#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 -0.15 -0.06 1.61 0.15 -1.26 -5.09 113.70 108.91 1rfl s SER 2 Ca 0.00 0.12 -0.07 0.00 0.70 0.00 0.00 55.95 56.70 1rfl s SER 2 Cb 0.00 1.14 -0.02 0.00 -1.71 0.00 0.00 66.02 65.42 1rfl s SER 2 CO 0.00 -0.03 -0.14 -0.11 1.20 0.00 0.00 173.24 174.16 1rfl n LEU 3 N 5.29 0.98 -3.65 3.45 -0.00 -1.26 -5.10 117.00 116.71 1rfl n LEU 3 Ca -0.08 0.16 -0.01 0.00 -0.00 0.00 0.00 56.01 56.08 1rfl n LEU 3 Cb 0.55 -0.51 -0.06 0.00 -0.00 0.00 0.00 43.42 43.39 1rfl n LEU 3 CO -0.12 -0.45 1.01 -0.22 -0.00 0.00 0.00 177.39 177.61 1rfl s LEU 4 N -6.52 -0.12 -0.18 -1.96 2.96 -1.26 -5.07 118.68 106.52 1rfl s LEU 4 Ca -0.12 0.21 -0.05 0.00 -0.22 0.00 0.00 54.13 53.96 1rfl s LEU 4 Cb 0.02 1.20 -0.09 0.00 0.50 0.00 0.00 46.19 47.82 1rfl s LEU 4 CO 0.18 -0.04 -0.21 0.54 -1.32 0.00 0.00 176.35 175.50 1rfl n ARG 5 N 2.56 0.41 -1.83 1.98 1.74 -1.26 -5.12 116.66 115.14 1rfl n ARG 5 Ca -0.15 0.14 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1rfl n ARG 5 Cb 0.57 -1.24 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 1rfl n ARG 5 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1rfl n GLU 6 N -3.50 -3.81 -4.10 5.56 1.02 -1.21 -4.99 120.64 109.61 1rfl n GLU 6 Ca -0.34 2.88 -0.07 0.00 -0.02 0.00 0.00 57.16 59.61 1rfl n GLU 6 Cb 0.79 -3.33 -0.10 0.00 -0.02 0.00 0.00 31.44 28.78 1rfl n GLU 6 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1rfl s GLY 7 N -0.40 0.51 -0.01 0.62 0.00 0.31 -4.88 107.32 103.48 1rfl s GLY 7 Ca 0.00 -1.23 -0.14 0.00 0.00 0.00 0.00 44.72 43.35 1rfl s GLY 7 CO 0.00 -1.33 0.65 1.03 0.00 0.00 0.00 173.10 173.44 1rfl n MET 8 N 0.09 0.10 -4.57 2.90 2.81 -1.26 -4.12 117.12 113.06 1rfl n MET 8 Ca -0.14 -0.40 -0.32 0.00 -1.81 0.00 0.00 57.70 55.03 1rfl n MET 8 Cb 0.61 0.66 -0.06 0.00 -0.71 0.00 0.00 33.22 33.72 1rfl n MET 8 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1rfl n LYS 9 N -0.47 0.77 -3.61 0.03 4.01 -1.26 -4.97 118.16 112.66 1rfl n LYS 9 Ca 0.02 -3.65 -0.15 0.00 -0.51 0.00 0.00 58.31 54.02 1rfl n LYS 9 Cb 0.29 0.92 -0.06 0.00 -0.51 0.00 0.00 35.03 35.67 1rfl n LYS 9 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1rfl s VAL 10 N -2.81 0.03 -0.10 -0.18 0.11 -1.26 -4.61 120.40 111.58 1rfl s VAL 10 Ca 0.03 -0.25 0.04 0.00 -2.93 0.00 0.00 61.98 58.87 1rfl s VAL 10 Cb -0.00 -0.90 0.00 0.00 -1.53 0.00 0.00 36.38 33.95 1rfl s VAL 10 CO 0.02 -0.14 -0.23 -0.69 -3.33 0.00 0.00 175.10 170.73 1rfl s VAL 11 N -1.81 1.98 -0.51 2.04 1.01 -1.21 -4.89 120.40 117.00 1rfl s VAL 11 Ca -0.09 -0.97 0.04 0.00 0.00 0.00 0.00 61.98 60.96 1rfl s VAL 11 Cb -0.02 -1.72 0.16 0.00 0.00 0.00 0.00 36.38 34.80 1rfl s VAL 11 CO 0.03 0.54 0.35 -0.63 0.00 0.00 0.00 175.10 175.39 1rfl s ILE 12 N 0.40 1.54 0.25 2.22 1.01 -1.26 -1.29 121.20 124.08 1rfl s ILE 12 Ca -0.18 -3.12 0.10 0.00 0.00 0.00 0.00 60.65 57.45 1rfl s ILE 12 Cb -0.18 -2.04 -0.04 0.00 0.01 0.00 0.00 42.46 40.21 1rfl s ILE 12 CO 0.08 -1.04 -0.06 0.00 0.00 0.00 0.00 174.94 173.92 1rfl s ALA 13 N -0.30 3.04 0.00 9.38 0.00 -1.25 -4.98 121.76 127.65 1rfl s ALA 13 Ca 0.25 -1.67 0.00 0.00 0.00 0.00 0.00 51.96 50.54 1rfl s ALA 13 Cb -0.09 -0.66 0.00 0.00 0.00 0.00 0.00 23.12 22.36 1rfl s ALA 13 CO -0.11 0.30 0.00 0.41 0.00 0.00 0.00 175.76 176.36 1rfl n GLY 14 N -0.67 -0.56 3.69 0.00 0.00 -1.26 -3.65 105.19 102.73 1rfl n GLY 14 Ca -0.07 -0.76 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 1rfl n GLY 14 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rfl s ARG 15 N -1.33 4.35 -1.07 1.61 1.81 -1.25 -4.93 118.95 118.13 1rfl s ARG 15 Ca 0.00 1.70 -0.22 0.00 -1.72 0.00 0.00 55.73 55.48 1rfl s ARG 15 Cb 0.00 -3.55 -0.00 0.00 -0.45 0.00 0.00 34.95 30.95 1rfl s ARG 15 CO 0.00 -0.45 1.74 -1.25 -0.68 0.00 0.00 175.30 174.66 1rfl s PRO 16 N 2.19 3.15 0.00 3.54 0.04 -1.26 -2.62 135.00 140.05 1rfl s PRO 16 Ca 0.56 -1.05 0.00 0.00 0.04 0.00 0.00 61.00 60.55 1rfl s PRO 16 Cb -0.25 -5.28 0.00 0.00 0.04 0.00 0.00 34.50 29.00 1rfl s PRO 16 CO 0.22 -2.90 0.00 0.09 0.04 0.00 0.00 177.00 174.45 1rfl n ASN 17 N 11.34 0.00 -3.31 6.66 3.02 -1.26 -5.01 115.26 126.70 1rfl n ASN 17 Ca 0.40 0.00 -0.34 0.00 -0.03 0.00 0.00 54.58 54.62 1rfl n ASN 17 Cb 0.48 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.63 1rfl n ASN 17 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1rfl n ALA 18 N 0.00 6.37 -2.97 5.41 0.00 -1.08 -4.68 120.51 123.55 1rfl n ALA 18 Ca 0.00 -3.05 -0.20 0.00 0.00 0.00 0.00 53.44 50.19 1rfl n ALA 18 Cb 0.00 -3.28 0.02 0.00 0.00 0.00 0.00 19.45 16.19 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 3.71 0.10 0.10 0.00 0.00 -1.26 -4.71 105.19 103.12 1rfl n GLY 19 Ca 0.65 0.58 -0.11 0.00 0.00 0.00 0.00 46.02 47.14 1rfl n GLY 19 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1rfl n LYS 20 N 0.39 0.76 -0.04 1.61 2.85 -1.26 -4.28 118.16 118.19 1rfl n LYS 20 Ca -0.04 0.02 -0.21 0.00 -1.05 0.00 0.00 58.31 57.02 1rfl n LYS 20 Cb 0.51 -1.50 -0.13 0.00 -0.65 0.00 0.00 35.03 33.26 1rfl n LYS 20 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1rfl n SER 21 N -2.82 2.06 -0.12 -5.58 2.88 -1.26 -3.83 113.62 104.95 1rfl n SER 21 Ca -0.34 0.17 0.27 0.00 -1.33 0.00 0.00 58.87 57.64 1rfl n SER 21 Cb 1.11 -0.79 0.71 0.00 -0.75 0.00 0.00 64.21 64.50 1rfl n SER 21 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1rfl h SER 22 N -0.13 0.00 0.06 -3.46 0.02 -1.94 0.82 113.55 108.92 1rfl h SER 22 Ca -0.46 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.21 1rfl h SER 22 Cb 1.90 0.00 0.03 0.00 0.14 0.00 0.00 62.40 64.46 1rfl h SER 22 CO -0.01 0.00 -1.11 0.25 -1.14 0.00 0.00 176.83 174.82 1rfl h LEU 23 N 0.00 0.88 -0.52 5.07 5.85 -1.75 -2.63 115.31 122.21 1rfl h LEU 23 Ca 0.38 -0.78 -0.05 0.00 0.84 0.00 0.00 57.88 58.26 1rfl h LEU 23 Cb 1.69 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 42.43 1rfl h LEU 23 CO -0.00 1.56 0.13 0.25 -0.34 0.00 0.00 178.44 180.03 1rfl h LEU 24 N 0.30 0.80 -0.67 2.25 5.85 0.37 -1.50 115.31 122.71 1rfl h LEU 24 Ca -0.16 -0.23 0.03 0.00 0.84 0.00 0.00 57.88 58.36 1rfl h LEU 24 Cb 1.78 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 42.56 1rfl h LEU 24 CO 0.22 0.82 0.42 -1.13 -0.34 0.00 0.00 178.44 178.42 1rfl h ASN 25 N 0.73 0.68 -0.52 1.25 -0.73 -0.60 -1.58 115.58 114.81 1rfl h ASN 25 Ca 0.16 0.00 0.02 0.00 1.87 0.00 0.00 56.30 58.35 1rfl h ASN 25 Cb 0.34 -0.15 -0.03 0.00 0.27 0.00 0.00 38.32 38.75 1rfl h ASN 25 CO 0.00 0.47 0.32 0.00 -0.37 0.00 0.00 177.43 177.85 1rfl h ALA 26 N 1.29 0.67 0.05 1.57 0.00 -1.08 0.51 119.26 122.26 1rfl h ALA 26 Ca 0.27 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1rfl h ALA 26 Cb 0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1rfl h ALA 26 CO -0.11 0.04 -0.13 -0.07 0.00 0.00 0.00 179.25 178.98 1rfl h LEU 27 N 0.64 -0.38 -0.08 0.00 -0.00 -0.35 -3.09 115.31 112.04 1rfl h LEU 27 Ca 0.20 0.04 0.01 0.00 -0.00 0.00 0.00 57.88 58.14 1rfl h LEU 27 Cb -0.00 0.14 -0.03 0.00 -0.00 0.00 0.00 40.66 40.77 1rfl h LEU 27 CO -0.08 -0.14 -0.20 0.00 -0.00 0.00 0.00 178.44 178.02 1rfl h ALA 28 N -1.35 -0.56 0.00 1.53 0.00 -1.25 -3.46 119.26 114.17 1rfl h ALA 28 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1rfl h ALA 28 Cb 0.19 0.77 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1rfl h ALA 28 CO -0.06 -0.64 0.00 0.41 0.00 0.00 0.00 179.25 178.96 1rfl n GLY 29 N -1.15 0.62 3.81 0.00 0.00 0.16 -5.04 105.19 103.58 1rfl n GLY 29 Ca -0.02 -0.77 -0.34 0.00 0.00 0.00 0.00 46.02 44.89 1rfl n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rfl s ARG 30 N -3.29 4.18 -1.48 1.61 0.52 -1.26 -4.93 118.95 114.30 1rfl s ARG 30 Ca 0.00 1.24 -0.11 0.00 -0.52 0.00 0.00 55.73 56.34 1rfl s ARG 30 Cb 0.00 -2.28 -0.05 0.00 0.52 0.00 0.00 34.95 33.13 1rfl s ARG 30 CO 0.00 -0.08 2.65 0.39 0.02 0.00 0.00 175.30 178.27 1rfl n GLU 31 N -0.48 3.24 0.00 3.54 4.71 -1.26 -3.88 120.64 126.50 1rfl n GLU 31 Ca 0.07 -2.23 0.00 0.00 -0.01 0.00 0.00 57.16 54.99 1rfl n GLU 31 Cb 0.53 -2.91 0.00 0.00 -1.01 0.00 0.00 31.44 28.05 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 4.49 0.00 -1.68 0.62 0.00 -1.26 -5.13 120.51 117.54 1rfl n ALA 32 Ca 0.67 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.68 1rfl n ALA 32 Cb 0.27 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.69 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 0.00 2.00 -2.42 0.00 0.00 -1.25 -4.97 120.51 113.86 1rfl n ALA 33 Ca 0.00 0.30 -0.27 0.00 0.00 0.00 0.00 53.44 53.47 1rfl n ALA 33 Cb 0.00 -2.59 -0.16 0.00 0.00 0.00 0.00 19.45 16.70 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 3.00 1.65 -0.21 0.00 1.10 -1.26 -5.12 121.20 120.37 1rfl s ILE 34 Ca 0.84 -0.90 0.01 0.00 -0.51 0.00 0.00 60.65 60.08 1rfl s ILE 34 Cb -0.49 -1.37 0.05 0.00 0.15 0.00 0.00 42.46 40.80 1rfl s ILE 34 CO 0.39 0.46 -0.07 -0.69 -2.11 0.00 0.00 174.94 172.92 1rfl s VAL 35 N -0.50 1.51 0.03 4.00 1.01 -1.26 -4.96 120.40 120.23 1rfl s VAL 35 Ca 0.08 -1.06 -0.20 0.00 0.00 0.00 0.00 61.98 60.80 1rfl s VAL 35 Cb -0.08 -1.69 -0.06 0.00 0.00 0.00 0.00 36.38 34.55 1rfl s VAL 35 CO -0.01 0.03 0.59 0.28 0.00 0.00 0.00 175.10 175.99 1rfl s THR 36 N 1.43 4.84 -0.53 3.92 -1.32 -1.26 -5.03 115.64 117.69 1rfl s THR 36 Ca -0.03 1.24 0.04 0.00 -1.21 0.00 0.00 61.69 61.72 1rfl s THR 36 Cb -0.17 -3.92 0.14 0.00 -1.51 0.00 0.00 72.50 67.03 1rfl s THR 36 CO -0.07 0.47 0.29 -1.81 -2.21 0.00 0.00 174.62 171.29 1rfl s ASP 37 N -0.53 4.20 0.11 8.08 1.11 -1.26 -5.07 116.67 123.31 1rfl s ASP 37 Ca 0.30 -3.07 0.02 0.00 0.18 0.00 0.00 52.55 49.98 1rfl s ASP 37 Cb -0.19 -1.49 -0.04 0.00 1.07 0.00 0.00 42.92 42.27 1rfl s ASP 37 CO 0.18 -0.21 -0.05 -0.51 1.18 0.00 0.00 175.17 175.75 1rfl s ILE 38 N -0.34 0.69 -0.18 0.77 2.07 -1.26 -5.06 121.20 117.89 1rfl s ILE 38 Ca 0.19 -1.95 0.02 0.00 -1.41 0.00 0.00 60.65 57.50 1rfl s ILE 38 Cb -0.22 -1.77 -0.12 0.00 0.13 0.00 0.00 42.46 40.48 1rfl s ILE 38 CO -0.03 -0.80 -0.15 0.00 -1.91 0.00 0.00 174.94 172.05 1rfl n ALA 39 N -0.08 1.61 -1.42 1.50 0.00 -1.26 -4.94 120.51 115.91 1rfl n ALA 39 Ca -0.11 -0.79 -0.51 0.00 0.00 0.00 0.00 53.44 52.03 1rfl n ALA 39 Cb 0.61 0.07 -0.08 0.00 0.00 0.00 0.00 19.45 20.06 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 2.60 0.41 3.56 0.00 0.00 -1.26 -4.83 105.19 105.68 1rfl n GLY 40 Ca -0.32 0.95 -0.40 0.00 0.00 0.00 0.00 46.02 46.25 1rfl n GLY 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rfl s THR 41 N 7.22 3.55 -0.28 2.61 2.01 -1.26 -4.91 115.64 124.58 1rfl s THR 41 Ca 1.11 0.39 -0.41 0.00 0.31 0.00 0.00 61.69 63.09 1rfl s THR 41 Cb -0.93 -4.24 -0.16 0.00 0.01 0.00 0.00 72.50 67.18 1rfl s THR 41 CO 0.51 -1.12 1.71 1.07 -0.69 0.00 0.00 174.62 176.09 1rfl n THR 42 N 6.97 0.26 -0.22 -0.82 5.66 -1.26 -4.79 114.28 120.08 1rfl n THR 42 Ca 0.15 -0.05 0.14 0.00 -3.05 0.00 0.00 64.05 61.24 1rfl n THR 42 Cb 0.50 -1.13 0.45 0.00 -1.55 0.00 0.00 70.33 68.60 1rfl n THR 42 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 175.07 172.05 1rfl h ARG 43 N 6.86 0.52 0.00 1.09 -0.00 -1.97 1.22 114.38 122.11 1rfl h ARG 43 Ca -0.46 -0.03 0.00 0.00 -0.50 0.00 0.00 59.98 58.99 1rfl h ARG 43 Cb 1.32 -0.12 0.00 0.00 0.00 0.00 0.00 29.97 31.18 1rfl h ARG 43 CO 0.95 0.34 0.00 -0.40 0.00 0.00 0.00 179.97 180.87 1rfl n ASP 44 N -4.52 0.00 0.00 7.04 5.75 -1.26 -4.59 116.55 118.97 1rfl n ASP 44 Ca 0.16 0.37 0.00 0.00 -0.01 0.00 0.00 54.79 55.31 1rfl n ASP 44 Cb 0.52 -0.44 0.00 0.00 -1.03 0.00 0.00 41.12 40.17 1rfl n ASP 44 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 1rfl n VAL 45 N -1.44 0.00 -1.34 2.12 0.31 0.42 -4.48 118.33 113.92 1rfl n VAL 45 Ca 0.05 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.05 1rfl n VAL 45 Cb 0.16 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 32.94 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 -0.09 0.00 7.52 7.94 -1.24 -4.61 117.00 126.53 1rfl n LEU 46 Ca 0.00 0.02 0.00 0.00 -1.11 0.00 0.00 56.01 54.92 1rfl n LEU 46 Cb 0.00 -0.74 0.00 0.00 0.53 0.00 0.00 43.42 43.21 1rfl n LEU 46 CO 0.00 -0.78 0.41 -1.14 -1.11 0.00 0.00 177.39 174.76 1rfl n ARG 47 N 6.99 1.90 -1.32 1.96 3.00 -1.26 -4.67 116.66 123.26 1rfl n ARG 47 Ca 0.59 -1.15 0.02 0.00 -0.00 0.00 0.00 57.85 57.32 1rfl n ARG 47 Cb 0.05 -0.88 0.10 0.00 0.00 0.00 0.00 32.46 31.73 1rfl n ARG 47 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1rfl n GLU 48 N -0.33 1.07 0.00 -0.14 1.02 -1.26 -5.07 120.64 115.93 1rfl n GLU 48 Ca 0.00 -2.82 0.00 0.00 -0.02 0.00 0.00 57.16 54.32 1rfl n GLU 48 Cb 0.28 -0.96 0.00 0.00 -0.02 0.00 0.00 31.44 30.74 1rfl n GLU 48 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 1rfl n HIS 49 N -0.33 0.00 -3.17 -0.32 1.44 -1.26 -4.75 115.22 106.83 1rfl n HIS 49 Ca 0.14 0.00 0.04 0.00 -2.01 0.00 0.00 57.72 55.89 1rfl n HIS 49 Cb 0.93 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 31.02 1rfl n HIS 49 CO 0.00 0.00 0.00 -1.50 -2.81 0.00 0.00 176.34 172.03 1rfl s ILE 50 N 0.00 -0.99 -0.03 0.61 1.10 -1.26 -4.98 121.20 115.66 1rfl s ILE 50 Ca 0.00 0.00 -0.30 0.00 -0.51 0.00 0.00 60.65 59.84 1rfl s ILE 50 Cb 0.00 -1.00 -0.03 0.00 0.15 0.00 0.00 42.46 41.58 1rfl s ILE 50 CO 0.00 0.00 1.12 -1.38 -2.11 0.00 0.00 174.94 172.57 1rfl s HIS 51 N 2.86 3.40 -0.72 3.50 -3.43 -1.26 -4.84 115.29 114.79 1rfl s HIS 51 Ca 0.20 1.40 0.01 0.00 -0.80 0.00 0.00 55.06 55.87 1rfl s HIS 51 Cb -0.15 -3.32 0.18 0.00 -1.43 0.00 0.00 32.58 27.86 1rfl s HIS 51 CO -0.21 -0.86 0.54 0.42 -2.00 0.00 0.00 174.74 172.63 1rfl s ILE 52 N 1.68 3.44 0.35 -5.38 -1.09 -1.26 -4.92 121.20 114.01 1rfl s ILE 52 Ca 0.54 -3.78 0.15 0.00 -2.23 0.00 0.00 60.65 55.33 1rfl s ILE 52 Cb -0.24 -3.22 0.35 0.00 -1.58 0.00 0.00 42.46 37.77 1rfl s ILE 52 CO 0.24 -0.98 1.60 0.44 -1.23 0.00 0.00 174.94 175.01 1rfl h ASP 53 N 6.04 0.20 0.00 3.58 3.32 -1.96 -2.95 116.42 124.64 1rfl h ASP 53 Ca 0.09 0.24 0.00 0.00 0.02 0.00 0.00 57.03 57.38 1rfl h ASP 53 Cb 0.83 0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.66 1rfl h ASP 53 CO 0.75 -0.34 0.00 0.61 -1.72 0.00 0.00 179.24 178.54 1rfl n GLY 54 N -1.31 -0.74 3.29 2.75 0.00 -1.26 -4.79 105.19 103.13 1rfl n GLY 54 Ca 0.33 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.05 1rfl n GLY 54 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1rfl s MET 55 N 0.00 1.89 -0.70 1.61 1.75 -1.11 -5.02 119.30 117.71 1rfl s MET 55 Ca 0.00 -0.93 -0.06 0.00 -1.25 0.00 0.00 55.69 53.45 1rfl s MET 55 Cb 0.00 -1.89 -0.12 0.00 2.84 0.00 0.00 34.83 35.65 1rfl s MET 55 CO 0.00 0.51 2.63 -0.35 -0.65 0.00 0.00 175.02 177.16 1rfl n PRO 56 N 2.28 2.24 -3.67 4.11 -0.04 -1.26 -4.71 135.00 133.94 1rfl n PRO 56 Ca -0.16 -1.34 -0.15 0.00 -0.04 0.00 0.00 63.50 61.81 1rfl n PRO 56 Cb 0.52 -2.29 -0.08 0.00 -0.04 0.00 0.00 33.50 31.60 1rfl n PRO 56 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1rfl s LEU 57 N 0.07 0.11 0.31 1.53 1.43 -1.26 -5.12 118.68 115.76 1rfl s LEU 57 Ca 0.51 0.63 0.00 0.00 -1.03 0.00 0.00 54.13 54.24 1rfl s LEU 57 Cb 0.18 1.82 0.00 0.00 0.03 0.00 0.00 46.19 48.22 1rfl s LEU 57 CO -0.03 -0.39 0.00 1.57 0.23 0.00 0.00 176.35 177.73 1rfl n HIS 58 N 1.75 -2.62 -3.79 0.29 -0.00 -1.26 -5.02 115.22 104.57 1rfl n HIS 58 Ca -0.18 1.40 -0.11 0.00 -0.00 0.00 0.00 57.72 58.83 1rfl n HIS 58 Cb 0.56 -2.51 -0.07 0.00 -0.00 0.00 0.00 29.99 27.96 1rfl n HIS 58 CO 0.00 0.00 0.00 0.96 -0.00 0.00 0.00 176.34 177.30 1rfl s ILE 59 N -2.79 0.10 0.07 3.57 -4.36 -1.26 -4.91 121.20 111.62 1rfl s ILE 59 Ca 0.00 -0.80 0.00 0.00 -0.26 0.00 0.00 60.65 59.60 1rfl s ILE 59 Cb 0.00 -0.99 0.00 0.00 1.25 0.00 0.00 42.46 42.72 1rfl s ILE 59 CO 0.00 -0.44 0.04 2.30 0.24 0.00 0.00 174.94 177.08 1rfl n ILE 60 N 0.49 0.00 -3.65 8.37 -6.64 -1.26 -5.08 119.36 111.59 1rfl n ILE 60 Ca -0.18 -0.29 -0.15 0.00 -1.77 0.00 0.00 62.75 60.36 1rfl n ILE 60 Cb 0.60 -0.33 -0.08 0.00 -1.44 0.00 0.00 39.64 38.39 1rfl n ILE 60 CO 0.00 0.00 0.00 -1.81 -1.77 0.00 0.00 176.55 172.97 1rfl s ASP 61 N -1.41 -0.57 -0.14 7.28 1.01 -1.26 -4.71 116.67 116.87 1rfl s ASP 61 Ca 0.03 0.94 -0.26 0.00 0.71 0.00 0.00 52.55 53.97 1rfl s ASP 61 Cb -0.00 0.94 -0.02 0.00 1.01 0.00 0.00 42.92 44.85 1rfl s ASP 61 CO 0.02 -0.33 0.86 0.42 0.21 0.00 0.00 175.17 176.35 1rfl s THR 62 N -0.23 4.88 0.00 -1.27 -4.23 -1.26 -4.94 115.64 108.58 1rfl s THR 62 Ca -0.04 1.70 0.00 0.00 -1.18 0.00 0.00 61.69 62.17 1rfl s THR 62 Cb -0.03 -4.17 0.00 0.00 1.34 0.00 0.00 72.50 69.64 1rfl s THR 62 CO 0.03 0.05 0.20 0.00 -0.54 0.00 0.00 174.62 174.36 1rfl n ALA 63 N 5.03 0.00 0.00 3.99 0.00 -1.26 -3.60 120.51 124.67 1rfl n ALA 63 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1rfl n ALA 63 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 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 1.16 1.87 3.61 0.00 0.00 -1.26 -4.66 105.19 105.91 1rfl n GLY 64 Ca 0.00 -0.61 -0.34 0.00 0.00 0.00 0.00 46.02 45.07 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 3.28 0.24 0.99 2.01 -1.26 -5.01 118.68 118.93 1rfl s LEU 65 Ca 0.00 0.00 -0.12 0.00 0.01 0.00 0.00 54.13 54.02 1rfl s LEU 65 Cb 0.00 -1.75 0.33 0.00 0.01 0.00 0.00 46.19 44.78 1rfl s LEU 65 CO 0.00 0.35 1.58 -0.09 1.01 0.00 0.00 176.35 179.20 1rfl h ARG 66 N 5.09 -0.02 -0.52 1.70 2.43 -2.01 0.64 114.38 121.70 1rfl h ARG 66 Ca -0.49 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 58.75 1rfl h ARG 66 Cb 1.18 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.67 1rfl h ARG 66 CO 0.53 -0.01 0.18 1.49 -1.51 0.00 0.00 179.97 180.65 1rfl h GLU 67 N -0.02 0.35 -0.55 0.20 4.81 -1.98 -1.29 114.58 116.11 1rfl h GLU 67 Ca 0.39 -0.02 0.10 0.00 -0.13 0.00 0.00 59.36 59.70 1rfl h GLU 67 Cb 0.62 -0.08 -0.08 0.00 0.63 0.00 0.00 28.75 29.84 1rfl h GLU 67 CO -0.89 0.23 0.08 0.00 -0.73 0.00 0.00 179.01 177.69 1rfl h ALA 68 N 1.35 0.60 -0.90 2.92 0.00 -0.03 -0.68 119.26 122.52 1rfl h ALA 68 Ca 0.25 0.13 0.20 0.00 0.00 0.00 0.00 54.91 55.49 1rfl h ALA 68 Cb 0.27 0.20 -0.17 0.00 0.00 0.00 0.00 17.79 18.09 1rfl h ALA 68 CO -0.25 -0.34 -0.16 0.45 0.00 0.00 0.00 179.25 178.95 1rfl n SER 69 N -5.17 -0.26 0.00 0.00 2.88 -0.38 0.12 113.62 110.81 1rfl n SER 69 Ca 0.07 1.55 0.00 0.00 -1.33 0.00 0.00 58.87 59.16 1rfl n SER 69 Cb 0.29 -0.49 0.00 0.00 -0.75 0.00 0.00 64.21 63.26 1rfl n SER 69 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1rfl n ASP 70 N -5.43 0.00 -0.56 -3.46 9.92 -0.28 0.46 116.55 117.20 1rfl n ASP 70 Ca 0.16 0.88 0.45 0.00 -0.53 0.00 0.00 54.79 55.75 1rfl n ASP 70 Cb 0.52 -0.40 0.74 0.00 -0.64 0.00 0.00 41.12 41.34 1rfl n ASP 70 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 1rfl h GLU 71 N 0.00 0.02 0.24 -1.24 4.39 -0.99 0.77 114.58 117.78 1rfl h GLU 71 Ca 0.00 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1rfl h GLU 71 Cb 0.00 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1rfl h GLU 71 CO 0.00 0.01 -0.12 0.28 -1.16 0.00 0.00 179.01 178.03 1rfl h VAL 72 N 0.02 0.66 -0.58 3.13 2.07 0.13 -3.35 116.25 118.32 1rfl h VAL 72 Ca 0.88 -0.91 -0.39 0.00 0.82 0.00 0.00 66.70 67.11 1rfl h VAL 72 Cb 3.14 1.06 -0.05 0.00 -1.52 0.00 0.00 31.29 33.93 1rfl h VAL 72 CO -0.25 0.16 1.21 -1.61 0.02 0.00 0.00 177.57 177.09 1rfl s GLU 73 N -3.70 2.77 0.00 1.57 2.02 0.27 -2.26 118.70 119.37 1rfl s GLU 73 Ca -0.12 -1.18 0.00 0.00 0.02 0.00 0.00 54.97 53.69 1rfl s GLU 73 Cb 0.01 -5.27 0.00 0.00 0.10 0.00 0.00 34.13 28.97 1rfl s GLU 73 CO 0.45 -3.58 0.00 2.89 0.02 0.00 0.00 175.26 175.04 1rfl n ARG 74 N 8.40 0.00 0.18 1.61 1.85 -1.25 -4.40 116.66 123.04 1rfl n ARG 74 Ca 0.44 0.00 0.13 0.00 -1.00 0.00 0.00 57.85 57.43 1rfl n ARG 74 Cb 0.47 0.00 0.41 0.00 -1.05 0.00 0.00 32.46 32.29 1rfl n ARG 74 CO 0.00 0.00 0.00 0.97 -0.01 0.00 0.00 177.63 178.59 1rfl h ILE 75 N 0.00 0.00 -0.18 8.89 2.10 -1.59 -2.80 117.51 123.93 1rfl h ILE 75 Ca 0.00 -0.59 0.00 0.00 1.08 0.00 0.00 64.86 65.35 1rfl h ILE 75 Cb 0.00 1.54 0.00 0.00 -1.09 0.00 0.00 36.82 37.27 1rfl h ILE 75 CO 0.00 0.00 0.00 0.61 -1.08 0.00 0.00 178.15 177.68 1rfl n GLY 76 N 0.72 1.00 2.82 8.18 0.00 -1.26 -5.03 105.19 111.62 1rfl n GLY 76 Ca 0.03 -0.45 -0.04 0.00 0.00 0.00 0.00 46.02 45.56 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 0.83-10.93 -3.82 -0.61 5.41 -1.06 -5.05 119.36 104.13 1rfl n ILE 77 Ca 0.11 1.40 -0.02 0.00 1.00 0.00 0.00 62.75 65.25 1rfl n ILE 77 Cb 0.41 -6.74 0.01 0.00 -0.71 0.00 0.00 39.64 32.61 1rfl n ILE 77 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1rfl s GLU 78 N -1.96 1.02 -0.24 0.38 -1.05 -1.26 -4.99 118.70 110.61 1rfl s GLU 78 Ca 0.10 -0.62 -0.41 0.00 -0.15 0.00 0.00 54.97 53.88 1rfl s GLU 78 Cb -0.02 0.31 -0.19 0.00 -0.44 0.00 0.00 34.13 33.79 1rfl s GLU 78 CO 0.74 -0.48 1.26 0.54 0.95 0.00 0.00 175.26 178.27 1rfl n ARG 79 N -0.63 0.00 -1.17 -4.83 1.74 -1.26 -4.46 116.66 106.05 1rfl n ARG 79 Ca -0.04 0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 56.84 1rfl n ARG 79 Cb 0.60 -1.41 -0.04 0.00 -1.02 0.00 0.00 32.46 30.59 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 2.59 5.87 0.00 7.54 0.00 -1.26 -4.11 120.51 131.15 1rfl n ALA 80 Ca 0.24 -2.26 0.00 0.00 0.00 0.00 0.00 53.44 51.42 1rfl n ALA 80 Cb 0.01 -1.85 0.00 0.00 0.00 0.00 0.00 19.45 17.61 1rfl n ALA 80 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1rfl n TRP 81 N 0.95 0.00 0.00 0.00 5.03 -1.26 -4.98 117.44 117.18 1rfl n TRP 81 Ca 0.39 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.92 1rfl n TRP 81 Cb 0.61 0.00 0.00 0.00 -1.03 0.00 0.00 31.31 30.89 1rfl n TRP 81 CO 0.00 0.00 0.00 1.04 -0.03 0.00 0.00 177.69 178.70 1rfl n GLN 82 N 0.00 0.00 -1.96 -0.99 6.02 -1.26 -5.13 117.38 114.07 1rfl n GLN 82 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 57.00 56.97 1rfl n GLN 82 Cb 0.00 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.24 1rfl n GLN 82 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1rfl n GLU 83 N -0.47 -2.64 -2.67 -1.09 1.02 -1.26 -4.80 120.64 108.73 1rfl n GLU 83 Ca 0.00 2.18 -0.04 0.00 -0.02 0.00 0.00 57.16 59.29 1rfl n GLU 83 Cb 0.00 -3.06 0.08 0.00 -0.02 0.00 0.00 31.44 28.44 1rfl n GLU 83 CO 0.00 0.00 0.00 1.51 1.18 0.00 0.00 177.13 179.82 1rfl n ILE 84 N 0.95 0.00 -3.30 -3.67 0.13 -1.26 -4.97 119.36 107.25 1rfl n ILE 84 Ca -0.15 -0.73 -0.44 0.00 -1.10 0.00 0.00 62.75 60.33 1rfl n ILE 84 Cb 0.23 0.96 -0.07 0.00 -0.84 0.00 0.00 39.64 39.91 1rfl n ILE 84 CO 0.00 0.00 0.00 -1.83 2.80 0.00 0.00 176.55 177.52 1rfl s GLU 85 N 0.06 3.05 0.00 9.51 1.03 -1.26 -4.84 118.70 126.24 1rfl s GLU 85 Ca 0.16 -1.07 0.00 0.00 0.03 0.00 0.00 54.97 54.08 1rfl s GLU 85 Cb 0.23 -4.09 0.00 0.00 -0.80 0.00 0.00 34.13 29.48 1rfl s GLU 85 CO -0.14 -1.06 0.00 0.00 -1.33 0.00 0.00 175.26 172.74 1rfl n GLN 86 N 5.62 1.42 -2.63 -4.83 -0.00 -1.26 -4.30 117.38 111.40 1rfl n GLN 86 Ca -0.09 0.00 -0.04 0.00 -0.00 0.00 0.00 57.00 56.87 1rfl n GLN 86 Cb 0.45 0.00 -0.03 0.00 -0.00 0.00 0.00 30.24 30.66 1rfl n GLN 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1rfl n ALA 87 N -3.00 -3.02 0.02 2.61 0.00 -1.26 -4.97 120.51 110.89 1rfl n ALA 87 Ca 0.00 1.80 0.00 0.00 0.00 0.00 0.00 53.44 55.24 1rfl n ALA 87 Cb 0.00 -3.67 0.00 0.00 0.00 0.00 0.00 19.45 15.78 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 1.88 -0.19 -3.86 0.00 -0.08 -1.26 -5.01 116.55 108.02 1rfl n ASP 88 Ca -0.30 0.09 -0.27 0.00 -1.51 0.00 0.00 54.79 52.79 1rfl n ASP 88 Cb 0.47 0.33 -0.17 0.00 2.34 0.00 0.00 41.12 44.09 1rfl n ASP 88 CO 0.00 0.00 0.00 -0.60 0.12 0.00 0.00 177.20 176.72 1rfl s ARG 89 N -2.00 1.27 -0.09 -0.67 6.06 -1.26 -3.96 118.95 118.30 1rfl s ARG 89 Ca 0.00 -0.35 -0.16 0.00 -2.50 0.00 0.00 55.73 52.72 1rfl s ARG 89 Cb 0.00 -1.76 -0.05 0.00 0.06 0.00 0.00 34.95 33.20 1rfl s ARG 89 CO 0.00 -0.39 0.41 0.08 -2.50 0.00 0.00 175.30 172.91 1rfl s VAL 90 N 1.72 5.16 -0.64 7.11 1.01 -1.02 -3.35 120.40 130.39 1rfl s VAL 90 Ca 0.02 0.83 0.03 0.00 0.00 0.00 0.00 61.98 62.86 1rfl s VAL 90 Cb -0.14 -3.74 0.16 0.00 0.00 0.00 0.00 36.38 32.65 1rfl s VAL 90 CO -0.08 0.42 0.42 -0.76 0.00 0.00 0.00 175.10 175.11 1rfl s LEU 91 N 0.02 4.75 -0.71 3.92 1.02 -0.41 -1.50 118.68 125.77 1rfl s LEU 91 Ca 0.23 -3.35 -0.26 0.00 0.02 0.00 0.00 54.13 50.78 1rfl s LEU 91 Cb -0.15 -1.70 0.04 0.00 0.02 0.00 0.00 46.19 44.40 1rfl s LEU 91 CO 0.10 -0.20 1.17 0.12 0.02 0.00 0.00 176.35 177.57 1rfl s PHE 92 N -0.76 2.42 -0.25 0.29 5.36 -1.25 -3.74 117.98 120.05 1rfl s PHE 92 Ca 0.21 -0.20 -0.29 0.00 -0.96 0.00 0.00 56.93 55.69 1rfl s PHE 92 Cb -0.16 -4.51 0.00 0.00 -0.34 0.00 0.00 43.02 38.01 1rfl s PHE 92 CO -0.07 -1.92 1.21 1.41 -1.46 0.00 0.00 175.22 174.39 1rfl s MET 93 N 5.16 4.11 -0.08 10.12 1.75 -1.24 -4.24 119.30 134.88 1rfl s MET 93 Ca 0.31 1.38 0.03 0.00 -1.25 0.00 0.00 55.69 56.16 1rfl s MET 93 Cb -0.11 -3.78 0.01 0.00 2.84 0.00 0.00 34.83 33.79 1rfl s MET 93 CO 0.14 -0.86 -0.17 0.08 -0.65 0.00 0.00 175.02 173.56 1rfl s VAL 94 N 3.76 1.49 1.25 10.11 1.01 -1.26 -3.89 120.40 132.87 1rfl s VAL 94 Ca 0.52 -0.69 -0.18 0.00 0.00 0.00 0.00 61.98 61.63 1rfl s VAL 94 Cb -0.17 -1.32 0.27 0.00 0.00 0.00 0.00 36.38 35.15 1rfl s VAL 94 CO 0.16 0.43 0.64 -0.67 0.00 0.00 0.00 175.10 175.67 1rfl n ASP 95 N 3.67 -2.97 0.00 3.32 -0.08 -1.26 -4.71 116.55 114.52 1rfl n ASP 95 Ca -0.21 -0.45 0.00 0.00 -1.51 0.00 0.00 54.79 52.61 1rfl n ASP 95 Cb 0.52 -1.02 0.00 0.00 2.34 0.00 0.00 41.12 42.96 1rfl n ASP 95 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1rfl n GLY 96 N 1.79 -1.22 2.75 0.27 0.00 -1.26 -4.30 105.19 103.22 1rfl n GLY 96 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 1rfl n GLY 96 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rfl n THR 97 N 0.00 3.21 -3.38 2.61 -2.24 -1.26 -4.95 114.28 108.27 1rfl n THR 97 Ca 0.00 -4.59 -0.43 0.00 -2.27 0.00 0.00 64.05 56.75 1rfl n THR 97 Cb 0.00 -1.26 -0.09 0.00 -2.10 0.00 0.00 70.33 66.88 1rfl n THR 97 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1rfl s THR 98 N -5.22 5.18 0.39 4.28 2.01 -1.26 -5.06 115.64 115.96 1rfl s THR 98 Ca 0.50 -0.68 -0.02 0.00 0.31 0.00 0.00 61.69 61.80 1rfl s THR 98 Cb 0.42 -4.04 -0.03 0.00 0.01 0.00 0.00 72.50 68.85 1rfl s THR 98 CO -0.33 -0.46 0.63 0.28 -0.69 0.00 0.00 174.62 174.06 1rfl s THR 99 N 1.86 5.03 0.00 -0.82 -1.32 -1.26 -4.81 115.64 114.32 1rfl s THR 99 Ca 0.07 -0.21 0.00 0.00 -1.21 0.00 0.00 61.69 60.35 1rfl s THR 99 Cb -0.20 -3.86 0.00 0.00 -1.51 0.00 0.00 72.50 66.93 1rfl s THR 99 CO 0.10 -0.66 0.00 -0.67 -2.21 0.00 0.00 174.62 171.18 1rfl n ASP 100 N -1.93 0.00 0.00 8.08 -0.08 -1.26 -4.98 116.55 116.38 1rfl n ASP 100 Ca -0.03 0.00 0.12 0.00 -1.51 0.00 0.00 54.79 53.37 1rfl n ASP 100 Cb 0.56 0.00 0.59 0.00 2.34 0.00 0.00 41.12 44.61 1rfl n ASP 100 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1rfl n ALA 101 N -0.02 2.20 0.03 -1.67 0.00 -1.26 -2.07 120.51 117.70 1rfl n ALA 101 Ca 0.00 -0.11 0.10 0.00 0.00 0.00 0.00 53.44 53.43 1rfl n ALA 101 Cb 0.00 -1.38 -0.11 0.00 0.00 0.00 0.00 19.45 17.96 1rfl n ALA 101 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1rfl n VAL 102 N -1.29 0.34 -0.04 0.00 0.31 -1.26 -3.58 118.33 112.81 1rfl n VAL 102 Ca 0.11 -0.54 -0.08 0.00 -0.01 0.00 0.00 64.34 63.82 1rfl n VAL 102 Cb 0.19 -0.18 -0.02 0.00 -0.91 0.00 0.00 33.84 32.93 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 0.00 -0.54 0.06 4.52 3.32 -1.80 -0.76 116.42 121.23 1rfl h ASP 103 Ca -0.03 0.11 -0.24 0.00 0.02 0.00 0.00 57.03 56.89 1rfl h ASP 103 Cb 1.09 0.27 0.01 0.00 0.22 0.00 0.00 39.33 40.92 1rfl h ASP 103 CO 0.00 -0.21 -0.92 1.55 -1.72 0.00 0.00 179.24 177.94 1rfl h PRO 104 N -0.16 0.63 -0.98 3.56 0.13 -1.74 -3.07 132.00 130.36 1rfl h PRO 104 Ca 0.13 -0.62 0.28 0.00 -0.87 0.00 0.00 66.00 64.91 1rfl h PRO 104 Cb 0.36 0.16 -0.05 0.00 0.13 0.00 0.00 31.00 31.60 1rfl h PRO 104 CO -0.32 1.23 0.69 0.00 -0.23 0.00 0.00 178.00 179.37 1rfl h ALA 105 N 0.57 2.77 0.08 -0.56 0.00 -1.49 0.36 119.26 120.98 1rfl h ALA 105 Ca -0.09 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.59 1rfl h ALA 105 Cb 1.56 0.06 0.02 0.00 0.00 0.00 0.00 17.79 19.43 1rfl h ALA 105 CO 0.18 -1.07 -0.89 1.49 0.00 0.00 0.00 179.25 178.96 1rfl h GLU 106 N 0.09 0.47 -1.90 0.00 4.57 -1.07 -3.27 114.58 113.46 1rfl h GLU 106 Ca 0.48 -0.60 -0.32 0.00 -1.18 0.00 0.00 59.36 57.74 1rfl h GLU 106 Cb 1.76 0.20 -0.12 0.00 -0.16 0.00 0.00 28.75 30.43 1rfl h GLU 106 CO -0.06 1.24 0.13 1.51 -1.18 0.00 0.00 179.01 180.65 1rfl n ILE 107 N -4.04 2.97 -0.06 2.32 0.00 0.12 -4.22 119.36 116.45 1rfl n ILE 107 Ca -0.12 -2.01 -0.04 0.00 0.00 0.00 0.00 62.75 60.57 1rfl n ILE 107 Cb 0.82 -1.65 -0.01 0.00 0.00 0.00 0.00 39.64 38.80 1rfl n ILE 107 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.55 177.34 1rfl n TRP 108 N 1.30 0.57 1.01 9.51 5.03 -1.00 -3.85 117.44 130.00 1rfl n TRP 108 Ca 0.38 0.25 0.11 0.00 3.03 0.00 0.00 57.50 61.26 1rfl n TRP 108 Cb 0.66 -0.60 0.55 0.00 -1.03 0.00 0.00 31.31 30.89 1rfl n TRP 108 CO 0.00 0.00 0.00 -0.35 -0.03 0.00 0.00 177.69 177.31 1rfl n PRO 109 N -4.09 0.26 -0.05 -0.99 -0.04 -1.26 -3.18 135.00 125.65 1rfl n PRO 109 Ca -0.07 0.08 -0.14 0.00 -0.04 0.00 0.00 63.50 63.33 1rfl n PRO 109 Cb 0.25 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.09 1rfl n PRO 109 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1rfl h GLU 110 N 0.00 0.04 -0.84 0.54 4.39 -1.78 -3.33 114.58 113.60 1rfl h GLU 110 Ca 0.00 -0.06 0.19 0.00 0.34 0.00 0.00 59.36 59.83 1rfl h GLU 110 Cb 0.25 0.02 -0.15 0.00 -0.10 0.00 0.00 28.75 28.76 1rfl h GLU 110 CO 0.00 0.96 -0.08 0.35 -1.16 0.00 0.00 179.01 179.08 1rfl h PHE 111 N -0.85 -0.22 -3.55 4.33 3.04 -1.65 -3.30 116.94 114.74 1rfl h PHE 111 Ca -0.01 0.07 -0.66 0.00 3.98 0.00 0.00 57.97 61.35 1rfl h PHE 111 Cb 1.00 0.23 -0.15 0.00 2.56 0.00 0.00 35.95 39.58 1rfl h PHE 111 CO 0.25 -0.33 0.14 0.96 -2.02 0.00 0.00 178.31 177.30 1rfl s ILE 112 N -6.15 4.81 0.12 1.41 -5.25 -1.25 -4.97 121.20 109.93 1rfl s ILE 112 Ca -0.14 0.06 -0.24 0.00 -0.99 0.00 0.00 60.65 59.34 1rfl s ILE 112 Cb 0.24 -4.23 0.08 0.00 2.95 0.00 0.00 42.46 41.51 1rfl s ILE 112 CO 0.76 -0.64 1.10 0.00 -1.79 0.00 0.00 174.94 174.38 1rfl s ALA 113 N 2.85 -1.84 -0.34 2.27 0.00 -1.24 -4.89 121.76 118.55 1rfl s ALA 113 Ca 0.22 -0.13 0.08 0.00 0.00 0.00 0.00 51.96 52.14 1rfl s ALA 113 Cb -0.14 0.74 0.45 0.00 0.00 0.00 0.00 23.12 24.17 1rfl s ALA 113 CO 0.18 -1.08 1.14 0.54 0.00 0.00 0.00 175.76 176.54 1rfl n ARG 114 N -0.70 3.26 -3.49 0.00 1.74 -1.26 -5.03 116.66 111.18 1rfl n ARG 114 Ca -0.02 -4.19 -0.15 0.00 -0.77 0.00 0.00 57.85 52.72 1rfl n ARG 114 Cb 0.60 -2.16 -0.04 0.00 -1.02 0.00 0.00 32.46 29.84 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 -3.57 -0.54 0.61 0.55 -0.00 -1.26 -5.04 118.68 109.42 1rfl s LEU 115 Ca 0.47 0.35 -0.15 0.00 -0.00 0.00 0.00 54.13 54.80 1rfl s LEU 115 Cb 0.40 2.51 -0.03 0.00 -0.00 0.00 0.00 46.19 49.07 1rfl s LEU 115 CO -0.05 -0.77 1.05 -2.16 -0.00 0.00 0.00 176.35 174.42 1rfl s PRO 116 N -2.42 3.31 -0.22 1.48 0.04 -1.25 -4.94 135.00 130.99 1rfl s PRO 116 Ca -0.05 1.13 -0.04 0.00 0.04 0.00 0.00 61.00 62.08 1rfl s PRO 116 Cb -0.01 -2.03 0.09 0.00 0.04 0.00 0.00 34.50 32.59 1rfl s PRO 116 CO -0.01 -0.81 0.17 0.00 0.04 0.00 0.00 177.00 176.39 1rfl s ALA 117 N -2.59 0.09 1.25 8.56 0.00 -1.26 -2.45 121.76 125.37 1rfl s ALA 117 Ca 0.62 -0.27 -0.17 0.00 0.00 0.00 0.00 51.96 52.14 1rfl s ALA 117 Cb -0.15 -1.32 0.25 0.00 0.00 0.00 0.00 23.12 21.90 1rfl s ALA 117 CO 0.40 -1.36 0.77 0.36 0.00 0.00 0.00 175.76 175.93 1rfl n LYS 118 N 5.29 -3.15 -3.64 0.00 -0.00 -0.56 -1.86 118.16 114.24 1rfl n LYS 118 Ca -0.06 -1.25 0.01 0.00 -0.00 0.00 0.00 58.31 57.02 1rfl n LYS 118 Cb 0.47 -1.30 -0.06 0.00 -0.00 0.00 0.00 35.03 34.14 1rfl n LYS 118 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 1rfl s LEU 119 N 0.00 -0.21 1.07 -5.58 0.20 -0.99 -3.77 118.68 109.40 1rfl s LEU 119 Ca 0.53 0.34 -0.17 0.00 0.69 0.00 0.00 54.13 55.51 1rfl s LEU 119 Cb -0.06 1.31 0.24 0.00 -0.43 0.00 0.00 46.19 47.24 1rfl s LEU 119 CO 0.41 -0.05 1.21 -2.16 -0.29 0.00 0.00 176.35 175.47 1rfl s PRO 120 N 1.18 -0.18 0.00 0.98 0.04 -1.26 -3.25 135.00 132.50 1rfl s PRO 120 Ca -0.08 -0.21 0.00 0.00 0.04 0.00 0.00 61.00 60.75 1rfl s PRO 120 Cb -0.03 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 32.78 1rfl s PRO 120 CO -0.12 -3.00 0.00 0.44 0.04 0.00 0.00 177.00 174.37 1rfl n ILE 121 N -4.22 0.00 -0.90 0.56 -5.35 -1.26 -4.80 119.36 103.39 1rfl n ILE 121 Ca 0.14 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.62 1rfl n ILE 121 Cb 0.59 -0.42 0.00 0.00 -1.74 0.00 0.00 39.64 38.07 1rfl n ILE 121 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 1rfl n THR 122 N -2.21 -3.37 -2.40 7.28 -1.04 -1.26 -4.49 114.28 106.79 1rfl n THR 122 Ca 0.00 1.32 -0.37 0.00 -2.04 0.00 0.00 64.05 62.96 1rfl n THR 122 Cb 0.07 -2.02 0.02 0.00 -1.82 0.00 0.00 70.33 66.58 1rfl n THR 122 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 1rfl n VAL 123 N -0.44 4.30 -1.34 12.58 3.14 -1.26 -4.94 118.33 130.36 1rfl n VAL 123 Ca 0.00 -5.19 -0.40 0.00 -2.96 0.00 0.00 64.34 55.79 1rfl n VAL 123 Cb 0.00 -1.38 0.01 0.00 -1.06 0.00 0.00 33.84 31.41 1rfl n VAL 123 CO 0.00 0.00 0.00 0.55 -6.46 0.00 0.00 176.83 170.92 1rfl n VAL 124 N -0.31 0.93 -0.12 1.55 3.14 -1.26 -4.82 118.33 117.43 1rfl n VAL 124 Ca 0.46 -0.50 -0.03 0.00 -2.96 0.00 0.00 64.34 61.31 1rfl n VAL 124 Cb 0.32 -0.25 -0.03 0.00 -1.06 0.00 0.00 33.84 32.82 1rfl n VAL 124 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1rfl n ARG 125 N 0.95 -0.13 -1.41 1.45 5.12 -1.26 -4.19 116.66 117.19 1rfl n ARG 125 Ca 0.10 1.15 -0.48 0.00 -1.93 0.00 0.00 57.85 56.69 1rfl n ARG 125 Cb 0.45 -1.71 -0.13 0.00 -1.16 0.00 0.00 32.46 29.91 1rfl n ARG 125 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1rfl n ASN 126 N -3.66 0.69 0.06 0.55 3.02 -1.26 -4.80 115.26 109.86 1rfl n ASN 126 Ca 0.01 0.34 -0.02 0.00 -0.03 0.00 0.00 54.58 54.87 1rfl n ASN 126 Cb 0.08 -0.97 -0.01 0.00 -0.61 0.00 0.00 39.78 38.26 1rfl n ASN 126 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1rfl h LYS 127 N 11.36 -0.15 -5.18 3.52 3.64 -1.95 -3.36 116.57 124.45 1rfl h LYS 127 Ca -0.09 0.01 -0.23 0.00 -1.27 0.00 0.00 60.65 59.07 1rfl h LYS 127 Cb 1.35 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.20 1rfl h LYS 127 CO 1.24 -0.10 0.70 0.00 -2.27 0.00 0.00 179.45 179.02 1rfl n ALA 128 N -2.12 1.09 0.00 5.00 0.00 -1.26 -2.37 120.51 120.85 1rfl n ALA 128 Ca -0.02 -2.65 0.00 0.00 0.00 0.00 0.00 53.44 50.77 1rfl n ALA 128 Cb 0.06 -3.45 0.00 0.00 0.00 0.00 0.00 19.45 16.06 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 16.06 0.00 0.26 0.00 10.43 -1.26 -4.92 116.55 137.13 1rfl n ASP 129 Ca 0.44 0.00 0.10 0.00 2.57 0.00 0.00 54.79 57.89 1rfl n ASP 129 Cb 0.46 0.15 0.70 0.00 1.84 0.00 0.00 41.12 44.27 1rfl n ASP 129 CO 0.00 0.00 0.00 0.16 -1.07 0.00 0.00 177.20 176.29 1rfl h ILE 130 N 0.00 0.86 0.34 0.53 3.07 -1.61 -2.98 117.51 117.72 1rfl h ILE 130 Ca 0.00 -0.17 -0.02 0.00 1.55 0.00 0.00 64.86 66.23 1rfl h ILE 130 Cb 0.00 1.09 0.00 0.00 -0.27 0.00 0.00 36.82 37.65 1rfl h ILE 130 CO 0.00 0.04 -0.18 0.74 -1.05 0.00 0.00 178.15 177.70 1rfl h THR 131 N 0.00 0.00 0.00 0.16 2.02 -1.92 0.12 112.91 113.29 1rfl h THR 131 Ca -0.00 0.00 -0.35 0.00 0.77 0.00 0.00 66.41 66.83 1rfl h THR 131 Cb 0.09 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.50 1rfl h THR 131 CO 0.01 0.00 2.05 0.61 0.37 0.00 0.00 175.52 178.55 1rfl n GLY 132 N -1.24 3.08 0.96 2.16 0.00 -1.12 -3.02 105.19 106.01 1rfl n GLY 132 Ca -0.06 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1rfl n GLY 132 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1rfl n GLU 133 N 3.65 0.00 0.00 1.61 4.07 -1.18 -4.91 120.64 123.89 1rfl n GLU 133 Ca 0.46 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.56 1rfl n GLU 133 Cb 0.29 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.67 1rfl n GLU 133 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48 1rfl n THR 134 N -2.60 0.00 0.24 6.31 -1.04 0.39 -1.03 114.28 116.56 1rfl n THR 134 Ca 0.00 1.38 -0.16 0.00 -2.04 0.00 0.00 64.05 63.23 1rfl n THR 134 Cb 0.00 -2.38 -0.08 0.00 -1.82 0.00 0.00 70.33 66.06 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 -0.65 -0.25 -4.42 3.38 -1.76 -3.16 115.31 108.45 1rfl h LEU 135 Ca 0.00 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1rfl h LEU 135 Cb 0.00 0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1rfl h LEU 135 CO 0.00 -0.41 -0.16 1.23 0.09 0.00 0.00 178.44 179.19 1rfl h GLY 136 N -0.64 -2.10 -7.21 0.83 0.00 -1.70 -3.26 103.07 88.99 1rfl h GLY 136 Ca -0.04 1.01 -0.02 0.00 0.00 0.00 0.00 47.33 48.29 1rfl h GLY 136 CO 0.04 -0.70 0.12 -0.13 0.00 0.00 0.00 176.54 175.87 1rfl n MET 137 N -3.60 0.34 -3.20 4.80 0.00 -0.20 -4.69 117.12 110.57 1rfl n MET 137 Ca 0.00 -1.12 -0.23 0.00 -0.00 0.00 0.00 57.70 56.35 1rfl n MET 137 Cb 0.08 -3.60 -0.06 0.00 0.00 0.00 0.00 33.22 29.63 1rfl n MET 137 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 1rfl n SER 138 N 18.29 0.75 -0.03 6.12 7.64 -1.23 -4.88 113.62 140.28 1rfl n SER 138 Ca 0.44 -2.85 -0.01 0.00 1.01 0.00 0.00 58.87 57.46 1rfl n SER 138 Cb 0.43 -0.64 -0.00 0.00 -1.01 0.00 0.00 64.21 62.99 1rfl n SER 138 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1rfl h GLU 139 N 3.78 0.00 -5.78 1.43 5.08 -1.93 -3.47 114.58 113.69 1rfl h GLU 139 Ca 0.09 0.00 -0.65 0.00 -1.00 0.00 0.00 59.36 57.80 1rfl h GLU 139 Cb 0.87 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.06 1rfl h GLU 139 CO 0.51 0.00 -0.42 0.54 -1.00 0.00 0.00 179.01 178.64 1rfl s VAL 140 N -1.46 5.39 0.19 3.13 0.11 -1.26 -5.00 120.40 121.49 1rfl s VAL 140 Ca -0.04 0.21 -0.19 0.00 -2.93 0.00 0.00 61.98 59.04 1rfl s VAL 140 Cb 0.01 -3.50 0.14 0.00 -1.53 0.00 0.00 36.38 31.49 1rfl s VAL 140 CO 0.05 0.50 1.61 -1.13 -3.33 0.00 0.00 175.10 172.80 1rfl h ASN 141 N 4.49 -0.90 -3.95 3.54 -1.24 -1.94 -3.48 115.58 112.10 1rfl h ASN 141 Ca -0.52 0.20 0.00 0.00 0.71 0.00 0.00 56.30 56.68 1rfl h ASN 141 Cb 1.21 0.47 0.00 0.00 0.73 0.00 0.00 38.32 40.74 1rfl h ASN 141 CO 0.62 -0.27 -0.71 0.61 -1.29 0.00 0.00 177.43 176.39 1rfl n GLY 142 N -1.42 -3.94 0.36 1.57 0.00 -1.26 -4.61 105.19 95.89 1rfl n GLY 142 Ca 0.04 -0.91 -0.10 0.00 0.00 0.00 0.00 46.02 45.05 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 0.56 -1.56 -0.78 1.61 -0.00 -1.66 -3.44 115.15 109.87 1rfl h HIS 143 Ca 0.00 0.10 0.00 0.00 -0.00 0.00 0.00 60.37 60.47 1rfl h HIS 143 Cb 0.45 0.78 0.00 0.00 -0.00 0.00 0.00 27.41 28.63 1rfl h HIS 143 CO 0.04 -0.34 0.00 0.00 -0.00 0.00 0.00 177.93 177.63 1rfl n ALA 144 N -3.16 0.00 -3.57 5.26 0.00 -1.26 -4.94 120.51 112.83 1rfl n ALA 144 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.22 1rfl n ALA 144 Cb 0.24 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.52 1rfl n ALA 144 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1rfl s LEU 145 N 0.00 1.44 -0.19 0.00 1.43 -1.26 -2.35 118.68 117.75 1rfl s LEU 145 Ca 0.00 -0.21 -0.04 0.00 -1.03 0.00 0.00 54.13 52.85 1rfl s LEU 145 Cb 0.00 -0.64 0.09 0.00 0.03 0.00 0.00 46.19 45.67 1rfl s LEU 145 CO 0.00 -0.02 0.23 0.27 0.23 0.00 0.00 176.35 177.06 1rfl s ILE 146 N 0.88 -0.35 0.57 -0.59 -4.36 -1.20 -5.00 121.20 111.16 1rfl s ILE 146 Ca -0.11 -0.05 -0.18 0.00 -0.26 0.00 0.00 60.65 60.05 1rfl s ILE 146 Cb -0.15 -0.64 -0.05 0.00 1.25 0.00 0.00 42.46 42.88 1rfl s ILE 146 CO 0.01 -0.15 1.11 0.00 0.24 0.00 0.00 174.94 176.15 1rfl s ARG 147 N 2.35 3.26 0.00 0.37 1.04 -1.26 -4.04 118.95 120.66 1rfl s ARG 147 Ca 0.06 1.50 0.00 0.00 -1.04 0.00 0.00 55.73 56.25 1rfl s ARG 147 Cb -0.15 -2.00 0.00 0.00 -2.04 0.00 0.00 34.95 30.75 1rfl s ARG 147 CO -0.12 -0.90 0.00 1.47 -0.04 0.00 0.00 175.30 175.72 1rfl n LEU 148 N -1.60 0.00 0.00 -1.89 -0.00 -1.26 -4.48 117.00 107.77 1rfl n LEU 148 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.12 1rfl n LEU 148 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.94 1rfl n LEU 148 CO 0.44 0.00 0.00 -1.54 -0.00 0.00 0.00 177.39 176.29 1rfl n SER 149 N -0.49 0.72 -0.07 1.45 3.41 -0.88 -4.60 113.62 113.15 1rfl n SER 149 Ca 0.00 -0.52 -0.15 0.00 -0.26 0.00 0.00 58.87 57.94 1rfl n SER 149 Cb 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 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 -3.00 1.89 -0.08 7.33 0.00 -1.26 -4.58 120.51 120.81 1rfl n ALA 150 Ca 0.00 -0.62 -0.09 0.00 0.00 0.00 0.00 53.44 52.72 1rfl n ALA 150 Cb 0.00 0.25 -0.10 0.00 0.00 0.00 0.00 19.45 19.60 1rfl n ALA 150 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1rfl n ARG 151 N -3.81 1.15 0.10 0.00 1.85 -1.26 -4.35 116.66 110.35 1rfl n ARG 151 Ca -0.27 0.04 0.09 0.00 -1.00 0.00 0.00 57.85 56.71 1rfl n ARG 151 Cb 0.64 -1.36 0.42 0.00 -1.05 0.00 0.00 32.46 31.11 1rfl n ARG 151 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1rfl n THR 152 N -2.74 1.12 0.00 8.89 -1.04 -1.26 -4.89 114.28 114.35 1rfl n THR 152 Ca -0.27 0.45 0.00 0.00 -2.04 0.00 0.00 64.05 62.19 1rfl n THR 152 Cb 0.91 -1.40 0.00 0.00 -1.82 0.00 0.00 70.33 68.03 1rfl n THR 152 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1rfl n GLY 153 N -0.70 1.63 5.00 3.41 0.00 -1.26 -4.87 105.19 108.40 1rfl n GLY 153 Ca 0.01 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1rfl n GLY 153 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1rfl n GLU 154 N 0.00 0.00 0.00 1.61 4.07 -1.26 -2.07 120.64 122.99 1rfl n GLU 154 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1rfl n GLU 154 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1rfl n GLU 154 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1rfl n GLY 155 N 0.00 0.46 5.29 8.31 0.00 -1.26 -4.84 105.19 113.15 1rfl n GLY 155 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 0.00 -0.30 1.61 0.31 -1.26 -2.11 118.33 116.58 1rfl n VAL 156 Ca 0.00 0.00 0.13 0.00 -0.01 0.00 0.00 64.34 64.46 1rfl n VAL 156 Cb 0.00 0.00 0.30 0.00 -0.91 0.00 0.00 33.84 33.23 1rfl n VAL 156 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1rfl h ASP 157 N 0.00 0.32 0.00 4.52 1.82 -1.94 0.33 116.42 121.47 1rfl h ASP 157 Ca 0.00 0.15 0.00 0.00 -0.39 0.00 0.00 57.03 56.79 1rfl h ASP 157 Cb 0.00 0.14 0.00 0.00 0.68 0.00 0.00 39.33 40.15 1rfl h ASP 157 CO 0.00 0.00 0.00 0.52 -1.61 0.00 0.00 179.24 178.15 1rfl n VAL 158 N -5.05 0.00 -0.35 2.25 0.31 -0.90 -1.25 118.33 113.35 1rfl n VAL 158 Ca 0.22 1.00 0.24 0.00 -0.01 0.00 0.00 64.34 65.78 1rfl n VAL 158 Cb 0.64 -1.69 0.48 0.00 -0.91 0.00 0.00 33.84 32.36 1rfl n VAL 158 CO 0.00 0.00 0.00 0.17 -1.32 0.00 0.00 176.83 175.68 1rfl h LEU 159 N 0.00 0.51 -0.76 7.52 8.10 -1.76 0.44 115.31 129.37 1rfl h LEU 159 Ca 0.00 0.15 0.09 0.00 0.11 0.00 0.00 57.88 58.23 1rfl h LEU 159 Cb 0.00 0.08 -0.12 0.00 -0.44 0.00 0.00 40.66 40.18 1rfl h LEU 159 CO 0.00 -0.03 -0.50 -0.09 -4.11 0.00 0.00 178.44 173.71 1rfl h ARG 160 N 0.38 -0.14 -0.78 0.17 2.43 0.68 0.92 114.38 118.04 1rfl h ARG 160 Ca 0.69 0.01 0.18 0.00 -0.81 0.00 0.00 59.98 60.05 1rfl h ARG 160 Cb 1.63 0.03 -0.12 0.00 -0.42 0.00 0.00 29.97 31.09 1rfl h ARG 160 CO -0.48 -0.09 0.17 -0.97 -1.51 0.00 0.00 179.97 177.09 1rfl h ASN 161 N -0.14 -0.03 0.44 -3.80 -0.73 0.51 1.41 115.58 113.25 1rfl h ASN 161 Ca 0.19 0.17 -0.06 0.00 1.87 0.00 0.00 56.30 58.46 1rfl h ASN 161 Cb 0.53 0.23 -0.01 0.00 0.27 0.00 0.00 38.32 39.34 1rfl h ASN 161 CO -0.81 -0.08 -0.30 0.45 -0.37 0.00 0.00 177.43 176.32 1rfl h HIS 162 N 0.24 0.00 0.00 0.67 3.86 0.23 0.16 115.15 120.30 1rfl h HIS 162 Ca 0.45 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.64 1rfl h HIS 162 Cb 0.81 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.28 1rfl h HIS 162 CO -0.28 0.30 -0.11 1.25 0.86 0.00 0.00 177.93 179.95 1rfl h LEU 163 N 0.00 0.00 0.00 2.43 7.12 0.85 -2.71 115.31 122.99 1rfl h LEU 163 Ca -0.00 0.00 -0.09 0.00 0.13 0.00 0.00 57.88 57.91 1rfl h LEU 163 Cb 0.60 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.71 1rfl h LEU 163 CO 0.04 0.11 -0.91 1.17 -0.13 0.00 0.00 178.44 178.71 1rfl n LYS 164 N -3.25 0.50 -0.47 1.25 3.00 -0.02 -4.13 118.16 115.04 1rfl n LYS 164 Ca 0.00 0.48 0.39 0.00 -0.00 0.00 0.00 58.31 59.19 1rfl n LYS 164 Cb 0.36 -1.66 0.67 0.00 0.00 0.00 0.00 35.03 34.40 1rfl n LYS 164 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.40 177.77 1rfl h GLN 165 N -1.00 0.05 -0.34 1.64 5.75 -0.78 1.42 115.11 121.85 1rfl h GLN 165 Ca -0.14 -0.00 0.01 0.00 -0.15 0.00 0.00 58.65 58.37 1rfl h GLN 165 Cb 0.86 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.38 1rfl h GLN 165 CO -0.09 0.03 0.20 0.77 -2.65 0.00 0.00 178.83 177.09 1rfl h SER 166 N 0.05 0.32 -1.44 -0.69 0.02 -1.65 -3.42 113.55 106.74 1rfl h SER 166 Ca 0.85 0.00 -0.72 0.00 -0.84 0.00 0.00 61.79 61.09 1rfl h SER 166 Cb 2.75 -0.06 0.01 0.00 0.14 0.00 0.00 62.40 65.24 1rfl h SER 166 CO -0.40 0.23 1.04 0.23 -1.14 0.00 0.00 176.83 176.80 1rfl n MET 167 N -4.90 1.20 -3.83 3.45 2.81 0.49 -4.94 117.12 111.41 1rfl n MET 167 Ca -0.00 0.42 -0.21 0.00 -1.81 0.00 0.00 57.70 56.10 1rfl n MET 167 Cb 0.06 -2.21 -0.02 0.00 -0.71 0.00 0.00 33.22 30.34 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 4.46 1.29 -0.48 3.03 0.00 -1.26 -4.83 107.32 109.53 1rfl s GLY 168 Ca 1.01 -1.24 -0.36 0.00 0.00 0.00 0.00 44.72 44.14 1rfl s GLY 168 CO 0.61 -1.23 2.27 0.29 0.00 0.00 0.00 173.10 175.04 1rfl n ILE 169 N -1.49 0.10 -3.65 0.90 -5.35 -1.26 -3.40 119.36 105.21 1rfl n ILE 169 Ca -0.07 -0.22 -0.03 0.00 -0.27 0.00 0.00 62.75 62.16 1rfl n ILE 169 Cb 0.57 -1.36 -0.07 0.00 -1.74 0.00 0.00 39.64 37.04 1rfl n ILE 169 CO 0.00 0.00 0.00 -1.00 -1.76 0.00 0.00 176.55 173.79 1rfl s HIS 170 N 7.71 -0.08 -0.07 4.28 3.76 -1.26 -4.92 115.29 124.71 1rfl s HIS 170 Ca 1.14 0.18 0.04 0.00 -0.15 0.00 0.00 55.06 56.27 1rfl s HIS 170 Cb -0.98 0.48 -0.02 0.00 1.11 0.00 0.00 32.58 33.17 1rfl s HIS 170 CO 0.50 -0.04 -0.18 0.50 -0.85 0.00 0.00 174.74 174.68 1rfl s ARG 171 N -0.07 2.68 0.00 1.40 3.00 -1.26 0.11 118.95 124.81 1rfl s ARG 171 Ca 0.07 -0.76 0.00 0.00 -1.00 0.00 0.00 55.73 54.04 1rfl s ARG 171 Cb -0.05 -2.35 0.00 0.00 0.00 0.00 0.00 34.95 32.55 1rfl s ARG 171 CO -0.14 0.47 0.00 -3.47 0.00 0.00 0.00 175.30 172.15