#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ntk s TYR 2 N 0.00 3.12 -1.98 2.03 5.04 -1.26 -1.64 117.35 122.67 2ntk s TYR 2 Ca 0.00 -0.02 0.23 0.00 -2.44 0.00 0.00 57.07 54.83 2ntk s TYR 2 Cb 0.00 -3.12 -0.01 0.00 0.35 0.00 0.00 41.96 39.17 2ntk s TYR 2 CO 0.00 -0.73 1.09 1.28 -1.34 0.00 0.00 175.55 175.85 2ntk n LEU 3 N 5.97 1.97 0.00 6.97 4.32 -1.26 -4.64 117.00 130.32 2ntk n LEU 3 Ca -0.04 -0.74 0.00 0.00 -0.02 0.00 0.00 56.01 55.22 2ntk n LEU 3 Cb 0.48 -0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.28 2ntk n LEU 3 CO 0.49 0.37 0.00 0.61 -1.22 0.00 0.00 177.39 177.64 2ntk n GLY 4 N 1.42 1.42 3.76 -0.72 0.00 -1.26 -1.67 105.19 108.14 2ntk n GLY 4 Ca 0.09 -0.59 -0.40 0.00 0.00 0.00 0.00 46.02 45.12 2ntk n GLY 4 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ntk s ARG 5 N 0.00 4.63 0.05 1.61 3.00 -1.26 -3.17 118.95 123.81 2ntk s ARG 5 Ca 0.00 1.25 0.06 0.00 0.00 0.00 0.00 55.73 57.03 2ntk s ARG 5 Cb 0.00 -3.31 -0.02 0.00 0.00 0.00 0.00 34.95 31.62 2ntk s ARG 5 CO 0.00 0.43 -0.16 0.42 0.00 0.00 0.00 175.30 175.99 2ntk s ILE 6 N -0.70 1.26 0.01 1.52 1.01 -0.53 -1.58 121.20 122.19 2ntk s ILE 6 Ca 0.39 -1.12 -0.01 0.00 0.00 0.00 0.00 60.65 59.91 2ntk s ILE 6 Cb -0.23 -1.14 -0.01 0.00 0.01 0.00 0.00 42.46 41.09 2ntk s ILE 6 CO 0.27 0.00 -0.00 -1.48 0.00 0.00 0.00 174.94 173.73 2ntk s LEU 7 N -1.29 2.11 0.06 2.97 0.05 -0.63 -0.70 118.68 121.25 2ntk s LEU 7 Ca 0.02 -0.35 0.04 0.00 0.05 0.00 0.00 54.13 53.90 2ntk s LEU 7 Cb -0.08 0.14 -0.03 0.00 -2.05 0.00 0.00 46.19 44.17 2ntk s LEU 7 CO 0.02 -0.24 -0.13 0.00 -0.55 0.00 0.00 176.35 175.45 2ntk s ALA 8 N -1.12 1.03 -0.06 1.48 0.00 -0.19 -1.30 121.76 121.60 2ntk s ALA 8 Ca -0.12 -0.95 -0.18 0.00 0.00 0.00 0.00 51.96 50.71 2ntk s ALA 8 Cb -0.08 -0.06 0.04 0.00 0.00 0.00 0.00 23.12 23.02 2ntk s ALA 8 CO -0.01 0.12 0.42 0.54 0.00 0.00 0.00 175.76 176.84 2ntk s VAL 9 N -1.30 0.03 -5.00 0.00 0.11 -0.32 -0.46 120.40 113.46 2ntk s VAL 9 Ca -0.04 -0.27 0.00 0.00 -2.93 0.00 0.00 61.98 58.74 2ntk s VAL 9 Cb -0.10 -0.70 0.00 0.00 -1.53 0.00 0.00 36.38 34.05 2ntk s VAL 9 CO 0.02 -0.15 0.00 0.61 -3.33 0.00 0.00 175.10 172.25 2ntk n GLY 10 N 1.55 -0.24 3.05 6.54 0.00 -0.89 -1.57 105.19 113.62 2ntk n GLY 10 Ca -0.19 -1.36 -0.12 0.00 0.00 0.00 0.00 46.02 44.34 2ntk n GLY 10 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ntk s ARG 11 N -2.00 0.49 0.24 1.61 0.52 -1.26 -0.98 118.95 117.58 2ntk s ARG 11 Ca 0.00 -0.74 0.04 0.00 -0.52 0.00 0.00 55.73 54.52 2ntk s ARG 11 Cb 0.00 -0.23 -0.02 0.00 0.52 0.00 0.00 34.95 35.23 2ntk s ARG 11 CO 0.00 0.03 0.15 0.27 0.02 0.00 0.00 175.30 175.77 2ntk n ASN 12 N 1.48 0.21 0.34 0.23 0.23 0.03 -4.44 115.26 113.34 2ntk n ASN 12 Ca -0.23 -2.45 0.22 0.00 -0.53 0.00 0.00 54.58 51.60 2ntk n ASN 12 Cb 0.55 0.93 1.20 0.00 -2.08 0.00 0.00 39.78 40.37 2ntk n ASN 12 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2ntk h SER 13 N 1.24 0.00 0.84 0.53 4.64 -1.94 -2.27 113.55 116.58 2ntk h SER 13 Ca -0.18 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.11 2ntk h SER 13 Cb 0.80 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.88 2ntk h SER 13 CO 0.27 0.00 -1.19 0.59 -0.87 0.00 0.00 176.83 175.63 2ntk n ASN 14 N -3.07 0.76 0.00 4.97 3.02 -1.26 -5.08 115.26 114.61 2ntk n ASN 14 Ca -0.03 0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.82 2ntk n ASN 14 Cb 0.09 0.55 0.00 0.00 -0.61 0.00 0.00 39.78 39.82 2ntk n ASN 14 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ntk n GLY 15 N 1.23 -0.29 3.78 7.41 0.00 -0.86 -4.47 105.19 111.99 2ntk n GLY 15 Ca -0.02 -1.40 -0.24 0.00 0.00 0.00 0.00 46.02 44.35 2ntk n GLY 15 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ntk s SER 16 N -4.00 5.33 0.23 1.61 1.04 -0.57 -0.79 113.70 116.54 2ntk s SER 16 Ca 0.00 -0.26 -0.22 0.00 0.48 0.00 0.00 55.95 55.94 2ntk s SER 16 Cb 0.00 -1.31 0.05 0.00 0.10 0.00 0.00 66.02 64.85 2ntk s SER 16 CO 0.00 0.02 0.85 0.72 0.98 0.00 0.00 173.24 175.81 2ntk s PHE 17 N -1.95 -0.12 -0.03 5.02 -0.12 -0.15 -0.80 117.98 119.83 2ntk s PHE 17 Ca 0.31 -0.29 -0.03 0.00 -0.05 0.00 0.00 56.93 56.87 2ntk s PHE 17 Cb -0.09 0.69 0.01 0.00 -0.63 0.00 0.00 43.02 43.00 2ntk s PHE 17 CO 0.23 -1.07 0.08 0.14 -0.05 0.00 0.00 175.22 174.54 2ntk s VAL 18 N -3.39 0.00 0.04 -2.49 -7.23 -0.86 -2.10 120.40 104.36 2ntk s VAL 18 Ca 0.13 -0.00 0.03 0.00 -1.81 0.00 0.00 61.98 60.32 2ntk s VAL 18 Cb -0.04 -0.12 -0.02 0.00 0.56 0.00 0.00 36.38 36.77 2ntk s VAL 18 CO 0.05 -0.00 -0.09 0.00 -0.31 0.00 0.00 175.10 174.75 2ntk s ALA 19 N 0.03 0.68 0.00 1.32 0.00 0.39 -1.26 121.76 122.92 2ntk s ALA 19 Ca -0.00 -0.72 0.01 0.00 0.00 0.00 0.00 51.96 51.24 2ntk s ALA 19 Cb -0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 23.12 23.10 2ntk s ALA 19 CO 0.00 0.04 -0.02 -0.47 0.00 0.00 0.00 175.76 175.31 2ntk s TYR 20 N -1.15 0.17 -0.02 0.00 5.04 0.95 -1.02 117.35 121.32 2ntk s TYR 20 Ca -0.06 -0.07 0.00 0.00 -2.44 0.00 0.00 57.07 54.50 2ntk s TYR 20 Cb -0.09 -0.11 0.03 0.00 0.35 0.00 0.00 41.96 42.14 2ntk s TYR 20 CO 0.01 -0.02 0.01 0.50 -1.34 0.00 0.00 175.55 174.71 2ntk s ARG 21 N -0.16 0.13 -0.23 4.97 3.52 0.12 -0.80 118.95 126.51 2ntk s ARG 21 Ca -0.01 0.12 -0.15 0.00 -0.13 0.00 0.00 55.73 55.56 2ntk s ARG 21 Cb -0.01 -0.35 -0.04 0.00 -1.56 0.00 0.00 34.95 32.99 2ntk s ARG 21 CO -0.00 -0.14 0.35 0.08 -0.81 0.00 0.00 175.30 174.78 2ntk s VAL 22 N 0.97 5.22 -0.05 7.11 1.01 0.91 -1.46 120.40 134.12 2ntk s VAL 22 Ca -0.09 0.58 0.06 0.00 0.00 0.00 0.00 61.98 62.53 2ntk s VAL 22 Cb -0.12 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 2ntk s VAL 22 CO -0.02 0.24 -0.23 -0.44 0.00 0.00 0.00 175.10 174.65 2ntk s SER 23 N 1.20 3.24 -0.15 3.32 0.01 -1.19 -0.58 113.70 119.55 2ntk s SER 23 Ca 0.16 -0.45 -0.25 0.00 1.31 0.00 0.00 55.95 56.72 2ntk s SER 23 Cb -0.15 -0.74 0.06 0.00 0.21 0.00 0.00 66.02 65.40 2ntk s SER 23 CO 0.08 0.27 0.63 -0.55 0.41 0.00 0.00 173.24 174.08 2ntk s SER 24 N -0.33 -0.63 -0.21 2.44 0.15 -0.56 -4.22 113.70 110.35 2ntk s SER 24 Ca 0.02 0.97 -0.10 0.00 0.70 0.00 0.00 55.95 57.54 2ntk s SER 24 Cb -0.12 0.93 -0.09 0.00 -1.71 0.00 0.00 66.02 65.03 2ntk s SER 24 CO 0.02 -0.39 -0.27 0.54 1.20 0.00 0.00 173.24 174.34 2ntk n ARG 25 N 1.91 0.45 0.05 5.44 1.74 -1.26 -4.50 116.66 120.47 2ntk n ARG 25 Ca -0.16 0.20 0.12 0.00 -0.77 0.00 0.00 57.85 57.23 2ntk n ARG 25 Cb 0.56 -1.25 0.25 0.00 -1.02 0.00 0.00 32.46 31.00 2ntk n ARG 25 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2ntk n SER 26 N -3.94 0.62 -3.19 0.55 3.41 -1.26 -4.42 113.62 105.40 2ntk n SER 26 Ca -0.41 0.12 -0.21 0.00 -0.26 0.00 0.00 58.87 58.10 2ntk n SER 26 Cb 0.80 0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.73 2ntk n SER 26 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2ntk n PHE 27 N -1.95 0.33 0.83 7.33 3.01 -1.26 -4.93 117.46 120.82 2ntk n PHE 27 Ca 0.04 -3.74 0.13 0.00 1.01 0.00 0.00 57.45 54.90 2ntk n PHE 27 Cb 0.41 -0.40 0.51 0.00 -0.01 0.00 0.00 39.48 39.99 2ntk n PHE 27 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 2ntk n PRO 28 N 0.73 0.12 -1.59 -1.08 -0.04 -1.26 -4.38 135.00 127.49 2ntk n PRO 28 Ca 0.24 0.09 -0.36 0.00 -0.04 0.00 0.00 63.50 63.44 2ntk n PRO 28 Cb 0.58 -1.63 -0.04 0.00 -0.04 0.00 0.00 33.50 32.37 2ntk n PRO 28 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2ntk n ASN 29 N -1.84 7.91 -4.14 3.54 5.03 -1.26 -4.89 115.26 119.61 2ntk n ASN 29 Ca 0.06 -2.87 -0.11 0.00 0.87 0.00 0.00 54.58 52.53 2ntk n ASN 29 Cb 0.38 -1.43 -0.10 0.00 -1.02 0.00 0.00 39.78 37.61 2ntk n ASN 29 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2ntk s ARG 30 N 0.25 0.76 0.28 3.52 0.52 -1.26 -1.86 118.95 121.15 2ntk s ARG 30 Ca 0.62 -1.21 0.01 0.00 -0.52 0.00 0.00 55.73 54.63 2ntk s ARG 30 Cb 0.22 -0.20 -0.03 0.00 0.52 0.00 0.00 34.95 35.46 2ntk s ARG 30 CO -0.09 -0.01 0.26 -0.08 0.02 0.00 0.00 175.30 175.40 2ntk s THR 31 N -3.19 0.00 0.00 0.02 -1.32 0.05 -4.68 115.64 106.53 2ntk s THR 31 Ca 0.07 -1.91 0.02 0.00 -1.21 0.00 0.00 61.69 58.66 2ntk s THR 31 Cb 0.02 -2.50 -0.04 0.00 -1.51 0.00 0.00 72.50 68.48 2ntk s THR 31 CO -0.04 0.00 -0.02 0.42 -2.21 0.00 0.00 174.62 172.77 2ntk s THR 32 N -3.71 4.02 -0.05 5.08 -4.23 -1.26 -1.25 115.64 114.24 2ntk s THR 32 Ca 0.38 -0.66 0.02 0.00 -1.18 0.00 0.00 61.69 60.24 2ntk s THR 32 Cb 0.04 -2.79 0.02 0.00 1.34 0.00 0.00 72.50 71.10 2ntk s THR 32 CO 0.19 0.37 -0.08 -0.55 -0.54 0.00 0.00 174.62 174.01 2ntk s SER 33 N -1.56 1.30 -0.14 3.99 0.15 0.77 -4.95 113.70 113.26 2ntk s SER 33 Ca 0.19 -0.20 -0.17 0.00 0.70 0.00 0.00 55.95 56.46 2ntk s SER 33 Cb -0.11 -0.59 -0.04 0.00 -1.71 0.00 0.00 66.02 63.56 2ntk s SER 33 CO 0.10 -0.01 0.45 -0.63 1.20 0.00 0.00 173.24 174.36 2ntk s ILE 34 N 0.73 5.20 0.28 6.45 1.01 -1.26 -0.35 121.20 133.25 2ntk s ILE 34 Ca -0.12 0.88 0.04 0.00 0.00 0.00 0.00 60.65 61.45 2ntk s ILE 34 Cb -0.15 -3.79 -0.01 0.00 0.01 0.00 0.00 42.46 38.52 2ntk s ILE 34 CO 0.02 0.31 0.13 0.00 0.00 0.00 0.00 174.94 175.40 2ntk n GLN 35 N 3.84 0.58 -1.58 2.79 1.13 0.01 -5.01 117.38 119.14 2ntk n GLN 35 Ca -0.07 -2.49 -0.45 0.00 -1.94 0.00 0.00 57.00 52.05 2ntk n GLN 35 Cb 0.51 1.53 -0.04 0.00 0.11 0.00 0.00 30.24 32.35 2ntk n GLN 35 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 2ntk n GLU 36 N -0.61 1.90 -2.10 -1.09 2.13 -1.26 -2.18 120.64 117.43 2ntk n GLU 36 Ca -0.02 0.58 -0.18 0.00 0.66 0.00 0.00 57.16 58.20 2ntk n GLU 36 Cb 0.44 -2.96 -0.03 0.00 0.27 0.00 0.00 31.44 29.16 2ntk n GLU 36 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2ntk n GLU 37 N 8.20 -1.69 -3.44 5.31 -0.58 -1.26 -4.94 120.64 122.24 2ntk n GLU 37 Ca 0.30 0.96 -0.12 0.00 -0.42 0.00 0.00 57.16 57.89 2ntk n GLU 37 Cb 0.37 -5.50 -0.02 0.00 -0.57 0.00 0.00 31.44 25.72 2ntk n GLU 37 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 2ntk s ARG 38 N -4.52 1.25 -0.07 3.49 1.70 -0.93 -0.40 118.95 119.47 2ntk s ARG 38 Ca 0.00 -0.47 0.02 0.00 -0.47 0.00 0.00 55.73 54.81 2ntk s ARG 38 Cb 0.00 0.57 0.01 0.00 -0.57 0.00 0.00 34.95 34.97 2ntk s ARG 38 CO 0.00 -0.55 -0.12 0.08 -1.08 0.00 0.00 175.30 173.63 2ntk s VAL 39 N -3.70 1.15 0.08 4.99 1.01 -0.26 -0.81 120.40 122.86 2ntk s VAL 39 Ca 0.02 -0.47 0.07 0.00 0.00 0.00 0.00 61.98 61.60 2ntk s VAL 39 Cb -0.01 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.27 2ntk s VAL 39 CO -0.12 0.36 -0.12 0.00 0.00 0.00 0.00 175.10 175.22 2ntk s ALA 40 N 0.82 2.87 -0.27 5.51 0.00 0.52 -0.48 121.76 130.73 2ntk s ALA 40 Ca -0.12 -1.22 -0.12 0.00 0.00 0.00 0.00 51.96 50.51 2ntk s ALA 40 Cb -0.15 -0.87 -0.05 0.00 0.00 0.00 0.00 23.12 22.05 2ntk s ALA 40 CO 0.02 0.62 0.22 0.08 0.00 0.00 0.00 175.76 176.70 2ntk s VAL 41 N -1.13 5.29 0.06 0.00 1.01 0.10 -0.16 120.40 125.58 2ntk s VAL 41 Ca 0.19 0.24 -0.02 0.00 0.00 0.00 0.00 61.98 62.40 2ntk s VAL 41 Cb -0.11 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 2ntk s VAL 41 CO 0.11 0.25 -0.00 0.68 0.00 0.00 0.00 175.10 176.14 2ntk s VAL 42 N 1.71 0.20 0.57 2.92 -7.23 -0.38 -1.99 120.40 116.20 2ntk s VAL 42 Ca 0.09 -1.78 -0.18 0.00 -1.81 0.00 0.00 61.98 58.29 2ntk s VAL 42 Cb -0.16 -1.58 -0.04 0.00 0.56 0.00 0.00 36.38 35.16 2ntk s VAL 42 CO 0.10 -0.90 1.14 -2.84 -0.31 0.00 0.00 175.10 172.28 2ntk s PRO 43 N -3.93 3.19 0.65 4.82 0.02 -1.26 -0.77 135.00 137.72 2ntk s PRO 43 Ca 0.09 1.59 -0.11 0.00 0.02 0.00 0.00 61.00 62.60 2ntk s PRO 43 Cb 0.08 -1.98 -0.02 0.00 0.02 0.00 0.00 34.50 32.59 2ntk s PRO 43 CO -0.08 -0.97 1.05 0.14 -0.33 0.00 0.00 177.00 176.80 2ntk s VAL 44 N -1.86 4.33 0.16 3.83 -7.23 -0.78 -4.71 120.40 114.14 2ntk s VAL 44 Ca 0.72 0.76 -0.33 0.00 -1.81 0.00 0.00 61.98 61.32 2ntk s VAL 44 Cb -0.24 -3.69 -0.16 0.00 0.56 0.00 0.00 36.38 32.85 2ntk s VAL 44 CO 0.31 -0.99 1.17 1.21 -0.31 0.00 0.00 175.10 176.49 2ntk n GLU 45 N -2.88 1.11 -0.24 4.82 2.13 -1.26 -1.71 120.64 122.61 2ntk n GLU 45 Ca 0.06 0.40 0.00 0.00 0.66 0.00 0.00 57.16 58.28 2ntk n GLU 45 Cb 0.54 -1.91 0.00 0.00 0.27 0.00 0.00 31.44 30.35 2ntk n GLU 45 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ntk n GLY 46 N 2.06 0.73 0.19 8.31 0.00 -1.26 -4.89 105.19 110.34 2ntk n GLY 46 Ca 0.16 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.21 2ntk n GLY 46 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2ntk n HIS 47 N -2.00 0.00 -0.34 1.61 8.25 -0.69 -4.85 115.22 117.19 2ntk n HIS 47 Ca 0.00 -0.41 0.18 0.00 -0.26 0.00 0.00 57.72 57.23 2ntk n HIS 47 Cb 0.00 -0.07 0.41 0.00 1.12 0.00 0.00 29.99 31.44 2ntk n HIS 47 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 2ntk h GLU 48 N 0.00 0.54 0.00 -0.41 3.07 -1.88 -0.73 114.58 115.17 2ntk h GLU 48 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 2ntk h GLU 48 Cb 1.04 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.83 2ntk h GLU 48 CO 0.00 0.36 0.00 0.54 -1.40 0.00 0.00 179.01 178.51 2ntk n ARG 49 N -4.80 0.02 0.24 2.33 1.74 -1.26 -2.74 116.66 112.19 2ntk n ARG 49 Ca 0.26 0.34 0.08 0.00 -0.77 0.00 0.00 57.85 57.76 2ntk n ARG 49 Cb 0.75 -1.50 0.59 0.00 -1.02 0.00 0.00 32.46 31.28 2ntk n ARG 49 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 2ntk h ASP 50 N 0.00 0.00 0.30 0.55 3.32 -1.53 -1.71 116.42 117.34 2ntk h ASP 50 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2ntk h ASP 50 Cb 0.11 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.66 2ntk h ASP 50 CO 0.00 0.15 -0.01 -0.37 -1.72 0.00 0.00 179.24 177.28 2ntk h VAL 51 N 0.00 0.09 -0.00 -1.35 -1.51 -1.74 0.40 116.25 112.14 2ntk h VAL 51 Ca -0.00 -0.19 0.00 0.00 -1.23 0.00 0.00 66.70 65.28 2ntk h VAL 51 Cb 0.28 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 30.61 2ntk h VAL 51 CO 0.02 0.01 -0.41 0.49 -1.23 0.00 0.00 177.57 176.45 2ntk n PHE 52 N -3.19 0.00 -0.06 5.19 3.01 -0.65 -3.95 117.46 117.82 2ntk n PHE 52 Ca -0.02 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.33 2ntk n PHE 52 Cb 0.15 -0.21 -0.15 0.00 -0.01 0.00 0.00 39.48 39.26 2ntk n PHE 52 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2ntk n ARG 53 N -1.22 0.67 -3.67 -1.08 1.74 0.08 -4.89 116.66 108.28 2ntk n ARG 53 Ca 0.08 0.17 -0.14 0.00 -0.77 0.00 0.00 57.85 57.19 2ntk n ARG 53 Cb 0.34 -1.66 -0.14 0.00 -1.02 0.00 0.00 32.46 29.98 2ntk n ARG 53 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2ntk s ASN 54 N -6.03 0.36 0.00 0.55 3.84 -0.87 -5.04 114.94 107.74 2ntk s ASN 54 Ca -0.11 0.51 0.21 0.00 0.21 0.00 0.00 52.86 53.68 2ntk s ASN 54 Cb 0.07 0.54 1.27 0.00 -0.55 0.00 0.00 41.25 42.58 2ntk s ASN 54 CO 0.80 -0.23 1.71 -0.81 -2.79 0.00 0.00 177.10 175.78 2ntk n PRO 55 N 5.17 0.82 -0.10 0.43 -0.04 -1.26 -3.63 135.00 136.39 2ntk n PRO 55 Ca -0.09 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.42 2ntk n PRO 55 Cb 0.50 -1.40 0.11 0.00 -0.04 0.00 0.00 33.50 32.66 2ntk n PRO 55 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2ntk n TYR 56 N -0.90 0.27 0.65 0.54 0.53 -1.26 -4.66 117.16 112.33 2ntk n TYR 56 Ca 0.16 -0.31 0.11 0.00 -1.02 0.00 0.00 57.90 56.84 2ntk n TYR 56 Cb 0.07 -0.02 -0.03 0.00 -1.03 0.00 0.00 39.34 38.33 2ntk n TYR 56 CO 0.00 0.00 0.00 0.44 -1.02 0.00 0.00 176.86 176.28 2ntk n ILE 57 N 0.52 0.08 -4.79 -0.72 -5.35 -1.24 -4.88 119.36 102.98 2ntk n ILE 57 Ca 0.09 -0.19 -0.28 0.00 -0.27 0.00 0.00 62.75 62.10 2ntk n ILE 57 Cb 0.36 0.43 -0.17 0.00 -1.74 0.00 0.00 39.64 38.52 2ntk n ILE 57 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2ntk s ALA 58 N -3.17 1.68 -0.12 -1.28 0.00 -1.26 -4.62 121.76 112.99 2ntk s ALA 58 Ca 0.04 -0.68 -0.33 0.00 0.00 0.00 0.00 51.96 50.98 2ntk s ALA 58 Cb 0.15 -0.71 0.14 0.00 0.00 0.00 0.00 23.12 22.70 2ntk s ALA 58 CO 0.83 0.14 1.36 1.52 0.00 0.00 0.00 175.76 179.61 2ntk s TYR 59 N 0.61 -0.03 -0.11 0.00 -0.85 -0.84 -4.85 117.35 111.28 2ntk s TYR 59 Ca -0.14 -0.01 -0.27 0.00 -0.52 0.00 0.00 57.07 56.12 2ntk s TYR 59 Cb -0.16 0.52 -0.02 0.00 0.38 0.00 0.00 41.96 42.67 2ntk s TYR 59 CO 0.04 -0.11 0.91 -0.80 -1.52 0.00 0.00 175.55 174.07 2ntk s ASN 60 N -2.72 7.13 0.06 -0.18 0.01 -1.26 0.03 114.94 118.01 2ntk s ASN 60 Ca 0.14 1.38 0.22 0.00 -0.71 0.00 0.00 52.86 53.89 2ntk s ASN 60 Cb 0.04 -2.50 -0.18 0.00 0.41 0.00 0.00 41.25 39.02 2ntk s ASN 60 CO -0.05 -0.36 0.74 0.00 -1.51 0.00 0.00 177.10 175.92 2ntk s ILE 62 N -3.42 -0.02 -0.02 0.00 1.01 -1.03 -1.35 121.20 116.37 2ntk s ILE 62 Ca -0.04 0.08 0.01 0.00 0.00 0.00 0.00 60.65 60.71 2ntk s ILE 62 Cb 0.13 -0.05 0.01 0.00 0.01 0.00 0.00 42.46 42.56 2ntk s ILE 62 CO 0.86 0.03 -0.05 -0.13 0.00 0.00 0.00 174.94 175.66 2ntk s ARG 63 N 0.43 0.56 -0.19 2.79 1.81 -0.46 -1.11 118.95 122.78 2ntk s ARG 63 Ca -0.04 -0.14 -0.03 0.00 -1.72 0.00 0.00 55.73 53.80 2ntk s ARG 63 Cb -0.05 -0.58 -0.01 0.00 -0.45 0.00 0.00 34.95 33.86 2ntk s ARG 63 CO -0.01 0.03 -0.06 0.42 -0.68 0.00 0.00 175.30 175.00 2ntk s ILE 64 N 0.34 3.42 -0.29 1.52 -1.09 0.46 -0.91 121.20 124.65 2ntk s ILE 64 Ca -0.04 -0.49 0.01 0.00 -2.23 0.00 0.00 60.65 57.90 2ntk s ILE 64 Cb -0.08 -2.53 0.08 0.00 -1.58 0.00 0.00 42.46 38.36 2ntk s ILE 64 CO -0.00 0.45 0.02 0.68 -1.23 0.00 0.00 174.94 174.86 2ntk s VAL 65 N 1.10 1.61 0.00 2.92 -7.23 0.21 -4.89 120.40 114.12 2ntk s VAL 65 Ca 0.01 -1.65 0.00 0.00 -1.81 0.00 0.00 61.98 58.53 2ntk s VAL 65 Cb -0.15 -2.07 0.00 0.00 0.56 0.00 0.00 36.38 34.73 2ntk s VAL 65 CO -0.01 -0.42 0.00 0.61 -0.31 0.00 0.00 175.10 174.98 2ntk n GLY 66 N 4.58 4.04 0.30 2.32 0.00 -1.26 -0.63 105.19 114.53 2ntk n GLY 66 Ca -0.04 0.08 0.13 0.00 0.00 0.00 0.00 46.02 46.19 2ntk n GLY 66 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2ntk n ASP 67 N 7.29 0.91 -4.64 1.61 5.75 -1.26 -4.87 116.55 121.33 2ntk n ASP 67 Ca 0.00 -1.42 -0.35 0.00 -0.01 0.00 0.00 54.79 53.01 2ntk n ASP 67 Cb 0.00 -0.03 -0.10 0.00 -1.03 0.00 0.00 41.12 39.96 2ntk n ASP 67 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2ntk s THR 68 N -1.95 4.23 -0.12 2.12 2.01 0.20 -4.11 115.64 118.02 2ntk s THR 68 Ca 0.37 -0.27 -0.01 0.00 0.31 0.00 0.00 61.69 62.09 2ntk s THR 68 Cb 0.19 -2.79 -0.02 0.00 0.01 0.00 0.00 72.50 69.88 2ntk s THR 68 CO 0.30 0.58 -0.08 0.00 -0.69 0.00 0.00 174.62 174.73 2ntk s ALA 69 N -0.61 2.84 -0.04 7.40 0.00 -0.16 -0.62 121.76 130.57 2ntk s ALA 69 Ca 0.10 -0.87 0.07 0.00 0.00 0.00 0.00 51.96 51.26 2ntk s ALA 69 Cb -0.12 -1.32 -0.01 0.00 0.00 0.00 0.00 23.12 21.67 2ntk s ALA 69 CO 0.02 0.33 -0.24 0.08 0.00 0.00 0.00 175.76 175.95 2ntk s VAL 70 N 0.01 1.95 -0.00 0.00 1.01 -0.09 -0.87 120.40 122.41 2ntk s VAL 70 Ca -0.02 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 60.95 2ntk s VAL 70 Cb -0.14 -1.63 -0.00 0.00 0.00 0.00 0.00 36.38 34.60 2ntk s VAL 70 CO 0.03 0.55 -0.04 0.54 0.00 0.00 0.00 175.10 176.18 2ntk s VAL 71 N -0.32 0.29 0.13 2.92 0.11 0.13 -1.35 120.40 122.32 2ntk s VAL 71 Ca 0.02 -0.16 -0.25 0.00 -2.93 0.00 0.00 61.98 58.66 2ntk s VAL 71 Cb -0.12 -0.25 0.07 0.00 -1.53 0.00 0.00 36.38 34.55 2ntk s VAL 71 CO 0.02 0.08 0.86 -0.94 -3.33 0.00 0.00 175.10 171.79 2ntk s SER 72 N -0.09 -0.28 -0.08 3.54 1.04 -0.46 -0.76 113.70 116.61 2ntk s SER 72 Ca 0.01 -0.29 0.12 0.00 0.48 0.00 0.00 55.95 56.27 2ntk s SER 72 Cb -0.01 0.51 0.47 0.00 0.10 0.00 0.00 66.02 67.09 2ntk s SER 72 CO -0.00 -0.91 1.32 -0.46 0.98 0.00 0.00 173.24 174.17 2ntk n ASN 73 N -0.40 3.30 -0.76 7.02 6.94 -1.12 -4.40 115.26 125.83 2ntk n ASN 73 Ca -0.08 -2.31 0.00 0.00 -0.02 0.00 0.00 54.58 52.18 2ntk n ASN 73 Cb 0.61 -0.47 0.00 0.00 -2.36 0.00 0.00 39.78 37.56 2ntk n ASN 73 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2ntk n GLY 74 N 0.81 2.35 0.02 4.83 0.00 -1.26 -4.97 105.19 106.96 2ntk n GLY 74 Ca 0.17 -0.99 0.07 0.00 0.00 0.00 0.00 46.02 45.27 2ntk n GLY 74 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ntk n SER 75 N -0.85 0.09 0.00 1.61 3.41 -1.26 -2.22 113.62 114.41 2ntk n SER 75 Ca 0.00 0.53 0.06 0.00 -0.26 0.00 0.00 58.87 59.20 2ntk n SER 75 Cb 0.00 -0.54 0.31 0.00 -0.26 0.00 0.00 64.21 63.71 2ntk n SER 75 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ntk n HIS 76 N -1.61 0.00 -0.23 7.33 1.44 -1.26 -1.84 115.22 119.06 2ntk n HIS 76 Ca 0.03 0.00 -0.07 0.00 -2.01 0.00 0.00 57.72 55.67 2ntk n HIS 76 Cb 0.15 -0.34 0.04 0.00 0.12 0.00 0.00 29.99 29.96 2ntk n HIS 76 CO 0.00 0.00 0.00 1.15 -2.81 0.00 0.00 176.34 174.68 2ntk h THR 77 N 0.00 1.23 -0.15 0.61 2.02 -1.68 -0.87 112.91 114.07 2ntk h THR 77 Ca 0.00 -0.66 -0.20 0.00 0.77 0.00 0.00 66.41 66.32 2ntk h THR 77 Cb 0.14 0.48 0.00 0.00 -1.74 0.00 0.00 68.15 67.03 2ntk h THR 77 CO 0.00 0.27 -0.71 0.44 0.37 0.00 0.00 175.52 175.89 2ntk h ASP 78 N 0.89 0.77 -0.60 4.18 3.32 -1.62 -0.89 116.42 122.46 2ntk h ASP 78 Ca 0.22 -0.48 0.01 0.00 0.02 0.00 0.00 57.03 56.79 2ntk h ASP 78 Cb 0.15 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.45 2ntk h ASP 78 CO -0.02 1.25 0.40 0.74 -1.72 0.00 0.00 179.24 179.89 2ntk h THR 79 N 0.46 1.16 -0.05 0.35 2.02 -1.46 0.50 112.91 115.89 2ntk h THR 79 Ca -0.03 -0.28 -0.05 0.00 0.77 0.00 0.00 66.41 66.82 2ntk h THR 79 Cb 1.31 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 67.99 2ntk h THR 79 CO 0.14 0.15 -0.15 0.40 0.37 0.00 0.00 175.52 176.43 2ntk h ILE 80 N 0.82 1.45 -0.79 3.11 2.04 -1.16 -2.98 117.51 120.00 2ntk h ILE 80 Ca 0.22 -1.54 0.02 0.00 1.00 0.00 0.00 64.86 64.56 2ntk h ILE 80 Cb -0.09 2.33 -0.04 0.00 -0.74 0.00 0.00 36.82 38.28 2ntk h ILE 80 CO -0.05 0.42 0.52 0.00 0.00 0.00 0.00 178.15 179.05 2ntk h ALA 81 N 0.43 1.02 -0.73 1.87 0.00 -1.04 -1.66 119.26 119.15 2ntk h ALA 81 Ca -0.00 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.87 2ntk h ALA 81 Cb 0.76 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 2ntk h ALA 81 CO 0.03 0.38 0.48 -0.44 0.00 0.00 0.00 179.25 179.70 2ntk h ASP 82 N 1.04 0.83 -0.58 0.00 3.32 -0.96 -0.07 116.42 120.01 2ntk h ASP 82 Ca 0.30 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.25 2ntk h ASP 82 Cb -0.08 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.24 2ntk h ASP 82 CO -0.08 0.60 0.07 0.11 -1.72 0.00 0.00 179.24 178.22 2ntk h LYS 83 N 0.98 0.98 -0.56 3.56 1.79 -1.28 -0.59 116.57 121.45 2ntk h LYS 83 Ca 0.27 -0.28 -0.01 0.00 -2.18 0.00 0.00 60.65 58.45 2ntk h LYS 83 Cb -0.10 -0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 30.41 2ntk h LYS 83 CO -0.06 0.94 0.32 0.28 -1.08 0.00 0.00 179.45 179.84 2ntk h VAL 84 N 0.88 1.18 -0.80 0.50 2.07 -0.90 -1.19 116.25 117.99 2ntk h VAL 84 Ca 0.17 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 2ntk h VAL 84 Cb 0.45 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 2ntk h VAL 84 CO 0.02 0.19 0.47 0.00 0.02 0.00 0.00 177.57 178.27 2ntk h ALA 85 N 1.15 1.33 -0.03 1.67 0.00 -0.63 -2.03 119.26 120.71 2ntk h ALA 85 Ca 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2ntk h ALA 85 Cb 0.02 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.49 2ntk h ALA 85 CO -0.03 0.57 0.00 1.28 0.00 0.00 0.00 179.25 181.07 2ntk n LEU 86 N -4.37 0.81 -0.26 0.00 4.77 -0.26 -4.95 117.00 112.74 2ntk n LEU 86 Ca 0.08 -0.29 0.00 0.00 -0.03 0.00 0.00 56.01 55.77 2ntk n LEU 86 Cb 0.07 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2ntk n LEU 86 CO 0.38 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 2ntk n GLY 87 N 1.05 -0.61 3.63 -0.72 0.00 -0.50 -5.06 105.19 102.98 2ntk n GLY 87 Ca 0.19 -0.67 -0.03 0.00 0.00 0.00 0.00 46.02 45.51 2ntk n GLY 87 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2ntk s MET 88 N -0.03 0.46 0.82 1.61 0.00 -1.12 -4.89 119.30 116.15 2ntk s MET 88 Ca 0.00 0.83 -0.13 0.00 0.00 0.00 0.00 55.69 56.39 2ntk s MET 88 Cb 0.00 0.14 0.07 0.00 0.00 0.00 0.00 34.83 35.05 2ntk s MET 88 CO 0.00 -0.10 1.09 0.27 0.00 0.00 0.00 175.02 176.27 2ntk n ASN 89 N 4.00 0.58 -0.24 1.11 0.23 -1.26 -4.38 115.26 115.30 2ntk n ASN 89 Ca -0.18 0.56 -0.02 0.00 -0.53 0.00 0.00 54.58 54.40 2ntk n ASN 89 Cb 0.57 -1.46 0.09 0.00 -2.08 0.00 0.00 39.78 36.90 2ntk n ASN 89 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 2ntk h LEU 90 N -0.98 0.65 -0.36 -4.53 3.38 -1.99 -1.57 115.31 109.91 2ntk h LEU 90 Ca -0.46 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.53 2ntk h LEU 90 Cb 1.30 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 2ntk h LEU 90 CO 0.44 0.43 0.23 -0.09 0.09 0.00 0.00 178.44 179.54 2ntk h ARG 91 N 0.78 0.45 -0.14 1.13 2.43 -1.97 -1.82 114.38 115.24 2ntk h ARG 91 Ca 0.29 -0.03 -0.17 0.00 -0.81 0.00 0.00 59.98 59.26 2ntk h ARG 91 Cb 0.10 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.54 2ntk h ARG 91 CO -0.14 0.30 -0.63 -0.44 -1.51 0.00 0.00 179.97 177.54 2ntk h ASP 92 N 0.46 0.57 -0.27 -3.80 3.32 -1.90 0.55 116.42 115.36 2ntk h ASP 92 Ca 0.13 -0.34 -0.00 0.00 0.02 0.00 0.00 57.03 56.85 2ntk h ASP 92 Cb -0.03 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.34 2ntk h ASP 92 CO -0.04 1.06 0.16 0.00 -1.72 0.00 0.00 179.24 178.70 2ntk h ALA 93 N 0.94 0.35 -0.13 3.45 0.00 -1.10 0.20 119.26 122.96 2ntk h ALA 93 Ca -0.01 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 2ntk h ALA 93 Cb 1.19 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 2ntk h ALA 93 CO 0.11 -0.14 -0.12 0.82 0.00 0.00 0.00 179.25 179.92 2ntk h ILE 94 N 0.34 1.35 -0.32 0.00 2.04 -1.32 -2.60 117.51 116.99 2ntk h ILE 94 Ca 0.10 -1.27 0.04 0.00 1.00 0.00 0.00 64.86 64.72 2ntk h ILE 94 Cb 0.03 1.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.96 2ntk h ILE 94 CO -0.02 0.37 0.11 1.23 0.00 0.00 0.00 178.15 179.84 2ntk h GLY 95 N -0.06 0.40 0.96 5.37 0.00 -0.70 -0.93 103.07 108.10 2ntk h GLY 95 Ca 0.02 -0.06 -0.06 0.00 0.00 0.00 0.00 47.33 47.23 2ntk h GLY 95 CO 0.03 0.03 0.04 -2.00 0.00 0.00 0.00 176.54 174.64 2ntk h LEU 96 N 0.25 0.71 -0.50 3.11 5.85 -0.68 -1.54 115.31 122.51 2ntk h LEU 96 Ca 0.14 -0.28 -0.04 0.00 0.84 0.00 0.00 57.88 58.55 2ntk h LEU 96 Cb 0.11 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 2ntk h LEU 96 CO -0.15 0.81 0.17 0.28 -0.34 0.00 0.00 178.44 179.22 2ntk h SER 97 N 0.58 0.72 -0.16 1.25 0.02 -1.26 -1.67 113.55 113.04 2ntk h SER 97 Ca 0.13 -0.20 -0.18 0.00 -0.84 0.00 0.00 61.79 60.70 2ntk h SER 97 Cb 0.42 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.78 2ntk h SER 97 CO 0.01 0.72 -0.57 -0.07 -1.14 0.00 0.00 176.83 175.78 2ntk h LEU 98 N 0.67 0.85 -0.58 5.07 3.38 -1.15 -0.98 115.31 122.57 2ntk h LEU 98 Ca 0.16 -0.47 -0.00 0.00 0.09 0.00 0.00 57.88 57.66 2ntk h LEU 98 Cb 0.25 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2ntk h LEU 98 CO -0.01 1.24 0.35 0.25 0.09 0.00 0.00 178.44 180.37 2ntk h LEU 99 N 0.57 0.69 -0.01 1.67 5.85 -1.19 0.20 115.31 123.10 2ntk h LEU 99 Ca 0.01 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.67 2ntk h LEU 99 Cb 1.16 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.02 2ntk h LEU 99 CO 0.12 0.54 -0.01 0.00 -0.34 0.00 0.00 178.44 178.75 2ntk h ALA 100 N 1.18 0.01 -0.00 1.25 0.00 -1.25 -3.34 119.26 117.11 2ntk h ALA 100 Ca 0.21 -0.29 -0.21 0.00 0.00 0.00 0.00 54.91 54.62 2ntk h ALA 100 Cb -0.03 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2ntk h ALA 100 CO -0.04 -0.20 -0.91 0.52 0.00 0.00 0.00 179.25 178.63 2ntk h MET 101 N -0.54 0.33 0.00 0.00 2.86 -1.17 -3.50 114.93 112.92 2ntk h MET 101 Ca 0.00 -0.35 0.24 0.00 -2.06 0.00 0.00 59.70 57.53 2ntk h MET 101 Cb 0.58 0.10 -0.06 0.00 0.06 0.00 0.00 31.60 32.28 2ntk h MET 101 CO 0.00 1.04 -0.31 -3.47 1.06 0.00 0.00 176.91 175.23 2ntk n ASP 102 N -3.72 -5.65 -4.75 1.22 4.64 0.68 -4.83 116.55 104.14 2ntk n ASP 102 Ca -0.05 0.93 -0.31 0.00 -1.38 0.00 0.00 54.79 53.98 2ntk n ASP 102 Cb 0.82 -2.63 0.10 0.00 -1.04 0.00 0.00 41.12 38.37 2ntk n ASP 102 CO 0.00 0.00 0.00 -0.72 -0.82 0.00 0.00 177.20 175.66 2ntk s TYR 103 N -1.61 2.41 0.26 -0.67 -0.85 -1.26 -4.60 117.35 111.02 2ntk s TYR 103 Ca 0.00 1.60 -0.30 0.00 -0.52 0.00 0.00 57.07 57.85 2ntk s TYR 103 Cb 0.00 -3.11 -0.09 0.00 0.38 0.00 0.00 41.96 39.14 2ntk s TYR 103 CO 0.00 -1.98 1.04 -1.21 -1.52 0.00 0.00 175.55 171.88 2ntk s GLU 104 N -4.81 4.72 -1.33 -3.49 2.02 0.10 -4.96 118.70 110.96 2ntk s GLU 104 Ca 0.63 1.68 -0.08 0.00 0.02 0.00 0.00 54.97 57.22 2ntk s GLU 104 Cb -0.18 -3.23 0.13 0.00 0.10 0.00 0.00 34.13 30.94 2ntk s GLU 104 CO 0.55 0.32 2.20 1.63 0.02 0.00 0.00 175.26 179.99 2ntk n LYS 105 N 1.37 4.10 -1.11 1.61 4.76 -1.26 -3.34 118.16 124.30 2ntk n LYS 105 Ca -0.01 -3.39 0.00 0.00 -2.87 0.00 0.00 58.31 52.03 2ntk n LYS 105 Cb 0.46 -2.78 0.00 0.00 -1.84 0.00 0.00 35.03 30.87 2ntk n LYS 105 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2ntk n ASP 106 N 2.82 1.43 0.29 4.39 5.68 -1.26 -4.98 116.55 124.92 2ntk n ASP 106 Ca 0.54 -0.65 0.19 0.00 -0.50 0.00 0.00 54.79 54.37 2ntk n ASP 106 Cb 0.30 0.00 0.89 0.00 -1.14 0.00 0.00 41.12 41.17 2ntk n ASP 106 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2ntk h GLU 107 N 0.00 0.00 -0.16 0.11 5.08 -2.02 -3.03 114.58 114.56 2ntk h GLU 107 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2ntk h GLU 107 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2ntk h GLU 107 CO 0.00 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.29 2ntk n LEU 108 N -3.00 2.31 -3.83 1.33 4.77 -1.26 -4.97 117.00 112.35 2ntk n LEU 108 Ca -0.01 -1.69 -0.29 0.00 -0.03 0.00 0.00 56.01 53.99 2ntk n LEU 108 Cb 0.19 -0.11 0.03 0.00 -2.33 0.00 0.00 43.42 41.20 2ntk n LEU 108 CO 0.23 0.55 0.10 0.59 -1.33 0.00 0.00 177.39 177.53 2ntk n ASN 109 N 0.25 -4.88 -4.67 -1.43 3.02 -1.14 -4.79 115.26 101.62 2ntk n ASN 109 Ca 0.07 -0.72 -0.57 0.00 -0.03 0.00 0.00 54.58 53.33 2ntk n ASN 109 Cb 0.31 -3.90 -0.07 0.00 -0.61 0.00 0.00 39.78 35.51 2ntk n ASN 109 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2ntk n THR 110 N -4.64 0.18 -0.97 3.41 -1.04 -1.21 -4.49 114.28 105.52 2ntk n THR 110 Ca 0.03 -0.03 -0.30 0.00 -2.04 0.00 0.00 64.05 61.71 2ntk n THR 110 Cb 0.53 -0.99 0.15 0.00 -1.82 0.00 0.00 70.33 68.20 2ntk n THR 110 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2ntk s PRO 111 N 2.51 1.19 -0.17 -2.82 0.02 -1.26 0.03 135.00 134.51 2ntk s PRO 111 Ca 0.95 1.17 -0.04 0.00 0.02 0.00 0.00 61.00 63.10 2ntk s PRO 111 Cb -1.09 -1.78 -0.03 0.00 0.02 0.00 0.00 34.50 31.63 2ntk s PRO 111 CO 0.62 -2.39 -0.03 1.03 -0.33 0.00 0.00 177.00 175.90 2ntk s ARG 112 N -4.77 3.65 0.22 5.54 0.52 -1.00 -4.68 118.95 118.43 2ntk s ARG 112 Ca 0.64 -0.52 0.11 0.00 -0.52 0.00 0.00 55.73 55.44 2ntk s ARG 112 Cb -0.20 -2.95 -0.05 0.00 0.52 0.00 0.00 34.95 32.27 2ntk s ARG 112 CO 0.58 0.18 -0.21 0.96 0.02 0.00 0.00 175.30 176.83 2ntk s ILE 113 N 0.54 2.50 0.11 1.52 -4.36 -1.26 -1.74 121.20 118.51 2ntk s ILE 113 Ca -0.03 -2.12 -0.25 0.00 -0.26 0.00 0.00 60.65 57.99 2ntk s ILE 113 Cb -0.14 -2.24 0.08 0.00 1.25 0.00 0.00 42.46 41.40 2ntk s ILE 113 CO 0.03 -0.22 0.81 0.00 0.24 0.00 0.00 174.94 175.80 2ntk s ALA 114 N -1.97 -1.66 0.08 2.27 0.00 -0.47 -2.80 121.76 117.22 2ntk s ALA 114 Ca 0.24 0.52 -0.22 0.00 0.00 0.00 0.00 51.96 52.50 2ntk s ALA 114 Cb -0.07 0.64 0.06 0.00 0.00 0.00 0.00 23.12 23.75 2ntk s ALA 114 CO 0.12 -0.83 0.53 0.00 0.00 0.00 0.00 175.76 175.58 2ntk s ALA 115 N -3.42 -1.36 -0.08 0.00 0.00 0.06 0.03 121.76 116.99 2ntk s ALA 115 Ca 0.06 0.51 -0.13 0.00 0.00 0.00 0.00 51.96 52.40 2ntk s ALA 115 Cb -0.02 0.54 0.03 0.00 0.00 0.00 0.00 23.12 23.68 2ntk s ALA 115 CO -0.06 -0.59 0.33 0.00 0.00 0.00 0.00 175.76 175.44 2ntk s ALA 116 N -2.93 -0.82 -0.10 0.00 0.00 -0.71 -0.69 121.76 116.50 2ntk s ALA 116 Ca -0.03 0.70 -0.08 0.00 0.00 0.00 0.00 51.96 52.56 2ntk s ALA 116 Cb -0.00 -0.30 0.03 0.00 0.00 0.00 0.00 23.12 22.86 2ntk s ALA 116 CO -0.06 -0.20 0.26 -1.50 0.00 0.00 0.00 175.76 174.26 2ntk s ILE 117 N -0.45 -0.01 0.00 0.00 2.07 -0.05 -1.53 121.20 121.22 2ntk s ILE 117 Ca -0.06 0.05 0.00 0.00 -1.41 0.00 0.00 60.65 59.24 2ntk s ILE 117 Cb -0.04 -0.38 0.00 0.00 0.13 0.00 0.00 42.46 42.18 2ntk s ILE 117 CO 0.02 0.02 0.00 -0.46 -1.91 0.00 0.00 174.94 172.61 2ntk n ASN 118 N 3.44 1.46 0.28 4.50 0.23 -0.42 -0.99 115.26 123.75 2ntk n ASN 118 Ca -0.17 -0.69 0.14 0.00 -0.53 0.00 0.00 54.58 53.33 2ntk n ASN 118 Cb 0.56 0.00 0.82 0.00 -2.08 0.00 0.00 39.78 39.08 2ntk n ASN 118 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2ntk h GLY 119 N 0.00 0.00 0.00 4.83 0.00 -2.02 -3.31 103.07 102.56 2ntk h GLY 119 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2ntk h GLY 119 CO 0.00 0.00 -1.30 -1.14 0.00 0.00 0.00 176.54 174.10 2ntk n SER 120 N -3.72 3.64 -3.93 0.19 3.41 -1.26 -5.09 113.62 106.84 2ntk n SER 120 Ca -0.02 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.50 2ntk n SER 120 Cb 0.17 1.12 -0.04 0.00 -0.26 0.00 0.00 64.21 65.19 2ntk n SER 120 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2ntk s GLU 121 N -2.35 1.56 -0.02 4.33 -1.05 -1.25 -5.15 118.70 114.78 2ntk s GLU 121 Ca -0.02 -1.14 -0.11 0.00 -0.15 0.00 0.00 54.97 53.55 2ntk s GLU 121 Cb 0.03 0.50 0.01 0.00 -0.44 0.00 0.00 34.13 34.24 2ntk s GLU 121 CO 0.24 -0.66 0.22 0.00 0.95 0.00 0.00 175.26 176.01 2ntk s ALA 122 N -3.98 -0.55 0.06 -0.84 0.00 -1.26 -1.30 121.76 113.88 2ntk s ALA 122 Ca 0.18 0.15 0.02 0.00 0.00 0.00 0.00 51.96 52.31 2ntk s ALA 122 Cb -0.02 0.04 -0.03 0.00 0.00 0.00 0.00 23.12 23.11 2ntk s ALA 122 CO 0.07 -0.22 -0.07 -0.06 0.00 0.00 0.00 175.76 175.47 2ntk s PHE 123 N -1.19 0.70 0.03 0.00 0.40 -0.59 -0.87 117.98 116.46 2ntk s PHE 123 Ca -0.13 -0.62 0.03 0.00 -0.60 0.00 0.00 56.93 55.61 2ntk s PHE 123 Cb -0.06 -0.42 -0.02 0.00 0.51 0.00 0.00 43.02 43.03 2ntk s PHE 123 CO 0.03 -0.11 -0.10 -1.50 0.70 0.00 0.00 175.22 174.23 2ntk s ILE 124 N -2.02 0.76 0.12 0.64 2.07 -0.16 -1.74 121.20 120.87 2ntk s ILE 124 Ca -0.04 -0.83 -0.10 0.00 -1.41 0.00 0.00 60.65 58.27 2ntk s ILE 124 Cb -0.06 -0.72 0.00 0.00 0.13 0.00 0.00 42.46 41.82 2ntk s ILE 124 CO -0.01 -0.09 0.27 -0.83 -1.91 0.00 0.00 174.94 172.37 2ntk s GLY 125 N -1.01 0.12 -0.08 1.50 0.00 0.10 -0.60 107.32 107.35 2ntk s GLY 125 Ca -0.02 -0.57 -0.20 0.00 0.00 0.00 0.00 44.72 43.93 2ntk s GLY 125 CO 0.01 -0.70 0.48 -1.50 0.00 0.00 0.00 173.10 171.39 2ntk s ILE 126 N -3.88 0.02 -0.06 0.90 2.07 0.26 -1.37 121.20 119.15 2ntk s ILE 126 Ca 0.08 -0.18 0.01 0.00 -1.41 0.00 0.00 60.65 59.14 2ntk s ILE 126 Cb 0.04 -0.75 0.02 0.00 0.13 0.00 0.00 42.46 41.90 2ntk s ILE 126 CO -0.08 -0.10 -0.05 0.54 -1.91 0.00 0.00 174.94 173.35 2ntk s VAL 127 N -0.76 0.60 0.28 4.00 0.11 -0.71 -0.90 120.40 123.03 2ntk s VAL 127 Ca -0.08 -0.12 0.02 0.00 -2.93 0.00 0.00 61.98 58.87 2ntk s VAL 127 Cb -0.03 -0.64 -0.01 0.00 -1.53 0.00 0.00 36.38 34.17 2ntk s VAL 127 CO 0.05 0.26 0.08 0.35 -3.33 0.00 0.00 175.10 172.50 2ntk n THR 128 N 4.31 0.00 0.46 5.04 -2.24 0.16 -2.37 114.28 119.65 2ntk n THR 128 Ca -0.20 -1.58 0.10 0.00 -2.27 0.00 0.00 64.05 60.09 2ntk n THR 128 Cb 0.51 0.52 0.40 0.00 -2.10 0.00 0.00 70.33 69.66 2ntk n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ntk n ALA 129 N -1.75 1.69 0.70 6.98 0.00 -1.26 -2.61 120.51 124.25 2ntk n ALA 129 Ca -0.11 0.01 0.08 0.00 0.00 0.00 0.00 53.44 53.42 2ntk n ALA 129 Cb 0.41 -1.32 0.02 0.00 0.00 0.00 0.00 19.45 18.56 2ntk n ALA 129 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2ntk n ASP 130 N -1.87 1.86 0.00 0.00 8.00 -1.26 -5.09 116.55 118.19 2ntk n ASP 130 Ca 0.03 -1.43 0.00 0.00 0.71 0.00 0.00 54.79 54.10 2ntk n ASP 130 Cb 0.21 0.32 0.00 0.00 -0.02 0.00 0.00 41.12 41.62 2ntk n ASP 130 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ntk n GLY 131 N 1.07 -1.27 2.84 0.44 0.00 -1.07 -5.13 105.19 102.06 2ntk n GLY 131 Ca 0.08 -1.13 -0.15 0.00 0.00 0.00 0.00 46.02 44.82 2ntk n GLY 131 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ntk s LEU 132 N 0.00 1.48 -0.08 0.99 2.96 -1.26 -0.66 118.68 122.10 2ntk s LEU 132 Ca 0.00 -0.01 -0.04 0.00 -0.22 0.00 0.00 54.13 53.87 2ntk s LEU 132 Cb 0.00 -0.12 0.04 0.00 0.50 0.00 0.00 46.19 46.61 2ntk s LEU 132 CO 0.00 -0.06 0.18 -0.32 -1.32 0.00 0.00 176.35 174.83 2ntk s MET 133 N 0.61 0.11 -0.07 1.98 -2.45 -0.08 -5.02 119.30 114.39 2ntk s MET 133 Ca -0.06 0.46 0.00 0.00 -1.25 0.00 0.00 55.69 54.85 2ntk s MET 133 Cb -0.08 -0.17 0.02 0.00 1.25 0.00 0.00 34.83 35.85 2ntk s MET 133 CO -0.01 -0.19 -0.05 0.08 1.05 0.00 0.00 175.02 175.89 2ntk s VAL 134 N 1.44 0.69 0.03 10.11 1.01 -1.26 -0.57 120.40 131.85 2ntk s VAL 134 Ca -0.07 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 61.78 2ntk s VAL 134 Cb -0.11 -0.74 -0.02 0.00 0.00 0.00 0.00 36.38 35.50 2ntk s VAL 134 CO -0.07 0.29 -0.04 -0.94 0.00 0.00 0.00 175.10 174.34 2ntk s SER 135 N 1.42 0.40 0.26 3.32 1.04 0.23 -4.96 113.70 115.41 2ntk s SER 135 Ca -0.02 -0.59 -0.30 0.00 0.48 0.00 0.00 55.95 55.52 2ntk s SER 135 Cb -0.13 0.10 -0.10 0.00 0.10 0.00 0.00 66.02 65.99 2ntk s SER 135 CO -0.03 -0.33 1.44 -0.60 0.98 0.00 0.00 173.24 174.70 2ntk s ARG 136 N -1.87 4.26 -0.00 4.02 3.52 -1.26 -0.98 118.95 126.63 2ntk s ARG 136 Ca -0.11 2.31 -0.30 0.00 -0.13 0.00 0.00 55.73 57.50 2ntk s ARG 136 Cb -0.07 -3.10 -0.03 0.00 -1.56 0.00 0.00 34.95 30.19 2ntk s ARG 136 CO -0.02 -0.41 1.03 0.08 -0.81 0.00 0.00 175.30 175.16 2ntk s VAL 137 N -0.11 4.69 0.13 7.11 1.01 -0.05 -4.86 120.40 128.31 2ntk s VAL 137 Ca 0.59 1.94 -0.35 0.00 0.00 0.00 0.00 61.98 64.16 2ntk s VAL 137 Cb -0.42 -4.24 -0.14 0.00 0.00 0.00 0.00 36.38 31.57 2ntk s VAL 137 CO 0.45 0.13 1.55 -2.65 0.00 0.00 0.00 175.10 174.57 2ntk n PRO 138 N 4.08 1.93 0.22 2.72 -0.02 -1.26 -4.73 135.00 137.94 2ntk n PRO 138 Ca 0.07 0.70 0.06 0.00 -2.02 0.00 0.00 63.50 62.31 2ntk n PRO 138 Cb 0.50 -2.44 0.51 0.00 -0.02 0.00 0.00 33.50 32.05 2ntk n PRO 138 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2ntk h GLU 139 N 5.84 0.00 0.00 -0.52 4.81 -1.98 -2.84 114.58 119.90 2ntk h GLU 139 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 2ntk h GLU 139 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 2ntk h GLU 139 CO 0.87 0.21 -0.01 -0.85 -0.73 0.00 0.00 179.01 178.50 2ntk n GLU 140 N -4.16 0.06 -3.60 1.92 0.00 -1.26 -4.88 120.64 108.72 2ntk n GLU 140 Ca -0.02 0.05 -0.15 0.00 0.00 0.00 0.00 57.16 57.04 2ntk n GLU 140 Cb 0.28 -1.57 -0.07 0.00 0.00 0.00 0.00 31.44 30.08 2ntk n GLU 140 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.13 177.05 2ntk s THR 141 N -3.02 0.00 0.65 3.84 -1.32 -1.07 -5.09 115.64 109.62 2ntk s THR 141 Ca 0.13 0.00 -0.15 0.00 -1.21 0.00 0.00 61.69 60.46 2ntk s THR 141 Cb 0.17 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 70.15 2ntk s THR 141 CO 0.55 0.00 1.09 -2.84 -2.21 0.00 0.00 174.62 171.21 2ntk s PRO 142 N -0.12 2.95 0.20 7.08 0.02 -1.25 -4.31 135.00 139.57 2ntk s PRO 142 Ca -0.03 1.29 0.01 0.00 0.02 0.00 0.00 61.00 62.29 2ntk s PRO 142 Cb -0.03 -1.98 -0.05 0.00 0.02 0.00 0.00 34.50 32.46 2ntk s PRO 142 CO 0.03 -1.12 0.07 0.14 -0.33 0.00 0.00 177.00 175.79 2ntk s VAL 143 N -2.45 0.40 0.10 3.83 -7.23 -0.61 -1.38 120.40 113.05 2ntk s VAL 143 Ca 0.65 -1.98 -0.05 0.00 -1.81 0.00 0.00 61.98 58.80 2ntk s VAL 143 Cb -0.18 -2.34 -0.02 0.00 0.56 0.00 0.00 36.38 34.39 2ntk s VAL 143 CO 0.41 -0.23 0.10 -0.72 -0.31 0.00 0.00 175.10 174.36 2ntk s TYR 144 N -3.86 0.46 0.04 2.82 -0.85 -0.38 -1.17 117.35 114.40 2ntk s TYR 144 Ca 0.31 -0.91 -0.18 0.00 -0.52 0.00 0.00 57.07 55.77 2ntk s TYR 144 Cb 0.07 -0.26 0.04 0.00 0.38 0.00 0.00 41.96 42.19 2ntk s TYR 144 CO 0.08 -0.51 0.41 -1.50 -1.52 0.00 0.00 175.55 172.51 2ntk s ILE 145 N -3.94 0.05 0.28 -3.49 2.07 -0.42 -1.33 121.20 114.43 2ntk s ILE 145 Ca 0.11 -0.44 0.02 0.00 -1.41 0.00 0.00 60.65 58.93 2ntk s ILE 145 Cb 0.06 -0.93 -0.04 0.00 0.13 0.00 0.00 42.46 41.68 2ntk s ILE 145 CO -0.06 -0.25 0.12 -0.94 -1.91 0.00 0.00 174.94 171.90 2ntk s SER 146 N -1.93 1.32 0.22 4.50 1.04 -0.44 -1.60 113.70 116.82 2ntk s SER 146 Ca -0.06 -1.46 0.13 0.00 0.48 0.00 0.00 55.95 55.04 2ntk s SER 146 Cb -0.01 0.26 -0.02 0.00 0.10 0.00 0.00 66.02 66.35 2ntk s SER 146 CO -0.01 -0.80 1.36 0.71 0.98 0.00 0.00 173.24 175.48 2ntk h THR 147 N 2.31 1.08 -4.32 2.02 1.35 -1.20 -3.35 112.91 110.81 2ntk h THR 147 Ca -0.36 -2.55 -0.58 0.00 -0.55 0.00 0.00 66.41 62.37 2ntk h THR 147 Cb 1.25 2.53 -0.28 0.00 -1.73 0.00 0.00 68.15 69.91 2ntk h THR 147 CO 0.57 0.62 -0.84 -0.31 -0.25 0.00 0.00 175.52 175.30 2ntk s TYR 148 N -2.89 1.74 0.00 4.73 4.12 -0.67 -4.46 117.35 119.93 2ntk s TYR 148 Ca 0.03 -0.34 0.00 0.00 0.02 0.00 0.00 57.07 56.78 2ntk s TYR 148 Cb 0.08 -1.10 0.00 0.00 -1.52 0.00 0.00 41.96 39.42 2ntk s TYR 148 CO 0.77 0.00 0.00 0.39 0.02 0.00 0.00 175.55 176.73 2ntk n GLU 149 N 2.40 0.00 -1.83 -0.62 -0.58 -1.26 -4.40 120.64 114.35 2ntk n GLU 149 Ca -0.16 0.00 -0.40 0.00 -0.42 0.00 0.00 57.16 56.19 2ntk n GLU 149 Cb 0.53 0.00 -0.01 0.00 -0.57 0.00 0.00 31.44 31.39 2ntk n GLU 149 CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 2ntk n GLN 150 N 0.00 4.36 -0.12 3.49 -0.06 -1.26 -4.69 117.38 119.10 2ntk n GLN 150 Ca 0.00 -3.16 -0.02 0.00 -2.00 0.00 0.00 57.00 51.82 2ntk n GLN 150 Cb 0.00 -2.68 0.02 0.00 -4.06 0.00 0.00 30.24 23.52 2ntk n GLN 150 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 2ntk n THR 151 N 2.21 1.12 -3.81 1.69 -2.24 -1.26 -1.32 114.28 110.67 2ntk n THR 151 Ca 0.66 -0.19 -0.12 0.00 -2.27 0.00 0.00 64.05 62.13 2ntk n THR 151 Cb 0.24 -0.90 -0.12 0.00 -2.10 0.00 0.00 70.33 67.46 2ntk n THR 151 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2ntk s GLU 152 N -0.42 0.29 0.32 -0.78 2.12 -1.26 -4.97 118.70 114.00 2ntk s GLU 152 Ca 0.06 0.15 -0.29 0.00 0.36 0.00 0.00 54.97 55.25 2ntk s GLU 152 Cb 0.05 0.13 -0.12 0.00 0.26 0.00 0.00 34.13 34.45 2ntk s GLU 152 CO 0.01 -0.05 1.38 -2.30 -0.54 0.00 0.00 175.26 173.77 2ntk n PRO 153 N 2.67 2.28 -4.28 4.30 -0.02 -1.26 -4.71 135.00 133.97 2ntk n PRO 153 Ca -0.15 0.80 -0.18 0.00 -2.02 0.00 0.00 63.50 61.95 2ntk n PRO 153 Cb 0.58 -2.45 -0.15 0.00 -0.02 0.00 0.00 33.50 31.46 2ntk n PRO 153 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ntk s ALA 154 N -0.78 0.68 0.48 3.55 0.00 -0.44 -4.94 121.76 120.31 2ntk s ALA 154 Ca 0.58 -0.27 -0.23 0.00 0.00 0.00 0.00 51.96 52.04 2ntk s ALA 154 Cb -0.56 -0.24 -0.07 0.00 0.00 0.00 0.00 23.12 22.26 2ntk s ALA 154 CO 0.59 0.12 1.30 0.00 0.00 0.00 0.00 175.76 177.76 2ntk s ALA 155 N 0.10 3.00 -0.14 0.00 0.00 -1.26 -1.25 121.76 122.21 2ntk s ALA 155 Ca -0.01 1.21 -0.10 0.00 0.00 0.00 0.00 51.96 53.06 2ntk s ALA 155 Cb -0.06 -3.50 0.05 0.00 0.00 0.00 0.00 23.12 19.61 2ntk s ALA 155 CO -0.00 -1.02 0.35 -0.08 0.00 0.00 0.00 175.76 175.01 2ntk s THR 156 N -1.35 -0.02 -1.06 0.00 -1.32 -0.48 -4.86 115.64 106.55 2ntk s THR 156 Ca 0.65 0.07 -0.19 0.00 -1.21 0.00 0.00 61.69 61.00 2ntk s THR 156 Cb -0.37 -0.52 0.10 0.00 -1.51 0.00 0.00 72.50 70.21 2ntk s THR 156 CO 0.45 0.03 1.38 -0.70 -2.21 0.00 0.00 174.62 173.57 2ntk s GLU 157 N 0.87 3.74 -0.55 7.08 2.12 -1.26 -3.92 118.70 126.78 2ntk s GLU 157 Ca -0.06 -1.73 -0.24 0.00 0.36 0.00 0.00 54.97 53.30 2ntk s GLU 157 Cb -0.06 -5.18 0.04 0.00 0.26 0.00 0.00 34.13 29.19 2ntk s GLU 157 CO -0.06 -1.99 0.95 0.12 -0.54 0.00 0.00 175.26 173.73 2ntk s PHE 158 N 3.48 2.79 -0.14 5.30 5.36 -1.26 -5.02 117.98 128.49 2ntk s PHE 158 Ca 0.42 -0.01 -0.15 0.00 -0.96 0.00 0.00 56.93 56.24 2ntk s PHE 158 Cb -0.02 -4.09 -0.05 0.00 -0.34 0.00 0.00 43.02 38.53 2ntk s PHE 158 CO -0.05 -1.36 0.33 -1.59 -1.46 0.00 0.00 175.22 171.09 2ntk s LYS 159 N 3.97 4.23 -0.30 10.12 -2.85 -1.26 -4.84 119.74 128.80 2ntk s LYS 159 Ca 0.31 0.17 -0.26 0.00 -1.00 0.00 0.00 55.97 55.19 2ntk s LYS 159 Cb -0.12 -3.41 0.20 0.00 -2.06 0.00 0.00 37.83 32.44 2ntk s LYS 159 CO 0.19 0.26 1.47 0.00 0.10 0.00 0.00 175.35 177.38 2ntk s ALA 160 N 0.37 -2.23 0.00 0.59 0.00 -1.26 -4.72 121.76 114.51 2ntk s ALA 160 Ca 0.19 1.72 0.00 0.00 0.00 0.00 0.00 51.96 53.87 2ntk s ALA 160 Cb -0.14 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.21 2ntk s ALA 160 CO 0.06 -0.12 0.82 0.41 0.00 0.00 0.00 175.76 176.93 2ntk n GLY 161 N 1.25 1.35 3.62 0.00 0.00 -1.26 -4.63 105.19 105.52 2ntk n GLY 161 Ca -0.07 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.85 2ntk n GLY 161 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ntk s SER 162 N -0.67 -0.42 0.37 1.61 1.04 -1.26 -4.96 113.70 109.40 2ntk s SER 162 Ca 0.00 -0.27 0.09 0.00 0.48 0.00 0.00 55.95 56.25 2ntk s SER 162 Cb 0.00 0.65 0.72 0.00 0.10 0.00 0.00 66.02 67.48 2ntk s SER 162 CO 0.00 -1.12 1.87 1.55 0.98 0.00 0.00 173.24 176.52 2ntk h PRO 163 N 2.00 0.21 -0.24 4.02 0.13 -1.88 -1.50 132.00 134.75 2ntk h PRO 163 Ca -0.27 -0.06 -0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2ntk h PRO 163 Cb 1.28 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 2ntk h PRO 163 CO 0.31 0.42 0.14 0.93 -0.23 0.00 0.00 178.00 179.57 2ntk h GLU 164 N 0.20 0.33 -0.62 0.86 3.07 -1.90 -0.80 114.58 115.73 2ntk h GLU 164 Ca 0.04 -0.03 -0.09 0.00 -0.50 0.00 0.00 59.36 58.77 2ntk h GLU 164 Cb 0.48 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.31 2ntk h GLU 164 CO 0.03 0.28 0.02 0.93 -1.40 0.00 0.00 179.01 178.88 2ntk h GLU 165 N 0.28 1.08 -0.54 2.33 5.08 -1.90 -2.15 114.58 118.76 2ntk h GLU 165 Ca 0.08 -0.33 -0.02 0.00 -1.00 0.00 0.00 59.36 58.09 2ntk h GLU 165 Cb 0.05 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 2ntk h GLU 165 CO -0.01 1.04 0.25 0.00 -1.00 0.00 0.00 179.01 179.29 2ntk h ALA 166 N 1.00 0.70 -0.49 3.43 0.00 -1.06 -0.34 119.26 122.49 2ntk h ALA 166 Ca 0.18 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 2ntk h ALA 166 Cb 0.54 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2ntk h ALA 166 CO 0.03 0.27 0.13 0.00 0.00 0.00 0.00 179.25 179.67 2ntk h ALA 167 N 1.09 0.65 -0.49 0.00 0.00 -1.06 -2.58 119.26 116.88 2ntk h ALA 167 Ca 0.18 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2ntk h ALA 167 Cb 0.13 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2ntk h ALA 167 CO -0.02 0.34 0.25 0.93 0.00 0.00 0.00 179.25 180.75 2ntk h GLU 168 N 0.68 0.69 0.01 0.00 4.39 -1.14 -2.37 114.58 116.84 2ntk h GLU 168 Ca 0.16 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.77 2ntk h GLU 168 Cb 0.32 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.84 2ntk h GLU 168 CO 0.00 0.56 -0.01 0.35 -1.16 0.00 0.00 179.01 178.75 2ntk h PHE 169 N 0.64 -0.03 0.00 4.33 3.57 -0.94 0.23 116.94 124.74 2ntk h PHE 169 Ca 0.17 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.67 2ntk h PHE 169 Cb 0.09 0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.84 2ntk h PHE 169 CO -0.01 -0.02 0.00 0.97 -2.23 0.00 0.00 178.31 177.02 2ntk h ILE 170 N -0.02 0.00 0.00 1.41 2.10 -1.44 0.62 117.51 120.18 2ntk h ILE 170 Ca 0.00 -0.39 -0.08 0.00 1.08 0.00 0.00 64.86 65.47 2ntk h ILE 170 Cb 0.02 1.38 -0.01 0.00 -1.09 0.00 0.00 36.82 37.13 2ntk h ILE 170 CO -0.01 0.00 -0.46 0.25 -1.08 0.00 0.00 178.15 176.86 2ntk h LEU 171 N 0.00 0.01 -0.28 2.19 5.85 -0.83 -3.44 115.31 118.81 2ntk h LEU 171 Ca 0.00 -0.83 0.00 0.00 0.84 0.00 0.00 57.88 57.89 2ntk h LEU 171 Cb 0.39 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.41 2ntk h LEU 171 CO 0.00 1.18 0.00 0.29 -0.34 0.00 0.00 178.44 179.57 2ntk n LYS 172 N -4.53 0.33 -2.69 1.25 5.02 0.74 -4.67 118.16 113.60 2ntk n LYS 172 Ca -0.18 -0.14 -0.25 0.00 -2.02 0.00 0.00 58.31 55.73 2ntk n LYS 172 Cb 0.56 -0.56 0.02 0.00 -0.02 0.00 0.00 35.03 35.03 2ntk n LYS 172 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2ntk s GLY 173 N -0.09 1.60 0.00 0.72 0.00 0.22 -4.13 107.32 105.63 2ntk s GLY 173 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 44.72 43.82 2ntk s GLY 173 CO 0.00 -0.67 0.00 0.61 0.00 0.00 0.00 173.10 173.04 2ntk n GLY 174 N -2.33 2.20 0.15 0.20 0.00 -1.26 -1.08 105.19 103.07 2ntk n GLY 174 Ca 0.03 -0.08 0.13 0.00 0.00 0.00 0.00 46.02 46.10 2ntk n GLY 174 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2ntk h GLU 175 N 0.00 0.00 0.00 1.61 9.09 -1.94 -2.84 114.58 120.50 2ntk h GLU 175 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2ntk h GLU 175 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 2ntk h GLU 175 CO 0.00 0.00 0.00 0.74 0.05 0.00 0.00 179.01 179.80 2ntk h PHE 176 N 0.00 0.00 -0.02 2.06 -1.00 -1.39 -2.93 116.94 113.67 2ntk h PHE 176 Ca 0.00 0.00 0.01 0.00 2.81 0.00 0.00 57.97 60.79 2ntk h PHE 176 Cb 0.41 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.97 2ntk h PHE 176 CO 0.00 0.00 0.01 0.00 -1.61 0.00 0.00 178.31 176.71 2ntk h ALA 177 N 2.03 1.90 0.00 2.45 0.00 -1.23 -1.97 119.26 122.44 2ntk h ALA 177 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2ntk h ALA 177 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2ntk h ALA 177 CO 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 179.25 179.17 2ntk h ALA 178 N 1.99 0.97 -2.22 0.00 0.00 -1.74 -3.44 119.26 114.81 2ntk h ALA 178 Ca 0.01 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.34 2ntk h ALA 178 Cb 0.04 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.77 2ntk h ALA 178 CO -0.00 0.00 0.61 -0.06 0.00 0.00 0.00 179.25 179.80 2ntk s PHE 179 N -3.16 3.40 0.76 0.00 0.08 -0.74 -4.87 117.98 113.46 2ntk s PHE 179 Ca 0.09 1.42 -0.12 0.00 0.12 0.00 0.00 56.93 58.44 2ntk s PHE 179 Cb 0.09 -3.17 0.05 0.00 -0.57 0.00 0.00 43.02 39.43 2ntk s PHE 179 CO 0.64 -0.35 1.10 0.95 -0.10 0.00 0.00 175.22 177.47 2ntk s THR 180 N 2.59 3.14 -1.19 0.64 -4.23 -0.65 -4.52 115.64 111.42 2ntk s THR 180 Ca 0.43 0.37 -0.07 0.00 -1.18 0.00 0.00 61.69 61.24 2ntk s THR 180 Cb -0.16 -3.24 0.01 0.00 1.34 0.00 0.00 72.50 70.44 2ntk s THR 180 CO 0.11 -0.48 1.04 1.41 -0.54 0.00 0.00 174.62 176.16 2ntk n HIS 181 N -3.25 -2.50 -2.01 3.99 8.25 -1.26 -4.66 115.22 113.77 2ntk n HIS 181 Ca 0.07 0.90 -0.39 0.00 -0.26 0.00 0.00 57.72 58.04 2ntk n HIS 181 Cb 0.57 -4.63 0.00 0.00 1.12 0.00 0.00 29.99 27.05 2ntk n HIS 181 CO 0.00 0.00 0.00 -2.14 0.64 0.00 0.00 176.34 174.84 2ntk s PRO 182 N -6.05 3.89 0.13 -0.41 0.02 -1.26 -1.49 135.00 129.83 2ntk s PRO 182 Ca 0.46 2.20 0.00 0.00 0.02 0.00 0.00 61.00 63.68 2ntk s PRO 182 Cb -0.20 -2.72 0.00 0.00 0.02 0.00 0.00 34.50 31.60 2ntk s PRO 182 CO 0.65 -0.57 0.00 0.28 -0.33 0.00 0.00 177.00 177.03 2ntk n VAL 183 N 0.03 1.00 -3.62 3.83 0.31 0.26 -4.85 118.33 115.27 2ntk n VAL 183 Ca 0.04 0.33 -0.12 0.00 -0.01 0.00 0.00 64.34 64.59 2ntk n VAL 183 Cb 0.43 -1.39 -0.05 0.00 -0.91 0.00 0.00 33.84 31.93 2ntk n VAL 183 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2ntk s THR 184 N -1.99 0.06 0.09 2.52 -1.32 -1.16 -4.03 115.64 109.81 2ntk s THR 184 Ca 0.00 -0.46 -0.02 0.00 -1.21 0.00 0.00 61.69 59.99 2ntk s THR 184 Cb 0.00 -1.06 -0.03 0.00 -1.51 0.00 0.00 72.50 69.89 2ntk s THR 184 CO 0.00 -0.26 0.04 0.00 -2.21 0.00 0.00 174.62 172.19 2ntk s ALA 185 N -3.18 0.51 0.15 11.08 0.00 -0.54 -0.06 121.76 129.71 2ntk s ALA 185 Ca -0.01 -1.21 -0.14 0.00 0.00 0.00 0.00 51.96 50.61 2ntk s ALA 185 Cb 0.01 0.52 0.02 0.00 0.00 0.00 0.00 23.12 23.66 2ntk s ALA 185 CO -0.08 -0.44 0.38 0.00 0.00 0.00 0.00 175.76 175.62 2ntk s ALA 186 N -3.96 -0.58 0.18 0.00 0.00 0.02 -1.09 121.76 116.33 2ntk s ALA 186 Ca 0.13 -0.40 -0.23 0.00 0.00 0.00 0.00 51.96 51.46 2ntk s ALA 186 Cb 0.07 0.75 0.06 0.00 0.00 0.00 0.00 23.12 24.01 2ntk s ALA 186 CO -0.06 -0.67 0.63 0.00 0.00 0.00 0.00 175.76 175.65 2ntk s ALA 187 N -3.88 -1.54 -0.05 0.00 0.00 -0.41 -0.03 121.76 115.86 2ntk s ALA 187 Ca 0.09 0.35 0.03 0.00 0.00 0.00 0.00 51.96 52.43 2ntk s ALA 187 Cb 0.02 0.88 0.01 0.00 0.00 0.00 0.00 23.12 24.02 2ntk s ALA 187 CO -0.06 -0.82 -0.12 0.00 0.00 0.00 0.00 175.76 174.76 2ntk s ALA 188 N -3.77 1.18 0.00 0.00 0.00 -0.39 -1.85 121.76 116.93 2ntk s ALA 188 Ca 0.03 -0.44 0.04 0.00 0.00 0.00 0.00 51.96 51.59 2ntk s ALA 188 Cb -0.02 -0.47 -0.01 0.00 0.00 0.00 0.00 23.12 22.62 2ntk s ALA 188 CO -0.09 0.16 -0.12 0.12 0.00 0.00 0.00 175.76 175.82 2ntk s PHE 189 N 0.38 1.05 -0.24 0.00 5.36 0.08 -2.02 117.98 122.59 2ntk s PHE 189 Ca -0.08 -0.24 -0.01 0.00 -0.96 0.00 0.00 56.93 55.64 2ntk s PHE 189 Cb -0.12 -0.66 0.07 0.00 -0.34 0.00 0.00 43.02 41.96 2ntk s PHE 189 CO 0.02 -0.01 0.02 1.21 -1.46 0.00 0.00 175.22 175.00 2ntk s ASN 190 N -0.50 3.52 0.00 6.13 3.84 0.02 -1.03 114.94 126.92 2ntk s ASN 190 Ca 0.03 -1.14 0.17 0.00 0.21 0.00 0.00 52.86 52.13 2ntk s ASN 190 Cb -0.05 -0.88 0.65 0.00 -0.55 0.00 0.00 41.25 40.41 2ntk s ASN 190 CO -0.00 -0.30 1.47 -0.90 -2.79 0.00 0.00 177.10 174.57 2ntk n ASP 191 N 4.85 1.39 0.00 -4.21 5.68 -1.26 -1.51 116.55 121.49 2ntk n ASP 191 Ca -0.08 -1.76 0.00 0.00 -0.50 0.00 0.00 54.79 52.45 2ntk n ASP 191 Cb 0.45 -0.12 0.00 0.00 -1.14 0.00 0.00 41.12 40.31 2ntk n ASP 191 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ntk n GLY 192 N 1.03 1.98 0.92 6.12 0.00 -1.26 -4.88 105.19 109.09 2ntk n GLY 192 Ca 0.14 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.23 2ntk n GLY 192 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ntk n GLU 193 N -0.19 3.07 0.00 1.61 1.02 -1.26 -5.07 120.64 119.82 2ntk n GLU 193 Ca 0.00 -2.61 0.00 0.00 -0.02 0.00 0.00 57.16 54.53 2ntk n GLU 193 Cb 0.00 -1.69 0.00 0.00 -0.02 0.00 0.00 31.44 29.73 2ntk n GLU 193 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ntk n GLY 194 N 0.00 3.35 3.70 0.62 0.00 -1.26 -5.05 105.19 106.54 2ntk n GLY 194 Ca 0.19 -1.93 -0.42 0.00 0.00 0.00 0.00 46.02 43.86 2ntk n GLY 194 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2ntk s TRP 195 N -2.86 3.53 0.07 1.61 0.52 -1.26 -4.29 118.94 116.26 2ntk s TRP 195 Ca 0.00 1.57 0.09 0.00 0.02 0.00 0.00 56.10 57.79 2ntk s TRP 195 Cb 0.00 -3.20 -0.03 0.00 -1.15 0.00 0.00 33.47 29.08 2ntk s TRP 195 CO 0.00 -0.33 -0.24 -0.80 0.02 0.00 0.00 176.95 175.60 2ntk s ASN 196 N 1.10 3.39 0.23 2.95 0.01 -0.20 -4.93 114.94 117.50 2ntk s ASN 196 Ca 0.51 -0.59 0.09 0.00 -0.71 0.00 0.00 52.86 52.16 2ntk s ASN 196 Cb -0.21 -0.36 -0.04 0.00 0.41 0.00 0.00 41.25 41.05 2ntk s ASN 196 CO 0.23 0.24 -0.04 -0.76 -1.51 0.00 0.00 177.10 175.25 2ntk s LEU 197 N -1.53 3.12 0.07 0.60 1.43 -1.26 -0.75 118.68 120.37 2ntk s LEU 197 Ca 0.13 -0.61 -0.26 0.00 -1.03 0.00 0.00 54.13 52.36 2ntk s LEU 197 Cb -0.10 -1.71 0.08 0.00 0.03 0.00 0.00 46.19 44.49 2ntk s LEU 197 CO 0.04 0.04 0.71 0.00 0.23 0.00 0.00 176.35 177.37 2ntk s ALA 198 N -2.08 -1.70 0.13 4.21 0.00 -0.77 -4.85 121.76 116.69 2ntk s ALA 198 Ca 0.29 0.80 0.04 0.00 0.00 0.00 0.00 51.96 53.09 2ntk s ALA 198 Cb -0.07 0.56 -0.04 0.00 0.00 0.00 0.00 23.12 23.56 2ntk s ALA 198 CO 0.18 -0.67 -0.10 0.95 0.00 0.00 0.00 175.76 176.12 2ntk s THR 199 N -3.10 1.11 -0.02 0.00 -4.23 -1.26 -1.29 115.64 106.85 2ntk s THR 199 Ca 0.00 -1.91 -0.03 0.00 -1.18 0.00 0.00 61.69 58.57 2ntk s THR 199 Cb -0.01 -1.68 0.00 0.00 1.34 0.00 0.00 72.50 72.16 2ntk s THR 199 CO -0.08 -0.66 0.08 -0.13 -0.54 0.00 0.00 174.62 173.29 2ntk s ARG 200 N -3.37 0.17 0.33 3.99 1.81 -0.25 -4.96 118.95 116.67 2ntk s ARG 200 Ca 0.13 -0.01 0.09 0.00 -1.72 0.00 0.00 55.73 54.21 2ntk s ARG 200 Cb 0.00 0.07 -0.05 0.00 -0.45 0.00 0.00 34.95 34.53 2ntk s ARG 200 CO 0.01 -0.03 0.02 -1.21 -0.68 0.00 0.00 175.30 173.40 2ntk s GLU 201 N -0.28 2.11 0.00 3.54 0.41 -1.26 -1.47 118.70 121.75 2ntk s GLU 201 Ca -0.03 -1.71 0.10 0.00 -0.41 0.00 0.00 54.97 52.92 2ntk s GLU 201 Cb -0.02 -1.96 0.59 0.00 -1.78 0.00 0.00 34.13 30.96 2ntk s GLU 201 CO 0.00 0.15 1.04 -1.33 -0.49 0.00 0.00 175.26 174.63