#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r9k s GLU 2 N 0.00 4.21 -0.26 -0.72 0.41 -1.26 -4.87 118.70 116.21 2r9k s GLU 2 Ca 0.00 2.40 0.03 0.00 -0.41 0.00 0.00 54.97 56.99 2r9k s GLU 2 Cb 0.00 -3.09 0.06 0.00 -1.78 0.00 0.00 34.13 29.32 2r9k s GLU 2 CO 0.00 -0.52 -0.11 -0.98 -0.49 0.00 0.00 175.26 173.16 2r9k s ARG 3 N -0.14 2.26 0.23 1.61 1.70 -1.26 -0.45 118.95 122.91 2r9k s ARG 3 Ca 0.63 -1.34 -0.18 0.00 -0.47 0.00 0.00 55.73 54.37 2r9k s ARG 3 Cb -0.44 -2.88 -0.08 0.00 -0.57 0.00 0.00 34.95 30.98 2r9k s ARG 3 CO 0.42 -0.56 0.71 -0.51 -1.08 0.00 0.00 175.30 174.28 2r9k s LEU 4 N 1.11 4.30 -0.08 -1.89 2.01 0.93 -4.97 118.68 120.08 2r9k s LEU 4 Ca -0.09 1.37 0.02 0.00 0.01 0.00 0.00 54.13 55.45 2r9k s LEU 4 Cb -0.20 -3.63 0.01 0.00 0.01 0.00 0.00 46.19 42.38 2r9k s LEU 4 CO -0.05 0.00 -0.15 -0.13 1.01 0.00 0.00 176.35 177.03 2r9k s ARG 5 N -2.12 2.08 -0.08 1.70 1.81 -1.26 -0.64 118.95 120.44 2r9k s ARG 5 Ca 0.44 -0.53 -0.01 0.00 -1.72 0.00 0.00 55.73 53.90 2r9k s ARG 5 Cb -0.16 -1.69 0.03 0.00 -0.45 0.00 0.00 34.95 32.69 2r9k s ARG 5 CO 0.20 0.04 -0.01 -1.17 -0.68 0.00 0.00 175.30 173.68 2r9k s LEU 6 N 0.68 0.71 -0.34 2.53 2.96 -0.14 -4.99 118.68 120.08 2r9k s LEU 6 Ca -0.14 -0.13 -0.21 0.00 -0.22 0.00 0.00 54.13 53.43 2r9k s LEU 6 Cb -0.16 -0.52 0.00 0.00 0.50 0.00 0.00 46.19 46.01 2r9k s LEU 6 CO 0.04 -0.18 0.67 0.00 -1.32 0.00 0.00 176.35 175.56 2r9k s ARG 7 N 1.92 3.77 -0.32 1.98 1.70 -1.26 -2.41 118.95 124.33 2r9k s ARG 7 Ca 0.05 0.20 -0.12 0.00 -0.47 0.00 0.00 55.73 55.39 2r9k s ARG 7 Cb -0.12 -3.78 -0.03 0.00 -0.57 0.00 0.00 34.95 30.45 2r9k s ARG 7 CO -0.06 -0.71 0.22 0.95 -1.08 0.00 0.00 175.30 174.62 2r9k s THR 8 N 2.77 5.24 0.10 4.99 -4.23 0.83 -4.77 115.64 120.57 2r9k s THR 8 Ca 0.26 -0.13 -0.06 0.00 -1.18 0.00 0.00 61.69 60.58 2r9k s THR 8 Cb -0.14 -3.64 0.02 0.00 1.34 0.00 0.00 72.50 70.08 2r9k s THR 8 CO 0.14 0.06 0.30 -0.90 -0.54 0.00 0.00 174.62 173.68 2r9k n ASP 9 N 5.08 -0.67 0.00 3.99 5.68 -1.26 -3.62 116.55 125.76 2r9k n ASP 9 Ca -0.13 -1.42 0.03 0.00 -0.50 0.00 0.00 54.79 52.78 2r9k n ASP 9 Cb 0.50 1.10 0.20 0.00 -1.14 0.00 0.00 41.12 41.79 2r9k n ASP 9 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2r9k n GLN 10 N -0.20 0.56 -0.01 0.11 3.00 -1.26 -0.07 117.38 119.50 2r9k n GLN 10 Ca -0.02 0.00 0.01 0.00 -0.01 0.00 0.00 57.00 56.98 2r9k n GLN 10 Cb 0.19 -1.19 0.01 0.00 0.00 0.00 0.00 30.24 29.25 2r9k n GLN 10 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 2r9k n GLN 11 N -0.69 0.51 -2.12 -1.09 3.00 -1.26 -4.99 117.38 110.74 2r9k n GLN 11 Ca 0.05 -0.92 -0.42 0.00 -0.01 0.00 0.00 57.00 55.69 2r9k n GLN 11 Cb 0.02 -1.03 -0.03 0.00 0.00 0.00 0.00 30.24 29.21 2r9k n GLN 11 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 2r9k s THR 12 N -0.42 3.52 0.39 5.09 2.01 0.89 -5.01 115.64 122.12 2r9k s THR 12 Ca 0.02 0.89 -0.05 0.00 0.31 0.00 0.00 61.69 62.85 2r9k s THR 12 Cb 0.01 -3.57 -0.05 0.00 0.01 0.00 0.00 72.50 68.91 2r9k s THR 12 CO 0.02 -0.02 0.67 0.42 -0.69 0.00 0.00 174.62 175.03 2r9k s THR 13 N 2.73 4.95 0.27 -0.82 -4.23 -1.26 -4.73 115.64 112.54 2r9k s THR 13 Ca 0.68 0.13 -0.01 0.00 -1.18 0.00 0.00 61.69 61.31 2r9k s THR 13 Cb -0.34 -3.80 0.25 0.00 1.34 0.00 0.00 72.50 69.96 2r9k s THR 13 CO 0.28 -0.58 1.79 1.23 -0.54 0.00 0.00 174.62 176.80 2r9k h GLY 14 N 0.95 1.47 1.44 3.99 0.00 -1.87 -1.82 103.07 107.23 2r9k h GLY 14 Ca -0.48 -0.32 -0.04 0.00 0.00 0.00 0.00 47.33 46.49 2r9k h GLY 14 CO 0.63 0.05 0.12 0.00 0.00 0.00 0.00 176.54 177.34 2r9k h ALA 15 N 1.54 1.33 -0.45 3.60 0.00 -1.95 0.14 119.26 123.47 2r9k h ALA 15 Ca 0.47 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 55.10 2r9k h ALA 15 Cb 0.57 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2r9k h ALA 15 CO -0.31 0.48 -0.10 0.93 0.00 0.00 0.00 179.25 180.25 2r9k h GLU 16 N 0.69 0.86 -0.26 0.00 5.08 -1.75 0.13 114.58 119.33 2r9k h GLU 16 Ca 0.16 -0.33 -0.18 0.00 -1.00 0.00 0.00 59.36 58.01 2r9k h GLU 16 Cb 0.25 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 2r9k h GLU 16 CO -0.00 0.96 -0.55 -0.92 -1.00 0.00 0.00 179.01 177.50 2r9k h TYR 17 N 0.70 1.00 -0.66 4.33 3.20 -0.66 -2.46 116.97 122.42 2r9k h TYR 17 Ca 0.11 -0.36 -0.07 0.00 3.14 0.00 0.00 58.73 61.55 2r9k h TYR 17 Cb 0.64 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.70 2r9k h TYR 17 CO 0.05 1.17 0.14 0.35 -1.64 0.00 0.00 178.16 178.22 2r9k h PHE 18 N 0.61 1.12 -0.22 -3.82 3.04 -0.27 -1.82 116.94 115.58 2r9k h PHE 18 Ca 0.01 -0.14 -0.09 0.00 3.98 0.00 0.00 57.97 61.74 2r9k h PHE 18 Cb 1.15 -0.31 -0.01 0.00 2.56 0.00 0.00 35.95 39.33 2r9k h PHE 18 CO 0.07 0.92 -0.25 1.03 -2.02 0.00 0.00 178.31 178.06 2r9k h SER 19 N 1.01 0.41 -0.09 0.41 0.87 -0.57 0.14 113.55 115.72 2r9k h SER 19 Ca 0.21 -0.13 -0.14 0.00 -1.23 0.00 0.00 61.79 60.49 2r9k h SER 19 Cb 0.39 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.23 2r9k h SER 19 CO 0.01 0.66 -0.43 0.15 -0.53 0.00 0.00 176.83 176.69 2r9k h PHE 20 N 0.37 0.77 -0.04 2.24 3.57 -1.07 -0.69 116.94 122.08 2r9k h PHE 20 Ca 0.06 -0.23 -0.21 0.00 3.53 0.00 0.00 57.97 61.11 2r9k h PHE 20 Cb 0.64 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.22 2r9k h PHE 20 CO 0.02 0.96 -0.86 0.82 -2.23 0.00 0.00 178.31 177.02 2r9k h ILE 21 N 0.52 1.37 -0.23 1.41 1.08 -0.47 -2.09 117.51 119.09 2r9k h ILE 21 Ca 0.04 -2.28 -0.01 0.00 -0.39 0.00 0.00 64.86 62.22 2r9k h ILE 21 Cb 0.96 2.26 -0.01 0.00 -3.07 0.00 0.00 36.82 36.96 2r9k h ILE 21 CO 0.09 0.69 0.11 0.74 -0.69 0.00 0.00 178.15 179.09 2r9k h THR 22 N 0.29 1.14 0.00 -0.27 2.02 -0.88 -0.12 112.91 115.10 2r9k h THR 22 Ca -0.06 -0.41 -0.04 0.00 0.77 0.00 0.00 66.41 66.66 2r9k h THR 22 Cb 1.47 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 68.87 2r9k h THR 22 CO 0.15 0.14 -0.21 -0.37 0.37 0.00 0.00 175.52 175.60 2r9k h VAL 23 N 0.24 0.79 -0.20 3.16 -1.51 -1.06 0.14 116.25 117.81 2r9k h VAL 23 Ca 0.08 -0.85 -0.08 0.00 -1.23 0.00 0.00 66.70 64.62 2r9k h VAL 23 Cb 0.12 1.51 -0.00 0.00 -2.13 0.00 0.00 31.29 30.80 2r9k h VAL 23 CO -0.01 0.21 -0.20 0.25 -1.23 0.00 0.00 177.57 176.59 2r9k h LEU 24 N 0.00 0.52 0.46 4.19 5.85 -0.54 -0.43 115.31 125.36 2r9k h LEU 24 Ca -0.00 -0.47 -0.02 0.00 0.84 0.00 0.00 57.88 58.23 2r9k h LEU 24 Cb 0.50 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 2r9k h LEU 24 CO 0.03 0.89 -0.30 0.03 -0.34 0.00 0.00 178.44 178.75 2r9k h ARG 25 N 0.17 -0.71 -0.81 1.25 3.08 -0.34 -1.03 114.38 116.00 2r9k h ARG 25 Ca 0.03 0.05 0.18 0.00 0.07 0.00 0.00 59.98 60.31 2r9k h ARG 25 Cb 0.74 0.16 -0.15 0.00 0.08 0.00 0.00 29.97 30.80 2r9k h ARG 25 CO 0.05 -0.47 -0.06 -0.44 -1.07 0.00 0.00 179.97 177.98 2r9k h ASP 26 N -0.73 -0.50 0.28 7.04 5.19 -0.62 0.23 116.42 127.30 2r9k h ASP 26 Ca -0.05 0.22 -0.12 0.00 -0.62 0.00 0.00 57.03 56.47 2r9k h ASP 26 Cb 0.61 0.42 -0.01 0.00 0.18 0.00 0.00 39.33 40.52 2r9k h ASP 26 CO 0.04 -0.23 -0.47 0.22 -3.12 0.00 0.00 179.24 175.68 2r9k h TYR 27 N 0.05 0.27 -0.02 4.55 5.03 -0.81 -2.31 116.97 123.74 2r9k h TYR 27 Ca 0.43 -0.08 0.00 0.00 2.58 0.00 0.00 58.73 61.66 2r9k h TYR 27 Cb 0.75 -0.06 0.00 0.00 1.55 0.00 0.00 36.73 38.98 2r9k h TYR 27 CO -0.51 0.65 -0.18 1.33 -1.32 0.00 0.00 178.16 178.14 2r9k n VAL 28 N -3.98 0.00 -2.13 1.81 0.24 -0.41 -4.89 118.33 108.97 2r9k n VAL 28 Ca -0.02 -0.29 -0.42 0.00 -2.04 0.00 0.00 64.34 61.57 2r9k n VAL 28 Cb 0.52 0.92 -0.03 0.00 -1.47 0.00 0.00 33.84 33.78 2r9k n VAL 28 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2r9k s SER 29 N -2.24 6.76 0.46 -1.34 0.01 0.01 -4.11 113.70 113.25 2r9k s SER 29 Ca 0.27 2.10 0.30 0.00 1.31 0.00 0.00 55.95 59.94 2r9k s SER 29 Cb 0.20 -2.54 1.12 0.00 0.21 0.00 0.00 66.02 65.01 2r9k s SER 29 CO 0.43 -0.85 1.87 0.77 0.41 0.00 0.00 173.24 175.86 2r9k h SER 30 N 8.92 0.00 0.00 2.44 4.64 -1.35 -3.47 113.55 124.73 2r9k h SER 30 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 2r9k h SER 30 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2r9k h SER 30 CO 0.95 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.52 2r9k n GLY 31 N 0.24 3.09 3.81 -0.77 0.00 -1.26 -4.99 105.19 105.30 2r9k n GLY 31 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 2r9k n GLY 31 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2r9k s SER 32 N 0.42 5.51 0.16 1.61 0.01 -1.26 -5.01 113.70 115.15 2r9k s SER 32 Ca 0.00 1.75 0.04 0.00 1.31 0.00 0.00 55.95 59.05 2r9k s SER 32 Cb 0.00 -2.52 -0.05 0.00 0.21 0.00 0.00 66.02 63.67 2r9k s SER 32 CO 0.00 -1.35 -0.07 -0.36 0.41 0.00 0.00 173.24 171.87 2r9k s PHE 33 N -2.70 1.30 -0.05 2.43 0.40 -1.26 -1.50 117.98 116.59 2r9k s PHE 33 Ca 0.61 -0.84 -0.08 0.00 -0.60 0.00 0.00 56.93 56.03 2r9k s PHE 33 Cb -0.15 -0.70 -0.03 0.00 0.51 0.00 0.00 43.02 42.65 2r9k s PHE 33 CO 0.45 0.00 -0.15 0.45 0.70 0.00 0.00 175.22 176.68 2r9k n SER 34 N -0.24 1.13 -2.70 1.36 2.88 -0.49 -4.82 113.62 110.73 2r9k n SER 34 Ca -0.09 0.18 -0.22 0.00 -1.33 0.00 0.00 58.87 57.41 2r9k n SER 34 Cb 0.62 -0.50 -0.00 0.00 -0.75 0.00 0.00 64.21 63.58 2r9k n SER 34 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2r9k n ASN 35 N -3.60 3.44 -0.02 -3.46 4.13 -1.26 -4.82 115.26 109.66 2r9k n ASN 35 Ca -0.06 -3.39 -0.00 0.00 1.68 0.00 0.00 54.58 52.81 2r9k n ASN 35 Cb 0.22 -0.52 -0.00 0.00 -1.54 0.00 0.00 39.78 37.94 2r9k n ASN 35 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2r9k n ASN 36 N -0.25 -3.32 -4.40 6.41 5.03 -1.26 -5.01 115.26 112.46 2r9k n ASN 36 Ca 0.29 0.01 -0.34 0.00 0.87 0.00 0.00 54.58 55.40 2r9k n ASN 36 Cb 0.64 -0.85 -0.13 0.00 -1.02 0.00 0.00 39.78 38.42 2r9k n ASN 36 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2r9k s ILE 37 N -1.91 3.63 0.80 2.41 1.01 -1.26 -5.05 121.20 120.82 2r9k s ILE 37 Ca 0.00 -0.43 -0.14 0.00 0.00 0.00 0.00 60.65 60.08 2r9k s ILE 37 Cb 0.00 -2.62 0.05 0.00 0.01 0.00 0.00 42.46 39.90 2r9k s ILE 37 CO 0.00 0.45 1.01 -2.65 0.00 0.00 0.00 174.94 173.75 2r9k n PRO 38 N 4.21 0.21 -4.78 2.79 -0.02 -1.26 -1.40 135.00 134.74 2r9k n PRO 38 Ca -0.18 0.14 -0.27 0.00 -2.02 0.00 0.00 63.50 61.17 2r9k n PRO 38 Cb 0.52 -2.27 -0.14 0.00 -0.02 0.00 0.00 33.50 31.58 2r9k n PRO 38 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2r9k s LEU 39 N -4.13 2.15 0.74 2.45 1.43 -0.56 -1.93 118.68 118.83 2r9k s LEU 39 Ca 0.71 -0.52 -0.11 0.00 -1.03 0.00 0.00 54.13 53.18 2r9k s LEU 39 Cb -0.30 -1.09 0.04 0.00 0.03 0.00 0.00 46.19 44.87 2r9k s LEU 39 CO 0.53 0.20 1.08 -0.76 0.23 0.00 0.00 176.35 177.63 2r9k s LEU 40 N -1.10 3.01 0.38 1.79 1.43 -0.28 -1.03 118.68 122.90 2r9k s LEU 40 Ca 0.09 1.67 -0.27 0.00 -1.03 0.00 0.00 54.13 54.59 2r9k s LEU 40 Cb -0.09 -4.44 -0.09 0.00 0.03 0.00 0.00 46.19 41.60 2r9k s LEU 40 CO 0.01 -1.77 1.26 -0.13 0.23 0.00 0.00 176.35 175.96 2r9k s ARG 41 N -4.99 4.11 0.33 1.70 0.52 -1.26 -4.43 118.95 114.94 2r9k s ARG 41 Ca 0.60 2.08 -0.26 0.00 -0.52 0.00 0.00 55.73 57.63 2r9k s ARG 41 Cb -0.15 -2.84 -0.14 0.00 0.52 0.00 0.00 34.95 32.34 2r9k s ARG 41 CO 0.55 -0.34 0.75 1.04 0.02 0.00 0.00 175.30 177.32 2r9k n GLN 42 N 0.33 0.81 0.00 3.54 6.02 -1.26 -4.62 117.38 122.21 2r9k n GLN 42 Ca 0.03 0.29 0.00 0.00 -0.01 0.00 0.00 57.00 57.30 2r9k n GLN 42 Cb 0.44 -1.57 0.00 0.00 1.02 0.00 0.00 30.24 30.12 2r9k n GLN 42 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2r9k n SER 43 N 1.34 2.41 -0.00 1.08 3.41 -1.26 -2.40 113.62 118.20 2r9k n SER 43 Ca 0.12 -1.72 0.05 0.00 -0.26 0.00 0.00 58.87 57.06 2r9k n SER 43 Cb 0.34 -0.43 -0.06 0.00 -0.26 0.00 0.00 64.21 63.80 2r9k n SER 43 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2r9k n THR 44 N 0.52 0.00 -1.47 6.66 -2.24 -1.26 -4.96 114.28 111.53 2r9k n THR 44 Ca 0.00 -0.26 -0.46 0.00 -2.27 0.00 0.00 64.05 61.06 2r9k n THR 44 Cb 0.41 0.97 -0.08 0.00 -2.10 0.00 0.00 70.33 69.53 2r9k n THR 44 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2r9k n VAL 45 N -1.27 0.10 -1.67 2.28 0.31 -1.01 -4.88 118.33 112.20 2r9k n VAL 45 Ca 0.02 -0.32 -0.42 0.00 -0.01 0.00 0.00 64.34 63.61 2r9k n VAL 45 Cb 0.16 -1.67 0.01 0.00 -0.91 0.00 0.00 33.84 31.43 2r9k n VAL 45 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2r9k n PRO 46 N 8.40 1.76 0.26 5.55 -0.04 -1.26 -4.84 135.00 144.83 2r9k n PRO 46 Ca 0.45 0.62 0.13 0.00 -0.04 0.00 0.00 63.50 64.66 2r9k n PRO 46 Cb 0.26 -2.23 0.58 0.00 -0.04 0.00 0.00 33.50 32.06 2r9k n PRO 46 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 2r9k h VAL 47 N 2.03 0.05 0.00 0.52 3.04 -1.90 -1.22 116.25 118.77 2r9k h VAL 47 Ca -0.46 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.23 2r9k h VAL 47 Cb 1.31 0.45 0.00 0.00 -2.01 0.00 0.00 31.29 31.04 2r9k h VAL 47 CO 0.60 0.00 -0.57 0.28 -1.01 0.00 0.00 177.57 176.87 2r9k h SER 48 N 0.00 0.00 -2.84 3.17 0.02 -1.92 -3.46 113.55 108.52 2r9k h SER 48 Ca 0.06 -0.09 -0.56 0.00 -0.84 0.00 0.00 61.79 60.36 2r9k h SER 48 Cb 1.22 0.00 0.08 0.00 0.14 0.00 0.00 62.40 63.84 2r9k h SER 48 CO -0.00 0.04 0.74 1.21 -1.14 0.00 0.00 176.83 177.69 2r9k n GLU 49 N -2.47 2.31 0.13 3.45 0.00 -0.46 -4.85 120.64 118.75 2r9k n GLU 49 Ca 0.03 0.82 0.10 0.00 0.00 0.00 0.00 57.16 58.11 2r9k n GLU 49 Cb 0.49 -2.54 0.49 0.00 0.00 0.00 0.00 31.44 29.88 2r9k n GLU 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2r9k n GLY 50 N 2.38 -0.86 1.71 8.31 0.00 -1.26 -2.58 105.19 112.89 2r9k n GLY 50 Ca 0.11 0.16 -0.05 0.00 0.00 0.00 0.00 46.02 46.24 2r9k n GLY 50 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2r9k n GLN 51 N -2.14 1.96 0.20 1.61 6.02 -1.26 -4.26 117.38 119.51 2r9k n GLN 51 Ca -0.01 -3.38 0.12 0.00 -0.01 0.00 0.00 57.00 53.73 2r9k n GLN 51 Cb 0.05 -1.52 0.19 0.00 1.02 0.00 0.00 30.24 29.98 2r9k n GLN 51 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 2r9k h ARG 52 N 1.72 0.00 -5.28 -1.09 9.65 -1.83 -3.45 114.38 114.10 2r9k h ARG 52 Ca 0.04 0.00 -0.39 0.00 -1.10 0.00 0.00 59.98 58.53 2r9k h ARG 52 Cb 1.40 0.00 -0.20 0.00 -1.39 0.00 0.00 29.97 29.78 2r9k h ARG 52 CO 0.30 0.00 -0.76 -0.06 2.80 0.00 0.00 179.97 182.25 2r9k s PHE 53 N -3.21 1.24 -0.05 2.20 0.08 -1.26 -1.76 117.98 115.22 2r9k s PHE 53 Ca 0.07 -0.53 0.03 0.00 0.12 0.00 0.00 56.93 56.62 2r9k s PHE 53 Cb 0.06 -0.67 0.01 0.00 -0.57 0.00 0.00 43.02 41.84 2r9k s PHE 53 CO 0.67 0.07 -0.13 0.54 -0.10 0.00 0.00 175.22 176.27 2r9k s VAL 54 N -1.79 1.15 -0.29 -0.44 0.11 0.00 -4.32 120.40 114.83 2r9k s VAL 54 Ca 0.03 -0.53 -0.12 0.00 -2.93 0.00 0.00 61.98 58.43 2r9k s VAL 54 Cb -0.07 -1.02 -0.04 0.00 -1.53 0.00 0.00 36.38 33.72 2r9k s VAL 54 CO 0.02 0.35 0.25 -0.76 -3.33 0.00 0.00 175.10 171.62 2r9k s LEU 55 N 0.34 4.11 -0.31 2.54 1.02 0.41 -0.17 118.68 126.63 2r9k s LEU 55 Ca -0.08 -0.01 -0.10 0.00 0.02 0.00 0.00 54.13 53.95 2r9k s LEU 55 Cb -0.13 -2.20 -0.02 0.00 0.02 0.00 0.00 46.19 43.87 2r9k s LEU 55 CO 0.02 -0.12 0.17 -0.69 0.02 0.00 0.00 176.35 175.76 2r9k s VAL 56 N 1.84 4.86 -0.16 -1.59 1.01 0.12 -0.05 120.40 126.42 2r9k s VAL 56 Ca 0.09 -0.25 -0.06 0.00 0.00 0.00 0.00 61.98 61.76 2r9k s VAL 56 Cb -0.16 -3.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 2r9k s VAL 56 CO 0.11 0.10 0.04 -0.70 0.00 0.00 0.00 175.10 174.65 2r9k s GLU 57 N 1.66 3.78 -0.06 2.72 2.12 0.19 0.86 118.70 129.96 2r9k s GLU 57 Ca 0.06 -0.37 0.05 0.00 0.36 0.00 0.00 54.97 55.07 2r9k s GLU 57 Cb -0.17 -3.11 -0.01 0.00 0.26 0.00 0.00 34.13 31.10 2r9k s GLU 57 CO 0.08 0.35 -0.23 -0.51 -0.54 0.00 0.00 175.26 174.41 2r9k s LEU 58 N 0.13 2.03 -0.06 2.70 1.43 -0.32 -0.96 118.68 123.61 2r9k s LEU 58 Ca 0.04 -0.48 -0.01 0.00 -1.03 0.00 0.00 54.13 52.65 2r9k s LEU 58 Cb -0.12 -1.28 0.03 0.00 0.03 0.00 0.00 46.19 44.84 2r9k s LEU 58 CO 0.01 0.20 0.00 -0.89 0.23 0.00 0.00 176.35 175.90 2r9k s THR 59 N 0.02 0.33 0.57 5.49 2.01 -1.01 -1.51 115.64 121.54 2r9k s THR 59 Ca -0.07 0.11 -0.06 0.00 0.31 0.00 0.00 61.69 61.98 2r9k s THR 59 Cb -0.14 -0.47 0.12 0.00 0.01 0.00 0.00 72.50 72.02 2r9k s THR 59 CO 0.05 0.24 0.78 -0.46 -0.69 0.00 0.00 174.62 174.53 2r9k n ASN 60 N 4.90 0.49 0.26 3.53 2.04 -0.63 -0.12 115.26 125.73 2r9k n ASN 60 Ca -0.11 -1.54 0.09 0.00 -0.44 0.00 0.00 54.58 52.57 2r9k n ASN 60 Cb 0.50 -0.56 0.67 0.00 -2.53 0.00 0.00 39.78 37.86 2r9k n ASN 60 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2r9k h ALA 61 N -1.21 1.83 0.00 -2.53 0.00 -1.91 -0.41 119.26 115.03 2r9k h ALA 61 Ca -0.26 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2r9k h ALA 61 Cb 0.81 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2r9k h ALA 61 CO 0.22 0.05 0.00 0.41 0.00 0.00 0.00 179.25 179.93 2r9k n GLY 62 N -1.37 -1.28 1.70 0.00 0.00 -1.26 -4.84 105.19 98.15 2r9k n GLY 62 Ca -0.03 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2r9k n GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r9k n GLY 63 N 1.27 0.97 3.75 -0.02 0.00 -0.16 -5.03 105.19 105.97 2r9k n GLY 63 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2r9k n GLY 63 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2r9k s ASP 64 N -3.03 6.49 -0.04 1.61 -0.00 -1.26 -4.82 116.67 115.62 2r9k s ASP 64 Ca 0.00 2.83 -0.01 0.00 -0.00 0.00 0.00 52.55 55.37 2r9k s ASP 64 Cb 0.00 -2.63 0.03 0.00 -0.00 0.00 0.00 42.92 40.32 2r9k s ASP 64 CO 0.00 -0.83 0.03 -0.89 -0.00 0.00 0.00 175.17 173.49 2r9k s THR 65 N 0.00 0.05 0.24 -1.27 2.01 -1.26 -1.60 115.64 113.81 2r9k s THR 65 Ca 0.62 0.27 0.08 0.00 0.31 0.00 0.00 61.69 62.97 2r9k s THR 65 Cb -0.45 -0.25 -0.05 0.00 0.01 0.00 0.00 72.50 71.76 2r9k s THR 65 CO 0.46 0.18 -0.13 0.27 -0.69 0.00 0.00 174.62 174.71 2r9k s ILE 66 N 1.78 1.82 -0.10 1.82 -5.25 -0.57 -4.54 121.20 116.15 2r9k s ILE 66 Ca 0.00 -2.22 -0.01 0.00 -0.99 0.00 0.00 60.65 57.44 2r9k s ILE 66 Cb -0.12 -2.19 0.03 0.00 2.95 0.00 0.00 42.46 43.12 2r9k s ILE 66 CO -0.03 -0.49 -0.05 -0.89 -1.79 0.00 0.00 174.94 171.69 2r9k s THR 67 N -2.92 0.80 -0.14 8.37 2.01 -0.75 -1.18 115.64 121.83 2r9k s THR 67 Ca 0.25 -0.15 -0.14 0.00 0.31 0.00 0.00 61.69 61.96 2r9k s THR 67 Cb -0.00 -0.86 -0.05 0.00 0.01 0.00 0.00 72.50 71.60 2r9k s THR 67 CO 0.09 0.33 0.32 0.00 -0.69 0.00 0.00 174.62 174.67 2r9k s ALA 68 N 1.75 3.59 -0.32 7.40 0.00 0.25 -0.32 121.76 134.10 2r9k s ALA 68 Ca 0.04 -0.41 -0.17 0.00 0.00 0.00 0.00 51.96 51.42 2r9k s ALA 68 Cb -0.13 -2.42 -0.01 0.00 0.00 0.00 0.00 23.12 20.56 2r9k s ALA 68 CO -0.07 0.11 0.48 0.00 0.00 0.00 0.00 175.76 176.28 2r9k s ALA 69 N 0.37 3.51 -0.23 0.00 0.00 0.87 0.14 121.76 126.43 2r9k s ALA 69 Ca 0.18 -0.93 -0.06 0.00 0.00 0.00 0.00 51.96 51.15 2r9k s ALA 69 Cb -0.13 -2.94 -0.02 0.00 0.00 0.00 0.00 23.12 20.03 2r9k s ALA 69 CO 0.05 -1.05 0.03 0.42 0.00 0.00 0.00 175.76 175.22 2r9k s ILE 70 N 2.30 4.07 -0.21 0.00 1.01 0.76 -0.29 121.20 128.84 2r9k s ILE 70 Ca 0.18 -0.26 -0.29 0.00 0.00 0.00 0.00 60.65 60.28 2r9k s ILE 70 Cb -0.16 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.40 2r9k s ILE 70 CO 0.12 0.38 1.84 -0.62 0.00 0.00 0.00 174.94 176.66 2r9k s ASP 71 N 1.41 6.07 0.66 3.58 -1.08 0.04 -0.82 116.67 126.53 2r9k s ASP 71 Ca 0.05 1.74 0.42 0.00 -0.52 0.00 0.00 52.55 54.25 2r9k s ASP 71 Cb -0.15 -2.53 2.34 0.00 -1.46 0.00 0.00 42.92 41.12 2r9k s ASP 71 CO 0.02 -1.49 2.35 0.58 0.52 0.00 0.00 175.17 177.14 2r9k h VAL 72 N 6.46 0.07 0.00 1.11 2.07 -1.67 0.18 116.25 124.48 2r9k h VAL 72 Ca -0.37 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.15 2r9k h VAL 72 Cb 1.19 0.99 0.00 0.00 -1.52 0.00 0.00 31.29 31.95 2r9k h VAL 72 CO 0.99 0.00 -0.30 0.35 0.02 0.00 0.00 177.57 178.63 2r9k n THR 73 N -3.18 0.47 -1.48 2.57 -2.24 -1.26 -4.27 114.28 104.88 2r9k n THR 73 Ca -0.03 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 2r9k n THR 73 Cb 0.08 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 2r9k n THR 73 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2r9k n ASN 74 N -2.18 0.00 -0.46 3.42 2.04 -1.12 -4.63 115.26 112.33 2r9k n ASN 74 Ca 0.04 -1.00 -0.06 0.00 -0.44 0.00 0.00 54.58 53.12 2r9k n ASN 74 Cb 0.43 0.00 -0.03 0.00 -2.53 0.00 0.00 39.78 37.66 2r9k n ASN 74 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 2r9k n LEU 75 N 0.00 0.27 -4.75 -4.53 4.77 0.62 -4.99 117.00 108.38 2r9k n LEU 75 Ca 0.00 0.15 -0.41 0.00 -0.03 0.00 0.00 56.01 55.72 2r9k n LEU 75 Cb 0.31 -2.59 -0.02 0.00 -2.33 0.00 0.00 43.42 38.79 2r9k n LEU 75 CO 0.00 -1.02 1.05 -0.31 -1.33 0.00 0.00 177.39 175.78 2r9k s TYR 76 N -1.50 3.06 -0.20 -1.77 4.12 -1.24 -4.71 117.35 115.11 2r9k s TYR 76 Ca 0.00 1.18 -0.29 0.00 0.02 0.00 0.00 57.07 57.98 2r9k s TYR 76 Cb 0.00 -3.75 0.00 0.00 -1.52 0.00 0.00 41.96 36.70 2r9k s TYR 76 CO 0.00 -2.30 1.06 0.08 0.02 0.00 0.00 175.55 174.42 2r9k s VAL 77 N -0.36 4.64 -0.10 0.71 1.01 -1.26 -0.78 120.40 124.26 2r9k s VAL 77 Ca 0.56 1.97 0.12 0.00 0.00 0.00 0.00 61.98 64.62 2r9k s VAL 77 Cb -0.40 -4.27 -0.17 0.00 0.00 0.00 0.00 36.38 31.54 2r9k s VAL 77 CO 0.46 -0.14 0.10 1.33 0.00 0.00 0.00 175.10 176.84 2r9k n VAL 78 N 5.18 0.69 -3.48 2.92 0.24 0.60 -4.82 118.33 119.66 2r9k n VAL 78 Ca 0.12 -0.49 -0.13 0.00 -2.04 0.00 0.00 64.34 61.79 2r9k n VAL 78 Cb 0.46 -0.48 -0.04 0.00 -1.47 0.00 0.00 33.84 32.31 2r9k n VAL 78 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2r9k s ALA 79 N -2.44 -1.73 0.13 2.33 0.00 -1.22 -0.96 121.76 117.88 2r9k s ALA 79 Ca -0.06 0.97 0.04 0.00 0.00 0.00 0.00 51.96 52.91 2r9k s ALA 79 Cb 0.05 0.34 -0.04 0.00 0.00 0.00 0.00 23.12 23.47 2r9k s ALA 79 CO 0.53 -0.57 -0.09 1.52 0.00 0.00 0.00 175.76 177.15 2r9k s TYR 80 N -2.49 1.14 -0.07 0.00 1.13 -0.72 -0.09 117.35 116.26 2r9k s TYR 80 Ca -0.03 -0.82 0.00 0.00 -1.41 0.00 0.00 57.07 54.82 2r9k s TYR 80 Cb -0.01 -0.61 0.02 0.00 -1.10 0.00 0.00 41.96 40.27 2r9k s TYR 80 CO -0.03 -0.00 -0.05 -2.00 -2.51 0.00 0.00 175.55 170.96 2r9k s GLU 81 N -3.78 1.04 -0.18 -3.49 -6.30 0.57 -1.15 118.70 105.41 2r9k s GLU 81 Ca 0.15 -0.13 -0.01 0.00 -2.50 0.00 0.00 54.97 52.49 2r9k s GLU 81 Cb 0.04 -1.11 0.05 0.00 0.00 0.00 0.00 34.13 33.10 2r9k s GLU 81 CO -0.01 -0.16 -0.04 0.00 0.02 0.00 0.00 175.26 175.07 2r9k s ALA 82 N 1.31 1.51 0.00 6.30 0.00 0.56 -1.81 121.76 129.64 2r9k s ALA 82 Ca -0.04 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.00 2r9k s ALA 82 Cb -0.14 -1.20 0.00 0.00 0.00 0.00 0.00 23.12 21.79 2r9k s ALA 82 CO -0.02 -0.93 0.00 0.41 0.00 0.00 0.00 175.76 175.21 2r9k n GLY 83 N 4.86 4.05 1.51 0.00 0.00 -1.26 -0.49 105.19 113.85 2r9k n GLY 83 Ca -0.11 0.10 0.07 0.00 0.00 0.00 0.00 46.02 46.08 2r9k n GLY 83 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2r9k n ASN 84 N 7.43 4.47 -4.45 1.61 6.94 -1.26 -4.86 115.26 125.13 2r9k n ASN 84 Ca 0.00 -2.56 -0.32 0.00 -0.02 0.00 0.00 54.58 51.68 2r9k n ASN 84 Cb 0.00 -0.59 -0.13 0.00 -2.36 0.00 0.00 39.78 36.70 2r9k n ASN 84 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 2r9k s GLN 85 N -2.11 2.38 -0.00 -3.83 -1.52 0.36 -2.16 119.66 112.77 2r9k s GLN 85 Ca 0.44 -0.78 0.02 0.00 -1.95 0.00 0.00 55.36 53.09 2r9k s GLN 85 Cb 0.31 -2.30 -0.01 0.00 -0.22 0.00 0.00 33.01 30.79 2r9k s GLN 85 CO 0.17 0.60 -0.07 -1.54 -0.25 0.00 0.00 175.29 174.20 2r9k s SER 86 N -0.84 0.83 -0.04 5.90 1.04 -0.03 -0.32 113.70 120.24 2r9k s SER 86 Ca 0.12 -0.14 0.04 0.00 0.48 0.00 0.00 55.95 56.45 2r9k s SER 86 Cb -0.10 -0.09 -0.00 0.00 0.10 0.00 0.00 66.02 65.93 2r9k s SER 86 CO 0.01 0.08 -0.15 -0.31 0.98 0.00 0.00 173.24 173.85 2r9k s TYR 87 N -0.20 1.53 -0.05 5.02 1.51 -0.30 -2.19 117.35 122.66 2r9k s TYR 87 Ca 0.02 -0.44 0.05 0.00 -1.01 0.00 0.00 57.07 55.70 2r9k s TYR 87 Cb -0.03 -1.04 -0.02 0.00 -0.11 0.00 0.00 41.96 40.76 2r9k s TYR 87 CO -0.00 -0.16 -0.21 -0.06 -1.11 0.00 0.00 175.55 174.01 2r9k s PHE 88 N 0.11 2.53 0.80 2.71 0.40 -0.73 -1.75 117.98 122.05 2r9k s PHE 88 Ca -0.04 -0.46 -0.11 0.00 -0.60 0.00 0.00 56.93 55.72 2r9k s PHE 88 Cb -0.11 -1.60 0.07 0.00 0.51 0.00 0.00 43.02 41.89 2r9k s PHE 88 CO 0.02 -0.04 1.09 -0.51 0.70 0.00 0.00 175.22 176.48 2r9k s LEU 89 N -0.42 2.82 0.34 -0.37 2.01 -0.13 -0.69 118.68 122.23 2r9k s LEU 89 Ca 0.04 1.69 0.11 0.00 0.01 0.00 0.00 54.13 55.98 2r9k s LEU 89 Cb -0.12 -4.33 0.61 0.00 0.01 0.00 0.00 46.19 42.36 2r9k s LEU 89 CO 0.02 -2.13 1.76 -1.28 1.01 0.00 0.00 176.35 175.73 2r9k h SER 90 N -1.19 0.03 -0.52 2.29 0.87 -1.20 -1.29 113.55 112.54 2r9k h SER 90 Ca -0.45 -0.01 -0.30 0.00 -1.23 0.00 0.00 61.79 59.79 2r9k h SER 90 Cb 1.24 -0.01 -0.18 0.00 -0.44 0.00 0.00 62.40 63.01 2r9k h SER 90 CO 0.53 0.46 -0.03 -0.90 -0.53 0.00 0.00 176.83 176.36 2r9k n ASP 91 N -4.02 3.35 -4.76 6.23 3.85 -1.26 -4.92 116.55 115.02 2r9k n ASP 91 Ca -0.02 -3.78 -0.41 0.00 -0.71 0.00 0.00 54.79 49.87 2r9k n ASP 91 Cb 0.46 -0.65 -0.01 0.00 -1.35 0.00 0.00 41.12 39.57 2r9k n ASP 91 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2r9k s ALA 92 N -3.36 3.71 0.19 2.12 0.00 -0.49 -4.92 121.76 119.01 2r9k s ALA 92 Ca 0.48 1.58 -0.33 0.00 0.00 0.00 0.00 51.96 53.69 2r9k s ALA 92 Cb 0.42 -3.64 -0.14 0.00 0.00 0.00 0.00 23.12 19.76 2r9k s ALA 92 CO 0.01 -1.01 1.37 -0.35 0.00 0.00 0.00 175.76 175.79 2r9k n PRO 93 N 1.77 1.74 -1.69 0.00 -0.04 -1.26 -4.84 135.00 130.68 2r9k n PRO 93 Ca 0.06 0.62 -0.56 0.00 -0.04 0.00 0.00 63.50 63.59 2r9k n PRO 93 Cb 0.38 -2.26 -0.07 0.00 -0.04 0.00 0.00 33.50 31.51 2r9k n PRO 93 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2r9k n ALA 94 N 2.18 0.09 -0.25 0.55 0.00 -1.26 -1.27 120.51 120.54 2r9k n ALA 94 Ca 0.14 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2r9k n ALA 94 Cb 0.28 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.43 2r9k n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r9k n GLY 95 N 4.40 0.86 0.20 0.00 0.00 -1.26 -4.90 105.19 104.49 2r9k n GLY 95 Ca 0.27 -0.10 -0.06 0.00 0.00 0.00 0.00 46.02 46.13 2r9k n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r9k h ALA 96 N 0.00 0.88 0.00 4.61 0.00 -1.53 -3.25 119.26 119.97 2r9k h ALA 96 Ca 0.00 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 2r9k h ALA 96 Cb 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 2r9k h ALA 96 CO 0.00 0.67 -0.04 0.93 0.00 0.00 0.00 179.25 180.80 2r9k h GLU 97 N 0.29 0.00 -0.01 0.00 5.08 -1.88 -1.67 114.58 116.39 2r9k h GLU 97 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2r9k h GLU 97 Cb 0.99 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.24 2r9k h GLU 97 CO 0.09 0.04 -0.25 0.25 -1.00 0.00 0.00 179.01 178.14 2r9k n THR 98 N -3.16 0.00 -0.05 1.13 -2.24 -1.23 -4.35 114.28 104.38 2r9k n THR 98 Ca 0.00 -0.10 -0.08 0.00 -2.27 0.00 0.00 64.05 61.60 2r9k n THR 98 Cb 0.32 0.29 -0.04 0.00 -2.10 0.00 0.00 70.33 68.80 2r9k n THR 98 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2r9k n GLN 99 N -0.79 0.24 -4.94 -0.78 1.13 -0.65 -4.95 117.38 106.65 2r9k n GLN 99 Ca 0.12 0.07 -0.33 0.00 -1.94 0.00 0.00 57.00 54.92 2r9k n GLN 99 Cb 0.34 -1.12 -0.14 0.00 0.11 0.00 0.00 30.24 29.42 2r9k n GLN 99 CO 0.00 0.00 0.00 0.16 -1.44 0.00 0.00 177.06 175.78 2r9k s ASP 100 N -5.16 3.81 0.00 1.08 1.47 -1.11 -4.81 116.67 111.95 2r9k s ASP 100 Ca -0.13 -0.31 0.00 0.00 1.18 0.00 0.00 52.55 53.29 2r9k s ASP 100 Cb 0.04 -1.10 0.00 0.00 -0.34 0.00 0.00 42.92 41.52 2r9k s ASP 100 CO 0.21 0.26 0.00 0.49 0.68 0.00 0.00 175.17 176.82 2r9k n PHE 101 N 2.85 0.00 0.00 2.11 3.72 -1.26 -4.84 117.46 120.04 2r9k n PHE 101 Ca -0.18 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.22 2r9k n PHE 101 Cb 0.52 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.06 2r9k n PHE 101 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2r9k n SER 102 N 3.29 0.00 -2.00 4.37 2.88 -1.26 -4.42 113.62 116.47 2r9k n SER 102 Ca 0.00 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.37 2r9k n SER 102 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 2r9k n SER 102 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2r9k n GLY 103 N 0.00 3.85 3.12 0.46 0.00 -1.26 -4.92 105.19 106.44 2r9k n GLY 103 Ca 0.00 -1.16 -0.08 0.00 0.00 0.00 0.00 46.02 44.78 2r9k n GLY 103 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2r9k s THR 104 N -1.67 0.18 0.14 2.61 -4.23 -1.26 -4.97 115.64 106.43 2r9k s THR 104 Ca 0.37 -1.44 -0.30 0.00 -1.18 0.00 0.00 61.69 59.14 2r9k s THR 104 Cb 0.25 -1.25 -0.07 0.00 1.34 0.00 0.00 72.50 72.77 2r9k s THR 104 CO -0.06 -0.80 1.21 -0.89 -0.54 0.00 0.00 174.62 173.55 2r9k s THR 105 N -3.45 3.70 -0.55 3.99 2.01 -0.92 -4.83 115.64 115.59 2r9k s THR 105 Ca 0.02 1.34 -0.00 0.00 0.31 0.00 0.00 61.69 63.37 2r9k s THR 105 Cb 0.04 -3.86 0.14 0.00 0.01 0.00 0.00 72.50 68.83 2r9k s THR 105 CO -0.08 0.17 0.33 -0.44 -0.69 0.00 0.00 174.62 173.91 2r9k s SER 106 N 0.49 4.89 0.07 3.53 0.01 -1.26 -0.85 113.70 120.58 2r9k s SER 106 Ca 0.55 -2.80 0.02 0.00 1.31 0.00 0.00 55.95 55.03 2r9k s SER 106 Cb -0.32 -1.76 -0.04 0.00 0.21 0.00 0.00 66.02 64.11 2r9k s SER 106 CO 0.34 -0.33 0.14 -0.94 0.41 0.00 0.00 173.24 172.85 2r9k s SER 107 N 0.45 5.91 0.35 2.44 1.04 -0.93 -5.01 113.70 117.95 2r9k s SER 107 Ca 0.16 0.12 0.07 0.00 0.48 0.00 0.00 55.95 56.78 2r9k s SER 107 Cb -0.22 -1.70 -0.02 0.00 0.10 0.00 0.00 66.02 64.17 2r9k s SER 107 CO -0.03 0.17 0.37 -0.94 0.98 0.00 0.00 173.24 173.79 2r9k s SER 108 N -2.45 5.46 0.21 7.02 1.04 -1.26 -1.76 113.70 121.96 2r9k s SER 108 Ca 0.32 -0.44 0.08 0.00 0.48 0.00 0.00 55.95 56.39 2r9k s SER 108 Cb -0.13 -0.97 -0.04 0.00 0.10 0.00 0.00 66.02 64.98 2r9k s SER 108 CO 0.25 -0.44 0.00 -1.10 0.98 0.00 0.00 173.24 172.93 2r9k s GLN 109 N -4.08 2.38 0.00 4.02 -0.21 0.13 -4.87 119.66 117.02 2r9k s GLN 109 Ca 0.44 -1.22 0.25 0.00 0.02 0.00 0.00 55.36 54.85 2r9k s GLN 109 Cb -0.07 -2.29 1.30 0.00 1.00 0.00 0.00 33.01 32.96 2r9k s GLN 109 CO 0.28 0.42 1.85 -2.30 -2.12 0.00 0.00 175.29 173.42 2r9k n PRO 110 N -0.44 0.43 -4.99 2.91 -0.02 -1.26 -4.09 135.00 127.53 2r9k n PRO 110 Ca -0.09 0.04 -0.28 0.00 -2.02 0.00 0.00 63.50 61.16 2r9k n PRO 110 Cb 0.57 -1.50 -0.15 0.00 -0.02 0.00 0.00 33.50 32.39 2r9k n PRO 110 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2r9k s PHE 111 N -2.48 1.94 0.79 6.00 -0.71 -1.26 -4.89 117.98 117.36 2r9k s PHE 111 Ca 0.26 -0.37 -0.07 0.00 -1.04 0.00 0.00 56.93 55.71 2r9k s PHE 111 Cb 0.17 -1.23 0.13 0.00 -1.21 0.00 0.00 43.02 40.88 2r9k s PHE 111 CO 0.37 -0.00 1.09 0.54 -1.34 0.00 0.00 175.22 175.88 2r9k s ASN 112 N -0.66 4.11 0.00 1.98 6.03 -1.26 -0.97 114.94 124.17 2r9k s ASN 112 Ca 0.08 0.03 0.24 0.00 -1.03 0.00 0.00 52.86 52.19 2r9k s ASN 112 Cb -0.09 -0.39 0.94 0.00 -3.03 0.00 0.00 41.25 38.68 2r9k s ASN 112 CO -0.00 -2.04 1.67 0.61 -2.03 0.00 0.00 177.10 175.30 2r9k n GLY 113 N -3.12 0.08 3.66 0.45 0.00 -1.26 -3.96 105.19 101.03 2r9k n GLY 113 Ca 0.13 -0.42 -0.30 0.00 0.00 0.00 0.00 46.02 45.44 2r9k n GLY 113 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2r9k s SER 114 N -1.78 2.79 0.00 1.61 1.04 -1.26 -4.72 113.70 111.37 2r9k s SER 114 Ca 0.35 1.61 0.00 0.00 0.48 0.00 0.00 55.95 58.39 2r9k s SER 114 Cb 0.19 -2.26 0.00 0.00 0.10 0.00 0.00 66.02 64.05 2r9k s SER 114 CO 0.30 -3.09 0.43 0.00 0.98 0.00 0.00 173.24 171.86 2r9k n TYR 115 N -4.19 0.00 -0.09 5.02 9.36 -1.26 -1.91 117.16 124.09 2r9k n TYR 115 Ca 0.07 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.41 2r9k n TYR 115 Cb 0.54 0.00 0.50 0.00 -0.63 0.00 0.00 39.34 39.75 2r9k n TYR 115 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 2r9k h PRO 116 N 0.00 0.41 -0.17 2.98 0.14 -2.00 -2.71 132.00 130.66 2r9k h PRO 116 Ca 0.00 -0.02 -0.03 0.00 0.14 0.00 0.00 66.00 66.08 2r9k h PRO 116 Cb 0.00 -0.09 -0.01 0.00 0.14 0.00 0.00 31.00 31.04 2r9k h PRO 116 CO 0.00 0.27 -0.02 0.22 0.14 0.00 0.00 178.00 178.61 2r9k h ASP 117 N 0.42 0.31 -0.76 1.44 3.58 -1.88 -1.77 116.42 117.75 2r9k h ASP 117 Ca 0.28 -0.34 0.06 0.00 0.42 0.00 0.00 57.03 57.45 2r9k h ASP 117 Cb 0.55 -0.08 -0.05 0.00 1.72 0.00 0.00 39.33 41.47 2r9k h ASP 117 CO -0.08 0.57 0.50 0.25 -2.88 0.00 0.00 179.24 177.60 2r9k h LEU 118 N 0.03 0.73 -0.98 2.28 5.85 -1.04 -2.63 115.31 119.56 2r9k h LEU 118 Ca 0.04 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.66 2r9k h LEU 118 Cb 0.43 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 2r9k h LEU 118 CO 0.01 0.48 -0.49 -0.33 -0.34 0.00 0.00 178.44 177.77 2r9k h GLU 119 N 0.84 0.00 -0.23 1.25 3.07 -1.36 0.21 114.58 118.35 2r9k h GLU 119 Ca 0.32 0.00 0.07 0.00 -0.50 0.00 0.00 59.36 59.25 2r9k h GLU 119 Cb 0.20 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.10 2r9k h GLU 119 CO -0.11 0.49 0.18 -0.09 -1.40 0.00 0.00 179.01 178.08 2r9k h ARG 120 N 0.00 0.00 0.00 2.33 9.65 -0.98 0.41 114.38 125.78 2r9k h ARG 120 Ca -0.00 0.00 -0.30 0.00 -1.10 0.00 0.00 59.98 58.57 2r9k h ARG 120 Cb 0.91 0.00 -0.06 0.00 -1.39 0.00 0.00 29.97 29.43 2r9k h ARG 120 CO 0.06 0.00 -2.14 0.66 2.80 0.00 0.00 179.97 181.35 2r9k n TYR 121 N -4.34 0.00 0.10 2.20 4.02 -0.49 -4.60 117.16 114.05 2r9k n TYR 121 Ca 0.03 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 58.03 2r9k n TYR 121 Cb 0.32 -0.81 -0.01 0.00 -0.02 0.00 0.00 39.34 38.82 2r9k n TYR 121 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2r9k n ALA 122 N -2.72 2.52 0.00 -0.72 0.00 0.60 -4.27 120.51 115.92 2r9k n ALA 122 Ca -0.29 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 52.89 2r9k n ALA 122 Cb 1.00 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 19.37 2r9k n ALA 122 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r9k n GLY 123 N 1.19 -2.72 3.73 0.00 0.00 0.14 -4.71 105.19 102.82 2r9k n GLY 123 Ca -0.01 -1.79 -0.41 0.00 0.00 0.00 0.00 46.02 43.81 2r9k n GLY 123 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2r9k s HIS 124 N -0.57 3.79 -0.58 1.61 3.76 -1.26 -4.48 115.29 117.55 2r9k s HIS 124 Ca 0.00 1.70 0.25 0.00 -0.15 0.00 0.00 55.06 56.85 2r9k s HIS 124 Cb 0.00 -2.98 0.92 0.00 1.11 0.00 0.00 32.58 31.63 2r9k s HIS 124 CO 0.00 0.23 1.74 2.89 -0.85 0.00 0.00 174.74 178.75 2r9k n ARG 125 N 2.79 0.22 0.00 1.40 1.85 -1.26 -0.57 116.66 121.09 2r9k n ARG 125 Ca 0.01 0.34 0.16 0.00 -1.00 0.00 0.00 57.85 57.36 2r9k n ARG 125 Cb 0.49 -1.84 0.92 0.00 -1.05 0.00 0.00 32.46 30.98 2r9k n ARG 125 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 2r9k n ASP 126 N -2.24 0.00 0.00 2.89 3.85 -1.26 -2.49 116.55 117.30 2r9k n ASP 126 Ca 0.03 -0.88 0.00 0.00 -0.71 0.00 0.00 54.79 53.23 2r9k n ASP 126 Cb 0.31 -0.04 0.00 0.00 -1.35 0.00 0.00 41.12 40.04 2r9k n ASP 126 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2r9k n GLN 127 N -1.04 1.45 -3.85 0.11 6.02 0.26 -4.91 117.38 115.43 2r9k n GLN 127 Ca 0.23 -1.07 -0.36 0.00 -0.01 0.00 0.00 57.00 55.78 2r9k n GLN 127 Cb 0.13 -0.95 -0.13 0.00 1.02 0.00 0.00 30.24 30.30 2r9k n GLN 127 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2r9k s ILE 128 N -0.59 3.31 0.41 5.09 1.01 -1.04 -4.98 121.20 124.41 2r9k s ILE 128 Ca 0.00 -1.23 -0.26 0.00 0.00 0.00 0.00 60.65 59.16 2r9k s ILE 128 Cb 0.00 -2.87 -0.09 0.00 0.01 0.00 0.00 42.46 39.52 2r9k s ILE 128 CO 0.00 -0.10 1.34 -2.84 0.00 0.00 0.00 174.94 173.34 2r9k s PRO 129 N 1.32 3.95 0.46 2.79 0.02 -1.26 -4.68 135.00 137.60 2r9k s PRO 129 Ca -0.03 2.24 0.06 0.00 0.02 0.00 0.00 61.00 63.28 2r9k s PRO 129 Cb -0.19 -2.77 -0.03 0.00 0.02 0.00 0.00 34.50 31.53 2r9k s PRO 129 CO 0.00 -0.54 0.19 -0.51 -0.33 0.00 0.00 177.00 175.81 2r9k s LEU 130 N -2.42 2.86 0.00 -5.54 1.43 0.12 -4.89 118.68 110.24 2r9k s LEU 130 Ca 0.57 -1.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.43 2r9k s LEU 130 Cb -0.40 -1.22 0.00 0.00 0.03 0.00 0.00 46.19 44.60 2r9k s LEU 130 CO 0.52 -0.72 0.00 0.61 0.23 0.00 0.00 176.35 176.98 2r9k n GLY 131 N -1.35 0.87 0.23 -3.19 0.00 -1.26 -1.57 105.19 98.92 2r9k n GLY 131 Ca -0.05 -1.98 -0.12 0.00 0.00 0.00 0.00 46.02 43.87 2r9k n GLY 131 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2r9k h ILE 132 N 0.00 1.29 -0.66 -0.61 6.09 -1.87 -2.16 117.51 119.60 2r9k h ILE 132 Ca 0.00 -1.74 -0.01 0.00 -1.37 0.00 0.00 64.86 61.74 2r9k h ILE 132 Cb 0.00 1.67 -0.03 0.00 0.47 0.00 0.00 36.82 38.93 2r9k h ILE 132 CO 0.00 0.56 0.38 0.44 -3.07 0.00 0.00 178.15 176.45 2r9k h ASP 133 N 0.57 0.80 1.61 2.19 3.45 -1.91 0.57 116.42 123.70 2r9k h ASP 133 Ca 0.02 -0.05 -0.05 0.00 0.43 0.00 0.00 57.03 57.38 2r9k h ASP 133 Cb 1.11 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 39.67 2r9k h ASP 133 CO 0.11 0.63 -0.40 1.56 -1.57 0.00 0.00 179.24 179.57 2r9k h GLN 134 N 0.91 0.00 0.17 3.56 7.50 -1.82 0.20 115.11 125.63 2r9k h GLN 134 Ca 0.24 0.00 -0.31 0.00 0.50 0.00 0.00 58.65 59.07 2r9k h GLN 134 Cb -0.00 0.00 0.03 0.00 0.05 0.00 0.00 27.48 27.56 2r9k h GLN 134 CO -0.04 0.19 -1.33 1.25 -1.50 0.00 0.00 178.83 177.39 2r9k h LEU 135 N 0.00 0.87 -0.08 1.46 5.85 -0.56 -0.46 115.31 122.39 2r9k h LEU 135 Ca -0.01 -0.85 -0.02 0.00 0.84 0.00 0.00 57.88 57.84 2r9k h LEU 135 Cb 1.17 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.92 2r9k h LEU 135 CO 0.02 1.65 -0.03 0.40 -0.34 0.00 0.00 178.44 180.15 2r9k h ILE 136 N 0.23 1.30 -0.93 4.05 2.04 -0.66 -1.92 117.51 121.62 2r9k h ILE 136 Ca -0.21 -0.98 0.11 0.00 1.00 0.00 0.00 64.86 64.78 2r9k h ILE 136 Cb 2.01 1.79 -0.07 0.00 -0.74 0.00 0.00 36.82 39.81 2r9k h ILE 136 CO 0.25 0.27 0.60 1.56 0.00 0.00 0.00 178.15 180.83 2r9k h GLN 137 N -0.19 0.89 -0.22 2.37 4.20 -0.56 0.85 115.11 122.45 2r9k h GLN 137 Ca 0.02 -0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.55 2r9k h GLN 137 Cb 0.44 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 2r9k h GLN 137 CO 0.01 0.59 -0.41 0.77 -0.67 0.00 0.00 178.83 179.12 2r9k h SER 138 N 0.92 0.54 -0.16 1.46 0.02 -0.62 0.19 113.55 115.89 2r9k h SER 138 Ca 0.44 -0.24 -0.01 0.00 -0.84 0.00 0.00 61.79 61.15 2r9k h SER 138 Cb 0.45 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 2r9k h SER 138 CO -0.21 0.89 0.08 0.58 -1.14 0.00 0.00 176.83 177.03 2r9k h VAL 139 N 0.42 1.12 -0.05 2.27 2.07 -0.09 -1.30 116.25 120.70 2r9k h VAL 139 Ca 0.04 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.20 2r9k h VAL 139 Cb 0.90 1.06 -0.00 0.00 -1.52 0.00 0.00 31.29 31.72 2r9k h VAL 139 CO 0.08 0.12 0.02 0.74 0.02 0.00 0.00 177.57 178.55 2r9k h THR 140 N 0.14 1.00 0.00 2.57 2.02 -0.90 -0.64 112.91 117.09 2r9k h THR 140 Ca 0.06 -0.02 -0.06 0.00 0.77 0.00 0.00 66.41 67.16 2r9k h THR 140 Cb 0.11 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 2r9k h THR 140 CO -0.01 0.01 -0.27 0.00 0.37 0.00 0.00 175.52 175.63 2r9k h ALA 141 N 1.03 1.20 0.00 6.16 0.00 -0.39 -2.05 119.26 125.22 2r9k h ALA 141 Ca 0.02 -0.24 -0.16 0.00 0.00 0.00 0.00 54.91 54.53 2r9k h ALA 141 Cb 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2r9k h ALA 141 CO -0.01 0.33 -1.33 -0.07 0.00 0.00 0.00 179.25 178.16 2r9k h LEU 142 N 0.00 0.00 -0.18 0.00 3.38 -0.87 -3.38 115.31 114.27 2r9k h LEU 142 Ca -0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2r9k h LEU 142 Cb 0.62 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2r9k h LEU 142 CO 0.03 0.54 -0.02 -0.09 0.09 0.00 0.00 178.44 179.00 2r9k h ARG 143 N 0.00 0.34 -5.06 1.13 9.65 -0.38 -3.43 114.38 116.63 2r9k h ARG 143 Ca -0.14 -0.12 -0.63 0.00 -1.10 0.00 0.00 59.98 57.99 2r9k h ARG 143 Cb 1.54 -0.02 -0.15 0.00 -1.39 0.00 0.00 29.97 29.95 2r9k h ARG 143 CO 0.05 0.58 -0.47 -0.06 2.80 0.00 0.00 179.97 182.87 2r9k s PHE 144 N -4.85 3.28 0.34 2.20 0.40 -1.15 -4.65 117.98 113.56 2r9k s PHE 144 Ca -0.14 0.24 -0.29 0.00 -0.60 0.00 0.00 56.93 56.14 2r9k s PHE 144 Cb 0.06 -2.35 -0.11 0.00 0.51 0.00 0.00 43.02 41.14 2r9k s PHE 144 CO 0.73 -0.04 1.43 -1.25 0.70 0.00 0.00 175.22 176.80 2r9k s PRO 145 N 1.38 4.21 0.00 0.24 0.05 -1.26 -4.25 135.00 135.37 2r9k s PRO 145 Ca 0.09 2.43 0.00 0.00 0.05 0.00 0.00 61.00 63.57 2r9k s PRO 145 Cb -0.15 -3.02 0.00 0.00 0.05 0.00 0.00 34.50 31.39 2r9k s PRO 145 CO 0.07 -0.42 0.00 0.41 0.05 0.00 0.00 177.00 177.12 2r9k n GLY 146 N 0.87 1.50 3.85 0.56 0.00 -1.26 -5.14 105.19 105.57 2r9k n GLY 146 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 2r9k n GLY 146 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2r9k s GLY 147 N -1.84 1.64 0.85 -0.02 0.00 -1.26 -5.08 107.32 101.61 2r9k s GLY 147 Ca 0.00 -0.18 -0.11 0.00 0.00 0.00 0.00 44.72 44.42 2r9k s GLY 147 CO 0.00 0.17 1.09 1.62 0.00 0.00 0.00 173.10 175.98 2r9k s GLN 148 N -5.22 1.64 0.37 2.90 2.00 -1.26 -4.97 119.66 115.12 2r9k s GLN 148 Ca 0.58 0.95 0.18 0.00 -2.00 0.00 0.00 55.36 55.07 2r9k s GLN 148 Cb -0.12 -1.84 0.64 0.00 0.80 0.00 0.00 33.01 32.48 2r9k s GLN 148 CO 0.53 -2.01 1.71 1.79 -0.50 0.00 0.00 175.29 176.82 2r9k h THR 149 N -1.38 0.89 -0.77 -0.34 1.35 -1.97 -2.98 112.91 107.70 2r9k h THR 149 Ca -0.47 -1.57 0.11 0.00 -0.55 0.00 0.00 66.41 63.93 2r9k h THR 149 Cb 1.26 1.96 -0.08 0.00 -1.73 0.00 0.00 68.15 69.57 2r9k h THR 149 CO 0.53 0.38 0.39 0.50 -0.25 0.00 0.00 175.52 177.08 2r9k h LYS 150 N 0.00 0.61 -0.30 4.72 1.63 -1.94 0.33 116.57 121.62 2r9k h LYS 150 Ca -0.00 -0.04 -0.15 0.00 -0.85 0.00 0.00 60.65 59.61 2r9k h LYS 150 Cb 0.93 -0.14 -0.00 0.00 -0.60 0.00 0.00 32.23 32.42 2r9k h LYS 150 CO 0.05 0.40 -0.38 1.15 -3.45 0.00 0.00 179.45 177.22 2r9k h THR 151 N 0.63 1.29 -0.42 1.00 2.02 -1.85 -0.69 112.91 114.89 2r9k h THR 151 Ca 0.40 -1.56 0.00 0.00 0.77 0.00 0.00 66.41 66.01 2r9k h THR 151 Cb 0.47 1.58 -0.02 0.00 -1.74 0.00 0.00 68.15 68.44 2r9k h THR 151 CO -0.30 0.51 0.27 1.56 0.37 0.00 0.00 175.52 177.92 2r9k h GLN 152 N 0.55 0.57 -0.44 6.66 4.20 -0.97 -0.70 115.11 124.98 2r9k h GLN 152 Ca 0.04 -0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.60 2r9k h GLN 152 Cb 0.97 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.61 2r9k h GLN 152 CO 0.09 0.40 -0.13 0.00 -0.67 0.00 0.00 178.83 178.52 2r9k h ALA 153 N 1.13 0.94 -0.04 3.87 0.00 -0.29 -0.83 119.26 124.05 2r9k h ALA 153 Ca 0.15 -0.33 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 2r9k h ALA 153 Cb -0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2r9k h ALA 153 CO -0.03 0.62 -0.68 -0.09 0.00 0.00 0.00 179.25 179.06 2r9k h ARG 154 N 0.72 0.19 -0.00 0.00 2.43 -0.88 -0.87 114.38 115.97 2r9k h ARG 154 Ca 0.12 -0.15 -0.18 0.00 -0.81 0.00 0.00 59.98 58.96 2r9k h ARG 154 Cb 0.63 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.19 2r9k h ARG 154 CO 0.04 0.80 -0.82 0.77 -1.51 0.00 0.00 179.97 179.25 2r9k h SER 155 N 0.13 0.15 0.41 -3.80 0.02 -0.61 -1.62 113.55 108.22 2r9k h SER 155 Ca -0.02 -0.12 -0.17 0.00 -0.84 0.00 0.00 61.79 60.65 2r9k h SER 155 Cb 1.22 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.70 2r9k h SER 155 CO 0.10 0.90 -0.72 0.40 -1.14 0.00 0.00 176.83 176.37 2r9k h ILE 156 N 0.07 1.42 -0.57 3.27 2.04 -0.86 -2.29 117.51 120.59 2r9k h ILE 156 Ca -0.03 -2.22 -0.10 0.00 1.00 0.00 0.00 64.86 63.51 2r9k h ILE 156 Cb 1.43 2.18 -0.02 0.00 -0.74 0.00 0.00 36.82 39.67 2r9k h ILE 156 CO 0.12 0.66 -0.05 0.25 0.00 0.00 0.00 178.15 179.13 2r9k h LEU 157 N 0.18 1.02 -0.58 1.44 6.46 -0.73 0.23 115.31 123.32 2r9k h LEU 157 Ca -0.02 -0.31 -0.07 0.00 -0.12 0.00 0.00 57.88 57.36 2r9k h LEU 157 Cb 1.28 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 40.91 2r9k h LEU 157 CO 0.11 1.09 0.09 0.40 -0.62 0.00 0.00 178.44 179.52 2r9k h ILE 158 N 0.93 1.26 -0.08 4.05 2.04 -1.09 -1.43 117.51 123.18 2r9k h ILE 158 Ca 0.16 -0.98 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 2r9k h ILE 158 Cb 0.60 0.77 -0.00 0.00 -0.74 0.00 0.00 36.82 37.45 2r9k h ILE 158 CO 0.04 0.36 0.02 -0.07 0.00 0.00 0.00 178.15 178.50 2r9k h LEU 159 N 0.86 0.13 -0.62 1.44 3.38 -0.73 0.96 115.31 120.72 2r9k h LEU 159 Ca 0.18 -0.22 0.08 0.00 0.09 0.00 0.00 57.88 58.01 2r9k h LEU 159 Cb 0.42 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.07 2r9k h LEU 159 CO 0.01 0.31 0.28 0.40 0.09 0.00 0.00 178.44 179.54 2r9k h ILE 160 N -0.07 0.85 -0.00 1.22 2.04 -0.40 0.28 117.51 121.43 2r9k h ILE 160 Ca 0.03 -0.17 -0.25 0.00 1.00 0.00 0.00 64.86 65.46 2r9k h ILE 160 Cb 0.23 0.30 0.02 0.00 -0.74 0.00 0.00 36.82 36.63 2r9k h ILE 160 CO -0.00 0.09 -1.01 1.56 0.00 0.00 0.00 178.15 178.79 2r9k h GLN 161 N 0.51 0.62 0.00 2.37 4.20 -0.83 0.20 115.11 122.18 2r9k h GLN 161 Ca 0.30 -0.66 0.00 0.00 0.06 0.00 0.00 58.65 58.35 2r9k h GLN 161 Cb 0.30 0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.27 2r9k h GLN 161 CO -0.25 1.26 -0.47 0.52 -0.67 0.00 0.00 178.83 179.22 2r9k h MET 162 N 0.35 0.00 0.00 1.46 2.86 -0.50 -3.01 114.93 116.09 2r9k h MET 162 Ca -0.11 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 2r9k h MET 162 Cb 1.66 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.32 2r9k h MET 162 CO 0.19 0.00 0.00 -0.89 1.06 0.00 0.00 176.91 177.27 2r9k n ILE 163 N -2.56 0.00 0.15 -1.22 5.41 0.95 -4.47 119.36 117.62 2r9k n ILE 163 Ca 0.03 0.15 -0.14 0.00 1.00 0.00 0.00 62.75 63.79 2r9k n ILE 163 Cb 0.49 -1.07 -0.06 0.00 -0.71 0.00 0.00 39.64 38.29 2r9k n ILE 163 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 2r9k h SER 164 N 0.00 -0.68 0.07 4.38 0.02 -1.31 -1.69 113.55 114.34 2r9k h SER 164 Ca 0.00 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 2r9k h SER 164 Cb 0.00 0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.78 2r9k h SER 164 CO 0.00 -0.36 -0.09 -0.33 -1.14 0.00 0.00 176.83 174.92 2r9k h GLU 165 N -0.51 0.04 -0.24 3.45 4.39 -0.71 -0.53 114.58 120.48 2r9k h GLU 165 Ca 0.01 -0.01 -0.13 0.00 0.34 0.00 0.00 59.36 59.57 2r9k h GLU 165 Cb 0.49 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.12 2r9k h GLU 165 CO -0.09 0.14 -0.37 0.00 -1.16 0.00 0.00 179.01 177.53 2r9k h ALA 166 N 1.87 0.90 -0.07 3.43 0.00 -1.36 -1.13 119.26 122.90 2r9k h ALA 166 Ca 0.01 -0.42 -0.15 0.00 0.00 0.00 0.00 54.91 54.35 2r9k h ALA 166 Cb 0.18 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2r9k h ALA 166 CO 0.01 0.63 -0.61 0.00 0.00 0.00 0.00 179.25 179.28 2r9k h ALA 167 N 1.14 0.84 -0.07 0.00 0.00 -0.19 -3.22 119.26 117.75 2r9k h ALA 167 Ca 0.04 -0.55 -0.24 0.00 0.00 0.00 0.00 54.91 54.17 2r9k h ALA 167 Cb 0.86 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.58 2r9k h ALA 167 CO 0.07 0.73 -0.89 0.00 0.00 0.00 0.00 179.25 179.17 2r9k h ARG 168 N 0.17 0.67 -4.37 0.00 3.08 -0.81 -3.40 114.38 109.73 2r9k h ARG 168 Ca -0.01 -0.63 -0.49 0.00 0.07 0.00 0.00 59.98 58.92 2r9k h ARG 168 Cb 1.12 0.16 -0.34 0.00 0.08 0.00 0.00 29.97 30.98 2r9k h ARG 168 CO 0.09 1.23 -0.80 -0.06 -1.07 0.00 0.00 179.97 179.36 2r9k s PHE 169 N -3.52 1.30 0.40 3.04 0.08 -0.47 -1.02 117.98 117.79 2r9k s PHE 169 Ca -0.09 -0.50 0.15 0.00 0.12 0.00 0.00 56.93 56.61 2r9k s PHE 169 Cb 0.08 -1.01 0.89 0.00 -0.57 0.00 0.00 43.02 42.41 2r9k s PHE 169 CO 0.90 -0.30 1.91 -0.91 -0.10 0.00 0.00 175.22 176.72 2r9k h ASN 170 N 7.26 0.00 0.55 1.36 -0.26 -1.05 -0.39 115.58 123.04 2r9k h ASN 170 Ca -0.32 0.00 -0.12 0.00 -0.56 0.00 0.00 56.30 55.30 2r9k h ASN 170 Cb 1.17 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 38.41 2r9k h ASN 170 CO 0.46 0.28 -0.56 -0.65 -1.06 0.00 0.00 177.43 175.89 2r9k h PRO 171 N 0.00 0.01 -0.02 0.81 0.11 -1.91 0.36 132.00 131.36 2r9k h PRO 171 Ca -0.00 -0.01 -0.21 0.00 0.11 0.00 0.00 66.00 65.89 2r9k h PRO 171 Cb 0.50 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.61 2r9k h PRO 171 CO 0.04 0.57 -0.87 0.82 -0.21 0.00 0.00 178.00 178.35 2r9k h ILE 172 N 0.01 1.41 -0.28 4.15 2.04 -1.71 0.16 117.51 123.29 2r9k h ILE 172 Ca -0.01 -2.37 -0.10 0.00 1.00 0.00 0.00 64.86 63.39 2r9k h ILE 172 Cb 1.00 2.33 -0.01 0.00 -0.74 0.00 0.00 36.82 39.40 2r9k h ILE 172 CO 0.07 0.71 -0.20 0.25 0.00 0.00 0.00 178.15 178.99 2r9k h LEU 173 N 0.23 0.66 -0.82 1.44 5.85 -0.75 -0.97 115.31 120.94 2r9k h LEU 173 Ca -0.06 -0.44 -0.11 0.00 0.84 0.00 0.00 57.88 58.11 2r9k h LEU 173 Cb 1.48 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.32 2r9k h LEU 173 CO 0.15 0.96 -0.34 -0.50 -0.34 0.00 0.00 178.44 178.37 2r9k h TRP 174 N 0.37 0.56 -0.35 1.25 4.06 -0.05 -1.74 115.95 120.05 2r9k h TRP 174 Ca 0.06 -0.14 -0.07 0.00 2.06 0.00 0.00 58.89 60.80 2r9k h TRP 174 Cb 0.74 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 28.76 2r9k h TRP 174 CO 0.07 0.76 -0.05 -0.09 -3.56 0.00 0.00 178.44 175.57 2r9k h ARG 175 N 0.41 0.65 -0.36 0.49 9.65 -0.68 -1.36 114.38 123.18 2r9k h ARG 175 Ca 0.05 -0.23 -0.13 0.00 -1.10 0.00 0.00 59.98 58.57 2r9k h ARG 175 Cb 0.79 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.31 2r9k h ARG 175 CO 0.06 0.79 -0.30 0.00 2.80 0.00 0.00 179.97 183.33 2r9k h ALA 176 N 0.84 0.79 -0.48 2.80 0.00 -0.92 -2.48 119.26 119.80 2r9k h ALA 176 Ca 0.09 -0.41 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 2r9k h ALA 176 Cb 0.53 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2r9k h ALA 176 CO 0.03 0.65 0.12 -0.09 0.00 0.00 0.00 179.25 179.95 2r9k h ARG 177 N 0.66 0.77 -0.30 0.00 2.43 -0.98 0.13 114.38 117.09 2r9k h ARG 177 Ca 0.08 -0.18 0.05 0.00 -0.81 0.00 0.00 59.98 59.12 2r9k h ARG 177 Cb 0.84 -0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 30.23 2r9k h ARG 177 CO 0.07 0.75 -0.02 0.37 -1.51 0.00 0.00 179.97 179.63 2r9k h GLN 178 N 0.65 0.06 0.07 0.20 4.15 -0.92 -0.89 115.11 118.44 2r9k h GLN 178 Ca 0.15 -0.00 -0.25 0.00 0.77 0.00 0.00 58.65 59.32 2r9k h GLN 178 Cb 0.33 -0.01 0.02 0.00 0.21 0.00 0.00 27.48 28.02 2r9k h GLN 178 CO 0.00 0.04 -1.01 1.88 -1.93 0.00 0.00 178.83 177.81 2r9k h TYR 179 N 0.06 0.88 -0.68 3.99 0.05 -1.05 -1.88 116.97 118.34 2r9k h TYR 179 Ca 0.14 -0.53 0.10 0.00 0.05 0.00 0.00 58.73 58.49 2r9k h TYR 179 Cb 0.20 -0.08 -0.04 0.00 1.01 0.00 0.00 36.73 37.81 2r9k h TYR 179 CO -0.24 1.37 0.45 0.82 -1.05 0.00 0.00 178.16 179.51 2r9k h ILE 180 N 0.14 0.91 -0.20 -2.88 2.04 -0.42 0.41 117.51 117.51 2r9k h ILE 180 Ca -0.15 -0.18 -0.15 0.00 1.00 0.00 0.00 64.86 65.38 2r9k h ILE 180 Cb 1.70 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 2r9k h ILE 180 CO 0.19 0.10 -0.45 -1.13 0.00 0.00 0.00 178.15 176.86 2r9k h ASN 181 N 0.53 0.74 0.85 1.72 -1.24 -0.80 -2.85 115.58 114.53 2r9k h ASN 181 Ca 0.31 -0.56 0.00 0.00 0.71 0.00 0.00 56.30 56.76 2r9k h ASN 181 Cb 0.52 -0.21 0.00 0.00 0.73 0.00 0.00 38.32 39.35 2r9k h ASN 181 CO -0.10 1.17 -0.24 -1.54 -1.29 0.00 0.00 177.43 175.43 2r9k n SER 182 N -4.20 0.31 0.00 1.15 3.41 0.33 -4.91 113.62 109.72 2r9k n SER 182 Ca -0.06 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 2r9k n SER 182 Cb 0.57 -0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 2r9k n SER 182 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2r9k n GLY 183 N 1.47 0.97 3.86 5.00 0.00 0.12 -5.02 105.19 111.59 2r9k n GLY 183 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 2r9k n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r9k s ALA 184 N -3.89 3.37 0.56 4.61 0.00 -1.15 -4.80 121.76 120.47 2r9k s ALA 184 Ca 0.00 -0.06 -0.05 0.00 0.00 0.00 0.00 51.96 51.86 2r9k s ALA 184 Cb 0.00 -2.70 0.01 0.00 0.00 0.00 0.00 23.12 20.43 2r9k s ALA 184 CO 0.00 0.31 0.86 -1.12 0.00 0.00 0.00 175.76 175.81 2r9k s SER 185 N -2.43 5.64 0.02 0.00 0.01 -1.26 -4.56 113.70 111.11 2r9k s SER 185 Ca 0.52 0.64 -0.24 0.00 1.31 0.00 0.00 55.95 58.18 2r9k s SER 185 Cb -0.10 -1.68 0.06 0.00 0.21 0.00 0.00 66.02 64.51 2r9k s SER 185 CO 0.20 -1.00 0.55 0.72 0.41 0.00 0.00 173.24 174.13 2r9k s PHE 186 N -2.91 -0.48 -0.17 2.43 -0.71 -0.61 -4.94 117.98 110.59 2r9k s PHE 186 Ca 0.53 0.64 -0.08 0.00 -1.04 0.00 0.00 56.93 56.98 2r9k s PHE 186 Cb -0.10 0.35 -0.04 0.00 -1.21 0.00 0.00 43.02 42.02 2r9k s PHE 186 CO 0.44 -0.62 0.10 -0.51 -1.34 0.00 0.00 175.22 173.29 2r9k s LEU 187 N -1.72 4.07 0.21 -1.99 1.43 -1.26 0.12 118.68 119.54 2r9k s LEU 187 Ca -0.07 0.23 -0.32 0.00 -1.03 0.00 0.00 54.13 52.93 2r9k s LEU 187 Cb -0.01 -2.02 -0.12 0.00 0.03 0.00 0.00 46.19 44.07 2r9k s LEU 187 CO 0.02 0.24 1.73 -0.81 0.23 0.00 0.00 176.35 177.76 2r9k n PRO 188 N 3.08 2.77 -2.09 1.29 -0.04 -1.26 -5.01 135.00 133.75 2r9k n PRO 188 Ca -0.17 1.00 -0.29 0.00 -0.04 0.00 0.00 63.50 64.00 2r9k n PRO 188 Cb 0.53 -2.85 0.19 0.00 -0.04 0.00 0.00 33.50 31.33 2r9k n PRO 188 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 2r9k s ASP 189 N 1.21 3.09 0.53 3.54 -4.77 -1.26 -4.77 116.67 114.24 2r9k s ASP 189 Ca 0.75 0.00 0.20 0.00 -3.30 0.00 0.00 52.55 50.21 2r9k s ASP 189 Cb -0.51 -0.01 1.33 0.00 -1.09 0.00 0.00 42.92 42.65 2r9k s ASP 189 CO 0.32 -2.73 2.09 0.58 0.70 0.00 0.00 175.17 176.13 2r9k h VAL 190 N -1.53 0.88 0.01 2.11 2.07 -1.93 -0.73 116.25 117.13 2r9k h VAL 190 Ca -0.42 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.10 2r9k h VAL 190 Cb 1.22 0.89 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 2r9k h VAL 190 CO 0.32 0.00 -0.00 0.22 0.02 0.00 0.00 177.57 178.13 2r9k h TYR 191 N 0.00 -0.01 -1.00 1.57 5.03 -1.94 0.10 116.97 120.71 2r9k h TYR 191 Ca 0.11 -0.00 0.04 0.00 2.58 0.00 0.00 58.73 61.46 2r9k h TYR 191 Cb 0.43 0.00 -0.06 0.00 1.55 0.00 0.00 36.73 38.66 2r9k h TYR 191 CO 0.00 0.73 0.66 1.98 -1.32 0.00 0.00 178.16 180.21 2r9k h MET 192 N -0.77 1.22 -0.51 1.82 4.05 -1.74 0.06 114.93 119.06 2r9k h MET 192 Ca -0.00 -0.07 -0.11 0.00 -0.28 0.00 0.00 59.70 59.23 2r9k h MET 192 Cb 0.75 -0.28 -0.02 0.00 -0.80 0.00 0.00 31.60 31.25 2r9k h MET 192 CO 0.00 0.81 -0.13 -0.07 0.23 0.00 0.00 176.91 177.75 2r9k h LEU 193 N 1.26 0.98 -0.35 3.39 3.38 -1.02 -1.93 115.31 121.02 2r9k h LEU 193 Ca 0.40 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2r9k h LEU 193 Cb 0.02 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.50 2r9k h LEU 193 CO -0.13 1.11 0.00 -0.33 0.09 0.00 0.00 178.44 179.18 2r9k h GLU 194 N 0.87 0.00 -0.24 1.13 5.08 -0.30 -2.72 114.58 118.39 2r9k h GLU 194 Ca 0.13 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.42 2r9k h GLU 194 Cb 0.69 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 2r9k h GLU 194 CO 0.05 0.00 -0.13 -0.07 -1.00 0.00 0.00 179.01 177.86 2r9k h LEU 195 N 0.00 0.52 -0.75 1.33 3.38 -0.24 -2.04 115.31 117.50 2r9k h LEU 195 Ca 0.00 -0.42 0.05 0.00 0.09 0.00 0.00 57.88 57.60 2r9k h LEU 195 Cb 0.86 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.41 2r9k h LEU 195 CO 0.00 0.82 0.46 -0.33 0.09 0.00 0.00 178.44 179.48 2r9k h GLU 196 N 0.22 0.83 -0.01 1.13 5.08 -1.14 0.28 114.58 120.97 2r9k h GLU 196 Ca 0.05 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2r9k h GLU 196 Cb 0.63 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2r9k h GLU 196 CO 0.04 0.55 -0.08 0.25 -1.00 0.00 0.00 179.01 178.76 2r9k n THR 197 N -4.68 0.00 0.26 1.13 -2.24 -1.08 -3.29 114.28 104.38 2r9k n THR 197 Ca 0.10 -0.15 0.05 0.00 -2.27 0.00 0.00 64.05 61.78 2r9k n THR 197 Cb 0.15 0.21 0.08 0.00 -2.10 0.00 0.00 70.33 68.67 2r9k n THR 197 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2r9k n SER 198 N -0.42 2.23 -0.26 3.42 3.41 -0.01 -4.60 113.62 117.39 2r9k n SER 198 Ca 0.17 -1.63 0.03 0.00 -0.26 0.00 0.00 58.87 57.18 2r9k n SER 198 Cb 0.30 -0.07 0.16 0.00 -0.26 0.00 0.00 64.21 64.34 2r9k n SER 198 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 175.04 174.63 2r9k h TRP 199 N 2.11 0.69 -0.46 7.33 7.01 -1.27 0.24 115.95 131.59 2r9k h TRP 199 Ca 0.00 0.03 -0.12 0.00 2.11 0.00 0.00 58.89 60.91 2r9k h TRP 199 Cb 0.54 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 27.40 2r9k h TRP 199 CO 0.07 0.23 -0.19 0.78 -2.79 0.00 0.00 178.44 176.54 2r9k h GLY 200 N 0.63 0.99 0.65 2.65 0.00 -1.85 -1.01 103.07 105.13 2r9k h GLY 200 Ca 0.38 -0.84 -0.01 0.00 0.00 0.00 0.00 47.33 46.86 2r9k h GLY 200 CO -0.29 0.76 -0.02 1.46 0.00 0.00 0.00 176.54 178.46 2r9k h GLN 201 N 0.80 0.10 -0.90 4.80 4.20 -1.65 -0.94 115.11 121.52 2r9k h GLN 201 Ca 0.11 -0.04 0.08 0.00 0.06 0.00 0.00 58.65 58.86 2r9k h GLN 201 Cb 0.74 -0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.45 2r9k h GLN 201 CO 0.06 0.47 0.58 1.96 -0.67 0.00 0.00 178.83 181.23 2r9k h GLN 202 N -0.28 0.95 -0.43 1.46 4.20 -0.37 0.96 115.11 121.59 2r9k h GLN 202 Ca 0.01 -0.06 -0.10 0.00 0.06 0.00 0.00 58.65 58.56 2r9k h GLN 202 Cb 0.43 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 2r9k h GLN 202 CO 0.01 0.63 -0.15 0.77 -0.67 0.00 0.00 178.83 179.42 2r9k h SER 203 N 0.98 0.81 0.05 1.46 0.02 -1.01 -0.64 113.55 115.22 2r9k h SER 203 Ca 0.40 -0.26 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 2r9k h SER 203 Cb 0.27 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.59 2r9k h SER 203 CO -0.16 0.96 -0.03 0.74 -1.14 0.00 0.00 176.83 177.21 2r9k h THR 204 N 0.72 1.24 -0.47 -2.27 2.02 -0.82 -2.43 112.91 110.90 2r9k h THR 204 Ca 0.11 -1.01 -0.03 0.00 0.77 0.00 0.00 66.41 66.25 2r9k h THR 204 Cb 0.65 1.89 -0.02 0.00 -1.74 0.00 0.00 68.15 68.93 2r9k h THR 204 CO 0.05 0.25 0.15 1.56 0.37 0.00 0.00 175.52 177.90 2r9k h GLN 205 N -0.52 0.69 -0.33 6.66 1.08 -0.56 0.87 115.11 123.00 2r9k h GLN 205 Ca -0.01 -0.11 -0.08 0.00 -1.45 0.00 0.00 58.65 57.01 2r9k h GLN 205 Cb 0.47 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.77 2r9k h GLN 205 CO 0.01 0.60 -0.09 0.28 -0.95 0.00 0.00 178.83 178.68 2r9k h VAL 206 N 0.68 1.28 0.00 -0.54 2.07 -1.04 -0.98 116.25 117.72 2r9k h VAL 206 Ca 0.16 -1.15 -0.08 0.00 0.82 0.00 0.00 66.70 66.45 2r9k h VAL 206 Cb 0.20 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 2r9k h VAL 206 CO -0.01 0.37 -0.37 1.56 0.02 0.00 0.00 177.57 179.14 2r9k h GLN 207 N 0.42 0.00 -0.00 1.57 4.20 -1.16 -2.47 115.11 117.66 2r9k h GLN 207 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 2r9k h GLN 207 Cb 0.59 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.37 2r9k h GLN 207 CO 0.03 0.37 -0.40 0.72 -0.67 0.00 0.00 178.83 178.89 2r9k n HIS 208 N -3.28 0.00 -2.12 2.96 8.25 0.28 -4.96 115.22 116.34 2r9k n HIS 208 Ca 0.02 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.10 2r9k n HIS 208 Cb 0.62 -0.18 0.01 0.00 1.12 0.00 0.00 29.99 31.55 2r9k n HIS 208 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2r9k s SER 209 N -2.76 5.90 -0.31 0.41 1.04 -0.39 -4.77 113.70 112.82 2r9k s SER 209 Ca 0.17 2.43 -0.08 0.00 0.48 0.00 0.00 55.95 58.95 2r9k s SER 209 Cb 0.18 -2.61 0.01 0.00 0.10 0.00 0.00 66.02 63.70 2r9k s SER 209 CO 0.62 -1.11 0.12 -0.89 0.98 0.00 0.00 173.24 172.95 2r9k s THR 210 N -1.49 4.23 -1.61 2.02 2.01 -0.54 -4.58 115.64 115.67 2r9k s THR 210 Ca 0.66 -0.66 -0.15 0.00 0.31 0.00 0.00 61.69 61.85 2r9k s THR 210 Cb -0.32 -3.21 0.12 0.00 0.01 0.00 0.00 72.50 69.10 2r9k s THR 210 CO 0.38 0.02 0.85 0.47 -0.69 0.00 0.00 174.62 175.65 2r9k n ASP 211 N 4.91 -3.76 0.00 3.53 8.00 -1.26 -0.46 116.55 127.52 2r9k n ASP 211 Ca -0.14 -0.91 0.00 0.00 0.71 0.00 0.00 54.79 54.45 2r9k n ASP 211 Cb 0.48 -3.26 0.00 0.00 -0.02 0.00 0.00 41.12 38.32 2r9k n ASP 211 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2r9k n GLY 212 N -1.55 1.63 3.71 0.44 0.00 -1.26 -4.98 105.19 103.17 2r9k n GLY 212 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 2r9k n GLY 212 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2r9k s VAL 213 N -2.84 5.10 0.31 1.61 1.01 0.40 -0.61 120.40 125.38 2r9k s VAL 213 Ca 0.00 1.21 -0.25 0.00 0.00 0.00 0.00 61.98 62.94 2r9k s VAL 213 Cb 0.00 -3.94 -0.10 0.00 0.00 0.00 0.00 36.38 32.35 2r9k s VAL 213 CO 0.00 0.26 0.91 -0.36 0.00 0.00 0.00 175.10 175.91 2r9k s PHE 214 N 0.89 3.67 0.19 5.22 0.08 -0.56 -1.47 117.98 126.00 2r9k s PHE 214 Ca 0.32 1.71 -0.05 0.00 0.12 0.00 0.00 56.93 59.03 2r9k s PHE 214 Cb -0.16 -2.87 0.10 0.00 -0.57 0.00 0.00 43.02 39.51 2r9k s PHE 214 CO 0.14 0.22 1.51 -0.91 -0.10 0.00 0.00 175.22 176.08 2r9k h ASN 215 N 3.18 0.70 -3.31 1.36 -0.26 -1.86 -3.38 115.58 112.01 2r9k h ASN 215 Ca -0.47 -0.35 -0.60 0.00 -0.56 0.00 0.00 56.30 54.32 2r9k h ASN 215 Cb 1.19 -0.20 -0.40 0.00 -1.06 0.00 0.00 38.32 37.85 2r9k h ASN 215 CO 0.65 1.07 -0.75 0.20 -1.06 0.00 0.00 177.43 177.54 2r9k s ASN 216 N -6.90 3.79 0.25 5.81 -0.87 -1.26 -5.10 114.94 110.67 2r9k s ASN 216 Ca -0.08 -2.18 -0.31 0.00 -1.57 0.00 0.00 52.86 48.72 2r9k s ASN 216 Cb 0.11 -0.94 -0.13 0.00 -0.02 0.00 0.00 41.25 40.27 2r9k s ASN 216 CO 0.85 -0.33 1.40 -2.65 -2.57 0.00 0.00 177.10 173.79 2r9k n PRO 217 N 4.13 2.05 -3.28 -0.60 -0.02 -1.26 -4.95 135.00 131.07 2r9k n PRO 217 Ca 0.04 0.73 -0.40 0.00 -2.02 0.00 0.00 63.50 61.85 2r9k n PRO 217 Cb 0.38 -2.38 -0.08 0.00 -0.02 0.00 0.00 33.50 31.40 2r9k n PRO 217 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2r9k s ILE 218 N -0.13 5.07 -0.31 4.25 1.01 -0.40 -4.91 121.20 125.78 2r9k s ILE 218 Ca 0.67 0.50 -0.20 0.00 0.00 0.00 0.00 60.65 61.62 2r9k s ILE 218 Cb -0.64 -3.87 -0.01 0.00 0.01 0.00 0.00 42.46 37.95 2r9k s ILE 218 CO 0.51 -0.06 0.61 0.00 0.00 0.00 0.00 174.94 176.00 2r9k s ALA 219 N 2.28 3.53 0.02 9.38 0.00 -1.26 0.04 121.76 135.75 2r9k s ALA 219 Ca 0.18 -0.68 0.05 0.00 0.00 0.00 0.00 51.96 51.51 2r9k s ALA 219 Cb -0.16 -3.08 -0.03 0.00 0.00 0.00 0.00 23.12 19.85 2r9k s ALA 219 CO 0.11 -1.08 -0.10 -0.51 0.00 0.00 0.00 175.76 174.18 2r9k s LEU 220 N 2.58 3.00 0.04 0.00 1.43 0.21 -4.97 118.68 120.97 2r9k s LEU 220 Ca 0.24 -0.25 -0.24 0.00 -1.03 0.00 0.00 54.13 52.86 2r9k s LEU 220 Cb -0.15 -1.74 -0.06 0.00 0.03 0.00 0.00 46.19 44.28 2r9k s LEU 220 CO 0.12 0.26 0.72 0.00 0.23 0.00 0.00 176.35 177.68 2r9k s ALA 221 N -1.00 3.41 0.12 4.21 0.00 -1.26 -0.01 121.76 127.24 2r9k s ALA 221 Ca 0.17 0.21 0.05 0.00 0.00 0.00 0.00 51.96 52.40 2r9k s ALA 221 Cb -0.11 -2.92 -0.04 0.00 0.00 0.00 0.00 23.12 20.05 2r9k s ALA 221 CO 0.08 0.12 0.02 -1.50 0.00 0.00 0.00 175.76 174.47 2r9k s ILE 222 N -0.19 4.03 0.02 0.00 1.10 0.14 -4.07 121.20 122.23 2r9k s ILE 222 Ca 0.36 -1.10 -0.04 0.00 -0.51 0.00 0.00 60.65 59.35 2r9k s ILE 222 Cb -0.20 -2.97 -0.01 0.00 0.15 0.00 0.00 42.46 39.43 2r9k s ILE 222 CO 0.22 0.03 0.34 0.00 -2.11 0.00 0.00 174.94 173.41 2r9k n ALA 223 N 0.26 -0.09 -1.52 1.50 0.00 -1.26 -2.77 120.51 116.62 2r9k n ALA 223 Ca -0.10 0.12 -0.40 0.00 0.00 0.00 0.00 53.44 53.07 2r9k n ALA 223 Cb 0.53 0.04 -0.02 0.00 0.00 0.00 0.00 19.45 20.00 2r9k n ALA 223 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2r9k n PRO 224 N -3.41 3.86 -4.11 0.00 -0.04 -1.26 -4.70 135.00 125.34 2r9k n PRO 224 Ca 0.00 -2.56 -0.31 0.00 -0.04 0.00 0.00 63.50 60.60 2r9k n PRO 224 Cb 0.04 -2.80 -0.03 0.00 -0.04 0.00 0.00 33.50 30.67 2r9k n PRO 224 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2r9k n GLY 225 N 3.16 -0.32 3.12 0.55 0.00 -1.11 -5.01 105.19 105.57 2r9k n GLY 225 Ca 0.72 0.14 -0.14 0.00 0.00 0.00 0.00 46.02 46.75 2r9k n GLY 225 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2r9k s VAL 226 N -3.67 0.77 0.20 1.61 -7.23 -1.15 -5.02 120.40 105.90 2r9k s VAL 226 Ca 0.35 -1.33 -0.03 0.00 -1.81 0.00 0.00 61.98 59.16 2r9k s VAL 226 Cb -0.19 -0.98 -0.05 0.00 0.56 0.00 0.00 36.38 35.72 2r9k s VAL 226 CO 0.91 -0.44 0.42 0.27 -0.31 0.00 0.00 175.10 175.96 2r9k s ILE 227 N -1.81 5.16 -0.04 -0.62 -4.36 -1.26 0.28 121.20 118.55 2r9k s ILE 227 Ca -0.03 -0.18 -0.00 0.00 -0.26 0.00 0.00 60.65 60.19 2r9k s ILE 227 Cb -0.07 -3.70 0.03 0.00 1.25 0.00 0.00 42.46 39.96 2r9k s ILE 227 CO 0.00 -0.15 0.01 -0.69 0.24 0.00 0.00 174.94 174.36 2r9k s VAL 228 N -1.85 0.16 -0.18 8.37 1.01 0.99 -4.79 120.40 124.11 2r9k s VAL 228 Ca 0.40 0.14 -0.07 0.00 0.00 0.00 0.00 61.98 62.44 2r9k s VAL 228 Cb -0.11 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.94 2r9k s VAL 228 CO 0.28 0.16 0.06 -0.89 0.00 0.00 0.00 175.10 174.71 2r9k s THR 229 N 1.28 4.78 -0.48 3.92 2.01 -1.26 -0.62 115.64 125.27 2r9k s THR 229 Ca -0.06 -0.04 -0.17 0.00 0.31 0.00 0.00 61.69 61.73 2r9k s THR 229 Cb -0.13 -3.15 0.06 0.00 0.01 0.00 0.00 72.50 69.29 2r9k s THR 229 CO -0.02 0.46 0.48 -0.76 -0.69 0.00 0.00 174.62 174.09 2r9k s LEU 230 N 0.35 5.26 -0.00 4.42 1.02 0.11 -4.88 118.68 124.96 2r9k s LEU 230 Ca 0.03 -1.07 0.04 0.00 0.02 0.00 0.00 54.13 53.15 2r9k s LEU 230 Cb -0.12 -2.31 -0.05 0.00 0.02 0.00 0.00 46.19 43.73 2r9k s LEU 230 CO 0.00 -0.72 0.14 0.35 0.02 0.00 0.00 176.35 176.13 2r9k n THR 231 N 5.39 0.00 -3.75 5.49 -2.24 -1.26 -1.27 114.28 116.63 2r9k n THR 231 Ca -0.09 -0.28 -0.13 0.00 -2.27 0.00 0.00 64.05 61.28 2r9k n THR 231 Cb 0.45 0.75 -0.08 0.00 -2.10 0.00 0.00 70.33 69.35 2r9k n THR 231 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2r9k s ASN 232 N -1.84 -0.19 0.58 3.42 3.84 -1.26 -1.50 114.94 117.99 2r9k s ASN 232 Ca 0.00 0.04 0.30 0.00 0.21 0.00 0.00 52.86 53.42 2r9k s ASN 232 Cb 0.03 0.33 1.76 0.00 -0.55 0.00 0.00 41.25 42.81 2r9k s ASN 232 CO 0.17 -0.49 2.21 0.16 -2.79 0.00 0.00 177.10 176.36 2r9k h ILE 233 N 3.71 0.50 0.00 -5.21 -0.00 -1.24 0.96 117.51 116.23 2r9k h ILE 233 Ca -0.30 -0.16 -0.00 0.00 -0.00 0.00 0.00 64.86 64.40 2r9k h ILE 233 Cb 1.18 1.10 -0.00 0.00 -0.00 0.00 0.00 36.82 39.10 2r9k h ILE 233 CO 0.41 0.03 -0.01 0.03 -0.00 0.00 0.00 178.15 178.62 2r9k h ARG 234 N 0.00 0.00 0.00 0.16 3.08 -1.97 0.33 114.38 115.98 2r9k h ARG 234 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2r9k h ARG 234 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 2r9k h ARG 234 CO 0.00 0.01 0.00 -0.44 -1.07 0.00 0.00 179.97 178.47 2r9k h ASP 235 N 0.00 0.00 0.00 7.04 3.32 -1.19 -3.29 116.42 122.30 2r9k h ASP 235 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2r9k h ASP 235 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 2r9k h ASP 235 CO 0.00 0.00 0.00 1.33 -1.72 0.00 0.00 179.24 178.85 2r9k n VAL 236 N -2.87 0.00 -0.32 -1.35 0.24 -0.12 -4.75 118.33 109.16 2r9k n VAL 236 Ca 0.04 -0.44 0.18 0.00 -2.04 0.00 0.00 64.34 62.07 2r9k n VAL 236 Cb 0.45 1.04 0.43 0.00 -1.47 0.00 0.00 33.84 34.29 2r9k n VAL 236 CO 0.00 0.00 0.00 -0.29 -2.14 0.00 0.00 176.83 174.40 2r9k h ILE 237 N 0.04 0.63 0.00 1.34 6.09 -0.52 0.01 117.51 125.11 2r9k h ILE 237 Ca 0.00 -0.19 0.00 0.00 -1.37 0.00 0.00 64.86 63.30 2r9k h ILE 237 Cb 0.02 0.03 0.00 0.00 0.47 0.00 0.00 36.82 37.34 2r9k h ILE 237 CO 0.00 0.10 -1.39 0.00 -3.07 0.00 0.00 178.15 173.79 2r9k n ALA 238 N -2.42 2.82 -0.13 0.18 0.00 -1.26 -4.51 120.51 115.20 2r9k n ALA 238 Ca 0.23 -0.38 -0.26 0.00 0.00 0.00 0.00 53.44 53.03 2r9k n ALA 238 Cb 0.71 -0.94 -0.11 0.00 0.00 0.00 0.00 19.45 19.11 2r9k n ALA 238 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2r9k n SER 239 N -2.37 1.96 -4.61 0.00 3.41 -0.34 -4.71 113.62 106.95 2r9k n SER 239 Ca -0.01 0.25 -0.43 0.00 -0.26 0.00 0.00 58.87 58.42 2r9k n SER 239 Cb 0.53 -0.76 -0.02 0.00 -0.26 0.00 0.00 64.21 63.71 2r9k n SER 239 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2r9k s LEU 240 N -7.33 3.71 -0.07 1.04 2.96 -0.16 -0.57 118.68 118.26 2r9k s LEU 240 Ca -0.36 0.92 0.09 0.00 -0.22 0.00 0.00 54.13 54.55 2r9k s LEU 240 Cb 0.12 -3.54 -0.24 0.00 0.50 0.00 0.00 46.19 43.04 2r9k s LEU 240 CO 0.54 -1.27 0.57 0.00 -1.32 0.00 0.00 176.35 174.87 2r9k n ALA 241 N 8.20 1.37 -3.59 5.97 0.00 -0.19 -4.81 120.51 127.45 2r9k n ALA 241 Ca 0.15 -0.75 -0.16 0.00 0.00 0.00 0.00 53.44 52.68 2r9k n ALA 241 Cb 0.48 -0.79 -0.07 0.00 0.00 0.00 0.00 19.45 19.07 2r9k n ALA 241 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2r9k s ILE 242 N -2.59 0.00 0.14 0.00 2.07 -1.23 -4.17 121.20 115.42 2r9k s ILE 242 Ca -0.09 -0.00 0.11 0.00 -1.41 0.00 0.00 60.65 59.26 2r9k s ILE 242 Cb 0.08 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.63 2r9k s ILE 242 CO 0.81 -0.00 -0.27 -0.04 -1.91 0.00 0.00 174.94 173.54 2r9k s MET 243 N -0.25 1.41 0.18 3.50 -1.94 -0.81 -4.84 119.30 116.55 2r9k s MET 243 Ca -0.04 -1.37 -0.31 0.00 -1.71 0.00 0.00 55.69 52.25 2r9k s MET 243 Cb -0.03 -1.89 -0.10 0.00 2.01 0.00 0.00 34.83 34.82 2r9k s MET 243 CO 0.05 0.44 1.51 -1.17 -0.01 0.00 0.00 175.02 175.83 2r9k s LEU 244 N -2.15 4.37 0.00 -0.03 2.96 -1.26 -1.12 118.68 121.46 2r9k s LEU 244 Ca 0.15 2.58 -0.30 0.00 -0.22 0.00 0.00 54.13 56.34 2r9k s LEU 244 Cb -0.10 -3.60 -0.06 0.00 0.50 0.00 0.00 46.19 42.93 2r9k s LEU 244 CO 0.07 -0.76 1.46 0.12 -1.32 0.00 0.00 176.35 175.91 2r9k s PHE 245 N 0.83 2.71 -0.05 5.38 2.19 -1.26 -4.83 117.98 122.95 2r9k s PHE 245 Ca 0.66 0.68 0.04 0.00 0.33 0.00 0.00 56.93 58.64 2r9k s PHE 245 Cb -0.42 -3.73 -0.05 0.00 -1.31 0.00 0.00 43.02 37.50 2r9k s PHE 245 CO 0.34 -2.80 0.01 0.28 1.83 0.00 0.00 175.22 174.89 2r9k n VAL 246 N 4.75 0.32 -1.18 3.12 0.31 -1.26 -4.78 118.33 119.61 2r9k n VAL 246 Ca 0.14 -0.19 -0.17 0.00 -0.01 0.00 0.00 64.34 64.11 2r9k n VAL 246 Cb 0.43 -0.86 0.13 0.00 -0.91 0.00 0.00 33.84 32.63 2r9k n VAL 246 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51