#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 0.71 0.06 1.61 3.41 -1.26 -4.47 113.62 113.68 1rfl n SER 2 Ca 0.00 -0.62 0.00 0.00 -0.26 0.00 0.00 58.87 57.99 1rfl n SER 2 Cb 0.00 -1.17 0.00 0.00 -0.26 0.00 0.00 64.21 62.78 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 12.69 0.63 0.00 1.04 4.77 -1.26 -5.09 117.00 129.78 1rfl n LEU 3 Ca 0.55 0.19 -0.14 0.00 -0.03 0.00 0.00 56.01 56.57 1rfl n LEU 3 Cb 0.29 -0.11 0.12 0.00 -2.33 0.00 0.00 43.42 41.38 1rfl n LEU 3 CO 0.82 -0.72 0.30 0.18 -1.33 0.00 0.00 177.39 176.64 1rfl n LEU 4 N -3.31 0.00 -3.68 2.23 7.99 -1.26 -5.09 117.00 113.89 1rfl n LEU 4 Ca 0.00 -0.56 -0.14 0.00 -0.01 0.00 0.00 56.01 55.30 1rfl n LEU 4 Cb 0.00 -0.48 -0.08 0.00 -0.11 0.00 0.00 43.42 42.75 1rfl n LEU 4 CO 0.00 -1.52 0.25 -0.13 -1.51 0.00 0.00 177.39 174.48 1rfl s ARG 5 N -4.19 0.69 0.42 3.23 0.52 -1.26 -5.18 118.95 113.17 1rfl s ARG 5 Ca 0.34 0.69 0.07 0.00 -0.52 0.00 0.00 55.73 56.31 1rfl s ARG 5 Cb -0.03 0.33 -0.07 0.00 0.52 0.00 0.00 34.95 35.70 1rfl s ARG 5 CO 0.26 -0.10 0.07 -1.21 0.02 0.00 0.00 175.30 174.33 1rfl s GLU 6 N 0.11 2.05 0.00 3.54 0.41 -1.26 -3.86 118.70 119.69 1rfl s GLU 6 Ca -0.01 -2.04 0.00 0.00 -0.41 0.00 0.00 54.97 52.51 1rfl s GLU 6 Cb -0.04 -1.75 0.00 0.00 -1.78 0.00 0.00 34.13 30.57 1rfl s GLU 6 CO 0.02 -0.09 0.00 0.41 -0.49 0.00 0.00 175.26 175.11 1rfl n GLY 7 N -1.07 1.66 3.50 -1.39 0.00 -1.19 -4.71 105.19 101.99 1rfl n GLY 7 Ca -0.04 0.43 -0.10 0.00 0.00 0.00 0.00 46.02 46.31 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 1.36 0.21 1.61 1.75 -1.26 -4.37 119.30 118.60 1rfl s MET 8 Ca 0.00 -0.74 0.07 0.00 -1.25 0.00 0.00 55.69 53.78 1rfl s MET 8 Cb 0.00 0.55 -0.04 0.00 2.84 0.00 0.00 34.83 38.18 1rfl s MET 8 CO 0.00 -0.58 0.06 -1.59 -0.65 0.00 0.00 175.02 172.26 1rfl s LYS 9 N -3.83 2.57 -0.01 4.11 0.00 -1.26 -4.97 119.74 116.34 1rfl s LYS 9 Ca 0.06 -1.14 -0.05 0.00 0.00 0.00 0.00 55.97 54.85 1rfl s LYS 9 Cb -0.01 -2.40 0.00 0.00 0.00 0.00 0.00 37.83 35.42 1rfl s LYS 9 CO -0.06 0.42 0.10 0.54 0.00 0.00 0.00 175.35 176.35 1rfl s VAL 10 N -1.97 0.05 0.09 1.79 0.11 -1.26 -4.36 120.40 114.85 1rfl s VAL 10 Ca 0.30 -0.45 0.09 0.00 -2.93 0.00 0.00 61.98 58.99 1rfl s VAL 10 Cb -0.08 -0.30 -0.04 0.00 -1.53 0.00 0.00 36.38 34.43 1rfl s VAL 10 CO 0.21 -0.25 -0.20 0.54 -3.33 0.00 0.00 175.10 172.07 1rfl s VAL 11 N -0.82 2.65 -0.54 2.04 0.11 -1.21 -4.93 120.40 117.70 1rfl s VAL 11 Ca -0.09 -1.44 0.06 0.00 -2.93 0.00 0.00 61.98 57.58 1rfl s VAL 11 Cb -0.05 -2.16 0.22 0.00 -1.53 0.00 0.00 36.38 32.86 1rfl s VAL 11 CO 0.01 0.20 0.57 -0.38 -3.33 0.00 0.00 175.10 172.17 1rfl n ILE 12 N 1.15 0.77 -1.73 7.04 5.41 -1.26 -2.27 119.36 128.48 1rfl n ILE 12 Ca -0.16 -4.52 -0.31 0.00 1.00 0.00 0.00 62.75 58.76 1rfl n ILE 12 Cb 0.52 -2.01 0.03 0.00 -0.71 0.00 0.00 39.64 37.48 1rfl n ILE 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1rfl s ALA 13 N -1.51 2.87 0.00 -1.39 0.00 -1.26 -4.91 121.76 115.56 1rfl s ALA 13 Ca 0.35 -0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.28 1rfl s ALA 13 Cb 0.10 -3.12 0.00 0.00 0.00 0.00 0.00 23.12 20.10 1rfl s ALA 13 CO -0.10 -0.98 0.00 0.41 0.00 0.00 0.00 175.76 175.09 1rfl n GLY 14 N -2.40 2.04 3.78 0.00 0.00 -1.26 -3.43 105.19 103.92 1rfl n GLY 14 Ca 0.07 -1.04 -0.33 0.00 0.00 0.00 0.00 46.02 44.72 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 -2.00 2.86 0.43 1.61 1.70 -1.26 -5.01 118.95 117.28 1rfl s ARG 15 Ca 0.00 1.29 -0.23 0.00 -0.47 0.00 0.00 55.73 56.33 1rfl s ARG 15 Cb 0.00 -1.96 -0.09 0.00 -0.57 0.00 0.00 34.95 32.33 1rfl s ARG 15 CO 0.00 -1.19 1.05 -1.25 -1.08 0.00 0.00 175.30 172.83 1rfl s PRO 16 N -4.25 4.02 -0.51 3.89 0.04 -1.26 -4.28 135.00 132.65 1rfl s PRO 16 Ca 0.65 1.46 -0.09 0.00 0.04 0.00 0.00 61.00 63.06 1rfl s PRO 16 Cb -0.19 -2.37 0.01 0.00 0.04 0.00 0.00 34.50 31.99 1rfl s PRO 16 CO 0.43 -0.26 0.59 0.09 0.04 0.00 0.00 177.00 177.90 1rfl n ASN 17 N -0.41 -7.48 0.00 6.66 4.13 -1.26 -4.96 115.26 111.94 1rfl n ASN 17 Ca 0.07 0.27 0.00 0.00 1.68 0.00 0.00 54.58 56.60 1rfl n ASN 17 Cb 0.51 -5.06 0.00 0.00 -1.54 0.00 0.00 39.78 33.69 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 -0.88 1.11 0.00 5.41 0.00 -1.26 -5.04 120.51 119.85 1rfl n ALA 18 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1rfl n ALA 18 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 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 -0.32 -0.33 0.04 0.00 0.00 -1.26 -4.90 105.19 98.42 1rfl n GLY 19 Ca 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 46.02 45.96 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 0.00 0.12 0.18 1.61 2.85 -1.26 -4.29 118.16 117.38 1rfl n LYS 20 Ca 0.00 0.03 -0.13 0.00 -1.05 0.00 0.00 58.31 57.16 1rfl n LYS 20 Cb 0.00 -1.09 -0.08 0.00 -0.65 0.00 0.00 35.03 33.21 1rfl n LYS 20 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 177.40 178.12 1rfl h SER 21 N -0.00 -0.41 -0.60 -5.58 0.02 -1.99 -1.15 113.55 103.84 1rfl h SER 21 Ca -0.11 -0.15 0.04 0.00 -0.84 0.00 0.00 61.79 60.73 1rfl h SER 21 Cb 1.17 0.11 -0.04 0.00 0.14 0.00 0.00 62.40 63.77 1rfl h SER 21 CO -0.02 -0.03 0.34 0.28 -1.14 0.00 0.00 176.83 176.26 1rfl h SER 22 N -0.86 0.53 -0.38 3.07 0.02 -1.94 -1.83 113.55 112.16 1rfl h SER 22 Ca -0.05 0.02 0.06 0.00 -0.84 0.00 0.00 61.79 60.98 1rfl h SER 22 Cb 0.53 -0.09 -0.05 0.00 0.14 0.00 0.00 62.40 62.93 1rfl h SER 22 CO 0.08 0.36 0.06 0.25 -1.14 0.00 0.00 176.83 176.44 1rfl h LEU 23 N 0.65 -0.03 -0.48 5.07 7.12 -1.74 -1.39 115.31 124.52 1rfl h LEU 23 Ca 0.25 0.07 0.10 0.00 0.13 0.00 0.00 57.88 58.43 1rfl h LEU 23 Cb 0.10 0.10 -0.09 0.00 -0.53 0.00 0.00 40.66 40.24 1rfl h LEU 23 CO -0.14 0.02 -0.11 0.25 -0.13 0.00 0.00 178.44 178.33 1rfl h LEU 24 N 0.18 -0.44 -0.71 2.25 5.85 -0.39 0.12 115.31 122.17 1rfl h LEU 24 Ca 0.18 0.14 0.12 0.00 0.84 0.00 0.00 57.88 59.17 1rfl h LEU 24 Cb 0.23 0.29 -0.13 0.00 0.37 0.00 0.00 40.66 41.42 1rfl h LEU 24 CO -0.26 -0.15 -0.34 0.78 -0.34 0.00 0.00 178.44 178.13 1rfl h ASN 25 N 0.01 -1.19 0.98 1.25 2.35 -0.67 -1.04 115.58 117.26 1rfl h ASN 25 Ca 0.23 0.25 -0.05 0.00 -0.55 0.00 0.00 56.30 56.18 1rfl h ASN 25 Cb 0.35 0.61 0.01 0.00 0.05 0.00 0.00 38.32 39.35 1rfl h ASN 25 CO -0.49 -0.30 -0.48 0.00 -1.65 0.00 0.00 177.43 174.51 1rfl h ALA 26 N 1.16 -1.36 0.00 -0.83 0.00 -0.79 -1.65 119.26 115.79 1rfl h ALA 26 Ca 0.27 -0.29 -0.68 0.00 0.00 0.00 0.00 54.91 54.21 1rfl h ALA 26 Cb 0.56 0.53 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1rfl h ALA 26 CO -0.77 -1.26 2.84 -0.11 0.00 0.00 0.00 179.25 179.95 1rfl n LEU 27 N -5.62 5.86 0.00 0.00 0.00 0.23 -3.46 117.00 114.01 1rfl n LEU 27 Ca -0.17 -3.66 0.00 0.00 0.00 0.00 0.00 56.01 52.18 1rfl n LEU 27 Cb 0.53 -1.45 0.00 0.00 0.00 0.00 0.00 43.42 42.50 1rfl n LEU 27 CO 0.40 0.58 0.00 0.00 0.00 0.00 0.00 177.39 178.37 1rfl n ALA 28 N 6.51 0.00 0.00 1.96 0.00 -1.07 -4.75 120.51 123.16 1rfl n ALA 28 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.96 1rfl n ALA 28 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.84 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 0.00 0.54 3.13 0.00 0.00 -0.62 -4.78 105.19 103.45 1rfl n GLY 29 Ca 0.00 -0.98 -0.04 0.00 0.00 0.00 0.00 46.02 45.00 1rfl n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rfl n ARG 30 N 0.00 -0.41 -0.31 1.61 1.74 -1.26 -4.60 116.66 113.42 1rfl n ARG 30 Ca 0.00 0.80 0.31 0.00 -0.77 0.00 0.00 57.85 58.19 1rfl n ARG 30 Cb 0.00 -1.04 0.57 0.00 -1.02 0.00 0.00 32.46 30.97 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 1.11 -0.06 0.00 5.56 -0.58 -1.26 -1.06 120.64 124.35 1rfl n GLU 31 Ca -0.01 1.35 0.00 0.00 -0.42 0.00 0.00 57.16 58.08 1rfl n GLU 31 Cb 0.50 -2.42 0.00 0.00 -0.57 0.00 0.00 31.44 28.95 1rfl n GLU 31 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1rfl n ALA 32 N -2.31 -0.32 -2.02 0.62 0.00 -1.26 -5.02 120.51 110.20 1rfl n ALA 32 Ca 0.37 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.79 1rfl n ALA 32 Cb 1.24 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.68 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 -1.59 -3.29 -3.75 0.00 0.00 -0.22 -5.05 120.51 106.60 1rfl n ALA 33 Ca 0.00 0.75 -0.29 0.00 0.00 0.00 0.00 53.44 53.90 1rfl n ALA 33 Cb 0.00 -1.48 -0.17 0.00 0.00 0.00 0.00 19.45 17.81 1rfl n ALA 33 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1rfl s ILE 34 N -0.48 1.53 0.14 0.00 1.01 -1.26 -5.08 121.20 117.05 1rfl s ILE 34 Ca -0.08 -0.65 0.07 0.00 0.00 0.00 0.00 60.65 59.99 1rfl s ILE 34 Cb 0.01 -1.41 -0.04 0.00 0.01 0.00 0.00 42.46 41.03 1rfl s ILE 34 CO 0.36 0.45 -0.02 0.54 0.00 0.00 0.00 174.94 176.27 1rfl s VAL 35 N 1.12 3.74 -0.11 2.92 0.11 -1.26 -5.12 120.40 121.80 1rfl s VAL 35 Ca -0.03 -1.28 -0.03 0.00 -2.93 0.00 0.00 61.98 57.71 1rfl s VAL 35 Cb -0.14 -2.83 -0.03 0.00 -1.53 0.00 0.00 36.38 31.84 1rfl s VAL 35 CO -0.04 -0.01 0.01 0.42 -3.33 0.00 0.00 175.10 172.15 1rfl s THR 36 N -1.52 4.35 -1.13 5.04 -4.23 -1.26 -5.03 115.64 111.85 1rfl s THR 36 Ca 0.26 -0.22 -0.06 0.00 -1.18 0.00 0.00 61.69 60.49 1rfl s THR 36 Cb -0.10 -2.86 0.28 0.00 1.34 0.00 0.00 72.50 71.15 1rfl s THR 36 CO 0.18 0.57 1.50 -0.67 -0.54 0.00 0.00 174.62 175.65 1rfl n ASP 37 N 2.55 6.02 -4.63 3.99 -0.08 -1.26 -4.98 116.55 118.16 1rfl n ASP 37 Ca -0.18 -3.29 -0.27 0.00 -1.51 0.00 0.00 54.79 49.53 1rfl n ASP 37 Cb 0.53 -1.34 -0.09 0.00 2.34 0.00 0.00 41.12 42.57 1rfl n ASP 37 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 1rfl s ILE 38 N -1.86 3.55 -0.26 5.18 -4.36 -1.26 -5.04 121.20 117.16 1rfl s ILE 38 Ca 0.33 -1.41 -0.05 0.00 -0.26 0.00 0.00 60.65 59.26 1rfl s ILE 38 Cb 0.03 -2.75 -0.16 0.00 1.25 0.00 0.00 42.46 40.84 1rfl s ILE 38 CO 0.06 -0.05 -0.24 0.00 0.24 0.00 0.00 174.94 174.95 1rfl n ALA 39 N 0.13 1.31 -1.56 2.27 0.00 -1.26 -4.97 120.51 116.44 1rfl n ALA 39 Ca -0.11 -1.07 -0.61 0.00 0.00 0.00 0.00 53.44 51.65 1rfl n ALA 39 Cb 0.54 -0.05 -0.08 0.00 0.00 0.00 0.00 19.45 19.86 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 1.86 -0.14 3.61 0.00 0.00 -1.26 -4.81 105.19 104.45 1rfl n GLY 40 Ca -0.48 0.82 -0.43 0.00 0.00 0.00 0.00 46.02 45.92 1rfl n GLY 40 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rfl s THR 41 N 0.71 4.12 -0.18 2.61 -4.23 -1.26 -4.95 115.64 112.46 1rfl s THR 41 Ca 0.94 1.19 -0.29 0.00 -1.18 0.00 0.00 61.69 62.35 1rfl s THR 41 Cb -1.31 -4.34 -0.05 0.00 1.34 0.00 0.00 72.50 68.14 1rfl s THR 41 CO 0.62 -0.74 1.96 -0.89 -0.54 0.00 0.00 174.62 175.03 1rfl s THR 42 N 4.68 3.24 0.27 3.99 2.01 -1.26 -4.85 115.64 123.73 1rfl s THR 42 Ca 0.54 0.27 -0.01 0.00 0.31 0.00 0.00 61.69 62.80 1rfl s THR 42 Cb -0.12 -3.27 0.28 0.00 0.01 0.00 0.00 72.50 69.39 1rfl s THR 42 CO 0.28 -0.13 1.87 -0.09 -0.69 0.00 0.00 174.62 175.86 1rfl h ARG 43 N 12.77 1.09 0.00 4.92 2.43 -1.98 0.52 114.38 134.13 1rfl h ARG 43 Ca -0.40 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 1rfl h ARG 43 Cb 1.21 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 30.51 1rfl h ARG 43 CO 0.98 0.72 0.00 -0.25 -1.51 0.00 0.00 179.97 179.91 1rfl n ASP 44 N -4.53 0.52 0.00 -3.80 9.92 -1.26 -4.32 116.55 113.08 1rfl n ASP 44 Ca 0.17 0.69 0.00 0.00 -0.53 0.00 0.00 54.79 55.12 1rfl n ASP 44 Cb 0.23 -0.78 0.00 0.00 -0.64 0.00 0.00 41.12 39.93 1rfl n ASP 44 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1rfl n VAL 45 N -2.15 0.00 -1.37 2.53 0.31 0.18 -4.47 118.33 113.35 1rfl n VAL 45 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 64.34 63.99 1rfl n VAL 45 Cb 0.10 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 32.88 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 -0.02 -0.23 7.52 7.94 -1.26 -4.57 117.00 126.38 1rfl n LEU 46 Ca 0.00 0.05 0.00 0.00 -1.11 0.00 0.00 56.01 54.95 1rfl n LEU 46 Cb 0.00 -0.78 0.01 0.00 0.53 0.00 0.00 43.42 43.18 1rfl n LEU 46 CO 0.00 -0.77 0.27 0.54 -1.11 0.00 0.00 177.39 176.32 1rfl n ARG 47 N 7.30 0.19 -2.60 1.96 5.12 -1.26 -4.86 116.66 122.50 1rfl n ARG 47 Ca 0.61 -0.86 -0.28 0.00 -1.93 0.00 0.00 57.85 55.39 1rfl n ARG 47 Cb 0.05 -0.57 -0.01 0.00 -1.16 0.00 0.00 32.46 30.77 1rfl n ARG 47 CO 0.00 0.00 0.00 -0.85 -1.93 0.00 0.00 177.63 174.85 1rfl n GLU 48 N -0.08 3.39 -0.07 5.56 0.28 -1.26 -5.08 120.64 123.38 1rfl n GLU 48 Ca 0.01 -4.58 0.01 0.00 -0.16 0.00 0.00 57.16 52.43 1rfl n GLU 48 Cb 0.59 -2.25 -0.00 0.00 1.43 0.00 0.00 31.44 31.20 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 -0.40 -1.49 -3.56 -1.84 8.25 -1.26 -4.62 115.22 110.30 1rfl n HIS 49 Ca 0.37 0.08 -0.29 0.00 -0.26 0.00 0.00 57.72 57.63 1rfl n HIS 49 Cb 0.55 -0.07 -0.12 0.00 1.12 0.00 0.00 29.99 31.47 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 -0.19 0.72 -0.71 1.59 -0.00 -1.26 -5.06 121.20 116.29 1rfl s ILE 50 Ca 0.00 -2.24 -0.28 0.00 -0.00 0.00 0.00 60.65 58.13 1rfl s ILE 50 Cb 0.00 -1.51 -0.14 0.00 -0.00 0.00 0.00 42.46 40.81 1rfl s ILE 50 CO 0.00 -0.99 2.54 1.57 -0.00 0.00 0.00 174.94 178.05 1rfl n HIS 51 N 3.61 1.05 0.00 1.37 -0.00 -1.26 -4.83 115.22 115.16 1rfl n HIS 51 Ca 0.14 0.23 0.00 0.00 0.46 0.00 0.00 57.72 58.54 1rfl n HIS 51 Cb 0.38 -2.51 0.00 0.00 -0.12 0.00 0.00 29.99 27.73 1rfl n HIS 51 CO 0.00 0.00 0.00 -0.89 0.46 0.00 0.00 176.34 175.91 1rfl n ILE 52 N 7.78 0.00 0.00 3.57 -0.00 -1.26 -4.79 119.36 124.67 1rfl n ILE 52 Ca 0.50 0.67 0.00 0.00 -0.00 0.00 0.00 62.75 63.92 1rfl n ILE 52 Cb 0.33 -1.49 0.00 0.00 -0.00 0.00 0.00 39.64 38.47 1rfl n ILE 52 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 1rfl n ASP 53 N -0.32 0.00 0.00 4.38 -0.08 -1.26 -4.53 116.55 114.73 1rfl n ASP 53 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1rfl n ASP 53 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1rfl n ASP 53 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1rfl n GLY 54 N 0.00 1.01 3.57 0.27 0.00 -1.26 -5.02 105.19 103.76 1rfl n GLY 54 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 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 2.03 0.14 1.61 -1.94 -1.26 -5.04 119.30 114.84 1rfl s MET 55 Ca 0.00 -1.53 -0.05 0.00 -1.71 0.00 0.00 55.69 52.40 1rfl s MET 55 Cb 0.00 -2.01 -0.06 0.00 2.01 0.00 0.00 34.83 34.76 1rfl s MET 55 CO 0.00 0.36 1.34 -1.00 -0.01 0.00 0.00 175.02 175.70 1rfl h PRO 56 N 2.14 0.46 -4.60 2.03 0.13 -1.95 -3.37 132.00 126.86 1rfl h PRO 56 Ca -0.43 -0.45 -0.67 0.00 -0.87 0.00 0.00 66.00 63.58 1rfl h PRO 56 Cb 1.25 0.12 -0.03 0.00 0.13 0.00 0.00 31.00 32.46 1rfl h PRO 56 CO 0.59 1.09 2.66 1.28 -0.23 0.00 0.00 178.00 183.40 1rfl n LEU 57 N -3.80 5.73 -3.56 1.56 4.77 -1.26 -4.77 117.00 115.68 1rfl n LEU 57 Ca -0.06 -3.82 -0.04 0.00 -0.03 0.00 0.00 56.01 52.06 1rfl n LEU 57 Cb 0.79 -1.59 -0.06 0.00 -2.33 0.00 0.00 43.42 40.23 1rfl n LEU 57 CO 0.51 0.46 0.13 -2.28 -1.33 0.00 0.00 177.39 174.88 1rfl s HIS 58 N 4.23 -1.13 -0.21 -1.77 2.46 -1.26 -5.14 115.29 112.47 1rfl s HIS 58 Ca 0.52 1.83 -0.05 0.00 0.47 0.00 0.00 55.06 57.83 1rfl s HIS 58 Cb 0.11 0.52 -0.02 0.00 -0.13 0.00 0.00 32.58 33.06 1rfl s HIS 58 CO -0.00 -0.63 -0.01 -1.50 -2.47 0.00 0.00 174.74 170.12 1rfl s ILE 59 N 2.76 3.75 0.13 0.89 1.10 -1.26 -5.01 121.20 123.56 1rfl s ILE 59 Ca 0.01 -0.37 0.06 0.00 -0.51 0.00 0.00 60.65 59.83 1rfl s ILE 59 Cb -0.13 -2.70 -0.04 0.00 0.15 0.00 0.00 42.46 39.74 1rfl s ILE 59 CO -0.17 0.42 0.01 -0.63 -2.11 0.00 0.00 174.94 172.46 1rfl s ILE 60 N 1.21 3.89 -0.15 2.00 1.01 -1.26 -5.09 121.20 122.81 1rfl s ILE 60 Ca 0.03 -1.20 -0.04 0.00 0.00 0.00 0.00 60.65 59.44 1rfl s ILE 60 Cb -0.15 -2.91 0.06 0.00 0.01 0.00 0.00 42.46 39.48 1rfl s ILE 60 CO 0.00 0.00 0.13 -1.81 0.00 0.00 0.00 174.94 173.27 1rfl s ASP 61 N -2.64 1.68 -1.42 3.58 1.11 -1.26 -5.01 116.67 112.72 1rfl s ASP 61 Ca 0.27 -0.27 -0.11 0.00 0.18 0.00 0.00 52.55 52.61 1rfl s ASP 61 Cb -0.10 0.01 0.07 0.00 1.07 0.00 0.00 42.92 43.97 1rfl s ASP 61 CO 0.19 -0.31 2.24 0.35 1.18 0.00 0.00 175.17 178.81 1rfl n THR 62 N 5.30 4.03 -0.50 -1.27 -2.24 -1.26 -4.86 114.28 113.48 1rfl n THR 62 Ca -0.06 -3.51 -0.27 0.00 -2.27 0.00 0.00 64.05 57.95 1rfl n THR 62 Cb 0.49 -2.48 0.20 0.00 -2.10 0.00 0.00 70.33 66.45 1rfl n THR 62 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rfl n ALA 63 N 4.62 -3.11 0.17 6.98 0.00 -1.26 -4.23 120.51 123.67 1rfl n ALA 63 Ca 0.53 -1.35 0.00 0.00 0.00 0.00 0.00 53.44 52.62 1rfl n ALA 63 Cb 0.34 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.42 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 2.02 -1.56 3.97 0.00 0.00 -1.26 -4.69 105.19 103.68 1rfl n GLY 64 Ca 0.05 0.35 -0.19 0.00 0.00 0.00 0.00 46.02 46.23 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 -6.48 3.91 0.14 0.99 1.02 -1.26 -4.93 118.68 112.07 1rfl s LEU 65 Ca 0.00 -0.24 -0.20 0.00 0.02 0.00 0.00 54.13 53.71 1rfl s LEU 65 Cb 0.00 -2.67 0.02 0.00 0.02 0.00 0.00 46.19 43.56 1rfl s LEU 65 CO 0.00 -0.44 1.67 0.03 0.02 0.00 0.00 176.35 177.63 1rfl h ARG 66 N 0.93 -0.10 0.31 1.70 3.08 -2.00 0.15 114.38 118.45 1rfl h ARG 66 Ca -0.45 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 59.60 1rfl h ARG 66 Cb 1.26 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 31.30 1rfl h ARG 66 CO 0.53 -0.07 -0.42 0.93 -1.07 0.00 0.00 179.97 179.88 1rfl h GLU 67 N -0.10 -0.72 -0.43 0.04 3.07 -1.97 -2.27 114.58 112.19 1rfl h GLU 67 Ca 0.13 0.05 0.06 0.00 -0.50 0.00 0.00 59.36 59.11 1rfl h GLU 67 Cb 0.30 0.16 -0.09 0.00 -0.84 0.00 0.00 28.75 28.29 1rfl h GLU 67 CO -0.31 -0.48 -0.48 0.00 -1.40 0.00 0.00 179.01 176.34 1rfl h ALA 68 N -0.97 -0.55 -1.71 3.43 0.00 -1.69 1.35 119.26 119.13 1rfl h ALA 68 Ca -0.04 0.04 0.53 0.00 0.00 0.00 0.00 54.91 55.44 1rfl h ALA 68 Cb 0.68 1.00 -0.10 0.00 0.00 0.00 0.00 17.79 19.36 1rfl h ALA 68 CO -0.11 -0.93 1.18 0.77 0.00 0.00 0.00 179.25 180.16 1rfl h SER 69 N -0.34 0.09 0.00 0.00 0.02 -0.42 1.14 113.55 114.04 1rfl h SER 69 Ca 0.12 0.07 -0.23 0.00 -0.84 0.00 0.00 61.79 60.90 1rfl h SER 69 Cb 0.59 0.07 -0.03 0.00 0.14 0.00 0.00 62.40 63.16 1rfl h SER 69 CO -0.60 -0.11 -1.26 0.44 -1.14 0.00 0.00 176.83 174.17 1rfl h ASP 70 N 0.01 0.00 -0.44 3.07 3.45 0.12 -3.26 116.42 119.38 1rfl h ASP 70 Ca 0.90 -0.51 0.09 0.00 0.43 0.00 0.00 57.03 57.94 1rfl h ASP 70 Cb 3.34 -0.00 -0.09 0.00 -0.56 0.00 0.00 39.33 42.02 1rfl h ASP 70 CO -0.20 1.49 -0.14 -0.08 -1.57 0.00 0.00 179.24 178.73 1rfl h GLU 71 N -0.99 -0.04 -0.30 3.56 4.57 0.65 0.65 114.58 122.67 1rfl h GLU 71 Ca -0.35 0.00 0.06 0.00 -1.18 0.00 0.00 59.36 57.89 1rfl h GLU 71 Cb 1.31 0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 29.85 1rfl h GLU 71 CO -0.21 -0.03 -0.03 -0.39 -1.18 0.00 0.00 179.01 177.17 1rfl h VAL 72 N -0.05 0.74 -0.10 0.32 -1.51 0.84 0.31 116.25 116.80 1rfl h VAL 72 Ca 0.21 -0.02 0.03 0.00 -1.23 0.00 0.00 66.70 65.70 1rfl h VAL 72 Cb 0.37 0.69 -0.00 0.00 -2.13 0.00 0.00 31.29 30.22 1rfl h VAL 72 CO -0.48 0.01 0.14 -0.33 -1.23 0.00 0.00 177.57 175.68 1rfl h GLU 73 N 0.05 0.00 -0.01 5.19 4.39 -1.14 0.17 114.58 123.23 1rfl h GLU 73 Ca 0.15 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.64 1rfl h GLU 73 Cb 0.21 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1rfl h GLU 73 CO -0.27 0.00 -0.88 -0.09 -1.16 0.00 0.00 179.01 176.61 1rfl h ARG 74 N 0.00 0.33 -0.00 2.33 1.12 0.17 0.89 114.38 119.22 1rfl h ARG 74 Ca 0.05 -0.34 -0.18 0.00 -1.11 0.00 0.00 59.98 58.40 1rfl h ARG 74 Cb 0.32 0.09 -0.02 0.00 -0.01 0.00 0.00 29.97 30.36 1rfl h ARG 74 CO -0.00 1.02 -0.82 0.82 -3.11 0.00 0.00 179.97 177.88 1rfl h ILE 75 N 0.19 1.54 -0.34 1.20 1.08 0.27 -2.91 117.51 118.54 1rfl h ILE 75 Ca -0.06 -2.68 0.00 0.00 -0.39 0.00 0.00 64.86 61.74 1rfl h ILE 75 Cb 1.50 2.46 0.00 0.00 -3.07 0.00 0.00 36.82 37.71 1rfl h ILE 75 CO 0.15 0.77 0.00 0.61 -0.69 0.00 0.00 178.15 178.99 1rfl n GLY 76 N 0.79 0.78 3.58 5.37 0.00 -0.19 -4.94 105.19 110.58 1rfl n GLY 76 Ca -0.02 -0.45 -0.25 0.00 0.00 0.00 0.00 46.02 45.30 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 0.64 -6.24 -4.35 -0.61 2.08 -0.68 -5.00 119.36 105.20 1rfl n ILE 77 Ca 0.15 -0.68 -0.15 0.00 0.56 0.00 0.00 62.75 62.63 1rfl n ILE 77 Cb 0.36 -4.59 -0.03 0.00 -0.75 0.00 0.00 39.64 34.62 1rfl n ILE 77 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1rfl n GLU 78 N -3.47 1.42 -2.08 0.38 1.02 0.30 -5.02 120.64 113.19 1rfl n GLU 78 Ca -0.12 -1.71 -0.32 0.00 -0.02 0.00 0.00 57.16 54.99 1rfl n GLU 78 Cb 0.59 0.47 -0.00 0.00 -0.02 0.00 0.00 31.44 32.48 1rfl n GLU 78 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1rfl s ARG 79 N -2.85 3.56 0.06 3.49 3.00 -1.26 -4.75 118.95 120.21 1rfl s ARG 79 Ca 0.00 0.99 -0.34 0.00 0.00 0.00 0.00 55.73 56.37 1rfl s ARG 79 Cb 0.00 -2.08 -0.19 0.00 0.00 0.00 0.00 34.95 32.68 1rfl s ARG 79 CO 0.00 -0.60 1.54 0.00 0.00 0.00 0.00 175.30 176.25 1rfl h ALA 80 N 0.32 -1.10 -2.36 2.13 0.00 -1.95 -3.39 119.26 112.91 1rfl h ALA 80 Ca -0.46 -0.24 -0.64 0.00 0.00 0.00 0.00 54.91 53.57 1rfl h ALA 80 Cb 1.20 0.42 -0.14 0.00 0.00 0.00 0.00 17.79 19.27 1rfl h ALA 80 CO 0.60 -1.10 0.07 -1.58 0.00 0.00 0.00 179.25 177.24 1rfl s TRP 81 N -5.86 3.16 -0.28 0.00 0.51 -1.26 -4.82 118.94 110.38 1rfl s TRP 81 Ca -0.18 0.28 -0.20 0.00 -2.12 0.00 0.00 56.10 53.87 1rfl s TRP 81 Cb 0.03 -3.07 0.12 0.00 -0.81 0.00 0.00 33.47 29.74 1rfl s TRP 81 CO 0.59 -0.60 0.92 -1.14 -0.51 0.00 0.00 176.95 176.21 1rfl s GLN 82 N 2.60 0.52 0.41 4.98 2.00 -1.26 -5.15 119.66 123.76 1rfl s GLN 82 Ca 0.22 0.77 -0.25 0.00 -2.00 0.00 0.00 55.36 54.10 1rfl s GLN 82 Cb -0.15 0.17 -0.08 0.00 0.80 0.00 0.00 33.01 33.75 1rfl s GLN 82 CO 0.14 -0.09 1.18 -1.83 -0.50 0.00 0.00 175.29 174.20 1rfl s GLU 83 N 0.92 3.98 -0.05 1.67 -1.05 -1.26 -4.99 118.70 117.93 1rfl s GLU 83 Ca -0.04 1.86 -0.02 0.00 -0.15 0.00 0.00 54.97 56.62 1rfl s GLU 83 Cb -0.04 -2.63 0.04 0.00 -0.44 0.00 0.00 34.13 31.05 1rfl s GLU 83 CO -0.11 -0.38 0.10 -1.50 0.95 0.00 0.00 175.26 174.31 1rfl s ILE 84 N -1.42 -0.07 0.75 1.83 -1.16 -1.26 -5.13 121.20 114.74 1rfl s ILE 84 Ca 0.58 0.22 -0.17 0.00 -0.51 0.00 0.00 60.65 60.77 1rfl s ILE 84 Cb -0.31 -0.19 -0.13 0.00 0.61 0.00 0.00 42.46 42.44 1rfl s ILE 84 CO 0.39 0.09 -0.33 -0.62 -2.81 0.00 0.00 174.94 171.66 1rfl n GLU 85 N 4.33 0.03 -4.61 3.50 -0.58 -1.26 -4.98 120.64 117.07 1rfl n GLU 85 Ca -0.24 0.01 -0.31 0.00 -0.42 0.00 0.00 57.16 56.20 1rfl n GLU 85 Cb 0.51 -1.11 -0.08 0.00 -0.57 0.00 0.00 31.44 30.19 1rfl n GLU 85 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1rfl s GLN 86 N -1.69 2.15 0.23 3.49 -0.21 -1.26 -4.54 119.66 117.83 1rfl s GLN 86 Ca 0.51 -2.26 -0.31 0.00 0.02 0.00 0.00 55.36 53.31 1rfl s GLN 86 Cb -0.34 -1.64 -0.14 0.00 1.00 0.00 0.00 33.01 31.90 1rfl s GLN 86 CO 0.73 -0.29 1.33 0.00 -2.12 0.00 0.00 175.29 174.93 1rfl n ALA 87 N -1.24 0.68 0.03 6.09 0.00 -1.26 -4.73 120.51 120.08 1rfl n ALA 87 Ca -0.13 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1rfl n ALA 87 Cb 0.67 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.91 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 2.00 0.39 -4.16 0.00 9.92 -1.26 -4.94 116.55 118.50 1rfl n ASP 88 Ca 0.12 0.08 -0.26 0.00 -0.53 0.00 0.00 54.79 54.20 1rfl n ASP 88 Cb 0.30 -0.10 -0.16 0.00 -0.64 0.00 0.00 41.12 40.53 1rfl n ASP 88 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1rfl s ARG 89 N -2.00 1.66 0.08 -1.24 0.52 -1.26 -3.62 118.95 113.09 1rfl s ARG 89 Ca 0.00 -0.63 0.05 0.00 -0.52 0.00 0.00 55.73 54.63 1rfl s ARG 89 Cb 0.00 -1.51 -0.04 0.00 0.52 0.00 0.00 34.95 33.92 1rfl s ARG 89 CO 0.00 0.31 -0.06 0.08 0.02 0.00 0.00 175.30 175.65 1rfl s VAL 90 N -0.17 3.65 -0.75 3.52 1.01 -1.11 -3.33 120.40 123.22 1rfl s VAL 90 Ca 0.01 -1.06 0.03 0.00 0.00 0.00 0.00 61.98 60.96 1rfl s VAL 90 Cb -0.10 -2.69 0.27 0.00 0.00 0.00 0.00 36.38 33.86 1rfl s VAL 90 CO 0.01 0.18 0.97 0.18 0.00 0.00 0.00 175.10 176.44 1rfl n LEU 91 N 0.86 4.56 -4.59 3.92 7.99 -0.96 -1.20 117.00 127.58 1rfl n LEU 91 Ca -0.13 -5.41 -0.41 0.00 -0.01 0.00 0.00 56.01 50.05 1rfl n LEU 91 Cb 0.52 -0.82 -0.03 0.00 -0.11 0.00 0.00 43.42 42.99 1rfl n LEU 91 CO 0.35 2.00 1.79 0.12 -1.51 0.00 0.00 177.39 180.13 1rfl s PHE 92 N -2.69 1.34 -0.26 -1.77 5.36 -0.79 -4.24 117.98 114.93 1rfl s PHE 92 Ca 0.39 0.79 -0.12 0.00 -0.96 0.00 0.00 56.93 57.03 1rfl s PHE 92 Cb 0.14 -3.92 -0.05 0.00 -0.34 0.00 0.00 43.02 38.85 1rfl s PHE 92 CO 0.01 -3.35 0.25 -1.64 -1.46 0.00 0.00 175.22 169.03 1rfl s MET 93 N 6.63 4.02 -0.03 10.12 -1.94 -1.22 -4.12 119.30 132.76 1rfl s MET 93 Ca 0.92 -0.16 0.02 0.00 -1.71 0.00 0.00 55.69 54.77 1rfl s MET 93 Cb -0.25 -3.62 0.00 0.00 2.01 0.00 0.00 34.83 32.97 1rfl s MET 93 CO 0.32 -0.14 -0.09 0.08 -0.01 0.00 0.00 175.02 175.17 1rfl s VAL 94 N 1.65 0.83 0.42 -6.03 1.01 -1.26 -4.24 120.40 112.78 1rfl s VAL 94 Ca 0.10 -0.38 0.28 0.00 0.00 0.00 0.00 61.98 61.98 1rfl s VAL 94 Cb -0.15 -0.75 0.45 0.00 0.00 0.00 0.00 36.38 35.94 1rfl s VAL 94 CO 0.09 0.26 1.61 0.44 0.00 0.00 0.00 175.10 177.50 1rfl h ASP 95 N 6.45 0.27 0.00 3.32 3.32 -1.90 -3.44 116.42 124.44 1rfl h ASP 95 Ca -0.33 0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.88 1rfl h ASP 95 Cb 1.17 0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.88 1rfl h ASP 95 CO 0.48 -0.24 0.00 0.61 -1.72 0.00 0.00 179.24 178.38 1rfl n GLY 96 N -1.46 0.51 1.47 2.75 0.00 -1.26 -4.83 105.19 102.37 1rfl n GLY 96 Ca 0.38 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1rfl n GLY 96 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1rfl n THR 97 N -3.66 0.00 -3.45 2.61 -1.04 -1.26 -4.59 114.28 102.89 1rfl n THR 97 Ca 0.00 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.62 1rfl n THR 97 Cb 0.42 -0.08 -0.10 0.00 -1.82 0.00 0.00 70.33 68.76 1rfl n THR 97 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1rfl s THR 98 N -1.73 5.21 -0.84 12.58 -1.32 -1.26 -5.00 115.64 123.28 1rfl s THR 98 Ca 0.00 0.23 0.01 0.00 -1.21 0.00 0.00 61.69 60.72 1rfl s THR 98 Cb 0.00 -3.70 0.27 0.00 -1.51 0.00 0.00 72.50 67.55 1rfl s THR 98 CO 0.00 0.08 1.03 0.41 -2.21 0.00 0.00 174.62 173.93 1rfl n THR 99 N 5.15 3.56 -0.70 5.08 -1.04 -1.26 -4.73 114.28 120.33 1rfl n THR 99 Ca -0.10 -5.48 -0.30 0.00 -2.04 0.00 0.00 64.05 56.12 1rfl n THR 99 Cb 0.50 -2.12 0.27 0.00 -1.82 0.00 0.00 70.33 67.16 1rfl n THR 99 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1rfl s ASP 100 N -1.94 -0.18 0.00 8.00 1.01 -1.26 -4.89 116.67 117.40 1rfl s ASP 100 Ca 0.35 0.74 0.21 0.00 0.71 0.00 0.00 52.55 54.56 1rfl s ASP 100 Cb 0.08 -1.04 0.91 0.00 1.01 0.00 0.00 42.92 43.89 1rfl s ASP 100 CO 0.02 -4.81 1.63 0.00 0.21 0.00 0.00 175.17 172.22 1rfl n ALA 101 N -5.24 2.56 -0.10 5.23 0.00 -1.26 -3.32 120.51 118.37 1rfl n ALA 101 Ca 0.13 -0.39 -0.10 0.00 0.00 0.00 0.00 53.44 53.08 1rfl n ALA 101 Cb 0.60 -1.17 -0.16 0.00 0.00 0.00 0.00 19.45 18.72 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 -0.06 1.41 -0.02 0.00 0.31 -1.26 -3.78 118.33 114.93 1rfl n VAL 102 Ca 0.16 -0.85 -0.09 0.00 -0.01 0.00 0.00 64.34 63.55 1rfl n VAL 102 Cb 0.25 -0.52 -0.02 0.00 -0.91 0.00 0.00 33.84 32.63 1rfl n VAL 102 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1rfl h ASP 103 N 0.00 -0.47 0.86 4.52 -0.00 -1.91 0.11 116.42 119.53 1rfl h ASP 103 Ca -0.53 0.09 0.00 0.00 -0.00 0.00 0.00 57.03 56.59 1rfl h ASP 103 Cb 2.23 0.24 0.00 0.00 -0.00 0.00 0.00 39.33 41.79 1rfl h ASP 103 CO 0.03 -0.19 0.00 -0.81 -0.00 0.00 0.00 179.24 178.27 1rfl n PRO 104 N -5.30 0.07 0.00 0.28 -0.04 -1.26 -2.32 135.00 126.43 1rfl n PRO 104 Ca -0.02 0.18 0.11 0.00 -0.04 0.00 0.00 63.50 63.73 1rfl n PRO 104 Cb 0.22 -1.61 0.51 0.00 -0.04 0.00 0.00 33.50 32.58 1rfl n PRO 104 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1rfl n ALA 105 N -1.59 2.07 -0.01 0.55 0.00 0.35 -2.04 120.51 119.85 1rfl n ALA 105 Ca 0.05 -0.09 0.01 0.00 0.00 0.00 0.00 53.44 53.41 1rfl n ALA 105 Cb 0.28 -1.37 0.02 0.00 0.00 0.00 0.00 19.45 18.38 1rfl n ALA 105 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1rfl n GLU 106 N -1.45 2.32 -0.06 0.00 2.13 -0.98 -4.59 120.64 118.00 1rfl n GLU 106 Ca 0.07 -1.40 -0.07 0.00 0.66 0.00 0.00 57.16 56.41 1rfl n GLU 106 Cb 0.25 -1.04 -0.07 0.00 0.27 0.00 0.00 31.44 30.85 1rfl n GLU 106 CO 0.00 0.00 0.00 1.51 -0.41 0.00 0.00 177.13 178.23 1rfl n ILE 107 N -0.28 0.75 -0.18 6.31 0.00 -0.96 -4.60 119.36 120.40 1rfl n ILE 107 Ca 0.01 -0.38 -0.09 0.00 0.00 0.00 0.00 62.75 62.30 1rfl n ILE 107 Cb 0.23 -0.84 -0.04 0.00 0.00 0.00 0.00 39.64 39.00 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 -1.26 0.00 9.51 4.06 -1.66 -0.23 115.95 126.37 1rfl h TRP 108 Ca -0.29 0.08 -0.33 0.00 2.06 0.00 0.00 58.89 60.40 1rfl h TRP 108 Cb 1.57 0.62 -0.01 0.00 -1.00 0.00 0.00 29.16 30.33 1rfl h TRP 108 CO 0.01 -0.43 1.55 -0.35 -3.56 0.00 0.00 178.44 175.66 1rfl n PRO 109 N -5.41 2.16 0.01 0.49 -0.04 -1.26 -3.01 135.00 127.94 1rfl n PRO 109 Ca 0.01 -1.28 0.00 0.00 -0.04 0.00 0.00 63.50 62.19 1rfl n PRO 109 Cb 0.35 -2.25 0.00 0.00 -0.04 0.00 0.00 33.50 31.56 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 3.30 0.00 -0.34 0.54 1.02 -0.24 -4.96 120.64 119.97 1rfl n GLU 110 Ca 0.46 0.00 0.15 0.00 -0.02 0.00 0.00 57.16 57.75 1rfl n GLU 110 Cb 0.42 0.00 0.29 0.00 -0.02 0.00 0.00 31.44 32.13 1rfl n GLU 110 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1rfl n PHE 111 N -2.38 0.63 -2.72 -0.32 -0.00 -0.37 -3.24 117.46 109.05 1rfl n PHE 111 Ca 0.00 1.19 -0.42 0.00 -0.00 0.00 0.00 57.45 58.22 1rfl n PHE 111 Cb 0.00 -1.24 -0.03 0.00 -0.00 0.00 0.00 39.48 38.21 1rfl n PHE 111 CO 0.00 0.00 0.00 -1.50 -0.00 0.00 0.00 176.76 175.26 1rfl s ILE 112 N -5.99 4.13 0.00 -2.13 -1.16 -1.26 -4.87 121.20 109.92 1rfl s ILE 112 Ca -0.13 -0.36 0.00 0.00 -0.51 0.00 0.00 60.65 59.66 1rfl s ILE 112 Cb 0.29 -4.83 0.00 0.00 0.61 0.00 0.00 42.46 38.53 1rfl s ILE 112 CO 0.77 -1.67 0.00 0.00 -2.81 0.00 0.00 174.94 171.23 1rfl n ALA 113 N 8.26 0.00 -2.75 1.50 0.00 -1.20 -5.05 120.51 121.27 1rfl n ALA 113 Ca 0.08 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.40 1rfl n ALA 113 Cb 0.48 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.95 1rfl n ALA 113 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1rfl n ARG 114 N 0.00 1.30 -3.72 0.00 3.00 -1.26 -5.08 116.66 110.90 1rfl n ARG 114 Ca 0.00 -3.39 -0.13 0.00 -0.01 0.00 0.00 57.85 54.32 1rfl n ARG 114 Cb 0.00 -1.41 -0.09 0.00 0.00 0.00 0.00 32.46 30.96 1rfl n ARG 114 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.63 177.15 1rfl s LEU 115 N -3.03 0.41 0.66 0.55 2.34 -1.26 -5.05 118.68 113.30 1rfl s LEU 115 Ca 0.31 0.69 -0.12 0.00 0.06 0.00 0.00 54.13 55.07 1rfl s LEU 115 Cb 0.43 1.49 -0.01 0.00 -0.56 0.00 0.00 46.19 47.54 1rfl s LEU 115 CO -0.00 -0.24 1.06 -2.16 -1.06 0.00 0.00 176.35 173.95 1rfl s PRO 116 N -0.18 3.08 0.18 1.48 0.04 -1.24 -4.95 135.00 133.40 1rfl s PRO 116 Ca -0.03 1.01 0.02 0.00 0.04 0.00 0.00 61.00 62.03 1rfl s PRO 116 Cb -0.03 -2.01 -0.05 0.00 0.04 0.00 0.00 34.50 32.45 1rfl s PRO 116 CO 0.02 -0.99 0.00 0.00 0.04 0.00 0.00 177.00 176.07 1rfl s ALA 117 N -2.90 1.40 0.04 8.56 0.00 -1.26 -2.77 121.76 124.83 1rfl s ALA 117 Ca 0.59 -1.61 0.07 0.00 0.00 0.00 0.00 51.96 51.01 1rfl s ALA 117 Cb -0.14 0.55 -0.03 0.00 0.00 0.00 0.00 23.12 23.49 1rfl s ALA 117 CO 0.50 -0.31 -0.16 0.15 0.00 0.00 0.00 175.76 175.94 1rfl s LYS 118 N -3.91 2.13 -0.11 0.00 1.02 -0.34 -0.75 119.74 117.77 1rfl s LYS 118 Ca 0.25 -0.96 -0.04 0.00 0.02 0.00 0.00 55.97 55.24 1rfl s LYS 118 Cb 0.06 -2.24 0.06 0.00 -0.52 0.00 0.00 37.83 35.19 1rfl s LYS 118 CO 0.05 0.54 0.19 -1.17 -0.92 0.00 0.00 175.35 174.04 1rfl s LEU 119 N -1.50 -0.13 0.43 3.17 0.20 -1.07 -1.89 118.68 117.88 1rfl s LEU 119 Ca 0.15 0.31 -0.23 0.00 0.69 0.00 0.00 54.13 55.05 1rfl s LEU 119 Cb -0.11 0.38 -0.09 0.00 -0.43 0.00 0.00 46.19 45.95 1rfl s LEU 119 CO 0.06 -0.26 1.05 -2.16 -0.29 0.00 0.00 176.35 174.76 1rfl s PRO 120 N 2.32 4.04 0.00 0.98 0.04 -1.25 -3.37 135.00 137.76 1rfl s PRO 120 Ca 0.03 1.47 0.00 0.00 0.04 0.00 0.00 61.00 62.54 1rfl s PRO 120 Cb -0.13 -2.39 0.00 0.00 0.04 0.00 0.00 34.50 32.02 1rfl s PRO 120 CO -0.07 -0.25 0.00 -0.89 0.04 0.00 0.00 177.00 175.83 1rfl n ILE 121 N -0.37 0.00 -3.65 0.56 2.08 -1.25 -4.75 119.36 111.98 1rfl n ILE 121 Ca 0.06 0.00 -0.03 0.00 0.56 0.00 0.00 62.75 63.35 1rfl n ILE 121 Cb 0.50 0.00 -0.07 0.00 -0.75 0.00 0.00 39.64 39.33 1rfl n ILE 121 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 1rfl s THR 122 N 0.00 0.00 -0.19 1.39 -1.32 -1.26 -4.40 115.64 109.86 1rfl s THR 122 Ca 0.00 0.00 0.17 0.00 -1.21 0.00 0.00 61.69 60.65 1rfl s THR 122 Cb 0.00 -1.00 0.39 0.00 -1.51 0.00 0.00 72.50 70.38 1rfl s THR 122 CO 0.00 0.00 1.23 0.55 -2.21 0.00 0.00 174.62 174.19 1rfl n VAL 123 N 1.90 0.46 -4.11 5.08 3.14 -1.26 -4.95 118.33 118.58 1rfl n VAL 123 Ca -0.12 -1.54 -0.27 0.00 -2.96 0.00 0.00 64.34 59.46 1rfl n VAL 123 Cb 0.57 1.03 -0.04 0.00 -1.06 0.00 0.00 33.84 34.34 1rfl n VAL 123 CO 0.00 0.00 0.00 0.68 -6.46 0.00 0.00 176.83 171.05 1rfl s VAL 124 N -1.34 1.79 0.00 1.55 -7.23 -1.26 -5.04 120.40 108.87 1rfl s VAL 124 Ca 0.19 -1.64 0.00 0.00 -1.81 0.00 0.00 61.98 58.72 1rfl s VAL 124 Cb 0.32 -2.44 0.00 0.00 0.56 0.00 0.00 36.38 34.82 1rfl s VAL 124 CO -0.09 0.00 0.00 -1.14 -0.31 0.00 0.00 175.10 173.56 1rfl n ARG 125 N -1.50 0.00 -0.29 4.82 3.00 -1.26 -4.70 116.66 116.73 1rfl n ARG 125 Ca -0.05 0.00 -0.26 0.00 -0.00 0.00 0.00 57.85 57.54 1rfl n ARG 125 Cb 0.65 0.00 0.24 0.00 0.00 0.00 0.00 32.46 33.35 1rfl n ARG 125 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1rfl n ASN 126 N -3.48 -3.59 -0.12 6.15 4.13 -1.26 -5.00 115.26 112.10 1rfl n ASN 126 Ca 0.00 -0.79 -0.24 0.00 1.68 0.00 0.00 54.58 55.23 1rfl n ASN 126 Cb 0.00 -0.84 -0.10 0.00 -1.54 0.00 0.00 39.78 37.30 1rfl n ASN 126 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1rfl n LYS 127 N -5.12 0.57 -1.60 3.52 5.02 -1.26 -4.38 118.16 114.91 1rfl n LYS 127 Ca 0.12 0.42 -0.34 0.00 -2.02 0.00 0.00 58.31 56.48 1rfl n LYS 127 Cb 0.51 -1.61 -0.07 0.00 -0.02 0.00 0.00 35.03 33.84 1rfl n LYS 127 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rfl n ALA 128 N -3.85 2.19 0.00 7.82 0.00 -1.26 -1.82 120.51 123.60 1rfl n ALA 128 Ca -0.40 -3.06 0.00 0.00 0.00 0.00 0.00 53.44 49.98 1rfl n ALA 128 Cb 0.75 -3.55 0.00 0.00 0.00 0.00 0.00 19.45 16.65 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 11.87 0.00 -1.51 0.00 2.03 -1.26 -4.93 116.55 122.75 1rfl n ASP 129 Ca 0.47 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.77 1rfl n ASP 129 Cb 0.44 0.00 0.23 0.00 -0.72 0.00 0.00 41.12 41.07 1rfl n ASP 129 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 1rfl n ILE 130 N 0.00 1.97 -0.03 5.18 -5.35 -0.75 -3.77 119.36 116.61 1rfl n ILE 130 Ca 0.00 -1.00 -0.06 0.00 -0.27 0.00 0.00 62.75 61.41 1rfl n ILE 130 Cb 0.00 -0.43 -0.02 0.00 -1.74 0.00 0.00 39.64 37.45 1rfl n ILE 130 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1rfl n THR 131 N 0.18 0.34 0.10 7.28 -2.24 -1.23 -4.54 114.28 114.16 1rfl n THR 131 Ca 0.23 -0.09 -0.04 0.00 -2.27 0.00 0.00 64.05 61.88 1rfl n THR 131 Cb 0.97 -1.53 -0.02 0.00 -2.10 0.00 0.00 70.33 67.65 1rfl n THR 131 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1rfl h GLY 132 N -0.18 -0.28 -0.80 3.38 0.00 -1.89 -3.16 103.07 100.14 1rfl h GLY 132 Ca -0.15 0.10 0.32 0.00 0.00 0.00 0.00 47.33 47.60 1rfl h GLY 132 CO -0.09 -0.10 0.33 0.83 0.00 0.00 0.00 176.54 177.50 1rfl h GLU 133 N -0.42 0.10 0.00 4.80 4.39 -1.89 -0.58 114.58 120.97 1rfl h GLU 133 Ca -0.03 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1rfl h GLU 133 Cb 0.21 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 1rfl h GLU 133 CO 0.05 0.06 0.00 2.41 -1.16 0.00 0.00 179.01 180.37 1rfl n THR 134 N -5.29 0.00 -0.33 1.13 -1.04 -1.23 -0.83 114.28 106.70 1rfl n THR 134 Ca 0.29 0.98 0.25 0.00 -2.04 0.00 0.00 64.05 63.53 1rfl n THR 134 Cb 0.95 -1.66 0.48 0.00 -1.82 0.00 0.00 70.33 68.28 1rfl n THR 134 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1rfl h LEU 135 N 0.00 0.31 -0.78 -4.42 7.12 -1.39 0.91 115.31 117.05 1rfl h LEU 135 Ca 0.00 0.22 0.18 0.00 0.13 0.00 0.00 57.88 58.41 1rfl h LEU 135 Cb 0.00 0.23 -0.12 0.00 -0.53 0.00 0.00 40.66 40.24 1rfl h LEU 135 CO 0.00 -0.26 0.21 1.23 -0.13 0.00 0.00 178.44 179.49 1rfl h GLY 136 N 0.17 1.13 -7.34 3.75 0.00 -0.10 -3.33 103.07 97.36 1rfl h GLY 136 Ca 0.74 -0.05 -0.45 0.00 0.00 0.00 0.00 47.33 47.58 1rfl h GLY 136 CO -0.69 -0.23 1.12 1.06 0.00 0.00 0.00 176.54 177.80 1rfl s MET 137 N -6.01 2.78 -0.37 4.80 -1.94 0.31 -4.70 119.30 114.17 1rfl s MET 137 Ca -0.13 0.00 0.13 0.00 -1.71 0.00 0.00 55.69 53.98 1rfl s MET 137 Cb 0.22 -4.69 0.41 0.00 2.01 0.00 0.00 34.83 32.78 1rfl s MET 137 CO 0.76 -2.81 1.10 0.45 -0.01 0.00 0.00 175.02 174.51 1rfl n SER 138 N 12.28 -0.30 0.00 3.03 2.88 -1.25 -4.98 113.62 125.28 1rfl n SER 138 Ca 0.26 -2.74 -0.01 0.00 -1.33 0.00 0.00 58.87 55.04 1rfl n SER 138 Cb 0.50 0.31 -0.01 0.00 -0.75 0.00 0.00 64.21 64.26 1rfl n SER 138 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1rfl h GLU 139 N 2.61 -0.09 -6.40 -1.46 3.07 -1.94 -3.46 114.58 106.91 1rfl h GLU 139 Ca -0.15 0.01 -0.55 0.00 -0.50 0.00 0.00 59.36 58.17 1rfl h GLU 139 Cb 1.20 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 29.09 1rfl h GLU 139 CO 0.24 -0.06 -0.09 0.54 -1.40 0.00 0.00 179.01 178.24 1rfl s VAL 140 N -1.76 4.88 0.21 3.13 0.11 -1.26 -4.98 120.40 120.73 1rfl s VAL 140 Ca -0.01 0.68 -0.10 0.00 -2.93 0.00 0.00 61.98 59.62 1rfl s VAL 140 Cb 0.00 -3.68 0.16 0.00 -1.53 0.00 0.00 36.38 31.34 1rfl s VAL 140 CO 0.04 0.08 1.70 0.78 -3.33 0.00 0.00 175.10 174.38 1rfl h ASN 141 N 3.04 0.00 -3.96 3.54 2.35 -1.96 -3.48 115.58 115.11 1rfl h ASN 141 Ca -0.48 0.11 0.00 0.00 -0.55 0.00 0.00 56.30 55.38 1rfl h ASN 141 Cb 1.18 0.15 0.00 0.00 0.05 0.00 0.00 38.32 39.70 1rfl h ASN 141 CO 0.67 0.01 -0.79 0.61 -1.65 0.00 0.00 177.43 176.28 1rfl n GLY 142 N -1.32 -4.08 0.10 2.83 0.00 -1.26 -4.94 105.19 96.52 1rfl n GLY 142 Ca 0.09 -0.86 -0.17 0.00 0.00 0.00 0.00 46.02 45.07 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 -1.80 0.37 -4.10 1.61 -0.00 0.07 -4.87 115.22 106.50 1rfl n HIS 143 Ca 0.00 0.16 -0.30 0.00 0.46 0.00 0.00 57.72 58.04 1rfl n HIS 143 Cb 0.24 -0.82 -0.07 0.00 -0.12 0.00 0.00 29.99 29.21 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 -2.65 3.39 -0.39 1.57 0.00 -1.25 -5.05 121.76 117.38 1rfl s ALA 144 Ca -0.29 -1.09 0.11 0.00 0.00 0.00 0.00 51.96 50.69 1rfl s ALA 144 Cb 0.07 -1.27 0.34 0.00 0.00 0.00 0.00 23.12 22.26 1rfl s ALA 144 CO 0.44 0.71 0.78 1.28 0.00 0.00 0.00 175.76 178.97 1rfl n LEU 145 N 0.51 0.24 -4.22 0.00 4.77 -1.26 -2.60 117.00 114.43 1rfl n LEU 145 Ca -0.10 -4.76 -0.29 0.00 -0.03 0.00 0.00 56.01 50.82 1rfl n LEU 145 Cb 0.52 0.75 -0.16 0.00 -2.33 0.00 0.00 43.42 42.20 1rfl n LEU 145 CO 0.41 2.24 -0.54 -0.63 -1.33 0.00 0.00 177.39 177.54 1rfl s ILE 146 N -1.89 1.81 1.23 -0.08 -1.09 -1.22 -4.56 121.20 115.41 1rfl s ILE 146 Ca 0.37 -0.94 -0.21 0.00 -2.23 0.00 0.00 60.65 57.64 1rfl s ILE 146 Cb 0.33 -1.54 0.30 0.00 -1.58 0.00 0.00 42.46 39.97 1rfl s ILE 146 CO -0.08 0.51 1.13 0.00 -1.23 0.00 0.00 174.94 175.28 1rfl s ARG 147 N -0.15 -1.46 0.00 2.79 1.70 -1.26 -3.82 118.95 116.76 1rfl s ARG 147 Ca -0.02 -0.24 0.00 0.00 -0.47 0.00 0.00 55.73 55.00 1rfl s ARG 147 Cb -0.12 -1.58 0.00 0.00 -0.57 0.00 0.00 34.95 32.67 1rfl s ARG 147 CO 0.03 -3.83 0.00 -0.11 -1.08 0.00 0.00 175.30 170.30 1rfl n LEU 148 N -4.81 0.00 -3.70 -1.89 0.00 -1.26 -4.52 117.00 100.82 1rfl n LEU 148 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 56.01 55.87 1rfl n LEU 148 Cb 0.60 0.00 -0.15 0.00 0.00 0.00 0.00 43.42 43.87 1rfl n LEU 148 CO 0.42 0.00 -0.33 -0.94 0.00 0.00 0.00 177.39 176.54 1rfl s SER 149 N 0.00 3.85 0.58 1.96 1.04 -1.26 -4.91 113.70 114.96 1rfl s SER 149 Ca 0.00 -1.50 0.31 0.00 0.48 0.00 0.00 55.95 55.23 1rfl s SER 149 Cb 0.00 -0.75 1.36 0.00 0.10 0.00 0.00 66.02 66.73 1rfl s SER 149 CO 0.00 -0.41 1.72 0.00 0.98 0.00 0.00 173.24 175.53 1rfl h ALA 150 N 8.16 2.61 -0.62 5.32 0.00 -1.94 1.40 119.26 134.20 1rfl h ALA 150 Ca -0.15 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.79 1rfl h ALA 150 Cb 1.02 0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.78 1rfl h ALA 150 CO 0.45 -1.18 -0.55 -0.09 0.00 0.00 0.00 179.25 177.89 1rfl h ARG 151 N 0.00 -0.22 0.00 0.00 2.43 -1.93 -3.14 114.38 111.52 1rfl h ARG 151 Ca 0.38 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.56 1rfl h ARG 151 Cb 1.92 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 31.52 1rfl h ARG 151 CO -0.00 -0.15 -0.10 -2.37 -1.51 0.00 0.00 179.97 175.84 1rfl n THR 152 N -5.21 1.00 -3.37 0.20 5.66 -0.42 -5.03 114.28 107.10 1rfl n THR 152 Ca -0.01 -1.15 -0.13 0.00 -3.05 0.00 0.00 64.05 59.70 1rfl n THR 152 Cb 0.30 0.28 0.00 0.00 -1.55 0.00 0.00 70.33 69.36 1rfl n THR 152 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1rfl n GLY 153 N -0.69 -1.17 0.46 1.09 0.00 0.47 -4.90 105.19 100.45 1rfl n GLY 153 Ca 0.06 0.64 -0.17 0.00 0.00 0.00 0.00 46.02 46.56 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 0.40 -0.84 -2.14 1.61 4.57 -1.88 -3.32 114.58 112.98 1rfl h GLU 154 Ca -0.30 0.06 -0.59 0.00 -1.18 0.00 0.00 59.36 57.35 1rfl h GLU 154 Cb 1.19 0.19 -0.41 0.00 -0.16 0.00 0.00 28.75 29.56 1rfl h GLU 154 CO 0.31 -0.56 -0.73 0.41 -1.18 0.00 0.00 179.01 177.27 1rfl n GLY 155 N -1.50 4.36 0.09 1.92 0.00 -1.26 -4.83 105.19 103.97 1rfl n GLY 155 Ca -0.10 -2.47 -0.11 0.00 0.00 0.00 0.00 46.02 43.34 1rfl n GLY 155 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1rfl h VAL 156 N 2.84 0.92 -0.06 1.61 2.07 -1.93 -3.32 116.25 118.38 1rfl h VAL 156 Ca 0.16 -2.72 -0.05 0.00 0.82 0.00 0.00 66.70 64.92 1rfl h VAL 156 Cb 0.71 2.50 -0.01 0.00 -1.52 0.00 0.00 31.29 32.98 1rfl h VAL 156 CO 0.74 0.62 -0.17 -0.78 0.02 0.00 0.00 177.57 178.00 1rfl h ASP 157 N 0.02 0.09 -0.91 0.57 1.82 -1.88 -2.52 116.42 113.61 1rfl h ASP 157 Ca -0.28 -0.02 -0.46 0.00 -0.39 0.00 0.00 57.03 55.89 1rfl h ASP 157 Cb 2.00 -0.02 -0.17 0.00 0.68 0.00 0.00 39.33 41.81 1rfl h ASP 157 CO 0.09 0.28 0.37 0.52 -1.61 0.00 0.00 179.24 178.89 1rfl n VAL 158 N -4.29 3.21 0.00 2.25 0.31 -1.25 -3.82 118.33 114.73 1rfl n VAL 158 Ca -0.02 -2.67 0.00 0.00 -0.01 0.00 0.00 64.34 61.64 1rfl n VAL 158 Cb 0.26 -1.55 0.00 0.00 -0.91 0.00 0.00 33.84 31.64 1rfl n VAL 158 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1rfl n LEU 159 N 0.81 0.00 0.33 7.52 4.77 -0.96 -4.86 117.00 124.61 1rfl n LEU 159 Ca 0.45 0.00 0.21 0.00 -0.03 0.00 0.00 56.01 56.64 1rfl n LEU 159 Cb 0.57 0.27 1.13 0.00 -2.33 0.00 0.00 43.42 43.07 1rfl n LEU 159 CO 0.34 -0.44 1.16 0.03 -1.33 0.00 0.00 177.39 177.14 1rfl h ARG 160 N 0.00 0.00 0.00 3.23 3.08 -1.63 -2.44 114.38 116.62 1rfl h ARG 160 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1rfl h ARG 160 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1rfl h ARG 160 CO 0.00 0.00 0.00 0.09 -1.07 0.00 0.00 179.97 178.99 1rfl n ASN 161 N -3.00 0.00 -0.35 7.04 3.02 -1.26 -2.43 115.26 118.28 1rfl n ASN 161 Ca -0.03 0.67 0.09 0.00 -0.03 0.00 0.00 54.58 55.29 1rfl n ASN 161 Cb 0.12 -0.46 0.20 0.00 -0.61 0.00 0.00 39.78 39.02 1rfl n ASN 161 CO 0.00 0.00 0.00 0.45 -2.62 0.00 0.00 177.26 175.09 1rfl h HIS 162 N 0.00 -0.35 -0.62 3.10 3.86 -1.86 1.44 115.15 120.72 1rfl h HIS 162 Ca 0.00 0.08 0.13 0.00 -1.16 0.00 0.00 60.37 59.42 1rfl h HIS 162 Cb 0.00 0.31 -0.10 0.00 1.06 0.00 0.00 27.41 28.68 1rfl h HIS 162 CO 0.09 -0.43 0.01 -0.07 0.86 0.00 0.00 177.93 178.39 1rfl h LEU 163 N 0.00 -0.25 -4.10 2.43 3.38 -1.53 0.19 115.31 115.43 1rfl h LEU 163 Ca 0.53 0.15 -0.36 0.00 0.09 0.00 0.00 57.88 58.29 1rfl h LEU 163 Cb 0.92 0.26 -0.13 0.00 0.09 0.00 0.00 40.66 41.80 1rfl h LEU 163 CO -0.99 -0.11 0.18 0.29 0.09 0.00 0.00 178.44 177.90 1rfl n LYS 164 N -5.27 2.10 0.00 1.13 4.01 0.49 -3.66 118.16 116.96 1rfl n LYS 164 Ca 0.09 -1.71 0.00 0.00 -0.51 0.00 0.00 58.31 56.18 1rfl n LYS 164 Cb 0.35 -1.94 0.00 0.00 -0.51 0.00 0.00 35.03 32.94 1rfl n LYS 164 CO 0.00 0.00 0.00 0.94 -1.11 0.00 0.00 177.40 177.23 1rfl n GLN 165 N 1.22 0.00 0.25 1.97 0.00 0.62 -4.85 117.38 116.59 1rfl n GLN 165 Ca 0.41 0.00 0.14 0.00 -0.00 0.00 0.00 57.00 57.54 1rfl n GLN 165 Cb 0.64 -0.12 0.60 0.00 0.00 0.00 0.00 30.24 31.36 1rfl n GLN 165 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1rfl h SER 166 N 0.00 0.00 -2.89 1.69 4.64 -1.47 -3.44 113.55 112.08 1rfl h SER 166 Ca 0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 1rfl h SER 166 Cb 0.00 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.16 1rfl h SER 166 CO 0.00 0.11 0.89 1.15 -0.87 0.00 0.00 176.83 178.11 1rfl n MET 167 N -3.27 2.60 -3.82 4.77 0.00 -1.25 -4.99 117.12 111.16 1rfl n MET 167 Ca 0.00 0.93 -0.23 0.00 0.00 0.00 0.00 57.70 58.40 1rfl n MET 167 Cb 0.35 -2.72 -0.02 0.00 0.00 0.00 0.00 33.22 30.82 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 0.76 1.40 -0.80 3.17 0.00 -1.26 -4.90 107.32 105.69 1rfl s GLY 168 Ca 0.70 -1.08 -0.26 0.00 0.00 0.00 0.00 44.72 44.08 1rfl s GLY 168 CO 0.42 -1.08 1.50 -0.26 0.00 0.00 0.00 173.10 173.68 1rfl s ILE 169 N -1.98 3.67 -0.10 0.90 -4.36 -1.26 -3.17 121.20 114.89 1rfl s ILE 169 Ca 0.36 0.02 -0.33 0.00 -0.26 0.00 0.00 60.65 60.44 1rfl s ILE 169 Cb -0.10 -4.67 0.15 0.00 1.25 0.00 0.00 42.46 39.10 1rfl s ILE 169 CO 0.30 -1.60 1.45 -1.00 0.24 0.00 0.00 174.94 174.33 1rfl s HIS 170 N 6.66 -0.00 -0.22 1.37 3.76 -1.25 -5.01 115.29 120.61 1rfl s HIS 170 Ca 0.47 -0.00 -0.07 0.00 -0.15 0.00 0.00 55.06 55.32 1rfl s HIS 170 Cb -0.07 0.50 0.01 0.00 1.11 0.00 0.00 32.58 34.13 1rfl s HIS 170 CO 0.09 -0.00 0.15 -2.13 -0.85 0.00 0.00 174.74 171.99 1rfl n ARG 171 N -0.49 -1.94 0.00 1.40 0.00 -1.26 -3.28 116.66 111.09 1rfl n ARG 171 Ca -0.10 1.77 0.00 0.00 -0.00 0.00 0.00 57.85 59.53 1rfl n ARG 171 Cb 0.64 -3.32 0.00 0.00 0.00 0.00 0.00 32.46 29.78 1rfl n ARG 171 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16