#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rfl n SER 2 N 0.00 -0.32 -3.89 1.61 3.41 -1.26 -4.97 113.62 108.21 1rfl n SER 2 Ca 0.00 -2.76 -0.35 0.00 -0.26 0.00 0.00 58.87 55.50 1rfl n SER 2 Cb 0.00 -0.28 0.01 0.00 -0.26 0.00 0.00 64.21 63.69 1rfl n SER 2 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1rfl n LEU 3 N 1.54 -1.40 -3.04 1.04 4.32 -1.26 -4.93 117.00 113.26 1rfl n LEU 3 Ca 0.20 -1.10 -0.01 0.00 -0.02 0.00 0.00 56.01 55.09 1rfl n LEU 3 Cb 0.54 -1.77 -0.00 0.00 -1.62 0.00 0.00 43.42 40.57 1rfl n LEU 3 CO 0.15 0.54 0.12 -0.22 -1.22 0.00 0.00 177.39 176.76 1rfl s LEU 4 N -6.26 -1.45 0.50 2.23 1.98 -1.26 -5.16 118.68 109.25 1rfl s LEU 4 Ca 0.28 -1.06 0.02 0.00 -2.89 0.00 0.00 54.13 50.48 1rfl s LEU 4 Cb -0.15 1.87 -0.01 0.00 0.66 0.00 0.00 46.19 48.56 1rfl s LEU 4 CO 0.92 -0.12 0.02 -0.13 -1.89 0.00 0.00 176.35 175.15 1rfl s ARG 5 N 1.53 2.16 0.08 1.98 0.52 -1.26 -5.00 118.95 118.96 1rfl s ARG 5 Ca 0.21 -2.38 -0.26 0.00 -0.52 0.00 0.00 55.73 52.78 1rfl s ARG 5 Cb -0.02 -1.43 0.09 0.00 0.52 0.00 0.00 34.95 34.11 1rfl s ARG 5 CO -0.07 -0.37 1.16 -1.83 0.02 0.00 0.00 175.30 174.21 1rfl s GLU 6 N -3.86 0.85 0.00 3.54 -1.05 -1.09 -4.37 118.70 112.72 1rfl s GLU 6 Ca 0.08 -0.54 0.00 0.00 -0.15 0.00 0.00 54.97 54.36 1rfl s GLU 6 Cb 0.02 0.24 0.00 0.00 -0.44 0.00 0.00 34.13 33.95 1rfl s GLU 6 CO 0.04 -0.40 0.00 0.41 0.95 0.00 0.00 175.26 176.27 1rfl n GLY 7 N -0.74 1.69 2.51 -3.83 0.00 -1.14 -4.87 105.19 98.80 1rfl n GLY 7 Ca -0.01 -1.63 -0.01 0.00 0.00 0.00 0.00 46.02 44.38 1rfl n GLY 7 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1rfl n MET 8 N -1.67 0.30 -3.58 1.61 2.81 -1.26 -3.16 117.12 112.18 1rfl n MET 8 Ca 0.00 -0.78 -0.37 0.00 -1.81 0.00 0.00 57.70 54.74 1rfl n MET 8 Cb 0.00 1.11 -0.09 0.00 -0.71 0.00 0.00 33.22 33.53 1rfl n MET 8 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1rfl s LYS 9 N -2.02 4.07 -0.04 0.03 -0.14 -1.26 -5.02 119.74 115.35 1rfl s LYS 9 Ca 0.16 -0.16 0.07 0.00 -1.36 0.00 0.00 55.97 54.68 1rfl s LYS 9 Cb -0.01 -3.57 -0.01 0.00 -1.68 0.00 0.00 37.83 32.56 1rfl s LYS 9 CO 0.02 -0.02 -0.24 0.14 -0.76 0.00 0.00 175.35 174.49 1rfl s VAL 10 N 1.29 1.93 0.02 3.17 -7.23 -1.26 -2.35 120.40 115.97 1rfl s VAL 10 Ca 0.10 -1.02 0.07 0.00 -1.81 0.00 0.00 61.98 59.33 1rfl s VAL 10 Cb -0.14 -1.61 -0.03 0.00 0.56 0.00 0.00 36.38 35.15 1rfl s VAL 10 CO 0.07 0.54 -0.20 0.54 -0.31 0.00 0.00 175.10 175.73 1rfl s VAL 11 N -0.35 2.59 -0.16 1.32 0.11 -1.25 -4.88 120.40 117.78 1rfl s VAL 11 Ca 0.03 -1.17 0.01 0.00 -2.93 0.00 0.00 61.98 57.92 1rfl s VAL 11 Cb -0.11 -2.04 0.02 0.00 -1.53 0.00 0.00 36.38 32.72 1rfl s VAL 11 CO 0.01 0.40 -0.16 -0.63 -3.33 0.00 0.00 175.10 171.40 1rfl s ILE 12 N -0.84 1.71 0.27 7.04 1.01 -1.26 -4.05 121.20 125.08 1rfl s ILE 12 Ca 0.13 -0.72 0.01 0.00 0.00 0.00 0.00 60.65 60.07 1rfl s ILE 12 Cb -0.10 -1.58 -0.00 0.00 0.01 0.00 0.00 42.46 40.78 1rfl s ILE 12 CO 0.03 0.48 0.32 0.00 0.00 0.00 0.00 174.94 175.78 1rfl n ALA 13 N 4.73 0.04 0.00 9.38 0.00 -1.25 -5.06 120.51 128.34 1rfl n ALA 13 Ca -0.18 -1.35 0.00 0.00 0.00 0.00 0.00 53.44 51.90 1rfl n ALA 13 Cb 0.50 1.09 0.00 0.00 0.00 0.00 0.00 19.45 21.04 1rfl n ALA 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rfl n GLY 14 N -0.47 -0.08 1.30 0.00 0.00 -1.26 -2.72 105.19 101.96 1rfl n GLY 14 Ca 0.03 -0.17 0.01 0.00 0.00 0.00 0.00 46.02 45.89 1rfl n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rfl n ARG 15 N 0.00 -3.39 -2.37 1.61 1.74 -1.26 -4.46 116.66 108.53 1rfl n ARG 15 Ca 0.00 2.64 -0.43 0.00 -0.77 0.00 0.00 57.85 59.29 1rfl n ARG 15 Cb 0.00 -3.33 -0.02 0.00 -1.02 0.00 0.00 32.46 28.09 1rfl n ARG 15 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1rfl s PRO 16 N -5.12 3.74 -0.03 5.56 0.04 -1.26 -4.12 135.00 133.81 1rfl s PRO 16 Ca 0.00 1.13 -0.01 0.00 0.04 0.00 0.00 61.00 62.16 1rfl s PRO 16 Cb 0.00 -3.96 0.00 0.00 0.04 0.00 0.00 34.50 30.58 1rfl s PRO 16 CO 0.00 -1.34 0.02 -1.71 0.04 0.00 0.00 177.00 174.01 1rfl n ASN 17 N 8.25 -2.43 -1.59 6.66 5.15 -1.26 -5.04 115.26 124.99 1rfl n ASN 17 Ca 0.16 0.07 -0.02 0.00 -0.60 0.00 0.00 54.58 54.19 1rfl n ASN 17 Cb 0.47 -1.32 0.03 0.00 -0.53 0.00 0.00 39.78 38.43 1rfl n ASN 17 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1rfl n ALA 18 N -0.19 1.04 -1.74 5.20 0.00 -1.26 -5.00 120.51 118.57 1rfl n ALA 18 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1rfl n ALA 18 Cb 0.02 -0.52 0.00 0.00 0.00 0.00 0.00 19.45 18.94 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 -0.51 0.65 0.24 0.00 0.00 -1.26 -4.39 105.19 99.91 1rfl n GLY 19 Ca -0.12 -0.39 -0.05 0.00 0.00 0.00 0.00 46.02 45.45 1rfl n GLY 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1rfl n LYS 20 N -1.19 0.30 0.30 1.61 5.02 -1.26 -4.29 118.16 118.65 1rfl n LYS 20 Ca 0.00 0.12 -0.16 0.00 -2.02 0.00 0.00 58.31 56.25 1rfl n LYS 20 Cb 0.49 -1.00 -0.08 0.00 -0.02 0.00 0.00 35.03 34.41 1rfl n LYS 20 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 1rfl h SER 21 N -0.57 -0.64 -1.30 4.39 0.02 -1.99 -1.53 113.55 111.93 1rfl h SER 21 Ca 0.00 -0.04 0.40 0.00 -0.84 0.00 0.00 61.79 61.31 1rfl h SER 21 Cb 0.57 0.16 -0.10 0.00 0.14 0.00 0.00 62.40 63.17 1rfl h SER 21 CO 0.00 -0.33 0.86 -1.28 -1.14 0.00 0.00 176.83 174.94 1rfl h SER 22 N -0.94 0.24 0.33 3.07 0.87 -1.99 0.12 113.55 115.26 1rfl h SER 22 Ca -0.08 0.09 -0.02 0.00 -1.23 0.00 0.00 61.79 60.56 1rfl h SER 22 Cb 0.64 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.67 1rfl h SER 22 CO 0.13 -0.08 -0.16 0.25 -0.53 0.00 0.00 176.83 176.44 1rfl h LEU 23 N 0.14 -0.38 -0.96 2.23 6.46 -1.65 -3.05 115.31 118.09 1rfl h LEU 23 Ca 0.74 0.01 0.23 0.00 -0.12 0.00 0.00 57.88 58.75 1rfl h LEU 23 Cb 2.40 0.10 -0.18 0.00 -0.73 0.00 0.00 40.66 42.24 1rfl h LEU 23 CO -0.30 -0.11 -0.07 0.17 -0.62 0.00 0.00 178.44 177.51 1rfl h LEU 24 N -0.77 -0.63 -0.21 2.25 8.10 0.09 0.18 115.31 124.31 1rfl h LEU 24 Ca -0.05 0.28 0.02 0.00 0.11 0.00 0.00 57.88 58.25 1rfl h LEU 24 Cb 0.34 0.52 -0.04 0.00 -0.44 0.00 0.00 40.66 41.04 1rfl h LEU 24 CO 0.08 -0.33 -0.25 -1.13 -4.11 0.00 0.00 178.44 172.69 1rfl h ASN 25 N 0.01 -0.86 -0.66 0.17 -0.00 -0.89 1.19 115.58 114.55 1rfl h ASN 25 Ca 0.54 0.11 0.19 0.00 -0.00 0.00 0.00 56.30 57.14 1rfl h ASN 25 Cb 1.00 0.36 -0.03 0.00 -0.00 0.00 0.00 38.32 39.65 1rfl h ASN 25 CO -0.93 -0.17 0.64 0.00 -0.00 0.00 0.00 177.43 176.96 1rfl h ALA 26 N -0.69 2.46 0.20 1.57 0.00 -0.60 -1.33 119.26 120.87 1rfl h ALA 26 Ca 0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1rfl h ALA 26 Cb 0.26 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1rfl h ALA 26 CO -0.29 -0.98 -0.10 1.25 0.00 0.00 0.00 179.25 179.14 1rfl h LEU 27 N 0.00 -0.23 -9.17 0.00 5.85 0.27 -3.42 115.31 108.61 1rfl h LEU 27 Ca 0.31 0.01 -0.61 0.00 0.84 0.00 0.00 57.88 58.43 1rfl h LEU 27 Cb 1.59 0.06 0.01 0.00 0.37 0.00 0.00 40.66 42.69 1rfl h LEU 27 CO -0.00 -0.12 1.20 0.00 -0.34 0.00 0.00 178.44 179.18 1rfl n ALA 28 N -2.21 1.08 -0.15 1.25 0.00 0.40 -4.78 120.51 116.11 1rfl n ALA 28 Ca -0.03 0.17 0.28 0.00 0.00 0.00 0.00 53.44 53.86 1rfl n ALA 28 Cb 0.11 -2.58 0.66 0.00 0.00 0.00 0.00 19.45 17.64 1rfl n ALA 28 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1rfl h GLY 29 N 10.44 0.00 -3.00 0.00 0.00 -1.82 -3.42 103.07 105.27 1rfl h GLY 29 Ca -0.46 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.30 1rfl h GLY 29 CO 0.96 0.00 -0.33 0.54 0.00 0.00 0.00 176.54 177.71 1rfl n ARG 30 N -3.68 0.53 -0.05 4.80 1.74 -1.26 -4.96 116.66 113.78 1rfl n ARG 30 Ca 0.19 0.21 -0.04 0.00 -0.77 0.00 0.00 57.85 57.44 1rfl n ARG 30 Cb 1.14 -1.77 -0.01 0.00 -1.02 0.00 0.00 32.46 30.79 1rfl n ARG 30 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1rfl n GLU 31 N -0.26 0.31 -1.51 5.56 4.71 -1.26 -4.82 120.64 123.37 1rfl n GLU 31 Ca 0.12 0.36 -0.36 0.00 -0.01 0.00 0.00 57.16 57.26 1rfl n GLU 31 Cb 0.48 -1.30 -0.14 0.00 -1.01 0.00 0.00 31.44 29.46 1rfl n GLU 31 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1rfl n ALA 32 N -3.31 0.50 -2.60 0.62 0.00 -1.26 -4.80 120.51 109.65 1rfl n ALA 32 Ca -0.06 -0.50 -0.43 0.00 0.00 0.00 0.00 53.44 52.46 1rfl n ALA 32 Cb 0.22 -2.46 -0.03 0.00 0.00 0.00 0.00 19.45 17.18 1rfl n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rfl s ALA 33 N 8.19 3.10 -0.07 0.00 0.00 -1.26 -5.01 121.76 126.72 1rfl s ALA 33 Ca 1.29 -0.93 0.02 0.00 0.00 0.00 0.00 51.96 52.34 1rfl s ALA 33 Cb -1.01 -3.86 -0.03 0.00 0.00 0.00 0.00 23.12 18.23 1rfl s ALA 33 CO 0.46 -2.44 -0.11 -1.50 0.00 0.00 0.00 175.76 172.17 1rfl s ILE 34 N 4.37 3.30 0.00 0.00 1.10 -1.26 -5.12 121.20 123.59 1rfl s ILE 34 Ca 0.38 -0.63 0.01 0.00 -0.51 0.00 0.00 60.65 59.91 1rfl s ILE 34 Cb -0.10 -2.33 -0.00 0.00 0.15 0.00 0.00 42.46 40.18 1rfl s ILE 34 CO 0.24 0.58 -0.04 0.54 -2.11 0.00 0.00 174.94 174.16 1rfl s VAL 35 N -0.60 0.28 0.22 4.00 0.11 -1.26 -5.02 120.40 118.13 1rfl s VAL 35 Ca 0.09 -0.22 0.01 0.00 -2.93 0.00 0.00 61.98 58.93 1rfl s VAL 35 Cb -0.11 -0.26 -0.00 0.00 -1.53 0.00 0.00 36.38 34.48 1rfl s VAL 35 CO 0.01 0.04 0.02 0.35 -3.33 0.00 0.00 175.10 172.19 1rfl n THR 36 N 2.88 0.00 -4.01 5.04 -2.24 -1.26 -5.14 114.28 109.55 1rfl n THR 36 Ca -0.13 -1.09 -0.36 0.00 -2.27 0.00 0.00 64.05 60.19 1rfl n THR 36 Cb 0.58 0.27 -0.07 0.00 -2.10 0.00 0.00 70.33 69.01 1rfl n THR 36 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1rfl s ASP 37 N -2.23 6.06 0.29 3.42 1.01 -1.26 -4.97 116.67 118.99 1rfl s ASP 37 Ca 0.03 0.36 0.12 0.00 0.71 0.00 0.00 52.55 53.77 1rfl s ASP 37 Cb 0.00 -1.91 0.94 0.00 1.01 0.00 0.00 42.92 42.96 1rfl s ASP 37 CO 0.02 0.38 1.30 2.30 0.21 0.00 0.00 175.17 179.38 1rfl n ILE 38 N 2.14 -0.35 -2.54 0.77 -0.00 -1.26 -4.61 119.36 113.52 1rfl n ILE 38 Ca -0.19 1.72 -0.02 0.00 -0.00 0.00 0.00 62.75 64.26 1rfl n ILE 38 Cb 0.54 -2.70 -0.00 0.00 -0.00 0.00 0.00 39.64 37.48 1rfl n ILE 38 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1rfl n ALA 39 N -2.69 -0.97 -0.14 -1.28 0.00 -1.26 -3.85 120.51 110.30 1rfl n ALA 39 Ca 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1rfl n ALA 39 Cb 0.91 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 19.77 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 -0.51 0.23 3.68 0.00 0.00 -1.26 -4.96 105.19 102.36 1rfl n GLY 40 Ca 0.01 -1.02 -0.50 0.00 0.00 0.00 0.00 46.02 44.50 1rfl n GLY 40 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rfl n THR 41 N 2.42 0.35 -1.72 2.61 -2.24 -1.25 -4.89 114.28 109.56 1rfl n THR 41 Ca 0.00 -0.06 -0.38 0.00 -2.27 0.00 0.00 64.05 61.34 1rfl n THR 41 Cb 0.00 -1.56 0.06 0.00 -2.10 0.00 0.00 70.33 66.73 1rfl n THR 41 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1rfl n THR 42 N 4.44 4.53 -0.25 4.28 -2.24 -1.26 -4.87 114.28 118.91 1rfl n THR 42 Ca 0.22 -0.50 -0.01 0.00 -2.27 0.00 0.00 64.05 61.49 1rfl n THR 42 Cb 0.25 -1.52 0.19 0.00 -2.10 0.00 0.00 70.33 67.15 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 0.79 1.08 0.00 -0.78 -0.00 -1.98 0.22 114.38 113.71 1rfl h ARG 43 Ca -0.51 -0.09 0.00 0.00 -0.50 0.00 0.00 59.98 58.88 1rfl h ARG 43 Cb 1.33 -0.23 0.00 0.00 0.00 0.00 0.00 29.97 31.07 1rfl h ARG 43 CO 0.54 0.75 0.00 -0.40 0.00 0.00 0.00 179.97 180.86 1rfl n ASP 44 N -4.38 0.00 -4.44 7.04 5.75 -1.26 -4.38 116.55 114.88 1rfl n ASP 44 Ca 0.09 -0.27 -0.41 0.00 -0.01 0.00 0.00 54.79 54.19 1rfl n ASP 44 Cb 0.06 -0.21 -0.06 0.00 -1.03 0.00 0.00 41.12 39.88 1rfl n ASP 44 CO 0.00 0.00 0.00 0.55 -0.11 0.00 0.00 177.20 177.64 1rfl n VAL 45 N -1.21 -0.37 -3.58 2.12 3.14 0.76 -3.73 118.33 115.47 1rfl n VAL 45 Ca 0.14 -0.01 -0.27 0.00 -2.96 0.00 0.00 64.34 61.23 1rfl n VAL 45 Cb 0.17 -0.90 -0.09 0.00 -1.06 0.00 0.00 33.84 31.95 1rfl n VAL 45 CO 0.00 0.00 0.00 -0.11 -6.46 0.00 0.00 176.83 170.26 1rfl n LEU 46 N -4.18 3.25 -0.91 6.55 7.94 -1.26 -4.76 117.00 123.64 1rfl n LEU 46 Ca 0.10 -5.31 0.08 0.00 -1.11 0.00 0.00 56.01 49.76 1rfl n LEU 46 Cb 0.47 -0.61 0.24 0.00 0.53 0.00 0.00 43.42 44.04 1rfl n LEU 46 CO 0.93 1.95 0.70 -2.11 -1.11 0.00 0.00 177.39 177.75 1rfl n ARG 47 N 1.30 3.06 -1.38 1.96 1.85 -1.26 -4.48 116.66 117.72 1rfl n ARG 47 Ca 0.26 -2.57 -0.21 0.00 -1.00 0.00 0.00 57.85 54.33 1rfl n ARG 47 Cb 0.40 -1.66 0.11 0.00 -1.05 0.00 0.00 32.46 30.26 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 0.07 2.67 -0.49 2.89 0.28 -1.26 -5.07 120.64 119.73 1rfl n GLU 48 Ca 0.18 -3.52 0.07 0.00 -0.16 0.00 0.00 57.16 53.73 1rfl n GLU 48 Cb 0.73 -2.13 -0.02 0.00 1.43 0.00 0.00 31.44 31.46 1rfl n GLU 48 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1rfl n HIS 49 N -0.94 -2.38 -3.93 -1.84 8.25 -1.26 -4.59 115.22 108.53 1rfl n HIS 49 Ca 0.47 0.61 -0.30 0.00 -0.26 0.00 0.00 57.72 58.24 1rfl n HIS 49 Cb 0.96 -1.06 -0.15 0.00 1.12 0.00 0.00 29.99 30.87 1rfl n HIS 49 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 1rfl s ILE 50 N -1.00 2.07 -0.07 1.59 -4.36 -1.26 -5.01 121.20 113.17 1rfl s ILE 50 Ca 0.00 -2.49 -0.30 0.00 -0.26 0.00 0.00 60.65 57.60 1rfl s ILE 50 Cb 0.00 -2.50 -0.05 0.00 1.25 0.00 0.00 42.46 41.16 1rfl s ILE 50 CO 0.00 -0.69 1.59 -2.28 0.24 0.00 0.00 174.94 173.79 1rfl s HIS 51 N 0.63 2.13 -0.28 1.37 5.65 -1.26 -4.95 115.29 118.58 1rfl s HIS 51 Ca 0.13 0.33 0.01 0.00 0.25 0.00 0.00 55.06 55.79 1rfl s HIS 51 Cb -0.21 -3.85 0.16 0.00 -1.18 0.00 0.00 32.58 27.50 1rfl s HIS 51 CO -0.07 -3.50 0.42 -1.50 -0.65 0.00 0.00 174.74 169.44 1rfl s ILE 52 N 3.89 -0.67 0.03 0.89 1.10 -1.26 -5.00 121.20 120.18 1rfl s ILE 52 Ca 0.70 -0.23 -0.04 0.00 -0.51 0.00 0.00 60.65 60.58 1rfl s ILE 52 Cb -0.32 -0.96 -0.28 0.00 0.15 0.00 0.00 42.46 41.05 1rfl s ILE 52 CO 0.27 -0.23 0.98 0.44 -2.11 0.00 0.00 174.94 174.30 1rfl h ASP 53 N 8.15 0.42 0.00 4.50 3.45 -2.00 -3.42 116.42 127.52 1rfl h ASP 53 Ca -0.10 -0.51 0.00 0.00 0.43 0.00 0.00 57.03 56.85 1rfl h ASP 53 Cb 1.13 -0.14 0.00 0.00 -0.56 0.00 0.00 39.33 39.77 1rfl h ASP 53 CO 0.26 1.41 0.00 0.61 -1.57 0.00 0.00 179.24 179.95 1rfl n GLY 54 N 1.61 -0.88 3.88 2.75 0.00 -1.26 -4.78 105.19 106.51 1rfl n GLY 54 Ca -0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 1rfl n GLY 54 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rfl s MET 55 N 0.00 3.27 -0.05 1.61 -1.94 -1.26 -5.04 119.30 115.90 1rfl s MET 55 Ca 0.00 -0.56 -0.25 0.00 -1.71 0.00 0.00 55.69 53.17 1rfl s MET 55 Cb 0.00 -2.92 -0.23 0.00 2.01 0.00 0.00 34.83 33.69 1rfl s MET 55 CO 0.00 0.57 1.06 -1.00 -0.01 0.00 0.00 175.02 175.64 1rfl h PRO 56 N 2.89 0.16 -5.92 2.03 0.13 -1.86 -3.39 132.00 126.04 1rfl h PRO 56 Ca -0.46 -0.16 -0.61 0.00 -0.87 0.00 0.00 66.00 63.90 1rfl h PRO 56 Cb 1.17 0.04 -0.08 0.00 0.13 0.00 0.00 31.00 32.26 1rfl h PRO 56 CO 0.71 0.87 1.82 -1.17 -0.23 0.00 0.00 178.00 180.00 1rfl s LEU 57 N -8.61 3.64 -0.24 1.56 0.20 -1.26 -4.84 118.68 109.13 1rfl s LEU 57 Ca -0.16 -1.97 -0.05 0.00 0.69 0.00 0.00 54.13 52.64 1rfl s LEU 57 Cb 0.01 -2.58 0.12 0.00 -0.43 0.00 0.00 46.19 43.32 1rfl s LEU 57 CO 0.73 -1.47 0.47 -2.28 -0.29 0.00 0.00 176.35 173.51 1rfl s HIS 58 N 5.15 -1.02 -0.21 5.38 2.46 -1.26 -5.14 115.29 120.65 1rfl s HIS 58 Ca 0.53 1.51 -0.10 0.00 0.47 0.00 0.00 55.06 57.46 1rfl s HIS 58 Cb 0.02 0.35 -0.05 0.00 -0.13 0.00 0.00 32.58 32.77 1rfl s HIS 58 CO 0.01 -0.64 0.15 0.96 -2.47 0.00 0.00 174.74 172.76 1rfl s ILE 59 N 2.68 5.39 0.25 0.89 -5.25 -1.26 -4.99 121.20 118.90 1rfl s ILE 59 Ca 0.05 0.20 0.09 0.00 -0.99 0.00 0.00 60.65 60.00 1rfl s ILE 59 Cb -0.13 -3.49 -0.05 0.00 2.95 0.00 0.00 42.46 41.74 1rfl s ILE 59 CO -0.16 0.40 -0.15 -0.63 -1.79 0.00 0.00 174.94 172.61 1rfl s ILE 60 N 0.62 2.00 -0.19 8.37 1.01 -1.26 -5.14 121.20 126.61 1rfl s ILE 60 Ca 0.08 -2.27 -0.06 0.00 0.00 0.00 0.00 60.65 58.40 1rfl s ILE 60 Cb -0.12 -2.21 0.09 0.00 0.01 0.00 0.00 42.46 40.23 1rfl s ILE 60 CO 0.01 -0.48 0.39 1.51 0.00 0.00 0.00 174.94 176.36 1rfl s ASP 61 N -3.41 -0.11 -0.43 3.58 3.84 -1.26 -4.90 116.67 113.98 1rfl s ASP 61 Ca 0.26 0.87 -0.10 0.00 -0.00 0.00 0.00 52.55 53.59 1rfl s ASP 61 Cb -0.01 1.21 0.08 0.00 -1.38 0.00 0.00 42.92 42.82 1rfl s ASP 61 CO 0.11 -0.24 0.28 -0.89 -0.00 0.00 0.00 175.17 174.43 1rfl s THR 62 N 2.57 4.30 0.00 2.11 2.01 -1.26 -4.99 115.64 120.38 1rfl s THR 62 Ca -0.00 -1.42 0.00 0.00 0.31 0.00 0.00 61.69 60.58 1rfl s THR 62 Cb -0.12 -3.65 0.00 0.00 0.01 0.00 0.00 72.50 68.74 1rfl s THR 62 CO -0.12 -0.54 0.00 0.00 -0.69 0.00 0.00 174.62 173.27 1rfl n ALA 63 N 4.94 0.00 0.00 7.40 0.00 -1.24 -3.98 120.51 127.62 1rfl n ALA 63 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1rfl n ALA 63 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 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 3.63 1.17 3.40 0.00 0.00 -1.26 -4.81 105.19 107.31 1rfl n GLY 64 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1rfl n GLY 64 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rfl s LEU 65 N 0.00 0.28 0.03 0.99 1.43 -1.26 -5.01 118.68 115.14 1rfl s LEU 65 Ca 0.00 -0.42 -0.17 0.00 -1.03 0.00 0.00 54.13 52.51 1rfl s LEU 65 Cb 0.00 1.93 -0.09 0.00 0.03 0.00 0.00 46.19 48.06 1rfl s LEU 65 CO 0.00 -0.94 1.24 -0.09 0.23 0.00 0.00 176.35 176.79 1rfl h ARG 66 N 2.30 -0.59 0.00 1.70 2.43 -1.98 0.60 114.38 118.83 1rfl h ARG 66 Ca -0.32 0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1rfl h ARG 66 Cb 1.26 0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.94 1rfl h ARG 66 CO 0.43 -0.39 -0.02 1.05 -1.51 0.00 0.00 179.97 179.53 1rfl h GLU 67 N -0.62 0.00 0.38 0.20 -0.00 -1.98 -1.06 114.58 111.50 1rfl h GLU 67 Ca -0.06 0.00 -0.02 0.00 -0.00 0.00 0.00 59.36 59.28 1rfl h GLU 67 Cb 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.22 1rfl h GLU 67 CO 0.10 0.02 -0.18 0.00 -0.00 0.00 0.00 179.01 178.95 1rfl h ALA 68 N 1.98 -0.50 -0.88 1.06 0.00 -1.69 -0.48 119.26 118.75 1rfl h ALA 68 Ca -0.00 -0.17 0.14 0.00 0.00 0.00 0.00 54.91 54.88 1rfl h ALA 68 Cb 0.05 0.20 -0.07 0.00 0.00 0.00 0.00 17.79 17.96 1rfl h ALA 68 CO 0.00 -0.52 0.57 0.77 0.00 0.00 0.00 179.25 180.07 1rfl h SER 69 N -1.02 0.65 -0.38 0.00 0.02 0.63 0.70 113.55 114.15 1rfl h SER 69 Ca -0.05 0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 60.88 1rfl h SER 69 Cb 0.51 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 1rfl h SER 69 CO 0.08 0.34 0.00 -0.78 -1.14 0.00 0.00 176.83 175.33 1rfl h ASP 70 N 0.69 0.65 0.69 3.07 3.58 -1.18 -1.98 116.42 121.94 1rfl h ASP 70 Ca 0.44 -0.30 -0.07 0.00 0.42 0.00 0.00 57.03 57.51 1rfl h ASP 70 Cb 0.69 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.56 1rfl h ASP 70 CO -0.20 0.80 -0.35 -0.33 -2.88 0.00 0.00 179.24 176.28 1rfl h GLU 71 N 0.48 0.00 -0.25 0.28 3.07 0.81 -2.96 114.58 116.01 1rfl h GLU 71 Ca 0.11 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.93 1rfl h GLU 71 Cb 0.46 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.36 1rfl h GLU 71 CO 0.02 0.35 0.02 0.28 -1.40 0.00 0.00 179.01 178.28 1rfl h VAL 72 N 0.00 1.24 -0.07 3.13 2.07 0.73 -2.28 116.25 121.08 1rfl h VAL 72 Ca -0.00 -0.83 -0.33 0.00 0.82 0.00 0.00 66.70 66.35 1rfl h VAL 72 Cb 0.79 1.29 -0.05 0.00 -1.52 0.00 0.00 31.29 31.80 1rfl h VAL 72 CO 0.05 0.26 0.77 -0.62 0.02 0.00 0.00 177.57 178.05 1rfl n GLU 73 N -4.66 2.49 0.00 1.57 -0.58 -0.78 -3.21 120.64 115.47 1rfl n GLU 73 Ca -0.03 -1.41 0.00 0.00 -0.42 0.00 0.00 57.16 55.30 1rfl n GLU 73 Cb 0.22 -2.22 0.00 0.00 -0.57 0.00 0.00 31.44 28.87 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 2.69 0.00 -0.18 3.49 0.63 -1.17 -3.70 116.66 118.42 1rfl n ARG 74 Ca 0.53 0.00 -0.10 0.00 -0.92 0.00 0.00 57.85 57.35 1rfl n ARG 74 Cb 0.72 0.00 0.01 0.00 0.45 0.00 0.00 32.46 33.64 1rfl n ARG 74 CO 0.00 0.00 0.00 0.97 -2.51 0.00 0.00 177.63 176.09 1rfl h ILE 75 N 0.00 1.27 -0.52 5.15 -0.00 -1.38 -2.83 117.51 119.20 1rfl h ILE 75 Ca 0.00 -1.30 -0.35 0.00 -0.00 0.00 0.00 64.86 63.21 1rfl h ILE 75 Cb 0.00 0.99 -0.15 0.00 -0.00 0.00 0.00 36.82 37.66 1rfl h ILE 75 CO 0.00 0.46 0.45 0.61 -0.00 0.00 0.00 178.15 179.67 1rfl n GLY 76 N -0.23 4.21 3.35 8.18 0.00 -1.21 -4.89 105.19 114.60 1rfl n GLY 76 Ca 0.01 -1.17 -0.20 0.00 0.00 0.00 0.00 46.02 44.66 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 0.21 -3.08 -3.64 -0.61 5.41 -1.07 -4.99 119.36 111.60 1rfl n ILE 77 Ca 0.33 0.30 -0.10 0.00 1.00 0.00 0.00 62.75 64.28 1rfl n ILE 77 Cb 0.61 -3.32 -0.07 0.00 -0.71 0.00 0.00 39.64 36.15 1rfl n ILE 77 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 1rfl s GLU 78 N -1.74 0.72 0.61 0.38 2.12 -1.26 -4.94 118.70 114.59 1rfl s GLU 78 Ca 0.20 1.02 -0.18 0.00 0.36 0.00 0.00 54.97 56.37 1rfl s GLU 78 Cb -0.02 0.26 -0.06 0.00 0.26 0.00 0.00 34.13 34.56 1rfl s GLU 78 CO 0.45 -0.11 0.69 0.54 -0.54 0.00 0.00 175.26 176.28 1rfl n ARG 79 N 3.37 0.60 -1.15 4.30 1.74 -1.26 -3.27 116.66 120.99 1rfl n ARG 79 Ca -0.17 0.24 -0.35 0.00 -0.77 0.00 0.00 57.85 56.81 1rfl n ARG 79 Cb 0.57 -1.89 -0.03 0.00 -1.02 0.00 0.00 32.46 30.09 1rfl n ARG 79 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1rfl n ALA 80 N -1.84 5.17 -2.58 7.54 0.00 -1.24 -4.73 120.51 122.83 1rfl n ALA 80 Ca 0.12 -3.01 0.00 0.00 0.00 0.00 0.00 53.44 50.55 1rfl n ALA 80 Cb 0.48 -3.34 0.00 0.00 0.00 0.00 0.00 19.45 16.59 1rfl n ALA 80 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1rfl n TRP 81 N 5.22 -0.45 -5.05 0.00 -0.00 -1.26 -5.12 117.44 110.77 1rfl n TRP 81 Ca 0.55 0.00 -0.32 0.00 -0.00 0.00 0.00 57.50 57.73 1rfl n TRP 81 Cb 0.27 0.00 -0.16 0.00 -0.00 0.00 0.00 31.31 31.42 1rfl n TRP 81 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 177.69 176.55 1rfl s GLN 82 N 1.32 3.14 0.00 5.87 0.74 -1.26 -4.95 119.66 124.52 1rfl s GLN 82 Ca 0.00 -0.82 0.00 0.00 0.05 0.00 0.00 55.36 54.59 1rfl s GLN 82 Cb 0.00 -2.41 0.00 0.00 1.10 0.00 0.00 33.01 31.70 1rfl s GLN 82 CO 0.00 0.17 0.00 0.39 -0.55 0.00 0.00 175.29 175.30 1rfl n GLU 83 N 3.57 0.00 -3.60 1.67 -0.58 -1.26 -5.17 120.64 115.28 1rfl n GLU 83 Ca -0.19 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.56 1rfl n GLU 83 Cb 0.53 0.00 -0.06 0.00 -0.57 0.00 0.00 31.44 31.34 1rfl n GLU 83 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 1rfl s ILE 84 N 0.00 -0.05 0.00 -3.67 1.10 -1.26 -5.03 121.20 112.30 1rfl s ILE 84 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.14 1rfl s ILE 84 Cb 0.00 -1.00 0.00 0.00 0.15 0.00 0.00 42.46 41.61 1rfl s ILE 84 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 174.94 172.21 1rfl n GLU 85 N 3.61 0.19 -4.09 3.50 1.02 -1.26 -5.11 120.64 118.51 1rfl n GLU 85 Ca -0.16 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.74 1rfl n GLU 85 Cb 0.56 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.92 1rfl n GLU 85 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1rfl s GLN 86 N -2.80 2.32 0.92 3.49 0.74 -1.26 -4.83 119.66 118.23 1rfl s GLN 86 Ca 0.00 -1.65 -0.13 0.00 0.05 0.00 0.00 55.36 53.63 1rfl s GLN 86 Cb 0.00 -2.11 0.02 0.00 1.10 0.00 0.00 33.01 32.01 1rfl s GLN 86 CO 0.00 0.02 0.39 0.00 -0.55 0.00 0.00 175.29 175.15 1rfl n ALA 87 N -1.19 -2.52 0.06 1.58 0.00 -1.26 -4.42 120.51 112.77 1rfl n ALA 87 Ca -0.02 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.87 1rfl n ALA 87 Cb 0.62 -1.78 0.00 0.00 0.00 0.00 0.00 19.45 18.29 1rfl n ALA 87 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1rfl n ASP 88 N -0.99 0.12 -4.18 0.00 -0.08 -0.99 -4.94 116.55 105.49 1rfl n ASP 88 Ca 0.07 0.21 -0.40 0.00 -1.51 0.00 0.00 54.79 53.16 1rfl n ASP 88 Cb 0.53 0.10 -0.08 0.00 2.34 0.00 0.00 41.12 44.01 1rfl n ASP 88 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 1rfl s ARG 89 N -2.00 2.71 -1.11 -0.67 1.81 -1.26 -3.85 118.95 114.57 1rfl s ARG 89 Ca 0.00 -2.23 -0.09 0.00 -1.72 0.00 0.00 55.73 51.69 1rfl s ARG 89 Cb 0.00 -3.92 0.28 0.00 -0.45 0.00 0.00 34.95 30.85 1rfl s ARG 89 CO 0.00 -1.20 1.10 0.54 -0.68 0.00 0.00 175.30 175.07 1rfl s VAL 90 N 0.51 5.96 0.30 3.52 0.11 -1.20 -3.84 120.40 125.76 1rfl s VAL 90 Ca 0.13 -3.45 -0.28 0.00 -2.93 0.00 0.00 61.98 55.45 1rfl s VAL 90 Cb -0.20 -4.58 -0.09 0.00 -1.53 0.00 0.00 36.38 29.98 1rfl s VAL 90 CO -0.04 -1.18 1.01 -1.48 -3.33 0.00 0.00 175.10 170.08 1rfl s LEU 91 N -1.29 4.45 0.20 2.54 -0.00 -1.16 -4.38 118.68 119.05 1rfl s LEU 91 Ca 0.31 2.05 0.06 0.00 -0.00 0.00 0.00 54.13 56.54 1rfl s LEU 91 Cb -0.10 -3.81 -0.04 0.00 -0.00 0.00 0.00 46.19 42.24 1rfl s LEU 91 CO -0.08 -0.11 0.15 -0.36 -0.00 0.00 0.00 176.35 175.95 1rfl s PHE 92 N -1.36 3.12 -0.14 3.48 0.08 -1.14 -3.92 117.98 118.10 1rfl s PHE 92 Ca 0.47 -0.06 -0.00 0.00 0.12 0.00 0.00 56.93 57.46 1rfl s PHE 92 Cb -0.26 -1.46 0.03 0.00 -0.57 0.00 0.00 43.02 40.76 1rfl s PHE 92 CO 0.32 0.52 -0.07 -1.64 -0.10 0.00 0.00 175.22 174.26 1rfl s MET 93 N -3.38 1.50 0.19 0.44 -1.94 -1.10 -4.09 119.30 110.91 1rfl s MET 93 Ca 0.32 -0.38 0.11 0.00 -1.71 0.00 0.00 55.69 54.02 1rfl s MET 93 Cb -0.09 -1.80 -0.04 0.00 2.01 0.00 0.00 34.83 34.91 1rfl s MET 93 CO 0.24 -0.35 -0.24 0.14 -0.01 0.00 0.00 175.02 174.80 1rfl s VAL 94 N 1.67 2.33 -0.41 -6.03 -7.23 -1.26 -4.47 120.40 104.99 1rfl s VAL 94 Ca 0.03 -2.01 -0.14 0.00 -1.81 0.00 0.00 61.98 58.04 1rfl s VAL 94 Cb -0.14 -2.11 0.03 0.00 0.56 0.00 0.00 36.38 34.72 1rfl s VAL 94 CO -0.08 -0.11 0.30 -0.62 -0.31 0.00 0.00 175.10 174.27 1rfl s ASP 95 N -2.63 6.03 0.00 4.85 -1.08 -1.26 -4.97 116.67 117.61 1rfl s ASP 95 Ca 0.20 -1.00 0.00 0.00 -0.52 0.00 0.00 52.55 51.23 1rfl s ASP 95 Cb -0.08 -2.13 0.00 0.00 -1.46 0.00 0.00 42.92 39.25 1rfl s ASP 95 CO 0.09 -0.47 0.00 0.61 0.52 0.00 0.00 175.17 175.92 1rfl n GLY 96 N 5.13 0.83 2.37 2.66 0.00 -1.26 -1.53 105.19 113.39 1rfl n GLY 96 Ca -0.11 -0.58 -0.24 0.00 0.00 0.00 0.00 46.02 45.09 1rfl n GLY 96 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1rfl n THR 97 N 0.00 3.28 -3.86 2.61 5.66 -1.26 -4.83 114.28 115.89 1rfl n THR 97 Ca 0.00 -2.65 -0.35 0.00 -3.05 0.00 0.00 64.05 58.00 1rfl n THR 97 Cb 0.00 -1.71 -0.09 0.00 -1.55 0.00 0.00 70.33 66.99 1rfl n THR 97 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1rfl s THR 98 N -1.40 5.16 -0.32 1.09 2.01 -0.58 -5.07 115.64 116.53 1rfl s THR 98 Ca 0.61 0.10 0.04 0.00 0.31 0.00 0.00 61.69 62.74 1rfl s THR 98 Cb 0.36 -3.33 0.09 0.00 0.01 0.00 0.00 72.50 69.63 1rfl s THR 98 CO -0.17 0.46 0.01 -0.89 -0.69 0.00 0.00 174.62 173.34 1rfl s THR 99 N 0.25 2.24 0.51 -0.82 2.01 -1.26 -4.74 115.64 113.83 1rfl s THR 99 Ca 0.07 -2.14 0.09 0.00 0.31 0.00 0.00 61.69 60.01 1rfl s THR 99 Cb -0.12 -2.57 0.05 0.00 0.01 0.00 0.00 72.50 69.88 1rfl s THR 99 CO -0.01 -0.44 0.70 -1.81 -0.69 0.00 0.00 174.62 172.37 1rfl s ASP 100 N 0.96 5.34 0.24 3.53 -0.00 -1.26 -5.00 116.67 120.48 1rfl s ASP 100 Ca 0.05 -0.66 0.25 0.00 -0.00 0.00 0.00 52.55 52.20 1rfl s ASP 100 Cb -0.19 -0.12 0.57 0.00 -0.00 0.00 0.00 42.92 43.18 1rfl s ASP 100 CO -0.07 -1.09 1.61 0.00 -0.00 0.00 0.00 175.17 175.62 1rfl h ALA 101 N 0.37 0.89 -0.00 5.23 0.00 -2.02 -3.01 119.26 120.73 1rfl h ALA 101 Ca -0.34 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1rfl h ALA 101 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1rfl h ALA 101 CO 0.43 0.00 -0.61 0.28 0.00 0.00 0.00 179.25 179.35 1rfl n VAL 102 N -2.44 0.00 0.12 0.00 0.31 -1.26 -3.64 118.33 111.42 1rfl n VAL 102 Ca 0.04 -0.02 -0.14 0.00 -0.01 0.00 0.00 64.34 64.22 1rfl n VAL 102 Cb 0.46 0.50 -0.08 0.00 -0.91 0.00 0.00 33.84 33.81 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 0.20 -0.20 0.09 4.52 3.32 -1.92 -3.09 116.42 119.35 1rfl h ASP 103 Ca 0.00 -0.02 -0.24 0.00 0.02 0.00 0.00 57.03 56.80 1rfl h ASP 103 Cb 0.51 0.05 0.01 0.00 0.22 0.00 0.00 39.33 40.12 1rfl h ASP 103 CO 0.00 -0.11 -0.92 1.55 -1.72 0.00 0.00 179.24 178.04 1rfl h PRO 104 N -0.27 0.61 -3.79 3.56 0.13 -1.74 -3.23 132.00 127.27 1rfl h PRO 104 Ca -0.02 -0.59 -0.42 0.00 -0.87 0.00 0.00 66.00 64.09 1rfl h PRO 104 Cb 0.21 0.15 0.03 0.00 0.13 0.00 0.00 31.00 31.52 1rfl h PRO 104 CO 0.04 1.21 2.38 0.00 -0.23 0.00 0.00 178.00 181.40 1rfl n ALA 105 N -2.59 3.97 0.00 -0.56 0.00 -1.17 -1.08 120.51 119.09 1rfl n ALA 105 Ca -0.08 -2.19 0.00 0.00 0.00 0.00 0.00 53.44 51.16 1rfl n ALA 105 Cb 0.82 -3.14 0.00 0.00 0.00 0.00 0.00 19.45 17.13 1rfl n ALA 105 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1rfl n GLU 106 N 5.08 0.00 0.02 0.00 -0.58 -1.26 -4.88 120.64 119.03 1rfl n GLU 106 Ca 0.42 0.00 0.11 0.00 -0.42 0.00 0.00 57.16 57.27 1rfl n GLU 106 Cb 0.20 0.00 -0.06 0.00 -0.57 0.00 0.00 31.44 31.00 1rfl n GLU 106 CO 0.00 0.00 0.00 1.51 -0.48 0.00 0.00 177.13 178.16 1rfl n ILE 107 N 0.00 0.15 0.23 -3.67 0.00 -0.61 -4.27 119.36 111.19 1rfl n ILE 107 Ca 0.00 -0.34 -0.14 0.00 0.00 0.00 0.00 62.75 62.28 1rfl n ILE 107 Cb 0.00 0.17 -0.08 0.00 0.00 0.00 0.00 39.64 39.73 1rfl n ILE 107 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 1rfl h TRP 108 N 0.00 -0.56 0.00 9.51 4.06 -1.39 -3.20 115.95 124.37 1rfl h TRP 108 Ca 0.00 -0.01 -0.34 0.00 2.06 0.00 0.00 58.89 60.59 1rfl h TRP 108 Cb 0.83 0.18 -0.01 0.00 -1.00 0.00 0.00 29.16 29.16 1rfl h TRP 108 CO 0.00 -0.23 1.69 -0.35 -3.56 0.00 0.00 178.44 175.98 1rfl n PRO 109 N -5.23 2.22 0.03 0.49 -0.04 -1.26 -3.12 135.00 128.09 1rfl n PRO 109 Ca -0.10 -1.32 0.00 0.00 -0.04 0.00 0.00 63.50 62.03 1rfl n PRO 109 Cb 0.30 -2.28 0.00 0.00 -0.04 0.00 0.00 33.50 31.48 1rfl n PRO 109 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1rfl n GLU 110 N 3.35 0.00 -0.37 0.54 -0.58 -1.21 -4.90 120.64 117.48 1rfl n GLU 110 Ca 0.47 0.00 0.31 0.00 -0.42 0.00 0.00 57.16 57.53 1rfl n GLU 110 Cb 0.40 0.00 0.58 0.00 -0.57 0.00 0.00 31.44 31.85 1rfl n GLU 110 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 1rfl h PHE 111 N 0.00 0.74 -1.49 -0.32 3.57 -1.57 -2.85 116.94 115.02 1rfl h PHE 111 Ca 0.00 0.03 -0.71 0.00 3.53 0.00 0.00 57.97 60.82 1rfl h PHE 111 Cb 0.00 -0.18 -0.13 0.00 2.79 0.00 0.00 35.95 38.43 1rfl h PHE 111 CO 0.00 -0.27 1.81 1.51 -2.23 0.00 0.00 178.31 179.13 1rfl n ILE 112 N -4.96 4.10 -3.84 1.41 0.00 -1.26 -4.86 119.36 109.93 1rfl n ILE 112 Ca 0.35 -4.40 -0.10 0.00 0.00 0.00 0.00 62.75 58.61 1rfl n ILE 112 Cb 1.24 -2.41 0.02 0.00 0.00 0.00 0.00 39.64 38.49 1rfl n ILE 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1rfl n ALA 113 N 6.94 -1.54 -2.60 1.51 0.00 -1.08 -5.07 120.51 118.67 1rfl n ALA 113 Ca 0.43 -1.34 -0.30 0.00 0.00 0.00 0.00 53.44 52.23 1rfl n ALA 113 Cb 0.44 1.07 -0.01 0.00 0.00 0.00 0.00 19.45 20.95 1rfl n ALA 113 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1rfl n ARG 114 N -0.55 3.52 -3.50 0.00 0.63 -1.26 -5.00 116.66 110.51 1rfl n ARG 114 Ca -0.07 -4.54 -0.12 0.00 -0.92 0.00 0.00 57.85 52.20 1rfl n ARG 114 Cb 0.60 -2.27 -0.03 0.00 0.45 0.00 0.00 32.46 31.20 1rfl n ARG 114 CO 0.00 0.00 0.00 -0.48 -2.51 0.00 0.00 177.63 174.64 1rfl s LEU 115 N -3.68 -0.48 0.60 6.15 2.34 -1.26 -5.03 118.68 117.32 1rfl s LEU 115 Ca 0.48 0.22 -0.15 0.00 0.06 0.00 0.00 54.13 54.74 1rfl s LEU 115 Cb 0.34 2.26 -0.03 0.00 -0.56 0.00 0.00 46.19 48.19 1rfl s LEU 115 CO -0.19 -0.66 1.05 -2.16 -1.06 0.00 0.00 176.35 173.32 1rfl s PRO 116 N -2.53 3.31 0.00 1.48 0.04 -1.25 -4.99 135.00 131.06 1rfl s PRO 116 Ca -0.01 1.13 0.00 0.00 0.04 0.00 0.00 61.00 62.16 1rfl s PRO 116 Cb -0.01 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.50 1rfl s PRO 116 CO -0.04 -0.81 0.00 0.00 0.04 0.00 0.00 177.00 176.19 1rfl n ALA 117 N -2.20 0.17 -1.28 8.56 0.00 -1.26 -3.26 120.51 121.23 1rfl n ALA 117 Ca 0.08 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1rfl n ALA 117 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1rfl n ALA 117 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1rfl n LYS 118 N -2.49 0.00 -3.35 0.00 4.81 -1.26 -3.00 118.16 112.86 1rfl n LYS 118 Ca 0.00 0.43 -0.32 0.00 -0.87 0.00 0.00 58.31 57.55 1rfl n LYS 118 Cb 0.00 -0.91 -0.05 0.00 0.02 0.00 0.00 35.03 34.09 1rfl n LYS 118 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1rfl s LEU 119 N -0.10 4.13 0.00 3.14 1.43 -1.21 -2.90 118.68 123.17 1rfl s LEU 119 Ca 0.00 0.97 0.00 0.00 -1.03 0.00 0.00 54.13 54.07 1rfl s LEU 119 Cb 0.00 -3.74 0.00 0.00 0.03 0.00 0.00 46.19 42.48 1rfl s LEU 119 CO 0.00 -0.11 0.00 -0.81 0.23 0.00 0.00 176.35 175.66 1rfl n PRO 120 N -0.26 -0.29 -4.07 1.29 -0.04 -1.26 -3.35 135.00 127.02 1rfl n PRO 120 Ca 0.01 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.34 1rfl n PRO 120 Cb 0.53 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.87 1rfl n PRO 120 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1rfl s ILE 121 N -0.86 0.52 -0.06 0.52 1.01 -1.11 -4.54 121.20 116.69 1rfl s ILE 121 Ca 0.00 -1.16 -0.03 0.00 0.00 0.00 0.00 60.65 59.46 1rfl s ILE 121 Cb 0.00 -0.70 -0.04 0.00 0.01 0.00 0.00 42.46 41.73 1rfl s ILE 121 CO 0.00 -0.44 0.08 0.28 0.00 0.00 0.00 174.94 174.86 1rfl s THR 122 N -1.63 4.89 -0.28 2.92 -1.32 -1.26 -4.30 115.64 114.65 1rfl s THR 122 Ca -0.08 -0.18 0.21 0.00 -1.21 0.00 0.00 61.69 60.43 1rfl s THR 122 Cb -0.08 -3.17 0.49 0.00 -1.51 0.00 0.00 72.50 68.23 1rfl s THR 122 CO -0.00 0.49 1.12 0.55 -2.21 0.00 0.00 174.62 174.57 1rfl n VAL 123 N 1.63 1.08 -1.90 5.08 3.14 -1.26 -4.94 118.33 121.15 1rfl n VAL 123 Ca -0.16 -2.75 -0.30 0.00 -2.96 0.00 0.00 64.34 58.17 1rfl n VAL 123 Cb 0.54 1.14 0.15 0.00 -1.06 0.00 0.00 33.84 34.61 1rfl n VAL 123 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1rfl s VAL 124 N -3.24 1.99 1.14 1.55 0.11 -1.26 -5.04 120.40 115.66 1rfl s VAL 124 Ca 0.25 0.00 -0.17 0.00 -2.93 0.00 0.00 61.98 59.14 1rfl s VAL 124 Cb 0.36 -2.99 0.22 0.00 -1.53 0.00 0.00 36.38 32.45 1rfl s VAL 124 CO -0.03 0.00 0.46 -2.11 -3.33 0.00 0.00 175.10 170.09 1rfl n ARG 125 N -3.62 -2.89 -2.42 1.54 1.85 -1.26 -4.69 116.66 105.17 1rfl n ARG 125 Ca 0.13 -0.85 -0.01 0.00 -1.00 0.00 0.00 57.85 56.11 1rfl n ARG 125 Cb 0.60 -1.64 -0.01 0.00 -1.05 0.00 0.00 32.46 30.36 1rfl n ARG 125 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1rfl n ASN 126 N -2.60 -7.09 0.11 2.89 4.13 -1.26 -4.81 115.26 106.62 1rfl n ASN 126 Ca 0.07 1.74 -0.08 0.00 1.68 0.00 0.00 54.58 57.99 1rfl n ASN 126 Cb 0.45 -5.18 -0.05 0.00 -1.54 0.00 0.00 39.78 33.46 1rfl n ASN 126 CO 0.00 0.00 0.00 0.50 0.28 0.00 0.00 177.26 178.04 1rfl h LYS 127 N 4.28 -0.35 -5.08 3.52 3.64 -2.02 -3.34 116.57 117.23 1rfl h LYS 127 Ca -0.15 0.02 -0.41 0.00 -1.27 0.00 0.00 60.65 58.84 1rfl h LYS 127 Cb 0.33 0.08 0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1rfl h LYS 127 CO 0.00 -0.11 1.34 0.00 -2.27 0.00 0.00 179.45 178.41 1rfl n ALA 128 N -2.69 1.96 0.00 5.00 0.00 -1.26 -1.68 120.51 121.84 1rfl n ALA 128 Ca -0.06 -2.98 0.00 0.00 0.00 0.00 0.00 53.44 50.40 1rfl n ALA 128 Cb 0.20 -3.54 0.00 0.00 0.00 0.00 0.00 19.45 16.12 1rfl n ALA 128 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1rfl n ASP 129 N 12.50 0.00 0.17 0.00 2.03 -1.26 -5.00 116.55 124.98 1rfl n ASP 129 Ca 0.46 0.00 -0.07 0.00 0.52 0.00 0.00 54.79 55.70 1rfl n ASP 129 Cb 0.44 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.81 1rfl n ASP 129 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 1rfl h ILE 130 N 0.00 0.00 -1.00 5.18 1.08 -1.44 -3.12 117.51 118.21 1rfl h ILE 130 Ca 0.00 -0.19 0.36 0.00 -0.39 0.00 0.00 64.86 64.64 1rfl h ILE 130 Cb 0.00 0.00 -0.16 0.00 -3.07 0.00 0.00 36.82 33.59 1rfl h ILE 130 CO 0.00 0.00 0.53 0.71 -0.69 0.00 0.00 178.15 178.70 1rfl h THR 131 N -0.64 0.17 -0.32 -0.27 1.35 -1.92 0.29 112.91 111.57 1rfl h THR 131 Ca -0.05 -0.06 0.07 0.00 -0.55 0.00 0.00 66.41 65.82 1rfl h THR 131 Cb 0.34 -0.03 -0.08 0.00 -1.73 0.00 0.00 68.15 66.65 1rfl h THR 131 CO 0.07 0.03 -0.34 1.23 -0.25 0.00 0.00 175.52 176.27 1rfl h GLY 132 N 0.18 -0.35 -4.77 5.82 0.00 -1.86 -1.55 103.07 100.54 1rfl h GLY 132 Ca 0.77 0.43 -0.73 0.00 0.00 0.00 0.00 47.33 47.79 1rfl h GLY 132 CO -0.68 -0.21 0.83 1.18 0.00 0.00 0.00 176.54 177.66 1rfl n GLU 133 N -5.41 2.82 -0.03 4.80 1.02 0.95 -4.34 120.64 120.45 1rfl n GLU 133 Ca -0.01 -3.59 -0.04 0.00 -0.02 0.00 0.00 57.16 53.50 1rfl n GLU 133 Cb 0.34 -2.27 -0.03 0.00 -0.02 0.00 0.00 31.44 29.46 1rfl n GLU 133 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1rfl n THR 134 N -0.60 0.35 -0.00 2.62 -1.04 -0.58 -4.53 114.28 110.49 1rfl n THR 134 Ca 0.54 -0.14 -0.00 0.00 -2.04 0.00 0.00 64.05 62.41 1rfl n THR 134 Cb 0.36 -0.72 -0.00 0.00 -1.82 0.00 0.00 70.33 68.14 1rfl n THR 134 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1rfl h LEU 135 N 0.00 0.00 -0.95 -4.42 4.07 -1.76 -3.38 115.31 108.87 1rfl h LEU 135 Ca -0.14 0.00 0.15 0.00 0.08 0.00 0.00 57.88 57.97 1rfl h LEU 135 Cb 1.21 0.00 -0.15 0.00 1.08 0.00 0.00 40.66 42.80 1rfl h LEU 135 CO -0.02 0.02 -0.38 0.61 -1.08 0.00 0.00 178.44 177.59 1rfl n GLY 136 N 1.90 -1.98 4.03 0.83 0.00 -1.26 -4.79 105.19 103.91 1rfl n GLY 136 Ca -0.00 1.07 -0.39 0.00 0.00 0.00 0.00 46.02 46.70 1rfl n GLY 136 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1rfl n MET 137 N -5.40 -0.90 0.00 1.61 2.81 -1.26 -2.39 117.12 111.58 1rfl n MET 137 Ca 0.10 0.19 0.00 0.00 -1.81 0.00 0.00 57.70 56.17 1rfl n MET 137 Cb 0.38 -3.26 0.00 0.00 -0.71 0.00 0.00 33.22 29.63 1rfl n MET 137 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1rfl n SER 138 N -2.48 0.00 0.00 7.83 2.88 -1.26 -4.71 113.62 115.88 1rfl n SER 138 Ca -0.17 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.37 1rfl n SER 138 Cb 0.61 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.07 1rfl n SER 138 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1rfl n GLU 139 N 0.00 -2.48 -0.54 -1.46 2.13 -1.01 -5.17 120.64 112.11 1rfl n GLU 139 Ca 0.00 0.00 0.02 0.00 0.66 0.00 0.00 57.16 57.84 1rfl n GLU 139 Cb 0.00 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 31.70 1rfl n GLU 139 CO 0.00 0.00 0.00 1.55 -0.41 0.00 0.00 177.13 178.27 1rfl n VAL 140 N 0.84 -0.85 -3.26 6.31 3.14 -1.26 -4.73 118.33 118.51 1rfl n VAL 140 Ca 0.00 0.47 -0.46 0.00 -2.96 0.00 0.00 64.34 61.39 1rfl n VAL 140 Cb 0.00 -0.77 -0.02 0.00 -1.06 0.00 0.00 33.84 31.99 1rfl n VAL 140 CO 0.00 0.00 0.00 0.21 -6.46 0.00 0.00 176.83 170.58 1rfl s ASN 141 N -4.18 6.85 0.20 6.55 2.47 -1.26 -4.98 114.94 120.59 1rfl s ASN 141 Ca 0.00 -2.75 -0.32 0.00 0.42 0.00 0.00 52.86 50.20 1rfl s ASN 141 Cb 0.00 -2.24 -0.13 0.00 -1.45 0.00 0.00 41.25 37.42 1rfl s ASN 141 CO 0.00 -0.60 1.54 0.61 -3.72 0.00 0.00 177.10 174.92 1rfl n GLY 142 N 3.99 1.07 0.41 1.21 0.00 -1.26 -4.87 105.19 105.74 1rfl n GLY 142 Ca 0.18 0.58 -0.09 0.00 0.00 0.00 0.00 46.02 46.69 1rfl n GLY 142 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1rfl h HIS 143 N 5.33 -1.50 -2.59 1.61 2.76 -1.93 -3.43 115.15 115.39 1rfl h HIS 143 Ca -0.45 0.10 -0.10 0.00 -2.20 0.00 0.00 60.37 57.72 1rfl h HIS 143 Cb 1.25 0.76 -0.22 0.00 1.55 0.00 0.00 27.41 30.75 1rfl h HIS 143 CO 0.60 -0.41 -0.13 0.00 -1.30 0.00 0.00 177.93 176.69 1rfl s ALA 144 N -5.72 -1.18 -0.30 5.26 0.00 -1.26 -4.98 121.76 113.57 1rfl s ALA 144 Ca -0.13 1.18 -0.08 0.00 0.00 0.00 0.00 51.96 52.92 1rfl s ALA 144 Cb 0.13 -0.56 0.00 0.00 0.00 0.00 0.00 23.12 22.70 1rfl s ALA 144 CO 0.65 -0.25 0.11 -0.51 0.00 0.00 0.00 175.76 175.77 1rfl s LEU 145 N -0.18 3.95 -0.07 0.00 1.43 -1.26 -3.36 118.68 119.20 1rfl s LEU 145 Ca -0.04 -0.60 0.02 0.00 -1.03 0.00 0.00 54.13 52.48 1rfl s LEU 145 Cb -0.03 -1.94 0.01 0.00 0.03 0.00 0.00 46.19 44.26 1rfl s LEU 145 CO 0.02 -0.19 -0.12 -0.63 0.23 0.00 0.00 176.35 175.67 1rfl s ILE 146 N 1.56 1.10 0.40 -0.59 1.09 -1.21 -4.93 121.20 118.62 1rfl s ILE 146 Ca 0.04 -0.46 -0.15 0.00 -1.10 0.00 0.00 60.65 58.98 1rfl s ILE 146 Cb -0.17 -1.02 -0.09 0.00 -1.06 0.00 0.00 42.46 40.13 1rfl s ILE 146 CO 0.04 0.35 0.84 0.00 -0.10 0.00 0.00 174.94 176.07 1rfl s ARG 147 N 0.71 3.98 0.11 2.79 1.70 -1.26 -2.75 118.95 124.22 1rfl s ARG 147 Ca -0.14 0.77 -0.26 0.00 -0.47 0.00 0.00 55.73 55.64 1rfl s ARG 147 Cb -0.16 -2.31 0.09 0.00 -0.57 0.00 0.00 34.95 32.00 1rfl s ARG 147 CO 0.03 -0.02 1.11 -0.48 -1.08 0.00 0.00 175.30 174.86 1rfl s LEU 148 N -3.47 -0.06 0.22 -1.89 2.34 -1.26 -3.53 118.68 111.03 1rfl s LEU 148 Ca 0.56 -0.42 0.00 0.00 0.06 0.00 0.00 54.13 54.33 1rfl s LEU 148 Cb -0.10 1.85 -0.04 0.00 -0.56 0.00 0.00 46.19 47.34 1rfl s LEU 148 CO 0.23 -0.72 0.15 -0.94 -1.06 0.00 0.00 176.35 174.00 1rfl s SER 149 N -3.25 0.35 0.00 1.48 1.04 -1.26 -4.86 113.70 107.20 1rfl s SER 149 Ca 0.19 -1.44 0.00 0.00 0.48 0.00 0.00 55.95 55.18 1rfl s SER 149 Cb -0.00 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.52 1rfl s SER 149 CO 0.02 -0.87 0.04 0.00 0.98 0.00 0.00 173.24 173.41 1rfl n ALA 150 N -0.32 -0.01 -1.00 5.32 0.00 -1.26 -4.48 120.51 118.76 1rfl n ALA 150 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1rfl n ALA 150 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.11 1rfl n ALA 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1rfl n ARG 151 N -1.18 0.00 -2.06 0.00 5.12 -1.26 -4.46 116.66 112.81 1rfl n ARG 151 Ca 0.00 0.20 -0.41 0.00 -1.93 0.00 0.00 57.85 55.71 1rfl n ARG 151 Cb 0.00 -0.74 -0.02 0.00 -1.16 0.00 0.00 32.46 30.53 1rfl n ARG 151 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1rfl s THR 152 N -0.49 2.69 -1.57 0.55 2.01 -1.26 -4.88 115.64 112.69 1rfl s THR 152 Ca 0.00 0.64 -0.11 0.00 0.31 0.00 0.00 61.69 62.53 1rfl s THR 152 Cb 0.00 -3.41 -0.07 0.00 0.01 0.00 0.00 72.50 69.04 1rfl s THR 152 CO 0.00 0.13 2.80 0.61 -0.69 0.00 0.00 174.62 177.47 1rfl n GLY 153 N 1.41 4.23 0.00 4.40 0.00 -1.26 -4.00 105.19 109.97 1rfl n GLY 153 Ca 0.03 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.56 1rfl n GLY 153 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1rfl n GLU 154 N 4.08 0.00 -3.32 1.61 1.02 -1.26 -4.16 120.64 118.61 1rfl n GLU 154 Ca 0.73 0.73 -0.25 0.00 -0.02 0.00 0.00 57.16 58.34 1rfl n GLU 154 Cb 0.26 -1.49 -0.08 0.00 -0.02 0.00 0.00 31.44 30.11 1rfl n GLU 154 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rfl n GLY 155 N -0.99 3.60 0.19 0.62 0.00 -1.23 -4.87 105.19 102.51 1rfl n GLY 155 Ca 0.00 -2.05 -0.23 0.00 0.00 0.00 0.00 46.02 43.73 1rfl n GLY 155 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1rfl n VAL 156 N 1.31 1.37 -0.22 1.61 0.31 -1.26 -4.03 118.33 117.42 1rfl n VAL 156 Ca 0.25 -0.41 -0.01 0.00 -0.01 0.00 0.00 64.34 64.16 1rfl n VAL 156 Cb 0.47 -1.67 0.19 0.00 -0.91 0.00 0.00 33.84 31.93 1rfl n VAL 156 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1rfl h ASP 157 N -0.60 0.90 -0.42 4.52 5.19 -1.89 0.21 116.42 124.33 1rfl h ASP 157 Ca -0.60 -0.08 -0.02 0.00 -0.62 0.00 0.00 57.03 55.71 1rfl h ASP 157 Cb 1.64 -0.23 -0.02 0.00 0.18 0.00 0.00 39.33 40.90 1rfl h ASP 157 CO -0.28 0.73 0.20 0.58 -3.12 0.00 0.00 179.24 177.34 1rfl h VAL 158 N 1.01 1.17 0.00 -1.35 2.07 -1.93 0.61 116.25 117.84 1rfl h VAL 158 Ca 0.26 -0.53 -0.07 0.00 0.82 0.00 0.00 66.70 67.17 1rfl h VAL 158 Cb 0.04 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1rfl h VAL 158 CO -0.04 0.21 -0.35 0.25 0.02 0.00 0.00 177.57 177.66 1rfl h LEU 159 N 0.67 0.00 0.05 2.57 5.85 -1.32 -2.95 115.31 120.18 1rfl h LEU 159 Ca 0.16 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.80 1rfl h LEU 159 Cb 0.12 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.16 1rfl h LEU 159 CO -0.02 0.35 -0.38 -0.09 -0.34 0.00 0.00 178.44 177.97 1rfl h ARG 160 N 0.00 0.16 0.00 1.25 2.43 0.10 -3.22 114.38 115.11 1rfl h ARG 160 Ca -0.00 -0.25 -0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1rfl h ARG 160 Cb 1.24 0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.88 1rfl h ARG 160 CO 0.05 1.07 -0.01 -0.97 -1.51 0.00 0.00 179.97 178.60 1rfl h ASN 161 N -0.62 0.00 -0.36 -3.80 -1.24 0.09 0.35 115.58 109.99 1rfl h ASN 161 Ca -0.06 0.00 -0.03 0.00 0.71 0.00 0.00 56.30 56.92 1rfl h ASN 161 Cb 1.25 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 40.28 1rfl h ASN 161 CO 0.07 0.01 0.04 1.41 -1.29 0.00 0.00 177.43 177.67 1rfl n HIS 162 N -3.92 1.28 0.00 0.67 8.25 -1.12 -3.46 115.22 116.92 1rfl n HIS 162 Ca -0.03 -0.51 0.00 0.00 -0.26 0.00 0.00 57.72 56.92 1rfl n HIS 162 Cb 0.09 -0.38 0.00 0.00 1.12 0.00 0.00 29.99 30.83 1rfl n HIS 162 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1rfl n LEU 163 N 0.28 1.58 0.04 2.41 0.00 0.12 -4.43 117.00 117.00 1rfl n LEU 163 Ca 0.18 0.00 -0.01 0.00 0.00 0.00 0.00 56.01 56.18 1rfl n LEU 163 Cb 0.85 0.00 0.26 0.00 0.00 0.00 0.00 43.42 44.53 1rfl n LEU 163 CO 0.21 0.24 0.79 0.50 0.00 0.00 0.00 177.39 179.14 1rfl h LYS 164 N 0.00 0.40 -0.39 1.96 3.64 -1.54 -2.49 116.57 118.15 1rfl h LYS 164 Ca 0.00 -0.13 -0.16 0.00 -1.27 0.00 0.00 60.65 59.09 1rfl h LYS 164 Cb 0.90 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.68 1rfl h LYS 164 CO 0.00 0.59 -0.37 0.37 -2.27 0.00 0.00 179.45 177.77 1rfl h GLN 165 N 0.37 0.94 0.00 1.90 -0.00 -1.83 -3.33 115.11 113.16 1rfl h GLN 165 Ca 0.06 -0.49 0.00 0.00 -0.00 0.00 0.00 58.65 58.22 1rfl h GLN 165 Cb 0.56 0.01 0.00 0.00 0.00 0.00 0.00 27.48 28.05 1rfl h GLN 165 CO 0.04 1.15 0.00 0.43 0.00 0.00 0.00 178.83 180.44 1rfl n SER 166 N -4.06 0.00 -4.61 -0.69 7.64 -0.99 -4.65 113.62 106.25 1rfl n SER 166 Ca -0.02 0.88 -0.49 0.00 1.01 0.00 0.00 58.87 60.25 1rfl n SER 166 Cb 0.54 -0.38 -0.05 0.00 -1.01 0.00 0.00 64.21 63.31 1rfl n SER 166 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 1rfl n MET 167 N -1.72 1.42 -3.79 1.43 0.00 -0.97 -4.95 117.12 108.54 1rfl n MET 167 Ca 0.00 0.51 -0.07 0.00 0.00 0.00 0.00 57.70 58.14 1rfl n MET 167 Cb 0.00 -2.13 -0.02 0.00 0.00 0.00 0.00 33.22 31.07 1rfl n MET 167 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 1rfl s GLY 168 N 0.38 -0.17 0.39 3.17 0.00 -1.19 -4.47 107.32 105.43 1rfl s GLY 168 Ca 0.78 -0.15 0.00 0.00 0.00 0.00 0.00 44.72 45.36 1rfl s GLY 168 CO 0.47 -0.04 0.00 1.39 0.00 0.00 0.00 173.10 174.92 1rfl n ILE 169 N -0.45 -0.07 -0.52 0.90 2.08 -1.26 -4.10 119.36 115.95 1rfl n ILE 169 Ca -0.06 0.41 0.00 0.00 0.56 0.00 0.00 62.75 63.67 1rfl n ILE 169 Cb 0.60 -0.79 0.00 0.00 -0.75 0.00 0.00 39.64 38.70 1rfl n ILE 169 CO 0.00 0.00 0.00 1.57 0.56 0.00 0.00 176.55 178.68 1rfl n HIS 170 N -3.82 0.00 -3.67 1.39 -0.00 -1.26 -2.89 115.22 104.97 1rfl n HIS 170 Ca -0.03 0.00 -0.36 0.00 0.46 0.00 0.00 57.72 57.78 1rfl n HIS 170 Cb 0.63 -1.29 -0.08 0.00 -0.12 0.00 0.00 29.99 29.14 1rfl n HIS 170 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1rfl s ARG 171 N -2.18 2.97 0.00 1.57 3.00 -1.26 -2.67 118.95 120.37 1rfl s ARG 171 Ca 0.00 -2.95 0.00 0.00 0.00 0.00 0.00 55.73 52.78 1rfl s ARG 171 Cb 0.00 -3.86 0.00 0.00 0.00 0.00 0.00 34.95 31.09 1rfl s ARG 171 CO 0.00 -1.23 0.00 -3.47 0.00 0.00 0.00 175.30 170.60