU 46 Cb 0.00 -0.75 0.00 0.00 0.53 0.00 0.00 43.42 43.20 1rfl n LEU 46 CO 0.00 -0.76 -0.26 -2.11 -1.11 0.00 0.00 177.39 173.15 1rfl n ARG 47 N 7.00 0.00 -0.92 1.96 1.85 -1.26 -4.84 116.66 120.45 1rfl n ARG 47 Ca 0.59 0.00 -0.23 0.00 -1.00 0.00 0.00 57.85 57.20 1rfl n ARG 47 Cb 0.04 -0.70 -0.05 0.00 -1.05 0.00 0.00 32.46 30.70 1rfl n ARG 47 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 177.63 176.77 1rfl n GLU 48 N -2.10 2.40 0.00 2.89 0.28 -1.26 -4.91 120.64 117.94 1rfl n GLU 48 Ca 0.00 -1.47 0.00 0.00 -0.16 0.00 0.00 57.16 55.53 1rfl n GLU 48 Cb 0.26 -2.38 0.00 0.00 1.43 0.00 0.00 31.44 30.75 1rfl n GLU 48 CO 0.00 0.00 0.00 1.58 -0.16 0.00 0.00 177.13 178.55 1rfl n HIS 49 N 3.53 -0.34 -2.67 -1.84 -0.00 -1.26 -4.82 115.22 107.82 1rfl n HIS 49 Ca 0.51 0.00 -0.04 0.00 -0.00 0.00 0.00 57.72 58.19 1rfl n HIS 49 Cb 0.33 0.02 0.08 0.00 -0.00 0.00 0.00 29.99 30.43 1rfl n HIS 49 CO 0.00 0.00 0.00 1.51 -0.00 0.00 0.00 176.34 177.85 1rfl n ILE 50 N -0.04 0.00 -2.27 3.57 0.13 -1.26 -5.02 119.36 114.47 1rfl n ILE 50 Ca 0.00 -0.69 -0.38 0.00 -1.10 0.00 0.00 62.75 60.58 1rfl n ILE 50 Cb 0.00 1.10 -0.02 0.00 -0.84 0.00 0.00 39.64 39.88 1rfl n ILE 50 CO 0.00 0.00 0.00 -1.38 2.80 0.00 0.00 176.55 177.97 1rfl s HIS 51 N 0.11 2.98 -0.51 9.51 -3.43 -1.26 -4.79 115.29 117.91 1rfl s HIS 51 Ca 0.25 1.54 0.03 0.00 -0.80 0.00 0.00 55.06 56.08 1rfl s HIS 51 Cb 0.23 -3.40 0.15 0.00 -1.43 0.00 0.00 32.58 28.13 1rfl s HIS 51 CO -0.11 -1.41 0.32 0.42 -2.00 0.00 0.00 174.74 171.95 1rfl s ILE 52 N -1.46 1.75 0.24 -5.38 1.09 -1.26 -4.97 121.20 111.20 1rfl s ILE 52 Ca 0.60 -3.09 -0.11 0.00 -1.10 0.00 0.00 60.65 56.94 1rfl s ILE 52 Cb -0.30 -2.20 0.30 0.00 -1.06 0.00 0.00 42.46 39.21 1rfl s ILE 52 CO 0.37 -0.96 1.61 -2.24 -0.10 0.00 0.00 174.94 173.62 1rfl h ASP 53 N 6.20 -0.64 -0.88 3.58 3.04 -1.95 0.82 116.42 126.59 1rfl h ASP 53 Ca 0.06 0.22 0.14 0.00 -3.24 0.00 0.00 57.03 54.22 1rfl h ASP 53 Cb 0.88 0.45 -0.14 0.00 -1.04 0.00 0.00 39.33 39.47 1rfl h ASP 53 CO 0.55 -0.24 -0.33 0.61 -2.04 0.00 0.00 179.24 177.79 1rfl n GLY 54 N -1.48 -1.77 0.00 7.15 0.00 -1.26 -4.61 105.19 103.22 1rfl n GLY 54 Ca 0.11 0.98 0.00 0.00 0.00 0.00 0.00 46.02 47.11 1rfl n GLY 54 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1rfl n MET 55 N -5.31 0.00 -2.39 1.61 2.81 0.28 -5.13 117.12 108.98 1rfl n MET 55 Ca 0.10 0.00 -0.43 0.00 -1.81 0.00 0.00 57.70 55.56 1rfl n MET 55 Cb 0.36 0.00 -0.02 0.00 -0.71 0.00 0.00 33.22 32.85 1rfl n MET 55 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1rfl s PRO 56 N 0.00 4.04 0.00 0.03 0.04 -1.18 -4.42 135.00 133.50 1rfl s PRO 56 Ca 0.00 1.46 0.00 0.00 0.04 0.00 0.00 61.00 62.50 1rfl s PRO 56 Cb 0.00 -3.85 0.00 0.00 0.04 0.00 0.00 34.50 30.69 1rfl s PRO 56 CO 0.00 -0.97 0.00 -0.11 0.04 0.00 0.00 177.00 175.96 1rfl n LEU 57 N 7.28 0.00 -4.98 -3.56 0.00 -1.26 -5.12 117.00 109.36 1rfl n LEU 57 Ca 0.15 0.00 -0.18 0.00 0.00 0.00 0.00 56.01 55.97 1rfl n LEU 57 Cb 0.46 0.17 -0.00 0.00 0.00 0.00 0.00 43.42 44.05 1rfl n LEU 57 CO 0.60 -0.17 0.08 -1.38 0.00 0.00 0.00 177.39 176.52 1rfl s HIS 58 N -1.83 2.94 0.05 1.96 -3.43 -1.26 -5.13 115.29 108.59 1rfl s HIS 58 Ca 0.00 -0.32 0.07 0.00 -0.80 0.00 0.00 55.06 54.01 1rfl s HIS 58 Cb 0.00 -2.15 -0.03 0.00 -1.43 0.00 0.00 32.58 28.98 1rfl s HIS 58 CO 0.00 -0.17 -0.19 0.42 -2.00 0.00 0.00 174.74 172.80 1rfl s ILE 59 N -2.28 1.52 0.25 -5.38 1.01 -1.26 -4.94 121.20 110.12 1rfl s ILE 59 Ca 0.49 -1.19 0.06 0.00 0.00 0.00 0.00 60.65 60.00 1rfl s ILE 59 Cb -0.09 -1.35 -0.03 0.00 0.01 0.00 0.00 42.46 41.00 1rfl s ILE 59 CO 0.31 0.11 0.29 -0.63 0.00 0.00 0.00 174.94 175.03 1rfl s ILE 60 N -0.87 4.86 -0.29 2.92 1.01 -1.26 -5.09 121.20 122.48 1rfl s ILE 60 Ca 0.06 -1.17 -0.05 0.00 0.00 0.00 0.00 60.65 59.49 1rfl s ILE 60 Cb -0.09 -3.65 0.02 0.00 0.01 0.00 0.00 42.46 38.76 1rfl s ILE 60 CO 0.02 -0.33 0.03 -1.81 0.00 0.00 0.00 174.94 172.85 1rfl s ASP 61 N -3.93 4.87 -1.00 3.58 -0.00 -1.26 -4.99 116.67 113.94 1rfl s ASP 61 Ca 0.34 -0.89 -0.03 0.00 -0.00 0.00 0.00 52.55 51.98 1rfl s ASP 61 Cb -0.08 -1.79 0.25 0.00 -0.00 0.00 0.00 42.92 41.29 1rfl s ASP 61 CO 0.27 -0.20 2.12 0.41 -0.00 0.00 0.00 175.17 177.77 1rfl n THR 62 N 4.77 5.09 -1.69 -1.27 -1.04 -1.26 -4.80 114.28 114.07 1rfl n THR 62 Ca -0.15 -4.90 0.00 0.00 -2.04 0.00 0.00 64.05 56.96 1rfl n THR 62 Cb 0.47 -1.62 0.00 0.00 -1.82 0.00 0.00 70.33 67.35 1rfl n THR 62 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1rfl n ALA 63 N 0.39 0.00 0.00 2.41 0.00 -1.26 -3.49 120.51 118.56 1rfl n ALA 63 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.96 1rfl n ALA 63 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.73 1rfl n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rfl n GLY 64 N 5.00 -0.98 0.00 0.00 0.00 -1.26 -4.63 105.19 103.31 1rfl n GLY 64 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1rfl n GLY 64 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rfl n LEU 65 N 0.00 0.00 -0.24 0.99 4.77 -1.26 -4.94 117.00 116.32 1rfl n LEU 65 Ca 0.00 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.02 1rfl n LEU 65 Cb 0.00 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.24 1rfl n LEU 65 CO 0.00 0.00 0.85 -0.09 -1.33 0.00 0.00 177.39 176.82 1rfl h ARG 66 N 0.00 0.13 0.39 3.23 2.43 -2.00 0.88 114.38 119.44 1rfl h ARG 66 Ca 0.00 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 1rfl h ARG 66 Cb 0.00 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 1rfl h ARG 66 CO 0.00 0.09 -0.19 0.93 -1.51 0.00 0.00 179.97 179.29 1rfl h GLU 67 N 0.13 -0.50 -0.64 0.20 5.08 -1.97 -3.09 114.58 113.79 1rfl h GLU 67 Ca 0.40 0.03 0.09 0.00 -1.00 0.00 0.00 59.36 58.88 1rfl h GLU 67 Cb 0.69 0.11 -0.11 0.00 0.50 0.00 0.00 28.75 29.94 1rfl h GLU 67 CO -0.61 -0.26 -0.44 0.00 -1.00 0.00 0.00 179.01 176.71 1rfl h ALA 68 N -0.93 -0.30 -0.95 3.43 0.00 -1.60 1.11 119.26 120.02 1rfl h ALA 68 Ca -0.05 0.12 0.17 0.00 0.00 0.00 0.00 54.91 55.15 1rfl h ALA 68 Cb 0.48 0.99 -0.17 0.00 0.00 0.00 0.00 17.79 19.10 1rfl h ALA 68 CO 0.09 -0.82 -0.32 1.03 0.00 0.00 0.00 179.25 179.22 1rfl h SER 69 N -0.19 -1.19 0.05 0.00 0.87 0.69 1.29 113.55 115.05 1rfl h SER 69 Ca 0.19 0.30 -0.00 0.00 -1.23 0.00 0.00 61.79 61.04 1rfl h SER 69 Cb 0.56 0.68 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 1rfl h SER 69 CO -0.73 -0.30 -0.02 0.44 -0.53 0.00 0.00 176.83 175.69 1rfl h ASP 70 N -0.01 -0.05 -0.74 6.23 3.32 -0.48 0.16 116.42 124.85 1rfl h ASP 70 Ca 0.38 -0.37 0.17 0.00 0.02 0.00 0.00 57.03 57.23 1rfl h ASP 70 Cb 0.64 0.01 -0.12 0.00 0.22 0.00 0.00 39.33 40.08 1rfl h ASP 70 CO -0.97 0.35 0.06 -0.33 -1.72 0.00 0.00 179.24 176.64 1rfl h GLU 71 N -0.46 0.15 -0.04 3.56 4.39 0.43 0.60 114.58 123.20 1rfl h GLU 71 Ca -0.01 -0.01 -0.15 0.00 0.34 0.00 0.00 59.36 59.54 1rfl h GLU 71 Cb 0.42 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 1rfl h GLU 71 CO 0.01 0.10 -0.65 -0.24 -1.16 0.00 0.00 179.01 177.07 1rfl h VAL 72 N 0.15 1.42 0.00 3.13 3.04 0.15 -3.31 116.25 120.83 1rfl h VAL 72 Ca 0.41 -2.11 -0.46 0.00 -1.01 0.00 0.00 66.70 63.52 1rfl h VAL 72 Cb 0.72 2.11 0.01 0.00 -2.01 0.00 0.00 31.29 32.12 1rfl h VAL 72 CO -0.61 0.62 2.56 -0.62 -1.01 0.00 0.00 177.57 178.51 1rfl n GLU 73 N -3.82 2.74 0.00 4.17 -0.58 0.21 -2.82 120.64 120.53 1rfl n GLU 73 Ca -0.02 -1.66 0.00 0.00 -0.42 0.00 0.00 57.16 55.06 1rfl n GLU 73 Cb 0.64 -2.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.02 1rfl n GLU 73 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 1rfl n ARG 74 N 3.55 0.00 0.01 3.49 0.63 -1.23 -4.31 116.66 118.80 1rfl n ARG 74 Ca 0.58 0.00 0.08 0.00 -0.92 0.00 0.00 57.85 57.59 1rfl n ARG 74 Cb 0.32 0.00 0.35 0.00 0.45 0.00 0.00 32.46 33.57 1rfl n ARG 74 CO 0.00 0.00 0.00 0.44 -2.51 0.00 0.00 177.63 175.56 1rfl n ILE 75 N -1.24 0.91 -1.26 5.15 -6.64 -1.13 -1.87 119.36 113.29 1rfl n ILE 75 Ca 0.00 0.23 0.06 0.00 -1.77 0.00 0.00 62.75 61.26 1rfl n ILE 75 Cb 0.00 -0.97 0.19 0.00 -1.44 0.00 0.00 39.64 37.43 1rfl n ILE 75 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1rfl n GLY 76 N 0.13 4.77 2.99 3.28 0.00 -1.23 -5.00 105.19 110.13 1rfl n GLY 76 Ca 0.04 -1.18 -0.10 0.00 0.00 0.00 0.00 46.02 44.78 1rfl n GLY 76 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1rfl n ILE 77 N -1.10 -9.97 -4.16 -0.61 5.41 -0.78 -5.04 119.36 103.10 1rfl n ILE 77 Ca 0.22 0.57 -0.17 0.00 1.00 0.00 0.00 62.75 64.37 1rfl n ILE 77 Cb 0.79 -6.72 -0.12 0.00 -0.71 0.00 0.00 39.64 32.88 1rfl n ILE 77 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1rfl s GLU 78 N -2.73 0.71 0.04 0.38 8.01 -1.26 -4.93 118.70 118.92 1rfl s GLU 78 Ca 0.21 -0.80 -0.13 0.00 0.01 0.00 0.00 54.97 54.25 1rfl s GLU 78 Cb -0.05 -0.63 -0.06 0.00 -4.31 0.00 0.00 34.13 29.08 1rfl s GLU 78 CO 0.78 0.14 1.21 -0.09 0.01 0.00 0.00 175.26 177.31 1rfl h ARG 79 N 4.58 -0.27 0.00 1.61 2.43 -1.96 -3.41 114.38 117.36 1rfl h ARG 79 Ca -0.38 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.81 1rfl h ARG 79 Cb 1.19 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1rfl h ARG 79 CO 0.42 -0.18 0.00 0.00 -1.51 0.00 0.00 179.97 178.70 1rfl n ALA 80 N -2.65 0.00 -3.57 2.80 0.00 -1.26 -5.00 120.51 110.84 1rfl n ALA 80 Ca -0.03 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.28 1rfl n ALA 80 Cb 0.16 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.48 1rfl n ALA 80 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1rfl s TRP 81 N -1.99 -0.30 0.01 0.00 -0.00 -1.26 -4.65 118.94 110.75 1rfl s TRP 81 Ca 0.00 0.72 0.00 0.00 -0.00 0.00 0.00 56.10 56.82 1rfl s TRP 81 Cb 0.00 0.05 0.00 0.00 -0.00 0.00 0.00 33.47 33.52 1rfl s TRP 81 CO 0.00 -0.20 0.00 0.94 -0.00 0.00 0.00 176.95 177.69 1rfl n GLN 82 N 3.90 0.00 -3.24 5.86 -0.06 -1.26 -5.13 117.38 117.44 1rfl n GLN 82 Ca -0.22 0.00 0.03 0.00 -2.00 0.00 0.00 57.00 54.81 1rfl n GLN 82 Cb 0.54 -0.00 -0.04 0.00 -4.06 0.00 0.00 30.24 26.68 1rfl n GLN 82 CO 0.00 0.00 0.00 -1.83 -0.20 0.00 0.00 177.06 175.03 1rfl s GLU 83 N -1.04 0.12 -0.35 3.69 -1.05 -1.26 -5.12 118.70 113.69 1rfl s GLU 83 Ca 0.00 0.29 -0.01 0.00 -0.15 0.00 0.00 54.97 55.10 1rfl s GLU 83 Cb 0.00 0.17 0.12 0.00 -0.44 0.00 0.00 34.13 33.98 1rfl s GLU 83 CO 0.00 -0.05 0.18 0.42 0.95 0.00 0.00 175.26 176.76 1rfl s ILE 84 N 2.28 0.43 1.01 1.83 1.09 -1.26 -5.05 121.20 121.53 1rfl s ILE 84 Ca -0.01 -1.58 -0.17 0.00 -1.10 0.00 0.00 60.65 57.79 1rfl s ILE 84 Cb -0.03 -1.33 0.26 0.00 -1.06 0.00 0.00 42.46 40.30 1rfl s ILE 84 CO -0.16 -0.86 0.70 -1.84 -0.10 0.00 0.00 174.94 172.68 1rfl n GLU 85 N 4.38 -3.56 -4.65 2.79 0.28 -1.26 -4.95 120.64 113.67 1rfl n GLU 85 Ca 0.05 -1.14 -0.33 0.00 -0.16 0.00 0.00 57.16 55.57 1rfl n GLU 85 Cb 0.39 -1.32 -0.12 0.00 1.43 0.00 0.00 31.44 31.82 1rfl n GLU 85 CO 0.00 0.00 0.00 1.14 -0.16 0.00 0.00 177.13 178.11 1rfl s GLN 86 N -4.63 2.57 0.15 3.44 -2.07 -1.26 -4.76 119.66 113.10 1rfl s GLN 86 Ca 0.50 -0.67 -0.33 0.00 -1.82 0.00 0.00 55.36 53.04 1rfl s GLN 86 Cb -0.07 -2.48 -0.17 0.00 -1.09 0.00 0.00 33.01 29.20 1rfl s GLN 86 CO 0.41 0.63 0.94 0.00 -1.32 0.00 0.00 175.29 175.94 1rfl n ALA 87 N 2.00 -2.00 -0.65 2.60 0.00 -1.26 -4.85 120.51 116.35 1rfl n ALA 87 Ca -0.17 0.48 0.07 0.00 0.00 0.00 0.00 53.44 53.83 1rfl n ALA 87 Cb 0.53 -1.84 0.21 0.00 0.00 0.00 0.00 19.45 18.34 1rfl n ALA 87 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1rfl n ASP 88 N 1.83 3.47 -3.62 0.00 9.92 -1.26 -4.89 116.55 122.00 1rfl n ASP 88 Ca 0.17 -2.59 -0.15 0.00 -0.53 0.00 0.00 54.79 51.68 1rfl n ASP 88 Cb 0.22 -0.41 -0.07 0.00 -0.64 0.00 0.00 41.12 40.21 1rfl n ASP 88 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1rfl s ARG 89 N -2.06 0.84 -0.03 -1.24 3.52 -1.26 -4.24 118.95 114.48 1rfl s ARG 89 Ca 0.34 0.69 0.02 0.00 -0.13 0.00 0.00 55.73 56.65 1rfl s ARG 89 Cb 0.25 0.41 0.01 0.00 -1.56 0.00 0.00 34.95 34.05 1rfl s ARG 89 CO 0.12 -0.16 -0.09 0.08 -0.81 0.00 0.00 175.30 174.44 1rfl s VAL 90 N -0.14 0.80 -0.74 7.11 1.01 -0.97 -3.05 120.40 124.43 1rfl s VAL 90 Ca -0.04 -0.36 0.04 0.00 0.00 0.00 0.00 61.98 61.62 1rfl s VAL 90 Cb -0.03 -0.72 0.18 0.00 0.00 0.00 0.00 36.38 35.80 1rfl s VAL 90 CO 0.03 0.25 0.54 -0.22 0.00 0.00 0.00 175.10 175.71 1rfl s LEU 91 N 0.28 4.95 1.24 3.92 2.96 -1.14 -2.39 118.68 128.50 1rfl s LEU 91 Ca -0.05 -3.82 -0.15 0.00 -0.22 0.00 0.00 54.13 49.90 1rfl s LEU 91 Cb -0.10 -1.69 0.32 0.00 0.50 0.00 0.00 46.19 45.22 1rfl s LEU 91 CO 0.01 -0.10 1.00 0.12 -1.32 0.00 0.00 176.35 176.05 1rfl s PHE 92 N -1.41 0.92 -0.21 5.38 5.36 0.16 -3.95 117.98 124.23 1rfl s PHE 92 Ca 0.25 1.05 -0.13 0.00 -0.96 0.00 0.00 56.93 57.14 1rfl s PHE 92 Cb -0.05 -3.03 0.06 0.00 -0.34 0.00 0.00 43.02 39.66 1rfl s PHE 92 CO -0.15 -4.23 0.53 1.41 -1.46 0.00 0.00 175.22 171.31 1rfl s MET 93 N -4.52 0.54 -0.12 10.12 -2.45 -1.17 -4.23 119.30 117.46 1rfl s MET 93 Ca 0.69 0.93 -0.03 0.00 -1.25 0.00 0.00 55.69 56.03 1rfl s MET 93 Cb -0.23 0.09 0.04 0.00 1.25 0.00 0.00 34.83 35.98 1rfl s MET 93 CO 0.64 -0.14 0.04 0.14 1.05 0.00 0.00 175.02 176.75 1rfl s VAL 94 N 1.29 0.22 0.13 10.11 -7.23 -1.26 -4.48 120.40 119.18 1rfl s VAL 94 Ca -0.08 -0.08 -0.33 0.00 -1.81 0.00 0.00 61.98 59.68 1rfl s VAL 94 Cb -0.06 -0.61 -0.18 0.00 0.56 0.00 0.00 36.38 36.09 1rfl s VAL 94 CO -0.13 -0.01 0.87 -0.67 -0.31 0.00 0.00 175.10 174.85 1rfl n ASP 95 N 5.18 -0.16 0.09 4.85 -0.08 -1.26 -4.70 116.55 120.47 1rfl n ASP 95 Ca -0.07 1.14 0.19 0.00 -1.51 0.00 0.00 54.79 54.55 1rfl n ASP 95 Cb 0.49 -1.01 0.59 0.00 2.34 0.00 0.00 41.12 43.53 1rfl n ASP 95 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 1rfl h GLY 96 N 2.26 0.00 0.00 0.27 0.00 -1.90 -3.37 103.07 100.33 1rfl h GLY 96 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.93 1rfl h GLY 96 CO 0.63 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.87 1rfl n THR 97 N -3.27 0.00 -0.43 4.70 -2.24 -1.26 -4.65 114.28 107.12 1rfl n THR 97 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1rfl n THR 97 Cb 0.86 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 1rfl n THR 97 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1rfl n THR 98 N 0.00 0.00 0.00 4.28 -2.24 -1.26 -5.02 114.28 110.04 1rfl n THR 98 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1rfl n THR 98 Cb 0.00 -0.75 0.00 0.00 -2.10 0.00 0.00 70.33 67.48 1rfl n THR 98 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1rfl n THR 99 N 0.00 0.00 -0.11 4.28 -2.24 -1.26 -4.46 114.28 110.49 1rfl n THR 99 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1rfl n THR 99 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1rfl n THR 99 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1rfl n ASP 100 N 0.00 0.00 0.10 3.42 2.03 -1.26 -4.91 116.55 115.94 1rfl n ASP 100 Ca 0.00 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.31 1rfl n ASP 100 Cb 0.00 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.38 1rfl n ASP 100 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1rfl h ALA 101 N 0.00 0.61 -0.08 -1.67 0.00 -2.02 -3.07 119.26 113.02 1rfl h ALA 101 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1rfl h ALA 101 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1rfl h ALA 101 CO 0.00 0.81 0.00 0.28 0.00 0.00 0.00 179.25 180.34 1rfl n VAL 102 N -3.20 0.08 0.04 0.00 0.31 -1.26 -3.97 118.33 110.33 1rfl n VAL 102 Ca -0.00 -0.34 -0.12 0.00 -0.01 0.00 0.00 64.34 63.87 1rfl n VAL 102 Cb 0.80 0.65 -0.09 0.00 -0.91 0.00 0.00 33.84 34.29 1rfl n VAL 102 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1rfl h ASP 103 N 2.79 -0.14 0.62 4.52 5.19 -1.89 -3.10 116.42 124.42 1rfl h ASP 103 Ca 0.00 -0.41 0.00 0.00 -0.62 0.00 0.00 57.03 56.00 1rfl h ASP 103 Cb 0.60 0.04 0.00 0.00 0.18 0.00 0.00 39.33 40.15 1rfl h ASP 103 CO 0.00 0.39 0.00 -0.81 -3.12 0.00 0.00 179.24 175.70 1rfl n PRO 104 N -4.91 0.13 0.13 3.56 -0.04 -1.26 -2.65 135.00 129.96 1rfl n PRO 104 Ca -0.08 0.10 -0.01 0.00 -0.04 0.00 0.00 63.50 63.47 1rfl n PRO 104 Cb 0.27 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.44 1rfl n PRO 104 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1rfl h ALA 105 N 2.88 1.05 -0.26 0.55 0.00 -1.66 -2.81 119.26 119.01 1rfl h ALA 105 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1rfl h ALA 105 Cb 0.31 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1rfl h ALA 105 CO 0.00 0.68 0.00 0.39 0.00 0.00 0.00 179.25 180.32 1rfl n GLU 106 N -3.91 2.87 -0.06 0.00 4.71 -1.09 -4.38 120.64 118.79 1rfl n GLU 106 Ca -0.02 -2.79 -0.04 0.00 -0.01 0.00 0.00 57.16 54.30 1rfl n GLU 106 Cb 0.55 -1.80 -0.12 0.00 -1.01 0.00 0.00 31.44 29.06 1rfl n GLU 106 CO 0.00 0.00 0.00 1.51 0.09 0.00 0.00 177.13 178.73 1rfl n ILE 107 N -0.48 0.81 0.20 -3.67 3.06 -1.07 -4.53 119.36 113.68 1rfl n ILE 107 Ca 0.21 -0.57 -0.14 0.00 -2.50 0.00 0.00 62.75 59.74 1rfl n ILE 107 Cb 0.86 -0.46 -0.08 0.00 0.54 0.00 0.00 39.64 40.50 1rfl n ILE 107 CO 0.00 0.00 0.00 -0.50 -2.50 0.00 0.00 176.55 173.55 1rfl h TRP 108 N 0.00 -0.48 0.00 9.51 4.06 -1.73 -3.27 115.95 124.04 1rfl h TRP 108 Ca -0.32 -0.01 -0.57 0.00 2.06 0.00 0.00 58.89 60.05 1rfl h TRP 108 Cb 1.68 0.16 0.02 0.00 -1.00 0.00 0.00 29.16 30.01 1rfl h TRP 108 CO 0.00 -0.16 2.99 -0.35 -3.56 0.00 0.00 178.44 177.36 1rfl n PRO 109 N -5.20 2.56 0.11 0.49 -0.04 -1.26 -3.76 135.00 127.89 1rfl n PRO 109 Ca -0.10 -1.94 0.00 0.00 -0.04 0.00 0.00 63.50 61.42 1rfl n PRO 109 Cb 0.28 -2.79 0.00 0.00 -0.04 0.00 0.00 33.50 30.95 1rfl n PRO 109 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1rfl n GLU 110 N 4.91 0.00 -0.71 0.54 4.07 -1.23 -4.85 120.64 123.36 1rfl n GLU 110 Ca 0.56 0.00 -0.11 0.00 -0.06 0.00 0.00 57.16 57.55 1rfl n GLU 110 Cb 0.26 -0.08 0.03 0.00 -0.06 0.00 0.00 31.44 31.59 1rfl n GLU 110 CO 0.00 0.00 0.00 1.97 -0.06 0.00 0.00 177.13 179.04 1rfl n PHE 111 N -3.33 1.09 -2.39 4.31 -1.74 -1.25 -3.97 117.46 110.17 1rfl n PHE 111 Ca 0.00 -1.56 -0.13 0.00 -0.56 0.00 0.00 57.45 55.21 1rfl n PHE 111 Cb 0.00 -0.76 0.03 0.00 1.52 0.00 0.00 39.48 40.27 1rfl n PHE 111 CO 0.00 0.00 0.00 0.44 -0.56 0.00 0.00 176.76 176.64 1rfl n ILE 112 N 0.54 1.94 -3.58 1.97 -5.35 -1.26 -5.04 119.36 108.58 1rfl n ILE 112 Ca 0.21 -3.61 -0.11 0.00 -0.27 0.00 0.00 62.75 58.98 1rfl n ILE 112 Cb 0.62 -0.01 -0.05 0.00 -1.74 0.00 0.00 39.64 38.46 1rfl n ILE 112 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1rfl s ALA 113 N -3.68 -1.93 -1.17 -1.28 0.00 -1.25 -5.07 121.76 107.39 1rfl s ALA 113 Ca 0.40 1.61 -0.23 0.00 0.00 0.00 0.00 51.96 53.73 1rfl s ALA 113 Cb 0.37 -0.76 -0.11 0.00 0.00 0.00 0.00 23.12 22.62 1rfl s ALA 113 CO 0.00 -0.30 1.96 0.54 0.00 0.00 0.00 175.76 177.96 1rfl n ARG 114 N 0.94 1.41 -3.64 0.00 1.74 -1.26 -4.74 116.66 111.09 1rfl n ARG 114 Ca -0.11 -2.36 -0.05 0.00 -0.77 0.00 0.00 57.85 54.56 1rfl n ARG 114 Cb 0.58 -3.74 -0.07 0.00 -1.02 0.00 0.00 32.46 28.20 1rfl n ARG 114 CO 0.00 0.00 0.00 -0.48 -1.52 0.00 0.00 177.63 175.63 1rfl s LEU 115 N 11.64 -0.23 0.48 0.55 0.05 -1.26 -4.86 118.68 125.05 1rfl s LEU 115 Ca 0.70 0.43 -0.20 0.00 0.05 0.00 0.00 54.13 55.11 1rfl s LEU 115 Cb -0.01 1.43 -0.09 0.00 -2.05 0.00 0.00 46.19 45.48 1rfl s LEU 115 CO 0.14 -0.07 1.04 -2.16 -0.55 0.00 0.00 176.35 174.75 1rfl s PRO 116 N 0.28 3.83 -0.12 1.48 0.04 -1.26 -4.91 135.00 134.34 1rfl s PRO 116 Ca 0.03 1.36 -0.01 0.00 0.04 0.00 0.00 61.00 62.43 1rfl s PRO 116 Cb -0.05 -2.12 0.03 0.00 0.04 0.00 0.00 34.50 32.40 1rfl s PRO 116 CO -0.12 -0.41 -0.07 0.00 0.04 0.00 0.00 177.00 176.45 1rfl s ALA 117 N -1.97 1.29 -0.02 8.56 0.00 -1.26 -2.28 121.76 126.08 1rfl s ALA 117 Ca 0.67 -0.54 0.01 0.00 0.00 0.00 0.00 51.96 52.09 1rfl s ALA 117 Cb -0.16 -0.92 -0.03 0.00 0.00 0.00 0.00 23.12 22.00 1rfl s ALA 117 CO 0.20 -0.47 -0.01 -1.59 0.00 0.00 0.00 175.76 173.90 1rfl s LYS 118 N 1.73 2.82 -0.03 0.00 -2.85 -1.01 -4.31 119.74 116.09 1rfl s LYS 118 Ca 0.04 -0.57 0.03 0.00 -1.00 0.00 0.00 55.97 54.48 1rfl s LYS 118 Cb -0.13 -2.68 0.00 0.00 -2.06 0.00 0.00 37.83 32.96 1rfl s LYS 118 CO -0.08 0.64 -0.10 -0.48 0.10 0.00 0.00 175.35 175.43 1rfl s LEU 119 N -1.35 1.80 0.65 2.77 0.05 -1.21 -0.67 118.68 120.73 1rfl s LEU 119 Ca 0.18 -0.21 -0.13 0.00 0.05 0.00 0.00 54.13 54.02 1rfl s LEU 119 Cb -0.11 -0.61 -0.01 0.00 -2.05 0.00 0.00 46.19 43.41 1rfl s LEU 119 CO 0.08 0.07 1.06 -2.16 -0.55 0.00 0.00 176.35 174.85 1rfl s PRO 120 N 0.19 3.10 0.36 1.48 0.04 -1.26 -4.33 135.00 134.58 1rfl s PRO 120 Ca -0.03 1.03 0.08 0.00 0.04 0.00 0.00 61.00 62.12 1rfl s PRO 120 Cb -0.09 -2.01 -0.07 0.00 0.04 0.00 0.00 34.50 32.37 1rfl s PRO 120 CO 0.01 -0.97 -0.05 0.42 0.04 0.00 0.00 177.00 176.44 1rfl s ILE 121 N -2.84 2.09 0.36 0.56 1.01 -1.24 -4.56 121.20 116.59 1rfl s ILE 121 Ca 0.60 -2.12 -0.27 0.00 0.00 0.00 0.00 60.65 58.85 1rfl s ILE 121 Cb -0.14 -2.76 -0.09 0.00 0.01 0.00 0.00 42.46 39.47 1rfl s ILE 121 CO 0.48 -0.13 1.21 -0.89 0.00 0.00 0.00 174.94 175.61 1rfl s THR 122 N -2.69 3.04 0.16 2.92 2.01 -1.26 -3.45 115.64 116.38 1rfl s THR 122 Ca 0.33 0.96 0.22 0.00 0.31 0.00 0.00 61.69 63.51 1rfl s THR 122 Cb 0.05 -3.57 0.22 0.00 0.01 0.00 0.00 72.50 69.21 1rfl s THR 122 CO 0.17 0.16 1.64 1.62 -0.69 0.00 0.00 174.62 177.51 1rfl h VAL 123 N 2.67 0.00 -2.43 3.82 3.04 -1.90 -3.46 116.25 117.99 1rfl h VAL 123 Ca -0.48 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.21 1rfl h VAL 123 Cb 1.23 0.49 0.00 0.00 -2.01 0.00 0.00 31.29 31.00 1rfl h VAL 123 CO 0.64 0.00 -0.58 0.52 -1.01 0.00 0.00 177.57 177.14 1rfl n VAL 124 N -2.39 -3.83 0.00 1.51 0.31 -1.26 -5.03 118.33 107.63 1rfl n VAL 124 Ca -0.01 1.58 0.00 0.00 -0.01 0.00 0.00 64.34 65.89 1rfl n VAL 124 Cb 0.23 -2.33 0.00 0.00 -0.91 0.00 0.00 33.84 30.83 1rfl n VAL 124 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1rfl n ARG 125 N -0.34 0.00 -4.15 5.55 0.63 -1.26 -5.02 116.66 112.07 1rfl n ARG 125 Ca 0.00 0.00 -0.16 0.00 -0.92 0.00 0.00 57.85 56.77 1rfl n ARG 125 Cb 0.00 0.00 -0.11 0.00 0.45 0.00 0.00 32.46 32.80 1rfl n ARG 125 CO 0.00 0.00 0.00 -0.80 -2.51 0.00 0.00 177.63 174.32 1rfl s ASN 126 N 0.00 1.42 -0.20 6.15 0.01 -1.26 -4.81 114.94 116.25 1rfl s ASN 126 Ca 0.00 -0.67 -0.01 0.00 -0.71 0.00 0.00 52.86 51.47 1rfl s ASN 126 Cb 0.00 -0.01 -0.01 0.00 0.41 0.00 0.00 41.25 41.64 1rfl s ASN 126 CO 0.00 -0.17 0.17 1.17 -1.51 0.00 0.00 177.10 176.76 1rfl n LYS 127 N 1.06 -0.72 -2.99 -0.60 0.00 -1.26 -3.36 118.16 110.29 1rfl n LYS 127 Ca -0.20 0.16 -0.13 0.00 0.00 0.00 0.00 58.31 58.14 1rfl n LYS 127 Cb 0.55 -2.61 -0.02 0.00 0.00 0.00 0.00 35.03 32.95 1rfl n LYS 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1rfl n ALA 128 N -1.71 -0.98 -1.02 3.14 0.00 -1.26 -3.79 120.51 114.88 1rfl n ALA 128 Ca -0.03 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1rfl n ALA 128 Cb 0.53 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.90 1rfl n ALA 128 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1rfl n ASP 129 N -1.65 -6.10 0.28 0.00 10.43 -1.21 -4.54 116.55 113.76 1rfl n ASP 129 Ca 0.04 0.74 0.14 0.00 2.57 0.00 0.00 54.79 58.27 1rfl n ASP 129 Cb 0.44 -2.32 0.72 0.00 1.84 0.00 0.00 41.12 41.80 1rfl n ASP 129 CO 0.00 0.00 0.00 -0.29 -1.07 0.00 0.00 177.20 175.84 1rfl h ILE 130 N 1.66 0.00 -1.30 0.53 6.09 -1.71 -2.42 117.51 120.35 1rfl h ILE 130 Ca 0.00 0.00 0.41 0.00 -1.37 0.00 0.00 64.86 63.90 1rfl h ILE 130 Cb 0.00 0.59 -0.09 0.00 0.47 0.00 0.00 36.82 37.79 1rfl h ILE 130 CO 0.00 0.00 0.89 0.41 -3.07 0.00 0.00 178.15 176.38 1rfl n THR 131 N -2.64 -0.11 0.28 2.19 -1.04 -1.26 0.12 114.28 111.81 1rfl n THR 131 Ca -0.02 1.32 -0.13 0.00 -2.04 0.00 0.00 64.05 63.18 1rfl n THR 131 Cb 0.31 -2.18 -0.07 0.00 -1.82 0.00 0.00 70.33 66.57 1rfl n THR 131 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1rfl h GLY 132 N 0.00 -0.77 0.74 3.41 0.00 -1.67 -2.27 103.07 102.51 1rfl h GLY 132 Ca 0.72 0.28 -0.04 0.00 0.00 0.00 0.00 47.33 48.30 1rfl h GLY 132 CO -0.21 -0.28 -0.35 0.83 0.00 0.00 0.00 176.54 176.52 1rfl h GLU 133 N -1.09 -0.95 -0.92 4.80 4.39 0.75 -2.75 114.58 118.80 1rfl h GLU 133 Ca -0.08 0.06 0.17 0.00 0.34 0.00 0.00 59.36 59.86 1rfl h GLU 133 Cb 0.62 0.22 -0.17 0.00 -0.10 0.00 0.00 28.75 29.32 1rfl h GLU 133 CO 0.12 -0.63 -0.26 -2.37 -1.16 0.00 0.00 179.01 174.70 1rfl n THR 134 N -4.69 -0.41 -0.19 1.13 5.66 0.01 0.17 114.28 115.95 1rfl n THR 134 Ca -0.12 2.12 -0.01 0.00 -3.05 0.00 0.00 64.05 62.98 1rfl n THR 134 Cb 0.39 -2.90 0.06 0.00 -1.55 0.00 0.00 70.33 66.33 1rfl n THR 134 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 1rfl h LEU 135 N 0.00 -0.48 -4.30 1.09 3.38 -1.26 -0.43 115.31 113.31 1rfl h LEU 135 Ca 0.41 0.17 -0.34 0.00 0.09 0.00 0.00 57.88 58.21 1rfl h LEU 135 Cb 0.64 0.34 -0.09 0.00 0.09 0.00 0.00 40.66 41.64 1rfl h LEU 135 CO -0.94 -0.17 0.34 0.61 0.09 0.00 0.00 178.44 178.37 1rfl n GLY 136 N -1.39 3.55 2.69 0.83 0.00 0.44 -3.92 105.19 107.39 1rfl n GLY 136 Ca 0.07 -1.44 -0.06 0.00 0.00 0.00 0.00 46.02 44.59 1rfl n GLY 136 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1rfl n MET 137 N 2.17 1.25 -2.76 1.61 1.56 -0.17 -4.97 117.12 115.81 1rfl n MET 137 Ca 0.49 -1.85 -0.39 0.00 -0.27 0.00 0.00 57.70 55.68 1rfl n MET 137 Cb 0.73 -0.08 0.01 0.00 2.15 0.00 0.00 33.22 36.03 1rfl n MET 137 CO 0.00 0.00 0.00 0.43 -0.73 0.00 0.00 175.97 175.67 1rfl n SER 138 N -0.77 6.68 -0.08 6.12 7.64 -1.25 -4.70 113.62 127.26 1rfl n SER 138 Ca -0.05 -3.64 -0.13 0.00 1.01 0.00 0.00 58.87 56.05 1rfl n SER 138 Cb 0.85 -1.08 -0.09 0.00 -1.01 0.00 0.00 64.21 62.89 1rfl n SER 138 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1rfl h GLU 139 N 4.20 0.00 -6.15 1.43 4.81 -1.95 -3.47 114.58 113.45 1rfl h GLU 139 Ca 0.42 0.00 -0.67 0.00 -0.13 0.00 0.00 59.36 58.97 1rfl h GLU 139 Cb 0.40 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 29.62 1rfl h GLU 139 CO 1.14 0.71 -0.66 0.54 -0.73 0.00 0.00 179.01 180.01 1rfl s VAL 140 N -2.17 3.97 -0.87 0.32 0.11 -1.26 -5.00 120.40 115.51 1rfl s VAL 140 Ca -0.19 -0.54 -0.30 0.00 -2.93 0.00 0.00 61.98 58.02 1rfl s VAL 140 Cb 0.01 -2.71 -0.19 0.00 -1.53 0.00 0.00 36.38 31.96 1rfl s VAL 140 CO 0.49 0.48 2.62 0.59 -3.33 0.00 0.00 175.10 175.94 1rfl n ASN 141 N 1.76 0.76 -0.36 3.54 3.02 -1.26 -4.75 115.26 117.97 1rfl n ASN 141 Ca -0.16 0.05 -0.06 0.00 -0.03 0.00 0.00 54.58 54.38 1rfl n ASN 141 Cb 0.53 -1.07 -0.03 0.00 -0.61 0.00 0.00 39.78 38.60 1rfl n ASN 141 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rfl n GLY 142 N 6.42 -2.12 5.00 7.41 0.00 -1.26 -4.22 105.19 116.41 1rfl n GLY 142 Ca 0.59 1.04 0.00 0.00 0.00 0.00 0.00 46.02 47.66 1rfl n GLY 142 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1rfl n HIS 143 N -5.22 0.00 -4.09 1.61 -0.00 -1.26 -3.74 115.22 102.52 1rfl n HIS 143 Ca 0.05 0.00 -0.17 0.00 0.46 0.00 0.00 57.72 58.06 1rfl n HIS 143 Cb 0.29 0.00 -0.16 0.00 -0.12 0.00 0.00 29.99 30.01 1rfl n HIS 143 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1rfl s ALA 144 N 0.00 0.46 -0.40 1.57 0.00 -1.26 -5.06 121.76 117.07 1rfl s ALA 144 Ca 0.00 -0.04 0.01 0.00 0.00 0.00 0.00 51.96 51.93 1rfl s ALA 144 Cb 0.00 -0.26 0.13 0.00 0.00 0.00 0.00 23.12 22.99 1rfl s ALA 144 CO 0.00 0.02 0.22 -0.51 0.00 0.00 0.00 175.76 175.49 1rfl s LEU 145 N 0.53 2.13 -0.05 0.00 1.43 -1.26 -3.29 118.68 118.18 1rfl s LEU 145 Ca -0.06 -2.41 -0.01 0.00 -1.03 0.00 0.00 54.13 50.63 1rfl s LEU 145 Cb -0.09 -0.83 0.03 0.00 0.03 0.00 0.00 46.19 45.33 1rfl s LEU 145 CO -0.00 -0.29 0.01 -0.63 0.23 0.00 0.00 176.35 175.66 1rfl s ILE 146 N 0.68 0.19 1.19 -0.59 1.09 -1.26 -4.94 121.20 117.56 1rfl s ILE 146 Ca 0.17 0.16 -0.18 0.00 -1.10 0.00 0.00 60.65 59.70 1rfl s ILE 146 Cb -0.24 -0.34 0.24 0.00 -1.06 0.00 0.00 42.46 41.07 1rfl s ILE 146 CO -0.02 0.19 0.51 -2.11 -0.10 0.00 0.00 174.94 173.42 1rfl n ARG 147 N 4.69 -3.06 -3.84 2.79 0.00 -1.26 -3.60 116.66 112.38 1rfl n ARG 147 Ca -0.15 -0.90 -0.10 0.00 -0.00 0.00 0.00 57.85 56.70 1rfl n ARG 147 Cb 0.50 -1.70 -0.06 0.00 -0.00 0.00 0.00 32.46 31.21 1rfl n ARG 147 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1rfl s LEU 148 N -3.19 0.71 0.00 2.89 1.43 -1.22 -4.54 118.68 114.76 1rfl s LEU 148 Ca 0.51 -0.67 0.00 0.00 -1.03 0.00 0.00 54.13 52.95 1rfl s LEU 148 Cb -0.10 1.51 0.00 0.00 0.03 0.00 0.00 46.19 47.63 1rfl s LEU 148 CO 0.47 -0.91 0.00 -1.54 0.23 0.00 0.00 176.35 174.60 1rfl n SER 149 N -0.23 0.34 0.00 2.29 3.41 -1.26 -4.63 113.62 113.53 1rfl n SER 149 Ca -0.10 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 1rfl n SER 149 Cb 0.63 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.58 1rfl n SER 149 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rfl n ALA 150 N -2.20 0.00 -0.28 7.33 0.00 -1.26 -4.65 120.51 119.44 1rfl n ALA 150 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1rfl n ALA 150 Cb 0.10 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.56 1rfl n ALA 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rfl h ARG 151 N 0.00 -0.10 0.00 0.00 2.47 -1.96 -2.68 114.38 112.11 1rfl h ARG 151 Ca 0.00 0.01 -0.05 0.00 -1.26 0.00 0.00 59.98 58.68 1rfl h ARG 151 Cb 0.00 0.02 -0.10 0.00 -1.65 0.00 0.00 29.97 28.24 1rfl h ARG 151 CO 0.00 -0.07 -0.54 0.25 0.56 0.00 0.00 179.97 180.17 1rfl n THR 152 N -5.44 1.30 -3.32 2.04 -2.24 -1.26 -5.04 114.28 100.32 1rfl n THR 152 Ca 0.06 -2.07 -0.20 0.00 -2.27 0.00 0.00 64.05 59.57 1rfl n THR 152 Cb 0.37 0.17 0.02 0.00 -2.10 0.00 0.00 70.33 68.79 1rfl n THR 152 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rfl n GLY 153 N -0.63 0.10 0.29 3.38 0.00 -1.01 -4.80 105.19 102.51 1rfl n GLY 153 Ca 0.13 0.57 -0.05 0.00 0.00 0.00 0.00 46.02 46.67 1rfl n GLY 153 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1rfl h GLU 154 N 2.82 -0.15 -0.50 1.61 4.57 -1.89 -3.32 114.58 117.71 1rfl h GLU 154 Ca -0.28 0.01 -0.28 0.00 -1.18 0.00 0.00 59.36 57.63 1rfl h GLU 154 Cb 1.19 0.03 -0.29 0.00 -0.16 0.00 0.00 28.75 29.52 1rfl h GLU 154 CO 0.11 -0.10 -0.82 0.41 -1.18 0.00 0.00 179.01 177.43 1rfl n GLY 155 N -1.41 1.53 0.26 1.92 0.00 -1.26 -4.94 105.19 101.29 1rfl n GLY 155 Ca 0.03 -0.77 0.01 0.00 0.00 0.00 0.00 46.02 45.29 1rfl n GLY 155 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1rfl h VAL 156 N 3.06 0.85 -0.56 1.61 -1.51 -1.92 -1.69 116.25 116.10 1rfl h VAL 156 Ca -0.20 -0.20 0.09 0.00 -1.23 0.00 0.00 66.70 65.17 1rfl h VAL 156 Cb 1.24 0.21 -0.11 0.00 -2.13 0.00 0.00 31.29 30.51 1rfl h VAL 156 CO 0.21 0.11 -0.37 -2.24 -1.23 0.00 0.00 177.57 174.04 1rfl h ASP 157 N 0.58 -1.29 -0.99 4.19 3.04 -1.92 0.76 116.42 120.80 1rfl h ASP 157 Ca 0.34 0.23 0.37 0.00 -3.24 0.00 0.00 57.03 54.73 1rfl h ASP 157 Cb 0.36 0.61 -0.17 0.00 -1.04 0.00 0.00 39.33 39.09 1rfl h ASP 157 CO -0.27 -0.32 0.48 0.58 -2.04 0.00 0.00 179.24 177.67 1rfl h VAL 158 N -0.21 0.11 0.02 4.15 2.07 -1.72 1.05 116.25 121.72 1rfl h VAL 158 Ca 0.20 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.68 1rfl h VAL 158 Cb 0.56 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1rfl h VAL 158 CO -0.66 0.02 -0.01 -0.07 0.02 0.00 0.00 177.57 176.87 1rfl h LEU 159 N 0.11 -0.02 -0.71 2.57 3.38 0.49 -2.67 115.31 118.46 1rfl h LEU 159 Ca 0.78 -0.40 0.13 0.00 0.09 0.00 0.00 57.88 58.47 1rfl h LEU 159 Cb 1.92 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 42.58 1rfl h LEU 159 CO -0.73 0.40 0.25 0.03 0.09 0.00 0.00 178.44 178.48 1rfl h ARG 160 N -0.44 0.37 0.16 1.13 3.08 0.26 0.18 114.38 119.13 1rfl h ARG 160 Ca -0.00 -0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.04 1rfl h ARG 160 Cb 0.42 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.35 1rfl h ARG 160 CO 0.00 0.25 -0.35 -0.97 -1.07 0.00 0.00 179.97 177.83 1rfl h ASN 161 N 0.39 -1.01 -0.10 7.04 -1.24 -0.27 0.15 115.58 120.53 1rfl h ASN 161 Ca 0.39 0.11 0.03 0.00 0.71 0.00 0.00 56.30 57.54 1rfl h ASN 161 Cb 0.58 0.38 -0.00 0.00 0.73 0.00 0.00 38.32 40.01 1rfl h ASN 161 CO -0.41 -0.45 0.12 0.45 -1.29 0.00 0.00 177.43 175.85 1rfl h HIS 162 N -0.61 0.00 -0.99 0.67 3.86 -0.89 -0.57 115.15 116.62 1rfl h HIS 162 Ca 0.02 0.00 -0.54 0.00 -1.16 0.00 0.00 60.37 58.69 1rfl h HIS 162 Cb 0.62 0.00 -0.21 0.00 1.06 0.00 0.00 27.41 28.88 1rfl h HIS 162 CO -0.29 0.00 0.66 -0.11 0.86 0.00 0.00 177.93 179.05 1rfl n LEU 163 N -3.82 7.04 0.00 2.43 0.00 0.51 -4.04 117.00 119.11 1rfl n LEU 163 Ca -0.00 -4.00 0.00 0.00 0.00 0.00 0.00 56.01 52.00 1rfl n LEU 163 Cb 0.22 -1.07 0.00 0.00 0.00 0.00 0.00 43.42 42.57 1rfl n LEU 163 CO 0.27 1.48 0.00 1.17 0.00 0.00 0.00 177.39 180.32 1rfl n LYS 164 N -0.09 0.00 -0.18 1.96 4.81 -0.24 -4.87 118.16 119.54 1rfl n LYS 164 Ca 0.48 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.90 1rfl n LYS 164 Cb 0.55 -0.03 0.08 0.00 0.02 0.00 0.00 35.03 35.64 1rfl n LYS 164 CO 0.00 0.00 0.00 0.37 1.17 0.00 0.00 177.40 178.94 1rfl h GLN 165 N 0.00 0.38 0.00 1.64 5.75 -1.64 -3.28 115.11 117.96 1rfl h GLN 165 Ca 0.00 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.48 1rfl h GLN 165 Cb 0.00 -0.09 0.00 0.00 1.07 0.00 0.00 27.48 28.46 1rfl h GLN 165 CO 0.00 0.25 0.00 -1.13 -2.65 0.00 0.00 178.83 175.30 1rfl n SER 166 N -4.98 0.00 -0.54 -0.69 3.41 -1.26 -4.95 113.62 104.61 1rfl n SER 166 Ca 0.06 0.26 0.04 0.00 -0.26 0.00 0.00 58.87 58.97 1rfl n SER 166 Cb 0.22 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.16 1rfl n SER 166 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1rfl n MET 167 N -0.27 -0.63 -3.15 4.33 2.81 -1.24 -4.89 117.12 114.09 1rfl n MET 167 Ca 0.00 0.42 0.04 0.00 -1.81 0.00 0.00 57.70 56.35 1rfl n MET 167 Cb 0.00 -0.77 -0.01 0.00 -0.71 0.00 0.00 33.22 31.73 1rfl n MET 167 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1rfl s GLY 168 N -3.16 -1.05 -0.18 3.03 0.00 -1.26 -4.93 107.32 99.76 1rfl s GLY 168 Ca 0.00 1.70 -0.37 0.00 0.00 0.00 0.00 44.72 46.05 1rfl s GLY 168 CO 0.00 3.44 1.79 4.51 0.00 0.00 0.00 173.10 182.84 1rfl n ILE 169 N 5.43 0.41 0.00 0.90 0.00 -1.26 -3.24 119.36 121.60 1rfl n ILE 169 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 62.75 62.68 1rfl n ILE 169 Cb 0.52 -1.49 0.00 0.00 0.00 0.00 0.00 39.64 38.67 1rfl n ILE 169 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 176.55 178.12 1rfl n HIS 170 N 5.79 0.00 -0.10 9.51 -0.00 -0.85 -4.96 115.22 124.61 1rfl n HIS 170 Ca 0.24 0.00 -0.15 0.00 0.46 0.00 0.00 57.72 58.27 1rfl n HIS 170 Cb 0.20 0.00 -0.06 0.00 -0.12 0.00 0.00 29.99 30.01 1rfl n HIS 170 CO 0.00 0.00 0.00 -2.13 0.46 0.00 0.00 176.34 174.67 1rfl n ARG 171 N -0.18 0.52 -0.05 1.57 0.63 -1.26 -4.00 116.66 113.90 1rfl n ARG 171 Ca 0.00 0.44 0.00 0.00 -0.92 0.00 0.00 57.85 57.37 1rfl n ARG 171 Cb 0.00 -1.62 0.00 0.00 0.45 0.00 0.00 32.46 31.29 1rfl n ARG 171 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87